USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1066 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 108 SER OG : rot -130:sc= 0 USER MOD Set 1.2: A 130 SER OG : rot 52:sc= 1.23 USER MOD Set 2.1: A 17 GLN : amide:sc= 1 K(o=2.6,f=-2.8) USER MOD Set 2.2: A 48 LYS NZ :NH3+ -153:sc= 1.56 (180deg=0.066) USER MOD Single : A 1 ALA N :NH3+ 158:sc= 1.03 (180deg=0.711) USER MOD Single : A 2 THR OG1 : rot 92:sc= 1.26 USER MOD Single : A 3 SER OG : rot 95:sc= 0.84 USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 169:sc= 1.22 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0.0058) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 ASN : amide:sc= -0.165 X(o=-0.17,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.0827) USER MOD Single : A 21 MET CE :methyl -112:sc= -0.0142 (180deg=-3.25!) USER MOD Single : A 25 ASN : amide:sc= -0.618 X(o=-0.62,f=-0.43) USER MOD Single : A 27 LYS NZ :NH3+ -149:sc= 0.841 (180deg=-0.122!) USER MOD Single : A 28 TYR OH : rot 30:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.0188 X(o=-0.019,f=0) USER MOD Single : A 35 SER OG : rot 180:sc= -0.265 USER MOD Single : A 42 SER OG : rot 180:sc= -0.0109 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 123:sc= 1.23 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 83:sc= 1.12 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -1.57 K(o=-1.6,f=-4.4!) USER MOD Single : A 59 LYS NZ :NH3+ 160:sc= -0.031 (180deg=-0.221) USER MOD Single : A 60 ASN : amide:sc= 0.943 K(o=0.94,f=-11!) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 TYR OH : rot 167:sc= 1.3 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 71:sc= 0.0486 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0.552 K(o=0.55,f=-0.0063) USER MOD Single : A 78 SER OG : rot -88:sc= 1.28 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -0.493 X(o=-0.49,f=-0.24) USER MOD Single : A 92 THR OG1 : rot 85:sc= 0.0457 USER MOD Single : A 93 THR OG1 : rot 100:sc= 0.365 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -0.1 X(o=-0.1,f=-0.3) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc=-0.00111 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= 0.295 K(o=0.3,f=-9.7!) USER MOD Single : A 116 ASN : amide:sc= 0.646 K(o=0.65,f=-0.015) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= 0.475 X(o=0.48,f=0) USER MOD Single : A 126 SER OG : rot -160:sc= 0.289 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot 137:sc= 0.116 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -4.267 -25.335 -1.241 1.00 0.00 N ATOM 2 CA ALA A 1 -4.698 -24.071 -0.633 1.00 0.00 C ATOM 3 C ALA A 1 -3.640 -23.612 0.357 1.00 0.00 C ATOM 4 O ALA A 1 -3.053 -24.439 1.057 1.00 0.00 O ATOM 5 CB ALA A 1 -6.047 -24.205 0.080 1.00 0.00 C ATOM 0 H1 ALA A 1 -5.095 -25.841 -1.614 1.00 0.00 H new ATOM 0 H2 ALA A 1 -3.603 -25.138 -2.017 1.00 0.00 H new ATOM 0 H3 ALA A 1 -3.796 -25.923 -0.523 1.00 0.00 H new ATOM 0 HA ALA A 1 -4.822 -23.337 -1.430 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -6.326 -23.245 0.515 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -6.808 -24.514 -0.637 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -5.968 -24.952 0.870 1.00 0.00 H new ATOM 11 N THR A 2 -3.427 -22.301 0.436 1.00 0.00 N ATOM 12 CA THR A 2 -2.821 -21.642 1.579 1.00 0.00 C ATOM 13 C THR A 2 -3.688 -20.403 1.826 1.00 0.00 C ATOM 14 O THR A 2 -4.342 -19.917 0.891 1.00 0.00 O ATOM 15 CB THR A 2 -1.354 -21.267 1.275 1.00 0.00 C ATOM 16 OG1 THR A 2 -0.627 -22.323 0.675 1.00 0.00 O ATOM 17 CG2 THR A 2 -0.578 -20.885 2.541 1.00 0.00 C ATOM 0 H THR A 2 -3.679 -21.656 -0.313 1.00 0.00 H new ATOM 0 HA THR A 2 -2.785 -22.282 2.461 1.00 0.00 H new ATOM 0 HB THR A 2 -1.434 -20.422 0.591 1.00 0.00 H new ATOM 0 HG1 THR A 2 -0.686 -22.248 -0.300 1.00 0.00 H new ATOM 0 HG21 THR A 2 0.448 -20.630 2.276 1.00 0.00 H new ATOM 0 HG22 THR A 2 -1.055 -20.027 3.015 1.00 0.00 H new ATOM 0 HG23 THR A 2 -0.575 -21.727 3.234 1.00 0.00 H new ATOM 25 N SER A 3 -3.669 -19.844 3.035 1.00 0.00 N ATOM 26 CA SER A 3 -4.183 -18.508 3.253 1.00 0.00 C ATOM 27 C SER A 3 -3.108 -17.735 3.987 1.00 0.00 C ATOM 28 O SER A 3 -2.854 -17.955 5.168 1.00 0.00 O ATOM 29 CB SER A 3 -5.554 -18.569 3.940 1.00 0.00 C ATOM 30 OG SER A 3 -5.681 -19.646 4.855 1.00 0.00 O ATOM 0 H SER A 3 -3.303 -20.300 3.871 1.00 0.00 H new ATOM 0 HA SER A 3 -4.387 -17.972 2.326 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.729 -17.632 4.468 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.329 -18.656 3.179 1.00 0.00 H new ATOM 0 HG SER A 3 -5.475 -19.332 5.760 1.00 0.00 H new ATOM 36 N THR A 4 -2.442 -16.844 3.264 1.00 0.00 N ATOM 37 CA THR A 4 -1.221 -16.220 3.729 1.00 0.00 C ATOM 38 C THR A 4 -1.564 -14.790 4.086 1.00 0.00 C ATOM 39 O THR A 4 -2.171 -14.080 3.283 1.00 0.00 O ATOM 40 CB THR A 4 -0.138 -16.318 2.662 1.00 0.00 C ATOM 41 OG1 THR A 4 -0.203 -17.551 1.962 1.00 0.00 O ATOM 42 CG2 THR A 4 1.248 -16.197 3.271 1.00 0.00 C ATOM 0 H THR A 4 -2.738 -16.537 2.338 1.00 0.00 H new ATOM 0 HA THR A 4 -0.819 -16.723 4.608 1.00 0.00 H new ATOM 0 HB THR A 4 -0.315 -15.494 1.971 1.00 0.00 H new ATOM 0 HG1 THR A 4 0.504 -17.580 1.284 1.00 0.00 H new ATOM 0 HG21 THR A 4 1.999 -16.271 2.484 1.00 0.00 H new ATOM 0 HG22 THR A 4 1.342 -15.234 3.773 1.00 0.00 H new ATOM 0 HG23 THR A 4 1.399 -16.999 3.993 1.00 0.00 H new ATOM 50 N VAL A 5 -1.267 -14.395 5.315 1.00 0.00 N ATOM 51 CA VAL A 5 -2.038 -13.369 5.977 1.00 0.00 C ATOM 52 C VAL A 5 -1.069 -12.296 6.443 1.00 0.00 C ATOM 53 O VAL A 5 -0.316 -12.507 7.390 1.00 0.00 O ATOM 54 CB VAL A 5 -2.919 -14.079 7.017 1.00 0.00 C ATOM 55 CG1 VAL A 5 -2.185 -15.015 7.996 1.00 0.00 C ATOM 56 CG2 VAL A 5 -3.786 -13.059 7.730 1.00 0.00 C ATOM 0 H VAL A 5 -0.498 -14.772 5.868 1.00 0.00 H new ATOM 0 HA VAL A 5 -2.745 -12.818 5.357 1.00 0.00 H new ATOM 0 HB VAL A 5 -3.546 -14.770 6.454 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -2.905 -15.460 8.683 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -1.681 -15.804 7.437 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -1.449 -14.444 8.562 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -4.410 -13.564 8.467 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -3.151 -12.329 8.231 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -4.421 -12.550 7.004 1.00 0.00 H new ATOM 66 N THR A 6 -0.986 -11.206 5.679 1.00 0.00 N ATOM 67 CA THR A 6 0.178 -10.341 5.643 1.00 0.00 C ATOM 68 C THR A 6 -0.259 -8.878 5.706 1.00 0.00 C ATOM 69 O THR A 6 -1.108 -8.419 4.934 1.00 0.00 O ATOM 70 CB THR A 6 1.031 -10.668 4.402 1.00 0.00 C ATOM 71 OG1 THR A 6 0.340 -10.577 3.175 1.00 0.00 O ATOM 72 CG2 THR A 6 1.617 -12.087 4.442 1.00 0.00 C ATOM 0 H THR A 6 -1.739 -10.901 5.062 1.00 0.00 H new ATOM 0 HA THR A 6 0.809 -10.517 6.515 1.00 0.00 H new ATOM 0 HB THR A 6 1.809 -9.906 4.447 1.00 0.00 H new ATOM 0 HG1 THR A 6 0.981 -10.619 2.435 1.00 0.00 H new ATOM 0 HG21 THR A 6 2.208 -12.262 3.543 1.00 0.00 H new ATOM 0 HG22 THR A 6 2.253 -12.193 5.321 1.00 0.00 H new ATOM 0 HG23 THR A 6 0.806 -12.814 4.490 1.00 0.00 H new ATOM 80 N GLY A 7 0.341 -8.116 6.615 1.00 0.00 N ATOM 81 CA GLY A 7 -0.011 -6.725 6.844 1.00 0.00 C ATOM 82 C GLY A 7 0.846 -6.146 7.956 1.00 0.00 C ATOM 83 O GLY A 7 1.725 -6.832 8.495 1.00 0.00 O ATOM 0 H GLY A 7 1.092 -8.453 7.217 1.00 0.00 H new ATOM 0 HA2 GLY A 7 0.131 -6.151 5.929 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -1.065 -6.648 7.109 1.00 0.00 H new ATOM 87 N GLY A 8 0.591 -4.884 8.295 1.00 0.00 N ATOM 88 CA GLY A 8 1.390 -4.147 9.252 1.00 0.00 C ATOM 89 C GLY A 8 1.189 -2.650 9.090 1.00 0.00 C ATOM 90 O GLY A 8 0.231 -2.193 8.463 1.00 0.00 O ATOM 0 H GLY A 8 -0.184 -4.346 7.906 1.00 0.00 H new ATOM 0 HA2 GLY A 8 1.119 -4.446 10.264 1.00 0.00 H new ATOM 0 HA3 GLY A 8 2.443 -4.393 9.118 1.00 0.00 H new ATOM 94 N TYR A 9 2.104 -1.883 9.674 1.00 0.00 N ATOM 95 CA TYR A 9 2.092 -0.424 9.630 1.00 0.00 C ATOM 96 C TYR A 9 2.946 0.063 8.466 1.00 0.00 C ATOM 97 O TYR A 9 3.834 -0.670 8.017 1.00 0.00 O ATOM 98 CB TYR A 9 2.597 0.148 10.962 1.00 0.00 C ATOM 99 CG TYR A 9 1.466 0.455 11.919 1.00 0.00 C ATOM 100 CD1 TYR A 9 0.992 -0.515 12.822 1.00 0.00 C ATOM 101 CD2 TYR A 9 0.834 1.707 11.841 1.00 0.00 C ATOM 102 CE1 TYR A 9 -0.126 -0.236 13.631 1.00 0.00 C ATOM 103 CE2 TYR A 9 -0.286 1.987 12.635 1.00 0.00 C ATOM 104 CZ TYR A 9 -0.784 1.010 13.519 1.00 0.00 C ATOM 105 OH TYR A 9 -1.933 1.252 14.206 1.00 0.00 O ATOM 0 H TYR A 9 2.889 -2.265 10.201 1.00 0.00 H new ATOM 0 HA TYR A 9 1.071 -0.074 9.478 1.00 0.00 H new ATOM 0 HB2 TYR A 9 3.279 -0.564 11.426 1.00 0.00 H new ATOM 0 HB3 TYR A 9 3.167 1.058 10.772 1.00 0.00 H new ATOM 0 HD1 TYR A 9 1.486 -1.473 12.894 1.00 0.00 H new ATOM 0 HD2 TYR A 9 1.214 2.459 11.165 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -0.480 -0.973 14.336 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -0.767 2.952 12.569 1.00 0.00 H new ATOM 0 HH TYR A 9 -2.246 2.160 14.010 1.00 0.00 H new ATOM 115 N ALA A 10 2.701 1.295 8.006 1.00 0.00 N ATOM 116 CA ALA A 10 3.585 2.010 7.093 1.00 0.00 C ATOM 117 C ALA A 10 3.949 3.375 7.689 1.00 0.00 C ATOM 118 O ALA A 10 3.319 3.813 8.656 1.00 0.00 O ATOM 119 CB ALA A 10 2.883 2.167 5.742 1.00 0.00 C ATOM 0 H ALA A 10 1.870 1.827 8.264 1.00 0.00 H new ATOM 0 HA ALA A 10 4.508 1.449 6.946 1.00 0.00 H new ATOM 0 HB1 ALA A 10 3.537 2.701 5.052 1.00 0.00 H new ATOM 0 HB2 ALA A 10 2.653 1.182 5.335 1.00 0.00 H new ATOM 0 HB3 ALA A 10 1.959 2.730 5.875 1.00 0.00 H new ATOM 125 N GLN A 11 4.922 4.060 7.088 1.00 0.00 N ATOM 126 CA GLN A 11 5.340 5.408 7.441 1.00 0.00 C ATOM 127 C GLN A 11 5.618 6.130 6.126 1.00 0.00 C ATOM 128 O GLN A 11 6.654 5.893 5.501 1.00 0.00 O ATOM 129 CB GLN A 11 6.582 5.306 8.351 1.00 0.00 C ATOM 130 CG GLN A 11 7.126 6.642 8.895 1.00 0.00 C ATOM 131 CD GLN A 11 8.352 6.426 9.792 1.00 0.00 C ATOM 132 OE1 GLN A 11 9.480 6.801 9.480 1.00 0.00 O ATOM 133 NE2 GLN A 11 8.183 5.763 10.923 1.00 0.00 N ATOM 0 H GLN A 11 5.459 3.672 6.312 1.00 0.00 H new ATOM 0 HA GLN A 11 4.586 5.967 7.995 1.00 0.00 H new ATOM 0 HB2 GLN A 11 6.338 4.663 9.197 1.00 0.00 H new ATOM 0 HB3 GLN A 11 7.378 4.811 7.794 1.00 0.00 H new ATOM 0 HG2 GLN A 11 7.393 7.293 8.063 1.00 0.00 H new ATOM 0 HG3 GLN A 11 6.345 7.151 9.460 1.00 0.00 H new ATOM 0 HE21 GLN A 11 7.252 5.446 11.194 1.00 0.00 H new ATOM 0 HE22 GLN A 11 8.983 5.569 11.525 1.00 0.00 H new ATOM 142 N SER A 12 4.704 7.000 5.697 1.00 0.00 N ATOM 143 CA SER A 12 4.931 7.870 4.556 1.00 0.00 C ATOM 144 C SER A 12 5.542 9.132 5.137 1.00 0.00 C ATOM 145 O SER A 12 4.875 9.806 5.918 1.00 0.00 O ATOM 146 CB SER A 12 3.613 8.133 3.812 1.00 0.00 C ATOM 147 OG SER A 12 3.847 8.546 2.476 1.00 0.00 O ATOM 0 H SER A 12 3.789 7.117 6.133 1.00 0.00 H new ATOM 0 HA SER A 12 5.596 7.431 3.812 1.00 0.00 H new ATOM 0 HB2 SER A 12 3.006 7.228 3.814 1.00 0.00 H new ATOM 0 HB3 SER A 12 3.044 8.900 4.337 1.00 0.00 H new ATOM 0 HG SER A 12 2.990 8.704 2.028 1.00 0.00 H new ATOM 153 N ASP A 13 6.788 9.430 4.778 1.00 0.00 N ATOM 154 CA ASP A 13 7.467 10.661 5.180 1.00 0.00 C ATOM 155 C ASP A 13 7.452 11.591 3.973 1.00 0.00 C ATOM 156 O ASP A 13 7.315 11.124 2.834 1.00 0.00 O ATOM 157 CB ASP A 13 8.945 10.401 5.515 1.00 0.00 C ATOM 158 CG ASP A 13 9.193 9.575 6.769 1.00 0.00 C ATOM 159 OD1 ASP A 13 8.691 9.926 7.862 1.00 0.00 O ATOM 160 OD2 ASP A 13 9.954 8.593 6.654 1.00 0.00 O ATOM 0 H ASP A 13 7.360 8.819 4.195 1.00 0.00 H new ATOM 0 HA ASP A 13 6.965 11.074 6.055 1.00 0.00 H new ATOM 0 HB2 ASP A 13 9.408 9.894 4.669 1.00 0.00 H new ATOM 0 HB3 ASP A 13 9.449 11.361 5.627 1.00 0.00 H new ATOM 165 N ALA A 14 7.662 12.887 4.198 1.00 0.00 N ATOM 166 CA ALA A 14 7.861 13.897 3.169 1.00 0.00 C ATOM 167 C ALA A 14 9.033 14.792 3.566 1.00 0.00 C ATOM 168 O ALA A 14 9.257 15.010 4.760 1.00 0.00 O ATOM 169 CB ALA A 14 6.592 14.753 3.052 1.00 0.00 C ATOM 0 H ALA A 14 7.699 13.274 5.141 1.00 0.00 H new ATOM 0 HA ALA A 14 8.071 13.415 2.214 1.00 0.00 H new ATOM 0 HB1 ALA A 14 6.735 15.512 2.283 1.00 0.00 H new ATOM 0 HB2 ALA A 14 5.748 14.118 2.783 1.00 0.00 H new ATOM 0 HB3 ALA A 14 6.391 15.238 4.007 1.00 0.00 H new ATOM 175 N GLN A 15 9.694 15.407 2.580 1.00 0.00 N ATOM 176 CA GLN A 15 10.625 16.520 2.765 1.00 0.00 C ATOM 177 C GLN A 15 9.894 17.726 3.384 1.00 0.00 C ATOM 178 O GLN A 15 9.531 18.666 2.672 1.00 0.00 O ATOM 179 CB GLN A 15 11.241 16.908 1.405 1.00 0.00 C ATOM 180 CG GLN A 15 12.309 15.945 0.872 1.00 0.00 C ATOM 181 CD GLN A 15 12.497 16.088 -0.640 1.00 0.00 C ATOM 182 OE1 GLN A 15 12.306 17.160 -1.212 1.00 0.00 O ATOM 183 NE2 GLN A 15 12.846 15.010 -1.319 1.00 0.00 N ATOM 0 H GLN A 15 9.591 15.134 1.603 1.00 0.00 H new ATOM 0 HA GLN A 15 11.421 16.214 3.443 1.00 0.00 H new ATOM 0 HB2 GLN A 15 10.440 16.980 0.669 1.00 0.00 H new ATOM 0 HB3 GLN A 15 11.682 17.901 1.494 1.00 0.00 H new ATOM 0 HG2 GLN A 15 13.256 16.137 1.376 1.00 0.00 H new ATOM 0 HG3 GLN A 15 12.025 14.920 1.108 1.00 0.00 H new ATOM 0 HE21 GLN A 15 13.001 14.128 -0.831 1.00 0.00 H new ATOM 0 HE22 GLN A 15 12.960 15.060 -2.331 1.00 0.00 H new ATOM 192 N GLY A 16 9.681 17.712 4.698 1.00 0.00 N ATOM 193 CA GLY A 16 9.041 18.773 5.460 1.00 0.00 C ATOM 194 C GLY A 16 8.375 18.203 6.707 1.00 0.00 C ATOM 195 O GLY A 16 8.384 18.847 7.762 1.00 0.00 O ATOM 0 H GLY A 16 9.963 16.925 5.283 1.00 0.00 H new ATOM 0 HA2 GLY A 16 9.780 19.522 5.745 1.00 0.00 H new ATOM 0 HA3 GLY A 16 8.298 19.277 4.841 1.00 0.00 H new ATOM 199 N GLN A 17 7.850 16.979 6.615 1.00 0.00 N ATOM 200 CA GLN A 17 7.274 16.239 7.721 1.00 0.00 C ATOM 201 C GLN A 17 7.650 14.774 7.542 1.00 0.00 C ATOM 202 O GLN A 17 6.974 14.020 6.844 1.00 0.00 O ATOM 203 CB GLN A 17 5.748 16.448 7.790 1.00 0.00 C ATOM 204 CG GLN A 17 5.427 17.777 8.485 1.00 0.00 C ATOM 205 CD GLN A 17 3.941 18.093 8.588 1.00 0.00 C ATOM 206 OE1 GLN A 17 3.098 17.202 8.673 1.00 0.00 O ATOM 207 NE2 GLN A 17 3.593 19.368 8.564 1.00 0.00 N ATOM 0 H GLN A 17 7.817 16.465 5.734 1.00 0.00 H new ATOM 0 HA GLN A 17 7.667 16.599 8.672 1.00 0.00 H new ATOM 0 HB2 GLN A 17 5.327 16.444 6.785 1.00 0.00 H new ATOM 0 HB3 GLN A 17 5.285 15.624 8.333 1.00 0.00 H new ATOM 0 HG2 GLN A 17 5.852 17.760 9.488 1.00 0.00 H new ATOM 0 HG3 GLN A 17 5.920 18.584 7.944 1.00 0.00 H new ATOM 0 HE21 GLN A 17 4.309 20.091 8.493 1.00 0.00 H new ATOM 0 HE22 GLN A 17 2.608 19.629 8.616 1.00 0.00 H new ATOM 216 N MET A 18 8.711 14.356 8.222 1.00 0.00 N ATOM 217 CA MET A 18 9.037 12.956 8.431 1.00 0.00 C ATOM 218 C MET A 18 8.320 12.529 9.702 1.00 0.00 C ATOM 219 O MET A 18 8.923 12.335 10.759 1.00 0.00 O ATOM 220 CB MET A 18 10.551 12.726 8.501 1.00 0.00 C ATOM 221 CG MET A 18 11.247 13.149 7.207 1.00 0.00 C ATOM 222 SD MET A 18 12.600 12.050 6.740 1.00 0.00 S ATOM 223 CE MET A 18 13.246 13.004 5.358 1.00 0.00 C ATOM 0 H MET A 18 9.380 14.996 8.651 1.00 0.00 H new ATOM 0 HA MET A 18 8.704 12.348 7.590 1.00 0.00 H new ATOM 0 HB2 MET A 18 10.966 13.287 9.338 1.00 0.00 H new ATOM 0 HB3 MET A 18 10.751 11.672 8.694 1.00 0.00 H new ATOM 0 HG2 MET A 18 10.515 13.177 6.400 1.00 0.00 H new ATOM 0 HG3 MET A 18 11.633 14.162 7.323 1.00 0.00 H new ATOM 0 HE1 MET A 18 14.101 12.485 4.925 1.00 0.00 H new ATOM 0 HE2 MET A 18 12.470 13.119 4.601 1.00 0.00 H new ATOM 0 HE3 MET A 18 13.558 13.987 5.709 1.00 0.00 H new ATOM 233 N ASN A 19 6.995 12.491 9.611 1.00 0.00 N ATOM 234 CA ASN A 19 6.094 11.912 10.601 1.00 0.00 C ATOM 235 C ASN A 19 5.457 10.704 9.928 1.00 0.00 C ATOM 236 O ASN A 19 5.445 10.622 8.701 1.00 0.00 O ATOM 237 CB ASN A 19 4.990 12.912 11.012 1.00 0.00 C ATOM 238 CG ASN A 19 5.521 14.121 11.775 1.00 0.00 C ATOM 239 OD1 ASN A 19 5.242 14.334 12.949 1.00 0.00 O ATOM 240 ND2 ASN A 19 6.242 15.001 11.102 1.00 0.00 N ATOM 0 H ASN A 19 6.498 12.880 8.810 1.00 0.00 H new ATOM 0 HA ASN A 19 6.640 11.646 11.506 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.470 13.256 10.118 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.255 12.396 11.630 1.00 0.00 H new ATOM 0 HD21 ASN A 19 6.564 15.854 11.560 1.00 0.00 H new ATOM 0 HD22 ASN A 19 6.476 14.827 10.125 1.00 0.00 H new ATOM 247 N LYS A 20 4.812 9.830 10.700 1.00 0.00 N ATOM 248 CA LYS A 20 3.924 8.828 10.124 1.00 0.00 C ATOM 249 C LYS A 20 2.700 9.579 9.646 1.00 0.00 C ATOM 250 O LYS A 20 1.798 9.852 10.442 1.00 0.00 O ATOM 251 CB LYS A 20 3.540 7.692 11.096 1.00 0.00 C ATOM 252 CG LYS A 20 2.580 6.703 10.402 1.00 0.00 C ATOM 253 CD LYS A 20 2.090 5.523 11.248 1.00 0.00 C ATOM 254 CE LYS A 20 1.063 5.908 12.322 1.00 0.00 C ATOM 255 NZ LYS A 20 1.684 6.174 13.636 1.00 0.00 N ATOM 0 H LYS A 20 4.888 9.797 11.717 1.00 0.00 H new ATOM 0 HA LYS A 20 4.438 8.315 9.311 1.00 0.00 H new ATOM 0 HB2 LYS A 20 4.436 7.168 11.428 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.066 8.108 11.985 1.00 0.00 H new ATOM 0 HG2 LYS A 20 1.709 7.259 10.054 1.00 0.00 H new ATOM 0 HG3 LYS A 20 3.079 6.306 9.518 1.00 0.00 H new ATOM 0 HD2 LYS A 20 1.648 4.776 10.589 1.00 0.00 H new ATOM 0 HD3 LYS A 20 2.948 5.055 11.731 1.00 0.00 H new ATOM 0 HE2 LYS A 20 0.518 6.794 11.996 1.00 0.00 H new ATOM 0 HE3 LYS A 20 0.333 5.105 12.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 1.065 6.797 14.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 1.820 5.277 14.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 2.605 6.636 13.497 1.00 0.00 H new ATOM 269 N MET A 21 2.652 9.876 8.359 1.00 0.00 N ATOM 270 CA MET A 21 1.404 9.907 7.637 1.00 0.00 C ATOM 271 C MET A 21 1.117 8.465 7.248 1.00 0.00 C ATOM 272 O MET A 21 1.933 7.851 6.555 1.00 0.00 O ATOM 273 CB MET A 21 1.558 10.817 6.424 1.00 0.00 C ATOM 274 CG MET A 21 1.414 12.282 6.846 1.00 0.00 C ATOM 275 SD MET A 21 2.837 13.065 7.651 1.00 0.00 S ATOM 276 CE MET A 21 4.045 13.019 6.298 1.00 0.00 C ATOM 0 H MET A 21 3.472 10.100 7.795 1.00 0.00 H new ATOM 0 HA MET A 21 0.576 10.304 8.224 1.00 0.00 H new ATOM 0 HB2 MET A 21 2.532 10.658 5.961 1.00 0.00 H new ATOM 0 HB3 MET A 21 0.805 10.570 5.676 1.00 0.00 H new ATOM 0 HG2 MET A 21 1.167 12.865 5.959 1.00 0.00 H new ATOM 0 HG3 MET A 21 0.563 12.355 7.523 1.00 0.00 H new ATOM 0 HE1 MET A 21 4.848 12.327 6.551 1.00 0.00 H new ATOM 0 HE2 MET A 21 3.554 12.686 5.383 1.00 0.00 H new ATOM 0 HE3 MET A 21 4.459 14.016 6.146 1.00 0.00 H new ATOM 286 N GLY A 22 0.016 7.883 7.728 1.00 0.00 N ATOM 287 CA GLY A 22 -0.272 6.486 7.452 1.00 0.00 C ATOM 288 C GLY A 22 -1.554 5.991 8.095 1.00 0.00 C ATOM 289 O GLY A 22 -2.452 6.773 8.424 1.00 0.00 O ATOM 0 H GLY A 22 -0.680 8.357 8.303 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -0.338 6.344 6.373 1.00 0.00 H new ATOM 0 HA3 GLY A 22 0.560 5.876 7.804 1.00 0.00 H new ATOM 293 N GLY A 23 -1.645 4.668 8.215 1.00 0.00 N ATOM 294 CA GLY A 23 -2.806 3.965 8.718 1.00 0.00 C ATOM 295 C GLY A 23 -2.380 2.539 9.022 1.00 0.00 C ATOM 296 O GLY A 23 -1.485 2.341 9.837 1.00 0.00 O ATOM 0 H GLY A 23 -0.883 4.042 7.954 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -3.189 4.450 9.616 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -3.610 3.976 7.982 1.00 0.00 H new ATOM 300 N PHE A 24 -2.979 1.551 8.368 1.00 0.00 N ATOM 301 CA PHE A 24 -2.730 0.138 8.602 1.00 0.00 C ATOM 302 C PHE A 24 -2.930 -0.583 7.271 1.00 0.00 C ATOM 303 O PHE A 24 -3.957 -0.373 6.618 1.00 0.00 O ATOM 304 CB PHE A 24 -3.712 -0.359 9.673 1.00 0.00 C ATOM 305 CG PHE A 24 -3.323 -1.668 10.326 1.00 0.00 C ATOM 306 CD1 PHE A 24 -3.544 -2.891 9.664 1.00 0.00 C ATOM 307 CD2 PHE A 24 -2.773 -1.665 11.623 1.00 0.00 C ATOM 308 CE1 PHE A 24 -3.230 -4.104 10.301 1.00 0.00 C ATOM 309 CE2 PHE A 24 -2.470 -2.877 12.266 1.00 0.00 C ATOM 310 CZ PHE A 24 -2.708 -4.095 11.608 1.00 0.00 C ATOM 0 H PHE A 24 -3.672 1.719 7.639 1.00 0.00 H new ATOM 0 HA PHE A 24 -1.719 -0.051 8.962 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.803 0.404 10.446 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -4.697 -0.473 9.220 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -3.955 -2.897 8.665 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -2.584 -0.728 12.125 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -3.389 -5.041 9.788 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -2.055 -2.872 13.263 1.00 0.00 H new ATOM 0 HZ PHE A 24 -2.490 -5.028 12.107 1.00 0.00 H new ATOM 320 N ASN A 25 -1.971 -1.412 6.864 1.00 0.00 N ATOM 321 CA ASN A 25 -1.972 -2.081 5.571 1.00 0.00 C ATOM 322 C ASN A 25 -2.548 -3.481 5.734 1.00 0.00 C ATOM 323 O ASN A 25 -2.220 -4.183 6.695 1.00 0.00 O ATOM 324 CB ASN A 25 -0.539 -2.199 5.030 1.00 0.00 C ATOM 325 CG ASN A 25 -0.508 -3.027 3.751 1.00 0.00 C ATOM 326 OD1 ASN A 25 -0.257 -4.227 3.778 1.00 0.00 O ATOM 327 ND2 ASN A 25 -0.793 -2.421 2.612 1.00 0.00 N ATOM 0 H ASN A 25 -1.158 -1.640 7.436 1.00 0.00 H new ATOM 0 HA ASN A 25 -2.574 -1.499 4.873 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -0.137 -1.205 4.835 1.00 0.00 H new ATOM 0 HB3 ASN A 25 0.101 -2.660 5.782 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -0.806 -2.952 1.741 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -1.000 -1.422 2.604 1.00 0.00 H new ATOM 334 N LEU A 26 -3.364 -3.889 4.765 1.00 0.00 N ATOM 335 CA LEU A 26 -3.959 -5.209 4.658 1.00 0.00 C ATOM 336 C LEU A 26 -3.752 -5.652 3.208 1.00 0.00 C ATOM 337 O LEU A 26 -3.872 -4.840 2.281 1.00 0.00 O ATOM 338 CB LEU A 26 -5.452 -5.111 5.049 1.00 0.00 C ATOM 339 CG LEU A 26 -6.105 -6.335 5.716 1.00 0.00 C ATOM 340 CD1 LEU A 26 -6.035 -7.608 4.876 1.00 0.00 C ATOM 341 CD2 LEU A 26 -5.521 -6.597 7.110 1.00 0.00 C ATOM 0 H LEU A 26 -3.638 -3.275 3.998 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.507 -5.943 5.325 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.566 -4.262 5.724 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -6.019 -4.880 4.147 1.00 0.00 H new ATOM 0 HG LEU A 26 -7.160 -6.075 5.809 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -6.516 -8.425 5.413 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -6.547 -7.447 3.927 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -4.992 -7.862 4.687 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -6.006 -7.468 7.550 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -4.450 -6.781 7.027 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -5.691 -5.728 7.745 1.00 0.00 H new ATOM 353 N LYS A 27 -3.436 -6.928 2.996 1.00 0.00 N ATOM 354 CA LYS A 27 -3.321 -7.562 1.687 1.00 0.00 C ATOM 355 C LYS A 27 -4.039 -8.909 1.764 1.00 0.00 C ATOM 356 O LYS A 27 -4.176 -9.464 2.860 1.00 0.00 O ATOM 357 CB LYS A 27 -1.826 -7.710 1.350 1.00 0.00 C ATOM 358 CG LYS A 27 -1.512 -8.225 -0.064 1.00 0.00 C ATOM 359 CD LYS A 27 -0.029 -8.575 -0.245 1.00 0.00 C ATOM 360 CE LYS A 27 0.918 -7.369 -0.209 1.00 0.00 C ATOM 361 NZ LYS A 27 1.814 -7.391 0.968 1.00 0.00 N ATOM 0 H LYS A 27 -3.246 -7.573 3.763 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.780 -6.971 0.894 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -1.345 -6.740 1.479 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -1.374 -8.389 2.073 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -2.118 -9.108 -0.269 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -1.795 -7.467 -0.795 1.00 0.00 H new ATOM 0 HD2 LYS A 27 0.264 -9.275 0.538 1.00 0.00 H new ATOM 0 HD3 LYS A 27 0.096 -9.091 -1.197 1.00 0.00 H new ATOM 0 HE2 LYS A 27 1.518 -7.354 -1.119 1.00 0.00 H new ATOM 0 HE3 LYS A 27 0.332 -6.450 -0.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 2.034 -6.416 1.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 1.344 -7.886 1.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 2.695 -7.887 0.724 1.00 0.00 H new ATOM 375 N TYR A 28 -4.479 -9.444 0.628 1.00 0.00 N ATOM 376 CA TYR A 28 -4.867 -10.839 0.505 1.00 0.00 C ATOM 377 C TYR A 28 -4.116 -11.411 -0.694 1.00 0.00 C ATOM 378 O TYR A 28 -3.956 -10.722 -1.712 1.00 0.00 O ATOM 379 CB TYR A 28 -6.396 -10.974 0.400 1.00 0.00 C ATOM 380 CG TYR A 28 -7.004 -10.632 -0.952 1.00 0.00 C ATOM 381 CD1 TYR A 28 -7.312 -9.299 -1.291 1.00 0.00 C ATOM 382 CD2 TYR A 28 -7.264 -11.664 -1.875 1.00 0.00 C ATOM 383 CE1 TYR A 28 -7.883 -9.000 -2.543 1.00 0.00 C ATOM 384 CE2 TYR A 28 -7.816 -11.369 -3.133 1.00 0.00 C ATOM 385 CZ TYR A 28 -8.131 -10.037 -3.473 1.00 0.00 C ATOM 386 OH TYR A 28 -8.686 -9.770 -4.685 1.00 0.00 O ATOM 0 H TYR A 28 -4.576 -8.914 -0.238 1.00 0.00 H new ATOM 0 HA TYR A 28 -4.597 -11.412 1.392 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -6.668 -11.999 0.650 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -6.850 -10.331 1.154 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -7.109 -8.504 -0.588 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -7.038 -12.687 -1.614 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -8.132 -7.979 -2.793 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -7.999 -12.164 -3.841 1.00 0.00 H new ATOM 0 HH TYR A 28 -8.431 -8.868 -4.970 1.00 0.00 H new ATOM 396 N ARG A 29 -3.614 -12.645 -0.569 1.00 0.00 N ATOM 397 CA ARG A 29 -2.971 -13.359 -1.668 1.00 0.00 C ATOM 398 C ARG A 29 -3.364 -14.826 -1.600 1.00 0.00 C ATOM 399 O ARG A 29 -2.912 -15.525 -0.690 1.00 0.00 O ATOM 400 CB ARG A 29 -1.450 -13.119 -1.650 1.00 0.00 C ATOM 401 CG ARG A 29 -0.799 -13.149 -3.040 1.00 0.00 C ATOM 402 CD ARG A 29 -0.888 -14.467 -3.828 1.00 0.00 C ATOM 403 NE ARG A 29 0.054 -15.457 -3.297 1.00 0.00 N ATOM 404 CZ ARG A 29 0.318 -16.680 -3.762 1.00 0.00 C ATOM 405 NH1 ARG A 29 -0.454 -17.274 -4.663 1.00 0.00 N ATOM 406 NH2 ARG A 29 1.400 -17.312 -3.338 1.00 0.00 N ATOM 0 H ARG A 29 -3.645 -13.175 0.302 1.00 0.00 H new ATOM 0 HA ARG A 29 -3.314 -12.979 -2.630 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -1.250 -12.153 -1.187 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -0.980 -13.877 -1.023 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -1.253 -12.363 -3.643 1.00 0.00 H new ATOM 0 HG3 ARG A 29 0.255 -12.894 -2.926 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.903 -14.860 -3.775 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -0.673 -14.282 -4.880 1.00 0.00 H new ATOM 0 HE ARG A 29 0.574 -15.175 -2.466 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -1.280 -16.795 -5.023 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -0.222 -18.210 -4.996 1.00 0.00 H new ATOM 0 HH21 ARG A 29 2.021 -16.864 -2.664 1.00 0.00 H new ATOM 0 HH22 ARG A 29 1.613 -18.247 -3.685 1.00 0.00 H new ATOM 420 N TYR A 30 -4.175 -15.296 -2.548 1.00 0.00 N ATOM 421 CA TYR A 30 -4.573 -16.698 -2.640 1.00 0.00 C ATOM 422 C TYR A 30 -3.717 -17.402 -3.694 1.00 0.00 C ATOM 423 O TYR A 30 -3.279 -16.788 -4.676 1.00 0.00 O ATOM 424 CB TYR A 30 -6.064 -16.808 -3.029 1.00 0.00 C ATOM 425 CG TYR A 30 -6.954 -17.464 -1.989 1.00 0.00 C ATOM 426 CD1 TYR A 30 -6.704 -18.788 -1.579 1.00 0.00 C ATOM 427 CD2 TYR A 30 -8.043 -16.760 -1.440 1.00 0.00 C ATOM 428 CE1 TYR A 30 -7.522 -19.401 -0.618 1.00 0.00 C ATOM 429 CE2 TYR A 30 -8.877 -17.374 -0.487 1.00 0.00 C ATOM 430 CZ TYR A 30 -8.622 -18.704 -0.077 1.00 0.00 C ATOM 431 OH TYR A 30 -9.379 -19.301 0.878 1.00 0.00 O ATOM 0 H TYR A 30 -4.577 -14.709 -3.279 1.00 0.00 H new ATOM 0 HA TYR A 30 -4.426 -17.172 -1.669 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -6.445 -15.807 -3.232 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -6.140 -17.373 -3.958 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -5.877 -19.335 -2.007 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -8.239 -15.745 -1.752 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -7.309 -20.408 -0.292 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -9.711 -16.830 -0.069 1.00 0.00 H new ATOM 0 HH TYR A 30 -10.098 -18.694 1.152 1.00 0.00 H new ATOM 441 N GLU A 31 -3.525 -18.703 -3.507 1.00 0.00 N ATOM 442 CA GLU A 31 -3.243 -19.678 -4.551 1.00 0.00 C ATOM 443 C GLU A 31 -4.571 -20.248 -5.057 1.00 0.00 C ATOM 444 O GLU A 31 -5.594 -20.141 -4.380 1.00 0.00 O ATOM 445 CB GLU A 31 -2.343 -20.796 -4.014 1.00 0.00 C ATOM 446 CG GLU A 31 -2.955 -21.554 -2.824 1.00 0.00 C ATOM 447 CD GLU A 31 -2.171 -22.827 -2.536 1.00 0.00 C ATOM 448 OE1 GLU A 31 -1.125 -22.763 -1.856 1.00 0.00 O ATOM 449 OE2 GLU A 31 -2.599 -23.920 -2.969 1.00 0.00 O ATOM 0 H GLU A 31 -3.564 -19.125 -2.579 1.00 0.00 H new ATOM 0 HA GLU A 31 -2.714 -19.196 -5.373 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -2.135 -21.503 -4.817 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.387 -20.369 -3.710 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.957 -20.915 -1.941 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -3.994 -21.802 -3.040 1.00 0.00 H new ATOM 456 N GLU A 32 -4.561 -20.855 -6.239 1.00 0.00 N ATOM 457 CA GLU A 32 -5.677 -21.636 -6.758 1.00 0.00 C ATOM 458 C GLU A 32 -5.121 -22.962 -7.273 1.00 0.00 C ATOM 459 O GLU A 32 -3.992 -23.009 -7.770 1.00 0.00 O ATOM 460 CB GLU A 32 -6.377 -20.861 -7.884 1.00 0.00 C ATOM 461 CG GLU A 32 -7.049 -19.579 -7.373 1.00 0.00 C ATOM 462 CD GLU A 32 -7.703 -18.783 -8.497 1.00 0.00 C ATOM 463 OE1 GLU A 32 -8.574 -19.352 -9.200 1.00 0.00 O ATOM 464 OE2 GLU A 32 -7.390 -17.581 -8.648 1.00 0.00 O ATOM 0 H GLU A 32 -3.763 -20.817 -6.874 1.00 0.00 H new ATOM 0 HA GLU A 32 -6.414 -21.824 -5.977 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -5.649 -20.606 -8.654 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -7.126 -21.500 -8.352 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -7.801 -19.838 -6.628 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -6.307 -18.956 -6.874 1.00 0.00 H new ATOM 471 N ASP A 33 -5.900 -24.046 -7.205 1.00 0.00 N ATOM 472 CA ASP A 33 -5.462 -25.345 -7.731 1.00 0.00 C ATOM 473 C ASP A 33 -5.674 -25.403 -9.242 1.00 0.00 C ATOM 474 O ASP A 33 -5.140 -26.272 -9.929 1.00 0.00 O ATOM 475 CB ASP A 33 -6.200 -26.494 -7.026 1.00 0.00 C ATOM 476 CG ASP A 33 -5.535 -26.799 -5.688 1.00 0.00 C ATOM 477 OD1 ASP A 33 -4.333 -27.142 -5.661 1.00 0.00 O ATOM 478 OD2 ASP A 33 -6.166 -26.589 -4.629 1.00 0.00 O ATOM 0 H ASP A 33 -6.833 -24.051 -6.793 1.00 0.00 H new ATOM 0 HA ASP A 33 -4.397 -25.460 -7.531 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -7.244 -26.224 -6.869 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -6.192 -27.383 -7.656 1.00 0.00 H new ATOM 483 N ASN A 34 -6.470 -24.471 -9.769 1.00 0.00 N ATOM 484 CA ASN A 34 -7.150 -24.616 -11.045 1.00 0.00 C ATOM 485 C ASN A 34 -6.402 -23.985 -12.218 1.00 0.00 C ATOM 486 O ASN A 34 -6.813 -24.200 -13.361 1.00 0.00 O ATOM 487 CB ASN A 34 -8.565 -24.020 -10.933 1.00 0.00 C ATOM 488 CG ASN A 34 -9.624 -25.067 -11.213 1.00 0.00 C ATOM 489 OD1 ASN A 34 -10.477 -25.334 -10.373 1.00 0.00 O ATOM 490 ND2 ASN A 34 -9.575 -25.723 -12.360 1.00 0.00 N ATOM 0 H ASN A 34 -6.660 -23.581 -9.308 1.00 0.00 H new ATOM 0 HA ASN A 34 -7.196 -25.683 -11.262 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -8.711 -23.609 -9.934 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -8.671 -23.194 -11.636 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -10.252 -26.461 -12.555 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -8.861 -25.491 -13.050 1.00 0.00 H new ATOM 497 N SER A 35 -5.344 -23.219 -11.950 1.00 0.00 N ATOM 498 CA SER A 35 -4.434 -22.590 -12.899 1.00 0.00 C ATOM 499 C SER A 35 -3.165 -22.214 -12.100 1.00 0.00 C ATOM 500 O SER A 35 -3.231 -22.172 -10.864 1.00 0.00 O ATOM 501 CB SER A 35 -5.132 -21.361 -13.514 1.00 0.00 C ATOM 502 OG SER A 35 -4.850 -21.239 -14.893 1.00 0.00 O ATOM 0 H SER A 35 -5.083 -23.008 -10.987 1.00 0.00 H new ATOM 0 HA SER A 35 -4.158 -23.245 -13.726 1.00 0.00 H new ATOM 0 HB2 SER A 35 -6.209 -21.443 -13.368 1.00 0.00 H new ATOM 0 HB3 SER A 35 -4.807 -20.459 -12.994 1.00 0.00 H new ATOM 0 HG SER A 35 -5.309 -20.451 -15.252 1.00 0.00 H new ATOM 508 N PRO A 36 -2.011 -21.924 -12.731 1.00 0.00 N ATOM 509 CA PRO A 36 -0.738 -21.713 -12.033 1.00 0.00 C ATOM 510 C PRO A 36 -0.605 -20.307 -11.404 1.00 0.00 C ATOM 511 O PRO A 36 0.508 -19.812 -11.190 1.00 0.00 O ATOM 512 CB PRO A 36 0.329 -21.987 -13.102 1.00 0.00 C ATOM 513 CG PRO A 36 -0.336 -21.486 -14.379 1.00 0.00 C ATOM 514 CD PRO A 36 -1.798 -21.878 -14.171 1.00 0.00 C ATOM 0 HA PRO A 36 -0.641 -22.374 -11.172 1.00 0.00 H new ATOM 0 HB2 PRO A 36 1.257 -21.454 -12.893 1.00 0.00 H new ATOM 0 HB3 PRO A 36 0.577 -23.047 -13.164 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -0.219 -20.409 -14.501 1.00 0.00 H new ATOM 0 HG3 PRO A 36 0.087 -21.956 -15.267 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -2.465 -21.154 -14.639 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -2.009 -22.846 -14.626 1.00 0.00 H new ATOM 522 N LEU A 37 -1.732 -19.640 -11.162 1.00 0.00 N ATOM 523 CA LEU A 37 -1.867 -18.210 -10.925 1.00 0.00 C ATOM 524 C LEU A 37 -2.177 -17.950 -9.451 1.00 0.00 C ATOM 525 O LEU A 37 -2.686 -18.838 -8.760 1.00 0.00 O ATOM 526 CB LEU A 37 -2.996 -17.688 -11.834 1.00 0.00 C ATOM 527 CG LEU A 37 -2.965 -16.166 -12.073 1.00 0.00 C ATOM 528 CD1 LEU A 37 -1.786 -15.789 -12.977 1.00 0.00 C ATOM 529 CD2 LEU A 37 -4.258 -15.722 -12.765 1.00 0.00 C ATOM 0 H LEU A 37 -2.632 -20.118 -11.125 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.939 -17.689 -11.158 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -2.936 -18.196 -12.796 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -3.956 -17.955 -11.392 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.862 -15.673 -11.106 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -1.779 -14.711 -13.135 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.852 -16.092 -12.503 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.887 -16.296 -13.937 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -4.230 -14.645 -12.931 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.353 -16.235 -13.722 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.112 -15.970 -12.134 1.00 0.00 H new ATOM 541 N GLY A 38 -1.861 -16.753 -8.959 1.00 0.00 N ATOM 542 CA GLY A 38 -2.467 -16.229 -7.746 1.00 0.00 C ATOM 543 C GLY A 38 -2.880 -14.776 -7.955 1.00 0.00 C ATOM 544 O GLY A 38 -2.308 -14.074 -8.793 1.00 0.00 O ATOM 0 H GLY A 38 -1.182 -16.126 -9.390 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -3.337 -16.828 -7.476 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -1.762 -16.300 -6.918 1.00 0.00 H new ATOM 548 N VAL A 39 -3.789 -14.283 -7.118 1.00 0.00 N ATOM 549 CA VAL A 39 -4.252 -12.895 -7.126 1.00 0.00 C ATOM 550 C VAL A 39 -3.526 -12.184 -5.991 1.00 0.00 C ATOM 551 O VAL A 39 -3.265 -12.803 -4.958 1.00 0.00 O ATOM 552 CB VAL A 39 -5.783 -12.870 -6.904 1.00 0.00 C ATOM 553 CG1 VAL A 39 -6.360 -11.466 -6.669 1.00 0.00 C ATOM 554 CG2 VAL A 39 -6.505 -13.479 -8.110 1.00 0.00 C ATOM 0 H VAL A 39 -4.236 -14.850 -6.397 1.00 0.00 H new ATOM 0 HA VAL A 39 -4.043 -12.401 -8.075 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.949 -13.453 -5.998 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.438 -11.535 -6.522 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -5.901 -11.027 -5.783 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.152 -10.837 -7.535 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.581 -13.455 -7.940 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -6.266 -12.905 -9.005 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.182 -14.511 -8.244 1.00 0.00 H new ATOM 564 N ILE A 40 -3.238 -10.891 -6.165 1.00 0.00 N ATOM 565 CA ILE A 40 -2.727 -10.004 -5.128 1.00 0.00 C ATOM 566 C ILE A 40 -3.663 -8.795 -5.119 1.00 0.00 C ATOM 567 O ILE A 40 -3.900 -8.211 -6.183 1.00 0.00 O ATOM 568 CB ILE A 40 -1.263 -9.560 -5.401 1.00 0.00 C ATOM 569 CG1 ILE A 40 -0.352 -10.659 -6.003 1.00 0.00 C ATOM 570 CG2 ILE A 40 -0.670 -9.010 -4.089 1.00 0.00 C ATOM 571 CD1 ILE A 40 1.060 -10.165 -6.334 1.00 0.00 C ATOM 0 H ILE A 40 -3.360 -10.422 -7.063 1.00 0.00 H new ATOM 0 HA ILE A 40 -2.704 -10.515 -4.165 1.00 0.00 H new ATOM 0 HB ILE A 40 -1.300 -8.790 -6.171 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -0.283 -11.489 -5.300 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.815 -11.048 -6.910 1.00 0.00 H new ATOM 0 HG21 ILE A 40 0.359 -8.693 -4.260 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -1.261 -8.159 -3.751 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -0.688 -9.789 -3.327 1.00 0.00 H new ATOM 0 HD11 ILE A 40 1.644 -10.985 -6.752 1.00 0.00 H new ATOM 0 HD12 ILE A 40 1.001 -9.355 -7.061 1.00 0.00 H new ATOM 0 HD13 ILE A 40 1.541 -9.803 -5.425 1.00 0.00 H new ATOM 583 N GLY A 41 -4.174 -8.410 -3.952 1.00 0.00 N ATOM 584 CA GLY A 41 -4.866 -7.145 -3.749 1.00 0.00 C ATOM 585 C GLY A 41 -4.358 -6.543 -2.448 1.00 0.00 C ATOM 586 O GLY A 41 -4.371 -7.229 -1.424 1.00 0.00 O ATOM 0 H GLY A 41 -4.116 -8.980 -3.108 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -4.678 -6.468 -4.583 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -5.944 -7.302 -3.703 1.00 0.00 H new ATOM 590 N SER A 42 -3.914 -5.284 -2.488 1.00 0.00 N ATOM 591 CA SER A 42 -3.321 -4.571 -1.358 1.00 0.00 C ATOM 592 C SER A 42 -4.112 -3.281 -1.143 1.00 0.00 C ATOM 593 O SER A 42 -4.453 -2.611 -2.123 1.00 0.00 O ATOM 594 CB SER A 42 -1.840 -4.264 -1.645 1.00 0.00 C ATOM 595 OG SER A 42 -1.139 -5.406 -2.115 1.00 0.00 O ATOM 0 H SER A 42 -3.960 -4.717 -3.335 1.00 0.00 H new ATOM 0 HA SER A 42 -3.364 -5.183 -0.457 1.00 0.00 H new ATOM 0 HB2 SER A 42 -1.772 -3.467 -2.386 1.00 0.00 H new ATOM 0 HB3 SER A 42 -1.364 -3.896 -0.736 1.00 0.00 H new ATOM 0 HG SER A 42 -0.204 -5.168 -2.287 1.00 0.00 H new ATOM 601 N PHE A 43 -4.400 -2.938 0.116 1.00 0.00 N ATOM 602 CA PHE A 43 -5.217 -1.796 0.499 1.00 0.00 C ATOM 603 C PHE A 43 -4.450 -0.970 1.524 1.00 0.00 C ATOM 604 O PHE A 43 -4.236 -1.416 2.651 1.00 0.00 O ATOM 605 CB PHE A 43 -6.591 -2.260 1.003 1.00 0.00 C ATOM 606 CG PHE A 43 -7.563 -2.521 -0.132 1.00 0.00 C ATOM 607 CD1 PHE A 43 -7.513 -3.723 -0.863 1.00 0.00 C ATOM 608 CD2 PHE A 43 -8.467 -1.513 -0.513 1.00 0.00 C ATOM 609 CE1 PHE A 43 -8.334 -3.893 -1.993 1.00 0.00 C ATOM 610 CE2 PHE A 43 -9.288 -1.685 -1.638 1.00 0.00 C ATOM 611 CZ PHE A 43 -9.215 -2.871 -2.386 1.00 0.00 C ATOM 0 H PHE A 43 -4.057 -3.468 0.918 1.00 0.00 H new ATOM 0 HA PHE A 43 -5.415 -1.159 -0.363 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -6.471 -3.169 1.592 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -7.007 -1.502 1.667 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -6.845 -4.514 -0.557 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -8.530 -0.602 0.063 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -8.287 -4.811 -2.560 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -9.976 -0.905 -1.929 1.00 0.00 H new ATOM 0 HZ PHE A 43 -9.835 -2.998 -3.262 1.00 0.00 H new ATOM 621 N THR A 44 -3.991 0.207 1.111 1.00 0.00 N ATOM 622 CA THR A 44 -3.304 1.194 1.926 1.00 0.00 C ATOM 623 C THR A 44 -4.003 2.552 1.747 1.00 0.00 C ATOM 624 O THR A 44 -4.363 2.927 0.624 1.00 0.00 O ATOM 625 CB THR A 44 -1.809 1.172 1.549 1.00 0.00 C ATOM 626 OG1 THR A 44 -1.040 1.992 2.400 1.00 0.00 O ATOM 627 CG2 THR A 44 -1.530 1.577 0.099 1.00 0.00 C ATOM 0 H THR A 44 -4.096 0.512 0.143 1.00 0.00 H new ATOM 0 HA THR A 44 -3.353 0.975 2.993 1.00 0.00 H new ATOM 0 HB THR A 44 -1.516 0.129 1.669 1.00 0.00 H new ATOM 0 HG1 THR A 44 -0.099 1.951 2.131 1.00 0.00 H new ATOM 0 HG21 THR A 44 -0.457 1.537 -0.090 1.00 0.00 H new ATOM 0 HG22 THR A 44 -2.043 0.891 -0.575 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.891 2.591 -0.071 1.00 0.00 H new ATOM 635 N TYR A 45 -4.186 3.278 2.853 1.00 0.00 N ATOM 636 CA TYR A 45 -4.796 4.609 2.910 1.00 0.00 C ATOM 637 C TYR A 45 -3.961 5.492 3.840 1.00 0.00 C ATOM 638 O TYR A 45 -3.227 4.972 4.685 1.00 0.00 O ATOM 639 CB TYR A 45 -6.277 4.553 3.340 1.00 0.00 C ATOM 640 CG TYR A 45 -6.505 4.206 4.799 1.00 0.00 C ATOM 641 CD1 TYR A 45 -6.409 5.206 5.788 1.00 0.00 C ATOM 642 CD2 TYR A 45 -6.738 2.872 5.182 1.00 0.00 C ATOM 643 CE1 TYR A 45 -6.479 4.874 7.151 1.00 0.00 C ATOM 644 CE2 TYR A 45 -6.818 2.534 6.544 1.00 0.00 C ATOM 645 CZ TYR A 45 -6.673 3.530 7.534 1.00 0.00 C ATOM 646 OH TYR A 45 -6.713 3.187 8.849 1.00 0.00 O ATOM 0 H TYR A 45 -3.901 2.940 3.772 1.00 0.00 H new ATOM 0 HA TYR A 45 -4.799 5.043 1.910 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -6.737 5.520 3.135 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -6.792 3.818 2.722 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -6.280 6.237 5.495 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -6.855 2.107 4.429 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -6.385 5.644 7.902 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -6.991 1.508 6.834 1.00 0.00 H new ATOM 0 HH TYR A 45 -6.855 2.221 8.931 1.00 0.00 H new ATOM 656 N THR A 46 -4.050 6.815 3.713 1.00 0.00 N ATOM 657 CA THR A 46 -3.470 7.754 4.669 1.00 0.00 C ATOM 658 C THR A 46 -4.595 8.587 5.302 1.00 0.00 C ATOM 659 O THR A 46 -5.698 8.683 4.750 1.00 0.00 O ATOM 660 CB THR A 46 -2.370 8.582 3.966 1.00 0.00 C ATOM 661 OG1 THR A 46 -1.309 8.877 4.848 1.00 0.00 O ATOM 662 CG2 THR A 46 -2.889 9.889 3.360 1.00 0.00 C ATOM 0 H THR A 46 -4.531 7.268 2.936 1.00 0.00 H new ATOM 0 HA THR A 46 -2.976 7.240 5.494 1.00 0.00 H new ATOM 0 HB THR A 46 -2.014 7.953 3.150 1.00 0.00 H new ATOM 0 HG1 THR A 46 -0.627 9.400 4.376 1.00 0.00 H new ATOM 0 HG21 THR A 46 -2.066 10.421 2.883 1.00 0.00 H new ATOM 0 HG22 THR A 46 -3.656 9.667 2.618 1.00 0.00 H new ATOM 0 HG23 THR A 46 -3.315 10.511 4.147 1.00 0.00 H new ATOM 670 N GLU A 47 -4.290 9.206 6.439 1.00 0.00 N ATOM 671 CA GLU A 47 -5.019 10.287 7.090 1.00 0.00 C ATOM 672 C GLU A 47 -3.944 11.148 7.781 1.00 0.00 C ATOM 673 O GLU A 47 -2.789 10.713 7.892 1.00 0.00 O ATOM 674 CB GLU A 47 -6.029 9.679 8.077 1.00 0.00 C ATOM 675 CG GLU A 47 -7.072 10.667 8.630 1.00 0.00 C ATOM 676 CD GLU A 47 -7.988 10.051 9.698 1.00 0.00 C ATOM 677 OE1 GLU A 47 -7.996 8.807 9.890 1.00 0.00 O ATOM 678 OE2 GLU A 47 -8.726 10.818 10.351 1.00 0.00 O ATOM 0 H GLU A 47 -3.460 8.942 6.970 1.00 0.00 H new ATOM 0 HA GLU A 47 -5.597 10.905 6.403 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -6.552 8.861 7.581 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -5.481 9.246 8.914 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -6.556 11.528 9.056 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -7.683 11.037 7.807 1.00 0.00 H new ATOM 685 N LYS A 48 -4.264 12.367 8.213 1.00 0.00 N ATOM 686 CA LYS A 48 -3.318 13.305 8.823 1.00 0.00 C ATOM 687 C LYS A 48 -4.034 13.998 9.986 1.00 0.00 C ATOM 688 O LYS A 48 -5.197 14.391 9.839 1.00 0.00 O ATOM 689 CB LYS A 48 -2.845 14.274 7.723 1.00 0.00 C ATOM 690 CG LYS A 48 -1.477 14.932 7.951 1.00 0.00 C ATOM 691 CD LYS A 48 -1.059 15.683 6.674 1.00 0.00 C ATOM 692 CE LYS A 48 0.198 16.545 6.851 1.00 0.00 C ATOM 693 NZ LYS A 48 1.457 15.787 6.867 1.00 0.00 N ATOM 0 H LYS A 48 -5.211 12.740 8.148 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.431 12.820 9.231 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.813 13.732 6.778 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -3.591 15.061 7.614 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -1.528 15.622 8.793 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -0.733 14.176 8.203 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -0.884 14.959 5.878 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -1.883 16.319 6.351 1.00 0.00 H new ATOM 0 HE2 LYS A 48 0.239 17.276 6.044 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.112 17.103 7.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 2.168 16.307 7.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 1.296 14.855 7.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 1.799 15.661 5.893 1.00 0.00 H new ATOM 707 N SER A 49 -3.381 14.119 11.140 1.00 0.00 N ATOM 708 CA SER A 49 -3.965 14.709 12.336 1.00 0.00 C ATOM 709 C SER A 49 -4.093 16.226 12.201 1.00 0.00 C ATOM 710 O SER A 49 -3.093 16.943 12.237 1.00 0.00 O ATOM 711 CB SER A 49 -3.120 14.358 13.564 1.00 0.00 C ATOM 712 OG SER A 49 -3.190 12.970 13.823 1.00 0.00 O ATOM 0 H SER A 49 -2.419 13.805 11.269 1.00 0.00 H new ATOM 0 HA SER A 49 -4.966 14.296 12.460 1.00 0.00 H new ATOM 0 HB2 SER A 49 -2.084 14.653 13.398 1.00 0.00 H new ATOM 0 HB3 SER A 49 -3.475 14.916 14.431 1.00 0.00 H new ATOM 0 HG SER A 49 -2.645 12.756 14.609 1.00 0.00 H new ATOM 718 N ARG A 50 -5.330 16.721 12.143 1.00 0.00 N ATOM 719 CA ARG A 50 -5.698 18.092 12.445 1.00 0.00 C ATOM 720 C ARG A 50 -5.495 18.252 13.945 1.00 0.00 C ATOM 721 O ARG A 50 -6.304 17.751 14.726 1.00 0.00 O ATOM 722 CB ARG A 50 -7.165 18.347 12.003 1.00 0.00 C ATOM 723 CG ARG A 50 -8.268 17.466 12.656 1.00 0.00 C ATOM 724 CD ARG A 50 -9.541 17.329 11.810 1.00 0.00 C ATOM 725 NE ARG A 50 -10.689 16.809 12.579 1.00 0.00 N ATOM 726 CZ ARG A 50 -11.910 16.566 12.076 1.00 0.00 C ATOM 727 NH1 ARG A 50 -12.119 16.521 10.766 1.00 0.00 N ATOM 728 NH2 ARG A 50 -12.952 16.375 12.873 1.00 0.00 N ATOM 0 H ARG A 50 -6.130 16.149 11.873 1.00 0.00 H new ATOM 0 HA ARG A 50 -5.093 18.825 11.910 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -7.402 19.391 12.207 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -7.221 18.212 10.923 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -7.861 16.473 12.844 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -8.532 17.891 13.624 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -9.800 18.302 11.393 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -9.343 16.664 10.969 1.00 0.00 H new ATOM 0 HE ARG A 50 -10.543 16.619 13.571 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -11.344 16.673 10.120 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -13.055 16.335 10.405 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -12.833 16.412 13.885 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -13.873 16.192 12.474 1.00 0.00 H new ATOM 742 N THR A 51 -4.394 18.865 14.365 1.00 0.00 N ATOM 743 CA THR A 51 -4.202 19.154 15.784 1.00 0.00 C ATOM 744 C THR A 51 -5.366 20.015 16.275 1.00 0.00 C ATOM 745 O THR A 51 -5.834 19.818 17.394 1.00 0.00 O ATOM 746 CB THR A 51 -2.861 19.858 16.085 1.00 0.00 C ATOM 747 OG1 THR A 51 -1.990 19.883 14.974 1.00 0.00 O ATOM 748 CG2 THR A 51 -2.142 19.205 17.262 1.00 0.00 C ATOM 0 H THR A 51 -3.633 19.167 13.757 1.00 0.00 H new ATOM 0 HA THR A 51 -4.174 18.201 16.312 1.00 0.00 H new ATOM 0 HB THR A 51 -3.122 20.886 16.335 1.00 0.00 H new ATOM 0 HG1 THR A 51 -1.748 20.810 14.769 1.00 0.00 H new ATOM 0 HG21 THR A 51 -1.202 19.724 17.448 1.00 0.00 H new ATOM 0 HG22 THR A 51 -2.771 19.264 18.150 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.939 18.159 17.030 1.00 0.00 H new ATOM 756 N ALA A 52 -5.809 20.985 15.456 1.00 0.00 N ATOM 757 CA ALA A 52 -6.835 21.998 15.726 1.00 0.00 C ATOM 758 C ALA A 52 -6.583 22.865 16.971 1.00 0.00 C ATOM 759 O ALA A 52 -7.250 23.882 17.143 1.00 0.00 O ATOM 760 CB ALA A 52 -8.232 21.363 15.728 1.00 0.00 C ATOM 0 H ALA A 52 -5.427 21.086 14.516 1.00 0.00 H new ATOM 0 HA ALA A 52 -6.773 22.709 14.902 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -8.980 22.130 15.930 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -8.428 20.912 14.755 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -8.282 20.595 16.500 1.00 0.00 H new ATOM 766 N SER A 53 -5.587 22.541 17.793 1.00 0.00 N ATOM 767 CA SER A 53 -5.172 23.188 19.020 1.00 0.00 C ATOM 768 C SER A 53 -4.339 24.411 18.638 1.00 0.00 C ATOM 769 O SER A 53 -3.116 24.427 18.793 1.00 0.00 O ATOM 770 CB SER A 53 -4.428 22.148 19.880 1.00 0.00 C ATOM 771 OG SER A 53 -4.124 22.617 21.177 1.00 0.00 O ATOM 0 H SER A 53 -4.995 21.736 17.588 1.00 0.00 H new ATOM 0 HA SER A 53 -6.004 23.549 19.625 1.00 0.00 H new ATOM 0 HB2 SER A 53 -5.038 21.248 19.959 1.00 0.00 H new ATOM 0 HB3 SER A 53 -3.504 21.864 19.377 1.00 0.00 H new ATOM 0 HG SER A 53 -3.655 21.916 21.677 1.00 0.00 H new ATOM 777 N SER A 54 -5.056 25.401 18.106 1.00 0.00 N ATOM 778 CA SER A 54 -4.716 26.730 17.575 1.00 0.00 C ATOM 779 C SER A 54 -5.167 26.882 16.111 1.00 0.00 C ATOM 780 O SER A 54 -5.003 27.956 15.538 1.00 0.00 O ATOM 781 CB SER A 54 -3.244 27.136 17.743 1.00 0.00 C ATOM 782 OG SER A 54 -2.839 27.015 19.098 1.00 0.00 O ATOM 0 H SER A 54 -6.064 25.265 18.023 1.00 0.00 H new ATOM 0 HA SER A 54 -5.277 27.428 18.196 1.00 0.00 H new ATOM 0 HB2 SER A 54 -2.615 26.507 17.113 1.00 0.00 H new ATOM 0 HB3 SER A 54 -3.105 28.164 17.408 1.00 0.00 H new ATOM 0 HG SER A 54 -2.599 26.084 19.286 1.00 0.00 H new ATOM 788 N GLY A 55 -5.794 25.857 15.522 1.00 0.00 N ATOM 789 CA GLY A 55 -6.462 25.969 14.233 1.00 0.00 C ATOM 790 C GLY A 55 -5.533 25.687 13.056 1.00 0.00 C ATOM 791 O GLY A 55 -5.655 26.349 12.026 1.00 0.00 O ATOM 0 H GLY A 55 -5.849 24.925 15.933 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -7.300 25.273 14.202 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -6.876 26.972 14.130 1.00 0.00 H new ATOM 795 N ASP A 56 -4.614 24.723 13.182 1.00 0.00 N ATOM 796 CA ASP A 56 -4.030 24.039 12.039 1.00 0.00 C ATOM 797 C ASP A 56 -4.942 22.841 11.795 1.00 0.00 C ATOM 798 O ASP A 56 -5.084 21.923 12.613 1.00 0.00 O ATOM 799 CB ASP A 56 -2.544 23.663 12.197 1.00 0.00 C ATOM 800 CG ASP A 56 -2.282 22.322 12.883 1.00 0.00 C ATOM 801 OD1 ASP A 56 -2.471 22.257 14.121 1.00 0.00 O ATOM 802 OD2 ASP A 56 -1.846 21.356 12.217 1.00 0.00 O ATOM 0 H ASP A 56 -4.259 24.400 14.082 1.00 0.00 H new ATOM 0 HA ASP A 56 -3.988 24.702 11.175 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -2.083 23.644 11.209 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -2.046 24.448 12.766 1.00 0.00 H new ATOM 807 N TYR A 57 -5.675 22.936 10.701 1.00 0.00 N ATOM 808 CA TYR A 57 -6.351 21.808 10.098 1.00 0.00 C ATOM 809 C TYR A 57 -5.333 21.143 9.198 1.00 0.00 C ATOM 810 O TYR A 57 -4.745 21.796 8.333 1.00 0.00 O ATOM 811 CB TYR A 57 -7.601 22.249 9.334 1.00 0.00 C ATOM 812 CG TYR A 57 -8.810 22.242 10.241 1.00 0.00 C ATOM 813 CD1 TYR A 57 -9.060 23.329 11.100 1.00 0.00 C ATOM 814 CD2 TYR A 57 -9.613 21.090 10.308 1.00 0.00 C ATOM 815 CE1 TYR A 57 -10.108 23.260 12.035 1.00 0.00 C ATOM 816 CE2 TYR A 57 -10.655 21.015 11.245 1.00 0.00 C ATOM 817 CZ TYR A 57 -10.912 22.101 12.113 1.00 0.00 C ATOM 818 OH TYR A 57 -11.924 22.019 13.021 1.00 0.00 O ATOM 0 H TYR A 57 -5.818 23.813 10.201 1.00 0.00 H new ATOM 0 HA TYR A 57 -6.711 21.108 10.852 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -7.451 23.249 8.927 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -7.771 21.583 8.488 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -8.447 24.216 11.041 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -9.428 20.263 9.639 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -10.298 24.094 12.694 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -11.263 20.124 11.303 1.00 0.00 H new ATOM 0 HH TYR A 57 -12.373 21.152 12.933 1.00 0.00 H new ATOM 828 N ASN A 58 -5.096 19.854 9.418 1.00 0.00 N ATOM 829 CA ASN A 58 -4.137 19.107 8.633 1.00 0.00 C ATOM 830 C ASN A 58 -4.955 18.056 7.915 1.00 0.00 C ATOM 831 O ASN A 58 -5.692 17.324 8.583 1.00 0.00 O ATOM 832 CB ASN A 58 -3.086 18.475 9.562 1.00 0.00 C ATOM 833 CG ASN A 58 -1.677 18.570 9.009 1.00 0.00 C ATOM 834 OD1 ASN A 58 -1.465 18.715 7.808 1.00 0.00 O ATOM 835 ND2 ASN A 58 -0.676 18.486 9.867 1.00 0.00 N ATOM 0 H ASN A 58 -5.563 19.307 10.141 1.00 0.00 H new ATOM 0 HA ASN A 58 -3.589 19.728 7.925 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -3.124 18.968 10.533 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -3.337 17.427 9.726 1.00 0.00 H new ATOM 0 HD21 ASN A 58 0.287 18.542 9.535 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -0.866 18.366 10.862 1.00 0.00 H new ATOM 842 N LYS A 59 -4.886 17.969 6.586 1.00 0.00 N ATOM 843 CA LYS A 59 -5.348 16.762 5.912 1.00 0.00 C ATOM 844 C LYS A 59 -4.520 16.451 4.689 1.00 0.00 C ATOM 845 O LYS A 59 -4.146 17.336 3.914 1.00 0.00 O ATOM 846 CB LYS A 59 -6.853 16.738 5.602 1.00 0.00 C ATOM 847 CG LYS A 59 -7.463 17.868 4.764 1.00 0.00 C ATOM 848 CD LYS A 59 -8.057 19.012 5.610 1.00 0.00 C ATOM 849 CE LYS A 59 -9.365 19.572 5.027 1.00 0.00 C ATOM 850 NZ LYS A 59 -10.470 18.587 5.024 1.00 0.00 N ATOM 0 H LYS A 59 -4.525 18.699 5.972 1.00 0.00 H new ATOM 0 HA LYS A 59 -5.198 15.962 6.637 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -7.068 15.799 5.092 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -7.384 16.712 6.554 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -6.696 18.275 4.105 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -8.245 17.455 4.126 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -8.242 18.651 6.622 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -7.326 19.817 5.688 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -9.667 20.446 5.604 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -9.185 19.910 4.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -11.380 19.086 4.950 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -10.360 17.945 4.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -10.448 18.038 5.907 1.00 0.00 H new ATOM 864 N ASN A 60 -4.301 15.157 4.494 1.00 0.00 N ATOM 865 CA ASN A 60 -4.024 14.557 3.207 1.00 0.00 C ATOM 866 C ASN A 60 -4.842 13.268 3.168 1.00 0.00 C ATOM 867 O ASN A 60 -5.221 12.747 4.218 1.00 0.00 O ATOM 868 CB ASN A 60 -2.522 14.284 3.029 1.00 0.00 C ATOM 869 CG ASN A 60 -2.187 13.897 1.591 1.00 0.00 C ATOM 870 OD1 ASN A 60 -2.980 14.139 0.688 1.00 0.00 O ATOM 871 ND2 ASN A 60 -1.017 13.345 1.339 1.00 0.00 N ATOM 0 H ASN A 60 -4.313 14.479 5.256 1.00 0.00 H new ATOM 0 HA ASN A 60 -4.298 15.222 2.388 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -1.955 15.172 3.309 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -2.215 13.484 3.703 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -0.759 13.112 0.380 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -0.370 13.151 2.103 1.00 0.00 H new ATOM 878 N GLN A 61 -5.137 12.764 1.978 1.00 0.00 N ATOM 879 CA GLN A 61 -5.901 11.552 1.735 1.00 0.00 C ATOM 880 C GLN A 61 -5.142 10.819 0.632 1.00 0.00 C ATOM 881 O GLN A 61 -4.519 11.476 -0.203 1.00 0.00 O ATOM 882 CB GLN A 61 -7.336 11.906 1.307 1.00 0.00 C ATOM 883 CG GLN A 61 -8.169 12.588 2.406 1.00 0.00 C ATOM 884 CD GLN A 61 -9.555 12.995 1.905 1.00 0.00 C ATOM 885 OE1 GLN A 61 -9.945 14.156 2.004 1.00 0.00 O ATOM 886 NE2 GLN A 61 -10.320 12.091 1.318 1.00 0.00 N ATOM 0 H GLN A 61 -4.834 13.213 1.114 1.00 0.00 H new ATOM 0 HA GLN A 61 -5.997 10.929 2.624 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -7.293 12.563 0.438 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -7.845 10.995 0.993 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -8.274 11.911 3.254 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -7.640 13.470 2.767 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -9.998 11.127 1.235 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -11.232 12.358 0.948 1.00 0.00 H new ATOM 895 N TYR A 62 -5.172 9.487 0.616 1.00 0.00 N ATOM 896 CA TYR A 62 -4.400 8.648 -0.299 1.00 0.00 C ATOM 897 C TYR A 62 -5.257 7.427 -0.595 1.00 0.00 C ATOM 898 O TYR A 62 -5.732 6.770 0.335 1.00 0.00 O ATOM 899 CB TYR A 62 -3.063 8.248 0.353 1.00 0.00 C ATOM 900 CG TYR A 62 -2.094 7.411 -0.472 1.00 0.00 C ATOM 901 CD1 TYR A 62 -1.305 8.028 -1.459 1.00 0.00 C ATOM 902 CD2 TYR A 62 -1.873 6.050 -0.172 1.00 0.00 C ATOM 903 CE1 TYR A 62 -0.315 7.304 -2.149 1.00 0.00 C ATOM 904 CE2 TYR A 62 -0.870 5.326 -0.847 1.00 0.00 C ATOM 905 CZ TYR A 62 -0.089 5.943 -1.850 1.00 0.00 C ATOM 906 OH TYR A 62 0.892 5.260 -2.501 1.00 0.00 O ATOM 0 H TYR A 62 -5.751 8.946 1.258 1.00 0.00 H new ATOM 0 HA TYR A 62 -4.159 9.176 -1.222 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -2.548 9.162 0.649 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -3.287 7.698 1.267 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -1.461 9.071 -1.691 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -2.476 5.561 0.579 1.00 0.00 H new ATOM 0 HE1 TYR A 62 0.275 7.792 -2.911 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -0.697 4.290 -0.595 1.00 0.00 H new ATOM 0 HH TYR A 62 1.055 4.408 -2.046 1.00 0.00 H new ATOM 916 N TYR A 63 -5.460 7.149 -1.880 1.00 0.00 N ATOM 917 CA TYR A 63 -5.561 5.789 -2.371 1.00 0.00 C ATOM 918 C TYR A 63 -4.177 5.476 -2.917 1.00 0.00 C ATOM 919 O TYR A 63 -3.550 6.358 -3.498 1.00 0.00 O ATOM 920 CB TYR A 63 -6.582 5.689 -3.513 1.00 0.00 C ATOM 921 CG TYR A 63 -8.006 5.463 -3.055 1.00 0.00 C ATOM 922 CD1 TYR A 63 -8.801 6.552 -2.664 1.00 0.00 C ATOM 923 CD2 TYR A 63 -8.519 4.155 -2.975 1.00 0.00 C ATOM 924 CE1 TYR A 63 -10.094 6.335 -2.160 1.00 0.00 C ATOM 925 CE2 TYR A 63 -9.815 3.930 -2.483 1.00 0.00 C ATOM 926 CZ TYR A 63 -10.606 5.020 -2.061 1.00 0.00 C ATOM 927 OH TYR A 63 -11.866 4.793 -1.602 1.00 0.00 O ATOM 0 H TYR A 63 -5.558 7.861 -2.603 1.00 0.00 H new ATOM 0 HA TYR A 63 -5.884 5.104 -1.587 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -6.543 6.606 -4.101 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.291 4.873 -4.175 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -8.418 7.558 -2.751 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -7.913 3.320 -3.294 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -10.698 7.174 -1.847 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -10.206 2.925 -2.428 1.00 0.00 H new ATOM 0 HH TYR A 63 -12.046 3.830 -1.604 1.00 0.00 H new ATOM 937 N GLY A 64 -3.757 4.221 -2.790 1.00 0.00 N ATOM 938 CA GLY A 64 -2.596 3.676 -3.469 1.00 0.00 C ATOM 939 C GLY A 64 -3.084 2.420 -4.166 1.00 0.00 C ATOM 940 O GLY A 64 -3.141 1.355 -3.550 1.00 0.00 O ATOM 0 H GLY A 64 -4.230 3.541 -2.195 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.190 4.390 -4.186 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -1.799 3.447 -2.761 1.00 0.00 H new ATOM 944 N ILE A 65 -3.554 2.565 -5.406 1.00 0.00 N ATOM 945 CA ILE A 65 -4.216 1.481 -6.123 1.00 0.00 C ATOM 946 C ILE A 65 -3.127 0.469 -6.474 1.00 0.00 C ATOM 947 O ILE A 65 -2.085 0.847 -7.009 1.00 0.00 O ATOM 948 CB ILE A 65 -4.936 2.001 -7.390 1.00 0.00 C ATOM 949 CG1 ILE A 65 -5.852 3.224 -7.151 1.00 0.00 C ATOM 950 CG2 ILE A 65 -5.737 0.858 -8.043 1.00 0.00 C ATOM 951 CD1 ILE A 65 -7.015 2.978 -6.186 1.00 0.00 C ATOM 0 H ILE A 65 -3.486 3.433 -5.937 1.00 0.00 H new ATOM 0 HA ILE A 65 -4.990 1.021 -5.508 1.00 0.00 H new ATOM 0 HB ILE A 65 -4.149 2.350 -8.059 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.246 4.044 -6.765 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -6.256 3.550 -8.109 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -6.242 1.230 -8.934 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -5.059 0.051 -8.320 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -6.478 0.483 -7.337 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -7.601 3.891 -6.082 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -7.650 2.183 -6.577 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -6.624 2.685 -5.212 1.00 0.00 H new ATOM 963 N THR A 66 -3.353 -0.805 -6.155 1.00 0.00 N ATOM 964 CA THR A 66 -2.388 -1.864 -6.375 1.00 0.00 C ATOM 965 C THR A 66 -3.149 -3.090 -6.881 1.00 0.00 C ATOM 966 O THR A 66 -4.078 -3.553 -6.221 1.00 0.00 O ATOM 967 CB THR A 66 -1.694 -2.126 -5.024 1.00 0.00 C ATOM 968 OG1 THR A 66 -1.067 -0.951 -4.540 1.00 0.00 O ATOM 969 CG2 THR A 66 -0.600 -3.187 -5.129 1.00 0.00 C ATOM 0 H THR A 66 -4.224 -1.127 -5.732 1.00 0.00 H new ATOM 0 HA THR A 66 -1.631 -1.608 -7.116 1.00 0.00 H new ATOM 0 HB THR A 66 -2.482 -2.465 -4.352 1.00 0.00 H new ATOM 0 HG1 THR A 66 -1.750 -0.312 -4.249 1.00 0.00 H new ATOM 0 HG21 THR A 66 -0.142 -3.335 -4.151 1.00 0.00 H new ATOM 0 HG22 THR A 66 -1.035 -4.126 -5.472 1.00 0.00 H new ATOM 0 HG23 THR A 66 0.159 -2.858 -5.839 1.00 0.00 H new ATOM 977 N ALA A 67 -2.733 -3.661 -8.015 1.00 0.00 N ATOM 978 CA ALA A 67 -3.265 -4.923 -8.523 1.00 0.00 C ATOM 979 C ALA A 67 -2.249 -5.561 -9.469 1.00 0.00 C ATOM 980 O ALA A 67 -1.432 -4.858 -10.072 1.00 0.00 O ATOM 981 CB ALA A 67 -4.578 -4.672 -9.278 1.00 0.00 C ATOM 0 H ALA A 67 -2.011 -3.254 -8.610 1.00 0.00 H new ATOM 0 HA ALA A 67 -3.456 -5.593 -7.685 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -4.968 -5.618 -9.654 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -5.306 -4.222 -8.603 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -4.394 -3.998 -10.114 1.00 0.00 H new ATOM 987 N GLY A 68 -2.324 -6.881 -9.638 1.00 0.00 N ATOM 988 CA GLY A 68 -1.534 -7.663 -10.587 1.00 0.00 C ATOM 989 C GLY A 68 -1.370 -9.104 -10.095 1.00 0.00 C ATOM 990 O GLY A 68 -1.611 -9.367 -8.910 1.00 0.00 O ATOM 0 H GLY A 68 -2.965 -7.459 -9.094 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -2.020 -7.659 -11.563 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -0.554 -7.204 -10.717 1.00 0.00 H new ATOM 994 N PRO A 69 -1.036 -10.057 -10.978 1.00 0.00 N ATOM 995 CA PRO A 69 -0.995 -11.466 -10.618 1.00 0.00 C ATOM 996 C PRO A 69 0.319 -11.830 -9.921 1.00 0.00 C ATOM 997 O PRO A 69 1.380 -11.249 -10.191 1.00 0.00 O ATOM 998 CB PRO A 69 -1.155 -12.218 -11.941 1.00 0.00 C ATOM 999 CG PRO A 69 -0.552 -11.273 -12.978 1.00 0.00 C ATOM 1000 CD PRO A 69 -0.798 -9.878 -12.404 1.00 0.00 C ATOM 0 HA PRO A 69 -1.780 -11.725 -9.907 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -0.633 -13.175 -11.922 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -2.202 -12.430 -12.155 1.00 0.00 H new ATOM 0 HG2 PRO A 69 0.512 -11.463 -13.119 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -1.029 -11.393 -13.951 1.00 0.00 H new ATOM 0 HD2 PRO A 69 0.061 -9.230 -12.576 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -1.655 -9.406 -12.885 1.00 0.00 H new ATOM 1008 N ALA A 70 0.253 -12.850 -9.067 1.00 0.00 N ATOM 1009 CA ALA A 70 1.396 -13.646 -8.651 1.00 0.00 C ATOM 1010 C ALA A 70 1.515 -14.830 -9.616 1.00 0.00 C ATOM 1011 O ALA A 70 0.547 -15.192 -10.289 1.00 0.00 O ATOM 1012 CB ALA A 70 1.185 -14.145 -7.215 1.00 0.00 C ATOM 0 H ALA A 70 -0.622 -13.150 -8.637 1.00 0.00 H new ATOM 0 HA ALA A 70 2.310 -13.052 -8.672 1.00 0.00 H new ATOM 0 HB1 ALA A 70 2.044 -14.741 -6.907 1.00 0.00 H new ATOM 0 HB2 ALA A 70 1.077 -13.292 -6.545 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.284 -14.757 -7.171 1.00 0.00 H new ATOM 1018 N TYR A 71 2.685 -15.465 -9.645 1.00 0.00 N ATOM 1019 CA TYR A 71 2.975 -16.609 -10.495 1.00 0.00 C ATOM 1020 C TYR A 71 3.813 -17.582 -9.672 1.00 0.00 C ATOM 1021 O TYR A 71 4.688 -17.155 -8.909 1.00 0.00 O ATOM 1022 CB TYR A 71 3.730 -16.133 -11.750 1.00 0.00 C ATOM 1023 CG TYR A 71 3.501 -16.993 -12.979 1.00 0.00 C ATOM 1024 CD1 TYR A 71 3.996 -18.311 -13.041 1.00 0.00 C ATOM 1025 CD2 TYR A 71 2.796 -16.463 -14.077 1.00 0.00 C ATOM 1026 CE1 TYR A 71 3.780 -19.104 -14.181 1.00 0.00 C ATOM 1027 CE2 TYR A 71 2.609 -17.237 -15.234 1.00 0.00 C ATOM 1028 CZ TYR A 71 3.087 -18.562 -15.283 1.00 0.00 C ATOM 1029 OH TYR A 71 2.899 -19.284 -16.415 1.00 0.00 O ATOM 0 H TYR A 71 3.475 -15.188 -9.062 1.00 0.00 H new ATOM 0 HA TYR A 71 2.064 -17.105 -10.830 1.00 0.00 H new ATOM 0 HB2 TYR A 71 3.428 -15.110 -11.975 1.00 0.00 H new ATOM 0 HB3 TYR A 71 4.797 -16.110 -11.531 1.00 0.00 H new ATOM 0 HD1 TYR A 71 4.547 -18.715 -12.205 1.00 0.00 H new ATOM 0 HD2 TYR A 71 2.399 -15.460 -14.029 1.00 0.00 H new ATOM 0 HE1 TYR A 71 4.142 -20.121 -14.213 1.00 0.00 H new ATOM 0 HE2 TYR A 71 2.098 -16.816 -16.087 1.00 0.00 H new ATOM 0 HH TYR A 71 2.400 -18.748 -17.066 1.00 0.00 H new ATOM 1039 N ARG A 72 3.567 -18.888 -9.804 1.00 0.00 N ATOM 1040 CA ARG A 72 4.330 -19.894 -9.072 1.00 0.00 C ATOM 1041 C ARG A 72 5.736 -20.047 -9.667 1.00 0.00 C ATOM 1042 O ARG A 72 5.963 -20.862 -10.563 1.00 0.00 O ATOM 1043 CB ARG A 72 3.517 -21.197 -8.946 1.00 0.00 C ATOM 1044 CG ARG A 72 3.350 -22.047 -10.217 1.00 0.00 C ATOM 1045 CD ARG A 72 2.061 -22.874 -10.221 1.00 0.00 C ATOM 1046 NE ARG A 72 1.763 -23.588 -8.970 1.00 0.00 N ATOM 1047 CZ ARG A 72 2.367 -24.649 -8.432 1.00 0.00 C ATOM 1048 NH1 ARG A 72 3.526 -25.101 -8.887 1.00 0.00 N ATOM 1049 NH2 ARG A 72 1.790 -25.247 -7.401 1.00 0.00 N ATOM 0 H ARG A 72 2.844 -19.271 -10.413 1.00 0.00 H new ATOM 0 HA ARG A 72 4.500 -19.569 -8.046 1.00 0.00 H new ATOM 0 HB2 ARG A 72 3.989 -21.817 -8.184 1.00 0.00 H new ATOM 0 HB3 ARG A 72 2.524 -20.941 -8.578 1.00 0.00 H new ATOM 0 HG2 ARG A 72 3.357 -21.392 -11.088 1.00 0.00 H new ATOM 0 HG3 ARG A 72 4.205 -22.717 -10.314 1.00 0.00 H new ATOM 0 HD2 ARG A 72 1.226 -22.212 -10.449 1.00 0.00 H new ATOM 0 HD3 ARG A 72 2.120 -23.603 -11.030 1.00 0.00 H new ATOM 0 HE ARG A 72 0.978 -23.217 -8.434 1.00 0.00 H new ATOM 0 HH11 ARG A 72 3.983 -24.635 -9.671 1.00 0.00 H new ATOM 0 HH12 ARG A 72 3.962 -25.915 -8.453 1.00 0.00 H new ATOM 0 HH21 ARG A 72 0.905 -24.894 -7.037 1.00 0.00 H new ATOM 0 HH22 ARG A 72 2.231 -26.060 -6.971 1.00 0.00 H new ATOM 1063 N ILE A 73 6.699 -19.274 -9.151 1.00 0.00 N ATOM 1064 CA ILE A 73 8.112 -19.421 -9.516 1.00 0.00 C ATOM 1065 C ILE A 73 8.564 -20.856 -9.200 1.00 0.00 C ATOM 1066 O ILE A 73 9.293 -21.456 -9.991 1.00 0.00 O ATOM 1067 CB ILE A 73 8.992 -18.332 -8.853 1.00 0.00 C ATOM 1068 CG1 ILE A 73 8.560 -16.930 -9.349 1.00 0.00 C ATOM 1069 CG2 ILE A 73 10.485 -18.560 -9.168 1.00 0.00 C ATOM 1070 CD1 ILE A 73 9.274 -15.763 -8.657 1.00 0.00 C ATOM 0 H ILE A 73 6.522 -18.533 -8.473 1.00 0.00 H new ATOM 0 HA ILE A 73 8.235 -19.263 -10.587 1.00 0.00 H new ATOM 0 HB ILE A 73 8.855 -18.394 -7.773 1.00 0.00 H new ATOM 0 HG12 ILE A 73 8.742 -16.866 -10.422 1.00 0.00 H new ATOM 0 HG13 ILE A 73 7.486 -16.821 -9.201 1.00 0.00 H new ATOM 0 HG21 ILE A 73 11.081 -17.782 -8.691 1.00 0.00 H new ATOM 0 HG22 ILE A 73 10.792 -19.535 -8.790 1.00 0.00 H new ATOM 0 HG23 ILE A 73 10.639 -18.524 -10.246 1.00 0.00 H new ATOM 0 HD11 ILE A 73 8.910 -14.820 -9.066 1.00 0.00 H new ATOM 0 HD12 ILE A 73 9.072 -15.796 -7.586 1.00 0.00 H new ATOM 0 HD13 ILE A 73 10.348 -15.842 -8.826 1.00 0.00 H new ATOM 1082 N ASN A 74 8.100 -21.439 -8.090 1.00 0.00 N ATOM 1083 CA ASN A 74 8.106 -22.883 -7.867 1.00 0.00 C ATOM 1084 C ASN A 74 6.673 -23.271 -7.550 1.00 0.00 C ATOM 1085 O ASN A 74 5.980 -23.740 -8.447 1.00 0.00 O ATOM 1086 CB ASN A 74 9.122 -23.321 -6.791 1.00 0.00 C ATOM 1087 CG ASN A 74 10.429 -23.851 -7.376 1.00 0.00 C ATOM 1088 OD1 ASN A 74 11.041 -24.771 -6.850 1.00 0.00 O ATOM 1089 ND2 ASN A 74 10.934 -23.267 -8.451 1.00 0.00 N ATOM 0 H ASN A 74 7.705 -20.911 -7.312 1.00 0.00 H new ATOM 0 HA ASN A 74 8.448 -23.413 -8.756 1.00 0.00 H new ATOM 0 HB2 ASN A 74 9.340 -22.474 -6.141 1.00 0.00 H new ATOM 0 HB3 ASN A 74 8.671 -24.093 -6.168 1.00 0.00 H new ATOM 0 HD21 ASN A 74 11.825 -23.585 -8.833 1.00 0.00 H new ATOM 0 HD22 ASN A 74 10.432 -22.499 -8.897 1.00 0.00 H new ATOM 1096 N ASP A 75 6.201 -23.002 -6.330 1.00 0.00 N ATOM 1097 CA ASP A 75 4.857 -23.378 -5.890 1.00 0.00 C ATOM 1098 C ASP A 75 4.194 -22.186 -5.201 1.00 0.00 C ATOM 1099 O ASP A 75 3.280 -21.560 -5.736 1.00 0.00 O ATOM 1100 CB ASP A 75 4.911 -24.595 -4.947 1.00 0.00 C ATOM 1101 CG ASP A 75 5.319 -25.909 -5.613 1.00 0.00 C ATOM 1102 OD1 ASP A 75 4.755 -26.249 -6.679 1.00 0.00 O ATOM 1103 OD2 ASP A 75 6.160 -26.616 -5.008 1.00 0.00 O ATOM 0 H ASP A 75 6.744 -22.515 -5.617 1.00 0.00 H new ATOM 0 HA ASP A 75 4.264 -23.660 -6.760 1.00 0.00 H new ATOM 0 HB2 ASP A 75 5.612 -24.380 -4.141 1.00 0.00 H new ATOM 0 HB3 ASP A 75 3.930 -24.726 -4.490 1.00 0.00 H new ATOM 1108 N TRP A 76 4.699 -21.830 -4.023 1.00 0.00 N ATOM 1109 CA TRP A 76 4.093 -20.917 -3.056 1.00 0.00 C ATOM 1110 C TRP A 76 4.975 -19.671 -2.878 1.00 0.00 C ATOM 1111 O TRP A 76 5.030 -19.048 -1.811 1.00 0.00 O ATOM 1112 CB TRP A 76 3.763 -21.716 -1.781 1.00 0.00 C ATOM 1113 CG TRP A 76 4.758 -22.768 -1.388 1.00 0.00 C ATOM 1114 CD1 TRP A 76 4.564 -24.097 -1.531 1.00 0.00 C ATOM 1115 CD2 TRP A 76 6.132 -22.615 -0.931 1.00 0.00 C ATOM 1116 NE1 TRP A 76 5.740 -24.768 -1.274 1.00 0.00 N ATOM 1117 CE2 TRP A 76 6.756 -23.896 -0.944 1.00 0.00 C ATOM 1118 CE3 TRP A 76 6.933 -21.515 -0.568 1.00 0.00 C ATOM 1119 CZ2 TRP A 76 8.125 -24.052 -0.681 1.00 0.00 C ATOM 1120 CZ3 TRP A 76 8.298 -21.661 -0.288 1.00 0.00 C ATOM 1121 CH2 TRP A 76 8.894 -22.927 -0.352 1.00 0.00 C ATOM 0 H TRP A 76 5.595 -22.192 -3.698 1.00 0.00 H new ATOM 0 HA TRP A 76 3.143 -20.509 -3.402 1.00 0.00 H new ATOM 0 HB2 TRP A 76 3.660 -21.015 -0.953 1.00 0.00 H new ATOM 0 HB3 TRP A 76 2.793 -22.194 -1.917 1.00 0.00 H new ATOM 0 HD1 TRP A 76 3.629 -24.563 -1.805 1.00 0.00 H new ATOM 0 HE1 TRP A 76 5.846 -25.781 -1.322 1.00 0.00 H new ATOM 0 HE3 TRP A 76 6.484 -20.535 -0.504 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 8.582 -25.029 -0.731 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 8.890 -20.798 -0.023 1.00 0.00 H new ATOM 0 HH2 TRP A 76 9.949 -23.037 -0.147 1.00 0.00 H new ATOM 1132 N ALA A 77 5.692 -19.320 -3.949 1.00 0.00 N ATOM 1133 CA ALA A 77 6.328 -18.029 -4.151 1.00 0.00 C ATOM 1134 C ALA A 77 5.267 -16.985 -4.520 1.00 0.00 C ATOM 1135 O ALA A 77 4.101 -17.312 -4.739 1.00 0.00 O ATOM 1136 CB ALA A 77 7.374 -18.160 -5.267 1.00 0.00 C ATOM 0 H ALA A 77 5.848 -19.960 -4.728 1.00 0.00 H new ATOM 0 HA ALA A 77 6.823 -17.705 -3.235 1.00 0.00 H new ATOM 0 HB1 ALA A 77 7.858 -17.196 -5.427 1.00 0.00 H new ATOM 0 HB2 ALA A 77 8.122 -18.898 -4.979 1.00 0.00 H new ATOM 0 HB3 ALA A 77 6.886 -18.478 -6.188 1.00 0.00 H new ATOM 1142 N SER A 78 5.687 -15.730 -4.636 1.00 0.00 N ATOM 1143 CA SER A 78 4.931 -14.634 -5.219 1.00 0.00 C ATOM 1144 C SER A 78 5.939 -13.759 -5.962 1.00 0.00 C ATOM 1145 O SER A 78 7.150 -13.948 -5.819 1.00 0.00 O ATOM 1146 CB SER A 78 4.176 -13.904 -4.104 1.00 0.00 C ATOM 1147 OG SER A 78 3.383 -12.821 -4.557 1.00 0.00 O ATOM 0 H SER A 78 6.608 -15.438 -4.310 1.00 0.00 H new ATOM 0 HA SER A 78 4.172 -14.960 -5.929 1.00 0.00 H new ATOM 0 HB2 SER A 78 3.536 -14.618 -3.586 1.00 0.00 H new ATOM 0 HB3 SER A 78 4.896 -13.533 -3.374 1.00 0.00 H new ATOM 0 HG SER A 78 3.925 -12.005 -4.579 1.00 0.00 H new ATOM 1153 N ILE A 79 5.454 -12.820 -6.771 1.00 0.00 N ATOM 1154 CA ILE A 79 6.296 -11.884 -7.491 1.00 0.00 C ATOM 1155 C ILE A 79 5.568 -10.542 -7.587 1.00 0.00 C ATOM 1156 O ILE A 79 4.362 -10.449 -7.339 1.00 0.00 O ATOM 1157 CB ILE A 79 6.695 -12.519 -8.850 1.00 0.00 C ATOM 1158 CG1 ILE A 79 7.847 -11.804 -9.590 1.00 0.00 C ATOM 1159 CG2 ILE A 79 5.492 -12.689 -9.796 1.00 0.00 C ATOM 1160 CD1 ILE A 79 9.132 -11.671 -8.764 1.00 0.00 C ATOM 0 H ILE A 79 4.457 -12.691 -6.943 1.00 0.00 H new ATOM 0 HA ILE A 79 7.233 -11.676 -6.973 1.00 0.00 H new ATOM 0 HB ILE A 79 7.073 -13.502 -8.569 1.00 0.00 H new ATOM 0 HG12 ILE A 79 8.071 -12.351 -10.506 1.00 0.00 H new ATOM 0 HG13 ILE A 79 7.513 -10.810 -9.886 1.00 0.00 H new ATOM 0 HG21 ILE A 79 5.826 -13.137 -10.732 1.00 0.00 H new ATOM 0 HG22 ILE A 79 4.750 -13.336 -9.328 1.00 0.00 H new ATOM 0 HG23 ILE A 79 5.048 -11.714 -9.998 1.00 0.00 H new ATOM 0 HD11 ILE A 79 9.892 -11.158 -9.354 1.00 0.00 H new ATOM 0 HD12 ILE A 79 8.926 -11.097 -7.860 1.00 0.00 H new ATOM 0 HD13 ILE A 79 9.493 -12.662 -8.490 1.00 0.00 H new ATOM 1172 N TYR A 80 6.282 -9.513 -8.027 1.00 0.00 N ATOM 1173 CA TYR A 80 5.822 -8.147 -8.156 1.00 0.00 C ATOM 1174 C TYR A 80 5.571 -7.831 -9.631 1.00 0.00 C ATOM 1175 O TYR A 80 5.896 -8.619 -10.525 1.00 0.00 O ATOM 1176 CB TYR A 80 6.930 -7.224 -7.617 1.00 0.00 C ATOM 1177 CG TYR A 80 8.288 -7.376 -8.286 1.00 0.00 C ATOM 1178 CD1 TYR A 80 8.597 -6.645 -9.449 1.00 0.00 C ATOM 1179 CD2 TYR A 80 9.245 -8.256 -7.744 1.00 0.00 C ATOM 1180 CE1 TYR A 80 9.851 -6.789 -10.066 1.00 0.00 C ATOM 1181 CE2 TYR A 80 10.503 -8.400 -8.349 1.00 0.00 C ATOM 1182 CZ TYR A 80 10.815 -7.661 -9.510 1.00 0.00 C ATOM 1183 OH TYR A 80 12.022 -7.839 -10.108 1.00 0.00 O ATOM 0 H TYR A 80 7.253 -9.622 -8.319 1.00 0.00 H new ATOM 0 HA TYR A 80 4.896 -8.001 -7.599 1.00 0.00 H new ATOM 0 HB2 TYR A 80 6.603 -6.190 -7.727 1.00 0.00 H new ATOM 0 HB3 TYR A 80 7.047 -7.410 -6.549 1.00 0.00 H new ATOM 0 HD1 TYR A 80 7.866 -5.970 -9.869 1.00 0.00 H new ATOM 0 HD2 TYR A 80 9.009 -8.824 -6.856 1.00 0.00 H new ATOM 0 HE1 TYR A 80 10.078 -6.234 -10.964 1.00 0.00 H new ATOM 0 HE2 TYR A 80 11.232 -9.076 -7.926 1.00 0.00 H new ATOM 0 HH TYR A 80 12.556 -8.473 -9.585 1.00 0.00 H new ATOM 1193 N GLY A 81 4.969 -6.665 -9.850 1.00 0.00 N ATOM 1194 CA GLY A 81 4.400 -6.236 -11.114 1.00 0.00 C ATOM 1195 C GLY A 81 3.074 -5.519 -10.864 1.00 0.00 C ATOM 1196 O GLY A 81 2.123 -5.707 -11.629 1.00 0.00 O ATOM 0 H GLY A 81 4.862 -5.966 -9.115 1.00 0.00 H new ATOM 0 HA2 GLY A 81 5.093 -5.571 -11.629 1.00 0.00 H new ATOM 0 HA3 GLY A 81 4.242 -7.097 -11.764 1.00 0.00 H new ATOM 1200 N VAL A 82 2.973 -4.736 -9.779 1.00 0.00 N ATOM 1201 CA VAL A 82 1.739 -4.066 -9.385 1.00 0.00 C ATOM 1202 C VAL A 82 1.967 -2.551 -9.407 1.00 0.00 C ATOM 1203 O VAL A 82 3.053 -2.075 -9.063 1.00 0.00 O ATOM 1204 CB VAL A 82 1.237 -4.623 -8.029 1.00 0.00 C ATOM 1205 CG1 VAL A 82 0.996 -6.140 -8.080 1.00 0.00 C ATOM 1206 CG2 VAL A 82 2.195 -4.381 -6.856 1.00 0.00 C ATOM 0 H VAL A 82 3.755 -4.553 -9.150 1.00 0.00 H new ATOM 0 HA VAL A 82 0.935 -4.270 -10.093 1.00 0.00 H new ATOM 0 HB VAL A 82 0.311 -4.073 -7.861 1.00 0.00 H new ATOM 0 HG11 VAL A 82 0.645 -6.486 -7.108 1.00 0.00 H new ATOM 0 HG12 VAL A 82 0.245 -6.364 -8.837 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.927 -6.648 -8.331 1.00 0.00 H new ATOM 0 HG21 VAL A 82 1.769 -4.801 -5.945 1.00 0.00 H new ATOM 0 HG22 VAL A 82 3.152 -4.860 -7.063 1.00 0.00 H new ATOM 0 HG23 VAL A 82 2.346 -3.310 -6.725 1.00 0.00 H new ATOM 1216 N VAL A 83 0.947 -1.802 -9.830 1.00 0.00 N ATOM 1217 CA VAL A 83 1.013 -0.374 -10.134 1.00 0.00 C ATOM 1218 C VAL A 83 -0.372 0.253 -9.968 1.00 0.00 C ATOM 1219 O VAL A 83 -1.385 -0.458 -9.941 1.00 0.00 O ATOM 1220 CB VAL A 83 1.530 -0.136 -11.576 1.00 0.00 C ATOM 1221 CG1 VAL A 83 3.024 -0.438 -11.714 1.00 0.00 C ATOM 1222 CG2 VAL A 83 0.773 -0.945 -12.640 1.00 0.00 C ATOM 0 H VAL A 83 0.015 -2.191 -9.976 1.00 0.00 H new ATOM 0 HA VAL A 83 1.711 0.094 -9.440 1.00 0.00 H new ATOM 0 HB VAL A 83 1.349 0.924 -11.754 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.339 -0.256 -12.742 1.00 0.00 H new ATOM 0 HG12 VAL A 83 3.589 0.208 -11.042 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.210 -1.481 -11.457 1.00 0.00 H new ATOM 0 HG21 VAL A 83 1.188 -0.729 -13.625 1.00 0.00 H new ATOM 0 HG22 VAL A 83 0.875 -2.009 -12.429 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -0.282 -0.671 -12.623 1.00 0.00 H new ATOM 1232 N GLY A 84 -0.418 1.585 -9.925 1.00 0.00 N ATOM 1233 CA GLY A 84 -1.654 2.345 -9.966 1.00 0.00 C ATOM 1234 C GLY A 84 -1.453 3.799 -9.578 1.00 0.00 C ATOM 1235 O GLY A 84 -0.322 4.283 -9.468 1.00 0.00 O ATOM 0 H GLY A 84 0.417 2.168 -9.860 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -2.075 2.295 -10.970 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -2.380 1.889 -9.293 1.00 0.00 H new ATOM 1239 N VAL A 85 -2.561 4.508 -9.383 1.00 0.00 N ATOM 1240 CA VAL A 85 -2.544 5.875 -8.888 1.00 0.00 C ATOM 1241 C VAL A 85 -2.209 5.855 -7.396 1.00 0.00 C ATOM 1242 O VAL A 85 -2.819 5.102 -6.634 1.00 0.00 O ATOM 1243 CB VAL A 85 -3.897 6.549 -9.166 1.00 0.00 C ATOM 1244 CG1 VAL A 85 -4.022 7.927 -8.502 1.00 0.00 C ATOM 1245 CG2 VAL A 85 -4.073 6.742 -10.674 1.00 0.00 C ATOM 0 H VAL A 85 -3.497 4.147 -9.565 1.00 0.00 H new ATOM 0 HA VAL A 85 -1.781 6.459 -9.403 1.00 0.00 H new ATOM 0 HB VAL A 85 -4.662 5.894 -8.750 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -4.998 8.355 -8.733 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -3.918 7.821 -7.422 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -3.239 8.585 -8.879 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -5.033 7.220 -10.870 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -3.269 7.371 -11.057 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -4.042 5.772 -11.171 1.00 0.00 H new ATOM 1255 N GLY A 86 -1.289 6.733 -7.006 1.00 0.00 N ATOM 1256 CA GLY A 86 -1.197 7.351 -5.700 1.00 0.00 C ATOM 1257 C GLY A 86 -1.584 8.815 -5.898 1.00 0.00 C ATOM 1258 O GLY A 86 -1.339 9.379 -6.973 1.00 0.00 O ATOM 0 H GLY A 86 -0.548 7.046 -7.634 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -1.865 6.864 -4.990 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.187 7.265 -5.298 1.00 0.00 H new ATOM 1262 N TYR A 87 -2.208 9.432 -4.898 1.00 0.00 N ATOM 1263 CA TYR A 87 -2.719 10.793 -4.994 1.00 0.00 C ATOM 1264 C TYR A 87 -2.596 11.441 -3.624 1.00 0.00 C ATOM 1265 O TYR A 87 -2.885 10.796 -2.618 1.00 0.00 O ATOM 1266 CB TYR A 87 -4.189 10.763 -5.448 1.00 0.00 C ATOM 1267 CG TYR A 87 -4.581 11.884 -6.389 1.00 0.00 C ATOM 1268 CD1 TYR A 87 -4.909 13.171 -5.912 1.00 0.00 C ATOM 1269 CD2 TYR A 87 -4.642 11.610 -7.764 1.00 0.00 C ATOM 1270 CE1 TYR A 87 -5.282 14.188 -6.816 1.00 0.00 C ATOM 1271 CE2 TYR A 87 -5.031 12.607 -8.666 1.00 0.00 C ATOM 1272 CZ TYR A 87 -5.336 13.901 -8.201 1.00 0.00 C ATOM 1273 OH TYR A 87 -5.715 14.822 -9.127 1.00 0.00 O ATOM 0 H TYR A 87 -2.374 8.996 -3.991 1.00 0.00 H new ATOM 0 HA TYR A 87 -2.149 11.367 -5.725 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -4.385 9.809 -5.938 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -4.829 10.806 -4.567 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -4.874 13.378 -4.853 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -4.388 10.625 -8.128 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -5.524 15.176 -6.455 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -5.097 12.384 -9.721 1.00 0.00 H new ATOM 0 HH TYR A 87 -5.682 14.420 -10.020 1.00 0.00 H new ATOM 1283 N GLY A 88 -2.217 12.717 -3.582 1.00 0.00 N ATOM 1284 CA GLY A 88 -2.011 13.451 -2.345 1.00 0.00 C ATOM 1285 C GLY A 88 -2.600 14.838 -2.499 1.00 0.00 C ATOM 1286 O GLY A 88 -2.019 15.683 -3.187 1.00 0.00 O ATOM 0 H GLY A 88 -2.043 13.273 -4.419 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -2.485 12.930 -1.513 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -0.947 13.516 -2.117 1.00 0.00 H new ATOM 1290 N LYS A 89 -3.780 15.055 -1.912 1.00 0.00 N ATOM 1291 CA LYS A 89 -4.461 16.350 -1.898 1.00 0.00 C ATOM 1292 C LYS A 89 -3.739 17.364 -1.008 1.00 0.00 C ATOM 1293 O LYS A 89 -3.826 18.542 -1.307 1.00 0.00 O ATOM 1294 CB LYS A 89 -5.931 16.146 -1.489 1.00 0.00 C ATOM 1295 CG LYS A 89 -6.864 17.355 -1.730 1.00 0.00 C ATOM 1296 CD LYS A 89 -6.928 18.359 -0.564 1.00 0.00 C ATOM 1297 CE LYS A 89 -8.259 19.119 -0.479 1.00 0.00 C ATOM 1298 NZ LYS A 89 -8.569 19.921 -1.680 1.00 0.00 N ATOM 0 H LYS A 89 -4.297 14.323 -1.425 1.00 0.00 H new ATOM 0 HA LYS A 89 -4.440 16.775 -2.901 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -6.326 15.290 -2.036 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -5.963 15.890 -0.430 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -6.533 17.880 -2.626 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -7.870 16.986 -1.930 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -6.763 17.826 0.373 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -6.115 19.078 -0.669 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -9.065 18.403 -0.314 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -8.235 19.778 0.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -9.481 20.404 -1.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -7.821 20.628 -1.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -8.624 19.296 -2.510 1.00 0.00 H new ATOM 1312 N PHE A 90 -3.037 16.911 0.041 1.00 0.00 N ATOM 1313 CA PHE A 90 -2.081 17.643 0.884 1.00 0.00 C ATOM 1314 C PHE A 90 -2.421 19.139 1.006 1.00 0.00 C ATOM 1315 O PHE A 90 -1.906 19.942 0.234 1.00 0.00 O ATOM 1316 CB PHE A 90 -0.672 17.380 0.307 1.00 0.00 C ATOM 1317 CG PHE A 90 0.523 17.856 1.123 1.00 0.00 C ATOM 1318 CD1 PHE A 90 0.944 19.201 1.081 1.00 0.00 C ATOM 1319 CD2 PHE A 90 1.284 16.928 1.862 1.00 0.00 C ATOM 1320 CE1 PHE A 90 2.083 19.617 1.786 1.00 0.00 C ATOM 1321 CE2 PHE A 90 2.447 17.339 2.540 1.00 0.00 C ATOM 1322 CZ PHE A 90 2.849 18.685 2.503 1.00 0.00 C ATOM 0 H PHE A 90 -3.131 15.942 0.347 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.129 17.283 1.912 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.567 16.306 0.152 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.618 17.850 -0.675 1.00 0.00 H new ATOM 0 HD1 PHE A 90 0.384 19.918 0.500 1.00 0.00 H new ATOM 0 HD2 PHE A 90 0.973 15.895 1.908 1.00 0.00 H new ATOM 0 HE1 PHE A 90 2.371 20.658 1.777 1.00 0.00 H new ATOM 0 HE2 PHE A 90 3.032 16.617 3.091 1.00 0.00 H new ATOM 0 HZ PHE A 90 3.742 19.000 3.023 1.00 0.00 H new ATOM 1332 N GLN A 91 -3.290 19.526 1.950 1.00 0.00 N ATOM 1333 CA GLN A 91 -3.686 20.933 2.105 1.00 0.00 C ATOM 1334 C GLN A 91 -3.028 21.555 3.336 1.00 0.00 C ATOM 1335 O GLN A 91 -2.458 20.841 4.167 1.00 0.00 O ATOM 1336 CB GLN A 91 -5.218 21.086 2.052 1.00 0.00 C ATOM 1337 CG GLN A 91 -6.001 20.956 3.370 1.00 0.00 C ATOM 1338 CD GLN A 91 -6.110 22.251 4.184 1.00 0.00 C ATOM 1339 OE1 GLN A 91 -5.869 22.256 5.386 1.00 0.00 O ATOM 1340 NE2 GLN A 91 -6.475 23.366 3.575 1.00 0.00 N ATOM 0 H GLN A 91 -3.730 18.889 2.614 1.00 0.00 H new ATOM 0 HA GLN A 91 -3.311 21.507 1.258 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -5.442 22.064 1.625 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -5.605 20.339 1.358 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -7.006 20.599 3.145 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -5.523 20.195 3.987 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -6.675 23.359 2.575 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -6.557 24.233 4.105 1.00 0.00 H new ATOM 1349 N THR A 92 -3.096 22.879 3.450 1.00 0.00 N ATOM 1350 CA THR A 92 -2.603 23.678 4.558 1.00 0.00 C ATOM 1351 C THR A 92 -3.659 24.737 4.879 1.00 0.00 C ATOM 1352 O THR A 92 -4.269 25.251 3.940 1.00 0.00 O ATOM 1353 CB THR A 92 -1.272 24.321 4.145 1.00 0.00 C ATOM 1354 OG1 THR A 92 -1.368 24.981 2.893 1.00 0.00 O ATOM 1355 CG2 THR A 92 -0.162 23.277 3.984 1.00 0.00 C ATOM 0 H THR A 92 -3.524 23.454 2.724 1.00 0.00 H new ATOM 0 HA THR A 92 -2.427 23.072 5.447 1.00 0.00 H new ATOM 0 HB THR A 92 -1.038 25.026 4.943 1.00 0.00 H new ATOM 0 HG1 THR A 92 -1.706 25.891 3.028 1.00 0.00 H new ATOM 0 HG21 THR A 92 0.764 23.772 3.691 1.00 0.00 H new ATOM 0 HG22 THR A 92 -0.012 22.757 4.930 1.00 0.00 H new ATOM 0 HG23 THR A 92 -0.447 22.558 3.216 1.00 0.00 H new ATOM 1363 N THR A 93 -3.892 25.082 6.147 1.00 0.00 N ATOM 1364 CA THR A 93 -4.981 25.992 6.499 1.00 0.00 C ATOM 1365 C THR A 93 -4.724 27.420 5.970 1.00 0.00 C ATOM 1366 O THR A 93 -5.313 27.770 4.946 1.00 0.00 O ATOM 1367 CB THR A 93 -5.343 25.888 7.990 1.00 0.00 C ATOM 1368 OG1 THR A 93 -5.027 24.596 8.472 1.00 0.00 O ATOM 1369 CG2 THR A 93 -6.845 26.081 8.215 1.00 0.00 C ATOM 0 H THR A 93 -3.345 24.748 6.941 1.00 0.00 H new ATOM 0 HA THR A 93 -5.887 25.677 5.981 1.00 0.00 H new ATOM 0 HB THR A 93 -4.780 26.664 8.509 1.00 0.00 H new ATOM 0 HG1 THR A 93 -4.172 24.625 8.950 1.00 0.00 H new ATOM 0 HG21 THR A 93 -7.067 26.001 9.279 1.00 0.00 H new ATOM 0 HG22 THR A 93 -7.143 27.066 7.855 1.00 0.00 H new ATOM 0 HG23 THR A 93 -7.396 25.314 7.671 1.00 0.00 H new ATOM 1377 N GLU A 94 -3.856 28.248 6.571 1.00 0.00 N ATOM 1378 CA GLU A 94 -3.450 29.528 5.977 1.00 0.00 C ATOM 1379 C GLU A 94 -2.066 30.014 6.441 1.00 0.00 C ATOM 1380 O GLU A 94 -1.413 30.731 5.682 1.00 0.00 O ATOM 1381 CB GLU A 94 -4.517 30.633 6.153 1.00 0.00 C ATOM 1382 CG GLU A 94 -5.027 30.890 7.580 1.00 0.00 C ATOM 1383 CD GLU A 94 -6.104 29.893 8.013 1.00 0.00 C ATOM 1384 OE1 GLU A 94 -7.177 29.869 7.370 1.00 0.00 O ATOM 1385 OE2 GLU A 94 -5.882 29.155 9.005 1.00 0.00 O ATOM 0 H GLU A 94 -3.421 28.051 7.472 1.00 0.00 H new ATOM 0 HA GLU A 94 -3.363 29.321 4.910 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -4.105 31.566 5.767 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -5.373 30.380 5.528 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -4.189 30.838 8.275 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -5.429 31.901 7.641 1.00 0.00 H new ATOM 1392 N TYR A 95 -1.571 29.587 7.610 1.00 0.00 N ATOM 1393 CA TYR A 95 -0.264 29.953 8.166 1.00 0.00 C ATOM 1394 C TYR A 95 0.895 29.960 7.156 1.00 0.00 C ATOM 1395 O TYR A 95 1.651 30.936 7.154 1.00 0.00 O ATOM 1396 CB TYR A 95 0.077 29.057 9.370 1.00 0.00 C ATOM 1397 CG TYR A 95 -0.214 29.642 10.740 1.00 0.00 C ATOM 1398 CD1 TYR A 95 -1.354 30.438 10.968 1.00 0.00 C ATOM 1399 CD2 TYR A 95 0.653 29.345 11.809 1.00 0.00 C ATOM 1400 CE1 TYR A 95 -1.649 30.897 12.261 1.00 0.00 C ATOM 1401 CE2 TYR A 95 0.374 29.812 13.104 1.00 0.00 C ATOM 1402 CZ TYR A 95 -0.801 30.561 13.338 1.00 0.00 C ATOM 1403 OH TYR A 95 -1.160 30.875 14.612 1.00 0.00 O ATOM 0 H TYR A 95 -2.091 28.953 8.217 1.00 0.00 H new ATOM 0 HA TYR A 95 -0.370 30.990 8.484 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -0.477 28.123 9.271 1.00 0.00 H new ATOM 0 HB3 TYR A 95 1.137 28.806 9.322 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -2.003 30.696 10.144 1.00 0.00 H new ATOM 0 HD2 TYR A 95 1.539 28.754 11.632 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -2.524 31.507 12.432 1.00 0.00 H new ATOM 0 HE2 TYR A 95 1.054 29.600 13.916 1.00 0.00 H new ATOM 0 HH TYR A 95 -0.464 30.572 15.232 1.00 0.00 H new ATOM 1413 N PRO A 96 1.098 28.938 6.298 1.00 0.00 N ATOM 1414 CA PRO A 96 2.195 28.941 5.332 1.00 0.00 C ATOM 1415 C PRO A 96 1.918 29.861 4.128 1.00 0.00 C ATOM 1416 O PRO A 96 2.196 29.494 2.987 1.00 0.00 O ATOM 1417 CB PRO A 96 2.393 27.468 4.968 1.00 0.00 C ATOM 1418 CG PRO A 96 1.001 26.876 5.100 1.00 0.00 C ATOM 1419 CD PRO A 96 0.418 27.645 6.280 1.00 0.00 C ATOM 0 HA PRO A 96 3.113 29.362 5.743 1.00 0.00 H new ATOM 0 HB2 PRO A 96 2.783 27.354 3.956 1.00 0.00 H new ATOM 0 HB3 PRO A 96 3.101 26.981 5.639 1.00 0.00 H new ATOM 0 HG2 PRO A 96 0.413 27.019 4.194 1.00 0.00 H new ATOM 0 HG3 PRO A 96 1.034 25.804 5.293 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -0.659 27.773 6.168 1.00 0.00 H new ATOM 0 HD3 PRO A 96 0.580 27.107 7.214 1.00 0.00 H new ATOM 1427 N THR A 97 1.403 31.071 4.360 1.00 0.00 N ATOM 1428 CA THR A 97 1.000 32.033 3.337 1.00 0.00 C ATOM 1429 C THR A 97 0.052 31.356 2.332 1.00 0.00 C ATOM 1430 O THR A 97 0.291 31.354 1.120 1.00 0.00 O ATOM 1431 CB THR A 97 2.252 32.702 2.727 1.00 0.00 C ATOM 1432 OG1 THR A 97 3.143 33.075 3.765 1.00 0.00 O ATOM 1433 CG2 THR A 97 1.934 33.978 1.941 1.00 0.00 C ATOM 0 H THR A 97 1.250 31.420 5.306 1.00 0.00 H new ATOM 0 HA THR A 97 0.422 32.852 3.765 1.00 0.00 H new ATOM 0 HB THR A 97 2.684 31.968 2.047 1.00 0.00 H new ATOM 0 HG1 THR A 97 3.938 33.498 3.378 1.00 0.00 H new ATOM 0 HG21 THR A 97 2.856 34.397 1.539 1.00 0.00 H new ATOM 0 HG22 THR A 97 1.256 33.741 1.121 1.00 0.00 H new ATOM 0 HG23 THR A 97 1.463 34.705 2.603 1.00 0.00 H new ATOM 1441 N TYR A 98 -1.022 30.749 2.858 1.00 0.00 N ATOM 1442 CA TYR A 98 -2.082 30.033 2.151 1.00 0.00 C ATOM 1443 C TYR A 98 -1.593 28.685 1.603 1.00 0.00 C ATOM 1444 O TYR A 98 -2.241 27.672 1.854 1.00 0.00 O ATOM 1445 CB TYR A 98 -2.735 30.938 1.084 1.00 0.00 C ATOM 1446 CG TYR A 98 -4.213 30.693 0.823 1.00 0.00 C ATOM 1447 CD1 TYR A 98 -4.635 29.516 0.179 1.00 0.00 C ATOM 1448 CD2 TYR A 98 -5.170 31.662 1.188 1.00 0.00 C ATOM 1449 CE1 TYR A 98 -5.998 29.312 -0.112 1.00 0.00 C ATOM 1450 CE2 TYR A 98 -6.534 31.464 0.903 1.00 0.00 C ATOM 1451 CZ TYR A 98 -6.957 30.289 0.242 1.00 0.00 C ATOM 1452 OH TYR A 98 -8.273 30.075 -0.033 1.00 0.00 O ATOM 0 H TYR A 98 -1.179 30.749 3.866 1.00 0.00 H new ATOM 0 HA TYR A 98 -2.867 29.783 2.865 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -2.606 31.977 1.388 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -2.194 30.811 0.146 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -3.910 28.764 -0.094 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -4.854 32.564 1.691 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -6.312 28.405 -0.608 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -7.259 32.212 1.190 1.00 0.00 H new ATOM 0 HH TYR A 98 -8.800 30.841 0.275 1.00 0.00 H new ATOM 1462 N LYS A 99 -0.455 28.656 0.895 1.00 0.00 N ATOM 1463 CA LYS A 99 -0.013 27.581 0.008 1.00 0.00 C ATOM 1464 C LYS A 99 -1.167 27.164 -0.900 1.00 0.00 C ATOM 1465 O LYS A 99 -1.377 27.845 -1.903 1.00 0.00 O ATOM 1466 CB LYS A 99 0.668 26.439 0.789 1.00 0.00 C ATOM 1467 CG LYS A 99 2.194 26.563 0.788 1.00 0.00 C ATOM 1468 CD LYS A 99 2.839 25.419 1.581 1.00 0.00 C ATOM 1469 CE LYS A 99 4.360 25.582 1.569 1.00 0.00 C ATOM 1470 NZ LYS A 99 5.027 24.705 2.551 1.00 0.00 N ATOM 0 H LYS A 99 0.214 29.425 0.931 1.00 0.00 H new ATOM 0 HA LYS A 99 0.776 27.937 -0.655 1.00 0.00 H new ATOM 0 HB2 LYS A 99 0.306 26.439 1.817 1.00 0.00 H new ATOM 0 HB3 LYS A 99 0.383 25.482 0.351 1.00 0.00 H new ATOM 0 HG2 LYS A 99 2.563 26.552 -0.238 1.00 0.00 H new ATOM 0 HG3 LYS A 99 2.485 27.520 1.221 1.00 0.00 H new ATOM 0 HD2 LYS A 99 2.471 25.421 2.607 1.00 0.00 H new ATOM 0 HD3 LYS A 99 2.562 24.459 1.145 1.00 0.00 H new ATOM 0 HE2 LYS A 99 4.739 25.360 0.571 1.00 0.00 H new ATOM 0 HE3 LYS A 99 4.613 26.621 1.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 6.056 24.852 2.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 4.687 24.933 3.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 4.809 23.712 2.334 1.00 0.00 H new ATOM 1484 N ASN A 100 -1.934 26.121 -0.570 1.00 0.00 N ATOM 1485 CA ASN A 100 -2.969 25.522 -1.417 1.00 0.00 C ATOM 1486 C ASN A 100 -2.476 25.335 -2.857 1.00 0.00 C ATOM 1487 O ASN A 100 -3.175 25.632 -3.826 1.00 0.00 O ATOM 1488 CB ASN A 100 -4.278 26.320 -1.321 1.00 0.00 C ATOM 1489 CG ASN A 100 -5.439 25.529 -1.902 1.00 0.00 C ATOM 1490 OD1 ASN A 100 -5.679 24.397 -1.488 1.00 0.00 O ATOM 1491 ND2 ASN A 100 -6.187 26.075 -2.838 1.00 0.00 N ATOM 0 H ASN A 100 -1.847 25.652 0.332 1.00 0.00 H new ATOM 0 HA ASN A 100 -3.187 24.520 -1.046 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -4.484 26.564 -0.279 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -4.173 27.265 -1.855 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -6.975 25.558 -3.227 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -5.978 27.015 -3.174 1.00 0.00 H new ATOM 1498 N ASP A 101 -1.228 24.890 -2.993 1.00 0.00 N ATOM 1499 CA ASP A 101 -0.478 24.774 -4.244 1.00 0.00 C ATOM 1500 C ASP A 101 -0.118 23.311 -4.536 1.00 0.00 C ATOM 1501 O ASP A 101 0.536 23.015 -5.540 1.00 0.00 O ATOM 1502 CB ASP A 101 0.791 25.648 -4.175 1.00 0.00 C ATOM 1503 CG ASP A 101 1.852 25.067 -3.233 1.00 0.00 C ATOM 1504 OD1 ASP A 101 1.508 24.810 -2.054 1.00 0.00 O ATOM 1505 OD2 ASP A 101 2.989 24.808 -3.682 1.00 0.00 O ATOM 0 H ASP A 101 -0.682 24.583 -2.188 1.00 0.00 H new ATOM 0 HA ASP A 101 -1.106 25.128 -5.062 1.00 0.00 H new ATOM 0 HB2 ASP A 101 1.213 25.750 -5.175 1.00 0.00 H new ATOM 0 HB3 ASP A 101 0.521 26.649 -3.840 1.00 0.00 H new ATOM 1510 N THR A 102 -0.525 22.376 -3.678 1.00 0.00 N ATOM 1511 CA THR A 102 -0.268 20.949 -3.794 1.00 0.00 C ATOM 1512 C THR A 102 -1.630 20.249 -3.899 1.00 0.00 C ATOM 1513 O THR A 102 -2.499 20.526 -3.079 1.00 0.00 O ATOM 1514 CB THR A 102 0.530 20.488 -2.557 1.00 0.00 C ATOM 1515 OG1 THR A 102 1.689 21.277 -2.303 1.00 0.00 O ATOM 1516 CG2 THR A 102 1.001 19.046 -2.688 1.00 0.00 C ATOM 0 H THR A 102 -1.068 22.608 -2.846 1.00 0.00 H new ATOM 0 HA THR A 102 0.325 20.704 -4.675 1.00 0.00 H new ATOM 0 HB THR A 102 -0.174 20.598 -1.732 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.149 20.936 -1.508 1.00 0.00 H new ATOM 0 HG21 THR A 102 1.559 18.763 -1.795 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.138 18.390 -2.800 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.644 18.951 -3.563 1.00 0.00 H new ATOM 1524 N SER A 103 -1.808 19.360 -4.885 1.00 0.00 N ATOM 1525 CA SER A 103 -2.935 18.440 -5.098 1.00 0.00 C ATOM 1526 C SER A 103 -2.874 17.912 -6.539 1.00 0.00 C ATOM 1527 O SER A 103 -3.207 18.636 -7.478 1.00 0.00 O ATOM 1528 CB SER A 103 -4.311 19.034 -4.732 1.00 0.00 C ATOM 1529 OG SER A 103 -4.471 20.388 -5.108 1.00 0.00 O ATOM 0 H SER A 103 -1.106 19.257 -5.618 1.00 0.00 H new ATOM 0 HA SER A 103 -2.828 17.607 -4.403 1.00 0.00 H new ATOM 0 HB2 SER A 103 -5.090 18.440 -5.210 1.00 0.00 H new ATOM 0 HB3 SER A 103 -4.458 18.947 -3.656 1.00 0.00 H new ATOM 0 HG SER A 103 -5.364 20.697 -4.847 1.00 0.00 H new ATOM 1535 N ASP A 104 -2.370 16.691 -6.742 1.00 0.00 N ATOM 1536 CA ASP A 104 -2.033 16.111 -8.055 1.00 0.00 C ATOM 1537 C ASP A 104 -1.921 14.585 -7.899 1.00 0.00 C ATOM 1538 O ASP A 104 -1.939 14.085 -6.766 1.00 0.00 O ATOM 1539 CB ASP A 104 -0.692 16.729 -8.500 1.00 0.00 C ATOM 1540 CG ASP A 104 -0.195 16.436 -9.918 1.00 0.00 C ATOM 1541 OD1 ASP A 104 -0.857 15.761 -10.731 1.00 0.00 O ATOM 1542 OD2 ASP A 104 0.908 16.938 -10.222 1.00 0.00 O ATOM 0 H ASP A 104 -2.177 16.052 -5.971 1.00 0.00 H new ATOM 0 HA ASP A 104 -2.795 16.322 -8.806 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -0.772 17.811 -8.392 1.00 0.00 H new ATOM 0 HB3 ASP A 104 0.076 16.395 -7.802 1.00 0.00 H new ATOM 1547 N TYR A 105 -1.742 13.845 -8.992 1.00 0.00 N ATOM 1548 CA TYR A 105 -1.327 12.442 -9.020 1.00 0.00 C ATOM 1549 C TYR A 105 0.207 12.321 -8.909 1.00 0.00 C ATOM 1550 O TYR A 105 0.921 13.317 -8.726 1.00 0.00 O ATOM 1551 CB TYR A 105 -1.902 11.752 -10.280 1.00 0.00 C ATOM 1552 CG TYR A 105 -1.856 12.535 -11.585 1.00 0.00 C ATOM 1553 CD1 TYR A 105 -2.902 13.423 -11.910 1.00 0.00 C ATOM 1554 CD2 TYR A 105 -0.799 12.350 -12.498 1.00 0.00 C ATOM 1555 CE1 TYR A 105 -2.891 14.131 -13.123 1.00 0.00 C ATOM 1556 CE2 TYR A 105 -0.773 13.070 -13.710 1.00 0.00 C ATOM 1557 CZ TYR A 105 -1.822 13.964 -14.029 1.00 0.00 C ATOM 1558 OH TYR A 105 -1.811 14.637 -15.214 1.00 0.00 O ATOM 0 H TYR A 105 -1.889 14.225 -9.927 1.00 0.00 H new ATOM 0 HA TYR A 105 -1.734 11.921 -8.153 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -1.363 10.816 -10.428 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -2.941 11.492 -10.078 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -3.720 13.560 -11.219 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -0.006 11.654 -12.269 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -3.701 14.804 -13.363 1.00 0.00 H new ATOM 0 HE2 TYR A 105 0.050 12.939 -14.397 1.00 0.00 H new ATOM 0 HH TYR A 105 -1.001 14.405 -15.714 1.00 0.00 H new ATOM 1568 N GLY A 106 0.710 11.087 -8.974 1.00 0.00 N ATOM 1569 CA GLY A 106 2.116 10.703 -9.067 1.00 0.00 C ATOM 1570 C GLY A 106 2.268 9.660 -10.176 1.00 0.00 C ATOM 1571 O GLY A 106 1.503 9.681 -11.144 1.00 0.00 O ATOM 0 H GLY A 106 0.098 10.271 -8.962 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.732 11.576 -9.282 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.460 10.296 -8.116 1.00 0.00 H new ATOM 1575 N PHE A 107 3.255 8.773 -10.056 1.00 0.00 N ATOM 1576 CA PHE A 107 3.264 7.428 -10.637 1.00 0.00 C ATOM 1577 C PHE A 107 3.681 6.497 -9.503 1.00 0.00 C ATOM 1578 O PHE A 107 4.701 6.769 -8.868 1.00 0.00 O ATOM 1579 CB PHE A 107 4.250 7.334 -11.810 1.00 0.00 C ATOM 1580 CG PHE A 107 4.287 5.988 -12.521 1.00 0.00 C ATOM 1581 CD1 PHE A 107 4.754 4.826 -11.868 1.00 0.00 C ATOM 1582 CD2 PHE A 107 3.870 5.897 -13.861 1.00 0.00 C ATOM 1583 CE1 PHE A 107 4.767 3.587 -12.533 1.00 0.00 C ATOM 1584 CE2 PHE A 107 3.929 4.667 -14.537 1.00 0.00 C ATOM 1585 CZ PHE A 107 4.366 3.508 -13.875 1.00 0.00 C ATOM 0 H PHE A 107 4.105 8.978 -9.531 1.00 0.00 H new ATOM 0 HA PHE A 107 2.287 7.163 -11.041 1.00 0.00 H new ATOM 0 HB2 PHE A 107 3.997 8.105 -12.538 1.00 0.00 H new ATOM 0 HB3 PHE A 107 5.251 7.560 -11.441 1.00 0.00 H new ATOM 0 HD1 PHE A 107 5.104 4.890 -10.848 1.00 0.00 H new ATOM 0 HD2 PHE A 107 3.503 6.775 -14.372 1.00 0.00 H new ATOM 0 HE1 PHE A 107 5.085 2.697 -12.011 1.00 0.00 H new ATOM 0 HE2 PHE A 107 3.636 4.612 -15.575 1.00 0.00 H new ATOM 0 HZ PHE A 107 4.393 2.562 -14.396 1.00 0.00 H new ATOM 1595 N SER A 108 2.949 5.412 -9.249 1.00 0.00 N ATOM 1596 CA SER A 108 3.115 4.592 -8.055 1.00 0.00 C ATOM 1597 C SER A 108 3.241 3.125 -8.466 1.00 0.00 C ATOM 1598 O SER A 108 2.470 2.622 -9.291 1.00 0.00 O ATOM 1599 CB SER A 108 1.948 4.856 -7.093 1.00 0.00 C ATOM 1600 OG SER A 108 1.830 6.245 -6.832 1.00 0.00 O ATOM 0 H SER A 108 2.217 5.077 -9.875 1.00 0.00 H new ATOM 0 HA SER A 108 4.030 4.852 -7.522 1.00 0.00 H new ATOM 0 HB2 SER A 108 1.020 4.480 -7.524 1.00 0.00 H new ATOM 0 HB3 SER A 108 2.108 4.316 -6.160 1.00 0.00 H new ATOM 0 HG SER A 108 1.777 6.393 -5.865 1.00 0.00 H new ATOM 1606 N TYR A 109 4.254 2.463 -7.911 1.00 0.00 N ATOM 1607 CA TYR A 109 4.614 1.066 -8.114 1.00 0.00 C ATOM 1608 C TYR A 109 4.828 0.453 -6.729 1.00 0.00 C ATOM 1609 O TYR A 109 5.269 1.154 -5.811 1.00 0.00 O ATOM 1610 CB TYR A 109 5.874 0.986 -9.010 1.00 0.00 C ATOM 1611 CG TYR A 109 6.965 0.028 -8.554 1.00 0.00 C ATOM 1612 CD1 TYR A 109 6.864 -1.355 -8.801 1.00 0.00 C ATOM 1613 CD2 TYR A 109 8.065 0.524 -7.828 1.00 0.00 C ATOM 1614 CE1 TYR A 109 7.838 -2.239 -8.294 1.00 0.00 C ATOM 1615 CE2 TYR A 109 9.045 -0.352 -7.332 1.00 0.00 C ATOM 1616 CZ TYR A 109 8.924 -1.743 -7.538 1.00 0.00 C ATOM 1617 OH TYR A 109 9.860 -2.585 -7.014 1.00 0.00 O ATOM 0 H TYR A 109 4.890 2.925 -7.261 1.00 0.00 H new ATOM 0 HA TYR A 109 3.833 0.506 -8.629 1.00 0.00 H new ATOM 0 HB2 TYR A 109 5.562 0.697 -10.014 1.00 0.00 H new ATOM 0 HB3 TYR A 109 6.305 1.985 -9.085 1.00 0.00 H new ATOM 0 HD1 TYR A 109 6.038 -1.739 -9.381 1.00 0.00 H new ATOM 0 HD2 TYR A 109 8.156 1.586 -7.651 1.00 0.00 H new ATOM 0 HE1 TYR A 109 7.754 -3.299 -8.484 1.00 0.00 H new ATOM 0 HE2 TYR A 109 9.894 0.040 -6.791 1.00 0.00 H new ATOM 0 HH TYR A 109 10.532 -2.064 -6.526 1.00 0.00 H new ATOM 1627 N GLY A 110 4.543 -0.843 -6.597 1.00 0.00 N ATOM 1628 CA GLY A 110 4.758 -1.631 -5.394 1.00 0.00 C ATOM 1629 C GLY A 110 5.032 -3.084 -5.771 1.00 0.00 C ATOM 1630 O GLY A 110 5.227 -3.407 -6.949 1.00 0.00 O ATOM 0 H GLY A 110 4.140 -1.389 -7.358 1.00 0.00 H new ATOM 0 HA2 GLY A 110 5.598 -1.227 -4.829 1.00 0.00 H new ATOM 0 HA3 GLY A 110 3.882 -1.572 -4.748 1.00 0.00 H new ATOM 1634 N ALA A 111 5.065 -3.970 -4.776 1.00 0.00 N ATOM 1635 CA ALA A 111 5.553 -5.331 -4.930 1.00 0.00 C ATOM 1636 C ALA A 111 4.683 -6.357 -4.198 1.00 0.00 C ATOM 1637 O ALA A 111 3.742 -5.997 -3.486 1.00 0.00 O ATOM 1638 CB ALA A 111 7.003 -5.349 -4.440 1.00 0.00 C ATOM 0 H ALA A 111 4.749 -3.755 -3.830 1.00 0.00 H new ATOM 0 HA ALA A 111 5.502 -5.626 -5.978 1.00 0.00 H new ATOM 0 HB1 ALA A 111 7.408 -6.356 -4.539 1.00 0.00 H new ATOM 0 HB2 ALA A 111 7.598 -4.658 -5.038 1.00 0.00 H new ATOM 0 HB3 ALA A 111 7.037 -5.045 -3.394 1.00 0.00 H new ATOM 1644 N GLY A 112 4.991 -7.648 -4.375 1.00 0.00 N ATOM 1645 CA GLY A 112 4.297 -8.728 -3.684 1.00 0.00 C ATOM 1646 C GLY A 112 5.214 -9.932 -3.545 1.00 0.00 C ATOM 1647 O GLY A 112 5.177 -10.832 -4.385 1.00 0.00 O ATOM 0 H GLY A 112 5.729 -7.967 -5.002 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.974 -8.392 -2.699 1.00 0.00 H new ATOM 0 HA3 GLY A 112 3.399 -9.006 -4.236 1.00 0.00 H new ATOM 1651 N LEU A 113 6.072 -9.940 -2.525 1.00 0.00 N ATOM 1652 CA LEU A 113 7.056 -10.994 -2.280 1.00 0.00 C ATOM 1653 C LEU A 113 6.681 -11.667 -0.963 1.00 0.00 C ATOM 1654 O LEU A 113 6.154 -11.020 -0.057 1.00 0.00 O ATOM 1655 CB LEU A 113 8.483 -10.420 -2.206 1.00 0.00 C ATOM 1656 CG LEU A 113 9.140 -9.953 -3.521 1.00 0.00 C ATOM 1657 CD1 LEU A 113 9.272 -11.062 -4.570 1.00 0.00 C ATOM 1658 CD2 LEU A 113 8.415 -8.766 -4.154 1.00 0.00 C ATOM 0 H LEU A 113 6.103 -9.195 -1.829 1.00 0.00 H new ATOM 0 HA LEU A 113 7.047 -11.713 -3.099 1.00 0.00 H new ATOM 0 HB2 LEU A 113 8.468 -9.573 -1.520 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.127 -11.179 -1.761 1.00 0.00 H new ATOM 0 HG LEU A 113 10.141 -9.646 -3.218 1.00 0.00 H new ATOM 0 HD11 LEU A 113 9.742 -10.660 -5.467 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.885 -11.870 -4.170 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.283 -11.446 -4.820 1.00 0.00 H new ATOM 0 HD21 LEU A 113 8.921 -8.480 -5.076 1.00 0.00 H new ATOM 0 HD22 LEU A 113 7.385 -9.045 -4.377 1.00 0.00 H new ATOM 0 HD23 LEU A 113 8.421 -7.925 -3.461 1.00 0.00 H new ATOM 1670 N GLN A 114 6.899 -12.978 -0.863 1.00 0.00 N ATOM 1671 CA GLN A 114 6.344 -13.824 0.182 1.00 0.00 C ATOM 1672 C GLN A 114 7.327 -14.932 0.542 1.00 0.00 C ATOM 1673 O GLN A 114 7.759 -15.670 -0.342 1.00 0.00 O ATOM 1674 CB GLN A 114 5.039 -14.448 -0.322 1.00 0.00 C ATOM 1675 CG GLN A 114 3.898 -13.438 -0.455 1.00 0.00 C ATOM 1676 CD GLN A 114 2.576 -14.171 -0.622 1.00 0.00 C ATOM 1677 OE1 GLN A 114 2.132 -14.462 -1.722 1.00 0.00 O ATOM 1678 NE2 GLN A 114 1.896 -14.483 0.466 1.00 0.00 N ATOM 0 H GLN A 114 7.482 -13.490 -1.525 1.00 0.00 H new ATOM 0 HA GLN A 114 6.153 -13.220 1.069 1.00 0.00 H new ATOM 0 HB2 GLN A 114 5.218 -14.914 -1.291 1.00 0.00 H new ATOM 0 HB3 GLN A 114 4.736 -15.241 0.362 1.00 0.00 H new ATOM 0 HG2 GLN A 114 3.861 -12.799 0.428 1.00 0.00 H new ATOM 0 HG3 GLN A 114 4.074 -12.788 -1.312 1.00 0.00 H new ATOM 0 HE21 GLN A 114 2.265 -14.241 1.385 1.00 0.00 H new ATOM 0 HE22 GLN A 114 1.001 -14.966 0.387 1.00 0.00 H new ATOM 1687 N PHE A 115 7.642 -15.099 1.828 1.00 0.00 N ATOM 1688 CA PHE A 115 8.437 -16.221 2.321 1.00 0.00 C ATOM 1689 C PHE A 115 7.511 -17.315 2.843 1.00 0.00 C ATOM 1690 O PHE A 115 6.351 -17.048 3.162 1.00 0.00 O ATOM 1691 CB PHE A 115 9.414 -15.740 3.407 1.00 0.00 C ATOM 1692 CG PHE A 115 10.841 -15.641 2.915 1.00 0.00 C ATOM 1693 CD1 PHE A 115 11.131 -14.865 1.777 1.00 0.00 C ATOM 1694 CD2 PHE A 115 11.859 -16.400 3.526 1.00 0.00 C ATOM 1695 CE1 PHE A 115 12.420 -14.879 1.227 1.00 0.00 C ATOM 1696 CE2 PHE A 115 13.149 -16.416 2.966 1.00 0.00 C ATOM 1697 CZ PHE A 115 13.422 -15.666 1.809 1.00 0.00 C ATOM 0 H PHE A 115 7.349 -14.453 2.561 1.00 0.00 H new ATOM 0 HA PHE A 115 9.029 -16.638 1.506 1.00 0.00 H new ATOM 0 HB2 PHE A 115 9.092 -14.764 3.771 1.00 0.00 H new ATOM 0 HB3 PHE A 115 9.374 -16.425 4.254 1.00 0.00 H new ATOM 0 HD1 PHE A 115 10.359 -14.258 1.327 1.00 0.00 H new ATOM 0 HD2 PHE A 115 11.649 -16.967 4.421 1.00 0.00 H new ATOM 0 HE1 PHE A 115 12.641 -14.283 0.354 1.00 0.00 H new ATOM 0 HE2 PHE A 115 13.930 -17.004 3.425 1.00 0.00 H new ATOM 0 HZ PHE A 115 14.407 -15.697 1.367 1.00 0.00 H new ATOM 1707 N ASN A 116 8.035 -18.538 2.924 1.00 0.00 N ATOM 1708 CA ASN A 116 7.340 -19.720 3.428 1.00 0.00 C ATOM 1709 C ASN A 116 6.891 -19.468 4.884 1.00 0.00 C ATOM 1710 O ASN A 116 7.768 -19.273 5.727 1.00 0.00 O ATOM 1711 CB ASN A 116 8.294 -20.917 3.322 1.00 0.00 C ATOM 1712 CG ASN A 116 7.588 -22.224 3.625 1.00 0.00 C ATOM 1713 OD1 ASN A 116 7.457 -22.616 4.782 1.00 0.00 O ATOM 1714 ND2 ASN A 116 7.144 -22.937 2.605 1.00 0.00 N ATOM 0 H ASN A 116 8.991 -18.739 2.629 1.00 0.00 H new ATOM 0 HA ASN A 116 6.446 -19.933 2.842 1.00 0.00 H new ATOM 0 HB2 ASN A 116 8.718 -20.957 2.319 1.00 0.00 H new ATOM 0 HB3 ASN A 116 9.125 -20.783 4.015 1.00 0.00 H new ATOM 0 HD21 ASN A 116 6.682 -23.831 2.770 1.00 0.00 H new ATOM 0 HD22 ASN A 116 7.263 -22.593 1.652 1.00 0.00 H new ATOM 1721 N PRO A 117 5.581 -19.365 5.184 1.00 0.00 N ATOM 1722 CA PRO A 117 5.088 -18.787 6.432 1.00 0.00 C ATOM 1723 C PRO A 117 5.095 -19.820 7.560 1.00 0.00 C ATOM 1724 O PRO A 117 4.574 -20.928 7.391 1.00 0.00 O ATOM 1725 CB PRO A 117 3.657 -18.335 6.117 1.00 0.00 C ATOM 1726 CG PRO A 117 3.186 -19.365 5.089 1.00 0.00 C ATOM 1727 CD PRO A 117 4.462 -19.666 4.302 1.00 0.00 C ATOM 0 HA PRO A 117 5.715 -17.964 6.774 1.00 0.00 H new ATOM 0 HB2 PRO A 117 3.028 -18.338 7.007 1.00 0.00 H new ATOM 0 HB3 PRO A 117 3.634 -17.323 5.713 1.00 0.00 H new ATOM 0 HG2 PRO A 117 2.785 -20.259 5.567 1.00 0.00 H new ATOM 0 HG3 PRO A 117 2.400 -18.966 4.448 1.00 0.00 H new ATOM 0 HD2 PRO A 117 4.486 -20.710 3.989 1.00 0.00 H new ATOM 0 HD3 PRO A 117 4.510 -19.061 3.397 1.00 0.00 H new ATOM 1735 N MET A 118 5.630 -19.464 8.728 1.00 0.00 N ATOM 1736 CA MET A 118 5.642 -20.314 9.908 1.00 0.00 C ATOM 1737 C MET A 118 5.999 -19.453 11.124 1.00 0.00 C ATOM 1738 O MET A 118 6.613 -18.400 10.964 1.00 0.00 O ATOM 1739 CB MET A 118 6.669 -21.448 9.695 1.00 0.00 C ATOM 1740 CG MET A 118 6.408 -22.637 10.618 1.00 0.00 C ATOM 1741 SD MET A 118 7.103 -24.204 10.028 1.00 0.00 S ATOM 1742 CE MET A 118 6.599 -25.279 11.392 1.00 0.00 C ATOM 0 H MET A 118 6.075 -18.558 8.878 1.00 0.00 H new ATOM 0 HA MET A 118 4.665 -20.767 10.079 1.00 0.00 H new ATOM 0 HB2 MET A 118 6.633 -21.780 8.657 1.00 0.00 H new ATOM 0 HB3 MET A 118 7.674 -21.065 9.872 1.00 0.00 H new ATOM 0 HG2 MET A 118 6.822 -22.416 11.602 1.00 0.00 H new ATOM 0 HG3 MET A 118 5.332 -22.755 10.745 1.00 0.00 H new ATOM 0 HE1 MET A 118 6.944 -26.295 11.201 1.00 0.00 H new ATOM 0 HE2 MET A 118 7.037 -24.916 12.322 1.00 0.00 H new ATOM 0 HE3 MET A 118 5.512 -25.274 11.477 1.00 0.00 H new ATOM 1752 N GLU A 119 5.633 -19.903 12.327 1.00 0.00 N ATOM 1753 CA GLU A 119 6.093 -19.414 13.641 1.00 0.00 C ATOM 1754 C GLU A 119 5.128 -18.344 14.178 1.00 0.00 C ATOM 1755 O GLU A 119 5.506 -17.440 14.921 1.00 0.00 O ATOM 1756 CB GLU A 119 7.587 -19.004 13.618 1.00 0.00 C ATOM 1757 CG GLU A 119 8.277 -19.031 14.990 1.00 0.00 C ATOM 1758 CD GLU A 119 9.798 -18.911 14.832 1.00 0.00 C ATOM 1759 OE1 GLU A 119 10.444 -19.935 14.507 1.00 0.00 O ATOM 1760 OE2 GLU A 119 10.360 -17.802 15.002 1.00 0.00 O ATOM 0 H GLU A 119 4.965 -20.668 12.422 1.00 0.00 H new ATOM 0 HA GLU A 119 6.061 -20.230 14.363 1.00 0.00 H new ATOM 0 HB2 GLU A 119 8.123 -19.671 12.943 1.00 0.00 H new ATOM 0 HB3 GLU A 119 7.668 -17.999 13.204 1.00 0.00 H new ATOM 0 HG2 GLU A 119 7.904 -18.213 15.607 1.00 0.00 H new ATOM 0 HG3 GLU A 119 8.032 -19.958 15.508 1.00 0.00 H new ATOM 1767 N ASN A 120 3.852 -18.446 13.788 1.00 0.00 N ATOM 1768 CA ASN A 120 2.789 -17.464 14.001 1.00 0.00 C ATOM 1769 C ASN A 120 3.226 -16.054 13.586 1.00 0.00 C ATOM 1770 O ASN A 120 2.848 -15.053 14.198 1.00 0.00 O ATOM 1771 CB ASN A 120 2.184 -17.559 15.413 1.00 0.00 C ATOM 1772 CG ASN A 120 0.714 -17.141 15.421 1.00 0.00 C ATOM 1773 OD1 ASN A 120 -0.179 -17.976 15.527 1.00 0.00 O ATOM 1774 ND2 ASN A 120 0.396 -15.864 15.301 1.00 0.00 N ATOM 0 H ASN A 120 3.516 -19.267 13.285 1.00 0.00 H new ATOM 0 HA ASN A 120 1.964 -17.713 13.333 1.00 0.00 H new ATOM 0 HB2 ASN A 120 2.275 -18.581 15.781 1.00 0.00 H new ATOM 0 HB3 ASN A 120 2.748 -16.923 16.095 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -0.584 -15.581 15.297 1.00 0.00 H new ATOM 0 HD22 ASN A 120 1.130 -15.162 15.212 1.00 0.00 H new ATOM 1781 N VAL A 121 4.002 -15.991 12.507 1.00 0.00 N ATOM 1782 CA VAL A 121 4.307 -14.814 11.718 1.00 0.00 C ATOM 1783 C VAL A 121 4.179 -15.249 10.256 1.00 0.00 C ATOM 1784 O VAL A 121 4.720 -16.282 9.852 1.00 0.00 O ATOM 1785 CB VAL A 121 5.699 -14.238 12.072 1.00 0.00 C ATOM 1786 CG1 VAL A 121 5.706 -13.690 13.502 1.00 0.00 C ATOM 1787 CG2 VAL A 121 6.859 -15.240 11.976 1.00 0.00 C ATOM 0 H VAL A 121 4.464 -16.823 12.140 1.00 0.00 H new ATOM 0 HA VAL A 121 3.620 -13.993 11.924 1.00 0.00 H new ATOM 0 HB VAL A 121 5.862 -13.462 11.324 1.00 0.00 H new ATOM 0 HG11 VAL A 121 6.693 -13.289 13.733 1.00 0.00 H new ATOM 0 HG12 VAL A 121 4.963 -12.898 13.592 1.00 0.00 H new ATOM 0 HG13 VAL A 121 5.468 -14.492 14.200 1.00 0.00 H new ATOM 0 HG21 VAL A 121 7.792 -14.743 12.242 1.00 0.00 H new ATOM 0 HG22 VAL A 121 6.681 -16.069 12.661 1.00 0.00 H new ATOM 0 HG23 VAL A 121 6.928 -15.620 10.957 1.00 0.00 H new ATOM 1797 N ALA A 122 3.387 -14.536 9.462 1.00 0.00 N ATOM 1798 CA ALA A 122 3.606 -14.558 8.025 1.00 0.00 C ATOM 1799 C ALA A 122 4.890 -13.776 7.744 1.00 0.00 C ATOM 1800 O ALA A 122 5.261 -12.923 8.551 1.00 0.00 O ATOM 1801 CB ALA A 122 2.419 -13.906 7.328 1.00 0.00 C ATOM 0 H ALA A 122 2.612 -13.954 9.778 1.00 0.00 H new ATOM 0 HA ALA A 122 3.703 -15.578 7.654 1.00 0.00 H new ATOM 0 HB1 ALA A 122 2.578 -13.920 6.250 1.00 0.00 H new ATOM 0 HB2 ALA A 122 1.509 -14.456 7.568 1.00 0.00 H new ATOM 0 HB3 ALA A 122 2.319 -12.875 7.667 1.00 0.00 H new ATOM 1807 N LEU A 123 5.526 -14.003 6.593 1.00 0.00 N ATOM 1808 CA LEU A 123 6.623 -13.173 6.122 1.00 0.00 C ATOM 1809 C LEU A 123 6.267 -12.792 4.690 1.00 0.00 C ATOM 1810 O LEU A 123 6.170 -13.653 3.812 1.00 0.00 O ATOM 1811 CB LEU A 123 7.968 -13.928 6.170 1.00 0.00 C ATOM 1812 CG LEU A 123 8.793 -13.931 7.473 1.00 0.00 C ATOM 1813 CD1 LEU A 123 9.298 -12.533 7.839 1.00 0.00 C ATOM 1814 CD2 LEU A 123 8.085 -14.551 8.675 1.00 0.00 C ATOM 0 H LEU A 123 5.290 -14.771 5.964 1.00 0.00 H new ATOM 0 HA LEU A 123 6.749 -12.295 6.756 1.00 0.00 H new ATOM 0 HB2 LEU A 123 7.768 -14.967 5.908 1.00 0.00 H new ATOM 0 HB3 LEU A 123 8.601 -13.517 5.384 1.00 0.00 H new ATOM 0 HG LEU A 123 9.641 -14.576 7.243 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.874 -12.584 8.763 1.00 0.00 H new ATOM 0 HD12 LEU A 123 9.932 -12.154 7.037 1.00 0.00 H new ATOM 0 HD13 LEU A 123 8.449 -11.864 7.977 1.00 0.00 H new ATOM 0 HD21 LEU A 123 8.741 -14.509 9.545 1.00 0.00 H new ATOM 0 HD22 LEU A 123 7.170 -13.997 8.883 1.00 0.00 H new ATOM 0 HD23 LEU A 123 7.839 -15.590 8.456 1.00 0.00 H new ATOM 1826 N ASP A 124 6.059 -11.509 4.443 1.00 0.00 N ATOM 1827 CA ASP A 124 5.796 -10.870 3.151 1.00 0.00 C ATOM 1828 C ASP A 124 6.534 -9.535 3.184 1.00 0.00 C ATOM 1829 O ASP A 124 6.916 -9.081 4.271 1.00 0.00 O ATOM 1830 CB ASP A 124 4.274 -10.778 3.013 1.00 0.00 C ATOM 1831 CG ASP A 124 3.616 -9.936 1.916 1.00 0.00 C ATOM 1832 OD1 ASP A 124 4.071 -8.831 1.571 1.00 0.00 O ATOM 1833 OD2 ASP A 124 2.485 -10.320 1.523 1.00 0.00 O ATOM 0 H ASP A 124 6.069 -10.826 5.200 1.00 0.00 H new ATOM 0 HA ASP A 124 6.153 -11.409 2.273 1.00 0.00 H new ATOM 0 HB2 ASP A 124 3.905 -11.797 2.893 1.00 0.00 H new ATOM 0 HB3 ASP A 124 3.892 -10.411 3.965 1.00 0.00 H new ATOM 1838 N PHE A 125 6.882 -8.973 2.029 1.00 0.00 N ATOM 1839 CA PHE A 125 7.665 -7.751 1.978 1.00 0.00 C ATOM 1840 C PHE A 125 7.309 -6.955 0.728 1.00 0.00 C ATOM 1841 O PHE A 125 7.439 -7.453 -0.396 1.00 0.00 O ATOM 1842 CB PHE A 125 9.165 -8.100 2.039 1.00 0.00 C ATOM 1843 CG PHE A 125 10.021 -7.178 2.892 1.00 0.00 C ATOM 1844 CD1 PHE A 125 9.622 -6.805 4.195 1.00 0.00 C ATOM 1845 CD2 PHE A 125 11.271 -6.755 2.408 1.00 0.00 C ATOM 1846 CE1 PHE A 125 10.470 -6.016 4.990 1.00 0.00 C ATOM 1847 CE2 PHE A 125 12.117 -5.962 3.201 1.00 0.00 C ATOM 1848 CZ PHE A 125 11.718 -5.600 4.497 1.00 0.00 C ATOM 0 H PHE A 125 6.631 -9.350 1.115 1.00 0.00 H new ATOM 0 HA PHE A 125 7.434 -7.122 2.838 1.00 0.00 H new ATOM 0 HB2 PHE A 125 9.268 -9.116 2.419 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.562 -8.098 1.024 1.00 0.00 H new ATOM 0 HD1 PHE A 125 8.665 -7.126 4.580 1.00 0.00 H new ATOM 0 HD2 PHE A 125 11.585 -7.043 1.415 1.00 0.00 H new ATOM 0 HE1 PHE A 125 10.161 -5.728 5.984 1.00 0.00 H new ATOM 0 HE2 PHE A 125 13.070 -5.632 2.815 1.00 0.00 H new ATOM 0 HZ PHE A 125 12.371 -5.002 5.115 1.00 0.00 H new ATOM 1858 N SER A 126 6.911 -5.700 0.922 1.00 0.00 N ATOM 1859 CA SER A 126 6.807 -4.724 -0.147 1.00 0.00 C ATOM 1860 C SER A 126 7.440 -3.420 0.331 1.00 0.00 C ATOM 1861 O SER A 126 7.707 -3.219 1.524 1.00 0.00 O ATOM 1862 CB SER A 126 5.342 -4.550 -0.575 1.00 0.00 C ATOM 1863 OG SER A 126 5.258 -3.843 -1.796 1.00 0.00 O ATOM 0 H SER A 126 6.650 -5.333 1.837 1.00 0.00 H new ATOM 0 HA SER A 126 7.344 -5.063 -1.033 1.00 0.00 H new ATOM 0 HB2 SER A 126 4.871 -5.527 -0.682 1.00 0.00 H new ATOM 0 HB3 SER A 126 4.793 -4.014 0.199 1.00 0.00 H new ATOM 0 HG SER A 126 4.358 -3.467 -1.895 1.00 0.00 H new ATOM 1869 N TYR A 127 7.674 -2.547 -0.634 1.00 0.00 N ATOM 1870 CA TYR A 127 8.047 -1.162 -0.504 1.00 0.00 C ATOM 1871 C TYR A 127 7.436 -0.532 -1.746 1.00 0.00 C ATOM 1872 O TYR A 127 7.655 -1.029 -2.856 1.00 0.00 O ATOM 1873 CB TYR A 127 9.575 -1.027 -0.462 1.00 0.00 C ATOM 1874 CG TYR A 127 10.094 0.252 0.166 1.00 0.00 C ATOM 1875 CD1 TYR A 127 9.757 1.512 -0.367 1.00 0.00 C ATOM 1876 CD2 TYR A 127 10.963 0.174 1.269 1.00 0.00 C ATOM 1877 CE1 TYR A 127 10.296 2.687 0.186 1.00 0.00 C ATOM 1878 CE2 TYR A 127 11.539 1.340 1.802 1.00 0.00 C ATOM 1879 CZ TYR A 127 11.208 2.602 1.259 1.00 0.00 C ATOM 1880 OH TYR A 127 11.815 3.723 1.729 1.00 0.00 O ATOM 0 H TYR A 127 7.599 -2.822 -1.613 1.00 0.00 H new ATOM 0 HA TYR A 127 7.698 -0.684 0.411 1.00 0.00 H new ATOM 0 HB2 TYR A 127 9.983 -1.875 0.088 1.00 0.00 H new ATOM 0 HB3 TYR A 127 9.958 -1.094 -1.480 1.00 0.00 H new ATOM 0 HD1 TYR A 127 9.080 1.576 -1.206 1.00 0.00 H new ATOM 0 HD2 TYR A 127 11.189 -0.786 1.709 1.00 0.00 H new ATOM 0 HE1 TYR A 127 10.013 3.651 -0.209 1.00 0.00 H new ATOM 0 HE2 TYR A 127 12.234 1.272 2.626 1.00 0.00 H new ATOM 0 HH TYR A 127 12.411 3.486 2.470 1.00 0.00 H new ATOM 1890 N GLU A 128 6.640 0.516 -1.576 1.00 0.00 N ATOM 1891 CA GLU A 128 6.006 1.223 -2.675 1.00 0.00 C ATOM 1892 C GLU A 128 6.616 2.624 -2.727 1.00 0.00 C ATOM 1893 O GLU A 128 6.766 3.258 -1.679 1.00 0.00 O ATOM 1894 CB GLU A 128 4.472 1.166 -2.510 1.00 0.00 C ATOM 1895 CG GLU A 128 3.887 2.083 -1.422 1.00 0.00 C ATOM 1896 CD GLU A 128 2.371 1.933 -1.260 1.00 0.00 C ATOM 1897 OE1 GLU A 128 1.921 0.840 -0.844 1.00 0.00 O ATOM 1898 OE2 GLU A 128 1.613 2.888 -1.559 1.00 0.00 O ATOM 0 H GLU A 128 6.416 0.902 -0.659 1.00 0.00 H new ATOM 0 HA GLU A 128 6.191 0.763 -3.646 1.00 0.00 H new ATOM 0 HB2 GLU A 128 4.012 1.424 -3.464 1.00 0.00 H new ATOM 0 HB3 GLU A 128 4.186 0.138 -2.286 1.00 0.00 H new ATOM 0 HG2 GLU A 128 4.371 1.863 -0.471 1.00 0.00 H new ATOM 0 HG3 GLU A 128 4.119 3.120 -1.666 1.00 0.00 H new ATOM 1905 N GLN A 129 7.004 3.094 -3.916 1.00 0.00 N ATOM 1906 CA GLN A 129 7.584 4.415 -4.118 1.00 0.00 C ATOM 1907 C GLN A 129 6.899 5.143 -5.263 1.00 0.00 C ATOM 1908 O GLN A 129 6.696 4.595 -6.353 1.00 0.00 O ATOM 1909 CB GLN A 129 9.091 4.344 -4.412 1.00 0.00 C ATOM 1910 CG GLN A 129 9.941 4.116 -3.161 1.00 0.00 C ATOM 1911 CD GLN A 129 11.418 4.348 -3.469 1.00 0.00 C ATOM 1912 OE1 GLN A 129 11.889 5.485 -3.513 1.00 0.00 O ATOM 1913 NE2 GLN A 129 12.185 3.301 -3.699 1.00 0.00 N ATOM 0 H GLN A 129 6.920 2.554 -4.777 1.00 0.00 H new ATOM 0 HA GLN A 129 7.432 4.962 -3.188 1.00 0.00 H new ATOM 0 HB2 GLN A 129 9.278 3.538 -5.122 1.00 0.00 H new ATOM 0 HB3 GLN A 129 9.405 5.271 -4.892 1.00 0.00 H new ATOM 0 HG2 GLN A 129 9.619 4.790 -2.367 1.00 0.00 H new ATOM 0 HG3 GLN A 129 9.795 3.100 -2.795 1.00 0.00 H new ATOM 0 HE21 GLN A 129 11.790 2.361 -3.661 1.00 0.00 H new ATOM 0 HE22 GLN A 129 13.174 3.430 -3.915 1.00 0.00 H new ATOM 1922 N SER A 130 6.688 6.434 -5.035 1.00 0.00 N ATOM 1923 CA SER A 130 6.394 7.455 -6.012 1.00 0.00 C ATOM 1924 C SER A 130 7.324 8.631 -5.705 1.00 0.00 C ATOM 1925 O SER A 130 7.800 8.770 -4.577 1.00 0.00 O ATOM 1926 CB SER A 130 4.917 7.835 -5.869 1.00 0.00 C ATOM 1927 OG SER A 130 4.491 8.563 -6.998 1.00 0.00 O ATOM 0 H SER A 130 6.722 6.814 -4.089 1.00 0.00 H new ATOM 0 HA SER A 130 6.556 7.128 -7.039 1.00 0.00 H new ATOM 0 HB2 SER A 130 4.312 6.936 -5.757 1.00 0.00 H new ATOM 0 HB3 SER A 130 4.773 8.430 -4.967 1.00 0.00 H new ATOM 0 HG SER A 130 4.718 8.067 -7.812 1.00 0.00 H new ATOM 1933 N ARG A 131 7.561 9.516 -6.673 1.00 0.00 N ATOM 1934 CA ARG A 131 8.219 10.793 -6.414 1.00 0.00 C ATOM 1935 C ARG A 131 7.337 11.837 -7.046 1.00 0.00 C ATOM 1936 O ARG A 131 7.369 12.019 -8.265 1.00 0.00 O ATOM 1937 CB ARG A 131 9.656 10.833 -6.950 1.00 0.00 C ATOM 1938 CG ARG A 131 10.401 12.069 -6.415 1.00 0.00 C ATOM 1939 CD ARG A 131 11.674 12.379 -7.200 1.00 0.00 C ATOM 1940 NE ARG A 131 11.375 13.269 -8.334 1.00 0.00 N ATOM 1941 CZ ARG A 131 12.062 13.364 -9.473 1.00 0.00 C ATOM 1942 NH1 ARG A 131 13.184 12.682 -9.667 1.00 0.00 N ATOM 1943 NH2 ARG A 131 11.615 14.182 -10.415 1.00 0.00 N ATOM 0 H ARG A 131 7.305 9.369 -7.649 1.00 0.00 H new ATOM 0 HA ARG A 131 8.332 10.969 -5.344 1.00 0.00 H new ATOM 0 HB2 ARG A 131 10.185 9.927 -6.655 1.00 0.00 H new ATOM 0 HB3 ARG A 131 9.643 10.853 -8.040 1.00 0.00 H new ATOM 0 HG2 ARG A 131 9.737 12.932 -6.453 1.00 0.00 H new ATOM 0 HG3 ARG A 131 10.656 11.909 -5.367 1.00 0.00 H new ATOM 0 HD2 ARG A 131 12.407 12.849 -6.545 1.00 0.00 H new ATOM 0 HD3 ARG A 131 12.119 11.453 -7.564 1.00 0.00 H new ATOM 0 HE ARG A 131 10.560 13.874 -8.239 1.00 0.00 H new ATOM 0 HH11 ARG A 131 13.540 12.067 -8.935 1.00 0.00 H new ATOM 0 HH12 ARG A 131 13.690 12.773 -10.548 1.00 0.00 H new ATOM 0 HH21 ARG A 131 10.763 14.721 -10.260 1.00 0.00 H new ATOM 0 HH22 ARG A 131 12.123 14.272 -11.295 1.00 0.00 H new ATOM 1957 N ILE A 132 6.499 12.468 -6.237 1.00 0.00 N ATOM 1958 CA ILE A 132 5.582 13.484 -6.695 1.00 0.00 C ATOM 1959 C ILE A 132 6.412 14.738 -6.937 1.00 0.00 C ATOM 1960 O ILE A 132 6.752 15.484 -6.021 1.00 0.00 O ATOM 1961 CB ILE A 132 4.393 13.615 -5.718 1.00 0.00 C ATOM 1962 CG1 ILE A 132 3.433 12.419 -5.955 1.00 0.00 C ATOM 1963 CG2 ILE A 132 3.616 14.927 -5.923 1.00 0.00 C ATOM 1964 CD1 ILE A 132 3.701 11.174 -5.109 1.00 0.00 C ATOM 0 H ILE A 132 6.441 12.282 -5.236 1.00 0.00 H new ATOM 0 HA ILE A 132 5.093 13.241 -7.638 1.00 0.00 H new ATOM 0 HB ILE A 132 4.785 13.618 -4.701 1.00 0.00 H new ATOM 0 HG12 ILE A 132 2.413 12.753 -5.764 1.00 0.00 H new ATOM 0 HG13 ILE A 132 3.485 12.139 -7.007 1.00 0.00 H new ATOM 0 HG21 ILE A 132 2.789 14.975 -5.214 1.00 0.00 H new ATOM 0 HG22 ILE A 132 4.283 15.774 -5.761 1.00 0.00 H new ATOM 0 HG23 ILE A 132 3.225 14.963 -6.940 1.00 0.00 H new ATOM 0 HD11 ILE A 132 2.972 10.402 -5.356 1.00 0.00 H new ATOM 0 HD12 ILE A 132 4.705 10.804 -5.315 1.00 0.00 H new ATOM 0 HD13 ILE A 132 3.617 11.427 -4.052 1.00 0.00 H new ATOM 1976 N ARG A 133 6.750 14.951 -8.205 1.00 0.00 N ATOM 1977 CA ARG A 133 7.364 16.140 -8.777 1.00 0.00 C ATOM 1978 C ARG A 133 8.790 16.256 -8.266 1.00 0.00 C ATOM 1979 O ARG A 133 9.716 15.756 -8.904 1.00 0.00 O ATOM 1980 CB ARG A 133 6.449 17.359 -8.516 1.00 0.00 C ATOM 1981 CG ARG A 133 6.766 18.630 -9.320 1.00 0.00 C ATOM 1982 CD ARG A 133 6.178 19.812 -8.538 1.00 0.00 C ATOM 1983 NE ARG A 133 5.952 21.019 -9.343 1.00 0.00 N ATOM 1984 CZ ARG A 133 5.725 22.230 -8.817 1.00 0.00 C ATOM 1985 NH1 ARG A 133 5.888 22.467 -7.517 1.00 0.00 N ATOM 1986 NH2 ARG A 133 5.319 23.222 -9.595 1.00 0.00 N ATOM 0 H ARG A 133 6.587 14.237 -8.915 1.00 0.00 H new ATOM 0 HA ARG A 133 7.455 16.082 -9.862 1.00 0.00 H new ATOM 0 HB2 ARG A 133 5.421 17.067 -8.728 1.00 0.00 H new ATOM 0 HB3 ARG A 133 6.498 17.604 -7.455 1.00 0.00 H new ATOM 0 HG2 ARG A 133 7.842 18.748 -9.447 1.00 0.00 H new ATOM 0 HG3 ARG A 133 6.332 18.573 -10.318 1.00 0.00 H new ATOM 0 HD2 ARG A 133 5.231 19.503 -8.094 1.00 0.00 H new ATOM 0 HD3 ARG A 133 6.850 20.059 -7.716 1.00 0.00 H new ATOM 0 HE ARG A 133 5.969 20.931 -10.359 1.00 0.00 H new ATOM 0 HH11 ARG A 133 6.193 21.717 -6.896 1.00 0.00 H new ATOM 0 HH12 ARG A 133 5.708 23.398 -7.142 1.00 0.00 H new ATOM 0 HH21 ARG A 133 5.180 23.063 -10.593 1.00 0.00 H new ATOM 0 HH22 ARG A 133 5.146 24.145 -9.196 1.00 0.00 H new ATOM 2000 N SER A 134 8.966 16.840 -7.088 1.00 0.00 N ATOM 2001 CA SER A 134 10.239 17.059 -6.435 1.00 0.00 C ATOM 2002 C SER A 134 10.135 16.718 -4.943 1.00 0.00 C ATOM 2003 O SER A 134 10.934 17.228 -4.157 1.00 0.00 O ATOM 2004 CB SER A 134 10.684 18.502 -6.716 1.00 0.00 C ATOM 2005 OG SER A 134 12.095 18.612 -6.748 1.00 0.00 O ATOM 0 H SER A 134 8.181 17.190 -6.538 1.00 0.00 H new ATOM 0 HA SER A 134 11.009 16.397 -6.831 1.00 0.00 H new ATOM 0 HB2 SER A 134 10.270 18.833 -7.669 1.00 0.00 H new ATOM 0 HB3 SER A 134 10.284 19.164 -5.948 1.00 0.00 H new ATOM 0 HG SER A 134 12.347 19.541 -6.930 1.00 0.00 H new ATOM 2011 N VAL A 135 9.190 15.863 -4.531 1.00 0.00 N ATOM 2012 CA VAL A 135 9.213 15.263 -3.192 1.00 0.00 C ATOM 2013 C VAL A 135 9.130 13.748 -3.351 1.00 0.00 C ATOM 2014 O VAL A 135 8.425 13.252 -4.230 1.00 0.00 O ATOM 2015 CB VAL A 135 8.127 15.852 -2.264 1.00 0.00 C ATOM 2016 CG1 VAL A 135 8.397 17.339 -1.981 1.00 0.00 C ATOM 2017 CG2 VAL A 135 6.692 15.710 -2.789 1.00 0.00 C ATOM 0 H VAL A 135 8.400 15.572 -5.107 1.00 0.00 H new ATOM 0 HA VAL A 135 10.148 15.509 -2.689 1.00 0.00 H new ATOM 0 HB VAL A 135 8.195 15.259 -1.352 1.00 0.00 H new ATOM 0 HG11 VAL A 135 7.619 17.732 -1.326 1.00 0.00 H new ATOM 0 HG12 VAL A 135 9.368 17.447 -1.497 1.00 0.00 H new ATOM 0 HG13 VAL A 135 8.395 17.894 -2.919 1.00 0.00 H new ATOM 0 HG21 VAL A 135 5.998 16.151 -2.074 1.00 0.00 H new ATOM 0 HG22 VAL A 135 6.602 16.224 -3.746 1.00 0.00 H new ATOM 0 HG23 VAL A 135 6.456 14.654 -2.921 1.00 0.00 H new ATOM 2027 N ASP A 136 9.872 13.011 -2.531 1.00 0.00 N ATOM 2028 CA ASP A 136 9.909 11.548 -2.564 1.00 0.00 C ATOM 2029 C ASP A 136 8.824 11.034 -1.628 1.00 0.00 C ATOM 2030 O ASP A 136 8.626 11.604 -0.554 1.00 0.00 O ATOM 2031 CB ASP A 136 11.300 11.027 -2.169 1.00 0.00 C ATOM 2032 CG ASP A 136 12.172 10.739 -3.391 1.00 0.00 C ATOM 2033 OD1 ASP A 136 11.806 9.844 -4.191 1.00 0.00 O ATOM 2034 OD2 ASP A 136 13.239 11.365 -3.581 1.00 0.00 O ATOM 0 H ASP A 136 10.474 13.416 -1.814 1.00 0.00 H new ATOM 0 HA ASP A 136 9.720 11.184 -3.574 1.00 0.00 H new ATOM 0 HB2 ASP A 136 11.796 11.762 -1.535 1.00 0.00 H new ATOM 0 HB3 ASP A 136 11.192 10.117 -1.578 1.00 0.00 H new ATOM 2039 N VAL A 137 8.093 10.001 -2.036 1.00 0.00 N ATOM 2040 CA VAL A 137 6.882 9.543 -1.374 1.00 0.00 C ATOM 2041 C VAL A 137 6.955 8.018 -1.376 1.00 0.00 C ATOM 2042 O VAL A 137 6.429 7.350 -2.270 1.00 0.00 O ATOM 2043 CB VAL A 137 5.626 10.136 -2.065 1.00 0.00 C ATOM 2044 CG1 VAL A 137 4.348 9.782 -1.287 1.00 0.00 C ATOM 2045 CG2 VAL A 137 5.721 11.670 -2.201 1.00 0.00 C ATOM 0 H VAL A 137 8.335 9.447 -2.857 1.00 0.00 H new ATOM 0 HA VAL A 137 6.801 9.888 -0.343 1.00 0.00 H new ATOM 0 HB VAL A 137 5.580 9.696 -3.061 1.00 0.00 H new ATOM 0 HG11 VAL A 137 3.483 10.210 -1.794 1.00 0.00 H new ATOM 0 HG12 VAL A 137 4.240 8.698 -1.238 1.00 0.00 H new ATOM 0 HG13 VAL A 137 4.413 10.186 -0.277 1.00 0.00 H new ATOM 0 HG21 VAL A 137 4.823 12.048 -2.690 1.00 0.00 H new ATOM 0 HG22 VAL A 137 5.812 12.118 -1.212 1.00 0.00 H new ATOM 0 HG23 VAL A 137 6.595 11.929 -2.798 1.00 0.00 H new ATOM 2055 N GLY A 138 7.642 7.463 -0.379 1.00 0.00 N ATOM 2056 CA GLY A 138 7.817 6.028 -0.223 1.00 0.00 C ATOM 2057 C GLY A 138 7.085 5.552 1.018 1.00 0.00 C ATOM 2058 O GLY A 138 6.942 6.316 1.981 1.00 0.00 O ATOM 0 H GLY A 138 8.098 8.010 0.352 1.00 0.00 H new ATOM 0 HA2 GLY A 138 7.436 5.508 -1.102 1.00 0.00 H new ATOM 0 HA3 GLY A 138 8.877 5.788 -0.145 1.00 0.00 H new ATOM 2062 N THR A 139 6.659 4.293 0.994 1.00 0.00 N ATOM 2063 CA THR A 139 6.163 3.571 2.152 1.00 0.00 C ATOM 2064 C THR A 139 6.674 2.135 2.097 1.00 0.00 C ATOM 2065 O THR A 139 6.337 1.401 1.161 1.00 0.00 O ATOM 2066 CB THR A 139 4.620 3.618 2.227 1.00 0.00 C ATOM 2067 OG1 THR A 139 3.986 4.001 1.020 1.00 0.00 O ATOM 2068 CG2 THR A 139 4.166 4.650 3.248 1.00 0.00 C ATOM 0 H THR A 139 6.651 3.734 0.141 1.00 0.00 H new ATOM 0 HA THR A 139 6.534 4.049 3.058 1.00 0.00 H new ATOM 0 HB THR A 139 4.339 2.596 2.482 1.00 0.00 H new ATOM 0 HG1 THR A 139 3.014 4.005 1.148 1.00 0.00 H new ATOM 0 HG21 THR A 139 3.077 4.669 3.287 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.560 4.388 4.230 1.00 0.00 H new ATOM 0 HG23 THR A 139 4.536 5.634 2.960 1.00 0.00 H new ATOM 2076 N TRP A 140 7.422 1.704 3.109 1.00 0.00 N ATOM 2077 CA TRP A 140 7.606 0.286 3.363 1.00 0.00 C ATOM 2078 C TRP A 140 6.412 -0.191 4.188 1.00 0.00 C ATOM 2079 O TRP A 140 5.821 0.595 4.939 1.00 0.00 O ATOM 2080 CB TRP A 140 8.965 0.032 4.034 1.00 0.00 C ATOM 2081 CG TRP A 140 9.072 0.059 5.531 1.00 0.00 C ATOM 2082 CD1 TRP A 140 9.351 1.143 6.292 1.00 0.00 C ATOM 2083 CD2 TRP A 140 8.998 -1.064 6.461 1.00 0.00 C ATOM 2084 NE1 TRP A 140 9.455 0.769 7.623 1.00 0.00 N ATOM 2085 CE2 TRP A 140 9.247 -0.587 7.782 1.00 0.00 C ATOM 2086 CE3 TRP A 140 8.796 -2.449 6.313 1.00 0.00 C ATOM 2087 CZ2 TRP A 140 9.264 -1.441 8.894 1.00 0.00 C ATOM 2088 CZ3 TRP A 140 8.763 -3.309 7.423 1.00 0.00 C ATOM 2089 CH2 TRP A 140 9.004 -2.807 8.711 1.00 0.00 C ATOM 0 H TRP A 140 7.908 2.318 3.763 1.00 0.00 H new ATOM 0 HA TRP A 140 7.634 -0.290 2.438 1.00 0.00 H new ATOM 0 HB2 TRP A 140 9.316 -0.945 3.700 1.00 0.00 H new ATOM 0 HB3 TRP A 140 9.664 0.772 3.644 1.00 0.00 H new ATOM 0 HD1 TRP A 140 9.474 2.149 5.918 1.00 0.00 H new ATOM 0 HE1 TRP A 140 9.659 1.413 8.387 1.00 0.00 H new ATOM 0 HE3 TRP A 140 8.663 -2.860 5.323 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 9.475 -1.052 9.879 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 8.552 -4.359 7.285 1.00 0.00 H new ATOM 0 HH2 TRP A 140 8.989 -3.473 9.561 1.00 0.00 H new ATOM 2100 N ILE A 141 6.045 -1.462 4.043 1.00 0.00 N ATOM 2101 CA ILE A 141 5.040 -2.111 4.877 1.00 0.00 C ATOM 2102 C ILE A 141 5.677 -3.342 5.497 1.00 0.00 C ATOM 2103 O ILE A 141 6.523 -3.980 4.863 1.00 0.00 O ATOM 2104 CB ILE A 141 3.765 -2.484 4.079 1.00 0.00 C ATOM 2105 CG1 ILE A 141 4.047 -3.312 2.804 1.00 0.00 C ATOM 2106 CG2 ILE A 141 2.962 -1.215 3.754 1.00 0.00 C ATOM 2107 CD1 ILE A 141 2.797 -4.017 2.255 1.00 0.00 C ATOM 0 H ILE A 141 6.443 -2.077 3.333 1.00 0.00 H new ATOM 0 HA ILE A 141 4.713 -1.418 5.652 1.00 0.00 H new ATOM 0 HB ILE A 141 3.172 -3.137 4.720 1.00 0.00 H new ATOM 0 HG12 ILE A 141 4.454 -2.656 2.035 1.00 0.00 H new ATOM 0 HG13 ILE A 141 4.811 -4.058 3.024 1.00 0.00 H new ATOM 0 HG21 ILE A 141 2.067 -1.484 3.193 1.00 0.00 H new ATOM 0 HG22 ILE A 141 2.674 -0.720 4.681 1.00 0.00 H new ATOM 0 HG23 ILE A 141 3.575 -0.540 3.157 1.00 0.00 H new ATOM 0 HD11 ILE A 141 3.061 -4.581 1.360 1.00 0.00 H new ATOM 0 HD12 ILE A 141 2.402 -4.697 3.010 1.00 0.00 H new ATOM 0 HD13 ILE A 141 2.040 -3.273 2.005 1.00 0.00 H new ATOM 2119 N ALA A 142 5.200 -3.733 6.679 1.00 0.00 N ATOM 2120 CA ALA A 142 5.521 -5.051 7.189 1.00 0.00 C ATOM 2121 C ALA A 142 4.458 -6.001 6.645 1.00 0.00 C ATOM 2122 O ALA A 142 3.351 -5.578 6.302 1.00 0.00 O ATOM 2123 CB ALA A 142 5.518 -5.038 8.719 1.00 0.00 C ATOM 0 H ALA A 142 4.605 -3.166 7.283 1.00 0.00 H new ATOM 0 HA ALA A 142 6.515 -5.370 6.874 1.00 0.00 H new ATOM 0 HB1 ALA A 142 5.760 -6.033 9.092 1.00 0.00 H new ATOM 0 HB2 ALA A 142 6.260 -4.325 9.078 1.00 0.00 H new ATOM 0 HB3 ALA A 142 4.531 -4.746 9.078 1.00 0.00 H new ATOM 2129 N GLY A 143 4.813 -7.277 6.555 1.00 0.00 N ATOM 2130 CA GLY A 143 4.000 -8.312 5.945 1.00 0.00 C ATOM 2131 C GLY A 143 3.862 -9.481 6.902 1.00 0.00 C ATOM 2132 O GLY A 143 4.129 -10.622 6.527 1.00 0.00 O ATOM 0 H GLY A 143 5.701 -7.626 6.916 1.00 0.00 H new ATOM 0 HA2 GLY A 143 3.016 -7.915 5.695 1.00 0.00 H new ATOM 0 HA3 GLY A 143 4.456 -8.644 5.012 1.00 0.00 H new ATOM 2136 N VAL A 144 3.464 -9.198 8.141 1.00 0.00 N ATOM 2137 CA VAL A 144 3.404 -10.169 9.227 1.00 0.00 C ATOM 2138 C VAL A 144 1.951 -10.556 9.506 1.00 0.00 C ATOM 2139 O VAL A 144 1.033 -10.008 8.891 1.00 0.00 O ATOM 2140 CB VAL A 144 4.179 -9.642 10.453 1.00 0.00 C ATOM 2141 CG1 VAL A 144 5.690 -9.691 10.192 1.00 0.00 C ATOM 2142 CG2 VAL A 144 3.794 -8.208 10.847 1.00 0.00 C ATOM 0 H VAL A 144 3.167 -8.263 8.422 1.00 0.00 H new ATOM 0 HA VAL A 144 3.903 -11.095 8.942 1.00 0.00 H new ATOM 0 HB VAL A 144 3.908 -10.297 11.281 1.00 0.00 H new ATOM 0 HG11 VAL A 144 6.223 -9.316 11.066 1.00 0.00 H new ATOM 0 HG12 VAL A 144 5.992 -10.720 9.997 1.00 0.00 H new ATOM 0 HG13 VAL A 144 5.930 -9.072 9.328 1.00 0.00 H new ATOM 0 HG21 VAL A 144 4.376 -7.901 11.716 1.00 0.00 H new ATOM 0 HG22 VAL A 144 4.000 -7.534 10.015 1.00 0.00 H new ATOM 0 HG23 VAL A 144 2.732 -8.170 11.090 1.00 0.00 H new ATOM 2152 N GLY A 145 1.734 -11.525 10.399 1.00 0.00 N ATOM 2153 CA GLY A 145 0.421 -12.081 10.679 1.00 0.00 C ATOM 2154 C GLY A 145 0.571 -13.413 11.399 1.00 0.00 C ATOM 2155 O GLY A 145 1.029 -13.422 12.539 1.00 0.00 O ATOM 0 H GLY A 145 2.480 -11.947 10.952 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -0.155 -11.388 11.292 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -0.132 -12.219 9.750 1.00 0.00 H new ATOM 2159 N TYR A 146 0.206 -14.521 10.751 1.00 0.00 N ATOM 2160 CA TYR A 146 0.140 -15.875 11.313 1.00 0.00 C ATOM 2161 C TYR A 146 0.180 -16.889 10.157 1.00 0.00 C ATOM 2162 O TYR A 146 0.285 -16.471 9.004 1.00 0.00 O ATOM 2163 CB TYR A 146 -1.088 -16.028 12.231 1.00 0.00 C ATOM 2164 CG TYR A 146 -2.449 -15.789 11.611 1.00 0.00 C ATOM 2165 CD1 TYR A 146 -2.974 -14.485 11.574 1.00 0.00 C ATOM 2166 CD2 TYR A 146 -3.217 -16.868 11.129 1.00 0.00 C ATOM 2167 CE1 TYR A 146 -4.241 -14.244 11.020 1.00 0.00 C ATOM 2168 CE2 TYR A 146 -4.496 -16.637 10.590 1.00 0.00 C ATOM 2169 CZ TYR A 146 -4.997 -15.319 10.503 1.00 0.00 C ATOM 2170 OH TYR A 146 -6.188 -15.076 9.891 1.00 0.00 O ATOM 0 H TYR A 146 -0.066 -14.499 9.768 1.00 0.00 H new ATOM 0 HA TYR A 146 1.001 -16.070 11.952 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -1.077 -17.037 12.644 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -0.972 -15.339 13.068 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -2.399 -13.663 11.974 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -2.824 -17.873 11.173 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -4.637 -13.240 10.989 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -5.094 -17.467 10.243 1.00 0.00 H new ATOM 0 HH TYR A 146 -6.259 -15.626 9.083 1.00 0.00 H new ATOM 2180 N ARG A 147 0.203 -18.203 10.409 1.00 0.00 N ATOM 2181 CA ARG A 147 0.033 -19.220 9.357 1.00 0.00 C ATOM 2182 C ARG A 147 -1.342 -19.875 9.482 1.00 0.00 C ATOM 2183 O ARG A 147 -1.741 -20.239 10.590 1.00 0.00 O ATOM 2184 CB ARG A 147 1.155 -20.282 9.352 1.00 0.00 C ATOM 2185 CG ARG A 147 1.441 -20.996 10.694 1.00 0.00 C ATOM 2186 CD ARG A 147 1.734 -22.488 10.519 1.00 0.00 C ATOM 2187 NE ARG A 147 0.474 -23.219 10.327 1.00 0.00 N ATOM 2188 CZ ARG A 147 -0.040 -23.702 9.193 1.00 0.00 C ATOM 2189 NH1 ARG A 147 0.708 -23.854 8.105 1.00 0.00 N ATOM 2190 NH2 ARG A 147 -1.330 -24.011 9.192 1.00 0.00 N ATOM 0 H ARG A 147 0.339 -18.593 11.342 1.00 0.00 H new ATOM 0 HA ARG A 147 0.103 -18.705 8.399 1.00 0.00 H new ATOM 0 HB2 ARG A 147 0.903 -21.040 8.610 1.00 0.00 H new ATOM 0 HB3 ARG A 147 2.076 -19.803 9.018 1.00 0.00 H new ATOM 0 HG2 ARG A 147 2.291 -20.518 11.181 1.00 0.00 H new ATOM 0 HG3 ARG A 147 0.584 -20.874 11.356 1.00 0.00 H new ATOM 0 HD2 ARG A 147 2.390 -22.642 9.662 1.00 0.00 H new ATOM 0 HD3 ARG A 147 2.258 -22.871 11.394 1.00 0.00 H new ATOM 0 HE ARG A 147 -0.080 -23.378 11.169 1.00 0.00 H new ATOM 0 HH11 ARG A 147 1.696 -23.600 8.125 1.00 0.00 H new ATOM 0 HH12 ARG A 147 0.294 -24.225 7.250 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -1.887 -23.877 10.036 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -1.765 -24.383 8.348 1.00 0.00 H new ATOM 2204 N PHE A 148 -2.050 -20.045 8.363 1.00 0.00 N ATOM 2205 CA PHE A 148 -3.181 -20.953 8.202 1.00 0.00 C ATOM 2206 C PHE A 148 -3.381 -21.250 6.716 1.00 0.00 C ATOM 2207 O PHE A 148 -4.261 -22.068 6.388 1.00 0.00 O ATOM 2208 CB PHE A 148 -4.465 -20.445 8.889 1.00 0.00 C ATOM 2209 CG PHE A 148 -5.284 -19.356 8.215 1.00 0.00 C ATOM 2210 CD1 PHE A 148 -4.679 -18.214 7.658 1.00 0.00 C ATOM 2211 CD2 PHE A 148 -6.690 -19.450 8.227 1.00 0.00 C ATOM 2212 CE1 PHE A 148 -5.472 -17.183 7.126 1.00 0.00 C ATOM 2213 CE2 PHE A 148 -7.482 -18.423 7.688 1.00 0.00 C ATOM 2214 CZ PHE A 148 -6.871 -17.282 7.147 1.00 0.00 C ATOM 0 H PHE A 148 -1.839 -19.529 7.509 1.00 0.00 H new ATOM 0 HA PHE A 148 -2.949 -21.886 8.715 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -5.120 -21.304 9.038 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -4.186 -20.082 9.878 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -3.602 -18.130 7.639 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -7.164 -20.321 8.655 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -5.002 -16.310 6.699 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -8.558 -18.511 7.690 1.00 0.00 H new ATOM 0 HZ PHE A 148 -7.476 -16.482 6.748 1.00 0.00 H new TER 2224 PHE A 148