USER MOD reduce.3.24.130724 H: found=0, std=0, add=704, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 705 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ -121:sc= 0 (180deg=-0.0113) USER MOD Single : A 45 SER OG : rot 180:sc= -0.0936 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 ASN : amide:sc= -4.38! C(o=-4.4!,f=-15!) USER MOD Single : A 66 SER OG : rot 59:sc= 1.24 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot -119:sc= 1.41 USER MOD Single : A 102 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= -14.6! C(o=-15!,f=-19!) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot -10:sc= -3.46! USER MOD Single : A 111 THR OG1 : rot 180:sc= 0.0429 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0319) USER MOD Single : A 123 THR OG1 : rot 44:sc= -0.311 USER MOD Single : A 125 THR OG1 : rot 180:sc= -0.102 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 12 N ASN A 36 -3.568 -14.948 -10.517 1.00 0.00 N ATOM 13 CA ASN A 36 -2.701 -15.251 -9.341 1.00 0.00 C ATOM 14 C ASN A 36 -1.770 -14.065 -9.054 1.00 0.00 C ATOM 15 O ASN A 36 -2.174 -13.090 -8.454 1.00 0.00 O ATOM 16 CB ASN A 36 -1.909 -16.495 -9.750 1.00 0.00 C ATOM 17 CG ASN A 36 -2.877 -17.633 -10.075 1.00 0.00 C ATOM 18 OD1 ASN A 36 -2.992 -18.043 -11.214 1.00 0.00 O ATOM 19 ND2 ASN A 36 -3.586 -18.168 -9.117 1.00 0.00 N ATOM 0 HA ASN A 36 -3.272 -15.422 -8.428 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -1.287 -16.274 -10.617 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -1.238 -16.793 -8.944 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -4.234 -18.928 -9.325 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -3.492 -17.826 -8.161 1.00 0.00 H new ATOM 26 N ALA A 37 -0.528 -14.139 -9.472 1.00 0.00 N ATOM 27 CA ALA A 37 0.422 -13.023 -9.222 1.00 0.00 C ATOM 28 C ALA A 37 -0.285 -11.670 -9.374 1.00 0.00 C ATOM 29 O ALA A 37 -1.151 -11.504 -10.210 1.00 0.00 O ATOM 30 CB ALA A 37 1.505 -13.182 -10.290 1.00 0.00 C ATOM 0 H ALA A 37 -0.135 -14.933 -9.978 1.00 0.00 H new ATOM 0 HA ALA A 37 0.832 -13.052 -8.212 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.248 -12.393 -10.174 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.986 -14.154 -10.178 1.00 0.00 H new ATOM 0 HB3 ALA A 37 1.053 -13.113 -11.280 1.00 0.00 H new ATOM 36 N VAL A 38 0.071 -10.706 -8.569 1.00 0.00 N ATOM 37 CA VAL A 38 -0.590 -9.372 -8.671 1.00 0.00 C ATOM 38 C VAL A 38 0.374 -8.340 -9.265 1.00 0.00 C ATOM 39 O VAL A 38 1.534 -8.285 -8.911 1.00 0.00 O ATOM 40 CB VAL A 38 -0.961 -9.004 -7.229 1.00 0.00 C ATOM 41 CG1 VAL A 38 0.267 -8.468 -6.490 1.00 0.00 C ATOM 42 CG2 VAL A 38 -2.049 -7.929 -7.245 1.00 0.00 C ATOM 0 H VAL A 38 0.788 -10.783 -7.848 1.00 0.00 H new ATOM 0 HA VAL A 38 -1.463 -9.393 -9.324 1.00 0.00 H new ATOM 0 HB VAL A 38 -1.326 -9.894 -6.717 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -0.008 -8.210 -5.467 1.00 0.00 H new ATOM 0 HG12 VAL A 38 1.045 -9.232 -6.475 1.00 0.00 H new ATOM 0 HG13 VAL A 38 0.640 -7.580 -7.001 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -2.315 -7.665 -6.221 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -1.679 -7.044 -7.763 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.930 -8.310 -7.762 1.00 0.00 H new ATOM 52 N VAL A 39 -0.098 -7.513 -10.162 1.00 0.00 N ATOM 53 CA VAL A 39 0.800 -6.485 -10.761 1.00 0.00 C ATOM 54 C VAL A 39 0.372 -5.087 -10.331 1.00 0.00 C ATOM 55 O VAL A 39 -0.791 -4.745 -10.364 1.00 0.00 O ATOM 56 CB VAL A 39 0.643 -6.611 -12.279 1.00 0.00 C ATOM 57 CG1 VAL A 39 -0.836 -6.486 -12.655 1.00 0.00 C ATOM 58 CG2 VAL A 39 1.424 -5.478 -12.959 1.00 0.00 C ATOM 0 H VAL A 39 -1.059 -7.506 -10.503 1.00 0.00 H new ATOM 0 HA VAL A 39 1.830 -6.637 -10.440 1.00 0.00 H new ATOM 0 HB VAL A 39 1.024 -7.579 -12.604 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -0.946 -6.576 -13.736 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -1.404 -7.277 -12.166 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -1.213 -5.516 -12.332 1.00 0.00 H new ATOM 0 HG21 VAL A 39 1.317 -5.561 -14.041 1.00 0.00 H new ATOM 0 HG22 VAL A 39 1.032 -4.516 -12.628 1.00 0.00 H new ATOM 0 HG23 VAL A 39 2.478 -5.551 -12.692 1.00 0.00 H new ATOM 68 N LEU A 40 1.306 -4.262 -9.972 1.00 0.00 N ATOM 69 CA LEU A 40 0.956 -2.874 -9.597 1.00 0.00 C ATOM 70 C LEU A 40 1.380 -1.983 -10.759 1.00 0.00 C ATOM 71 O LEU A 40 2.384 -2.236 -11.395 1.00 0.00 O ATOM 72 CB LEU A 40 1.769 -2.575 -8.342 1.00 0.00 C ATOM 73 CG LEU A 40 1.865 -1.065 -8.150 1.00 0.00 C ATOM 74 CD1 LEU A 40 0.458 -0.474 -8.059 1.00 0.00 C ATOM 75 CD2 LEU A 40 2.632 -0.765 -6.861 1.00 0.00 C ATOM 0 H LEU A 40 2.299 -4.490 -9.922 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.105 -2.715 -9.402 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.299 -3.034 -7.472 1.00 0.00 H new ATOM 0 HB3 LEU A 40 2.766 -3.006 -8.430 1.00 0.00 H new ATOM 0 HG LEU A 40 2.390 -0.621 -8.996 1.00 0.00 H new ATOM 0 HD11 LEU A 40 0.525 0.605 -7.922 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.087 -0.690 -8.978 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.068 -0.915 -7.213 1.00 0.00 H new ATOM 0 HD21 LEU A 40 2.702 0.314 -6.722 1.00 0.00 H new ATOM 0 HD22 LEU A 40 2.107 -1.207 -6.014 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.634 -1.188 -6.927 1.00 0.00 H new ATOM 87 N VAL A 41 0.627 -0.982 -11.089 1.00 0.00 N ATOM 88 CA VAL A 41 1.023 -0.161 -12.262 1.00 0.00 C ATOM 89 C VAL A 41 0.717 1.325 -12.054 1.00 0.00 C ATOM 90 O VAL A 41 -0.394 1.711 -11.761 1.00 0.00 O ATOM 91 CB VAL A 41 0.180 -0.757 -13.398 1.00 0.00 C ATOM 92 CG1 VAL A 41 -0.119 0.289 -14.468 1.00 0.00 C ATOM 93 CG2 VAL A 41 0.933 -1.936 -14.024 1.00 0.00 C ATOM 0 H VAL A 41 -0.228 -0.698 -10.612 1.00 0.00 H new ATOM 0 HA VAL A 41 2.095 -0.192 -12.458 1.00 0.00 H new ATOM 0 HB VAL A 41 -0.768 -1.099 -12.983 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -0.717 -0.161 -15.260 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.670 1.117 -14.023 1.00 0.00 H new ATOM 0 HG13 VAL A 41 0.817 0.659 -14.886 1.00 0.00 H new ATOM 0 HG21 VAL A 41 0.337 -2.361 -14.831 1.00 0.00 H new ATOM 0 HG22 VAL A 41 1.887 -1.589 -14.422 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.112 -2.698 -13.265 1.00 0.00 H new ATOM 103 N LEU A 42 1.701 2.161 -12.244 1.00 0.00 N ATOM 104 CA LEU A 42 1.490 3.610 -12.110 1.00 0.00 C ATOM 105 C LEU A 42 2.041 4.307 -13.353 1.00 0.00 C ATOM 106 O LEU A 42 2.376 3.673 -14.335 1.00 0.00 O ATOM 107 CB LEU A 42 2.275 4.045 -10.874 1.00 0.00 C ATOM 108 CG LEU A 42 1.365 4.056 -9.649 1.00 0.00 C ATOM 109 CD1 LEU A 42 0.124 4.900 -9.941 1.00 0.00 C ATOM 110 CD2 LEU A 42 0.944 2.625 -9.315 1.00 0.00 C ATOM 0 H LEU A 42 2.652 1.887 -12.490 1.00 0.00 H new ATOM 0 HA LEU A 42 0.435 3.863 -12.011 1.00 0.00 H new ATOM 0 HB2 LEU A 42 3.112 3.367 -10.708 1.00 0.00 H new ATOM 0 HB3 LEU A 42 2.696 5.038 -11.032 1.00 0.00 H new ATOM 0 HG LEU A 42 1.901 4.484 -8.802 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -0.525 4.907 -9.066 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.425 5.920 -10.178 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -0.414 4.475 -10.788 1.00 0.00 H new ATOM 0 HD21 LEU A 42 0.294 2.632 -8.440 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.408 2.196 -10.162 1.00 0.00 H new ATOM 0 HD23 LEU A 42 1.829 2.025 -9.105 1.00 0.00 H new ATOM 122 N MET A 43 2.154 5.600 -13.320 1.00 0.00 N ATOM 123 CA MET A 43 2.704 6.323 -14.507 1.00 0.00 C ATOM 124 C MET A 43 4.155 6.740 -14.243 1.00 0.00 C ATOM 125 O MET A 43 4.637 6.679 -13.130 1.00 0.00 O ATOM 126 CB MET A 43 1.794 7.542 -14.702 1.00 0.00 C ATOM 127 CG MET A 43 2.186 8.667 -13.739 1.00 0.00 C ATOM 128 SD MET A 43 2.738 10.105 -14.691 1.00 0.00 S ATOM 129 CE MET A 43 3.048 11.205 -13.288 1.00 0.00 C ATOM 0 H MET A 43 1.893 6.190 -12.530 1.00 0.00 H new ATOM 0 HA MET A 43 2.720 5.701 -15.402 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.866 7.895 -15.731 1.00 0.00 H new ATOM 0 HB3 MET A 43 0.755 7.258 -14.534 1.00 0.00 H new ATOM 0 HG2 MET A 43 1.337 8.936 -13.111 1.00 0.00 H new ATOM 0 HG3 MET A 43 2.981 8.331 -13.073 1.00 0.00 H new ATOM 0 HE1 MET A 43 3.404 12.169 -13.653 1.00 0.00 H new ATOM 0 HE2 MET A 43 2.125 11.348 -12.727 1.00 0.00 H new ATOM 0 HE3 MET A 43 3.803 10.762 -12.638 1.00 0.00 H new ATOM 139 N LYS A 44 4.855 7.154 -15.262 1.00 0.00 N ATOM 140 CA LYS A 44 6.279 7.563 -15.082 1.00 0.00 C ATOM 141 C LYS A 44 6.415 8.569 -13.938 1.00 0.00 C ATOM 142 O LYS A 44 6.103 9.734 -14.083 1.00 0.00 O ATOM 143 CB LYS A 44 6.670 8.211 -16.411 1.00 0.00 C ATOM 144 CG LYS A 44 7.802 7.413 -17.055 1.00 0.00 C ATOM 145 CD LYS A 44 9.009 8.328 -17.271 1.00 0.00 C ATOM 146 CE LYS A 44 10.292 7.584 -16.887 1.00 0.00 C ATOM 147 NZ LYS A 44 10.360 7.668 -15.399 1.00 0.00 N ATOM 0 H LYS A 44 4.502 7.228 -16.216 1.00 0.00 H new ATOM 0 HA LYS A 44 6.918 6.717 -14.829 1.00 0.00 H new ATOM 0 HB2 LYS A 44 5.809 8.244 -17.079 1.00 0.00 H new ATOM 0 HB3 LYS A 44 6.985 9.241 -16.246 1.00 0.00 H new ATOM 0 HG2 LYS A 44 8.078 6.573 -16.418 1.00 0.00 H new ATOM 0 HG3 LYS A 44 7.472 6.996 -18.007 1.00 0.00 H new ATOM 0 HD2 LYS A 44 9.057 8.643 -18.313 1.00 0.00 H new ATOM 0 HD3 LYS A 44 8.906 9.231 -16.669 1.00 0.00 H new ATOM 0 HE2 LYS A 44 10.262 6.547 -17.222 1.00 0.00 H new ATOM 0 HE3 LYS A 44 11.167 8.043 -17.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 11.241 8.143 -15.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 9.546 8.210 -15.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 10.340 6.710 -14.996 1.00 0.00 H new ATOM 161 N SER A 45 6.883 8.129 -12.801 1.00 0.00 N ATOM 162 CA SER A 45 7.042 9.066 -11.653 1.00 0.00 C ATOM 163 C SER A 45 8.421 9.744 -11.715 1.00 0.00 C ATOM 164 O SER A 45 8.715 10.473 -12.642 1.00 0.00 O ATOM 165 CB SER A 45 6.909 8.186 -10.414 1.00 0.00 C ATOM 166 OG SER A 45 7.283 8.932 -9.264 1.00 0.00 O ATOM 0 H SER A 45 7.161 7.165 -12.618 1.00 0.00 H new ATOM 0 HA SER A 45 6.304 9.869 -11.655 1.00 0.00 H new ATOM 0 HB2 SER A 45 5.883 7.832 -10.314 1.00 0.00 H new ATOM 0 HB3 SER A 45 7.542 7.304 -10.511 1.00 0.00 H new ATOM 0 HG SER A 45 7.197 8.369 -8.467 1.00 0.00 H new ATOM 172 N ASP A 46 9.272 9.524 -10.743 1.00 0.00 N ATOM 173 CA ASP A 46 10.615 10.174 -10.775 1.00 0.00 C ATOM 174 C ASP A 46 11.694 9.222 -10.247 1.00 0.00 C ATOM 175 O ASP A 46 12.462 8.657 -11.000 1.00 0.00 O ATOM 176 CB ASP A 46 10.484 11.387 -9.852 1.00 0.00 C ATOM 177 CG ASP A 46 9.871 12.558 -10.624 1.00 0.00 C ATOM 178 OD1 ASP A 46 10.434 12.933 -11.639 1.00 0.00 O ATOM 179 OD2 ASP A 46 8.849 13.059 -10.185 1.00 0.00 O ATOM 0 H ASP A 46 9.095 8.927 -9.935 1.00 0.00 H new ATOM 0 HA ASP A 46 10.909 10.450 -11.788 1.00 0.00 H new ATOM 0 HB2 ASP A 46 9.860 11.138 -8.994 1.00 0.00 H new ATOM 0 HB3 ASP A 46 11.463 11.668 -9.463 1.00 0.00 H new ATOM 184 N GLU A 47 11.764 9.055 -8.954 1.00 0.00 N ATOM 185 CA GLU A 47 12.799 8.155 -8.360 1.00 0.00 C ATOM 186 C GLU A 47 12.216 6.765 -8.128 1.00 0.00 C ATOM 187 O GLU A 47 12.535 6.106 -7.162 1.00 0.00 O ATOM 188 CB GLU A 47 13.172 8.803 -7.025 1.00 0.00 C ATOM 189 CG GLU A 47 13.171 10.324 -7.171 1.00 0.00 C ATOM 190 CD GLU A 47 14.234 10.934 -6.257 1.00 0.00 C ATOM 191 OE1 GLU A 47 15.327 10.395 -6.208 1.00 0.00 O ATOM 192 OE2 GLU A 47 13.937 11.932 -5.621 1.00 0.00 O ATOM 0 H GLU A 47 11.146 9.505 -8.279 1.00 0.00 H new ATOM 0 HA GLU A 47 13.664 8.036 -9.013 1.00 0.00 H new ATOM 0 HB2 GLU A 47 12.463 8.502 -6.253 1.00 0.00 H new ATOM 0 HB3 GLU A 47 14.156 8.460 -6.706 1.00 0.00 H new ATOM 0 HG2 GLU A 47 13.368 10.599 -8.207 1.00 0.00 H new ATOM 0 HG3 GLU A 47 12.189 10.722 -6.917 1.00 0.00 H new ATOM 199 N ILE A 48 11.355 6.318 -8.996 1.00 0.00 N ATOM 200 CA ILE A 48 10.741 4.988 -8.818 1.00 0.00 C ATOM 201 C ILE A 48 11.792 3.918 -8.647 1.00 0.00 C ATOM 202 O ILE A 48 11.920 3.324 -7.601 1.00 0.00 O ATOM 203 CB ILE A 48 9.895 4.745 -10.037 1.00 0.00 C ATOM 204 CG1 ILE A 48 10.418 5.469 -11.280 1.00 0.00 C ATOM 205 CG2 ILE A 48 8.504 5.229 -9.692 1.00 0.00 C ATOM 206 CD1 ILE A 48 9.584 6.721 -11.509 1.00 0.00 C ATOM 0 H ILE A 48 11.052 6.826 -9.827 1.00 0.00 H new ATOM 0 HA ILE A 48 10.133 4.954 -7.914 1.00 0.00 H new ATOM 0 HB ILE A 48 9.912 3.685 -10.289 1.00 0.00 H new ATOM 0 HG12 ILE A 48 11.467 5.734 -11.148 1.00 0.00 H new ATOM 0 HG13 ILE A 48 10.361 4.814 -12.149 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.843 5.076 -10.546 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.126 4.670 -8.836 1.00 0.00 H new ATOM 0 HG23 ILE A 48 8.539 6.290 -9.445 1.00 0.00 H new ATOM 0 HD11 ILE A 48 9.949 7.244 -12.393 1.00 0.00 H new ATOM 0 HD12 ILE A 48 8.541 6.441 -11.657 1.00 0.00 H new ATOM 0 HD13 ILE A 48 9.664 7.375 -10.641 1.00 0.00 H new ATOM 218 N ASP A 49 12.548 3.668 -9.654 1.00 0.00 N ATOM 219 CA ASP A 49 13.611 2.631 -9.523 1.00 0.00 C ATOM 220 C ASP A 49 14.280 2.774 -8.151 1.00 0.00 C ATOM 221 O ASP A 49 14.555 1.805 -7.469 1.00 0.00 O ATOM 222 CB ASP A 49 14.605 2.932 -10.645 1.00 0.00 C ATOM 223 CG ASP A 49 14.871 4.438 -10.701 1.00 0.00 C ATOM 224 OD1 ASP A 49 15.483 4.945 -9.775 1.00 0.00 O ATOM 225 OD2 ASP A 49 14.457 5.058 -11.666 1.00 0.00 O ATOM 0 H ASP A 49 12.488 4.126 -10.563 1.00 0.00 H new ATOM 0 HA ASP A 49 13.226 1.614 -9.598 1.00 0.00 H new ATOM 0 HB2 ASP A 49 15.537 2.393 -10.474 1.00 0.00 H new ATOM 0 HB3 ASP A 49 14.208 2.586 -11.599 1.00 0.00 H new ATOM 230 N ALA A 50 14.506 3.990 -7.734 1.00 0.00 N ATOM 231 CA ALA A 50 15.126 4.223 -6.399 1.00 0.00 C ATOM 232 C ALA A 50 14.112 3.966 -5.290 1.00 0.00 C ATOM 233 O ALA A 50 14.387 3.236 -4.358 1.00 0.00 O ATOM 234 CB ALA A 50 15.569 5.685 -6.407 1.00 0.00 C ATOM 0 H ALA A 50 14.287 4.835 -8.262 1.00 0.00 H new ATOM 0 HA ALA A 50 15.965 3.552 -6.215 1.00 0.00 H new ATOM 0 HB1 ALA A 50 16.036 5.929 -5.453 1.00 0.00 H new ATOM 0 HB2 ALA A 50 16.286 5.844 -7.213 1.00 0.00 H new ATOM 0 HB3 ALA A 50 14.702 6.327 -6.561 1.00 0.00 H new ATOM 240 N ILE A 51 12.940 4.536 -5.363 1.00 0.00 N ATOM 241 CA ILE A 51 11.965 4.282 -4.310 1.00 0.00 C ATOM 242 C ILE A 51 11.437 2.860 -4.439 1.00 0.00 C ATOM 243 O ILE A 51 11.467 2.133 -3.498 1.00 0.00 O ATOM 244 CB ILE A 51 10.901 5.323 -4.529 1.00 0.00 C ATOM 245 CG1 ILE A 51 10.277 5.159 -5.892 1.00 0.00 C ATOM 246 CG2 ILE A 51 11.519 6.718 -4.415 1.00 0.00 C ATOM 247 CD1 ILE A 51 9.762 6.514 -6.398 1.00 0.00 C ATOM 0 H ILE A 51 12.633 5.160 -6.109 1.00 0.00 H new ATOM 0 HA ILE A 51 12.372 4.354 -3.302 1.00 0.00 H new ATOM 0 HB ILE A 51 10.128 5.200 -3.771 1.00 0.00 H new ATOM 0 HG12 ILE A 51 11.010 4.755 -6.591 1.00 0.00 H new ATOM 0 HG13 ILE A 51 9.456 4.444 -5.842 1.00 0.00 H new ATOM 0 HG21 ILE A 51 10.748 7.472 -4.574 1.00 0.00 H new ATOM 0 HG22 ILE A 51 11.951 6.844 -3.422 1.00 0.00 H new ATOM 0 HG23 ILE A 51 12.299 6.833 -5.168 1.00 0.00 H new ATOM 0 HD11 ILE A 51 9.313 6.388 -7.383 1.00 0.00 H new ATOM 0 HD12 ILE A 51 9.015 6.901 -5.705 1.00 0.00 H new ATOM 0 HD13 ILE A 51 10.593 7.217 -6.466 1.00 0.00 H new ATOM 259 N ILE A 52 11.009 2.420 -5.591 1.00 0.00 N ATOM 260 CA ILE A 52 10.555 1.002 -5.683 1.00 0.00 C ATOM 261 C ILE A 52 11.593 0.124 -4.999 1.00 0.00 C ATOM 262 O ILE A 52 11.285 -0.826 -4.319 1.00 0.00 O ATOM 263 CB ILE A 52 10.510 0.681 -7.158 1.00 0.00 C ATOM 264 CG1 ILE A 52 9.465 1.563 -7.846 1.00 0.00 C ATOM 265 CG2 ILE A 52 10.148 -0.795 -7.322 1.00 0.00 C ATOM 266 CD1 ILE A 52 8.076 1.235 -7.299 1.00 0.00 C ATOM 0 H ILE A 52 10.954 2.964 -6.452 1.00 0.00 H new ATOM 0 HA ILE A 52 9.586 0.839 -5.211 1.00 0.00 H new ATOM 0 HB ILE A 52 11.480 0.874 -7.616 1.00 0.00 H new ATOM 0 HG12 ILE A 52 9.694 2.615 -7.677 1.00 0.00 H new ATOM 0 HG13 ILE A 52 9.490 1.401 -8.924 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.111 -1.045 -8.382 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.901 -1.411 -6.830 1.00 0.00 H new ATOM 0 HG23 ILE A 52 9.174 -0.983 -6.871 1.00 0.00 H new ATOM 0 HD11 ILE A 52 7.334 1.864 -7.790 1.00 0.00 H new ATOM 0 HD12 ILE A 52 7.848 0.187 -7.491 1.00 0.00 H new ATOM 0 HD13 ILE A 52 8.055 1.420 -6.225 1.00 0.00 H new ATOM 278 N GLU A 53 12.832 0.455 -5.162 1.00 0.00 N ATOM 279 CA GLU A 53 13.889 -0.343 -4.509 1.00 0.00 C ATOM 280 C GLU A 53 13.764 -0.236 -2.988 1.00 0.00 C ATOM 281 O GLU A 53 13.526 -1.213 -2.307 1.00 0.00 O ATOM 282 CB GLU A 53 15.198 0.277 -4.987 1.00 0.00 C ATOM 283 CG GLU A 53 16.370 -0.312 -4.195 1.00 0.00 C ATOM 284 CD GLU A 53 17.151 0.818 -3.518 1.00 0.00 C ATOM 285 OE1 GLU A 53 16.516 1.708 -2.978 1.00 0.00 O ATOM 286 OE2 GLU A 53 18.369 0.772 -3.550 1.00 0.00 O ATOM 0 H GLU A 53 13.160 1.244 -5.719 1.00 0.00 H new ATOM 0 HA GLU A 53 13.826 -1.402 -4.758 1.00 0.00 H new ATOM 0 HB2 GLU A 53 15.334 0.086 -6.052 1.00 0.00 H new ATOM 0 HB3 GLU A 53 15.167 1.359 -4.858 1.00 0.00 H new ATOM 0 HG2 GLU A 53 16.001 -1.012 -3.446 1.00 0.00 H new ATOM 0 HG3 GLU A 53 17.026 -0.874 -4.860 1.00 0.00 H new ATOM 293 N ASP A 54 13.919 0.945 -2.452 1.00 0.00 N ATOM 294 CA ASP A 54 13.829 1.105 -0.963 1.00 0.00 C ATOM 295 C ASP A 54 12.377 1.146 -0.493 1.00 0.00 C ATOM 296 O ASP A 54 12.086 1.087 0.684 1.00 0.00 O ATOM 297 CB ASP A 54 14.504 2.436 -0.680 1.00 0.00 C ATOM 298 CG ASP A 54 14.501 2.702 0.825 1.00 0.00 C ATOM 299 OD1 ASP A 54 14.695 1.758 1.574 1.00 0.00 O ATOM 300 OD2 ASP A 54 14.303 3.844 1.206 1.00 0.00 O ATOM 0 H ASP A 54 14.103 1.803 -2.972 1.00 0.00 H new ATOM 0 HA ASP A 54 14.297 0.270 -0.441 1.00 0.00 H new ATOM 0 HB2 ASP A 54 15.527 2.423 -1.055 1.00 0.00 H new ATOM 0 HB3 ASP A 54 13.983 3.238 -1.202 1.00 0.00 H new ATOM 305 N ILE A 55 11.477 1.268 -1.408 1.00 0.00 N ATOM 306 CA ILE A 55 10.034 1.342 -1.054 1.00 0.00 C ATOM 307 C ILE A 55 9.329 0.032 -1.401 1.00 0.00 C ATOM 308 O ILE A 55 8.378 -0.369 -0.760 1.00 0.00 O ATOM 309 CB ILE A 55 9.503 2.505 -1.905 1.00 0.00 C ATOM 310 CG1 ILE A 55 8.380 3.223 -1.180 1.00 0.00 C ATOM 311 CG2 ILE A 55 8.948 1.983 -3.213 1.00 0.00 C ATOM 312 CD1 ILE A 55 8.926 3.897 0.080 1.00 0.00 C ATOM 0 H ILE A 55 11.675 1.321 -2.407 1.00 0.00 H new ATOM 0 HA ILE A 55 9.864 1.499 0.011 1.00 0.00 H new ATOM 0 HB ILE A 55 10.331 3.190 -2.088 1.00 0.00 H new ATOM 0 HG12 ILE A 55 7.929 3.968 -1.836 1.00 0.00 H new ATOM 0 HG13 ILE A 55 7.595 2.515 -0.914 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.574 2.816 -3.808 1.00 0.00 H new ATOM 0 HG22 ILE A 55 9.736 1.469 -3.763 1.00 0.00 H new ATOM 0 HG23 ILE A 55 8.133 1.288 -3.011 1.00 0.00 H new ATOM 0 HD11 ILE A 55 8.116 4.411 0.597 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.356 3.143 0.739 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.695 4.618 -0.197 1.00 0.00 H new ATOM 324 N VAL A 56 9.763 -0.609 -2.446 1.00 0.00 N ATOM 325 CA VAL A 56 9.093 -1.857 -2.879 1.00 0.00 C ATOM 326 C VAL A 56 10.027 -3.077 -2.819 1.00 0.00 C ATOM 327 O VAL A 56 9.635 -4.128 -2.351 1.00 0.00 O ATOM 328 CB VAL A 56 8.638 -1.539 -4.300 1.00 0.00 C ATOM 329 CG1 VAL A 56 8.450 -2.827 -5.090 1.00 0.00 C ATOM 330 CG2 VAL A 56 7.313 -0.781 -4.222 1.00 0.00 C ATOM 0 H VAL A 56 10.556 -0.320 -3.019 1.00 0.00 H new ATOM 0 HA VAL A 56 8.266 -2.137 -2.227 1.00 0.00 H new ATOM 0 HB VAL A 56 9.390 -0.932 -4.804 1.00 0.00 H new ATOM 0 HG11 VAL A 56 8.125 -2.589 -6.103 1.00 0.00 H new ATOM 0 HG12 VAL A 56 9.394 -3.370 -5.130 1.00 0.00 H new ATOM 0 HG13 VAL A 56 7.696 -3.446 -4.603 1.00 0.00 H new ATOM 0 HG21 VAL A 56 6.970 -0.544 -5.229 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.569 -1.400 -3.721 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.454 0.142 -3.660 1.00 0.00 H new ATOM 340 N LEU A 57 11.249 -2.974 -3.278 1.00 0.00 N ATOM 341 CA LEU A 57 12.137 -4.172 -3.208 1.00 0.00 C ATOM 342 C LEU A 57 12.322 -4.554 -1.742 1.00 0.00 C ATOM 343 O LEU A 57 12.297 -5.713 -1.378 1.00 0.00 O ATOM 344 CB LEU A 57 13.465 -3.759 -3.854 1.00 0.00 C ATOM 345 CG LEU A 57 14.588 -4.675 -3.360 1.00 0.00 C ATOM 346 CD1 LEU A 57 15.743 -4.658 -4.363 1.00 0.00 C ATOM 347 CD2 LEU A 57 15.089 -4.178 -2.001 1.00 0.00 C ATOM 0 H LEU A 57 11.661 -2.136 -3.688 1.00 0.00 H new ATOM 0 HA LEU A 57 11.724 -5.037 -3.727 1.00 0.00 H new ATOM 0 HB2 LEU A 57 13.386 -3.818 -4.940 1.00 0.00 H new ATOM 0 HB3 LEU A 57 13.693 -2.722 -3.607 1.00 0.00 H new ATOM 0 HG LEU A 57 14.208 -5.692 -3.261 1.00 0.00 H new ATOM 0 HD11 LEU A 57 16.541 -5.311 -4.010 1.00 0.00 H new ATOM 0 HD12 LEU A 57 15.389 -5.010 -5.332 1.00 0.00 H new ATOM 0 HD13 LEU A 57 16.123 -3.641 -4.463 1.00 0.00 H new ATOM 0 HD21 LEU A 57 15.889 -4.829 -1.648 1.00 0.00 H new ATOM 0 HD22 LEU A 57 15.467 -3.161 -2.103 1.00 0.00 H new ATOM 0 HD23 LEU A 57 14.268 -4.190 -1.284 1.00 0.00 H new ATOM 359 N LYS A 58 12.485 -3.579 -0.900 1.00 0.00 N ATOM 360 CA LYS A 58 12.646 -3.859 0.552 1.00 0.00 C ATOM 361 C LYS A 58 11.279 -3.809 1.234 1.00 0.00 C ATOM 362 O LYS A 58 10.948 -4.641 2.055 1.00 0.00 O ATOM 363 CB LYS A 58 13.539 -2.736 1.072 1.00 0.00 C ATOM 364 CG LYS A 58 14.992 -3.212 1.098 1.00 0.00 C ATOM 365 CD LYS A 58 15.694 -2.651 2.337 1.00 0.00 C ATOM 366 CE LYS A 58 15.318 -3.485 3.563 1.00 0.00 C ATOM 367 NZ LYS A 58 15.861 -2.724 4.724 1.00 0.00 N ATOM 0 H LYS A 58 12.514 -2.592 -1.155 1.00 0.00 H new ATOM 0 HA LYS A 58 13.075 -4.842 0.746 1.00 0.00 H new ATOM 0 HB2 LYS A 58 13.444 -1.857 0.435 1.00 0.00 H new ATOM 0 HB3 LYS A 58 13.224 -2.440 2.073 1.00 0.00 H new ATOM 0 HG2 LYS A 58 15.028 -4.301 1.109 1.00 0.00 H new ATOM 0 HG3 LYS A 58 15.509 -2.885 0.196 1.00 0.00 H new ATOM 0 HD2 LYS A 58 16.774 -2.665 2.193 1.00 0.00 H new ATOM 0 HD3 LYS A 58 15.406 -1.611 2.490 1.00 0.00 H new ATOM 0 HE2 LYS A 58 14.238 -3.608 3.641 1.00 0.00 H new ATOM 0 HE3 LYS A 58 15.750 -4.484 3.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 15.643 -3.232 5.605 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 16.892 -2.628 4.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 15.427 -1.779 4.753 1.00 0.00 H new ATOM 381 N GLY A 59 10.482 -2.833 0.894 1.00 0.00 N ATOM 382 CA GLY A 59 9.131 -2.713 1.513 1.00 0.00 C ATOM 383 C GLY A 59 8.187 -3.764 0.917 1.00 0.00 C ATOM 384 O GLY A 59 7.527 -4.489 1.633 1.00 0.00 O ATOM 0 H GLY A 59 10.709 -2.110 0.211 1.00 0.00 H new ATOM 0 HA2 GLY A 59 9.203 -2.847 2.592 1.00 0.00 H new ATOM 0 HA3 GLY A 59 8.731 -1.714 1.342 1.00 0.00 H new ATOM 388 N GLY A 60 8.110 -3.849 -0.386 1.00 0.00 N ATOM 389 CA GLY A 60 7.198 -4.852 -1.010 1.00 0.00 C ATOM 390 C GLY A 60 7.734 -6.266 -0.764 1.00 0.00 C ATOM 391 O GLY A 60 7.076 -7.085 -0.161 1.00 0.00 O ATOM 0 H GLY A 60 8.636 -3.271 -1.041 1.00 0.00 H new ATOM 0 HA2 GLY A 60 6.196 -4.755 -0.592 1.00 0.00 H new ATOM 0 HA3 GLY A 60 7.116 -4.666 -2.081 1.00 0.00 H new ATOM 395 N LYS A 61 8.923 -6.551 -1.229 1.00 0.00 N ATOM 396 CA LYS A 61 9.525 -7.912 -1.046 1.00 0.00 C ATOM 397 C LYS A 61 9.797 -8.246 0.433 1.00 0.00 C ATOM 398 O LYS A 61 10.443 -9.230 0.735 1.00 0.00 O ATOM 399 CB LYS A 61 10.843 -7.854 -1.818 1.00 0.00 C ATOM 400 CG LYS A 61 11.061 -9.174 -2.563 1.00 0.00 C ATOM 401 CD LYS A 61 12.333 -9.849 -2.041 1.00 0.00 C ATOM 402 CE LYS A 61 13.311 -10.066 -3.199 1.00 0.00 C ATOM 403 NZ LYS A 61 14.581 -9.429 -2.753 1.00 0.00 N ATOM 0 H LYS A 61 9.513 -5.891 -1.735 1.00 0.00 H new ATOM 0 HA LYS A 61 8.846 -8.688 -1.401 1.00 0.00 H new ATOM 0 HB2 LYS A 61 10.826 -7.024 -2.525 1.00 0.00 H new ATOM 0 HB3 LYS A 61 11.670 -7.671 -1.132 1.00 0.00 H new ATOM 0 HG2 LYS A 61 10.203 -9.831 -2.420 1.00 0.00 H new ATOM 0 HG3 LYS A 61 11.147 -8.990 -3.634 1.00 0.00 H new ATOM 0 HD2 LYS A 61 12.796 -9.231 -1.272 1.00 0.00 H new ATOM 0 HD3 LYS A 61 12.086 -10.804 -1.576 1.00 0.00 H new ATOM 0 HE2 LYS A 61 13.452 -11.127 -3.403 1.00 0.00 H new ATOM 0 HE3 LYS A 61 12.942 -9.611 -4.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 15.302 -9.536 -3.495 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 14.418 -8.418 -2.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 14.911 -9.888 -1.880 1.00 0.00 H new ATOM 417 N ALA A 62 9.316 -7.461 1.358 1.00 0.00 N ATOM 418 CA ALA A 62 9.559 -7.771 2.786 1.00 0.00 C ATOM 419 C ALA A 62 9.183 -9.226 3.040 1.00 0.00 C ATOM 420 O ALA A 62 10.012 -10.061 3.347 1.00 0.00 O ATOM 421 CB ALA A 62 8.633 -6.832 3.559 1.00 0.00 C ATOM 0 H ALA A 62 8.766 -6.620 1.182 1.00 0.00 H new ATOM 0 HA ALA A 62 10.599 -7.637 3.084 1.00 0.00 H new ATOM 0 HB1 ALA A 62 8.754 -7.001 4.629 1.00 0.00 H new ATOM 0 HB2 ALA A 62 8.885 -5.798 3.324 1.00 0.00 H new ATOM 0 HB3 ALA A 62 7.599 -7.027 3.276 1.00 0.00 H new ATOM 427 N LYS A 63 7.932 -9.526 2.873 1.00 0.00 N ATOM 428 CA LYS A 63 7.446 -10.924 3.049 1.00 0.00 C ATOM 429 C LYS A 63 7.301 -11.537 1.661 1.00 0.00 C ATOM 430 O LYS A 63 7.223 -12.737 1.484 1.00 0.00 O ATOM 431 CB LYS A 63 6.068 -10.814 3.713 1.00 0.00 C ATOM 432 CG LYS A 63 6.029 -9.637 4.694 1.00 0.00 C ATOM 433 CD LYS A 63 4.575 -9.229 4.929 1.00 0.00 C ATOM 434 CE LYS A 63 4.066 -8.465 3.706 1.00 0.00 C ATOM 435 NZ LYS A 63 2.798 -7.825 4.151 1.00 0.00 N ATOM 0 H LYS A 63 7.210 -8.853 2.617 1.00 0.00 H new ATOM 0 HA LYS A 63 8.119 -11.536 3.649 1.00 0.00 H new ATOM 0 HB2 LYS A 63 5.301 -10.683 2.950 1.00 0.00 H new ATOM 0 HB3 LYS A 63 5.838 -11.740 4.240 1.00 0.00 H new ATOM 0 HG2 LYS A 63 6.498 -9.918 5.637 1.00 0.00 H new ATOM 0 HG3 LYS A 63 6.596 -8.796 4.295 1.00 0.00 H new ATOM 0 HD2 LYS A 63 3.960 -10.112 5.104 1.00 0.00 H new ATOM 0 HD3 LYS A 63 4.499 -8.606 5.820 1.00 0.00 H new ATOM 0 HE2 LYS A 63 4.790 -7.719 3.377 1.00 0.00 H new ATOM 0 HE3 LYS A 63 3.895 -9.136 2.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 2.389 -7.282 3.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 2.126 -8.559 4.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 2.993 -7.186 4.948 1.00 0.00 H new ATOM 449 N ASN A 64 7.257 -10.684 0.680 1.00 0.00 N ATOM 450 CA ASN A 64 7.106 -11.128 -0.732 1.00 0.00 C ATOM 451 C ASN A 64 8.361 -11.871 -1.203 1.00 0.00 C ATOM 452 O ASN A 64 9.473 -11.473 -0.925 1.00 0.00 O ATOM 453 CB ASN A 64 6.922 -9.818 -1.496 1.00 0.00 C ATOM 454 CG ASN A 64 5.491 -9.732 -2.031 1.00 0.00 C ATOM 455 OD1 ASN A 64 5.005 -10.658 -2.649 1.00 0.00 O ATOM 456 ND2 ASN A 64 4.791 -8.651 -1.816 1.00 0.00 N ATOM 0 H ASN A 64 7.321 -9.673 0.800 1.00 0.00 H new ATOM 0 HA ASN A 64 6.279 -11.822 -0.878 1.00 0.00 H new ATOM 0 HB2 ASN A 64 7.127 -8.971 -0.841 1.00 0.00 H new ATOM 0 HB3 ASN A 64 7.633 -9.763 -2.320 1.00 0.00 H new ATOM 0 HD21 ASN A 64 3.836 -8.584 -2.167 1.00 0.00 H new ATOM 0 HD22 ASN A 64 5.199 -7.874 -1.297 1.00 0.00 H new ATOM 463 N PRO A 65 8.113 -12.949 -1.891 1.00 0.00 N ATOM 464 CA PRO A 65 9.192 -13.823 -2.426 1.00 0.00 C ATOM 465 C PRO A 65 10.093 -13.095 -3.434 1.00 0.00 C ATOM 466 O PRO A 65 11.298 -13.238 -3.404 1.00 0.00 O ATOM 467 CB PRO A 65 8.400 -14.944 -3.103 1.00 0.00 C ATOM 468 CG PRO A 65 7.090 -14.327 -3.419 1.00 0.00 C ATOM 469 CD PRO A 65 6.793 -13.469 -2.249 1.00 0.00 C ATOM 0 HA PRO A 65 9.878 -14.167 -1.652 1.00 0.00 H new ATOM 0 HB2 PRO A 65 8.901 -15.297 -4.004 1.00 0.00 H new ATOM 0 HB3 PRO A 65 8.286 -15.805 -2.444 1.00 0.00 H new ATOM 0 HG2 PRO A 65 7.138 -13.743 -4.338 1.00 0.00 H new ATOM 0 HG3 PRO A 65 6.319 -15.084 -3.562 1.00 0.00 H new ATOM 0 HD2 PRO A 65 6.096 -12.669 -2.500 1.00 0.00 H new ATOM 0 HD3 PRO A 65 6.346 -14.037 -1.433 1.00 0.00 H new ATOM 477 N SER A 66 9.537 -12.321 -4.328 1.00 0.00 N ATOM 478 CA SER A 66 10.391 -11.611 -5.315 1.00 0.00 C ATOM 479 C SER A 66 9.534 -10.795 -6.251 1.00 0.00 C ATOM 480 O SER A 66 8.731 -11.290 -7.017 1.00 0.00 O ATOM 481 CB SER A 66 11.162 -12.694 -6.063 1.00 0.00 C ATOM 482 OG SER A 66 12.496 -12.746 -5.573 1.00 0.00 O ATOM 0 H SER A 66 8.535 -12.152 -4.415 1.00 0.00 H new ATOM 0 HA SER A 66 11.077 -10.914 -4.834 1.00 0.00 H new ATOM 0 HB2 SER A 66 10.676 -13.660 -5.930 1.00 0.00 H new ATOM 0 HB3 SER A 66 11.163 -12.483 -7.132 1.00 0.00 H new ATOM 0 HG SER A 66 12.484 -12.943 -4.613 1.00 0.00 H new ATOM 488 N ILE A 67 9.687 -9.533 -6.121 1.00 0.00 N ATOM 489 CA ILE A 67 8.909 -8.567 -6.887 1.00 0.00 C ATOM 490 C ILE A 67 9.716 -7.993 -8.054 1.00 0.00 C ATOM 491 O ILE A 67 10.918 -7.834 -7.975 1.00 0.00 O ATOM 492 CB ILE A 67 8.630 -7.525 -5.816 1.00 0.00 C ATOM 493 CG1 ILE A 67 7.407 -7.962 -5.005 1.00 0.00 C ATOM 494 CG2 ILE A 67 8.386 -6.150 -6.444 1.00 0.00 C ATOM 495 CD1 ILE A 67 7.541 -9.451 -4.657 1.00 0.00 C ATOM 0 H ILE A 67 10.357 -9.110 -5.479 1.00 0.00 H new ATOM 0 HA ILE A 67 8.016 -8.972 -7.363 1.00 0.00 H new ATOM 0 HB ILE A 67 9.497 -7.443 -5.161 1.00 0.00 H new ATOM 0 HG12 ILE A 67 7.328 -7.369 -4.094 1.00 0.00 H new ATOM 0 HG13 ILE A 67 6.495 -7.790 -5.577 1.00 0.00 H new ATOM 0 HG21 ILE A 67 8.189 -5.421 -5.658 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.268 -5.846 -7.008 1.00 0.00 H new ATOM 0 HG23 ILE A 67 7.528 -6.203 -7.114 1.00 0.00 H new ATOM 0 HD11 ILE A 67 6.673 -9.769 -4.079 1.00 0.00 H new ATOM 0 HD12 ILE A 67 7.600 -10.035 -5.575 1.00 0.00 H new ATOM 0 HD13 ILE A 67 8.445 -9.607 -4.069 1.00 0.00 H new ATOM 507 N VAL A 68 9.058 -7.671 -9.131 1.00 0.00 N ATOM 508 CA VAL A 68 9.783 -7.096 -10.299 1.00 0.00 C ATOM 509 C VAL A 68 9.406 -5.622 -10.485 1.00 0.00 C ATOM 510 O VAL A 68 8.326 -5.201 -10.122 1.00 0.00 O ATOM 511 CB VAL A 68 9.340 -7.930 -11.509 1.00 0.00 C ATOM 512 CG1 VAL A 68 8.017 -7.395 -12.061 1.00 0.00 C ATOM 513 CG2 VAL A 68 10.409 -7.843 -12.601 1.00 0.00 C ATOM 0 H VAL A 68 8.051 -7.780 -9.254 1.00 0.00 H new ATOM 0 HA VAL A 68 10.864 -7.130 -10.166 1.00 0.00 H new ATOM 0 HB VAL A 68 9.207 -8.966 -11.197 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.712 -7.994 -12.919 1.00 0.00 H new ATOM 0 HG12 VAL A 68 7.251 -7.452 -11.288 1.00 0.00 H new ATOM 0 HG13 VAL A 68 8.145 -6.357 -12.370 1.00 0.00 H new ATOM 0 HG21 VAL A 68 10.098 -8.434 -13.462 1.00 0.00 H new ATOM 0 HG22 VAL A 68 10.538 -6.803 -12.902 1.00 0.00 H new ATOM 0 HG23 VAL A 68 11.353 -8.229 -12.217 1.00 0.00 H new ATOM 523 N VAL A 69 10.278 -4.841 -11.060 1.00 0.00 N ATOM 524 CA VAL A 69 9.949 -3.406 -11.279 1.00 0.00 C ATOM 525 C VAL A 69 9.954 -3.101 -12.780 1.00 0.00 C ATOM 526 O VAL A 69 10.990 -3.007 -13.405 1.00 0.00 O ATOM 527 CB VAL A 69 11.041 -2.615 -10.558 1.00 0.00 C ATOM 528 CG1 VAL A 69 10.800 -1.115 -10.754 1.00 0.00 C ATOM 529 CG2 VAL A 69 11.006 -2.942 -9.062 1.00 0.00 C ATOM 0 H VAL A 69 11.199 -5.133 -11.386 1.00 0.00 H new ATOM 0 HA VAL A 69 8.961 -3.145 -10.899 1.00 0.00 H new ATOM 0 HB VAL A 69 12.014 -2.885 -10.968 1.00 0.00 H new ATOM 0 HG11 VAL A 69 11.578 -0.551 -10.240 1.00 0.00 H new ATOM 0 HG12 VAL A 69 10.823 -0.879 -11.818 1.00 0.00 H new ATOM 0 HG13 VAL A 69 9.827 -0.846 -10.344 1.00 0.00 H new ATOM 0 HG21 VAL A 69 11.784 -2.378 -8.548 1.00 0.00 H new ATOM 0 HG22 VAL A 69 10.032 -2.672 -8.653 1.00 0.00 H new ATOM 0 HG23 VAL A 69 11.176 -4.009 -8.919 1.00 0.00 H new ATOM 539 N GLU A 70 8.796 -2.959 -13.359 1.00 0.00 N ATOM 540 CA GLU A 70 8.707 -2.674 -14.820 1.00 0.00 C ATOM 541 C GLU A 70 8.859 -1.174 -15.090 1.00 0.00 C ATOM 542 O GLU A 70 7.941 -0.528 -15.554 1.00 0.00 O ATOM 543 CB GLU A 70 7.305 -3.125 -15.226 1.00 0.00 C ATOM 544 CG GLU A 70 6.960 -4.459 -14.565 1.00 0.00 C ATOM 545 CD GLU A 70 8.111 -5.445 -14.772 1.00 0.00 C ATOM 546 OE1 GLU A 70 9.191 -5.178 -14.270 1.00 0.00 O ATOM 547 OE2 GLU A 70 7.893 -6.449 -15.428 1.00 0.00 O ATOM 0 H GLU A 70 7.898 -3.029 -12.880 1.00 0.00 H new ATOM 0 HA GLU A 70 9.493 -3.185 -15.377 1.00 0.00 H new ATOM 0 HB2 GLU A 70 6.575 -2.369 -14.936 1.00 0.00 H new ATOM 0 HB3 GLU A 70 7.248 -3.224 -16.310 1.00 0.00 H new ATOM 0 HG2 GLU A 70 6.779 -4.313 -13.500 1.00 0.00 H new ATOM 0 HG3 GLU A 70 6.041 -4.861 -14.992 1.00 0.00 H new ATOM 554 N ASP A 71 10.001 -0.612 -14.812 1.00 0.00 N ATOM 555 CA ASP A 71 10.183 0.847 -15.067 1.00 0.00 C ATOM 556 C ASP A 71 10.766 1.072 -16.465 1.00 0.00 C ATOM 557 O ASP A 71 11.865 0.650 -16.764 1.00 0.00 O ATOM 558 CB ASP A 71 11.163 1.320 -13.993 1.00 0.00 C ATOM 559 CG ASP A 71 10.531 2.460 -13.190 1.00 0.00 C ATOM 560 OD1 ASP A 71 10.095 3.420 -13.805 1.00 0.00 O ATOM 561 OD2 ASP A 71 10.494 2.354 -11.975 1.00 0.00 O ATOM 0 H ASP A 71 10.812 -1.093 -14.422 1.00 0.00 H new ATOM 0 HA ASP A 71 9.241 1.393 -15.026 1.00 0.00 H new ATOM 0 HB2 ASP A 71 11.420 0.493 -13.331 1.00 0.00 H new ATOM 0 HB3 ASP A 71 12.091 1.658 -14.455 1.00 0.00 H new ATOM 566 N LYS A 72 10.038 1.736 -17.325 1.00 0.00 N ATOM 567 CA LYS A 72 10.557 1.988 -18.701 1.00 0.00 C ATOM 568 C LYS A 72 10.049 3.336 -19.218 1.00 0.00 C ATOM 569 O LYS A 72 8.931 3.732 -18.955 1.00 0.00 O ATOM 570 CB LYS A 72 10.003 0.844 -19.554 1.00 0.00 C ATOM 571 CG LYS A 72 10.765 0.781 -20.881 1.00 0.00 C ATOM 572 CD LYS A 72 9.952 -0.017 -21.901 1.00 0.00 C ATOM 573 CE LYS A 72 10.871 -0.998 -22.632 1.00 0.00 C ATOM 574 NZ LYS A 72 10.110 -2.277 -22.680 1.00 0.00 N ATOM 0 H LYS A 72 9.110 2.113 -17.134 1.00 0.00 H new ATOM 0 HA LYS A 72 11.646 2.025 -18.729 1.00 0.00 H new ATOM 0 HB2 LYS A 72 10.101 -0.102 -19.021 1.00 0.00 H new ATOM 0 HB3 LYS A 72 8.940 0.997 -19.740 1.00 0.00 H new ATOM 0 HG2 LYS A 72 10.949 1.788 -21.255 1.00 0.00 H new ATOM 0 HG3 LYS A 72 11.739 0.314 -20.731 1.00 0.00 H new ATOM 0 HD2 LYS A 72 9.150 -0.559 -21.399 1.00 0.00 H new ATOM 0 HD3 LYS A 72 9.482 0.659 -22.616 1.00 0.00 H new ATOM 0 HE2 LYS A 72 11.110 -0.643 -23.635 1.00 0.00 H new ATOM 0 HE3 LYS A 72 11.817 -1.121 -22.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 10.677 -3.000 -23.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 9.903 -2.594 -21.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 9.218 -2.131 -23.195 1.00 0.00 H new ATOM 588 N ALA A 73 10.863 4.044 -19.955 1.00 0.00 N ATOM 589 CA ALA A 73 10.426 5.365 -20.492 1.00 0.00 C ATOM 590 C ALA A 73 8.993 5.267 -21.020 1.00 0.00 C ATOM 591 O ALA A 73 8.761 4.855 -22.139 1.00 0.00 O ATOM 592 CB ALA A 73 11.400 5.670 -21.631 1.00 0.00 C ATOM 0 H ALA A 73 11.811 3.765 -20.208 1.00 0.00 H new ATOM 0 HA ALA A 73 10.433 6.146 -19.732 1.00 0.00 H new ATOM 0 HB1 ALA A 73 11.145 6.630 -22.080 1.00 0.00 H new ATOM 0 HB2 ALA A 73 12.416 5.711 -21.239 1.00 0.00 H new ATOM 0 HB3 ALA A 73 11.334 4.887 -22.386 1.00 0.00 H new ATOM 598 N GLY A 74 8.031 5.638 -20.221 1.00 0.00 N ATOM 599 CA GLY A 74 6.615 5.559 -20.676 1.00 0.00 C ATOM 600 C GLY A 74 5.708 5.350 -19.472 1.00 0.00 C ATOM 601 O GLY A 74 4.808 6.122 -19.206 1.00 0.00 O ATOM 0 H GLY A 74 8.164 5.992 -19.274 1.00 0.00 H new ATOM 0 HA2 GLY A 74 6.338 6.474 -21.199 1.00 0.00 H new ATOM 0 HA3 GLY A 74 6.494 4.738 -21.383 1.00 0.00 H new ATOM 605 N PHE A 75 5.944 4.300 -18.753 1.00 0.00 N ATOM 606 CA PHE A 75 5.106 4.000 -17.555 1.00 0.00 C ATOM 607 C PHE A 75 5.974 3.453 -16.418 1.00 0.00 C ATOM 608 O PHE A 75 7.093 3.024 -16.621 1.00 0.00 O ATOM 609 CB PHE A 75 4.099 2.936 -18.015 1.00 0.00 C ATOM 610 CG PHE A 75 4.768 1.965 -18.961 1.00 0.00 C ATOM 611 CD1 PHE A 75 5.713 1.055 -18.474 1.00 0.00 C ATOM 612 CD2 PHE A 75 4.444 1.978 -20.321 1.00 0.00 C ATOM 613 CE1 PHE A 75 6.335 0.157 -19.349 1.00 0.00 C ATOM 614 CE2 PHE A 75 5.067 1.080 -21.198 1.00 0.00 C ATOM 615 CZ PHE A 75 6.012 0.169 -20.711 1.00 0.00 C ATOM 0 H PHE A 75 6.686 3.626 -18.939 1.00 0.00 H new ATOM 0 HA PHE A 75 4.609 4.893 -17.176 1.00 0.00 H new ATOM 0 HB2 PHE A 75 3.703 2.401 -17.152 1.00 0.00 H new ATOM 0 HB3 PHE A 75 3.253 3.414 -18.509 1.00 0.00 H new ATOM 0 HD1 PHE A 75 5.962 1.046 -17.423 1.00 0.00 H new ATOM 0 HD2 PHE A 75 3.714 2.680 -20.696 1.00 0.00 H new ATOM 0 HE1 PHE A 75 7.064 -0.545 -18.973 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.818 1.091 -22.249 1.00 0.00 H new ATOM 0 HZ PHE A 75 6.492 -0.524 -21.386 1.00 0.00 H new ATOM 625 N TRP A 76 5.456 3.469 -15.225 1.00 0.00 N ATOM 626 CA TRP A 76 6.220 2.959 -14.051 1.00 0.00 C ATOM 627 C TRP A 76 5.461 1.769 -13.451 1.00 0.00 C ATOM 628 O TRP A 76 4.798 1.882 -12.440 1.00 0.00 O ATOM 629 CB TRP A 76 6.266 4.167 -13.104 1.00 0.00 C ATOM 630 CG TRP A 76 6.451 3.753 -11.692 1.00 0.00 C ATOM 631 CD1 TRP A 76 7.332 2.838 -11.257 1.00 0.00 C ATOM 632 CD2 TRP A 76 5.779 4.272 -10.512 1.00 0.00 C ATOM 633 NE1 TRP A 76 7.230 2.740 -9.893 1.00 0.00 N ATOM 634 CE2 TRP A 76 6.273 3.597 -9.381 1.00 0.00 C ATOM 635 CE3 TRP A 76 4.792 5.244 -10.324 1.00 0.00 C ATOM 636 CZ2 TRP A 76 5.801 3.877 -8.098 1.00 0.00 C ATOM 637 CZ3 TRP A 76 4.310 5.536 -9.041 1.00 0.00 C ATOM 638 CH2 TRP A 76 4.811 4.850 -7.926 1.00 0.00 C ATOM 0 H TRP A 76 4.523 3.818 -15.008 1.00 0.00 H new ATOM 0 HA TRP A 76 7.223 2.597 -14.277 1.00 0.00 H new ATOM 0 HB2 TRP A 76 7.080 4.829 -13.398 1.00 0.00 H new ATOM 0 HB3 TRP A 76 5.342 4.738 -13.197 1.00 0.00 H new ATOM 0 HD1 TRP A 76 8.010 2.272 -11.879 1.00 0.00 H new ATOM 0 HE1 TRP A 76 7.794 2.109 -9.323 1.00 0.00 H new ATOM 0 HE3 TRP A 76 4.397 5.776 -11.177 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 6.197 3.347 -7.245 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 3.550 6.292 -8.911 1.00 0.00 H new ATOM 0 HH2 TRP A 76 4.434 5.072 -6.938 1.00 0.00 H new ATOM 649 N TRP A 77 5.534 0.632 -14.102 1.00 0.00 N ATOM 650 CA TRP A 77 4.798 -0.573 -13.614 1.00 0.00 C ATOM 651 C TRP A 77 5.693 -1.476 -12.766 1.00 0.00 C ATOM 652 O TRP A 77 6.879 -1.577 -12.989 1.00 0.00 O ATOM 653 CB TRP A 77 4.395 -1.323 -14.889 1.00 0.00 C ATOM 654 CG TRP A 77 3.295 -0.594 -15.585 1.00 0.00 C ATOM 655 CD1 TRP A 77 3.072 0.736 -15.502 1.00 0.00 C ATOM 656 CD2 TRP A 77 2.267 -1.128 -16.471 1.00 0.00 C ATOM 657 NE1 TRP A 77 1.970 1.051 -16.275 1.00 0.00 N ATOM 658 CE2 TRP A 77 1.441 -0.062 -16.892 1.00 0.00 C ATOM 659 CE3 TRP A 77 1.974 -2.422 -16.943 1.00 0.00 C ATOM 660 CZ2 TRP A 77 0.360 -0.267 -17.750 1.00 0.00 C ATOM 661 CZ3 TRP A 77 0.885 -2.633 -17.807 1.00 0.00 C ATOM 662 CH2 TRP A 77 0.080 -1.557 -18.210 1.00 0.00 C ATOM 0 H TRP A 77 6.075 0.489 -14.955 1.00 0.00 H new ATOM 0 HA TRP A 77 3.952 -0.289 -12.988 1.00 0.00 H new ATOM 0 HB2 TRP A 77 5.255 -1.418 -15.552 1.00 0.00 H new ATOM 0 HB3 TRP A 77 4.071 -2.333 -14.639 1.00 0.00 H new ATOM 0 HD1 TRP A 77 3.658 1.437 -14.927 1.00 0.00 H new ATOM 0 HE1 TRP A 77 1.594 1.994 -16.376 1.00 0.00 H new ATOM 0 HE3 TRP A 77 2.589 -3.257 -16.640 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 -0.256 0.565 -18.057 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 0.667 -3.629 -18.162 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -0.755 -1.725 -18.875 1.00 0.00 H new ATOM 673 N ILE A 78 5.116 -2.159 -11.815 1.00 0.00 N ATOM 674 CA ILE A 78 5.907 -3.093 -10.969 1.00 0.00 C ATOM 675 C ILE A 78 5.027 -4.281 -10.575 1.00 0.00 C ATOM 676 O ILE A 78 3.912 -4.120 -10.123 1.00 0.00 O ATOM 677 CB ILE A 78 6.337 -2.283 -9.749 1.00 0.00 C ATOM 678 CG1 ILE A 78 7.555 -1.441 -10.128 1.00 0.00 C ATOM 679 CG2 ILE A 78 6.714 -3.233 -8.611 1.00 0.00 C ATOM 680 CD1 ILE A 78 7.174 0.034 -10.148 1.00 0.00 C ATOM 0 H ILE A 78 4.123 -2.108 -11.587 1.00 0.00 H new ATOM 0 HA ILE A 78 6.778 -3.496 -11.485 1.00 0.00 H new ATOM 0 HB ILE A 78 5.520 -1.639 -9.424 1.00 0.00 H new ATOM 0 HG12 ILE A 78 8.361 -1.609 -9.414 1.00 0.00 H new ATOM 0 HG13 ILE A 78 7.928 -1.743 -11.107 1.00 0.00 H new ATOM 0 HG21 ILE A 78 7.021 -2.654 -7.740 1.00 0.00 H new ATOM 0 HG22 ILE A 78 5.853 -3.850 -8.352 1.00 0.00 H new ATOM 0 HG23 ILE A 78 7.537 -3.873 -8.929 1.00 0.00 H new ATOM 0 HD11 ILE A 78 8.045 0.631 -10.419 1.00 0.00 H new ATOM 0 HD12 ILE A 78 6.382 0.195 -10.879 1.00 0.00 H new ATOM 0 HD13 ILE A 78 6.822 0.332 -9.160 1.00 0.00 H new ATOM 692 N LYS A 79 5.517 -5.475 -10.761 1.00 0.00 N ATOM 693 CA LYS A 79 4.705 -6.676 -10.417 1.00 0.00 C ATOM 694 C LYS A 79 5.060 -7.180 -9.018 1.00 0.00 C ATOM 695 O LYS A 79 6.104 -6.879 -8.479 1.00 0.00 O ATOM 696 CB LYS A 79 5.021 -7.694 -11.536 1.00 0.00 C ATOM 697 CG LYS A 79 5.613 -9.002 -10.990 1.00 0.00 C ATOM 698 CD LYS A 79 4.755 -10.183 -11.452 1.00 0.00 C ATOM 699 CE LYS A 79 5.017 -10.458 -12.934 1.00 0.00 C ATOM 700 NZ LYS A 79 4.081 -11.560 -13.300 1.00 0.00 N ATOM 0 H LYS A 79 6.445 -5.671 -11.136 1.00 0.00 H new ATOM 0 HA LYS A 79 3.634 -6.477 -10.374 1.00 0.00 H new ATOM 0 HB2 LYS A 79 4.109 -7.915 -12.090 1.00 0.00 H new ATOM 0 HB3 LYS A 79 5.722 -7.248 -12.241 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.638 -9.124 -11.341 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.650 -8.970 -9.901 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.988 -11.068 -10.861 1.00 0.00 H new ATOM 0 HD3 LYS A 79 3.699 -9.963 -11.294 1.00 0.00 H new ATOM 0 HE2 LYS A 79 4.834 -9.569 -13.538 1.00 0.00 H new ATOM 0 HE3 LYS A 79 6.054 -10.750 -13.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 4.205 -11.802 -14.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 4.283 -12.396 -12.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 3.101 -11.252 -13.136 1.00 0.00 H new ATOM 714 N ALA A 80 4.191 -7.958 -8.435 1.00 0.00 N ATOM 715 CA ALA A 80 4.464 -8.501 -7.078 1.00 0.00 C ATOM 716 C ALA A 80 3.779 -9.861 -6.913 1.00 0.00 C ATOM 717 O ALA A 80 2.678 -10.072 -7.383 1.00 0.00 O ATOM 718 CB ALA A 80 3.876 -7.475 -6.110 1.00 0.00 C ATOM 0 H ALA A 80 3.300 -8.241 -8.843 1.00 0.00 H new ATOM 0 HA ALA A 80 5.528 -8.657 -6.898 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.039 -7.807 -5.085 1.00 0.00 H new ATOM 0 HB2 ALA A 80 4.363 -6.512 -6.261 1.00 0.00 H new ATOM 0 HB3 ALA A 80 2.806 -7.374 -6.293 1.00 0.00 H new ATOM 724 N ASP A 81 4.422 -10.785 -6.256 1.00 0.00 N ATOM 725 CA ASP A 81 3.805 -12.129 -6.066 1.00 0.00 C ATOM 726 C ASP A 81 3.360 -12.294 -4.613 1.00 0.00 C ATOM 727 O ASP A 81 3.670 -13.271 -3.960 1.00 0.00 O ATOM 728 CB ASP A 81 4.913 -13.126 -6.409 1.00 0.00 C ATOM 729 CG ASP A 81 4.311 -14.334 -7.129 1.00 0.00 C ATOM 730 OD1 ASP A 81 3.463 -14.986 -6.543 1.00 0.00 O ATOM 731 OD2 ASP A 81 4.709 -14.587 -8.254 1.00 0.00 O ATOM 0 H ASP A 81 5.347 -10.669 -5.842 1.00 0.00 H new ATOM 0 HA ASP A 81 2.923 -12.276 -6.689 1.00 0.00 H new ATOM 0 HB2 ASP A 81 5.662 -12.649 -7.041 1.00 0.00 H new ATOM 0 HB3 ASP A 81 5.421 -13.448 -5.500 1.00 0.00 H new ATOM 736 N GLY A 82 2.635 -11.338 -4.109 1.00 0.00 N ATOM 737 CA GLY A 82 2.159 -11.409 -2.714 1.00 0.00 C ATOM 738 C GLY A 82 1.145 -10.291 -2.470 1.00 0.00 C ATOM 739 O GLY A 82 0.052 -10.304 -3.001 1.00 0.00 O ATOM 0 H GLY A 82 2.351 -10.500 -4.617 1.00 0.00 H new ATOM 0 HA2 GLY A 82 1.701 -12.379 -2.523 1.00 0.00 H new ATOM 0 HA3 GLY A 82 2.998 -11.311 -2.026 1.00 0.00 H new ATOM 743 N ALA A 83 1.502 -9.319 -1.678 1.00 0.00 N ATOM 744 CA ALA A 83 0.562 -8.194 -1.406 1.00 0.00 C ATOM 745 C ALA A 83 1.221 -6.860 -1.771 1.00 0.00 C ATOM 746 O ALA A 83 2.405 -6.670 -1.582 1.00 0.00 O ATOM 747 CB ALA A 83 0.280 -8.265 0.094 1.00 0.00 C ATOM 0 H ALA A 83 2.404 -9.254 -1.207 1.00 0.00 H new ATOM 0 HA ALA A 83 -0.354 -8.267 -1.993 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -0.407 -7.466 0.373 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -0.168 -9.229 0.335 1.00 0.00 H new ATOM 0 HB3 ALA A 83 1.213 -8.150 0.645 1.00 0.00 H new ATOM 753 N ILE A 84 0.461 -5.937 -2.295 1.00 0.00 N ATOM 754 CA ILE A 84 1.042 -4.615 -2.675 1.00 0.00 C ATOM 755 C ILE A 84 0.036 -3.498 -2.375 1.00 0.00 C ATOM 756 O ILE A 84 -1.144 -3.745 -2.221 1.00 0.00 O ATOM 757 CB ILE A 84 1.314 -4.731 -4.175 1.00 0.00 C ATOM 758 CG1 ILE A 84 1.901 -3.421 -4.699 1.00 0.00 C ATOM 759 CG2 ILE A 84 0.009 -5.038 -4.909 1.00 0.00 C ATOM 760 CD1 ILE A 84 3.410 -3.418 -4.462 1.00 0.00 C ATOM 0 H ILE A 84 -0.537 -6.040 -2.477 1.00 0.00 H new ATOM 0 HA ILE A 84 1.948 -4.372 -2.120 1.00 0.00 H new ATOM 0 HB ILE A 84 2.027 -5.537 -4.349 1.00 0.00 H new ATOM 0 HG12 ILE A 84 1.687 -3.312 -5.762 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.439 -2.573 -4.193 1.00 0.00 H new ATOM 0 HG21 ILE A 84 0.204 -5.121 -5.978 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -0.403 -5.978 -4.542 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -0.706 -4.235 -4.731 1.00 0.00 H new ATOM 0 HD11 ILE A 84 3.835 -2.486 -4.834 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.611 -3.508 -3.394 1.00 0.00 H new ATOM 0 HD13 ILE A 84 3.863 -4.258 -4.988 1.00 0.00 H new ATOM 772 N GLU A 85 0.487 -2.275 -2.275 1.00 0.00 N ATOM 773 CA GLU A 85 -0.444 -1.173 -1.968 1.00 0.00 C ATOM 774 C GLU A 85 -0.286 -0.004 -2.951 1.00 0.00 C ATOM 775 O GLU A 85 0.776 0.567 -3.099 1.00 0.00 O ATOM 776 CB GLU A 85 -0.088 -0.745 -0.545 1.00 0.00 C ATOM 777 CG GLU A 85 -0.183 -1.956 0.386 1.00 0.00 C ATOM 778 CD GLU A 85 0.548 -1.651 1.694 1.00 0.00 C ATOM 779 OE1 GLU A 85 0.663 -0.483 2.026 1.00 0.00 O ATOM 780 OE2 GLU A 85 0.980 -2.591 2.341 1.00 0.00 O ATOM 0 H GLU A 85 1.462 -2.001 -2.394 1.00 0.00 H new ATOM 0 HA GLU A 85 -1.483 -1.489 -2.057 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.920 -0.330 -0.519 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -0.765 0.040 -0.209 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -1.228 -2.192 0.587 1.00 0.00 H new ATOM 0 HG3 GLU A 85 0.255 -2.832 -0.093 1.00 0.00 H new ATOM 787 N ILE A 86 -1.355 0.353 -3.614 1.00 0.00 N ATOM 788 CA ILE A 86 -1.330 1.467 -4.576 1.00 0.00 C ATOM 789 C ILE A 86 -1.411 2.804 -3.821 1.00 0.00 C ATOM 790 O ILE A 86 -1.749 2.841 -2.652 1.00 0.00 O ATOM 791 CB ILE A 86 -2.574 1.226 -5.417 1.00 0.00 C ATOM 792 CG1 ILE A 86 -2.228 0.237 -6.525 1.00 0.00 C ATOM 793 CG2 ILE A 86 -3.083 2.552 -6.002 1.00 0.00 C ATOM 794 CD1 ILE A 86 -2.011 1.003 -7.802 1.00 0.00 C ATOM 0 H ILE A 86 -2.263 -0.101 -3.518 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.424 1.514 -5.180 1.00 0.00 H new ATOM 0 HB ILE A 86 -3.370 0.810 -4.799 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.331 -0.325 -6.264 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -3.033 -0.487 -6.650 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -3.974 2.367 -6.602 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -3.328 3.237 -5.191 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -2.309 2.994 -6.629 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.762 0.309 -8.605 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -2.921 1.545 -8.060 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -1.193 1.710 -7.667 1.00 0.00 H new ATOM 806 N ASP A 87 -1.113 3.903 -4.467 1.00 0.00 N ATOM 807 CA ASP A 87 -1.187 5.218 -3.756 1.00 0.00 C ATOM 808 C ASP A 87 -1.393 6.367 -4.728 1.00 0.00 C ATOM 809 O ASP A 87 -0.776 6.430 -5.773 1.00 0.00 O ATOM 810 CB ASP A 87 0.169 5.412 -3.100 1.00 0.00 C ATOM 811 CG ASP A 87 0.575 4.143 -2.351 1.00 0.00 C ATOM 812 OD1 ASP A 87 0.173 4.001 -1.208 1.00 0.00 O ATOM 813 OD2 ASP A 87 1.281 3.336 -2.933 1.00 0.00 O ATOM 0 H ASP A 87 -0.825 3.949 -5.444 1.00 0.00 H new ATOM 0 HA ASP A 87 -2.019 5.212 -3.052 1.00 0.00 H new ATOM 0 HB2 ASP A 87 0.917 5.653 -3.856 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.131 6.255 -2.410 1.00 0.00 H new ATOM 818 N ALA A 88 -2.218 7.305 -4.371 1.00 0.00 N ATOM 819 CA ALA A 88 -2.406 8.475 -5.260 1.00 0.00 C ATOM 820 C ALA A 88 -2.816 9.712 -4.451 1.00 0.00 C ATOM 821 O ALA A 88 -2.477 10.827 -4.794 1.00 0.00 O ATOM 822 CB ALA A 88 -3.511 8.086 -6.239 1.00 0.00 C ATOM 0 H ALA A 88 -2.765 7.312 -3.510 1.00 0.00 H new ATOM 0 HA ALA A 88 -1.482 8.730 -5.780 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -3.697 8.912 -6.925 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -3.203 7.207 -6.805 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -4.423 7.860 -5.687 1.00 0.00 H new ATOM 828 N ALA A 89 -3.554 9.522 -3.388 1.00 0.00 N ATOM 829 CA ALA A 89 -4.001 10.682 -2.567 1.00 0.00 C ATOM 830 C ALA A 89 -2.846 11.652 -2.358 1.00 0.00 C ATOM 831 O ALA A 89 -2.955 12.833 -2.628 1.00 0.00 O ATOM 832 CB ALA A 89 -4.445 10.080 -1.237 1.00 0.00 C ATOM 0 H ALA A 89 -3.866 8.610 -3.054 1.00 0.00 H new ATOM 0 HA ALA A 89 -4.804 11.243 -3.046 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -4.790 10.874 -0.575 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -5.257 9.374 -1.410 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.606 9.561 -0.774 1.00 0.00 H new ATOM 838 N GLU A 90 -1.738 11.165 -1.889 1.00 0.00 N ATOM 839 CA GLU A 90 -0.573 12.066 -1.675 1.00 0.00 C ATOM 840 C GLU A 90 -0.219 12.731 -3.010 1.00 0.00 C ATOM 841 O GLU A 90 0.012 13.922 -3.092 1.00 0.00 O ATOM 842 CB GLU A 90 0.553 11.153 -1.150 1.00 0.00 C ATOM 843 CG GLU A 90 1.612 10.903 -2.233 1.00 0.00 C ATOM 844 CD GLU A 90 2.754 10.067 -1.653 1.00 0.00 C ATOM 845 OE1 GLU A 90 2.713 9.786 -0.466 1.00 0.00 O ATOM 846 OE2 GLU A 90 3.650 9.723 -2.405 1.00 0.00 O ATOM 0 H GLU A 90 -1.586 10.187 -1.644 1.00 0.00 H new ATOM 0 HA GLU A 90 -0.761 12.871 -0.964 1.00 0.00 H new ATOM 0 HB2 GLU A 90 1.021 11.611 -0.279 1.00 0.00 H new ATOM 0 HB3 GLU A 90 0.132 10.202 -0.823 1.00 0.00 H new ATOM 0 HG2 GLU A 90 1.164 10.385 -3.081 1.00 0.00 H new ATOM 0 HG3 GLU A 90 1.996 11.852 -2.606 1.00 0.00 H new ATOM 853 N ALA A 91 -0.198 11.960 -4.058 1.00 0.00 N ATOM 854 CA ALA A 91 0.113 12.530 -5.396 1.00 0.00 C ATOM 855 C ALA A 91 -1.003 13.486 -5.809 1.00 0.00 C ATOM 856 O ALA A 91 -0.763 14.490 -6.443 1.00 0.00 O ATOM 857 CB ALA A 91 0.173 11.324 -6.333 1.00 0.00 C ATOM 0 H ALA A 91 -0.383 10.957 -4.046 1.00 0.00 H new ATOM 0 HA ALA A 91 1.045 13.095 -5.413 1.00 0.00 H new ATOM 0 HB1 ALA A 91 0.399 11.660 -7.345 1.00 0.00 H new ATOM 0 HB2 ALA A 91 0.951 10.640 -5.996 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -0.789 10.811 -6.327 1.00 0.00 H new ATOM 863 N GLY A 92 -2.221 13.189 -5.442 1.00 0.00 N ATOM 864 CA GLY A 92 -3.348 14.094 -5.805 1.00 0.00 C ATOM 865 C GLY A 92 -3.208 15.391 -5.009 1.00 0.00 C ATOM 866 O GLY A 92 -3.125 16.468 -5.565 1.00 0.00 O ATOM 0 H GLY A 92 -2.483 12.361 -4.908 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -3.335 14.303 -6.875 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -4.303 13.616 -5.585 1.00 0.00 H new ATOM 870 N GLU A 93 -3.164 15.292 -3.709 1.00 0.00 N ATOM 871 CA GLU A 93 -3.008 16.513 -2.871 1.00 0.00 C ATOM 872 C GLU A 93 -1.767 17.283 -3.323 1.00 0.00 C ATOM 873 O GLU A 93 -1.609 18.455 -3.045 1.00 0.00 O ATOM 874 CB GLU A 93 -2.814 15.988 -1.447 1.00 0.00 C ATOM 875 CG GLU A 93 -1.481 15.242 -1.362 1.00 0.00 C ATOM 876 CD GLU A 93 -1.072 15.080 0.104 1.00 0.00 C ATOM 877 OE1 GLU A 93 -1.678 14.266 0.780 1.00 0.00 O ATOM 878 OE2 GLU A 93 -0.156 15.769 0.523 1.00 0.00 O ATOM 0 H GLU A 93 -3.230 14.416 -3.190 1.00 0.00 H new ATOM 0 HA GLU A 93 -3.861 17.188 -2.945 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.827 16.815 -0.737 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -3.634 15.323 -1.177 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.570 14.264 -1.835 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -0.711 15.790 -1.906 1.00 0.00 H new ATOM 885 N LEU A 94 -0.881 16.616 -4.013 1.00 0.00 N ATOM 886 CA LEU A 94 0.367 17.277 -4.487 1.00 0.00 C ATOM 887 C LEU A 94 0.087 18.123 -5.729 1.00 0.00 C ATOM 888 O LEU A 94 0.252 19.327 -5.715 1.00 0.00 O ATOM 889 CB LEU A 94 1.312 16.126 -4.824 1.00 0.00 C ATOM 890 CG LEU A 94 2.573 16.675 -5.491 1.00 0.00 C ATOM 891 CD1 LEU A 94 3.700 15.654 -5.344 1.00 0.00 C ATOM 892 CD2 LEU A 94 2.297 16.918 -6.976 1.00 0.00 C ATOM 0 H LEU A 94 -0.970 15.633 -4.270 1.00 0.00 H new ATOM 0 HA LEU A 94 0.787 17.950 -3.740 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.576 15.582 -3.917 1.00 0.00 H new ATOM 0 HB3 LEU A 94 0.816 15.418 -5.488 1.00 0.00 H new ATOM 0 HG LEU A 94 2.862 17.613 -5.018 1.00 0.00 H new ATOM 0 HD11 LEU A 94 4.603 16.039 -5.818 1.00 0.00 H new ATOM 0 HD12 LEU A 94 3.893 15.475 -4.286 1.00 0.00 H new ATOM 0 HD13 LEU A 94 3.409 14.719 -5.823 1.00 0.00 H new ATOM 0 HD21 LEU A 94 3.195 17.310 -7.454 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.013 15.979 -7.452 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.486 17.639 -7.082 1.00 0.00 H new ATOM 904 N LEU A 95 -0.351 17.515 -6.802 1.00 0.00 N ATOM 905 CA LEU A 95 -0.643 18.340 -8.018 1.00 0.00 C ATOM 906 C LEU A 95 -1.978 19.047 -7.831 1.00 0.00 C ATOM 907 O LEU A 95 -2.111 20.226 -8.094 1.00 0.00 O ATOM 908 CB LEU A 95 -0.674 17.450 -9.275 1.00 0.00 C ATOM 909 CG LEU A 95 -0.679 15.964 -8.946 1.00 0.00 C ATOM 910 CD1 LEU A 95 -2.042 15.577 -8.378 1.00 0.00 C ATOM 911 CD2 LEU A 95 -0.412 15.188 -10.233 1.00 0.00 C ATOM 0 H LEU A 95 -0.516 16.512 -6.892 1.00 0.00 H new ATOM 0 HA LEU A 95 0.143 19.083 -8.151 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -1.560 17.690 -9.863 1.00 0.00 H new ATOM 0 HB3 LEU A 95 0.192 17.677 -9.897 1.00 0.00 H new ATOM 0 HG LEU A 95 0.089 15.734 -8.208 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -2.049 14.513 -8.141 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -2.235 16.152 -7.472 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -2.817 15.790 -9.115 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -0.411 14.119 -10.020 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -1.191 15.412 -10.961 1.00 0.00 H new ATOM 0 HD23 LEU A 95 0.558 15.478 -10.638 1.00 0.00 H new ATOM 923 N GLY A 96 -2.966 18.345 -7.363 1.00 0.00 N ATOM 924 CA GLY A 96 -4.284 18.989 -7.143 1.00 0.00 C ATOM 925 C GLY A 96 -4.945 18.364 -5.921 1.00 0.00 C ATOM 926 O GLY A 96 -4.993 18.947 -4.856 1.00 0.00 O ATOM 0 H GLY A 96 -2.918 17.355 -7.124 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -4.159 20.062 -6.996 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -4.917 18.860 -8.021 1.00 0.00 H new ATOM 930 N LYS A 97 -5.450 17.174 -6.077 1.00 0.00 N ATOM 931 CA LYS A 97 -6.119 16.471 -4.944 1.00 0.00 C ATOM 932 C LYS A 97 -6.900 15.270 -5.481 1.00 0.00 C ATOM 933 O LYS A 97 -6.694 14.151 -5.057 1.00 0.00 O ATOM 934 CB LYS A 97 -7.080 17.493 -4.327 1.00 0.00 C ATOM 935 CG LYS A 97 -6.733 17.689 -2.848 1.00 0.00 C ATOM 936 CD LYS A 97 -7.523 18.874 -2.286 1.00 0.00 C ATOM 937 CE LYS A 97 -8.386 18.405 -1.112 1.00 0.00 C ATOM 938 NZ LYS A 97 -8.479 19.585 -0.209 1.00 0.00 N ATOM 0 H LYS A 97 -5.428 16.650 -6.952 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.403 16.104 -4.209 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.008 18.442 -4.858 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -8.109 17.148 -4.428 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -6.967 16.784 -2.287 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -5.663 17.866 -2.736 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -6.839 19.657 -1.958 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -8.153 19.306 -3.064 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -9.373 18.087 -1.449 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -7.933 17.554 -0.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -9.056 19.342 0.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -7.525 19.861 0.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -8.920 20.378 -0.718 1.00 0.00 H new ATOM 952 N PRO A 98 -7.777 15.554 -6.408 1.00 0.00 N ATOM 953 CA PRO A 98 -8.608 14.491 -7.023 1.00 0.00 C ATOM 954 C PRO A 98 -7.766 13.632 -7.969 1.00 0.00 C ATOM 955 O PRO A 98 -8.115 12.509 -8.273 1.00 0.00 O ATOM 956 CB PRO A 98 -9.671 15.269 -7.794 1.00 0.00 C ATOM 957 CG PRO A 98 -9.048 16.598 -8.077 1.00 0.00 C ATOM 958 CD PRO A 98 -8.077 16.879 -6.961 1.00 0.00 C ATOM 0 HA PRO A 98 -9.035 13.805 -6.292 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -9.944 14.756 -8.716 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -10.584 15.378 -7.208 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -8.536 16.586 -9.039 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -9.809 17.377 -8.130 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -7.177 17.371 -7.330 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -8.513 17.536 -6.209 1.00 0.00 H new ATOM 966 N PHE A 99 -6.657 14.142 -8.436 1.00 0.00 N ATOM 967 CA PHE A 99 -5.807 13.337 -9.351 1.00 0.00 C ATOM 968 C PHE A 99 -5.565 11.961 -8.746 1.00 0.00 C ATOM 969 O PHE A 99 -5.730 10.943 -9.387 1.00 0.00 O ATOM 970 CB PHE A 99 -4.491 14.097 -9.448 1.00 0.00 C ATOM 971 CG PHE A 99 -3.400 13.160 -9.921 1.00 0.00 C ATOM 972 CD1 PHE A 99 -2.754 12.315 -9.007 1.00 0.00 C ATOM 973 CD2 PHE A 99 -3.037 13.140 -11.268 1.00 0.00 C ATOM 974 CE1 PHE A 99 -1.745 11.449 -9.449 1.00 0.00 C ATOM 975 CE2 PHE A 99 -2.027 12.276 -11.711 1.00 0.00 C ATOM 976 CZ PHE A 99 -1.381 11.431 -10.801 1.00 0.00 C ATOM 0 H PHE A 99 -6.307 15.076 -8.223 1.00 0.00 H new ATOM 0 HA PHE A 99 -6.271 13.196 -10.327 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -4.592 14.933 -10.140 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -4.229 14.517 -8.477 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -3.034 12.332 -7.964 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -3.535 13.792 -11.970 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -1.248 10.796 -8.747 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -1.747 12.262 -12.754 1.00 0.00 H new ATOM 0 HZ PHE A 99 -0.602 10.765 -11.142 1.00 0.00 H new ATOM 986 N SER A 100 -5.153 11.951 -7.510 1.00 0.00 N ATOM 987 CA SER A 100 -4.862 10.678 -6.802 1.00 0.00 C ATOM 988 C SER A 100 -5.762 9.553 -7.298 1.00 0.00 C ATOM 989 O SER A 100 -5.322 8.605 -7.915 1.00 0.00 O ATOM 990 CB SER A 100 -5.164 10.978 -5.334 1.00 0.00 C ATOM 991 OG SER A 100 -6.443 11.591 -5.233 1.00 0.00 O ATOM 0 H SER A 100 -5.003 12.791 -6.951 1.00 0.00 H new ATOM 0 HA SER A 100 -3.836 10.350 -6.967 1.00 0.00 H new ATOM 0 HB2 SER A 100 -5.142 10.057 -4.751 1.00 0.00 H new ATOM 0 HB3 SER A 100 -4.399 11.635 -4.920 1.00 0.00 H new ATOM 0 HG SER A 100 -6.347 12.487 -4.847 1.00 0.00 H new ATOM 997 N VAL A 101 -7.017 9.636 -7.005 1.00 0.00 N ATOM 998 CA VAL A 101 -7.939 8.555 -7.413 1.00 0.00 C ATOM 999 C VAL A 101 -8.164 8.491 -8.932 1.00 0.00 C ATOM 1000 O VAL A 101 -7.959 7.462 -9.544 1.00 0.00 O ATOM 1001 CB VAL A 101 -9.206 8.846 -6.655 1.00 0.00 C ATOM 1002 CG1 VAL A 101 -10.444 8.444 -7.466 1.00 0.00 C ATOM 1003 CG2 VAL A 101 -9.171 8.065 -5.342 1.00 0.00 C ATOM 0 H VAL A 101 -7.448 10.409 -6.498 1.00 0.00 H new ATOM 0 HA VAL A 101 -7.533 7.571 -7.180 1.00 0.00 H new ATOM 0 HB VAL A 101 -9.270 9.917 -6.463 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -11.343 8.667 -6.892 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -10.463 9.003 -8.402 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -10.407 7.376 -7.682 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -10.082 8.262 -4.777 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -9.100 6.998 -5.555 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -8.306 8.376 -4.756 1.00 0.00 H new ATOM 1013 N TYR A 102 -8.599 9.553 -9.554 1.00 0.00 N ATOM 1014 CA TYR A 102 -8.838 9.470 -11.026 1.00 0.00 C ATOM 1015 C TYR A 102 -7.606 8.875 -11.706 1.00 0.00 C ATOM 1016 O TYR A 102 -7.694 8.155 -12.690 1.00 0.00 O ATOM 1017 CB TYR A 102 -9.081 10.907 -11.493 1.00 0.00 C ATOM 1018 CG TYR A 102 -10.120 10.910 -12.592 1.00 0.00 C ATOM 1019 CD1 TYR A 102 -10.144 9.876 -13.538 1.00 0.00 C ATOM 1020 CD2 TYR A 102 -11.060 11.945 -12.666 1.00 0.00 C ATOM 1021 CE1 TYR A 102 -11.106 9.881 -14.557 1.00 0.00 C ATOM 1022 CE2 TYR A 102 -12.021 11.949 -13.683 1.00 0.00 C ATOM 1023 CZ TYR A 102 -12.044 10.917 -14.628 1.00 0.00 C ATOM 1024 OH TYR A 102 -12.991 10.923 -15.633 1.00 0.00 O ATOM 0 H TYR A 102 -8.796 10.455 -9.121 1.00 0.00 H new ATOM 0 HA TYR A 102 -9.688 8.833 -11.274 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -9.418 11.520 -10.657 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -8.151 11.345 -11.856 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -9.421 9.076 -13.482 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -11.043 12.742 -11.937 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -11.123 9.086 -15.287 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -12.745 12.748 -13.739 1.00 0.00 H new ATOM 0 HH TYR A 102 -13.565 11.711 -15.537 1.00 0.00 H new ATOM 1034 N ASP A 103 -6.457 9.134 -11.161 1.00 0.00 N ATOM 1035 CA ASP A 103 -5.223 8.566 -11.750 1.00 0.00 C ATOM 1036 C ASP A 103 -5.151 7.108 -11.355 1.00 0.00 C ATOM 1037 O ASP A 103 -4.614 6.276 -12.060 1.00 0.00 O ATOM 1038 CB ASP A 103 -4.071 9.360 -11.133 1.00 0.00 C ATOM 1039 CG ASP A 103 -2.847 9.257 -12.041 1.00 0.00 C ATOM 1040 OD1 ASP A 103 -2.074 8.332 -11.856 1.00 0.00 O ATOM 1041 OD2 ASP A 103 -2.705 10.102 -12.908 1.00 0.00 O ATOM 0 H ASP A 103 -6.320 9.714 -10.333 1.00 0.00 H new ATOM 0 HA ASP A 103 -5.190 8.629 -12.838 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -4.359 10.404 -11.008 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -3.837 8.973 -10.141 1.00 0.00 H new ATOM 1046 N LEU A 104 -5.718 6.795 -10.228 1.00 0.00 N ATOM 1047 CA LEU A 104 -5.720 5.400 -9.762 1.00 0.00 C ATOM 1048 C LEU A 104 -6.563 4.555 -10.723 1.00 0.00 C ATOM 1049 O LEU A 104 -6.137 3.524 -11.179 1.00 0.00 O ATOM 1050 CB LEU A 104 -6.294 5.502 -8.331 1.00 0.00 C ATOM 1051 CG LEU A 104 -7.619 4.749 -8.158 1.00 0.00 C ATOM 1052 CD1 LEU A 104 -7.360 3.452 -7.412 1.00 0.00 C ATOM 1053 CD2 LEU A 104 -8.584 5.617 -7.352 1.00 0.00 C ATOM 0 H LEU A 104 -6.183 7.458 -9.608 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.746 4.910 -9.743 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.564 5.107 -7.624 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.445 6.552 -8.081 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.053 4.528 -9.133 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -8.298 2.911 -7.285 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.661 2.838 -7.981 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -6.934 3.674 -6.433 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -9.529 5.089 -7.225 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.152 5.829 -6.374 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.760 6.553 -7.882 1.00 0.00 H new ATOM 1065 N LEU A 105 -7.745 4.988 -11.052 1.00 0.00 N ATOM 1066 CA LEU A 105 -8.580 4.184 -11.986 1.00 0.00 C ATOM 1067 C LEU A 105 -7.917 4.124 -13.362 1.00 0.00 C ATOM 1068 O LEU A 105 -8.168 3.226 -14.141 1.00 0.00 O ATOM 1069 CB LEU A 105 -9.922 4.915 -12.061 1.00 0.00 C ATOM 1070 CG LEU A 105 -10.483 5.105 -10.651 1.00 0.00 C ATOM 1071 CD1 LEU A 105 -10.996 6.538 -10.492 1.00 0.00 C ATOM 1072 CD2 LEU A 105 -11.637 4.127 -10.427 1.00 0.00 C ATOM 0 H LEU A 105 -8.167 5.855 -10.719 1.00 0.00 H new ATOM 0 HA LEU A 105 -8.704 3.155 -11.648 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -9.794 5.883 -12.546 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -10.625 4.345 -12.669 1.00 0.00 H new ATOM 0 HG LEU A 105 -9.696 4.917 -9.920 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -11.396 6.672 -9.487 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -10.176 7.238 -10.653 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -11.782 6.726 -11.223 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -12.038 4.261 -9.422 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -12.422 4.317 -11.159 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -11.275 3.105 -10.540 1.00 0.00 H new ATOM 1084 N ILE A 106 -7.070 5.065 -13.670 1.00 0.00 N ATOM 1085 CA ILE A 106 -6.397 5.044 -14.992 1.00 0.00 C ATOM 1086 C ILE A 106 -5.013 4.393 -14.860 1.00 0.00 C ATOM 1087 O ILE A 106 -4.455 3.902 -15.822 1.00 0.00 O ATOM 1088 CB ILE A 106 -6.303 6.515 -15.392 1.00 0.00 C ATOM 1089 CG1 ILE A 106 -7.484 6.868 -16.300 1.00 0.00 C ATOM 1090 CG2 ILE A 106 -4.997 6.790 -16.137 1.00 0.00 C ATOM 1091 CD1 ILE A 106 -8.725 7.120 -15.444 1.00 0.00 C ATOM 0 H ILE A 106 -6.817 5.845 -13.063 1.00 0.00 H new ATOM 0 HA ILE A 106 -6.932 4.463 -15.743 1.00 0.00 H new ATOM 0 HB ILE A 106 -6.327 7.125 -14.489 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -7.250 7.754 -16.891 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -7.672 6.056 -17.003 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -4.950 7.844 -16.413 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -4.152 6.546 -15.493 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -4.956 6.177 -17.037 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -9.567 7.372 -16.089 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -8.961 6.222 -14.872 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -8.533 7.946 -14.759 1.00 0.00 H new ATOM 1103 N ASN A 107 -4.454 4.390 -13.680 1.00 0.00 N ATOM 1104 CA ASN A 107 -3.109 3.779 -13.500 1.00 0.00 C ATOM 1105 C ASN A 107 -3.209 2.463 -12.723 1.00 0.00 C ATOM 1106 O ASN A 107 -2.402 1.576 -12.887 1.00 0.00 O ATOM 1107 CB ASN A 107 -2.297 4.827 -12.725 1.00 0.00 C ATOM 1108 CG ASN A 107 -2.594 4.756 -11.219 1.00 0.00 C ATOM 1109 OD1 ASN A 107 -2.621 3.694 -10.631 1.00 0.00 O ATOM 1110 ND2 ASN A 107 -2.800 5.863 -10.559 1.00 0.00 N ATOM 0 H ASN A 107 -4.870 4.783 -12.836 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.639 3.529 -14.451 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -1.233 4.666 -12.897 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.533 5.823 -13.099 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -2.982 5.832 -9.556 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -2.779 6.759 -11.046 1.00 0.00 H new ATOM 1117 N VAL A 108 -4.186 2.327 -11.874 1.00 0.00 N ATOM 1118 CA VAL A 108 -4.315 1.066 -11.089 1.00 0.00 C ATOM 1119 C VAL A 108 -4.752 -0.095 -11.994 1.00 0.00 C ATOM 1120 O VAL A 108 -4.939 -1.206 -11.540 1.00 0.00 O ATOM 1121 CB VAL A 108 -5.382 1.367 -10.027 1.00 0.00 C ATOM 1122 CG1 VAL A 108 -6.787 1.152 -10.609 1.00 0.00 C ATOM 1123 CG2 VAL A 108 -5.183 0.442 -8.826 1.00 0.00 C ATOM 0 H VAL A 108 -4.900 3.031 -11.688 1.00 0.00 H new ATOM 0 HA VAL A 108 -3.369 0.763 -10.640 1.00 0.00 H new ATOM 0 HB VAL A 108 -5.283 2.406 -9.712 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -7.534 1.369 -9.846 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -6.934 1.817 -11.460 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -6.891 0.117 -10.935 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -5.941 0.656 -8.072 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -5.274 -0.596 -9.147 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -4.193 0.605 -8.401 1.00 0.00 H new ATOM 1133 N SER A 109 -4.928 0.162 -13.264 1.00 0.00 N ATOM 1134 CA SER A 109 -5.364 -0.912 -14.210 1.00 0.00 C ATOM 1135 C SER A 109 -4.748 -2.262 -13.864 1.00 0.00 C ATOM 1136 O SER A 109 -5.317 -3.297 -14.153 1.00 0.00 O ATOM 1137 CB SER A 109 -4.877 -0.439 -15.580 1.00 0.00 C ATOM 1138 OG SER A 109 -5.820 -0.821 -16.573 1.00 0.00 O ATOM 0 H SER A 109 -4.787 1.077 -13.691 1.00 0.00 H new ATOM 0 HA SER A 109 -6.443 -1.062 -14.171 1.00 0.00 H new ATOM 0 HB2 SER A 109 -4.751 0.644 -15.580 1.00 0.00 H new ATOM 0 HB3 SER A 109 -3.902 -0.873 -15.802 1.00 0.00 H new ATOM 0 HG SER A 109 -5.511 -0.517 -17.452 1.00 0.00 H new ATOM 1144 N SER A 110 -3.611 -2.282 -13.243 1.00 0.00 N ATOM 1145 CA SER A 110 -3.003 -3.593 -12.888 1.00 0.00 C ATOM 1146 C SER A 110 -3.675 -4.179 -11.642 1.00 0.00 C ATOM 1147 O SER A 110 -3.050 -4.868 -10.860 1.00 0.00 O ATOM 1148 CB SER A 110 -1.540 -3.282 -12.608 1.00 0.00 C ATOM 1149 OG SER A 110 -1.454 -2.380 -11.512 1.00 0.00 O ATOM 0 H SER A 110 -3.077 -1.458 -12.966 1.00 0.00 H new ATOM 0 HA SER A 110 -3.123 -4.329 -13.683 1.00 0.00 H new ATOM 0 HB2 SER A 110 -0.998 -4.200 -12.382 1.00 0.00 H new ATOM 0 HB3 SER A 110 -1.073 -2.845 -13.491 1.00 0.00 H new ATOM 0 HG SER A 110 -2.348 -2.043 -11.295 1.00 0.00 H new ATOM 1155 N THR A 111 -4.943 -3.929 -11.445 1.00 0.00 N ATOM 1156 CA THR A 111 -5.617 -4.498 -10.245 1.00 0.00 C ATOM 1157 C THR A 111 -6.297 -5.813 -10.623 1.00 0.00 C ATOM 1158 O THR A 111 -7.430 -6.070 -10.266 1.00 0.00 O ATOM 1159 CB THR A 111 -6.656 -3.458 -9.834 1.00 0.00 C ATOM 1160 OG1 THR A 111 -7.434 -3.095 -10.967 1.00 0.00 O ATOM 1161 CG2 THR A 111 -5.947 -2.225 -9.285 1.00 0.00 C ATOM 0 H THR A 111 -5.533 -3.363 -12.055 1.00 0.00 H new ATOM 0 HA THR A 111 -4.920 -4.708 -9.434 1.00 0.00 H new ATOM 0 HB THR A 111 -7.307 -3.875 -9.066 1.00 0.00 H new ATOM 0 HG1 THR A 111 -8.103 -2.428 -10.705 1.00 0.00 H new ATOM 0 HG21 THR A 111 -6.687 -1.481 -8.991 1.00 0.00 H new ATOM 0 HG22 THR A 111 -5.349 -2.505 -8.418 1.00 0.00 H new ATOM 0 HG23 THR A 111 -5.297 -1.807 -10.054 1.00 0.00 H new ATOM 1169 N VAL A 112 -5.612 -6.636 -11.358 1.00 0.00 N ATOM 1170 CA VAL A 112 -6.202 -7.938 -11.790 1.00 0.00 C ATOM 1171 C VAL A 112 -6.563 -8.800 -10.578 1.00 0.00 C ATOM 1172 O VAL A 112 -7.558 -9.497 -10.577 1.00 0.00 O ATOM 1173 CB VAL A 112 -5.111 -8.618 -12.619 1.00 0.00 C ATOM 1174 CG1 VAL A 112 -4.728 -7.725 -13.799 1.00 0.00 C ATOM 1175 CG2 VAL A 112 -3.878 -8.859 -11.745 1.00 0.00 C ATOM 0 H VAL A 112 -4.660 -6.466 -11.683 1.00 0.00 H new ATOM 0 HA VAL A 112 -7.121 -7.795 -12.358 1.00 0.00 H new ATOM 0 HB VAL A 112 -5.486 -9.571 -12.992 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -3.951 -8.213 -14.387 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -5.604 -7.554 -14.425 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -4.356 -6.770 -13.427 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -3.102 -9.344 -12.337 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -3.506 -7.906 -11.369 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -4.147 -9.500 -10.905 1.00 0.00 H new ATOM 1185 N GLY A 113 -5.760 -8.768 -9.552 1.00 0.00 N ATOM 1186 CA GLY A 113 -6.061 -9.598 -8.353 1.00 0.00 C ATOM 1187 C GLY A 113 -7.187 -8.953 -7.544 1.00 0.00 C ATOM 1188 O GLY A 113 -8.312 -9.411 -7.551 1.00 0.00 O ATOM 0 H GLY A 113 -4.911 -8.205 -9.491 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -6.351 -10.603 -8.659 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -5.168 -9.698 -7.735 1.00 0.00 H new ATOM 1192 N ARG A 114 -6.888 -7.900 -6.834 1.00 0.00 N ATOM 1193 CA ARG A 114 -7.911 -7.232 -6.016 1.00 0.00 C ATOM 1194 C ARG A 114 -7.676 -5.719 -5.997 1.00 0.00 C ATOM 1195 O ARG A 114 -6.853 -5.202 -6.726 1.00 0.00 O ATOM 1196 CB ARG A 114 -7.714 -7.828 -4.636 1.00 0.00 C ATOM 1197 CG ARG A 114 -8.964 -7.607 -3.782 1.00 0.00 C ATOM 1198 CD ARG A 114 -9.175 -8.811 -2.862 1.00 0.00 C ATOM 1199 NE ARG A 114 -10.540 -8.626 -2.295 1.00 0.00 N ATOM 1200 CZ ARG A 114 -11.501 -9.443 -2.630 1.00 0.00 C ATOM 1201 NH1 ARG A 114 -11.902 -9.504 -3.869 1.00 0.00 N ATOM 1202 NH2 ARG A 114 -12.060 -10.198 -1.725 1.00 0.00 N ATOM 0 H ARG A 114 -5.961 -7.476 -6.793 1.00 0.00 H new ATOM 0 HA ARG A 114 -8.923 -7.377 -6.395 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -7.505 -8.895 -4.719 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -6.850 -7.371 -4.154 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -8.856 -6.698 -3.190 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -9.835 -7.469 -4.423 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -9.100 -9.748 -3.414 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -8.421 -8.844 -2.075 1.00 0.00 H new ATOM 0 HE ARG A 114 -10.723 -7.861 -1.645 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -11.465 -8.913 -4.576 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -12.653 -10.142 -4.131 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -11.746 -10.150 -0.756 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -12.811 -10.837 -1.987 1.00 0.00 H new ATOM 1216 N ALA A 115 -8.386 -5.002 -5.168 1.00 0.00 N ATOM 1217 CA ALA A 115 -8.188 -3.527 -5.111 1.00 0.00 C ATOM 1218 C ALA A 115 -8.848 -2.944 -3.858 1.00 0.00 C ATOM 1219 O ALA A 115 -9.885 -2.315 -3.928 1.00 0.00 O ATOM 1220 CB ALA A 115 -8.868 -2.990 -6.370 1.00 0.00 C ATOM 0 H ALA A 115 -9.091 -5.373 -4.531 1.00 0.00 H new ATOM 0 HA ALA A 115 -7.133 -3.257 -5.065 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -8.767 -1.905 -6.404 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -8.398 -3.426 -7.252 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -9.925 -3.255 -6.354 1.00 0.00 H new ATOM 1226 N TYR A 116 -8.249 -3.138 -2.715 1.00 0.00 N ATOM 1227 CA TYR A 116 -8.838 -2.581 -1.463 1.00 0.00 C ATOM 1228 C TYR A 116 -8.461 -1.103 -1.330 1.00 0.00 C ATOM 1229 O TYR A 116 -7.298 -0.751 -1.308 1.00 0.00 O ATOM 1230 CB TYR A 116 -8.220 -3.400 -0.331 1.00 0.00 C ATOM 1231 CG TYR A 116 -9.316 -3.977 0.532 1.00 0.00 C ATOM 1232 CD1 TYR A 116 -10.205 -4.919 -0.003 1.00 0.00 C ATOM 1233 CD2 TYR A 116 -9.442 -3.575 1.868 1.00 0.00 C ATOM 1234 CE1 TYR A 116 -11.218 -5.458 0.798 1.00 0.00 C ATOM 1235 CE2 TYR A 116 -10.456 -4.114 2.668 1.00 0.00 C ATOM 1236 CZ TYR A 116 -11.344 -5.056 2.133 1.00 0.00 C ATOM 1237 OH TYR A 116 -12.341 -5.588 2.922 1.00 0.00 O ATOM 0 H TYR A 116 -7.379 -3.657 -2.593 1.00 0.00 H new ATOM 0 HA TYR A 116 -9.926 -2.639 -1.451 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -7.606 -4.202 -0.742 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -7.563 -2.771 0.270 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -10.108 -5.229 -1.033 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -8.757 -2.849 2.281 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -11.903 -6.184 0.386 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -10.554 -3.804 3.698 1.00 0.00 H new ATOM 0 HH TYR A 116 -12.287 -5.203 3.822 1.00 0.00 H new ATOM 1247 N THR A 117 -9.432 -0.235 -1.253 1.00 0.00 N ATOM 1248 CA THR A 117 -9.120 1.220 -1.134 1.00 0.00 C ATOM 1249 C THR A 117 -8.851 1.596 0.325 1.00 0.00 C ATOM 1250 O THR A 117 -9.293 0.931 1.243 1.00 0.00 O ATOM 1251 CB THR A 117 -10.370 1.932 -1.651 1.00 0.00 C ATOM 1252 OG1 THR A 117 -10.784 1.331 -2.870 1.00 0.00 O ATOM 1253 CG2 THR A 117 -10.059 3.411 -1.890 1.00 0.00 C ATOM 0 H THR A 117 -10.425 -0.468 -1.267 1.00 0.00 H new ATOM 0 HA THR A 117 -8.227 1.496 -1.696 1.00 0.00 H new ATOM 0 HB THR A 117 -11.167 1.847 -0.912 1.00 0.00 H new ATOM 0 HG1 THR A 117 -11.586 1.785 -3.202 1.00 0.00 H new ATOM 0 HG21 THR A 117 -10.952 3.916 -2.259 1.00 0.00 H new ATOM 0 HG22 THR A 117 -9.742 3.872 -0.955 1.00 0.00 H new ATOM 0 HG23 THR A 117 -9.261 3.501 -2.627 1.00 0.00 H new ATOM 1261 N LEU A 118 -8.127 2.660 0.544 1.00 0.00 N ATOM 1262 CA LEU A 118 -7.823 3.089 1.939 1.00 0.00 C ATOM 1263 C LEU A 118 -8.188 4.551 2.131 1.00 0.00 C ATOM 1264 O LEU A 118 -7.490 5.285 2.800 1.00 0.00 O ATOM 1265 CB LEU A 118 -6.315 2.886 2.102 1.00 0.00 C ATOM 1266 CG LEU A 118 -6.041 1.452 2.557 1.00 0.00 C ATOM 1267 CD1 LEU A 118 -6.203 0.499 1.373 1.00 0.00 C ATOM 1268 CD2 LEU A 118 -4.614 1.352 3.098 1.00 0.00 C ATOM 0 H LEU A 118 -7.732 3.253 -0.186 1.00 0.00 H new ATOM 0 HA LEU A 118 -8.390 2.521 2.676 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -5.806 3.083 1.158 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -5.919 3.593 2.831 1.00 0.00 H new ATOM 0 HG LEU A 118 -6.748 1.180 3.341 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -6.007 -0.523 1.699 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -7.220 0.568 0.987 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -5.497 0.771 0.588 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -4.419 0.330 3.422 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -3.908 1.625 2.314 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -4.497 2.030 3.944 1.00 0.00 H new ATOM 1280 N GLY A 119 -9.272 4.986 1.552 1.00 0.00 N ATOM 1281 CA GLY A 119 -9.667 6.413 1.706 1.00 0.00 C ATOM 1282 C GLY A 119 -8.659 7.283 0.972 1.00 0.00 C ATOM 1283 O GLY A 119 -8.986 8.018 0.062 1.00 0.00 O ATOM 0 H GLY A 119 -9.899 4.418 0.982 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -10.667 6.573 1.304 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -9.701 6.683 2.761 1.00 0.00 H new ATOM 1287 N THR A 120 -7.432 7.188 1.370 1.00 0.00 N ATOM 1288 CA THR A 120 -6.359 7.990 0.716 1.00 0.00 C ATOM 1289 C THR A 120 -5.370 7.058 0.013 1.00 0.00 C ATOM 1290 O THR A 120 -4.549 7.485 -0.773 1.00 0.00 O ATOM 1291 CB THR A 120 -5.671 8.742 1.857 1.00 0.00 C ATOM 1292 OG1 THR A 120 -5.032 7.811 2.721 1.00 0.00 O ATOM 1293 CG2 THR A 120 -6.711 9.541 2.643 1.00 0.00 C ATOM 0 H THR A 120 -7.116 6.584 2.129 1.00 0.00 H new ATOM 0 HA THR A 120 -6.751 8.672 -0.038 1.00 0.00 H new ATOM 0 HB THR A 120 -4.927 9.424 1.446 1.00 0.00 H new ATOM 0 HG1 THR A 120 -4.590 8.292 3.451 1.00 0.00 H new ATOM 0 HG21 THR A 120 -6.220 10.076 3.456 1.00 0.00 H new ATOM 0 HG22 THR A 120 -7.198 10.256 1.980 1.00 0.00 H new ATOM 0 HG23 THR A 120 -7.457 8.861 3.055 1.00 0.00 H new ATOM 1301 N LYS A 121 -5.447 5.784 0.293 1.00 0.00 N ATOM 1302 CA LYS A 121 -4.514 4.818 -0.354 1.00 0.00 C ATOM 1303 C LYS A 121 -5.292 3.753 -1.127 1.00 0.00 C ATOM 1304 O LYS A 121 -6.476 3.883 -1.371 1.00 0.00 O ATOM 1305 CB LYS A 121 -3.748 4.181 0.793 1.00 0.00 C ATOM 1306 CG LYS A 121 -2.278 4.595 0.718 1.00 0.00 C ATOM 1307 CD LYS A 121 -2.001 5.681 1.759 1.00 0.00 C ATOM 1308 CE LYS A 121 -1.166 5.094 2.899 1.00 0.00 C ATOM 1309 NZ LYS A 121 -2.127 4.286 3.700 1.00 0.00 N ATOM 0 H LYS A 121 -6.116 5.371 0.942 1.00 0.00 H new ATOM 0 HA LYS A 121 -3.854 5.308 -1.070 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -4.176 4.491 1.746 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -3.834 3.096 0.743 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -1.636 3.732 0.897 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -2.044 4.965 -0.280 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -1.471 6.515 1.298 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -2.940 6.075 2.147 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -0.353 4.477 2.516 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -0.712 5.880 3.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -1.664 3.962 4.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -2.953 4.869 3.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -2.435 3.462 3.145 1.00 0.00 H new ATOM 1323 N PHE A 122 -4.625 2.708 -1.522 1.00 0.00 N ATOM 1324 CA PHE A 122 -5.292 1.625 -2.289 1.00 0.00 C ATOM 1325 C PHE A 122 -4.517 0.327 -2.043 1.00 0.00 C ATOM 1326 O PHE A 122 -3.403 0.359 -1.558 1.00 0.00 O ATOM 1327 CB PHE A 122 -5.172 2.102 -3.733 1.00 0.00 C ATOM 1328 CG PHE A 122 -5.971 1.227 -4.674 1.00 0.00 C ATOM 1329 CD1 PHE A 122 -5.540 -0.065 -5.005 1.00 0.00 C ATOM 1330 CD2 PHE A 122 -7.149 1.730 -5.230 1.00 0.00 C ATOM 1331 CE1 PHE A 122 -6.300 -0.847 -5.889 1.00 0.00 C ATOM 1332 CE2 PHE A 122 -7.906 0.949 -6.110 1.00 0.00 C ATOM 1333 CZ PHE A 122 -7.481 -0.339 -6.439 1.00 0.00 C ATOM 0 H PHE A 122 -3.632 2.557 -1.343 1.00 0.00 H new ATOM 0 HA PHE A 122 -6.330 1.430 -2.018 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -5.521 3.132 -3.807 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -4.124 2.098 -4.033 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -4.627 -0.457 -4.582 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -7.478 2.728 -4.979 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -5.972 -1.844 -6.145 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -8.818 1.342 -6.534 1.00 0.00 H new ATOM 0 HZ PHE A 122 -8.064 -0.943 -7.118 1.00 0.00 H new ATOM 1343 N THR A 123 -5.071 -0.813 -2.348 1.00 0.00 N ATOM 1344 CA THR A 123 -4.329 -2.059 -2.092 1.00 0.00 C ATOM 1345 C THR A 123 -4.727 -3.130 -3.106 1.00 0.00 C ATOM 1346 O THR A 123 -5.816 -3.124 -3.631 1.00 0.00 O ATOM 1347 CB THR A 123 -4.706 -2.442 -0.648 1.00 0.00 C ATOM 1348 OG1 THR A 123 -3.575 -2.259 0.192 1.00 0.00 O ATOM 1349 CG2 THR A 123 -5.165 -3.901 -0.563 1.00 0.00 C ATOM 0 H THR A 123 -5.997 -0.927 -2.759 1.00 0.00 H new ATOM 0 HA THR A 123 -3.250 -1.948 -2.198 1.00 0.00 H new ATOM 0 HB THR A 123 -5.529 -1.804 -0.326 1.00 0.00 H new ATOM 0 HG1 THR A 123 -3.139 -1.409 -0.027 1.00 0.00 H new ATOM 0 HG21 THR A 123 -5.424 -4.141 0.468 1.00 0.00 H new ATOM 0 HG22 THR A 123 -6.038 -4.046 -1.200 1.00 0.00 H new ATOM 0 HG23 THR A 123 -4.360 -4.556 -0.897 1.00 0.00 H new ATOM 1357 N ILE A 124 -3.847 -4.048 -3.377 1.00 0.00 N ATOM 1358 CA ILE A 124 -4.164 -5.123 -4.355 1.00 0.00 C ATOM 1359 C ILE A 124 -3.574 -6.445 -3.858 1.00 0.00 C ATOM 1360 O ILE A 124 -2.522 -6.470 -3.250 1.00 0.00 O ATOM 1361 CB ILE A 124 -3.485 -4.684 -5.655 1.00 0.00 C ATOM 1362 CG1 ILE A 124 -3.711 -3.186 -5.868 1.00 0.00 C ATOM 1363 CG2 ILE A 124 -4.086 -5.459 -6.831 1.00 0.00 C ATOM 1364 CD1 ILE A 124 -2.677 -2.386 -5.071 1.00 0.00 C ATOM 0 H ILE A 124 -2.917 -4.101 -2.962 1.00 0.00 H new ATOM 0 HA ILE A 124 -5.235 -5.273 -4.492 1.00 0.00 H new ATOM 0 HB ILE A 124 -2.416 -4.886 -5.592 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -3.633 -2.944 -6.928 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -4.718 -2.912 -5.552 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -3.603 -5.147 -7.757 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -3.928 -6.527 -6.681 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -5.155 -5.255 -6.893 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -2.843 -1.320 -5.227 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -2.776 -2.618 -4.011 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -1.674 -2.650 -5.408 1.00 0.00 H new ATOM 1376 N THR A 125 -4.230 -7.544 -4.106 1.00 0.00 N ATOM 1377 CA THR A 125 -3.684 -8.848 -3.633 1.00 0.00 C ATOM 1378 C THR A 125 -3.865 -9.925 -4.703 1.00 0.00 C ATOM 1379 O THR A 125 -4.477 -9.700 -5.729 1.00 0.00 O ATOM 1380 CB THR A 125 -4.493 -9.193 -2.382 1.00 0.00 C ATOM 1381 OG1 THR A 125 -3.970 -10.377 -1.798 1.00 0.00 O ATOM 1382 CG2 THR A 125 -5.959 -9.411 -2.760 1.00 0.00 C ATOM 0 H THR A 125 -5.114 -7.597 -4.612 1.00 0.00 H new ATOM 0 HA THR A 125 -2.616 -8.790 -3.423 1.00 0.00 H new ATOM 0 HB THR A 125 -4.426 -8.373 -1.667 1.00 0.00 H new ATOM 0 HG1 THR A 125 -4.485 -10.601 -0.995 1.00 0.00 H new ATOM 0 HG21 THR A 125 -6.533 -9.657 -1.866 1.00 0.00 H new ATOM 0 HG22 THR A 125 -6.358 -8.501 -3.209 1.00 0.00 H new ATOM 0 HG23 THR A 125 -6.032 -10.231 -3.475 1.00 0.00 H new ATOM 1390 N SER A 126 -3.330 -11.092 -4.475 1.00 0.00 N ATOM 1391 CA SER A 126 -3.461 -12.184 -5.475 1.00 0.00 C ATOM 1392 C SER A 126 -4.494 -13.219 -5.006 1.00 0.00 C ATOM 1393 O SER A 126 -5.687 -13.010 -5.122 1.00 0.00 O ATOM 1394 CB SER A 126 -2.064 -12.792 -5.553 1.00 0.00 C ATOM 1395 OG SER A 126 -1.791 -13.504 -4.353 1.00 0.00 O ATOM 0 H SER A 126 -2.806 -11.336 -3.635 1.00 0.00 H new ATOM 0 HA SER A 126 -3.808 -11.830 -6.446 1.00 0.00 H new ATOM 0 HB2 SER A 126 -1.994 -13.462 -6.410 1.00 0.00 H new ATOM 0 HB3 SER A 126 -1.322 -12.008 -5.700 1.00 0.00 H new ATOM 0 HG SER A 126 -0.894 -13.897 -4.402 1.00 0.00 H new