USER MOD reduce.3.24.130724 H: found=0, std=0, add=885, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 883 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 46 SER OG : rot -144:sc= 0.498 USER MOD Set 1.2: A 47 ASN : amide:sc= -0.147 K(o=0.35,f=-2.6!) USER MOD Set 2.1: A 40 THR OG1 : rot 179:sc= 0.0124 USER MOD Set 2.2: A 52 LYS NZ :NH3+ 159:sc= 0.0116 (180deg=0) USER MOD Set 3.1: A 10 SER OG : rot 180:sc= 1.07 USER MOD Set 3.2: A 99 SER OG : rot 61:sc= 1.01 USER MOD Set 4.1: A 5 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 94 SER OG : rot 150:sc= -0.348 USER MOD Set 4.3: A 98 ASN : amide:sc= -3.87! C(o=-4.2!,f=-4.2!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0869) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc=-0.00479 (180deg=-0.00479) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0.112 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -0.0515 X(o=-0.052,f=-0.54) USER MOD Single : A 31 LYS NZ :NH3+ -164:sc=-0.00942 (180deg=-0.274) USER MOD Single : A 32 CYS SG : rot 177:sc= -0.333 USER MOD Single : A 33 SER OG : rot 180:sc= -0.522 USER MOD Single : A 35 LYS NZ :NH3+ 163:sc= -0.149 (180deg=-0.489) USER MOD Single : A 36 ASN : amide:sc= -0.0574 X(o=-0.057,f=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 HIS :FLIP no HD1:sc= -0.711 F(o=-2.4!,f=-0.71) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= 0.155 X(o=0.15,f=0) USER MOD Single : A 54 ASN : amide:sc= -2.16! X(o=-2.2!,f=-1.7) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 CYS SG : rot 3:sc= -1.19 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 ASN : amide:sc= -1.18 X(o=-1.2,f=-1.1) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot 107:sc= -2.24! USER MOD Single : A 75 HIS : no HD1:sc= -0.049 X(o=-0.049,f=-0.0039) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0.38) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 HIS : no HE2:sc= 0.312 K(o=0.31,f=-4!) USER MOD Single : A 82 GLN : amide:sc= -0.394 X(o=-0.39,f=0) USER MOD Single : A 87 GLN : amide:sc= -0.0652 X(o=-0.065,f=-0.064) USER MOD Single : A 89 TYR OH : rot 180:sc= -0.269 USER MOD Single : A 97 THR OG1 : rot 110:sc= 1.29 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= -0.0638 USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.418 -10.086 -12.741 1.00 0.00 N ATOM 2 CA GLY A 1 -9.047 -8.864 -12.052 1.00 0.00 C ATOM 3 C GLY A 1 -9.860 -8.639 -10.793 1.00 0.00 C ATOM 4 O GLY A 1 -9.751 -9.399 -9.831 1.00 0.00 O ATOM 0 H1 GLY A 1 -8.834 -10.194 -13.595 1.00 0.00 H new ATOM 0 H2 GLY A 1 -9.265 -10.900 -12.111 1.00 0.00 H new ATOM 0 H3 GLY A 1 -10.421 -10.041 -13.011 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -7.988 -8.902 -11.795 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.181 -8.016 -12.724 1.00 0.00 H new ATOM 8 N SER A 2 -10.677 -7.590 -10.797 1.00 0.00 N ATOM 9 CA SER A 2 -11.507 -7.263 -9.644 1.00 0.00 C ATOM 10 C SER A 2 -12.949 -7.003 -10.069 1.00 0.00 C ATOM 11 O SER A 2 -13.230 -6.779 -11.246 1.00 0.00 O ATOM 12 CB SER A 2 -10.949 -6.038 -8.917 1.00 0.00 C ATOM 13 OG SER A 2 -9.623 -6.269 -8.473 1.00 0.00 O ATOM 0 H SER A 2 -10.782 -6.952 -11.586 1.00 0.00 H new ATOM 0 HA SER A 2 -11.494 -8.116 -8.965 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.968 -5.176 -9.584 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.584 -5.796 -8.065 1.00 0.00 H new ATOM 0 HG SER A 2 -9.288 -5.471 -8.013 1.00 0.00 H new ATOM 19 N SER A 3 -13.860 -7.033 -9.101 1.00 0.00 N ATOM 20 CA SER A 3 -15.274 -6.805 -9.374 1.00 0.00 C ATOM 21 C SER A 3 -15.842 -5.740 -8.441 1.00 0.00 C ATOM 22 O SER A 3 -16.985 -5.835 -7.996 1.00 0.00 O ATOM 23 CB SER A 3 -16.062 -8.107 -9.221 1.00 0.00 C ATOM 24 OG SER A 3 -15.751 -8.750 -7.997 1.00 0.00 O ATOM 0 H SER A 3 -13.644 -7.213 -8.121 1.00 0.00 H new ATOM 0 HA SER A 3 -15.368 -6.451 -10.401 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.131 -7.896 -9.264 1.00 0.00 H new ATOM 0 HB3 SER A 3 -15.835 -8.773 -10.053 1.00 0.00 H new ATOM 0 HG SER A 3 -16.269 -9.579 -7.922 1.00 0.00 H new ATOM 30 N GLY A 4 -15.034 -4.726 -8.148 1.00 0.00 N ATOM 31 CA GLY A 4 -15.473 -3.658 -7.270 1.00 0.00 C ATOM 32 C GLY A 4 -15.377 -4.035 -5.805 1.00 0.00 C ATOM 33 O GLY A 4 -16.006 -4.996 -5.362 1.00 0.00 O ATOM 0 H GLY A 4 -14.083 -4.625 -8.503 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.869 -2.770 -7.454 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -16.504 -3.397 -7.508 1.00 0.00 H new ATOM 37 N SER A 5 -14.585 -3.279 -5.051 1.00 0.00 N ATOM 38 CA SER A 5 -14.404 -3.544 -3.628 1.00 0.00 C ATOM 39 C SER A 5 -15.525 -2.909 -2.811 1.00 0.00 C ATOM 40 O SER A 5 -16.160 -1.949 -3.248 1.00 0.00 O ATOM 41 CB SER A 5 -13.049 -3.010 -3.157 1.00 0.00 C ATOM 42 OG SER A 5 -11.984 -3.670 -3.819 1.00 0.00 O ATOM 0 H SER A 5 -14.059 -2.479 -5.401 1.00 0.00 H new ATOM 0 HA SER A 5 -14.434 -4.623 -3.477 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.991 -1.938 -3.347 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.954 -3.149 -2.080 1.00 0.00 H new ATOM 0 HG SER A 5 -11.129 -3.310 -3.502 1.00 0.00 H new ATOM 48 N SER A 6 -15.763 -3.453 -1.622 1.00 0.00 N ATOM 49 CA SER A 6 -16.809 -2.944 -0.744 1.00 0.00 C ATOM 50 C SER A 6 -16.215 -2.406 0.555 1.00 0.00 C ATOM 51 O SER A 6 -16.742 -2.650 1.639 1.00 0.00 O ATOM 52 CB SER A 6 -17.826 -4.045 -0.435 1.00 0.00 C ATOM 53 OG SER A 6 -18.641 -4.317 -1.561 1.00 0.00 O ATOM 0 H SER A 6 -15.245 -4.247 -1.245 1.00 0.00 H new ATOM 0 HA SER A 6 -17.314 -2.126 -1.258 1.00 0.00 H new ATOM 0 HB2 SER A 6 -17.303 -4.953 -0.133 1.00 0.00 H new ATOM 0 HB3 SER A 6 -18.451 -3.742 0.405 1.00 0.00 H new ATOM 0 HG SER A 6 -19.281 -5.025 -1.338 1.00 0.00 H new ATOM 59 N GLY A 7 -15.114 -1.671 0.434 1.00 0.00 N ATOM 60 CA GLY A 7 -14.465 -1.110 1.605 1.00 0.00 C ATOM 61 C GLY A 7 -14.181 -2.153 2.667 1.00 0.00 C ATOM 62 O GLY A 7 -14.947 -2.305 3.619 1.00 0.00 O ATOM 0 H GLY A 7 -14.660 -1.454 -0.453 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -13.530 -0.637 1.306 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.097 -0.329 2.027 1.00 0.00 H new ATOM 66 N TYR A 8 -13.078 -2.876 2.504 1.00 0.00 N ATOM 67 CA TYR A 8 -12.697 -3.914 3.454 1.00 0.00 C ATOM 68 C TYR A 8 -11.942 -3.317 4.638 1.00 0.00 C ATOM 69 O TYR A 8 -12.205 -3.657 5.791 1.00 0.00 O ATOM 70 CB TYR A 8 -11.834 -4.973 2.766 1.00 0.00 C ATOM 71 CG TYR A 8 -12.635 -6.074 2.110 1.00 0.00 C ATOM 72 CD1 TYR A 8 -13.810 -5.792 1.424 1.00 0.00 C ATOM 73 CD2 TYR A 8 -12.217 -7.398 2.176 1.00 0.00 C ATOM 74 CE1 TYR A 8 -14.546 -6.795 0.824 1.00 0.00 C ATOM 75 CE2 TYR A 8 -12.946 -8.408 1.577 1.00 0.00 C ATOM 76 CZ TYR A 8 -14.110 -8.101 0.903 1.00 0.00 C ATOM 77 OH TYR A 8 -14.839 -9.103 0.306 1.00 0.00 O ATOM 0 H TYR A 8 -12.432 -2.762 1.723 1.00 0.00 H new ATOM 0 HA TYR A 8 -13.608 -4.383 3.826 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -11.212 -4.489 2.013 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -11.160 -5.414 3.501 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -14.154 -4.770 1.359 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -11.307 -7.642 2.704 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -15.458 -6.558 0.296 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -12.606 -9.432 1.636 1.00 0.00 H new ATOM 0 HH TYR A 8 -14.394 -9.964 0.454 1.00 0.00 H new ATOM 87 N GLY A 9 -11.002 -2.425 4.344 1.00 0.00 N ATOM 88 CA GLY A 9 -10.223 -1.794 5.393 1.00 0.00 C ATOM 89 C GLY A 9 -8.803 -1.489 4.958 1.00 0.00 C ATOM 90 O GLY A 9 -8.272 -2.133 4.053 1.00 0.00 O ATOM 0 H GLY A 9 -10.766 -2.128 3.397 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -10.713 -0.869 5.698 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -10.200 -2.446 6.266 1.00 0.00 H new ATOM 94 N SER A 10 -8.187 -0.502 5.601 1.00 0.00 N ATOM 95 CA SER A 10 -6.822 -0.109 5.272 1.00 0.00 C ATOM 96 C SER A 10 -5.814 -0.904 6.096 1.00 0.00 C ATOM 97 O SER A 10 -4.662 -1.067 5.696 1.00 0.00 O ATOM 98 CB SER A 10 -6.628 1.389 5.513 1.00 0.00 C ATOM 99 OG SER A 10 -5.288 1.678 5.873 1.00 0.00 O ATOM 0 H SER A 10 -8.612 0.040 6.353 1.00 0.00 H new ATOM 0 HA SER A 10 -6.652 -0.325 4.217 1.00 0.00 H new ATOM 0 HB2 SER A 10 -6.894 1.943 4.613 1.00 0.00 H new ATOM 0 HB3 SER A 10 -7.300 1.724 6.303 1.00 0.00 H new ATOM 0 HG SER A 10 -5.189 2.642 6.020 1.00 0.00 H new ATOM 105 N GLU A 11 -6.258 -1.396 7.248 1.00 0.00 N ATOM 106 CA GLU A 11 -5.394 -2.173 8.129 1.00 0.00 C ATOM 107 C GLU A 11 -5.781 -3.649 8.108 1.00 0.00 C ATOM 108 O GLU A 11 -6.962 -3.992 8.037 1.00 0.00 O ATOM 109 CB GLU A 11 -5.471 -1.635 9.560 1.00 0.00 C ATOM 110 CG GLU A 11 -4.201 -1.858 10.363 1.00 0.00 C ATOM 111 CD GLU A 11 -4.167 -3.216 11.036 1.00 0.00 C ATOM 112 OE1 GLU A 11 -5.249 -3.736 11.380 1.00 0.00 O ATOM 113 OE2 GLU A 11 -3.057 -3.759 11.219 1.00 0.00 O ATOM 0 H GLU A 11 -7.210 -1.271 7.593 1.00 0.00 H new ATOM 0 HA GLU A 11 -4.370 -2.078 7.767 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -5.687 -0.567 9.527 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -6.305 -2.113 10.074 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -3.338 -1.761 9.705 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -4.113 -1.079 11.120 1.00 0.00 H new ATOM 120 N LYS A 12 -4.779 -4.518 8.169 1.00 0.00 N ATOM 121 CA LYS A 12 -5.012 -5.958 8.157 1.00 0.00 C ATOM 122 C LYS A 12 -3.738 -6.718 8.514 1.00 0.00 C ATOM 123 O LYS A 12 -2.715 -6.587 7.841 1.00 0.00 O ATOM 124 CB LYS A 12 -5.515 -6.402 6.782 1.00 0.00 C ATOM 125 CG LYS A 12 -5.514 -7.909 6.593 1.00 0.00 C ATOM 126 CD LYS A 12 -6.064 -8.300 5.231 1.00 0.00 C ATOM 127 CE LYS A 12 -5.739 -9.747 4.893 1.00 0.00 C ATOM 128 NZ LYS A 12 -6.201 -10.682 5.956 1.00 0.00 N ATOM 0 H LYS A 12 -3.796 -4.251 8.227 1.00 0.00 H new ATOM 0 HA LYS A 12 -5.771 -6.185 8.906 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -6.528 -6.026 6.636 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -4.892 -5.947 6.012 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -4.498 -8.289 6.699 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -6.112 -8.375 7.376 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -7.144 -8.156 5.219 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -5.647 -7.644 4.467 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -6.209 -10.013 3.946 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -4.663 -9.855 4.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -6.164 -11.658 5.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -5.584 -10.594 6.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -7.178 -10.448 6.224 1.00 0.00 H new ATOM 142 N LYS A 13 -3.808 -7.513 9.576 1.00 0.00 N ATOM 143 CA LYS A 13 -2.662 -8.297 10.022 1.00 0.00 C ATOM 144 C LYS A 13 -2.960 -9.791 9.942 1.00 0.00 C ATOM 145 O LYS A 13 -3.836 -10.297 10.642 1.00 0.00 O ATOM 146 CB LYS A 13 -2.284 -7.918 11.455 1.00 0.00 C ATOM 147 CG LYS A 13 -1.194 -8.793 12.049 1.00 0.00 C ATOM 148 CD LYS A 13 -0.694 -8.239 13.373 1.00 0.00 C ATOM 149 CE LYS A 13 0.354 -7.156 13.164 1.00 0.00 C ATOM 150 NZ LYS A 13 0.462 -6.254 14.344 1.00 0.00 N ATOM 0 H LYS A 13 -4.647 -7.632 10.144 1.00 0.00 H new ATOM 0 HA LYS A 13 -1.824 -8.075 9.361 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -1.954 -6.879 11.472 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -3.172 -7.981 12.084 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -1.577 -9.803 12.197 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -0.363 -8.867 11.348 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -1.532 -7.831 13.938 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -0.270 -9.047 13.970 1.00 0.00 H new ATOM 0 HE2 LYS A 13 1.322 -7.619 12.971 1.00 0.00 H new ATOM 0 HE3 LYS A 13 0.100 -6.570 12.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 1.186 -5.530 14.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -0.454 -5.792 14.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 0.730 -6.809 15.182 1.00 0.00 H new ATOM 164 N GLY A 14 -2.225 -10.492 9.084 1.00 0.00 N ATOM 165 CA GLY A 14 -2.426 -11.921 8.930 1.00 0.00 C ATOM 166 C GLY A 14 -1.194 -12.625 8.396 1.00 0.00 C ATOM 167 O GLY A 14 -0.069 -12.286 8.763 1.00 0.00 O ATOM 0 H GLY A 14 -1.494 -10.096 8.493 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -2.699 -12.352 9.893 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -3.263 -12.096 8.254 1.00 0.00 H new ATOM 171 N TYR A 15 -1.407 -13.609 7.529 1.00 0.00 N ATOM 172 CA TYR A 15 -0.305 -14.366 6.947 1.00 0.00 C ATOM 173 C TYR A 15 -0.479 -14.509 5.438 1.00 0.00 C ATOM 174 O TYR A 15 -1.595 -14.440 4.921 1.00 0.00 O ATOM 175 CB TYR A 15 -0.210 -15.749 7.594 1.00 0.00 C ATOM 176 CG TYR A 15 0.388 -15.729 8.982 1.00 0.00 C ATOM 177 CD1 TYR A 15 -0.383 -15.388 10.087 1.00 0.00 C ATOM 178 CD2 TYR A 15 1.724 -16.048 9.189 1.00 0.00 C ATOM 179 CE1 TYR A 15 0.160 -15.368 11.358 1.00 0.00 C ATOM 180 CE2 TYR A 15 2.275 -16.032 10.456 1.00 0.00 C ATOM 181 CZ TYR A 15 1.489 -15.690 11.537 1.00 0.00 C ATOM 182 OH TYR A 15 2.034 -15.671 12.800 1.00 0.00 O ATOM 0 H TYR A 15 -2.332 -13.901 7.214 1.00 0.00 H new ATOM 0 HA TYR A 15 0.618 -13.819 7.138 1.00 0.00 H new ATOM 0 HB2 TYR A 15 -1.207 -16.187 7.643 1.00 0.00 H new ATOM 0 HB3 TYR A 15 0.392 -16.398 6.958 1.00 0.00 H new ATOM 0 HD1 TYR A 15 -1.424 -15.134 9.950 1.00 0.00 H new ATOM 0 HD2 TYR A 15 2.343 -16.313 8.345 1.00 0.00 H new ATOM 0 HE1 TYR A 15 -0.453 -15.102 12.206 1.00 0.00 H new ATOM 0 HE2 TYR A 15 3.315 -16.286 10.599 1.00 0.00 H new ATOM 0 HH TYR A 15 2.980 -15.924 12.752 1.00 0.00 H new ATOM 192 N LEU A 16 0.632 -14.709 4.738 1.00 0.00 N ATOM 193 CA LEU A 16 0.604 -14.863 3.287 1.00 0.00 C ATOM 194 C LEU A 16 1.744 -15.759 2.813 1.00 0.00 C ATOM 195 O LEU A 16 2.750 -15.920 3.505 1.00 0.00 O ATOM 196 CB LEU A 16 0.698 -13.496 2.608 1.00 0.00 C ATOM 197 CG LEU A 16 -0.631 -12.795 2.324 1.00 0.00 C ATOM 198 CD1 LEU A 16 -0.390 -11.395 1.779 1.00 0.00 C ATOM 199 CD2 LEU A 16 -1.468 -13.612 1.350 1.00 0.00 C ATOM 0 H LEU A 16 1.563 -14.768 5.151 1.00 0.00 H new ATOM 0 HA LEU A 16 -0.341 -15.333 3.014 1.00 0.00 H new ATOM 0 HB2 LEU A 16 1.304 -12.842 3.235 1.00 0.00 H new ATOM 0 HB3 LEU A 16 1.231 -13.617 1.665 1.00 0.00 H new ATOM 0 HG LEU A 16 -1.182 -12.708 3.261 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -1.347 -10.911 1.583 1.00 0.00 H new ATOM 0 HD12 LEU A 16 0.169 -10.811 2.510 1.00 0.00 H new ATOM 0 HD13 LEU A 16 0.181 -11.458 0.853 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -2.410 -13.098 1.160 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.924 -13.731 0.413 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.671 -14.593 1.779 1.00 0.00 H new ATOM 211 N LEU A 17 1.581 -16.337 1.628 1.00 0.00 N ATOM 212 CA LEU A 17 2.597 -17.215 1.059 1.00 0.00 C ATOM 213 C LEU A 17 3.571 -16.428 0.187 1.00 0.00 C ATOM 214 O LEU A 17 3.161 -15.619 -0.645 1.00 0.00 O ATOM 215 CB LEU A 17 1.939 -18.323 0.235 1.00 0.00 C ATOM 216 CG LEU A 17 1.079 -19.319 1.015 1.00 0.00 C ATOM 217 CD1 LEU A 17 0.341 -20.246 0.063 1.00 0.00 C ATOM 218 CD2 LEU A 17 1.936 -20.119 1.985 1.00 0.00 C ATOM 0 H LEU A 17 0.755 -16.213 1.043 1.00 0.00 H new ATOM 0 HA LEU A 17 3.155 -17.664 1.881 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.318 -17.859 -0.531 1.00 0.00 H new ATOM 0 HB3 LEU A 17 2.722 -18.877 -0.283 1.00 0.00 H new ATOM 0 HG LEU A 17 0.341 -18.760 1.590 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.266 -20.948 0.636 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.304 -19.658 -0.591 1.00 0.00 H new ATOM 0 HD13 LEU A 17 1.062 -20.798 -0.540 1.00 0.00 H new ATOM 0 HD21 LEU A 17 1.307 -20.822 2.531 1.00 0.00 H new ATOM 0 HD22 LEU A 17 2.697 -20.668 1.431 1.00 0.00 H new ATOM 0 HD23 LEU A 17 2.418 -19.441 2.689 1.00 0.00 H new ATOM 230 N LYS A 18 4.862 -16.672 0.383 1.00 0.00 N ATOM 231 CA LYS A 18 5.896 -15.990 -0.387 1.00 0.00 C ATOM 232 C LYS A 18 6.776 -16.993 -1.125 1.00 0.00 C ATOM 233 O LYS A 18 7.275 -17.951 -0.533 1.00 0.00 O ATOM 234 CB LYS A 18 6.755 -15.120 0.533 1.00 0.00 C ATOM 235 CG LYS A 18 7.539 -14.047 -0.202 1.00 0.00 C ATOM 236 CD LYS A 18 8.257 -13.120 0.765 1.00 0.00 C ATOM 237 CE LYS A 18 9.022 -12.031 0.029 1.00 0.00 C ATOM 238 NZ LYS A 18 10.409 -12.457 -0.306 1.00 0.00 N ATOM 0 H LYS A 18 5.218 -17.338 1.069 1.00 0.00 H new ATOM 0 HA LYS A 18 5.405 -15.354 -1.124 1.00 0.00 H new ATOM 0 HB2 LYS A 18 6.112 -14.645 1.274 1.00 0.00 H new ATOM 0 HB3 LYS A 18 7.451 -15.758 1.077 1.00 0.00 H new ATOM 0 HG2 LYS A 18 8.266 -14.516 -0.865 1.00 0.00 H new ATOM 0 HG3 LYS A 18 6.863 -13.467 -0.830 1.00 0.00 H new ATOM 0 HD2 LYS A 18 7.532 -12.664 1.440 1.00 0.00 H new ATOM 0 HD3 LYS A 18 8.946 -13.698 1.381 1.00 0.00 H new ATOM 0 HE2 LYS A 18 8.491 -11.770 -0.887 1.00 0.00 H new ATOM 0 HE3 LYS A 18 9.057 -11.132 0.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 10.897 -11.687 -0.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 10.924 -12.682 0.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 10.376 -13.300 -0.915 1.00 0.00 H new ATOM 252 N LYS A 19 6.965 -16.767 -2.420 1.00 0.00 N ATOM 253 CA LYS A 19 7.788 -17.649 -3.239 1.00 0.00 C ATOM 254 C LYS A 19 9.271 -17.357 -3.032 1.00 0.00 C ATOM 255 O LYS A 19 9.704 -16.208 -3.111 1.00 0.00 O ATOM 256 CB LYS A 19 7.428 -17.489 -4.718 1.00 0.00 C ATOM 257 CG LYS A 19 7.679 -18.739 -5.544 1.00 0.00 C ATOM 258 CD LYS A 19 7.525 -18.465 -7.031 1.00 0.00 C ATOM 259 CE LYS A 19 6.139 -17.931 -7.358 1.00 0.00 C ATOM 260 NZ LYS A 19 5.978 -17.663 -8.814 1.00 0.00 N ATOM 0 H LYS A 19 6.559 -15.980 -2.926 1.00 0.00 H new ATOM 0 HA LYS A 19 7.591 -18.676 -2.932 1.00 0.00 H new ATOM 0 HB2 LYS A 19 6.376 -17.215 -4.800 1.00 0.00 H new ATOM 0 HB3 LYS A 19 8.006 -16.665 -5.137 1.00 0.00 H new ATOM 0 HG2 LYS A 19 8.683 -19.113 -5.344 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.982 -19.521 -5.243 1.00 0.00 H new ATOM 0 HD2 LYS A 19 8.278 -17.744 -7.349 1.00 0.00 H new ATOM 0 HD3 LYS A 19 7.704 -19.382 -7.592 1.00 0.00 H new ATOM 0 HE2 LYS A 19 5.387 -18.651 -7.036 1.00 0.00 H new ATOM 0 HE3 LYS A 19 5.962 -17.013 -6.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 5.020 -17.300 -8.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 6.679 -16.957 -9.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 6.122 -18.544 -9.347 1.00 0.00 H new ATOM 274 N SER A 20 10.045 -18.406 -2.768 1.00 0.00 N ATOM 275 CA SER A 20 11.479 -18.261 -2.548 1.00 0.00 C ATOM 276 C SER A 20 12.156 -17.643 -3.767 1.00 0.00 C ATOM 277 O SER A 20 11.493 -17.252 -4.728 1.00 0.00 O ATOM 278 CB SER A 20 12.108 -19.620 -2.235 1.00 0.00 C ATOM 279 OG SER A 20 13.389 -19.467 -1.650 1.00 0.00 O ATOM 0 H SER A 20 9.703 -19.365 -2.701 1.00 0.00 H new ATOM 0 HA SER A 20 11.626 -17.596 -1.697 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.460 -20.177 -1.558 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.191 -20.205 -3.151 1.00 0.00 H new ATOM 0 HG SER A 20 13.769 -20.350 -1.458 1.00 0.00 H new ATOM 285 N ASP A 21 13.481 -17.558 -3.720 1.00 0.00 N ATOM 286 CA ASP A 21 14.250 -16.988 -4.820 1.00 0.00 C ATOM 287 C ASP A 21 14.067 -17.808 -6.093 1.00 0.00 C ATOM 288 O ASP A 21 13.276 -18.750 -6.128 1.00 0.00 O ATOM 289 CB ASP A 21 15.734 -16.921 -4.452 1.00 0.00 C ATOM 290 CG ASP A 21 16.088 -15.647 -3.711 1.00 0.00 C ATOM 291 OD1 ASP A 21 15.817 -15.573 -2.494 1.00 0.00 O ATOM 292 OD2 ASP A 21 16.637 -14.723 -4.347 1.00 0.00 O ATOM 0 H ASP A 21 14.045 -17.877 -2.932 1.00 0.00 H new ATOM 0 HA ASP A 21 13.882 -15.978 -5.003 1.00 0.00 H new ATOM 0 HB2 ASP A 21 15.992 -17.781 -3.834 1.00 0.00 H new ATOM 0 HB3 ASP A 21 16.334 -16.989 -5.359 1.00 0.00 H new ATOM 297 N GLY A 22 14.802 -17.442 -7.139 1.00 0.00 N ATOM 298 CA GLY A 22 14.704 -18.152 -8.400 1.00 0.00 C ATOM 299 C GLY A 22 15.525 -19.426 -8.413 1.00 0.00 C ATOM 300 O GLY A 22 16.115 -19.782 -9.434 1.00 0.00 O ATOM 0 H GLY A 22 15.464 -16.666 -7.135 1.00 0.00 H new ATOM 0 HA2 GLY A 22 13.660 -18.394 -8.597 1.00 0.00 H new ATOM 0 HA3 GLY A 22 15.038 -17.500 -9.207 1.00 0.00 H new ATOM 304 N ILE A 23 15.566 -20.114 -7.276 1.00 0.00 N ATOM 305 CA ILE A 23 16.322 -21.355 -7.161 1.00 0.00 C ATOM 306 C ILE A 23 15.408 -22.523 -6.806 1.00 0.00 C ATOM 307 O ILE A 23 15.498 -23.597 -7.402 1.00 0.00 O ATOM 308 CB ILE A 23 17.430 -21.242 -6.097 1.00 0.00 C ATOM 309 CG1 ILE A 23 18.403 -20.119 -6.460 1.00 0.00 C ATOM 310 CG2 ILE A 23 18.167 -22.566 -5.959 1.00 0.00 C ATOM 311 CD1 ILE A 23 19.138 -20.353 -7.762 1.00 0.00 C ATOM 0 H ILE A 23 15.085 -19.833 -6.422 1.00 0.00 H new ATOM 0 HA ILE A 23 16.781 -21.538 -8.133 1.00 0.00 H new ATOM 0 HB ILE A 23 16.971 -21.002 -5.138 1.00 0.00 H new ATOM 0 HG12 ILE A 23 17.853 -19.180 -6.526 1.00 0.00 H new ATOM 0 HG13 ILE A 23 19.131 -20.006 -5.657 1.00 0.00 H new ATOM 0 HG21 ILE A 23 18.947 -22.471 -5.204 1.00 0.00 H new ATOM 0 HG22 ILE A 23 17.465 -23.344 -5.660 1.00 0.00 H new ATOM 0 HG23 ILE A 23 18.618 -22.833 -6.915 1.00 0.00 H new ATOM 0 HD11 ILE A 23 19.810 -19.517 -7.956 1.00 0.00 H new ATOM 0 HD12 ILE A 23 19.716 -21.275 -7.693 1.00 0.00 H new ATOM 0 HD13 ILE A 23 18.418 -20.436 -8.576 1.00 0.00 H new ATOM 323 N ARG A 24 14.529 -22.306 -5.834 1.00 0.00 N ATOM 324 CA ARG A 24 13.599 -23.341 -5.400 1.00 0.00 C ATOM 325 C ARG A 24 12.155 -22.875 -5.557 1.00 0.00 C ATOM 326 O ARG A 24 11.236 -23.688 -5.666 1.00 0.00 O ATOM 327 CB ARG A 24 13.867 -23.720 -3.942 1.00 0.00 C ATOM 328 CG ARG A 24 15.307 -24.128 -3.674 1.00 0.00 C ATOM 329 CD ARG A 24 15.421 -24.975 -2.416 1.00 0.00 C ATOM 330 NE ARG A 24 16.772 -24.952 -1.861 1.00 0.00 N ATOM 331 CZ ARG A 24 17.075 -25.398 -0.648 1.00 0.00 C ATOM 332 NH1 ARG A 24 16.129 -25.899 0.134 1.00 0.00 N ATOM 333 NH2 ARG A 24 18.328 -25.344 -0.214 1.00 0.00 N ATOM 0 H ARG A 24 14.441 -21.423 -5.332 1.00 0.00 H new ATOM 0 HA ARG A 24 13.751 -24.217 -6.030 1.00 0.00 H new ATOM 0 HB2 ARG A 24 13.613 -22.874 -3.303 1.00 0.00 H new ATOM 0 HB3 ARG A 24 13.207 -24.541 -3.662 1.00 0.00 H new ATOM 0 HG2 ARG A 24 15.693 -24.687 -4.527 1.00 0.00 H new ATOM 0 HG3 ARG A 24 15.926 -23.237 -3.571 1.00 0.00 H new ATOM 0 HD2 ARG A 24 14.716 -24.611 -1.669 1.00 0.00 H new ATOM 0 HD3 ARG A 24 15.140 -26.003 -2.645 1.00 0.00 H new ATOM 0 HE ARG A 24 17.524 -24.573 -2.437 1.00 0.00 H new ATOM 0 HH11 ARG A 24 15.165 -25.943 -0.196 1.00 0.00 H new ATOM 0 HH12 ARG A 24 16.365 -26.241 1.065 1.00 0.00 H new ATOM 0 HH21 ARG A 24 19.059 -24.960 -0.813 1.00 0.00 H new ATOM 0 HH22 ARG A 24 18.560 -25.687 0.718 1.00 0.00 H new ATOM 347 N LYS A 25 11.961 -21.560 -5.569 1.00 0.00 N ATOM 348 CA LYS A 25 10.629 -20.984 -5.714 1.00 0.00 C ATOM 349 C LYS A 25 9.596 -21.802 -4.946 1.00 0.00 C ATOM 350 O LYS A 25 8.570 -22.200 -5.497 1.00 0.00 O ATOM 351 CB LYS A 25 10.241 -20.911 -7.192 1.00 0.00 C ATOM 352 CG LYS A 25 10.789 -19.687 -7.905 1.00 0.00 C ATOM 353 CD LYS A 25 10.136 -19.494 -9.264 1.00 0.00 C ATOM 354 CE LYS A 25 10.581 -20.561 -10.253 1.00 0.00 C ATOM 355 NZ LYS A 25 11.865 -20.202 -10.916 1.00 0.00 N ATOM 0 H LYS A 25 12.710 -20.873 -5.480 1.00 0.00 H new ATOM 0 HA LYS A 25 10.649 -19.976 -5.300 1.00 0.00 H new ATOM 0 HB2 LYS A 25 10.600 -21.807 -7.698 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.154 -20.913 -7.274 1.00 0.00 H new ATOM 0 HG2 LYS A 25 10.622 -18.802 -7.291 1.00 0.00 H new ATOM 0 HG3 LYS A 25 11.867 -19.790 -8.030 1.00 0.00 H new ATOM 0 HD2 LYS A 25 9.052 -19.526 -9.156 1.00 0.00 H new ATOM 0 HD3 LYS A 25 10.388 -18.508 -9.653 1.00 0.00 H new ATOM 0 HE2 LYS A 25 10.694 -21.513 -9.734 1.00 0.00 H new ATOM 0 HE3 LYS A 25 9.808 -20.700 -11.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.134 -20.954 -11.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.750 -19.307 -11.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 12.609 -20.094 -10.197 1.00 0.00 H new ATOM 369 N VAL A 26 9.872 -22.047 -3.669 1.00 0.00 N ATOM 370 CA VAL A 26 8.965 -22.815 -2.824 1.00 0.00 C ATOM 371 C VAL A 26 8.044 -21.896 -2.029 1.00 0.00 C ATOM 372 O VAL A 26 8.492 -20.916 -1.433 1.00 0.00 O ATOM 373 CB VAL A 26 9.739 -23.719 -1.846 1.00 0.00 C ATOM 374 CG1 VAL A 26 10.508 -24.790 -2.604 1.00 0.00 C ATOM 375 CG2 VAL A 26 10.676 -22.888 -0.982 1.00 0.00 C ATOM 0 H VAL A 26 10.717 -21.725 -3.197 1.00 0.00 H new ATOM 0 HA VAL A 26 8.366 -23.439 -3.488 1.00 0.00 H new ATOM 0 HB VAL A 26 9.023 -24.215 -1.191 1.00 0.00 H new ATOM 0 HG11 VAL A 26 11.049 -25.419 -1.897 1.00 0.00 H new ATOM 0 HG12 VAL A 26 9.811 -25.403 -3.175 1.00 0.00 H new ATOM 0 HG13 VAL A 26 11.216 -24.317 -3.284 1.00 0.00 H new ATOM 0 HG21 VAL A 26 11.215 -23.542 -0.297 1.00 0.00 H new ATOM 0 HG22 VAL A 26 11.388 -22.363 -1.619 1.00 0.00 H new ATOM 0 HG23 VAL A 26 10.097 -22.163 -0.411 1.00 0.00 H new ATOM 385 N TRP A 27 6.756 -22.219 -2.025 1.00 0.00 N ATOM 386 CA TRP A 27 5.771 -21.422 -1.302 1.00 0.00 C ATOM 387 C TRP A 27 5.862 -21.674 0.199 1.00 0.00 C ATOM 388 O TRP A 27 5.443 -22.724 0.686 1.00 0.00 O ATOM 389 CB TRP A 27 4.361 -21.742 -1.801 1.00 0.00 C ATOM 390 CG TRP A 27 4.058 -21.151 -3.145 1.00 0.00 C ATOM 391 CD1 TRP A 27 3.848 -21.830 -4.311 1.00 0.00 C ATOM 392 CD2 TRP A 27 3.934 -19.760 -3.461 1.00 0.00 C ATOM 393 NE1 TRP A 27 3.601 -20.946 -5.332 1.00 0.00 N ATOM 394 CE2 TRP A 27 3.647 -19.670 -4.837 1.00 0.00 C ATOM 395 CE3 TRP A 27 4.035 -18.582 -2.716 1.00 0.00 C ATOM 396 CZ2 TRP A 27 3.462 -18.448 -5.480 1.00 0.00 C ATOM 397 CZ3 TRP A 27 3.852 -17.371 -3.355 1.00 0.00 C ATOM 398 CH2 TRP A 27 3.567 -17.311 -4.726 1.00 0.00 C ATOM 0 H TRP A 27 6.369 -23.026 -2.514 1.00 0.00 H new ATOM 0 HA TRP A 27 5.985 -20.369 -1.488 1.00 0.00 H new ATOM 0 HB2 TRP A 27 4.238 -22.824 -1.852 1.00 0.00 H new ATOM 0 HB3 TRP A 27 3.635 -21.372 -1.077 1.00 0.00 H new ATOM 0 HD1 TRP A 27 3.873 -22.905 -4.415 1.00 0.00 H new ATOM 0 HE1 TRP A 27 3.414 -21.199 -6.302 1.00 0.00 H new ATOM 0 HE3 TRP A 27 4.252 -18.618 -1.659 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 3.243 -18.400 -6.537 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 3.930 -16.455 -2.788 1.00 0.00 H new ATOM 0 HH2 TRP A 27 3.428 -16.349 -5.196 1.00 0.00 H new ATOM 409 N GLN A 28 6.410 -20.706 0.925 1.00 0.00 N ATOM 410 CA GLN A 28 6.556 -20.826 2.371 1.00 0.00 C ATOM 411 C GLN A 28 5.719 -19.773 3.091 1.00 0.00 C ATOM 412 O GLN A 28 5.817 -18.581 2.799 1.00 0.00 O ATOM 413 CB GLN A 28 8.026 -20.686 2.771 1.00 0.00 C ATOM 414 CG GLN A 28 8.935 -21.712 2.113 1.00 0.00 C ATOM 415 CD GLN A 28 8.797 -23.092 2.727 1.00 0.00 C ATOM 416 OE1 GLN A 28 8.711 -23.236 3.946 1.00 0.00 O ATOM 417 NE2 GLN A 28 8.776 -24.116 1.882 1.00 0.00 N ATOM 0 H GLN A 28 6.760 -19.830 0.537 1.00 0.00 H new ATOM 0 HA GLN A 28 6.199 -21.813 2.666 1.00 0.00 H new ATOM 0 HB2 GLN A 28 8.372 -19.686 2.510 1.00 0.00 H new ATOM 0 HB3 GLN A 28 8.110 -20.779 3.854 1.00 0.00 H new ATOM 0 HG2 GLN A 28 8.704 -21.767 1.049 1.00 0.00 H new ATOM 0 HG3 GLN A 28 9.970 -21.382 2.198 1.00 0.00 H new ATOM 0 HE21 GLN A 28 8.850 -23.951 0.878 1.00 0.00 H new ATOM 0 HE22 GLN A 28 8.686 -25.068 2.237 1.00 0.00 H new ATOM 426 N ARG A 29 4.896 -20.221 4.034 1.00 0.00 N ATOM 427 CA ARG A 29 4.041 -19.318 4.794 1.00 0.00 C ATOM 428 C ARG A 29 4.870 -18.241 5.489 1.00 0.00 C ATOM 429 O ARG A 29 5.894 -18.534 6.105 1.00 0.00 O ATOM 430 CB ARG A 29 3.231 -20.100 5.830 1.00 0.00 C ATOM 431 CG ARG A 29 2.050 -19.324 6.391 1.00 0.00 C ATOM 432 CD ARG A 29 1.540 -19.944 7.682 1.00 0.00 C ATOM 433 NE ARG A 29 0.459 -19.162 8.275 1.00 0.00 N ATOM 434 CZ ARG A 29 -0.121 -19.466 9.431 1.00 0.00 C ATOM 435 NH1 ARG A 29 0.276 -20.531 10.115 1.00 0.00 N ATOM 436 NH2 ARG A 29 -1.098 -18.705 9.906 1.00 0.00 N ATOM 0 H ARG A 29 4.804 -21.204 4.290 1.00 0.00 H new ATOM 0 HA ARG A 29 3.357 -18.833 4.098 1.00 0.00 H new ATOM 0 HB2 ARG A 29 2.867 -21.021 5.374 1.00 0.00 H new ATOM 0 HB3 ARG A 29 3.888 -20.389 6.650 1.00 0.00 H new ATOM 0 HG2 ARG A 29 2.346 -18.291 6.574 1.00 0.00 H new ATOM 0 HG3 ARG A 29 1.246 -19.300 5.655 1.00 0.00 H new ATOM 0 HD2 ARG A 29 1.188 -20.956 7.484 1.00 0.00 H new ATOM 0 HD3 ARG A 29 2.361 -20.026 8.394 1.00 0.00 H new ATOM 0 HE ARG A 29 0.131 -18.336 7.774 1.00 0.00 H new ATOM 0 HH11 ARG A 29 1.028 -21.118 9.754 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -0.170 -20.763 11.002 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -1.405 -17.885 9.384 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -1.542 -18.940 10.794 1.00 0.00 H new ATOM 450 N ARG A 30 4.419 -16.996 5.383 1.00 0.00 N ATOM 451 CA ARG A 30 5.119 -15.875 5.999 1.00 0.00 C ATOM 452 C ARG A 30 4.132 -14.904 6.641 1.00 0.00 C ATOM 453 O ARG A 30 3.099 -14.575 6.058 1.00 0.00 O ATOM 454 CB ARG A 30 5.968 -15.142 4.959 1.00 0.00 C ATOM 455 CG ARG A 30 7.112 -15.978 4.409 1.00 0.00 C ATOM 456 CD ARG A 30 8.317 -15.952 5.336 1.00 0.00 C ATOM 457 NE ARG A 30 9.438 -16.719 4.798 1.00 0.00 N ATOM 458 CZ ARG A 30 10.232 -16.278 3.829 1.00 0.00 C ATOM 459 NH1 ARG A 30 10.030 -15.081 3.294 1.00 0.00 N ATOM 460 NH2 ARG A 30 11.232 -17.034 3.393 1.00 0.00 N ATOM 0 H ARG A 30 3.572 -16.738 4.876 1.00 0.00 H new ATOM 0 HA ARG A 30 5.772 -16.271 6.777 1.00 0.00 H new ATOM 0 HB2 ARG A 30 5.328 -14.830 4.134 1.00 0.00 H new ATOM 0 HB3 ARG A 30 6.374 -14.235 5.407 1.00 0.00 H new ATOM 0 HG2 ARG A 30 6.779 -17.007 4.272 1.00 0.00 H new ATOM 0 HG3 ARG A 30 7.399 -15.602 3.427 1.00 0.00 H new ATOM 0 HD2 ARG A 30 8.628 -14.920 5.497 1.00 0.00 H new ATOM 0 HD3 ARG A 30 8.035 -16.356 6.308 1.00 0.00 H new ATOM 0 HE ARG A 30 9.621 -17.644 5.188 1.00 0.00 H new ATOM 0 HH11 ARG A 30 9.263 -14.496 3.627 1.00 0.00 H new ATOM 0 HH12 ARG A 30 10.642 -14.745 2.550 1.00 0.00 H new ATOM 0 HH21 ARG A 30 11.391 -17.955 3.802 1.00 0.00 H new ATOM 0 HH22 ARG A 30 11.841 -16.694 2.649 1.00 0.00 H new ATOM 474 N LYS A 31 4.457 -14.449 7.847 1.00 0.00 N ATOM 475 CA LYS A 31 3.601 -13.515 8.569 1.00 0.00 C ATOM 476 C LYS A 31 3.631 -12.136 7.919 1.00 0.00 C ATOM 477 O LYS A 31 4.686 -11.508 7.822 1.00 0.00 O ATOM 478 CB LYS A 31 4.043 -13.412 10.030 1.00 0.00 C ATOM 479 CG LYS A 31 2.937 -12.965 10.970 1.00 0.00 C ATOM 480 CD LYS A 31 2.818 -11.451 11.011 1.00 0.00 C ATOM 481 CE LYS A 31 2.001 -10.988 12.207 1.00 0.00 C ATOM 482 NZ LYS A 31 0.804 -11.847 12.427 1.00 0.00 N ATOM 0 H LYS A 31 5.307 -14.712 8.345 1.00 0.00 H new ATOM 0 HA LYS A 31 2.579 -13.893 8.531 1.00 0.00 H new ATOM 0 HB2 LYS A 31 4.416 -14.382 10.357 1.00 0.00 H new ATOM 0 HB3 LYS A 31 4.874 -12.710 10.101 1.00 0.00 H new ATOM 0 HG2 LYS A 31 1.989 -13.397 10.649 1.00 0.00 H new ATOM 0 HG3 LYS A 31 3.136 -13.343 11.973 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.813 -11.008 11.055 1.00 0.00 H new ATOM 0 HD3 LYS A 31 2.352 -11.097 10.092 1.00 0.00 H new ATOM 0 HE2 LYS A 31 2.626 -11.000 13.100 1.00 0.00 H new ATOM 0 HE3 LYS A 31 1.684 -9.956 12.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 0.138 -11.359 13.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 0.340 -12.036 11.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 1.097 -12.746 12.860 1.00 0.00 H new ATOM 496 N CYS A 32 2.468 -11.670 7.477 1.00 0.00 N ATOM 497 CA CYS A 32 2.362 -10.363 6.837 1.00 0.00 C ATOM 498 C CYS A 32 1.481 -9.427 7.657 1.00 0.00 C ATOM 499 O CYS A 32 0.705 -9.870 8.504 1.00 0.00 O ATOM 500 CB CYS A 32 1.795 -10.510 5.424 1.00 0.00 C ATOM 501 SG CYS A 32 3.040 -10.865 4.162 1.00 0.00 S ATOM 0 H CYS A 32 1.586 -12.177 7.550 1.00 0.00 H new ATOM 0 HA CYS A 32 3.361 -9.932 6.777 1.00 0.00 H new ATOM 0 HB2 CYS A 32 1.054 -11.309 5.423 1.00 0.00 H new ATOM 0 HB3 CYS A 32 1.273 -9.591 5.156 1.00 0.00 H new ATOM 0 HG CYS A 32 2.457 -11.037 3.013 1.00 0.00 H new ATOM 507 N SER A 33 1.608 -8.128 7.401 1.00 0.00 N ATOM 508 CA SER A 33 0.827 -7.128 8.120 1.00 0.00 C ATOM 509 C SER A 33 0.729 -5.835 7.315 1.00 0.00 C ATOM 510 O SER A 33 1.639 -5.489 6.561 1.00 0.00 O ATOM 511 CB SER A 33 1.454 -6.846 9.486 1.00 0.00 C ATOM 512 OG SER A 33 2.108 -7.995 9.994 1.00 0.00 O ATOM 0 H SER A 33 2.244 -7.744 6.702 1.00 0.00 H new ATOM 0 HA SER A 33 -0.179 -7.523 8.265 1.00 0.00 H new ATOM 0 HB2 SER A 33 2.167 -6.026 9.400 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.682 -6.525 10.185 1.00 0.00 H new ATOM 0 HG SER A 33 2.502 -7.788 10.867 1.00 0.00 H new ATOM 518 N VAL A 34 -0.382 -5.124 7.482 1.00 0.00 N ATOM 519 CA VAL A 34 -0.600 -3.869 6.774 1.00 0.00 C ATOM 520 C VAL A 34 -1.264 -2.836 7.677 1.00 0.00 C ATOM 521 O VAL A 34 -2.414 -3.000 8.086 1.00 0.00 O ATOM 522 CB VAL A 34 -1.472 -4.076 5.521 1.00 0.00 C ATOM 523 CG1 VAL A 34 -2.140 -2.771 5.114 1.00 0.00 C ATOM 524 CG2 VAL A 34 -0.638 -4.636 4.379 1.00 0.00 C ATOM 0 H VAL A 34 -1.145 -5.396 8.102 1.00 0.00 H new ATOM 0 HA VAL A 34 0.381 -3.503 6.469 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.253 -4.798 5.758 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -2.752 -2.937 4.227 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -2.771 -2.416 5.929 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -1.377 -2.025 4.894 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.270 -4.776 3.502 1.00 0.00 H new ATOM 0 HG22 VAL A 34 0.166 -3.940 4.140 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -0.212 -5.594 4.676 1.00 0.00 H new ATOM 534 N LYS A 35 -0.533 -1.770 7.985 1.00 0.00 N ATOM 535 CA LYS A 35 -1.050 -0.708 8.839 1.00 0.00 C ATOM 536 C LYS A 35 -0.380 0.624 8.518 1.00 0.00 C ATOM 537 O LYS A 35 0.836 0.690 8.338 1.00 0.00 O ATOM 538 CB LYS A 35 -0.832 -1.058 10.313 1.00 0.00 C ATOM 539 CG LYS A 35 0.592 -1.477 10.634 1.00 0.00 C ATOM 540 CD LYS A 35 0.693 -2.096 12.018 1.00 0.00 C ATOM 541 CE LYS A 35 0.491 -3.603 11.971 1.00 0.00 C ATOM 542 NZ LYS A 35 1.731 -4.316 11.554 1.00 0.00 N ATOM 0 H LYS A 35 0.420 -1.619 7.655 1.00 0.00 H new ATOM 0 HA LYS A 35 -2.119 -0.612 8.649 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -1.095 -0.195 10.925 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -1.511 -1.865 10.591 1.00 0.00 H new ATOM 0 HG2 LYS A 35 0.938 -2.193 9.888 1.00 0.00 H new ATOM 0 HG3 LYS A 35 1.250 -0.610 10.573 1.00 0.00 H new ATOM 0 HD2 LYS A 35 1.669 -1.872 12.447 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -0.054 -1.648 12.673 1.00 0.00 H new ATOM 0 HE2 LYS A 35 0.180 -3.959 12.953 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -0.315 -3.840 11.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 1.654 -5.322 11.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 1.855 -4.224 10.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 2.551 -3.900 12.040 1.00 0.00 H new ATOM 556 N ASN A 36 -1.180 1.683 8.448 1.00 0.00 N ATOM 557 CA ASN A 36 -0.663 3.013 8.149 1.00 0.00 C ATOM 558 C ASN A 36 -0.056 3.059 6.750 1.00 0.00 C ATOM 559 O ASN A 36 0.829 3.867 6.472 1.00 0.00 O ATOM 560 CB ASN A 36 0.386 3.421 9.185 1.00 0.00 C ATOM 561 CG ASN A 36 -0.156 3.382 10.601 1.00 0.00 C ATOM 562 OD1 ASN A 36 -0.732 4.357 11.084 1.00 0.00 O ATOM 563 ND2 ASN A 36 0.028 2.253 11.275 1.00 0.00 N ATOM 0 H ASN A 36 -2.189 1.646 8.594 1.00 0.00 H new ATOM 0 HA ASN A 36 -1.495 3.716 8.189 1.00 0.00 H new ATOM 0 HB2 ASN A 36 1.246 2.755 9.109 1.00 0.00 H new ATOM 0 HB3 ASN A 36 0.741 4.427 8.962 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -0.314 2.169 12.232 1.00 0.00 H new ATOM 0 HD22 ASN A 36 0.511 1.470 10.835 1.00 0.00 H new ATOM 570 N GLY A 37 -0.540 2.186 5.871 1.00 0.00 N ATOM 571 CA GLY A 37 -0.035 2.144 4.512 1.00 0.00 C ATOM 572 C GLY A 37 1.358 1.552 4.429 1.00 0.00 C ATOM 573 O GLY A 37 2.178 1.987 3.620 1.00 0.00 O ATOM 0 H GLY A 37 -1.273 1.507 6.077 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -0.714 1.556 3.894 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -0.022 3.153 4.101 1.00 0.00 H new ATOM 577 N ILE A 38 1.628 0.559 5.270 1.00 0.00 N ATOM 578 CA ILE A 38 2.932 -0.093 5.288 1.00 0.00 C ATOM 579 C ILE A 38 2.788 -1.606 5.408 1.00 0.00 C ATOM 580 O ILE A 38 2.050 -2.105 6.258 1.00 0.00 O ATOM 581 CB ILE A 38 3.802 0.423 6.450 1.00 0.00 C ATOM 582 CG1 ILE A 38 3.998 1.936 6.336 1.00 0.00 C ATOM 583 CG2 ILE A 38 5.145 -0.291 6.462 1.00 0.00 C ATOM 584 CD1 ILE A 38 4.775 2.354 5.107 1.00 0.00 C ATOM 0 H ILE A 38 0.962 0.189 5.947 1.00 0.00 H new ATOM 0 HA ILE A 38 3.420 0.149 4.344 1.00 0.00 H new ATOM 0 HB ILE A 38 3.291 0.212 7.389 1.00 0.00 H new ATOM 0 HG12 ILE A 38 3.022 2.421 6.321 1.00 0.00 H new ATOM 0 HG13 ILE A 38 4.518 2.295 7.224 1.00 0.00 H new ATOM 0 HG21 ILE A 38 5.749 0.084 7.288 1.00 0.00 H new ATOM 0 HG22 ILE A 38 4.986 -1.362 6.585 1.00 0.00 H new ATOM 0 HG23 ILE A 38 5.663 -0.107 5.521 1.00 0.00 H new ATOM 0 HD11 ILE A 38 4.875 3.439 5.092 1.00 0.00 H new ATOM 0 HD12 ILE A 38 5.765 1.898 5.130 1.00 0.00 H new ATOM 0 HD13 ILE A 38 4.245 2.026 4.213 1.00 0.00 H new ATOM 596 N LEU A 39 3.500 -2.332 4.553 1.00 0.00 N ATOM 597 CA LEU A 39 3.454 -3.790 4.563 1.00 0.00 C ATOM 598 C LEU A 39 4.727 -4.370 5.172 1.00 0.00 C ATOM 599 O LEU A 39 5.765 -4.444 4.514 1.00 0.00 O ATOM 600 CB LEU A 39 3.265 -4.324 3.143 1.00 0.00 C ATOM 601 CG LEU A 39 3.586 -5.804 2.934 1.00 0.00 C ATOM 602 CD1 LEU A 39 2.775 -6.666 3.889 1.00 0.00 C ATOM 603 CD2 LEU A 39 3.321 -6.209 1.491 1.00 0.00 C ATOM 0 H LEU A 39 4.116 -1.935 3.844 1.00 0.00 H new ATOM 0 HA LEU A 39 2.607 -4.098 5.175 1.00 0.00 H new ATOM 0 HB2 LEU A 39 2.230 -4.152 2.846 1.00 0.00 H new ATOM 0 HB3 LEU A 39 3.891 -3.738 2.470 1.00 0.00 H new ATOM 0 HG LEU A 39 4.644 -5.960 3.146 1.00 0.00 H new ATOM 0 HD11 LEU A 39 3.017 -7.716 3.726 1.00 0.00 H new ATOM 0 HD12 LEU A 39 3.014 -6.394 4.917 1.00 0.00 H new ATOM 0 HD13 LEU A 39 1.712 -6.506 3.710 1.00 0.00 H new ATOM 0 HD21 LEU A 39 3.555 -7.266 1.361 1.00 0.00 H new ATOM 0 HD22 LEU A 39 2.271 -6.038 1.252 1.00 0.00 H new ATOM 0 HD23 LEU A 39 3.947 -5.614 0.825 1.00 0.00 H new ATOM 615 N THR A 40 4.639 -4.783 6.432 1.00 0.00 N ATOM 616 CA THR A 40 5.783 -5.357 7.130 1.00 0.00 C ATOM 617 C THR A 40 5.904 -6.851 6.849 1.00 0.00 C ATOM 618 O THR A 40 4.918 -7.585 6.910 1.00 0.00 O ATOM 619 CB THR A 40 5.681 -5.139 8.651 1.00 0.00 C ATOM 620 OG1 THR A 40 5.432 -3.758 8.932 1.00 0.00 O ATOM 621 CG2 THR A 40 6.959 -5.582 9.348 1.00 0.00 C ATOM 0 H THR A 40 3.787 -4.731 6.990 1.00 0.00 H new ATOM 0 HA THR A 40 6.670 -4.846 6.757 1.00 0.00 H new ATOM 0 HB THR A 40 4.854 -5.740 9.028 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.351 -3.631 9.900 1.00 0.00 H new ATOM 0 HG21 THR A 40 6.863 -5.418 10.421 1.00 0.00 H new ATOM 0 HG22 THR A 40 7.130 -6.641 9.156 1.00 0.00 H new ATOM 0 HG23 THR A 40 7.801 -5.004 8.966 1.00 0.00 H new ATOM 629 N ILE A 41 7.119 -7.294 6.542 1.00 0.00 N ATOM 630 CA ILE A 41 7.368 -8.700 6.253 1.00 0.00 C ATOM 631 C ILE A 41 8.425 -9.275 7.190 1.00 0.00 C ATOM 632 O ILE A 41 9.584 -8.859 7.165 1.00 0.00 O ATOM 633 CB ILE A 41 7.825 -8.904 4.797 1.00 0.00 C ATOM 634 CG1 ILE A 41 6.752 -8.401 3.828 1.00 0.00 C ATOM 635 CG2 ILE A 41 8.132 -10.372 4.538 1.00 0.00 C ATOM 636 CD1 ILE A 41 7.264 -8.179 2.422 1.00 0.00 C ATOM 0 H ILE A 41 7.946 -6.699 6.487 1.00 0.00 H new ATOM 0 HA ILE A 41 6.425 -9.225 6.406 1.00 0.00 H new ATOM 0 HB ILE A 41 8.736 -8.328 4.634 1.00 0.00 H new ATOM 0 HG12 ILE A 41 5.934 -9.121 3.799 1.00 0.00 H new ATOM 0 HG13 ILE A 41 6.340 -7.466 4.208 1.00 0.00 H new ATOM 0 HG21 ILE A 41 8.454 -10.500 3.504 1.00 0.00 H new ATOM 0 HG22 ILE A 41 8.926 -10.701 5.208 1.00 0.00 H new ATOM 0 HG23 ILE A 41 7.237 -10.968 4.715 1.00 0.00 H new ATOM 0 HD11 ILE A 41 6.450 -7.823 1.790 1.00 0.00 H new ATOM 0 HD12 ILE A 41 8.062 -7.437 2.438 1.00 0.00 H new ATOM 0 HD13 ILE A 41 7.649 -9.117 2.023 1.00 0.00 H new ATOM 648 N SER A 42 8.018 -10.234 8.016 1.00 0.00 N ATOM 649 CA SER A 42 8.930 -10.864 8.963 1.00 0.00 C ATOM 650 C SER A 42 9.886 -11.814 8.248 1.00 0.00 C ATOM 651 O SER A 42 9.470 -12.831 7.693 1.00 0.00 O ATOM 652 CB SER A 42 8.142 -11.626 10.032 1.00 0.00 C ATOM 653 OG SER A 42 8.997 -12.088 11.063 1.00 0.00 O ATOM 0 H SER A 42 7.063 -10.591 8.048 1.00 0.00 H new ATOM 0 HA SER A 42 9.516 -10.079 9.442 1.00 0.00 H new ATOM 0 HB2 SER A 42 7.375 -10.977 10.455 1.00 0.00 H new ATOM 0 HB3 SER A 42 7.628 -12.472 9.575 1.00 0.00 H new ATOM 0 HG SER A 42 8.470 -12.570 11.734 1.00 0.00 H new ATOM 659 N HIS A 43 11.171 -11.473 8.264 1.00 0.00 N ATOM 660 CA HIS A 43 12.188 -12.294 7.617 1.00 0.00 C ATOM 661 C HIS A 43 12.911 -13.167 8.638 1.00 0.00 C ATOM 662 O HIS A 43 12.987 -12.826 9.818 1.00 0.00 O ATOM 663 CB HIS A 43 13.195 -11.410 6.881 1.00 0.00 C ATOM 664 CG HIS A 43 12.644 -10.782 5.638 1.00 0.00 C ATOM 665 ND1 HIS A 43 11.367 -10.530 5.264 1.00 0.00 N flip ATOM 666 CD2 HIS A 43 13.440 -10.333 4.605 1.00 0.00 C flip ATOM 667 CE1 HIS A 43 11.415 -9.938 4.026 1.00 0.00 C flip ATOM 668 NE2 HIS A 43 12.677 -9.830 3.651 1.00 0.00 N flip ATOM 0 H HIS A 43 11.532 -10.634 8.718 1.00 0.00 H new ATOM 0 HA HIS A 43 11.691 -12.943 6.896 1.00 0.00 H new ATOM 0 HB2 HIS A 43 13.537 -10.624 7.555 1.00 0.00 H new ATOM 0 HB3 HIS A 43 14.068 -12.008 6.620 1.00 0.00 H new ATOM 0 HD2 HIS A 43 14.518 -10.385 4.580 1.00 0.00 H new ATOM 0 HE1 HIS A 43 10.560 -9.613 3.452 1.00 0.00 H new ATOM 0 HE2 HIS A 43 13.006 -9.427 2.774 1.00 0.00 H new ATOM 677 N ALA A 44 13.439 -14.296 8.175 1.00 0.00 N ATOM 678 CA ALA A 44 14.157 -15.217 9.047 1.00 0.00 C ATOM 679 C ALA A 44 15.601 -14.770 9.249 1.00 0.00 C ATOM 680 O ALA A 44 16.134 -14.838 10.357 1.00 0.00 O ATOM 681 CB ALA A 44 14.113 -16.627 8.476 1.00 0.00 C ATOM 0 H ALA A 44 13.383 -14.594 7.201 1.00 0.00 H new ATOM 0 HA ALA A 44 13.665 -15.215 10.020 1.00 0.00 H new ATOM 0 HB1 ALA A 44 14.653 -17.304 9.137 1.00 0.00 H new ATOM 0 HB2 ALA A 44 13.076 -16.953 8.391 1.00 0.00 H new ATOM 0 HB3 ALA A 44 14.578 -16.635 7.490 1.00 0.00 H new ATOM 687 N THR A 45 16.230 -14.314 8.171 1.00 0.00 N ATOM 688 CA THR A 45 17.613 -13.858 8.229 1.00 0.00 C ATOM 689 C THR A 45 17.731 -12.402 7.793 1.00 0.00 C ATOM 690 O THR A 45 17.546 -12.078 6.620 1.00 0.00 O ATOM 691 CB THR A 45 18.528 -14.723 7.342 1.00 0.00 C ATOM 692 OG1 THR A 45 18.473 -16.089 7.766 1.00 0.00 O ATOM 693 CG2 THR A 45 19.965 -14.226 7.399 1.00 0.00 C ATOM 0 H THR A 45 15.803 -14.251 7.247 1.00 0.00 H new ATOM 0 HA THR A 45 17.932 -13.951 9.267 1.00 0.00 H new ATOM 0 HB THR A 45 18.175 -14.648 6.313 1.00 0.00 H new ATOM 0 HG1 THR A 45 19.056 -16.632 7.196 1.00 0.00 H new ATOM 0 HG21 THR A 45 20.592 -14.853 6.765 1.00 0.00 H new ATOM 0 HG22 THR A 45 20.008 -13.195 7.047 1.00 0.00 H new ATOM 0 HG23 THR A 45 20.326 -14.274 8.426 1.00 0.00 H new ATOM 701 N SER A 46 18.040 -11.527 8.745 1.00 0.00 N ATOM 702 CA SER A 46 18.179 -10.104 8.460 1.00 0.00 C ATOM 703 C SER A 46 18.897 -9.389 9.601 1.00 0.00 C ATOM 704 O SER A 46 19.308 -10.013 10.577 1.00 0.00 O ATOM 705 CB SER A 46 16.805 -9.471 8.230 1.00 0.00 C ATOM 706 OG SER A 46 16.927 -8.113 7.846 1.00 0.00 O ATOM 0 H SER A 46 18.199 -11.779 9.721 1.00 0.00 H new ATOM 0 HA SER A 46 18.776 -9.997 7.554 1.00 0.00 H new ATOM 0 HB2 SER A 46 16.271 -10.024 7.457 1.00 0.00 H new ATOM 0 HB3 SER A 46 16.211 -9.543 9.141 1.00 0.00 H new ATOM 0 HG SER A 46 16.188 -7.597 8.231 1.00 0.00 H new ATOM 712 N ASN A 47 19.042 -8.074 9.468 1.00 0.00 N ATOM 713 CA ASN A 47 19.710 -7.272 10.487 1.00 0.00 C ATOM 714 C ASN A 47 18.759 -6.950 11.635 1.00 0.00 C ATOM 715 O ASN A 47 18.494 -5.783 11.927 1.00 0.00 O ATOM 716 CB ASN A 47 20.246 -5.977 9.875 1.00 0.00 C ATOM 717 CG ASN A 47 20.984 -6.215 8.572 1.00 0.00 C ATOM 718 OD1 ASN A 47 20.397 -6.659 7.585 1.00 0.00 O ATOM 719 ND2 ASN A 47 22.279 -5.921 8.563 1.00 0.00 N ATOM 0 H ASN A 47 18.706 -7.542 8.665 1.00 0.00 H new ATOM 0 HA ASN A 47 20.544 -7.852 10.882 1.00 0.00 H new ATOM 0 HB2 ASN A 47 19.417 -5.291 9.700 1.00 0.00 H new ATOM 0 HB3 ASN A 47 20.916 -5.493 10.586 1.00 0.00 H new ATOM 0 HD21 ASN A 47 22.828 -6.061 7.715 1.00 0.00 H new ATOM 0 HD22 ASN A 47 22.725 -5.555 9.404 1.00 0.00 H new ATOM 726 N ARG A 48 18.248 -7.991 12.284 1.00 0.00 N ATOM 727 CA ARG A 48 17.326 -7.819 13.400 1.00 0.00 C ATOM 728 C ARG A 48 16.231 -6.816 13.050 1.00 0.00 C ATOM 729 O ARG A 48 15.931 -5.913 13.832 1.00 0.00 O ATOM 730 CB ARG A 48 18.081 -7.353 14.646 1.00 0.00 C ATOM 731 CG ARG A 48 18.772 -8.480 15.397 1.00 0.00 C ATOM 732 CD ARG A 48 19.549 -7.957 16.595 1.00 0.00 C ATOM 733 NE ARG A 48 20.540 -6.956 16.209 1.00 0.00 N ATOM 734 CZ ARG A 48 21.157 -6.161 17.077 1.00 0.00 C ATOM 735 NH1 ARG A 48 20.885 -6.249 18.371 1.00 0.00 N ATOM 736 NH2 ARG A 48 22.047 -5.275 16.649 1.00 0.00 N ATOM 0 H ARG A 48 18.457 -8.963 12.056 1.00 0.00 H new ATOM 0 HA ARG A 48 16.860 -8.783 13.606 1.00 0.00 H new ATOM 0 HB2 ARG A 48 18.826 -6.613 14.354 1.00 0.00 H new ATOM 0 HB3 ARG A 48 17.383 -6.854 15.318 1.00 0.00 H new ATOM 0 HG2 ARG A 48 18.030 -9.204 15.732 1.00 0.00 H new ATOM 0 HG3 ARG A 48 19.449 -9.006 14.724 1.00 0.00 H new ATOM 0 HD2 ARG A 48 18.856 -7.522 17.315 1.00 0.00 H new ATOM 0 HD3 ARG A 48 20.048 -8.788 17.094 1.00 0.00 H new ATOM 0 HE ARG A 48 20.771 -6.862 15.220 1.00 0.00 H new ATOM 0 HH11 ARG A 48 20.200 -6.928 18.703 1.00 0.00 H new ATOM 0 HH12 ARG A 48 21.360 -5.637 19.035 1.00 0.00 H new ATOM 0 HH21 ARG A 48 22.258 -5.204 15.654 1.00 0.00 H new ATOM 0 HH22 ARG A 48 22.520 -4.665 17.315 1.00 0.00 H new ATOM 750 N GLN A 49 15.638 -6.980 11.872 1.00 0.00 N ATOM 751 CA GLN A 49 14.578 -6.088 11.420 1.00 0.00 C ATOM 752 C GLN A 49 13.912 -6.629 10.158 1.00 0.00 C ATOM 753 O GLN A 49 14.575 -7.036 9.204 1.00 0.00 O ATOM 754 CB GLN A 49 15.138 -4.689 11.155 1.00 0.00 C ATOM 755 CG GLN A 49 15.691 -4.510 9.751 1.00 0.00 C ATOM 756 CD GLN A 49 16.509 -3.243 9.603 1.00 0.00 C ATOM 757 OE1 GLN A 49 16.132 -2.329 8.869 1.00 0.00 O ATOM 758 NE2 GLN A 49 17.637 -3.182 10.301 1.00 0.00 N ATOM 0 H GLN A 49 15.874 -7.722 11.214 1.00 0.00 H new ATOM 0 HA GLN A 49 13.827 -6.028 12.208 1.00 0.00 H new ATOM 0 HB2 GLN A 49 14.351 -3.954 11.323 1.00 0.00 H new ATOM 0 HB3 GLN A 49 15.928 -4.480 11.877 1.00 0.00 H new ATOM 0 HG2 GLN A 49 16.311 -5.370 9.496 1.00 0.00 H new ATOM 0 HG3 GLN A 49 14.866 -4.490 9.039 1.00 0.00 H new ATOM 0 HE21 GLN A 49 17.911 -3.963 10.897 1.00 0.00 H new ATOM 0 HE22 GLN A 49 18.230 -2.354 10.241 1.00 0.00 H new ATOM 767 N PRO A 50 12.571 -6.634 10.152 1.00 0.00 N ATOM 768 CA PRO A 50 11.787 -7.123 9.014 1.00 0.00 C ATOM 769 C PRO A 50 11.886 -6.201 7.804 1.00 0.00 C ATOM 770 O PRO A 50 12.725 -5.301 7.764 1.00 0.00 O ATOM 771 CB PRO A 50 10.354 -7.145 9.554 1.00 0.00 C ATOM 772 CG PRO A 50 10.344 -6.128 10.643 1.00 0.00 C ATOM 773 CD PRO A 50 11.717 -6.164 11.256 1.00 0.00 C ATOM 0 HA PRO A 50 12.139 -8.093 8.662 1.00 0.00 H new ATOM 0 HB2 PRO A 50 9.633 -6.898 8.775 1.00 0.00 H new ATOM 0 HB3 PRO A 50 10.088 -8.132 9.932 1.00 0.00 H new ATOM 0 HG2 PRO A 50 10.118 -5.137 10.249 1.00 0.00 H new ATOM 0 HG3 PRO A 50 9.579 -6.358 11.385 1.00 0.00 H new ATOM 0 HD2 PRO A 50 12.024 -5.180 11.611 1.00 0.00 H new ATOM 0 HD3 PRO A 50 11.758 -6.839 12.111 1.00 0.00 H new ATOM 781 N ALA A 51 11.023 -6.430 6.819 1.00 0.00 N ATOM 782 CA ALA A 51 11.013 -5.618 5.608 1.00 0.00 C ATOM 783 C ALA A 51 9.700 -4.854 5.472 1.00 0.00 C ATOM 784 O ALA A 51 8.628 -5.453 5.380 1.00 0.00 O ATOM 785 CB ALA A 51 11.247 -6.492 4.385 1.00 0.00 C ATOM 0 H ALA A 51 10.322 -7.171 6.836 1.00 0.00 H new ATOM 0 HA ALA A 51 11.821 -4.890 5.680 1.00 0.00 H new ATOM 0 HB1 ALA A 51 11.237 -5.873 3.488 1.00 0.00 H new ATOM 0 HB2 ALA A 51 12.213 -6.989 4.472 1.00 0.00 H new ATOM 0 HB3 ALA A 51 10.459 -7.242 4.317 1.00 0.00 H new ATOM 791 N LYS A 52 9.791 -3.529 5.460 1.00 0.00 N ATOM 792 CA LYS A 52 8.611 -2.682 5.334 1.00 0.00 C ATOM 793 C LYS A 52 8.489 -2.126 3.918 1.00 0.00 C ATOM 794 O LYS A 52 9.491 -1.801 3.280 1.00 0.00 O ATOM 795 CB LYS A 52 8.673 -1.532 6.341 1.00 0.00 C ATOM 796 CG LYS A 52 8.472 -1.973 7.781 1.00 0.00 C ATOM 797 CD LYS A 52 7.827 -0.878 8.614 1.00 0.00 C ATOM 798 CE LYS A 52 8.219 -0.989 10.079 1.00 0.00 C ATOM 799 NZ LYS A 52 7.328 -1.921 10.824 1.00 0.00 N ATOM 0 H LYS A 52 10.670 -3.018 5.536 1.00 0.00 H new ATOM 0 HA LYS A 52 7.733 -3.293 5.543 1.00 0.00 H new ATOM 0 HB2 LYS A 52 9.639 -1.035 6.253 1.00 0.00 H new ATOM 0 HB3 LYS A 52 7.911 -0.795 6.086 1.00 0.00 H new ATOM 0 HG2 LYS A 52 7.847 -2.866 7.805 1.00 0.00 H new ATOM 0 HG3 LYS A 52 9.433 -2.245 8.217 1.00 0.00 H new ATOM 0 HD2 LYS A 52 8.126 0.097 8.229 1.00 0.00 H new ATOM 0 HD3 LYS A 52 6.743 -0.939 8.521 1.00 0.00 H new ATOM 0 HE2 LYS A 52 9.250 -1.335 10.154 1.00 0.00 H new ATOM 0 HE3 LYS A 52 8.180 -0.002 10.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 7.810 -2.247 11.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 6.449 -1.429 11.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 7.102 -2.739 10.224 1.00 0.00 H new ATOM 813 N LEU A 53 7.257 -2.017 3.434 1.00 0.00 N ATOM 814 CA LEU A 53 7.004 -1.499 2.095 1.00 0.00 C ATOM 815 C LEU A 53 6.010 -0.342 2.137 1.00 0.00 C ATOM 816 O LEU A 53 5.027 -0.383 2.876 1.00 0.00 O ATOM 817 CB LEU A 53 6.472 -2.610 1.188 1.00 0.00 C ATOM 818 CG LEU A 53 7.454 -3.735 0.860 1.00 0.00 C ATOM 819 CD1 LEU A 53 6.708 -5.033 0.593 1.00 0.00 C ATOM 820 CD2 LEU A 53 8.317 -3.359 -0.336 1.00 0.00 C ATOM 0 H LEU A 53 6.417 -2.281 3.949 1.00 0.00 H new ATOM 0 HA LEU A 53 7.947 -1.130 1.692 1.00 0.00 H new ATOM 0 HB2 LEU A 53 5.593 -3.048 1.661 1.00 0.00 H new ATOM 0 HB3 LEU A 53 6.140 -2.160 0.252 1.00 0.00 H new ATOM 0 HG LEU A 53 8.106 -3.884 1.721 1.00 0.00 H new ATOM 0 HD11 LEU A 53 7.423 -5.822 0.361 1.00 0.00 H new ATOM 0 HD12 LEU A 53 6.134 -5.311 1.477 1.00 0.00 H new ATOM 0 HD13 LEU A 53 6.032 -4.897 -0.251 1.00 0.00 H new ATOM 0 HD21 LEU A 53 9.010 -4.172 -0.555 1.00 0.00 H new ATOM 0 HD22 LEU A 53 7.680 -3.182 -1.203 1.00 0.00 H new ATOM 0 HD23 LEU A 53 8.880 -2.454 -0.108 1.00 0.00 H new ATOM 832 N ASN A 54 6.272 0.687 1.338 1.00 0.00 N ATOM 833 CA ASN A 54 5.400 1.854 1.283 1.00 0.00 C ATOM 834 C ASN A 54 4.210 1.601 0.362 1.00 0.00 C ATOM 835 O ASN A 54 4.340 1.640 -0.862 1.00 0.00 O ATOM 836 CB ASN A 54 6.181 3.078 0.801 1.00 0.00 C ATOM 837 CG ASN A 54 5.634 4.373 1.370 1.00 0.00 C ATOM 838 OD1 ASN A 54 5.375 4.478 2.569 1.00 0.00 O ATOM 839 ND2 ASN A 54 5.456 5.369 0.509 1.00 0.00 N ATOM 0 H ASN A 54 7.082 0.736 0.720 1.00 0.00 H new ATOM 0 HA ASN A 54 5.025 2.044 2.289 1.00 0.00 H new ATOM 0 HB2 ASN A 54 7.228 2.973 1.085 1.00 0.00 H new ATOM 0 HB3 ASN A 54 6.149 3.120 -0.288 1.00 0.00 H new ATOM 0 HD21 ASN A 54 5.091 6.265 0.833 1.00 0.00 H new ATOM 0 HD22 ASN A 54 5.684 5.238 -0.477 1.00 0.00 H new ATOM 846 N LEU A 55 3.052 1.343 0.959 1.00 0.00 N ATOM 847 CA LEU A 55 1.838 1.084 0.192 1.00 0.00 C ATOM 848 C LEU A 55 1.443 2.305 -0.632 1.00 0.00 C ATOM 849 O LEU A 55 0.557 2.233 -1.484 1.00 0.00 O ATOM 850 CB LEU A 55 0.693 0.696 1.130 1.00 0.00 C ATOM 851 CG LEU A 55 0.579 -0.791 1.470 1.00 0.00 C ATOM 852 CD1 LEU A 55 1.898 -1.316 2.015 1.00 0.00 C ATOM 853 CD2 LEU A 55 -0.545 -1.025 2.469 1.00 0.00 C ATOM 0 H LEU A 55 2.928 1.307 1.971 1.00 0.00 H new ATOM 0 HA LEU A 55 2.038 0.258 -0.490 1.00 0.00 H new ATOM 0 HB2 LEU A 55 0.807 1.253 2.060 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -0.245 1.018 0.678 1.00 0.00 H new ATOM 0 HG LEU A 55 0.344 -1.337 0.556 1.00 0.00 H new ATOM 0 HD11 LEU A 55 1.798 -2.375 2.251 1.00 0.00 H new ATOM 0 HD12 LEU A 55 2.679 -1.183 1.267 1.00 0.00 H new ATOM 0 HD13 LEU A 55 2.163 -0.766 2.918 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -0.612 -2.088 2.699 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -0.341 -0.468 3.383 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -1.489 -0.687 2.041 1.00 0.00 H new ATOM 865 N LEU A 56 2.108 3.426 -0.374 1.00 0.00 N ATOM 866 CA LEU A 56 1.829 4.664 -1.094 1.00 0.00 C ATOM 867 C LEU A 56 2.441 4.632 -2.490 1.00 0.00 C ATOM 868 O LEU A 56 2.118 5.461 -3.342 1.00 0.00 O ATOM 869 CB LEU A 56 2.370 5.864 -0.314 1.00 0.00 C ATOM 870 CG LEU A 56 2.074 5.878 1.186 1.00 0.00 C ATOM 871 CD1 LEU A 56 2.243 7.281 1.750 1.00 0.00 C ATOM 872 CD2 LEU A 56 0.670 5.358 1.458 1.00 0.00 C ATOM 0 H LEU A 56 2.844 3.503 0.328 1.00 0.00 H new ATOM 0 HA LEU A 56 0.748 4.761 -1.194 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.451 5.904 -0.451 1.00 0.00 H new ATOM 0 HB3 LEU A 56 1.959 6.773 -0.754 1.00 0.00 H new ATOM 0 HG LEU A 56 2.786 5.220 1.683 1.00 0.00 H new ATOM 0 HD11 LEU A 56 2.028 7.272 2.819 1.00 0.00 H new ATOM 0 HD12 LEU A 56 3.267 7.617 1.589 1.00 0.00 H new ATOM 0 HD13 LEU A 56 1.555 7.961 1.247 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.477 5.375 2.531 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -0.057 5.990 0.948 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.583 4.336 1.090 1.00 0.00 H new ATOM 884 N THR A 57 3.327 3.668 -2.720 1.00 0.00 N ATOM 885 CA THR A 57 3.984 3.526 -4.013 1.00 0.00 C ATOM 886 C THR A 57 3.988 2.073 -4.472 1.00 0.00 C ATOM 887 O THR A 57 4.493 1.753 -5.549 1.00 0.00 O ATOM 888 CB THR A 57 5.435 4.041 -3.965 1.00 0.00 C ATOM 889 OG1 THR A 57 6.255 3.127 -3.229 1.00 0.00 O ATOM 890 CG2 THR A 57 5.500 5.418 -3.322 1.00 0.00 C ATOM 0 H THR A 57 3.606 2.974 -2.027 1.00 0.00 H new ATOM 0 HA THR A 57 3.416 4.127 -4.723 1.00 0.00 H new ATOM 0 HB THR A 57 5.804 4.117 -4.988 1.00 0.00 H new ATOM 0 HG1 THR A 57 7.176 3.461 -3.204 1.00 0.00 H new ATOM 0 HG21 THR A 57 6.535 5.761 -3.299 1.00 0.00 H new ATOM 0 HG22 THR A 57 4.898 6.119 -3.901 1.00 0.00 H new ATOM 0 HG23 THR A 57 5.114 5.363 -2.304 1.00 0.00 H new ATOM 898 N CYS A 58 3.421 1.196 -3.651 1.00 0.00 N ATOM 899 CA CYS A 58 3.359 -0.225 -3.973 1.00 0.00 C ATOM 900 C CYS A 58 2.326 -0.491 -5.063 1.00 0.00 C ATOM 901 O CYS A 58 1.263 0.128 -5.086 1.00 0.00 O ATOM 902 CB CYS A 58 3.021 -1.038 -2.723 1.00 0.00 C ATOM 903 SG CYS A 58 1.248 -1.248 -2.436 1.00 0.00 S ATOM 0 H CYS A 58 2.997 1.444 -2.757 1.00 0.00 H new ATOM 0 HA CYS A 58 4.337 -0.532 -4.343 1.00 0.00 H new ATOM 0 HB2 CYS A 58 3.484 -2.021 -2.806 1.00 0.00 H new ATOM 0 HB3 CYS A 58 3.463 -0.550 -1.855 1.00 0.00 H new ATOM 0 HG CYS A 58 0.583 -0.693 -3.406 1.00 0.00 H new ATOM 909 N GLN A 59 2.648 -1.414 -5.963 1.00 0.00 N ATOM 910 CA GLN A 59 1.748 -1.759 -7.057 1.00 0.00 C ATOM 911 C GLN A 59 1.196 -3.170 -6.883 1.00 0.00 C ATOM 912 O GLN A 59 1.943 -4.148 -6.911 1.00 0.00 O ATOM 913 CB GLN A 59 2.474 -1.645 -8.399 1.00 0.00 C ATOM 914 CG GLN A 59 1.571 -1.871 -9.601 1.00 0.00 C ATOM 915 CD GLN A 59 0.935 -0.589 -10.102 1.00 0.00 C ATOM 916 OE1 GLN A 59 -0.173 -0.234 -9.700 1.00 0.00 O ATOM 917 NE2 GLN A 59 1.635 0.113 -10.986 1.00 0.00 N ATOM 0 H GLN A 59 3.524 -1.936 -5.956 1.00 0.00 H new ATOM 0 HA GLN A 59 0.914 -1.057 -7.043 1.00 0.00 H new ATOM 0 HB2 GLN A 59 2.926 -0.656 -8.475 1.00 0.00 H new ATOM 0 HB3 GLN A 59 3.288 -2.370 -8.425 1.00 0.00 H new ATOM 0 HG2 GLN A 59 2.150 -2.323 -10.406 1.00 0.00 H new ATOM 0 HG3 GLN A 59 0.788 -2.581 -9.334 1.00 0.00 H new ATOM 0 HE21 GLN A 59 2.550 -0.219 -11.291 1.00 0.00 H new ATOM 0 HE22 GLN A 59 1.258 0.984 -11.359 1.00 0.00 H new ATOM 926 N VAL A 60 -0.118 -3.268 -6.703 1.00 0.00 N ATOM 927 CA VAL A 60 -0.770 -4.560 -6.525 1.00 0.00 C ATOM 928 C VAL A 60 -1.285 -5.103 -7.853 1.00 0.00 C ATOM 929 O VAL A 60 -2.364 -4.728 -8.313 1.00 0.00 O ATOM 930 CB VAL A 60 -1.944 -4.463 -5.532 1.00 0.00 C ATOM 931 CG1 VAL A 60 -2.682 -5.791 -5.447 1.00 0.00 C ATOM 932 CG2 VAL A 60 -1.448 -4.031 -4.161 1.00 0.00 C ATOM 0 H VAL A 60 -0.751 -2.469 -6.677 1.00 0.00 H new ATOM 0 HA VAL A 60 -0.020 -5.241 -6.124 1.00 0.00 H new ATOM 0 HB VAL A 60 -2.642 -3.709 -5.894 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -3.508 -5.704 -4.741 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -3.071 -6.054 -6.430 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.996 -6.567 -5.109 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.291 -3.968 -3.473 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.729 -4.760 -3.788 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -0.969 -3.055 -4.238 1.00 0.00 H new ATOM 942 N LYS A 61 -0.507 -5.989 -8.465 1.00 0.00 N ATOM 943 CA LYS A 61 -0.884 -6.587 -9.740 1.00 0.00 C ATOM 944 C LYS A 61 -1.356 -8.025 -9.548 1.00 0.00 C ATOM 945 O LYS A 61 -0.562 -8.966 -9.519 1.00 0.00 O ATOM 946 CB LYS A 61 0.298 -6.552 -10.712 1.00 0.00 C ATOM 947 CG LYS A 61 0.556 -5.179 -11.306 1.00 0.00 C ATOM 948 CD LYS A 61 1.266 -5.275 -12.646 1.00 0.00 C ATOM 949 CE LYS A 61 0.285 -5.533 -13.779 1.00 0.00 C ATOM 950 NZ LYS A 61 0.984 -5.802 -15.067 1.00 0.00 N ATOM 0 H LYS A 61 0.389 -6.309 -8.098 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.707 -6.006 -10.157 1.00 0.00 H new ATOM 0 HB2 LYS A 61 1.195 -6.888 -10.192 1.00 0.00 H new ATOM 0 HB3 LYS A 61 0.114 -7.260 -11.520 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -0.390 -4.652 -11.432 1.00 0.00 H new ATOM 0 HG3 LYS A 61 1.159 -4.590 -10.615 1.00 0.00 H new ATOM 0 HD2 LYS A 61 1.810 -4.350 -12.838 1.00 0.00 H new ATOM 0 HD3 LYS A 61 2.003 -6.077 -12.612 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -0.348 -6.383 -13.525 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -0.371 -4.670 -13.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 0.281 -5.973 -15.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 1.569 -4.981 -15.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 1.591 -6.640 -14.964 1.00 0.00 H new ATOM 964 N PRO A 62 -2.679 -8.202 -9.416 1.00 0.00 N ATOM 965 CA PRO A 62 -3.286 -9.523 -9.227 1.00 0.00 C ATOM 966 C PRO A 62 -3.197 -10.386 -10.481 1.00 0.00 C ATOM 967 O PRO A 62 -3.272 -9.881 -11.600 1.00 0.00 O ATOM 968 CB PRO A 62 -4.746 -9.199 -8.903 1.00 0.00 C ATOM 969 CG PRO A 62 -4.988 -7.870 -9.531 1.00 0.00 C ATOM 970 CD PRO A 62 -3.684 -7.126 -9.440 1.00 0.00 C ATOM 0 HA PRO A 62 -2.780 -10.097 -8.451 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -5.418 -9.956 -9.307 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -4.914 -9.165 -7.827 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -5.303 -7.980 -10.569 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -5.781 -7.332 -9.012 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -3.540 -6.461 -10.292 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -3.635 -6.510 -8.542 1.00 0.00 H new ATOM 978 N ASN A 63 -3.037 -11.691 -10.285 1.00 0.00 N ATOM 979 CA ASN A 63 -2.938 -12.625 -11.401 1.00 0.00 C ATOM 980 C ASN A 63 -4.255 -12.696 -12.169 1.00 0.00 C ATOM 981 O ASN A 63 -5.319 -12.407 -11.624 1.00 0.00 O ATOM 982 CB ASN A 63 -2.554 -14.017 -10.896 1.00 0.00 C ATOM 983 CG ASN A 63 -1.052 -14.205 -10.805 1.00 0.00 C ATOM 984 OD1 ASN A 63 -0.471 -15.011 -11.532 1.00 0.00 O ATOM 985 ND2 ASN A 63 -0.416 -13.459 -9.909 1.00 0.00 N ATOM 0 H ASN A 63 -2.973 -12.125 -9.364 1.00 0.00 H new ATOM 0 HA ASN A 63 -2.162 -12.264 -12.077 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -2.998 -14.179 -9.914 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -2.972 -14.771 -11.563 1.00 0.00 H new ATOM 0 HD21 ASN A 63 0.595 -13.541 -9.802 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -0.939 -12.804 -9.328 1.00 0.00 H new ATOM 992 N ALA A 64 -4.173 -13.083 -13.438 1.00 0.00 N ATOM 993 CA ALA A 64 -5.357 -13.195 -14.280 1.00 0.00 C ATOM 994 C ALA A 64 -5.578 -14.636 -14.729 1.00 0.00 C ATOM 995 O ALA A 64 -6.688 -15.160 -14.640 1.00 0.00 O ATOM 996 CB ALA A 64 -5.235 -12.277 -15.487 1.00 0.00 C ATOM 0 H ALA A 64 -3.299 -13.324 -13.905 1.00 0.00 H new ATOM 0 HA ALA A 64 -6.221 -12.889 -13.691 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -6.126 -12.371 -16.107 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -5.134 -11.245 -15.151 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -4.357 -12.556 -16.069 1.00 0.00 H new ATOM 1002 N GLU A 65 -4.514 -15.270 -15.212 1.00 0.00 N ATOM 1003 CA GLU A 65 -4.593 -16.650 -15.676 1.00 0.00 C ATOM 1004 C GLU A 65 -4.815 -17.605 -14.507 1.00 0.00 C ATOM 1005 O GLU A 65 -5.334 -18.708 -14.682 1.00 0.00 O ATOM 1006 CB GLU A 65 -3.316 -17.033 -16.427 1.00 0.00 C ATOM 1007 CG GLU A 65 -2.056 -16.906 -15.588 1.00 0.00 C ATOM 1008 CD GLU A 65 -0.804 -17.291 -16.353 1.00 0.00 C ATOM 1009 OE1 GLU A 65 -0.579 -16.725 -17.444 1.00 0.00 O ATOM 1010 OE2 GLU A 65 -0.052 -18.158 -15.863 1.00 0.00 O ATOM 0 H GLU A 65 -3.588 -14.850 -15.292 1.00 0.00 H new ATOM 0 HA GLU A 65 -5.442 -16.730 -16.354 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -3.406 -18.061 -16.779 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -3.220 -16.401 -17.310 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -1.961 -15.879 -15.236 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -2.147 -17.539 -14.705 1.00 0.00 H new ATOM 1017 N ASP A 66 -4.418 -17.174 -13.315 1.00 0.00 N ATOM 1018 CA ASP A 66 -4.573 -17.989 -12.116 1.00 0.00 C ATOM 1019 C ASP A 66 -5.059 -17.144 -10.943 1.00 0.00 C ATOM 1020 O ASP A 66 -4.409 -16.175 -10.550 1.00 0.00 O ATOM 1021 CB ASP A 66 -3.249 -18.666 -11.759 1.00 0.00 C ATOM 1022 CG ASP A 66 -3.418 -19.757 -10.719 1.00 0.00 C ATOM 1023 OD1 ASP A 66 -4.417 -20.503 -10.798 1.00 0.00 O ATOM 1024 OD2 ASP A 66 -2.551 -19.865 -9.827 1.00 0.00 O ATOM 0 H ASP A 66 -3.986 -16.264 -13.153 1.00 0.00 H new ATOM 0 HA ASP A 66 -5.320 -18.755 -12.322 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -2.808 -19.092 -12.660 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -2.551 -17.917 -11.386 1.00 0.00 H new ATOM 1029 N LYS A 67 -6.207 -17.516 -10.387 1.00 0.00 N ATOM 1030 CA LYS A 67 -6.782 -16.793 -9.259 1.00 0.00 C ATOM 1031 C LYS A 67 -6.024 -17.103 -7.972 1.00 0.00 C ATOM 1032 O LYS A 67 -5.196 -18.013 -7.930 1.00 0.00 O ATOM 1033 CB LYS A 67 -8.259 -17.156 -9.093 1.00 0.00 C ATOM 1034 CG LYS A 67 -9.101 -16.030 -8.519 1.00 0.00 C ATOM 1035 CD LYS A 67 -10.524 -16.071 -9.052 1.00 0.00 C ATOM 1036 CE LYS A 67 -10.588 -15.629 -10.506 1.00 0.00 C ATOM 1037 NZ LYS A 67 -11.904 -15.946 -11.125 1.00 0.00 N ATOM 0 H LYS A 67 -6.758 -18.315 -10.700 1.00 0.00 H new ATOM 0 HA LYS A 67 -6.698 -15.726 -9.463 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -8.665 -17.444 -10.063 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -8.340 -18.027 -8.442 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -9.116 -16.104 -7.432 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -8.646 -15.071 -8.767 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -10.919 -17.083 -8.961 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -11.159 -15.425 -8.446 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -10.407 -14.556 -10.568 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -9.794 -16.119 -11.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -11.907 -15.629 -12.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -12.066 -16.973 -11.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -12.660 -15.458 -10.603 1.00 0.00 H new ATOM 1051 N LYS A 68 -6.313 -16.341 -6.922 1.00 0.00 N ATOM 1052 CA LYS A 68 -5.661 -16.535 -5.632 1.00 0.00 C ATOM 1053 C LYS A 68 -4.163 -16.268 -5.734 1.00 0.00 C ATOM 1054 O LYS A 68 -3.353 -16.999 -5.166 1.00 0.00 O ATOM 1055 CB LYS A 68 -5.903 -17.958 -5.124 1.00 0.00 C ATOM 1056 CG LYS A 68 -7.155 -18.096 -4.276 1.00 0.00 C ATOM 1057 CD LYS A 68 -7.170 -19.410 -3.514 1.00 0.00 C ATOM 1058 CE LYS A 68 -7.522 -20.578 -4.423 1.00 0.00 C ATOM 1059 NZ LYS A 68 -8.995 -20.730 -4.586 1.00 0.00 N ATOM 0 H LYS A 68 -6.995 -15.583 -6.939 1.00 0.00 H new ATOM 0 HA LYS A 68 -6.091 -15.825 -4.925 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -5.976 -18.632 -5.978 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -5.041 -18.277 -4.539 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -7.212 -17.266 -3.572 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -8.036 -18.034 -4.914 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -6.193 -19.581 -3.062 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -7.892 -19.351 -2.699 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -7.062 -20.429 -5.400 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -7.105 -21.497 -4.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -9.194 -21.536 -5.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -9.432 -20.897 -3.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -9.389 -19.863 -5.003 1.00 0.00 H new ATOM 1073 N SER A 69 -3.802 -15.215 -6.461 1.00 0.00 N ATOM 1074 CA SER A 69 -2.401 -14.853 -6.639 1.00 0.00 C ATOM 1075 C SER A 69 -2.264 -13.384 -7.027 1.00 0.00 C ATOM 1076 O SER A 69 -3.140 -12.819 -7.683 1.00 0.00 O ATOM 1077 CB SER A 69 -1.756 -15.737 -7.708 1.00 0.00 C ATOM 1078 OG SER A 69 -0.378 -15.935 -7.442 1.00 0.00 O ATOM 0 H SER A 69 -4.461 -14.598 -6.936 1.00 0.00 H new ATOM 0 HA SER A 69 -1.888 -15.009 -5.690 1.00 0.00 H new ATOM 0 HB2 SER A 69 -2.265 -16.700 -7.744 1.00 0.00 H new ATOM 0 HB3 SER A 69 -1.878 -15.276 -8.688 1.00 0.00 H new ATOM 0 HG SER A 69 0.011 -16.504 -8.138 1.00 0.00 H new ATOM 1084 N PHE A 70 -1.159 -12.770 -6.618 1.00 0.00 N ATOM 1085 CA PHE A 70 -0.906 -11.367 -6.921 1.00 0.00 C ATOM 1086 C PHE A 70 0.573 -11.031 -6.753 1.00 0.00 C ATOM 1087 O PHE A 70 1.255 -11.597 -5.899 1.00 0.00 O ATOM 1088 CB PHE A 70 -1.751 -10.467 -6.017 1.00 0.00 C ATOM 1089 CG PHE A 70 -1.224 -10.365 -4.614 1.00 0.00 C ATOM 1090 CD1 PHE A 70 -1.634 -11.260 -3.638 1.00 0.00 C ATOM 1091 CD2 PHE A 70 -0.320 -9.373 -4.270 1.00 0.00 C ATOM 1092 CE1 PHE A 70 -1.152 -11.168 -2.347 1.00 0.00 C ATOM 1093 CE2 PHE A 70 0.167 -9.277 -2.980 1.00 0.00 C ATOM 1094 CZ PHE A 70 -0.251 -10.175 -2.017 1.00 0.00 C ATOM 0 H PHE A 70 -0.424 -13.223 -6.075 1.00 0.00 H new ATOM 0 HA PHE A 70 -1.184 -11.191 -7.960 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -1.798 -9.469 -6.453 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -2.771 -10.850 -5.987 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -2.339 -12.039 -3.890 1.00 0.00 H new ATOM 0 HD2 PHE A 70 0.008 -8.667 -5.018 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -1.479 -11.872 -1.596 1.00 0.00 H new ATOM 0 HE2 PHE A 70 0.873 -8.501 -2.725 1.00 0.00 H new ATOM 0 HZ PHE A 70 0.126 -10.101 -1.008 1.00 0.00 H new ATOM 1104 N ASP A 71 1.061 -10.109 -7.575 1.00 0.00 N ATOM 1105 CA ASP A 71 2.459 -9.697 -7.518 1.00 0.00 C ATOM 1106 C ASP A 71 2.581 -8.258 -7.026 1.00 0.00 C ATOM 1107 O ASP A 71 1.919 -7.356 -7.541 1.00 0.00 O ATOM 1108 CB ASP A 71 3.110 -9.836 -8.895 1.00 0.00 C ATOM 1109 CG ASP A 71 3.656 -11.229 -9.139 1.00 0.00 C ATOM 1110 OD1 ASP A 71 4.484 -11.692 -8.327 1.00 0.00 O ATOM 1111 OD2 ASP A 71 3.256 -11.855 -10.143 1.00 0.00 O ATOM 0 H ASP A 71 0.510 -9.633 -8.289 1.00 0.00 H new ATOM 0 HA ASP A 71 2.976 -10.348 -6.813 1.00 0.00 H new ATOM 0 HB2 ASP A 71 2.378 -9.596 -9.666 1.00 0.00 H new ATOM 0 HB3 ASP A 71 3.919 -9.111 -8.986 1.00 0.00 H new ATOM 1116 N LEU A 72 3.432 -8.050 -6.027 1.00 0.00 N ATOM 1117 CA LEU A 72 3.641 -6.721 -5.464 1.00 0.00 C ATOM 1118 C LEU A 72 4.933 -6.104 -5.991 1.00 0.00 C ATOM 1119 O LEU A 72 6.029 -6.504 -5.597 1.00 0.00 O ATOM 1120 CB LEU A 72 3.682 -6.792 -3.937 1.00 0.00 C ATOM 1121 CG LEU A 72 3.623 -5.454 -3.200 1.00 0.00 C ATOM 1122 CD1 LEU A 72 2.270 -4.791 -3.406 1.00 0.00 C ATOM 1123 CD2 LEU A 72 3.902 -5.648 -1.717 1.00 0.00 C ATOM 0 H LEU A 72 3.988 -8.785 -5.590 1.00 0.00 H new ATOM 0 HA LEU A 72 2.807 -6.089 -5.769 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.848 -7.407 -3.600 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.597 -7.306 -3.642 1.00 0.00 H new ATOM 0 HG LEU A 72 4.392 -4.801 -3.612 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.246 -3.840 -2.874 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.109 -4.616 -4.470 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.484 -5.441 -3.022 1.00 0.00 H new ATOM 0 HD21 LEU A 72 3.856 -4.685 -1.209 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.156 -6.319 -1.291 1.00 0.00 H new ATOM 0 HD23 LEU A 72 4.894 -6.079 -1.587 1.00 0.00 H new ATOM 1135 N ILE A 73 4.796 -5.126 -6.880 1.00 0.00 N ATOM 1136 CA ILE A 73 5.952 -4.452 -7.458 1.00 0.00 C ATOM 1137 C ILE A 73 6.279 -3.172 -6.696 1.00 0.00 C ATOM 1138 O ILE A 73 5.526 -2.200 -6.744 1.00 0.00 O ATOM 1139 CB ILE A 73 5.721 -4.109 -8.941 1.00 0.00 C ATOM 1140 CG1 ILE A 73 5.399 -5.376 -9.736 1.00 0.00 C ATOM 1141 CG2 ILE A 73 6.942 -3.410 -9.520 1.00 0.00 C ATOM 1142 CD1 ILE A 73 4.498 -5.130 -10.926 1.00 0.00 C ATOM 0 H ILE A 73 3.896 -4.783 -7.216 1.00 0.00 H new ATOM 0 HA ILE A 73 6.792 -5.143 -7.381 1.00 0.00 H new ATOM 0 HB ILE A 73 4.870 -3.431 -9.013 1.00 0.00 H new ATOM 0 HG12 ILE A 73 6.330 -5.824 -10.082 1.00 0.00 H new ATOM 0 HG13 ILE A 73 4.923 -6.100 -9.074 1.00 0.00 H new ATOM 0 HG21 ILE A 73 6.763 -3.174 -10.569 1.00 0.00 H new ATOM 0 HG22 ILE A 73 7.130 -2.489 -8.968 1.00 0.00 H new ATOM 0 HG23 ILE A 73 7.809 -4.065 -9.438 1.00 0.00 H new ATOM 0 HD11 ILE A 73 4.312 -6.072 -11.442 1.00 0.00 H new ATOM 0 HD12 ILE A 73 3.552 -4.710 -10.585 1.00 0.00 H new ATOM 0 HD13 ILE A 73 4.980 -4.431 -11.609 1.00 0.00 H new ATOM 1154 N SER A 74 7.408 -3.179 -5.995 1.00 0.00 N ATOM 1155 CA SER A 74 7.835 -2.019 -5.221 1.00 0.00 C ATOM 1156 C SER A 74 9.054 -1.360 -5.858 1.00 0.00 C ATOM 1157 O SER A 74 9.538 -1.799 -6.902 1.00 0.00 O ATOM 1158 CB SER A 74 8.155 -2.429 -3.782 1.00 0.00 C ATOM 1159 OG SER A 74 6.984 -2.831 -3.094 1.00 0.00 O ATOM 0 H SER A 74 8.044 -3.975 -5.947 1.00 0.00 H new ATOM 0 HA SER A 74 7.018 -1.298 -5.212 1.00 0.00 H new ATOM 0 HB2 SER A 74 8.877 -3.246 -3.785 1.00 0.00 H new ATOM 0 HB3 SER A 74 8.620 -1.594 -3.258 1.00 0.00 H new ATOM 0 HG SER A 74 6.989 -3.804 -2.981 1.00 0.00 H new ATOM 1165 N HIS A 75 9.547 -0.302 -5.221 1.00 0.00 N ATOM 1166 CA HIS A 75 10.712 0.419 -5.724 1.00 0.00 C ATOM 1167 C HIS A 75 11.722 -0.544 -6.340 1.00 0.00 C ATOM 1168 O HIS A 75 12.465 -1.218 -5.628 1.00 0.00 O ATOM 1169 CB HIS A 75 11.370 1.216 -4.597 1.00 0.00 C ATOM 1170 CG HIS A 75 12.079 2.448 -5.070 1.00 0.00 C ATOM 1171 ND1 HIS A 75 13.375 2.754 -4.713 1.00 0.00 N ATOM 1172 CD2 HIS A 75 11.665 3.452 -5.878 1.00 0.00 C ATOM 1173 CE1 HIS A 75 13.727 3.894 -5.279 1.00 0.00 C ATOM 1174 NE2 HIS A 75 12.708 4.338 -5.992 1.00 0.00 N ATOM 0 H HIS A 75 9.159 0.075 -4.356 1.00 0.00 H new ATOM 0 HA HIS A 75 10.376 1.109 -6.498 1.00 0.00 H new ATOM 0 HB2 HIS A 75 10.608 1.501 -3.872 1.00 0.00 H new ATOM 0 HB3 HIS A 75 12.081 0.575 -4.077 1.00 0.00 H new ATOM 0 HD2 HIS A 75 10.695 3.540 -6.346 1.00 0.00 H new ATOM 0 HE1 HIS A 75 14.686 4.381 -5.176 1.00 0.00 H new ATOM 0 HE2 HIS A 75 12.697 5.199 -6.539 1.00 0.00 H new ATOM 1183 N ASN A 76 11.743 -0.602 -7.668 1.00 0.00 N ATOM 1184 CA ASN A 76 12.662 -1.483 -8.380 1.00 0.00 C ATOM 1185 C ASN A 76 12.719 -2.857 -7.719 1.00 0.00 C ATOM 1186 O ASN A 76 13.798 -3.370 -7.422 1.00 0.00 O ATOM 1187 CB ASN A 76 14.062 -0.867 -8.423 1.00 0.00 C ATOM 1188 CG ASN A 76 14.848 -1.304 -9.644 1.00 0.00 C ATOM 1189 OD1 ASN A 76 15.272 -2.456 -9.744 1.00 0.00 O ATOM 1190 ND2 ASN A 76 15.046 -0.384 -10.581 1.00 0.00 N ATOM 0 H ASN A 76 11.135 -0.050 -8.272 1.00 0.00 H new ATOM 0 HA ASN A 76 12.294 -1.604 -9.399 1.00 0.00 H new ATOM 0 HB2 ASN A 76 13.978 0.220 -8.418 1.00 0.00 H new ATOM 0 HB3 ASN A 76 14.608 -1.149 -7.523 1.00 0.00 H new ATOM 0 HD21 ASN A 76 15.568 -0.620 -11.425 1.00 0.00 H new ATOM 0 HD22 ASN A 76 14.677 0.559 -10.456 1.00 0.00 H new ATOM 1197 N ARG A 77 11.550 -3.448 -7.494 1.00 0.00 N ATOM 1198 CA ARG A 77 11.467 -4.763 -6.868 1.00 0.00 C ATOM 1199 C ARG A 77 10.140 -5.439 -7.199 1.00 0.00 C ATOM 1200 O ARG A 77 9.098 -4.787 -7.267 1.00 0.00 O ATOM 1201 CB ARG A 77 11.625 -4.640 -5.351 1.00 0.00 C ATOM 1202 CG ARG A 77 13.056 -4.386 -4.906 1.00 0.00 C ATOM 1203 CD ARG A 77 13.275 -4.814 -3.464 1.00 0.00 C ATOM 1204 NE ARG A 77 14.693 -4.895 -3.126 1.00 0.00 N ATOM 1205 CZ ARG A 77 15.453 -3.833 -2.882 1.00 0.00 C ATOM 1206 NH1 ARG A 77 14.932 -2.615 -2.936 1.00 0.00 N ATOM 1207 NH2 ARG A 77 16.736 -3.988 -2.581 1.00 0.00 N ATOM 0 H ARG A 77 10.648 -3.038 -7.735 1.00 0.00 H new ATOM 0 HA ARG A 77 12.277 -5.378 -7.262 1.00 0.00 H new ATOM 0 HB2 ARG A 77 10.993 -3.828 -4.993 1.00 0.00 H new ATOM 0 HB3 ARG A 77 11.264 -5.555 -4.881 1.00 0.00 H new ATOM 0 HG2 ARG A 77 13.742 -4.929 -5.556 1.00 0.00 H new ATOM 0 HG3 ARG A 77 13.288 -3.326 -5.011 1.00 0.00 H new ATOM 0 HD2 ARG A 77 12.783 -4.106 -2.797 1.00 0.00 H new ATOM 0 HD3 ARG A 77 12.807 -5.785 -3.299 1.00 0.00 H new ATOM 0 HE ARG A 77 15.124 -5.818 -3.074 1.00 0.00 H new ATOM 0 HH11 ARG A 77 13.946 -2.492 -3.165 1.00 0.00 H new ATOM 0 HH12 ARG A 77 15.517 -1.801 -2.748 1.00 0.00 H new ATOM 0 HH21 ARG A 77 17.140 -4.924 -2.537 1.00 0.00 H new ATOM 0 HH22 ARG A 77 17.318 -3.172 -2.394 1.00 0.00 H new ATOM 1221 N THR A 78 10.186 -6.752 -7.405 1.00 0.00 N ATOM 1222 CA THR A 78 8.989 -7.517 -7.731 1.00 0.00 C ATOM 1223 C THR A 78 8.845 -8.728 -6.817 1.00 0.00 C ATOM 1224 O THR A 78 9.611 -9.687 -6.915 1.00 0.00 O ATOM 1225 CB THR A 78 9.008 -7.993 -9.196 1.00 0.00 C ATOM 1226 OG1 THR A 78 9.265 -6.887 -10.067 1.00 0.00 O ATOM 1227 CG2 THR A 78 7.685 -8.644 -9.570 1.00 0.00 C ATOM 0 H THR A 78 11.040 -7.307 -7.352 1.00 0.00 H new ATOM 0 HA THR A 78 8.139 -6.851 -7.584 1.00 0.00 H new ATOM 0 HB THR A 78 9.802 -8.732 -9.305 1.00 0.00 H new ATOM 0 HG1 THR A 78 9.277 -7.198 -10.996 1.00 0.00 H new ATOM 0 HG21 THR A 78 7.722 -8.972 -10.609 1.00 0.00 H new ATOM 0 HG22 THR A 78 7.507 -9.504 -8.924 1.00 0.00 H new ATOM 0 HG23 THR A 78 6.877 -7.923 -9.446 1.00 0.00 H new ATOM 1235 N TYR A 79 7.859 -8.679 -5.928 1.00 0.00 N ATOM 1236 CA TYR A 79 7.615 -9.772 -4.995 1.00 0.00 C ATOM 1237 C TYR A 79 6.518 -10.696 -5.512 1.00 0.00 C ATOM 1238 O TYR A 79 5.756 -10.334 -6.410 1.00 0.00 O ATOM 1239 CB TYR A 79 7.228 -9.221 -3.621 1.00 0.00 C ATOM 1240 CG TYR A 79 8.306 -8.376 -2.982 1.00 0.00 C ATOM 1241 CD1 TYR A 79 9.284 -8.952 -2.181 1.00 0.00 C ATOM 1242 CD2 TYR A 79 8.347 -7.001 -3.179 1.00 0.00 C ATOM 1243 CE1 TYR A 79 10.271 -8.184 -1.594 1.00 0.00 C ATOM 1244 CE2 TYR A 79 9.331 -6.225 -2.597 1.00 0.00 C ATOM 1245 CZ TYR A 79 10.290 -6.821 -1.805 1.00 0.00 C ATOM 1246 OH TYR A 79 11.272 -6.052 -1.223 1.00 0.00 O ATOM 0 H TYR A 79 7.215 -7.893 -5.834 1.00 0.00 H new ATOM 0 HA TYR A 79 8.536 -10.348 -4.902 1.00 0.00 H new ATOM 0 HB2 TYR A 79 6.321 -8.624 -3.720 1.00 0.00 H new ATOM 0 HB3 TYR A 79 6.990 -10.054 -2.959 1.00 0.00 H new ATOM 0 HD1 TYR A 79 9.273 -10.019 -2.014 1.00 0.00 H new ATOM 0 HD2 TYR A 79 7.597 -6.531 -3.798 1.00 0.00 H new ATOM 0 HE1 TYR A 79 11.023 -8.648 -0.974 1.00 0.00 H new ATOM 0 HE2 TYR A 79 9.349 -5.158 -2.761 1.00 0.00 H new ATOM 0 HH TYR A 79 11.143 -5.113 -1.472 1.00 0.00 H new ATOM 1256 N HIS A 80 6.442 -11.893 -4.940 1.00 0.00 N ATOM 1257 CA HIS A 80 5.437 -12.871 -5.341 1.00 0.00 C ATOM 1258 C HIS A 80 4.674 -13.396 -4.129 1.00 0.00 C ATOM 1259 O HIS A 80 5.218 -14.142 -3.315 1.00 0.00 O ATOM 1260 CB HIS A 80 6.095 -14.033 -6.086 1.00 0.00 C ATOM 1261 CG HIS A 80 7.237 -13.615 -6.960 1.00 0.00 C ATOM 1262 ND1 HIS A 80 7.164 -12.553 -7.837 1.00 0.00 N ATOM 1263 CD2 HIS A 80 8.485 -14.121 -7.088 1.00 0.00 C ATOM 1264 CE1 HIS A 80 8.317 -12.425 -8.467 1.00 0.00 C ATOM 1265 NE2 HIS A 80 9.137 -13.364 -8.031 1.00 0.00 N ATOM 0 H HIS A 80 7.065 -12.209 -4.197 1.00 0.00 H new ATOM 0 HA HIS A 80 4.730 -12.376 -6.006 1.00 0.00 H new ATOM 0 HB2 HIS A 80 6.452 -14.763 -5.360 1.00 0.00 H new ATOM 0 HB3 HIS A 80 5.344 -14.533 -6.698 1.00 0.00 H new ATOM 0 HD1 HIS A 80 6.347 -11.959 -7.977 1.00 0.00 H new ATOM 0 HD2 HIS A 80 8.893 -14.963 -6.549 1.00 0.00 H new ATOM 0 HE1 HIS A 80 8.550 -11.679 -9.212 1.00 0.00 H new ATOM 1274 N PHE A 81 3.411 -12.999 -4.013 1.00 0.00 N ATOM 1275 CA PHE A 81 2.574 -13.427 -2.899 1.00 0.00 C ATOM 1276 C PHE A 81 1.386 -14.247 -3.395 1.00 0.00 C ATOM 1277 O PHE A 81 0.928 -14.074 -4.524 1.00 0.00 O ATOM 1278 CB PHE A 81 2.076 -12.214 -2.111 1.00 0.00 C ATOM 1279 CG PHE A 81 3.179 -11.429 -1.460 1.00 0.00 C ATOM 1280 CD1 PHE A 81 3.890 -11.960 -0.396 1.00 0.00 C ATOM 1281 CD2 PHE A 81 3.505 -10.160 -1.911 1.00 0.00 C ATOM 1282 CE1 PHE A 81 4.905 -11.240 0.206 1.00 0.00 C ATOM 1283 CE2 PHE A 81 4.519 -9.435 -1.314 1.00 0.00 C ATOM 1284 CZ PHE A 81 5.220 -9.977 -0.254 1.00 0.00 C ATOM 0 H PHE A 81 2.945 -12.381 -4.677 1.00 0.00 H new ATOM 0 HA PHE A 81 3.179 -14.054 -2.244 1.00 0.00 H new ATOM 0 HB2 PHE A 81 1.521 -11.558 -2.781 1.00 0.00 H new ATOM 0 HB3 PHE A 81 1.378 -12.550 -1.344 1.00 0.00 H new ATOM 0 HD1 PHE A 81 3.648 -12.948 -0.033 1.00 0.00 H new ATOM 0 HD2 PHE A 81 2.960 -9.732 -2.739 1.00 0.00 H new ATOM 0 HE1 PHE A 81 5.451 -11.665 1.035 1.00 0.00 H new ATOM 0 HE2 PHE A 81 4.763 -8.447 -1.675 1.00 0.00 H new ATOM 0 HZ PHE A 81 6.013 -9.413 0.214 1.00 0.00 H new ATOM 1294 N GLN A 82 0.894 -15.141 -2.542 1.00 0.00 N ATOM 1295 CA GLN A 82 -0.239 -15.988 -2.894 1.00 0.00 C ATOM 1296 C GLN A 82 -1.169 -16.176 -1.701 1.00 0.00 C ATOM 1297 O GLN A 82 -0.724 -16.487 -0.597 1.00 0.00 O ATOM 1298 CB GLN A 82 0.251 -17.349 -3.393 1.00 0.00 C ATOM 1299 CG GLN A 82 -0.816 -18.150 -4.121 1.00 0.00 C ATOM 1300 CD GLN A 82 -0.345 -19.540 -4.501 1.00 0.00 C ATOM 1301 OE1 GLN A 82 -0.771 -20.535 -3.912 1.00 0.00 O ATOM 1302 NE2 GLN A 82 0.539 -19.617 -5.489 1.00 0.00 N ATOM 0 H GLN A 82 1.262 -15.297 -1.604 1.00 0.00 H new ATOM 0 HA GLN A 82 -0.796 -15.495 -3.691 1.00 0.00 H new ATOM 0 HB2 GLN A 82 1.099 -17.198 -4.061 1.00 0.00 H new ATOM 0 HB3 GLN A 82 0.613 -17.929 -2.544 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -1.700 -18.230 -3.488 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -1.117 -17.614 -5.021 1.00 0.00 H new ATOM 0 HE21 GLN A 82 0.865 -18.767 -5.949 1.00 0.00 H new ATOM 0 HE22 GLN A 82 0.892 -20.526 -5.788 1.00 0.00 H new ATOM 1311 N ALA A 83 -2.464 -15.985 -1.931 1.00 0.00 N ATOM 1312 CA ALA A 83 -3.458 -16.135 -0.875 1.00 0.00 C ATOM 1313 C ALA A 83 -3.830 -17.600 -0.675 1.00 0.00 C ATOM 1314 O ALA A 83 -3.912 -18.365 -1.635 1.00 0.00 O ATOM 1315 CB ALA A 83 -4.697 -15.313 -1.196 1.00 0.00 C ATOM 0 H ALA A 83 -2.849 -15.726 -2.839 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.023 -15.768 0.054 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -5.431 -15.434 -0.399 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.424 -14.261 -1.281 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -5.125 -15.654 -2.139 1.00 0.00 H new ATOM 1321 N GLU A 84 -4.051 -17.984 0.579 1.00 0.00 N ATOM 1322 CA GLU A 84 -4.413 -19.359 0.904 1.00 0.00 C ATOM 1323 C GLU A 84 -5.831 -19.673 0.436 1.00 0.00 C ATOM 1324 O GLU A 84 -6.091 -20.742 -0.118 1.00 0.00 O ATOM 1325 CB GLU A 84 -4.296 -19.598 2.410 1.00 0.00 C ATOM 1326 CG GLU A 84 -2.871 -19.841 2.879 1.00 0.00 C ATOM 1327 CD GLU A 84 -2.806 -20.696 4.130 1.00 0.00 C ATOM 1328 OE1 GLU A 84 -3.502 -20.365 5.112 1.00 0.00 O ATOM 1329 OE2 GLU A 84 -2.059 -21.697 4.126 1.00 0.00 O ATOM 0 H GLU A 84 -3.986 -17.363 1.385 1.00 0.00 H new ATOM 0 HA GLU A 84 -3.722 -20.023 0.384 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.701 -18.735 2.939 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -4.910 -20.456 2.682 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.308 -20.327 2.082 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.388 -18.883 3.073 1.00 0.00 H new ATOM 1336 N ASP A 85 -6.744 -18.736 0.664 1.00 0.00 N ATOM 1337 CA ASP A 85 -8.136 -18.912 0.267 1.00 0.00 C ATOM 1338 C ASP A 85 -8.682 -17.642 -0.378 1.00 0.00 C ATOM 1339 O ASP A 85 -8.131 -16.557 -0.196 1.00 0.00 O ATOM 1340 CB ASP A 85 -8.990 -19.291 1.478 1.00 0.00 C ATOM 1341 CG ASP A 85 -8.491 -18.656 2.760 1.00 0.00 C ATOM 1342 OD1 ASP A 85 -7.648 -19.277 3.442 1.00 0.00 O ATOM 1343 OD2 ASP A 85 -8.942 -17.537 3.083 1.00 0.00 O ATOM 0 H ASP A 85 -6.545 -17.846 1.122 1.00 0.00 H new ATOM 0 HA ASP A 85 -8.180 -19.718 -0.466 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -10.021 -18.985 1.302 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -8.994 -20.375 1.591 1.00 0.00 H new ATOM 1348 N GLU A 86 -9.766 -17.787 -1.134 1.00 0.00 N ATOM 1349 CA GLU A 86 -10.384 -16.650 -1.807 1.00 0.00 C ATOM 1350 C GLU A 86 -10.619 -15.501 -0.831 1.00 0.00 C ATOM 1351 O GLU A 86 -10.408 -14.336 -1.167 1.00 0.00 O ATOM 1352 CB GLU A 86 -11.709 -17.068 -2.449 1.00 0.00 C ATOM 1353 CG GLU A 86 -11.561 -17.581 -3.871 1.00 0.00 C ATOM 1354 CD GLU A 86 -12.641 -18.577 -4.247 1.00 0.00 C ATOM 1355 OE1 GLU A 86 -12.807 -19.577 -3.518 1.00 0.00 O ATOM 1356 OE2 GLU A 86 -13.321 -18.356 -5.272 1.00 0.00 O ATOM 0 H GLU A 86 -10.234 -18.679 -1.296 1.00 0.00 H new ATOM 0 HA GLU A 86 -9.703 -16.308 -2.586 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -12.170 -17.844 -1.838 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -12.388 -16.216 -2.448 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -11.592 -16.739 -4.562 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -10.584 -18.050 -3.984 1.00 0.00 H new ATOM 1363 N GLN A 87 -11.057 -15.839 0.377 1.00 0.00 N ATOM 1364 CA GLN A 87 -11.322 -14.836 1.401 1.00 0.00 C ATOM 1365 C GLN A 87 -10.073 -14.010 1.690 1.00 0.00 C ATOM 1366 O GLN A 87 -10.158 -12.813 1.965 1.00 0.00 O ATOM 1367 CB GLN A 87 -11.814 -15.505 2.686 1.00 0.00 C ATOM 1368 CG GLN A 87 -13.323 -15.678 2.742 1.00 0.00 C ATOM 1369 CD GLN A 87 -14.056 -14.360 2.896 1.00 0.00 C ATOM 1370 OE1 GLN A 87 -14.792 -13.938 2.003 1.00 0.00 O ATOM 1371 NE2 GLN A 87 -13.859 -13.702 4.032 1.00 0.00 N ATOM 0 H GLN A 87 -11.236 -16.799 0.671 1.00 0.00 H new ATOM 0 HA GLN A 87 -12.099 -14.169 1.027 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -11.341 -16.482 2.781 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -11.493 -14.911 3.541 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -13.662 -16.174 1.832 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -13.579 -16.332 3.576 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -13.241 -14.089 4.745 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -14.326 -12.809 4.192 1.00 0.00 H new ATOM 1380 N ASP A 88 -8.915 -14.657 1.626 1.00 0.00 N ATOM 1381 CA ASP A 88 -7.647 -13.982 1.880 1.00 0.00 C ATOM 1382 C ASP A 88 -7.241 -13.120 0.688 1.00 0.00 C ATOM 1383 O ASP A 88 -6.761 -11.999 0.855 1.00 0.00 O ATOM 1384 CB ASP A 88 -6.551 -15.005 2.182 1.00 0.00 C ATOM 1385 CG ASP A 88 -5.409 -14.411 2.982 1.00 0.00 C ATOM 1386 OD1 ASP A 88 -5.676 -13.821 4.050 1.00 0.00 O ATOM 1387 OD2 ASP A 88 -4.247 -14.535 2.540 1.00 0.00 O ATOM 0 H ASP A 88 -8.828 -15.648 1.400 1.00 0.00 H new ATOM 0 HA ASP A 88 -7.777 -13.334 2.747 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -6.981 -15.841 2.734 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -6.164 -15.406 1.245 1.00 0.00 H new ATOM 1392 N TYR A 89 -7.437 -13.652 -0.513 1.00 0.00 N ATOM 1393 CA TYR A 89 -7.088 -12.934 -1.733 1.00 0.00 C ATOM 1394 C TYR A 89 -7.954 -11.688 -1.898 1.00 0.00 C ATOM 1395 O TYR A 89 -7.446 -10.568 -1.947 1.00 0.00 O ATOM 1396 CB TYR A 89 -7.250 -13.846 -2.950 1.00 0.00 C ATOM 1397 CG TYR A 89 -7.183 -13.111 -4.270 1.00 0.00 C ATOM 1398 CD1 TYR A 89 -5.965 -12.881 -4.898 1.00 0.00 C ATOM 1399 CD2 TYR A 89 -8.337 -12.646 -4.888 1.00 0.00 C ATOM 1400 CE1 TYR A 89 -5.899 -12.209 -6.104 1.00 0.00 C ATOM 1401 CE2 TYR A 89 -8.281 -11.975 -6.095 1.00 0.00 C ATOM 1402 CZ TYR A 89 -7.059 -11.759 -6.698 1.00 0.00 C ATOM 1403 OH TYR A 89 -6.999 -11.090 -7.899 1.00 0.00 O ATOM 0 H TYR A 89 -7.836 -14.578 -0.668 1.00 0.00 H new ATOM 0 HA TYR A 89 -6.046 -12.623 -1.656 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -6.472 -14.609 -2.928 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -8.206 -14.365 -2.880 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -5.055 -13.233 -4.436 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -9.295 -12.812 -4.417 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -4.944 -12.037 -6.578 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -9.188 -11.622 -6.563 1.00 0.00 H new ATOM 0 HH TYR A 89 -7.904 -10.842 -8.181 1.00 0.00 H new ATOM 1413 N VAL A 90 -9.264 -11.893 -1.982 1.00 0.00 N ATOM 1414 CA VAL A 90 -10.202 -10.788 -2.140 1.00 0.00 C ATOM 1415 C VAL A 90 -9.922 -9.681 -1.130 1.00 0.00 C ATOM 1416 O VAL A 90 -9.885 -8.502 -1.481 1.00 0.00 O ATOM 1417 CB VAL A 90 -11.659 -11.261 -1.976 1.00 0.00 C ATOM 1418 CG1 VAL A 90 -12.617 -10.084 -2.078 1.00 0.00 C ATOM 1419 CG2 VAL A 90 -11.994 -12.323 -3.012 1.00 0.00 C ATOM 0 H VAL A 90 -9.700 -12.814 -1.943 1.00 0.00 H new ATOM 0 HA VAL A 90 -10.065 -10.399 -3.149 1.00 0.00 H new ATOM 0 HB VAL A 90 -11.770 -11.704 -0.986 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -13.641 -10.437 -1.960 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -12.390 -9.361 -1.295 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -12.507 -9.609 -3.053 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -13.027 -12.646 -2.881 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -11.867 -11.909 -4.012 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -11.328 -13.177 -2.886 1.00 0.00 H new ATOM 1429 N ALA A 91 -9.724 -10.069 0.125 1.00 0.00 N ATOM 1430 CA ALA A 91 -9.444 -9.110 1.186 1.00 0.00 C ATOM 1431 C ALA A 91 -8.106 -8.414 0.959 1.00 0.00 C ATOM 1432 O ALA A 91 -8.051 -7.198 0.780 1.00 0.00 O ATOM 1433 CB ALA A 91 -9.457 -9.802 2.541 1.00 0.00 C ATOM 0 H ALA A 91 -9.752 -11.041 0.432 1.00 0.00 H new ATOM 0 HA ALA A 91 -10.226 -8.351 1.170 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -9.246 -9.073 3.324 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -10.437 -10.246 2.713 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -8.697 -10.583 2.558 1.00 0.00 H new ATOM 1439 N TRP A 92 -7.031 -9.194 0.967 1.00 0.00 N ATOM 1440 CA TRP A 92 -5.693 -8.652 0.762 1.00 0.00 C ATOM 1441 C TRP A 92 -5.702 -7.570 -0.312 1.00 0.00 C ATOM 1442 O TRP A 92 -5.341 -6.422 -0.052 1.00 0.00 O ATOM 1443 CB TRP A 92 -4.722 -9.768 0.371 1.00 0.00 C ATOM 1444 CG TRP A 92 -4.055 -10.414 1.548 1.00 0.00 C ATOM 1445 CD1 TRP A 92 -4.065 -11.741 1.868 1.00 0.00 C ATOM 1446 CD2 TRP A 92 -3.282 -9.760 2.560 1.00 0.00 C ATOM 1447 NE1 TRP A 92 -3.345 -11.953 3.019 1.00 0.00 N ATOM 1448 CE2 TRP A 92 -2.854 -10.753 3.463 1.00 0.00 C ATOM 1449 CE3 TRP A 92 -2.909 -8.434 2.792 1.00 0.00 C ATOM 1450 CZ2 TRP A 92 -2.072 -10.459 4.577 1.00 0.00 C ATOM 1451 CZ3 TRP A 92 -2.134 -8.143 3.898 1.00 0.00 C ATOM 1452 CH2 TRP A 92 -1.722 -9.152 4.779 1.00 0.00 C ATOM 0 H TRP A 92 -7.060 -10.203 1.113 1.00 0.00 H new ATOM 0 HA TRP A 92 -5.363 -8.204 1.699 1.00 0.00 H new ATOM 0 HB2 TRP A 92 -5.262 -10.528 -0.194 1.00 0.00 H new ATOM 0 HB3 TRP A 92 -3.959 -9.360 -0.292 1.00 0.00 H new ATOM 0 HD1 TRP A 92 -4.565 -12.511 1.300 1.00 0.00 H new ATOM 0 HE1 TRP A 92 -3.200 -12.856 3.470 1.00 0.00 H new ATOM 0 HE3 TRP A 92 -3.221 -7.650 2.118 1.00 0.00 H new ATOM 0 HZ2 TRP A 92 -1.753 -11.235 5.257 1.00 0.00 H new ATOM 0 HZ3 TRP A 92 -1.841 -7.121 4.087 1.00 0.00 H new ATOM 0 HH2 TRP A 92 -1.116 -8.893 5.635 1.00 0.00 H new ATOM 1463 N ILE A 93 -6.117 -7.943 -1.518 1.00 0.00 N ATOM 1464 CA ILE A 93 -6.174 -7.003 -2.630 1.00 0.00 C ATOM 1465 C ILE A 93 -6.978 -5.762 -2.260 1.00 0.00 C ATOM 1466 O ILE A 93 -6.633 -4.647 -2.651 1.00 0.00 O ATOM 1467 CB ILE A 93 -6.796 -7.650 -3.882 1.00 0.00 C ATOM 1468 CG1 ILE A 93 -5.956 -8.845 -4.337 1.00 0.00 C ATOM 1469 CG2 ILE A 93 -6.920 -6.626 -5.001 1.00 0.00 C ATOM 1470 CD1 ILE A 93 -4.566 -8.466 -4.798 1.00 0.00 C ATOM 0 H ILE A 93 -6.419 -8.889 -1.750 1.00 0.00 H new ATOM 0 HA ILE A 93 -5.147 -6.714 -2.852 1.00 0.00 H new ATOM 0 HB ILE A 93 -7.794 -8.007 -3.630 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -5.876 -9.557 -3.515 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -6.474 -9.354 -5.150 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -7.361 -7.098 -5.879 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -7.556 -5.804 -4.673 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -5.932 -6.242 -5.254 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -4.028 -9.362 -5.106 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -4.637 -7.778 -5.641 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -4.030 -7.984 -3.980 1.00 0.00 H new ATOM 1482 N SER A 94 -8.052 -5.963 -1.502 1.00 0.00 N ATOM 1483 CA SER A 94 -8.907 -4.860 -1.080 1.00 0.00 C ATOM 1484 C SER A 94 -8.154 -3.915 -0.148 1.00 0.00 C ATOM 1485 O SER A 94 -8.307 -2.696 -0.225 1.00 0.00 O ATOM 1486 CB SER A 94 -10.158 -5.395 -0.382 1.00 0.00 C ATOM 1487 OG SER A 94 -11.182 -4.415 -0.347 1.00 0.00 O ATOM 0 H SER A 94 -8.350 -6.879 -1.168 1.00 0.00 H new ATOM 0 HA SER A 94 -9.206 -4.304 -1.968 1.00 0.00 H new ATOM 0 HB2 SER A 94 -10.517 -6.282 -0.903 1.00 0.00 H new ATOM 0 HB3 SER A 94 -9.908 -5.701 0.634 1.00 0.00 H new ATOM 0 HG SER A 94 -12.057 -4.856 -0.361 1.00 0.00 H new ATOM 1493 N VAL A 95 -7.341 -4.488 0.734 1.00 0.00 N ATOM 1494 CA VAL A 95 -6.563 -3.699 1.681 1.00 0.00 C ATOM 1495 C VAL A 95 -5.370 -3.040 0.998 1.00 0.00 C ATOM 1496 O VAL A 95 -5.341 -1.823 0.811 1.00 0.00 O ATOM 1497 CB VAL A 95 -6.058 -4.564 2.851 1.00 0.00 C ATOM 1498 CG1 VAL A 95 -5.974 -3.741 4.127 1.00 0.00 C ATOM 1499 CG2 VAL A 95 -6.958 -5.775 3.045 1.00 0.00 C ATOM 0 H VAL A 95 -7.204 -5.496 0.812 1.00 0.00 H new ATOM 0 HA VAL A 95 -7.227 -2.927 2.070 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.056 -4.920 2.611 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -5.615 -4.369 4.942 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.285 -2.910 3.979 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.962 -3.353 4.375 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -6.586 -6.375 3.876 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -7.973 -5.443 3.263 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.960 -6.376 2.136 1.00 0.00 H new ATOM 1509 N LEU A 96 -4.385 -3.851 0.628 1.00 0.00 N ATOM 1510 CA LEU A 96 -3.187 -3.347 -0.036 1.00 0.00 C ATOM 1511 C LEU A 96 -3.520 -2.155 -0.927 1.00 0.00 C ATOM 1512 O LEU A 96 -2.757 -1.191 -1.004 1.00 0.00 O ATOM 1513 CB LEU A 96 -2.537 -4.454 -0.867 1.00 0.00 C ATOM 1514 CG LEU A 96 -1.925 -5.614 -0.079 1.00 0.00 C ATOM 1515 CD1 LEU A 96 -1.704 -6.816 -0.984 1.00 0.00 C ATOM 1516 CD2 LEU A 96 -0.618 -5.185 0.571 1.00 0.00 C ATOM 0 H LEU A 96 -4.392 -4.860 0.776 1.00 0.00 H new ATOM 0 HA LEU A 96 -2.486 -3.019 0.732 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -3.287 -4.859 -1.547 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -1.756 -4.008 -1.483 1.00 0.00 H new ATOM 0 HG LEU A 96 -2.622 -5.902 0.708 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -1.268 -7.631 -0.406 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.658 -7.137 -1.402 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -1.027 -6.542 -1.793 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -0.196 -6.022 1.127 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.086 -4.870 -0.200 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -0.806 -4.355 1.252 1.00 0.00 H new ATOM 1528 N THR A 97 -4.665 -2.225 -1.599 1.00 0.00 N ATOM 1529 CA THR A 97 -5.099 -1.152 -2.484 1.00 0.00 C ATOM 1530 C THR A 97 -5.823 -0.058 -1.707 1.00 0.00 C ATOM 1531 O THR A 97 -5.604 1.130 -1.940 1.00 0.00 O ATOM 1532 CB THR A 97 -6.029 -1.680 -3.592 1.00 0.00 C ATOM 1533 OG1 THR A 97 -5.495 -2.888 -4.146 1.00 0.00 O ATOM 1534 CG2 THR A 97 -6.201 -0.644 -4.693 1.00 0.00 C ATOM 0 H THR A 97 -5.309 -3.015 -1.547 1.00 0.00 H new ATOM 0 HA THR A 97 -4.201 -0.736 -2.941 1.00 0.00 H new ATOM 0 HB THR A 97 -7.005 -1.884 -3.150 1.00 0.00 H new ATOM 0 HG1 THR A 97 -6.058 -3.646 -3.883 1.00 0.00 H new ATOM 0 HG21 THR A 97 -6.862 -1.039 -5.464 1.00 0.00 H new ATOM 0 HG22 THR A 97 -6.635 0.264 -4.274 1.00 0.00 H new ATOM 0 HG23 THR A 97 -5.230 -0.413 -5.131 1.00 0.00 H new ATOM 1542 N ASN A 98 -6.686 -0.466 -0.783 1.00 0.00 N ATOM 1543 CA ASN A 98 -7.442 0.480 0.029 1.00 0.00 C ATOM 1544 C ASN A 98 -6.506 1.423 0.779 1.00 0.00 C ATOM 1545 O ASN A 98 -6.511 2.632 0.550 1.00 0.00 O ATOM 1546 CB ASN A 98 -8.335 -0.266 1.022 1.00 0.00 C ATOM 1547 CG ASN A 98 -9.691 -0.609 0.435 1.00 0.00 C ATOM 1548 OD1 ASN A 98 -10.215 0.116 -0.411 1.00 0.00 O ATOM 1549 ND2 ASN A 98 -10.266 -1.719 0.883 1.00 0.00 N ATOM 0 H ASN A 98 -6.879 -1.446 -0.578 1.00 0.00 H new ATOM 0 HA ASN A 98 -8.068 1.072 -0.638 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -7.836 -1.182 1.338 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -8.472 0.346 1.914 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -11.179 -2.001 0.525 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -9.795 -2.290 1.585 1.00 0.00 H new ATOM 1556 N SER A 99 -5.703 0.860 1.677 1.00 0.00 N ATOM 1557 CA SER A 99 -4.763 1.650 2.464 1.00 0.00 C ATOM 1558 C SER A 99 -4.075 2.699 1.596 1.00 0.00 C ATOM 1559 O SER A 99 -3.879 3.839 2.017 1.00 0.00 O ATOM 1560 CB SER A 99 -3.716 0.740 3.110 1.00 0.00 C ATOM 1561 OG SER A 99 -3.119 1.367 4.232 1.00 0.00 O ATOM 0 H SER A 99 -5.685 -0.140 1.877 1.00 0.00 H new ATOM 0 HA SER A 99 -5.323 2.162 3.247 1.00 0.00 H new ATOM 0 HB2 SER A 99 -4.183 -0.196 3.418 1.00 0.00 H new ATOM 0 HB3 SER A 99 -2.948 0.488 2.379 1.00 0.00 H new ATOM 0 HG SER A 99 -3.806 1.555 4.905 1.00 0.00 H new ATOM 1567 N LYS A 100 -3.711 2.306 0.380 1.00 0.00 N ATOM 1568 CA LYS A 100 -3.046 3.210 -0.550 1.00 0.00 C ATOM 1569 C LYS A 100 -3.904 4.442 -0.819 1.00 0.00 C ATOM 1570 O LYS A 100 -3.401 5.564 -0.855 1.00 0.00 O ATOM 1571 CB LYS A 100 -2.743 2.490 -1.866 1.00 0.00 C ATOM 1572 CG LYS A 100 -1.713 3.201 -2.726 1.00 0.00 C ATOM 1573 CD LYS A 100 -2.361 4.236 -3.631 1.00 0.00 C ATOM 1574 CE LYS A 100 -1.495 4.537 -4.844 1.00 0.00 C ATOM 1575 NZ LYS A 100 -1.621 3.484 -5.890 1.00 0.00 N ATOM 0 H LYS A 100 -3.866 1.366 0.016 1.00 0.00 H new ATOM 0 HA LYS A 100 -2.109 3.533 -0.096 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -2.388 1.483 -1.646 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -3.667 2.385 -2.434 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -0.976 3.686 -2.086 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -1.177 2.471 -3.332 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -3.335 3.874 -3.959 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -2.534 5.154 -3.070 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -1.780 5.502 -5.264 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -0.453 4.619 -4.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -1.016 3.725 -6.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -1.325 2.568 -5.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -2.611 3.423 -6.203 1.00 0.00 H new ATOM 1589 N GLU A 101 -5.203 4.224 -1.005 1.00 0.00 N ATOM 1590 CA GLU A 101 -6.130 5.318 -1.269 1.00 0.00 C ATOM 1591 C GLU A 101 -6.500 6.041 0.023 1.00 0.00 C ATOM 1592 O GLU A 101 -6.801 7.234 0.013 1.00 0.00 O ATOM 1593 CB GLU A 101 -7.394 4.791 -1.952 1.00 0.00 C ATOM 1594 CG GLU A 101 -7.113 3.938 -3.178 1.00 0.00 C ATOM 1595 CD GLU A 101 -8.355 3.243 -3.702 1.00 0.00 C ATOM 1596 OE1 GLU A 101 -9.243 3.940 -4.237 1.00 0.00 O ATOM 1597 OE2 GLU A 101 -8.439 2.004 -3.576 1.00 0.00 O ATOM 0 H GLU A 101 -5.636 3.301 -0.978 1.00 0.00 H new ATOM 0 HA GLU A 101 -5.636 6.027 -1.933 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -7.966 4.203 -1.234 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -8.019 5.636 -2.243 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -6.693 4.566 -3.964 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -6.360 3.190 -2.931 1.00 0.00 H new ATOM 1604 N GLU A 102 -6.476 5.309 1.132 1.00 0.00 N ATOM 1605 CA GLU A 102 -6.810 5.881 2.431 1.00 0.00 C ATOM 1606 C GLU A 102 -5.719 6.837 2.902 1.00 0.00 C ATOM 1607 O GLU A 102 -5.959 7.706 3.740 1.00 0.00 O ATOM 1608 CB GLU A 102 -7.012 4.771 3.465 1.00 0.00 C ATOM 1609 CG GLU A 102 -8.422 4.206 3.484 1.00 0.00 C ATOM 1610 CD GLU A 102 -9.429 5.171 4.079 1.00 0.00 C ATOM 1611 OE1 GLU A 102 -9.274 5.533 5.264 1.00 0.00 O ATOM 1612 OE2 GLU A 102 -10.371 5.564 3.360 1.00 0.00 O ATOM 0 H GLU A 102 -6.229 4.320 1.157 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.738 6.442 2.324 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -6.309 3.964 3.261 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.772 5.160 4.455 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -8.722 3.955 2.467 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -8.430 3.279 4.057 1.00 0.00 H new ATOM 1619 N ALA A 103 -4.518 6.671 2.356 1.00 0.00 N ATOM 1620 CA ALA A 103 -3.390 7.519 2.719 1.00 0.00 C ATOM 1621 C ALA A 103 -3.232 8.673 1.734 1.00 0.00 C ATOM 1622 O ALA A 103 -2.689 9.725 2.075 1.00 0.00 O ATOM 1623 CB ALA A 103 -2.111 6.698 2.781 1.00 0.00 C ATOM 0 H ALA A 103 -4.302 5.957 1.661 1.00 0.00 H new ATOM 0 HA ALA A 103 -3.587 7.941 3.705 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -1.277 7.344 3.053 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -2.219 5.911 3.528 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -1.919 6.249 1.806 1.00 0.00 H new ATOM 1629 N LEU A 104 -3.710 8.471 0.511 1.00 0.00 N ATOM 1630 CA LEU A 104 -3.622 9.495 -0.524 1.00 0.00 C ATOM 1631 C LEU A 104 -4.743 10.518 -0.375 1.00 0.00 C ATOM 1632 O LEU A 104 -4.512 11.725 -0.460 1.00 0.00 O ATOM 1633 CB LEU A 104 -3.684 8.852 -1.911 1.00 0.00 C ATOM 1634 CG LEU A 104 -2.391 8.207 -2.411 1.00 0.00 C ATOM 1635 CD1 LEU A 104 -2.565 7.693 -3.831 1.00 0.00 C ATOM 1636 CD2 LEU A 104 -1.238 9.198 -2.338 1.00 0.00 C ATOM 0 H LEU A 104 -4.163 7.607 0.212 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.668 10.010 -0.411 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -4.466 8.092 -1.902 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -3.988 9.614 -2.629 1.00 0.00 H new ATOM 0 HG LEU A 104 -2.157 7.360 -1.766 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -1.634 7.237 -4.170 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -3.362 6.950 -3.854 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.823 8.523 -4.489 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -0.326 8.722 -2.698 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -1.464 10.065 -2.959 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -1.098 9.517 -1.305 1.00 0.00 H new ATOM 1648 N THR A 105 -5.958 10.029 -0.149 1.00 0.00 N ATOM 1649 CA THR A 105 -7.115 10.901 0.014 1.00 0.00 C ATOM 1650 C THR A 105 -6.927 11.850 1.192 1.00 0.00 C ATOM 1651 O THR A 105 -7.585 12.885 1.278 1.00 0.00 O ATOM 1652 CB THR A 105 -8.406 10.087 0.225 1.00 0.00 C ATOM 1653 OG1 THR A 105 -9.550 10.922 0.018 1.00 0.00 O ATOM 1654 CG2 THR A 105 -8.450 9.496 1.626 1.00 0.00 C ATOM 0 H THR A 105 -6.167 9.033 -0.075 1.00 0.00 H new ATOM 0 HA THR A 105 -7.206 11.481 -0.904 1.00 0.00 H new ATOM 0 HB THR A 105 -8.417 9.270 -0.497 1.00 0.00 H new ATOM 0 HG1 THR A 105 -10.367 10.397 0.152 1.00 0.00 H new ATOM 0 HG21 THR A 105 -9.370 8.926 1.752 1.00 0.00 H new ATOM 0 HG22 THR A 105 -7.593 8.838 1.770 1.00 0.00 H new ATOM 0 HG23 THR A 105 -8.418 10.300 2.361 1.00 0.00 H new ATOM 1662 N MET A 106 -6.024 11.489 2.098 1.00 0.00 N ATOM 1663 CA MET A 106 -5.748 12.311 3.271 1.00 0.00 C ATOM 1664 C MET A 106 -4.506 13.169 3.054 1.00 0.00 C ATOM 1665 O MET A 106 -4.236 14.092 3.821 1.00 0.00 O ATOM 1666 CB MET A 106 -5.563 11.428 4.506 1.00 0.00 C ATOM 1667 CG MET A 106 -4.327 10.544 4.442 1.00 0.00 C ATOM 1668 SD MET A 106 -3.863 9.882 6.054 1.00 0.00 S ATOM 1669 CE MET A 106 -2.945 11.261 6.735 1.00 0.00 C ATOM 0 H MET A 106 -5.471 10.633 2.043 1.00 0.00 H new ATOM 0 HA MET A 106 -6.600 12.972 3.430 1.00 0.00 H new ATOM 0 HB2 MET A 106 -5.500 12.063 5.390 1.00 0.00 H new ATOM 0 HB3 MET A 106 -6.444 10.798 4.627 1.00 0.00 H new ATOM 0 HG2 MET A 106 -4.510 9.719 3.754 1.00 0.00 H new ATOM 0 HG3 MET A 106 -3.494 11.119 4.036 1.00 0.00 H new ATOM 0 HE1 MET A 106 -2.591 11.005 7.733 1.00 0.00 H new ATOM 0 HE2 MET A 106 -2.092 11.483 6.093 1.00 0.00 H new ATOM 0 HE3 MET A 106 -3.593 12.136 6.793 1.00 0.00 H new ATOM 1679 N ALA A 107 -3.753 12.857 2.004 1.00 0.00 N ATOM 1680 CA ALA A 107 -2.541 13.601 1.686 1.00 0.00 C ATOM 1681 C ALA A 107 -2.756 14.514 0.483 1.00 0.00 C ATOM 1682 O ALA A 107 -3.787 14.443 -0.186 1.00 0.00 O ATOM 1683 CB ALA A 107 -1.387 12.644 1.424 1.00 0.00 C ATOM 0 H ALA A 107 -3.961 12.094 1.360 1.00 0.00 H new ATOM 0 HA ALA A 107 -2.293 14.226 2.544 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -0.488 13.214 1.188 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -1.209 12.037 2.312 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -1.636 11.995 0.585 1.00 0.00 H new ATOM 1689 N PHE A 108 -1.777 15.371 0.213 1.00 0.00 N ATOM 1690 CA PHE A 108 -1.861 16.299 -0.909 1.00 0.00 C ATOM 1691 C PHE A 108 -2.075 15.549 -2.220 1.00 0.00 C ATOM 1692 O PHE A 108 -1.830 14.345 -2.307 1.00 0.00 O ATOM 1693 CB PHE A 108 -0.589 17.145 -0.994 1.00 0.00 C ATOM 1694 CG PHE A 108 0.667 16.330 -1.117 1.00 0.00 C ATOM 1695 CD1 PHE A 108 1.112 15.903 -2.358 1.00 0.00 C ATOM 1696 CD2 PHE A 108 1.402 15.991 0.007 1.00 0.00 C ATOM 1697 CE1 PHE A 108 2.267 15.152 -2.474 1.00 0.00 C ATOM 1698 CE2 PHE A 108 2.557 15.241 -0.102 1.00 0.00 C ATOM 1699 CZ PHE A 108 2.991 14.822 -1.345 1.00 0.00 C ATOM 0 H PHE A 108 -0.916 15.442 0.756 1.00 0.00 H new ATOM 0 HA PHE A 108 -2.715 16.955 -0.743 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -0.664 17.814 -1.851 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -0.520 17.772 -0.105 1.00 0.00 H new ATOM 0 HD1 PHE A 108 0.550 16.160 -3.244 1.00 0.00 H new ATOM 0 HD2 PHE A 108 1.068 16.317 0.981 1.00 0.00 H new ATOM 0 HE1 PHE A 108 2.603 14.824 -3.447 1.00 0.00 H new ATOM 0 HE2 PHE A 108 3.120 14.983 0.783 1.00 0.00 H new ATOM 0 HZ PHE A 108 3.895 14.237 -1.434 1.00 0.00 H new ATOM 1709 N SER A 109 -2.533 16.269 -3.239 1.00 0.00 N ATOM 1710 CA SER A 109 -2.785 15.672 -4.545 1.00 0.00 C ATOM 1711 C SER A 109 -1.786 16.184 -5.578 1.00 0.00 C ATOM 1712 O SER A 109 -1.011 17.101 -5.308 1.00 0.00 O ATOM 1713 CB SER A 109 -4.212 15.978 -5.003 1.00 0.00 C ATOM 1714 OG SER A 109 -5.164 15.362 -4.153 1.00 0.00 O ATOM 0 H SER A 109 -2.737 17.267 -3.185 1.00 0.00 H new ATOM 0 HA SER A 109 -2.665 14.593 -4.453 1.00 0.00 H new ATOM 0 HB2 SER A 109 -4.371 17.056 -5.011 1.00 0.00 H new ATOM 0 HB3 SER A 109 -4.352 15.627 -6.025 1.00 0.00 H new ATOM 0 HG SER A 109 -6.068 15.574 -4.466 1.00 0.00 H new ATOM 1720 N GLY A 110 -1.811 15.585 -6.765 1.00 0.00 N ATOM 1721 CA GLY A 110 -0.903 15.993 -7.821 1.00 0.00 C ATOM 1722 C GLY A 110 -0.657 14.891 -8.832 1.00 0.00 C ATOM 1723 O GLY A 110 -1.161 14.925 -9.955 1.00 0.00 O ATOM 0 H GLY A 110 -2.444 14.825 -7.014 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -1.312 16.865 -8.331 1.00 0.00 H new ATOM 0 HA3 GLY A 110 0.047 16.297 -7.382 1.00 0.00 H new ATOM 1727 N PRO A 111 0.136 13.885 -8.435 1.00 0.00 N ATOM 1728 CA PRO A 111 0.467 12.749 -9.300 1.00 0.00 C ATOM 1729 C PRO A 111 -0.730 11.837 -9.545 1.00 0.00 C ATOM 1730 O PRO A 111 -0.728 11.028 -10.472 1.00 0.00 O ATOM 1731 CB PRO A 111 1.551 12.008 -8.513 1.00 0.00 C ATOM 1732 CG PRO A 111 1.303 12.372 -7.091 1.00 0.00 C ATOM 1733 CD PRO A 111 0.771 13.779 -7.110 1.00 0.00 C ATOM 0 HA PRO A 111 0.785 13.072 -10.291 1.00 0.00 H new ATOM 0 HB2 PRO A 111 1.483 10.931 -8.663 1.00 0.00 H new ATOM 0 HB3 PRO A 111 2.548 12.312 -8.831 1.00 0.00 H new ATOM 0 HG2 PRO A 111 0.587 11.690 -6.633 1.00 0.00 H new ATOM 0 HG3 PRO A 111 2.221 12.310 -6.506 1.00 0.00 H new ATOM 0 HD2 PRO A 111 0.055 13.949 -6.306 1.00 0.00 H new ATOM 0 HD3 PRO A 111 1.568 14.512 -6.987 1.00 0.00 H new ATOM 1741 N SER A 112 -1.753 11.975 -8.707 1.00 0.00 N ATOM 1742 CA SER A 112 -2.957 11.161 -8.830 1.00 0.00 C ATOM 1743 C SER A 112 -3.519 11.234 -10.246 1.00 0.00 C ATOM 1744 O SER A 112 -3.958 10.229 -10.805 1.00 0.00 O ATOM 1745 CB SER A 112 -4.014 11.621 -7.825 1.00 0.00 C ATOM 1746 OG SER A 112 -4.578 12.863 -8.210 1.00 0.00 O ATOM 0 H SER A 112 -1.772 12.643 -7.936 1.00 0.00 H new ATOM 0 HA SER A 112 -2.690 10.126 -8.617 1.00 0.00 H new ATOM 0 HB2 SER A 112 -4.800 10.869 -7.749 1.00 0.00 H new ATOM 0 HB3 SER A 112 -3.564 11.713 -6.836 1.00 0.00 H new ATOM 0 HG SER A 112 -5.252 13.134 -7.552 1.00 0.00 H new ATOM 1752 N SER A 113 -3.503 12.432 -10.822 1.00 0.00 N ATOM 1753 CA SER A 113 -4.014 12.639 -12.171 1.00 0.00 C ATOM 1754 C SER A 113 -2.880 12.618 -13.192 1.00 0.00 C ATOM 1755 O SER A 113 -2.355 13.662 -13.575 1.00 0.00 O ATOM 1756 CB SER A 113 -4.767 13.969 -12.256 1.00 0.00 C ATOM 1757 OG SER A 113 -5.656 13.982 -13.360 1.00 0.00 O ATOM 0 H SER A 113 -3.141 13.274 -10.375 1.00 0.00 H new ATOM 0 HA SER A 113 -4.701 11.825 -12.401 1.00 0.00 H new ATOM 0 HB2 SER A 113 -5.325 14.134 -11.334 1.00 0.00 H new ATOM 0 HB3 SER A 113 -4.055 14.789 -12.349 1.00 0.00 H new ATOM 0 HG SER A 113 -6.126 14.841 -13.391 1.00 0.00 H new ATOM 1763 N GLY A 114 -2.507 11.418 -13.627 1.00 0.00 N ATOM 1764 CA GLY A 114 -1.437 11.282 -14.599 1.00 0.00 C ATOM 1765 C GLY A 114 -0.063 11.367 -13.964 1.00 0.00 C ATOM 1766 O GLY A 114 0.559 10.345 -13.674 1.00 0.00 O ATOM 0 H GLY A 114 -2.926 10.539 -13.324 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -1.537 10.327 -15.114 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -1.534 12.063 -15.353 1.00 0.00 H new TER 1770 GLY A 114