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ramithuh/log_structure_custom_color_scheme_wandb.ipynb

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log_structure_custom_color_scheme_wandb.ipynb
{
"cells": [
{
"cell_type": "markdown",
"id": "6f12b8d7-b249-4141-8a3f-b604b01ea4ab",
"metadata": {},
"source": [
"### Visualize structure and log to wandb"
]
},
{
"cell_type": "code",
"execution_count": 1,
"id": "4047af88-fe93-485c-9eb9-a3774e7d4d94",
"metadata": {},
"outputs": [],
"source": [
"import py3Dmol\n",
"import glob\n",
"import matplotlib.pyplot as plt"
]
},
{
"cell_type": "code",
"execution_count": 2,
"id": "05d0e26c-d735-4099-8f14-72b660cef26a",
"metadata": {},
"outputs": [],
"source": [
"pdb_filename = \"189_0.pdb\"\n",
"pdb_file = glob.glob(pdb_filename)"
]
},
{
"cell_type": "code",
"execution_count": null,
"id": "dad8fda9-d881-4ffd-b466-8b6bc716dc23",
"metadata": {},
"outputs": [],
"source": []
},
{
"cell_type": "code",
"execution_count": 3,
"id": "ea7fb16a-cd1b-44b2-b049-f179f1b73295",
"metadata": {},
"outputs": [],
"source": [
"## Code Credit : https://william-dawson.github.io/using-py3dmol.html\n",
"\n",
"class Atom(dict):\n",
" def __init__(self, line):\n",
" self[\"type\"] = line[0:6].strip()\n",
" self[\"idx\"] = line[6:11].strip()\n",
" self[\"name\"] = line[12:16].strip()\n",
" self[\"resname\"] = line[17:20].strip()\n",
" self[\"resid\"] = int(int(line[22:26]))\n",
" self[\"x\"] = float(line[30:38])\n",
" self[\"y\"] = float(line[38:46])\n",
" self[\"z\"] = float(line[46:54])\n",
" self[\"sym\"] = line[76:78].strip()\n",
"\n",
" def __str__(self):\n",
" line = list(\" \" * 80)\n",
"\n",
" line[0:6] = self[\"type\"].ljust(6)\n",
" line[6:11] = self[\"idx\"].ljust(5)\n",
" line[12:16] = self[\"name\"].ljust(4)\n",
" line[17:20] = self[\"resname\"].ljust(3)\n",
" line[22:26] = str(self[\"resid\"]).ljust(4)\n",
" line[30:38] = str(self[\"x\"]).rjust(8)\n",
" line[38:46] = str(self[\"y\"]).rjust(8)\n",
" line[46:54] = str(self[\"z\"]).rjust(8)\n",
" line[76:78] = self[\"sym\"].rjust(2)\n",
" return \"\".join(line) + \"\\n\"\n",
" \n",
"class Molecule(list):\n",
" def __init__(self, file):\n",
" for line in file:\n",
" if \"ATOM\" in line or \"HETATM\" in line:\n",
" self.append(Atom(line))\n",
"\n",
" def __str__(self):\n",
" outstr = \"\"\n",
" for at in self:\n",
" outstr += str(at)\n",
"\n",
" return outstr"
]
},
{
"cell_type": "code",
"execution_count": null,
"id": "bb7ba30d-bbdd-40de-85ad-51ce0f9d87a8",
"metadata": {},
"outputs": [],
"source": []
},
{
"cell_type": "code",
"execution_count": null,
"id": "2900d4a2-06ec-4a96-a5e4-517954c24058",
"metadata": {},
"outputs": [],
"source": []
},
{
"cell_type": "code",
"execution_count": 4,
"id": "33fe3d5a-cfec-4bab-9047-435854110bc7",
"metadata": {},
"outputs": [],
"source": [
"## lDDT View"
]
},
{
"cell_type": "code",
"execution_count": 5,
"id": "dfc212ae-d96d-4849-8816-d7378cf30e5d",
"metadata": {},
"outputs": [],
"source": [
"lDDT_view = py3Dmol.view(width=400, height=300) #py3Dmol.view(js='https://3dmol.org/build/3Dmol.js')\n",
"lDDT_view.addModel(open(pdb_filename,'r').read(),'pdb')\n",
"lDDT_view.setStyle({'cartoon': {'colorscheme': {'prop':'b','gradient': 'roygb','min':50,'max':90}}})\n",
"lDDT_view.zoomTo()\n",
"\n",
"v1 = lDDT_view.write_html()"
]
},
{
"cell_type": "markdown",
"id": "3166ab06-d091-40c7-b7b7-6f71ecc6d045",
"metadata": {},
"source": [
"### Some Custom View"
]
},
{
"cell_type": "code",
"execution_count": 6,
"id": "b5fe16c4-419c-461f-a06a-5a3713b81065",
"metadata": {},
"outputs": [],
"source": [
"with open(\"189_0.pdb\") as ifile:\n",
" mol = Molecule(ifile)"
]
},
{
"cell_type": "code",
"execution_count": 7,
"id": "6389965e-27e8-411e-aa83-8ddef2640230",
"metadata": {},
"outputs": [
{
"data": {
"application/3dmoljs_load.v0": "<div id=\"3dmolviewer_1706850542354171\" style=\"position: relative; width: 400px; height: 300px;\">\n <p id=\"3dmolwarning_1706850542354171\" style=\"background-color:#ffcccc;color:black\">You appear to be running in JupyterLab (or JavaScript failed to load for some other reason). You need to install the 3dmol extension: <br>\n <tt>jupyter labextension install jupyterlab_3dmol</tt></p>\n </div>\n<script>\n\nvar loadScriptAsync = function(uri){\n return new Promise((resolve, reject) => {\n //this is to ignore the existence of requirejs amd\n var savedexports, savedmodule;\n if (typeof exports !== 'undefined') savedexports = exports;\n else exports = {}\n if (typeof module !== 'undefined') savedmodule = module;\n else module = {}\n\n var tag = document.createElement('script');\n tag.src = uri;\n tag.async = true;\n tag.onload = () => {\n exports = savedexports;\n module = savedmodule;\n resolve();\n };\n var firstScriptTag = document.getElementsByTagName('script')[0];\n firstScriptTag.parentNode.insertBefore(tag, firstScriptTag);\n});\n};\n\nif(typeof $3Dmolpromise === 'undefined') {\n$3Dmolpromise = null;\n $3Dmolpromise = loadScriptAsync('https://cdnjs.cloudflare.com/ajax/libs/3Dmol/2.0.4/3Dmol-min.js');\n}\n\nvar viewer_1706850542354171 = null;\nvar warn = document.getElementById(\"3dmolwarning_1706850542354171\");\nif(warn) {\n warn.parentNode.removeChild(warn);\n}\n$3Dmolpromise.then(function() {\nviewer_1706850542354171 = $3Dmol.createViewer(document.getElementById(\"3dmolviewer_1706850542354171\"),{backgroundColor:\"white\"});\nviewer_1706850542354171.zoomTo();\n\tviewer_1706850542354171.addModelsAsFrames(\"ATOM 1 N MET 1 -1.467 -20.434 -40.368 N \\nATOM 2 CA MET 1 -0.925 -21.223 -39.266 C \\nATOM 3 C MET 1 -0.25 -20.326 -38.235 C \\nATOM 4 CB MET 1 0.069 -22.263 -39.786 C \\nATOM 5 O MET 1 0.652 -19.556 -38.571 O \\nATOM 6 CG MET 1 -0.539 -23.64 -40.0 C \\nATOM 7 SD MET 1 0.677 -24.852 -40.649 S \\nATOM 8 CE MET 1 -0.446 -26.041 -41.435 C \\nATOM 9 N ASP 2 -0.838 -19.787 -36.708 N \\nATOM 10 CA ASP 2 -1.359 -19.916 -35.351 C \\nATOM 11 C ASP 2 -2.457 -18.889 -35.085 C \\nATOM 12 CB ASP 2 -0.234 -19.76 -34.326 C \\nATOM 13 O ASP 2 -2.24 -17.686 -35.242 O \\nATOM 14 CG ASP 2 -0.123 -20.945 -33.382 C \\nATOM 15 OD1 ASP 2 -1.078 -21.746 -33.294 O \\nATOM 16 OD2 ASP 2 0.928 -21.077 -32.719 O \\nATOM 17 N PRO 3 -3.952 -19.036 -35.195 N \\nATOM 18 CA PRO 3 -4.781 -18.683 -34.041 C \\nATOM 19 C PRO 3 -3.956 -18.372 -32.794 C \\nATOM 20 CB PRO 3 -5.641 -19.932 -33.83 C \\nATOM 21 O PRO 3 -3.37 -19.278 -32.196 O \\nATOM 22 CG PRO 3 -5.015 -20.977 -34.695 C \\nATOM 23 CD PRO 3 -3.983 -20.32 -35.566 C \\nATOM 24 N THR 4 -3.04 -17.447 -32.984 N \\nATOM 25 CA THR 4 -2.931 -16.86 -31.654 C \\nATOM 26 C THR 4 -3.951 -15.74 -31.472 C \\nATOM 27 CB THR 4 -1.514 -16.314 -31.398 C \\nATOM 28 O THR 4 -3.987 -14.791 -32.258 O \\nATOM 29 CG2 THR 4 -0.896 -16.948 -30.156 C \\nATOM 30 OG1 THR 4 -0.686 -16.602 -32.531 O \\nATOM 31 N VAL 5 -5.331 -15.963 -31.523 N \\nATOM 32 CA VAL 5 -6.246 -15.377 -30.548 C \\nATOM 33 C VAL 5 -5.46 -14.541 -29.54 C \\nATOM 34 CB VAL 5 -7.067 -16.462 -29.816 C \\nATOM 35 O VAL 5 -4.604 -15.065 -28.823 O \\nATOM 36 CG1 VAL 5 -8.115 -15.823 -28.906 C \\nATOM 37 CG2 VAL 5 -7.73 -17.399 -30.824 C \\nATOM 38 N TYR 6 -4.861 -13.517 -29.962 N \\nATOM 39 CA TYR 6 -4.723 -12.61 -28.828 C \\nATOM 40 C TYR 6 -5.83 -12.842 -27.807 C \\nATOM 41 CB TYR 6 -4.745 -11.153 -29.299 C \\nATOM 42 O TYR 6 -7.015 -12.761 -28.137 O \\nATOM 43 CG TYR 6 -3.388 -10.622 -29.693 C \\nATOM 44 CD1 TYR 6 -2.535 -10.064 -28.743 C \\nATOM 45 CD2 TYR 6 -2.956 -10.676 -31.014 C \\nATOM 46 CE1 TYR 6 -1.284 -9.571 -29.101 C \\nATOM 47 CE2 TYR 6 -1.708 -10.187 -31.383 C \\nATOM 48 OH TYR 6 0.357 -9.152 -30.781 O \\nATOM 49 CZ TYR 6 -0.88 -9.638 -30.421 C \\nATOM 50 N SER 7 -5.87 -14.026 -27.065 N \\nATOM 51 CA SER 7 -6.528 -14.108 -25.765 C \\nATOM 52 C SER 7 -6.769 -12.721 -25.179 C \\nATOM 53 CB SER 7 -5.692 -14.943 -24.794 C \\nATOM 54 O SER 7 -5.85 -11.903 -25.108 O \\nATOM 55 OG SER 7 -6.218 -16.254 -24.677 O \\nATOM 56 N ALA 8 -7.749 -11.984 -25.661 N \\nATOM 57 CA ALA 8 -8.177 -11.04 -24.632 C \\nATOM 58 C ALA 8 -7.497 -11.337 -23.298 C \\nATOM 59 CB ALA 8 -9.694 -11.079 -24.472 C \\nATOM 60 O ALA 8 -7.542 -12.468 -22.809 O \\nATOM 61 N THR 9 -6.221 -11.231 -23.18 N \\nATOM 62 CA THR 9 -5.768 -11.161 -21.795 C \\nATOM 63 C THR 9 -6.953 -11.016 -20.845 C \\nATOM 64 CB THR 9 -4.792 -9.988 -21.586 C \\nATOM 65 O THR 9 -7.822 -10.166 -21.053 O \\nATOM 66 CG2 THR 9 -3.375 -10.491 -21.328 C \\nATOM 67 OG1 THR 9 -4.788 -9.162 -22.756 O \\nATOM 68 N SER 10 -7.955 -11.998 -20.864 N \\nATOM 69 CA SER 10 -8.839 -11.964 -19.704 C \\nATOM 70 C SER 10 -8.3 -11.03 -18.626 C \\nATOM 71 CB SER 10 -9.022 -13.369 -19.128 C \\nATOM 72 O SER 10 -7.13 -11.116 -18.25 O \\nATOM 73 OG SER 10 -8.382 -13.484 -17.869 O \\nATOM 74 N THR 11 -8.182 -9.837 -19.101 N \\nATOM 75 CA THR 11 -8.053 -8.922 -17.972 C \\nATOM 76 C THR 11 -8.694 -9.515 -16.721 C \\nATOM 77 CB THR 11 -8.694 -7.557 -18.284 C \\nATOM 78 O THR 11 -9.918 -9.489 -16.572 O \\nATOM 79 CG2 THR 11 -7.645 -6.547 -18.734 C \\nATOM 80 OG1 THR 11 -9.665 -7.718 -19.325 O \\nATOM 81 N LYS 12 -8.431 -10.789 -16.527 N \\nATOM 82 CA LYS 12 -8.94 -11.209 -15.225 C \\nATOM 83 C LYS 12 -8.913 -10.056 -14.225 C \\nATOM 84 CB LYS 12 -8.129 -12.389 -14.686 C \\nATOM 85 O LYS 12 -7.873 -9.425 -14.026 O \\nATOM 86 CG LYS 12 -8.93 -13.674 -14.539 C \\nATOM 87 CD LYS 12 -8.077 -14.802 -13.972 C \\nATOM 88 CE LYS 12 -8.866 -16.1 -13.862 C \\nATOM 89 NZ LYS 12 -8.034 -17.209 -13.307 N \\nATOM 90 N LYS 13 -9.965 -9.327 -14.238 N \\nATOM 91 CA LYS 13 -10.154 -8.319 -13.199 C \\nATOM 92 C LYS 13 -9.546 -8.773 -11.875 C \\nATOM 93 CB LYS 13 -11.64 -8.009 -13.014 C \\nATOM 94 O LYS 13 -9.659 -9.943 -11.503 O \\nATOM 95 CG LYS 13 -12.205 -7.045 -14.047 C \\nATOM 96 CD LYS 13 -13.635 -6.642 -13.712 C \\nATOM 97 CE LYS 13 -14.222 -5.723 -14.774 C \\nATOM 98 NZ LYS 13 -15.615 -5.304 -14.438 N \\nATOM 99 N LEU 14 -8.601 -8.05 -11.465 N \\nATOM 100 CA LEU 14 -8.04 -8.408 -10.167 C \\nATOM 101 C LEU 14 -9.145 -8.626 -9.138 C \\nATOM 102 CB LEU 14 -7.081 -7.319 -9.679 C \\nATOM 103 O LEU 14 -10.182 -7.961 -9.185 O \\nATOM 104 CG LEU 14 -5.915 -6.977 -10.608 C \\nATOM 105 CD1 LEU 14 -5.039 -5.896 -9.983 C \\nATOM 106 CD2 LEU 14 -5.094 -8.224 -10.917 C \\nATOM 107 N HIS 15 -9.059 -9.65 -8.436 N \\nATOM 108 CA HIS 15 -10.065 -9.963 -7.427 C \\nATOM 109 C HIS 15 -9.541 -9.684 -6.022 C \\nATOM 110 CB HIS 15 -10.502 -11.425 -7.543 C \\nATOM 111 O HIS 15 -8.346 -9.834 -5.759 O \\nATOM 112 CG HIS 15 -9.418 -12.403 -7.222 C \\nATOM 113 CD2 HIS 15 -9.151 -13.095 -6.09 C \\nATOM 114 ND1 HIS 15 -8.446 -12.762 -8.132 N \\nATOM 115 CE1 HIS 15 -7.627 -13.636 -7.57 C \\nATOM 116 NE2 HIS 15 -8.033 -13.855 -6.332 N \\nATOM 117 N LYS 16 -10.479 -9.228 -5.171 N \\nATOM 118 CA LYS 16 -10.174 -8.976 -3.766 C \\nATOM 119 C LYS 16 -10.523 -10.185 -2.902 C \\nATOM 120 CB LYS 16 -10.926 -7.741 -3.267 C \\nATOM 121 O LYS 16 -11.534 -10.85 -3.136 O \\nATOM 122 CG LYS 16 -10.579 -6.461 -4.014 C \\nATOM 123 CD LYS 16 -11.443 -5.294 -3.553 C \\nATOM 124 CE LYS 16 -11.253 -4.072 -4.443 C \\nATOM 125 NZ LYS 16 -12.192 -2.97 -4.077 N \\nATOM 126 N GLU 17 -9.652 -10.498 -2.026 N \\nATOM 127 CA GLU 17 -9.834 -11.574 -1.056 C \\nATOM 128 C GLU 17 -9.886 -11.03 0.369 C \\nATOM 129 CB GLU 17 -8.712 -12.608 -1.183 C \\nATOM 130 O GLU 17 -9.125 -10.128 0.723 O \\nATOM 131 CG GLU 17 -8.619 -13.248 -2.56 C \\nATOM 132 CD GLU 17 -7.423 -14.174 -2.712 C \\nATOM 133 OE1 GLU 17 -7.212 -15.042 -1.835 O \\nATOM 134 OE2 GLU 17 -6.69 -14.03 -3.716 O \\nATOM 135 N PRO 18 -10.79 -11.583 1.172 N \\nATOM 136 CA PRO 18 -10.915 -11.073 2.539 C \\nATOM 137 C PRO 18 -9.702 -11.406 3.406 C \\nATOM 138 CB PRO 18 -12.17 -11.774 3.064 C \\nATOM 139 O PRO 18 -9.066 -12.445 3.211 O \\nATOM 140 CG PRO 18 -12.251 -13.047 2.285 C \\nATOM 141 CD PRO 18 -11.725 -12.794 0.902 C \\nATOM 142 N ALA 19 -9.403 -10.613 4.364 N \\nATOM 143 CA ALA 19 -8.381 -10.793 5.392 C \\nATOM 144 C ALA 19 -8.773 -10.081 6.684 C \\nATOM 145 CB ALA 19 -7.031 -10.283 4.896 C \\nATOM 146 O ALA 19 -9.682 -9.248 6.69 O \\nATOM 147 N THR 20 -8.094 -10.412 7.715 N \\nATOM 148 CA THR 20 -8.323 -9.777 9.009 C \\nATOM 149 C THR 20 -7.046 -9.116 9.52 C \\nATOM 150 CB THR 20 -8.829 -10.795 10.048 C \\nATOM 151 O THR 20 -5.966 -9.705 9.453 O \\nATOM 152 CG2 THR 20 -9.156 -10.112 11.372 C \\nATOM 153 OG1 THR 20 -10.01 -11.433 9.548 O \\nATOM 154 N LEU 21 -7.172 -7.959 10.066 N \\nATOM 155 CA LEU 21 -6.028 -7.188 10.539 C \\nATOM 156 C LEU 21 -5.447 -7.8 11.809 C \\nATOM 157 CB LEU 21 -6.431 -5.734 10.797 C \\nATOM 158 O LEU 21 -6.185 -8.113 12.746 O \\nATOM 159 CG LEU 21 -5.323 -4.8 11.285 C \\nATOM 160 CD1 LEU 21 -4.306 -4.557 10.175 C \\nATOM 161 CD2 LEU 21 -5.912 -3.481 11.775 C \\nATOM 162 N ILE 22 -4.13 -7.981 11.846 N \\nATOM 163 CA ILE 22 -3.396 -8.281 13.07 C \\nATOM 164 C ILE 22 -2.766 -7.003 13.62 C \\nATOM 165 CB ILE 22 -2.31 -9.353 12.829 C \\nATOM 166 O ILE 22 -2.976 -6.651 14.783 O \\nATOM 167 CG1 ILE 22 -2.954 -10.683 12.421 C \\nATOM 168 CG2 ILE 22 -1.437 -9.527 14.076 C \\nATOM 169 CD1 ILE 22 -1.954 -11.752 12.003 C \\nATOM 170 N LYS 23 -2.084 -6.279 12.709 N \\nATOM 171 CA LYS 23 -1.507 -5.002 13.12 C \\nATOM 172 C LYS 23 -0.978 -4.226 11.918 C \\nATOM 173 CB LYS 23 -0.386 -5.222 14.137 C \\nATOM 174 O LYS 23 -0.593 -4.82 10.909 O \\nATOM 175 CG LYS 23 0.816 -5.972 13.58 C \\nATOM 176 CD LYS 23 1.93 -6.086 14.612 C \\nATOM 177 CE LYS 23 3.137 -6.828 14.054 C \\nATOM 178 NZ LYS 23 4.259 -6.882 15.038 N \\nATOM 179 N ALA 24 -1.076 -2.931 12.026 N \\nATOM 180 CA ALA 24 -0.335 -2.042 11.135 C \\nATOM 181 C ALA 24 1.111 -1.883 11.598 C \\nATOM 182 CB ALA 24 -1.018 -0.679 11.054 C \\nATOM 183 O ALA 24 1.366 -1.599 12.771 O \\nATOM 184 N ILE 25 2.135 -2.099 10.729 N \\nATOM 185 CA ILE 25 3.547 -2.101 11.096 C \\nATOM 186 C ILE 25 4.148 -0.72 10.843 C \\nATOM 187 CB ILE 25 4.332 -3.178 10.314 C \\nATOM 188 O ILE 25 4.834 -0.167 11.707 O \\nATOM 189 CG1 ILE 25 3.842 -4.58 10.697 C \\nATOM 190 CG2 ILE 25 5.837 -3.038 10.564 C \\nATOM 191 CD1 ILE 25 4.416 -5.694 9.833 C \\nATOM 192 N ASP 26 3.901 -0.156 9.705 N \\nATOM 193 CA ASP 26 4.295 1.2 9.337 C \\nATOM 194 C ASP 26 3.434 1.731 8.193 C \\nATOM 195 CB ASP 26 5.774 1.242 8.945 C \\nATOM 196 O ASP 26 2.314 1.262 7.983 O \\nATOM 197 CG ASP 26 6.112 0.299 7.803 C \\nATOM 198 OD1 ASP 26 5.23 0.018 6.964 O \\nATOM 199 OD2 ASP 26 7.27 -0.168 7.744 O \\nATOM 200 N GLY 27 3.989 2.695 7.51 N \\nATOM 201 CA GLY 27 3.135 3.365 6.542 C \\nATOM 202 C GLY 27 2.745 2.477 5.375 C \\nATOM 203 O GLY 27 1.651 2.612 4.824 O \\nATOM 204 N ASP 28 3.617 1.507 5.021 N \\nATOM 205 CA ASP 28 3.31 0.735 3.821 C \\nATOM 206 C ASP 28 3.408 -0.764 4.092 C \\nATOM 207 CB ASP 28 4.249 1.125 2.677 C \\nATOM 208 O ASP 28 3.493 -1.565 3.159 O \\nATOM 209 CG ASP 28 5.714 1.096 3.077 C \\nATOM 210 OD1 ASP 28 6.039 0.579 4.167 O \\nATOM 211 OD2 ASP 28 6.551 1.598 2.295 O \\nATOM 212 N THR 29 3.346 -1.126 5.359 N \\nATOM 213 CA THR 29 3.429 -2.534 5.732 C \\nATOM 214 C THR 29 2.378 -2.877 6.783 C \\nATOM 215 CB THR 29 4.828 -2.889 6.266 C \\nATOM 216 O THR 29 2.24 -2.17 7.784 O \\nATOM 217 CG2 THR 29 4.956 -4.387 6.521 C \\nATOM 218 OG1 THR 29 5.815 -2.494 5.305 O \\nATOM 219 N VAL 30 1.627 -3.937 6.558 N \\nATOM 220 CA VAL 30 0.62 -4.41 7.502 C \\nATOM 221 C VAL 30 0.728 -5.925 7.657 C \\nATOM 222 CB VAL 30 -0.807 -4.02 7.052 C \\nATOM 223 O VAL 30 1.176 -6.619 6.741 O \\nATOM 224 CG1 VAL 30 -0.959 -2.501 6.996 C \\nATOM 225 CG2 VAL 30 -1.127 -4.644 5.695 C \\nATOM 226 N LYS 31 0.373 -6.369 8.782 N \\nATOM 227 CA LYS 31 0.237 -7.8 9.035 C \\nATOM 228 C LYS 31 -1.232 -8.209 9.103 C \\nATOM 229 CB LYS 31 0.949 -8.187 10.332 C \\nATOM 230 O LYS 31 -2.015 -7.608 9.841 O \\nATOM 231 CG LYS 31 1.134 -9.686 10.514 C \\nATOM 232 CD LYS 31 2.045 -9.998 11.694 C \\nATOM 233 CE LYS 31 2.39 -11.479 11.759 C \\nATOM 234 NZ LYS 31 3.37 -11.773 12.847 N \\nATOM 235 N LEU 32 -1.668 -9.228 8.403 N \\nATOM 236 CA LEU 32 -3.05 -9.686 8.308 C \\nATOM 237 C LEU 32 -3.138 -11.194 8.515 C \\nATOM 238 CB LEU 32 -3.648 -9.309 6.95 C \\nATOM 239 O LEU 32 -2.184 -11.921 8.231 O \\nATOM 240 CG LEU 32 -3.524 -7.842 6.538 C \\nATOM 241 CD1 LEU 32 -4.056 -7.642 5.123 C \\nATOM 242 CD2 LEU 32 -4.263 -6.945 7.524 C \\nATOM 243 N MET 33 -4.203 -11.672 9.018 N \\nATOM 244 CA MET 33 -4.6 -13.068 8.86 C \\nATOM 245 C MET 33 -5.196 -13.312 7.477 C \\nATOM 246 CB MET 33 -5.606 -13.468 9.941 C \\nATOM 247 O MET 33 -6.284 -12.821 7.17 O \\nATOM 248 CG MET 33 -5.86 -14.964 10.019 C \\nATOM 249 SD MET 33 -4.346 -15.914 10.432 S \\nATOM 250 CE MET 33 -4.09 -15.378 12.147 C \\nATOM 251 N TYR 34 -4.555 -13.897 6.657 N \\nATOM 252 CA TYR 34 -4.929 -14.202 5.281 C \\nATOM 253 C TYR 34 -4.988 -15.707 5.052 C \\nATOM 254 CB TYR 34 -3.941 -13.563 4.301 C \\nATOM 255 O TYR 34 -3.998 -16.412 5.26 O \\nATOM 256 CG TYR 34 -4.244 -13.861 2.852 C \\nATOM 257 CD1 TYR 34 -5.408 -13.387 2.253 C \\nATOM 258 CD2 TYR 34 -3.368 -14.617 2.081 C \\nATOM 259 CE1 TYR 34 -5.693 -13.661 0.919 C \\nATOM 260 CE2 TYR 34 -3.642 -14.897 0.747 C \\nATOM 261 OH TYR 34 -5.082 -14.688 -1.146 O \\nATOM 262 CZ TYR 34 -4.805 -14.415 0.175 C \\nATOM 263 N LYS 35 -6.077 -16.108 4.75 N \\nATOM 264 CA LYS 35 -6.333 -17.532 4.552 C \\nATOM 265 C LYS 35 -5.889 -18.343 5.766 C \\nATOM 266 CB LYS 35 -5.621 -18.036 3.296 C \\nATOM 267 O LYS 35 -5.285 -19.408 5.62 O \\nATOM 268 CG LYS 35 -6.18 -17.47 1.999 C \\nATOM 269 CD LYS 35 -5.51 -18.095 0.781 C \\nATOM 270 CE LYS 35 -6.17 -17.643 -0.514 C \\nATOM 271 NZ LYS 35 -5.516 -18.253 -1.711 N \\nATOM 272 N GLY 36 -6.237 -17.828 6.862 N \\nATOM 273 CA GLY 36 -6.046 -18.557 8.105 C \\nATOM 274 C GLY 36 -4.619 -18.501 8.617 C \\nATOM 275 O GLY 36 -4.285 -19.145 9.613 O \\nATOM 276 N GLN 37 -3.733 -17.679 7.971 N \\nATOM 277 CA GLN 37 -2.334 -17.578 8.375 C \\nATOM 278 C GLN 37 -1.898 -16.12 8.488 C \\nATOM 279 CB GLN 37 -1.434 -18.32 7.385 C \\nATOM 280 O GLN 37 -2.299 -15.282 7.677 O \\nATOM 281 CG GLN 37 -1.759 -19.802 7.251 C \\nATOM 282 CD GLN 37 -1.44 -20.589 8.508 C \\nATOM 283 NE2 GLN 37 -2.192 -21.658 8.745 N \\nATOM 284 OE1 GLN 37 -0.524 -20.239 9.259 O \\nATOM 285 N PRO 38 -1.171 -15.863 9.586 N \\nATOM 286 CA PRO 38 -0.589 -14.52 9.635 C \\nATOM 287 C PRO 38 0.394 -14.26 8.496 C \\nATOM 288 CB PRO 38 0.124 -14.494 10.989 C \\nATOM 289 O PRO 38 1.255 -15.098 8.216 O \\nATOM 290 CG PRO 38 0.42 -15.927 11.293 C \\nATOM 291 CD PRO 38 -0.589 -16.783 10.583 C \\nATOM 292 N MET 39 0.237 -13.206 7.828 N \\nATOM 293 CA MET 39 1.128 -12.795 6.747 C \\nATOM 294 C MET 39 1.368 -11.289 6.782 C \\nATOM 295 CB MET 39 0.55 -13.2 5.39 C \\nATOM 296 O MET 39 0.445 -10.515 7.041 O \\nATOM 297 CG MET 39 1.45 -12.86 4.213 C \\nATOM 298 SD MET 39 0.81 -13.518 2.625 S \\nATOM 299 CE MET 39 1.513 -15.191 2.665 C \\nATOM 300 N THR 40 2.631 -10.915 6.56 N \\nATOM 301 CA THR 40 2.971 -9.505 6.405 C \\nATOM 302 C THR 40 2.823 -9.069 4.95 C \\nATOM 303 CB THR 40 4.406 -9.22 6.886 C \\nATOM 304 O THR 40 3.269 -9.769 4.039 O \\nATOM 305 CG2 THR 40 4.77 -7.752 6.692 C \\nATOM 306 OG1 THR 40 4.511 -9.547 8.277 O \\nATOM 307 N PHE 41 2.193 -7.925 4.708 N \\nATOM 308 CA PHE 41 1.991 -7.405 3.361 C \\nATOM 309 C PHE 41 2.726 -6.083 3.175 C \\nATOM 310 CB PHE 41 0.497 -7.219 3.074 C \\nATOM 311 O PHE 41 2.692 -5.219 4.053 O \\nATOM 312 CG PHE 41 -0.26 -8.512 2.935 C \\nATOM 313 CD1 PHE 41 -0.446 -9.094 1.687 C \\nATOM 314 CD2 PHE 41 -0.785 -9.147 4.053 C \\nATOM 315 CE1 PHE 41 -1.146 -10.291 1.556 C \\nATOM 316 CE2 PHE 41 -1.486 -10.343 3.93 C \\nATOM 317 CZ PHE 41 -1.666 -10.913 2.68 C \\nATOM 318 N ARG 42 3.407 -6.043 2.044 N \\nATOM 319 CA ARG 42 3.968 -4.815 1.49 C \\nATOM 320 C ARG 42 3.035 -4.207 0.449 C \\nATOM 321 CB ARG 42 5.342 -5.082 0.871 C \\nATOM 322 O ARG 42 2.668 -4.869 -0.524 O \\nATOM 323 CG ARG 42 5.968 -3.864 0.212 C \\nATOM 324 CD ARG 42 6.492 -2.873 1.242 C \\nATOM 325 NE ARG 42 7.317 -1.838 0.625 N \\nATOM 326 NH1 ARG 42 6.255 -0.075 1.674 N \\nATOM 327 NH2 ARG 42 7.99 0.322 0.228 N \\nATOM 328 CZ ARG 42 7.185 -0.533 0.844 C \\nATOM 329 N LEU 43 2.6 -2.916 0.721 N \\nATOM 330 CA LEU 43 1.704 -2.247 -0.216 C \\nATOM 331 C LEU 43 2.406 -1.982 -1.544 C \\nATOM 332 CB LEU 43 1.194 -0.931 0.376 C \\nATOM 333 O LEU 43 3.499 -1.411 -1.571 O \\nATOM 334 CG LEU 43 -0.008 -1.031 1.317 C \\nATOM 335 CD1 LEU 43 0.368 -1.806 2.576 C \\nATOM 336 CD2 LEU 43 -0.527 0.358 1.672 C \\nATOM 337 N LEU 44 1.745 -2.421 -2.594 N \\nATOM 338 CA LEU 44 2.328 -2.316 -3.927 C \\nATOM 339 C LEU 44 2.404 -0.859 -4.373 C \\nATOM 340 CB LEU 44 1.511 -3.128 -4.935 C \\nATOM 341 O LEU 44 1.492 -0.074 -4.103 O \\nATOM 342 CG LEU 44 1.783 -4.633 -4.972 C \\nATOM 343 CD1 LEU 44 0.768 -5.333 -5.869 C \\nATOM 344 CD2 LEU 44 3.205 -4.908 -5.448 C \\nATOM 345 N LEU 45 3.425 -0.413 -4.991 N \\nATOM 346 CA LEU 45 3.584 0.769 -5.83 C \\nATOM 347 C LEU 45 3.732 2.025 -4.977 C \\nATOM 348 CB LEU 45 2.39 0.919 -6.777 C \\nATOM 349 O LEU 45 3.691 3.142 -5.498 O \\nATOM 350 CG LEU 45 2.139 -0.242 -7.74 C \\nATOM 351 CD1 LEU 45 0.937 0.058 -8.63 C \\nATOM 352 CD2 LEU 45 3.38 -0.517 -8.583 C \\nATOM 353 N VAL 46 4.008 1.784 -3.637 N \\nATOM 354 CA VAL 46 4.135 2.973 -2.801 C \\nATOM 355 C VAL 46 5.384 2.861 -1.93 C \\nATOM 356 CB VAL 46 2.885 3.181 -1.917 C \\nATOM 357 O VAL 46 5.804 1.758 -1.574 O \\nATOM 358 CG1 VAL 46 1.641 3.383 -2.78 C \\nATOM 359 CG2 VAL 46 2.697 1.996 -0.972 C \\nATOM 360 N ASP 47 5.992 3.952 -1.696 N \\nATOM 361 CA ASP 47 7.075 4.134 -0.735 C \\nATOM 362 C ASP 47 6.757 5.263 0.243 C \\nATOM 363 CB ASP 47 8.392 4.421 -1.458 C \\nATOM 364 O ASP 47 6.532 6.403 -0.168 O \\nATOM 365 CG ASP 47 9.607 4.278 -0.558 C \\nATOM 366 OD1 ASP 47 9.502 3.637 0.511 O \\nATOM 367 OD2 ASP 47 10.677 4.812 -0.919 O \\nATOM 368 N THR 48 6.624 4.937 1.534 N \\nATOM 369 CA THR 48 6.378 5.918 2.585 C \\nATOM 370 C THR 48 7.677 6.283 3.298 C \\nATOM 371 CB THR 48 5.356 5.394 3.611 C \\nATOM 372 O THR 48 8.611 5.48 3.348 O \\nATOM 373 CG2 THR 48 4.002 5.138 2.956 C \\nATOM 374 OG1 THR 48 5.84 4.169 4.176 O \\nATOM 375 N PRO 49 7.66 7.525 3.852 N \\nATOM 376 CA PRO 49 8.818 7.822 4.697 C \\nATOM 377 C PRO 49 8.952 6.859 5.875 C \\nATOM 378 CB PRO 49 8.542 9.246 5.185 C \\nATOM 379 O PRO 49 7.944 6.398 6.417 O \\nATOM 380 CG PRO 49 7.536 9.791 4.225 C \\nATOM 381 CD PRO 49 6.662 8.662 3.757 C \\nATOM 382 N GLU 50 10.125 6.582 6.285 N \\nATOM 383 CA GLU 50 10.44 5.565 7.283 C \\nATOM 384 C GLU 50 10.07 6.035 8.686 C \\nATOM 385 CB GLU 50 11.925 5.197 7.226 C \\nATOM 386 O GLU 50 10.316 7.188 9.046 O \\nATOM 387 CG GLU 50 12.363 4.608 5.893 C \\nATOM 388 CD GLU 50 11.798 3.22 5.636 C \\nATOM 389 OE1 GLU 50 11.2 2.627 6.562 O \\nATOM 390 OE2 GLU 50 11.955 2.722 4.499 O \\nATOM 391 N THR 51 9.433 5.189 9.409 N \\nATOM 392 CA THR 51 9.186 5.453 10.822 C \\nATOM 393 C THR 51 10.405 5.082 11.663 C \\nATOM 394 CB THR 51 7.955 4.679 11.329 C \\nATOM 395 O THR 51 10.612 5.638 12.743 O \\nATOM 396 CG2 THR 51 6.669 5.236 10.726 C \\nATOM 397 OG1 THR 51 8.082 3.299 10.964 O \\nATOM 398 N LYS 52 11.006 4.102 11.265 N \\nATOM 399 CA LYS 52 12.231 3.611 11.889 C \\nATOM 400 C LYS 52 13.209 3.085 10.842 C \\nATOM 401 CB LYS 52 11.913 2.515 12.907 C \\nATOM 402 O LYS 52 12.848 2.246 10.014 O \\nATOM 403 CG LYS 52 13.098 2.111 13.772 C \\nATOM 404 CD LYS 52 12.708 1.053 14.795 C \\nATOM 405 CE LYS 52 13.909 0.592 15.61 C \\nATOM 406 NZ LYS 52 13.537 -0.465 16.597 N \\nATOM 407 N HIS 53 14.353 3.69 10.805 N \\nATOM 408 CA HIS 53 15.4 3.165 9.936 C \\nATOM 409 C HIS 53 16.754 3.174 10.637 C \\nATOM 410 CB HIS 53 15.475 3.974 8.639 C \\nATOM 411 O HIS 53 17.114 4.157 11.288 O \\nATOM 412 CG HIS 53 16.242 3.293 7.551 C \\nATOM 413 CD2 HIS 53 15.821 2.614 6.458 C \\nATOM 414 ND1 HIS 53 17.619 3.263 7.517 N \\nATOM 415 CE1 HIS 53 18.013 2.593 6.447 C \\nATOM 416 NE2 HIS 53 16.941 2.188 5.787 N \\nATOM 417 N PRO 54 17.374 2.004 10.662 N \\nATOM 418 CA PRO 54 18.639 1.888 11.391 C \\nATOM 419 C PRO 54 19.625 3.0 11.041 C \\nATOM 420 CB PRO 54 19.176 0.524 10.951 C \\nATOM 421 O PRO 54 20.378 3.458 11.905 O \\nATOM 422 CG PRO 54 18.372 0.168 9.742 C \\nATOM 423 CD PRO 54 17.061 0.898 9.81 C \\nATOM 424 N LYS 55 19.542 3.523 9.74 N \\nATOM 425 CA LYS 55 20.519 4.508 9.283 C \\nATOM 426 C LYS 55 19.898 5.899 9.198 C \\nATOM 427 CB LYS 55 21.091 4.105 7.923 C \\nATOM 428 O LYS 55 20.542 6.894 9.54 O \\nATOM 429 CG LYS 55 21.961 2.858 7.962 C \\nATOM 430 CD LYS 55 22.559 2.55 6.595 C \\nATOM 431 CE LYS 55 23.369 1.261 6.615 C \\nATOM 432 NZ LYS 55 23.907 0.924 5.263 N \\nATOM 433 N LYS 56 18.7 6.065 8.872 N \\nATOM 434 CA LYS 56 18.084 7.351 8.557 C \\nATOM 435 C LYS 56 17.279 7.88 9.74 C \\nATOM 436 CB LYS 56 17.186 7.229 7.325 C \\nATOM 437 O LYS 56 16.952 9.067 9.795 O \\nATOM 438 CG LYS 56 17.941 6.942 6.035 C \\nATOM 439 CD LYS 56 17.006 6.922 4.833 C \\nATOM 440 CE LYS 56 17.755 6.605 3.545 C \\nATOM 441 NZ LYS 56 16.832 6.519 2.374 N \\nATOM 442 N GLY 57 17.064 7.006 10.756 N \\nATOM 443 CA GLY 57 16.184 7.402 11.844 C \\nATOM 444 C GLY 57 14.742 7.584 11.41 C \\nATOM 445 O GLY 57 14.246 6.843 10.558 O \\nATOM 446 N VAL 58 13.987 8.397 11.975 N \\nATOM 447 CA VAL 58 12.603 8.746 11.672 C \\nATOM 448 C VAL 58 12.568 9.841 10.608 C \\nATOM 449 CB VAL 58 11.845 9.207 12.936 C \\nATOM 450 O VAL 58 13.146 10.914 10.793 O \\nATOM 451 CG1 VAL 58 10.406 9.589 12.594 C \\nATOM 452 CG2 VAL 58 11.871 8.113 14.002 C \\nATOM 453 N GLU 59 12.112 9.427 9.451 N \\nATOM 454 CA GLU 59 11.996 10.425 8.392 C \\nATOM 455 C GLU 59 10.802 11.346 8.63 C \\nATOM 456 CB GLU 59 11.872 9.747 7.025 C \\nATOM 457 O GLU 59 9.811 10.941 9.24 O \\nATOM 458 CG GLU 59 13.115 8.975 6.607 C \\nATOM 459 CD GLU 59 12.989 8.331 5.236 C \\nATOM 460 OE1 GLU 59 11.912 7.774 4.924 O \\nATOM 461 OE2 GLU 59 13.975 8.382 4.468 O \\nATOM 462 N LYS 60 10.992 12.542 8.114 N \\nATOM 463 CA LYS 60 9.868 13.474 8.133 C \\nATOM 464 C LYS 60 8.633 12.859 7.482 C \\nATOM 465 CB LYS 60 10.24 14.778 7.426 C \\nATOM 466 O LYS 60 8.725 12.253 6.412 O \\nATOM 467 CG LYS 60 9.223 15.895 7.612 C \\nATOM 468 CD LYS 60 9.71 17.202 7.0 C \\nATOM 469 CE LYS 60 8.721 18.335 7.239 C \\nATOM 470 NZ LYS 60 9.187 19.616 6.629 N \\nATOM 471 N TYR 61 7.445 12.886 8.085 N \\nATOM 472 CA TYR 61 6.132 12.402 7.672 C \\nATOM 473 C TYR 61 6.035 10.889 7.827 C \\nATOM 474 CB TYR 61 5.846 12.797 6.22 C \\nATOM 475 O TYR 61 4.991 10.295 7.547 O \\nATOM 476 CG TYR 61 5.863 14.287 5.982 C \\nATOM 477 CD1 TYR 61 4.813 15.094 6.416 C \\nATOM 478 CD2 TYR 61 6.927 14.892 5.322 C \\nATOM 479 CE1 TYR 61 4.824 16.467 6.197 C \\nATOM 480 CE2 TYR 61 6.948 16.264 5.098 C \\nATOM 481 OH TYR 61 5.91 18.402 5.319 O \\nATOM 482 CZ TYR 61 5.894 17.042 5.538 C \\nATOM 483 N GLY 62 7.137 10.228 8.27 N \\nATOM 484 CA GLY 62 7.095 8.801 8.546 C \\nATOM 485 C GLY 62 6.036 8.422 9.564 C \\nATOM 486 O GLY 62 5.209 7.543 9.311 O \\nATOM 487 N PRO 63 6.084 9.05 10.741 N \\nATOM 488 CA PRO 63 5.05 8.759 11.737 C \\nATOM 489 C PRO 63 3.645 9.095 11.244 C \\nATOM 490 CB PRO 63 5.441 9.647 12.921 C \\nATOM 491 O PRO 63 2.69 8.377 11.552 O \\nATOM 492 CG PRO 63 6.924 9.793 12.816 C \\nATOM 493 CD PRO 63 7.293 9.883 11.363 C \\nATOM 494 N GLU 64 3.478 10.209 10.518 N \\nATOM 495 CA GLU 64 2.176 10.584 9.975 C \\nATOM 496 C GLU 64 1.654 9.523 9.01 C \\nATOM 497 CB GLU 64 2.258 11.941 9.27 C \\nATOM 498 O GLU 64 0.47 9.18 9.037 O \\nATOM 499 CG GLU 64 2.485 13.111 10.215 C \\nATOM 500 CD GLU 64 3.955 13.411 10.457 C \\nATOM 501 OE1 GLU 64 4.804 12.523 10.216 O \\nATOM 502 OE2 GLU 64 4.262 14.544 10.892 O \\nATOM 503 N ALA 65 2.557 9.01 8.149 N \\nATOM 504 CA ALA 65 2.161 7.955 7.22 C \\nATOM 505 C ALA 65 1.762 6.686 7.968 C \\nATOM 506 CB ALA 65 3.293 7.656 6.24 C \\nATOM 507 O ALA 65 0.755 6.055 7.64 O \\nATOM 508 N SER 66 2.575 6.338 8.97 N \\nATOM 509 CA SER 66 2.272 5.16 9.776 C \\nATOM 510 C SER 66 0.932 5.308 10.49 C \\nATOM 511 CB SER 66 3.38 4.912 10.8 C \\nATOM 512 O SER 66 0.119 4.381 10.494 O \\nATOM 513 OG SER 66 3.125 3.731 11.541 O \\nATOM 514 N ALA 67 0.648 6.462 11.066 N \\nATOM 515 CA ALA 67 -0.605 6.72 11.77 C \\nATOM 516 C ALA 67 -1.792 6.68 10.811 C \\nATOM 517 CB ALA 67 -0.547 8.069 12.482 C \\nATOM 518 O ALA 67 -2.864 6.182 11.161 O \\nATOM 519 N PHE 68 -1.566 7.186 9.607 N \\nATOM 520 CA PHE 68 -2.629 7.209 8.609 C \\nATOM 521 C PHE 68 -3.037 5.794 8.219 C \\nATOM 522 CB PHE 68 -2.184 7.988 7.367 C \\nATOM 523 O PHE 68 -4.225 5.467 8.201 O \\nATOM 524 CG PHE 68 -3.249 8.105 6.31 C \\nATOM 525 CD1 PHE 68 -4.21 9.105 6.38 C \\nATOM 526 CD2 PHE 68 -3.288 7.213 5.246 C \\nATOM 527 CE1 PHE 68 -5.197 9.216 5.403 C \\nATOM 528 CE2 PHE 68 -4.271 7.317 4.266 C \\nATOM 529 CZ PHE 68 -5.225 8.319 4.347 C \\nATOM 530 N THR 69 -2.068 4.981 7.93 N \\nATOM 531 CA THR 69 -2.34 3.586 7.6 C \\nATOM 532 C THR 69 -3.005 2.872 8.773 C \\nATOM 533 CB THR 69 -1.05 2.843 7.208 C \\nATOM 534 O THR 69 -3.988 2.151 8.591 O \\nATOM 535 CG2 THR 69 -1.32 1.361 6.966 C \\nATOM 536 OG1 THR 69 -0.517 3.421 6.01 O \\nATOM 537 N LYS 70 -2.424 3.082 9.959 N \\nATOM 538 CA LYS 70 -2.979 2.46 11.158 C \\nATOM 539 C LYS 70 -4.452 2.821 11.333 C \\nATOM 540 CB LYS 70 -2.186 2.881 12.396 C \\nATOM 541 O LYS 70 -5.286 1.946 11.57 O \\nATOM 542 CG LYS 70 -2.651 2.217 13.684 C \\nATOM 543 CD LYS 70 -1.756 2.588 14.859 C \\nATOM 544 CE LYS 70 -2.232 1.94 16.152 C \\nATOM 545 NZ LYS 70 -1.37 2.319 17.312 N \\nATOM 546 N LYS 71 -4.799 4.069 11.192 N \\nATOM 547 CA LYS 71 -6.173 4.54 11.337 C \\nATOM 548 C LYS 71 -7.081 3.921 10.278 C \\nATOM 549 CB LYS 71 -6.23 6.066 11.25 C \\nATOM 550 O LYS 71 -8.191 3.481 10.584 O \\nATOM 551 CG LYS 71 -7.616 6.648 11.488 C \\nATOM 552 CD LYS 71 -7.598 8.17 11.442 C \\nATOM 553 CE LYS 71 -8.985 8.754 11.675 C \\nATOM 554 NZ LYS 71 -8.966 10.248 11.664 N \\nATOM 555 N MET 72 -6.634 3.822 9.002 N \\nATOM 556 CA MET 72 -7.467 3.302 7.921 C \\nATOM 557 C MET 72 -7.801 1.832 8.15 C \\nATOM 558 CB MET 72 -6.768 3.476 6.572 C \\nATOM 559 O MET 72 -8.944 1.414 7.959 O \\nATOM 560 CG MET 72 -6.803 4.9 6.042 C \\nATOM 561 SD MET 72 -6.245 5.015 4.297 S \\nATOM 562 CE MET 72 -7.647 4.224 3.46 C \\nATOM 563 N VAL 73 -6.821 1.079 8.598 N \\nATOM 564 CA VAL 73 -7.032 -0.365 8.62 C \\nATOM 565 C VAL 73 -7.632 -0.78 9.962 C \\nATOM 566 CB VAL 73 -5.718 -1.135 8.363 C \\nATOM 567 O VAL 73 -8.43 -1.718 10.028 O \\nATOM 568 CG1 VAL 73 -5.183 -0.84 6.963 C \\nATOM 569 CG2 VAL 73 -4.676 -0.779 9.423 C \\nATOM 570 N GLU 74 -7.285 -0.11 11.047 N \\nATOM 571 CA GLU 74 -7.823 -0.482 12.352 C \\nATOM 572 C GLU 74 -9.289 -0.078 12.48 C \\nATOM 573 CB GLU 74 -7.002 0.157 13.475 C \\nATOM 574 O GLU 74 -10.043 -0.689 13.241 O \\nATOM 575 CG GLU 74 -5.624 -0.463 13.658 C \\nATOM 576 CD GLU 74 -4.859 0.113 14.839 C \\nATOM 577 OE1 GLU 74 -5.336 1.097 15.449 O \\nATOM 578 OE2 GLU 74 -3.774 -0.423 15.157 O \\nATOM 579 N ASN 75 -9.685 0.959 11.78 N \\nATOM 580 CA ASN 75 -11.068 1.414 11.875 C \\nATOM 581 C ASN 75 -11.956 0.727 10.843 C \\nATOM 582 CB ASN 75 -11.145 2.934 11.715 C \\nATOM 583 O ASN 75 -13.176 0.903 10.851 O \\nATOM 584 CG ASN 75 -10.6 3.677 12.919 C \\nATOM 585 ND2 ASN 75 -10.279 4.951 12.734 N \\nATOM 586 OD1 ASN 75 -10.468 3.109 14.007 O \\nATOM 587 N ALA 76 -11.348 -0.089 10.062 N \\nATOM 588 CA ALA 76 -12.098 -0.719 8.979 C \\nATOM 589 C ALA 76 -12.862 -1.942 9.479 C \\nATOM 590 CB ALA 76 -11.16 -1.111 7.839 C \\nATOM 591 O ALA 76 -12.353 -2.705 10.304 O \\nATOM 592 N LYS 77 -14.046 -2.149 8.944 N \\nATOM 593 CA LYS 77 -14.842 -3.344 9.207 C \\nATOM 594 C LYS 77 -14.436 -4.49 8.284 C \\nATOM 595 CB LYS 77 -16.333 -3.043 9.044 C \\nATOM 596 O LYS 77 -14.603 -5.661 8.63 O \\nATOM 597 CG LYS 77 -16.878 -2.047 10.057 C \\nATOM 598 CD LYS 77 -18.357 -1.766 9.825 C \\nATOM 599 CE LYS 77 -18.882 -0.705 10.783 C \\nATOM 600 NZ LYS 77 -20.317 -0.383 10.52 N \\nATOM 601 N LYS 78 -13.999 -4.126 7.229 N \\nATOM 602 CA LYS 78 -13.602 -5.102 6.219 C \\nATOM 603 C LYS 78 -12.247 -4.746 5.613 C \\nATOM 604 CB LYS 78 -14.66 -5.197 5.119 C \\nATOM 605 O LYS 78 -12.033 -3.612 5.182 O \\nATOM 606 CG LYS 78 -14.436 -6.342 4.142 C \\nATOM 607 CD LYS 78 -15.523 -6.388 3.076 C \\nATOM 608 CE LYS 78 -15.255 -7.481 2.05 C \\nATOM 609 NZ LYS 78 -16.271 -7.474 0.955 N \\nATOM 610 N ILE 79 -11.362 -5.748 5.63 N \\nATOM 611 CA ILE 79 -10.067 -5.636 4.969 C \\nATOM 612 C ILE 79 -9.974 -6.657 3.837 C \\nATOM 613 CB ILE 79 -8.904 -5.835 5.967 C \\nATOM 614 O ILE 79 -10.304 -7.831 4.024 O \\nATOM 615 CG1 ILE 79 -8.995 -4.81 7.103 C \\nATOM 616 CG2 ILE 79 -7.554 -5.74 5.25 C \\nATOM 617 CD1 ILE 79 -8.755 -3.373 6.662 C \\nATOM 618 N GLU 80 -9.543 -6.235 2.655 N \\nATOM 619 CA GLU 80 -9.369 -7.114 1.502 C \\nATOM 620 C GLU 80 -7.994 -6.926 0.868 C \\nATOM 621 CB GLU 80 -10.466 -6.862 0.464 C \\nATOM 622 O GLU 80 -7.433 -5.829 0.903 O \\nATOM 623 CG GLU 80 -11.874 -7.12 0.982 C \\nATOM 624 CD GLU 80 -12.959 -6.611 0.047 C \\nATOM 625 OE1 GLU 80 -13.025 -5.384 -0.195 O \\nATOM 626 OE2 GLU 80 -13.751 -7.445 -0.446 O \\nATOM 627 N VAL 81 -7.513 -8.001 0.336 N \\nATOM 628 CA VAL 81 -6.224 -8.028 -0.347 C \\nATOM 629 C VAL 81 -6.433 -8.287 -1.837 C \\nATOM 630 CB VAL 81 -5.286 -9.098 0.254 C \\nATOM 631 O VAL 81 -7.21 -9.166 -2.218 O \\nATOM 632 CG1 VAL 81 -3.984 -9.182 -0.541 C \\nATOM 633 CG2 VAL 81 -5.0 -8.793 1.723 C \\nATOM 634 N GLU 82 -5.78 -7.484 -2.688 N \\nATOM 635 CA GLU 82 -5.81 -7.632 -4.14 C \\nATOM 636 C GLU 82 -4.408 -7.848 -4.702 C \\nATOM 637 CB GLU 82 -6.456 -6.407 -4.792 C \\nATOM 638 O GLU 82 -3.569 -6.945 -4.656 O \\nATOM 639 CG GLU 82 -6.551 -6.496 -6.308 C \\nATOM 640 CD GLU 82 -7.148 -5.252 -6.946 C \\nATOM 641 OE1 GLU 82 -6.413 -4.257 -7.139 O \\nATOM 642 OE2 GLU 82 -8.36 -5.272 -7.255 O \\nATOM 643 N PHE 83 -4.165 -8.994 -5.164 N \\nATOM 644 CA PHE 83 -2.884 -9.285 -5.798 C \\nATOM 645 C PHE 83 -2.902 -8.878 -7.267 C \\nATOM 646 CB PHE 83 -2.546 -10.774 -5.671 C \\nATOM 647 O PHE 83 -3.924 -9.017 -7.943 O \\nATOM 648 CG PHE 83 -2.273 -11.216 -4.259 C \\nATOM 649 CD1 PHE 83 -1.014 -11.051 -3.695 C \\nATOM 650 CD2 PHE 83 -3.277 -11.797 -3.495 C \\nATOM 651 CE1 PHE 83 -0.759 -11.46 -2.388 C \\nATOM 652 CE2 PHE 83 -3.03 -12.207 -2.188 C \\nATOM 653 CZ PHE 83 -1.77 -12.039 -1.637 C \\nATOM 654 N ASN 84 -1.784 -8.335 -7.588 N \\nATOM 655 CA ASN 84 -1.634 -8.008 -9.002 C \\nATOM 656 C ASN 84 -1.251 -9.236 -9.823 C \\nATOM 657 CB ASN 84 -0.598 -6.898 -9.189 C \\nATOM 658 O ASN 84 -1.222 -10.352 -9.303 O \\nATOM 659 CG ASN 84 -0.931 -5.978 -10.347 C \\nATOM 660 ND2 ASN 84 -0.549 -4.712 -10.226 N \\nATOM 661 OD1 ASN 84 -1.527 -6.401 -11.341 O \\nATOM 662 N LYS 85 -0.923 -8.982 -11.07 N \\nATOM 663 CA LYS 85 -0.725 -10.063 -12.031 C \\nATOM 664 C LYS 85 0.61 -10.765 -11.803 C \\nATOM 665 CB LYS 85 -0.798 -9.53 -13.463 C \\nATOM 666 O LYS 85 0.754 -11.951 -12.107 O \\nATOM 667 CG LYS 85 -2.151 -8.941 -13.835 C \\nATOM 668 CD LYS 85 -2.144 -8.375 -15.25 C \\nATOM 669 CE LYS 85 -3.47 -7.712 -15.595 C \\nATOM 670 NZ LYS 85 -3.435 -7.068 -16.942 N \\nATOM 671 N GLY 86 1.505 -10.177 -11.266 N \\nATOM 672 CA GLY 86 2.835 -10.749 -11.126 C \\nATOM 673 C GLY 86 3.051 -11.436 -9.79 C \\nATOM 674 O GLY 86 2.105 -11.954 -9.193 O \\nATOM 675 N GLN 87 4.322 -11.438 -9.417 N \\nATOM 676 CA GLN 87 4.738 -12.1 -8.185 C \\nATOM 677 C GLN 87 3.923 -11.605 -6.993 C \\nATOM 678 CB GLN 87 6.229 -11.875 -7.931 C \\nATOM 679 O GLN 87 3.729 -10.399 -6.825 O \\nATOM 680 CG GLN 87 7.136 -12.575 -8.934 C \\nATOM 681 CD GLN 87 8.609 -12.397 -8.618 C \\nATOM 682 NE2 GLN 87 9.428 -13.351 -9.048 N \\nATOM 683 OE1 GLN 87 9.008 -11.409 -7.992 O \\nATOM 684 N ARG 88 3.575 -12.546 -6.122 N \\nATOM 685 CA ARG 88 2.704 -12.225 -4.996 C \\nATOM 686 C ARG 88 3.513 -12.006 -3.722 C \\nATOM 687 CB ARG 88 1.675 -13.337 -4.778 C \\nATOM 688 O ARG 88 2.982 -11.529 -2.717 O \\nATOM 689 CG ARG 88 0.605 -13.406 -5.855 C \\nATOM 690 CD ARG 88 -0.475 -14.424 -5.514 C \\nATOM 691 NE ARG 88 -1.57 -14.393 -6.479 N \\nATOM 692 NH1 ARG 88 -2.981 -15.731 -5.233 N \\nATOM 693 NH2 ARG 88 -3.662 -14.919 -7.266 N \\nATOM 694 CZ ARG 88 -2.735 -15.014 -6.324 C \\nATOM 695 N THR 89 4.736 -12.499 -3.714 N \\nATOM 696 CA THR 89 5.596 -12.317 -2.55 C \\nATOM 697 C THR 89 6.971 -11.805 -2.969 C \\nATOM 698 CB THR 89 5.753 -13.629 -1.761 C \\nATOM 699 O THR 89 7.392 -12.003 -4.11 O \\nATOM 700 CG2 THR 89 4.405 -14.129 -1.251 C \\nATOM 701 OG1 THR 89 6.328 -14.627 -2.613 O \\nATOM 702 N ASP 90 7.612 -11.113 -2.078 N \\nATOM 703 CA ASP 90 8.984 -10.694 -2.349 C \\nATOM 704 C ASP 90 9.986 -11.647 -1.701 C \\nATOM 705 CB ASP 90 9.218 -9.266 -1.851 C \\nATOM 706 O ASP 90 9.602 -12.679 -1.148 O \\nATOM 707 CG ASP 90 9.098 -9.137 -0.343 C \\nATOM 708 OD1 ASP 90 9.172 -10.164 0.365 O \\nATOM 709 OD2 ASP 90 8.924 -7.998 0.141 O \\nATOM 710 N LYS 91 11.206 -11.38 -1.764 N \\nATOM 711 CA LYS 91 12.255 -12.295 -1.323 C \\nATOM 712 C LYS 91 12.242 -12.457 0.194 C \\nATOM 713 CB LYS 91 13.627 -11.803 -1.787 C \\nATOM 714 O LYS 91 12.839 -13.393 0.729 O \\nATOM 715 CG LYS 91 14.029 -10.455 -1.206 C \\nATOM 716 CD LYS 91 15.413 -10.033 -1.682 C \\nATOM 717 CE LYS 91 15.813 -8.68 -1.109 C \\nATOM 718 NZ LYS 91 17.261 -8.391 -1.33 N \\nATOM 719 N TYR 92 11.5 -11.522 0.98 N \\nATOM 720 CA TYR 92 11.429 -11.586 2.435 C \\nATOM 721 C TYR 92 10.169 -12.313 2.888 C \\nATOM 722 CB TYR 92 11.466 -10.178 3.037 C \\nATOM 723 O TYR 92 9.938 -12.48 4.088 O \\nATOM 724 CG TYR 92 12.697 -9.39 2.664 C \\nATOM 725 CD1 TYR 92 13.954 -9.759 3.137 C \\nATOM 726 CD2 TYR 92 12.606 -8.274 1.838 C \\nATOM 727 CE1 TYR 92 15.092 -9.034 2.797 C \\nATOM 728 CE2 TYR 92 13.737 -7.542 1.492 C \\nATOM 729 OH TYR 92 16.097 -7.208 1.635 O \\nATOM 730 CZ TYR 92 14.974 -7.929 1.975 C \\nATOM 731 N GLY 93 9.384 -12.808 1.874 N \\nATOM 732 CA GLY 93 8.174 -13.553 2.184 C \\nATOM 733 C GLY 93 6.974 -12.661 2.442 C \\nATOM 734 O GLY 93 5.926 -13.134 2.887 O \\nATOM 735 N ARG 94 7.126 -11.347 2.225 N \\nATOM 736 CA ARG 94 5.979 -10.459 2.382 C \\nATOM 737 C ARG 94 5.052 -10.542 1.173 C \\nATOM 738 CB ARG 94 6.441 -9.015 2.589 C \\nATOM 739 O ARG 94 5.514 -10.678 0.038 O \\nATOM 740 CG ARG 94 7.382 -8.833 3.768 C \\nATOM 741 CD ARG 94 7.898 -7.403 3.863 C \\nATOM 742 NE ARG 94 8.744 -7.059 2.724 N \\nATOM 743 NH1 ARG 94 9.37 -4.994 3.55 N \\nATOM 744 NH2 ARG 94 10.163 -5.711 1.522 N \\nATOM 745 CZ ARG 94 9.424 -5.922 2.601 C \\nATOM 746 N GLY 95 3.803 -10.583 1.467 N \\nATOM 747 CA GLY 95 2.827 -10.493 0.393 C \\nATOM 748 C GLY 95 2.818 -9.14 -0.293 C \\nATOM 749 O GLY 95 2.861 -8.101 0.369 O \\nATOM 750 N LEU 96 2.871 -9.16 -1.635 N \\nATOM 751 CA LEU 96 2.803 -7.939 -2.431 C \\nATOM 752 C LEU 96 1.385 -7.701 -2.942 C \\nATOM 753 CB LEU 96 3.777 -8.013 -3.61 C \\nATOM 754 O LEU 96 0.892 -8.451 -3.788 O \\nATOM 755 CG LEU 96 5.257 -8.167 -3.257 C \\nATOM 756 CD1 LEU 96 6.088 -8.347 -4.524 C \\nATOM 757 CD2 LEU 96 5.745 -6.964 -2.458 C \\nATOM 758 N ALA 97 0.724 -6.668 -2.335 N \\nATOM 759 CA ALA 97 -0.693 -6.555 -2.671 C \\nATOM 760 C ALA 97 -1.184 -5.12 -2.499 C \\nATOM 761 CB ALA 97 -1.522 -7.505 -1.81 C \\nATOM 762 O ALA 97 -0.524 -4.305 -1.85 O \\nATOM 763 N TYR 98 -2.289 -4.746 -3.227 N \\nATOM 764 CA TYR 98 -3.129 -3.617 -2.845 C \\nATOM 765 C TYR 98 -4.039 -3.983 -1.679 C \\nATOM 766 CB TYR 98 -3.97 -3.145 -4.036 C \\nATOM 767 O TYR 98 -4.649 -5.055 -1.673 O \\nATOM 768 CG TYR 98 -3.16 -2.868 -5.279 C \\nATOM 769 CD1 TYR 98 -2.4 -1.706 -5.395 C \\nATOM 770 CD2 TYR 98 -3.153 -3.766 -6.34 C \\nATOM 771 CE1 TYR 98 -1.653 -1.445 -6.539 C \\nATOM 772 CE2 TYR 98 -2.41 -3.516 -7.49 C \\nATOM 773 OH TYR 98 -0.927 -2.103 -8.715 O \\nATOM 774 CZ TYR 98 -1.665 -2.355 -7.579 C \\nATOM 775 N ILE 99 -4.078 -3.163 -0.654 N \\nATOM 776 CA ILE 99 -4.889 -3.412 0.532 C \\nATOM 777 C ILE 99 -6.101 -2.483 0.533 C \\nATOM 778 CB ILE 99 -4.068 -3.224 1.828 C \\nATOM 779 O ILE 99 -5.968 -1.279 0.299 O \\nATOM 780 CG1 ILE 99 -2.817 -4.109 1.8 C \\nATOM 781 CG2 ILE 99 -4.926 -3.527 3.059 C \\nATOM 782 CD1 ILE 99 -3.114 -5.597 1.674 C \\nATOM 783 N TYR 100 -7.24 -3.016 0.802 N \\nATOM 784 CA TYR 100 -8.475 -2.242 0.863 C \\nATOM 785 C TYR 100 -9.072 -2.278 2.265 C \\nATOM 786 CB TYR 100 -9.493 -2.772 -0.151 C \\nATOM 787 O TYR 100 -9.163 -3.343 2.881 O \\nATOM 788 CG TYR 100 -9.084 -2.561 -1.588 C \\nATOM 789 CD1 TYR 100 -9.597 -1.499 -2.33 C \\nATOM 790 CD2 TYR 100 -8.185 -3.422 -2.208 C \\nATOM 791 CE1 TYR 100 -9.224 -1.302 -3.656 C \\nATOM 792 CE2 TYR 100 -7.805 -3.234 -3.533 C \\nATOM 793 OH TYR 100 -7.956 -1.982 -5.559 O \\nATOM 794 CZ TYR 100 -8.329 -2.173 -4.247 C \\nATOM 795 N ALA 101 -9.369 -1.16 2.759 N \\nATOM 796 CA ALA 101 -10.09 -0.945 4.011 C \\nATOM 797 C ALA 101 -11.476 -0.362 3.752 C \\nATOM 798 CB ALA 101 -9.293 -0.025 4.932 C \\nATOM 799 O ALA 101 -11.603 0.742 3.217 O \\nATOM 800 N ASP 102 -12.548 -1.144 3.987 N \\nATOM 801 CA ASP 102 -13.941 -0.788 3.737 C \\nATOM 802 C ASP 102 -14.132 -0.284 2.308 C \\nATOM 803 CB ASP 102 -14.412 0.272 4.736 C \\nATOM 804 O ASP 102 -14.847 0.694 2.079 O \\nATOM 805 CG ASP 102 -14.548 -0.265 6.15 C \\nATOM 806 OD1 ASP 102 -14.698 -1.493 6.324 O \\nATOM 807 OD2 ASP 102 -14.507 0.549 7.098 O \\nATOM 808 N GLY 103 -13.37 -0.94 1.384 N \\nATOM 809 CA GLY 103 -13.539 -0.656 -0.033 C \\nATOM 810 C GLY 103 -12.624 0.445 -0.533 C \\nATOM 811 O GLY 103 -12.568 0.715 -1.735 O \\nATOM 812 N LYS 104 -11.883 1.101 0.334 N \\nATOM 813 CA LYS 104 -10.913 2.124 -0.048 C \\nATOM 814 C LYS 104 -9.505 1.543 -0.129 C \\nATOM 815 CB LYS 104 -10.943 3.289 0.943 C \\nATOM 816 O LYS 104 -9.04 0.894 0.81 O \\nATOM 817 CG LYS 104 -12.262 4.046 0.969 C \\nATOM 818 CD LYS 104 -12.217 5.215 1.945 C \\nATOM 819 CE LYS 104 -13.571 5.904 2.056 C \\nATOM 820 NZ LYS 104 -13.543 7.022 3.046 N \\nATOM 821 N MET 105 -8.869 1.793 -1.249 N \\nATOM 822 CA MET 105 -7.498 1.339 -1.464 C \\nATOM 823 C MET 105 -6.519 2.144 -0.617 C \\nATOM 824 CB MET 105 -7.121 1.445 -2.942 C \\nATOM 825 O MET 105 -6.36 3.349 -0.82 O \\nATOM 826 CG MET 105 -5.767 0.84 -3.275 C \\nATOM 827 SD MET 105 -5.267 1.149 -5.013 S \\nATOM 828 CE MET 105 -6.405 0.032 -5.878 C \\nATOM 829 N VAL 106 -5.83 1.476 0.314 N \\nATOM 830 CA VAL 106 -4.928 2.122 1.262 C \\nATOM 831 C VAL 106 -3.723 2.697 0.521 C \\nATOM 832 CB VAL 106 -4.46 1.14 2.359 C \\nATOM 833 O VAL 106 -3.278 3.809 0.815 O \\nATOM 834 CG1 VAL 106 -3.451 1.811 3.29 C \\nATOM 835 CG2 VAL 106 -5.656 0.615 3.151 C \\nATOM 836 N ASN 107 -3.198 1.973 -0.487 N \\nATOM 837 CA ASN 107 -2.108 2.449 -1.332 C \\nATOM 838 C ASN 107 -2.394 3.841 -1.888 C \\nATOM 839 CB ASN 107 -1.844 1.465 -2.474 C \\nATOM 840 O ASN 107 -1.568 4.746 -1.764 O \\nATOM 841 CG ASN 107 -1.441 0.09 -1.978 C \\nATOM 842 ND2 ASN 107 -0.28 -0.382 -2.418 N \\nATOM 843 OD1 ASN 107 -2.167 -0.544 -1.208 O \\nATOM 844 N GLU 108 -3.589 3.979 -2.495 N \\nATOM 845 CA GLU 108 -3.974 5.232 -3.137 C \\nATOM 846 C GLU 108 -4.208 6.332 -2.105 C \\nATOM 847 CB GLU 108 -5.23 5.036 -3.99 C \\nATOM 848 O GLU 108 -3.828 7.484 -2.321 O \\nATOM 849 CG GLU 108 -5.645 6.277 -4.768 C \\nATOM 850 CD GLU 108 -7.093 6.238 -5.23 C \\nATOM 851 OE1 GLU 108 -7.778 5.216 -4.997 O \\nATOM 852 OE2 GLU 108 -7.546 7.238 -5.831 O \\nATOM 853 N ALA 109 -4.846 5.975 -1.013 N \\nATOM 854 CA ALA 109 -5.137 6.966 0.02 C \\nATOM 855 C ALA 109 -3.855 7.605 0.544 C \\nATOM 856 CB ALA 109 -5.916 6.326 1.166 C \\nATOM 857 O ALA 109 -3.805 8.817 0.768 O \\nATOM 858 N LEU 110 -2.804 6.831 0.675 N \\nATOM 859 CA LEU 110 -1.504 7.338 1.102 C \\nATOM 860 C LEU 110 -0.935 8.31 0.074 C \\nATOM 861 CB LEU 110 -0.525 6.182 1.324 C \\nATOM 862 O LEU 110 -0.475 9.398 0.43 O \\nATOM 863 CG LEU 110 -0.672 5.412 2.637 C \\nATOM 864 CD1 LEU 110 0.074 4.084 2.559 C \\nATOM 865 CD2 LEU 110 -0.165 6.247 3.808 C \\nATOM 866 N VAL 111 -0.972 7.893 -1.182 N \\nATOM 867 CA VAL 111 -0.413 8.712 -2.252 C \\nATOM 868 C VAL 111 -1.21 10.008 -2.381 C \\nATOM 869 CB VAL 111 -0.404 7.956 -3.6 C \\nATOM 870 O VAL 111 -0.632 11.086 -2.537 O \\nATOM 871 CG1 VAL 111 -0.077 8.906 -4.75 C \\nATOM 872 CG2 VAL 111 0.595 6.801 -3.556 C \\nATOM 873 N ARG 112 -2.542 9.873 -2.267 N \\nATOM 874 CA ARG 112 -3.427 11.02 -2.435 C \\nATOM 875 C ARG 112 -3.237 12.029 -1.308 C \\nATOM 876 CB ARG 112 -4.888 10.568 -2.493 C \\nATOM 877 O ARG 112 -3.426 13.231 -1.505 O \\nATOM 878 CG ARG 112 -5.885 11.714 -2.573 C \\nATOM 879 CD ARG 112 -5.705 12.53 -3.846 C \\nATOM 880 NE ARG 112 -6.609 13.676 -3.883 N \\nATOM 881 NH1 ARG 112 -5.009 15.221 -3.26 N \\nATOM 882 NH2 ARG 112 -7.161 15.895 -3.67 N \\nATOM 883 CZ ARG 112 -6.258 14.928 -3.604 C \\nATOM 884 N GLN 113 -2.806 11.56 -0.144 N \\nATOM 885 CA GLN 113 -2.595 12.436 1.004 C \\nATOM 886 C GLN 113 -1.16 12.954 1.043 C \\nATOM 887 CB GLN 113 -2.925 11.704 2.306 C \\nATOM 888 O GLN 113 -0.797 13.724 1.936 O \\nATOM 889 CG GLN 113 -4.409 11.42 2.492 C \\nATOM 890 CD GLN 113 -5.245 12.684 2.557 C \\nATOM 891 NE2 GLN 113 -6.453 12.625 2.007 N \\nATOM 892 OE1 GLN 113 -4.809 13.706 3.097 O \\nATOM 893 N GLY 114 -0.379 12.6 0.076 N \\nATOM 894 CA GLY 114 1.01 13.032 0.057 C \\nATOM 895 C GLY 114 1.859 12.358 1.118 C \\nATOM 896 O GLY 114 2.865 12.915 1.562 O \\nATOM 897 N LEU 115 1.513 11.237 1.561 N \\nATOM 898 CA LEU 115 2.214 10.5 2.606 C \\nATOM 899 C LEU 115 3.001 9.335 2.016 C \\nATOM 900 CB LEU 115 1.225 9.984 3.654 C \\nATOM 901 O LEU 115 3.636 8.574 2.749 O \\nATOM 902 CG LEU 115 0.589 11.036 4.563 C \\nATOM 903 CD1 LEU 115 -0.526 10.413 5.397 C \\nATOM 904 CD2 LEU 115 1.643 11.674 5.462 C \\nATOM 905 N ALA 116 2.891 9.188 0.734 N \\nATOM 906 CA ALA 116 3.677 8.219 -0.025 C \\nATOM 907 C ALA 116 3.962 8.728 -1.435 C \\nATOM 908 CB ALA 116 2.952 6.876 -0.084 C \\nATOM 909 O ALA 116 3.21 9.545 -1.971 O \\nATOM 910 N LYS 117 5.082 8.187 -1.978 N \\nATOM 911 CA LYS 117 5.385 8.348 -3.397 C \\nATOM 912 C LYS 117 5.128 7.053 -4.164 C \\nATOM 913 CB LYS 117 6.835 8.792 -3.59 C \\nATOM 914 O LYS 117 5.251 5.961 -3.606 O \\nATOM 915 CG LYS 117 7.205 10.049 -2.816 C \\nATOM 916 CD LYS 117 8.687 10.375 -2.954 C \\nATOM 917 CE LYS 117 9.091 11.537 -2.058 C \\nATOM 918 NZ LYS 117 10.559 11.803 -2.122 N \\nATOM 919 N VAL 118 4.595 7.187 -5.386 N \\nATOM 920 CA VAL 118 4.553 6.011 -6.25 C \\nATOM 921 C VAL 118 5.971 5.501 -6.498 C \\nATOM 922 CB VAL 118 3.854 6.318 -7.593 C \\nATOM 923 O VAL 118 6.835 6.251 -6.961 O \\nATOM 924 CG1 VAL 118 3.85 5.084 -8.494 C \\nATOM 925 CG2 VAL 118 2.429 6.811 -7.351 C \\nATOM 926 N ALA 119 6.271 4.368 -6.149 N \\nATOM 927 CA ALA 119 7.597 3.763 -6.237 C \\nATOM 928 C ALA 119 7.499 2.251 -6.417 C \\nATOM 929 CB ALA 119 8.418 4.095 -4.994 C \\nATOM 930 O ALA 119 6.403 1.685 -6.385 O \\nATOM 931 N TYR 120 8.664 1.661 -6.78 N \\nATOM 932 CA TYR 120 8.804 0.21 -6.843 C \\nATOM 933 C TYR 120 7.843 -0.386 -7.864 C \\nATOM 934 CB TYR 120 8.555 -0.414 -5.466 C \\nATOM 935 O TYR 120 7.186 -1.394 -7.593 O \\nATOM 936 CG TYR 120 9.397 0.187 -4.366 C \\nATOM 937 CD1 TYR 120 10.787 0.195 -4.452 C \\nATOM 938 CD2 TYR 120 8.804 0.747 -3.24 C \\nATOM 939 CE1 TYR 120 11.567 0.746 -3.44 C \\nATOM 940 CE2 TYR 120 9.573 1.3 -2.222 C \\nATOM 941 OH TYR 120 11.718 1.842 -1.326 O \\nATOM 942 CZ TYR 120 10.951 1.296 -2.331 C \\nATOM 943 N VAL 121 7.728 0.128 -9.042 N \\nATOM 944 CA VAL 121 6.879 -0.319 -10.141 C \\nATOM 945 C VAL 121 7.563 -1.458 -10.893 C \\nATOM 946 CB VAL 121 6.549 0.838 -11.11 C \\nATOM 947 O VAL 121 8.554 -1.239 -11.595 O \\nATOM 948 CG1 VAL 121 5.596 0.368 -12.207 C \\nATOM 949 CG2 VAL 121 5.95 2.018 -10.347 C \\nATOM 950 N TYR 122 7.156 -2.644 -10.533 N \\nATOM 951 CA TYR 122 7.673 -3.843 -11.184 C \\nATOM 952 C TYR 122 6.574 -4.561 -11.957 C \\nATOM 953 CB TYR 122 8.29 -4.791 -10.151 C \\nATOM 954 O TYR 122 5.672 -5.153 -11.36 O \\nATOM 955 CG TYR 122 9.407 -4.171 -9.348 C \\nATOM 956 CD1 TYR 122 10.601 -3.789 -9.958 C \\nATOM 957 CD2 TYR 122 9.273 -3.965 -7.979 C \\nATOM 958 CE1 TYR 122 11.634 -3.219 -9.221 C \\nATOM 959 CE2 TYR 122 10.299 -3.395 -7.233 C \\nATOM 960 OH TYR 122 12.494 -2.462 -7.129 O \\nATOM 961 CZ TYR 122 11.474 -3.026 -7.862 C \\nATOM 962 N LYS 123 6.647 -4.418 -13.354 N \\nATOM 963 CA LYS 123 5.685 -5.116 -14.202 C \\nATOM 964 C LYS 123 5.807 -6.629 -14.041 C \\nATOM 965 CB LYS 123 5.88 -4.728 -15.668 C \\nATOM 966 O LYS 123 6.911 -7.155 -13.882 O \\nATOM 967 CG LYS 123 5.549 -3.274 -15.973 C \\nATOM 968 CD LYS 123 5.72 -2.96 -17.453 C \\nATOM 969 CE LYS 123 5.387 -1.506 -17.76 C \\nATOM 970 NZ LYS 123 5.589 -1.184 -19.204 N \\nATOM 971 N PRO 124 4.691 -7.193 -14.037 N \\nATOM 972 CA PRO 124 3.356 -6.713 -14.4 C \\nATOM 973 C PRO 124 2.522 -6.314 -13.184 C \\nATOM 974 CB PRO 124 2.734 -7.912 -15.119 C \\nATOM 975 O PRO 124 1.29 -6.334 -13.243 O \\nATOM 976 CG PRO 124 3.265 -9.109 -14.398 C \\nATOM 977 CD PRO 124 4.678 -8.822 -13.975 C \\nATOM 978 N ASN 125 3.178 -6.158 -12.089 N \\nATOM 979 CA ASN 125 2.456 -5.708 -10.903 C \\nATOM 980 C ASN 125 2.278 -4.193 -10.897 C \\nATOM 981 CB ASN 125 3.176 -6.164 -9.632 C \\nATOM 982 O ASN 125 2.732 -3.514 -9.974 O \\nATOM 983 CG ASN 125 2.945 -7.63 -9.324 C \\nATOM 984 ND2 ASN 125 3.753 -8.182 -8.427 N \\nATOM 985 OD1 ASN 125 2.049 -8.263 -9.89 O \\nATOM 986 N ASN 126 1.53 -3.649 -11.89 N \\nATOM 987 CA ASN 126 1.415 -2.199 -12.007 C \\nATOM 988 C ASN 126 0.025 -1.783 -12.478 C \\nATOM 989 CB ASN 126 2.484 -1.651 -12.955 C \\nATOM 990 O ASN 126 -0.154 -0.681 -13.0 O \\nATOM 991 CG ASN 126 2.24 -2.043 -14.399 C \\nATOM 992 ND2 ASN 126 2.508 -1.122 -15.317 N \\nATOM 993 OD1 ASN 126 1.813 -3.164 -14.687 O \\nATOM 994 N THR 127 -0.96 -2.688 -12.302 N \\nATOM 995 CA THR 127 -2.33 -2.49 -12.761 C \\nATOM 996 C THR 127 -2.835 -1.103 -12.374 C \\nATOM 997 CB THR 127 -3.273 -3.562 -12.184 C \\nATOM 998 O THR 127 -3.532 -0.451 -13.154 O \\nATOM 999 CG2 THR 127 -4.722 -3.285 -12.569 C \\nATOM 1000 OG1 THR 127 -2.893 -4.847 -12.691 O \\nATOM 1001 N HIS 128 -2.49 -0.62 -11.168 N \\nATOM 1002 CA HIS 128 -3.06 0.623 -10.661 C \\nATOM 1003 C HIS 128 -2.047 1.761 -10.727 C \\nATOM 1004 CB HIS 128 -3.55 0.44 -9.223 C \\nATOM 1005 O HIS 128 -2.26 2.823 -10.137 O \\nATOM 1006 CG HIS 128 -4.684 -0.527 -9.094 C \\nATOM 1007 CD2 HIS 128 -4.729 -1.78 -8.582 C \\nATOM 1008 ND1 HIS 128 -5.96 -0.24 -9.527 N \\nATOM 1009 CE1 HIS 128 -6.744 -1.278 -9.285 C \\nATOM 1010 NE2 HIS 128 -6.021 -2.225 -8.713 N \\nATOM 1011 N GLU 129 -0.975 1.624 -11.554 N \\nATOM 1012 CA GLU 129 0.098 2.614 -11.564 C \\nATOM 1013 C GLU 129 -0.414 3.979 -12.017 C \\nATOM 1014 CB GLU 129 1.245 2.156 -12.469 C \\nATOM 1015 O GLU 129 -0.143 4.994 -11.372 O \\nATOM 1016 CG GLU 129 2.401 3.143 -12.544 C \\nATOM 1017 CD GLU 129 3.528 2.678 -13.453 C \\nATOM 1018 OE1 GLU 129 3.458 1.542 -13.974 O \\nATOM 1019 OE2 GLU 129 4.488 3.457 -13.646 O \\nATOM 1020 N GLN 130 -1.108 4.017 -13.151 N \\nATOM 1021 CA GLN 130 -1.579 5.289 -13.689 C \\nATOM 1022 C GLN 130 -2.549 5.968 -12.726 C \\nATOM 1023 CB GLN 130 -2.246 5.084 -15.049 C \\nATOM 1024 O GLN 130 -2.506 7.187 -12.55 O \\nATOM 1025 CG GLN 130 -1.265 4.803 -16.18 C \\nATOM 1026 CD GLN 130 -1.944 4.691 -17.532 C \\nATOM 1027 NE2 GLN 130 -1.15 4.503 -18.58 N \\nATOM 1028 OE1 GLN 130 -3.172 4.771 -17.633 O \\nATOM 1029 N HIS 131 -3.438 5.145 -12.086 N \\nATOM 1030 CA HIS 131 -4.371 5.676 -11.1 C \\nATOM 1031 C HIS 131 -3.631 6.291 -9.916 C \\nATOM 1032 CB HIS 131 -5.319 4.578 -10.613 C \\nATOM 1033 O HIS 131 -3.965 7.393 -9.475 O \\nATOM 1034 CG HIS 131 -6.335 5.057 -9.626 C \\nATOM 1035 CD2 HIS 131 -6.488 4.792 -8.308 C \\nATOM 1036 ND1 HIS 131 -7.357 5.917 -9.968 N \\nATOM 1037 CE1 HIS 131 -8.095 6.161 -8.898 C \\nATOM 1038 NE2 HIS 131 -7.589 5.49 -7.877 N \\nATOM 1039 N LEU 132 -2.571 5.629 -9.396 N \\nATOM 1040 CA LEU 132 -1.787 6.136 -8.276 C \\nATOM 1041 C LEU 132 -0.979 7.362 -8.688 C \\nATOM 1042 CB LEU 132 -0.849 5.049 -7.742 C \\nATOM 1043 O LEU 132 -0.819 8.299 -7.903 O \\nATOM 1044 CG LEU 132 -1.398 4.175 -6.613 C \\nATOM 1045 CD1 LEU 132 -2.537 3.301 -7.125 C \\nATOM 1046 CD2 LEU 132 -0.288 3.319 -6.012 C \\nATOM 1047 N ARG 133 -0.449 7.473 -9.971 N \\nATOM 1048 CA ARG 133 0.313 8.628 -10.435 C \\nATOM 1049 C ARG 133 -0.58 9.857 -10.567 C \\nATOM 1050 CB ARG 133 0.988 8.325 -11.774 C \\nATOM 1051 O ARG 133 -0.138 10.982 -10.324 O \\nATOM 1052 CG ARG 133 2.154 7.355 -11.67 C \\nATOM 1053 CD ARG 133 2.954 7.293 -12.964 C \\nATOM 1054 NE ARG 133 3.991 6.267 -12.909 N \\nATOM 1055 NH1 ARG 133 5.362 7.437 -11.464 N \\nATOM 1056 NH2 ARG 133 5.987 5.365 -12.219 N \\nATOM 1057 CZ ARG 133 5.111 6.359 -12.198 C \\nATOM 1058 N LYS 134 -1.82 9.599 -10.961 N \\nATOM 1059 CA LYS 134 -2.764 10.712 -10.987 C \\nATOM 1060 C LYS 134 -3.013 11.254 -9.582 C \\nATOM 1061 CB LYS 134 -4.085 10.281 -11.624 C \\nATOM 1062 O LYS 134 -3.064 12.469 -9.379 O \\nATOM 1063 CG LYS 134 -4.025 10.141 -13.138 C \\nATOM 1064 CD LYS 134 -5.362 9.689 -13.711 C \\nATOM 1065 CE LYS 134 -5.285 9.482 -15.218 C \\nATOM 1066 NZ LYS 134 -6.563 8.939 -15.769 N \\nATOM 1067 N SER 135 -3.184 10.403 -8.593 N \\nATOM 1068 CA SER 135 -3.367 10.808 -7.203 C \\nATOM 1069 C SER 135 -2.131 11.524 -6.669 C \\nATOM 1070 CB SER 135 -3.682 9.595 -6.328 C \\nATOM 1071 O SER 135 -2.246 12.499 -5.923 O \\nATOM 1072 OG SER 135 -4.942 9.042 -6.668 O \\nATOM 1073 N GLU 136 -0.959 11.043 -7.133 N \\nATOM 1074 CA GLU 136 0.283 11.691 -6.723 C \\nATOM 1075 C GLU 136 0.379 13.106 -7.286 C \\nATOM 1076 CB GLU 136 1.493 10.865 -7.168 C \\nATOM 1077 O GLU 136 0.788 14.033 -6.583 O \\nATOM 1078 CG GLU 136 2.821 11.385 -6.638 C \\nATOM 1079 CD GLU 136 4.001 10.496 -7.0 C \\nATOM 1080 OE1 GLU 136 4.498 10.585 -8.146 O \\nATOM 1081 OE2 GLU 136 4.43 9.705 -6.131 O \\nATOM 1082 N ALA 137 0.02 13.225 -8.57 N \\nATOM 1083 CA ALA 137 0.039 14.543 -9.199 C \\nATOM 1084 C ALA 137 -0.881 15.514 -8.465 C \\nATOM 1085 CB ALA 137 -0.365 14.438 -10.667 C \\nATOM 1086 O ALA 137 -0.537 16.683 -8.277 O \\nATOM 1087 N GLN 138 -2.026 15.032 -8.034 N \\nATOM 1088 CA GLN 138 -2.949 15.861 -7.266 C \\nATOM 1089 C GLN 138 -2.348 16.249 -5.917 C \\nATOM 1090 CB GLN 138 -4.278 15.134 -7.058 C \\nATOM 1091 O GLN 138 -2.461 17.4 -5.49 O \\nATOM 1092 CG GLN 138 -5.335 15.974 -6.353 C \\nATOM 1093 CD GLN 138 -5.69 17.234 -7.119 C \\nATOM 1094 NE2 GLN 138 -6.09 18.275 -6.395 N \\nATOM 1095 OE1 GLN 138 -5.606 17.273 -8.35 O \\nATOM 1096 N ALA 139 -1.711 15.354 -5.204 N \\nATOM 1097 CA ALA 139 -1.064 15.644 -3.927 C \\nATOM 1098 C ALA 139 0.058 16.664 -4.1 C \\nATOM 1099 CB ALA 139 -0.522 14.361 -3.302 C \\nATOM 1100 O ALA 139 0.243 17.542 -3.254 O \\nATOM 1101 N LYS 140 0.774 16.583 -5.229 N \\nATOM 1102 CA LYS 140 1.836 17.538 -5.531 C \\nATOM 1103 C LYS 140 1.267 18.931 -5.787 C \\nATOM 1104 CB LYS 140 2.647 17.073 -6.742 C \\nATOM 1105 O LYS 140 1.799 19.925 -5.288 O \\nATOM 1106 CG LYS 140 3.614 15.938 -6.441 C \\nATOM 1107 CD LYS 140 4.37 15.502 -7.689 C \\nATOM 1108 CE LYS 140 5.36 14.385 -7.383 C \\nATOM 1109 NZ LYS 140 6.042 13.896 -8.618 N \\nATOM 1110 N LYS 141 0.225 18.857 -6.59 N \\nATOM 1111 CA LYS 141 -0.428 20.124 -6.904 C \\nATOM 1112 C LYS 141 -0.951 20.8 -5.639 C \\nATOM 1113 CB LYS 141 -1.574 19.907 -7.894 C \\nATOM 1114 O LYS 141 -0.838 22.019 -5.489 O \\nATOM 1115 CG LYS 141 -2.277 21.189 -8.318 C \\nATOM 1116 CD LYS 141 -3.404 20.908 -9.303 C \\nATOM 1117 CE LYS 141 -4.142 22.183 -9.687 C \\nATOM 1118 NZ LYS 141 -5.246 21.914 -10.656 N \\nATOM 1119 N GLU 142 -1.44 20.049 -4.641 N \\nATOM 1120 CA GLU 142 -2.043 20.553 -3.411 C \\nATOM 1121 C GLU 142 -1.0 20.701 -2.306 C \\nATOM 1122 CB GLU 142 -3.173 19.63 -2.947 C \\nATOM 1123 O GLU 142 -1.316 21.158 -1.205 O \\nATOM 1124 CG GLU 142 -4.385 19.632 -3.867 C \\nATOM 1125 CD GLU 142 -5.428 18.593 -3.487 C \\nATOM 1126 OE1 GLU 142 -5.338 18.02 -2.378 O \\nATOM 1127 OE2 GLU 142 -6.342 18.35 -4.306 O \\nATOM 1128 N LYS 143 0.364 20.33 -2.643 N \\nATOM 1129 CA LYS 143 1.492 20.455 -1.724 C \\nATOM 1130 C LYS 143 1.174 19.819 -0.374 C \\nATOM 1131 CB LYS 143 1.871 21.924 -1.535 C \\nATOM 1132 O LYS 143 1.393 20.432 0.673 O \\nATOM 1133 CG LYS 143 2.367 22.603 -2.803 C \\nATOM 1134 CD LYS 143 2.81 24.035 -2.534 C \\nATOM 1135 CE LYS 143 3.31 24.715 -3.801 C \\nATOM 1136 NZ LYS 143 3.766 26.113 -3.538 N \\nATOM 1137 N LEU 144 0.756 18.546 -0.483 N \\nATOM 1138 CA LEU 144 0.394 17.841 0.741 C \\nATOM 1139 C LEU 144 1.593 17.092 1.313 C \\nATOM 1140 CB LEU 144 -0.754 16.863 0.477 C \\nATOM 1141 O LEU 144 2.324 16.427 0.576 O \\nATOM 1142 CG LEU 144 -2.072 17.477 0.0 C \\nATOM 1143 CD1 LEU 144 -3.088 16.381 -0.302 C \\nATOM 1144 CD2 LEU 144 -2.618 18.447 1.042 C \\nATOM 1145 N ASN 145 1.824 17.265 2.547 N \\nATOM 1146 CA ASN 145 2.818 16.568 3.356 C \\nATOM 1147 C ASN 145 4.165 16.488 2.643 C \\nATOM 1148 CB ASN 145 2.326 15.166 3.721 C \\nATOM 1149 O ASN 145 4.874 17.489 2.531 O \\nATOM 1150 CG ASN 145 1.115 15.191 4.633 C \\nATOM 1151 ND2 ASN 145 0.061 14.488 4.238 N \\nATOM 1152 OD1 ASN 145 1.127 15.838 5.684 O \\nATOM 1153 N ILE 146 4.6 15.219 2.206 N \\nATOM 1154 CA ILE 146 5.932 15.062 1.633 C \\nATOM 1155 C ILE 146 6.158 16.12 0.556 C \\nATOM 1156 CB ILE 146 6.131 13.647 1.045 C \\nATOM 1157 O ILE 146 7.292 16.55 0.327 O \\nATOM 1158 CG1 ILE 146 6.087 12.595 2.159 C \\nATOM 1159 CG2 ILE 146 7.448 13.566 0.267 C \\nATOM 1160 CD1 ILE 146 5.945 11.165 1.655 C \\nATOM 1161 N TRP 147 4.967 16.545 0.019 N \\nATOM 1162 CA TRP 147 5.072 17.443 -1.126 C \\nATOM 1163 C TRP 147 4.982 18.9 -0.685 C \\nATOM 1164 CB TRP 147 3.976 17.139 -2.151 C \\nATOM 1165 O TRP 147 4.995 19.81 -1.518 O \\nATOM 1166 CG TRP 147 3.971 15.719 -2.633 C \\nATOM 1167 CD1 TRP 147 3.015 14.772 -2.393 C \\nATOM 1168 CD2 TRP 147 4.972 15.085 -3.434 C \\nATOM 1169 CE2 TRP 147 4.558 13.751 -3.642 C \\nATOM 1170 CE3 TRP 147 6.181 15.515 -3.996 C \\nATOM 1171 NE1 TRP 147 3.362 13.586 -2.998 N \\nATOM 1172 CH2 TRP 147 6.489 13.29 -4.93 C \\nATOM 1173 CZ2 TRP 147 5.311 12.843 -4.391 C \\nATOM 1174 CZ3 TRP 147 6.929 14.611 -4.741 C \\nATOM 1175 N SER 148 4.716 19.133 0.622 N \\nATOM 1176 CA SER 148 4.527 20.488 1.13 C \\nATOM 1177 C SER 148 5.818 21.295 1.045 C \\nATOM 1178 CB SER 148 4.032 20.454 2.576 C \\nATOM 1179 O SER 148 5.784 22.515 0.873 O \\nATOM 1180 OG SER 148 4.998 19.859 3.425 O \\nATOM 1181 N GLU 149 6.982 20.703 1.326 N \\nATOM 1182 CA GLU 149 8.188 21.511 1.471 C \\nATOM 1183 C GLU 149 9.112 21.345 0.269 C \\nATOM 1184 CB GLU 149 8.93 21.144 2.759 C \\nATOM 1185 O GLU 149 9.999 22.171 0.041 O \\nATOM 1186 CG GLU 149 8.159 21.476 4.029 C \\nATOM 1187 CD GLU 149 8.942 21.184 5.299 C \\nATOM 1188 OE1 GLU 149 10.085 20.682 5.206 O \\nATOM 1189 OE2 GLU 149 8.407 21.458 6.397 O \\nATOM 1190 N ASN 150 8.844 20.36 -0.521 N \\nATOM 1191 CA ASN 150 9.818 20.026 -1.555 C \\nATOM 1192 C ASN 150 9.552 20.794 -2.846 C \\nATOM 1193 CB ASN 150 9.82 18.519 -1.824 C \\nATOM 1194 O ASN 150 10.152 20.503 -3.882 O \\nATOM 1195 CG ASN 150 10.669 17.75 -0.831 C \\nATOM 1196 ND2 ASN 150 10.477 16.437 -0.779 N \\nATOM 1197 OD1 ASN 150 11.49 18.33 -0.117 O \\nATOM 1198 N ASP 151 9.238 21.881 -2.722 N \\nATOM 1199 CA ASP 151 9.548 22.805 -3.808 C \\nATOM 1200 C ASP 151 10.716 23.717 -3.437 C \\nATOM 1201 CB ASP 151 8.32 23.644 -4.167 C \\nATOM 1202 O ASP 151 11.143 24.547 -4.243 O \\nATOM 1203 CG ASP 151 7.512 23.053 -5.309 C \\nATOM 1204 OD1 ASP 151 7.995 22.113 -5.976 O \\nATOM 1205 OD2 ASP 151 6.382 23.534 -5.545 O \\nATOM 1206 N ALA 152 11.282 23.422 -2.288 N \\nATOM 1207 CA ALA 152 12.305 24.458 -2.174 C \\nATOM 1208 C ALA 152 13.618 24.004 -2.804 C \\nATOM 1209 CB ALA 152 12.522 24.833 -0.709 C \\nATOM 1210 O ALA 152 14.409 24.829 -3.267 O \\nATOM 1211 N ASP 153 13.688 22.711 -3.195 N \\nATOM 1212 CA ASP 153 14.964 22.43 -3.846 C \\nATOM 1213 C ASP 153 14.753 21.907 -5.265 C \\nATOM 1214 CB ASP 153 15.774 21.422 -3.029 C \\nATOM 1215 O ASP 153 15.685 21.891 -6.072 O \\nATOM 1216 CG ASP 153 16.734 22.082 -2.055 C \\nATOM 1217 OD1 ASP 153 16.975 23.303 -2.169 O \\nATOM 1218 OD2 ASP 153 17.256 21.374 -1.166 O \\nATOM 1219 N SER 154 13.733 22.082 -5.872 N \\nATOM 1220 CA SER 154 13.634 21.931 -7.32 C \\nATOM 1221 C SER 154 13.038 23.177 -7.967 C \\nATOM 1222 CB SER 154 12.788 20.708 -7.676 C \\nATOM 1223 O SER 154 12.871 23.23 -9.187 O \\nATOM 1224 OG SER 154 11.473 20.841 -7.167 O \\nATOM 1225 N GLY 155 13.298 24.301 -7.324 N \\nATOM 1226 CA GLY 155 13.124 25.582 -7.989 C \\nATOM 1227 C GLY 155 14.424 26.163 -8.513 C \\nATOM 1228 O GLY 155 15.407 26.262 -7.777 O \\nATOM 1229 N GLN 156 15.042 25.47 -9.343 N \\nATOM 1230 CA GLN 156 15.883 26.082 -10.366 C \\nATOM 1231 C GLN 156 17.144 25.257 -10.608 C \\nATOM 1232 CB GLN 156 16.259 27.511 -9.969 C \\nATOM 1233 O 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CD2 TYR 6 -2.956 -10.676 -31.014 C \\nATOM 46 CE1 TYR 6 -1.284 -9.571 -29.101 C \\nATOM 47 CE2 TYR 6 -1.708 -10.187 -31.383 C \\nATOM 48 OH TYR 6 0.357 -9.152 -30.781 O \\nATOM 49 CZ TYR 6 -0.88 -9.638 -30.421 C \\nATOM 50 N SER 7 -5.87 -14.026 -27.065 N \\nATOM 51 CA SER 7 -6.528 -14.108 -25.765 C \\nATOM 52 C SER 7 -6.769 -12.721 -25.179 C \\nATOM 53 CB SER 7 -5.692 -14.943 -24.794 C \\nATOM 54 O SER 7 -5.85 -11.903 -25.108 O \\nATOM 55 OG SER 7 -6.218 -16.254 -24.677 O \\nATOM 56 N ALA 8 -7.749 -11.984 -25.661 N \\nATOM 57 CA ALA 8 -8.177 -11.04 -24.632 C \\nATOM 58 C ALA 8 -7.497 -11.337 -23.298 C \\nATOM 59 CB ALA 8 -9.694 -11.079 -24.472 C \\nATOM 60 O ALA 8 -7.542 -12.468 -22.809 O \\nATOM 61 N THR 9 -6.221 -11.231 -23.18 N \\nATOM 62 CA THR 9 -5.768 -11.161 -21.795 C \\nATOM 63 C THR 9 -6.953 -11.016 -20.845 C \\nATOM 64 CB THR 9 -4.792 -9.988 -21.586 C \\nATOM 65 O THR 9 -7.822 -10.166 -21.053 O \\nATOM 66 CG2 THR 9 -3.375 -10.491 -21.328 C \\nATOM 67 OG1 THR 9 -4.788 -9.162 -22.756 O \\nATOM 68 N SER 10 -7.955 -11.998 -20.864 N \\nATOM 69 CA SER 10 -8.839 -11.964 -19.704 C \\nATOM 70 C SER 10 -8.3 -11.03 -18.626 C \\nATOM 71 CB SER 10 -9.022 -13.369 -19.128 C \\nATOM 72 O SER 10 -7.13 -11.116 -18.25 O \\nATOM 73 OG SER 10 -8.382 -13.484 -17.869 O \\nATOM 74 N THR 11 -8.182 -9.837 -19.101 N \\nATOM 75 CA THR 11 -8.053 -8.922 -17.972 C \\nATOM 76 C THR 11 -8.694 -9.515 -16.721 C \\nATOM 77 CB THR 11 -8.694 -7.557 -18.284 C \\nATOM 78 O THR 11 -9.918 -9.489 -16.572 O \\nATOM 79 CG2 THR 11 -7.645 -6.547 -18.734 C \\nATOM 80 OG1 THR 11 -9.665 -7.718 -19.325 O \\nATOM 81 N LYS 12 -8.431 -10.789 -16.527 N \\nATOM 82 CA LYS 12 -8.94 -11.209 -15.225 C \\nATOM 83 C LYS 12 -8.913 -10.056 -14.225 C \\nATOM 84 CB LYS 12 -8.129 -12.389 -14.686 C \\nATOM 85 O LYS 12 -7.873 -9.425 -14.026 O \\nATOM 86 CG LYS 12 -8.93 -13.674 -14.539 C \\nATOM 87 CD LYS 12 -8.077 -14.802 -13.972 C \\nATOM 88 CE LYS 12 -8.866 -16.1 -13.862 C \\nATOM 89 NZ LYS 12 -8.034 -17.209 -13.307 N \\nATOM 90 N LYS 13 -9.965 -9.327 -14.238 N \\nATOM 91 CA LYS 13 -10.154 -8.319 -13.199 C \\nATOM 92 C LYS 13 -9.546 -8.773 -11.875 C \\nATOM 93 CB LYS 13 -11.64 -8.009 -13.014 C \\nATOM 94 O LYS 13 -9.659 -9.943 -11.503 O \\nATOM 95 CG LYS 13 -12.205 -7.045 -14.047 C \\nATOM 96 CD LYS 13 -13.635 -6.642 -13.712 C \\nATOM 97 CE LYS 13 -14.222 -5.723 -14.774 C \\nATOM 98 NZ LYS 13 -15.615 -5.304 -14.438 N \\nATOM 99 N LEU 14 -8.601 -8.05 -11.465 N \\nATOM 100 CA LEU 14 -8.04 -8.408 -10.167 C \\nATOM 101 C LEU 14 -9.145 -8.626 -9.138 C \\nATOM 102 CB LEU 14 -7.081 -7.319 -9.679 C \\nATOM 103 O LEU 14 -10.182 -7.961 -9.185 O \\nATOM 104 CG LEU 14 -5.915 -6.977 -10.608 C \\nATOM 105 CD1 LEU 14 -5.039 -5.896 -9.983 C \\nATOM 106 CD2 LEU 14 -5.094 -8.224 -10.917 C \\nATOM 107 N HIS 15 -9.059 -9.65 -8.436 N \\nATOM 108 CA HIS 15 -10.065 -9.963 -7.427 C \\nATOM 109 C HIS 15 -9.541 -9.684 -6.022 C \\nATOM 110 CB HIS 15 -10.502 -11.425 -7.543 C \\nATOM 111 O HIS 15 -8.346 -9.834 -5.759 O \\nATOM 112 CG HIS 15 -9.418 -12.403 -7.222 C \\nATOM 113 CD2 HIS 15 -9.151 -13.095 -6.09 C \\nATOM 114 ND1 HIS 15 -8.446 -12.762 -8.132 N \\nATOM 115 CE1 HIS 15 -7.627 -13.636 -7.57 C \\nATOM 116 NE2 HIS 15 -8.033 -13.855 -6.332 N \\nATOM 117 N LYS 16 -10.479 -9.228 -5.171 N \\nATOM 118 CA LYS 16 -10.174 -8.976 -3.766 C \\nATOM 119 C LYS 16 -10.523 -10.185 -2.902 C \\nATOM 120 CB LYS 16 -10.926 -7.741 -3.267 C \\nATOM 121 O LYS 16 -11.534 -10.85 -3.136 O \\nATOM 122 CG LYS 16 -10.579 -6.461 -4.014 C \\nATOM 123 CD LYS 16 -11.443 -5.294 -3.553 C \\nATOM 124 CE LYS 16 -11.253 -4.072 -4.443 C \\nATOM 125 NZ LYS 16 -12.192 -2.97 -4.077 N \\nATOM 126 N GLU 17 -9.652 -10.498 -2.026 N \\nATOM 127 CA GLU 17 -9.834 -11.574 -1.056 C \\nATOM 128 C GLU 17 -9.886 -11.03 0.369 C \\nATOM 129 CB GLU 17 -8.712 -12.608 -1.183 C \\nATOM 130 O GLU 17 -9.125 -10.128 0.723 O \\nATOM 131 CG GLU 17 -8.619 -13.248 -2.56 C \\nATOM 132 CD GLU 17 -7.423 -14.174 -2.712 C \\nATOM 133 OE1 GLU 17 -7.212 -15.042 -1.835 O \\nATOM 134 OE2 GLU 17 -6.69 -14.03 -3.716 O \\nATOM 135 N PRO 18 -10.79 -11.583 1.172 N \\nATOM 136 CA PRO 18 -10.915 -11.073 2.539 C \\nATOM 137 C PRO 18 -9.702 -11.406 3.406 C \\nATOM 138 CB PRO 18 -12.17 -11.774 3.064 C \\nATOM 139 O PRO 18 -9.066 -12.445 3.211 O \\nATOM 140 CG PRO 18 -12.251 -13.047 2.285 C \\nATOM 141 CD PRO 18 -11.725 -12.794 0.902 C \\nATOM 142 N ALA 19 -9.403 -10.613 4.364 N \\nATOM 143 CA ALA 19 -8.381 -10.793 5.392 C \\nATOM 144 C ALA 19 -8.773 -10.081 6.684 C \\nATOM 145 CB ALA 19 -7.031 -10.283 4.896 C \\nATOM 146 O ALA 19 -9.682 -9.248 6.69 O \\nATOM 147 N THR 20 -8.094 -10.412 7.715 N \\nATOM 148 CA THR 20 -8.323 -9.777 9.009 C \\nATOM 149 C THR 20 -7.046 -9.116 9.52 C \\nATOM 150 CB THR 20 -8.829 -10.795 10.048 C \\nATOM 151 O THR 20 -5.966 -9.705 9.453 O \\nATOM 152 CG2 THR 20 -9.156 -10.112 11.372 C \\nATOM 153 OG1 THR 20 -10.01 -11.433 9.548 O \\nATOM 154 N LEU 21 -7.172 -7.959 10.066 N \\nATOM 155 CA LEU 21 -6.028 -7.188 10.539 C \\nATOM 156 C LEU 21 -5.447 -7.8 11.809 C \\nATOM 157 CB LEU 21 -6.431 -5.734 10.797 C \\nATOM 158 O LEU 21 -6.185 -8.113 12.746 O \\nATOM 159 CG LEU 21 -5.323 -4.8 11.285 C \\nATOM 160 CD1 LEU 21 -4.306 -4.557 10.175 C \\nATOM 161 CD2 LEU 21 -5.912 -3.481 11.775 C \\nATOM 162 N ILE 22 -4.13 -7.981 11.846 N \\nATOM 163 CA ILE 22 -3.396 -8.281 13.07 C \\nATOM 164 C ILE 22 -2.766 -7.003 13.62 C \\nATOM 165 CB ILE 22 -2.31 -9.353 12.829 C \\nATOM 166 O ILE 22 -2.976 -6.651 14.783 O \\nATOM 167 CG1 ILE 22 -2.954 -10.683 12.421 C \\nATOM 168 CG2 ILE 22 -1.437 -9.527 14.076 C \\nATOM 169 CD1 ILE 22 -1.954 -11.752 12.003 C \\nATOM 170 N LYS 23 -2.084 -6.279 12.709 N \\nATOM 171 CA LYS 23 -1.507 -5.002 13.12 C \\nATOM 172 C LYS 23 -0.978 -4.226 11.918 C \\nATOM 173 CB LYS 23 -0.386 -5.222 14.137 C \\nATOM 174 O LYS 23 -0.593 -4.82 10.909 O \\nATOM 175 CG LYS 23 0.816 -5.972 13.58 C \\nATOM 176 CD LYS 23 1.93 -6.086 14.612 C \\nATOM 177 CE LYS 23 3.137 -6.828 14.054 C \\nATOM 178 NZ LYS 23 4.259 -6.882 15.038 N \\nATOM 179 N ALA 24 -1.076 -2.931 12.026 N \\nATOM 180 CA ALA 24 -0.335 -2.042 11.135 C \\nATOM 181 C ALA 24 1.111 -1.883 11.598 C \\nATOM 182 CB ALA 24 -1.018 -0.679 11.054 C \\nATOM 183 O ALA 24 1.366 -1.599 12.771 O \\nATOM 184 N ILE 25 2.135 -2.099 10.729 N \\nATOM 185 CA ILE 25 3.547 -2.101 11.096 C \\nATOM 186 C ILE 25 4.148 -0.72 10.843 C \\nATOM 187 CB ILE 25 4.332 -3.178 10.314 C \\nATOM 188 O ILE 25 4.834 -0.167 11.707 O \\nATOM 189 CG1 ILE 25 3.842 -4.58 10.697 C \\nATOM 190 CG2 ILE 25 5.837 -3.038 10.564 C \\nATOM 191 CD1 ILE 25 4.416 -5.694 9.833 C \\nATOM 192 N ASP 26 3.901 -0.156 9.705 N \\nATOM 193 CA ASP 26 4.295 1.2 9.337 C \\nATOM 194 C ASP 26 3.434 1.731 8.193 C \\nATOM 195 CB ASP 26 5.774 1.242 8.945 C \\nATOM 196 O ASP 26 2.314 1.262 7.983 O \\nATOM 197 CG ASP 26 6.112 0.299 7.803 C \\nATOM 198 OD1 ASP 26 5.23 0.018 6.964 O \\nATOM 199 OD2 ASP 26 7.27 -0.168 7.744 O \\nATOM 200 N GLY 27 3.989 2.695 7.51 N \\nATOM 201 CA GLY 27 3.135 3.365 6.542 C \\nATOM 202 C GLY 27 2.745 2.477 5.375 C \\nATOM 203 O GLY 27 1.651 2.612 4.824 O \\nATOM 204 N ASP 28 3.617 1.507 5.021 N \\nATOM 205 CA ASP 28 3.31 0.735 3.821 C \\nATOM 206 C ASP 28 3.408 -0.764 4.092 C \\nATOM 207 CB ASP 28 4.249 1.125 2.677 C \\nATOM 208 O ASP 28 3.493 -1.565 3.159 O \\nATOM 209 CG ASP 28 5.714 1.096 3.077 C \\nATOM 210 OD1 ASP 28 6.039 0.579 4.167 O \\nATOM 211 OD2 ASP 28 6.551 1.598 2.295 O \\nATOM 212 N THR 29 3.346 -1.126 5.359 N \\nATOM 213 CA THR 29 3.429 -2.534 5.732 C \\nATOM 214 C THR 29 2.378 -2.877 6.783 C \\nATOM 215 CB THR 29 4.828 -2.889 6.266 C \\nATOM 216 O THR 29 2.24 -2.17 7.784 O \\nATOM 217 CG2 THR 29 4.956 -4.387 6.521 C \\nATOM 218 OG1 THR 29 5.815 -2.494 5.305 O \\nATOM 219 N VAL 30 1.627 -3.937 6.558 N \\nATOM 220 CA VAL 30 0.62 -4.41 7.502 C \\nATOM 221 C VAL 30 0.728 -5.925 7.657 C \\nATOM 222 CB VAL 30 -0.807 -4.02 7.052 C \\nATOM 223 O VAL 30 1.176 -6.619 6.741 O \\nATOM 224 CG1 VAL 30 -0.959 -2.501 6.996 C \\nATOM 225 CG2 VAL 30 -1.127 -4.644 5.695 C \\nATOM 226 N LYS 31 0.373 -6.369 8.782 N \\nATOM 227 CA LYS 31 0.237 -7.8 9.035 C \\nATOM 228 C LYS 31 -1.232 -8.209 9.103 C \\nATOM 229 CB LYS 31 0.949 -8.187 10.332 C \\nATOM 230 O LYS 31 -2.015 -7.608 9.841 O \\nATOM 231 CG LYS 31 1.134 -9.686 10.514 C \\nATOM 232 CD LYS 31 2.045 -9.998 11.694 C \\nATOM 233 CE LYS 31 2.39 -11.479 11.759 C \\nATOM 234 NZ LYS 31 3.37 -11.773 12.847 N \\nATOM 235 N LEU 32 -1.668 -9.228 8.403 N \\nATOM 236 CA LEU 32 -3.05 -9.686 8.308 C \\nATOM 237 C LEU 32 -3.138 -11.194 8.515 C \\nATOM 238 CB LEU 32 -3.648 -9.309 6.95 C \\nATOM 239 O LEU 32 -2.184 -11.921 8.231 O \\nATOM 240 CG LEU 32 -3.524 -7.842 6.538 C \\nATOM 241 CD1 LEU 32 -4.056 -7.642 5.123 C \\nATOM 242 CD2 LEU 32 -4.263 -6.945 7.524 C \\nATOM 243 N MET 33 -4.203 -11.672 9.018 N \\nATOM 244 CA MET 33 -4.6 -13.068 8.86 C \\nATOM 245 C MET 33 -5.196 -13.312 7.477 C \\nATOM 246 CB MET 33 -5.606 -13.468 9.941 C \\nATOM 247 O MET 33 -6.284 -12.821 7.17 O \\nATOM 248 CG MET 33 -5.86 -14.964 10.019 C \\nATOM 249 SD MET 33 -4.346 -15.914 10.432 S \\nATOM 250 CE MET 33 -4.09 -15.378 12.147 C \\nATOM 251 N TYR 34 -4.555 -13.897 6.657 N \\nATOM 252 CA TYR 34 -4.929 -14.202 5.281 C \\nATOM 253 C TYR 34 -4.988 -15.707 5.052 C \\nATOM 254 CB TYR 34 -3.941 -13.563 4.301 C \\nATOM 255 O TYR 34 -3.998 -16.412 5.26 O \\nATOM 256 CG TYR 34 -4.244 -13.861 2.852 C \\nATOM 257 CD1 TYR 34 -5.408 -13.387 2.253 C \\nATOM 258 CD2 TYR 34 -3.368 -14.617 2.081 C \\nATOM 259 CE1 TYR 34 -5.693 -13.661 0.919 C \\nATOM 260 CE2 TYR 34 -3.642 -14.897 0.747 C \\nATOM 261 OH TYR 34 -5.082 -14.688 -1.146 O \\nATOM 262 CZ TYR 34 -4.805 -14.415 0.175 C \\nATOM 263 N LYS 35 -6.077 -16.108 4.75 N \\nATOM 264 CA LYS 35 -6.333 -17.532 4.552 C \\nATOM 265 C LYS 35 -5.889 -18.343 5.766 C \\nATOM 266 CB LYS 35 -5.621 -18.036 3.296 C \\nATOM 267 O LYS 35 -5.285 -19.408 5.62 O \\nATOM 268 CG LYS 35 -6.18 -17.47 1.999 C \\nATOM 269 CD LYS 35 -5.51 -18.095 0.781 C \\nATOM 270 CE LYS 35 -6.17 -17.643 -0.514 C \\nATOM 271 NZ LYS 35 -5.516 -18.253 -1.711 N \\nATOM 272 N GLY 36 -6.237 -17.828 6.862 N \\nATOM 273 CA GLY 36 -6.046 -18.557 8.105 C \\nATOM 274 C GLY 36 -4.619 -18.501 8.617 C \\nATOM 275 O GLY 36 -4.285 -19.145 9.613 O \\nATOM 276 N GLN 37 -3.733 -17.679 7.971 N \\nATOM 277 CA GLN 37 -2.334 -17.578 8.375 C \\nATOM 278 C GLN 37 -1.898 -16.12 8.488 C \\nATOM 279 CB GLN 37 -1.434 -18.32 7.385 C \\nATOM 280 O GLN 37 -2.299 -15.282 7.677 O \\nATOM 281 CG GLN 37 -1.759 -19.802 7.251 C \\nATOM 282 CD GLN 37 -1.44 -20.589 8.508 C \\nATOM 283 NE2 GLN 37 -2.192 -21.658 8.745 N \\nATOM 284 OE1 GLN 37 -0.524 -20.239 9.259 O \\nATOM 285 N PRO 38 -1.171 -15.863 9.586 N \\nATOM 286 CA PRO 38 -0.589 -14.52 9.635 C \\nATOM 287 C PRO 38 0.394 -14.26 8.496 C \\nATOM 288 CB PRO 38 0.124 -14.494 10.989 C \\nATOM 289 O PRO 38 1.255 -15.098 8.216 O \\nATOM 290 CG PRO 38 0.42 -15.927 11.293 C \\nATOM 291 CD PRO 38 -0.589 -16.783 10.583 C \\nATOM 292 N MET 39 0.237 -13.206 7.828 N \\nATOM 293 CA MET 39 1.128 -12.795 6.747 C \\nATOM 294 C MET 39 1.368 -11.289 6.782 C \\nATOM 295 CB MET 39 0.55 -13.2 5.39 C \\nATOM 296 O MET 39 0.445 -10.515 7.041 O \\nATOM 297 CG MET 39 1.45 -12.86 4.213 C \\nATOM 298 SD MET 39 0.81 -13.518 2.625 S \\nATOM 299 CE MET 39 1.513 -15.191 2.665 C \\nATOM 300 N THR 40 2.631 -10.915 6.56 N \\nATOM 301 CA THR 40 2.971 -9.505 6.405 C \\nATOM 302 C THR 40 2.823 -9.069 4.95 C \\nATOM 303 CB THR 40 4.406 -9.22 6.886 C \\nATOM 304 O THR 40 3.269 -9.769 4.039 O \\nATOM 305 CG2 THR 40 4.77 -7.752 6.692 C \\nATOM 306 OG1 THR 40 4.511 -9.547 8.277 O \\nATOM 307 N PHE 41 2.193 -7.925 4.708 N \\nATOM 308 CA PHE 41 1.991 -7.405 3.361 C \\nATOM 309 C PHE 41 2.726 -6.083 3.175 C \\nATOM 310 CB PHE 41 0.497 -7.219 3.074 C \\nATOM 311 O PHE 41 2.692 -5.219 4.053 O \\nATOM 312 CG PHE 41 -0.26 -8.512 2.935 C \\nATOM 313 CD1 PHE 41 -0.446 -9.094 1.687 C \\nATOM 314 CD2 PHE 41 -0.785 -9.147 4.053 C \\nATOM 315 CE1 PHE 41 -1.146 -10.291 1.556 C \\nATOM 316 CE2 PHE 41 -1.486 -10.343 3.93 C \\nATOM 317 CZ PHE 41 -1.666 -10.913 2.68 C \\nATOM 318 N ARG 42 3.407 -6.043 2.044 N \\nATOM 319 CA ARG 42 3.968 -4.815 1.49 C \\nATOM 320 C ARG 42 3.035 -4.207 0.449 C \\nATOM 321 CB ARG 42 5.342 -5.082 0.871 C \\nATOM 322 O ARG 42 2.668 -4.869 -0.524 O \\nATOM 323 CG ARG 42 5.968 -3.864 0.212 C \\nATOM 324 CD ARG 42 6.492 -2.873 1.242 C \\nATOM 325 NE ARG 42 7.317 -1.838 0.625 N \\nATOM 326 NH1 ARG 42 6.255 -0.075 1.674 N \\nATOM 327 NH2 ARG 42 7.99 0.322 0.228 N \\nATOM 328 CZ ARG 42 7.185 -0.533 0.844 C \\nATOM 329 N LEU 43 2.6 -2.916 0.721 N \\nATOM 330 CA LEU 43 1.704 -2.247 -0.216 C \\nATOM 331 C LEU 43 2.406 -1.982 -1.544 C \\nATOM 332 CB LEU 43 1.194 -0.931 0.376 C \\nATOM 333 O LEU 43 3.499 -1.411 -1.571 O \\nATOM 334 CG LEU 43 -0.008 -1.031 1.317 C \\nATOM 335 CD1 LEU 43 0.368 -1.806 2.576 C \\nATOM 336 CD2 LEU 43 -0.527 0.358 1.672 C \\nATOM 337 N LEU 44 1.745 -2.421 -2.594 N \\nATOM 338 CA LEU 44 2.328 -2.316 -3.927 C \\nATOM 339 C LEU 44 2.404 -0.859 -4.373 C \\nATOM 340 CB LEU 44 1.511 -3.128 -4.935 C \\nATOM 341 O LEU 44 1.492 -0.074 -4.103 O \\nATOM 342 CG LEU 44 1.783 -4.633 -4.972 C \\nATOM 343 CD1 LEU 44 0.768 -5.333 -5.869 C \\nATOM 344 CD2 LEU 44 3.205 -4.908 -5.448 C \\nATOM 345 N LEU 45 3.425 -0.413 -4.991 N \\nATOM 346 CA LEU 45 3.584 0.769 -5.83 C \\nATOM 347 C LEU 45 3.732 2.025 -4.977 C \\nATOM 348 CB LEU 45 2.39 0.919 -6.777 C \\nATOM 349 O LEU 45 3.691 3.142 -5.498 O \\nATOM 350 CG LEU 45 2.139 -0.242 -7.74 C \\nATOM 351 CD1 LEU 45 0.937 0.058 -8.63 C \\nATOM 352 CD2 LEU 45 3.38 -0.517 -8.583 C \\nATOM 353 N VAL 46 4.008 1.784 -3.637 N \\nATOM 354 CA VAL 46 4.135 2.973 -2.801 C \\nATOM 355 C VAL 46 5.384 2.861 -1.93 C \\nATOM 356 CB VAL 46 2.885 3.181 -1.917 C \\nATOM 357 O VAL 46 5.804 1.758 -1.574 O \\nATOM 358 CG1 VAL 46 1.641 3.383 -2.78 C \\nATOM 359 CG2 VAL 46 2.697 1.996 -0.972 C \\nATOM 360 N ASP 47 5.992 3.952 -1.696 N \\nATOM 361 CA ASP 47 7.075 4.134 -0.735 C \\nATOM 362 C ASP 47 6.757 5.263 0.243 C \\nATOM 363 CB ASP 47 8.392 4.421 -1.458 C \\nATOM 364 O ASP 47 6.532 6.403 -0.168 O \\nATOM 365 CG ASP 47 9.607 4.278 -0.558 C \\nATOM 366 OD1 ASP 47 9.502 3.637 0.511 O \\nATOM 367 OD2 ASP 47 10.677 4.812 -0.919 O \\nATOM 368 N THR 48 6.624 4.937 1.534 N \\nATOM 369 CA THR 48 6.378 5.918 2.585 C \\nATOM 370 C THR 48 7.677 6.283 3.298 C \\nATOM 371 CB THR 48 5.356 5.394 3.611 C \\nATOM 372 O THR 48 8.611 5.48 3.348 O \\nATOM 373 CG2 THR 48 4.002 5.138 2.956 C \\nATOM 374 OG1 THR 48 5.84 4.169 4.176 O \\nATOM 375 N PRO 49 7.66 7.525 3.852 N \\nATOM 376 CA PRO 49 8.818 7.822 4.697 C \\nATOM 377 C PRO 49 8.952 6.859 5.875 C \\nATOM 378 CB PRO 49 8.542 9.246 5.185 C \\nATOM 379 O PRO 49 7.944 6.398 6.417 O \\nATOM 380 CG PRO 49 7.536 9.791 4.225 C \\nATOM 381 CD PRO 49 6.662 8.662 3.757 C \\nATOM 382 N GLU 50 10.125 6.582 6.285 N \\nATOM 383 CA GLU 50 10.44 5.565 7.283 C \\nATOM 384 C GLU 50 10.07 6.035 8.686 C \\nATOM 385 CB GLU 50 11.925 5.197 7.226 C \\nATOM 386 O GLU 50 10.316 7.188 9.046 O \\nATOM 387 CG GLU 50 12.363 4.608 5.893 C \\nATOM 388 CD GLU 50 11.798 3.22 5.636 C \\nATOM 389 OE1 GLU 50 11.2 2.627 6.562 O \\nATOM 390 OE2 GLU 50 11.955 2.722 4.499 O \\nATOM 391 N THR 51 9.433 5.189 9.409 N \\nATOM 392 CA THR 51 9.186 5.453 10.822 C \\nATOM 393 C THR 51 10.405 5.082 11.663 C \\nATOM 394 CB THR 51 7.955 4.679 11.329 C \\nATOM 395 O THR 51 10.612 5.638 12.743 O \\nATOM 396 CG2 THR 51 6.669 5.236 10.726 C \\nATOM 397 OG1 THR 51 8.082 3.299 10.964 O \\nATOM 398 N LYS 52 11.006 4.102 11.265 N \\nATOM 399 CA LYS 52 12.231 3.611 11.889 C \\nATOM 400 C LYS 52 13.209 3.085 10.842 C \\nATOM 401 CB LYS 52 11.913 2.515 12.907 C \\nATOM 402 O LYS 52 12.848 2.246 10.014 O \\nATOM 403 CG LYS 52 13.098 2.111 13.772 C \\nATOM 404 CD LYS 52 12.708 1.053 14.795 C \\nATOM 405 CE LYS 52 13.909 0.592 15.61 C \\nATOM 406 NZ LYS 52 13.537 -0.465 16.597 N \\nATOM 407 N HIS 53 14.353 3.69 10.805 N \\nATOM 408 CA HIS 53 15.4 3.165 9.936 C \\nATOM 409 C HIS 53 16.754 3.174 10.637 C \\nATOM 410 CB HIS 53 15.475 3.974 8.639 C \\nATOM 411 O HIS 53 17.114 4.157 11.288 O \\nATOM 412 CG HIS 53 16.242 3.293 7.551 C \\nATOM 413 CD2 HIS 53 15.821 2.614 6.458 C \\nATOM 414 ND1 HIS 53 17.619 3.263 7.517 N \\nATOM 415 CE1 HIS 53 18.013 2.593 6.447 C \\nATOM 416 NE2 HIS 53 16.941 2.188 5.787 N \\nATOM 417 N PRO 54 17.374 2.004 10.662 N \\nATOM 418 CA PRO 54 18.639 1.888 11.391 C \\nATOM 419 C PRO 54 19.625 3.0 11.041 C \\nATOM 420 CB PRO 54 19.176 0.524 10.951 C \\nATOM 421 O PRO 54 20.378 3.458 11.905 O \\nATOM 422 CG PRO 54 18.372 0.168 9.742 C \\nATOM 423 CD PRO 54 17.061 0.898 9.81 C \\nATOM 424 N LYS 55 19.542 3.523 9.74 N \\nATOM 425 CA LYS 55 20.519 4.508 9.283 C \\nATOM 426 C LYS 55 19.898 5.899 9.198 C \\nATOM 427 CB LYS 55 21.091 4.105 7.923 C \\nATOM 428 O LYS 55 20.542 6.894 9.54 O \\nATOM 429 CG LYS 55 21.961 2.858 7.962 C \\nATOM 430 CD LYS 55 22.559 2.55 6.595 C \\nATOM 431 CE LYS 55 23.369 1.261 6.615 C \\nATOM 432 NZ LYS 55 23.907 0.924 5.263 N \\nATOM 433 N LYS 56 18.7 6.065 8.872 N \\nATOM 434 CA LYS 56 18.084 7.351 8.557 C \\nATOM 435 C LYS 56 17.279 7.88 9.74 C \\nATOM 436 CB LYS 56 17.186 7.229 7.325 C \\nATOM 437 O LYS 56 16.952 9.067 9.795 O \\nATOM 438 CG LYS 56 17.941 6.942 6.035 C \\nATOM 439 CD LYS 56 17.006 6.922 4.833 C \\nATOM 440 CE LYS 56 17.755 6.605 3.545 C \\nATOM 441 NZ LYS 56 16.832 6.519 2.374 N \\nATOM 442 N GLY 57 17.064 7.006 10.756 N \\nATOM 443 CA GLY 57 16.184 7.402 11.844 C \\nATOM 444 C GLY 57 14.742 7.584 11.41 C \\nATOM 445 O GLY 57 14.246 6.843 10.558 O \\nATOM 446 N VAL 58 13.987 8.397 11.975 N \\nATOM 447 CA VAL 58 12.603 8.746 11.672 C \\nATOM 448 C VAL 58 12.568 9.841 10.608 C \\nATOM 449 CB VAL 58 11.845 9.207 12.936 C \\nATOM 450 O VAL 58 13.146 10.914 10.793 O \\nATOM 451 CG1 VAL 58 10.406 9.589 12.594 C \\nATOM 452 CG2 VAL 58 11.871 8.113 14.002 C \\nATOM 453 N GLU 59 12.112 9.427 9.451 N \\nATOM 454 CA GLU 59 11.996 10.425 8.392 C \\nATOM 455 C GLU 59 10.802 11.346 8.63 C \\nATOM 456 CB GLU 59 11.872 9.747 7.025 C \\nATOM 457 O GLU 59 9.811 10.941 9.24 O \\nATOM 458 CG GLU 59 13.115 8.975 6.607 C \\nATOM 459 CD GLU 59 12.989 8.331 5.236 C \\nATOM 460 OE1 GLU 59 11.912 7.774 4.924 O \\nATOM 461 OE2 GLU 59 13.975 8.382 4.468 O \\nATOM 462 N LYS 60 10.992 12.542 8.114 N \\nATOM 463 CA LYS 60 9.868 13.474 8.133 C \\nATOM 464 C LYS 60 8.633 12.859 7.482 C \\nATOM 465 CB LYS 60 10.24 14.778 7.426 C \\nATOM 466 O LYS 60 8.725 12.253 6.412 O \\nATOM 467 CG LYS 60 9.223 15.895 7.612 C \\nATOM 468 CD LYS 60 9.71 17.202 7.0 C \\nATOM 469 CE LYS 60 8.721 18.335 7.239 C \\nATOM 470 NZ LYS 60 9.187 19.616 6.629 N \\nATOM 471 N TYR 61 7.445 12.886 8.085 N \\nATOM 472 CA TYR 61 6.132 12.402 7.672 C \\nATOM 473 C TYR 61 6.035 10.889 7.827 C \\nATOM 474 CB TYR 61 5.846 12.797 6.22 C \\nATOM 475 O TYR 61 4.991 10.295 7.547 O \\nATOM 476 CG TYR 61 5.863 14.287 5.982 C \\nATOM 477 CD1 TYR 61 4.813 15.094 6.416 C \\nATOM 478 CD2 TYR 61 6.927 14.892 5.322 C \\nATOM 479 CE1 TYR 61 4.824 16.467 6.197 C \\nATOM 480 CE2 TYR 61 6.948 16.264 5.098 C \\nATOM 481 OH TYR 61 5.91 18.402 5.319 O \\nATOM 482 CZ TYR 61 5.894 17.042 5.538 C \\nATOM 483 N GLY 62 7.137 10.228 8.27 N \\nATOM 484 CA GLY 62 7.095 8.801 8.546 C \\nATOM 485 C GLY 62 6.036 8.422 9.564 C \\nATOM 486 O GLY 62 5.209 7.543 9.311 O \\nATOM 487 N PRO 63 6.084 9.05 10.741 N \\nATOM 488 CA PRO 63 5.05 8.759 11.737 C \\nATOM 489 C PRO 63 3.645 9.095 11.244 C \\nATOM 490 CB PRO 63 5.441 9.647 12.921 C \\nATOM 491 O PRO 63 2.69 8.377 11.552 O \\nATOM 492 CG PRO 63 6.924 9.793 12.816 C \\nATOM 493 CD PRO 63 7.293 9.883 11.363 C \\nATOM 494 N GLU 64 3.478 10.209 10.518 N \\nATOM 495 CA GLU 64 2.176 10.584 9.975 C \\nATOM 496 C GLU 64 1.654 9.523 9.01 C \\nATOM 497 CB GLU 64 2.258 11.941 9.27 C \\nATOM 498 O GLU 64 0.47 9.18 9.037 O \\nATOM 499 CG GLU 64 2.485 13.111 10.215 C \\nATOM 500 CD GLU 64 3.955 13.411 10.457 C \\nATOM 501 OE1 GLU 64 4.804 12.523 10.216 O \\nATOM 502 OE2 GLU 64 4.262 14.544 10.892 O \\nATOM 503 N ALA 65 2.557 9.01 8.149 N \\nATOM 504 CA ALA 65 2.161 7.955 7.22 C \\nATOM 505 C ALA 65 1.762 6.686 7.968 C \\nATOM 506 CB ALA 65 3.293 7.656 6.24 C \\nATOM 507 O ALA 65 0.755 6.055 7.64 O \\nATOM 508 N SER 66 2.575 6.338 8.97 N \\nATOM 509 CA SER 66 2.272 5.16 9.776 C \\nATOM 510 C SER 66 0.932 5.308 10.49 C \\nATOM 511 CB SER 66 3.38 4.912 10.8 C \\nATOM 512 O SER 66 0.119 4.381 10.494 O \\nATOM 513 OG SER 66 3.125 3.731 11.541 O \\nATOM 514 N ALA 67 0.648 6.462 11.066 N \\nATOM 515 CA ALA 67 -0.605 6.72 11.77 C \\nATOM 516 C ALA 67 -1.792 6.68 10.811 C \\nATOM 517 CB ALA 67 -0.547 8.069 12.482 C \\nATOM 518 O ALA 67 -2.864 6.182 11.161 O \\nATOM 519 N PHE 68 -1.566 7.186 9.607 N \\nATOM 520 CA PHE 68 -2.629 7.209 8.609 C \\nATOM 521 C PHE 68 -3.037 5.794 8.219 C \\nATOM 522 CB PHE 68 -2.184 7.988 7.367 C \\nATOM 523 O PHE 68 -4.225 5.467 8.201 O \\nATOM 524 CG PHE 68 -3.249 8.105 6.31 C \\nATOM 525 CD1 PHE 68 -4.21 9.105 6.38 C \\nATOM 526 CD2 PHE 68 -3.288 7.213 5.246 C \\nATOM 527 CE1 PHE 68 -5.197 9.216 5.403 C \\nATOM 528 CE2 PHE 68 -4.271 7.317 4.266 C \\nATOM 529 CZ PHE 68 -5.225 8.319 4.347 C \\nATOM 530 N THR 69 -2.068 4.981 7.93 N \\nATOM 531 CA THR 69 -2.34 3.586 7.6 C \\nATOM 532 C THR 69 -3.005 2.872 8.773 C \\nATOM 533 CB THR 69 -1.05 2.843 7.208 C \\nATOM 534 O THR 69 -3.988 2.151 8.591 O \\nATOM 535 CG2 THR 69 -1.32 1.361 6.966 C \\nATOM 536 OG1 THR 69 -0.517 3.421 6.01 O \\nATOM 537 N LYS 70 -2.424 3.082 9.959 N \\nATOM 538 CA LYS 70 -2.979 2.46 11.158 C \\nATOM 539 C LYS 70 -4.452 2.821 11.333 C \\nATOM 540 CB LYS 70 -2.186 2.881 12.396 C \\nATOM 541 O LYS 70 -5.286 1.946 11.57 O \\nATOM 542 CG LYS 70 -2.651 2.217 13.684 C \\nATOM 543 CD LYS 70 -1.756 2.588 14.859 C \\nATOM 544 CE LYS 70 -2.232 1.94 16.152 C \\nATOM 545 NZ LYS 70 -1.37 2.319 17.312 N \\nATOM 546 N LYS 71 -4.799 4.069 11.192 N \\nATOM 547 CA LYS 71 -6.173 4.54 11.337 C \\nATOM 548 C LYS 71 -7.081 3.921 10.278 C \\nATOM 549 CB LYS 71 -6.23 6.066 11.25 C \\nATOM 550 O LYS 71 -8.191 3.481 10.584 O \\nATOM 551 CG LYS 71 -7.616 6.648 11.488 C \\nATOM 552 CD LYS 71 -7.598 8.17 11.442 C \\nATOM 553 CE LYS 71 -8.985 8.754 11.675 C \\nATOM 554 NZ LYS 71 -8.966 10.248 11.664 N \\nATOM 555 N MET 72 -6.634 3.822 9.002 N \\nATOM 556 CA MET 72 -7.467 3.302 7.921 C \\nATOM 557 C MET 72 -7.801 1.832 8.15 C \\nATOM 558 CB MET 72 -6.768 3.476 6.572 C \\nATOM 559 O MET 72 -8.944 1.414 7.959 O \\nATOM 560 CG MET 72 -6.803 4.9 6.042 C \\nATOM 561 SD MET 72 -6.245 5.015 4.297 S \\nATOM 562 CE MET 72 -7.647 4.224 3.46 C \\nATOM 563 N VAL 73 -6.821 1.079 8.598 N \\nATOM 564 CA VAL 73 -7.032 -0.365 8.62 C \\nATOM 565 C VAL 73 -7.632 -0.78 9.962 C \\nATOM 566 CB VAL 73 -5.718 -1.135 8.363 C \\nATOM 567 O VAL 73 -8.43 -1.718 10.028 O \\nATOM 568 CG1 VAL 73 -5.183 -0.84 6.963 C \\nATOM 569 CG2 VAL 73 -4.676 -0.779 9.423 C \\nATOM 570 N GLU 74 -7.285 -0.11 11.047 N \\nATOM 571 CA GLU 74 -7.823 -0.482 12.352 C \\nATOM 572 C GLU 74 -9.289 -0.078 12.48 C \\nATOM 573 CB GLU 74 -7.002 0.157 13.475 C \\nATOM 574 O GLU 74 -10.043 -0.689 13.241 O \\nATOM 575 CG GLU 74 -5.624 -0.463 13.658 C \\nATOM 576 CD GLU 74 -4.859 0.113 14.839 C \\nATOM 577 OE1 GLU 74 -5.336 1.097 15.449 O \\nATOM 578 OE2 GLU 74 -3.774 -0.423 15.157 O \\nATOM 579 N ASN 75 -9.685 0.959 11.78 N \\nATOM 580 CA ASN 75 -11.068 1.414 11.875 C \\nATOM 581 C ASN 75 -11.956 0.727 10.843 C \\nATOM 582 CB ASN 75 -11.145 2.934 11.715 C \\nATOM 583 O ASN 75 -13.176 0.903 10.851 O \\nATOM 584 CG ASN 75 -10.6 3.677 12.919 C \\nATOM 585 ND2 ASN 75 -10.279 4.951 12.734 N \\nATOM 586 OD1 ASN 75 -10.468 3.109 14.007 O \\nATOM 587 N ALA 76 -11.348 -0.089 10.062 N \\nATOM 588 CA ALA 76 -12.098 -0.719 8.979 C \\nATOM 589 C ALA 76 -12.862 -1.942 9.479 C \\nATOM 590 CB ALA 76 -11.16 -1.111 7.839 C \\nATOM 591 O ALA 76 -12.353 -2.705 10.304 O \\nATOM 592 N LYS 77 -14.046 -2.149 8.944 N \\nATOM 593 CA LYS 77 -14.842 -3.344 9.207 C \\nATOM 594 C LYS 77 -14.436 -4.49 8.284 C \\nATOM 595 CB LYS 77 -16.333 -3.043 9.044 C \\nATOM 596 O LYS 77 -14.603 -5.661 8.63 O \\nATOM 597 CG LYS 77 -16.878 -2.047 10.057 C \\nATOM 598 CD LYS 77 -18.357 -1.766 9.825 C \\nATOM 599 CE LYS 77 -18.882 -0.705 10.783 C \\nATOM 600 NZ LYS 77 -20.317 -0.383 10.52 N \\nATOM 601 N LYS 78 -13.999 -4.126 7.229 N \\nATOM 602 CA LYS 78 -13.602 -5.102 6.219 C \\nATOM 603 C LYS 78 -12.247 -4.746 5.613 C \\nATOM 604 CB LYS 78 -14.66 -5.197 5.119 C \\nATOM 605 O LYS 78 -12.033 -3.612 5.182 O \\nATOM 606 CG LYS 78 -14.436 -6.342 4.142 C \\nATOM 607 CD LYS 78 -15.523 -6.388 3.076 C \\nATOM 608 CE LYS 78 -15.255 -7.481 2.05 C \\nATOM 609 NZ LYS 78 -16.271 -7.474 0.955 N \\nATOM 610 N ILE 79 -11.362 -5.748 5.63 N \\nATOM 611 CA ILE 79 -10.067 -5.636 4.969 C \\nATOM 612 C ILE 79 -9.974 -6.657 3.837 C \\nATOM 613 CB ILE 79 -8.904 -5.835 5.967 C \\nATOM 614 O ILE 79 -10.304 -7.831 4.024 O \\nATOM 615 CG1 ILE 79 -8.995 -4.81 7.103 C \\nATOM 616 CG2 ILE 79 -7.554 -5.74 5.25 C \\nATOM 617 CD1 ILE 79 -8.755 -3.373 6.662 C \\nATOM 618 N GLU 80 -9.543 -6.235 2.655 N \\nATOM 619 CA GLU 80 -9.369 -7.114 1.502 C \\nATOM 620 C GLU 80 -7.994 -6.926 0.868 C \\nATOM 621 CB GLU 80 -10.466 -6.862 0.464 C \\nATOM 622 O GLU 80 -7.433 -5.829 0.903 O \\nATOM 623 CG GLU 80 -11.874 -7.12 0.982 C \\nATOM 624 CD GLU 80 -12.959 -6.611 0.047 C \\nATOM 625 OE1 GLU 80 -13.025 -5.384 -0.195 O \\nATOM 626 OE2 GLU 80 -13.751 -7.445 -0.446 O \\nATOM 627 N VAL 81 -7.513 -8.001 0.336 N \\nATOM 628 CA VAL 81 -6.224 -8.028 -0.347 C \\nATOM 629 C VAL 81 -6.433 -8.287 -1.837 C \\nATOM 630 CB VAL 81 -5.286 -9.098 0.254 C \\nATOM 631 O VAL 81 -7.21 -9.166 -2.218 O \\nATOM 632 CG1 VAL 81 -3.984 -9.182 -0.541 C \\nATOM 633 CG2 VAL 81 -5.0 -8.793 1.723 C \\nATOM 634 N GLU 82 -5.78 -7.484 -2.688 N \\nATOM 635 CA GLU 82 -5.81 -7.632 -4.14 C \\nATOM 636 C GLU 82 -4.408 -7.848 -4.702 C \\nATOM 637 CB GLU 82 -6.456 -6.407 -4.792 C \\nATOM 638 O GLU 82 -3.569 -6.945 -4.656 O \\nATOM 639 CG GLU 82 -6.551 -6.496 -6.308 C \\nATOM 640 CD GLU 82 -7.148 -5.252 -6.946 C \\nATOM 641 OE1 GLU 82 -6.413 -4.257 -7.139 O \\nATOM 642 OE2 GLU 82 -8.36 -5.272 -7.255 O \\nATOM 643 N PHE 83 -4.165 -8.994 -5.164 N \\nATOM 644 CA PHE 83 -2.884 -9.285 -5.798 C \\nATOM 645 C PHE 83 -2.902 -8.878 -7.267 C \\nATOM 646 CB PHE 83 -2.546 -10.774 -5.671 C \\nATOM 647 O PHE 83 -3.924 -9.017 -7.943 O \\nATOM 648 CG PHE 83 -2.273 -11.216 -4.259 C \\nATOM 649 CD1 PHE 83 -1.014 -11.051 -3.695 C \\nATOM 650 CD2 PHE 83 -3.277 -11.797 -3.495 C \\nATOM 651 CE1 PHE 83 -0.759 -11.46 -2.388 C \\nATOM 652 CE2 PHE 83 -3.03 -12.207 -2.188 C \\nATOM 653 CZ PHE 83 -1.77 -12.039 -1.637 C \\nATOM 654 N ASN 84 -1.784 -8.335 -7.588 N \\nATOM 655 CA ASN 84 -1.634 -8.008 -9.002 C \\nATOM 656 C ASN 84 -1.251 -9.236 -9.823 C \\nATOM 657 CB ASN 84 -0.598 -6.898 -9.189 C \\nATOM 658 O ASN 84 -1.222 -10.352 -9.303 O \\nATOM 659 CG ASN 84 -0.931 -5.978 -10.347 C \\nATOM 660 ND2 ASN 84 -0.549 -4.712 -10.226 N \\nATOM 661 OD1 ASN 84 -1.527 -6.401 -11.341 O \\nATOM 662 N LYS 85 -0.923 -8.982 -11.07 N \\nATOM 663 CA LYS 85 -0.725 -10.063 -12.031 C \\nATOM 664 C LYS 85 0.61 -10.765 -11.803 C \\nATOM 665 CB LYS 85 -0.798 -9.53 -13.463 C \\nATOM 666 O LYS 85 0.754 -11.951 -12.107 O \\nATOM 667 CG LYS 85 -2.151 -8.941 -13.835 C \\nATOM 668 CD LYS 85 -2.144 -8.375 -15.25 C \\nATOM 669 CE LYS 85 -3.47 -7.712 -15.595 C \\nATOM 670 NZ LYS 85 -3.435 -7.068 -16.942 N \\nATOM 671 N GLY 86 1.505 -10.177 -11.266 N \\nATOM 672 CA GLY 86 2.835 -10.749 -11.126 C \\nATOM 673 C GLY 86 3.051 -11.436 -9.79 C \\nATOM 674 O GLY 86 2.105 -11.954 -9.193 O \\nATOM 675 N GLN 87 4.322 -11.438 -9.417 N \\nATOM 676 CA GLN 87 4.738 -12.1 -8.185 C \\nATOM 677 C GLN 87 3.923 -11.605 -6.993 C \\nATOM 678 CB GLN 87 6.229 -11.875 -7.931 C \\nATOM 679 O GLN 87 3.729 -10.399 -6.825 O \\nATOM 680 CG GLN 87 7.136 -12.575 -8.934 C \\nATOM 681 CD GLN 87 8.609 -12.397 -8.618 C \\nATOM 682 NE2 GLN 87 9.428 -13.351 -9.048 N \\nATOM 683 OE1 GLN 87 9.008 -11.409 -7.992 O \\nATOM 684 N ARG 88 3.575 -12.546 -6.122 N \\nATOM 685 CA ARG 88 2.704 -12.225 -4.996 C \\nATOM 686 C ARG 88 3.513 -12.006 -3.722 C \\nATOM 687 CB ARG 88 1.675 -13.337 -4.778 C \\nATOM 688 O ARG 88 2.982 -11.529 -2.717 O \\nATOM 689 CG ARG 88 0.605 -13.406 -5.855 C \\nATOM 690 CD ARG 88 -0.475 -14.424 -5.514 C \\nATOM 691 NE ARG 88 -1.57 -14.393 -6.479 N \\nATOM 692 NH1 ARG 88 -2.981 -15.731 -5.233 N \\nATOM 693 NH2 ARG 88 -3.662 -14.919 -7.266 N \\nATOM 694 CZ ARG 88 -2.735 -15.014 -6.324 C \\nATOM 695 N THR 89 4.736 -12.499 -3.714 N \\nATOM 696 CA THR 89 5.596 -12.317 -2.55 C \\nATOM 697 C THR 89 6.971 -11.805 -2.969 C \\nATOM 698 CB THR 89 5.753 -13.629 -1.761 C \\nATOM 699 O THR 89 7.392 -12.003 -4.11 O \\nATOM 700 CG2 THR 89 4.405 -14.129 -1.251 C \\nATOM 701 OG1 THR 89 6.328 -14.627 -2.613 O \\nATOM 702 N ASP 90 7.612 -11.113 -2.078 N \\nATOM 703 CA ASP 90 8.984 -10.694 -2.349 C \\nATOM 704 C ASP 90 9.986 -11.647 -1.701 C \\nATOM 705 CB ASP 90 9.218 -9.266 -1.851 C \\nATOM 706 O ASP 90 9.602 -12.679 -1.148 O \\nATOM 707 CG ASP 90 9.098 -9.137 -0.343 C \\nATOM 708 OD1 ASP 90 9.172 -10.164 0.365 O \\nATOM 709 OD2 ASP 90 8.924 -7.998 0.141 O \\nATOM 710 N LYS 91 11.206 -11.38 -1.764 N \\nATOM 711 CA LYS 91 12.255 -12.295 -1.323 C \\nATOM 712 C LYS 91 12.242 -12.457 0.194 C \\nATOM 713 CB LYS 91 13.627 -11.803 -1.787 C \\nATOM 714 O LYS 91 12.839 -13.393 0.729 O \\nATOM 715 CG LYS 91 14.029 -10.455 -1.206 C \\nATOM 716 CD LYS 91 15.413 -10.033 -1.682 C \\nATOM 717 CE LYS 91 15.813 -8.68 -1.109 C \\nATOM 718 NZ LYS 91 17.261 -8.391 -1.33 N \\nATOM 719 N TYR 92 11.5 -11.522 0.98 N \\nATOM 720 CA TYR 92 11.429 -11.586 2.435 C \\nATOM 721 C TYR 92 10.169 -12.313 2.888 C \\nATOM 722 CB TYR 92 11.466 -10.178 3.037 C \\nATOM 723 O TYR 92 9.938 -12.48 4.088 O \\nATOM 724 CG TYR 92 12.697 -9.39 2.664 C \\nATOM 725 CD1 TYR 92 13.954 -9.759 3.137 C \\nATOM 726 CD2 TYR 92 12.606 -8.274 1.838 C \\nATOM 727 CE1 TYR 92 15.092 -9.034 2.797 C \\nATOM 728 CE2 TYR 92 13.737 -7.542 1.492 C \\nATOM 729 OH TYR 92 16.097 -7.208 1.635 O \\nATOM 730 CZ TYR 92 14.974 -7.929 1.975 C \\nATOM 731 N GLY 93 9.384 -12.808 1.874 N \\nATOM 732 CA GLY 93 8.174 -13.553 2.184 C \\nATOM 733 C GLY 93 6.974 -12.661 2.442 C \\nATOM 734 O GLY 93 5.926 -13.134 2.887 O \\nATOM 735 N ARG 94 7.126 -11.347 2.225 N \\nATOM 736 CA ARG 94 5.979 -10.459 2.382 C \\nATOM 737 C ARG 94 5.052 -10.542 1.173 C \\nATOM 738 CB ARG 94 6.441 -9.015 2.589 C \\nATOM 739 O ARG 94 5.514 -10.678 0.038 O \\nATOM 740 CG ARG 94 7.382 -8.833 3.768 C \\nATOM 741 CD ARG 94 7.898 -7.403 3.863 C \\nATOM 742 NE ARG 94 8.744 -7.059 2.724 N \\nATOM 743 NH1 ARG 94 9.37 -4.994 3.55 N \\nATOM 744 NH2 ARG 94 10.163 -5.711 1.522 N \\nATOM 745 CZ ARG 94 9.424 -5.922 2.601 C \\nATOM 746 N GLY 95 3.803 -10.583 1.467 N \\nATOM 747 CA GLY 95 2.827 -10.493 0.393 C \\nATOM 748 C GLY 95 2.818 -9.14 -0.293 C \\nATOM 749 O GLY 95 2.861 -8.101 0.369 O \\nATOM 750 N LEU 96 2.871 -9.16 -1.635 N \\nATOM 751 CA LEU 96 2.803 -7.939 -2.431 C \\nATOM 752 C LEU 96 1.385 -7.701 -2.942 C \\nATOM 753 CB LEU 96 3.777 -8.013 -3.61 C \\nATOM 754 O LEU 96 0.892 -8.451 -3.788 O \\nATOM 755 CG LEU 96 5.257 -8.167 -3.257 C \\nATOM 756 CD1 LEU 96 6.088 -8.347 -4.524 C \\nATOM 757 CD2 LEU 96 5.745 -6.964 -2.458 C \\nATOM 758 N ALA 97 0.724 -6.668 -2.335 N \\nATOM 759 CA ALA 97 -0.693 -6.555 -2.671 C \\nATOM 760 C ALA 97 -1.184 -5.12 -2.499 C \\nATOM 761 CB ALA 97 -1.522 -7.505 -1.81 C \\nATOM 762 O ALA 97 -0.524 -4.305 -1.85 O \\nATOM 763 N TYR 98 -2.289 -4.746 -3.227 N \\nATOM 764 CA TYR 98 -3.129 -3.617 -2.845 C \\nATOM 765 C TYR 98 -4.039 -3.983 -1.679 C \\nATOM 766 CB TYR 98 -3.97 -3.145 -4.036 C \\nATOM 767 O TYR 98 -4.649 -5.055 -1.673 O \\nATOM 768 CG TYR 98 -3.16 -2.868 -5.279 C \\nATOM 769 CD1 TYR 98 -2.4 -1.706 -5.395 C \\nATOM 770 CD2 TYR 98 -3.153 -3.766 -6.34 C \\nATOM 771 CE1 TYR 98 -1.653 -1.445 -6.539 C \\nATOM 772 CE2 TYR 98 -2.41 -3.516 -7.49 C \\nATOM 773 OH TYR 98 -0.927 -2.103 -8.715 O \\nATOM 774 CZ TYR 98 -1.665 -2.355 -7.579 C \\nATOM 775 N ILE 99 -4.078 -3.163 -0.654 N \\nATOM 776 CA ILE 99 -4.889 -3.412 0.532 C \\nATOM 777 C ILE 99 -6.101 -2.483 0.533 C \\nATOM 778 CB ILE 99 -4.068 -3.224 1.828 C \\nATOM 779 O ILE 99 -5.968 -1.279 0.299 O \\nATOM 780 CG1 ILE 99 -2.817 -4.109 1.8 C \\nATOM 781 CG2 ILE 99 -4.926 -3.527 3.059 C \\nATOM 782 CD1 ILE 99 -3.114 -5.597 1.674 C \\nATOM 783 N TYR 100 -7.24 -3.016 0.802 N \\nATOM 784 CA TYR 100 -8.475 -2.242 0.863 C \\nATOM 785 C TYR 100 -9.072 -2.278 2.265 C \\nATOM 786 CB TYR 100 -9.493 -2.772 -0.151 C \\nATOM 787 O TYR 100 -9.163 -3.343 2.881 O \\nATOM 788 CG TYR 100 -9.084 -2.561 -1.588 C \\nATOM 789 CD1 TYR 100 -9.597 -1.499 -2.33 C \\nATOM 790 CD2 TYR 100 -8.185 -3.422 -2.208 C \\nATOM 791 CE1 TYR 100 -9.224 -1.302 -3.656 C \\nATOM 792 CE2 TYR 100 -7.805 -3.234 -3.533 C \\nATOM 793 OH TYR 100 -7.956 -1.982 -5.559 O \\nATOM 794 CZ TYR 100 -8.329 -2.173 -4.247 C \\nATOM 795 N ALA 101 -9.369 -1.16 2.759 N \\nATOM 796 CA ALA 101 -10.09 -0.945 4.011 C \\nATOM 797 C ALA 101 -11.476 -0.362 3.752 C \\nATOM 798 CB ALA 101 -9.293 -0.025 4.932 C \\nATOM 799 O ALA 101 -11.603 0.742 3.217 O \\nATOM 800 N ASP 102 -12.548 -1.144 3.987 N \\nATOM 801 CA ASP 102 -13.941 -0.788 3.737 C \\nATOM 802 C ASP 102 -14.132 -0.284 2.308 C \\nATOM 803 CB ASP 102 -14.412 0.272 4.736 C \\nATOM 804 O ASP 102 -14.847 0.694 2.079 O \\nATOM 805 CG ASP 102 -14.548 -0.265 6.15 C \\nATOM 806 OD1 ASP 102 -14.698 -1.493 6.324 O \\nATOM 807 OD2 ASP 102 -14.507 0.549 7.098 O \\nATOM 808 N GLY 103 -13.37 -0.94 1.384 N \\nATOM 809 CA GLY 103 -13.539 -0.656 -0.033 C \\nATOM 810 C GLY 103 -12.624 0.445 -0.533 C \\nATOM 811 O GLY 103 -12.568 0.715 -1.735 O \\nATOM 812 N LYS 104 -11.883 1.101 0.334 N \\nATOM 813 CA LYS 104 -10.913 2.124 -0.048 C \\nATOM 814 C LYS 104 -9.505 1.543 -0.129 C \\nATOM 815 CB LYS 104 -10.943 3.289 0.943 C \\nATOM 816 O LYS 104 -9.04 0.894 0.81 O \\nATOM 817 CG LYS 104 -12.262 4.046 0.969 C \\nATOM 818 CD LYS 104 -12.217 5.215 1.945 C \\nATOM 819 CE LYS 104 -13.571 5.904 2.056 C \\nATOM 820 NZ LYS 104 -13.543 7.022 3.046 N \\nATOM 821 N MET 105 -8.869 1.793 -1.249 N \\nATOM 822 CA MET 105 -7.498 1.339 -1.464 C \\nATOM 823 C MET 105 -6.519 2.144 -0.617 C \\nATOM 824 CB MET 105 -7.121 1.445 -2.942 C \\nATOM 825 O MET 105 -6.36 3.349 -0.82 O \\nATOM 826 CG MET 105 -5.767 0.84 -3.275 C \\nATOM 827 SD MET 105 -5.267 1.149 -5.013 S \\nATOM 828 CE MET 105 -6.405 0.032 -5.878 C \\nATOM 829 N VAL 106 -5.83 1.476 0.314 N \\nATOM 830 CA VAL 106 -4.928 2.122 1.262 C \\nATOM 831 C VAL 106 -3.723 2.697 0.521 C \\nATOM 832 CB VAL 106 -4.46 1.14 2.359 C \\nATOM 833 O VAL 106 -3.278 3.809 0.815 O \\nATOM 834 CG1 VAL 106 -3.451 1.811 3.29 C \\nATOM 835 CG2 VAL 106 -5.656 0.615 3.151 C \\nATOM 836 N ASN 107 -3.198 1.973 -0.487 N \\nATOM 837 CA ASN 107 -2.108 2.449 -1.332 C \\nATOM 838 C ASN 107 -2.394 3.841 -1.888 C \\nATOM 839 CB ASN 107 -1.844 1.465 -2.474 C \\nATOM 840 O ASN 107 -1.568 4.746 -1.764 O \\nATOM 841 CG ASN 107 -1.441 0.09 -1.978 C \\nATOM 842 ND2 ASN 107 -0.28 -0.382 -2.418 N \\nATOM 843 OD1 ASN 107 -2.167 -0.544 -1.208 O \\nATOM 844 N GLU 108 -3.589 3.979 -2.495 N \\nATOM 845 CA GLU 108 -3.974 5.232 -3.137 C \\nATOM 846 C GLU 108 -4.208 6.332 -2.105 C \\nATOM 847 CB GLU 108 -5.23 5.036 -3.99 C \\nATOM 848 O GLU 108 -3.828 7.484 -2.321 O \\nATOM 849 CG GLU 108 -5.645 6.277 -4.768 C \\nATOM 850 CD GLU 108 -7.093 6.238 -5.23 C \\nATOM 851 OE1 GLU 108 -7.778 5.216 -4.997 O \\nATOM 852 OE2 GLU 108 -7.546 7.238 -5.831 O \\nATOM 853 N ALA 109 -4.846 5.975 -1.013 N \\nATOM 854 CA ALA 109 -5.137 6.966 0.02 C \\nATOM 855 C ALA 109 -3.855 7.605 0.544 C \\nATOM 856 CB ALA 109 -5.916 6.326 1.166 C \\nATOM 857 O ALA 109 -3.805 8.817 0.768 O \\nATOM 858 N LEU 110 -2.804 6.831 0.675 N \\nATOM 859 CA LEU 110 -1.504 7.338 1.102 C \\nATOM 860 C LEU 110 -0.935 8.31 0.074 C \\nATOM 861 CB LEU 110 -0.525 6.182 1.324 C \\nATOM 862 O LEU 110 -0.475 9.398 0.43 O \\nATOM 863 CG LEU 110 -0.672 5.412 2.637 C \\nATOM 864 CD1 LEU 110 0.074 4.084 2.559 C \\nATOM 865 CD2 LEU 110 -0.165 6.247 3.808 C \\nATOM 866 N VAL 111 -0.972 7.893 -1.182 N \\nATOM 867 CA VAL 111 -0.413 8.712 -2.252 C \\nATOM 868 C VAL 111 -1.21 10.008 -2.381 C \\nATOM 869 CB VAL 111 -0.404 7.956 -3.6 C \\nATOM 870 O VAL 111 -0.632 11.086 -2.537 O \\nATOM 871 CG1 VAL 111 -0.077 8.906 -4.75 C \\nATOM 872 CG2 VAL 111 0.595 6.801 -3.556 C \\nATOM 873 N ARG 112 -2.542 9.873 -2.267 N \\nATOM 874 CA ARG 112 -3.427 11.02 -2.435 C \\nATOM 875 C ARG 112 -3.237 12.029 -1.308 C \\nATOM 876 CB ARG 112 -4.888 10.568 -2.493 C \\nATOM 877 O ARG 112 -3.426 13.231 -1.505 O \\nATOM 878 CG ARG 112 -5.885 11.714 -2.573 C \\nATOM 879 CD ARG 112 -5.705 12.53 -3.846 C \\nATOM 880 NE ARG 112 -6.609 13.676 -3.883 N \\nATOM 881 NH1 ARG 112 -5.009 15.221 -3.26 N \\nATOM 882 NH2 ARG 112 -7.161 15.895 -3.67 N \\nATOM 883 CZ ARG 112 -6.258 14.928 -3.604 C \\nATOM 884 N GLN 113 -2.806 11.56 -0.144 N \\nATOM 885 CA GLN 113 -2.595 12.436 1.004 C \\nATOM 886 C GLN 113 -1.16 12.954 1.043 C \\nATOM 887 CB GLN 113 -2.925 11.704 2.306 C \\nATOM 888 O GLN 113 -0.797 13.724 1.936 O \\nATOM 889 CG GLN 113 -4.409 11.42 2.492 C \\nATOM 890 CD GLN 113 -5.245 12.684 2.557 C \\nATOM 891 NE2 GLN 113 -6.453 12.625 2.007 N \\nATOM 892 OE1 GLN 113 -4.809 13.706 3.097 O \\nATOM 893 N GLY 114 -0.379 12.6 0.076 N \\nATOM 894 CA GLY 114 1.01 13.032 0.057 C \\nATOM 895 C GLY 114 1.859 12.358 1.118 C \\nATOM 896 O GLY 114 2.865 12.915 1.562 O \\nATOM 897 N LEU 115 1.513 11.237 1.561 N \\nATOM 898 CA LEU 115 2.214 10.5 2.606 C \\nATOM 899 C LEU 115 3.001 9.335 2.016 C \\nATOM 900 CB LEU 115 1.225 9.984 3.654 C \\nATOM 901 O LEU 115 3.636 8.574 2.749 O \\nATOM 902 CG LEU 115 0.589 11.036 4.563 C \\nATOM 903 CD1 LEU 115 -0.526 10.413 5.397 C \\nATOM 904 CD2 LEU 115 1.643 11.674 5.462 C \\nATOM 905 N ALA 116 2.891 9.188 0.734 N \\nATOM 906 CA ALA 116 3.677 8.219 -0.025 C \\nATOM 907 C ALA 116 3.962 8.728 -1.435 C \\nATOM 908 CB ALA 116 2.952 6.876 -0.084 C \\nATOM 909 O ALA 116 3.21 9.545 -1.971 O \\nATOM 910 N LYS 117 5.082 8.187 -1.978 N \\nATOM 911 CA LYS 117 5.385 8.348 -3.397 C \\nATOM 912 C LYS 117 5.128 7.053 -4.164 C \\nATOM 913 CB LYS 117 6.835 8.792 -3.59 C \\nATOM 914 O LYS 117 5.251 5.961 -3.606 O \\nATOM 915 CG LYS 117 7.205 10.049 -2.816 C \\nATOM 916 CD LYS 117 8.687 10.375 -2.954 C \\nATOM 917 CE LYS 117 9.091 11.537 -2.058 C \\nATOM 918 NZ LYS 117 10.559 11.803 -2.122 N \\nATOM 919 N VAL 118 4.595 7.187 -5.386 N \\nATOM 920 CA VAL 118 4.553 6.011 -6.25 C \\nATOM 921 C VAL 118 5.971 5.501 -6.498 C \\nATOM 922 CB VAL 118 3.854 6.318 -7.593 C \\nATOM 923 O VAL 118 6.835 6.251 -6.961 O \\nATOM 924 CG1 VAL 118 3.85 5.084 -8.494 C \\nATOM 925 CG2 VAL 118 2.429 6.811 -7.351 C \\nATOM 926 N ALA 119 6.271 4.368 -6.149 N \\nATOM 927 CA ALA 119 7.597 3.763 -6.237 C \\nATOM 928 C ALA 119 7.499 2.251 -6.417 C \\nATOM 929 CB ALA 119 8.418 4.095 -4.994 C \\nATOM 930 O ALA 119 6.403 1.685 -6.385 O \\nATOM 931 N TYR 120 8.664 1.661 -6.78 N \\nATOM 932 CA TYR 120 8.804 0.21 -6.843 C \\nATOM 933 C TYR 120 7.843 -0.386 -7.864 C \\nATOM 934 CB TYR 120 8.555 -0.414 -5.466 C \\nATOM 935 O TYR 120 7.186 -1.394 -7.593 O \\nATOM 936 CG TYR 120 9.397 0.187 -4.366 C \\nATOM 937 CD1 TYR 120 10.787 0.195 -4.452 C \\nATOM 938 CD2 TYR 120 8.804 0.747 -3.24 C \\nATOM 939 CE1 TYR 120 11.567 0.746 -3.44 C \\nATOM 940 CE2 TYR 120 9.573 1.3 -2.222 C \\nATOM 941 OH TYR 120 11.718 1.842 -1.326 O \\nATOM 942 CZ TYR 120 10.951 1.296 -2.331 C \\nATOM 943 N VAL 121 7.728 0.128 -9.042 N \\nATOM 944 CA VAL 121 6.879 -0.319 -10.141 C \\nATOM 945 C VAL 121 7.563 -1.458 -10.893 C \\nATOM 946 CB VAL 121 6.549 0.838 -11.11 C \\nATOM 947 O VAL 121 8.554 -1.239 -11.595 O \\nATOM 948 CG1 VAL 121 5.596 0.368 -12.207 C \\nATOM 949 CG2 VAL 121 5.95 2.018 -10.347 C \\nATOM 950 N TYR 122 7.156 -2.644 -10.533 N \\nATOM 951 CA TYR 122 7.673 -3.843 -11.184 C \\nATOM 952 C TYR 122 6.574 -4.561 -11.957 C \\nATOM 953 CB TYR 122 8.29 -4.791 -10.151 C \\nATOM 954 O TYR 122 5.672 -5.153 -11.36 O \\nATOM 955 CG TYR 122 9.407 -4.171 -9.348 C \\nATOM 956 CD1 TYR 122 10.601 -3.789 -9.958 C \\nATOM 957 CD2 TYR 122 9.273 -3.965 -7.979 C \\nATOM 958 CE1 TYR 122 11.634 -3.219 -9.221 C \\nATOM 959 CE2 TYR 122 10.299 -3.395 -7.233 C \\nATOM 960 OH TYR 122 12.494 -2.462 -7.129 O \\nATOM 961 CZ TYR 122 11.474 -3.026 -7.862 C \\nATOM 962 N LYS 123 6.647 -4.418 -13.354 N \\nATOM 963 CA LYS 123 5.685 -5.116 -14.202 C \\nATOM 964 C LYS 123 5.807 -6.629 -14.041 C \\nATOM 965 CB LYS 123 5.88 -4.728 -15.668 C \\nATOM 966 O LYS 123 6.911 -7.155 -13.882 O \\nATOM 967 CG LYS 123 5.549 -3.274 -15.973 C \\nATOM 968 CD LYS 123 5.72 -2.96 -17.453 C \\nATOM 969 CE LYS 123 5.387 -1.506 -17.76 C \\nATOM 970 NZ LYS 123 5.589 -1.184 -19.204 N \\nATOM 971 N PRO 124 4.691 -7.193 -14.037 N \\nATOM 972 CA PRO 124 3.356 -6.713 -14.4 C \\nATOM 973 C PRO 124 2.522 -6.314 -13.184 C \\nATOM 974 CB PRO 124 2.734 -7.912 -15.119 C \\nATOM 975 O PRO 124 1.29 -6.334 -13.243 O \\nATOM 976 CG PRO 124 3.265 -9.109 -14.398 C \\nATOM 977 CD PRO 124 4.678 -8.822 -13.975 C \\nATOM 978 N ASN 125 3.178 -6.158 -12.089 N \\nATOM 979 CA ASN 125 2.456 -5.708 -10.903 C \\nATOM 980 C ASN 125 2.278 -4.193 -10.897 C \\nATOM 981 CB ASN 125 3.176 -6.164 -9.632 C \\nATOM 982 O ASN 125 2.732 -3.514 -9.974 O \\nATOM 983 CG ASN 125 2.945 -7.63 -9.324 C \\nATOM 984 ND2 ASN 125 3.753 -8.182 -8.427 N \\nATOM 985 OD1 ASN 125 2.049 -8.263 -9.89 O \\nATOM 986 N ASN 126 1.53 -3.649 -11.89 N \\nATOM 987 CA ASN 126 1.415 -2.199 -12.007 C \\nATOM 988 C ASN 126 0.025 -1.783 -12.478 C \\nATOM 989 CB ASN 126 2.484 -1.651 -12.955 C \\nATOM 990 O ASN 126 -0.154 -0.681 -13.0 O \\nATOM 991 CG ASN 126 2.24 -2.043 -14.399 C \\nATOM 992 ND2 ASN 126 2.508 -1.122 -15.317 N \\nATOM 993 OD1 ASN 126 1.813 -3.164 -14.687 O \\nATOM 994 N THR 127 -0.96 -2.688 -12.302 N \\nATOM 995 CA THR 127 -2.33 -2.49 -12.761 C \\nATOM 996 C THR 127 -2.835 -1.103 -12.374 C \\nATOM 997 CB THR 127 -3.273 -3.562 -12.184 C \\nATOM 998 O THR 127 -3.532 -0.451 -13.154 O \\nATOM 999 CG2 THR 127 -4.722 -3.285 -12.569 C \\nATOM 1000 OG1 THR 127 -2.893 -4.847 -12.691 O \\nATOM 1001 N HIS 128 -2.49 -0.62 -11.168 N \\nATOM 1002 CA HIS 128 -3.06 0.623 -10.661 C \\nATOM 1003 C HIS 128 -2.047 1.761 -10.727 C \\nATOM 1004 CB HIS 128 -3.55 0.44 -9.223 C \\nATOM 1005 O HIS 128 -2.26 2.823 -10.137 O \\nATOM 1006 CG HIS 128 -4.684 -0.527 -9.094 C \\nATOM 1007 CD2 HIS 128 -4.729 -1.78 -8.582 C \\nATOM 1008 ND1 HIS 128 -5.96 -0.24 -9.527 N \\nATOM 1009 CE1 HIS 128 -6.744 -1.278 -9.285 C \\nATOM 1010 NE2 HIS 128 -6.021 -2.225 -8.713 N \\nATOM 1011 N GLU 129 -0.975 1.624 -11.554 N \\nATOM 1012 CA GLU 129 0.098 2.614 -11.564 C \\nATOM 1013 C GLU 129 -0.414 3.979 -12.017 C \\nATOM 1014 CB GLU 129 1.245 2.156 -12.469 C \\nATOM 1015 O GLU 129 -0.143 4.994 -11.372 O \\nATOM 1016 CG GLU 129 2.401 3.143 -12.544 C \\nATOM 1017 CD GLU 129 3.528 2.678 -13.453 C \\nATOM 1018 OE1 GLU 129 3.458 1.542 -13.974 O \\nATOM 1019 OE2 GLU 129 4.488 3.457 -13.646 O \\nATOM 1020 N GLN 130 -1.108 4.017 -13.151 N \\nATOM 1021 CA GLN 130 -1.579 5.289 -13.689 C \\nATOM 1022 C GLN 130 -2.549 5.968 -12.726 C \\nATOM 1023 CB GLN 130 -2.246 5.084 -15.049 C \\nATOM 1024 O GLN 130 -2.506 7.187 -12.55 O \\nATOM 1025 CG GLN 130 -1.265 4.803 -16.18 C \\nATOM 1026 CD GLN 130 -1.944 4.691 -17.532 C \\nATOM 1027 NE2 GLN 130 -1.15 4.503 -18.58 N \\nATOM 1028 OE1 GLN 130 -3.172 4.771 -17.633 O \\nATOM 1029 N HIS 131 -3.438 5.145 -12.086 N \\nATOM 1030 CA HIS 131 -4.371 5.676 -11.1 C \\nATOM 1031 C HIS 131 -3.631 6.291 -9.916 C \\nATOM 1032 CB HIS 131 -5.319 4.578 -10.613 C \\nATOM 1033 O HIS 131 -3.965 7.393 -9.475 O \\nATOM 1034 CG HIS 131 -6.335 5.057 -9.626 C \\nATOM 1035 CD2 HIS 131 -6.488 4.792 -8.308 C \\nATOM 1036 ND1 HIS 131 -7.357 5.917 -9.968 N \\nATOM 1037 CE1 HIS 131 -8.095 6.161 -8.898 C \\nATOM 1038 NE2 HIS 131 -7.589 5.49 -7.877 N \\nATOM 1039 N LEU 132 -2.571 5.629 -9.396 N \\nATOM 1040 CA LEU 132 -1.787 6.136 -8.276 C \\nATOM 1041 C LEU 132 -0.979 7.362 -8.688 C \\nATOM 1042 CB LEU 132 -0.849 5.049 -7.742 C \\nATOM 1043 O LEU 132 -0.819 8.299 -7.903 O \\nATOM 1044 CG LEU 132 -1.398 4.175 -6.613 C \\nATOM 1045 CD1 LEU 132 -2.537 3.301 -7.125 C \\nATOM 1046 CD2 LEU 132 -0.288 3.319 -6.012 C \\nATOM 1047 N ARG 133 -0.449 7.473 -9.971 N \\nATOM 1048 CA ARG 133 0.313 8.628 -10.435 C \\nATOM 1049 C ARG 133 -0.58 9.857 -10.567 C \\nATOM 1050 CB ARG 133 0.988 8.325 -11.774 C \\nATOM 1051 O ARG 133 -0.138 10.982 -10.324 O \\nATOM 1052 CG ARG 133 2.154 7.355 -11.67 C \\nATOM 1053 CD ARG 133 2.954 7.293 -12.964 C \\nATOM 1054 NE ARG 133 3.991 6.267 -12.909 N \\nATOM 1055 NH1 ARG 133 5.362 7.437 -11.464 N \\nATOM 1056 NH2 ARG 133 5.987 5.365 -12.219 N \\nATOM 1057 CZ ARG 133 5.111 6.359 -12.198 C \\nATOM 1058 N LYS 134 -1.82 9.599 -10.961 N \\nATOM 1059 CA LYS 134 -2.764 10.712 -10.987 C \\nATOM 1060 C LYS 134 -3.013 11.254 -9.582 C \\nATOM 1061 CB LYS 134 -4.085 10.281 -11.624 C \\nATOM 1062 O LYS 134 -3.064 12.469 -9.379 O \\nATOM 1063 CG LYS 134 -4.025 10.141 -13.138 C \\nATOM 1064 CD LYS 134 -5.362 9.689 -13.711 C \\nATOM 1065 CE LYS 134 -5.285 9.482 -15.218 C \\nATOM 1066 NZ LYS 134 -6.563 8.939 -15.769 N \\nATOM 1067 N SER 135 -3.184 10.403 -8.593 N \\nATOM 1068 CA SER 135 -3.367 10.808 -7.203 C \\nATOM 1069 C SER 135 -2.131 11.524 -6.669 C \\nATOM 1070 CB SER 135 -3.682 9.595 -6.328 C \\nATOM 1071 O SER 135 -2.246 12.499 -5.923 O \\nATOM 1072 OG SER 135 -4.942 9.042 -6.668 O \\nATOM 1073 N GLU 136 -0.959 11.043 -7.133 N \\nATOM 1074 CA GLU 136 0.283 11.691 -6.723 C \\nATOM 1075 C GLU 136 0.379 13.106 -7.286 C \\nATOM 1076 CB GLU 136 1.493 10.865 -7.168 C \\nATOM 1077 O GLU 136 0.788 14.033 -6.583 O \\nATOM 1078 CG GLU 136 2.821 11.385 -6.638 C \\nATOM 1079 CD GLU 136 4.001 10.496 -7.0 C \\nATOM 1080 OE1 GLU 136 4.498 10.585 -8.146 O \\nATOM 1081 OE2 GLU 136 4.43 9.705 -6.131 O \\nATOM 1082 N ALA 137 0.02 13.225 -8.57 N \\nATOM 1083 CA ALA 137 0.039 14.543 -9.199 C \\nATOM 1084 C ALA 137 -0.881 15.514 -8.465 C \\nATOM 1085 CB ALA 137 -0.365 14.438 -10.667 C \\nATOM 1086 O ALA 137 -0.537 16.683 -8.277 O \\nATOM 1087 N GLN 138 -2.026 15.032 -8.034 N \\nATOM 1088 CA GLN 138 -2.949 15.861 -7.266 C \\nATOM 1089 C GLN 138 -2.348 16.249 -5.917 C \\nATOM 1090 CB GLN 138 -4.278 15.134 -7.058 C \\nATOM 1091 O GLN 138 -2.461 17.4 -5.49 O \\nATOM 1092 CG GLN 138 -5.335 15.974 -6.353 C \\nATOM 1093 CD GLN 138 -5.69 17.234 -7.119 C \\nATOM 1094 NE2 GLN 138 -6.09 18.275 -6.395 N \\nATOM 1095 OE1 GLN 138 -5.606 17.273 -8.35 O \\nATOM 1096 N ALA 139 -1.711 15.354 -5.204 N \\nATOM 1097 CA ALA 139 -1.064 15.644 -3.927 C \\nATOM 1098 C ALA 139 0.058 16.664 -4.1 C \\nATOM 1099 CB ALA 139 -0.522 14.361 -3.302 C \\nATOM 1100 O ALA 139 0.243 17.542 -3.254 O \\nATOM 1101 N LYS 140 0.774 16.583 -5.229 N \\nATOM 1102 CA LYS 140 1.836 17.538 -5.531 C \\nATOM 1103 C LYS 140 1.267 18.931 -5.787 C \\nATOM 1104 CB LYS 140 2.647 17.073 -6.742 C \\nATOM 1105 O LYS 140 1.799 19.925 -5.288 O \\nATOM 1106 CG LYS 140 3.614 15.938 -6.441 C \\nATOM 1107 CD LYS 140 4.37 15.502 -7.689 C \\nATOM 1108 CE LYS 140 5.36 14.385 -7.383 C \\nATOM 1109 NZ LYS 140 6.042 13.896 -8.618 N \\nATOM 1110 N LYS 141 0.225 18.857 -6.59 N \\nATOM 1111 CA LYS 141 -0.428 20.124 -6.904 C \\nATOM 1112 C LYS 141 -0.951 20.8 -5.639 C \\nATOM 1113 CB LYS 141 -1.574 19.907 -7.894 C \\nATOM 1114 O LYS 141 -0.838 22.019 -5.489 O \\nATOM 1115 CG LYS 141 -2.277 21.189 -8.318 C \\nATOM 1116 CD LYS 141 -3.404 20.908 -9.303 C \\nATOM 1117 CE LYS 141 -4.142 22.183 -9.687 C \\nATOM 1118 NZ LYS 141 -5.246 21.914 -10.656 N \\nATOM 1119 N GLU 142 -1.44 20.049 -4.641 N \\nATOM 1120 CA GLU 142 -2.043 20.553 -3.411 C \\nATOM 1121 C GLU 142 -1.0 20.701 -2.306 C \\nATOM 1122 CB GLU 142 -3.173 19.63 -2.947 C \\nATOM 1123 O GLU 142 -1.316 21.158 -1.205 O \\nATOM 1124 CG GLU 142 -4.385 19.632 -3.867 C \\nATOM 1125 CD GLU 142 -5.428 18.593 -3.487 C \\nATOM 1126 OE1 GLU 142 -5.338 18.02 -2.378 O \\nATOM 1127 OE2 GLU 142 -6.342 18.35 -4.306 O \\nATOM 1128 N LYS 143 0.364 20.33 -2.643 N \\nATOM 1129 CA LYS 143 1.492 20.455 -1.724 C \\nATOM 1130 C LYS 143 1.174 19.819 -0.374 C \\nATOM 1131 CB LYS 143 1.871 21.924 -1.535 C \\nATOM 1132 O LYS 143 1.393 20.432 0.673 O \\nATOM 1133 CG LYS 143 2.367 22.603 -2.803 C \\nATOM 1134 CD LYS 143 2.81 24.035 -2.534 C \\nATOM 1135 CE LYS 143 3.31 24.715 -3.801 C \\nATOM 1136 NZ LYS 143 3.766 26.113 -3.538 N \\nATOM 1137 N LEU 144 0.756 18.546 -0.483 N \\nATOM 1138 CA LEU 144 0.394 17.841 0.741 C \\nATOM 1139 C LEU 144 1.593 17.092 1.313 C \\nATOM 1140 CB LEU 144 -0.754 16.863 0.477 C \\nATOM 1141 O LEU 144 2.324 16.427 0.576 O \\nATOM 1142 CG LEU 144 -2.072 17.477 0.0 C \\nATOM 1143 CD1 LEU 144 -3.088 16.381 -0.302 C \\nATOM 1144 CD2 LEU 144 -2.618 18.447 1.042 C \\nATOM 1145 N ASN 145 1.824 17.265 2.547 N \\nATOM 1146 CA ASN 145 2.818 16.568 3.356 C \\nATOM 1147 C ASN 145 4.165 16.488 2.643 C \\nATOM 1148 CB ASN 145 2.326 15.166 3.721 C \\nATOM 1149 O ASN 145 4.874 17.489 2.531 O \\nATOM 1150 CG ASN 145 1.115 15.191 4.633 C \\nATOM 1151 ND2 ASN 145 0.061 14.488 4.238 N \\nATOM 1152 OD1 ASN 145 1.127 15.838 5.684 O \\nATOM 1153 N ILE 146 4.6 15.219 2.206 N \\nATOM 1154 CA ILE 146 5.932 15.062 1.633 C \\nATOM 1155 C ILE 146 6.158 16.12 0.556 C \\nATOM 1156 CB ILE 146 6.131 13.647 1.045 C \\nATOM 1157 O ILE 146 7.292 16.55 0.327 O \\nATOM 1158 CG1 ILE 146 6.087 12.595 2.159 C \\nATOM 1159 CG2 ILE 146 7.448 13.566 0.267 C \\nATOM 1160 CD1 ILE 146 5.945 11.165 1.655 C \\nATOM 1161 N TRP 147 4.967 16.545 0.019 N \\nATOM 1162 CA TRP 147 5.072 17.443 -1.126 C \\nATOM 1163 C TRP 147 4.982 18.9 -0.685 C \\nATOM 1164 CB TRP 147 3.976 17.139 -2.151 C \\nATOM 1165 O TRP 147 4.995 19.81 -1.518 O \\nATOM 1166 CG TRP 147 3.971 15.719 -2.633 C \\nATOM 1167 CD1 TRP 147 3.015 14.772 -2.393 C \\nATOM 1168 CD2 TRP 147 4.972 15.085 -3.434 C \\nATOM 1169 CE2 TRP 147 4.558 13.751 -3.642 C \\nATOM 1170 CE3 TRP 147 6.181 15.515 -3.996 C \\nATOM 1171 NE1 TRP 147 3.362 13.586 -2.998 N \\nATOM 1172 CH2 TRP 147 6.489 13.29 -4.93 C \\nATOM 1173 CZ2 TRP 147 5.311 12.843 -4.391 C \\nATOM 1174 CZ3 TRP 147 6.929 14.611 -4.741 C \\nATOM 1175 N SER 148 4.716 19.133 0.622 N \\nATOM 1176 CA SER 148 4.527 20.488 1.13 C \\nATOM 1177 C SER 148 5.818 21.295 1.045 C \\nATOM 1178 CB SER 148 4.032 20.454 2.576 C \\nATOM 1179 O SER 148 5.784 22.515 0.873 O \\nATOM 1180 OG SER 148 4.998 19.859 3.425 O \\nATOM 1181 N GLU 149 6.982 20.703 1.326 N \\nATOM 1182 CA GLU 149 8.188 21.511 1.471 C \\nATOM 1183 C GLU 149 9.112 21.345 0.269 C \\nATOM 1184 CB GLU 149 8.93 21.144 2.759 C \\nATOM 1185 O GLU 149 9.999 22.171 0.041 O \\nATOM 1186 CG GLU 149 8.159 21.476 4.029 C \\nATOM 1187 CD GLU 149 8.942 21.184 5.299 C \\nATOM 1188 OE1 GLU 149 10.085 20.682 5.206 O \\nATOM 1189 OE2 GLU 149 8.407 21.458 6.397 O \\nATOM 1190 N ASN 150 8.844 20.36 -0.521 N \\nATOM 1191 CA ASN 150 9.818 20.026 -1.555 C \\nATOM 1192 C ASN 150 9.552 20.794 -2.846 C \\nATOM 1193 CB ASN 150 9.82 18.519 -1.824 C \\nATOM 1194 O ASN 150 10.152 20.503 -3.882 O \\nATOM 1195 CG ASN 150 10.669 17.75 -0.831 C \\nATOM 1196 ND2 ASN 150 10.477 16.437 -0.779 N \\nATOM 1197 OD1 ASN 150 11.49 18.33 -0.117 O \\nATOM 1198 N ASP 151 9.238 21.881 -2.722 N \\nATOM 1199 CA ASP 151 9.548 22.805 -3.808 C \\nATOM 1200 C ASP 151 10.716 23.717 -3.437 C \\nATOM 1201 CB ASP 151 8.32 23.644 -4.167 C \\nATOM 1202 O ASP 151 11.143 24.547 -4.243 O \\nATOM 1203 CG ASP 151 7.512 23.053 -5.309 C \\nATOM 1204 OD1 ASP 151 7.995 22.113 -5.976 O \\nATOM 1205 OD2 ASP 151 6.382 23.534 -5.545 O \\nATOM 1206 N ALA 152 11.282 23.422 -2.288 N \\nATOM 1207 CA ALA 152 12.305 24.458 -2.174 C \\nATOM 1208 C ALA 152 13.618 24.004 -2.804 C \\nATOM 1209 CB ALA 152 12.522 24.833 -0.709 C \\nATOM 1210 O ALA 152 14.409 24.829 -3.267 O \\nATOM 1211 N ASP 153 13.688 22.711 -3.195 N \\nATOM 1212 CA ASP 153 14.964 22.43 -3.846 C \\nATOM 1213 C ASP 153 14.753 21.907 -5.265 C \\nATOM 1214 CB ASP 153 15.774 21.422 -3.029 C \\nATOM 1215 O ASP 153 15.685 21.891 -6.072 O \\nATOM 1216 CG ASP 153 16.734 22.082 -2.055 C \\nATOM 1217 OD1 ASP 153 16.975 23.303 -2.169 O \\nATOM 1218 OD2 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"\tviewer_1706850542354171.setStyle({\"model\": -1, \"serial\": 1234},{\"cartoon\": {\"color\": \"gray\"}});\n",
"\tviewer_1706850542354171.setStyle({\"model\": -1, \"serial\": 1235},{\"cartoon\": {\"color\": \"gray\"}});\n",
"\tviewer_1706850542354171.setStyle({\"model\": -1, \"serial\": 1236},{\"cartoon\": {\"color\": \"gray\"}});\n",
"\tviewer_1706850542354171.setStyle({\"model\": -1, \"serial\": 1237},{\"cartoon\": {\"color\": \"gray\"}});\n",
"\tviewer_1706850542354171.zoomTo();\n",
"viewer_1706850542354171.render();\n",
"});\n",
"</script>"
]
},
"metadata": {},
"output_type": "display_data"
}
],
"source": [
"view = py3Dmol.view(width=400, height=300)\n",
"view.addModelsAsFrames(str(mol))\n",
"\n",
"for i, at in enumerate(mol):\n",
" \n",
" if(at['resid']%3 == 0):\n",
" default = {\"cartoon\": {'color': 'gray'}}\n",
" elif(at['resid']%3 == 1):\n",
" default = {\"cartoon\": {'color': 'cyan'}}\n",
" else:\n",
" default = {\"cartoon\": {'color': 'red'}}\n",
" \n",
" view.setStyle({'model': -1, 'serial': i+1}, at.get(\"pymol\", default))\n",
"\n",
"view.zoomTo()\n",
"view.show()"
]
},
{
"cell_type": "code",
"execution_count": 8,
"id": "8dd67f42-e54d-43ef-ac82-f76370d25bdc",
"metadata": {},
"outputs": [],
"source": [
"v2 = view.write_html()"
]
},
{
"cell_type": "code",
"execution_count": null,
"id": "8681e721-7bd7-46ad-af90-fd2ecb539b1e",
"metadata": {},
"outputs": [],
"source": []
},
{
"cell_type": "code",
"execution_count": 9,
"id": "1687ce44-5546-4a92-9acd-9db28a4a8e6e",
"metadata": {},
"outputs": [],
"source": [
"import wandb"
]
},
{
"cell_type": "code",
"execution_count": null,
"id": "aa2250e2-437a-4c90-a079-32c85c0d982f",
"metadata": {},
"outputs": [],
"source": [
"\n"
]
},
{
"cell_type": "code",
"execution_count": 10,
"id": "0c91d41b-3e75-456b-9a54-691671da3dcf",
"metadata": {},
"outputs": [
{
"name": "stderr",
"output_type": "stream",
"text": [
"Failed to detect the name of this notebook, you can set it manually with the WANDB_NOTEBOOK_NAME environment variable to enable code saving.\n",
"\u001b[34m\u001b[1mwandb\u001b[0m: Currently logged in as: \u001b[33mbio_nmr\u001b[0m (\u001b[33mhkariyawasam\u001b[0m). Use \u001b[1m`wandb login --relogin`\u001b[0m to force relogin\n",
"2024-02-02 00:09:04.687460: E external/local_xla/xla/stream_executor/cuda/cuda_dnn.cc:9261] Unable to register cuDNN factory: Attempting to register factory for plugin cuDNN when one has already been registered\n",
"2024-02-02 00:09:04.687497: E external/local_xla/xla/stream_executor/cuda/cuda_fft.cc:607] Unable to register cuFFT factory: Attempting to register factory for plugin cuFFT when one has already been registered\n",
"2024-02-02 00:09:04.688824: E external/local_xla/xla/stream_executor/cuda/cuda_blas.cc:1515] Unable to register cuBLAS factory: Attempting to register factory for plugin cuBLAS when one has already been registered\n",
"2024-02-02 00:09:04.695133: I tensorflow/core/platform/cpu_feature_guard.cc:182] This TensorFlow binary is optimized to use available CPU instructions in performance-critical operations.\n",
"To enable the following instructions: AVX2 AVX512F FMA, in other operations, rebuild TensorFlow with the appropriate compiler flags.\n"
]
},
{
"data": {
"text/html": [
"Tracking run with wandb version 0.16.2"
],
"text/plain": [
"<IPython.core.display.HTML object>"
]
},
"metadata": {},
"output_type": "display_data"
},
{
"data": {
"text/html": [
"Run data is saved locally in <code>/home/jupyter-ramith/NMR Project/notebooks/wandb/run-20240202_000903-c2be5x0k</code>"
],
"text/plain": [
"<IPython.core.display.HTML object>"
]
},
"metadata": {},
"output_type": "display_data"
},
{
"data": {
"text/html": [
"Syncing run <strong><a href='https://wandb.ai/hkariyawasam/Test-Project/runs/c2be5x0k' target=\"_blank\">demo-3d-plot-log</a></strong> to <a href='https://wandb.ai/hkariyawasam/Test-Project' target=\"_blank\">Weights & Biases</a> (<a href='https://wandb.me/run' target=\"_blank\">docs</a>)<br/>"
],
"text/plain": [
"<IPython.core.display.HTML object>"
]
},
"metadata": {},
"output_type": "display_data"
},
{
"data": {
"text/html": [
" View project at <a href='https://wandb.ai/hkariyawasam/Test-Project' target=\"_blank\">https://wandb.ai/hkariyawasam/Test-Project</a>"
],
"text/plain": [
"<IPython.core.display.HTML object>"
]
},
"metadata": {},
"output_type": "display_data"
},
{
"data": {
"text/html": [
" View run at <a href='https://wandb.ai/hkariyawasam/Test-Project/runs/c2be5x0k' target=\"_blank\">https://wandb.ai/hkariyawasam/Test-Project/runs/c2be5x0k</a>"
],
"text/plain": [
"<IPython.core.display.HTML object>"
]
},
"metadata": {},
"output_type": "display_data"
},
{
"data": {
"text/html": [
"<button onClick=\"this.nextSibling.style.display='block';this.style.display='none';\">Display W&B run</button><iframe src='https://wandb.ai/hkariyawasam/Test-Project/runs/c2be5x0k?jupyter=true' style='border:none;width:100%;height:420px;display:none;'></iframe>"
],
"text/plain": [
"<wandb.sdk.wandb_run.Run at 0x7fdf52649b50>"
]
},
"execution_count": 10,
"metadata": {},
"output_type": "execute_result"
}
],
"source": [
"wandb.init(\n",
" project=\"Test-Project\",\n",
" name = f\"demo-3d-plot-log\",\n",
" tags = [\"Ramith\"],\n",
")"
]
},
{
"cell_type": "code",
"execution_count": 11,
"id": "c25018de-0a26-49fc-8fd1-9959eab43124",
"metadata": {},
"outputs": [],
"source": [
"\n",
"my_data = [\n",
" [0, wandb.Html(v1)],\n",
" [1, wandb.Html(v2)],\n",
"]\n",
"\n",
"# create a wandb.Table() with corresponding columns\n",
"columns = [\"id\", \"structure\"]\n",
"test_table = wandb.Table(data=my_data, columns=columns)"
]
},
{
"cell_type": "code",
"execution_count": 12,
"id": "b192bb40-deee-4dd4-ba07-ec2e549cccf6",
"metadata": {},
"outputs": [],
"source": [
"wandb.log({\"table_key\": test_table})"
]
},
{
"cell_type": "code",
"execution_count": 13,
"id": "2fb27501-674e-4b2d-ad1e-7f18174e1968",
"metadata": {},
"outputs": [
{
"name": "stderr",
"output_type": "stream",
"text": [
"wandb: WARNING Source type is set to 'repo' but some required information is missing from the environment. A job will not be created from this run. See https://docs.wandb.ai/guides/launch/create-job\n"
]
},
{
"data": {
"text/html": [
" View run <strong style=\"color:#cdcd00\">demo-3d-plot-log</strong> at: <a href='https://wandb.ai/hkariyawasam/Test-Project/runs/c2be5x0k' target=\"_blank\">https://wandb.ai/hkariyawasam/Test-Project/runs/c2be5x0k</a><br/>Synced 4 W&B file(s), 1 media file(s), 3 artifact file(s) and 0 other file(s)"
],
"text/plain": [
"<IPython.core.display.HTML object>"
]
},
"metadata": {},
"output_type": "display_data"
},
{
"data": {
"text/html": [
"Find logs at: <code>./wandb/run-20240202_000903-c2be5x0k/logs</code>"
],
"text/plain": [
"<IPython.core.display.HTML object>"
]
},
"metadata": {},
"output_type": "display_data"
}
],
"source": [
"wandb.finish()"
]
},
{
"cell_type": "code",
"execution_count": null,
"id": "a0223af7-4fab-4e8f-94ab-77db01027ec6",
"metadata": {},
"outputs": [],
"source": []
}
],
"metadata": {
"kernelspec": {
"display_name": "jax",
"language": "python",
"name": "jax"
},
"language_info": {
"codemirror_mode": {
"name": "ipython",
"version": 3
},
"file_extension": ".py",
"mimetype": "text/x-python",
"name": "python",
"nbconvert_exporter": "python",
"pygments_lexer": "ipython3",
"version": "3.11.5"
},
"widgets": {
"application/vnd.jupyter.widget-state+json": {
"state": {},
"version_major": 2,
"version_minor": 0
}
}
},
"nbformat": 4,
"nbformat_minor": 5
}
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