USER MOD reduce.3.24.130724 H: found=0, std=0, add=1093, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1089 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 102 GLN : amide:sc= -0.271 K(o=-0.28,f=-2.1!) USER MOD Set 1.2: A 125 THR OG1 : rot 180:sc= -0.013 USER MOD Set 2.1: A 55 CYS SG : rot 140:sc= -0.513 USER MOD Set 2.2: A 58 MET CE :methyl -123:sc= -3.17 (180deg=-6.01!) USER MOD Set 3.1: A 52 SER OG : rot 180:sc=-0.00321 USER MOD Set 3.2: A 120 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 48 TYR OH : rot -160:sc= 0.192 USER MOD Set 4.2: A 139 LYS NZ :NH3+ -128:sc= 0 (180deg=-0.33) USER MOD Single : A 1 GLY N :NH3+ -118:sc= 0.0669 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.148 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -10:sc= 0.701 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 32:sc= 0.0955 USER MOD Single : A 19 CYS SG : rot 180:sc= -0.303 USER MOD Single : A 25 MET CE :methyl 168:sc= -2.64 (180deg=-3.23) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 36 CYS SG : rot 180:sc= -0.234 USER MOD Single : A 39 THR OG1 : rot -150:sc= -0.3 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.15 K(o=-0.15,f=-0.92) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 HIS : no HD1:sc= -3.56 K(o=-3.6,f=-6.9!) USER MOD Single : A 64 CYS SG : rot 180:sc= -0.375 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.122 K(o=-0.12,f=-2.1!) USER MOD Single : A 69 ASN : amide:sc= -1 K(o=-1,f=-10!) USER MOD Single : A 73 GLN : amide:sc= -0.478 K(o=-0.48,f=-2) USER MOD Single : A 75 THR OG1 : rot 16:sc= 1.05 USER MOD Single : A 77 MET CE :methyl -177:sc= -0.056 (180deg=-0.0763) USER MOD Single : A 79 ASN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 80 LYS NZ :NH3+ 164:sc= -0.0754 (180deg=-0.32) USER MOD Single : A 81 SER OG : rot -55:sc= 0.857 USER MOD Single : A 83 ASN : amide:sc= -0.127 K(o=-0.13,f=-0.99) USER MOD Single : A 88 ASN : amide:sc= -0.105 K(o=-0.1,f=-2.3!) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 83:sc= 0.125 USER MOD Single : A 101 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 105 TYR OH : rot 150:sc= 0 USER MOD Single : A 107 GLN : amide:sc= -3.32! C(o=-3.3!,f=-8.7!) USER MOD Single : A 114 ASN : amide:sc= -0.361 X(o=-0.36,f=-0.82) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 ASN : amide:sc= -1.19 X(o=-1.2,f=-1) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 130:sc=-0.00162 USER MOD Single : A 135 CYS SG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot -107:sc= 0.167! USER MOD Single : A 140 SER OG : rot -132:sc= 0.307 USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 29.713 13.710 -13.589 1.00 0.00 N ATOM 2 CA GLY A 1 29.810 12.277 -13.798 1.00 0.00 C ATOM 3 C GLY A 1 29.073 11.822 -15.041 1.00 0.00 C ATOM 4 O GLY A 1 28.382 12.610 -15.686 1.00 0.00 O ATOM 0 H1 GLY A 1 30.663 14.131 -13.627 1.00 0.00 H new ATOM 0 H2 GLY A 1 29.118 14.130 -14.332 1.00 0.00 H new ATOM 0 H3 GLY A 1 29.288 13.897 -12.658 1.00 0.00 H new ATOM 0 HA2 GLY A 1 30.860 11.995 -13.878 1.00 0.00 H new ATOM 0 HA3 GLY A 1 29.406 11.758 -12.929 1.00 0.00 H new ATOM 8 N SER A 2 29.221 10.545 -15.380 1.00 0.00 N ATOM 9 CA SER A 2 28.568 9.986 -16.558 1.00 0.00 C ATOM 10 C SER A 2 27.728 8.768 -16.188 1.00 0.00 C ATOM 11 O SER A 2 27.730 8.325 -15.039 1.00 0.00 O ATOM 12 CB SER A 2 29.610 9.600 -17.610 1.00 0.00 C ATOM 13 OG SER A 2 28.990 9.198 -18.819 1.00 0.00 O ATOM 0 H SER A 2 29.787 9.878 -14.856 1.00 0.00 H new ATOM 0 HA SER A 2 27.908 10.748 -16.972 1.00 0.00 H new ATOM 0 HB2 SER A 2 30.270 10.446 -17.800 1.00 0.00 H new ATOM 0 HB3 SER A 2 30.232 8.790 -17.230 1.00 0.00 H new ATOM 0 HG SER A 2 29.677 8.958 -19.475 1.00 0.00 H new ATOM 19 N SER A 3 27.010 8.231 -17.169 1.00 0.00 N ATOM 20 CA SER A 3 26.161 7.067 -16.946 1.00 0.00 C ATOM 21 C SER A 3 26.084 6.203 -18.202 1.00 0.00 C ATOM 22 O SER A 3 26.076 6.713 -19.321 1.00 0.00 O ATOM 23 CB SER A 3 24.756 7.505 -16.529 1.00 0.00 C ATOM 24 OG SER A 3 24.044 6.435 -15.932 1.00 0.00 O ATOM 0 H SER A 3 26.999 8.584 -18.126 1.00 0.00 H new ATOM 0 HA SER A 3 26.602 6.475 -16.144 1.00 0.00 H new ATOM 0 HB2 SER A 3 24.824 8.337 -15.828 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.211 7.867 -17.401 1.00 0.00 H new ATOM 0 HG SER A 3 23.150 6.741 -15.673 1.00 0.00 H new ATOM 30 N GLY A 4 26.028 4.889 -18.006 1.00 0.00 N ATOM 31 CA GLY A 4 25.953 3.973 -19.129 1.00 0.00 C ATOM 32 C GLY A 4 24.616 3.264 -19.211 1.00 0.00 C ATOM 33 O GLY A 4 23.641 3.691 -18.593 1.00 0.00 O ATOM 0 H GLY A 4 26.033 4.443 -17.089 1.00 0.00 H new ATOM 0 HA2 GLY A 4 26.127 4.523 -20.054 1.00 0.00 H new ATOM 0 HA3 GLY A 4 26.749 3.233 -19.044 1.00 0.00 H new ATOM 37 N SER A 5 24.569 2.179 -19.977 1.00 0.00 N ATOM 38 CA SER A 5 23.340 1.412 -20.142 1.00 0.00 C ATOM 39 C SER A 5 23.647 -0.021 -20.567 1.00 0.00 C ATOM 40 O SER A 5 24.716 -0.304 -21.108 1.00 0.00 O ATOM 41 CB SER A 5 22.432 2.080 -21.177 1.00 0.00 C ATOM 42 OG SER A 5 21.071 1.762 -20.942 1.00 0.00 O ATOM 0 H SER A 5 25.368 1.811 -20.493 1.00 0.00 H new ATOM 0 HA SER A 5 22.826 1.385 -19.181 1.00 0.00 H new ATOM 0 HB2 SER A 5 22.568 3.161 -21.141 1.00 0.00 H new ATOM 0 HB3 SER A 5 22.717 1.756 -22.178 1.00 0.00 H new ATOM 0 HG SER A 5 20.511 2.202 -21.615 1.00 0.00 H new ATOM 48 N SER A 6 22.700 -0.920 -20.319 1.00 0.00 N ATOM 49 CA SER A 6 22.869 -2.325 -20.672 1.00 0.00 C ATOM 50 C SER A 6 21.518 -3.024 -20.781 1.00 0.00 C ATOM 51 O SER A 6 20.474 -2.424 -20.530 1.00 0.00 O ATOM 52 CB SER A 6 23.740 -3.033 -19.632 1.00 0.00 C ATOM 53 OG SER A 6 25.029 -2.449 -19.563 1.00 0.00 O ATOM 0 H SER A 6 21.808 -0.701 -19.875 1.00 0.00 H new ATOM 0 HA SER A 6 23.363 -2.373 -21.643 1.00 0.00 H new ATOM 0 HB2 SER A 6 23.260 -2.980 -18.655 1.00 0.00 H new ATOM 0 HB3 SER A 6 23.829 -4.089 -19.886 1.00 0.00 H new ATOM 0 HG SER A 6 25.142 -1.818 -20.304 1.00 0.00 H new ATOM 59 N GLY A 7 21.547 -4.299 -21.159 1.00 0.00 N ATOM 60 CA GLY A 7 20.318 -5.060 -21.295 1.00 0.00 C ATOM 61 C GLY A 7 20.040 -5.933 -20.088 1.00 0.00 C ATOM 62 O GLY A 7 20.684 -5.791 -19.048 1.00 0.00 O ATOM 0 H GLY A 7 22.399 -4.818 -21.373 1.00 0.00 H new ATOM 0 HA2 GLY A 7 19.484 -4.374 -21.443 1.00 0.00 H new ATOM 0 HA3 GLY A 7 20.378 -5.685 -22.186 1.00 0.00 H new ATOM 66 N VAL A 8 19.077 -6.839 -20.224 1.00 0.00 N ATOM 67 CA VAL A 8 18.714 -7.739 -19.136 1.00 0.00 C ATOM 68 C VAL A 8 18.404 -9.137 -19.659 1.00 0.00 C ATOM 69 O VAL A 8 18.089 -9.317 -20.836 1.00 0.00 O ATOM 70 CB VAL A 8 17.496 -7.212 -18.355 1.00 0.00 C ATOM 71 CG1 VAL A 8 17.804 -5.859 -17.732 1.00 0.00 C ATOM 72 CG2 VAL A 8 16.278 -7.125 -19.263 1.00 0.00 C ATOM 0 H VAL A 8 18.534 -6.969 -21.078 1.00 0.00 H new ATOM 0 HA VAL A 8 19.572 -7.788 -18.466 1.00 0.00 H new ATOM 0 HB VAL A 8 17.272 -7.912 -17.550 1.00 0.00 H new ATOM 0 HG11 VAL A 8 16.931 -5.503 -17.185 1.00 0.00 H new ATOM 0 HG12 VAL A 8 18.647 -5.957 -17.048 1.00 0.00 H new ATOM 0 HG13 VAL A 8 18.055 -5.146 -18.517 1.00 0.00 H new ATOM 0 HG21 VAL A 8 15.426 -6.751 -18.695 1.00 0.00 H new ATOM 0 HG22 VAL A 8 16.488 -6.447 -20.090 1.00 0.00 H new ATOM 0 HG23 VAL A 8 16.045 -8.115 -19.656 1.00 0.00 H new ATOM 82 N THR A 9 18.494 -10.127 -18.776 1.00 0.00 N ATOM 83 CA THR A 9 18.223 -11.510 -19.148 1.00 0.00 C ATOM 84 C THR A 9 17.120 -12.106 -18.281 1.00 0.00 C ATOM 85 O THR A 9 16.612 -11.455 -17.369 1.00 0.00 O ATOM 86 CB THR A 9 19.486 -12.382 -19.023 1.00 0.00 C ATOM 87 OG1 THR A 9 20.263 -11.961 -17.897 1.00 0.00 O ATOM 88 CG2 THR A 9 20.329 -12.298 -20.287 1.00 0.00 C ATOM 0 H THR A 9 18.753 -9.996 -17.798 1.00 0.00 H new ATOM 0 HA THR A 9 17.898 -11.500 -20.188 1.00 0.00 H new ATOM 0 HB THR A 9 19.173 -13.417 -18.882 1.00 0.00 H new ATOM 0 HG1 THR A 9 21.063 -12.522 -17.824 1.00 0.00 H new ATOM 0 HG21 THR A 9 21.216 -12.922 -20.175 1.00 0.00 H new ATOM 0 HG22 THR A 9 19.744 -12.647 -21.138 1.00 0.00 H new ATOM 0 HG23 THR A 9 20.632 -11.264 -20.454 1.00 0.00 H new ATOM 96 N GLY A 10 16.753 -13.351 -18.572 1.00 0.00 N ATOM 97 CA GLY A 10 15.712 -14.014 -17.809 1.00 0.00 C ATOM 98 C GLY A 10 15.880 -15.521 -17.787 1.00 0.00 C ATOM 99 O GLY A 10 15.180 -16.241 -18.499 1.00 0.00 O ATOM 0 H GLY A 10 17.158 -13.911 -19.322 1.00 0.00 H new ATOM 0 HA2 GLY A 10 15.718 -13.636 -16.787 1.00 0.00 H new ATOM 0 HA3 GLY A 10 14.740 -13.766 -18.235 1.00 0.00 H new ATOM 103 N ASP A 11 16.811 -15.998 -16.969 1.00 0.00 N ATOM 104 CA ASP A 11 17.070 -17.429 -16.857 1.00 0.00 C ATOM 105 C ASP A 11 16.718 -17.938 -15.463 1.00 0.00 C ATOM 106 O ASP A 11 16.449 -19.124 -15.274 1.00 0.00 O ATOM 107 CB ASP A 11 18.537 -17.729 -17.167 1.00 0.00 C ATOM 108 CG ASP A 11 18.774 -18.000 -18.640 1.00 0.00 C ATOM 109 OD1 ASP A 11 18.968 -17.028 -19.398 1.00 0.00 O ATOM 110 OD2 ASP A 11 18.765 -19.186 -19.034 1.00 0.00 O ATOM 0 H ASP A 11 17.399 -15.415 -16.373 1.00 0.00 H new ATOM 0 HA ASP A 11 16.440 -17.945 -17.582 1.00 0.00 H new ATOM 0 HB2 ASP A 11 19.152 -16.886 -16.852 1.00 0.00 H new ATOM 0 HB3 ASP A 11 18.859 -18.593 -16.585 1.00 0.00 H new ATOM 115 N ARG A 12 16.721 -17.033 -14.490 1.00 0.00 N ATOM 116 CA ARG A 12 16.404 -17.391 -13.112 1.00 0.00 C ATOM 117 C ARG A 12 15.259 -16.535 -12.578 1.00 0.00 C ATOM 118 O ARG A 12 14.757 -15.650 -13.271 1.00 0.00 O ATOM 119 CB ARG A 12 17.637 -17.224 -12.223 1.00 0.00 C ATOM 120 CG ARG A 12 18.214 -15.818 -12.239 1.00 0.00 C ATOM 121 CD ARG A 12 17.796 -15.030 -11.007 1.00 0.00 C ATOM 122 NE ARG A 12 17.779 -13.591 -11.256 1.00 0.00 N ATOM 123 CZ ARG A 12 17.532 -12.685 -10.317 1.00 0.00 C ATOM 124 NH1 ARG A 12 17.282 -13.067 -9.072 1.00 0.00 N ATOM 125 NH2 ARG A 12 17.535 -11.394 -10.622 1.00 0.00 N ATOM 0 H ARG A 12 16.939 -16.047 -14.630 1.00 0.00 H new ATOM 0 HA ARG A 12 16.092 -18.435 -13.097 1.00 0.00 H new ATOM 0 HB2 ARG A 12 17.374 -17.488 -11.199 1.00 0.00 H new ATOM 0 HB3 ARG A 12 18.405 -17.926 -12.546 1.00 0.00 H new ATOM 0 HG2 ARG A 12 19.302 -15.870 -12.287 1.00 0.00 H new ATOM 0 HG3 ARG A 12 17.880 -15.297 -13.136 1.00 0.00 H new ATOM 0 HD2 ARG A 12 16.805 -15.354 -10.689 1.00 0.00 H new ATOM 0 HD3 ARG A 12 18.481 -15.248 -10.188 1.00 0.00 H new ATOM 0 HE ARG A 12 17.967 -13.264 -12.204 1.00 0.00 H new ATOM 0 HH11 ARG A 12 17.279 -14.059 -8.834 1.00 0.00 H new ATOM 0 HH12 ARG A 12 17.093 -12.369 -8.353 1.00 0.00 H new ATOM 0 HH21 ARG A 12 17.727 -11.096 -11.579 1.00 0.00 H new ATOM 0 HH22 ARG A 12 17.345 -10.699 -9.900 1.00 0.00 H new ATOM 139 N ALA A 13 14.851 -16.806 -11.343 1.00 0.00 N ATOM 140 CA ALA A 13 13.767 -16.061 -10.716 1.00 0.00 C ATOM 141 C ALA A 13 12.460 -16.245 -11.480 1.00 0.00 C ATOM 142 O ALA A 13 11.954 -15.309 -12.097 1.00 0.00 O ATOM 143 CB ALA A 13 14.124 -14.585 -10.625 1.00 0.00 C ATOM 0 H ALA A 13 15.255 -17.536 -10.757 1.00 0.00 H new ATOM 0 HA ALA A 13 13.626 -16.452 -9.708 1.00 0.00 H new ATOM 0 HB1 ALA A 13 13.305 -14.041 -10.155 1.00 0.00 H new ATOM 0 HB2 ALA A 13 15.029 -14.466 -10.029 1.00 0.00 H new ATOM 0 HB3 ALA A 13 14.294 -14.189 -11.626 1.00 0.00 H new ATOM 149 N GLY A 14 11.919 -17.458 -11.435 1.00 0.00 N ATOM 150 CA GLY A 14 10.676 -17.743 -12.128 1.00 0.00 C ATOM 151 C GLY A 14 9.459 -17.524 -11.251 1.00 0.00 C ATOM 152 O GLY A 14 9.495 -16.725 -10.316 1.00 0.00 O ATOM 0 H GLY A 14 12.319 -18.249 -10.931 1.00 0.00 H new ATOM 0 HA2 GLY A 14 10.602 -17.108 -13.011 1.00 0.00 H new ATOM 0 HA3 GLY A 14 10.687 -18.775 -12.477 1.00 0.00 H new ATOM 156 N GLY A 15 8.377 -18.235 -11.554 1.00 0.00 N ATOM 157 CA GLY A 15 7.159 -18.098 -10.777 1.00 0.00 C ATOM 158 C GLY A 15 6.574 -16.702 -10.857 1.00 0.00 C ATOM 159 O GLY A 15 7.261 -15.755 -11.241 1.00 0.00 O ATOM 0 H GLY A 15 8.322 -18.903 -12.323 1.00 0.00 H new ATOM 0 HA2 GLY A 15 6.422 -18.818 -11.132 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.367 -18.342 -9.735 1.00 0.00 H new ATOM 163 N ARG A 16 5.302 -16.573 -10.494 1.00 0.00 N ATOM 164 CA ARG A 16 4.625 -15.282 -10.529 1.00 0.00 C ATOM 165 C ARG A 16 4.824 -14.528 -9.218 1.00 0.00 C ATOM 166 O ARG A 16 5.200 -15.115 -8.203 1.00 0.00 O ATOM 167 CB ARG A 16 3.131 -15.474 -10.797 1.00 0.00 C ATOM 168 CG ARG A 16 2.723 -15.151 -12.225 1.00 0.00 C ATOM 169 CD ARG A 16 1.595 -16.054 -12.700 1.00 0.00 C ATOM 170 NE ARG A 16 0.352 -15.316 -12.904 1.00 0.00 N ATOM 171 CZ ARG A 16 -0.774 -15.877 -13.331 1.00 0.00 C ATOM 172 NH1 ARG A 16 -0.813 -17.175 -13.597 1.00 0.00 N ATOM 173 NH2 ARG A 16 -1.865 -15.138 -13.492 1.00 0.00 N ATOM 0 H ARG A 16 4.720 -17.346 -10.172 1.00 0.00 H new ATOM 0 HA ARG A 16 5.060 -14.693 -11.336 1.00 0.00 H new ATOM 0 HB2 ARG A 16 2.860 -16.506 -10.575 1.00 0.00 H new ATOM 0 HB3 ARG A 16 2.564 -14.842 -10.114 1.00 0.00 H new ATOM 0 HG2 ARG A 16 2.408 -14.109 -12.288 1.00 0.00 H new ATOM 0 HG3 ARG A 16 3.583 -15.264 -12.885 1.00 0.00 H new ATOM 0 HD2 ARG A 16 1.886 -16.538 -13.632 1.00 0.00 H new ATOM 0 HD3 ARG A 16 1.431 -16.845 -11.968 1.00 0.00 H new ATOM 0 HE ARG A 16 0.348 -14.315 -12.708 1.00 0.00 H new ATOM 0 HH11 ARG A 16 0.023 -17.746 -13.474 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -1.679 -17.603 -13.925 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -1.839 -14.139 -13.288 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -2.729 -15.569 -13.820 1.00 0.00 H new ATOM 187 N SER A 17 4.571 -13.224 -9.247 1.00 0.00 N ATOM 188 CA SER A 17 4.727 -12.388 -8.062 1.00 0.00 C ATOM 189 C SER A 17 3.751 -11.216 -8.092 1.00 0.00 C ATOM 190 O SER A 17 3.923 -10.270 -8.860 1.00 0.00 O ATOM 191 CB SER A 17 6.163 -11.868 -7.964 1.00 0.00 C ATOM 192 OG SER A 17 6.973 -12.749 -7.206 1.00 0.00 O ATOM 0 H SER A 17 4.257 -12.723 -10.078 1.00 0.00 H new ATOM 0 HA SER A 17 4.508 -12.998 -7.186 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.581 -11.754 -8.964 1.00 0.00 H new ATOM 0 HB3 SER A 17 6.165 -10.880 -7.503 1.00 0.00 H new ATOM 0 HG SER A 17 6.657 -13.669 -7.326 1.00 0.00 H new ATOM 198 N TRP A 18 2.726 -11.287 -7.250 1.00 0.00 N ATOM 199 CA TRP A 18 1.721 -10.232 -7.179 1.00 0.00 C ATOM 200 C TRP A 18 2.376 -8.867 -6.998 1.00 0.00 C ATOM 201 O TRP A 18 3.556 -8.775 -6.657 1.00 0.00 O ATOM 202 CB TRP A 18 0.749 -10.502 -6.029 1.00 0.00 C ATOM 203 CG TRP A 18 -0.123 -11.699 -6.257 1.00 0.00 C ATOM 204 CD1 TRP A 18 0.173 -12.998 -5.956 1.00 0.00 C ATOM 205 CD2 TRP A 18 -1.432 -11.708 -6.835 1.00 0.00 C ATOM 206 NE1 TRP A 18 -0.873 -13.813 -6.312 1.00 0.00 N ATOM 207 CE2 TRP A 18 -1.871 -13.046 -6.853 1.00 0.00 C ATOM 208 CE3 TRP A 18 -2.278 -10.715 -7.338 1.00 0.00 C ATOM 209 CZ2 TRP A 18 -3.116 -13.414 -7.355 1.00 0.00 C ATOM 210 CZ3 TRP A 18 -3.514 -11.082 -7.836 1.00 0.00 C ATOM 211 CH2 TRP A 18 -3.924 -12.422 -7.841 1.00 0.00 C ATOM 0 H TRP A 18 2.569 -12.063 -6.607 1.00 0.00 H new ATOM 0 HA TRP A 18 1.169 -10.227 -8.119 1.00 0.00 H new ATOM 0 HB2 TRP A 18 1.316 -10.645 -5.109 1.00 0.00 H new ATOM 0 HB3 TRP A 18 0.119 -9.625 -5.882 1.00 0.00 H new ATOM 0 HD1 TRP A 18 1.094 -13.335 -5.504 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -0.902 -14.826 -6.193 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -1.971 -9.680 -7.337 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -3.433 -14.446 -7.361 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -4.175 -10.323 -8.228 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -4.896 -12.677 -8.236 1.00 0.00 H new ATOM 222 N CYS A 19 1.605 -7.810 -7.229 1.00 0.00 N ATOM 223 CA CYS A 19 2.112 -6.450 -7.091 1.00 0.00 C ATOM 224 C CYS A 19 0.980 -5.434 -7.208 1.00 0.00 C ATOM 225 O CYS A 19 -0.196 -5.799 -7.237 1.00 0.00 O ATOM 226 CB CYS A 19 3.177 -6.170 -8.153 1.00 0.00 C ATOM 227 SG CYS A 19 2.519 -5.990 -9.828 1.00 0.00 S ATOM 0 H CYS A 19 0.627 -7.869 -7.513 1.00 0.00 H new ATOM 0 HA CYS A 19 2.561 -6.354 -6.103 1.00 0.00 H new ATOM 0 HB2 CYS A 19 3.712 -5.259 -7.884 1.00 0.00 H new ATOM 0 HB3 CYS A 19 3.905 -6.981 -8.145 1.00 0.00 H new ATOM 0 HG CYS A 19 3.494 -5.753 -10.654 1.00 0.00 H new ATOM 233 N LEU A 20 1.343 -4.157 -7.274 1.00 0.00 N ATOM 234 CA LEU A 20 0.358 -3.087 -7.386 1.00 0.00 C ATOM 235 C LEU A 20 0.598 -2.255 -8.642 1.00 0.00 C ATOM 236 O LEU A 20 1.099 -1.133 -8.569 1.00 0.00 O ATOM 237 CB LEU A 20 0.408 -2.189 -6.148 1.00 0.00 C ATOM 238 CG LEU A 20 -0.068 -2.822 -4.840 1.00 0.00 C ATOM 239 CD1 LEU A 20 0.073 -1.838 -3.689 1.00 0.00 C ATOM 240 CD2 LEU A 20 -1.509 -3.293 -4.969 1.00 0.00 C ATOM 0 H LEU A 20 2.312 -3.838 -7.252 1.00 0.00 H new ATOM 0 HA LEU A 20 -0.630 -3.542 -7.457 1.00 0.00 H new ATOM 0 HB2 LEU A 20 1.435 -1.849 -6.011 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -0.198 -1.304 -6.341 1.00 0.00 H new ATOM 0 HG LEU A 20 0.558 -3.689 -4.629 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -0.271 -2.306 -2.766 1.00 0.00 H new ATOM 0 HD12 LEU A 20 1.119 -1.550 -3.582 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -0.528 -0.952 -3.892 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.831 -3.741 -4.029 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -2.150 -2.443 -5.204 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.580 -4.033 -5.766 1.00 0.00 H new ATOM 252 N ARG A 21 0.236 -2.813 -9.793 1.00 0.00 N ATOM 253 CA ARG A 21 0.412 -2.122 -11.065 1.00 0.00 C ATOM 254 C ARG A 21 -0.192 -0.722 -11.011 1.00 0.00 C ATOM 255 O ARG A 21 -1.412 -0.562 -10.979 1.00 0.00 O ATOM 256 CB ARG A 21 -0.232 -2.923 -12.197 1.00 0.00 C ATOM 257 CG ARG A 21 0.313 -2.579 -13.574 1.00 0.00 C ATOM 258 CD ARG A 21 -0.372 -3.389 -14.663 1.00 0.00 C ATOM 259 NE ARG A 21 -1.615 -2.764 -15.110 1.00 0.00 N ATOM 260 CZ ARG A 21 -2.430 -3.309 -16.005 1.00 0.00 C ATOM 261 NH1 ARG A 21 -2.137 -4.483 -16.547 1.00 0.00 N ATOM 262 NH2 ARG A 21 -3.543 -2.679 -16.361 1.00 0.00 N ATOM 0 H ARG A 21 -0.181 -3.741 -9.871 1.00 0.00 H new ATOM 0 HA ARG A 21 1.481 -2.031 -11.256 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -0.080 -3.986 -12.011 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -1.308 -2.749 -12.188 1.00 0.00 H new ATOM 0 HG2 ARG A 21 0.172 -1.516 -13.767 1.00 0.00 H new ATOM 0 HG3 ARG A 21 1.386 -2.768 -13.599 1.00 0.00 H new ATOM 0 HD2 ARG A 21 0.303 -3.500 -15.511 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -0.584 -4.391 -14.291 1.00 0.00 H new ATOM 0 HE ARG A 21 -1.870 -1.860 -14.713 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -1.283 -4.971 -16.277 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -2.766 -4.899 -17.234 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -3.772 -1.776 -15.947 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -4.169 -3.098 -17.049 1.00 0.00 H new ATOM 276 N ARG A 22 0.671 0.289 -11.000 1.00 0.00 N ATOM 277 CA ARG A 22 0.223 1.675 -10.948 1.00 0.00 C ATOM 278 C ARG A 22 -0.721 1.986 -12.106 1.00 0.00 C ATOM 279 O ARG A 22 -0.394 1.745 -13.269 1.00 0.00 O ATOM 280 CB ARG A 22 1.423 2.623 -10.986 1.00 0.00 C ATOM 281 CG ARG A 22 1.081 4.054 -10.602 1.00 0.00 C ATOM 282 CD ARG A 22 1.209 4.274 -9.103 1.00 0.00 C ATOM 283 NE ARG A 22 1.647 5.630 -8.784 1.00 0.00 N ATOM 284 CZ ARG A 22 2.917 6.019 -8.818 1.00 0.00 C ATOM 285 NH1 ARG A 22 3.868 5.160 -9.155 1.00 0.00 N ATOM 286 NH2 ARG A 22 3.236 7.271 -8.515 1.00 0.00 N ATOM 0 H ARG A 22 1.684 0.174 -11.026 1.00 0.00 H new ATOM 0 HA ARG A 22 -0.317 1.820 -10.013 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.193 2.249 -10.311 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.849 2.617 -11.989 1.00 0.00 H new ATOM 0 HG2 ARG A 22 1.742 4.741 -11.130 1.00 0.00 H new ATOM 0 HG3 ARG A 22 0.064 4.284 -10.919 1.00 0.00 H new ATOM 0 HD2 ARG A 22 0.248 4.082 -8.625 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.919 3.557 -8.691 1.00 0.00 H new ATOM 0 HE ARG A 22 0.939 6.316 -8.521 1.00 0.00 H new ATOM 0 HH11 ARG A 22 3.626 4.197 -9.389 1.00 0.00 H new ATOM 0 HH12 ARG A 22 4.842 5.462 -9.180 1.00 0.00 H new ATOM 0 HH21 ARG A 22 2.506 7.935 -8.256 1.00 0.00 H new ATOM 0 HH22 ARG A 22 4.211 7.569 -8.541 1.00 0.00 H new ATOM 300 N VAL A 23 -1.893 2.521 -11.781 1.00 0.00 N ATOM 301 CA VAL A 23 -2.884 2.865 -12.794 1.00 0.00 C ATOM 302 C VAL A 23 -2.459 4.098 -13.582 1.00 0.00 C ATOM 303 O VAL A 23 -2.220 5.161 -13.011 1.00 0.00 O ATOM 304 CB VAL A 23 -4.265 3.124 -12.163 1.00 0.00 C ATOM 305 CG1 VAL A 23 -5.274 3.518 -13.230 1.00 0.00 C ATOM 306 CG2 VAL A 23 -4.739 1.898 -11.397 1.00 0.00 C ATOM 0 H VAL A 23 -2.180 2.726 -10.824 1.00 0.00 H new ATOM 0 HA VAL A 23 -2.955 2.012 -13.469 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.174 3.951 -11.459 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.244 3.697 -12.765 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.938 4.426 -13.731 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.364 2.714 -13.960 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.716 2.099 -10.958 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.814 1.050 -12.078 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -4.026 1.665 -10.606 1.00 0.00 H new ATOM 316 N GLY A 24 -2.366 3.948 -14.900 1.00 0.00 N ATOM 317 CA GLY A 24 -1.970 5.058 -15.747 1.00 0.00 C ATOM 318 C GLY A 24 -0.479 5.077 -16.019 1.00 0.00 C ATOM 319 O GLY A 24 -0.040 5.514 -17.082 1.00 0.00 O ATOM 0 H GLY A 24 -2.558 3.078 -15.396 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.508 4.999 -16.693 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.262 5.995 -15.273 1.00 0.00 H new ATOM 323 N MET A 25 0.303 4.602 -15.054 1.00 0.00 N ATOM 324 CA MET A 25 1.754 4.566 -15.195 1.00 0.00 C ATOM 325 C MET A 25 2.259 3.128 -15.253 1.00 0.00 C ATOM 326 O MET A 25 1.856 2.286 -14.451 1.00 0.00 O ATOM 327 CB MET A 25 2.419 5.306 -14.033 1.00 0.00 C ATOM 328 CG MET A 25 2.578 6.798 -14.274 1.00 0.00 C ATOM 329 SD MET A 25 2.631 7.748 -12.742 1.00 0.00 S ATOM 330 CE MET A 25 3.807 6.789 -11.791 1.00 0.00 C ATOM 0 H MET A 25 -0.044 4.237 -14.167 1.00 0.00 H new ATOM 0 HA MET A 25 2.016 5.062 -16.130 1.00 0.00 H new ATOM 0 HB2 MET A 25 1.828 5.153 -13.130 1.00 0.00 H new ATOM 0 HB3 MET A 25 3.401 4.869 -13.849 1.00 0.00 H new ATOM 0 HG2 MET A 25 3.493 6.975 -14.839 1.00 0.00 H new ATOM 0 HG3 MET A 25 1.751 7.153 -14.889 1.00 0.00 H new ATOM 0 HE1 MET A 25 4.109 7.354 -10.909 1.00 0.00 H new ATOM 0 HE2 MET A 25 3.345 5.852 -11.480 1.00 0.00 H new ATOM 0 HE3 MET A 25 4.683 6.576 -12.404 1.00 0.00 H new ATOM 340 N SER A 26 3.143 2.854 -16.207 1.00 0.00 N ATOM 341 CA SER A 26 3.700 1.517 -16.372 1.00 0.00 C ATOM 342 C SER A 26 4.882 1.300 -15.431 1.00 0.00 C ATOM 343 O SER A 26 5.514 0.245 -15.444 1.00 0.00 O ATOM 344 CB SER A 26 4.141 1.300 -17.821 1.00 0.00 C ATOM 345 OG SER A 26 5.219 2.155 -18.159 1.00 0.00 O ATOM 0 H SER A 26 3.489 3.541 -16.877 1.00 0.00 H new ATOM 0 HA SER A 26 2.923 0.794 -16.124 1.00 0.00 H new ATOM 0 HB2 SER A 26 4.439 0.261 -17.962 1.00 0.00 H new ATOM 0 HB3 SER A 26 3.302 1.485 -18.492 1.00 0.00 H new ATOM 0 HG SER A 26 5.483 1.996 -19.089 1.00 0.00 H new ATOM 351 N ALA A 27 5.172 2.308 -14.615 1.00 0.00 N ATOM 352 CA ALA A 27 6.276 2.229 -13.666 1.00 0.00 C ATOM 353 C ALA A 27 5.773 2.331 -12.230 1.00 0.00 C ATOM 354 O ALA A 27 4.569 2.407 -11.987 1.00 0.00 O ATOM 355 CB ALA A 27 7.295 3.322 -13.949 1.00 0.00 C ATOM 0 H ALA A 27 4.658 3.189 -14.592 1.00 0.00 H new ATOM 0 HA ALA A 27 6.758 1.259 -13.787 1.00 0.00 H new ATOM 0 HB1 ALA A 27 8.113 3.251 -13.233 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.686 3.202 -14.960 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.817 4.297 -13.858 1.00 0.00 H new ATOM 361 N GLY A 28 6.703 2.331 -11.280 1.00 0.00 N ATOM 362 CA GLY A 28 6.334 2.423 -9.880 1.00 0.00 C ATOM 363 C GLY A 28 5.490 1.250 -9.424 1.00 0.00 C ATOM 364 O GLY A 28 4.597 1.405 -8.591 1.00 0.00 O ATOM 0 H GLY A 28 7.706 2.269 -11.455 1.00 0.00 H new ATOM 0 HA2 GLY A 28 7.237 2.475 -9.272 1.00 0.00 H new ATOM 0 HA3 GLY A 28 5.784 3.349 -9.713 1.00 0.00 H new ATOM 368 N TRP A 29 5.770 0.073 -9.973 1.00 0.00 N ATOM 369 CA TRP A 29 5.028 -1.131 -9.619 1.00 0.00 C ATOM 370 C TRP A 29 5.501 -1.689 -8.281 1.00 0.00 C ATOM 371 O TRP A 29 6.604 -2.228 -8.177 1.00 0.00 O ATOM 372 CB TRP A 29 5.184 -2.191 -10.711 1.00 0.00 C ATOM 373 CG TRP A 29 4.573 -1.789 -12.019 1.00 0.00 C ATOM 374 CD1 TRP A 29 3.993 -0.590 -12.319 1.00 0.00 C ATOM 375 CD2 TRP A 29 4.481 -2.589 -13.203 1.00 0.00 C ATOM 376 NE1 TRP A 29 3.545 -0.596 -13.618 1.00 0.00 N ATOM 377 CE2 TRP A 29 3.833 -1.811 -14.182 1.00 0.00 C ATOM 378 CE3 TRP A 29 4.884 -3.886 -13.532 1.00 0.00 C ATOM 379 CZ2 TRP A 29 3.579 -2.289 -15.465 1.00 0.00 C ATOM 380 CZ3 TRP A 29 4.631 -4.360 -14.805 1.00 0.00 C ATOM 381 CH2 TRP A 29 3.985 -3.563 -15.760 1.00 0.00 C ATOM 0 H TRP A 29 6.505 -0.073 -10.665 1.00 0.00 H new ATOM 0 HA TRP A 29 3.975 -0.865 -9.528 1.00 0.00 H new ATOM 0 HB2 TRP A 29 6.244 -2.395 -10.861 1.00 0.00 H new ATOM 0 HB3 TRP A 29 4.725 -3.120 -10.374 1.00 0.00 H new ATOM 0 HD1 TRP A 29 3.900 0.241 -11.636 1.00 0.00 H new ATOM 0 HE1 TRP A 29 3.074 0.178 -14.086 1.00 0.00 H new ATOM 0 HE3 TRP A 29 5.385 -4.507 -12.804 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 3.080 -1.677 -16.201 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 4.936 -5.362 -15.069 1.00 0.00 H new ATOM 0 HH2 TRP A 29 3.804 -3.961 -16.747 1.00 0.00 H new ATOM 392 N LEU A 30 4.662 -1.557 -7.260 1.00 0.00 N ATOM 393 CA LEU A 30 4.995 -2.048 -5.927 1.00 0.00 C ATOM 394 C LEU A 30 4.909 -3.570 -5.871 1.00 0.00 C ATOM 395 O LEU A 30 3.819 -4.142 -5.898 1.00 0.00 O ATOM 396 CB LEU A 30 4.058 -1.434 -4.886 1.00 0.00 C ATOM 397 CG LEU A 30 3.768 0.059 -5.042 1.00 0.00 C ATOM 398 CD1 LEU A 30 2.626 0.479 -4.130 1.00 0.00 C ATOM 399 CD2 LEU A 30 5.017 0.878 -4.747 1.00 0.00 C ATOM 0 H LEU A 30 3.746 -1.114 -7.329 1.00 0.00 H new ATOM 0 HA LEU A 30 6.020 -1.751 -5.703 1.00 0.00 H new ATOM 0 HB2 LEU A 30 3.111 -1.973 -4.916 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.487 -1.599 -3.898 1.00 0.00 H new ATOM 0 HG LEU A 30 3.470 0.246 -6.074 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.434 1.545 -4.255 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.729 -0.084 -4.387 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.896 0.278 -3.093 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.793 1.938 -4.863 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.345 0.686 -3.725 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.809 0.597 -5.441 1.00 0.00 H new ATOM 411 N LEU A 31 6.065 -4.220 -5.790 1.00 0.00 N ATOM 412 CA LEU A 31 6.121 -5.676 -5.728 1.00 0.00 C ATOM 413 C LEU A 31 5.490 -6.190 -4.438 1.00 0.00 C ATOM 414 O LEU A 31 5.609 -5.565 -3.383 1.00 0.00 O ATOM 415 CB LEU A 31 7.571 -6.155 -5.826 1.00 0.00 C ATOM 416 CG LEU A 31 7.798 -7.654 -5.622 1.00 0.00 C ATOM 417 CD1 LEU A 31 7.406 -8.427 -6.871 1.00 0.00 C ATOM 418 CD2 LEU A 31 9.249 -7.928 -5.255 1.00 0.00 C ATOM 0 H LEU A 31 6.976 -3.762 -5.766 1.00 0.00 H new ATOM 0 HA LEU A 31 5.556 -6.073 -6.571 1.00 0.00 H new ATOM 0 HB2 LEU A 31 7.958 -5.879 -6.807 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.162 -5.614 -5.087 1.00 0.00 H new ATOM 0 HG LEU A 31 7.167 -7.990 -4.799 1.00 0.00 H new ATOM 0 HD11 LEU A 31 7.574 -9.492 -6.708 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.352 -8.255 -7.089 1.00 0.00 H new ATOM 0 HD13 LEU A 31 8.011 -8.089 -7.713 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.392 -8.999 -5.114 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.899 -7.577 -6.056 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.496 -7.404 -4.332 1.00 0.00 H new ATOM 430 N LEU A 32 4.820 -7.334 -4.528 1.00 0.00 N ATOM 431 CA LEU A 32 4.171 -7.934 -3.368 1.00 0.00 C ATOM 432 C LEU A 32 4.692 -9.347 -3.122 1.00 0.00 C ATOM 433 O LEU A 32 4.007 -10.329 -3.406 1.00 0.00 O ATOM 434 CB LEU A 32 2.655 -7.965 -3.566 1.00 0.00 C ATOM 435 CG LEU A 32 1.938 -6.617 -3.477 1.00 0.00 C ATOM 436 CD1 LEU A 32 0.505 -6.741 -3.969 1.00 0.00 C ATOM 437 CD2 LEU A 32 1.970 -6.089 -2.050 1.00 0.00 C ATOM 0 H LEU A 32 4.712 -7.864 -5.393 1.00 0.00 H new ATOM 0 HA LEU A 32 4.405 -7.323 -2.496 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.445 -8.402 -4.542 1.00 0.00 H new ATOM 0 HB3 LEU A 32 2.225 -8.633 -2.819 1.00 0.00 H new ATOM 0 HG LEU A 32 2.460 -5.907 -4.118 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.011 -5.772 -3.898 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.504 -7.074 -5.007 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.029 -7.466 -3.355 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.455 -5.129 -2.006 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.473 -6.798 -1.388 1.00 0.00 H new ATOM 0 HD23 LEU A 32 3.005 -5.961 -1.733 1.00 0.00 H new ATOM 449 N GLU A 33 5.908 -9.439 -2.592 1.00 0.00 N ATOM 450 CA GLU A 33 6.519 -10.732 -2.307 1.00 0.00 C ATOM 451 C GLU A 33 5.669 -11.532 -1.324 1.00 0.00 C ATOM 452 O GLU A 33 5.132 -10.982 -0.362 1.00 0.00 O ATOM 453 CB GLU A 33 7.928 -10.541 -1.742 1.00 0.00 C ATOM 454 CG GLU A 33 9.010 -11.228 -2.559 1.00 0.00 C ATOM 455 CD GLU A 33 9.054 -12.726 -2.327 1.00 0.00 C ATOM 456 OE1 GLU A 33 9.733 -13.159 -1.372 1.00 0.00 O ATOM 457 OE2 GLU A 33 8.409 -13.465 -3.099 1.00 0.00 O ATOM 0 H GLU A 33 6.488 -8.635 -2.352 1.00 0.00 H new ATOM 0 HA GLU A 33 6.582 -11.289 -3.242 1.00 0.00 H new ATOM 0 HB2 GLU A 33 8.147 -9.475 -1.688 1.00 0.00 H new ATOM 0 HB3 GLU A 33 7.956 -10.924 -0.722 1.00 0.00 H new ATOM 0 HG2 GLU A 33 8.839 -11.033 -3.618 1.00 0.00 H new ATOM 0 HG3 GLU A 33 9.979 -10.797 -2.308 1.00 0.00 H new ATOM 464 N ASP A 34 5.552 -12.831 -1.573 1.00 0.00 N ATOM 465 CA ASP A 34 4.768 -13.707 -0.711 1.00 0.00 C ATOM 466 C ASP A 34 5.450 -13.892 0.641 1.00 0.00 C ATOM 467 O ASP A 34 6.513 -14.504 0.733 1.00 0.00 O ATOM 468 CB ASP A 34 4.561 -15.067 -1.381 1.00 0.00 C ATOM 469 CG ASP A 34 4.143 -16.140 -0.396 1.00 0.00 C ATOM 470 OD1 ASP A 34 5.033 -16.724 0.258 1.00 0.00 O ATOM 471 OD2 ASP A 34 2.927 -16.398 -0.279 1.00 0.00 O ATOM 0 H ASP A 34 5.990 -13.301 -2.365 1.00 0.00 H new ATOM 0 HA ASP A 34 3.797 -13.239 -0.548 1.00 0.00 H new ATOM 0 HB2 ASP A 34 3.801 -14.974 -2.157 1.00 0.00 H new ATOM 0 HB3 ASP A 34 5.485 -15.370 -1.874 1.00 0.00 H new ATOM 476 N GLY A 35 4.832 -13.355 1.689 1.00 0.00 N ATOM 477 CA GLY A 35 5.394 -13.470 3.022 1.00 0.00 C ATOM 478 C GLY A 35 6.235 -12.268 3.401 1.00 0.00 C ATOM 479 O GLY A 35 7.018 -12.324 4.351 1.00 0.00 O ATOM 0 H GLY A 35 3.952 -12.842 1.638 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.587 -13.587 3.745 1.00 0.00 H new ATOM 0 HA3 GLY A 35 6.006 -14.370 3.079 1.00 0.00 H new ATOM 483 N CYS A 36 6.076 -11.178 2.659 1.00 0.00 N ATOM 484 CA CYS A 36 6.829 -9.957 2.921 1.00 0.00 C ATOM 485 C CYS A 36 5.890 -8.774 3.134 1.00 0.00 C ATOM 486 O CYS A 36 5.154 -8.383 2.228 1.00 0.00 O ATOM 487 CB CYS A 36 7.784 -9.663 1.764 1.00 0.00 C ATOM 488 SG CYS A 36 9.273 -10.689 1.757 1.00 0.00 S ATOM 0 H CYS A 36 5.432 -11.115 1.871 1.00 0.00 H new ATOM 0 HA CYS A 36 7.409 -10.106 3.832 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.253 -9.806 0.823 1.00 0.00 H new ATOM 0 HB3 CYS A 36 8.078 -8.614 1.807 1.00 0.00 H new ATOM 0 HG CYS A 36 10.017 -10.368 0.740 1.00 0.00 H new ATOM 494 N GLU A 37 5.919 -8.211 4.338 1.00 0.00 N ATOM 495 CA GLU A 37 5.068 -7.074 4.670 1.00 0.00 C ATOM 496 C GLU A 37 5.379 -5.881 3.772 1.00 0.00 C ATOM 497 O GLU A 37 6.537 -5.488 3.620 1.00 0.00 O ATOM 498 CB GLU A 37 5.251 -6.683 6.138 1.00 0.00 C ATOM 499 CG GLU A 37 3.958 -6.275 6.825 1.00 0.00 C ATOM 500 CD GLU A 37 4.192 -5.367 8.016 1.00 0.00 C ATOM 501 OE1 GLU A 37 5.191 -4.617 8.002 1.00 0.00 O ATOM 502 OE2 GLU A 37 3.377 -5.405 8.961 1.00 0.00 O ATOM 0 H GLU A 37 6.522 -8.523 5.099 1.00 0.00 H new ATOM 0 HA GLU A 37 4.031 -7.369 4.507 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.690 -7.523 6.677 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.961 -5.859 6.200 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.314 -5.767 6.107 1.00 0.00 H new ATOM 0 HG3 GLU A 37 3.427 -7.169 7.153 1.00 0.00 H new ATOM 509 N VAL A 38 4.338 -5.307 3.177 1.00 0.00 N ATOM 510 CA VAL A 38 4.499 -4.158 2.294 1.00 0.00 C ATOM 511 C VAL A 38 3.791 -2.930 2.855 1.00 0.00 C ATOM 512 O VAL A 38 2.583 -2.763 2.682 1.00 0.00 O ATOM 513 CB VAL A 38 3.953 -4.453 0.884 1.00 0.00 C ATOM 514 CG1 VAL A 38 4.103 -3.233 -0.012 1.00 0.00 C ATOM 515 CG2 VAL A 38 4.658 -5.658 0.281 1.00 0.00 C ATOM 0 H VAL A 38 3.374 -5.619 3.291 1.00 0.00 H new ATOM 0 HA VAL A 38 5.568 -3.958 2.227 1.00 0.00 H new ATOM 0 HB VAL A 38 2.891 -4.686 0.965 1.00 0.00 H new ATOM 0 HG11 VAL A 38 3.712 -3.460 -1.004 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.548 -2.398 0.415 1.00 0.00 H new ATOM 0 HG13 VAL A 38 5.157 -2.966 -0.090 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.260 -5.852 -0.715 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.727 -5.457 0.211 1.00 0.00 H new ATOM 0 HG23 VAL A 38 4.493 -6.530 0.914 1.00 0.00 H new ATOM 525 N THR A 39 4.550 -2.072 3.529 1.00 0.00 N ATOM 526 CA THR A 39 3.996 -0.859 4.117 1.00 0.00 C ATOM 527 C THR A 39 4.209 0.342 3.202 1.00 0.00 C ATOM 528 O THR A 39 5.319 0.586 2.730 1.00 0.00 O ATOM 529 CB THR A 39 4.626 -0.562 5.490 1.00 0.00 C ATOM 530 OG1 THR A 39 6.041 -0.392 5.354 1.00 0.00 O ATOM 531 CG2 THR A 39 4.338 -1.688 6.473 1.00 0.00 C ATOM 0 H THR A 39 5.551 -2.195 3.681 1.00 0.00 H new ATOM 0 HA THR A 39 2.927 -1.030 4.246 1.00 0.00 H new ATOM 0 HB THR A 39 4.185 0.358 5.875 1.00 0.00 H new ATOM 0 HG1 THR A 39 6.485 -0.674 6.181 1.00 0.00 H new ATOM 0 HG21 THR A 39 4.793 -1.456 7.436 1.00 0.00 H new ATOM 0 HG22 THR A 39 3.260 -1.796 6.597 1.00 0.00 H new ATOM 0 HG23 THR A 39 4.754 -2.620 6.091 1.00 0.00 H new ATOM 539 N VAL A 40 3.138 1.090 2.956 1.00 0.00 N ATOM 540 CA VAL A 40 3.208 2.267 2.099 1.00 0.00 C ATOM 541 C VAL A 40 3.015 3.546 2.906 1.00 0.00 C ATOM 542 O VAL A 40 2.227 3.584 3.850 1.00 0.00 O ATOM 543 CB VAL A 40 2.149 2.213 0.982 1.00 0.00 C ATOM 544 CG1 VAL A 40 2.359 3.348 -0.008 1.00 0.00 C ATOM 545 CG2 VAL A 40 2.188 0.865 0.278 1.00 0.00 C ATOM 0 H VAL A 40 2.211 0.901 3.338 1.00 0.00 H new ATOM 0 HA VAL A 40 4.200 2.271 1.648 1.00 0.00 H new ATOM 0 HB VAL A 40 1.164 2.334 1.432 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.602 3.294 -0.790 1.00 0.00 H new ATOM 0 HG12 VAL A 40 2.277 4.303 0.511 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.349 3.262 -0.455 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.434 0.843 -0.508 1.00 0.00 H new ATOM 0 HG22 VAL A 40 3.174 0.712 -0.161 1.00 0.00 H new ATOM 0 HG23 VAL A 40 1.984 0.072 0.998 1.00 0.00 H new ATOM 555 N GLY A 41 3.740 4.594 2.527 1.00 0.00 N ATOM 556 CA GLY A 41 3.634 5.862 3.225 1.00 0.00 C ATOM 557 C GLY A 41 4.736 6.829 2.842 1.00 0.00 C ATOM 558 O GLY A 41 5.480 6.588 1.892 1.00 0.00 O ATOM 0 H GLY A 41 4.399 4.587 1.749 1.00 0.00 H new ATOM 0 HA2 GLY A 41 2.666 6.314 3.006 1.00 0.00 H new ATOM 0 HA3 GLY A 41 3.668 5.685 4.300 1.00 0.00 H new ATOM 562 N ARG A 42 4.840 7.929 3.582 1.00 0.00 N ATOM 563 CA ARG A 42 5.857 8.937 3.313 1.00 0.00 C ATOM 564 C ARG A 42 6.976 8.871 4.348 1.00 0.00 C ATOM 565 O ARG A 42 7.650 9.865 4.614 1.00 0.00 O ATOM 566 CB ARG A 42 5.233 10.334 3.310 1.00 0.00 C ATOM 567 CG ARG A 42 4.695 10.763 4.665 1.00 0.00 C ATOM 568 CD ARG A 42 4.461 12.265 4.721 1.00 0.00 C ATOM 569 NE ARG A 42 4.308 12.744 6.092 1.00 0.00 N ATOM 570 CZ ARG A 42 4.361 14.027 6.432 1.00 0.00 C ATOM 571 NH1 ARG A 42 4.562 14.954 5.506 1.00 0.00 N ATOM 572 NH2 ARG A 42 4.212 14.385 7.701 1.00 0.00 N ATOM 0 H ARG A 42 4.232 8.144 4.372 1.00 0.00 H new ATOM 0 HA ARG A 42 6.282 8.734 2.330 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.980 11.056 2.980 1.00 0.00 H new ATOM 0 HB3 ARG A 42 4.422 10.359 2.582 1.00 0.00 H new ATOM 0 HG2 ARG A 42 3.761 10.240 4.869 1.00 0.00 H new ATOM 0 HG3 ARG A 42 5.399 10.474 5.445 1.00 0.00 H new ATOM 0 HD2 ARG A 42 5.297 12.780 4.248 1.00 0.00 H new ATOM 0 HD3 ARG A 42 3.568 12.514 4.148 1.00 0.00 H new ATOM 0 HE ARG A 42 4.152 12.056 6.829 1.00 0.00 H new ATOM 0 HH11 ARG A 42 4.676 14.683 4.529 1.00 0.00 H new ATOM 0 HH12 ARG A 42 4.602 15.938 5.770 1.00 0.00 H new ATOM 0 HH21 ARG A 42 4.057 13.675 8.416 1.00 0.00 H new ATOM 0 HH22 ARG A 42 4.253 15.370 7.961 1.00 0.00 H new ATOM 586 N GLY A 43 7.168 7.691 4.930 1.00 0.00 N ATOM 587 CA GLY A 43 8.206 7.516 5.929 1.00 0.00 C ATOM 588 C GLY A 43 9.426 6.804 5.381 1.00 0.00 C ATOM 589 O GLY A 43 9.411 6.312 4.252 1.00 0.00 O ATOM 0 H GLY A 43 6.623 6.853 4.727 1.00 0.00 H new ATOM 0 HA2 GLY A 43 8.502 8.491 6.315 1.00 0.00 H new ATOM 0 HA3 GLY A 43 7.805 6.949 6.769 1.00 0.00 H new ATOM 593 N PHE A 44 10.486 6.749 6.179 1.00 0.00 N ATOM 594 CA PHE A 44 11.722 6.094 5.766 1.00 0.00 C ATOM 595 C PHE A 44 11.725 4.627 6.184 1.00 0.00 C ATOM 596 O PHE A 44 12.375 3.792 5.555 1.00 0.00 O ATOM 597 CB PHE A 44 12.931 6.811 6.370 1.00 0.00 C ATOM 598 CG PHE A 44 12.949 6.795 7.872 1.00 0.00 C ATOM 599 CD1 PHE A 44 13.480 5.716 8.560 1.00 0.00 C ATOM 600 CD2 PHE A 44 12.434 7.859 8.596 1.00 0.00 C ATOM 601 CE1 PHE A 44 13.498 5.698 9.942 1.00 0.00 C ATOM 602 CE2 PHE A 44 12.450 7.847 9.978 1.00 0.00 C ATOM 603 CZ PHE A 44 12.981 6.765 10.652 1.00 0.00 C ATOM 0 H PHE A 44 10.515 7.150 7.116 1.00 0.00 H new ATOM 0 HA PHE A 44 11.785 6.144 4.679 1.00 0.00 H new ATOM 0 HB2 PHE A 44 13.843 6.344 5.999 1.00 0.00 H new ATOM 0 HB3 PHE A 44 12.939 7.845 6.026 1.00 0.00 H new ATOM 0 HD1 PHE A 44 13.885 4.879 8.010 1.00 0.00 H new ATOM 0 HD2 PHE A 44 12.016 8.707 8.074 1.00 0.00 H new ATOM 0 HE1 PHE A 44 13.916 4.851 10.466 1.00 0.00 H new ATOM 0 HE2 PHE A 44 12.048 8.683 10.530 1.00 0.00 H new ATOM 0 HZ PHE A 44 12.992 6.753 11.732 1.00 0.00 H new ATOM 613 N GLY A 45 10.995 4.320 7.252 1.00 0.00 N ATOM 614 CA GLY A 45 10.927 2.954 7.737 1.00 0.00 C ATOM 615 C GLY A 45 10.099 2.059 6.836 1.00 0.00 C ATOM 616 O GLY A 45 10.403 0.877 6.673 1.00 0.00 O ATOM 0 H GLY A 45 10.449 4.993 7.790 1.00 0.00 H new ATOM 0 HA2 GLY A 45 11.936 2.550 7.817 1.00 0.00 H new ATOM 0 HA3 GLY A 45 10.501 2.949 8.740 1.00 0.00 H new ATOM 620 N VAL A 46 9.047 2.622 6.251 1.00 0.00 N ATOM 621 CA VAL A 46 8.171 1.867 5.362 1.00 0.00 C ATOM 622 C VAL A 46 8.952 1.274 4.195 1.00 0.00 C ATOM 623 O VAL A 46 10.026 1.760 3.841 1.00 0.00 O ATOM 624 CB VAL A 46 7.035 2.749 4.811 1.00 0.00 C ATOM 625 CG1 VAL A 46 6.041 3.090 5.911 1.00 0.00 C ATOM 626 CG2 VAL A 46 7.601 4.014 4.182 1.00 0.00 C ATOM 0 H VAL A 46 8.780 3.598 6.376 1.00 0.00 H new ATOM 0 HA VAL A 46 7.739 1.060 5.954 1.00 0.00 H new ATOM 0 HB VAL A 46 6.507 2.190 4.038 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.246 3.714 5.502 1.00 0.00 H new ATOM 0 HG12 VAL A 46 5.612 2.171 6.311 1.00 0.00 H new ATOM 0 HG13 VAL A 46 6.552 3.630 6.708 1.00 0.00 H new ATOM 0 HG21 VAL A 46 6.785 4.626 3.798 1.00 0.00 H new ATOM 0 HG22 VAL A 46 8.154 4.578 4.933 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.270 3.746 3.364 1.00 0.00 H new ATOM 636 N THR A 47 8.404 0.220 3.598 1.00 0.00 N ATOM 637 CA THR A 47 9.049 -0.441 2.471 1.00 0.00 C ATOM 638 C THR A 47 9.021 0.441 1.228 1.00 0.00 C ATOM 639 O THR A 47 9.993 0.499 0.474 1.00 0.00 O ATOM 640 CB THR A 47 8.373 -1.786 2.146 1.00 0.00 C ATOM 641 OG1 THR A 47 8.434 -2.652 3.285 1.00 0.00 O ATOM 642 CG2 THR A 47 9.044 -2.456 0.957 1.00 0.00 C ATOM 0 H THR A 47 7.514 -0.194 3.877 1.00 0.00 H new ATOM 0 HA THR A 47 10.084 -0.624 2.762 1.00 0.00 H new ATOM 0 HB THR A 47 7.331 -1.592 1.892 1.00 0.00 H new ATOM 0 HG1 THR A 47 8.001 -3.505 3.071 1.00 0.00 H new ATOM 0 HG21 THR A 47 8.549 -3.404 0.747 1.00 0.00 H new ATOM 0 HG22 THR A 47 8.971 -1.807 0.084 1.00 0.00 H new ATOM 0 HG23 THR A 47 10.094 -2.638 1.187 1.00 0.00 H new ATOM 650 N TYR A 48 7.903 1.128 1.020 1.00 0.00 N ATOM 651 CA TYR A 48 7.748 2.006 -0.133 1.00 0.00 C ATOM 652 C TYR A 48 7.458 3.438 0.307 1.00 0.00 C ATOM 653 O TYR A 48 6.371 3.739 0.798 1.00 0.00 O ATOM 654 CB TYR A 48 6.623 1.501 -1.038 1.00 0.00 C ATOM 655 CG TYR A 48 6.943 0.197 -1.732 1.00 0.00 C ATOM 656 CD1 TYR A 48 7.872 0.146 -2.765 1.00 0.00 C ATOM 657 CD2 TYR A 48 6.318 -0.985 -1.355 1.00 0.00 C ATOM 658 CE1 TYR A 48 8.167 -1.044 -3.402 1.00 0.00 C ATOM 659 CE2 TYR A 48 6.608 -2.180 -1.985 1.00 0.00 C ATOM 660 CZ TYR A 48 7.532 -2.204 -3.008 1.00 0.00 C ATOM 661 OH TYR A 48 7.824 -3.391 -3.640 1.00 0.00 O ATOM 0 H TYR A 48 7.090 1.093 1.636 1.00 0.00 H new ATOM 0 HA TYR A 48 8.685 1.999 -0.691 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.719 1.374 -0.443 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.405 2.259 -1.790 1.00 0.00 H new ATOM 0 HD1 TYR A 48 8.372 1.052 -3.075 1.00 0.00 H new ATOM 0 HD2 TYR A 48 5.592 -0.970 -0.555 1.00 0.00 H new ATOM 0 HE1 TYR A 48 8.890 -1.066 -4.204 1.00 0.00 H new ATOM 0 HE2 TYR A 48 6.114 -3.090 -1.678 1.00 0.00 H new ATOM 0 HH TYR A 48 7.098 -4.031 -3.485 1.00 0.00 H new ATOM 671 N GLN A 49 8.440 4.316 0.127 1.00 0.00 N ATOM 672 CA GLN A 49 8.291 5.716 0.506 1.00 0.00 C ATOM 673 C GLN A 49 7.783 6.546 -0.668 1.00 0.00 C ATOM 674 O GLN A 49 8.286 6.433 -1.786 1.00 0.00 O ATOM 675 CB GLN A 49 9.624 6.276 1.003 1.00 0.00 C ATOM 676 CG GLN A 49 9.505 7.648 1.648 1.00 0.00 C ATOM 677 CD GLN A 49 10.795 8.096 2.308 1.00 0.00 C ATOM 678 OE1 GLN A 49 11.827 7.435 2.192 1.00 0.00 O ATOM 679 NE2 GLN A 49 10.742 9.225 3.004 1.00 0.00 N ATOM 0 H GLN A 49 9.346 4.083 -0.279 1.00 0.00 H new ATOM 0 HA GLN A 49 7.559 5.773 1.311 1.00 0.00 H new ATOM 0 HB2 GLN A 49 10.054 5.581 1.724 1.00 0.00 H new ATOM 0 HB3 GLN A 49 10.318 6.337 0.165 1.00 0.00 H new ATOM 0 HG2 GLN A 49 9.216 8.377 0.891 1.00 0.00 H new ATOM 0 HG3 GLN A 49 8.709 7.628 2.392 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.865 9.741 3.073 1.00 0.00 H new ATOM 0 HE22 GLN A 49 11.579 9.577 3.469 1.00 0.00 H new ATOM 688 N LEU A 50 6.782 7.380 -0.407 1.00 0.00 N ATOM 689 CA LEU A 50 6.205 8.230 -1.442 1.00 0.00 C ATOM 690 C LEU A 50 6.101 9.675 -0.965 1.00 0.00 C ATOM 691 O LEU A 50 5.632 9.943 0.142 1.00 0.00 O ATOM 692 CB LEU A 50 4.822 7.713 -1.843 1.00 0.00 C ATOM 693 CG LEU A 50 4.727 6.216 -2.142 1.00 0.00 C ATOM 694 CD1 LEU A 50 3.302 5.722 -1.943 1.00 0.00 C ATOM 695 CD2 LEU A 50 5.201 5.925 -3.559 1.00 0.00 C ATOM 0 H LEU A 50 6.353 7.485 0.513 1.00 0.00 H new ATOM 0 HA LEU A 50 6.863 8.200 -2.310 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.122 7.949 -1.042 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.493 8.261 -2.726 1.00 0.00 H new ATOM 0 HG LEU A 50 5.375 5.683 -1.446 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.253 4.655 -2.160 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.997 5.897 -0.911 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.633 6.260 -2.615 1.00 0.00 H new ATOM 0 HD21 LEU A 50 5.127 4.855 -3.755 1.00 0.00 H new ATOM 0 HD22 LEU A 50 4.578 6.468 -4.270 1.00 0.00 H new ATOM 0 HD23 LEU A 50 6.238 6.243 -3.668 1.00 0.00 H new ATOM 707 N VAL A 51 6.539 10.605 -1.808 1.00 0.00 N ATOM 708 CA VAL A 51 6.492 12.023 -1.474 1.00 0.00 C ATOM 709 C VAL A 51 5.799 12.823 -2.571 1.00 0.00 C ATOM 710 O VAL A 51 5.964 12.541 -3.758 1.00 0.00 O ATOM 711 CB VAL A 51 7.906 12.594 -1.252 1.00 0.00 C ATOM 712 CG1 VAL A 51 7.838 14.084 -0.952 1.00 0.00 C ATOM 713 CG2 VAL A 51 8.612 11.847 -0.131 1.00 0.00 C ATOM 0 H VAL A 51 6.931 10.401 -2.728 1.00 0.00 H new ATOM 0 HA VAL A 51 5.923 12.112 -0.549 1.00 0.00 H new ATOM 0 HB VAL A 51 8.483 12.458 -2.167 1.00 0.00 H new ATOM 0 HG11 VAL A 51 8.845 14.470 -0.798 1.00 0.00 H new ATOM 0 HG12 VAL A 51 7.374 14.603 -1.791 1.00 0.00 H new ATOM 0 HG13 VAL A 51 7.245 14.247 -0.052 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.609 12.263 0.012 1.00 0.00 H new ATOM 0 HG22 VAL A 51 8.040 11.950 0.791 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.693 10.792 -0.392 1.00 0.00 H new ATOM 723 N SER A 52 5.024 13.824 -2.166 1.00 0.00 N ATOM 724 CA SER A 52 4.303 14.665 -3.115 1.00 0.00 C ATOM 725 C SER A 52 4.760 16.117 -3.011 1.00 0.00 C ATOM 726 O SER A 52 4.650 16.741 -1.956 1.00 0.00 O ATOM 727 CB SER A 52 2.796 14.573 -2.866 1.00 0.00 C ATOM 728 OG SER A 52 2.203 13.582 -3.686 1.00 0.00 O ATOM 0 H SER A 52 4.879 14.073 -1.187 1.00 0.00 H new ATOM 0 HA SER A 52 4.521 14.306 -4.121 1.00 0.00 H new ATOM 0 HB2 SER A 52 2.611 14.340 -1.817 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.332 15.539 -3.064 1.00 0.00 H new ATOM 0 HG SER A 52 1.240 13.542 -3.507 1.00 0.00 H new ATOM 734 N LYS A 53 5.274 16.648 -4.115 1.00 0.00 N ATOM 735 CA LYS A 53 5.747 18.027 -4.152 1.00 0.00 C ATOM 736 C LYS A 53 4.594 19.004 -3.948 1.00 0.00 C ATOM 737 O LYS A 53 4.799 20.140 -3.519 1.00 0.00 O ATOM 738 CB LYS A 53 6.443 18.313 -5.485 1.00 0.00 C ATOM 739 CG LYS A 53 7.497 17.284 -5.854 1.00 0.00 C ATOM 740 CD LYS A 53 8.500 17.084 -4.730 1.00 0.00 C ATOM 741 CE LYS A 53 9.222 18.379 -4.391 1.00 0.00 C ATOM 742 NZ LYS A 53 10.684 18.166 -4.202 1.00 0.00 N ATOM 0 H LYS A 53 5.374 16.144 -4.996 1.00 0.00 H new ATOM 0 HA LYS A 53 6.461 18.162 -3.340 1.00 0.00 H new ATOM 0 HB2 LYS A 53 5.693 18.352 -6.275 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.909 19.297 -5.438 1.00 0.00 H new ATOM 0 HG2 LYS A 53 7.014 16.334 -6.085 1.00 0.00 H new ATOM 0 HG3 LYS A 53 8.019 17.604 -6.756 1.00 0.00 H new ATOM 0 HD2 LYS A 53 7.986 16.710 -3.844 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.227 16.326 -5.020 1.00 0.00 H new ATOM 0 HE2 LYS A 53 9.061 19.104 -5.189 1.00 0.00 H new ATOM 0 HE3 LYS A 53 8.797 18.805 -3.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 11.140 19.072 -3.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 10.839 17.493 -3.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 11.095 17.784 -5.077 1.00 0.00 H new ATOM 756 N ILE A 54 3.382 18.555 -4.258 1.00 0.00 N ATOM 757 CA ILE A 54 2.197 19.389 -4.106 1.00 0.00 C ATOM 758 C ILE A 54 1.483 19.096 -2.791 1.00 0.00 C ATOM 759 O ILE A 54 1.289 19.989 -1.965 1.00 0.00 O ATOM 760 CB ILE A 54 1.210 19.183 -5.270 1.00 0.00 C ATOM 761 CG1 ILE A 54 1.892 19.489 -6.606 1.00 0.00 C ATOM 762 CG2 ILE A 54 -0.019 20.060 -5.084 1.00 0.00 C ATOM 763 CD1 ILE A 54 2.397 20.911 -6.715 1.00 0.00 C ATOM 0 H ILE A 54 3.196 17.618 -4.616 1.00 0.00 H new ATOM 0 HA ILE A 54 2.538 20.424 -4.109 1.00 0.00 H new ATOM 0 HB ILE A 54 0.891 18.141 -5.276 1.00 0.00 H new ATOM 0 HG12 ILE A 54 2.728 18.804 -6.743 1.00 0.00 H new ATOM 0 HG13 ILE A 54 1.188 19.299 -7.416 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.707 19.903 -5.915 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -0.514 19.799 -4.149 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.282 21.107 -5.055 1.00 0.00 H new ATOM 0 HD11 ILE A 54 2.868 21.056 -7.687 1.00 0.00 H new ATOM 0 HD12 ILE A 54 1.561 21.603 -6.610 1.00 0.00 H new ATOM 0 HD13 ILE A 54 3.126 21.100 -5.927 1.00 0.00 H new ATOM 775 N CYS A 55 1.095 17.839 -2.603 1.00 0.00 N ATOM 776 CA CYS A 55 0.403 17.426 -1.387 1.00 0.00 C ATOM 777 C CYS A 55 1.135 16.272 -0.710 1.00 0.00 C ATOM 778 O CYS A 55 0.705 15.120 -0.755 1.00 0.00 O ATOM 779 CB CYS A 55 -1.035 17.016 -1.708 1.00 0.00 C ATOM 780 SG CYS A 55 -2.197 17.272 -0.347 1.00 0.00 S ATOM 0 H CYS A 55 1.248 17.089 -3.277 1.00 0.00 H new ATOM 0 HA CYS A 55 0.387 18.274 -0.702 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -1.378 17.581 -2.575 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -1.047 15.963 -1.989 1.00 0.00 H new ATOM 0 HG CYS A 55 -3.321 17.727 -0.816 1.00 0.00 H new ATOM 786 N PRO A 56 2.270 16.587 -0.067 1.00 0.00 N ATOM 787 CA PRO A 56 3.087 15.590 0.631 1.00 0.00 C ATOM 788 C PRO A 56 2.406 15.060 1.889 1.00 0.00 C ATOM 789 O PRO A 56 2.794 14.023 2.428 1.00 0.00 O ATOM 790 CB PRO A 56 4.356 16.363 0.995 1.00 0.00 C ATOM 791 CG PRO A 56 3.926 17.788 1.059 1.00 0.00 C ATOM 792 CD PRO A 56 2.842 17.940 0.028 1.00 0.00 C ATOM 0 HA PRO A 56 3.270 14.710 0.015 1.00 0.00 H new ATOM 0 HB2 PRO A 56 4.763 16.029 1.949 1.00 0.00 H new ATOM 0 HB3 PRO A 56 5.136 16.218 0.248 1.00 0.00 H new ATOM 0 HG2 PRO A 56 3.557 18.040 2.053 1.00 0.00 H new ATOM 0 HG3 PRO A 56 4.760 18.457 0.850 1.00 0.00 H new ATOM 0 HD2 PRO A 56 2.095 18.672 0.335 1.00 0.00 H new ATOM 0 HD3 PRO A 56 3.242 18.275 -0.929 1.00 0.00 H new ATOM 800 N LEU A 57 1.389 15.778 2.352 1.00 0.00 N ATOM 801 CA LEU A 57 0.653 15.380 3.547 1.00 0.00 C ATOM 802 C LEU A 57 -0.425 14.356 3.206 1.00 0.00 C ATOM 803 O LEU A 57 -0.882 13.611 4.073 1.00 0.00 O ATOM 804 CB LEU A 57 0.018 16.604 4.210 1.00 0.00 C ATOM 805 CG LEU A 57 0.933 17.815 4.400 1.00 0.00 C ATOM 806 CD1 LEU A 57 0.114 19.061 4.696 1.00 0.00 C ATOM 807 CD2 LEU A 57 1.936 17.556 5.514 1.00 0.00 C ATOM 0 H LEU A 57 1.055 16.639 1.918 1.00 0.00 H new ATOM 0 HA LEU A 57 1.357 14.922 4.242 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.840 16.912 3.612 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.364 16.306 5.186 1.00 0.00 H new ATOM 0 HG LEU A 57 1.484 17.979 3.474 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.782 19.912 4.828 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.564 19.257 3.865 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -0.464 18.908 5.607 1.00 0.00 H new ATOM 0 HD21 LEU A 57 2.579 18.428 5.635 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.404 17.365 6.446 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.546 16.689 5.260 1.00 0.00 H new ATOM 819 N MET A 58 -0.825 14.324 1.939 1.00 0.00 N ATOM 820 CA MET A 58 -1.846 13.388 1.484 1.00 0.00 C ATOM 821 C MET A 58 -1.503 11.962 1.903 1.00 0.00 C ATOM 822 O MET A 58 -2.389 11.166 2.214 1.00 0.00 O ATOM 823 CB MET A 58 -1.996 13.463 -0.036 1.00 0.00 C ATOM 824 CG MET A 58 -3.339 12.960 -0.540 1.00 0.00 C ATOM 825 SD MET A 58 -3.806 13.691 -2.121 1.00 0.00 S ATOM 826 CE MET A 58 -4.720 15.130 -1.573 1.00 0.00 C ATOM 0 H MET A 58 -0.458 14.935 1.210 1.00 0.00 H new ATOM 0 HA MET A 58 -2.791 13.667 1.949 1.00 0.00 H new ATOM 0 HB2 MET A 58 -1.861 14.496 -0.356 1.00 0.00 H new ATOM 0 HB3 MET A 58 -1.201 12.879 -0.501 1.00 0.00 H new ATOM 0 HG2 MET A 58 -3.301 11.876 -0.643 1.00 0.00 H new ATOM 0 HG3 MET A 58 -4.107 13.183 0.200 1.00 0.00 H new ATOM 0 HE1 MET A 58 -5.725 15.104 -1.993 1.00 0.00 H new ATOM 0 HE2 MET A 58 -4.781 15.129 -0.485 1.00 0.00 H new ATOM 0 HE3 MET A 58 -4.210 16.034 -1.907 1.00 0.00 H new ATOM 836 N ILE A 59 -0.212 11.646 1.908 1.00 0.00 N ATOM 837 CA ILE A 59 0.247 10.317 2.290 1.00 0.00 C ATOM 838 C ILE A 59 0.839 10.322 3.695 1.00 0.00 C ATOM 839 O ILE A 59 1.733 11.111 4.000 1.00 0.00 O ATOM 840 CB ILE A 59 1.301 9.780 1.303 1.00 0.00 C ATOM 841 CG1 ILE A 59 0.793 9.903 -0.135 1.00 0.00 C ATOM 842 CG2 ILE A 59 1.643 8.334 1.628 1.00 0.00 C ATOM 843 CD1 ILE A 59 -0.513 9.179 -0.379 1.00 0.00 C ATOM 0 H ILE A 59 0.534 12.293 1.652 1.00 0.00 H new ATOM 0 HA ILE A 59 -0.625 9.664 2.268 1.00 0.00 H new ATOM 0 HB ILE A 59 2.207 10.378 1.401 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.665 10.958 -0.377 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.550 9.509 -0.814 1.00 0.00 H new ATOM 0 HG21 ILE A 59 2.389 7.969 0.922 1.00 0.00 H new ATOM 0 HG22 ILE A 59 2.042 8.273 2.641 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.744 7.722 1.555 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -0.813 9.309 -1.419 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -0.385 8.117 -0.169 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.283 9.588 0.275 1.00 0.00 H new ATOM 855 N SER A 60 0.336 9.434 4.547 1.00 0.00 N ATOM 856 CA SER A 60 0.814 9.337 5.921 1.00 0.00 C ATOM 857 C SER A 60 1.952 8.327 6.030 1.00 0.00 C ATOM 858 O SER A 60 2.209 7.561 5.101 1.00 0.00 O ATOM 859 CB SER A 60 -0.330 8.935 6.854 1.00 0.00 C ATOM 860 OG SER A 60 -0.148 9.481 8.149 1.00 0.00 O ATOM 0 H SER A 60 -0.402 8.772 4.310 1.00 0.00 H new ATOM 0 HA SER A 60 1.190 10.316 6.219 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.278 9.279 6.441 1.00 0.00 H new ATOM 0 HB3 SER A 60 -0.386 7.848 6.919 1.00 0.00 H new ATOM 0 HG SER A 60 -0.893 9.211 8.726 1.00 0.00 H new ATOM 866 N ARG A 61 2.632 8.333 7.172 1.00 0.00 N ATOM 867 CA ARG A 61 3.744 7.419 7.404 1.00 0.00 C ATOM 868 C ARG A 61 3.330 5.977 7.125 1.00 0.00 C ATOM 869 O ARG A 61 4.075 5.214 6.511 1.00 0.00 O ATOM 870 CB ARG A 61 4.247 7.548 8.843 1.00 0.00 C ATOM 871 CG ARG A 61 4.837 8.911 9.162 1.00 0.00 C ATOM 872 CD ARG A 61 5.463 8.937 10.548 1.00 0.00 C ATOM 873 NE ARG A 61 6.027 10.245 10.870 1.00 0.00 N ATOM 874 CZ ARG A 61 6.484 10.572 12.073 1.00 0.00 C ATOM 875 NH1 ARG A 61 6.443 9.692 13.064 1.00 0.00 N ATOM 876 NH2 ARG A 61 6.983 11.783 12.288 1.00 0.00 N ATOM 0 H ARG A 61 2.432 8.961 7.951 1.00 0.00 H new ATOM 0 HA ARG A 61 4.550 7.686 6.720 1.00 0.00 H new ATOM 0 HB2 ARG A 61 3.421 7.350 9.527 1.00 0.00 H new ATOM 0 HB3 ARG A 61 5.002 6.783 9.025 1.00 0.00 H new ATOM 0 HG2 ARG A 61 5.590 9.166 8.417 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.057 9.670 9.100 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.710 8.674 11.291 1.00 0.00 H new ATOM 0 HD3 ARG A 61 6.246 8.181 10.606 1.00 0.00 H new ATOM 0 HE ARG A 61 6.072 10.946 10.130 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.060 8.761 12.903 1.00 0.00 H new ATOM 0 HH12 ARG A 61 6.795 9.946 13.987 1.00 0.00 H new ATOM 0 HH21 ARG A 61 7.016 12.463 11.529 1.00 0.00 H new ATOM 0 HH22 ARG A 61 7.334 12.033 13.212 1.00 0.00 H new ATOM 890 N ASN A 62 2.137 5.611 7.582 1.00 0.00 N ATOM 891 CA ASN A 62 1.624 4.260 7.384 1.00 0.00 C ATOM 892 C ASN A 62 0.232 4.293 6.761 1.00 0.00 C ATOM 893 O ASN A 62 -0.754 3.918 7.398 1.00 0.00 O ATOM 894 CB ASN A 62 1.582 3.507 8.715 1.00 0.00 C ATOM 895 CG ASN A 62 2.967 3.253 9.279 1.00 0.00 C ATOM 896 OD1 ASN A 62 3.554 4.120 9.926 1.00 0.00 O ATOM 897 ND2 ASN A 62 3.495 2.059 9.036 1.00 0.00 N ATOM 0 H ASN A 62 1.507 6.231 8.092 1.00 0.00 H new ATOM 0 HA ASN A 62 2.296 3.740 6.702 1.00 0.00 H new ATOM 0 HB2 ASN A 62 0.999 4.080 9.436 1.00 0.00 H new ATOM 0 HB3 ASN A 62 1.069 2.555 8.575 1.00 0.00 H new ATOM 0 HD21 ASN A 62 4.424 1.830 9.391 1.00 0.00 H new ATOM 0 HD22 ASN A 62 2.972 1.371 8.495 1.00 0.00 H new ATOM 904 N HIS A 63 0.158 4.743 5.512 1.00 0.00 N ATOM 905 CA HIS A 63 -1.114 4.824 4.803 1.00 0.00 C ATOM 906 C HIS A 63 -1.817 3.470 4.793 1.00 0.00 C ATOM 907 O HIS A 63 -3.038 3.393 4.936 1.00 0.00 O ATOM 908 CB HIS A 63 -0.892 5.306 3.369 1.00 0.00 C ATOM 909 CG HIS A 63 -1.998 6.172 2.851 1.00 0.00 C ATOM 910 ND1 HIS A 63 -1.985 7.548 2.946 1.00 0.00 N ATOM 911 CD2 HIS A 63 -3.156 5.851 2.228 1.00 0.00 C ATOM 912 CE1 HIS A 63 -3.087 8.035 2.405 1.00 0.00 C ATOM 913 NE2 HIS A 63 -3.815 7.026 1.962 1.00 0.00 N ATOM 0 H HIS A 63 0.963 5.057 4.971 1.00 0.00 H new ATOM 0 HA HIS A 63 -1.749 5.540 5.326 1.00 0.00 H new ATOM 0 HB2 HIS A 63 0.045 5.861 3.322 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -0.783 4.440 2.716 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -3.498 4.856 1.985 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -3.348 9.081 2.336 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -4.720 7.106 1.498 1.00 0.00 H new ATOM 921 N CYS A 64 -1.041 2.406 4.623 1.00 0.00 N ATOM 922 CA CYS A 64 -1.590 1.055 4.594 1.00 0.00 C ATOM 923 C CYS A 64 -0.482 0.015 4.719 1.00 0.00 C ATOM 924 O CYS A 64 0.683 0.297 4.439 1.00 0.00 O ATOM 925 CB CYS A 64 -2.374 0.830 3.300 1.00 0.00 C ATOM 926 SG CYS A 64 -1.369 0.930 1.800 1.00 0.00 S ATOM 0 H CYS A 64 -0.029 2.452 4.503 1.00 0.00 H new ATOM 0 HA CYS A 64 -2.264 0.944 5.443 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -2.849 -0.150 3.341 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -3.173 1.569 3.239 1.00 0.00 H new ATOM 0 HG CYS A 64 -2.121 0.724 0.760 1.00 0.00 H new ATOM 932 N VAL A 65 -0.853 -1.189 5.143 1.00 0.00 N ATOM 933 CA VAL A 65 0.110 -2.272 5.306 1.00 0.00 C ATOM 934 C VAL A 65 -0.433 -3.579 4.739 1.00 0.00 C ATOM 935 O VAL A 65 -1.306 -4.212 5.334 1.00 0.00 O ATOM 936 CB VAL A 65 0.474 -2.481 6.788 1.00 0.00 C ATOM 937 CG1 VAL A 65 1.475 -3.616 6.938 1.00 0.00 C ATOM 938 CG2 VAL A 65 1.021 -1.194 7.388 1.00 0.00 C ATOM 0 H VAL A 65 -1.813 -1.439 5.380 1.00 0.00 H new ATOM 0 HA VAL A 65 1.006 -1.984 4.756 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.431 -2.753 7.331 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.720 -3.748 7.992 1.00 0.00 H new ATOM 0 HG12 VAL A 65 1.042 -4.537 6.548 1.00 0.00 H new ATOM 0 HG13 VAL A 65 2.382 -3.377 6.382 1.00 0.00 H new ATOM 0 HG21 VAL A 65 1.273 -1.359 8.435 1.00 0.00 H new ATOM 0 HG22 VAL A 65 1.915 -0.890 6.843 1.00 0.00 H new ATOM 0 HG23 VAL A 65 0.267 -0.410 7.316 1.00 0.00 H new ATOM 948 N LEU A 66 0.091 -3.979 3.585 1.00 0.00 N ATOM 949 CA LEU A 66 -0.340 -5.213 2.936 1.00 0.00 C ATOM 950 C LEU A 66 0.374 -6.421 3.535 1.00 0.00 C ATOM 951 O LEU A 66 1.555 -6.352 3.875 1.00 0.00 O ATOM 952 CB LEU A 66 -0.072 -5.141 1.432 1.00 0.00 C ATOM 953 CG LEU A 66 -1.039 -4.281 0.618 1.00 0.00 C ATOM 954 CD1 LEU A 66 -0.348 -3.017 0.131 1.00 0.00 C ATOM 955 CD2 LEU A 66 -1.598 -5.072 -0.555 1.00 0.00 C ATOM 0 H LEU A 66 0.814 -3.467 3.080 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.411 -5.328 3.103 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.938 -4.759 1.281 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -0.093 -6.154 1.031 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.869 -3.991 1.263 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.051 -2.417 -0.446 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.002 -2.441 0.987 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.501 -3.286 -0.498 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.284 -4.444 -1.123 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.780 -5.392 -1.201 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -2.131 -5.947 -0.183 1.00 0.00 H new ATOM 967 N LYS A 67 -0.351 -7.528 3.659 1.00 0.00 N ATOM 968 CA LYS A 67 0.212 -8.753 4.213 1.00 0.00 C ATOM 969 C LYS A 67 -0.739 -9.928 4.013 1.00 0.00 C ATOM 970 O LYS A 67 -1.955 -9.749 3.949 1.00 0.00 O ATOM 971 CB LYS A 67 0.512 -8.574 5.703 1.00 0.00 C ATOM 972 CG LYS A 67 -0.717 -8.255 6.536 1.00 0.00 C ATOM 973 CD LYS A 67 -0.510 -7.009 7.381 1.00 0.00 C ATOM 974 CE LYS A 67 -0.063 -7.361 8.792 1.00 0.00 C ATOM 975 NZ LYS A 67 -0.623 -6.421 9.802 1.00 0.00 N ATOM 0 H LYS A 67 -1.330 -7.601 3.383 1.00 0.00 H new ATOM 0 HA LYS A 67 1.141 -8.966 3.685 1.00 0.00 H new ATOM 0 HB2 LYS A 67 0.973 -9.485 6.084 1.00 0.00 H new ATOM 0 HB3 LYS A 67 1.241 -7.773 5.825 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -1.575 -8.112 5.880 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.948 -9.101 7.184 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.236 -6.369 6.911 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -1.438 -6.439 7.424 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -0.376 -8.378 9.029 1.00 0.00 H new ATOM 0 HE3 LYS A 67 1.026 -7.343 8.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -0.295 -6.695 10.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -0.304 -5.454 9.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -1.662 -6.457 9.771 1.00 0.00 H new ATOM 989 N GLN A 68 -0.178 -11.129 3.916 1.00 0.00 N ATOM 990 CA GLN A 68 -0.978 -12.333 3.725 1.00 0.00 C ATOM 991 C GLN A 68 -1.387 -12.934 5.065 1.00 0.00 C ATOM 992 O GLN A 68 -0.540 -13.348 5.855 1.00 0.00 O ATOM 993 CB GLN A 68 -0.198 -13.364 2.907 1.00 0.00 C ATOM 994 CG GLN A 68 0.168 -12.884 1.512 1.00 0.00 C ATOM 995 CD GLN A 68 0.971 -13.907 0.734 1.00 0.00 C ATOM 996 OE1 GLN A 68 2.106 -14.225 1.092 1.00 0.00 O ATOM 997 NE2 GLN A 68 0.386 -14.430 -0.337 1.00 0.00 N ATOM 0 H GLN A 68 0.827 -11.294 3.967 1.00 0.00 H new ATOM 0 HA GLN A 68 -1.881 -12.056 3.182 1.00 0.00 H new ATOM 0 HB2 GLN A 68 0.714 -13.626 3.443 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -0.792 -14.274 2.825 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -0.743 -12.649 0.962 1.00 0.00 H new ATOM 0 HG3 GLN A 68 0.741 -11.960 1.589 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -0.556 -14.138 -0.597 1.00 0.00 H new ATOM 0 HE22 GLN A 68 0.878 -15.124 -0.899 1.00 0.00 H new ATOM 1006 N ASN A 69 -2.692 -12.978 5.315 1.00 0.00 N ATOM 1007 CA ASN A 69 -3.214 -13.527 6.561 1.00 0.00 C ATOM 1008 C ASN A 69 -2.640 -14.916 6.825 1.00 0.00 C ATOM 1009 O ASN A 69 -2.138 -15.589 5.925 1.00 0.00 O ATOM 1010 CB ASN A 69 -4.741 -13.594 6.513 1.00 0.00 C ATOM 1011 CG ASN A 69 -5.252 -14.240 5.240 1.00 0.00 C ATOM 1012 OD1 ASN A 69 -4.714 -15.249 4.783 1.00 0.00 O ATOM 1013 ND2 ASN A 69 -6.296 -13.660 4.659 1.00 0.00 N ATOM 0 H ASN A 69 -3.407 -12.640 4.671 1.00 0.00 H new ATOM 0 HA ASN A 69 -2.912 -12.868 7.375 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -5.104 -14.156 7.373 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -5.149 -12.586 6.595 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -6.683 -14.050 3.800 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -6.711 -12.825 5.072 1.00 0.00 H new ATOM 1020 N PRO A 70 -2.717 -15.357 8.090 1.00 0.00 N ATOM 1021 CA PRO A 70 -2.212 -16.670 8.502 1.00 0.00 C ATOM 1022 C PRO A 70 -2.707 -17.792 7.596 1.00 0.00 C ATOM 1023 O PRO A 70 -2.055 -18.827 7.463 1.00 0.00 O ATOM 1024 CB PRO A 70 -2.773 -16.838 9.916 1.00 0.00 C ATOM 1025 CG PRO A 70 -2.955 -15.448 10.419 1.00 0.00 C ATOM 1026 CD PRO A 70 -3.302 -14.608 9.214 1.00 0.00 C ATOM 0 HA PRO A 70 -1.124 -16.723 8.451 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -3.718 -17.382 9.905 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -2.088 -17.402 10.549 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -3.748 -15.405 11.166 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -2.046 -15.085 10.898 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -4.380 -14.494 9.102 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -2.881 -13.605 9.290 1.00 0.00 H new ATOM 1034 N GLU A 71 -3.862 -17.579 6.974 1.00 0.00 N ATOM 1035 CA GLU A 71 -4.444 -18.574 6.080 1.00 0.00 C ATOM 1036 C GLU A 71 -3.586 -18.749 4.830 1.00 0.00 C ATOM 1037 O GLU A 71 -3.419 -19.861 4.330 1.00 0.00 O ATOM 1038 CB GLU A 71 -5.865 -18.168 5.684 1.00 0.00 C ATOM 1039 CG GLU A 71 -6.718 -17.716 6.858 1.00 0.00 C ATOM 1040 CD GLU A 71 -8.198 -17.947 6.625 1.00 0.00 C ATOM 1041 OE1 GLU A 71 -8.578 -19.096 6.315 1.00 0.00 O ATOM 1042 OE2 GLU A 71 -8.978 -16.979 6.753 1.00 0.00 O ATOM 0 H GLU A 71 -4.413 -16.727 7.072 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.481 -19.525 6.611 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.813 -17.362 4.952 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -6.352 -19.012 5.195 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -6.407 -18.251 7.756 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -6.544 -16.656 7.042 1.00 0.00 H new ATOM 1049 N GLY A 72 -3.045 -17.642 4.331 1.00 0.00 N ATOM 1050 CA GLY A 72 -2.212 -17.694 3.143 1.00 0.00 C ATOM 1051 C GLY A 72 -2.765 -16.854 2.010 1.00 0.00 C ATOM 1052 O GLY A 72 -2.410 -17.056 0.849 1.00 0.00 O ATOM 0 H GLY A 72 -3.168 -16.710 4.728 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.209 -17.348 3.391 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -2.120 -18.729 2.813 1.00 0.00 H new ATOM 1056 N GLN A 73 -3.639 -15.910 2.346 1.00 0.00 N ATOM 1057 CA GLN A 73 -4.244 -15.039 1.346 1.00 0.00 C ATOM 1058 C GLN A 73 -3.920 -13.576 1.632 1.00 0.00 C ATOM 1059 O GLN A 73 -3.963 -13.134 2.780 1.00 0.00 O ATOM 1060 CB GLN A 73 -5.760 -15.241 1.313 1.00 0.00 C ATOM 1061 CG GLN A 73 -6.492 -14.215 0.463 1.00 0.00 C ATOM 1062 CD GLN A 73 -6.002 -14.188 -0.971 1.00 0.00 C ATOM 1063 OE1 GLN A 73 -5.349 -15.124 -1.434 1.00 0.00 O ATOM 1064 NE2 GLN A 73 -6.315 -13.112 -1.684 1.00 0.00 N ATOM 0 H GLN A 73 -3.943 -15.729 3.303 1.00 0.00 H new ATOM 0 HA GLN A 73 -3.829 -15.301 0.373 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -5.977 -16.238 0.931 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -6.146 -15.199 2.331 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.560 -14.435 0.474 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -6.366 -13.227 0.905 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -6.858 -12.360 -1.260 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -6.012 -13.038 -2.655 1.00 0.00 H new ATOM 1073 N TRP A 74 -3.597 -12.831 0.581 1.00 0.00 N ATOM 1074 CA TRP A 74 -3.266 -11.417 0.720 1.00 0.00 C ATOM 1075 C TRP A 74 -4.423 -10.646 1.345 1.00 0.00 C ATOM 1076 O TRP A 74 -5.589 -10.913 1.054 1.00 0.00 O ATOM 1077 CB TRP A 74 -2.914 -10.819 -0.643 1.00 0.00 C ATOM 1078 CG TRP A 74 -1.480 -11.022 -1.029 1.00 0.00 C ATOM 1079 CD1 TRP A 74 -1.005 -11.840 -2.014 1.00 0.00 C ATOM 1080 CD2 TRP A 74 -0.336 -10.398 -0.436 1.00 0.00 C ATOM 1081 NE1 TRP A 74 0.366 -11.762 -2.069 1.00 0.00 N ATOM 1082 CE2 TRP A 74 0.800 -10.884 -1.112 1.00 0.00 C ATOM 1083 CE3 TRP A 74 -0.161 -9.475 0.599 1.00 0.00 C ATOM 1084 CZ2 TRP A 74 2.091 -10.477 -0.785 1.00 0.00 C ATOM 1085 CZ3 TRP A 74 1.120 -9.073 0.923 1.00 0.00 C ATOM 1086 CH2 TRP A 74 2.233 -9.573 0.233 1.00 0.00 C ATOM 0 H TRP A 74 -3.557 -13.182 -0.376 1.00 0.00 H new ATOM 0 HA TRP A 74 -2.402 -11.334 1.379 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.554 -11.266 -1.404 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -3.132 -9.751 -0.630 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -1.617 -12.457 -2.655 1.00 0.00 H new ATOM 0 HE1 TRP A 74 0.963 -12.275 -2.717 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -1.012 -9.083 1.136 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 2.950 -10.861 -1.316 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 1.267 -8.361 1.722 1.00 0.00 H new ATOM 0 HH2 TRP A 74 3.222 -9.238 0.510 1.00 0.00 H new ATOM 1097 N THR A 75 -4.093 -9.687 2.205 1.00 0.00 N ATOM 1098 CA THR A 75 -5.106 -8.877 2.871 1.00 0.00 C ATOM 1099 C THR A 75 -4.575 -7.483 3.187 1.00 0.00 C ATOM 1100 O THR A 75 -3.552 -7.335 3.857 1.00 0.00 O ATOM 1101 CB THR A 75 -5.584 -9.539 4.177 1.00 0.00 C ATOM 1102 OG1 THR A 75 -4.474 -10.130 4.863 1.00 0.00 O ATOM 1103 CG2 THR A 75 -6.634 -10.602 3.891 1.00 0.00 C ATOM 0 H THR A 75 -3.133 -9.452 2.456 1.00 0.00 H new ATOM 0 HA THR A 75 -5.948 -8.795 2.183 1.00 0.00 H new ATOM 0 HB THR A 75 -6.030 -8.769 4.806 1.00 0.00 H new ATOM 0 HG1 THR A 75 -3.637 -9.769 4.502 1.00 0.00 H new ATOM 0 HG21 THR A 75 -6.957 -11.056 4.828 1.00 0.00 H new ATOM 0 HG22 THR A 75 -7.490 -10.144 3.396 1.00 0.00 H new ATOM 0 HG23 THR A 75 -6.208 -11.369 3.244 1.00 0.00 H new ATOM 1111 N ILE A 76 -5.276 -6.465 2.701 1.00 0.00 N ATOM 1112 CA ILE A 76 -4.875 -5.082 2.933 1.00 0.00 C ATOM 1113 C ILE A 76 -5.458 -4.553 4.239 1.00 0.00 C ATOM 1114 O ILE A 76 -6.648 -4.711 4.508 1.00 0.00 O ATOM 1115 CB ILE A 76 -5.318 -4.166 1.777 1.00 0.00 C ATOM 1116 CG1 ILE A 76 -4.772 -2.751 1.981 1.00 0.00 C ATOM 1117 CG2 ILE A 76 -6.836 -4.143 1.672 1.00 0.00 C ATOM 1118 CD1 ILE A 76 -4.840 -1.892 0.738 1.00 0.00 C ATOM 0 H ILE A 76 -6.124 -6.571 2.144 1.00 0.00 H new ATOM 0 HA ILE A 76 -3.787 -5.075 2.994 1.00 0.00 H new ATOM 0 HB ILE A 76 -4.914 -4.561 0.845 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -5.333 -2.265 2.779 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -3.736 -2.815 2.313 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.134 -3.491 0.851 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -7.203 -5.152 1.486 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.260 -3.769 2.604 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -4.436 -0.903 0.956 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -4.255 -2.355 -0.057 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -5.877 -1.798 0.417 1.00 0.00 H new ATOM 1130 N MET A 77 -4.611 -3.923 5.046 1.00 0.00 N ATOM 1131 CA MET A 77 -5.043 -3.367 6.323 1.00 0.00 C ATOM 1132 C MET A 77 -4.470 -1.968 6.529 1.00 0.00 C ATOM 1133 O MET A 77 -3.258 -1.766 6.452 1.00 0.00 O ATOM 1134 CB MET A 77 -4.614 -4.281 7.472 1.00 0.00 C ATOM 1135 CG MET A 77 -5.047 -3.780 8.841 1.00 0.00 C ATOM 1136 SD MET A 77 -3.753 -3.951 10.085 1.00 0.00 S ATOM 1137 CE MET A 77 -2.775 -2.486 9.760 1.00 0.00 C ATOM 0 H MET A 77 -3.622 -3.785 4.839 1.00 0.00 H new ATOM 0 HA MET A 77 -6.131 -3.296 6.311 1.00 0.00 H new ATOM 0 HB2 MET A 77 -5.030 -5.275 7.310 1.00 0.00 H new ATOM 0 HB3 MET A 77 -3.529 -4.384 7.458 1.00 0.00 H new ATOM 0 HG2 MET A 77 -5.336 -2.732 8.765 1.00 0.00 H new ATOM 0 HG3 MET A 77 -5.930 -4.332 9.163 1.00 0.00 H new ATOM 0 HE1 MET A 77 -1.904 -2.477 10.416 1.00 0.00 H new ATOM 0 HE2 MET A 77 -2.447 -2.491 8.721 1.00 0.00 H new ATOM 0 HE3 MET A 77 -3.378 -1.597 9.946 1.00 0.00 H new ATOM 1147 N ASP A 78 -5.348 -1.007 6.790 1.00 0.00 N ATOM 1148 CA ASP A 78 -4.929 0.373 7.008 1.00 0.00 C ATOM 1149 C ASP A 78 -4.415 0.567 8.431 1.00 0.00 C ATOM 1150 O ASP A 78 -5.086 0.208 9.398 1.00 0.00 O ATOM 1151 CB ASP A 78 -6.091 1.330 6.737 1.00 0.00 C ATOM 1152 CG ASP A 78 -5.754 2.765 7.095 1.00 0.00 C ATOM 1153 OD1 ASP A 78 -4.555 3.112 7.089 1.00 0.00 O ATOM 1154 OD2 ASP A 78 -6.691 3.540 7.379 1.00 0.00 O ATOM 0 H ASP A 78 -6.355 -1.157 6.856 1.00 0.00 H new ATOM 0 HA ASP A 78 -4.117 0.594 6.315 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -6.364 1.276 5.683 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.962 1.011 7.309 1.00 0.00 H new ATOM 1159 N ASN A 79 -3.220 1.136 8.552 1.00 0.00 N ATOM 1160 CA ASN A 79 -2.615 1.376 9.857 1.00 0.00 C ATOM 1161 C ASN A 79 -3.103 2.695 10.448 1.00 0.00 C ATOM 1162 O ASN A 79 -2.304 3.566 10.794 1.00 0.00 O ATOM 1163 CB ASN A 79 -1.090 1.389 9.741 1.00 0.00 C ATOM 1164 CG ASN A 79 -0.410 0.891 11.002 1.00 0.00 C ATOM 1165 OD1 ASN A 79 -0.993 0.916 12.086 1.00 0.00 O ATOM 1166 ND2 ASN A 79 0.830 0.436 10.865 1.00 0.00 N ATOM 0 H ASN A 79 -2.651 1.440 7.762 1.00 0.00 H new ATOM 0 HA ASN A 79 -2.915 0.567 10.523 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -0.787 0.767 8.898 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -0.753 2.403 9.526 1.00 0.00 H new ATOM 0 HD21 ASN A 79 1.338 0.088 11.678 1.00 0.00 H new ATOM 0 HD22 ASN A 79 1.274 0.434 9.947 1.00 0.00 H new ATOM 1173 N LYS A 80 -4.419 2.835 10.562 1.00 0.00 N ATOM 1174 CA LYS A 80 -5.015 4.046 11.113 1.00 0.00 C ATOM 1175 C LYS A 80 -4.492 5.286 10.394 1.00 0.00 C ATOM 1176 O LYS A 80 -3.518 5.901 10.826 1.00 0.00 O ATOM 1177 CB LYS A 80 -4.718 4.150 12.611 1.00 0.00 C ATOM 1178 CG LYS A 80 -5.708 3.394 13.481 1.00 0.00 C ATOM 1179 CD LYS A 80 -5.003 2.613 14.577 1.00 0.00 C ATOM 1180 CE LYS A 80 -4.291 3.539 15.552 1.00 0.00 C ATOM 1181 NZ LYS A 80 -5.233 4.497 16.195 1.00 0.00 N ATOM 0 H LYS A 80 -5.094 2.124 10.280 1.00 0.00 H new ATOM 0 HA LYS A 80 -6.093 3.989 10.965 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.715 3.769 12.801 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.720 5.201 12.901 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -6.411 4.096 13.928 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -6.290 2.711 12.862 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -5.729 2.004 15.116 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -4.282 1.928 14.131 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -3.795 2.946 16.320 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -3.513 4.092 15.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -4.782 4.918 17.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -5.479 5.248 15.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -6.097 3.994 16.483 1.00 0.00 H new ATOM 1195 N SER A 81 -5.148 5.647 9.295 1.00 0.00 N ATOM 1196 CA SER A 81 -4.747 6.812 8.515 1.00 0.00 C ATOM 1197 C SER A 81 -5.700 7.980 8.754 1.00 0.00 C ATOM 1198 O SER A 81 -6.741 7.826 9.393 1.00 0.00 O ATOM 1199 CB SER A 81 -4.710 6.466 7.025 1.00 0.00 C ATOM 1200 OG SER A 81 -5.960 5.963 6.587 1.00 0.00 O ATOM 0 H SER A 81 -5.958 5.150 8.925 1.00 0.00 H new ATOM 0 HA SER A 81 -3.749 7.108 8.837 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.450 7.354 6.449 1.00 0.00 H new ATOM 0 HB3 SER A 81 -3.932 5.726 6.840 1.00 0.00 H new ATOM 0 HG SER A 81 -6.216 5.195 7.140 1.00 0.00 H new ATOM 1206 N LEU A 82 -5.336 9.147 8.235 1.00 0.00 N ATOM 1207 CA LEU A 82 -6.157 10.343 8.391 1.00 0.00 C ATOM 1208 C LEU A 82 -7.104 10.511 7.207 1.00 0.00 C ATOM 1209 O LEU A 82 -8.322 10.547 7.375 1.00 0.00 O ATOM 1210 CB LEU A 82 -5.269 11.581 8.529 1.00 0.00 C ATOM 1211 CG LEU A 82 -5.998 12.920 8.651 1.00 0.00 C ATOM 1212 CD1 LEU A 82 -6.461 13.146 10.082 1.00 0.00 C ATOM 1213 CD2 LEU A 82 -5.101 14.060 8.192 1.00 0.00 C ATOM 0 H LEU A 82 -4.478 9.291 7.703 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.753 10.229 9.296 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.636 11.453 9.407 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -4.608 11.628 7.664 1.00 0.00 H new ATOM 0 HG LEU A 82 -6.876 12.894 8.006 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -6.978 14.103 10.150 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.140 12.345 10.375 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -5.598 13.151 10.747 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -5.636 15.005 8.286 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -4.204 14.088 8.810 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -4.819 13.905 7.151 1.00 0.00 H new ATOM 1225 N ASN A 83 -6.534 10.612 6.010 1.00 0.00 N ATOM 1226 CA ASN A 83 -7.328 10.775 4.798 1.00 0.00 C ATOM 1227 C ASN A 83 -8.268 9.590 4.600 1.00 0.00 C ATOM 1228 O ASN A 83 -9.454 9.764 4.324 1.00 0.00 O ATOM 1229 CB ASN A 83 -6.413 10.923 3.581 1.00 0.00 C ATOM 1230 CG ASN A 83 -5.257 11.870 3.839 1.00 0.00 C ATOM 1231 OD1 ASN A 83 -4.184 11.452 4.275 1.00 0.00 O ATOM 1232 ND2 ASN A 83 -5.471 13.152 3.570 1.00 0.00 N ATOM 0 H ASN A 83 -5.526 10.584 5.854 1.00 0.00 H new ATOM 0 HA ASN A 83 -7.929 11.678 4.905 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -6.022 9.944 3.302 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -6.995 11.287 2.734 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -4.730 13.836 3.723 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -6.376 13.453 3.210 1.00 0.00 H new ATOM 1239 N GLY A 84 -7.729 8.383 4.743 1.00 0.00 N ATOM 1240 CA GLY A 84 -8.533 7.186 4.577 1.00 0.00 C ATOM 1241 C GLY A 84 -8.108 6.364 3.377 1.00 0.00 C ATOM 1242 O GLY A 84 -7.553 6.896 2.415 1.00 0.00 O ATOM 0 H GLY A 84 -6.749 8.213 4.971 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -8.459 6.575 5.477 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.580 7.468 4.468 1.00 0.00 H new ATOM 1246 N VAL A 85 -8.367 5.061 3.433 1.00 0.00 N ATOM 1247 CA VAL A 85 -8.007 4.163 2.342 1.00 0.00 C ATOM 1248 C VAL A 85 -9.223 3.820 1.489 1.00 0.00 C ATOM 1249 O VAL A 85 -10.295 3.517 2.012 1.00 0.00 O ATOM 1250 CB VAL A 85 -7.380 2.859 2.872 1.00 0.00 C ATOM 1251 CG1 VAL A 85 -6.839 2.022 1.723 1.00 0.00 C ATOM 1252 CG2 VAL A 85 -6.284 3.167 3.881 1.00 0.00 C ATOM 0 H VAL A 85 -8.825 4.604 4.222 1.00 0.00 H new ATOM 0 HA VAL A 85 -7.273 4.687 1.729 1.00 0.00 H new ATOM 0 HB VAL A 85 -8.155 2.282 3.377 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -6.400 1.105 2.116 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -7.652 1.772 1.041 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -6.077 2.588 1.187 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -5.852 2.235 4.245 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -5.507 3.765 3.404 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -6.706 3.723 4.718 1.00 0.00 H new ATOM 1262 N TRP A 86 -9.048 3.868 0.173 1.00 0.00 N ATOM 1263 CA TRP A 86 -10.131 3.561 -0.754 1.00 0.00 C ATOM 1264 C TRP A 86 -9.854 2.264 -1.505 1.00 0.00 C ATOM 1265 O TRP A 86 -8.724 2.005 -1.921 1.00 0.00 O ATOM 1266 CB TRP A 86 -10.322 4.709 -1.746 1.00 0.00 C ATOM 1267 CG TRP A 86 -10.602 6.025 -1.085 1.00 0.00 C ATOM 1268 CD1 TRP A 86 -9.691 6.988 -0.756 1.00 0.00 C ATOM 1269 CD2 TRP A 86 -11.880 6.521 -0.671 1.00 0.00 C ATOM 1270 NE1 TRP A 86 -10.326 8.052 -0.163 1.00 0.00 N ATOM 1271 CE2 TRP A 86 -11.669 7.791 -0.100 1.00 0.00 C ATOM 1272 CE3 TRP A 86 -13.182 6.017 -0.730 1.00 0.00 C ATOM 1273 CZ2 TRP A 86 -12.711 8.560 0.409 1.00 0.00 C ATOM 1274 CZ3 TRP A 86 -14.216 6.782 -0.223 1.00 0.00 C ATOM 1275 CH2 TRP A 86 -13.976 8.042 0.339 1.00 0.00 C ATOM 0 H TRP A 86 -8.166 4.117 -0.276 1.00 0.00 H new ATOM 0 HA TRP A 86 -11.046 3.435 -0.175 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -9.426 4.802 -2.360 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -11.145 4.466 -2.418 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -8.628 6.923 -0.936 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -9.871 8.900 0.176 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -13.377 5.047 -1.164 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -12.528 9.531 0.844 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -15.226 6.401 -0.261 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -14.805 8.616 0.725 1.00 0.00 H new ATOM 1286 N LEU A 87 -10.891 1.452 -1.677 1.00 0.00 N ATOM 1287 CA LEU A 87 -10.758 0.180 -2.380 1.00 0.00 C ATOM 1288 C LEU A 87 -12.010 -0.123 -3.198 1.00 0.00 C ATOM 1289 O LEU A 87 -13.054 -0.471 -2.647 1.00 0.00 O ATOM 1290 CB LEU A 87 -10.500 -0.951 -1.384 1.00 0.00 C ATOM 1291 CG LEU A 87 -10.482 -2.366 -1.965 1.00 0.00 C ATOM 1292 CD1 LEU A 87 -9.169 -2.631 -2.685 1.00 0.00 C ATOM 1293 CD2 LEU A 87 -10.708 -3.396 -0.867 1.00 0.00 C ATOM 0 H LEU A 87 -11.833 1.651 -1.340 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.910 0.256 -3.061 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.542 -0.768 -0.897 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.265 -0.908 -0.609 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.293 -2.451 -2.689 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.175 -3.642 -3.092 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -9.048 -1.914 -3.497 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.342 -2.527 -1.983 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.692 -4.397 -1.298 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.919 -3.310 -0.120 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.675 -3.219 -0.396 1.00 0.00 H new ATOM 1305 N ASN A 88 -11.897 0.010 -4.515 1.00 0.00 N ATOM 1306 CA ASN A 88 -13.019 -0.251 -5.410 1.00 0.00 C ATOM 1307 C ASN A 88 -14.206 0.643 -5.068 1.00 0.00 C ATOM 1308 O ASN A 88 -15.328 0.165 -4.897 1.00 0.00 O ATOM 1309 CB ASN A 88 -13.433 -1.722 -5.325 1.00 0.00 C ATOM 1310 CG ASN A 88 -12.542 -2.622 -6.160 1.00 0.00 C ATOM 1311 OD1 ASN A 88 -12.047 -2.220 -7.213 1.00 0.00 O ATOM 1312 ND2 ASN A 88 -12.334 -3.847 -5.691 1.00 0.00 N ATOM 0 H ASN A 88 -11.040 0.297 -4.987 1.00 0.00 H new ATOM 0 HA ASN A 88 -12.700 -0.028 -6.428 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -13.400 -2.046 -4.285 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -14.465 -1.826 -5.659 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -11.743 -4.498 -6.209 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -12.765 -4.137 -4.813 1.00 0.00 H new ATOM 1319 N ARG A 89 -13.952 1.944 -4.970 1.00 0.00 N ATOM 1320 CA ARG A 89 -14.999 2.906 -4.649 1.00 0.00 C ATOM 1321 C ARG A 89 -15.645 2.577 -3.306 1.00 0.00 C ATOM 1322 O ARG A 89 -16.852 2.737 -3.131 1.00 0.00 O ATOM 1323 CB ARG A 89 -16.063 2.920 -5.748 1.00 0.00 C ATOM 1324 CG ARG A 89 -15.529 3.344 -7.107 1.00 0.00 C ATOM 1325 CD ARG A 89 -15.462 2.169 -8.070 1.00 0.00 C ATOM 1326 NE ARG A 89 -16.603 2.143 -8.981 1.00 0.00 N ATOM 1327 CZ ARG A 89 -16.904 1.104 -9.752 1.00 0.00 C ATOM 1328 NH1 ARG A 89 -16.152 0.012 -9.723 1.00 0.00 N ATOM 1329 NH2 ARG A 89 -17.959 1.156 -10.556 1.00 0.00 N ATOM 0 H ARG A 89 -13.029 2.356 -5.108 1.00 0.00 H new ATOM 0 HA ARG A 89 -14.542 3.894 -4.582 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -16.499 1.925 -5.833 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -16.866 3.596 -5.456 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -16.169 4.122 -7.524 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -14.536 3.777 -6.990 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -14.539 2.225 -8.647 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -15.428 1.238 -7.504 1.00 0.00 H new ATOM 0 HE ARG A 89 -17.201 2.968 -9.028 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -15.340 -0.032 -9.107 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -16.386 -0.784 -10.316 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -18.539 1.994 -10.582 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -18.189 0.358 -11.148 1.00 0.00 H new ATOM 1343 N ALA A 90 -14.831 2.118 -2.361 1.00 0.00 N ATOM 1344 CA ALA A 90 -15.323 1.769 -1.033 1.00 0.00 C ATOM 1345 C ALA A 90 -14.360 2.242 0.050 1.00 0.00 C ATOM 1346 O ALA A 90 -13.144 2.102 -0.081 1.00 0.00 O ATOM 1347 CB ALA A 90 -15.539 0.266 -0.929 1.00 0.00 C ATOM 0 H ALA A 90 -13.829 1.979 -2.490 1.00 0.00 H new ATOM 0 HA ALA A 90 -16.277 2.274 -0.881 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -15.906 0.019 0.067 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -16.270 -0.049 -1.674 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -14.595 -0.250 -1.106 1.00 0.00 H new ATOM 1353 N ARG A 91 -14.912 2.804 1.121 1.00 0.00 N ATOM 1354 CA ARG A 91 -14.102 3.300 2.227 1.00 0.00 C ATOM 1355 C ARG A 91 -13.732 2.168 3.181 1.00 0.00 C ATOM 1356 O ARG A 91 -14.586 1.378 3.585 1.00 0.00 O ATOM 1357 CB ARG A 91 -14.852 4.396 2.986 1.00 0.00 C ATOM 1358 CG ARG A 91 -13.999 5.117 4.016 1.00 0.00 C ATOM 1359 CD ARG A 91 -13.267 6.301 3.403 1.00 0.00 C ATOM 1360 NE ARG A 91 -12.377 6.950 4.361 1.00 0.00 N ATOM 1361 CZ ARG A 91 -12.794 7.800 5.293 1.00 0.00 C ATOM 1362 NH1 ARG A 91 -14.082 8.102 5.391 1.00 0.00 N ATOM 1363 NH2 ARG A 91 -11.923 8.351 6.129 1.00 0.00 N ATOM 0 H ARG A 91 -15.917 2.927 1.246 1.00 0.00 H new ATOM 0 HA ARG A 91 -13.184 3.718 1.813 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -15.236 5.124 2.271 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -15.714 3.955 3.486 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -14.630 5.462 4.835 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -13.276 4.422 4.442 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -12.689 5.964 2.542 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -13.994 7.025 3.035 1.00 0.00 H new ATOM 0 HE ARG A 91 -11.380 6.739 4.312 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -14.755 7.681 4.750 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -14.400 8.755 6.107 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -10.932 8.122 6.057 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -12.245 9.003 6.844 1.00 0.00 H new ATOM 1377 N LEU A 92 -12.454 2.095 3.536 1.00 0.00 N ATOM 1378 CA LEU A 92 -11.970 1.059 4.442 1.00 0.00 C ATOM 1379 C LEU A 92 -11.786 1.612 5.852 1.00 0.00 C ATOM 1380 O LEU A 92 -11.444 2.780 6.031 1.00 0.00 O ATOM 1381 CB LEU A 92 -10.648 0.483 3.931 1.00 0.00 C ATOM 1382 CG LEU A 92 -10.616 0.085 2.455 1.00 0.00 C ATOM 1383 CD1 LEU A 92 -9.194 -0.230 2.018 1.00 0.00 C ATOM 1384 CD2 LEU A 92 -11.529 -1.107 2.205 1.00 0.00 C ATOM 0 H LEU A 92 -11.734 2.740 3.211 1.00 0.00 H new ATOM 0 HA LEU A 92 -12.715 0.264 4.477 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -9.863 1.218 4.106 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.402 -0.395 4.529 1.00 0.00 H new ATOM 0 HG LEU A 92 -10.978 0.926 1.863 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -9.191 -0.511 0.965 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -8.566 0.650 2.161 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -8.804 -1.055 2.615 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -11.494 -1.377 1.150 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -11.196 -1.953 2.807 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -12.551 -0.846 2.479 1.00 0.00 H new ATOM 1396 N GLU A 93 -12.012 0.763 6.850 1.00 0.00 N ATOM 1397 CA GLU A 93 -11.870 1.167 8.243 1.00 0.00 C ATOM 1398 C GLU A 93 -10.442 0.938 8.733 1.00 0.00 C ATOM 1399 O GLU A 93 -9.675 0.170 8.151 1.00 0.00 O ATOM 1400 CB GLU A 93 -12.852 0.394 9.125 1.00 0.00 C ATOM 1401 CG GLU A 93 -14.107 1.178 9.471 1.00 0.00 C ATOM 1402 CD GLU A 93 -15.375 0.372 9.264 1.00 0.00 C ATOM 1403 OE1 GLU A 93 -15.785 0.200 8.097 1.00 0.00 O ATOM 1404 OE2 GLU A 93 -15.957 -0.086 10.269 1.00 0.00 O ATOM 0 H GLU A 93 -12.294 -0.208 6.719 1.00 0.00 H new ATOM 0 HA GLU A 93 -12.094 2.232 8.310 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -13.138 -0.526 8.616 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -12.349 0.105 10.048 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.053 1.503 10.510 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.149 2.078 8.858 1.00 0.00 H new ATOM 1411 N PRO A 94 -10.076 1.621 9.827 1.00 0.00 N ATOM 1412 CA PRO A 94 -8.740 1.510 10.419 1.00 0.00 C ATOM 1413 C PRO A 94 -8.505 0.151 11.070 1.00 0.00 C ATOM 1414 O PRO A 94 -9.304 -0.302 11.890 1.00 0.00 O ATOM 1415 CB PRO A 94 -8.727 2.618 11.476 1.00 0.00 C ATOM 1416 CG PRO A 94 -10.159 2.820 11.830 1.00 0.00 C ATOM 1417 CD PRO A 94 -10.938 2.554 10.572 1.00 0.00 C ATOM 0 HA PRO A 94 -7.954 1.606 9.670 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -8.141 2.327 12.348 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -8.283 3.533 11.085 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -10.463 2.142 12.628 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -10.333 3.834 12.190 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -11.912 2.115 10.788 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -11.118 3.470 10.010 1.00 0.00 H new ATOM 1425 N LEU A 95 -7.405 -0.495 10.698 1.00 0.00 N ATOM 1426 CA LEU A 95 -7.065 -1.804 11.246 1.00 0.00 C ATOM 1427 C LEU A 95 -8.123 -2.839 10.880 1.00 0.00 C ATOM 1428 O LEU A 95 -8.646 -3.540 11.746 1.00 0.00 O ATOM 1429 CB LEU A 95 -6.922 -1.720 12.767 1.00 0.00 C ATOM 1430 CG LEU A 95 -6.139 -0.520 13.303 1.00 0.00 C ATOM 1431 CD1 LEU A 95 -5.981 -0.617 14.812 1.00 0.00 C ATOM 1432 CD2 LEU A 95 -4.779 -0.426 12.627 1.00 0.00 C ATOM 0 H LEU A 95 -6.734 -0.134 10.020 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.114 -2.116 10.814 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -7.920 -1.702 13.205 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.436 -2.631 13.117 1.00 0.00 H new ATOM 0 HG LEU A 95 -6.699 0.387 13.075 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -5.422 0.245 15.175 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -6.965 -0.635 15.280 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -5.443 -1.531 15.063 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -4.236 0.433 13.020 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.211 -1.335 12.824 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.914 -0.308 11.552 1.00 0.00 H new ATOM 1444 N ARG A 96 -8.431 -2.932 9.590 1.00 0.00 N ATOM 1445 CA ARG A 96 -9.425 -3.883 9.109 1.00 0.00 C ATOM 1446 C ARG A 96 -8.823 -4.817 8.063 1.00 0.00 C ATOM 1447 O ARG A 96 -7.834 -4.481 7.411 1.00 0.00 O ATOM 1448 CB ARG A 96 -10.626 -3.143 8.516 1.00 0.00 C ATOM 1449 CG ARG A 96 -11.952 -3.849 8.747 1.00 0.00 C ATOM 1450 CD ARG A 96 -12.600 -3.405 10.049 1.00 0.00 C ATOM 1451 NE ARG A 96 -13.533 -4.404 10.564 1.00 0.00 N ATOM 1452 CZ ARG A 96 -13.155 -5.478 11.249 1.00 0.00 C ATOM 1453 NH1 ARG A 96 -11.871 -5.690 11.501 1.00 0.00 N ATOM 1454 NH2 ARG A 96 -14.064 -6.341 11.685 1.00 0.00 N ATOM 0 H ARG A 96 -8.006 -2.360 8.860 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.758 -4.481 9.957 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -10.676 -2.144 8.949 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -10.472 -3.019 7.444 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -12.625 -3.642 7.915 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -11.793 -4.927 8.768 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -11.826 -3.214 10.793 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -13.127 -2.465 9.889 1.00 0.00 H new ATOM 0 HE ARG A 96 -14.529 -4.270 10.388 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -11.170 -5.028 11.169 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -11.584 -6.515 12.027 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -15.053 -6.180 11.494 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -13.774 -7.165 12.211 1.00 0.00 H new ATOM 1468 N VAL A 97 -9.426 -5.991 7.908 1.00 0.00 N ATOM 1469 CA VAL A 97 -8.951 -6.974 6.942 1.00 0.00 C ATOM 1470 C VAL A 97 -9.811 -6.968 5.683 1.00 0.00 C ATOM 1471 O VAL A 97 -11.033 -7.101 5.753 1.00 0.00 O ATOM 1472 CB VAL A 97 -8.946 -8.393 7.540 1.00 0.00 C ATOM 1473 CG1 VAL A 97 -8.321 -9.381 6.567 1.00 0.00 C ATOM 1474 CG2 VAL A 97 -8.210 -8.407 8.872 1.00 0.00 C ATOM 0 H VAL A 97 -10.245 -6.285 8.440 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.930 -6.694 6.683 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.978 -8.697 7.717 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -8.326 -10.378 7.007 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.894 -9.391 5.640 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -7.294 -9.083 6.356 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.216 -9.418 9.280 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -7.180 -8.082 8.722 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.706 -7.731 9.569 1.00 0.00 H new ATOM 1484 N TYR A 98 -9.165 -6.813 4.533 1.00 0.00 N ATOM 1485 CA TYR A 98 -9.871 -6.788 3.257 1.00 0.00 C ATOM 1486 C TYR A 98 -9.163 -7.660 2.225 1.00 0.00 C ATOM 1487 O TYR A 98 -8.173 -7.247 1.621 1.00 0.00 O ATOM 1488 CB TYR A 98 -9.981 -5.352 2.740 1.00 0.00 C ATOM 1489 CG TYR A 98 -11.033 -4.531 3.450 1.00 0.00 C ATOM 1490 CD1 TYR A 98 -12.380 -4.676 3.142 1.00 0.00 C ATOM 1491 CD2 TYR A 98 -10.681 -3.611 4.430 1.00 0.00 C ATOM 1492 CE1 TYR A 98 -13.345 -3.928 3.788 1.00 0.00 C ATOM 1493 CE2 TYR A 98 -11.639 -2.859 5.082 1.00 0.00 C ATOM 1494 CZ TYR A 98 -12.969 -3.021 4.757 1.00 0.00 C ATOM 1495 OH TYR A 98 -13.928 -2.274 5.403 1.00 0.00 O ATOM 0 H TYR A 98 -8.154 -6.703 4.458 1.00 0.00 H new ATOM 0 HA TYR A 98 -10.873 -7.188 3.417 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -9.014 -4.861 2.849 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -10.208 -5.375 1.674 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -12.678 -5.386 2.384 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -9.640 -3.482 4.687 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -14.388 -4.053 3.536 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -11.348 -2.149 5.842 1.00 0.00 H new ATOM 0 HH TYR A 98 -13.498 -1.684 6.057 1.00 0.00 H new ATOM 1505 N SER A 99 -9.678 -8.869 2.028 1.00 0.00 N ATOM 1506 CA SER A 99 -9.095 -9.802 1.071 1.00 0.00 C ATOM 1507 C SER A 99 -9.107 -9.215 -0.337 1.00 0.00 C ATOM 1508 O SER A 99 -10.170 -8.985 -0.915 1.00 0.00 O ATOM 1509 CB SER A 99 -9.857 -11.128 1.090 1.00 0.00 C ATOM 1510 OG SER A 99 -10.739 -11.194 2.198 1.00 0.00 O ATOM 0 H SER A 99 -10.498 -9.226 2.518 1.00 0.00 H new ATOM 0 HA SER A 99 -8.060 -9.982 1.361 1.00 0.00 H new ATOM 0 HB2 SER A 99 -10.422 -11.240 0.164 1.00 0.00 H new ATOM 0 HB3 SER A 99 -9.150 -11.957 1.134 1.00 0.00 H new ATOM 0 HG SER A 99 -11.574 -10.730 1.979 1.00 0.00 H new ATOM 1516 N ILE A 100 -7.919 -8.976 -0.881 1.00 0.00 N ATOM 1517 CA ILE A 100 -7.793 -8.417 -2.222 1.00 0.00 C ATOM 1518 C ILE A 100 -7.657 -9.519 -3.266 1.00 0.00 C ATOM 1519 O ILE A 100 -7.039 -10.555 -3.015 1.00 0.00 O ATOM 1520 CB ILE A 100 -6.580 -7.474 -2.326 1.00 0.00 C ATOM 1521 CG1 ILE A 100 -5.279 -8.258 -2.145 1.00 0.00 C ATOM 1522 CG2 ILE A 100 -6.683 -6.362 -1.293 1.00 0.00 C ATOM 1523 CD1 ILE A 100 -4.037 -7.401 -2.250 1.00 0.00 C ATOM 0 H ILE A 100 -7.031 -9.160 -0.415 1.00 0.00 H new ATOM 0 HA ILE A 100 -8.703 -7.848 -2.414 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.574 -7.022 -3.318 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.292 -8.747 -1.171 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -5.232 -9.046 -2.897 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.818 -5.704 -1.379 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -7.594 -5.789 -1.465 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -6.711 -6.795 -0.293 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.153 -8.023 -2.111 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -4.000 -6.932 -3.233 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.062 -6.629 -1.481 1.00 0.00 H new ATOM 1535 N HIS A 101 -8.237 -9.290 -4.440 1.00 0.00 N ATOM 1536 CA HIS A 101 -8.178 -10.263 -5.525 1.00 0.00 C ATOM 1537 C HIS A 101 -7.644 -9.621 -6.802 1.00 0.00 C ATOM 1538 O HIS A 101 -7.354 -8.426 -6.832 1.00 0.00 O ATOM 1539 CB HIS A 101 -9.564 -10.857 -5.781 1.00 0.00 C ATOM 1540 CG HIS A 101 -10.263 -11.303 -4.534 1.00 0.00 C ATOM 1541 ND1 HIS A 101 -9.771 -12.291 -3.708 1.00 0.00 N ATOM 1542 CD2 HIS A 101 -11.423 -10.888 -3.973 1.00 0.00 C ATOM 1543 CE1 HIS A 101 -10.599 -12.466 -2.693 1.00 0.00 C ATOM 1544 NE2 HIS A 101 -11.610 -11.627 -2.830 1.00 0.00 N ATOM 0 H HIS A 101 -8.753 -8.439 -4.664 1.00 0.00 H new ATOM 0 HA HIS A 101 -7.497 -11.061 -5.228 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -10.181 -10.115 -6.288 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -9.467 -11.706 -6.457 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -12.079 -10.119 -4.353 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -10.471 -13.175 -1.888 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -12.401 -11.542 -2.191 1.00 0.00 H new ATOM 1552 N GLN A 102 -7.515 -10.424 -7.853 1.00 0.00 N ATOM 1553 CA GLN A 102 -7.014 -9.934 -9.132 1.00 0.00 C ATOM 1554 C GLN A 102 -8.023 -8.999 -9.790 1.00 0.00 C ATOM 1555 O GLN A 102 -8.897 -9.438 -10.537 1.00 0.00 O ATOM 1556 CB GLN A 102 -6.703 -11.106 -10.065 1.00 0.00 C ATOM 1557 CG GLN A 102 -5.561 -10.829 -11.029 1.00 0.00 C ATOM 1558 CD GLN A 102 -5.995 -10.005 -12.226 1.00 0.00 C ATOM 1559 OE1 GLN A 102 -7.181 -9.933 -12.547 1.00 0.00 O ATOM 1560 NE2 GLN A 102 -5.033 -9.377 -12.893 1.00 0.00 N ATOM 0 H GLN A 102 -7.750 -11.416 -7.844 1.00 0.00 H new ATOM 0 HA GLN A 102 -6.097 -9.375 -8.944 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -6.457 -11.982 -9.465 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -7.598 -11.352 -10.636 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -4.764 -10.305 -10.501 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -5.145 -11.775 -11.375 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -4.063 -9.465 -12.592 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -5.265 -8.807 -13.707 1.00 0.00 H new ATOM 1569 N GLY A 103 -7.897 -7.706 -9.507 1.00 0.00 N ATOM 1570 CA GLY A 103 -8.805 -6.729 -10.079 1.00 0.00 C ATOM 1571 C GLY A 103 -9.340 -5.759 -9.045 1.00 0.00 C ATOM 1572 O GLY A 103 -10.515 -5.392 -9.076 1.00 0.00 O ATOM 0 H GLY A 103 -7.182 -7.318 -8.892 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.289 -6.173 -10.862 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -9.639 -7.247 -10.553 1.00 0.00 H new ATOM 1576 N ASP A 104 -8.477 -5.343 -8.124 1.00 0.00 N ATOM 1577 CA ASP A 104 -8.869 -4.410 -7.074 1.00 0.00 C ATOM 1578 C ASP A 104 -8.125 -3.086 -7.218 1.00 0.00 C ATOM 1579 O ASP A 104 -6.902 -3.063 -7.364 1.00 0.00 O ATOM 1580 CB ASP A 104 -8.598 -5.016 -5.696 1.00 0.00 C ATOM 1581 CG ASP A 104 -9.813 -5.719 -5.124 1.00 0.00 C ATOM 1582 OD1 ASP A 104 -10.577 -6.318 -5.910 1.00 0.00 O ATOM 1583 OD2 ASP A 104 -9.999 -5.672 -3.890 1.00 0.00 O ATOM 0 H ASP A 104 -7.501 -5.637 -8.084 1.00 0.00 H new ATOM 0 HA ASP A 104 -9.937 -4.218 -7.173 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -7.773 -5.725 -5.770 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -8.282 -4.229 -5.012 1.00 0.00 H new ATOM 1588 N TYR A 105 -8.869 -1.987 -7.176 1.00 0.00 N ATOM 1589 CA TYR A 105 -8.280 -0.660 -7.304 1.00 0.00 C ATOM 1590 C TYR A 105 -8.031 -0.039 -5.933 1.00 0.00 C ATOM 1591 O TYR A 105 -8.968 0.218 -5.177 1.00 0.00 O ATOM 1592 CB TYR A 105 -9.192 0.248 -8.130 1.00 0.00 C ATOM 1593 CG TYR A 105 -8.699 0.482 -9.540 1.00 0.00 C ATOM 1594 CD1 TYR A 105 -8.454 -0.584 -10.397 1.00 0.00 C ATOM 1595 CD2 TYR A 105 -8.479 1.769 -10.016 1.00 0.00 C ATOM 1596 CE1 TYR A 105 -8.002 -0.375 -11.686 1.00 0.00 C ATOM 1597 CE2 TYR A 105 -8.028 1.987 -11.304 1.00 0.00 C ATOM 1598 CZ TYR A 105 -7.791 0.912 -12.135 1.00 0.00 C ATOM 1599 OH TYR A 105 -7.343 1.124 -13.418 1.00 0.00 O ATOM 0 H TYR A 105 -9.882 -1.989 -7.054 1.00 0.00 H new ATOM 0 HA TYR A 105 -7.322 -0.763 -7.814 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -10.188 -0.192 -8.171 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -9.289 1.209 -7.624 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -8.620 -1.593 -10.050 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -8.664 2.613 -9.368 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -7.815 -1.215 -12.338 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -7.862 2.994 -11.658 1.00 0.00 H new ATOM 0 HH TYR A 105 -7.682 1.983 -13.745 1.00 0.00 H new ATOM 1609 N ILE A 106 -6.762 0.201 -5.621 1.00 0.00 N ATOM 1610 CA ILE A 106 -6.390 0.794 -4.342 1.00 0.00 C ATOM 1611 C ILE A 106 -5.940 2.241 -4.517 1.00 0.00 C ATOM 1612 O ILE A 106 -5.080 2.537 -5.346 1.00 0.00 O ATOM 1613 CB ILE A 106 -5.263 -0.003 -3.659 1.00 0.00 C ATOM 1614 CG1 ILE A 106 -5.691 -1.457 -3.450 1.00 0.00 C ATOM 1615 CG2 ILE A 106 -4.887 0.641 -2.333 1.00 0.00 C ATOM 1616 CD1 ILE A 106 -5.383 -2.354 -4.628 1.00 0.00 C ATOM 0 H ILE A 106 -5.975 -0.006 -6.236 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.278 0.766 -3.711 1.00 0.00 H new ATOM 0 HB ILE A 106 -4.386 0.008 -4.307 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -5.192 -1.850 -2.564 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.762 -1.487 -3.252 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -4.089 0.066 -1.863 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -4.545 1.661 -2.508 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -5.757 0.658 -1.677 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.714 -3.369 -4.409 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.904 -1.986 -5.512 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -4.309 -2.355 -4.814 1.00 0.00 H new ATOM 1628 N GLN A 107 -6.526 3.136 -3.729 1.00 0.00 N ATOM 1629 CA GLN A 107 -6.185 4.552 -3.796 1.00 0.00 C ATOM 1630 C GLN A 107 -5.745 5.071 -2.431 1.00 0.00 C ATOM 1631 O GLN A 107 -6.503 5.018 -1.462 1.00 0.00 O ATOM 1632 CB GLN A 107 -7.379 5.363 -4.303 1.00 0.00 C ATOM 1633 CG GLN A 107 -6.984 6.622 -5.057 1.00 0.00 C ATOM 1634 CD GLN A 107 -8.145 7.240 -5.810 1.00 0.00 C ATOM 1635 OE1 GLN A 107 -8.300 7.031 -7.014 1.00 0.00 O ATOM 1636 NE2 GLN A 107 -8.968 8.006 -5.105 1.00 0.00 N ATOM 0 H GLN A 107 -7.239 2.906 -3.037 1.00 0.00 H new ATOM 0 HA GLN A 107 -5.355 4.667 -4.493 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -7.984 4.734 -4.956 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -8.006 5.639 -3.455 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -6.583 7.351 -4.353 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -6.185 6.384 -5.760 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -8.802 8.152 -4.109 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -9.767 8.449 -5.559 1.00 0.00 H new ATOM 1645 N LEU A 108 -4.517 5.572 -2.363 1.00 0.00 N ATOM 1646 CA LEU A 108 -3.975 6.101 -1.116 1.00 0.00 C ATOM 1647 C LEU A 108 -4.348 7.570 -0.940 1.00 0.00 C ATOM 1648 O LEU A 108 -3.551 8.462 -1.226 1.00 0.00 O ATOM 1649 CB LEU A 108 -2.454 5.943 -1.090 1.00 0.00 C ATOM 1650 CG LEU A 108 -1.925 4.516 -1.240 1.00 0.00 C ATOM 1651 CD1 LEU A 108 -0.405 4.500 -1.170 1.00 0.00 C ATOM 1652 CD2 LEU A 108 -2.520 3.612 -0.171 1.00 0.00 C ATOM 0 H LEU A 108 -3.878 5.623 -3.156 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.407 5.534 -0.292 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.032 6.552 -1.890 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.082 6.350 -0.150 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.227 4.137 -2.217 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -0.047 3.476 -1.279 1.00 0.00 H new ATOM 0 HD12 LEU A 108 0.003 5.114 -1.973 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.081 4.898 -0.208 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -2.133 2.601 -0.293 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -2.249 3.988 0.816 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -3.606 3.599 -0.269 1.00 0.00 H new ATOM 1664 N GLY A 109 -5.566 7.813 -0.465 1.00 0.00 N ATOM 1665 CA GLY A 109 -6.023 9.175 -0.257 1.00 0.00 C ATOM 1666 C GLY A 109 -7.094 9.585 -1.248 1.00 0.00 C ATOM 1667 O GLY A 109 -7.636 8.748 -1.969 1.00 0.00 O ATOM 0 H GLY A 109 -6.244 7.091 -0.221 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -6.413 9.273 0.756 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -5.176 9.856 -0.340 1.00 0.00 H new ATOM 1671 N VAL A 110 -7.401 10.878 -1.283 1.00 0.00 N ATOM 1672 CA VAL A 110 -8.415 11.398 -2.193 1.00 0.00 C ATOM 1673 C VAL A 110 -7.799 12.337 -3.223 1.00 0.00 C ATOM 1674 O VAL A 110 -6.737 12.923 -3.010 1.00 0.00 O ATOM 1675 CB VAL A 110 -9.523 12.147 -1.429 1.00 0.00 C ATOM 1676 CG1 VAL A 110 -10.486 11.163 -0.783 1.00 0.00 C ATOM 1677 CG2 VAL A 110 -8.917 13.075 -0.387 1.00 0.00 C ATOM 0 H VAL A 110 -6.962 11.584 -0.692 1.00 0.00 H new ATOM 0 HA VAL A 110 -8.852 10.540 -2.704 1.00 0.00 H new ATOM 0 HB VAL A 110 -10.084 12.753 -2.140 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -11.262 11.711 -0.248 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -10.945 10.544 -1.554 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.942 10.528 -0.084 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.714 13.596 0.143 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -8.330 12.492 0.322 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -8.272 13.803 -0.879 1.00 0.00 H new ATOM 1687 N PRO A 111 -8.479 12.486 -4.370 1.00 0.00 N ATOM 1688 CA PRO A 111 -8.018 13.354 -5.457 1.00 0.00 C ATOM 1689 C PRO A 111 -8.110 14.833 -5.096 1.00 0.00 C ATOM 1690 O PRO A 111 -8.781 15.208 -4.134 1.00 0.00 O ATOM 1691 CB PRO A 111 -8.975 13.024 -6.605 1.00 0.00 C ATOM 1692 CG PRO A 111 -10.210 12.526 -5.937 1.00 0.00 C ATOM 1693 CD PRO A 111 -9.752 11.818 -4.692 1.00 0.00 C ATOM 0 HA PRO A 111 -6.968 13.184 -5.697 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -9.182 13.904 -7.214 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -8.552 12.270 -7.269 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -10.881 13.350 -5.693 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -10.761 11.849 -6.590 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -10.475 11.919 -3.883 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -9.614 10.751 -4.864 1.00 0.00 H new ATOM 1701 N LEU A 112 -7.432 15.670 -5.874 1.00 0.00 N ATOM 1702 CA LEU A 112 -7.437 17.109 -5.637 1.00 0.00 C ATOM 1703 C LEU A 112 -8.443 17.807 -6.547 1.00 0.00 C ATOM 1704 O LEU A 112 -9.124 17.163 -7.344 1.00 0.00 O ATOM 1705 CB LEU A 112 -6.040 17.689 -5.864 1.00 0.00 C ATOM 1706 CG LEU A 112 -5.022 17.443 -4.749 1.00 0.00 C ATOM 1707 CD1 LEU A 112 -5.553 17.955 -3.419 1.00 0.00 C ATOM 1708 CD2 LEU A 112 -4.682 15.963 -4.655 1.00 0.00 C ATOM 0 H LEU A 112 -6.872 15.377 -6.674 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.731 17.280 -4.601 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -5.642 17.274 -6.790 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.135 18.765 -6.012 1.00 0.00 H new ATOM 0 HG LEU A 112 -4.110 17.991 -4.988 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -4.815 17.771 -2.638 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -5.746 19.025 -3.492 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -6.479 17.436 -3.173 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -3.957 15.806 -3.857 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -5.587 15.395 -4.440 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -4.259 15.626 -5.601 1.00 0.00 H new ATOM 1720 N GLU A 113 -8.530 19.128 -6.421 1.00 0.00 N ATOM 1721 CA GLU A 113 -9.452 19.913 -7.233 1.00 0.00 C ATOM 1722 C GLU A 113 -8.907 20.103 -8.646 1.00 0.00 C ATOM 1723 O GLU A 113 -7.702 20.008 -8.875 1.00 0.00 O ATOM 1724 CB GLU A 113 -9.705 21.276 -6.585 1.00 0.00 C ATOM 1725 CG GLU A 113 -8.452 22.122 -6.439 1.00 0.00 C ATOM 1726 CD GLU A 113 -8.621 23.248 -5.437 1.00 0.00 C ATOM 1727 OE1 GLU A 113 -9.413 24.174 -5.712 1.00 0.00 O ATOM 1728 OE2 GLU A 113 -7.962 23.201 -4.377 1.00 0.00 O ATOM 0 H GLU A 113 -7.974 19.676 -5.765 1.00 0.00 H new ATOM 0 HA GLU A 113 -10.394 19.368 -7.295 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -10.435 21.823 -7.182 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -10.148 21.124 -5.601 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -7.623 21.486 -6.129 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -8.186 22.541 -7.409 1.00 0.00 H new ATOM 1735 N ASN A 114 -9.804 20.371 -9.589 1.00 0.00 N ATOM 1736 CA ASN A 114 -9.414 20.573 -10.980 1.00 0.00 C ATOM 1737 C ASN A 114 -8.654 19.362 -11.513 1.00 0.00 C ATOM 1738 O ASN A 114 -7.838 19.480 -12.427 1.00 0.00 O ATOM 1739 CB ASN A 114 -8.550 21.829 -11.111 1.00 0.00 C ATOM 1740 CG ASN A 114 -8.999 22.939 -10.180 1.00 0.00 C ATOM 1741 OD1 ASN A 114 -10.187 23.080 -9.892 1.00 0.00 O ATOM 1742 ND2 ASN A 114 -8.046 23.734 -9.705 1.00 0.00 N ATOM 0 H ASN A 114 -10.806 20.453 -9.416 1.00 0.00 H new ATOM 0 HA ASN A 114 -10.321 20.700 -11.571 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -7.512 21.576 -10.897 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -8.585 22.185 -12.141 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -8.287 24.499 -9.074 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -7.073 23.580 -9.971 1.00 0.00 H new ATOM 1749 N LYS A 115 -8.929 18.197 -10.936 1.00 0.00 N ATOM 1750 CA LYS A 115 -8.274 16.963 -11.353 1.00 0.00 C ATOM 1751 C LYS A 115 -9.295 15.948 -11.857 1.00 0.00 C ATOM 1752 O LYS A 115 -10.488 16.241 -11.931 1.00 0.00 O ATOM 1753 CB LYS A 115 -7.477 16.367 -10.191 1.00 0.00 C ATOM 1754 CG LYS A 115 -6.297 17.221 -9.761 1.00 0.00 C ATOM 1755 CD LYS A 115 -5.035 16.853 -10.523 1.00 0.00 C ATOM 1756 CE LYS A 115 -4.288 15.713 -9.847 1.00 0.00 C ATOM 1757 NZ LYS A 115 -3.345 15.038 -10.781 1.00 0.00 N ATOM 0 H LYS A 115 -9.601 18.082 -10.178 1.00 0.00 H new ATOM 0 HA LYS A 115 -7.592 17.201 -12.169 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -8.143 16.227 -9.339 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -7.115 15.380 -10.478 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -6.529 18.273 -9.926 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -6.127 17.096 -8.692 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -5.295 16.566 -11.542 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -4.384 17.725 -10.594 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -3.736 16.098 -8.989 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -5.004 14.985 -9.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -2.855 14.267 -10.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -3.874 14.648 -11.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -2.646 15.726 -11.126 1.00 0.00 H new ATOM 1771 N GLU A 116 -8.819 14.756 -12.200 1.00 0.00 N ATOM 1772 CA GLU A 116 -9.692 13.699 -12.695 1.00 0.00 C ATOM 1773 C GLU A 116 -9.736 12.526 -11.719 1.00 0.00 C ATOM 1774 O GLU A 116 -10.787 11.928 -11.498 1.00 0.00 O ATOM 1775 CB GLU A 116 -9.218 13.216 -14.068 1.00 0.00 C ATOM 1776 CG GLU A 116 -9.382 14.252 -15.167 1.00 0.00 C ATOM 1777 CD GLU A 116 -9.416 13.634 -16.551 1.00 0.00 C ATOM 1778 OE1 GLU A 116 -9.326 12.392 -16.648 1.00 0.00 O ATOM 1779 OE2 GLU A 116 -9.532 14.391 -17.537 1.00 0.00 O ATOM 0 H GLU A 116 -7.834 14.498 -12.144 1.00 0.00 H new ATOM 0 HA GLU A 116 -10.698 14.109 -12.789 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -8.168 12.932 -14.001 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -9.774 12.319 -14.340 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.303 14.811 -15.000 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -8.561 14.967 -15.113 1.00 0.00 H new ATOM 1786 N ASN A 117 -8.584 12.205 -11.139 1.00 0.00 N ATOM 1787 CA ASN A 117 -8.489 11.103 -10.187 1.00 0.00 C ATOM 1788 C ASN A 117 -7.170 11.157 -9.422 1.00 0.00 C ATOM 1789 O ASN A 117 -6.199 11.758 -9.881 1.00 0.00 O ATOM 1790 CB ASN A 117 -8.617 9.762 -10.912 1.00 0.00 C ATOM 1791 CG ASN A 117 -10.052 9.276 -10.981 1.00 0.00 C ATOM 1792 OD1 ASN A 117 -10.575 9.004 -12.062 1.00 0.00 O ATOM 1793 ND2 ASN A 117 -10.695 9.166 -9.825 1.00 0.00 N ATOM 0 H ASN A 117 -7.704 12.691 -11.311 1.00 0.00 H new ATOM 0 HA ASN A 117 -9.307 11.201 -9.473 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -8.220 9.859 -11.923 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -8.008 9.016 -10.401 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -11.663 8.845 -9.808 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -10.221 9.403 -8.953 1.00 0.00 H new ATOM 1800 N ALA A 118 -7.144 10.525 -8.254 1.00 0.00 N ATOM 1801 CA ALA A 118 -5.944 10.498 -7.427 1.00 0.00 C ATOM 1802 C ALA A 118 -4.737 10.018 -8.225 1.00 0.00 C ATOM 1803 O ALA A 118 -4.725 8.899 -8.736 1.00 0.00 O ATOM 1804 CB ALA A 118 -6.161 9.611 -6.210 1.00 0.00 C ATOM 0 H ALA A 118 -7.940 10.025 -7.859 1.00 0.00 H new ATOM 0 HA ALA A 118 -5.743 11.515 -7.090 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -5.257 9.600 -5.602 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -6.991 10.000 -5.620 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -6.391 8.597 -6.536 1.00 0.00 H new ATOM 1810 N GLU A 119 -3.724 10.873 -8.330 1.00 0.00 N ATOM 1811 CA GLU A 119 -2.513 10.534 -9.068 1.00 0.00 C ATOM 1812 C GLU A 119 -1.929 9.213 -8.579 1.00 0.00 C ATOM 1813 O GLU A 119 -1.281 8.489 -9.337 1.00 0.00 O ATOM 1814 CB GLU A 119 -1.474 11.648 -8.925 1.00 0.00 C ATOM 1815 CG GLU A 119 -0.861 11.734 -7.537 1.00 0.00 C ATOM 1816 CD GLU A 119 0.238 12.776 -7.448 1.00 0.00 C ATOM 1817 OE1 GLU A 119 1.116 12.789 -8.335 1.00 0.00 O ATOM 1818 OE2 GLU A 119 0.218 13.577 -6.490 1.00 0.00 O ATOM 0 H GLU A 119 -3.718 11.804 -7.914 1.00 0.00 H new ATOM 0 HA GLU A 119 -2.778 10.426 -10.120 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -0.680 11.489 -9.654 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -1.942 12.603 -9.166 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -1.641 11.971 -6.813 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -0.456 10.760 -7.262 1.00 0.00 H new ATOM 1825 N TYR A 120 -2.161 8.904 -7.308 1.00 0.00 N ATOM 1826 CA TYR A 120 -1.656 7.671 -6.716 1.00 0.00 C ATOM 1827 C TYR A 120 -2.707 6.567 -6.777 1.00 0.00 C ATOM 1828 O TYR A 120 -3.550 6.449 -5.889 1.00 0.00 O ATOM 1829 CB TYR A 120 -1.236 7.913 -5.265 1.00 0.00 C ATOM 1830 CG TYR A 120 0.074 8.655 -5.128 1.00 0.00 C ATOM 1831 CD1 TYR A 120 1.207 8.235 -5.813 1.00 0.00 C ATOM 1832 CD2 TYR A 120 0.178 9.776 -4.315 1.00 0.00 C ATOM 1833 CE1 TYR A 120 2.407 8.910 -5.691 1.00 0.00 C ATOM 1834 CE2 TYR A 120 1.373 10.458 -4.188 1.00 0.00 C ATOM 1835 CZ TYR A 120 2.484 10.021 -4.878 1.00 0.00 C ATOM 1836 OH TYR A 120 3.676 10.697 -4.753 1.00 0.00 O ATOM 0 H TYR A 120 -2.696 9.491 -6.668 1.00 0.00 H new ATOM 0 HA TYR A 120 -0.787 7.351 -7.290 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -2.018 8.478 -4.759 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -1.155 6.953 -4.754 1.00 0.00 H new ATOM 0 HD1 TYR A 120 1.149 7.366 -6.452 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -0.690 10.121 -3.773 1.00 0.00 H new ATOM 0 HE1 TYR A 120 3.279 8.569 -6.229 1.00 0.00 H new ATOM 0 HE2 TYR A 120 1.437 11.328 -3.552 1.00 0.00 H new ATOM 0 HH TYR A 120 3.559 11.456 -4.144 1.00 0.00 H new ATOM 1846 N GLU A 121 -2.647 5.760 -7.831 1.00 0.00 N ATOM 1847 CA GLU A 121 -3.594 4.665 -8.009 1.00 0.00 C ATOM 1848 C GLU A 121 -2.882 3.403 -8.487 1.00 0.00 C ATOM 1849 O GLU A 121 -1.886 3.474 -9.208 1.00 0.00 O ATOM 1850 CB GLU A 121 -4.683 5.059 -9.009 1.00 0.00 C ATOM 1851 CG GLU A 121 -5.869 5.762 -8.371 1.00 0.00 C ATOM 1852 CD GLU A 121 -6.773 6.425 -9.392 1.00 0.00 C ATOM 1853 OE1 GLU A 121 -6.283 7.293 -10.143 1.00 0.00 O ATOM 1854 OE2 GLU A 121 -7.971 6.074 -9.439 1.00 0.00 O ATOM 0 H GLU A 121 -1.953 5.843 -8.574 1.00 0.00 H new ATOM 0 HA GLU A 121 -4.056 4.458 -7.044 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -4.250 5.711 -9.767 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -5.035 4.164 -9.522 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -6.447 5.040 -7.794 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -5.507 6.514 -7.670 1.00 0.00 H new ATOM 1861 N TYR A 122 -3.399 2.249 -8.079 1.00 0.00 N ATOM 1862 CA TYR A 122 -2.812 0.971 -8.463 1.00 0.00 C ATOM 1863 C TYR A 122 -3.895 -0.027 -8.865 1.00 0.00 C ATOM 1864 O TYR A 122 -5.073 0.318 -8.944 1.00 0.00 O ATOM 1865 CB TYR A 122 -1.981 0.401 -7.312 1.00 0.00 C ATOM 1866 CG TYR A 122 -1.097 1.427 -6.639 1.00 0.00 C ATOM 1867 CD1 TYR A 122 -1.583 2.222 -5.608 1.00 0.00 C ATOM 1868 CD2 TYR A 122 0.224 1.601 -7.034 1.00 0.00 C ATOM 1869 CE1 TYR A 122 -0.779 3.161 -4.991 1.00 0.00 C ATOM 1870 CE2 TYR A 122 1.035 2.536 -6.421 1.00 0.00 C ATOM 1871 CZ TYR A 122 0.529 3.314 -5.400 1.00 0.00 C ATOM 1872 OH TYR A 122 1.333 4.248 -4.788 1.00 0.00 O ATOM 0 H TYR A 122 -4.223 2.173 -7.483 1.00 0.00 H new ATOM 0 HA TYR A 122 -2.163 1.142 -9.322 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -2.652 -0.031 -6.570 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -1.359 -0.410 -7.691 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -2.606 2.104 -5.284 1.00 0.00 H new ATOM 0 HD2 TYR A 122 0.623 0.995 -7.834 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -1.173 3.772 -4.192 1.00 0.00 H new ATOM 0 HE2 TYR A 122 2.060 2.657 -6.739 1.00 0.00 H new ATOM 0 HH TYR A 122 2.225 4.228 -5.193 1.00 0.00 H new ATOM 1882 N GLU A 123 -3.484 -1.266 -9.117 1.00 0.00 N ATOM 1883 CA GLU A 123 -4.418 -2.314 -9.512 1.00 0.00 C ATOM 1884 C GLU A 123 -3.843 -3.696 -9.213 1.00 0.00 C ATOM 1885 O GLU A 123 -2.890 -4.136 -9.857 1.00 0.00 O ATOM 1886 CB GLU A 123 -4.750 -2.198 -11.001 1.00 0.00 C ATOM 1887 CG GLU A 123 -5.844 -3.150 -11.456 1.00 0.00 C ATOM 1888 CD GLU A 123 -5.919 -3.273 -12.966 1.00 0.00 C ATOM 1889 OE1 GLU A 123 -5.048 -2.698 -13.652 1.00 0.00 O ATOM 1890 OE2 GLU A 123 -6.848 -3.944 -13.460 1.00 0.00 O ATOM 0 H GLU A 123 -2.512 -1.568 -9.055 1.00 0.00 H new ATOM 0 HA GLU A 123 -5.333 -2.187 -8.933 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -5.057 -1.175 -11.218 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -3.848 -2.390 -11.582 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -5.667 -4.135 -11.023 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -6.804 -2.803 -11.075 1.00 0.00 H new ATOM 1897 N VAL A 124 -4.428 -4.375 -8.232 1.00 0.00 N ATOM 1898 CA VAL A 124 -3.976 -5.706 -7.848 1.00 0.00 C ATOM 1899 C VAL A 124 -3.886 -6.627 -9.059 1.00 0.00 C ATOM 1900 O VAL A 124 -4.883 -6.881 -9.736 1.00 0.00 O ATOM 1901 CB VAL A 124 -4.915 -6.339 -6.804 1.00 0.00 C ATOM 1902 CG1 VAL A 124 -4.366 -7.677 -6.333 1.00 0.00 C ATOM 1903 CG2 VAL A 124 -5.120 -5.394 -5.630 1.00 0.00 C ATOM 0 H VAL A 124 -5.217 -4.025 -7.688 1.00 0.00 H new ATOM 0 HA VAL A 124 -2.985 -5.589 -7.410 1.00 0.00 H new ATOM 0 HB VAL A 124 -5.883 -6.516 -7.272 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -5.043 -8.109 -5.596 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -4.276 -8.353 -7.183 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -3.385 -7.529 -5.882 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -5.786 -5.857 -4.902 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -4.159 -5.183 -5.160 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -5.562 -4.463 -5.985 1.00 0.00 H new ATOM 1913 N THR A 125 -2.683 -7.126 -9.329 1.00 0.00 N ATOM 1914 CA THR A 125 -2.462 -8.019 -10.459 1.00 0.00 C ATOM 1915 C THR A 125 -1.306 -8.975 -10.187 1.00 0.00 C ATOM 1916 O THR A 125 -0.419 -8.678 -9.388 1.00 0.00 O ATOM 1917 CB THR A 125 -2.167 -7.230 -11.749 1.00 0.00 C ATOM 1918 OG1 THR A 125 -2.023 -8.131 -12.852 1.00 0.00 O ATOM 1919 CG2 THR A 125 -0.902 -6.399 -11.598 1.00 0.00 C ATOM 0 H THR A 125 -1.847 -6.926 -8.780 1.00 0.00 H new ATOM 0 HA THR A 125 -3.380 -8.592 -10.593 1.00 0.00 H new ATOM 0 HB THR A 125 -3.004 -6.557 -11.937 1.00 0.00 H new ATOM 0 HG1 THR A 125 -1.837 -7.622 -13.668 1.00 0.00 H new ATOM 0 HG21 THR A 125 -0.714 -5.851 -12.521 1.00 0.00 H new ATOM 0 HG22 THR A 125 -1.026 -5.694 -10.776 1.00 0.00 H new ATOM 0 HG23 THR A 125 -0.058 -7.056 -11.388 1.00 0.00 H new ATOM 1927 N GLU A 126 -1.324 -10.124 -10.856 1.00 0.00 N ATOM 1928 CA GLU A 126 -0.276 -11.123 -10.685 1.00 0.00 C ATOM 1929 C GLU A 126 0.617 -11.192 -11.920 1.00 0.00 C ATOM 1930 O GLU A 126 0.180 -11.611 -12.991 1.00 0.00 O ATOM 1931 CB GLU A 126 -0.891 -12.497 -10.410 1.00 0.00 C ATOM 1932 CG GLU A 126 -0.005 -13.404 -9.574 1.00 0.00 C ATOM 1933 CD GLU A 126 -0.552 -14.814 -9.464 1.00 0.00 C ATOM 1934 OE1 GLU A 126 -1.719 -15.031 -9.852 1.00 0.00 O ATOM 1935 OE2 GLU A 126 0.188 -15.702 -8.989 1.00 0.00 O ATOM 0 H GLU A 126 -2.052 -10.386 -11.521 1.00 0.00 H new ATOM 0 HA GLU A 126 0.335 -10.829 -9.832 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -1.844 -12.363 -9.899 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -1.104 -12.987 -11.360 1.00 0.00 H new ATOM 0 HG2 GLU A 126 0.992 -13.438 -10.014 1.00 0.00 H new ATOM 0 HG3 GLU A 126 0.102 -12.981 -8.575 1.00 0.00 H new ATOM 1942 N GLU A 127 1.870 -10.776 -11.761 1.00 0.00 N ATOM 1943 CA GLU A 127 2.824 -10.789 -12.863 1.00 0.00 C ATOM 1944 C GLU A 127 4.156 -11.390 -12.423 1.00 0.00 C ATOM 1945 O GLU A 127 4.512 -11.341 -11.246 1.00 0.00 O ATOM 1946 CB GLU A 127 3.043 -9.371 -13.395 1.00 0.00 C ATOM 1947 CG GLU A 127 1.859 -8.824 -14.174 1.00 0.00 C ATOM 1948 CD GLU A 127 1.386 -9.772 -15.259 1.00 0.00 C ATOM 1949 OE1 GLU A 127 2.237 -10.476 -15.842 1.00 0.00 O ATOM 1950 OE2 GLU A 127 0.167 -9.809 -15.525 1.00 0.00 O ATOM 0 H GLU A 127 2.247 -10.426 -10.880 1.00 0.00 H new ATOM 0 HA GLU A 127 2.411 -11.408 -13.659 1.00 0.00 H new ATOM 0 HB2 GLU A 127 3.254 -8.706 -12.557 1.00 0.00 H new ATOM 0 HB3 GLU A 127 3.924 -9.365 -14.037 1.00 0.00 H new ATOM 0 HG2 GLU A 127 1.037 -8.626 -13.486 1.00 0.00 H new ATOM 0 HG3 GLU A 127 2.135 -7.871 -14.625 1.00 0.00 H new ATOM 1957 N ASP A 128 4.886 -11.958 -13.377 1.00 0.00 N ATOM 1958 CA ASP A 128 6.178 -12.569 -13.088 1.00 0.00 C ATOM 1959 C ASP A 128 7.205 -11.510 -12.699 1.00 0.00 C ATOM 1960 O ASP A 128 7.112 -10.357 -13.121 1.00 0.00 O ATOM 1961 CB ASP A 128 6.675 -13.357 -14.301 1.00 0.00 C ATOM 1962 CG ASP A 128 5.840 -14.593 -14.570 1.00 0.00 C ATOM 1963 OD1 ASP A 128 5.810 -15.490 -13.701 1.00 0.00 O ATOM 1964 OD2 ASP A 128 5.215 -14.664 -15.649 1.00 0.00 O ATOM 0 H ASP A 128 4.605 -12.008 -14.356 1.00 0.00 H new ATOM 0 HA ASP A 128 6.050 -13.251 -12.248 1.00 0.00 H new ATOM 0 HB2 ASP A 128 6.659 -12.713 -15.180 1.00 0.00 H new ATOM 0 HB3 ASP A 128 7.712 -13.651 -14.140 1.00 0.00 H new ATOM 1969 N TRP A 129 8.182 -11.908 -11.893 1.00 0.00 N ATOM 1970 CA TRP A 129 9.226 -10.993 -11.446 1.00 0.00 C ATOM 1971 C TRP A 129 9.959 -10.381 -12.635 1.00 0.00 C ATOM 1972 O TRP A 129 10.394 -9.232 -12.582 1.00 0.00 O ATOM 1973 CB TRP A 129 10.218 -11.722 -10.539 1.00 0.00 C ATOM 1974 CG TRP A 129 11.498 -10.969 -10.332 1.00 0.00 C ATOM 1975 CD1 TRP A 129 12.707 -11.235 -10.909 1.00 0.00 C ATOM 1976 CD2 TRP A 129 11.695 -9.829 -9.489 1.00 0.00 C ATOM 1977 NE1 TRP A 129 13.644 -10.329 -10.475 1.00 0.00 N ATOM 1978 CE2 TRP A 129 13.048 -9.455 -9.604 1.00 0.00 C ATOM 1979 CE3 TRP A 129 10.860 -9.086 -8.650 1.00 0.00 C ATOM 1980 CZ2 TRP A 129 13.583 -8.373 -8.910 1.00 0.00 C ATOM 1981 CZ3 TRP A 129 11.392 -8.012 -7.962 1.00 0.00 C ATOM 1982 CH2 TRP A 129 12.742 -7.663 -8.096 1.00 0.00 C ATOM 0 H TRP A 129 8.273 -12.859 -11.535 1.00 0.00 H new ATOM 0 HA TRP A 129 8.753 -10.189 -10.882 1.00 0.00 H new ATOM 0 HB2 TRP A 129 9.750 -11.902 -9.571 1.00 0.00 H new ATOM 0 HB3 TRP A 129 10.444 -12.697 -10.970 1.00 0.00 H new ATOM 0 HD1 TRP A 129 12.898 -12.039 -11.604 1.00 0.00 H new ATOM 0 HE1 TRP A 129 14.624 -10.310 -10.756 1.00 0.00 H new ATOM 0 HE3 TRP A 129 9.818 -9.347 -8.541 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 14.624 -8.104 -9.010 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 10.756 -7.432 -7.310 1.00 0.00 H new ATOM 0 HH2 TRP A 129 13.127 -6.817 -7.546 1.00 0.00 H new ATOM 1993 N GLU A 130 10.092 -11.158 -13.706 1.00 0.00 N ATOM 1994 CA GLU A 130 10.774 -10.691 -14.907 1.00 0.00 C ATOM 1995 C GLU A 130 9.913 -9.684 -15.665 1.00 0.00 C ATOM 1996 O GLU A 130 10.361 -9.072 -16.635 1.00 0.00 O ATOM 1997 CB GLU A 130 11.118 -11.872 -15.817 1.00 0.00 C ATOM 1998 CG GLU A 130 11.715 -13.057 -15.077 1.00 0.00 C ATOM 1999 CD GLU A 130 12.947 -13.614 -15.764 1.00 0.00 C ATOM 2000 OE1 GLU A 130 12.824 -14.076 -16.917 1.00 0.00 O ATOM 2001 OE2 GLU A 130 14.033 -13.587 -15.148 1.00 0.00 O ATOM 0 H GLU A 130 9.737 -12.112 -13.766 1.00 0.00 H new ATOM 0 HA GLU A 130 11.696 -10.197 -14.601 1.00 0.00 H new ATOM 0 HB2 GLU A 130 10.215 -12.195 -16.335 1.00 0.00 H new ATOM 0 HB3 GLU A 130 11.822 -11.539 -16.580 1.00 0.00 H new ATOM 0 HG2 GLU A 130 11.975 -12.754 -14.063 1.00 0.00 H new ATOM 0 HG3 GLU A 130 10.965 -13.843 -14.992 1.00 0.00 H new ATOM 2008 N THR A 131 8.673 -9.519 -15.216 1.00 0.00 N ATOM 2009 CA THR A 131 7.747 -8.589 -15.851 1.00 0.00 C ATOM 2010 C THR A 131 7.681 -7.271 -15.088 1.00 0.00 C ATOM 2011 O THR A 131 7.496 -6.208 -15.682 1.00 0.00 O ATOM 2012 CB THR A 131 6.330 -9.185 -15.948 1.00 0.00 C ATOM 2013 OG1 THR A 131 6.356 -10.384 -16.731 1.00 0.00 O ATOM 2014 CG2 THR A 131 5.365 -8.188 -16.571 1.00 0.00 C ATOM 0 H THR A 131 8.286 -10.018 -14.415 1.00 0.00 H new ATOM 0 HA THR A 131 8.125 -8.404 -16.857 1.00 0.00 H new ATOM 0 HB THR A 131 5.987 -9.417 -14.940 1.00 0.00 H new ATOM 0 HG1 THR A 131 5.452 -10.758 -16.787 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.371 -8.631 -16.629 1.00 0.00 H new ATOM 0 HG22 THR A 131 5.326 -7.288 -15.958 1.00 0.00 H new ATOM 0 HG23 THR A 131 5.706 -7.929 -17.573 1.00 0.00 H new ATOM 2022 N ILE A 132 7.834 -7.348 -13.770 1.00 0.00 N ATOM 2023 CA ILE A 132 7.793 -6.160 -12.927 1.00 0.00 C ATOM 2024 C ILE A 132 9.198 -5.647 -12.631 1.00 0.00 C ATOM 2025 O ILE A 132 9.378 -4.499 -12.224 1.00 0.00 O ATOM 2026 CB ILE A 132 7.069 -6.439 -11.596 1.00 0.00 C ATOM 2027 CG1 ILE A 132 5.714 -7.100 -11.856 1.00 0.00 C ATOM 2028 CG2 ILE A 132 6.893 -5.149 -10.808 1.00 0.00 C ATOM 2029 CD1 ILE A 132 5.193 -7.893 -10.678 1.00 0.00 C ATOM 0 H ILE A 132 7.987 -8.220 -13.264 1.00 0.00 H new ATOM 0 HA ILE A 132 7.240 -5.400 -13.479 1.00 0.00 H new ATOM 0 HB ILE A 132 7.678 -7.123 -11.005 1.00 0.00 H new ATOM 0 HG12 ILE A 132 4.987 -6.330 -12.116 1.00 0.00 H new ATOM 0 HG13 ILE A 132 5.801 -7.761 -12.719 1.00 0.00 H new ATOM 0 HG21 ILE A 132 6.380 -5.363 -9.870 1.00 0.00 H new ATOM 0 HG22 ILE A 132 7.871 -4.716 -10.596 1.00 0.00 H new ATOM 0 HG23 ILE A 132 6.302 -4.443 -11.392 1.00 0.00 H new ATOM 0 HD11 ILE A 132 4.229 -8.333 -10.934 1.00 0.00 H new ATOM 0 HD12 ILE A 132 5.900 -8.685 -10.431 1.00 0.00 H new ATOM 0 HD13 ILE A 132 5.074 -7.233 -9.819 1.00 0.00 H new ATOM 2041 N TYR A 133 10.191 -6.505 -12.840 1.00 0.00 N ATOM 2042 CA TYR A 133 11.581 -6.139 -12.595 1.00 0.00 C ATOM 2043 C TYR A 133 11.947 -4.859 -13.340 1.00 0.00 C ATOM 2044 O TYR A 133 12.397 -3.875 -12.752 1.00 0.00 O ATOM 2045 CB TYR A 133 12.512 -7.275 -13.022 1.00 0.00 C ATOM 2046 CG TYR A 133 13.880 -6.804 -13.460 1.00 0.00 C ATOM 2047 CD1 TYR A 133 14.623 -5.936 -12.669 1.00 0.00 C ATOM 2048 CD2 TYR A 133 14.430 -7.226 -14.664 1.00 0.00 C ATOM 2049 CE1 TYR A 133 15.874 -5.502 -13.065 1.00 0.00 C ATOM 2050 CE2 TYR A 133 15.680 -6.799 -15.067 1.00 0.00 C ATOM 2051 CZ TYR A 133 16.398 -5.937 -14.265 1.00 0.00 C ATOM 2052 OH TYR A 133 17.643 -5.508 -14.664 1.00 0.00 O ATOM 0 H TYR A 133 10.059 -7.458 -13.178 1.00 0.00 H new ATOM 0 HA TYR A 133 11.701 -5.962 -11.526 1.00 0.00 H new ATOM 0 HB2 TYR A 133 12.626 -7.972 -12.192 1.00 0.00 H new ATOM 0 HB3 TYR A 133 12.048 -7.826 -13.840 1.00 0.00 H new ATOM 0 HD1 TYR A 133 14.216 -5.595 -11.729 1.00 0.00 H new ATOM 0 HD2 TYR A 133 13.870 -7.900 -15.296 1.00 0.00 H new ATOM 0 HE1 TYR A 133 16.438 -4.826 -12.439 1.00 0.00 H new ATOM 0 HE2 TYR A 133 16.093 -7.138 -16.005 1.00 0.00 H new ATOM 0 HH TYR A 133 18.187 -6.280 -14.925 1.00 0.00 H new ATOM 2062 N PRO A 134 11.749 -4.870 -14.666 1.00 0.00 N ATOM 2063 CA PRO A 134 12.050 -3.719 -15.522 1.00 0.00 C ATOM 2064 C PRO A 134 11.391 -2.437 -15.022 1.00 0.00 C ATOM 2065 O PRO A 134 12.032 -1.389 -14.944 1.00 0.00 O ATOM 2066 CB PRO A 134 11.470 -4.124 -16.879 1.00 0.00 C ATOM 2067 CG PRO A 134 11.493 -5.613 -16.872 1.00 0.00 C ATOM 2068 CD PRO A 134 11.215 -6.009 -15.433 1.00 0.00 C ATOM 0 HA PRO A 134 13.117 -3.499 -15.548 1.00 0.00 H new ATOM 0 HB2 PRO A 134 10.456 -3.744 -17.005 1.00 0.00 H new ATOM 0 HB3 PRO A 134 12.065 -3.723 -17.699 1.00 0.00 H new ATOM 0 HG2 PRO A 134 10.739 -6.022 -17.545 1.00 0.00 H new ATOM 0 HG3 PRO A 134 12.458 -5.993 -17.206 1.00 0.00 H new ATOM 0 HD2 PRO A 134 10.150 -6.153 -15.253 1.00 0.00 H new ATOM 0 HD3 PRO A 134 11.712 -6.942 -15.168 1.00 0.00 H new ATOM 2076 N CYS A 135 10.109 -2.530 -14.685 1.00 0.00 N ATOM 2077 CA CYS A 135 9.363 -1.377 -14.192 1.00 0.00 C ATOM 2078 C CYS A 135 8.996 -1.554 -12.723 1.00 0.00 C ATOM 2079 O CYS A 135 7.818 -1.579 -12.365 1.00 0.00 O ATOM 2080 CB CYS A 135 8.098 -1.168 -15.025 1.00 0.00 C ATOM 2081 SG CYS A 135 8.377 -1.194 -16.812 1.00 0.00 S ATOM 0 H CYS A 135 9.565 -3.391 -14.744 1.00 0.00 H new ATOM 0 HA CYS A 135 10.000 -0.497 -14.285 1.00 0.00 H new ATOM 0 HB2 CYS A 135 7.376 -1.943 -14.770 1.00 0.00 H new ATOM 0 HB3 CYS A 135 7.650 -0.213 -14.752 1.00 0.00 H new ATOM 0 HG CYS A 135 7.248 -1.011 -17.430 1.00 0.00 H new ATOM 2087 N LEU A 136 10.011 -1.680 -11.876 1.00 0.00 N ATOM 2088 CA LEU A 136 9.796 -1.857 -10.444 1.00 0.00 C ATOM 2089 C LEU A 136 9.641 -0.510 -9.745 1.00 0.00 C ATOM 2090 O LEU A 136 9.907 0.539 -10.332 1.00 0.00 O ATOM 2091 CB LEU A 136 10.959 -2.634 -9.825 1.00 0.00 C ATOM 2092 CG LEU A 136 10.635 -4.042 -9.324 1.00 0.00 C ATOM 2093 CD1 LEU A 136 11.846 -4.656 -8.639 1.00 0.00 C ATOM 2094 CD2 LEU A 136 9.444 -4.010 -8.379 1.00 0.00 C ATOM 0 H LEU A 136 10.992 -1.663 -12.156 1.00 0.00 H new ATOM 0 HA LEU A 136 8.875 -2.424 -10.308 1.00 0.00 H new ATOM 0 HB2 LEU A 136 11.755 -2.708 -10.566 1.00 0.00 H new ATOM 0 HB3 LEU A 136 11.353 -2.055 -8.990 1.00 0.00 H new ATOM 0 HG LEU A 136 10.376 -4.662 -10.182 1.00 0.00 H new ATOM 0 HD11 LEU A 136 11.597 -5.658 -8.289 1.00 0.00 H new ATOM 0 HD12 LEU A 136 12.673 -4.714 -9.346 1.00 0.00 H new ATOM 0 HD13 LEU A 136 12.137 -4.037 -7.790 1.00 0.00 H new ATOM 0 HD21 LEU A 136 9.227 -5.020 -8.032 1.00 0.00 H new ATOM 0 HD22 LEU A 136 9.675 -3.375 -7.524 1.00 0.00 H new ATOM 0 HD23 LEU A 136 8.575 -3.612 -8.903 1.00 0.00 H new ATOM 2106 N SER A 137 9.210 -0.547 -8.488 1.00 0.00 N ATOM 2107 CA SER A 137 9.018 0.671 -7.710 1.00 0.00 C ATOM 2108 C SER A 137 10.196 0.907 -6.770 1.00 0.00 C ATOM 2109 O SER A 137 10.962 -0.003 -6.453 1.00 0.00 O ATOM 2110 CB SER A 137 7.719 0.589 -6.907 1.00 0.00 C ATOM 2111 OG SER A 137 7.922 0.997 -5.565 1.00 0.00 O ATOM 0 H SER A 137 8.987 -1.407 -7.987 1.00 0.00 H new ATOM 0 HA SER A 137 8.956 1.509 -8.404 1.00 0.00 H new ATOM 0 HB2 SER A 137 6.961 1.219 -7.371 1.00 0.00 H new ATOM 0 HB3 SER A 137 7.340 -0.433 -6.926 1.00 0.00 H new ATOM 0 HG SER A 137 7.893 0.214 -4.977 1.00 0.00 H new ATOM 2117 N PRO A 138 10.346 2.159 -6.312 1.00 0.00 N ATOM 2118 CA PRO A 138 11.428 2.545 -5.401 1.00 0.00 C ATOM 2119 C PRO A 138 11.251 1.952 -4.008 1.00 0.00 C ATOM 2120 O PRO A 138 10.304 2.284 -3.295 1.00 0.00 O ATOM 2121 CB PRO A 138 11.321 4.071 -5.350 1.00 0.00 C ATOM 2122 CG PRO A 138 9.898 4.362 -5.680 1.00 0.00 C ATOM 2123 CD PRO A 138 9.470 3.294 -6.648 1.00 0.00 C ATOM 0 HA PRO A 138 12.398 2.183 -5.743 1.00 0.00 H new ATOM 0 HB2 PRO A 138 11.585 4.454 -4.364 1.00 0.00 H new ATOM 0 HB3 PRO A 138 11.997 4.539 -6.065 1.00 0.00 H new ATOM 0 HG2 PRO A 138 9.279 4.347 -4.783 1.00 0.00 H new ATOM 0 HG3 PRO A 138 9.795 5.353 -6.122 1.00 0.00 H new ATOM 0 HD2 PRO A 138 8.417 3.039 -6.526 1.00 0.00 H new ATOM 0 HD3 PRO A 138 9.603 3.612 -7.682 1.00 0.00 H new ATOM 2131 N LYS A 139 12.170 1.071 -3.624 1.00 0.00 N ATOM 2132 CA LYS A 139 12.117 0.432 -2.315 1.00 0.00 C ATOM 2133 C LYS A 139 12.971 1.191 -1.304 1.00 0.00 C ATOM 2134 O LYS A 139 13.873 1.940 -1.678 1.00 0.00 O ATOM 2135 CB LYS A 139 12.594 -1.019 -2.413 1.00 0.00 C ATOM 2136 CG LYS A 139 11.529 -1.976 -2.919 1.00 0.00 C ATOM 2137 CD LYS A 139 12.115 -3.339 -3.250 1.00 0.00 C ATOM 2138 CE LYS A 139 11.036 -4.320 -3.680 1.00 0.00 C ATOM 2139 NZ LYS A 139 10.690 -4.168 -5.121 1.00 0.00 N ATOM 0 H LYS A 139 12.960 0.784 -4.202 1.00 0.00 H new ATOM 0 HA LYS A 139 11.082 0.446 -1.974 1.00 0.00 H new ATOM 0 HB2 LYS A 139 13.457 -1.065 -3.077 1.00 0.00 H new ATOM 0 HB3 LYS A 139 12.930 -1.349 -1.430 1.00 0.00 H new ATOM 0 HG2 LYS A 139 10.750 -2.087 -2.164 1.00 0.00 H new ATOM 0 HG3 LYS A 139 11.055 -1.558 -3.807 1.00 0.00 H new ATOM 0 HD2 LYS A 139 12.852 -3.236 -4.046 1.00 0.00 H new ATOM 0 HD3 LYS A 139 12.639 -3.732 -2.379 1.00 0.00 H new ATOM 0 HE2 LYS A 139 11.376 -5.339 -3.494 1.00 0.00 H new ATOM 0 HE3 LYS A 139 10.143 -4.166 -3.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 9.660 -4.060 -5.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 11.165 -3.327 -5.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 11.002 -5.011 -5.644 1.00 0.00 H new ATOM 2153 N SER A 140 12.681 0.991 -0.022 1.00 0.00 N ATOM 2154 CA SER A 140 13.421 1.659 1.042 1.00 0.00 C ATOM 2155 C SER A 140 13.788 0.676 2.149 1.00 0.00 C ATOM 2156 O SER A 140 12.928 0.229 2.907 1.00 0.00 O ATOM 2157 CB SER A 140 12.596 2.811 1.620 1.00 0.00 C ATOM 2158 OG SER A 140 13.087 3.202 2.890 1.00 0.00 O ATOM 0 H SER A 140 11.939 0.372 0.305 1.00 0.00 H new ATOM 0 HA SER A 140 14.341 2.058 0.615 1.00 0.00 H new ATOM 0 HB2 SER A 140 12.624 3.661 0.938 1.00 0.00 H new ATOM 0 HB3 SER A 140 11.553 2.507 1.708 1.00 0.00 H new ATOM 0 HG SER A 140 12.342 3.267 3.523 1.00 0.00 H new ATOM 2164 N GLY A 141 15.072 0.342 2.235 1.00 0.00 N ATOM 2165 CA GLY A 141 15.531 -0.586 3.251 1.00 0.00 C ATOM 2166 C GLY A 141 15.976 -1.912 2.666 1.00 0.00 C ATOM 2167 O GLY A 141 16.057 -2.082 1.449 1.00 0.00 O ATOM 0 H GLY A 141 15.803 0.698 1.619 1.00 0.00 H new ATOM 0 HA2 GLY A 141 16.359 -0.138 3.800 1.00 0.00 H new ATOM 0 HA3 GLY A 141 14.729 -0.760 3.969 1.00 0.00 H new ATOM 2171 N PRO A 142 16.274 -2.881 3.545 1.00 0.00 N ATOM 2172 CA PRO A 142 16.719 -4.215 3.132 1.00 0.00 C ATOM 2173 C PRO A 142 15.603 -5.020 2.474 1.00 0.00 C ATOM 2174 O PRO A 142 14.521 -4.498 2.209 1.00 0.00 O ATOM 2175 CB PRO A 142 17.146 -4.869 4.448 1.00 0.00 C ATOM 2176 CG PRO A 142 16.360 -4.161 5.496 1.00 0.00 C ATOM 2177 CD PRO A 142 16.199 -2.748 5.010 1.00 0.00 C ATOM 0 HA PRO A 142 17.513 -4.168 2.386 1.00 0.00 H new ATOM 0 HB2 PRO A 142 16.931 -5.938 4.447 1.00 0.00 H new ATOM 0 HB3 PRO A 142 18.218 -4.759 4.615 1.00 0.00 H new ATOM 0 HG2 PRO A 142 15.390 -4.636 5.643 1.00 0.00 H new ATOM 0 HG3 PRO A 142 16.877 -4.187 6.455 1.00 0.00 H new ATOM 0 HD2 PRO A 142 15.248 -2.320 5.327 1.00 0.00 H new ATOM 0 HD3 PRO A 142 16.985 -2.098 5.395 1.00 0.00 H new ATOM 2185 N SER A 143 15.875 -6.295 2.214 1.00 0.00 N ATOM 2186 CA SER A 143 14.894 -7.172 1.584 1.00 0.00 C ATOM 2187 C SER A 143 15.275 -8.637 1.773 1.00 0.00 C ATOM 2188 O SER A 143 16.281 -8.951 2.410 1.00 0.00 O ATOM 2189 CB SER A 143 14.777 -6.852 0.092 1.00 0.00 C ATOM 2190 OG SER A 143 15.865 -7.398 -0.634 1.00 0.00 O ATOM 0 H SER A 143 16.765 -6.744 2.429 1.00 0.00 H new ATOM 0 HA SER A 143 13.929 -7.001 2.062 1.00 0.00 H new ATOM 0 HB2 SER A 143 13.840 -7.251 -0.296 1.00 0.00 H new ATOM 0 HB3 SER A 143 14.747 -5.772 -0.050 1.00 0.00 H new ATOM 0 HG SER A 143 15.766 -7.181 -1.585 1.00 0.00 H new ATOM 2196 N SER A 144 14.463 -9.530 1.215 1.00 0.00 N ATOM 2197 CA SER A 144 14.711 -10.962 1.325 1.00 0.00 C ATOM 2198 C SER A 144 13.723 -11.752 0.473 1.00 0.00 C ATOM 2199 O SER A 144 12.698 -11.224 0.041 1.00 0.00 O ATOM 2200 CB SER A 144 14.613 -11.408 2.786 1.00 0.00 C ATOM 2201 OG SER A 144 13.551 -10.745 3.451 1.00 0.00 O ATOM 0 H SER A 144 13.628 -9.286 0.682 1.00 0.00 H new ATOM 0 HA SER A 144 15.718 -11.160 0.959 1.00 0.00 H new ATOM 0 HB2 SER A 144 14.458 -12.486 2.831 1.00 0.00 H new ATOM 0 HB3 SER A 144 15.553 -11.200 3.297 1.00 0.00 H new ATOM 0 HG SER A 144 13.508 -11.048 4.382 1.00 0.00 H new ATOM 2207 N GLY A 145 14.038 -13.022 0.235 1.00 0.00 N ATOM 2208 CA GLY A 145 13.168 -13.864 -0.565 1.00 0.00 C ATOM 2209 C GLY A 145 13.669 -15.292 -0.657 1.00 0.00 C ATOM 2210 O GLY A 145 12.996 -16.159 -1.214 1.00 0.00 O ATOM 0 H GLY A 145 14.880 -13.482 0.582 1.00 0.00 H new ATOM 0 HA2 GLY A 145 12.167 -13.860 -0.134 1.00 0.00 H new ATOM 0 HA3 GLY A 145 13.085 -13.446 -1.568 1.00 0.00 H new TER 2214 GLY A 145