USER MOD reduce.3.24.130724 H: found=0, std=0, add=660, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 658 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 Set 1.1: A 133 CYS SG : rot -108:sc= 0.461 USER MOD Set 1.2: A 138 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 110 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.00106) USER MOD Set 2.2: A 127 TYR OH : rot -153:sc= 0.00876 USER MOD Set 2.3: A 131 GLN : amide:sc= -0.544 X(o=-0.54,f=-0.55) USER MOD Set 3.1: A 66 SER OG : rot -143:sc= 0.0274 USER MOD Set 3.2: A 70 SER OG : rot 27:sc= 0.0449 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 159:sc= -0.139 (180deg=-0.7) USER MOD Single : A 80 LYS NZ :NH3+ 132:sc= -0.0801 (180deg=-0.687) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 86 TYR OH : rot 30:sc= 0.0763 USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 95 LYS NZ :NH3+ 154:sc= -0.0784 (180deg=-0.508) USER MOD Single : A 101 THR OG1 : rot 70:sc= 0.351 USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 GLN : amide:sc= -0.714 K(o=-0.71,f=-1.3) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 ASN : amide:sc= -0.225 K(o=-0.23,f=-0.87) USER MOD Single : A 123 ASN : amide:sc= 0.158 K(o=0.16,f=-5.5!) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= -0.219 K(o=-0.22,f=-3.7!) USER MOD Single : A 132 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.389) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= 0.282 K(o=0.28,f=-1.7!) USER MOD Single : A 141 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 65 18.554 12.075 2.447 1.00 0.00 N ATOM 2 CA GLY A 65 17.943 13.217 1.791 1.00 0.00 C ATOM 3 C GLY A 65 17.288 12.848 0.475 1.00 0.00 C ATOM 4 O GLY A 65 16.143 12.397 0.448 1.00 0.00 O ATOM 0 HA2 GLY A 65 17.197 13.657 2.454 1.00 0.00 H new ATOM 0 HA3 GLY A 65 18.702 13.979 1.614 1.00 0.00 H new ATOM 8 N SER A 66 18.016 13.042 -0.621 1.00 0.00 N ATOM 9 CA SER A 66 17.497 12.732 -1.948 1.00 0.00 C ATOM 10 C SER A 66 18.612 12.244 -2.867 1.00 0.00 C ATOM 11 O SER A 66 19.737 12.741 -2.814 1.00 0.00 O ATOM 12 CB SER A 66 16.822 13.964 -2.555 1.00 0.00 C ATOM 13 OG SER A 66 15.808 14.463 -1.701 1.00 0.00 O ATOM 0 H SER A 66 18.966 13.412 -0.616 1.00 0.00 H new ATOM 0 HA SER A 66 16.760 11.936 -1.846 1.00 0.00 H new ATOM 0 HB2 SER A 66 17.567 14.740 -2.732 1.00 0.00 H new ATOM 0 HB3 SER A 66 16.392 13.707 -3.523 1.00 0.00 H new ATOM 0 HG SER A 66 15.055 14.784 -2.240 1.00 0.00 H new ATOM 19 N SER A 67 18.291 11.267 -3.709 1.00 0.00 N ATOM 20 CA SER A 67 19.266 10.707 -4.638 1.00 0.00 C ATOM 21 C SER A 67 19.127 11.341 -6.019 1.00 0.00 C ATOM 22 O SER A 67 20.112 11.768 -6.620 1.00 0.00 O ATOM 23 CB SER A 67 19.092 9.191 -4.741 1.00 0.00 C ATOM 24 OG SER A 67 20.324 8.555 -5.035 1.00 0.00 O ATOM 0 H SER A 67 17.363 10.847 -3.767 1.00 0.00 H new ATOM 0 HA SER A 67 20.263 10.926 -4.255 1.00 0.00 H new ATOM 0 HB2 SER A 67 18.693 8.803 -3.804 1.00 0.00 H new ATOM 0 HB3 SER A 67 18.364 8.957 -5.518 1.00 0.00 H new ATOM 0 HG SER A 67 20.186 7.587 -5.094 1.00 0.00 H new ATOM 30 N GLY A 68 17.895 11.398 -6.515 1.00 0.00 N ATOM 31 CA GLY A 68 17.648 11.981 -7.821 1.00 0.00 C ATOM 32 C GLY A 68 16.520 12.994 -7.800 1.00 0.00 C ATOM 33 O GLY A 68 16.101 13.444 -6.734 1.00 0.00 O ATOM 0 H GLY A 68 17.064 11.051 -6.036 1.00 0.00 H new ATOM 0 HA2 GLY A 68 18.558 12.463 -8.178 1.00 0.00 H new ATOM 0 HA3 GLY A 68 17.407 11.189 -8.530 1.00 0.00 H new ATOM 37 N SER A 69 16.029 13.355 -8.981 1.00 0.00 N ATOM 38 CA SER A 69 14.947 14.326 -9.094 1.00 0.00 C ATOM 39 C SER A 69 13.939 14.151 -7.963 1.00 0.00 C ATOM 40 O SER A 69 13.448 13.049 -7.719 1.00 0.00 O ATOM 41 CB SER A 69 14.244 14.183 -10.446 1.00 0.00 C ATOM 42 OG SER A 69 15.007 14.774 -11.483 1.00 0.00 O ATOM 0 H SER A 69 16.363 12.990 -9.873 1.00 0.00 H new ATOM 0 HA SER A 69 15.379 15.324 -9.021 1.00 0.00 H new ATOM 0 HB2 SER A 69 14.082 13.128 -10.665 1.00 0.00 H new ATOM 0 HB3 SER A 69 13.262 14.653 -10.400 1.00 0.00 H new ATOM 0 HG SER A 69 14.537 14.668 -12.336 1.00 0.00 H new ATOM 48 N SER A 70 13.636 15.246 -7.273 1.00 0.00 N ATOM 49 CA SER A 70 12.690 15.214 -6.164 1.00 0.00 C ATOM 50 C SER A 70 11.402 15.947 -6.528 1.00 0.00 C ATOM 51 O SER A 70 11.338 17.175 -6.480 1.00 0.00 O ATOM 52 CB SER A 70 13.313 15.843 -4.917 1.00 0.00 C ATOM 53 OG SER A 70 14.383 15.054 -4.428 1.00 0.00 O ATOM 0 H SER A 70 14.032 16.167 -7.463 1.00 0.00 H new ATOM 0 HA SER A 70 12.448 14.172 -5.954 1.00 0.00 H new ATOM 0 HB2 SER A 70 13.674 16.844 -5.152 1.00 0.00 H new ATOM 0 HB3 SER A 70 12.554 15.952 -4.143 1.00 0.00 H new ATOM 0 HG SER A 70 14.773 14.539 -5.165 1.00 0.00 H new ATOM 59 N GLY A 71 10.376 15.183 -6.892 1.00 0.00 N ATOM 60 CA GLY A 71 9.103 15.776 -7.259 1.00 0.00 C ATOM 61 C GLY A 71 7.927 14.884 -6.912 1.00 0.00 C ATOM 62 O GLY A 71 7.576 14.737 -5.742 1.00 0.00 O ATOM 0 H GLY A 71 10.404 14.164 -6.939 1.00 0.00 H new ATOM 0 HA2 GLY A 71 8.991 16.734 -6.750 1.00 0.00 H new ATOM 0 HA3 GLY A 71 9.096 15.981 -8.330 1.00 0.00 H new ATOM 66 N MET A 72 7.317 14.289 -7.932 1.00 0.00 N ATOM 67 CA MET A 72 6.173 13.408 -7.728 1.00 0.00 C ATOM 68 C MET A 72 6.403 12.056 -8.395 1.00 0.00 C ATOM 69 O MET A 72 6.721 11.985 -9.581 1.00 0.00 O ATOM 70 CB MET A 72 4.900 14.053 -8.281 1.00 0.00 C ATOM 71 CG MET A 72 4.290 15.089 -7.351 1.00 0.00 C ATOM 72 SD MET A 72 5.353 16.526 -7.119 1.00 0.00 S ATOM 73 CE MET A 72 5.406 17.180 -8.785 1.00 0.00 C ATOM 0 H MET A 72 7.595 14.401 -8.907 1.00 0.00 H new ATOM 0 HA MET A 72 6.055 13.249 -6.656 1.00 0.00 H new ATOM 0 HB2 MET A 72 5.127 14.524 -9.237 1.00 0.00 H new ATOM 0 HB3 MET A 72 4.163 13.274 -8.477 1.00 0.00 H new ATOM 0 HG2 MET A 72 3.331 15.413 -7.754 1.00 0.00 H new ATOM 0 HG3 MET A 72 4.090 14.630 -6.383 1.00 0.00 H new ATOM 0 HE1 MET A 72 5.692 18.231 -8.754 1.00 0.00 H new ATOM 0 HE2 MET A 72 6.136 16.623 -9.372 1.00 0.00 H new ATOM 0 HE3 MET A 72 4.422 17.085 -9.245 1.00 0.00 H new ATOM 83 N GLU A 73 6.240 10.985 -7.624 1.00 0.00 N ATOM 84 CA GLU A 73 6.431 9.635 -8.141 1.00 0.00 C ATOM 85 C GLU A 73 5.703 8.612 -7.274 1.00 0.00 C ATOM 86 O GLU A 73 5.650 8.743 -6.051 1.00 0.00 O ATOM 87 CB GLU A 73 7.922 9.297 -8.206 1.00 0.00 C ATOM 88 CG GLU A 73 8.561 9.099 -6.841 1.00 0.00 C ATOM 89 CD GLU A 73 9.022 10.402 -6.219 1.00 0.00 C ATOM 90 OE1 GLU A 73 8.571 11.472 -6.679 1.00 0.00 O ATOM 91 OE2 GLU A 73 9.835 10.353 -5.272 1.00 0.00 O ATOM 0 H GLU A 73 5.976 11.026 -6.640 1.00 0.00 H new ATOM 0 HA GLU A 73 6.013 9.596 -9.147 1.00 0.00 H new ATOM 0 HB2 GLU A 73 8.055 8.390 -8.795 1.00 0.00 H new ATOM 0 HB3 GLU A 73 8.445 10.097 -8.730 1.00 0.00 H new ATOM 0 HG2 GLU A 73 7.845 8.616 -6.176 1.00 0.00 H new ATOM 0 HG3 GLU A 73 9.412 8.425 -6.937 1.00 0.00 H new ATOM 98 N CYS A 74 5.143 7.593 -7.917 1.00 0.00 N ATOM 99 CA CYS A 74 4.416 6.547 -7.208 1.00 0.00 C ATOM 100 C CYS A 74 5.210 6.057 -6.000 1.00 0.00 C ATOM 101 O CYS A 74 6.420 5.848 -6.083 1.00 0.00 O ATOM 102 CB CYS A 74 4.121 5.376 -8.146 1.00 0.00 C ATOM 103 SG CYS A 74 3.073 4.080 -7.411 1.00 0.00 S ATOM 0 H CYS A 74 5.179 7.469 -8.929 1.00 0.00 H new ATOM 0 HA CYS A 74 3.474 6.968 -6.856 1.00 0.00 H new ATOM 0 HB2 CYS A 74 3.633 5.757 -9.043 1.00 0.00 H new ATOM 0 HB3 CYS A 74 5.064 4.930 -8.461 1.00 0.00 H new ATOM 108 N ARG A 75 4.519 5.877 -4.879 1.00 0.00 N ATOM 109 CA ARG A 75 5.159 5.413 -3.653 1.00 0.00 C ATOM 110 C ARG A 75 5.082 3.894 -3.542 1.00 0.00 C ATOM 111 O ARG A 75 5.812 3.280 -2.763 1.00 0.00 O ATOM 112 CB ARG A 75 4.500 6.059 -2.433 1.00 0.00 C ATOM 113 CG ARG A 75 4.531 7.579 -2.457 1.00 0.00 C ATOM 114 CD ARG A 75 5.902 8.114 -2.073 1.00 0.00 C ATOM 115 NE ARG A 75 6.014 9.551 -2.310 1.00 0.00 N ATOM 116 CZ ARG A 75 7.174 10.187 -2.431 1.00 0.00 C ATOM 117 NH1 ARG A 75 8.314 9.517 -2.340 1.00 0.00 N ATOM 118 NH2 ARG A 75 7.194 11.497 -2.645 1.00 0.00 N ATOM 0 H ARG A 75 3.517 6.045 -4.794 1.00 0.00 H new ATOM 0 HA ARG A 75 6.209 5.705 -3.687 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.464 5.726 -2.371 1.00 0.00 H new ATOM 0 HB3 ARG A 75 5.002 5.708 -1.531 1.00 0.00 H new ATOM 0 HG2 ARG A 75 4.267 7.934 -3.453 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.781 7.970 -1.770 1.00 0.00 H new ATOM 0 HD2 ARG A 75 6.091 7.904 -1.020 1.00 0.00 H new ATOM 0 HD3 ARG A 75 6.669 7.591 -2.645 1.00 0.00 H new ATOM 0 HE ARG A 75 5.155 10.096 -2.387 1.00 0.00 H new ATOM 0 HH11 ARG A 75 8.302 8.510 -2.177 1.00 0.00 H new ATOM 0 HH12 ARG A 75 9.203 10.008 -2.433 1.00 0.00 H new ATOM 0 HH21 ARG A 75 6.319 12.015 -2.717 1.00 0.00 H new ATOM 0 HH22 ARG A 75 8.085 11.985 -2.738 1.00 0.00 H new ATOM 132 N VAL A 76 4.192 3.292 -4.325 1.00 0.00 N ATOM 133 CA VAL A 76 4.019 1.844 -4.314 1.00 0.00 C ATOM 134 C VAL A 76 5.109 1.155 -5.127 1.00 0.00 C ATOM 135 O VAL A 76 5.832 0.298 -4.617 1.00 0.00 O ATOM 136 CB VAL A 76 2.643 1.439 -4.875 1.00 0.00 C ATOM 137 CG1 VAL A 76 2.446 -0.066 -4.771 1.00 0.00 C ATOM 138 CG2 VAL A 76 1.532 2.182 -4.147 1.00 0.00 C ATOM 0 H VAL A 76 3.580 3.785 -4.975 1.00 0.00 H new ATOM 0 HA VAL A 76 4.088 1.525 -3.274 1.00 0.00 H new ATOM 0 HB VAL A 76 2.604 1.714 -5.929 1.00 0.00 H new ATOM 0 HG11 VAL A 76 1.468 -0.334 -5.172 1.00 0.00 H new ATOM 0 HG12 VAL A 76 3.224 -0.575 -5.341 1.00 0.00 H new ATOM 0 HG13 VAL A 76 2.505 -0.369 -3.726 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.566 1.884 -4.556 1.00 0.00 H new ATOM 0 HG22 VAL A 76 1.567 1.939 -3.085 1.00 0.00 H new ATOM 0 HG23 VAL A 76 1.666 3.256 -4.278 1.00 0.00 H new ATOM 148 N CYS A 77 5.224 1.535 -6.395 1.00 0.00 N ATOM 149 CA CYS A 77 6.226 0.954 -7.280 1.00 0.00 C ATOM 150 C CYS A 77 7.363 1.940 -7.535 1.00 0.00 C ATOM 151 O CYS A 77 8.537 1.574 -7.489 1.00 0.00 O ATOM 152 CB CYS A 77 5.587 0.542 -8.608 1.00 0.00 C ATOM 153 SG CYS A 77 5.158 1.941 -9.693 1.00 0.00 S ATOM 0 H CYS A 77 4.635 2.243 -6.833 1.00 0.00 H new ATOM 0 HA CYS A 77 6.637 0.070 -6.792 1.00 0.00 H new ATOM 0 HB2 CYS A 77 6.272 -0.119 -9.139 1.00 0.00 H new ATOM 0 HB3 CYS A 77 4.685 -0.034 -8.402 1.00 0.00 H new ATOM 158 N GLY A 78 7.005 3.192 -7.803 1.00 0.00 N ATOM 159 CA GLY A 78 8.006 4.211 -8.060 1.00 0.00 C ATOM 160 C GLY A 78 7.690 5.036 -9.292 1.00 0.00 C ATOM 161 O GLY A 78 7.805 6.261 -9.273 1.00 0.00 O ATOM 0 H GLY A 78 6.040 3.519 -7.847 1.00 0.00 H new ATOM 0 HA2 GLY A 78 8.080 4.870 -7.195 1.00 0.00 H new ATOM 0 HA3 GLY A 78 8.980 3.737 -8.184 1.00 0.00 H new ATOM 165 N ASP A 79 7.293 4.363 -10.367 1.00 0.00 N ATOM 166 CA ASP A 79 6.960 5.042 -11.614 1.00 0.00 C ATOM 167 C ASP A 79 6.159 6.312 -11.344 1.00 0.00 C ATOM 168 O ASP A 79 5.412 6.393 -10.368 1.00 0.00 O ATOM 169 CB ASP A 79 6.167 4.109 -12.531 1.00 0.00 C ATOM 170 CG ASP A 79 5.895 4.727 -13.889 1.00 0.00 C ATOM 171 OD1 ASP A 79 6.848 5.247 -14.505 1.00 0.00 O ATOM 172 OD2 ASP A 79 4.729 4.690 -14.335 1.00 0.00 O ATOM 0 H ASP A 79 7.194 3.348 -10.400 1.00 0.00 H new ATOM 0 HA ASP A 79 7.891 5.320 -12.108 1.00 0.00 H new ATOM 0 HB2 ASP A 79 6.719 3.178 -12.662 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.220 3.854 -12.055 1.00 0.00 H new ATOM 177 N LYS A 80 6.320 7.303 -12.214 1.00 0.00 N ATOM 178 CA LYS A 80 5.613 8.570 -12.072 1.00 0.00 C ATOM 179 C LYS A 80 4.221 8.353 -11.486 1.00 0.00 C ATOM 180 O LYS A 80 3.497 7.449 -11.901 1.00 0.00 O ATOM 181 CB LYS A 80 5.504 9.272 -13.427 1.00 0.00 C ATOM 182 CG LYS A 80 5.457 10.787 -13.324 1.00 0.00 C ATOM 183 CD LYS A 80 4.839 11.411 -14.565 1.00 0.00 C ATOM 184 CE LYS A 80 3.320 11.402 -14.495 1.00 0.00 C ATOM 185 NZ LYS A 80 2.811 12.226 -13.364 1.00 0.00 N ATOM 0 H LYS A 80 6.935 7.253 -13.026 1.00 0.00 H new ATOM 0 HA LYS A 80 6.182 9.200 -11.389 1.00 0.00 H new ATOM 0 HB2 LYS A 80 6.354 8.984 -14.045 1.00 0.00 H new ATOM 0 HB3 LYS A 80 4.606 8.923 -13.937 1.00 0.00 H new ATOM 0 HG2 LYS A 80 4.880 11.075 -12.445 1.00 0.00 H new ATOM 0 HG3 LYS A 80 6.466 11.175 -13.185 1.00 0.00 H new ATOM 0 HD2 LYS A 80 5.193 12.436 -14.673 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.167 10.865 -15.450 1.00 0.00 H new ATOM 0 HE2 LYS A 80 2.911 11.780 -15.432 1.00 0.00 H new ATOM 0 HE3 LYS A 80 2.968 10.376 -14.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 2.053 12.851 -13.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 2.438 11.602 -12.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 3.586 12.801 -12.977 1.00 0.00 H new ATOM 199 N ALA A 81 3.853 9.189 -10.522 1.00 0.00 N ATOM 200 CA ALA A 81 2.546 9.091 -9.882 1.00 0.00 C ATOM 201 C ALA A 81 1.500 9.898 -10.644 1.00 0.00 C ATOM 202 O ALA A 81 1.467 11.125 -10.560 1.00 0.00 O ATOM 203 CB ALA A 81 2.629 9.561 -8.438 1.00 0.00 C ATOM 0 H ALA A 81 4.441 9.943 -10.166 1.00 0.00 H new ATOM 0 HA ALA A 81 2.240 8.045 -9.895 1.00 0.00 H new ATOM 0 HB1 ALA A 81 1.646 9.482 -7.973 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.339 8.939 -7.893 1.00 0.00 H new ATOM 0 HB3 ALA A 81 2.961 10.599 -8.412 1.00 0.00 H new ATOM 209 N SER A 82 0.648 9.200 -11.389 1.00 0.00 N ATOM 210 CA SER A 82 -0.396 9.852 -12.169 1.00 0.00 C ATOM 211 C SER A 82 -1.067 10.959 -11.362 1.00 0.00 C ATOM 212 O SER A 82 -1.244 12.076 -11.845 1.00 0.00 O ATOM 213 CB SER A 82 -1.441 8.829 -12.619 1.00 0.00 C ATOM 214 OG SER A 82 -2.602 9.470 -13.117 1.00 0.00 O ATOM 0 H SER A 82 0.661 8.183 -11.468 1.00 0.00 H new ATOM 0 HA SER A 82 0.068 10.298 -13.049 1.00 0.00 H new ATOM 0 HB2 SER A 82 -1.017 8.187 -13.391 1.00 0.00 H new ATOM 0 HB3 SER A 82 -1.709 8.185 -11.781 1.00 0.00 H new ATOM 0 HG SER A 82 -3.253 8.794 -13.399 1.00 0.00 H new ATOM 220 N GLY A 83 -1.439 10.639 -10.126 1.00 0.00 N ATOM 221 CA GLY A 83 -2.087 11.615 -9.270 1.00 0.00 C ATOM 222 C GLY A 83 -2.125 11.180 -7.818 1.00 0.00 C ATOM 223 O GLY A 83 -1.366 10.302 -7.406 1.00 0.00 O ATOM 0 H GLY A 83 -1.303 9.721 -9.703 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -1.561 12.567 -9.347 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -3.105 11.783 -9.622 1.00 0.00 H new ATOM 227 N PHE A 84 -3.009 11.795 -7.040 1.00 0.00 N ATOM 228 CA PHE A 84 -3.140 11.468 -5.625 1.00 0.00 C ATOM 229 C PHE A 84 -4.408 10.657 -5.371 1.00 0.00 C ATOM 230 O PHE A 84 -5.490 11.215 -5.191 1.00 0.00 O ATOM 231 CB PHE A 84 -3.162 12.746 -4.784 1.00 0.00 C ATOM 232 CG PHE A 84 -2.732 12.533 -3.361 1.00 0.00 C ATOM 233 CD1 PHE A 84 -1.558 11.857 -3.071 1.00 0.00 C ATOM 234 CD2 PHE A 84 -3.502 13.011 -2.312 1.00 0.00 C ATOM 235 CE1 PHE A 84 -1.161 11.660 -1.762 1.00 0.00 C ATOM 236 CE2 PHE A 84 -3.109 12.817 -1.001 1.00 0.00 C ATOM 237 CZ PHE A 84 -1.937 12.141 -0.726 1.00 0.00 C ATOM 0 H PHE A 84 -3.645 12.523 -7.365 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.279 10.866 -5.335 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -2.509 13.487 -5.246 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.170 13.160 -4.793 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -0.946 11.480 -3.877 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -4.419 13.541 -2.521 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -0.244 11.130 -1.549 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -3.718 13.194 -0.193 1.00 0.00 H new ATOM 0 HZ PHE A 84 -1.628 11.989 0.297 1.00 0.00 H new ATOM 247 N HIS A 85 -4.264 9.335 -5.357 1.00 0.00 N ATOM 248 CA HIS A 85 -5.397 8.446 -5.125 1.00 0.00 C ATOM 249 C HIS A 85 -5.275 7.753 -3.771 1.00 0.00 C ATOM 250 O HIS A 85 -4.173 7.429 -3.325 1.00 0.00 O ATOM 251 CB HIS A 85 -5.490 7.402 -6.238 1.00 0.00 C ATOM 252 CG HIS A 85 -5.261 7.965 -7.607 1.00 0.00 C ATOM 253 ND1 HIS A 85 -6.150 8.816 -8.229 1.00 0.00 N ATOM 254 CD2 HIS A 85 -4.236 7.795 -8.474 1.00 0.00 C ATOM 255 CE1 HIS A 85 -5.683 9.144 -9.420 1.00 0.00 C ATOM 256 NE2 HIS A 85 -4.522 8.538 -9.593 1.00 0.00 N ATOM 0 H HIS A 85 -3.375 8.857 -5.503 1.00 0.00 H new ATOM 0 HA HIS A 85 -6.306 9.048 -5.125 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -4.758 6.616 -6.050 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -6.474 6.935 -6.206 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -3.357 7.188 -8.315 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -6.168 9.796 -10.131 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -3.933 8.610 -10.423 1.00 0.00 H new ATOM 264 N TYR A 86 -6.412 7.530 -3.121 1.00 0.00 N ATOM 265 CA TYR A 86 -6.431 6.878 -1.817 1.00 0.00 C ATOM 266 C TYR A 86 -5.539 7.619 -0.825 1.00 0.00 C ATOM 267 O TYR A 86 -4.964 7.016 0.080 1.00 0.00 O ATOM 268 CB TYR A 86 -5.976 5.424 -1.943 1.00 0.00 C ATOM 269 CG TYR A 86 -6.710 4.650 -3.014 1.00 0.00 C ATOM 270 CD1 TYR A 86 -6.351 4.763 -4.351 1.00 0.00 C ATOM 271 CD2 TYR A 86 -7.764 3.804 -2.688 1.00 0.00 C ATOM 272 CE1 TYR A 86 -7.020 4.058 -5.333 1.00 0.00 C ATOM 273 CE2 TYR A 86 -8.438 3.094 -3.663 1.00 0.00 C ATOM 274 CZ TYR A 86 -8.062 3.225 -4.984 1.00 0.00 C ATOM 275 OH TYR A 86 -8.730 2.520 -5.959 1.00 0.00 O ATOM 0 H TYR A 86 -7.332 7.791 -3.476 1.00 0.00 H new ATOM 0 HA TYR A 86 -7.455 6.899 -1.443 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -4.908 5.404 -2.160 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -6.116 4.924 -0.985 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -5.534 5.413 -4.628 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.061 3.700 -1.655 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -6.729 4.159 -6.368 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -9.254 2.440 -3.393 1.00 0.00 H new ATOM 0 HH TYR A 86 -8.118 2.325 -6.699 1.00 0.00 H new ATOM 285 N GLY A 87 -5.430 8.932 -1.003 1.00 0.00 N ATOM 286 CA GLY A 87 -4.607 9.734 -0.117 1.00 0.00 C ATOM 287 C GLY A 87 -3.146 9.334 -0.161 1.00 0.00 C ATOM 288 O GLY A 87 -2.369 9.694 0.723 1.00 0.00 O ATOM 0 H GLY A 87 -5.897 9.454 -1.745 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -4.701 10.785 -0.391 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.976 9.637 0.904 1.00 0.00 H new ATOM 292 N VAL A 88 -2.770 8.586 -1.194 1.00 0.00 N ATOM 293 CA VAL A 88 -1.392 8.136 -1.350 1.00 0.00 C ATOM 294 C VAL A 88 -0.930 8.273 -2.796 1.00 0.00 C ATOM 295 O VAL A 88 -1.619 7.845 -3.723 1.00 0.00 O ATOM 296 CB VAL A 88 -1.227 6.670 -0.906 1.00 0.00 C ATOM 297 CG1 VAL A 88 -1.838 5.729 -1.934 1.00 0.00 C ATOM 298 CG2 VAL A 88 0.242 6.345 -0.680 1.00 0.00 C ATOM 0 H VAL A 88 -3.400 8.279 -1.935 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.777 8.772 -0.713 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.756 6.532 0.037 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -1.712 4.698 -1.604 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -2.900 5.948 -2.042 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -1.340 5.866 -2.894 1.00 0.00 H new ATOM 0 HG21 VAL A 88 0.341 5.306 -0.367 1.00 0.00 H new ATOM 0 HG22 VAL A 88 0.795 6.499 -1.606 1.00 0.00 H new ATOM 0 HG23 VAL A 88 0.644 6.997 0.095 1.00 0.00 H new ATOM 308 N HIS A 89 0.242 8.872 -2.983 1.00 0.00 N ATOM 309 CA HIS A 89 0.797 9.065 -4.318 1.00 0.00 C ATOM 310 C HIS A 89 1.002 7.726 -5.020 1.00 0.00 C ATOM 311 O HIS A 89 2.003 7.045 -4.799 1.00 0.00 O ATOM 312 CB HIS A 89 2.125 9.819 -4.237 1.00 0.00 C ATOM 313 CG HIS A 89 1.971 11.308 -4.286 1.00 0.00 C ATOM 314 ND1 HIS A 89 1.919 12.097 -3.157 1.00 0.00 N ATOM 315 CD2 HIS A 89 1.861 12.153 -5.338 1.00 0.00 C ATOM 316 CE1 HIS A 89 1.781 13.362 -3.512 1.00 0.00 C ATOM 317 NE2 HIS A 89 1.743 13.423 -4.831 1.00 0.00 N ATOM 0 H HIS A 89 0.825 9.232 -2.228 1.00 0.00 H new ATOM 0 HA HIS A 89 0.087 9.655 -4.898 1.00 0.00 H new ATOM 0 HB2 HIS A 89 2.634 9.545 -3.313 1.00 0.00 H new ATOM 0 HB3 HIS A 89 2.765 9.501 -5.060 1.00 0.00 H new ATOM 0 HD2 HIS A 89 1.865 11.879 -6.383 1.00 0.00 H new ATOM 0 HE1 HIS A 89 1.711 14.203 -2.838 1.00 0.00 H new ATOM 0 HE2 HIS A 89 1.642 14.275 -5.383 1.00 0.00 H new ATOM 325 N ALA A 90 0.046 7.354 -5.865 1.00 0.00 N ATOM 326 CA ALA A 90 0.123 6.097 -6.600 1.00 0.00 C ATOM 327 C ALA A 90 -0.087 6.321 -8.094 1.00 0.00 C ATOM 328 O ALA A 90 -0.696 7.309 -8.504 1.00 0.00 O ATOM 329 CB ALA A 90 -0.902 5.109 -6.063 1.00 0.00 C ATOM 0 H ALA A 90 -0.791 7.905 -6.058 1.00 0.00 H new ATOM 0 HA ALA A 90 1.121 5.682 -6.459 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -0.834 4.175 -6.621 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -0.705 4.917 -5.008 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -1.903 5.526 -6.175 1.00 0.00 H new ATOM 335 N CYS A 91 0.422 5.398 -8.902 1.00 0.00 N ATOM 336 CA CYS A 91 0.292 5.494 -10.351 1.00 0.00 C ATOM 337 C CYS A 91 -0.939 4.735 -10.839 1.00 0.00 C ATOM 338 O CYS A 91 -1.604 4.050 -10.063 1.00 0.00 O ATOM 339 CB CYS A 91 1.546 4.945 -11.035 1.00 0.00 C ATOM 340 SG CYS A 91 1.738 3.139 -10.898 1.00 0.00 S ATOM 0 H CYS A 91 0.929 4.574 -8.578 1.00 0.00 H new ATOM 0 HA CYS A 91 0.175 6.546 -10.610 1.00 0.00 H new ATOM 0 HB2 CYS A 91 1.520 5.218 -12.090 1.00 0.00 H new ATOM 0 HB3 CYS A 91 2.423 5.427 -10.603 1.00 0.00 H new ATOM 345 N GLU A 92 -1.234 4.864 -12.128 1.00 0.00 N ATOM 346 CA GLU A 92 -2.386 4.191 -12.718 1.00 0.00 C ATOM 347 C GLU A 92 -2.264 2.677 -12.574 1.00 0.00 C ATOM 348 O GLU A 92 -3.178 2.014 -12.085 1.00 0.00 O ATOM 349 CB GLU A 92 -2.520 4.564 -14.196 1.00 0.00 C ATOM 350 CG GLU A 92 -3.086 5.955 -14.424 1.00 0.00 C ATOM 351 CD GLU A 92 -3.769 6.094 -15.771 1.00 0.00 C ATOM 352 OE1 GLU A 92 -3.302 5.464 -16.742 1.00 0.00 O ATOM 353 OE2 GLU A 92 -4.772 6.834 -15.853 1.00 0.00 O ATOM 0 H GLU A 92 -0.692 5.427 -12.784 1.00 0.00 H new ATOM 0 HA GLU A 92 -3.279 4.519 -12.185 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -1.540 4.498 -14.669 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -3.162 3.834 -14.689 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -3.800 6.187 -13.633 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -2.281 6.687 -14.352 1.00 0.00 H new ATOM 360 N GLY A 93 -1.127 2.137 -13.002 1.00 0.00 N ATOM 361 CA GLY A 93 -0.906 0.705 -12.913 1.00 0.00 C ATOM 362 C GLY A 93 -1.253 0.149 -11.546 1.00 0.00 C ATOM 363 O GLY A 93 -2.225 -0.593 -11.398 1.00 0.00 O ATOM 0 H GLY A 93 -0.355 2.665 -13.409 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -1.506 0.200 -13.670 1.00 0.00 H new ATOM 0 HA3 GLY A 93 0.138 0.487 -13.136 1.00 0.00 H new ATOM 367 N CYS A 94 -0.457 0.507 -10.544 1.00 0.00 N ATOM 368 CA CYS A 94 -0.683 0.038 -9.182 1.00 0.00 C ATOM 369 C CYS A 94 -2.161 0.131 -8.813 1.00 0.00 C ATOM 370 O CYS A 94 -2.749 -0.828 -8.314 1.00 0.00 O ATOM 371 CB CYS A 94 0.153 0.853 -8.194 1.00 0.00 C ATOM 372 SG CYS A 94 1.946 0.552 -8.312 1.00 0.00 S ATOM 0 H CYS A 94 0.351 1.121 -10.650 1.00 0.00 H new ATOM 0 HA CYS A 94 -0.378 -1.007 -9.129 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -0.038 1.913 -8.361 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -0.177 0.625 -7.181 1.00 0.00 H new ATOM 377 N LYS A 95 -2.755 1.293 -9.062 1.00 0.00 N ATOM 378 CA LYS A 95 -4.164 1.513 -8.758 1.00 0.00 C ATOM 379 C LYS A 95 -4.990 0.271 -9.077 1.00 0.00 C ATOM 380 O LYS A 95 -5.536 -0.370 -8.181 1.00 0.00 O ATOM 381 CB LYS A 95 -4.696 2.710 -9.549 1.00 0.00 C ATOM 382 CG LYS A 95 -6.047 3.207 -9.065 1.00 0.00 C ATOM 383 CD LYS A 95 -6.279 4.658 -9.450 1.00 0.00 C ATOM 384 CE LYS A 95 -6.924 4.775 -10.823 1.00 0.00 C ATOM 385 NZ LYS A 95 -8.306 4.220 -10.835 1.00 0.00 N ATOM 0 H LYS A 95 -2.282 2.098 -9.474 1.00 0.00 H new ATOM 0 HA LYS A 95 -4.252 1.722 -7.692 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -3.975 3.525 -9.487 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -4.775 2.434 -10.600 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.837 2.587 -9.489 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -6.107 3.103 -7.982 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -6.916 5.135 -8.706 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -5.329 5.193 -9.446 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -6.950 5.822 -11.124 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -6.314 4.248 -11.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -8.859 4.681 -11.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -8.267 3.196 -11.013 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -8.758 4.394 -9.915 1.00 0.00 H new ATOM 399 N GLY A 96 -5.076 -0.063 -10.361 1.00 0.00 N ATOM 400 CA GLY A 96 -5.836 -1.228 -10.775 1.00 0.00 C ATOM 401 C GLY A 96 -5.661 -2.400 -9.830 1.00 0.00 C ATOM 402 O GLY A 96 -6.640 -2.964 -9.341 1.00 0.00 O ATOM 0 H GLY A 96 -4.633 0.452 -11.122 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -6.893 -0.967 -10.833 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -5.525 -1.524 -11.777 1.00 0.00 H new ATOM 406 N PHE A 97 -4.411 -2.769 -9.573 1.00 0.00 N ATOM 407 CA PHE A 97 -4.111 -3.884 -8.682 1.00 0.00 C ATOM 408 C PHE A 97 -4.848 -3.733 -7.354 1.00 0.00 C ATOM 409 O PHE A 97 -5.728 -4.530 -7.026 1.00 0.00 O ATOM 410 CB PHE A 97 -2.604 -3.975 -8.433 1.00 0.00 C ATOM 411 CG PHE A 97 -2.220 -5.058 -7.466 1.00 0.00 C ATOM 412 CD1 PHE A 97 -2.255 -6.390 -7.847 1.00 0.00 C ATOM 413 CD2 PHE A 97 -1.824 -4.745 -6.176 1.00 0.00 C ATOM 414 CE1 PHE A 97 -1.903 -7.388 -6.959 1.00 0.00 C ATOM 415 CE2 PHE A 97 -1.470 -5.739 -5.283 1.00 0.00 C ATOM 416 CZ PHE A 97 -1.509 -7.063 -5.676 1.00 0.00 C ATOM 0 H PHE A 97 -3.589 -2.313 -9.969 1.00 0.00 H new ATOM 0 HA PHE A 97 -4.449 -4.802 -9.164 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -2.097 -4.150 -9.382 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -2.248 -3.017 -8.053 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -2.561 -6.651 -8.849 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -1.791 -3.712 -5.864 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -1.936 -8.422 -7.268 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -1.164 -5.481 -4.280 1.00 0.00 H new ATOM 0 HZ PHE A 97 -1.232 -7.842 -4.981 1.00 0.00 H new ATOM 426 N PHE A 98 -4.483 -2.706 -6.595 1.00 0.00 N ATOM 427 CA PHE A 98 -5.108 -2.450 -5.303 1.00 0.00 C ATOM 428 C PHE A 98 -6.618 -2.661 -5.377 1.00 0.00 C ATOM 429 O PHE A 98 -7.150 -3.615 -4.810 1.00 0.00 O ATOM 430 CB PHE A 98 -4.804 -1.024 -4.838 1.00 0.00 C ATOM 431 CG PHE A 98 -5.417 -0.683 -3.510 1.00 0.00 C ATOM 432 CD1 PHE A 98 -5.014 -1.337 -2.357 1.00 0.00 C ATOM 433 CD2 PHE A 98 -6.397 0.292 -3.415 1.00 0.00 C ATOM 434 CE1 PHE A 98 -5.577 -1.025 -1.134 1.00 0.00 C ATOM 435 CE2 PHE A 98 -6.962 0.609 -2.195 1.00 0.00 C ATOM 436 CZ PHE A 98 -6.553 -0.051 -1.053 1.00 0.00 C ATOM 0 H PHE A 98 -3.757 -2.037 -6.852 1.00 0.00 H new ATOM 0 HA PHE A 98 -4.695 -3.156 -4.582 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -3.724 -0.894 -4.775 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -5.167 -0.321 -5.588 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -4.251 -2.099 -2.415 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -6.723 0.810 -4.305 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -5.254 -1.542 -0.243 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -7.723 1.373 -2.134 1.00 0.00 H new ATOM 0 HZ PHE A 98 -6.995 0.194 -0.099 1.00 0.00 H new ATOM 446 N ARG A 99 -7.301 -1.764 -6.080 1.00 0.00 N ATOM 447 CA ARG A 99 -8.748 -1.850 -6.227 1.00 0.00 C ATOM 448 C ARG A 99 -9.174 -3.268 -6.594 1.00 0.00 C ATOM 449 O ARG A 99 -9.935 -3.906 -5.866 1.00 0.00 O ATOM 450 CB ARG A 99 -9.233 -0.868 -7.296 1.00 0.00 C ATOM 451 CG ARG A 99 -10.746 -0.792 -7.412 1.00 0.00 C ATOM 452 CD ARG A 99 -11.191 0.515 -8.051 1.00 0.00 C ATOM 453 NE ARG A 99 -11.193 1.619 -7.095 1.00 0.00 N ATOM 454 CZ ARG A 99 -11.839 2.762 -7.294 1.00 0.00 C ATOM 455 NH1 ARG A 99 -12.530 2.951 -8.409 1.00 0.00 N ATOM 456 NH2 ARG A 99 -11.793 3.720 -6.377 1.00 0.00 N ATOM 0 H ARG A 99 -6.875 -0.969 -6.557 1.00 0.00 H new ATOM 0 HA ARG A 99 -9.201 -1.589 -5.271 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -8.844 0.125 -7.068 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -8.817 -1.160 -8.261 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -11.109 -1.631 -8.006 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -11.193 -0.885 -6.422 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -10.528 0.756 -8.882 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -12.191 0.393 -8.466 1.00 0.00 H new ATOM 0 HE ARG A 99 -10.670 1.506 -6.227 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -12.567 2.218 -9.117 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -13.025 3.830 -8.559 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -11.261 3.579 -5.518 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -12.290 4.598 -6.531 1.00 0.00 H new ATOM 470 N ARG A 100 -8.678 -3.755 -7.727 1.00 0.00 N ATOM 471 CA ARG A 100 -9.009 -5.097 -8.191 1.00 0.00 C ATOM 472 C ARG A 100 -8.987 -6.093 -7.035 1.00 0.00 C ATOM 473 O ARG A 100 -9.888 -6.921 -6.897 1.00 0.00 O ATOM 474 CB ARG A 100 -8.027 -5.540 -9.278 1.00 0.00 C ATOM 475 CG ARG A 100 -8.221 -6.980 -9.724 1.00 0.00 C ATOM 476 CD ARG A 100 -7.819 -7.172 -11.177 1.00 0.00 C ATOM 477 NE ARG A 100 -6.372 -7.294 -11.334 1.00 0.00 N ATOM 478 CZ ARG A 100 -5.729 -7.020 -12.463 1.00 0.00 C ATOM 479 NH1 ARG A 100 -6.402 -6.612 -13.530 1.00 0.00 N ATOM 480 NH2 ARG A 100 -4.411 -7.155 -12.527 1.00 0.00 N ATOM 0 H ARG A 100 -8.046 -3.240 -8.340 1.00 0.00 H new ATOM 0 HA ARG A 100 -10.016 -5.072 -8.608 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -8.134 -4.884 -10.142 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -7.009 -5.417 -8.908 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -7.629 -7.641 -9.091 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -9.265 -7.265 -9.594 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -8.303 -8.065 -11.572 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -8.178 -6.328 -11.767 1.00 0.00 H new ATOM 0 HE ARG A 100 -5.825 -7.607 -10.532 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -7.416 -6.508 -13.485 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -5.906 -6.402 -14.396 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -3.890 -7.470 -11.708 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -3.918 -6.944 -13.395 1.00 0.00 H new ATOM 494 N THR A 101 -7.951 -6.007 -6.205 1.00 0.00 N ATOM 495 CA THR A 101 -7.811 -6.900 -5.063 1.00 0.00 C ATOM 496 C THR A 101 -8.955 -6.711 -4.073 1.00 0.00 C ATOM 497 O THR A 101 -9.392 -7.663 -3.427 1.00 0.00 O ATOM 498 CB THR A 101 -6.473 -6.674 -4.334 1.00 0.00 C ATOM 499 OG1 THR A 101 -5.381 -6.933 -5.223 1.00 0.00 O ATOM 500 CG2 THR A 101 -6.364 -7.574 -3.112 1.00 0.00 C ATOM 0 H THR A 101 -7.197 -5.327 -6.304 1.00 0.00 H new ATOM 0 HA THR A 101 -7.837 -7.918 -5.453 1.00 0.00 H new ATOM 0 HB THR A 101 -6.434 -5.636 -4.005 1.00 0.00 H new ATOM 0 HG1 THR A 101 -5.338 -6.228 -5.903 1.00 0.00 H new ATOM 0 HG21 THR A 101 -5.411 -7.397 -2.613 1.00 0.00 H new ATOM 0 HG22 THR A 101 -7.180 -7.354 -2.424 1.00 0.00 H new ATOM 0 HG23 THR A 101 -6.423 -8.617 -3.422 1.00 0.00 H new ATOM 508 N ILE A 102 -9.434 -5.477 -3.959 1.00 0.00 N ATOM 509 CA ILE A 102 -10.529 -5.164 -3.049 1.00 0.00 C ATOM 510 C ILE A 102 -11.867 -5.616 -3.622 1.00 0.00 C ATOM 511 O ILE A 102 -12.591 -6.392 -2.999 1.00 0.00 O ATOM 512 CB ILE A 102 -10.596 -3.655 -2.747 1.00 0.00 C ATOM 513 CG1 ILE A 102 -9.238 -3.151 -2.252 1.00 0.00 C ATOM 514 CG2 ILE A 102 -11.679 -3.369 -1.718 1.00 0.00 C ATOM 515 CD1 ILE A 102 -8.812 -3.757 -0.933 1.00 0.00 C ATOM 0 H ILE A 102 -9.081 -4.678 -4.485 1.00 0.00 H new ATOM 0 HA ILE A 102 -10.333 -5.704 -2.122 1.00 0.00 H new ATOM 0 HB ILE A 102 -10.846 -3.126 -3.667 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -8.481 -3.372 -3.005 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -9.278 -2.067 -2.148 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -11.714 -2.299 -1.515 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -12.644 -3.697 -2.105 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -11.456 -3.906 -0.796 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.841 -3.354 -0.644 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -9.548 -3.515 -0.167 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -8.739 -4.840 -1.037 1.00 0.00 H new ATOM 527 N ARG A 103 -12.189 -5.126 -4.815 1.00 0.00 N ATOM 528 CA ARG A 103 -13.441 -5.480 -5.474 1.00 0.00 C ATOM 529 C ARG A 103 -13.564 -6.993 -5.630 1.00 0.00 C ATOM 530 O ARG A 103 -14.667 -7.539 -5.633 1.00 0.00 O ATOM 531 CB ARG A 103 -13.529 -4.806 -6.844 1.00 0.00 C ATOM 532 CG ARG A 103 -12.316 -5.056 -7.725 1.00 0.00 C ATOM 533 CD ARG A 103 -12.561 -4.597 -9.154 1.00 0.00 C ATOM 534 NE ARG A 103 -13.530 -5.445 -9.842 1.00 0.00 N ATOM 535 CZ ARG A 103 -14.839 -5.218 -9.839 1.00 0.00 C ATOM 536 NH1 ARG A 103 -15.332 -4.174 -9.187 1.00 0.00 N ATOM 537 NH2 ARG A 103 -15.657 -6.035 -10.489 1.00 0.00 N ATOM 0 H ARG A 103 -11.601 -4.483 -5.345 1.00 0.00 H new ATOM 0 HA ARG A 103 -14.263 -5.128 -4.851 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -14.421 -5.163 -7.359 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -13.651 -3.732 -6.704 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -11.453 -4.530 -7.316 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -12.074 -6.119 -7.720 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -12.920 -3.568 -9.148 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -11.620 -4.603 -9.703 1.00 0.00 H new ATOM 0 HE ARG A 103 -13.183 -6.257 -10.353 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -14.706 -3.543 -8.686 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -16.337 -4.002 -9.186 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -15.281 -6.839 -10.992 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -16.662 -5.859 -10.486 1.00 0.00 H new ATOM 551 N MET A 104 -12.424 -7.664 -5.761 1.00 0.00 N ATOM 552 CA MET A 104 -12.405 -9.114 -5.917 1.00 0.00 C ATOM 553 C MET A 104 -12.132 -9.801 -4.583 1.00 0.00 C ATOM 554 O MET A 104 -12.196 -11.026 -4.479 1.00 0.00 O ATOM 555 CB MET A 104 -11.344 -9.524 -6.941 1.00 0.00 C ATOM 556 CG MET A 104 -11.590 -8.958 -8.330 1.00 0.00 C ATOM 557 SD MET A 104 -10.800 -9.932 -9.626 1.00 0.00 S ATOM 558 CE MET A 104 -12.172 -10.949 -10.168 1.00 0.00 C ATOM 0 H MET A 104 -11.502 -7.227 -5.762 1.00 0.00 H new ATOM 0 HA MET A 104 -13.386 -9.429 -6.274 1.00 0.00 H new ATOM 0 HB2 MET A 104 -10.366 -9.194 -6.591 1.00 0.00 H new ATOM 0 HB3 MET A 104 -11.310 -10.612 -7.001 1.00 0.00 H new ATOM 0 HG2 MET A 104 -12.663 -8.915 -8.516 1.00 0.00 H new ATOM 0 HG3 MET A 104 -11.218 -7.934 -8.372 1.00 0.00 H new ATOM 0 HE1 MET A 104 -11.841 -11.609 -10.970 1.00 0.00 H new ATOM 0 HE2 MET A 104 -12.534 -11.548 -9.332 1.00 0.00 H new ATOM 0 HE3 MET A 104 -12.977 -10.310 -10.532 1.00 0.00 H new ATOM 568 N LYS A 105 -11.828 -9.004 -3.563 1.00 0.00 N ATOM 569 CA LYS A 105 -11.547 -9.535 -2.235 1.00 0.00 C ATOM 570 C LYS A 105 -10.594 -10.723 -2.314 1.00 0.00 C ATOM 571 O LYS A 105 -10.832 -11.765 -1.701 1.00 0.00 O ATOM 572 CB LYS A 105 -12.847 -9.955 -1.545 1.00 0.00 C ATOM 573 CG LYS A 105 -13.660 -8.786 -1.016 1.00 0.00 C ATOM 574 CD LYS A 105 -14.951 -9.255 -0.364 1.00 0.00 C ATOM 575 CE LYS A 105 -14.680 -10.008 0.929 1.00 0.00 C ATOM 576 NZ LYS A 105 -15.927 -10.581 1.508 1.00 0.00 N ATOM 0 H LYS A 105 -11.770 -7.988 -3.632 1.00 0.00 H new ATOM 0 HA LYS A 105 -11.071 -8.748 -1.650 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -13.456 -10.521 -2.250 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -12.610 -10.625 -0.719 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -13.067 -8.227 -0.292 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -13.891 -8.103 -1.833 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -15.590 -8.396 -0.159 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -15.495 -9.899 -1.054 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -13.966 -10.809 0.740 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -14.220 -9.335 1.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -15.701 -11.086 2.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -16.599 -9.814 1.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -16.353 -11.243 0.828 1.00 0.00 H new ATOM 590 N LEU A 106 -9.514 -10.560 -3.070 1.00 0.00 N ATOM 591 CA LEU A 106 -8.524 -11.619 -3.228 1.00 0.00 C ATOM 592 C LEU A 106 -7.526 -11.608 -2.074 1.00 0.00 C ATOM 593 O LEU A 106 -6.953 -10.570 -1.747 1.00 0.00 O ATOM 594 CB LEU A 106 -7.785 -11.459 -4.558 1.00 0.00 C ATOM 595 CG LEU A 106 -8.662 -11.372 -5.807 1.00 0.00 C ATOM 596 CD1 LEU A 106 -7.863 -10.835 -6.984 1.00 0.00 C ATOM 597 CD2 LEU A 106 -9.254 -12.734 -6.139 1.00 0.00 C ATOM 0 H LEU A 106 -9.302 -9.704 -3.583 1.00 0.00 H new ATOM 0 HA LEU A 106 -9.047 -12.575 -3.223 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -7.173 -10.558 -4.505 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -7.103 -12.301 -4.675 1.00 0.00 H new ATOM 0 HG LEU A 106 -9.481 -10.682 -5.605 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -8.504 -10.780 -7.864 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -7.488 -9.840 -6.745 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -7.023 -11.500 -7.187 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -9.875 -12.653 -7.031 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -8.449 -13.446 -6.321 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -9.862 -13.080 -5.303 1.00 0.00 H new ATOM 609 N GLU A 107 -7.323 -12.771 -1.463 1.00 0.00 N ATOM 610 CA GLU A 107 -6.393 -12.895 -0.347 1.00 0.00 C ATOM 611 C GLU A 107 -5.210 -13.783 -0.720 1.00 0.00 C ATOM 612 O GLU A 107 -5.262 -14.526 -1.700 1.00 0.00 O ATOM 613 CB GLU A 107 -7.107 -13.466 0.880 1.00 0.00 C ATOM 614 CG GLU A 107 -7.595 -14.893 0.691 1.00 0.00 C ATOM 615 CD GLU A 107 -8.766 -15.234 1.592 1.00 0.00 C ATOM 616 OE1 GLU A 107 -8.597 -15.181 2.828 1.00 0.00 O ATOM 617 OE2 GLU A 107 -9.850 -15.554 1.061 1.00 0.00 O ATOM 0 H GLU A 107 -7.790 -13.640 -1.722 1.00 0.00 H new ATOM 0 HA GLU A 107 -6.017 -11.900 -0.109 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -6.429 -13.433 1.733 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -7.957 -12.829 1.124 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -7.887 -15.038 -0.349 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -6.775 -15.583 0.891 1.00 0.00 H new ATOM 624 N TYR A 108 -4.144 -13.700 0.069 1.00 0.00 N ATOM 625 CA TYR A 108 -2.946 -14.494 -0.179 1.00 0.00 C ATOM 626 C TYR A 108 -2.246 -14.847 1.129 1.00 0.00 C ATOM 627 O TYR A 108 -2.565 -14.298 2.184 1.00 0.00 O ATOM 628 CB TYR A 108 -1.986 -13.733 -1.095 1.00 0.00 C ATOM 629 CG TYR A 108 -2.653 -13.145 -2.318 1.00 0.00 C ATOM 630 CD1 TYR A 108 -3.020 -13.952 -3.388 1.00 0.00 C ATOM 631 CD2 TYR A 108 -2.917 -11.784 -2.403 1.00 0.00 C ATOM 632 CE1 TYR A 108 -3.629 -13.419 -4.508 1.00 0.00 C ATOM 633 CE2 TYR A 108 -3.527 -11.243 -3.518 1.00 0.00 C ATOM 634 CZ TYR A 108 -3.880 -12.064 -4.568 1.00 0.00 C ATOM 635 OH TYR A 108 -4.488 -11.530 -5.681 1.00 0.00 O ATOM 0 H TYR A 108 -4.085 -13.091 0.885 1.00 0.00 H new ATOM 0 HA TYR A 108 -3.249 -15.419 -0.669 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -1.515 -12.930 -0.527 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -1.191 -14.407 -1.414 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -2.826 -15.014 -3.344 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -2.641 -11.138 -1.583 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -3.907 -14.060 -5.332 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -3.726 -10.183 -3.567 1.00 0.00 H new ATOM 0 HH TYR A 108 -4.594 -10.563 -5.564 1.00 0.00 H new ATOM 645 N GLU A 109 -1.290 -15.768 1.052 1.00 0.00 N ATOM 646 CA GLU A 109 -0.545 -16.195 2.229 1.00 0.00 C ATOM 647 C GLU A 109 0.537 -15.180 2.586 1.00 0.00 C ATOM 648 O GLU A 109 1.145 -14.568 1.708 1.00 0.00 O ATOM 649 CB GLU A 109 0.087 -17.568 1.990 1.00 0.00 C ATOM 650 CG GLU A 109 -0.883 -18.724 2.168 1.00 0.00 C ATOM 651 CD GLU A 109 -0.186 -20.018 2.543 1.00 0.00 C ATOM 652 OE1 GLU A 109 0.321 -20.705 1.633 1.00 0.00 O ATOM 653 OE2 GLU A 109 -0.149 -20.342 3.749 1.00 0.00 O ATOM 0 H GLU A 109 -1.014 -16.232 0.187 1.00 0.00 H new ATOM 0 HA GLU A 109 -1.243 -16.265 3.063 1.00 0.00 H new ATOM 0 HB2 GLU A 109 0.495 -17.600 0.980 1.00 0.00 H new ATOM 0 HB3 GLU A 109 0.924 -17.698 2.676 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -1.608 -18.469 2.941 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -1.441 -18.871 1.243 1.00 0.00 H new ATOM 660 N LYS A 110 0.773 -15.007 3.883 1.00 0.00 N ATOM 661 CA LYS A 110 1.782 -14.067 4.358 1.00 0.00 C ATOM 662 C LYS A 110 3.144 -14.375 3.745 1.00 0.00 C ATOM 663 O LYS A 110 3.768 -15.386 4.069 1.00 0.00 O ATOM 664 CB LYS A 110 1.875 -14.117 5.885 1.00 0.00 C ATOM 665 CG LYS A 110 2.784 -13.053 6.474 1.00 0.00 C ATOM 666 CD LYS A 110 2.620 -12.951 7.981 1.00 0.00 C ATOM 667 CE LYS A 110 3.181 -11.642 8.516 1.00 0.00 C ATOM 668 NZ LYS A 110 2.251 -10.503 8.281 1.00 0.00 N ATOM 0 H LYS A 110 0.279 -15.505 4.623 1.00 0.00 H new ATOM 0 HA LYS A 110 1.483 -13.065 4.050 1.00 0.00 H new ATOM 0 HB2 LYS A 110 0.876 -14.003 6.305 1.00 0.00 H new ATOM 0 HB3 LYS A 110 2.237 -15.100 6.187 1.00 0.00 H new ATOM 0 HG2 LYS A 110 3.821 -13.287 6.235 1.00 0.00 H new ATOM 0 HG3 LYS A 110 2.561 -12.089 6.017 1.00 0.00 H new ATOM 0 HD2 LYS A 110 1.564 -13.028 8.239 1.00 0.00 H new ATOM 0 HD3 LYS A 110 3.127 -13.788 8.461 1.00 0.00 H new ATOM 0 HE2 LYS A 110 3.374 -11.739 9.584 1.00 0.00 H new ATOM 0 HE3 LYS A 110 4.138 -11.434 8.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 2.796 -9.621 8.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 1.722 -10.663 7.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 1.585 -10.429 9.076 1.00 0.00 H new ATOM 682 N CYS A 111 3.601 -13.497 2.859 1.00 0.00 N ATOM 683 CA CYS A 111 4.890 -13.673 2.201 1.00 0.00 C ATOM 684 C CYS A 111 6.009 -13.033 3.016 1.00 0.00 C ATOM 685 O CYS A 111 6.374 -11.880 2.789 1.00 0.00 O ATOM 686 CB CYS A 111 4.856 -13.067 0.796 1.00 0.00 C ATOM 687 SG CYS A 111 6.333 -13.431 -0.206 1.00 0.00 S ATOM 0 H CYS A 111 3.097 -12.655 2.580 1.00 0.00 H new ATOM 0 HA CYS A 111 5.087 -14.742 2.124 1.00 0.00 H new ATOM 0 HB2 CYS A 111 3.975 -13.438 0.273 1.00 0.00 H new ATOM 0 HB3 CYS A 111 4.745 -11.986 0.881 1.00 0.00 H new ATOM 692 N GLU A 112 6.549 -13.790 3.966 1.00 0.00 N ATOM 693 CA GLU A 112 7.626 -13.295 4.816 1.00 0.00 C ATOM 694 C GLU A 112 8.734 -12.664 3.977 1.00 0.00 C ATOM 695 O GLU A 112 9.274 -11.616 4.331 1.00 0.00 O ATOM 696 CB GLU A 112 8.199 -14.432 5.665 1.00 0.00 C ATOM 697 CG GLU A 112 7.308 -14.830 6.830 1.00 0.00 C ATOM 698 CD GLU A 112 7.851 -16.018 7.600 1.00 0.00 C ATOM 699 OE1 GLU A 112 8.086 -17.073 6.977 1.00 0.00 O ATOM 700 OE2 GLU A 112 8.041 -15.890 8.828 1.00 0.00 O ATOM 0 H GLU A 112 6.259 -14.747 4.166 1.00 0.00 H new ATOM 0 HA GLU A 112 7.213 -12.532 5.475 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.362 -15.302 5.029 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.173 -14.131 6.050 1.00 0.00 H new ATOM 0 HG2 GLU A 112 7.200 -13.982 7.506 1.00 0.00 H new ATOM 0 HG3 GLU A 112 6.312 -15.068 6.456 1.00 0.00 H new ATOM 707 N ARG A 113 9.068 -13.311 2.866 1.00 0.00 N ATOM 708 CA ARG A 113 10.113 -12.815 1.978 1.00 0.00 C ATOM 709 C ARG A 113 10.046 -11.296 1.856 1.00 0.00 C ATOM 710 O ARG A 113 11.062 -10.636 1.637 1.00 0.00 O ATOM 711 CB ARG A 113 9.981 -13.454 0.594 1.00 0.00 C ATOM 712 CG ARG A 113 10.163 -14.963 0.600 1.00 0.00 C ATOM 713 CD ARG A 113 10.574 -15.481 -0.769 1.00 0.00 C ATOM 714 NE ARG A 113 9.491 -15.370 -1.743 1.00 0.00 N ATOM 715 CZ ARG A 113 9.491 -15.993 -2.917 1.00 0.00 C ATOM 716 NH1 ARG A 113 10.512 -16.767 -3.260 1.00 0.00 N ATOM 717 NH2 ARG A 113 8.469 -15.842 -3.749 1.00 0.00 N ATOM 0 H ARG A 113 8.631 -14.180 2.559 1.00 0.00 H new ATOM 0 HA ARG A 113 11.078 -13.086 2.406 1.00 0.00 H new ATOM 0 HB2 ARG A 113 8.999 -13.217 0.186 1.00 0.00 H new ATOM 0 HB3 ARG A 113 10.719 -13.010 -0.074 1.00 0.00 H new ATOM 0 HG2 ARG A 113 10.920 -15.236 1.336 1.00 0.00 H new ATOM 0 HG3 ARG A 113 9.233 -15.441 0.907 1.00 0.00 H new ATOM 0 HD2 ARG A 113 11.440 -14.921 -1.124 1.00 0.00 H new ATOM 0 HD3 ARG A 113 10.881 -16.524 -0.685 1.00 0.00 H new ATOM 0 HE ARG A 113 8.691 -14.782 -1.509 1.00 0.00 H new ATOM 0 HH11 ARG A 113 11.299 -16.885 -2.622 1.00 0.00 H new ATOM 0 HH12 ARG A 113 10.510 -17.244 -4.161 1.00 0.00 H new ATOM 0 HH21 ARG A 113 7.682 -15.247 -3.488 1.00 0.00 H new ATOM 0 HH22 ARG A 113 8.470 -16.320 -4.650 1.00 0.00 H new ATOM 731 N SER A 114 8.844 -10.747 1.999 1.00 0.00 N ATOM 732 CA SER A 114 8.644 -9.306 1.901 1.00 0.00 C ATOM 733 C SER A 114 9.246 -8.761 0.609 1.00 0.00 C ATOM 734 O SER A 114 9.927 -7.735 0.612 1.00 0.00 O ATOM 735 CB SER A 114 9.270 -8.600 3.106 1.00 0.00 C ATOM 736 OG SER A 114 8.337 -8.477 4.165 1.00 0.00 O ATOM 0 H SER A 114 7.993 -11.279 2.183 1.00 0.00 H new ATOM 0 HA SER A 114 7.571 -9.112 1.892 1.00 0.00 H new ATOM 0 HB2 SER A 114 10.141 -9.159 3.447 1.00 0.00 H new ATOM 0 HB3 SER A 114 9.622 -7.612 2.810 1.00 0.00 H new ATOM 0 HG SER A 114 8.761 -8.024 4.924 1.00 0.00 H new ATOM 742 N CYS A 115 8.990 -9.456 -0.494 1.00 0.00 N ATOM 743 CA CYS A 115 9.505 -9.044 -1.794 1.00 0.00 C ATOM 744 C CYS A 115 9.522 -7.523 -1.916 1.00 0.00 C ATOM 745 O CYS A 115 8.554 -6.850 -1.561 1.00 0.00 O ATOM 746 CB CYS A 115 8.658 -9.647 -2.917 1.00 0.00 C ATOM 747 SG CYS A 115 8.238 -11.402 -2.670 1.00 0.00 S ATOM 0 H CYS A 115 8.429 -10.307 -0.513 1.00 0.00 H new ATOM 0 HA CYS A 115 10.528 -9.410 -1.883 1.00 0.00 H new ATOM 0 HB2 CYS A 115 7.736 -9.073 -3.010 1.00 0.00 H new ATOM 0 HB3 CYS A 115 9.195 -9.542 -3.859 1.00 0.00 H new ATOM 752 N LYS A 116 10.628 -6.987 -2.421 1.00 0.00 N ATOM 753 CA LYS A 116 10.772 -5.546 -2.592 1.00 0.00 C ATOM 754 C LYS A 116 10.148 -5.090 -3.907 1.00 0.00 C ATOM 755 O LYS A 116 10.722 -5.287 -4.978 1.00 0.00 O ATOM 756 CB LYS A 116 12.250 -5.153 -2.552 1.00 0.00 C ATOM 757 CG LYS A 116 12.483 -3.705 -2.156 1.00 0.00 C ATOM 758 CD LYS A 116 12.176 -2.756 -3.302 1.00 0.00 C ATOM 759 CE LYS A 116 12.254 -1.303 -2.860 1.00 0.00 C ATOM 760 NZ LYS A 116 13.647 -0.781 -2.913 1.00 0.00 N ATOM 0 H LYS A 116 11.439 -7.530 -2.719 1.00 0.00 H new ATOM 0 HA LYS A 116 10.249 -5.053 -1.772 1.00 0.00 H new ATOM 0 HB2 LYS A 116 12.771 -5.802 -1.848 1.00 0.00 H new ATOM 0 HB3 LYS A 116 12.691 -5.328 -3.533 1.00 0.00 H new ATOM 0 HG2 LYS A 116 11.857 -3.456 -1.299 1.00 0.00 H new ATOM 0 HG3 LYS A 116 13.519 -3.575 -1.843 1.00 0.00 H new ATOM 0 HD2 LYS A 116 12.880 -2.928 -4.116 1.00 0.00 H new ATOM 0 HD3 LYS A 116 11.180 -2.966 -3.692 1.00 0.00 H new ATOM 0 HE2 LYS A 116 11.614 -0.694 -3.498 1.00 0.00 H new ATOM 0 HE3 LYS A 116 11.870 -1.211 -1.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 13.658 0.212 -2.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 14.253 -1.345 -2.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 14.005 -0.844 -3.888 1.00 0.00 H new ATOM 774 N ILE A 117 8.972 -4.478 -3.817 1.00 0.00 N ATOM 775 CA ILE A 117 8.273 -3.991 -5.000 1.00 0.00 C ATOM 776 C ILE A 117 9.083 -2.913 -5.713 1.00 0.00 C ATOM 777 O ILE A 117 9.016 -1.737 -5.358 1.00 0.00 O ATOM 778 CB ILE A 117 6.887 -3.422 -4.641 1.00 0.00 C ATOM 779 CG1 ILE A 117 6.091 -4.440 -3.822 1.00 0.00 C ATOM 780 CG2 ILE A 117 6.129 -3.039 -5.903 1.00 0.00 C ATOM 781 CD1 ILE A 117 5.686 -5.666 -4.610 1.00 0.00 C ATOM 0 H ILE A 117 8.484 -4.308 -2.938 1.00 0.00 H new ATOM 0 HA ILE A 117 8.145 -4.846 -5.665 1.00 0.00 H new ATOM 0 HB ILE A 117 7.023 -2.525 -4.037 1.00 0.00 H new ATOM 0 HG12 ILE A 117 6.688 -4.750 -2.964 1.00 0.00 H new ATOM 0 HG13 ILE A 117 5.195 -3.958 -3.430 1.00 0.00 H new ATOM 0 HG21 ILE A 117 5.152 -2.639 -5.633 1.00 0.00 H new ATOM 0 HG22 ILE A 117 6.692 -2.283 -6.450 1.00 0.00 H new ATOM 0 HG23 ILE A 117 5.999 -3.920 -6.531 1.00 0.00 H new ATOM 0 HD11 ILE A 117 5.125 -6.344 -3.966 1.00 0.00 H new ATOM 0 HD12 ILE A 117 5.063 -5.367 -5.453 1.00 0.00 H new ATOM 0 HD13 ILE A 117 6.578 -6.172 -4.980 1.00 0.00 H new ATOM 793 N GLN A 118 9.846 -3.324 -6.720 1.00 0.00 N ATOM 794 CA GLN A 118 10.668 -2.392 -7.484 1.00 0.00 C ATOM 795 C GLN A 118 10.034 -2.089 -8.837 1.00 0.00 C ATOM 796 O GLN A 118 9.455 -2.969 -9.475 1.00 0.00 O ATOM 797 CB GLN A 118 12.073 -2.964 -7.683 1.00 0.00 C ATOM 798 CG GLN A 118 13.061 -1.964 -8.262 1.00 0.00 C ATOM 799 CD GLN A 118 13.090 -0.659 -7.491 1.00 0.00 C ATOM 800 OE1 GLN A 118 12.869 -0.636 -6.279 1.00 0.00 O ATOM 801 NE2 GLN A 118 13.363 0.436 -8.190 1.00 0.00 N ATOM 0 H GLN A 118 9.913 -4.295 -7.026 1.00 0.00 H new ATOM 0 HA GLN A 118 10.738 -1.462 -6.920 1.00 0.00 H new ATOM 0 HB2 GLN A 118 12.450 -3.321 -6.725 1.00 0.00 H new ATOM 0 HB3 GLN A 118 12.014 -3.828 -8.344 1.00 0.00 H new ATOM 0 HG2 GLN A 118 14.059 -2.403 -8.263 1.00 0.00 H new ATOM 0 HG3 GLN A 118 12.801 -1.762 -9.301 1.00 0.00 H new ATOM 0 HE21 GLN A 118 13.540 0.370 -9.192 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.396 1.343 -7.725 1.00 0.00 H new ATOM 810 N LYS A 119 10.145 -0.838 -9.270 1.00 0.00 N ATOM 811 CA LYS A 119 9.583 -0.417 -10.548 1.00 0.00 C ATOM 812 C LYS A 119 9.872 -1.447 -11.635 1.00 0.00 C ATOM 813 O LYS A 119 8.972 -1.868 -12.362 1.00 0.00 O ATOM 814 CB LYS A 119 10.153 0.944 -10.956 1.00 0.00 C ATOM 815 CG LYS A 119 9.918 2.035 -9.926 1.00 0.00 C ATOM 816 CD LYS A 119 10.756 3.268 -10.218 1.00 0.00 C ATOM 817 CE LYS A 119 12.170 3.121 -9.678 1.00 0.00 C ATOM 818 NZ LYS A 119 13.098 4.123 -10.273 1.00 0.00 N ATOM 0 H LYS A 119 10.620 -0.097 -8.754 1.00 0.00 H new ATOM 0 HA LYS A 119 8.503 -0.331 -10.431 1.00 0.00 H new ATOM 0 HB2 LYS A 119 11.225 0.843 -11.128 1.00 0.00 H new ATOM 0 HB3 LYS A 119 9.705 1.247 -11.903 1.00 0.00 H new ATOM 0 HG2 LYS A 119 8.862 2.306 -9.916 1.00 0.00 H new ATOM 0 HG3 LYS A 119 10.160 1.657 -8.933 1.00 0.00 H new ATOM 0 HD2 LYS A 119 10.792 3.438 -11.294 1.00 0.00 H new ATOM 0 HD3 LYS A 119 10.284 4.144 -9.772 1.00 0.00 H new ATOM 0 HE2 LYS A 119 12.159 3.235 -8.594 1.00 0.00 H new ATOM 0 HE3 LYS A 119 12.537 2.116 -9.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 14.051 3.990 -9.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 13.129 3.998 -11.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 12.763 5.082 -10.051 1.00 0.00 H new ATOM 832 N LYS A 120 11.133 -1.852 -11.741 1.00 0.00 N ATOM 833 CA LYS A 120 11.541 -2.835 -12.737 1.00 0.00 C ATOM 834 C LYS A 120 10.644 -4.067 -12.684 1.00 0.00 C ATOM 835 O LYS A 120 10.149 -4.530 -13.711 1.00 0.00 O ATOM 836 CB LYS A 120 13.000 -3.243 -12.514 1.00 0.00 C ATOM 837 CG LYS A 120 13.538 -4.183 -13.578 1.00 0.00 C ATOM 838 CD LYS A 120 15.056 -4.153 -13.632 1.00 0.00 C ATOM 839 CE LYS A 120 15.596 -5.119 -14.676 1.00 0.00 C ATOM 840 NZ LYS A 120 17.043 -5.405 -14.471 1.00 0.00 N ATOM 0 H LYS A 120 11.891 -1.514 -11.148 1.00 0.00 H new ATOM 0 HA LYS A 120 11.444 -2.379 -13.722 1.00 0.00 H new ATOM 0 HB2 LYS A 120 13.619 -2.346 -12.487 1.00 0.00 H new ATOM 0 HB3 LYS A 120 13.090 -3.722 -11.539 1.00 0.00 H new ATOM 0 HG2 LYS A 120 13.200 -5.199 -13.372 1.00 0.00 H new ATOM 0 HG3 LYS A 120 13.133 -3.903 -14.550 1.00 0.00 H new ATOM 0 HD2 LYS A 120 15.393 -3.142 -13.861 1.00 0.00 H new ATOM 0 HD3 LYS A 120 15.461 -4.410 -12.653 1.00 0.00 H new ATOM 0 HE2 LYS A 120 15.032 -6.051 -14.635 1.00 0.00 H new ATOM 0 HE3 LYS A 120 15.446 -4.700 -15.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 17.373 -6.067 -15.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 17.584 -4.519 -14.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 17.183 -5.829 -13.532 1.00 0.00 H new ATOM 854 N ASN A 121 10.438 -4.593 -11.481 1.00 0.00 N ATOM 855 CA ASN A 121 9.600 -5.771 -11.295 1.00 0.00 C ATOM 856 C ASN A 121 8.585 -5.546 -10.177 1.00 0.00 C ATOM 857 O ASN A 121 8.796 -5.968 -9.040 1.00 0.00 O ATOM 858 CB ASN A 121 10.464 -6.993 -10.976 1.00 0.00 C ATOM 859 CG ASN A 121 11.642 -7.130 -11.921 1.00 0.00 C ATOM 860 OD1 ASN A 121 12.771 -6.777 -11.579 1.00 0.00 O ATOM 861 ND2 ASN A 121 11.384 -7.645 -13.117 1.00 0.00 N ATOM 0 H ASN A 121 10.840 -4.222 -10.620 1.00 0.00 H new ATOM 0 HA ASN A 121 9.058 -5.950 -12.224 1.00 0.00 H new ATOM 0 HB2 ASN A 121 10.830 -6.919 -9.952 1.00 0.00 H new ATOM 0 HB3 ASN A 121 9.851 -7.893 -11.031 1.00 0.00 H new ATOM 0 HD21 ASN A 121 12.137 -7.762 -13.795 1.00 0.00 H new ATOM 0 HD22 ASN A 121 10.433 -7.924 -13.358 1.00 0.00 H new ATOM 868 N ARG A 122 7.485 -4.880 -10.510 1.00 0.00 N ATOM 869 CA ARG A 122 6.438 -4.598 -9.535 1.00 0.00 C ATOM 870 C ARG A 122 5.428 -5.740 -9.476 1.00 0.00 C ATOM 871 O ARG A 122 4.854 -6.021 -8.425 1.00 0.00 O ATOM 872 CB ARG A 122 5.726 -3.290 -9.883 1.00 0.00 C ATOM 873 CG ARG A 122 5.002 -3.327 -11.219 1.00 0.00 C ATOM 874 CD ARG A 122 4.953 -1.951 -11.864 1.00 0.00 C ATOM 875 NE ARG A 122 3.995 -1.898 -12.966 1.00 0.00 N ATOM 876 CZ ARG A 122 4.026 -0.977 -13.922 1.00 0.00 C ATOM 877 NH1 ARG A 122 4.962 -0.038 -13.913 1.00 0.00 N ATOM 878 NH2 ARG A 122 3.120 -0.994 -14.892 1.00 0.00 N ATOM 0 H ARG A 122 7.295 -4.525 -11.447 1.00 0.00 H new ATOM 0 HA ARG A 122 6.906 -4.499 -8.555 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.008 -3.057 -9.097 1.00 0.00 H new ATOM 0 HB3 ARG A 122 6.457 -2.481 -9.898 1.00 0.00 H new ATOM 0 HG2 ARG A 122 5.505 -4.026 -11.887 1.00 0.00 H new ATOM 0 HG3 ARG A 122 3.988 -3.699 -11.074 1.00 0.00 H new ATOM 0 HD2 ARG A 122 4.684 -1.208 -11.113 1.00 0.00 H new ATOM 0 HD3 ARG A 122 5.944 -1.687 -12.232 1.00 0.00 H new ATOM 0 HE ARG A 122 3.263 -2.607 -13.003 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.661 -0.022 -13.170 1.00 0.00 H new ATOM 0 HH12 ARG A 122 4.983 0.668 -14.649 1.00 0.00 H new ATOM 0 HH21 ARG A 122 2.399 -1.715 -14.904 1.00 0.00 H new ATOM 0 HH22 ARG A 122 3.145 -0.286 -15.626 1.00 0.00 H new ATOM 892 N ASN A 123 5.215 -6.394 -10.614 1.00 0.00 N ATOM 893 CA ASN A 123 4.274 -7.504 -10.693 1.00 0.00 C ATOM 894 C ASN A 123 4.963 -8.826 -10.369 1.00 0.00 C ATOM 895 O ASN A 123 4.760 -9.829 -11.055 1.00 0.00 O ATOM 896 CB ASN A 123 3.647 -7.571 -12.087 1.00 0.00 C ATOM 897 CG ASN A 123 4.688 -7.644 -13.186 1.00 0.00 C ATOM 898 OD1 ASN A 123 5.881 -7.462 -12.940 1.00 0.00 O ATOM 899 ND2 ASN A 123 4.241 -7.912 -14.408 1.00 0.00 N ATOM 0 H ASN A 123 5.682 -6.174 -11.494 1.00 0.00 H new ATOM 0 HA ASN A 123 3.489 -7.334 -9.957 1.00 0.00 H new ATOM 0 HB2 ASN A 123 2.996 -8.443 -12.148 1.00 0.00 H new ATOM 0 HB3 ASN A 123 3.019 -6.694 -12.243 1.00 0.00 H new ATOM 0 HD21 ASN A 123 4.895 -7.974 -15.188 1.00 0.00 H new ATOM 0 HD22 ASN A 123 3.244 -8.056 -14.566 1.00 0.00 H new ATOM 906 N LYS A 124 5.779 -8.821 -9.320 1.00 0.00 N ATOM 907 CA LYS A 124 6.498 -10.019 -8.903 1.00 0.00 C ATOM 908 C LYS A 124 5.686 -10.813 -7.885 1.00 0.00 C ATOM 909 O LYS A 124 5.313 -11.960 -8.132 1.00 0.00 O ATOM 910 CB LYS A 124 7.856 -9.642 -8.307 1.00 0.00 C ATOM 911 CG LYS A 124 8.869 -10.773 -8.339 1.00 0.00 C ATOM 912 CD LYS A 124 10.039 -10.500 -7.410 1.00 0.00 C ATOM 913 CE LYS A 124 10.977 -9.450 -7.988 1.00 0.00 C ATOM 914 NZ LYS A 124 12.340 -9.538 -7.396 1.00 0.00 N ATOM 0 H LYS A 124 5.959 -8.000 -8.743 1.00 0.00 H new ATOM 0 HA LYS A 124 6.655 -10.643 -9.782 1.00 0.00 H new ATOM 0 HB2 LYS A 124 8.259 -8.789 -8.853 1.00 0.00 H new ATOM 0 HB3 LYS A 124 7.714 -9.322 -7.275 1.00 0.00 H new ATOM 0 HG2 LYS A 124 8.384 -11.705 -8.050 1.00 0.00 H new ATOM 0 HG3 LYS A 124 9.235 -10.906 -9.357 1.00 0.00 H new ATOM 0 HD2 LYS A 124 9.666 -10.163 -6.443 1.00 0.00 H new ATOM 0 HD3 LYS A 124 10.589 -11.424 -7.235 1.00 0.00 H new ATOM 0 HE2 LYS A 124 11.042 -9.576 -9.069 1.00 0.00 H new ATOM 0 HE3 LYS A 124 10.566 -8.457 -7.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 12.949 -8.806 -7.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 12.282 -9.392 -6.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 12.743 -10.477 -7.590 1.00 0.00 H new ATOM 928 N CYS A 125 5.416 -10.196 -6.740 1.00 0.00 N ATOM 929 CA CYS A 125 4.648 -10.845 -5.684 1.00 0.00 C ATOM 930 C CYS A 125 3.277 -10.192 -5.529 1.00 0.00 C ATOM 931 O CYS A 125 3.124 -8.990 -5.740 1.00 0.00 O ATOM 932 CB CYS A 125 5.408 -10.779 -4.358 1.00 0.00 C ATOM 933 SG CYS A 125 4.567 -11.618 -2.976 1.00 0.00 S ATOM 0 H CYS A 125 5.718 -9.247 -6.519 1.00 0.00 H new ATOM 0 HA CYS A 125 4.505 -11.889 -5.962 1.00 0.00 H new ATOM 0 HB2 CYS A 125 6.393 -11.225 -4.494 1.00 0.00 H new ATOM 0 HB3 CYS A 125 5.565 -9.733 -4.093 1.00 0.00 H new ATOM 938 N GLN A 126 2.284 -10.995 -5.160 1.00 0.00 N ATOM 939 CA GLN A 126 0.926 -10.496 -4.978 1.00 0.00 C ATOM 940 C GLN A 126 0.734 -9.941 -3.570 1.00 0.00 C ATOM 941 O GLN A 126 0.494 -8.748 -3.390 1.00 0.00 O ATOM 942 CB GLN A 126 -0.089 -11.609 -5.243 1.00 0.00 C ATOM 943 CG GLN A 126 -0.199 -11.996 -6.709 1.00 0.00 C ATOM 944 CD GLN A 126 0.947 -12.877 -7.167 1.00 0.00 C ATOM 945 OE1 GLN A 126 1.658 -13.465 -6.352 1.00 0.00 O ATOM 946 NE2 GLN A 126 1.131 -12.974 -8.479 1.00 0.00 N ATOM 0 H GLN A 126 2.394 -11.993 -4.981 1.00 0.00 H new ATOM 0 HA GLN A 126 0.764 -9.689 -5.692 1.00 0.00 H new ATOM 0 HB2 GLN A 126 0.190 -12.489 -4.663 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -1.068 -11.289 -4.886 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -1.142 -12.518 -6.873 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -0.224 -11.093 -7.319 1.00 0.00 H new ATOM 0 HE21 GLN A 126 0.518 -12.469 -9.119 1.00 0.00 H new ATOM 0 HE22 GLN A 126 1.886 -13.553 -8.847 1.00 0.00 H new ATOM 955 N TYR A 127 0.842 -10.815 -2.576 1.00 0.00 N ATOM 956 CA TYR A 127 0.678 -10.414 -1.184 1.00 0.00 C ATOM 957 C TYR A 127 1.449 -9.130 -0.893 1.00 0.00 C ATOM 958 O TYR A 127 0.857 -8.079 -0.642 1.00 0.00 O ATOM 959 CB TYR A 127 1.151 -11.529 -0.250 1.00 0.00 C ATOM 960 CG TYR A 127 0.839 -11.271 1.207 1.00 0.00 C ATOM 961 CD1 TYR A 127 -0.455 -11.401 1.695 1.00 0.00 C ATOM 962 CD2 TYR A 127 1.840 -10.899 2.096 1.00 0.00 C ATOM 963 CE1 TYR A 127 -0.744 -11.166 3.025 1.00 0.00 C ATOM 964 CE2 TYR A 127 1.561 -10.663 3.429 1.00 0.00 C ATOM 965 CZ TYR A 127 0.267 -10.797 3.888 1.00 0.00 C ATOM 966 OH TYR A 127 -0.017 -10.564 5.214 1.00 0.00 O ATOM 0 H TYR A 127 1.043 -11.806 -2.708 1.00 0.00 H new ATOM 0 HA TYR A 127 -0.382 -10.228 -1.009 1.00 0.00 H new ATOM 0 HB2 TYR A 127 0.685 -12.467 -0.552 1.00 0.00 H new ATOM 0 HB3 TYR A 127 2.227 -11.656 -0.365 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -1.249 -11.691 1.023 1.00 0.00 H new ATOM 0 HD2 TYR A 127 2.854 -10.792 1.739 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -1.756 -11.271 3.387 1.00 0.00 H new ATOM 0 HE2 TYR A 127 2.351 -10.376 4.107 1.00 0.00 H new ATOM 0 HH TYR A 127 0.635 -9.931 5.582 1.00 0.00 H new ATOM 976 N CYS A 128 2.774 -9.222 -0.928 1.00 0.00 N ATOM 977 CA CYS A 128 3.629 -8.070 -0.669 1.00 0.00 C ATOM 978 C CYS A 128 3.076 -6.819 -1.346 1.00 0.00 C ATOM 979 O CYS A 128 2.935 -5.771 -0.716 1.00 0.00 O ATOM 980 CB CYS A 128 5.051 -8.343 -1.161 1.00 0.00 C ATOM 981 SG CYS A 128 5.943 -9.604 -0.195 1.00 0.00 S ATOM 0 H CYS A 128 3.279 -10.084 -1.134 1.00 0.00 H new ATOM 0 HA CYS A 128 3.651 -7.900 0.407 1.00 0.00 H new ATOM 0 HB2 CYS A 128 5.009 -8.661 -2.203 1.00 0.00 H new ATOM 0 HB3 CYS A 128 5.618 -7.412 -1.135 1.00 0.00 H new ATOM 986 N ARG A 129 2.764 -6.938 -2.632 1.00 0.00 N ATOM 987 CA ARG A 129 2.227 -5.818 -3.395 1.00 0.00 C ATOM 988 C ARG A 129 1.055 -5.173 -2.661 1.00 0.00 C ATOM 989 O ARG A 129 1.017 -3.956 -2.479 1.00 0.00 O ATOM 990 CB ARG A 129 1.780 -6.284 -4.781 1.00 0.00 C ATOM 991 CG ARG A 129 1.503 -5.144 -5.747 1.00 0.00 C ATOM 992 CD ARG A 129 1.323 -5.651 -7.170 1.00 0.00 C ATOM 993 NE ARG A 129 0.669 -4.664 -8.024 1.00 0.00 N ATOM 994 CZ ARG A 129 0.800 -4.633 -9.346 1.00 0.00 C ATOM 995 NH1 ARG A 129 1.557 -5.530 -9.961 1.00 0.00 N ATOM 996 NH2 ARG A 129 0.172 -3.703 -10.054 1.00 0.00 N ATOM 0 H ARG A 129 2.874 -7.799 -3.168 1.00 0.00 H new ATOM 0 HA ARG A 129 3.017 -5.075 -3.507 1.00 0.00 H new ATOM 0 HB2 ARG A 129 2.550 -6.928 -5.204 1.00 0.00 H new ATOM 0 HB3 ARG A 129 0.879 -6.889 -4.679 1.00 0.00 H new ATOM 0 HG2 ARG A 129 0.606 -4.610 -5.434 1.00 0.00 H new ATOM 0 HG3 ARG A 129 2.326 -4.430 -5.715 1.00 0.00 H new ATOM 0 HD2 ARG A 129 2.296 -5.906 -7.590 1.00 0.00 H new ATOM 0 HD3 ARG A 129 0.732 -6.567 -7.156 1.00 0.00 H new ATOM 0 HE ARG A 129 0.079 -3.959 -7.582 1.00 0.00 H new ATOM 0 HH11 ARG A 129 2.041 -6.246 -9.420 1.00 0.00 H new ATOM 0 HH12 ARG A 129 1.656 -5.504 -10.976 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -0.412 -3.011 -9.584 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.273 -3.680 -11.069 1.00 0.00 H new ATOM 1010 N PHE A 130 0.099 -5.996 -2.243 1.00 0.00 N ATOM 1011 CA PHE A 130 -1.075 -5.506 -1.531 1.00 0.00 C ATOM 1012 C PHE A 130 -0.686 -4.928 -0.174 1.00 0.00 C ATOM 1013 O PHE A 130 -1.030 -3.791 0.149 1.00 0.00 O ATOM 1014 CB PHE A 130 -2.092 -6.634 -1.345 1.00 0.00 C ATOM 1015 CG PHE A 130 -3.383 -6.181 -0.725 1.00 0.00 C ATOM 1016 CD1 PHE A 130 -4.105 -5.137 -1.281 1.00 0.00 C ATOM 1017 CD2 PHE A 130 -3.874 -6.799 0.414 1.00 0.00 C ATOM 1018 CE1 PHE A 130 -5.293 -4.718 -0.713 1.00 0.00 C ATOM 1019 CE2 PHE A 130 -5.062 -6.384 0.986 1.00 0.00 C ATOM 1020 CZ PHE A 130 -5.772 -5.342 0.423 1.00 0.00 C ATOM 0 H PHE A 130 0.115 -7.006 -2.385 1.00 0.00 H new ATOM 0 HA PHE A 130 -1.527 -4.713 -2.128 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -2.303 -7.086 -2.314 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -1.651 -7.411 -0.720 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -3.735 -4.645 -2.168 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -3.323 -7.614 0.860 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -5.847 -3.904 -1.157 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -5.435 -6.875 1.873 1.00 0.00 H new ATOM 0 HZ PHE A 130 -6.700 -5.016 0.870 1.00 0.00 H new ATOM 1030 N GLN A 131 0.032 -5.720 0.616 1.00 0.00 N ATOM 1031 CA GLN A 131 0.466 -5.287 1.939 1.00 0.00 C ATOM 1032 C GLN A 131 1.082 -3.893 1.881 1.00 0.00 C ATOM 1033 O GLN A 131 0.711 -3.006 2.651 1.00 0.00 O ATOM 1034 CB GLN A 131 1.476 -6.280 2.517 1.00 0.00 C ATOM 1035 CG GLN A 131 0.860 -7.609 2.921 1.00 0.00 C ATOM 1036 CD GLN A 131 0.294 -7.587 4.327 1.00 0.00 C ATOM 1037 OE1 GLN A 131 1.036 -7.639 5.308 1.00 0.00 O ATOM 1038 NE2 GLN A 131 -1.027 -7.510 4.433 1.00 0.00 N ATOM 0 H GLN A 131 0.325 -6.664 0.363 1.00 0.00 H new ATOM 0 HA GLN A 131 -0.410 -5.250 2.587 1.00 0.00 H new ATOM 0 HB2 GLN A 131 2.258 -6.461 1.779 1.00 0.00 H new ATOM 0 HB3 GLN A 131 1.956 -5.832 3.387 1.00 0.00 H new ATOM 0 HG2 GLN A 131 0.067 -7.866 2.218 1.00 0.00 H new ATOM 0 HG3 GLN A 131 1.615 -8.392 2.850 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -1.604 -7.469 3.593 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -1.465 -7.492 5.354 1.00 0.00 H new ATOM 1047 N LYS A 132 2.024 -3.705 0.963 1.00 0.00 N ATOM 1048 CA LYS A 132 2.691 -2.419 0.803 1.00 0.00 C ATOM 1049 C LYS A 132 1.674 -1.284 0.729 1.00 0.00 C ATOM 1050 O LYS A 132 1.760 -0.312 1.481 1.00 0.00 O ATOM 1051 CB LYS A 132 3.557 -2.424 -0.459 1.00 0.00 C ATOM 1052 CG LYS A 132 3.762 -1.045 -1.062 1.00 0.00 C ATOM 1053 CD LYS A 132 4.923 -1.032 -2.042 1.00 0.00 C ATOM 1054 CE LYS A 132 6.219 -0.611 -1.366 1.00 0.00 C ATOM 1055 NZ LYS A 132 6.974 -1.781 -0.838 1.00 0.00 N ATOM 0 H LYS A 132 2.343 -4.428 0.318 1.00 0.00 H new ATOM 0 HA LYS A 132 3.327 -2.257 1.673 1.00 0.00 H new ATOM 0 HB2 LYS A 132 4.529 -2.855 -0.220 1.00 0.00 H new ATOM 0 HB3 LYS A 132 3.095 -3.072 -1.204 1.00 0.00 H new ATOM 0 HG2 LYS A 132 2.851 -0.731 -1.571 1.00 0.00 H new ATOM 0 HG3 LYS A 132 3.948 -0.323 -0.267 1.00 0.00 H new ATOM 0 HD2 LYS A 132 5.044 -2.024 -2.477 1.00 0.00 H new ATOM 0 HD3 LYS A 132 4.701 -0.349 -2.862 1.00 0.00 H new ATOM 0 HE2 LYS A 132 6.841 -0.069 -2.078 1.00 0.00 H new ATOM 0 HE3 LYS A 132 5.996 0.076 -0.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 7.962 -1.507 -0.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 6.542 -2.099 0.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 6.945 -2.555 -1.532 1.00 0.00 H new ATOM 1069 N CYS A 133 0.713 -1.415 -0.178 1.00 0.00 N ATOM 1070 CA CYS A 133 -0.321 -0.400 -0.349 1.00 0.00 C ATOM 1071 C CYS A 133 -0.971 -0.057 0.987 1.00 0.00 C ATOM 1072 O CYS A 133 -1.081 1.114 1.354 1.00 0.00 O ATOM 1073 CB CYS A 133 -1.382 -0.885 -1.338 1.00 0.00 C ATOM 1074 SG CYS A 133 -0.981 -0.559 -3.070 1.00 0.00 S ATOM 0 H CYS A 133 0.628 -2.214 -0.807 1.00 0.00 H new ATOM 0 HA CYS A 133 0.149 0.500 -0.745 1.00 0.00 H new ATOM 0 HB2 CYS A 133 -1.524 -1.957 -1.205 1.00 0.00 H new ATOM 0 HB3 CYS A 133 -2.331 -0.406 -1.100 1.00 0.00 H new ATOM 0 HG CYS A 133 -1.744 0.393 -3.520 1.00 0.00 H new ATOM 1080 N LEU A 134 -1.403 -1.084 1.710 1.00 0.00 N ATOM 1081 CA LEU A 134 -2.045 -0.892 3.006 1.00 0.00 C ATOM 1082 C LEU A 134 -1.146 -0.096 3.946 1.00 0.00 C ATOM 1083 O LEU A 134 -1.586 0.864 4.577 1.00 0.00 O ATOM 1084 CB LEU A 134 -2.388 -2.245 3.633 1.00 0.00 C ATOM 1085 CG LEU A 134 -3.412 -3.093 2.879 1.00 0.00 C ATOM 1086 CD1 LEU A 134 -3.436 -4.512 3.426 1.00 0.00 C ATOM 1087 CD2 LEU A 134 -4.794 -2.463 2.966 1.00 0.00 C ATOM 0 H LEU A 134 -1.320 -2.059 1.421 1.00 0.00 H new ATOM 0 HA LEU A 134 -2.964 -0.328 2.849 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -1.468 -2.822 3.729 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -2.762 -2.071 4.642 1.00 0.00 H new ATOM 0 HG LEU A 134 -3.119 -3.134 1.830 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -4.171 -5.101 2.877 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -2.450 -4.963 3.311 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -3.704 -4.490 4.482 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -5.510 -3.080 2.424 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -5.096 -2.390 4.011 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -4.768 -1.466 2.526 1.00 0.00 H new ATOM 1099 N ALA A 135 0.117 -0.502 4.034 1.00 0.00 N ATOM 1100 CA ALA A 135 1.079 0.176 4.894 1.00 0.00 C ATOM 1101 C ALA A 135 1.233 1.641 4.498 1.00 0.00 C ATOM 1102 O ALA A 135 1.466 2.503 5.347 1.00 0.00 O ATOM 1103 CB ALA A 135 2.425 -0.531 4.839 1.00 0.00 C ATOM 0 H ALA A 135 0.497 -1.297 3.520 1.00 0.00 H new ATOM 0 HA ALA A 135 0.703 0.141 5.916 1.00 0.00 H new ATOM 0 HB1 ALA A 135 3.134 -0.014 5.486 1.00 0.00 H new ATOM 0 HB2 ALA A 135 2.309 -1.561 5.177 1.00 0.00 H new ATOM 0 HB3 ALA A 135 2.797 -0.525 3.815 1.00 0.00 H new ATOM 1109 N LEU A 136 1.101 1.916 3.205 1.00 0.00 N ATOM 1110 CA LEU A 136 1.225 3.278 2.697 1.00 0.00 C ATOM 1111 C LEU A 136 0.094 4.159 3.216 1.00 0.00 C ATOM 1112 O LEU A 136 0.255 5.369 3.368 1.00 0.00 O ATOM 1113 CB LEU A 136 1.223 3.275 1.167 1.00 0.00 C ATOM 1114 CG LEU A 136 2.488 2.739 0.495 1.00 0.00 C ATOM 1115 CD1 LEU A 136 2.312 2.694 -1.015 1.00 0.00 C ATOM 1116 CD2 LEU A 136 3.692 3.592 0.868 1.00 0.00 C ATOM 0 H LEU A 136 0.908 1.215 2.490 1.00 0.00 H new ATOM 0 HA LEU A 136 2.171 3.687 3.053 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.375 2.681 0.826 1.00 0.00 H new ATOM 0 HB3 LEU A 136 1.057 4.295 0.822 1.00 0.00 H new ATOM 0 HG LEU A 136 2.663 1.723 0.850 1.00 0.00 H new ATOM 0 HD11 LEU A 136 3.222 2.310 -1.476 1.00 0.00 H new ATOM 0 HD12 LEU A 136 1.476 2.041 -1.265 1.00 0.00 H new ATOM 0 HD13 LEU A 136 2.112 3.698 -1.388 1.00 0.00 H new ATOM 0 HD21 LEU A 136 4.583 3.196 0.381 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.526 4.619 0.542 1.00 0.00 H new ATOM 0 HD23 LEU A 136 3.830 3.573 1.949 1.00 0.00 H new ATOM 1128 N GLY A 137 -1.052 3.542 3.490 1.00 0.00 N ATOM 1129 CA GLY A 137 -2.193 4.285 3.992 1.00 0.00 C ATOM 1130 C GLY A 137 -3.354 4.292 3.018 1.00 0.00 C ATOM 1131 O GLY A 137 -4.198 5.187 3.055 1.00 0.00 O ATOM 0 H GLY A 137 -1.210 2.541 3.373 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -2.518 3.850 4.937 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.891 5.311 4.200 1.00 0.00 H new ATOM 1135 N MET A 138 -3.397 3.293 2.143 1.00 0.00 N ATOM 1136 CA MET A 138 -4.464 3.188 1.154 1.00 0.00 C ATOM 1137 C MET A 138 -5.793 2.853 1.823 1.00 0.00 C ATOM 1138 O MET A 138 -5.962 1.769 2.382 1.00 0.00 O ATOM 1139 CB MET A 138 -4.120 2.121 0.113 1.00 0.00 C ATOM 1140 CG MET A 138 -3.245 2.636 -1.018 1.00 0.00 C ATOM 1141 SD MET A 138 -3.443 1.685 -2.537 1.00 0.00 S ATOM 1142 CE MET A 138 -2.813 2.845 -3.748 1.00 0.00 C ATOM 0 H MET A 138 -2.706 2.544 2.098 1.00 0.00 H new ATOM 0 HA MET A 138 -4.561 4.153 0.656 1.00 0.00 H new ATOM 0 HB2 MET A 138 -3.611 1.293 0.607 1.00 0.00 H new ATOM 0 HB3 MET A 138 -5.044 1.722 -0.306 1.00 0.00 H new ATOM 0 HG2 MET A 138 -3.488 3.680 -1.213 1.00 0.00 H new ATOM 0 HG3 MET A 138 -2.201 2.604 -0.708 1.00 0.00 H new ATOM 0 HE1 MET A 138 -2.870 2.400 -4.742 1.00 0.00 H new ATOM 0 HE2 MET A 138 -3.410 3.757 -3.724 1.00 0.00 H new ATOM 0 HE3 MET A 138 -1.775 3.085 -3.517 1.00 0.00 H new ATOM 1152 N SER A 139 -6.734 3.789 1.761 1.00 0.00 N ATOM 1153 CA SER A 139 -8.047 3.595 2.364 1.00 0.00 C ATOM 1154 C SER A 139 -8.895 2.643 1.525 1.00 0.00 C ATOM 1155 O SER A 139 -9.291 2.968 0.405 1.00 0.00 O ATOM 1156 CB SER A 139 -8.767 4.937 2.515 1.00 0.00 C ATOM 1157 OG SER A 139 -9.783 4.862 3.500 1.00 0.00 O ATOM 0 H SER A 139 -6.611 4.690 1.299 1.00 0.00 H new ATOM 0 HA SER A 139 -7.904 3.154 3.351 1.00 0.00 H new ATOM 0 HB2 SER A 139 -8.049 5.710 2.787 1.00 0.00 H new ATOM 0 HB3 SER A 139 -9.203 5.229 1.560 1.00 0.00 H new ATOM 0 HG SER A 139 -10.227 5.732 3.579 1.00 0.00 H new ATOM 1163 N HIS A 140 -9.169 1.464 2.075 1.00 0.00 N ATOM 1164 CA HIS A 140 -9.970 0.463 1.379 1.00 0.00 C ATOM 1165 C HIS A 140 -11.459 0.703 1.608 1.00 0.00 C ATOM 1166 O HIS A 140 -12.303 0.117 0.932 1.00 0.00 O ATOM 1167 CB HIS A 140 -9.590 -0.941 1.848 1.00 0.00 C ATOM 1168 CG HIS A 140 -9.736 -1.139 3.325 1.00 0.00 C ATOM 1169 ND1 HIS A 140 -8.812 -0.682 4.241 1.00 0.00 N ATOM 1170 CD2 HIS A 140 -10.707 -1.749 4.045 1.00 0.00 C ATOM 1171 CE1 HIS A 140 -9.208 -1.003 5.460 1.00 0.00 C ATOM 1172 NE2 HIS A 140 -10.356 -1.650 5.369 1.00 0.00 N ATOM 0 H HIS A 140 -8.848 1.179 3.000 1.00 0.00 H new ATOM 0 HA HIS A 140 -9.766 0.549 0.312 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -10.213 -1.670 1.329 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -8.558 -1.143 1.563 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -11.593 -2.225 3.651 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -8.682 -0.775 6.375 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -10.894 -2.016 6.154 1.00 0.00 H new ATOM 1180 N ASN A 141 -11.773 1.569 2.567 1.00 0.00 N ATOM 1181 CA ASN A 141 -13.161 1.886 2.886 1.00 0.00 C ATOM 1182 C ASN A 141 -13.655 3.065 2.054 1.00 0.00 C ATOM 1183 O ASN A 141 -14.771 3.547 2.243 1.00 0.00 O ATOM 1184 CB ASN A 141 -13.303 2.203 4.376 1.00 0.00 C ATOM 1185 CG ASN A 141 -12.591 1.191 5.253 1.00 0.00 C ATOM 1186 OD1 ASN A 141 -11.520 1.467 5.793 1.00 0.00 O ATOM 1187 ND2 ASN A 141 -13.184 0.012 5.398 1.00 0.00 N ATOM 0 H ASN A 141 -11.086 2.063 3.136 1.00 0.00 H new ATOM 0 HA ASN A 141 -13.771 1.015 2.647 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -12.901 3.197 4.573 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -14.360 2.228 4.640 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -12.752 -0.709 5.976 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -14.072 -0.173 4.931 1.00 0.00 H new ATOM 1194 N ALA A 142 -12.815 3.524 1.132 1.00 0.00 N ATOM 1195 CA ALA A 142 -13.167 4.645 0.269 1.00 0.00 C ATOM 1196 C ALA A 142 -13.459 4.174 -1.152 1.00 0.00 C ATOM 1197 O ALA A 142 -13.203 4.892 -2.119 1.00 0.00 O ATOM 1198 CB ALA A 142 -12.052 5.680 0.265 1.00 0.00 C ATOM 0 H ALA A 142 -11.886 3.137 0.964 1.00 0.00 H new ATOM 0 HA ALA A 142 -14.073 5.105 0.665 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -12.329 6.511 -0.384 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -11.894 6.048 1.279 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -11.133 5.223 -0.103 1.00 0.00 H new ATOM 1204 N ILE A 143 -13.994 2.964 -1.271 1.00 0.00 N ATOM 1205 CA ILE A 143 -14.320 2.398 -2.574 1.00 0.00 C ATOM 1206 C ILE A 143 -15.779 2.652 -2.934 1.00 0.00 C ATOM 1207 O ILE A 143 -16.651 1.828 -2.657 1.00 0.00 O ATOM 1208 CB ILE A 143 -14.050 0.882 -2.613 1.00 0.00 C ATOM 1209 CG1 ILE A 143 -12.676 0.571 -2.015 1.00 0.00 C ATOM 1210 CG2 ILE A 143 -14.142 0.364 -4.040 1.00 0.00 C ATOM 1211 CD1 ILE A 143 -11.523 1.059 -2.864 1.00 0.00 C ATOM 0 H ILE A 143 -14.211 2.357 -0.481 1.00 0.00 H new ATOM 0 HA ILE A 143 -13.677 2.892 -3.302 1.00 0.00 H new ATOM 0 HB ILE A 143 -14.809 0.377 -2.015 1.00 0.00 H new ATOM 0 HG12 ILE A 143 -12.607 1.026 -1.027 1.00 0.00 H new ATOM 0 HG13 ILE A 143 -12.584 -0.506 -1.877 1.00 0.00 H new ATOM 0 HG21 ILE A 143 -13.949 -0.709 -4.051 1.00 0.00 H new ATOM 0 HG22 ILE A 143 -15.140 0.557 -4.433 1.00 0.00 H new ATOM 0 HG23 ILE A 143 -13.403 0.872 -4.660 1.00 0.00 H new ATOM 0 HD11 ILE A 143 -10.581 0.804 -2.379 1.00 0.00 H new ATOM 0 HD12 ILE A 143 -11.567 0.584 -3.844 1.00 0.00 H new ATOM 0 HD13 ILE A 143 -11.590 2.141 -2.981 1.00 0.00 H new ATOM 1223 N ARG A 144 -16.039 3.798 -3.556 1.00 0.00 N ATOM 1224 CA ARG A 144 -17.393 4.161 -3.955 1.00 0.00 C ATOM 1225 C ARG A 144 -17.371 5.238 -5.036 1.00 0.00 C ATOM 1226 O ARG A 144 -16.805 6.315 -4.842 1.00 0.00 O ATOM 1227 CB ARG A 144 -18.190 4.653 -2.746 1.00 0.00 C ATOM 1228 CG ARG A 144 -19.663 4.885 -3.040 1.00 0.00 C ATOM 1229 CD ARG A 144 -20.484 3.629 -2.793 1.00 0.00 C ATOM 1230 NE ARG A 144 -20.553 3.291 -1.374 1.00 0.00 N ATOM 1231 CZ ARG A 144 -21.400 2.400 -0.871 1.00 0.00 C ATOM 1232 NH1 ARG A 144 -22.246 1.761 -1.667 1.00 0.00 N ATOM 1233 NH2 ARG A 144 -21.402 2.146 0.432 1.00 0.00 N ATOM 0 H ARG A 144 -15.329 4.491 -3.794 1.00 0.00 H new ATOM 0 HA ARG A 144 -17.875 3.272 -4.362 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -18.100 3.924 -1.941 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -17.750 5.582 -2.385 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -20.037 5.695 -2.414 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -19.783 5.202 -4.076 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -21.492 3.773 -3.181 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -20.047 2.796 -3.343 1.00 0.00 H new ATOM 0 HE ARG A 144 -19.916 3.765 -0.734 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -22.248 1.953 -2.669 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -22.895 1.077 -1.278 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -20.753 2.635 1.048 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -22.053 1.462 0.817 1.00 0.00 H new ATOM 1247 N PHE A 145 -17.989 4.940 -6.174 1.00 0.00 N ATOM 1248 CA PHE A 145 -18.039 5.882 -7.286 1.00 0.00 C ATOM 1249 C PHE A 145 -18.976 7.045 -6.972 1.00 0.00 C ATOM 1250 O PHE A 145 -18.655 8.203 -7.234 1.00 0.00 O ATOM 1251 CB PHE A 145 -18.497 5.173 -8.562 1.00 0.00 C ATOM 1252 CG PHE A 145 -19.733 4.341 -8.375 1.00 0.00 C ATOM 1253 CD1 PHE A 145 -19.644 3.043 -7.898 1.00 0.00 C ATOM 1254 CD2 PHE A 145 -20.983 4.856 -8.675 1.00 0.00 C ATOM 1255 CE1 PHE A 145 -20.780 2.274 -7.726 1.00 0.00 C ATOM 1256 CE2 PHE A 145 -22.123 4.093 -8.504 1.00 0.00 C ATOM 1257 CZ PHE A 145 -22.021 2.800 -8.028 1.00 0.00 C ATOM 0 H PHE A 145 -18.462 4.054 -6.350 1.00 0.00 H new ATOM 0 HA PHE A 145 -17.035 6.279 -7.439 1.00 0.00 H new ATOM 0 HB2 PHE A 145 -18.684 5.918 -9.335 1.00 0.00 H new ATOM 0 HB3 PHE A 145 -17.690 4.535 -8.923 1.00 0.00 H new ATOM 0 HD1 PHE A 145 -18.676 2.627 -7.658 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -21.068 5.866 -9.047 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -20.697 1.263 -7.356 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -23.092 4.507 -8.742 1.00 0.00 H new ATOM 0 HZ PHE A 145 -22.910 2.202 -7.892 1.00 0.00 H new ATOM 1267 N GLY A 146 -20.138 6.725 -6.410 1.00 0.00 N ATOM 1268 CA GLY A 146 -21.105 7.753 -6.070 1.00 0.00 C ATOM 1269 C GLY A 146 -22.210 7.235 -5.171 1.00 0.00 C ATOM 1270 O GLY A 146 -22.559 6.056 -5.223 1.00 0.00 O ATOM 0 H GLY A 146 -20.427 5.773 -6.184 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -20.594 8.578 -5.574 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -21.542 8.153 -6.985 1.00 0.00 H new ATOM 1274 N SER A 147 -22.760 8.118 -4.344 1.00 0.00 N ATOM 1275 CA SER A 147 -23.828 7.742 -3.425 1.00 0.00 C ATOM 1276 C SER A 147 -24.977 7.072 -4.173 1.00 0.00 C ATOM 1277 O SER A 147 -25.647 7.699 -4.993 1.00 0.00 O ATOM 1278 CB SER A 147 -24.341 8.972 -2.675 1.00 0.00 C ATOM 1279 OG SER A 147 -25.217 8.601 -1.624 1.00 0.00 O ATOM 0 H SER A 147 -22.484 9.099 -4.291 1.00 0.00 H new ATOM 0 HA SER A 147 -23.422 7.031 -2.706 1.00 0.00 H new ATOM 0 HB2 SER A 147 -23.498 9.532 -2.269 1.00 0.00 H new ATOM 0 HB3 SER A 147 -24.860 9.634 -3.368 1.00 0.00 H new ATOM 0 HG SER A 147 -25.529 9.405 -1.159 1.00 0.00 H new ATOM 1285 N GLY A 148 -25.199 5.794 -3.883 1.00 0.00 N ATOM 1286 CA GLY A 148 -26.267 5.060 -4.536 1.00 0.00 C ATOM 1287 C GLY A 148 -25.819 3.697 -5.027 1.00 0.00 C ATOM 1288 O GLY A 148 -25.162 3.571 -6.060 1.00 0.00 O ATOM 0 H GLY A 148 -24.658 5.254 -3.208 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -27.097 4.937 -3.840 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -26.641 5.641 -5.379 1.00 0.00 H new ATOM 1292 N PRO A 149 -26.175 2.646 -4.273 1.00 0.00 N ATOM 1293 CA PRO A 149 -25.814 1.268 -4.617 1.00 0.00 C ATOM 1294 C PRO A 149 -26.560 0.763 -5.847 1.00 0.00 C ATOM 1295 O PRO A 149 -27.612 0.134 -5.733 1.00 0.00 O ATOM 1296 CB PRO A 149 -26.229 0.473 -3.377 1.00 0.00 C ATOM 1297 CG PRO A 149 -27.306 1.287 -2.747 1.00 0.00 C ATOM 1298 CD PRO A 149 -26.957 2.723 -3.028 1.00 0.00 C ATOM 0 HA PRO A 149 -24.757 1.174 -4.867 1.00 0.00 H new ATOM 0 HB2 PRO A 149 -26.589 -0.520 -3.646 1.00 0.00 H new ATOM 0 HB3 PRO A 149 -25.389 0.334 -2.697 1.00 0.00 H new ATOM 0 HG2 PRO A 149 -28.281 1.034 -3.163 1.00 0.00 H new ATOM 0 HG3 PRO A 149 -27.359 1.101 -1.674 1.00 0.00 H new ATOM 0 HD2 PRO A 149 -27.849 3.337 -3.151 1.00 0.00 H new ATOM 0 HD3 PRO A 149 -26.378 3.162 -2.216 1.00 0.00 H new ATOM 1306 N SER A 150 -26.008 1.042 -7.024 1.00 0.00 N ATOM 1307 CA SER A 150 -26.624 0.619 -8.277 1.00 0.00 C ATOM 1308 C SER A 150 -25.653 -0.219 -9.103 1.00 0.00 C ATOM 1309 O SER A 150 -24.824 0.316 -9.839 1.00 0.00 O ATOM 1310 CB SER A 150 -27.078 1.837 -9.083 1.00 0.00 C ATOM 1311 OG SER A 150 -28.198 1.523 -9.893 1.00 0.00 O ATOM 0 H SER A 150 -25.136 1.559 -7.136 1.00 0.00 H new ATOM 0 HA SER A 150 -27.493 0.006 -8.038 1.00 0.00 H new ATOM 0 HB2 SER A 150 -27.332 2.652 -8.405 1.00 0.00 H new ATOM 0 HB3 SER A 150 -26.259 2.188 -9.710 1.00 0.00 H new ATOM 0 HG SER A 150 -28.470 2.318 -10.397 1.00 0.00 H new ATOM 1317 N SER A 151 -25.762 -1.538 -8.975 1.00 0.00 N ATOM 1318 CA SER A 151 -24.892 -2.452 -9.706 1.00 0.00 C ATOM 1319 C SER A 151 -24.604 -1.923 -11.108 1.00 0.00 C ATOM 1320 O SER A 151 -25.412 -1.199 -11.689 1.00 0.00 O ATOM 1321 CB SER A 151 -25.532 -3.838 -9.793 1.00 0.00 C ATOM 1322 OG SER A 151 -25.867 -4.327 -8.506 1.00 0.00 O ATOM 0 H SER A 151 -26.444 -1.997 -8.372 1.00 0.00 H new ATOM 0 HA SER A 151 -23.949 -2.528 -9.165 1.00 0.00 H new ATOM 0 HB2 SER A 151 -26.428 -3.790 -10.412 1.00 0.00 H new ATOM 0 HB3 SER A 151 -24.845 -4.529 -10.281 1.00 0.00 H new ATOM 0 HG SER A 151 -26.276 -5.214 -8.589 1.00 0.00 H new ATOM 1328 N GLY A 152 -23.445 -2.290 -11.646 1.00 0.00 N ATOM 1329 CA GLY A 152 -23.069 -1.844 -12.975 1.00 0.00 C ATOM 1330 C GLY A 152 -22.027 -2.740 -13.614 1.00 0.00 C ATOM 1331 O GLY A 152 -20.924 -2.294 -13.928 1.00 0.00 O ATOM 0 H GLY A 152 -22.759 -2.888 -11.185 1.00 0.00 H new ATOM 0 HA2 GLY A 152 -23.955 -1.813 -13.609 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -22.683 -0.826 -12.918 1.00 0.00 H new TER 1335 GLY A 152 HETATM 1336 ZN ZN A 200 2.954 2.520 -9.110 1.00 0.00 ZN HETATM 1337 ZN ZN A 300 6.340 -11.457 -1.454 1.00 0.00 ZN