USER MOD reduce.3.24.130724 H: found=0, std=0, add=919, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 922 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 118 GLN :FLIP amide:sc= -0.533 F(o=-1.8!,f=-0.53) USER MOD Set 1.2: A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -0.179 X(o=-0.18,f=-0.27) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0.0193 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 130:sc= 0.0282 USER MOD Single : A 55 LYS NZ :NH3+ -178:sc= 2.09 (180deg=2.02) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 GLN : amide:sc= -0.239 K(o=-0.24,f=-1.6) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 176:sc= 1.55 (180deg=1.47) USER MOD Single : A 68 TYR OH : rot 15:sc= 0.207 USER MOD Single : A 71 GLN : amide:sc= -0.15 X(o=-0.15,f=-0.092) USER MOD Single : A 75 THR OG1 : rot -83:sc= 1.43 USER MOD Single : A 79 LYS NZ :NH3+ -115:sc= 0.659 (180deg=-0.758) USER MOD Single : A 84 LYS NZ :NH3+ 158:sc= 0.822 (180deg=0.544) USER MOD Single : A 85 TYR OH : rot 150:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ -153:sc= 1.05 (180deg=0.025) USER MOD Single : A 91 TYR OH : rot 180:sc= -0.0283 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 THR OG1 : rot -25:sc= -0.0484 USER MOD Single : A 115 LYS NZ :NH3+ -164:sc= -0.0177 (180deg=-0.262) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 LYS NZ :NH3+ 170:sc= -1.1 (180deg=-1.35) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot -140:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 ASN :FLIP amide:sc= -1.11 F(o=-2.1!,f=-1.1) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 179:sc= 1.24! (180deg=1.07!) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ -167:sc= 1.21 (180deg=1.01) USER MOD Single : A 144 ASN : amide:sc= 0.158 X(o=0.16,f=-0.018) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 26 -8.462 -9.818 -5.804 1.00 42.51 N ATOM 2 CA ALA A 26 -9.767 -10.409 -5.433 1.00 13.25 C ATOM 3 C ALA A 26 -9.941 -11.763 -6.103 1.00 25.45 C ATOM 4 O ALA A 26 -9.769 -12.807 -5.473 1.00 3.31 O ATOM 5 CB ALA A 26 -10.903 -9.475 -5.816 1.00 71.45 C ATOM 0 HA ALA A 26 -9.790 -10.551 -4.352 1.00 13.25 H new ATOM 0 HB1 ALA A 26 -11.855 -9.926 -5.536 1.00 71.45 H new ATOM 0 HB2 ALA A 26 -10.784 -8.525 -5.295 1.00 71.45 H new ATOM 0 HB3 ALA A 26 -10.886 -9.303 -6.892 1.00 71.45 H new ATOM 13 N ASP A 27 -10.268 -11.742 -7.388 1.00 21.00 N ATOM 14 CA ASP A 27 -10.391 -12.962 -8.169 1.00 71.43 C ATOM 15 C ASP A 27 -10.064 -12.659 -9.619 1.00 14.12 C ATOM 16 O ASP A 27 -10.793 -11.920 -10.282 1.00 74.12 O ATOM 17 CB ASP A 27 -11.801 -13.551 -8.060 1.00 64.01 C ATOM 18 CG ASP A 27 -11.882 -14.959 -8.622 1.00 4.41 C ATOM 19 OD1 ASP A 27 -12.149 -15.117 -9.831 1.00 23.51 O ATOM 20 OD2 ASP A 27 -11.677 -15.920 -7.850 1.00 2.31 O ATOM 0 H ASP A 27 -10.454 -10.887 -7.913 1.00 21.00 H new ATOM 0 HA ASP A 27 -9.691 -13.700 -7.777 1.00 71.43 H new ATOM 0 HB2 ASP A 27 -12.108 -13.561 -7.014 1.00 64.01 H new ATOM 0 HB3 ASP A 27 -12.503 -12.909 -8.592 1.00 64.01 H new ATOM 25 N VAL A 28 -8.950 -13.212 -10.087 1.00 4.12 N ATOM 26 CA VAL A 28 -8.444 -12.962 -11.438 1.00 61.44 C ATOM 27 C VAL A 28 -7.887 -11.541 -11.559 1.00 2.13 C ATOM 28 O VAL A 28 -8.522 -10.567 -11.150 1.00 10.30 O ATOM 29 CB VAL A 28 -9.520 -13.197 -12.527 1.00 35.22 C ATOM 30 CG1 VAL A 28 -8.975 -12.881 -13.912 1.00 61.41 C ATOM 31 CG2 VAL A 28 -10.029 -14.630 -12.478 1.00 15.34 C ATOM 0 H VAL A 28 -8.369 -13.848 -9.541 1.00 4.12 H new ATOM 0 HA VAL A 28 -7.641 -13.680 -11.605 1.00 61.44 H new ATOM 0 HB VAL A 28 -10.352 -12.523 -12.324 1.00 35.22 H new ATOM 0 HG11 VAL A 28 -9.752 -13.055 -14.657 1.00 61.41 H new ATOM 0 HG12 VAL A 28 -8.662 -11.838 -13.951 1.00 61.41 H new ATOM 0 HG13 VAL A 28 -8.120 -13.524 -14.122 1.00 61.41 H new ATOM 0 HG21 VAL A 28 -10.784 -14.775 -13.251 1.00 15.34 H new ATOM 0 HG22 VAL A 28 -9.200 -15.317 -12.648 1.00 15.34 H new ATOM 0 HG23 VAL A 28 -10.468 -14.827 -11.500 1.00 15.34 H new ATOM 41 N PHE A 29 -6.685 -11.435 -12.098 1.00 75.24 N ATOM 42 CA PHE A 29 -6.069 -10.145 -12.350 1.00 2.42 C ATOM 43 C PHE A 29 -5.627 -10.073 -13.805 1.00 44.04 C ATOM 44 O PHE A 29 -5.741 -11.059 -14.539 1.00 34.33 O ATOM 45 CB PHE A 29 -4.882 -9.910 -11.401 1.00 22.04 C ATOM 46 CG PHE A 29 -3.753 -10.896 -11.551 1.00 51.02 C ATOM 47 CD1 PHE A 29 -3.895 -12.214 -11.140 1.00 4.51 C ATOM 48 CD2 PHE A 29 -2.544 -10.500 -12.100 1.00 62.32 C ATOM 49 CE1 PHE A 29 -2.855 -13.113 -11.276 1.00 3.50 C ATOM 50 CE2 PHE A 29 -1.500 -11.396 -12.237 1.00 42.22 C ATOM 51 CZ PHE A 29 -1.657 -12.703 -11.824 1.00 73.44 C ATOM 0 H PHE A 29 -6.113 -12.234 -12.371 1.00 75.24 H new ATOM 0 HA PHE A 29 -6.799 -9.357 -12.161 1.00 2.42 H new ATOM 0 HB2 PHE A 29 -4.494 -8.905 -11.568 1.00 22.04 H new ATOM 0 HB3 PHE A 29 -5.243 -9.945 -10.373 1.00 22.04 H new ATOM 0 HD1 PHE A 29 -4.830 -12.541 -10.709 1.00 4.51 H new ATOM 0 HD2 PHE A 29 -2.416 -9.478 -12.425 1.00 62.32 H new ATOM 0 HE1 PHE A 29 -2.980 -14.136 -10.954 1.00 3.50 H new ATOM 0 HE2 PHE A 29 -0.563 -11.073 -12.667 1.00 42.22 H new ATOM 0 HZ PHE A 29 -0.843 -13.405 -11.930 1.00 73.44 H new ATOM 61 N ASP A 30 -5.147 -8.916 -14.227 1.00 31.12 N ATOM 62 CA ASP A 30 -4.689 -8.736 -15.597 1.00 11.12 C ATOM 63 C ASP A 30 -3.360 -9.458 -15.811 1.00 25.23 C ATOM 64 O ASP A 30 -2.497 -9.456 -14.936 1.00 72.23 O ATOM 65 CB ASP A 30 -4.561 -7.244 -15.931 1.00 12.22 C ATOM 66 CG ASP A 30 -3.606 -6.514 -15.011 1.00 73.41 C ATOM 67 OD1 ASP A 30 -3.916 -6.385 -13.808 1.00 24.04 O ATOM 68 OD2 ASP A 30 -2.555 -6.038 -15.489 1.00 74.52 O ATOM 0 H ASP A 30 -5.064 -8.085 -13.641 1.00 31.12 H new ATOM 0 HA ASP A 30 -5.427 -9.171 -16.271 1.00 11.12 H new ATOM 0 HB2 ASP A 30 -4.220 -7.135 -16.961 1.00 12.22 H new ATOM 0 HB3 ASP A 30 -5.544 -6.778 -15.870 1.00 12.22 H new ATOM 73 N PRO A 31 -3.199 -10.106 -16.976 1.00 75.10 N ATOM 74 CA PRO A 31 -2.011 -10.914 -17.289 1.00 41.51 C ATOM 75 C PRO A 31 -0.696 -10.163 -17.080 1.00 44.13 C ATOM 76 O PRO A 31 -0.644 -8.934 -17.208 1.00 25.20 O ATOM 77 CB PRO A 31 -2.199 -11.265 -18.766 1.00 55.24 C ATOM 78 CG PRO A 31 -3.670 -11.202 -18.983 1.00 25.21 C ATOM 79 CD PRO A 31 -4.167 -10.105 -18.085 1.00 5.12 C ATOM 0 HA PRO A 31 -1.936 -11.780 -16.631 1.00 41.51 H new ATOM 0 HB2 PRO A 31 -1.673 -10.561 -19.411 1.00 55.24 H new ATOM 0 HB3 PRO A 31 -1.807 -12.257 -18.991 1.00 55.24 H new ATOM 0 HG2 PRO A 31 -3.903 -10.990 -20.026 1.00 25.21 H new ATOM 0 HG3 PRO A 31 -4.143 -12.153 -18.738 1.00 25.21 H new ATOM 0 HD2 PRO A 31 -4.188 -9.144 -18.599 1.00 5.12 H new ATOM 0 HD3 PRO A 31 -5.180 -10.301 -17.734 1.00 5.12 H new ATOM 87 N PRO A 32 0.379 -10.910 -16.751 1.00 41.50 N ATOM 88 CA PRO A 32 1.712 -10.353 -16.500 1.00 74.55 C ATOM 89 C PRO A 32 2.115 -9.285 -17.512 1.00 45.33 C ATOM 90 O PRO A 32 1.975 -9.472 -18.723 1.00 2.44 O ATOM 91 CB PRO A 32 2.618 -11.576 -16.619 1.00 71.21 C ATOM 92 CG PRO A 32 1.770 -12.708 -16.161 1.00 41.54 C ATOM 93 CD PRO A 32 0.365 -12.380 -16.592 1.00 61.54 C ATOM 0 HA PRO A 32 1.766 -9.845 -15.537 1.00 74.55 H new ATOM 0 HB2 PRO A 32 2.956 -11.722 -17.645 1.00 71.21 H new ATOM 0 HB3 PRO A 32 3.510 -11.472 -16.001 1.00 71.21 H new ATOM 0 HG2 PRO A 32 2.103 -13.648 -16.602 1.00 41.54 H new ATOM 0 HG3 PRO A 32 1.828 -12.825 -15.079 1.00 41.54 H new ATOM 0 HD2 PRO A 32 0.105 -12.881 -17.525 1.00 61.54 H new ATOM 0 HD3 PRO A 32 -0.366 -12.695 -15.847 1.00 61.54 H new ATOM 101 N THR A 33 2.629 -8.176 -17.010 1.00 50.02 N ATOM 102 CA THR A 33 2.943 -7.030 -17.843 1.00 75.42 C ATOM 103 C THR A 33 4.390 -7.088 -18.335 1.00 71.03 C ATOM 104 O THR A 33 5.186 -6.181 -18.090 1.00 31.32 O ATOM 105 CB THR A 33 2.697 -5.724 -17.063 1.00 32.14 C ATOM 106 OG1 THR A 33 1.440 -5.814 -16.373 1.00 31.44 O ATOM 107 CG2 THR A 33 2.671 -4.521 -17.994 1.00 65.12 C ATOM 0 H THR A 33 2.839 -8.045 -16.020 1.00 50.02 H new ATOM 0 HA THR A 33 2.288 -7.053 -18.714 1.00 75.42 H new ATOM 0 HB THR A 33 3.513 -5.591 -16.352 1.00 32.14 H new ATOM 0 HG1 THR A 33 1.281 -4.986 -15.874 1.00 31.44 H new ATOM 0 HG21 THR A 33 2.496 -3.615 -17.413 1.00 65.12 H new ATOM 0 HG22 THR A 33 3.627 -4.441 -18.512 1.00 65.12 H new ATOM 0 HG23 THR A 33 1.872 -4.644 -18.725 1.00 65.12 H new ATOM 115 N GLN A 34 4.727 -8.170 -19.023 1.00 63.42 N ATOM 116 CA GLN A 34 6.065 -8.340 -19.572 1.00 43.24 C ATOM 117 C GLN A 34 6.015 -8.417 -21.092 1.00 74.53 C ATOM 118 O GLN A 34 5.747 -9.473 -21.665 1.00 40.14 O ATOM 119 CB GLN A 34 6.737 -9.591 -19.002 1.00 11.50 C ATOM 120 CG GLN A 34 7.160 -9.449 -17.545 1.00 15.43 C ATOM 121 CD GLN A 34 8.236 -8.397 -17.350 1.00 72.41 C ATOM 122 OE1 GLN A 34 7.945 -7.224 -17.126 1.00 35.30 O ATOM 123 NE2 GLN A 34 9.492 -8.810 -17.430 1.00 14.23 N ATOM 0 H GLN A 34 4.091 -8.944 -19.214 1.00 63.42 H new ATOM 0 HA GLN A 34 6.657 -7.471 -19.285 1.00 43.24 H new ATOM 0 HB2 GLN A 34 6.052 -10.434 -19.092 1.00 11.50 H new ATOM 0 HB3 GLN A 34 7.614 -9.828 -19.604 1.00 11.50 H new ATOM 0 HG2 GLN A 34 6.290 -9.190 -16.942 1.00 15.43 H new ATOM 0 HG3 GLN A 34 7.526 -10.409 -17.181 1.00 15.43 H new ATOM 0 HE21 GLN A 34 9.695 -9.792 -17.617 1.00 14.23 H new ATOM 0 HE22 GLN A 34 10.256 -8.146 -17.304 1.00 14.23 H new ATOM 132 N TYR A 35 6.248 -7.283 -21.734 1.00 2.24 N ATOM 133 CA TYR A 35 6.274 -7.205 -23.187 1.00 0.33 C ATOM 134 C TYR A 35 7.236 -6.112 -23.630 1.00 40.40 C ATOM 135 O TYR A 35 7.452 -5.144 -22.903 1.00 65.21 O ATOM 136 CB TYR A 35 4.868 -6.953 -23.752 1.00 41.41 C ATOM 137 CG TYR A 35 4.070 -5.877 -23.039 1.00 41.35 C ATOM 138 CD1 TYR A 35 4.356 -4.530 -23.218 1.00 12.14 C ATOM 139 CD2 TYR A 35 3.015 -6.215 -22.199 1.00 51.31 C ATOM 140 CE1 TYR A 35 3.619 -3.552 -22.579 1.00 70.34 C ATOM 141 CE2 TYR A 35 2.271 -5.242 -21.558 1.00 72.05 C ATOM 142 CZ TYR A 35 2.578 -3.912 -21.752 1.00 43.31 C ATOM 143 OH TYR A 35 1.842 -2.935 -21.119 1.00 42.11 O ATOM 0 H TYR A 35 6.424 -6.394 -21.265 1.00 2.24 H new ATOM 0 HA TYR A 35 6.621 -8.161 -23.579 1.00 0.33 H new ATOM 0 HB2 TYR A 35 4.960 -6.679 -24.803 1.00 41.41 H new ATOM 0 HB3 TYR A 35 4.306 -7.886 -23.714 1.00 41.41 H new ATOM 0 HD1 TYR A 35 5.169 -4.242 -23.868 1.00 12.14 H new ATOM 0 HD2 TYR A 35 2.772 -7.256 -22.045 1.00 51.31 H new ATOM 0 HE1 TYR A 35 3.858 -2.509 -22.727 1.00 70.34 H new ATOM 0 HE2 TYR A 35 1.454 -5.522 -20.909 1.00 72.05 H new ATOM 0 HH TYR A 35 1.144 -3.353 -20.573 1.00 42.11 H new ATOM 153 N GLY A 36 7.820 -6.265 -24.813 1.00 11.30 N ATOM 154 CA GLY A 36 8.818 -5.311 -25.256 1.00 25.13 C ATOM 155 C GLY A 36 8.772 -5.020 -26.742 1.00 1.31 C ATOM 156 O GLY A 36 9.816 -4.936 -27.387 1.00 42.12 O ATOM 0 H GLY A 36 7.623 -7.023 -25.466 1.00 11.30 H new ATOM 0 HA2 GLY A 36 8.683 -4.378 -24.709 1.00 25.13 H new ATOM 0 HA3 GLY A 36 9.807 -5.690 -25.000 1.00 25.13 H new ATOM 160 N TYR A 37 7.571 -4.872 -27.291 1.00 44.21 N ATOM 161 CA TYR A 37 7.415 -4.426 -28.677 1.00 43.01 C ATOM 162 C TYR A 37 5.963 -4.066 -28.966 1.00 54.23 C ATOM 163 O TYR A 37 5.684 -3.165 -29.754 1.00 43.32 O ATOM 164 CB TYR A 37 7.926 -5.479 -29.684 1.00 43.31 C ATOM 165 CG TYR A 37 7.004 -6.660 -29.910 1.00 43.33 C ATOM 166 CD1 TYR A 37 6.951 -7.711 -29.007 1.00 25.11 C ATOM 167 CD2 TYR A 37 6.195 -6.727 -31.041 1.00 22.41 C ATOM 168 CE1 TYR A 37 6.120 -8.792 -29.221 1.00 64.22 C ATOM 169 CE2 TYR A 37 5.361 -7.808 -31.260 1.00 0.42 C ATOM 170 CZ TYR A 37 5.327 -8.837 -30.346 1.00 71.43 C ATOM 171 OH TYR A 37 4.501 -9.919 -30.557 1.00 43.32 O ATOM 0 H TYR A 37 6.694 -5.052 -26.803 1.00 44.21 H new ATOM 0 HA TYR A 37 8.028 -3.533 -28.801 1.00 43.01 H new ATOM 0 HB2 TYR A 37 8.101 -4.987 -30.641 1.00 43.31 H new ATOM 0 HB3 TYR A 37 8.889 -5.852 -29.337 1.00 43.31 H new ATOM 0 HD1 TYR A 37 7.570 -7.683 -28.122 1.00 25.11 H new ATOM 0 HD2 TYR A 37 6.219 -5.921 -31.760 1.00 22.41 H new ATOM 0 HE1 TYR A 37 6.092 -9.602 -28.507 1.00 64.22 H new ATOM 0 HE2 TYR A 37 4.740 -7.845 -32.143 1.00 0.42 H new ATOM 0 HH TYR A 37 4.008 -9.796 -31.395 1.00 43.32 H new ATOM 181 N ASP A 38 5.044 -4.769 -28.320 1.00 65.44 N ATOM 182 CA ASP A 38 3.621 -4.504 -28.481 1.00 31.31 C ATOM 183 C ASP A 38 2.921 -4.730 -27.143 1.00 60.14 C ATOM 184 O ASP A 38 3.566 -4.654 -26.099 1.00 54.11 O ATOM 185 CB ASP A 38 3.041 -5.411 -29.575 1.00 13.11 C ATOM 186 CG ASP A 38 1.679 -4.949 -30.058 1.00 21.34 C ATOM 187 OD1 ASP A 38 1.612 -3.980 -30.838 1.00 24.43 O ATOM 188 OD2 ASP A 38 0.664 -5.548 -29.649 1.00 23.43 O ATOM 0 H ASP A 38 5.259 -5.531 -27.677 1.00 65.44 H new ATOM 0 HA ASP A 38 3.463 -3.470 -28.789 1.00 31.31 H new ATOM 0 HB2 ASP A 38 3.730 -5.441 -30.419 1.00 13.11 H new ATOM 0 HB3 ASP A 38 2.960 -6.429 -29.193 1.00 13.11 H new ATOM 193 N GLY A 39 1.623 -5.008 -27.164 1.00 55.22 N ATOM 194 CA GLY A 39 0.885 -5.245 -25.938 1.00 73.21 C ATOM 195 C GLY A 39 1.078 -6.659 -25.421 1.00 73.02 C ATOM 196 O GLY A 39 0.579 -7.015 -24.354 1.00 11.20 O ATOM 0 H GLY A 39 1.065 -5.074 -28.015 1.00 55.22 H new ATOM 0 HA2 GLY A 39 1.208 -4.534 -25.178 1.00 73.21 H new ATOM 0 HA3 GLY A 39 -0.176 -5.065 -26.113 1.00 73.21 H new ATOM 200 N LYS A 40 1.791 -7.465 -26.193 1.00 50.31 N ATOM 201 CA LYS A 40 2.125 -8.825 -25.801 1.00 62.25 C ATOM 202 C LYS A 40 3.601 -9.092 -26.063 1.00 61.33 C ATOM 203 O LYS A 40 4.217 -8.408 -26.885 1.00 54.34 O ATOM 204 CB LYS A 40 1.259 -9.840 -26.561 1.00 31.43 C ATOM 205 CG LYS A 40 -0.162 -9.958 -26.028 1.00 52.23 C ATOM 206 CD LYS A 40 -0.174 -10.498 -24.608 1.00 12.43 C ATOM 207 CE LYS A 40 -1.589 -10.647 -24.084 1.00 2.50 C ATOM 208 NZ LYS A 40 -1.614 -11.202 -22.706 1.00 33.11 N ATOM 0 H LYS A 40 2.154 -7.195 -27.107 1.00 50.31 H new ATOM 0 HA LYS A 40 1.925 -8.937 -24.735 1.00 62.25 H new ATOM 0 HB2 LYS A 40 1.220 -9.555 -27.612 1.00 31.43 H new ATOM 0 HB3 LYS A 40 1.737 -10.818 -26.514 1.00 31.43 H new ATOM 0 HG2 LYS A 40 -0.644 -8.981 -26.052 1.00 52.23 H new ATOM 0 HG3 LYS A 40 -0.742 -10.616 -26.675 1.00 52.23 H new ATOM 0 HD2 LYS A 40 0.329 -11.464 -24.581 1.00 12.43 H new ATOM 0 HD3 LYS A 40 0.388 -9.828 -23.958 1.00 12.43 H new ATOM 0 HE2 LYS A 40 -2.084 -9.676 -24.093 1.00 2.50 H new ATOM 0 HE3 LYS A 40 -2.155 -11.299 -24.749 1.00 2.50 H new ATOM 0 HZ1 LYS A 40 -2.599 -11.288 -22.384 1.00 33.11 H new ATOM 0 HZ2 LYS A 40 -1.165 -12.140 -22.701 1.00 33.11 H new ATOM 0 HZ3 LYS A 40 -1.095 -10.567 -22.066 1.00 33.11 H new ATOM 222 N PRO A 41 4.200 -10.057 -25.346 1.00 34.23 N ATOM 223 CA PRO A 41 5.592 -10.451 -25.560 1.00 30.31 C ATOM 224 C PRO A 41 5.771 -11.185 -26.884 1.00 33.40 C ATOM 225 O PRO A 41 4.802 -11.667 -27.472 1.00 43.23 O ATOM 226 CB PRO A 41 5.887 -11.387 -24.384 1.00 65.12 C ATOM 227 CG PRO A 41 4.559 -11.932 -23.994 1.00 40.30 C ATOM 228 CD PRO A 41 3.566 -10.836 -24.267 1.00 3.12 C ATOM 0 HA PRO A 41 6.262 -9.592 -25.608 1.00 30.31 H new ATOM 0 HB2 PRO A 41 6.572 -12.183 -24.674 1.00 65.12 H new ATOM 0 HB3 PRO A 41 6.353 -10.850 -23.558 1.00 65.12 H new ATOM 0 HG2 PRO A 41 4.320 -12.827 -24.569 1.00 40.30 H new ATOM 0 HG3 PRO A 41 4.547 -12.216 -22.942 1.00 40.30 H new ATOM 0 HD2 PRO A 41 2.601 -11.237 -24.576 1.00 3.12 H new ATOM 0 HD3 PRO A 41 3.389 -10.225 -23.382 1.00 3.12 H new ATOM 236 N LEU A 42 7.007 -11.255 -27.359 1.00 64.31 N ATOM 237 CA LEU A 42 7.298 -11.958 -28.598 1.00 62.25 C ATOM 238 C LEU A 42 7.072 -13.457 -28.428 1.00 73.25 C ATOM 239 O LEU A 42 7.673 -14.099 -27.563 1.00 35.02 O ATOM 240 CB LEU A 42 8.727 -11.642 -29.081 1.00 63.14 C ATOM 241 CG LEU A 42 9.841 -11.728 -28.027 1.00 14.23 C ATOM 242 CD1 LEU A 42 10.465 -13.115 -28.001 1.00 22.44 C ATOM 243 CD2 LEU A 42 10.902 -10.669 -28.288 1.00 73.43 C ATOM 0 H LEU A 42 7.820 -10.836 -26.907 1.00 64.31 H new ATOM 0 HA LEU A 42 6.611 -11.609 -29.369 1.00 62.25 H new ATOM 0 HB2 LEU A 42 8.972 -12.327 -29.893 1.00 63.14 H new ATOM 0 HB3 LEU A 42 8.731 -10.636 -29.500 1.00 63.14 H new ATOM 0 HG LEU A 42 9.396 -11.542 -27.049 1.00 14.23 H new ATOM 0 HD11 LEU A 42 11.250 -13.147 -27.246 1.00 22.44 H new ATOM 0 HD12 LEU A 42 9.700 -13.854 -27.760 1.00 22.44 H new ATOM 0 HD13 LEU A 42 10.892 -13.340 -28.978 1.00 22.44 H new ATOM 0 HD21 LEU A 42 11.684 -10.743 -27.532 1.00 73.43 H new ATOM 0 HD22 LEU A 42 11.336 -10.824 -29.276 1.00 73.43 H new ATOM 0 HD23 LEU A 42 10.447 -9.679 -28.243 1.00 73.43 H new ATOM 255 N ASP A 43 6.154 -13.998 -29.216 1.00 11.12 N ATOM 256 CA ASP A 43 5.827 -15.413 -29.141 1.00 43.31 C ATOM 257 C ASP A 43 5.468 -15.948 -30.527 1.00 32.24 C ATOM 258 O ASP A 43 5.605 -15.239 -31.525 1.00 45.21 O ATOM 259 CB ASP A 43 4.673 -15.637 -28.153 1.00 1.10 C ATOM 260 CG ASP A 43 4.616 -17.065 -27.647 1.00 22.23 C ATOM 261 OD1 ASP A 43 5.321 -17.376 -26.662 1.00 4.54 O ATOM 262 OD2 ASP A 43 3.882 -17.879 -28.241 1.00 30.00 O ATOM 0 H ASP A 43 5.623 -13.478 -29.914 1.00 11.12 H new ATOM 0 HA ASP A 43 6.699 -15.959 -28.780 1.00 43.31 H new ATOM 0 HB2 ASP A 43 4.785 -14.959 -27.307 1.00 1.10 H new ATOM 0 HB3 ASP A 43 3.729 -15.388 -28.638 1.00 1.10 H new ATOM 267 N ALA A 44 4.988 -17.183 -30.580 1.00 0.23 N ATOM 268 CA ALA A 44 4.659 -17.842 -31.836 1.00 50.44 C ATOM 269 C ALA A 44 3.492 -17.154 -32.532 1.00 53.35 C ATOM 270 O ALA A 44 3.324 -17.279 -33.744 1.00 32.52 O ATOM 271 CB ALA A 44 4.341 -19.307 -31.588 1.00 45.51 C ATOM 0 H ALA A 44 4.816 -17.756 -29.754 1.00 0.23 H new ATOM 0 HA ALA A 44 5.526 -17.773 -32.494 1.00 50.44 H new ATOM 0 HB1 ALA A 44 4.096 -19.791 -32.533 1.00 45.51 H new ATOM 0 HB2 ALA A 44 5.207 -19.797 -31.143 1.00 45.51 H new ATOM 0 HB3 ALA A 44 3.491 -19.385 -30.910 1.00 45.51 H new ATOM 277 N SER A 45 2.696 -16.434 -31.752 1.00 51.32 N ATOM 278 CA SER A 45 1.518 -15.741 -32.257 1.00 41.13 C ATOM 279 C SER A 45 1.861 -14.836 -33.447 1.00 75.10 C ATOM 280 O SER A 45 1.085 -14.731 -34.400 1.00 42.23 O ATOM 281 CB SER A 45 0.901 -14.913 -31.131 1.00 53.22 C ATOM 282 OG SER A 45 0.794 -15.681 -29.941 1.00 41.32 O ATOM 0 H SER A 45 2.849 -16.314 -30.751 1.00 51.32 H new ATOM 0 HA SER A 45 0.804 -16.487 -32.607 1.00 41.13 H new ATOM 0 HB2 SER A 45 1.513 -14.030 -30.946 1.00 53.22 H new ATOM 0 HB3 SER A 45 -0.086 -14.560 -31.431 1.00 53.22 H new ATOM 0 HG SER A 45 0.398 -15.132 -29.232 1.00 41.32 H new ATOM 288 N PHE A 46 3.031 -14.207 -33.397 1.00 71.34 N ATOM 289 CA PHE A 46 3.470 -13.309 -34.461 1.00 24.43 C ATOM 290 C PHE A 46 3.867 -14.097 -35.714 1.00 13.01 C ATOM 291 O PHE A 46 3.691 -13.634 -36.840 1.00 43.32 O ATOM 292 CB PHE A 46 4.648 -12.461 -33.971 1.00 4.43 C ATOM 293 CG PHE A 46 5.151 -11.466 -34.980 1.00 44.41 C ATOM 294 CD1 PHE A 46 4.459 -10.288 -35.214 1.00 22.41 C ATOM 295 CD2 PHE A 46 6.312 -11.712 -35.697 1.00 34.10 C ATOM 296 CE1 PHE A 46 4.917 -9.373 -36.142 1.00 4.40 C ATOM 297 CE2 PHE A 46 6.773 -10.801 -36.627 1.00 14.24 C ATOM 298 CZ PHE A 46 6.075 -9.630 -36.850 1.00 74.42 C ATOM 0 H PHE A 46 3.695 -14.303 -32.628 1.00 71.34 H new ATOM 0 HA PHE A 46 2.641 -12.652 -34.724 1.00 24.43 H new ATOM 0 HB2 PHE A 46 4.347 -11.927 -33.069 1.00 4.43 H new ATOM 0 HB3 PHE A 46 5.467 -13.124 -33.691 1.00 4.43 H new ATOM 0 HD1 PHE A 46 3.552 -10.083 -34.665 1.00 22.41 H new ATOM 0 HD2 PHE A 46 6.862 -12.626 -35.526 1.00 34.10 H new ATOM 0 HE1 PHE A 46 4.370 -8.458 -36.314 1.00 4.40 H new ATOM 0 HE2 PHE A 46 7.679 -11.004 -37.179 1.00 14.24 H new ATOM 0 HZ PHE A 46 6.434 -8.916 -37.577 1.00 74.42 H new ATOM 308 N CYS A 47 4.372 -15.304 -35.510 1.00 74.31 N ATOM 309 CA CYS A 47 4.901 -16.107 -36.604 1.00 42.51 C ATOM 310 C CYS A 47 3.830 -17.003 -37.216 1.00 45.01 C ATOM 311 O CYS A 47 4.117 -17.798 -38.109 1.00 24.14 O ATOM 312 CB CYS A 47 6.082 -16.943 -36.121 1.00 73.31 C ATOM 313 SG CYS A 47 7.425 -15.948 -35.396 1.00 15.21 S ATOM 0 H CYS A 47 4.427 -15.751 -34.595 1.00 74.31 H new ATOM 0 HA CYS A 47 5.242 -15.424 -37.382 1.00 42.51 H new ATOM 0 HB2 CYS A 47 5.731 -17.660 -35.380 1.00 73.31 H new ATOM 0 HB3 CYS A 47 6.477 -17.518 -36.958 1.00 73.31 H new ATOM 318 N ARG A 48 2.594 -16.854 -36.752 1.00 24.34 N ATOM 319 CA ARG A 48 1.473 -17.633 -37.280 1.00 12.21 C ATOM 320 C ARG A 48 1.199 -17.285 -38.739 1.00 13.21 C ATOM 321 O ARG A 48 0.437 -17.968 -39.422 1.00 3.22 O ATOM 322 CB ARG A 48 0.214 -17.398 -36.446 1.00 15.43 C ATOM 323 CG ARG A 48 0.320 -17.936 -35.034 1.00 1.32 C ATOM 324 CD ARG A 48 -0.951 -17.689 -34.239 1.00 33.11 C ATOM 325 NE ARG A 48 -0.858 -18.236 -32.885 1.00 1.33 N ATOM 326 CZ ARG A 48 -1.611 -17.838 -31.862 1.00 51.25 C ATOM 327 NH1 ARG A 48 -2.515 -16.874 -32.026 1.00 53.54 N ATOM 328 NH2 ARG A 48 -1.447 -18.398 -30.669 1.00 20.24 N ATOM 0 H ARG A 48 2.340 -16.201 -36.011 1.00 24.34 H new ATOM 0 HA ARG A 48 1.747 -18.686 -37.222 1.00 12.21 H new ATOM 0 HB2 ARG A 48 0.008 -16.328 -36.405 1.00 15.43 H new ATOM 0 HB3 ARG A 48 -0.635 -17.867 -36.943 1.00 15.43 H new ATOM 0 HG2 ARG A 48 0.526 -19.006 -35.067 1.00 1.32 H new ATOM 0 HG3 ARG A 48 1.163 -17.465 -34.528 1.00 1.32 H new ATOM 0 HD2 ARG A 48 -1.145 -16.618 -34.186 1.00 33.11 H new ATOM 0 HD3 ARG A 48 -1.797 -18.141 -34.756 1.00 33.11 H new ATOM 0 HE ARG A 48 -0.171 -18.970 -32.714 1.00 1.33 H new ATOM 0 HH11 ARG A 48 -2.634 -16.436 -32.940 1.00 53.54 H new ATOM 0 HH12 ARG A 48 -3.089 -16.574 -31.238 1.00 53.54 H new ATOM 0 HH21 ARG A 48 -0.747 -19.129 -30.541 1.00 20.24 H new ATOM 0 HH22 ARG A 48 -2.021 -18.097 -29.881 1.00 20.24 H new ATOM 342 N THR A 49 1.810 -16.209 -39.206 1.00 73.02 N ATOM 343 CA THR A 49 1.674 -15.797 -40.589 1.00 51.24 C ATOM 344 C THR A 49 3.029 -15.833 -41.306 1.00 73.41 C ATOM 345 O THR A 49 3.188 -15.274 -42.390 1.00 71.41 O ATOM 346 CB THR A 49 1.076 -14.382 -40.676 1.00 3.24 C ATOM 347 OG1 THR A 49 0.463 -14.034 -39.424 1.00 22.04 O ATOM 348 CG2 THR A 49 0.031 -14.315 -41.775 1.00 61.30 C ATOM 0 H THR A 49 2.407 -15.604 -38.643 1.00 73.02 H new ATOM 0 HA THR A 49 1.000 -16.498 -41.081 1.00 51.24 H new ATOM 0 HB THR A 49 1.880 -13.681 -40.902 1.00 3.24 H new ATOM 0 HG1 THR A 49 0.085 -13.132 -39.484 1.00 22.04 H new ATOM 0 HG21 THR A 49 -0.382 -13.307 -41.823 1.00 61.30 H new ATOM 0 HG22 THR A 49 0.492 -14.564 -42.731 1.00 61.30 H new ATOM 0 HG23 THR A 49 -0.768 -15.025 -41.561 1.00 61.30 H new ATOM 356 N ALA A 50 4.007 -16.502 -40.694 1.00 3.31 N ATOM 357 CA ALA A 50 5.365 -16.546 -41.237 1.00 33.42 C ATOM 358 C ALA A 50 5.505 -17.623 -42.309 1.00 32.22 C ATOM 359 O ALA A 50 6.401 -17.556 -43.150 1.00 61.43 O ATOM 360 CB ALA A 50 6.380 -16.775 -40.127 1.00 21.23 C ATOM 0 H ALA A 50 3.884 -17.020 -39.824 1.00 3.31 H new ATOM 0 HA ALA A 50 5.563 -15.580 -41.702 1.00 33.42 H new ATOM 0 HB1 ALA A 50 7.383 -16.804 -40.552 1.00 21.23 H new ATOM 0 HB2 ALA A 50 6.316 -15.963 -39.403 1.00 21.23 H new ATOM 0 HB3 ALA A 50 6.168 -17.722 -39.630 1.00 21.23 H new ATOM 366 N GLY A 51 4.626 -18.615 -42.268 1.00 53.53 N ATOM 367 CA GLY A 51 4.644 -19.670 -43.263 1.00 44.23 C ATOM 368 C GLY A 51 5.819 -20.617 -43.104 1.00 12.22 C ATOM 369 O GLY A 51 5.802 -21.501 -42.241 1.00 1.21 O ATOM 0 H GLY A 51 3.897 -18.708 -41.560 1.00 53.53 H new ATOM 0 HA2 GLY A 51 3.716 -20.238 -43.199 1.00 44.23 H new ATOM 0 HA3 GLY A 51 4.676 -19.224 -44.257 1.00 44.23 H new ATOM 373 N SER A 52 6.848 -20.400 -43.920 1.00 73.14 N ATOM 374 CA SER A 52 8.015 -21.278 -43.972 1.00 45.25 C ATOM 375 C SER A 52 8.644 -21.481 -42.600 1.00 15.22 C ATOM 376 O SER A 52 8.901 -22.611 -42.184 1.00 52.41 O ATOM 377 CB SER A 52 9.054 -20.680 -44.924 1.00 33.10 C ATOM 378 OG SER A 52 9.115 -19.267 -44.777 1.00 41.34 O ATOM 0 H SER A 52 6.896 -19.610 -44.564 1.00 73.14 H new ATOM 0 HA SER A 52 7.682 -22.252 -44.329 1.00 45.25 H new ATOM 0 HB2 SER A 52 10.033 -21.114 -44.721 1.00 33.10 H new ATOM 0 HB3 SER A 52 8.800 -20.933 -45.953 1.00 33.10 H new ATOM 0 HG SER A 52 10.048 -18.990 -44.662 1.00 41.34 H new ATOM 384 N ARG A 53 8.870 -20.388 -41.888 1.00 53.15 N ATOM 385 CA ARG A 53 9.568 -20.453 -40.615 1.00 64.53 C ATOM 386 C ARG A 53 8.620 -20.273 -39.441 1.00 23.51 C ATOM 387 O ARG A 53 9.038 -19.927 -38.337 1.00 32.33 O ATOM 388 CB ARG A 53 10.691 -19.422 -40.576 1.00 74.43 C ATOM 389 CG ARG A 53 11.821 -19.763 -41.531 1.00 22.41 C ATOM 390 CD ARG A 53 13.001 -18.821 -41.387 1.00 3.43 C ATOM 391 NE ARG A 53 14.176 -19.327 -42.093 1.00 14.40 N ATOM 392 CZ ARG A 53 14.931 -20.335 -41.653 1.00 74.30 C ATOM 393 NH1 ARG A 53 14.666 -20.914 -40.488 1.00 51.24 N ATOM 394 NH2 ARG A 53 15.956 -20.755 -42.383 1.00 64.23 N ATOM 0 H ARG A 53 8.582 -19.451 -42.168 1.00 53.15 H new ATOM 0 HA ARG A 53 10.004 -21.448 -40.523 1.00 64.53 H new ATOM 0 HB2 ARG A 53 10.289 -18.441 -40.828 1.00 74.43 H new ATOM 0 HB3 ARG A 53 11.084 -19.354 -39.561 1.00 74.43 H new ATOM 0 HG2 ARG A 53 12.151 -20.786 -41.349 1.00 22.41 H new ATOM 0 HG3 ARG A 53 11.452 -19.725 -42.556 1.00 22.41 H new ATOM 0 HD2 ARG A 53 12.735 -17.839 -41.778 1.00 3.43 H new ATOM 0 HD3 ARG A 53 13.237 -18.690 -40.331 1.00 3.43 H new ATOM 0 HE ARG A 53 14.434 -18.883 -42.974 1.00 14.40 H new ATOM 0 HH11 ARG A 53 13.881 -20.589 -39.924 1.00 51.24 H new ATOM 0 HH12 ARG A 53 15.247 -21.684 -40.157 1.00 51.24 H new ATOM 0 HH21 ARG A 53 16.164 -20.308 -43.276 1.00 64.23 H new ATOM 0 HH22 ARG A 53 16.537 -21.525 -42.051 1.00 64.23 H new ATOM 408 N GLU A 54 7.343 -20.533 -39.681 1.00 43.10 N ATOM 409 CA GLU A 54 6.354 -20.552 -38.610 1.00 22.23 C ATOM 410 C GLU A 54 6.682 -21.670 -37.630 1.00 44.44 C ATOM 411 O GLU A 54 6.625 -21.492 -36.414 1.00 45.02 O ATOM 412 CB GLU A 54 4.946 -20.733 -39.195 1.00 22.14 C ATOM 413 CG GLU A 54 3.879 -21.133 -38.180 1.00 73.35 C ATOM 414 CD GLU A 54 3.506 -22.604 -38.268 1.00 51.04 C ATOM 415 OE1 GLU A 54 2.923 -23.008 -39.295 1.00 42.24 O ATOM 416 OE2 GLU A 54 3.797 -23.362 -37.324 1.00 12.44 O ATOM 0 H GLU A 54 6.966 -20.734 -40.607 1.00 43.10 H new ATOM 0 HA GLU A 54 6.380 -19.602 -38.076 1.00 22.23 H new ATOM 0 HB2 GLU A 54 4.643 -19.801 -39.672 1.00 22.14 H new ATOM 0 HB3 GLU A 54 4.987 -21.492 -39.976 1.00 22.14 H new ATOM 0 HG2 GLU A 54 4.239 -20.914 -37.175 1.00 73.35 H new ATOM 0 HG3 GLU A 54 2.987 -20.526 -38.339 1.00 73.35 H new ATOM 423 N LYS A 55 7.084 -22.805 -38.182 1.00 31.31 N ATOM 424 CA LYS A 55 7.369 -23.985 -37.385 1.00 52.24 C ATOM 425 C LYS A 55 8.685 -23.805 -36.633 1.00 54.21 C ATOM 426 O LYS A 55 8.842 -24.267 -35.505 1.00 10.21 O ATOM 427 CB LYS A 55 7.424 -25.231 -38.277 1.00 24.15 C ATOM 428 CG LYS A 55 6.255 -25.348 -39.252 1.00 10.41 C ATOM 429 CD LYS A 55 6.640 -24.876 -40.651 1.00 34.42 C ATOM 430 CE LYS A 55 5.460 -24.917 -41.613 1.00 2.14 C ATOM 431 NZ LYS A 55 4.491 -23.814 -41.368 1.00 71.44 N ATOM 0 H LYS A 55 7.220 -22.932 -39.185 1.00 31.31 H new ATOM 0 HA LYS A 55 6.569 -24.119 -36.657 1.00 52.24 H new ATOM 0 HB2 LYS A 55 8.356 -25.220 -38.842 1.00 24.15 H new ATOM 0 HB3 LYS A 55 7.446 -26.118 -37.644 1.00 24.15 H new ATOM 0 HG2 LYS A 55 5.920 -26.384 -39.297 1.00 10.41 H new ATOM 0 HG3 LYS A 55 5.415 -24.757 -38.886 1.00 10.41 H new ATOM 0 HD2 LYS A 55 7.028 -23.859 -40.596 1.00 34.42 H new ATOM 0 HD3 LYS A 55 7.444 -25.503 -41.037 1.00 34.42 H new ATOM 0 HE2 LYS A 55 5.827 -24.854 -42.637 1.00 2.14 H new ATOM 0 HE3 LYS A 55 4.949 -25.875 -41.516 1.00 2.14 H new ATOM 0 HZ1 LYS A 55 3.689 -23.904 -42.024 1.00 71.44 H new ATOM 0 HZ2 LYS A 55 4.144 -23.867 -40.389 1.00 71.44 H new ATOM 0 HZ3 LYS A 55 4.961 -22.899 -41.519 1.00 71.44 H new ATOM 445 N ASP A 56 9.626 -23.115 -37.269 1.00 73.11 N ATOM 446 CA ASP A 56 10.908 -22.803 -36.646 1.00 23.34 C ATOM 447 C ASP A 56 10.712 -21.828 -35.496 1.00 42.20 C ATOM 448 O ASP A 56 11.226 -22.028 -34.394 1.00 52.02 O ATOM 449 CB ASP A 56 11.870 -22.189 -37.667 1.00 22.24 C ATOM 450 CG ASP A 56 12.134 -23.088 -38.851 1.00 43.21 C ATOM 451 OD1 ASP A 56 11.290 -23.120 -39.771 1.00 60.04 O ATOM 452 OD2 ASP A 56 13.189 -23.752 -38.876 1.00 2.43 O ATOM 0 H ASP A 56 9.524 -22.760 -38.220 1.00 73.11 H new ATOM 0 HA ASP A 56 11.334 -23.732 -36.268 1.00 23.34 H new ATOM 0 HB2 ASP A 56 11.459 -21.244 -38.021 1.00 22.24 H new ATOM 0 HB3 ASP A 56 12.815 -21.961 -37.174 1.00 22.24 H new ATOM 457 N CYS A 57 9.946 -20.776 -35.761 1.00 65.05 N ATOM 458 CA CYS A 57 9.730 -19.711 -34.794 1.00 54.41 C ATOM 459 C CYS A 57 9.120 -20.235 -33.502 1.00 73.54 C ATOM 460 O CYS A 57 9.577 -19.895 -32.413 1.00 11.41 O ATOM 461 CB CYS A 57 8.828 -18.632 -35.390 1.00 34.33 C ATOM 462 SG CYS A 57 8.441 -17.271 -34.243 1.00 60.41 S ATOM 0 H CYS A 57 9.460 -20.639 -36.648 1.00 65.05 H new ATOM 0 HA CYS A 57 10.704 -19.283 -34.556 1.00 54.41 H new ATOM 0 HB2 CYS A 57 9.309 -18.220 -36.277 1.00 34.33 H new ATOM 0 HB3 CYS A 57 7.896 -19.093 -35.718 1.00 34.33 H new ATOM 467 N ARG A 58 8.115 -21.096 -33.621 1.00 22.22 N ATOM 468 CA ARG A 58 7.377 -21.560 -32.456 1.00 3.11 C ATOM 469 C ARG A 58 8.268 -22.398 -31.542 1.00 24.03 C ATOM 470 O ARG A 58 8.105 -22.381 -30.326 1.00 21.15 O ATOM 471 CB ARG A 58 6.126 -22.335 -32.881 1.00 44.04 C ATOM 472 CG ARG A 58 6.411 -23.572 -33.709 1.00 74.13 C ATOM 473 CD ARG A 58 5.157 -24.076 -34.401 1.00 50.34 C ATOM 474 NE ARG A 58 4.102 -24.419 -33.453 1.00 44.12 N ATOM 475 CZ ARG A 58 2.920 -24.912 -33.814 1.00 43.15 C ATOM 476 NH1 ARG A 58 2.620 -25.051 -35.100 1.00 42.02 N ATOM 477 NH2 ARG A 58 2.030 -25.234 -32.886 1.00 13.43 N ATOM 0 H ARG A 58 7.795 -21.484 -34.508 1.00 22.22 H new ATOM 0 HA ARG A 58 7.052 -20.688 -31.888 1.00 3.11 H new ATOM 0 HB2 ARG A 58 5.574 -22.629 -31.988 1.00 44.04 H new ATOM 0 HB3 ARG A 58 5.478 -21.671 -33.453 1.00 44.04 H new ATOM 0 HG2 ARG A 58 7.174 -23.345 -34.454 1.00 74.13 H new ATOM 0 HG3 ARG A 58 6.815 -24.356 -33.068 1.00 74.13 H new ATOM 0 HD2 ARG A 58 4.791 -23.312 -35.087 1.00 50.34 H new ATOM 0 HD3 ARG A 58 5.403 -24.952 -35.001 1.00 50.34 H new ATOM 0 HE ARG A 58 4.280 -24.273 -32.459 1.00 44.12 H new ATOM 0 HH11 ARG A 58 3.296 -24.780 -35.814 1.00 42.02 H new ATOM 0 HH12 ARG A 58 1.713 -25.429 -35.374 1.00 42.02 H new ATOM 0 HH21 ARG A 58 2.252 -25.104 -31.899 1.00 13.43 H new ATOM 0 HH22 ARG A 58 1.123 -25.612 -33.159 1.00 13.43 H new ATOM 491 N LYS A 59 9.227 -23.108 -32.125 1.00 51.23 N ATOM 492 CA LYS A 59 10.167 -23.898 -31.339 1.00 31.13 C ATOM 493 C LYS A 59 11.222 -23.001 -30.704 1.00 21.21 C ATOM 494 O LYS A 59 11.550 -23.141 -29.527 1.00 2.11 O ATOM 495 CB LYS A 59 10.837 -24.960 -32.212 1.00 30.23 C ATOM 496 CG LYS A 59 10.104 -26.290 -32.224 1.00 21.15 C ATOM 497 CD LYS A 59 10.204 -26.984 -30.876 1.00 63.53 C ATOM 498 CE LYS A 59 9.480 -28.319 -30.881 1.00 62.21 C ATOM 499 NZ LYS A 59 9.634 -29.043 -29.594 1.00 70.33 N ATOM 0 H LYS A 59 9.374 -23.153 -33.133 1.00 51.23 H new ATOM 0 HA LYS A 59 9.611 -24.397 -30.546 1.00 31.13 H new ATOM 0 HB2 LYS A 59 10.909 -24.586 -33.233 1.00 30.23 H new ATOM 0 HB3 LYS A 59 11.855 -25.119 -31.858 1.00 30.23 H new ATOM 0 HG2 LYS A 59 9.056 -26.128 -32.476 1.00 21.15 H new ATOM 0 HG3 LYS A 59 10.523 -26.932 -32.999 1.00 21.15 H new ATOM 0 HD2 LYS A 59 11.253 -27.139 -30.622 1.00 63.53 H new ATOM 0 HD3 LYS A 59 9.781 -26.342 -30.103 1.00 63.53 H new ATOM 0 HE2 LYS A 59 8.421 -28.156 -31.080 1.00 62.21 H new ATOM 0 HE3 LYS A 59 9.865 -28.937 -31.692 1.00 62.21 H new ATOM 0 HZ1 LYS A 59 9.124 -29.948 -29.642 1.00 70.33 H new ATOM 0 HZ2 LYS A 59 10.643 -29.223 -29.415 1.00 70.33 H new ATOM 0 HZ3 LYS A 59 9.243 -28.466 -28.822 1.00 70.33 H new ATOM 513 N ASP A 60 11.725 -22.064 -31.498 1.00 33.33 N ATOM 514 CA ASP A 60 12.810 -21.183 -31.076 1.00 24.03 C ATOM 515 C ASP A 60 12.351 -20.261 -29.948 1.00 0.14 C ATOM 516 O ASP A 60 13.089 -20.012 -28.996 1.00 52.15 O ATOM 517 CB ASP A 60 13.296 -20.362 -32.279 1.00 74.14 C ATOM 518 CG ASP A 60 14.594 -19.614 -32.022 1.00 22.03 C ATOM 519 OD1 ASP A 60 15.615 -20.270 -31.728 1.00 11.52 O ATOM 520 OD2 ASP A 60 14.609 -18.373 -32.150 1.00 31.22 O ATOM 0 H ASP A 60 11.395 -21.893 -32.448 1.00 33.33 H new ATOM 0 HA ASP A 60 13.633 -21.789 -30.698 1.00 24.03 H new ATOM 0 HB2 ASP A 60 13.433 -21.028 -33.131 1.00 74.14 H new ATOM 0 HB3 ASP A 60 12.522 -19.646 -32.555 1.00 74.14 H new ATOM 525 N VAL A 61 11.114 -19.783 -30.044 1.00 34.31 N ATOM 526 CA VAL A 61 10.578 -18.857 -29.056 1.00 1.32 C ATOM 527 C VAL A 61 10.210 -19.571 -27.749 1.00 22.12 C ATOM 528 O VAL A 61 10.364 -19.005 -26.667 1.00 11.40 O ATOM 529 CB VAL A 61 9.352 -18.081 -29.602 1.00 34.35 C ATOM 530 CG1 VAL A 61 8.140 -18.986 -29.780 1.00 32.12 C ATOM 531 CG2 VAL A 61 9.016 -16.905 -28.702 1.00 11.41 C ATOM 0 H VAL A 61 10.466 -20.022 -30.795 1.00 34.31 H new ATOM 0 HA VAL A 61 11.370 -18.139 -28.843 1.00 1.32 H new ATOM 0 HB VAL A 61 9.621 -17.700 -30.587 1.00 34.35 H new ATOM 0 HG11 VAL A 61 7.303 -18.402 -30.164 1.00 32.12 H new ATOM 0 HG12 VAL A 61 8.381 -19.782 -30.484 1.00 32.12 H new ATOM 0 HG13 VAL A 61 7.867 -19.422 -28.819 1.00 32.12 H new ATOM 0 HG21 VAL A 61 8.153 -16.374 -29.104 1.00 11.41 H new ATOM 0 HG22 VAL A 61 8.785 -17.268 -27.700 1.00 11.41 H new ATOM 0 HG23 VAL A 61 9.869 -16.228 -28.655 1.00 11.41 H new ATOM 541 N GLN A 62 9.742 -20.815 -27.840 1.00 75.35 N ATOM 542 CA GLN A 62 9.347 -21.557 -26.644 1.00 23.10 C ATOM 543 C GLN A 62 10.562 -22.131 -25.929 1.00 61.30 C ATOM 544 O GLN A 62 10.490 -22.491 -24.752 1.00 14.42 O ATOM 545 CB GLN A 62 8.356 -22.673 -26.978 1.00 32.54 C ATOM 546 CG GLN A 62 7.016 -22.162 -27.480 1.00 21.42 C ATOM 547 CD GLN A 62 6.418 -21.090 -26.587 1.00 31.13 C ATOM 548 OE1 GLN A 62 6.634 -21.071 -25.372 1.00 71.24 O ATOM 549 NE2 GLN A 62 5.663 -20.187 -27.189 1.00 31.31 N ATOM 0 H GLN A 62 9.628 -21.324 -28.716 1.00 75.35 H new ATOM 0 HA GLN A 62 8.852 -20.852 -25.977 1.00 23.10 H new ATOM 0 HB2 GLN A 62 8.795 -23.323 -27.735 1.00 32.54 H new ATOM 0 HB3 GLN A 62 8.194 -23.282 -26.089 1.00 32.54 H new ATOM 0 HG2 GLN A 62 7.140 -21.762 -28.486 1.00 21.42 H new ATOM 0 HG3 GLN A 62 6.319 -22.997 -27.553 1.00 21.42 H new ATOM 0 HE21 GLN A 62 5.510 -20.240 -28.196 1.00 31.31 H new ATOM 0 HE22 GLN A 62 5.233 -19.438 -26.646 1.00 31.31 H new ATOM 558 N ALA A 63 11.668 -22.239 -26.652 1.00 63.45 N ATOM 559 CA ALA A 63 12.937 -22.633 -26.054 1.00 2.50 C ATOM 560 C ALA A 63 13.488 -21.515 -25.173 1.00 15.11 C ATOM 561 O ALA A 63 14.401 -21.729 -24.377 1.00 41.20 O ATOM 562 CB ALA A 63 13.943 -23.009 -27.134 1.00 5.45 C ATOM 0 H ALA A 63 11.713 -22.059 -27.655 1.00 63.45 H new ATOM 0 HA ALA A 63 12.763 -23.507 -25.427 1.00 2.50 H new ATOM 0 HB1 ALA A 63 14.885 -23.300 -26.669 1.00 5.45 H new ATOM 0 HB2 ALA A 63 13.554 -23.842 -27.719 1.00 5.45 H new ATOM 0 HB3 ALA A 63 14.111 -22.154 -27.788 1.00 5.45 H new ATOM 568 N CYS A 64 12.915 -20.328 -25.309 1.00 64.21 N ATOM 569 CA CYS A 64 13.362 -19.175 -24.549 1.00 14.55 C ATOM 570 C CYS A 64 12.292 -18.762 -23.535 1.00 44.33 C ATOM 571 O CYS A 64 11.321 -18.091 -23.884 1.00 33.31 O ATOM 572 CB CYS A 64 13.671 -18.017 -25.505 1.00 41.31 C ATOM 573 SG CYS A 64 14.835 -16.777 -24.848 1.00 13.14 S ATOM 0 H CYS A 64 12.137 -20.140 -25.941 1.00 64.21 H new ATOM 0 HA CYS A 64 14.269 -19.435 -24.003 1.00 14.55 H new ATOM 0 HB2 CYS A 64 14.080 -18.426 -26.429 1.00 41.31 H new ATOM 0 HB3 CYS A 64 12.737 -17.518 -25.763 1.00 41.31 H new ATOM 578 N ASP A 65 12.452 -19.200 -22.288 1.00 55.33 N ATOM 579 CA ASP A 65 11.514 -18.850 -21.221 1.00 4.42 C ATOM 580 C ASP A 65 11.724 -17.417 -20.769 1.00 35.14 C ATOM 581 O ASP A 65 10.772 -16.641 -20.653 1.00 24.53 O ATOM 582 CB ASP A 65 11.667 -19.785 -20.018 1.00 34.40 C ATOM 583 CG ASP A 65 11.013 -21.131 -20.228 1.00 3.22 C ATOM 584 OD1 ASP A 65 9.791 -21.243 -19.993 1.00 70.33 O ATOM 585 OD2 ASP A 65 11.717 -22.087 -20.612 1.00 2.23 O ATOM 0 H ASP A 65 13.223 -19.798 -21.990 1.00 55.33 H new ATOM 0 HA ASP A 65 10.508 -18.958 -21.626 1.00 4.42 H new ATOM 0 HB2 ASP A 65 12.727 -19.931 -19.811 1.00 34.40 H new ATOM 0 HB3 ASP A 65 11.233 -19.310 -19.138 1.00 34.40 H new ATOM 590 N LYS A 66 12.975 -17.069 -20.514 1.00 42.34 N ATOM 591 CA LYS A 66 13.314 -15.718 -20.107 1.00 43.35 C ATOM 592 C LYS A 66 13.649 -14.900 -21.335 1.00 22.01 C ATOM 593 O LYS A 66 14.800 -14.868 -21.777 1.00 34.52 O ATOM 594 CB LYS A 66 14.496 -15.707 -19.137 1.00 54.34 C ATOM 595 CG LYS A 66 14.247 -16.474 -17.853 1.00 4.32 C ATOM 596 CD LYS A 66 15.410 -16.324 -16.886 1.00 43.53 C ATOM 597 CE LYS A 66 16.702 -16.884 -17.462 1.00 31.41 C ATOM 598 NZ LYS A 66 17.857 -16.653 -16.557 1.00 0.51 N ATOM 0 H LYS A 66 13.771 -17.704 -20.582 1.00 42.34 H new ATOM 0 HA LYS A 66 12.456 -15.286 -19.591 1.00 43.35 H new ATOM 0 HB2 LYS A 66 15.367 -16.129 -19.637 1.00 54.34 H new ATOM 0 HB3 LYS A 66 14.740 -14.674 -18.890 1.00 54.34 H new ATOM 0 HG2 LYS A 66 13.332 -16.114 -17.383 1.00 4.32 H new ATOM 0 HG3 LYS A 66 14.094 -17.529 -18.081 1.00 4.32 H new ATOM 0 HD2 LYS A 66 15.547 -15.270 -16.644 1.00 43.53 H new ATOM 0 HD3 LYS A 66 15.176 -16.838 -15.954 1.00 43.53 H new ATOM 0 HE2 LYS A 66 16.587 -17.953 -17.639 1.00 31.41 H new ATOM 0 HE3 LYS A 66 16.900 -16.421 -18.429 1.00 31.41 H new ATOM 0 HZ1 LYS A 66 18.718 -17.049 -16.985 1.00 0.51 H new ATOM 0 HZ2 LYS A 66 17.983 -15.631 -16.408 1.00 0.51 H new ATOM 0 HZ3 LYS A 66 17.680 -17.117 -15.643 1.00 0.51 H new ATOM 612 N LYS A 67 12.641 -14.253 -21.901 1.00 43.01 N ATOM 613 CA LYS A 67 12.807 -13.529 -23.146 1.00 11.01 C ATOM 614 C LYS A 67 13.262 -12.103 -22.879 1.00 4.23 C ATOM 615 O LYS A 67 13.952 -11.501 -23.693 1.00 65.14 O ATOM 616 CB LYS A 67 11.483 -13.504 -23.917 1.00 65.32 C ATOM 617 CG LYS A 67 10.893 -14.879 -24.184 1.00 53.13 C ATOM 618 CD LYS A 67 9.500 -14.774 -24.786 1.00 11.33 C ATOM 619 CE LYS A 67 8.908 -16.143 -25.088 1.00 2.42 C ATOM 620 NZ LYS A 67 7.530 -16.042 -25.645 1.00 3.23 N ATOM 0 H LYS A 67 11.698 -14.216 -21.514 1.00 43.01 H new ATOM 0 HA LYS A 67 13.566 -14.037 -23.740 1.00 11.01 H new ATOM 0 HB2 LYS A 67 10.759 -12.913 -23.356 1.00 65.32 H new ATOM 0 HB3 LYS A 67 11.639 -12.997 -24.869 1.00 65.32 H new ATOM 0 HG2 LYS A 67 11.544 -15.431 -24.862 1.00 53.13 H new ATOM 0 HG3 LYS A 67 10.848 -15.445 -23.254 1.00 53.13 H new ATOM 0 HD2 LYS A 67 8.846 -14.240 -24.097 1.00 11.33 H new ATOM 0 HD3 LYS A 67 9.544 -14.187 -25.703 1.00 11.33 H new ATOM 0 HE2 LYS A 67 9.549 -16.667 -25.797 1.00 2.42 H new ATOM 0 HE3 LYS A 67 8.888 -16.739 -24.176 1.00 2.42 H new ATOM 0 HZ1 LYS A 67 7.188 -16.991 -25.900 1.00 3.23 H new ATOM 0 HZ2 LYS A 67 6.897 -15.626 -24.932 1.00 3.23 H new ATOM 0 HZ3 LYS A 67 7.541 -15.439 -26.492 1.00 3.23 H new ATOM 634 N TYR A 68 12.923 -11.573 -21.715 1.00 63.12 N ATOM 635 CA TYR A 68 13.107 -10.155 -21.468 1.00 12.44 C ATOM 636 C TYR A 68 14.010 -9.920 -20.270 1.00 72.31 C ATOM 637 O TYR A 68 14.054 -10.722 -19.336 1.00 50.14 O ATOM 638 CB TYR A 68 11.757 -9.459 -21.265 1.00 65.13 C ATOM 639 CG TYR A 68 10.939 -9.363 -22.531 1.00 4.40 C ATOM 640 CD1 TYR A 68 11.242 -8.413 -23.497 1.00 72.12 C ATOM 641 CD2 TYR A 68 9.874 -10.221 -22.766 1.00 33.15 C ATOM 642 CE1 TYR A 68 10.508 -8.321 -24.661 1.00 10.01 C ATOM 643 CE2 TYR A 68 9.134 -10.136 -23.928 1.00 40.13 C ATOM 644 CZ TYR A 68 9.455 -9.186 -24.873 1.00 42.32 C ATOM 645 OH TYR A 68 8.716 -9.097 -26.031 1.00 75.31 O ATOM 0 H TYR A 68 12.524 -12.097 -20.936 1.00 63.12 H new ATOM 0 HA TYR A 68 13.590 -9.725 -22.346 1.00 12.44 H new ATOM 0 HB2 TYR A 68 11.186 -10.002 -20.512 1.00 65.13 H new ATOM 0 HB3 TYR A 68 11.928 -8.456 -20.874 1.00 65.13 H new ATOM 0 HD1 TYR A 68 12.066 -7.735 -23.334 1.00 72.12 H new ATOM 0 HD2 TYR A 68 9.620 -10.967 -22.028 1.00 33.15 H new ATOM 0 HE1 TYR A 68 10.756 -7.576 -25.402 1.00 10.01 H new ATOM 0 HE2 TYR A 68 8.308 -10.811 -24.096 1.00 40.13 H new ATOM 0 HH TYR A 68 9.199 -8.551 -26.686 1.00 75.31 H new ATOM 655 N ASP A 69 14.728 -8.815 -20.325 1.00 52.22 N ATOM 656 CA ASP A 69 15.680 -8.439 -19.295 1.00 43.12 C ATOM 657 C ASP A 69 14.962 -7.835 -18.089 1.00 13.31 C ATOM 658 O ASP A 69 13.811 -7.409 -18.194 1.00 21.50 O ATOM 659 CB ASP A 69 16.680 -7.436 -19.887 1.00 73.55 C ATOM 660 CG ASP A 69 17.742 -6.991 -18.906 1.00 42.01 C ATOM 661 OD1 ASP A 69 17.506 -6.009 -18.183 1.00 44.51 O ATOM 662 OD2 ASP A 69 18.823 -7.616 -18.865 1.00 14.44 O ATOM 0 H ASP A 69 14.667 -8.146 -21.093 1.00 52.22 H new ATOM 0 HA ASP A 69 16.212 -9.326 -18.952 1.00 43.12 H new ATOM 0 HB2 ASP A 69 17.163 -7.886 -20.754 1.00 73.55 H new ATOM 0 HB3 ASP A 69 16.137 -6.561 -20.244 1.00 73.55 H new ATOM 667 N ASP A 70 15.654 -7.811 -16.956 1.00 72.24 N ATOM 668 CA ASP A 70 15.124 -7.248 -15.711 1.00 54.30 C ATOM 669 C ASP A 70 14.646 -5.806 -15.892 1.00 15.44 C ATOM 670 O ASP A 70 13.688 -5.379 -15.245 1.00 71.25 O ATOM 671 CB ASP A 70 16.191 -7.311 -14.614 1.00 30.24 C ATOM 672 CG ASP A 70 15.799 -6.551 -13.358 1.00 23.12 C ATOM 673 OD1 ASP A 70 14.965 -7.059 -12.582 1.00 45.02 O ATOM 674 OD2 ASP A 70 16.345 -5.447 -13.131 1.00 13.53 O ATOM 0 H ASP A 70 16.601 -8.181 -16.870 1.00 72.24 H new ATOM 0 HA ASP A 70 14.261 -7.847 -15.420 1.00 54.30 H new ATOM 0 HB2 ASP A 70 16.379 -8.354 -14.357 1.00 30.24 H new ATOM 0 HB3 ASP A 70 17.126 -6.905 -15.001 1.00 30.24 H new ATOM 679 N GLN A 71 15.289 -5.065 -16.791 1.00 24.32 N ATOM 680 CA GLN A 71 14.925 -3.668 -17.023 1.00 3.45 C ATOM 681 C GLN A 71 13.818 -3.551 -18.075 1.00 71.23 C ATOM 682 O GLN A 71 13.479 -2.453 -18.509 1.00 60.11 O ATOM 683 CB GLN A 71 16.139 -2.840 -17.467 1.00 73.13 C ATOM 684 CG GLN A 71 17.162 -2.564 -16.368 1.00 3.05 C ATOM 685 CD GLN A 71 18.210 -3.652 -16.241 1.00 71.04 C ATOM 686 OE1 GLN A 71 19.245 -3.611 -16.911 1.00 30.12 O ATOM 687 NE2 GLN A 71 17.971 -4.612 -15.363 1.00 0.02 N ATOM 0 H GLN A 71 16.059 -5.404 -17.367 1.00 24.32 H new ATOM 0 HA GLN A 71 14.557 -3.274 -16.075 1.00 3.45 H new ATOM 0 HB2 GLN A 71 16.637 -3.361 -18.285 1.00 73.13 H new ATOM 0 HB3 GLN A 71 15.786 -1.888 -17.863 1.00 73.13 H new ATOM 0 HG2 GLN A 71 17.656 -1.614 -16.571 1.00 3.05 H new ATOM 0 HG3 GLN A 71 16.643 -2.456 -15.416 1.00 3.05 H new ATOM 0 HE21 GLN A 71 17.102 -4.610 -14.829 1.00 0.02 H new ATOM 0 HE22 GLN A 71 18.656 -5.355 -15.220 1.00 0.02 H new ATOM 696 N GLY A 72 13.262 -4.685 -18.486 1.00 73.40 N ATOM 697 CA GLY A 72 12.189 -4.674 -19.464 1.00 51.11 C ATOM 698 C GLY A 72 12.699 -4.566 -20.886 1.00 40.23 C ATOM 699 O GLY A 72 11.968 -4.164 -21.790 1.00 35.44 O ATOM 0 H GLY A 72 13.535 -5.612 -18.160 1.00 73.40 H new ATOM 0 HA2 GLY A 72 11.599 -5.585 -19.361 1.00 51.11 H new ATOM 0 HA3 GLY A 72 11.522 -3.837 -19.257 1.00 51.11 H new ATOM 703 N ARG A 73 13.959 -4.922 -21.085 1.00 43.10 N ATOM 704 CA ARG A 73 14.566 -4.866 -22.408 1.00 5.12 C ATOM 705 C ARG A 73 14.565 -6.240 -23.066 1.00 73.35 C ATOM 706 O ARG A 73 14.302 -7.245 -22.412 1.00 10.32 O ATOM 707 CB ARG A 73 16.002 -4.344 -22.324 1.00 73.15 C ATOM 708 CG ARG A 73 16.112 -2.903 -21.851 1.00 23.00 C ATOM 709 CD ARG A 73 15.281 -1.961 -22.710 1.00 22.23 C ATOM 710 NE ARG A 73 15.553 -2.120 -24.141 1.00 45.41 N ATOM 711 CZ ARG A 73 15.406 -1.147 -25.040 1.00 42.03 C ATOM 712 NH1 ARG A 73 15.125 0.090 -24.646 1.00 73.34 N ATOM 713 NH2 ARG A 73 15.576 -1.404 -26.330 1.00 62.54 N ATOM 0 H ARG A 73 14.582 -5.253 -20.348 1.00 43.10 H new ATOM 0 HA ARG A 73 13.972 -4.182 -23.014 1.00 5.12 H new ATOM 0 HB2 ARG A 73 16.570 -4.982 -21.647 1.00 73.15 H new ATOM 0 HB3 ARG A 73 16.466 -4.429 -23.307 1.00 73.15 H new ATOM 0 HG2 ARG A 73 15.783 -2.835 -20.814 1.00 23.00 H new ATOM 0 HG3 ARG A 73 17.156 -2.591 -21.875 1.00 23.00 H new ATOM 0 HD2 ARG A 73 14.223 -2.142 -22.522 1.00 22.23 H new ATOM 0 HD3 ARG A 73 15.485 -0.931 -22.417 1.00 22.23 H new ATOM 0 HE ARG A 73 15.874 -3.031 -24.469 1.00 45.41 H new ATOM 0 HH11 ARG A 73 15.021 0.298 -23.653 1.00 73.34 H new ATOM 0 HH12 ARG A 73 15.013 0.832 -25.337 1.00 73.34 H new ATOM 0 HH21 ARG A 73 15.819 -2.347 -26.634 1.00 62.54 H new ATOM 0 HH22 ARG A 73 15.463 -0.659 -27.018 1.00 62.54 H new ATOM 727 N GLU A 74 14.852 -6.279 -24.357 1.00 41.14 N ATOM 728 CA GLU A 74 14.985 -7.539 -25.068 1.00 30.34 C ATOM 729 C GLU A 74 16.399 -8.079 -24.889 1.00 4.44 C ATOM 730 O GLU A 74 17.377 -7.342 -25.046 1.00 3.33 O ATOM 731 CB GLU A 74 14.672 -7.356 -26.556 1.00 22.45 C ATOM 732 CG GLU A 74 13.246 -6.904 -26.825 1.00 61.45 C ATOM 733 CD GLU A 74 12.957 -6.713 -28.299 1.00 33.12 C ATOM 734 OE1 GLU A 74 13.441 -5.712 -28.878 1.00 34.13 O ATOM 735 OE2 GLU A 74 12.233 -7.547 -28.883 1.00 52.32 O ATOM 0 H GLU A 74 14.997 -5.451 -24.934 1.00 41.14 H new ATOM 0 HA GLU A 74 14.272 -8.253 -24.656 1.00 30.34 H new ATOM 0 HB2 GLU A 74 15.362 -6.625 -26.977 1.00 22.45 H new ATOM 0 HB3 GLU A 74 14.850 -8.298 -27.075 1.00 22.45 H new ATOM 0 HG2 GLU A 74 12.554 -7.640 -26.417 1.00 61.45 H new ATOM 0 HG3 GLU A 74 13.062 -5.967 -26.299 1.00 61.45 H new ATOM 742 N THR A 75 16.502 -9.352 -24.545 1.00 40.14 N ATOM 743 CA THR A 75 17.791 -9.986 -24.312 1.00 52.41 C ATOM 744 C THR A 75 18.449 -10.385 -25.631 1.00 22.31 C ATOM 745 O THR A 75 17.916 -10.112 -26.708 1.00 45.02 O ATOM 746 CB THR A 75 17.629 -11.245 -23.438 1.00 63.13 C ATOM 747 OG1 THR A 75 16.653 -12.121 -24.026 1.00 3.20 O ATOM 748 CG2 THR A 75 17.213 -10.877 -22.022 1.00 74.23 C ATOM 0 H THR A 75 15.702 -9.972 -24.420 1.00 40.14 H new ATOM 0 HA THR A 75 18.422 -9.262 -23.797 1.00 52.41 H new ATOM 0 HB THR A 75 18.591 -11.755 -23.387 1.00 63.13 H new ATOM 0 HG1 THR A 75 15.754 -11.832 -23.764 1.00 3.20 H new ATOM 0 HG21 THR A 75 17.106 -11.784 -21.427 1.00 74.23 H new ATOM 0 HG22 THR A 75 17.973 -10.237 -21.574 1.00 74.23 H new ATOM 0 HG23 THR A 75 16.261 -10.346 -22.049 1.00 74.23 H new ATOM 756 N ALA A 76 19.603 -11.037 -25.546 1.00 74.24 N ATOM 757 CA ALA A 76 20.261 -11.571 -26.729 1.00 0.25 C ATOM 758 C ALA A 76 19.416 -12.683 -27.336 1.00 53.32 C ATOM 759 O ALA A 76 19.396 -12.871 -28.551 1.00 12.22 O ATOM 760 CB ALA A 76 21.651 -12.082 -26.380 1.00 22.51 C ATOM 0 H ALA A 76 20.100 -11.207 -24.672 1.00 74.24 H new ATOM 0 HA ALA A 76 20.368 -10.773 -27.464 1.00 0.25 H new ATOM 0 HB1 ALA A 76 22.129 -12.478 -27.276 1.00 22.51 H new ATOM 0 HB2 ALA A 76 22.250 -11.263 -25.981 1.00 22.51 H new ATOM 0 HB3 ALA A 76 21.571 -12.871 -25.633 1.00 22.51 H new ATOM 766 N CYS A 77 18.706 -13.410 -26.481 1.00 22.13 N ATOM 767 CA CYS A 77 17.793 -14.445 -26.940 1.00 52.54 C ATOM 768 C CYS A 77 16.587 -13.798 -27.616 1.00 42.11 C ATOM 769 O CYS A 77 16.226 -14.154 -28.738 1.00 30.14 O ATOM 770 CB CYS A 77 17.343 -15.313 -25.758 1.00 41.50 C ATOM 771 SG CYS A 77 16.328 -16.754 -26.225 1.00 14.04 S ATOM 0 H CYS A 77 18.746 -13.301 -25.468 1.00 22.13 H new ATOM 0 HA CYS A 77 18.304 -15.083 -27.661 1.00 52.54 H new ATOM 0 HB2 CYS A 77 18.226 -15.664 -25.224 1.00 41.50 H new ATOM 0 HB3 CYS A 77 16.775 -14.694 -25.064 1.00 41.50 H new ATOM 776 N ALA A 78 15.999 -12.817 -26.935 1.00 52.55 N ATOM 777 CA ALA A 78 14.863 -12.074 -27.476 1.00 53.13 C ATOM 778 C ALA A 78 15.186 -11.432 -28.815 1.00 72.12 C ATOM 779 O ALA A 78 14.341 -11.400 -29.709 1.00 10.12 O ATOM 780 CB ALA A 78 14.405 -11.008 -26.503 1.00 21.22 C ATOM 0 H ALA A 78 16.291 -12.517 -26.005 1.00 52.55 H new ATOM 0 HA ALA A 78 14.060 -12.795 -27.630 1.00 53.13 H new ATOM 0 HB1 ALA A 78 13.559 -10.468 -26.927 1.00 21.22 H new ATOM 0 HB2 ALA A 78 14.104 -11.476 -25.566 1.00 21.22 H new ATOM 0 HB3 ALA A 78 15.222 -10.312 -26.315 1.00 21.22 H new ATOM 786 N LYS A 79 16.421 -10.965 -28.985 1.00 55.20 N ATOM 787 CA LYS A 79 16.768 -10.244 -30.199 1.00 33.15 C ATOM 788 C LYS A 79 17.059 -11.259 -31.288 1.00 13.24 C ATOM 789 O LYS A 79 16.937 -10.974 -32.476 1.00 14.45 O ATOM 790 CB LYS A 79 17.977 -9.318 -29.996 1.00 63.02 C ATOM 791 CG LYS A 79 19.318 -10.027 -30.066 1.00 34.23 C ATOM 792 CD LYS A 79 20.470 -9.040 -30.106 1.00 25.31 C ATOM 793 CE LYS A 79 21.791 -9.743 -30.368 1.00 0.13 C ATOM 794 NZ LYS A 79 21.814 -10.412 -31.699 1.00 64.35 N ATOM 0 H LYS A 79 17.180 -11.071 -28.312 1.00 55.20 H new ATOM 0 HA LYS A 79 15.930 -9.607 -30.481 1.00 33.15 H new ATOM 0 HB2 LYS A 79 17.952 -8.534 -30.753 1.00 63.02 H new ATOM 0 HB3 LYS A 79 17.887 -8.828 -29.027 1.00 63.02 H new ATOM 0 HG2 LYS A 79 19.429 -10.682 -29.202 1.00 34.23 H new ATOM 0 HG3 LYS A 79 19.350 -10.660 -30.953 1.00 34.23 H new ATOM 0 HD2 LYS A 79 20.290 -8.299 -30.884 1.00 25.31 H new ATOM 0 HD3 LYS A 79 20.524 -8.502 -29.160 1.00 25.31 H new ATOM 0 HE2 LYS A 79 22.604 -9.019 -30.312 1.00 0.13 H new ATOM 0 HE3 LYS A 79 21.969 -10.483 -29.587 1.00 0.13 H new ATOM 0 HZ1 LYS A 79 21.883 -11.442 -31.569 1.00 64.35 H new ATOM 0 HZ2 LYS A 79 20.940 -10.186 -32.216 1.00 64.35 H new ATOM 0 HZ3 LYS A 79 22.634 -10.076 -32.242 1.00 64.35 H new ATOM 808 N GLY A 80 17.414 -12.468 -30.852 1.00 10.42 N ATOM 809 CA GLY A 80 17.761 -13.525 -31.771 1.00 11.13 C ATOM 810 C GLY A 80 16.539 -14.039 -32.483 1.00 20.50 C ATOM 811 O GLY A 80 16.611 -14.475 -33.626 1.00 14.11 O ATOM 0 H GLY A 80 17.465 -12.729 -29.867 1.00 10.42 H new ATOM 0 HA2 GLY A 80 18.483 -13.157 -32.499 1.00 11.13 H new ATOM 0 HA3 GLY A 80 18.241 -14.340 -31.230 1.00 11.13 H new ATOM 815 N ILE A 81 15.408 -13.993 -31.800 1.00 34.34 N ATOM 816 CA ILE A 81 14.140 -14.339 -32.412 1.00 30.42 C ATOM 817 C ILE A 81 13.724 -13.216 -33.355 1.00 2.41 C ATOM 818 O ILE A 81 13.288 -13.457 -34.482 1.00 2.01 O ATOM 819 CB ILE A 81 13.051 -14.576 -31.342 1.00 22.02 C ATOM 820 CG1 ILE A 81 13.518 -15.652 -30.356 1.00 61.51 C ATOM 821 CG2 ILE A 81 11.734 -14.980 -31.991 1.00 64.33 C ATOM 822 CD1 ILE A 81 12.590 -15.852 -29.179 1.00 13.30 C ATOM 0 H ILE A 81 15.344 -13.719 -30.820 1.00 34.34 H new ATOM 0 HA ILE A 81 14.257 -15.267 -32.972 1.00 30.42 H new ATOM 0 HB ILE A 81 12.886 -13.646 -30.799 1.00 22.02 H new ATOM 0 HG12 ILE A 81 13.622 -16.597 -30.888 1.00 61.51 H new ATOM 0 HG13 ILE A 81 14.507 -15.385 -29.984 1.00 61.51 H new ATOM 0 HG21 ILE A 81 10.982 -15.142 -31.218 1.00 64.33 H new ATOM 0 HG22 ILE A 81 11.401 -14.188 -32.662 1.00 64.33 H new ATOM 0 HG23 ILE A 81 11.875 -15.900 -32.558 1.00 64.33 H new ATOM 0 HD11 ILE A 81 12.990 -16.629 -28.528 1.00 13.30 H new ATOM 0 HD12 ILE A 81 12.504 -14.920 -28.621 1.00 13.30 H new ATOM 0 HD13 ILE A 81 11.605 -16.151 -29.539 1.00 13.30 H new ATOM 834 N ARG A 82 13.902 -11.982 -32.882 1.00 13.22 N ATOM 835 CA ARG A 82 13.605 -10.785 -33.670 1.00 75.33 C ATOM 836 C ARG A 82 14.347 -10.784 -35.001 1.00 11.31 C ATOM 837 O ARG A 82 13.817 -10.313 -36.003 1.00 64.32 O ATOM 838 CB ARG A 82 13.979 -9.512 -32.904 1.00 0.45 C ATOM 839 CG ARG A 82 13.215 -9.304 -31.608 1.00 44.20 C ATOM 840 CD ARG A 82 11.718 -9.150 -31.841 1.00 22.13 C ATOM 841 NE ARG A 82 11.403 -8.053 -32.762 1.00 74.53 N ATOM 842 CZ ARG A 82 11.092 -6.812 -32.369 1.00 51.14 C ATOM 843 NH1 ARG A 82 11.196 -6.468 -31.092 1.00 40.11 N ATOM 844 NH2 ARG A 82 10.716 -5.903 -33.263 1.00 64.42 N ATOM 0 H ARG A 82 14.255 -11.784 -31.946 1.00 13.22 H new ATOM 0 HA ARG A 82 12.532 -10.801 -33.860 1.00 75.33 H new ATOM 0 HB2 ARG A 82 15.046 -9.539 -32.681 1.00 0.45 H new ATOM 0 HB3 ARG A 82 13.810 -8.652 -33.552 1.00 0.45 H new ATOM 0 HG2 ARG A 82 13.392 -10.150 -30.944 1.00 44.20 H new ATOM 0 HG3 ARG A 82 13.595 -8.416 -31.102 1.00 44.20 H new ATOM 0 HD2 ARG A 82 11.318 -10.082 -32.241 1.00 22.13 H new ATOM 0 HD3 ARG A 82 11.221 -8.973 -30.887 1.00 22.13 H new ATOM 0 HE ARG A 82 11.422 -8.248 -33.763 1.00 74.53 H new ATOM 0 HH11 ARG A 82 11.514 -7.151 -30.404 1.00 40.11 H new ATOM 0 HH12 ARG A 82 10.958 -5.521 -30.798 1.00 40.11 H new ATOM 0 HH21 ARG A 82 10.664 -6.151 -34.251 1.00 64.42 H new ATOM 0 HH22 ARG A 82 10.479 -4.958 -32.961 1.00 64.42 H new ATOM 858 N GLU A 83 15.575 -11.294 -35.013 1.00 61.04 N ATOM 859 CA GLU A 83 16.394 -11.252 -36.218 1.00 1.14 C ATOM 860 C GLU A 83 16.130 -12.440 -37.148 1.00 72.03 C ATOM 861 O GLU A 83 16.063 -12.257 -38.363 1.00 12.52 O ATOM 862 CB GLU A 83 17.884 -11.141 -35.870 1.00 24.00 C ATOM 863 CG GLU A 83 18.383 -12.184 -34.892 1.00 34.30 C ATOM 864 CD GLU A 83 19.806 -11.926 -34.448 1.00 5.30 C ATOM 865 OE1 GLU A 83 20.039 -10.950 -33.707 1.00 73.05 O ATOM 866 OE2 GLU A 83 20.702 -12.702 -34.833 1.00 14.22 O ATOM 0 H GLU A 83 16.021 -11.737 -34.210 1.00 61.04 H new ATOM 0 HA GLU A 83 16.104 -10.355 -36.765 1.00 1.14 H new ATOM 0 HB2 GLU A 83 18.465 -11.217 -36.789 1.00 24.00 H new ATOM 0 HB3 GLU A 83 18.074 -10.152 -35.454 1.00 24.00 H new ATOM 0 HG2 GLU A 83 17.731 -12.201 -34.019 1.00 34.30 H new ATOM 0 HG3 GLU A 83 18.323 -13.169 -35.354 1.00 34.30 H new ATOM 873 N LYS A 84 15.965 -13.644 -36.598 1.00 21.42 N ATOM 874 CA LYS A 84 15.720 -14.827 -37.432 1.00 25.03 C ATOM 875 C LYS A 84 14.410 -14.683 -38.194 1.00 1.22 C ATOM 876 O LYS A 84 14.321 -14.991 -39.381 1.00 60.15 O ATOM 877 CB LYS A 84 15.647 -16.111 -36.597 1.00 2.42 C ATOM 878 CG LYS A 84 16.889 -16.428 -35.783 1.00 41.15 C ATOM 879 CD LYS A 84 16.801 -17.831 -35.203 1.00 62.31 C ATOM 880 CE LYS A 84 17.652 -17.992 -33.954 1.00 63.22 C ATOM 881 NZ LYS A 84 17.004 -17.390 -32.760 1.00 12.35 N ATOM 0 H LYS A 84 15.995 -13.827 -35.595 1.00 21.42 H new ATOM 0 HA LYS A 84 16.559 -14.898 -38.125 1.00 25.03 H new ATOM 0 HB2 LYS A 84 14.797 -16.035 -35.918 1.00 2.42 H new ATOM 0 HB3 LYS A 84 15.447 -16.949 -37.265 1.00 2.42 H new ATOM 0 HG2 LYS A 84 17.775 -16.343 -36.412 1.00 41.15 H new ATOM 0 HG3 LYS A 84 16.999 -15.701 -34.978 1.00 41.15 H new ATOM 0 HD2 LYS A 84 15.762 -18.059 -34.964 1.00 62.31 H new ATOM 0 HD3 LYS A 84 17.121 -18.553 -35.954 1.00 62.31 H new ATOM 0 HE2 LYS A 84 17.834 -19.051 -33.773 1.00 63.22 H new ATOM 0 HE3 LYS A 84 18.624 -17.525 -34.114 1.00 63.22 H new ATOM 0 HZ1 LYS A 84 17.395 -17.821 -31.898 1.00 12.35 H new ATOM 0 HZ2 LYS A 84 17.184 -16.366 -32.747 1.00 12.35 H new ATOM 0 HZ3 LYS A 84 15.979 -17.561 -32.798 1.00 12.35 H new ATOM 895 N TYR A 85 13.397 -14.203 -37.495 1.00 41.43 N ATOM 896 CA TYR A 85 12.054 -14.135 -38.040 1.00 74.43 C ATOM 897 C TYR A 85 11.636 -12.681 -38.200 1.00 23.35 C ATOM 898 O TYR A 85 10.459 -12.340 -38.078 1.00 71.52 O ATOM 899 CB TYR A 85 11.098 -14.892 -37.115 1.00 23.30 C ATOM 900 CG TYR A 85 11.657 -16.231 -36.690 1.00 30.20 C ATOM 901 CD1 TYR A 85 11.728 -17.290 -37.585 1.00 4.11 C ATOM 902 CD2 TYR A 85 12.150 -16.424 -35.404 1.00 52.34 C ATOM 903 CE1 TYR A 85 12.274 -18.503 -37.212 1.00 74.42 C ATOM 904 CE2 TYR A 85 12.692 -17.636 -35.023 1.00 22.35 C ATOM 905 CZ TYR A 85 12.754 -18.669 -35.931 1.00 20.40 C ATOM 906 OH TYR A 85 13.304 -19.873 -35.559 1.00 55.10 O ATOM 0 H TYR A 85 13.481 -13.852 -36.541 1.00 41.43 H new ATOM 0 HA TYR A 85 12.024 -14.601 -39.025 1.00 74.43 H new ATOM 0 HB2 TYR A 85 10.895 -14.287 -36.231 1.00 23.30 H new ATOM 0 HB3 TYR A 85 10.146 -15.042 -37.624 1.00 23.30 H new ATOM 0 HD1 TYR A 85 11.350 -17.164 -38.589 1.00 4.11 H new ATOM 0 HD2 TYR A 85 12.108 -15.613 -34.692 1.00 52.34 H new ATOM 0 HE1 TYR A 85 12.324 -19.317 -37.920 1.00 74.42 H new ATOM 0 HE2 TYR A 85 13.065 -17.773 -34.019 1.00 22.35 H new ATOM 0 HH TYR A 85 13.989 -19.722 -34.875 1.00 55.10 H new ATOM 916 N LYS A 86 12.626 -11.840 -38.491 1.00 51.52 N ATOM 917 CA LYS A 86 12.434 -10.398 -38.605 1.00 1.20 C ATOM 918 C LYS A 86 11.317 -10.056 -39.584 1.00 32.53 C ATOM 919 O LYS A 86 11.120 -10.747 -40.584 1.00 20.22 O ATOM 920 CB LYS A 86 13.737 -9.721 -39.073 1.00 11.13 C ATOM 921 CG LYS A 86 14.049 -9.940 -40.553 1.00 71.21 C ATOM 922 CD LYS A 86 15.212 -9.078 -41.037 1.00 14.34 C ATOM 923 CE LYS A 86 16.564 -9.767 -40.890 1.00 2.33 C ATOM 924 NZ LYS A 86 16.960 -9.971 -39.471 1.00 21.44 N ATOM 0 H LYS A 86 13.587 -12.141 -38.655 1.00 51.52 H new ATOM 0 HA LYS A 86 12.156 -10.029 -37.618 1.00 1.20 H new ATOM 0 HB2 LYS A 86 13.669 -8.650 -38.880 1.00 11.13 H new ATOM 0 HB3 LYS A 86 14.567 -10.100 -38.476 1.00 11.13 H new ATOM 0 HG2 LYS A 86 14.285 -10.991 -40.720 1.00 71.21 H new ATOM 0 HG3 LYS A 86 13.162 -9.715 -41.146 1.00 71.21 H new ATOM 0 HD2 LYS A 86 15.054 -8.819 -42.084 1.00 14.34 H new ATOM 0 HD3 LYS A 86 15.223 -8.144 -40.476 1.00 14.34 H new ATOM 0 HE2 LYS A 86 16.531 -10.733 -41.395 1.00 2.33 H new ATOM 0 HE3 LYS A 86 17.326 -9.171 -41.392 1.00 2.33 H new ATOM 0 HZ1 LYS A 86 17.997 -10.000 -39.401 1.00 21.44 H new ATOM 0 HZ2 LYS A 86 16.596 -9.187 -38.893 1.00 21.44 H new ATOM 0 HZ3 LYS A 86 16.565 -10.869 -39.126 1.00 21.44 H new ATOM 938 N PRO A 87 10.550 -9.001 -39.296 1.00 64.12 N ATOM 939 CA PRO A 87 9.643 -8.422 -40.278 1.00 43.21 C ATOM 940 C PRO A 87 10.447 -7.738 -41.378 1.00 64.41 C ATOM 941 O PRO A 87 11.625 -7.431 -41.177 1.00 33.34 O ATOM 942 CB PRO A 87 8.839 -7.399 -39.470 1.00 32.53 C ATOM 943 CG PRO A 87 9.707 -7.059 -38.305 1.00 42.04 C ATOM 944 CD PRO A 87 10.499 -8.299 -37.999 1.00 35.45 C ATOM 0 HA PRO A 87 9.004 -9.157 -40.769 1.00 43.21 H new ATOM 0 HB2 PRO A 87 8.614 -6.514 -40.066 1.00 32.53 H new ATOM 0 HB3 PRO A 87 7.886 -7.815 -39.144 1.00 32.53 H new ATOM 0 HG2 PRO A 87 10.366 -6.224 -38.541 1.00 42.04 H new ATOM 0 HG3 PRO A 87 9.107 -6.758 -37.446 1.00 42.04 H new ATOM 0 HD2 PRO A 87 11.497 -8.058 -37.633 1.00 35.45 H new ATOM 0 HD3 PRO A 87 10.016 -8.905 -37.233 1.00 35.45 H new ATOM 952 N ALA A 88 9.839 -7.513 -42.533 1.00 4.50 N ATOM 953 CA ALA A 88 10.545 -6.866 -43.629 1.00 21.21 C ATOM 954 C ALA A 88 10.856 -5.415 -43.278 1.00 52.41 C ATOM 955 O ALA A 88 10.034 -4.516 -43.481 1.00 12.54 O ATOM 956 CB ALA A 88 9.738 -6.951 -44.913 1.00 24.55 C ATOM 0 H ALA A 88 8.871 -7.765 -42.735 1.00 4.50 H new ATOM 0 HA ALA A 88 11.488 -7.389 -43.789 1.00 21.21 H new ATOM 0 HB1 ALA A 88 10.284 -6.461 -45.719 1.00 24.55 H new ATOM 0 HB2 ALA A 88 9.573 -7.997 -45.170 1.00 24.55 H new ATOM 0 HB3 ALA A 88 8.777 -6.456 -44.772 1.00 24.55 H new ATOM 962 N VAL A 89 12.043 -5.214 -42.722 1.00 22.04 N ATOM 963 CA VAL A 89 12.529 -3.903 -42.320 1.00 63.21 C ATOM 964 C VAL A 89 14.034 -3.865 -42.528 1.00 45.24 C ATOM 965 O VAL A 89 14.704 -4.890 -42.397 1.00 20.10 O ATOM 966 CB VAL A 89 12.240 -3.588 -40.824 1.00 62.23 C ATOM 967 CG1 VAL A 89 12.637 -2.158 -40.480 1.00 62.51 C ATOM 968 CG2 VAL A 89 10.782 -3.824 -40.466 1.00 52.44 C ATOM 0 H VAL A 89 12.704 -5.968 -42.535 1.00 22.04 H new ATOM 0 HA VAL A 89 12.010 -3.160 -42.925 1.00 63.21 H new ATOM 0 HB VAL A 89 12.846 -4.274 -40.233 1.00 62.23 H new ATOM 0 HG11 VAL A 89 12.424 -1.964 -39.429 1.00 62.51 H new ATOM 0 HG12 VAL A 89 13.702 -2.021 -40.666 1.00 62.51 H new ATOM 0 HG13 VAL A 89 12.069 -1.464 -41.099 1.00 62.51 H new ATOM 0 HG21 VAL A 89 10.624 -3.592 -39.413 1.00 52.44 H new ATOM 0 HG22 VAL A 89 10.149 -3.182 -41.078 1.00 52.44 H new ATOM 0 HG23 VAL A 89 10.526 -4.868 -40.650 1.00 52.44 H new ATOM 978 N VAL A 90 14.567 -2.704 -42.858 1.00 15.25 N ATOM 979 CA VAL A 90 16.003 -2.554 -42.994 1.00 5.15 C ATOM 980 C VAL A 90 16.638 -2.264 -41.636 1.00 51.24 C ATOM 981 O VAL A 90 16.386 -1.229 -41.021 1.00 20.51 O ATOM 982 CB VAL A 90 16.374 -1.452 -44.015 1.00 51.31 C ATOM 983 CG1 VAL A 90 16.077 -1.921 -45.427 1.00 51.33 C ATOM 984 CG2 VAL A 90 15.624 -0.161 -43.731 1.00 12.31 C ATOM 0 H VAL A 90 14.030 -1.855 -43.036 1.00 15.25 H new ATOM 0 HA VAL A 90 16.398 -3.496 -43.375 1.00 5.15 H new ATOM 0 HB VAL A 90 17.442 -1.255 -43.918 1.00 51.31 H new ATOM 0 HG11 VAL A 90 16.343 -1.136 -46.135 1.00 51.33 H new ATOM 0 HG12 VAL A 90 16.660 -2.817 -45.643 1.00 51.33 H new ATOM 0 HG13 VAL A 90 15.015 -2.148 -45.519 1.00 51.33 H new ATOM 0 HG21 VAL A 90 15.907 0.593 -44.466 1.00 12.31 H new ATOM 0 HG22 VAL A 90 14.551 -0.343 -43.792 1.00 12.31 H new ATOM 0 HG23 VAL A 90 15.876 0.194 -42.732 1.00 12.31 H new ATOM 994 N TYR A 91 17.430 -3.204 -41.153 1.00 23.54 N ATOM 995 CA TYR A 91 18.108 -3.044 -39.876 1.00 34.24 C ATOM 996 C TYR A 91 19.443 -2.340 -40.075 1.00 73.23 C ATOM 997 O TYR A 91 20.176 -2.647 -41.014 1.00 22.23 O ATOM 998 CB TYR A 91 18.326 -4.402 -39.206 1.00 73.25 C ATOM 999 CG TYR A 91 17.057 -5.027 -38.663 1.00 44.44 C ATOM 1000 CD1 TYR A 91 16.124 -5.616 -39.509 1.00 15.35 C ATOM 1001 CD2 TYR A 91 16.796 -5.027 -37.300 1.00 54.13 C ATOM 1002 CE1 TYR A 91 14.967 -6.184 -39.009 1.00 41.35 C ATOM 1003 CE2 TYR A 91 15.642 -5.593 -36.793 1.00 15.43 C ATOM 1004 CZ TYR A 91 14.731 -6.170 -37.650 1.00 23.31 C ATOM 1005 OH TYR A 91 13.582 -6.736 -37.146 1.00 33.04 O ATOM 0 H TYR A 91 17.621 -4.088 -41.625 1.00 23.54 H new ATOM 0 HA TYR A 91 17.479 -2.435 -39.227 1.00 34.24 H new ATOM 0 HB2 TYR A 91 18.776 -5.084 -39.927 1.00 73.25 H new ATOM 0 HB3 TYR A 91 19.039 -4.284 -38.390 1.00 73.25 H new ATOM 0 HD1 TYR A 91 16.306 -5.630 -40.573 1.00 15.35 H new ATOM 0 HD2 TYR A 91 17.507 -4.577 -36.624 1.00 54.13 H new ATOM 0 HE1 TYR A 91 14.251 -6.637 -39.679 1.00 41.35 H new ATOM 0 HE2 TYR A 91 15.455 -5.583 -35.729 1.00 15.43 H new ATOM 0 HH TYR A 91 13.572 -6.642 -36.171 1.00 33.04 H new ATOM 1015 N GLY A 92 19.750 -1.400 -39.195 1.00 60.22 N ATOM 1016 CA GLY A 92 20.992 -0.659 -39.303 1.00 43.40 C ATOM 1017 C GLY A 92 22.120 -1.309 -38.525 1.00 2.23 C ATOM 1018 O GLY A 92 21.945 -2.385 -37.954 1.00 44.03 O ATOM 0 H GLY A 92 19.161 -1.135 -38.406 1.00 60.22 H new ATOM 0 HA2 GLY A 92 21.276 -0.581 -40.353 1.00 43.40 H new ATOM 0 HA3 GLY A 92 20.840 0.356 -38.937 1.00 43.40 H new ATOM 1022 N TYR A 93 23.270 -0.640 -38.477 1.00 20.34 N ATOM 1023 CA TYR A 93 24.443 -1.160 -37.771 1.00 24.11 C ATOM 1024 C TYR A 93 24.191 -1.222 -36.269 1.00 45.20 C ATOM 1025 O TYR A 93 24.916 -1.882 -35.525 1.00 63.31 O ATOM 1026 CB TYR A 93 25.674 -0.291 -38.063 1.00 44.00 C ATOM 1027 CG TYR A 93 25.531 1.159 -37.642 1.00 62.40 C ATOM 1028 CD1 TYR A 93 24.969 2.099 -38.494 1.00 23.12 C ATOM 1029 CD2 TYR A 93 25.966 1.583 -36.392 1.00 73.45 C ATOM 1030 CE1 TYR A 93 24.841 3.421 -38.113 1.00 41.43 C ATOM 1031 CE2 TYR A 93 25.841 2.903 -36.003 1.00 24.50 C ATOM 1032 CZ TYR A 93 25.278 3.819 -36.868 1.00 73.41 C ATOM 1033 OH TYR A 93 25.153 5.136 -36.487 1.00 54.31 O ATOM 0 H TYR A 93 23.417 0.267 -38.920 1.00 20.34 H new ATOM 0 HA TYR A 93 24.632 -2.172 -38.131 1.00 24.11 H new ATOM 0 HB2 TYR A 93 26.536 -0.721 -37.554 1.00 44.00 H new ATOM 0 HB3 TYR A 93 25.884 -0.327 -39.132 1.00 44.00 H new ATOM 0 HD1 TYR A 93 24.626 1.792 -39.471 1.00 23.12 H new ATOM 0 HD2 TYR A 93 26.409 0.869 -35.713 1.00 73.45 H new ATOM 0 HE1 TYR A 93 24.400 4.140 -38.788 1.00 41.43 H new ATOM 0 HE2 TYR A 93 26.182 3.216 -35.027 1.00 24.50 H new ATOM 0 HH TYR A 93 25.508 5.249 -35.581 1.00 54.31 H new ATOM 1043 N ASP A 94 23.153 -0.521 -35.835 1.00 30.43 N ATOM 1044 CA ASP A 94 22.751 -0.506 -34.434 1.00 44.11 C ATOM 1045 C ASP A 94 22.155 -1.852 -34.032 1.00 15.41 C ATOM 1046 O ASP A 94 22.006 -2.147 -32.848 1.00 4.14 O ATOM 1047 CB ASP A 94 21.703 0.587 -34.198 1.00 64.25 C ATOM 1048 CG ASP A 94 22.121 1.941 -34.741 1.00 34.22 C ATOM 1049 OD1 ASP A 94 22.099 2.117 -35.979 1.00 1.31 O ATOM 1050 OD2 ASP A 94 22.446 2.840 -33.934 1.00 23.52 O ATOM 0 H ASP A 94 22.567 0.052 -36.442 1.00 30.43 H new ATOM 0 HA ASP A 94 23.637 -0.307 -33.831 1.00 44.11 H new ATOM 0 HB2 ASP A 94 20.765 0.289 -34.665 1.00 64.25 H new ATOM 0 HB3 ASP A 94 21.513 0.674 -33.128 1.00 64.25 H new ATOM 1055 N GLY A 95 21.804 -2.660 -35.030 1.00 63.14 N ATOM 1056 CA GLY A 95 21.092 -3.897 -34.773 1.00 21.22 C ATOM 1057 C GLY A 95 19.623 -3.629 -34.535 1.00 74.41 C ATOM 1058 O GLY A 95 18.873 -4.502 -34.099 1.00 73.31 O ATOM 0 H GLY A 95 22.002 -2.478 -36.014 1.00 63.14 H new ATOM 0 HA2 GLY A 95 21.211 -4.573 -35.619 1.00 21.22 H new ATOM 0 HA3 GLY A 95 21.521 -4.396 -33.904 1.00 21.22 H new ATOM 1062 N LYS A 96 19.227 -2.405 -34.845 1.00 41.43 N ATOM 1063 CA LYS A 96 17.878 -1.927 -34.604 1.00 42.22 C ATOM 1064 C LYS A 96 17.203 -1.632 -35.940 1.00 63.23 C ATOM 1065 O LYS A 96 17.871 -1.221 -36.891 1.00 0.33 O ATOM 1066 CB LYS A 96 17.956 -0.662 -33.738 1.00 55.30 C ATOM 1067 CG LYS A 96 16.616 -0.118 -33.270 1.00 34.40 C ATOM 1068 CD LYS A 96 16.804 1.133 -32.425 1.00 73.31 C ATOM 1069 CE LYS A 96 17.407 2.269 -33.240 1.00 65.04 C ATOM 1070 NZ LYS A 96 17.846 3.404 -32.385 1.00 41.33 N ATOM 0 H LYS A 96 19.839 -1.711 -35.274 1.00 41.43 H new ATOM 0 HA LYS A 96 17.289 -2.680 -34.081 1.00 42.22 H new ATOM 0 HB2 LYS A 96 18.569 -0.877 -32.863 1.00 55.30 H new ATOM 0 HB3 LYS A 96 18.469 0.116 -34.304 1.00 55.30 H new ATOM 0 HG2 LYS A 96 15.991 0.112 -34.133 1.00 34.40 H new ATOM 0 HG3 LYS A 96 16.093 -0.878 -32.690 1.00 34.40 H new ATOM 0 HD2 LYS A 96 15.843 1.446 -32.017 1.00 73.31 H new ATOM 0 HD3 LYS A 96 17.452 0.908 -31.578 1.00 73.31 H new ATOM 0 HE2 LYS A 96 18.258 1.894 -33.808 1.00 65.04 H new ATOM 0 HE3 LYS A 96 16.673 2.624 -33.963 1.00 65.04 H new ATOM 0 HZ1 LYS A 96 18.250 4.153 -32.983 1.00 41.33 H new ATOM 0 HZ2 LYS A 96 17.030 3.781 -31.862 1.00 41.33 H new ATOM 0 HZ3 LYS A 96 18.566 3.073 -31.712 1.00 41.33 H new ATOM 1084 N PRO A 97 15.887 -1.876 -36.052 1.00 43.01 N ATOM 1085 CA PRO A 97 15.140 -1.592 -37.280 1.00 20.33 C ATOM 1086 C PRO A 97 14.911 -0.093 -37.501 1.00 65.24 C ATOM 1087 O PRO A 97 14.054 0.517 -36.859 1.00 12.20 O ATOM 1088 CB PRO A 97 13.808 -2.314 -37.065 1.00 11.52 C ATOM 1089 CG PRO A 97 13.642 -2.393 -35.585 1.00 61.33 C ATOM 1090 CD PRO A 97 15.029 -2.471 -35.004 1.00 52.00 C ATOM 0 HA PRO A 97 15.681 -1.924 -38.166 1.00 20.33 H new ATOM 0 HB2 PRO A 97 12.985 -1.767 -37.525 1.00 11.52 H new ATOM 0 HB3 PRO A 97 13.821 -3.307 -37.514 1.00 11.52 H new ATOM 0 HG2 PRO A 97 13.111 -1.519 -35.207 1.00 61.33 H new ATOM 0 HG3 PRO A 97 13.055 -3.268 -35.306 1.00 61.33 H new ATOM 0 HD2 PRO A 97 15.101 -1.919 -34.067 1.00 52.00 H new ATOM 0 HD3 PRO A 97 15.315 -3.501 -34.790 1.00 52.00 H new ATOM 1098 N LEU A 98 15.702 0.496 -38.391 1.00 42.25 N ATOM 1099 CA LEU A 98 15.520 1.890 -38.775 1.00 1.01 C ATOM 1100 C LEU A 98 15.883 2.066 -40.246 1.00 3.14 C ATOM 1101 O LEU A 98 16.911 1.558 -40.708 1.00 34.34 O ATOM 1102 CB LEU A 98 16.351 2.846 -37.897 1.00 14.24 C ATOM 1103 CG LEU A 98 17.860 2.899 -38.178 1.00 74.24 C ATOM 1104 CD1 LEU A 98 18.471 4.128 -37.531 1.00 70.40 C ATOM 1105 CD2 LEU A 98 18.558 1.649 -37.673 1.00 42.44 C ATOM 0 H LEU A 98 16.477 0.028 -38.861 1.00 42.25 H new ATOM 0 HA LEU A 98 14.472 2.147 -38.623 1.00 1.01 H new ATOM 0 HB2 LEU A 98 15.947 3.852 -38.012 1.00 14.24 H new ATOM 0 HB3 LEU A 98 16.208 2.562 -36.854 1.00 14.24 H new ATOM 0 HG LEU A 98 17.998 2.954 -39.258 1.00 74.24 H new ATOM 0 HD11 LEU A 98 19.541 4.154 -37.738 1.00 70.40 H new ATOM 0 HD12 LEU A 98 18.001 5.024 -37.936 1.00 70.40 H new ATOM 0 HD13 LEU A 98 18.310 4.090 -36.454 1.00 70.40 H new ATOM 0 HD21 LEU A 98 19.625 1.716 -37.887 1.00 42.44 H new ATOM 0 HD22 LEU A 98 18.408 1.558 -36.597 1.00 42.44 H new ATOM 0 HD23 LEU A 98 18.143 0.774 -38.172 1.00 42.44 H new ATOM 1117 N ASP A 99 15.044 2.776 -40.984 1.00 11.20 N ATOM 1118 CA ASP A 99 15.259 2.946 -42.414 1.00 45.30 C ATOM 1119 C ASP A 99 16.419 3.895 -42.676 1.00 21.31 C ATOM 1120 O ASP A 99 16.664 4.811 -41.899 1.00 11.33 O ATOM 1121 CB ASP A 99 13.987 3.425 -43.126 1.00 54.14 C ATOM 1122 CG ASP A 99 13.510 4.796 -42.681 1.00 2.23 C ATOM 1123 OD1 ASP A 99 14.008 5.811 -43.213 1.00 73.24 O ATOM 1124 OD2 ASP A 99 12.599 4.862 -41.829 1.00 74.24 O ATOM 0 H ASP A 99 14.213 3.242 -40.620 1.00 11.20 H new ATOM 0 HA ASP A 99 15.514 1.970 -42.826 1.00 45.30 H new ATOM 0 HB2 ASP A 99 14.170 3.446 -44.200 1.00 54.14 H new ATOM 0 HB3 ASP A 99 13.191 2.701 -42.953 1.00 54.14 H new ATOM 1129 N LEU A 100 17.164 3.599 -43.748 1.00 13.34 N ATOM 1130 CA LEU A 100 18.334 4.376 -44.200 1.00 2.34 C ATOM 1131 C LEU A 100 19.499 4.324 -43.202 1.00 52.42 C ATOM 1132 O LEU A 100 20.630 4.657 -43.560 1.00 20.24 O ATOM 1133 CB LEU A 100 17.957 5.836 -44.561 1.00 64.44 C ATOM 1134 CG LEU A 100 17.813 6.843 -43.407 1.00 33.31 C ATOM 1135 CD1 LEU A 100 19.146 7.504 -43.084 1.00 45.34 C ATOM 1136 CD2 LEU A 100 16.768 7.895 -43.746 1.00 11.14 C ATOM 0 H LEU A 100 16.969 2.794 -44.342 1.00 13.34 H new ATOM 0 HA LEU A 100 18.684 3.895 -45.113 1.00 2.34 H new ATOM 0 HB2 LEU A 100 18.713 6.218 -45.247 1.00 64.44 H new ATOM 0 HB3 LEU A 100 17.014 5.814 -45.107 1.00 64.44 H new ATOM 0 HG LEU A 100 17.485 6.296 -42.523 1.00 33.31 H new ATOM 0 HD11 LEU A 100 19.013 8.210 -42.265 1.00 45.34 H new ATOM 0 HD12 LEU A 100 19.869 6.742 -42.792 1.00 45.34 H new ATOM 0 HD13 LEU A 100 19.512 8.033 -43.964 1.00 45.34 H new ATOM 0 HD21 LEU A 100 16.679 8.599 -42.919 1.00 11.14 H new ATOM 0 HD22 LEU A 100 17.069 8.430 -44.647 1.00 11.14 H new ATOM 0 HD23 LEU A 100 15.806 7.411 -43.916 1.00 11.14 H new ATOM 1148 N GLY A 101 19.237 3.871 -41.975 1.00 41.41 N ATOM 1149 CA GLY A 101 20.263 3.832 -40.941 1.00 31.32 C ATOM 1150 C GLY A 101 21.445 2.947 -41.297 1.00 61.01 C ATOM 1151 O GLY A 101 22.559 3.164 -40.819 1.00 62.12 O ATOM 0 H GLY A 101 18.324 3.527 -41.677 1.00 41.41 H new ATOM 0 HA2 GLY A 101 20.620 4.845 -40.755 1.00 31.32 H new ATOM 0 HA3 GLY A 101 19.819 3.475 -40.012 1.00 31.32 H new ATOM 1155 N PHE A 102 21.205 1.956 -42.140 1.00 63.23 N ATOM 1156 CA PHE A 102 22.255 1.034 -42.559 1.00 12.34 C ATOM 1157 C PHE A 102 23.152 1.667 -43.623 1.00 51.03 C ATOM 1158 O PHE A 102 24.278 1.226 -43.846 1.00 33.11 O ATOM 1159 CB PHE A 102 21.624 -0.260 -43.094 1.00 61.01 C ATOM 1160 CG PHE A 102 22.619 -1.261 -43.613 1.00 44.12 C ATOM 1161 CD1 PHE A 102 23.443 -1.954 -42.741 1.00 33.34 C ATOM 1162 CD2 PHE A 102 22.725 -1.511 -44.973 1.00 12.54 C ATOM 1163 CE1 PHE A 102 24.354 -2.877 -43.217 1.00 33.42 C ATOM 1164 CE2 PHE A 102 23.634 -2.433 -45.454 1.00 53.41 C ATOM 1165 CZ PHE A 102 24.450 -3.118 -44.574 1.00 44.40 C ATOM 0 H PHE A 102 20.290 1.767 -42.550 1.00 63.23 H new ATOM 0 HA PHE A 102 22.876 0.802 -41.694 1.00 12.34 H new ATOM 0 HB2 PHE A 102 21.041 -0.723 -42.298 1.00 61.01 H new ATOM 0 HB3 PHE A 102 20.928 -0.008 -43.894 1.00 61.01 H new ATOM 0 HD1 PHE A 102 23.372 -1.771 -41.679 1.00 33.34 H new ATOM 0 HD2 PHE A 102 22.089 -0.978 -45.664 1.00 12.54 H new ATOM 0 HE1 PHE A 102 24.992 -3.411 -42.528 1.00 33.42 H new ATOM 0 HE2 PHE A 102 23.707 -2.618 -46.516 1.00 53.41 H new ATOM 0 HZ PHE A 102 25.161 -3.840 -44.946 1.00 44.40 H new ATOM 1175 N CYS A 103 22.663 2.718 -44.262 1.00 61.32 N ATOM 1176 CA CYS A 103 23.366 3.306 -45.394 1.00 41.34 C ATOM 1177 C CYS A 103 23.864 4.717 -45.078 1.00 40.34 C ATOM 1178 O CYS A 103 24.510 5.355 -45.910 1.00 13.32 O ATOM 1179 CB CYS A 103 22.446 3.330 -46.616 1.00 62.42 C ATOM 1180 SG CYS A 103 21.638 1.730 -46.958 1.00 3.33 S ATOM 0 H CYS A 103 21.787 3.180 -44.019 1.00 61.32 H new ATOM 0 HA CYS A 103 24.240 2.690 -45.607 1.00 41.34 H new ATOM 0 HB2 CYS A 103 21.679 4.090 -46.467 1.00 62.42 H new ATOM 0 HB3 CYS A 103 23.025 3.629 -47.490 1.00 62.42 H new ATOM 1185 N THR A 104 23.597 5.194 -43.862 1.00 30.55 N ATOM 1186 CA THR A 104 23.928 6.572 -43.490 1.00 65.41 C ATOM 1187 C THR A 104 25.439 6.778 -43.391 1.00 11.54 C ATOM 1188 O THR A 104 25.924 7.910 -43.354 1.00 1.12 O ATOM 1189 CB THR A 104 23.293 6.948 -42.142 1.00 62.41 C ATOM 1190 OG1 THR A 104 22.118 6.159 -41.923 1.00 33.23 O ATOM 1191 CG2 THR A 104 22.920 8.423 -42.114 1.00 0.44 C ATOM 0 H THR A 104 23.155 4.651 -43.120 1.00 30.55 H new ATOM 0 HA THR A 104 23.529 7.213 -44.276 1.00 65.41 H new ATOM 0 HB THR A 104 24.021 6.754 -41.354 1.00 62.41 H new ATOM 0 HG1 THR A 104 21.751 5.872 -42.785 1.00 33.23 H new ATOM 0 HG21 THR A 104 22.472 8.667 -41.151 1.00 0.44 H new ATOM 0 HG22 THR A 104 23.815 9.027 -42.262 1.00 0.44 H new ATOM 0 HG23 THR A 104 22.205 8.633 -42.910 1.00 0.44 H new ATOM 1199 N LEU A 105 26.176 5.679 -43.353 1.00 12.45 N ATOM 1200 CA LEU A 105 27.627 5.734 -43.231 1.00 62.50 C ATOM 1201 C LEU A 105 28.279 5.951 -44.593 1.00 22.12 C ATOM 1202 O LEU A 105 29.485 6.179 -44.688 1.00 41.21 O ATOM 1203 CB LEU A 105 28.207 4.476 -42.536 1.00 12.14 C ATOM 1204 CG LEU A 105 27.499 3.118 -42.759 1.00 23.01 C ATOM 1205 CD1 LEU A 105 26.254 2.994 -41.885 1.00 50.32 C ATOM 1206 CD2 LEU A 105 27.155 2.886 -44.227 1.00 51.20 C ATOM 0 H LEU A 105 25.793 4.735 -43.405 1.00 12.45 H new ATOM 0 HA LEU A 105 27.861 6.587 -42.594 1.00 62.50 H new ATOM 0 HB2 LEU A 105 29.243 4.367 -42.858 1.00 12.14 H new ATOM 0 HB3 LEU A 105 28.225 4.668 -41.463 1.00 12.14 H new ATOM 0 HG LEU A 105 28.203 2.341 -42.463 1.00 23.01 H new ATOM 0 HD11 LEU A 105 25.778 2.030 -42.064 1.00 50.32 H new ATOM 0 HD12 LEU A 105 26.537 3.070 -40.835 1.00 50.32 H new ATOM 0 HD13 LEU A 105 25.556 3.794 -42.131 1.00 50.32 H new ATOM 0 HD21 LEU A 105 26.660 1.921 -44.337 1.00 51.20 H new ATOM 0 HD22 LEU A 105 26.490 3.677 -44.574 1.00 51.20 H new ATOM 0 HD23 LEU A 105 28.069 2.894 -44.821 1.00 51.20 H new ATOM 1218 N ALA A 106 27.469 5.895 -45.641 1.00 42.34 N ATOM 1219 CA ALA A 106 27.955 6.093 -46.996 1.00 10.22 C ATOM 1220 C ALA A 106 27.622 7.497 -47.482 1.00 65.21 C ATOM 1221 O ALA A 106 27.007 8.281 -46.755 1.00 11.43 O ATOM 1222 CB ALA A 106 27.356 5.050 -47.927 1.00 62.33 C ATOM 0 H ALA A 106 26.467 5.713 -45.576 1.00 42.34 H new ATOM 0 HA ALA A 106 29.039 5.978 -46.997 1.00 10.22 H new ATOM 0 HB1 ALA A 106 27.728 5.209 -48.939 1.00 62.33 H new ATOM 0 HB2 ALA A 106 27.641 4.054 -47.588 1.00 62.33 H new ATOM 0 HB3 ALA A 106 26.270 5.139 -47.922 1.00 62.33 H new ATOM 1228 N GLY A 107 28.023 7.814 -48.704 1.00 73.22 N ATOM 1229 CA GLY A 107 27.758 9.127 -49.249 1.00 35.43 C ATOM 1230 C GLY A 107 26.652 9.118 -50.281 1.00 15.44 C ATOM 1231 O GLY A 107 25.470 9.120 -49.940 1.00 5.34 O ATOM 0 H GLY A 107 28.528 7.184 -49.328 1.00 73.22 H new ATOM 0 HA2 GLY A 107 27.488 9.804 -48.439 1.00 35.43 H new ATOM 0 HA3 GLY A 107 28.669 9.519 -49.702 1.00 35.43 H new ATOM 1235 N ILE A 108 27.032 9.085 -51.548 1.00 44.32 N ATOM 1236 CA ILE A 108 26.068 9.142 -52.639 1.00 70.24 C ATOM 1237 C ILE A 108 25.395 7.786 -52.842 1.00 54.51 C ATOM 1238 O ILE A 108 24.232 7.711 -53.243 1.00 62.44 O ATOM 1239 CB ILE A 108 26.735 9.613 -53.958 1.00 22.13 C ATOM 1240 CG1 ILE A 108 25.701 9.682 -55.090 1.00 72.22 C ATOM 1241 CG2 ILE A 108 27.894 8.697 -54.341 1.00 54.13 C ATOM 1242 CD1 ILE A 108 26.266 10.171 -56.407 1.00 54.33 C ATOM 0 H ILE A 108 28.004 9.019 -51.849 1.00 44.32 H new ATOM 0 HA ILE A 108 25.306 9.872 -52.365 1.00 70.24 H new ATOM 0 HB ILE A 108 27.136 10.614 -53.797 1.00 22.13 H new ATOM 0 HG12 ILE A 108 25.270 8.692 -55.236 1.00 72.22 H new ATOM 0 HG13 ILE A 108 24.888 10.342 -54.787 1.00 72.22 H new ATOM 0 HG21 ILE A 108 28.345 9.049 -55.269 1.00 54.13 H new ATOM 0 HG22 ILE A 108 28.642 8.706 -53.548 1.00 54.13 H new ATOM 0 HG23 ILE A 108 27.524 7.681 -54.480 1.00 54.13 H new ATOM 0 HD11 ILE A 108 25.475 10.192 -57.157 1.00 54.33 H new ATOM 0 HD12 ILE A 108 26.671 11.175 -56.279 1.00 54.33 H new ATOM 0 HD13 ILE A 108 27.059 9.499 -56.735 1.00 54.33 H new ATOM 1254 N ARG A 109 26.114 6.712 -52.524 1.00 40.52 N ATOM 1255 CA ARG A 109 25.606 5.364 -52.754 1.00 24.00 C ATOM 1256 C ARG A 109 24.518 5.004 -51.740 1.00 50.50 C ATOM 1257 O ARG A 109 23.927 3.931 -51.811 1.00 3.54 O ATOM 1258 CB ARG A 109 26.753 4.344 -52.711 1.00 64.44 C ATOM 1259 CG ARG A 109 27.161 3.907 -51.310 1.00 13.23 C ATOM 1260 CD ARG A 109 28.581 3.356 -51.280 1.00 51.33 C ATOM 1261 NE ARG A 109 28.921 2.603 -52.488 1.00 12.20 N ATOM 1262 CZ ARG A 109 30.108 2.028 -52.697 1.00 30.44 C ATOM 1263 NH1 ARG A 109 31.022 1.996 -51.734 1.00 63.13 N ATOM 1264 NH2 ARG A 109 30.376 1.473 -53.869 1.00 32.43 N ATOM 0 H ARG A 109 27.045 6.749 -52.109 1.00 40.52 H new ATOM 0 HA ARG A 109 25.156 5.335 -53.747 1.00 24.00 H new ATOM 0 HB2 ARG A 109 26.459 3.463 -53.281 1.00 64.44 H new ATOM 0 HB3 ARG A 109 27.622 4.772 -53.211 1.00 64.44 H new ATOM 0 HG2 ARG A 109 27.086 4.754 -50.629 1.00 13.23 H new ATOM 0 HG3 ARG A 109 26.468 3.146 -50.950 1.00 13.23 H new ATOM 0 HD2 ARG A 109 29.284 4.181 -51.161 1.00 51.33 H new ATOM 0 HD3 ARG A 109 28.697 2.710 -50.410 1.00 51.33 H new ATOM 0 HE ARG A 109 28.209 2.512 -53.213 1.00 12.20 H new ATOM 0 HH11 ARG A 109 30.820 2.413 -50.825 1.00 63.13 H new ATOM 0 HH12 ARG A 109 31.926 1.554 -51.903 1.00 63.13 H new ATOM 0 HH21 ARG A 109 29.676 1.485 -54.611 1.00 32.43 H new ATOM 0 HH22 ARG A 109 31.282 1.034 -54.030 1.00 32.43 H new ATOM 1278 N GLU A 110 24.254 5.921 -50.808 1.00 15.04 N ATOM 1279 CA GLU A 110 23.214 5.740 -49.795 1.00 73.31 C ATOM 1280 C GLU A 110 21.835 5.619 -50.450 1.00 51.00 C ATOM 1281 O GLU A 110 21.009 4.800 -50.042 1.00 21.24 O ATOM 1282 CB GLU A 110 23.261 6.916 -48.803 1.00 23.55 C ATOM 1283 CG GLU A 110 22.158 6.920 -47.752 1.00 52.14 C ATOM 1284 CD GLU A 110 20.950 7.737 -48.165 1.00 30.23 C ATOM 1285 OE1 GLU A 110 21.066 8.981 -48.235 1.00 31.33 O ATOM 1286 OE2 GLU A 110 19.880 7.148 -48.409 1.00 41.34 O ATOM 0 H GLU A 110 24.754 6.807 -50.734 1.00 15.04 H new ATOM 0 HA GLU A 110 23.396 4.814 -49.250 1.00 73.31 H new ATOM 0 HB2 GLU A 110 24.225 6.904 -48.295 1.00 23.55 H new ATOM 0 HB3 GLU A 110 23.209 7.848 -49.366 1.00 23.55 H new ATOM 0 HG2 GLU A 110 21.846 5.894 -47.556 1.00 52.14 H new ATOM 0 HG3 GLU A 110 22.555 7.316 -46.818 1.00 52.14 H new ATOM 1293 N VAL A 111 21.623 6.402 -51.500 1.00 14.20 N ATOM 1294 CA VAL A 111 20.341 6.432 -52.198 1.00 50.10 C ATOM 1295 C VAL A 111 20.078 5.089 -52.885 1.00 1.10 C ATOM 1296 O VAL A 111 18.963 4.564 -52.865 1.00 44.44 O ATOM 1297 CB VAL A 111 20.307 7.565 -53.249 1.00 11.31 C ATOM 1298 CG1 VAL A 111 18.927 7.683 -53.876 1.00 1.23 C ATOM 1299 CG2 VAL A 111 20.726 8.887 -52.624 1.00 62.34 C ATOM 0 H VAL A 111 22.326 7.029 -51.890 1.00 14.20 H new ATOM 0 HA VAL A 111 19.563 6.619 -51.458 1.00 50.10 H new ATOM 0 HB VAL A 111 21.017 7.316 -54.038 1.00 11.31 H new ATOM 0 HG11 VAL A 111 18.929 8.487 -54.612 1.00 1.23 H new ATOM 0 HG12 VAL A 111 18.668 6.744 -54.365 1.00 1.23 H new ATOM 0 HG13 VAL A 111 18.193 7.903 -53.101 1.00 1.23 H new ATOM 0 HG21 VAL A 111 20.696 9.672 -53.379 1.00 62.34 H new ATOM 0 HG22 VAL A 111 20.044 9.138 -51.812 1.00 62.34 H new ATOM 0 HG23 VAL A 111 21.739 8.799 -52.232 1.00 62.34 H new ATOM 1309 N ASP A 112 21.135 4.538 -53.464 1.00 61.30 N ATOM 1310 CA ASP A 112 21.089 3.250 -54.153 1.00 32.13 C ATOM 1311 C ASP A 112 21.003 2.110 -53.133 1.00 11.35 C ATOM 1312 O ASP A 112 20.479 1.032 -53.407 1.00 23.12 O ATOM 1313 CB ASP A 112 22.330 3.102 -55.037 1.00 11.52 C ATOM 1314 CG ASP A 112 22.221 1.948 -56.004 1.00 12.32 C ATOM 1315 OD1 ASP A 112 21.194 1.855 -56.712 1.00 71.34 O ATOM 1316 OD2 ASP A 112 23.165 1.143 -56.089 1.00 22.43 O ATOM 0 H ASP A 112 22.057 4.973 -53.471 1.00 61.30 H new ATOM 0 HA ASP A 112 20.202 3.204 -54.785 1.00 32.13 H new ATOM 0 HB2 ASP A 112 22.486 4.025 -55.595 1.00 11.52 H new ATOM 0 HB3 ASP A 112 23.207 2.960 -54.405 1.00 11.52 H new ATOM 1321 N CYS A 113 21.500 2.408 -51.944 1.00 52.11 N ATOM 1322 CA CYS A 113 21.651 1.420 -50.876 1.00 40.03 C ATOM 1323 C CYS A 113 20.298 1.111 -50.237 1.00 14.52 C ATOM 1324 O CYS A 113 20.015 -0.025 -49.855 1.00 44.32 O ATOM 1325 CB CYS A 113 22.631 1.942 -49.817 1.00 2.11 C ATOM 1326 SG CYS A 113 22.829 0.866 -48.358 1.00 2.13 S ATOM 0 H CYS A 113 21.813 3.344 -51.686 1.00 52.11 H new ATOM 0 HA CYS A 113 22.047 0.499 -51.304 1.00 40.03 H new ATOM 0 HB2 CYS A 113 23.607 2.081 -50.283 1.00 2.11 H new ATOM 0 HB3 CYS A 113 22.294 2.924 -49.484 1.00 2.11 H new ATOM 1331 N ARG A 114 19.453 2.130 -50.159 1.00 62.15 N ATOM 1332 CA ARG A 114 18.177 2.026 -49.464 1.00 2.31 C ATOM 1333 C ARG A 114 17.162 1.188 -50.248 1.00 53.53 C ATOM 1334 O ARG A 114 16.333 0.493 -49.658 1.00 43.52 O ATOM 1335 CB ARG A 114 17.612 3.427 -49.198 1.00 63.21 C ATOM 1336 CG ARG A 114 16.234 3.421 -48.553 1.00 20.21 C ATOM 1337 CD ARG A 114 15.740 4.828 -48.252 1.00 13.12 C ATOM 1338 NE ARG A 114 14.360 4.816 -47.768 1.00 43.51 N ATOM 1339 CZ ARG A 114 13.978 5.255 -46.572 1.00 23.34 C ATOM 1340 NH1 ARG A 114 14.855 5.819 -45.751 1.00 70.03 N ATOM 1341 NH2 ARG A 114 12.709 5.150 -46.206 1.00 11.33 N ATOM 0 H ARG A 114 19.630 3.045 -50.572 1.00 62.15 H new ATOM 0 HA ARG A 114 18.357 1.517 -48.517 1.00 2.31 H new ATOM 0 HB2 ARG A 114 18.302 3.971 -48.553 1.00 63.21 H new ATOM 0 HB3 ARG A 114 17.560 3.972 -50.140 1.00 63.21 H new ATOM 0 HG2 ARG A 114 15.526 2.922 -49.215 1.00 20.21 H new ATOM 0 HG3 ARG A 114 16.268 2.843 -47.629 1.00 20.21 H new ATOM 0 HD2 ARG A 114 16.385 5.290 -47.505 1.00 13.12 H new ATOM 0 HD3 ARG A 114 15.806 5.439 -49.152 1.00 13.12 H new ATOM 0 HE ARG A 114 13.641 4.446 -48.390 1.00 43.51 H new ATOM 0 HH11 ARG A 114 15.829 5.918 -46.036 1.00 70.03 H new ATOM 0 HH12 ARG A 114 14.555 6.153 -44.835 1.00 70.03 H new ATOM 0 HH21 ARG A 114 12.028 4.733 -46.841 1.00 11.33 H new ATOM 0 HH22 ARG A 114 12.413 5.486 -45.289 1.00 11.33 H new ATOM 1355 N LYS A 115 17.244 1.240 -51.574 1.00 62.02 N ATOM 1356 CA LYS A 115 16.201 0.676 -52.431 1.00 51.54 C ATOM 1357 C LYS A 115 16.124 -0.849 -52.344 1.00 2.01 C ATOM 1358 O LYS A 115 15.062 -1.410 -52.070 1.00 23.34 O ATOM 1359 CB LYS A 115 16.452 1.083 -53.886 1.00 2.34 C ATOM 1360 CG LYS A 115 16.398 2.583 -54.122 1.00 13.14 C ATOM 1361 CD LYS A 115 16.771 2.933 -55.553 1.00 53.24 C ATOM 1362 CE LYS A 115 16.554 4.410 -55.844 1.00 75.20 C ATOM 1363 NZ LYS A 115 15.114 4.785 -55.783 1.00 55.43 N ATOM 0 H LYS A 115 18.020 1.666 -52.080 1.00 62.02 H new ATOM 0 HA LYS A 115 15.250 1.074 -52.077 1.00 51.54 H new ATOM 0 HB2 LYS A 115 17.429 0.711 -54.194 1.00 2.34 H new ATOM 0 HB3 LYS A 115 15.712 0.598 -54.522 1.00 2.34 H new ATOM 0 HG2 LYS A 115 15.395 2.951 -53.905 1.00 13.14 H new ATOM 0 HG3 LYS A 115 17.078 3.086 -53.434 1.00 13.14 H new ATOM 0 HD2 LYS A 115 17.815 2.676 -55.730 1.00 53.24 H new ATOM 0 HD3 LYS A 115 16.174 2.335 -56.242 1.00 53.24 H new ATOM 0 HE2 LYS A 115 17.115 5.007 -55.125 1.00 75.20 H new ATOM 0 HE3 LYS A 115 16.949 4.647 -56.832 1.00 75.20 H new ATOM 0 HZ1 LYS A 115 14.976 5.708 -56.242 1.00 55.43 H new ATOM 0 HZ2 LYS A 115 14.547 4.065 -56.275 1.00 55.43 H new ATOM 0 HZ3 LYS A 115 14.812 4.844 -54.789 1.00 55.43 H new ATOM 1377 N ASP A 116 17.246 -1.508 -52.576 1.00 1.23 N ATOM 1378 CA ASP A 116 17.271 -2.967 -52.688 1.00 21.54 C ATOM 1379 C ASP A 116 17.285 -3.651 -51.332 1.00 11.14 C ATOM 1380 O ASP A 116 16.846 -4.792 -51.207 1.00 4.15 O ATOM 1381 CB ASP A 116 18.469 -3.419 -53.516 1.00 1.44 C ATOM 1382 CG ASP A 116 18.368 -2.955 -54.949 1.00 70.32 C ATOM 1383 OD1 ASP A 116 18.660 -1.768 -55.215 1.00 24.25 O ATOM 1384 OD2 ASP A 116 17.985 -3.762 -55.818 1.00 70.25 O ATOM 0 H ASP A 116 18.155 -1.061 -52.691 1.00 1.23 H new ATOM 0 HA ASP A 116 16.351 -3.263 -53.192 1.00 21.54 H new ATOM 0 HB2 ASP A 116 19.385 -3.030 -53.072 1.00 1.44 H new ATOM 0 HB3 ASP A 116 18.539 -4.506 -53.490 1.00 1.44 H new ATOM 1389 N ALA A 117 17.772 -2.941 -50.322 1.00 42.33 N ATOM 1390 CA ALA A 117 17.995 -3.517 -48.997 1.00 54.21 C ATOM 1391 C ALA A 117 16.753 -4.217 -48.441 1.00 21.23 C ATOM 1392 O ALA A 117 16.848 -5.313 -47.886 1.00 12.40 O ATOM 1393 CB ALA A 117 18.468 -2.440 -48.036 1.00 70.44 C ATOM 0 H ALA A 117 18.023 -1.955 -50.395 1.00 42.33 H new ATOM 0 HA ALA A 117 18.766 -4.280 -49.103 1.00 54.21 H new ATOM 0 HB1 ALA A 117 18.632 -2.878 -47.051 1.00 70.44 H new ATOM 0 HB2 ALA A 117 19.400 -2.010 -48.402 1.00 70.44 H new ATOM 0 HB3 ALA A 117 17.712 -1.658 -47.965 1.00 70.44 H new ATOM 1399 N GLN A 118 15.590 -3.590 -48.588 1.00 75.31 N ATOM 1400 CA GLN A 118 14.341 -4.149 -48.064 1.00 33.53 C ATOM 1401 C GLN A 118 13.911 -5.424 -48.804 1.00 15.41 C ATOM 1402 O GLN A 118 12.999 -6.120 -48.362 1.00 21.20 O ATOM 1403 CB GLN A 118 13.225 -3.089 -48.087 1.00 41.23 C ATOM 1404 CG GLN A 118 12.956 -2.459 -49.454 1.00 22.11 C ATOM 1405 CD GLN A 118 12.115 -3.323 -50.385 1.00 63.15 C ATOM 1406 OE1 GLN A 118 11.219 -4.122 -49.822 1.00 22.22 O flip ATOM 1407 NE2 GLN A 118 12.262 -3.264 -51.604 1.00 23.10 N flip ATOM 0 H GLN A 118 15.483 -2.695 -49.065 1.00 75.31 H new ATOM 0 HA GLN A 118 14.526 -4.439 -47.030 1.00 33.53 H new ATOM 0 HB2 GLN A 118 12.303 -3.547 -47.728 1.00 41.23 H new ATOM 0 HB3 GLN A 118 13.483 -2.297 -47.384 1.00 41.23 H new ATOM 0 HG2 GLN A 118 12.451 -1.504 -49.308 1.00 22.11 H new ATOM 0 HG3 GLN A 118 13.909 -2.245 -49.937 1.00 22.11 H new ATOM 0 HE21 GLN A 118 12.961 -2.638 -52.004 1.00 23.10 H new ATOM 0 HE22 GLN A 118 11.685 -3.841 -52.216 1.00 23.10 H new ATOM 1416 N THR A 119 14.561 -5.719 -49.924 1.00 74.21 N ATOM 1417 CA THR A 119 14.240 -6.907 -50.711 1.00 63.40 C ATOM 1418 C THR A 119 14.982 -8.137 -50.158 1.00 44.23 C ATOM 1419 O THR A 119 14.662 -9.283 -50.477 1.00 62.34 O ATOM 1420 CB THR A 119 14.613 -6.686 -52.199 1.00 14.34 C ATOM 1421 OG1 THR A 119 14.031 -5.464 -52.674 1.00 43.20 O ATOM 1422 CG2 THR A 119 14.131 -7.830 -53.074 1.00 11.12 C ATOM 0 H THR A 119 15.316 -5.151 -50.309 1.00 74.21 H new ATOM 0 HA THR A 119 13.167 -7.085 -50.640 1.00 63.40 H new ATOM 0 HB THR A 119 15.700 -6.636 -52.259 1.00 14.34 H new ATOM 0 HG1 THR A 119 14.272 -5.331 -53.614 1.00 43.20 H new ATOM 0 HG21 THR A 119 14.411 -7.639 -54.110 1.00 11.12 H new ATOM 0 HG22 THR A 119 14.589 -8.761 -52.740 1.00 11.12 H new ATOM 0 HG23 THR A 119 13.047 -7.912 -53.001 1.00 11.12 H new ATOM 1430 N CYS A 120 15.967 -7.884 -49.311 1.00 1.41 N ATOM 1431 CA CYS A 120 16.806 -8.942 -48.751 1.00 20.34 C ATOM 1432 C CYS A 120 16.288 -9.375 -47.374 1.00 63.52 C ATOM 1433 O CYS A 120 17.077 -9.591 -46.452 1.00 74.40 O ATOM 1434 CB CYS A 120 18.248 -8.432 -48.635 1.00 61.11 C ATOM 1435 SG CYS A 120 18.655 -7.093 -49.809 1.00 21.43 S ATOM 0 H CYS A 120 16.210 -6.946 -48.991 1.00 1.41 H new ATOM 0 HA CYS A 120 16.774 -9.808 -49.412 1.00 20.34 H new ATOM 0 HB2 CYS A 120 18.416 -8.075 -47.619 1.00 61.11 H new ATOM 0 HB3 CYS A 120 18.932 -9.265 -48.797 1.00 61.11 H new ATOM 1440 N ASP A 121 14.967 -9.518 -47.240 1.00 20.33 N ATOM 1441 CA ASP A 121 14.350 -9.685 -45.922 1.00 62.35 C ATOM 1442 C ASP A 121 14.658 -11.051 -45.281 1.00 33.14 C ATOM 1443 O ASP A 121 15.258 -11.099 -44.206 1.00 75.45 O ATOM 1444 CB ASP A 121 12.827 -9.482 -46.020 1.00 43.10 C ATOM 1445 CG ASP A 121 12.129 -10.587 -46.796 1.00 14.41 C ATOM 1446 OD1 ASP A 121 12.556 -10.882 -47.933 1.00 54.32 O ATOM 1447 OD2 ASP A 121 11.184 -11.203 -46.252 1.00 21.11 O ATOM 0 H ASP A 121 14.310 -9.522 -48.020 1.00 20.33 H new ATOM 0 HA ASP A 121 14.786 -8.925 -45.274 1.00 62.35 H new ATOM 0 HB2 ASP A 121 12.408 -9.430 -45.015 1.00 43.10 H new ATOM 0 HB3 ASP A 121 12.624 -8.525 -46.500 1.00 43.10 H new ATOM 1452 N LYS A 122 14.259 -12.159 -45.913 1.00 42.11 N ATOM 1453 CA LYS A 122 14.549 -13.475 -45.350 1.00 34.24 C ATOM 1454 C LYS A 122 15.195 -14.416 -46.358 1.00 33.52 C ATOM 1455 O LYS A 122 16.392 -14.709 -46.283 1.00 60.12 O ATOM 1456 CB LYS A 122 13.256 -14.114 -44.840 1.00 45.24 C ATOM 1457 CG LYS A 122 12.607 -13.367 -43.692 1.00 63.51 C ATOM 1458 CD LYS A 122 11.133 -13.704 -43.583 1.00 62.12 C ATOM 1459 CE LYS A 122 10.493 -13.004 -42.401 1.00 63.25 C ATOM 1460 NZ LYS A 122 9.011 -12.979 -42.501 1.00 14.03 N ATOM 0 H LYS A 122 13.746 -12.170 -46.795 1.00 42.11 H new ATOM 0 HA LYS A 122 15.256 -13.321 -44.535 1.00 34.24 H new ATOM 0 HB2 LYS A 122 12.546 -14.179 -45.664 1.00 45.24 H new ATOM 0 HB3 LYS A 122 13.469 -15.134 -44.521 1.00 45.24 H new ATOM 0 HG2 LYS A 122 13.111 -13.620 -42.759 1.00 63.51 H new ATOM 0 HG3 LYS A 122 12.728 -12.294 -43.839 1.00 63.51 H new ATOM 0 HD2 LYS A 122 10.622 -13.412 -44.501 1.00 62.12 H new ATOM 0 HD3 LYS A 122 11.011 -14.782 -43.479 1.00 62.12 H new ATOM 0 HE2 LYS A 122 10.785 -13.508 -41.480 1.00 63.25 H new ATOM 0 HE3 LYS A 122 10.869 -11.983 -42.338 1.00 63.25 H new ATOM 0 HZ1 LYS A 122 8.615 -12.491 -41.672 1.00 14.03 H new ATOM 0 HZ2 LYS A 122 8.730 -12.475 -43.366 1.00 14.03 H new ATOM 0 HZ3 LYS A 122 8.649 -13.953 -42.535 1.00 14.03 H new ATOM 1474 N LYS A 123 14.383 -14.904 -47.295 1.00 1.11 N ATOM 1475 CA LYS A 123 14.864 -15.844 -48.299 1.00 70.10 C ATOM 1476 C LYS A 123 14.340 -15.534 -49.704 1.00 4.43 C ATOM 1477 O LYS A 123 15.105 -15.516 -50.666 1.00 12.33 O ATOM 1478 CB LYS A 123 14.561 -17.303 -47.895 1.00 72.23 C ATOM 1479 CG LYS A 123 13.100 -17.747 -47.999 1.00 53.10 C ATOM 1480 CD LYS A 123 12.207 -17.111 -46.946 1.00 54.02 C ATOM 1481 CE LYS A 123 10.808 -17.713 -46.976 1.00 21.44 C ATOM 1482 NZ LYS A 123 10.135 -17.512 -48.288 1.00 20.12 N ATOM 0 H LYS A 123 13.395 -14.664 -47.377 1.00 1.11 H new ATOM 0 HA LYS A 123 15.946 -15.723 -48.340 1.00 70.10 H new ATOM 0 HB2 LYS A 123 15.164 -17.963 -48.519 1.00 72.23 H new ATOM 0 HB3 LYS A 123 14.890 -17.448 -46.866 1.00 72.23 H new ATOM 0 HG2 LYS A 123 12.720 -17.496 -48.989 1.00 53.10 H new ATOM 0 HG3 LYS A 123 13.048 -18.832 -47.904 1.00 53.10 H new ATOM 0 HD2 LYS A 123 12.646 -17.253 -45.959 1.00 54.02 H new ATOM 0 HD3 LYS A 123 12.147 -16.036 -47.117 1.00 54.02 H new ATOM 0 HE2 LYS A 123 10.869 -18.780 -46.761 1.00 21.44 H new ATOM 0 HE3 LYS A 123 10.204 -17.263 -46.188 1.00 21.44 H new ATOM 0 HZ1 LYS A 123 9.263 -18.078 -48.321 1.00 20.12 H new ATOM 0 HZ2 LYS A 123 9.899 -16.506 -48.407 1.00 20.12 H new ATOM 0 HZ3 LYS A 123 10.772 -17.811 -49.054 1.00 20.12 H new ATOM 1496 N TYR A 124 13.037 -15.265 -49.803 1.00 42.32 N ATOM 1497 CA TYR A 124 12.323 -15.323 -51.079 1.00 41.53 C ATOM 1498 C TYR A 124 12.865 -14.313 -52.085 1.00 41.25 C ATOM 1499 O TYR A 124 13.496 -14.689 -53.073 1.00 74.12 O ATOM 1500 CB TYR A 124 10.827 -15.099 -50.851 1.00 12.40 C ATOM 1501 CG TYR A 124 9.963 -15.419 -52.048 1.00 63.33 C ATOM 1502 CD1 TYR A 124 9.492 -16.706 -52.255 1.00 71.54 C ATOM 1503 CD2 TYR A 124 9.618 -14.437 -52.968 1.00 23.23 C ATOM 1504 CE1 TYR A 124 8.704 -17.011 -53.343 1.00 30.12 C ATOM 1505 CE2 TYR A 124 8.829 -14.734 -54.061 1.00 1.43 C ATOM 1506 CZ TYR A 124 8.376 -16.024 -54.243 1.00 51.43 C ATOM 1507 OH TYR A 124 7.590 -16.328 -55.329 1.00 15.02 O ATOM 0 H TYR A 124 12.452 -15.003 -49.009 1.00 42.32 H new ATOM 0 HA TYR A 124 12.480 -16.315 -51.502 1.00 41.53 H new ATOM 0 HB2 TYR A 124 10.504 -15.712 -50.009 1.00 12.40 H new ATOM 0 HB3 TYR A 124 10.666 -14.059 -50.568 1.00 12.40 H new ATOM 0 HD1 TYR A 124 9.747 -17.484 -51.551 1.00 71.54 H new ATOM 0 HD2 TYR A 124 9.972 -13.427 -52.826 1.00 23.23 H new ATOM 0 HE1 TYR A 124 8.346 -18.019 -53.488 1.00 30.12 H new ATOM 0 HE2 TYR A 124 8.568 -13.961 -54.769 1.00 1.43 H new ATOM 0 HH TYR A 124 7.449 -15.521 -55.867 1.00 15.02 H new ATOM 1517 N GLU A 125 12.622 -13.038 -51.841 1.00 30.03 N ATOM 1518 CA GLU A 125 13.107 -11.996 -52.732 1.00 3.23 C ATOM 1519 C GLU A 125 14.566 -11.662 -52.441 1.00 3.02 C ATOM 1520 O GLU A 125 15.167 -10.822 -53.109 1.00 3.40 O ATOM 1521 CB GLU A 125 12.240 -10.734 -52.650 1.00 61.14 C ATOM 1522 CG GLU A 125 11.675 -10.435 -51.269 1.00 65.32 C ATOM 1523 CD GLU A 125 10.373 -11.161 -51.011 1.00 22.51 C ATOM 1524 OE1 GLU A 125 9.329 -10.712 -51.529 1.00 52.12 O ATOM 1525 OE2 GLU A 125 10.389 -12.195 -50.307 1.00 12.42 O ATOM 0 H GLU A 125 12.094 -12.699 -51.037 1.00 30.03 H new ATOM 0 HA GLU A 125 13.038 -12.382 -53.749 1.00 3.23 H new ATOM 0 HB2 GLU A 125 12.834 -9.880 -52.976 1.00 61.14 H new ATOM 0 HB3 GLU A 125 11.412 -10.833 -53.352 1.00 61.14 H new ATOM 0 HG2 GLU A 125 12.404 -10.721 -50.511 1.00 65.32 H new ATOM 0 HG3 GLU A 125 11.516 -9.361 -51.169 1.00 65.32 H new ATOM 1532 N SER A 126 15.145 -12.351 -51.469 1.00 12.11 N ATOM 1533 CA SER A 126 16.534 -12.137 -51.108 1.00 71.12 C ATOM 1534 C SER A 126 17.456 -12.571 -52.246 1.00 14.12 C ATOM 1535 O SER A 126 18.502 -11.963 -52.472 1.00 22.41 O ATOM 1536 CB SER A 126 16.859 -12.889 -49.822 1.00 41.53 C ATOM 1537 OG SER A 126 15.922 -12.562 -48.811 1.00 23.32 O ATOM 0 H SER A 126 14.671 -13.065 -50.916 1.00 12.11 H new ATOM 0 HA SER A 126 16.696 -11.073 -50.935 1.00 71.12 H new ATOM 0 HB2 SER A 126 16.844 -13.963 -50.007 1.00 41.53 H new ATOM 0 HB3 SER A 126 17.866 -12.636 -49.490 1.00 41.53 H new ATOM 0 HG SER A 126 16.386 -12.471 -47.952 1.00 23.32 H new ATOM 1543 N ASP A 127 17.056 -13.619 -52.965 1.00 25.41 N ATOM 1544 CA ASP A 127 17.759 -14.032 -54.180 1.00 33.01 C ATOM 1545 C ASP A 127 17.797 -12.891 -55.185 1.00 20.52 C ATOM 1546 O ASP A 127 18.821 -12.636 -55.824 1.00 21.11 O ATOM 1547 CB ASP A 127 17.081 -15.244 -54.820 1.00 25.13 C ATOM 1548 CG ASP A 127 17.377 -16.540 -54.102 1.00 31.22 C ATOM 1549 OD1 ASP A 127 16.706 -16.831 -53.096 1.00 51.51 O ATOM 1550 OD2 ASP A 127 18.280 -17.282 -54.548 1.00 50.23 O ATOM 0 H ASP A 127 16.250 -14.197 -52.728 1.00 25.41 H new ATOM 0 HA ASP A 127 18.776 -14.303 -53.898 1.00 33.01 H new ATOM 0 HB2 ASP A 127 16.003 -15.083 -54.836 1.00 25.13 H new ATOM 0 HB3 ASP A 127 17.406 -15.328 -55.857 1.00 25.13 H new ATOM 1555 N LYS A 128 16.672 -12.197 -55.313 1.00 30.23 N ATOM 1556 CA LYS A 128 16.566 -11.079 -56.236 1.00 51.01 C ATOM 1557 C LYS A 128 17.406 -9.909 -55.748 1.00 2.44 C ATOM 1558 O LYS A 128 17.947 -9.149 -56.546 1.00 71.04 O ATOM 1559 CB LYS A 128 15.104 -10.657 -56.415 1.00 63.51 C ATOM 1560 CG LYS A 128 14.187 -11.810 -56.793 1.00 21.15 C ATOM 1561 CD LYS A 128 14.751 -12.618 -57.952 1.00 73.00 C ATOM 1562 CE LYS A 128 13.899 -13.840 -58.243 1.00 51.43 C ATOM 1563 NZ LYS A 128 14.538 -14.739 -59.236 1.00 41.10 N ATOM 0 H LYS A 128 15.820 -12.391 -54.787 1.00 30.23 H new ATOM 0 HA LYS A 128 16.946 -11.398 -57.206 1.00 51.01 H new ATOM 0 HB2 LYS A 128 14.747 -10.207 -55.489 1.00 63.51 H new ATOM 0 HB3 LYS A 128 15.047 -9.889 -57.186 1.00 63.51 H new ATOM 0 HG2 LYS A 128 14.045 -12.461 -55.930 1.00 21.15 H new ATOM 0 HG3 LYS A 128 13.205 -11.421 -57.064 1.00 21.15 H new ATOM 0 HD2 LYS A 128 14.806 -11.991 -58.842 1.00 73.00 H new ATOM 0 HD3 LYS A 128 15.769 -12.930 -57.719 1.00 73.00 H new ATOM 0 HE2 LYS A 128 13.723 -14.388 -57.318 1.00 51.43 H new ATOM 0 HE3 LYS A 128 12.925 -13.523 -58.615 1.00 51.43 H new ATOM 0 HZ1 LYS A 128 13.924 -15.561 -59.406 1.00 41.10 H new ATOM 0 HZ2 LYS A 128 14.683 -14.224 -60.128 1.00 41.10 H new ATOM 0 HZ3 LYS A 128 15.456 -15.063 -58.871 1.00 41.10 H new ATOM 1577 N CYS A 129 17.531 -9.782 -54.436 1.00 4.13 N ATOM 1578 CA CYS A 129 18.386 -8.766 -53.839 1.00 62.03 C ATOM 1579 C CYS A 129 19.850 -9.051 -54.156 1.00 4.51 C ATOM 1580 O CYS A 129 20.583 -8.169 -54.595 1.00 71.43 O ATOM 1581 CB CYS A 129 18.163 -8.736 -52.321 1.00 73.15 C ATOM 1582 SG CYS A 129 19.552 -8.039 -51.365 1.00 53.23 S ATOM 0 H CYS A 129 17.048 -10.374 -53.760 1.00 4.13 H new ATOM 0 HA CYS A 129 18.130 -7.792 -54.257 1.00 62.03 H new ATOM 0 HB2 CYS A 129 17.265 -8.155 -52.110 1.00 73.15 H new ATOM 0 HB3 CYS A 129 17.974 -9.752 -51.974 1.00 73.15 H new ATOM 1587 N LEU A 130 20.254 -10.306 -53.970 1.00 71.22 N ATOM 1588 CA LEU A 130 21.643 -10.707 -54.144 1.00 11.11 C ATOM 1589 C LEU A 130 22.156 -10.340 -55.538 1.00 64.22 C ATOM 1590 O LEU A 130 23.189 -9.686 -55.665 1.00 52.30 O ATOM 1591 CB LEU A 130 21.782 -12.218 -53.878 1.00 23.22 C ATOM 1592 CG LEU A 130 23.211 -12.794 -53.866 1.00 11.51 C ATOM 1593 CD1 LEU A 130 23.703 -13.085 -55.274 1.00 45.45 C ATOM 1594 CD2 LEU A 130 24.169 -11.847 -53.155 1.00 14.33 C ATOM 0 H LEU A 130 19.631 -11.066 -53.697 1.00 71.22 H new ATOM 0 HA LEU A 130 22.257 -10.166 -53.424 1.00 11.11 H new ATOM 0 HB2 LEU A 130 21.320 -12.437 -52.916 1.00 23.22 H new ATOM 0 HB3 LEU A 130 21.208 -12.750 -54.636 1.00 23.22 H new ATOM 0 HG LEU A 130 23.181 -13.736 -53.318 1.00 11.51 H new ATOM 0 HD11 LEU A 130 24.714 -13.490 -55.230 1.00 45.45 H new ATOM 0 HD12 LEU A 130 23.042 -13.811 -55.748 1.00 45.45 H new ATOM 0 HD13 LEU A 130 23.707 -12.163 -55.856 1.00 45.45 H new ATOM 0 HD21 LEU A 130 25.172 -12.274 -53.158 1.00 14.33 H new ATOM 0 HD22 LEU A 130 24.181 -10.887 -53.671 1.00 14.33 H new ATOM 0 HD23 LEU A 130 23.840 -11.702 -52.126 1.00 14.33 H new ATOM 1606 N ASN A 131 21.421 -10.718 -56.578 1.00 64.13 N ATOM 1607 CA ASN A 131 21.880 -10.471 -57.945 1.00 14.43 C ATOM 1608 C ASN A 131 21.767 -8.991 -58.301 1.00 74.54 C ATOM 1609 O ASN A 131 22.522 -8.488 -59.135 1.00 72.41 O ATOM 1610 CB ASN A 131 21.115 -11.329 -58.969 1.00 34.45 C ATOM 1611 CG ASN A 131 19.708 -10.831 -59.251 1.00 22.14 C ATOM 1612 OD1 ASN A 131 18.728 -11.385 -58.559 1.00 53.44 O flip ATOM 1613 ND2 ASN A 131 19.499 -9.974 -60.112 1.00 14.11 N flip ATOM 0 H ASN A 131 20.519 -11.189 -56.507 1.00 64.13 H new ATOM 0 HA ASN A 131 22.930 -10.760 -57.988 1.00 14.43 H new ATOM 0 HB2 ASN A 131 21.677 -11.352 -59.903 1.00 34.45 H new ATOM 0 HB3 ASN A 131 21.062 -12.354 -58.603 1.00 34.45 H new ATOM 0 HD21 ASN A 131 20.280 -9.568 -60.627 1.00 14.11 H new ATOM 0 HD22 ASN A 131 18.545 -9.671 -60.309 1.00 14.11 H new ATOM 1620 N ALA A 132 20.853 -8.289 -57.636 1.00 53.31 N ATOM 1621 CA ALA A 132 20.609 -6.881 -57.924 1.00 13.43 C ATOM 1622 C ALA A 132 21.692 -6.017 -57.294 1.00 3.42 C ATOM 1623 O ALA A 132 22.056 -4.965 -57.818 1.00 25.34 O ATOM 1624 CB ALA A 132 19.238 -6.454 -57.427 1.00 44.22 C ATOM 0 H ALA A 132 20.269 -8.674 -56.893 1.00 53.31 H new ATOM 0 HA ALA A 132 20.636 -6.746 -59.005 1.00 13.43 H new ATOM 0 HB1 ALA A 132 19.081 -5.400 -57.654 1.00 44.22 H new ATOM 0 HB2 ALA A 132 18.470 -7.050 -57.921 1.00 44.22 H new ATOM 0 HB3 ALA A 132 19.178 -6.606 -56.349 1.00 44.22 H new ATOM 1630 N ILE A 133 22.231 -6.498 -56.183 1.00 43.22 N ATOM 1631 CA ILE A 133 23.238 -5.764 -55.435 1.00 11.21 C ATOM 1632 C ILE A 133 24.592 -5.912 -56.110 1.00 62.13 C ATOM 1633 O ILE A 133 25.419 -5.002 -56.091 1.00 51.32 O ATOM 1634 CB ILE A 133 23.317 -6.249 -53.964 1.00 64.12 C ATOM 1635 CG1 ILE A 133 22.067 -5.813 -53.196 1.00 64.43 C ATOM 1636 CG2 ILE A 133 24.571 -5.731 -53.269 1.00 52.30 C ATOM 1637 CD1 ILE A 133 21.897 -4.308 -53.120 1.00 64.35 C ATOM 0 H ILE A 133 21.984 -7.401 -55.778 1.00 43.22 H new ATOM 0 HA ILE A 133 22.952 -4.712 -55.423 1.00 11.21 H new ATOM 0 HB ILE A 133 23.369 -7.338 -53.975 1.00 64.12 H new ATOM 0 HG12 ILE A 133 21.188 -6.246 -53.673 1.00 64.43 H new ATOM 0 HG13 ILE A 133 22.112 -6.217 -52.185 1.00 64.43 H new ATOM 0 HG21 ILE A 133 24.592 -6.091 -52.240 1.00 52.30 H new ATOM 0 HG22 ILE A 133 25.454 -6.090 -53.797 1.00 52.30 H new ATOM 0 HG23 ILE A 133 24.565 -4.641 -53.272 1.00 52.30 H new ATOM 0 HD11 ILE A 133 20.991 -4.072 -52.562 1.00 64.35 H new ATOM 0 HD12 ILE A 133 22.758 -3.870 -52.616 1.00 64.35 H new ATOM 0 HD13 ILE A 133 21.819 -3.899 -54.127 1.00 64.35 H new ATOM 1649 N LYS A 134 24.794 -7.044 -56.763 1.00 63.01 N ATOM 1650 CA LYS A 134 26.065 -7.319 -57.405 1.00 10.14 C ATOM 1651 C LYS A 134 26.146 -6.580 -58.729 1.00 52.33 C ATOM 1652 O LYS A 134 27.228 -6.276 -59.216 1.00 51.34 O ATOM 1653 CB LYS A 134 26.244 -8.817 -57.633 1.00 73.51 C ATOM 1654 CG LYS A 134 26.179 -9.649 -56.364 1.00 43.55 C ATOM 1655 CD LYS A 134 26.065 -11.127 -56.688 1.00 15.00 C ATOM 1656 CE LYS A 134 27.337 -11.669 -57.308 1.00 41.55 C ATOM 1657 NZ LYS A 134 27.095 -12.928 -58.056 1.00 14.32 N ATOM 0 H LYS A 134 24.098 -7.783 -56.862 1.00 63.01 H new ATOM 0 HA LYS A 134 26.864 -6.973 -56.750 1.00 10.14 H new ATOM 0 HB2 LYS A 134 25.474 -9.163 -58.322 1.00 73.51 H new ATOM 0 HB3 LYS A 134 27.205 -8.988 -58.118 1.00 73.51 H new ATOM 0 HG2 LYS A 134 27.071 -9.473 -55.763 1.00 43.55 H new ATOM 0 HG3 LYS A 134 25.324 -9.338 -55.764 1.00 43.55 H new ATOM 0 HD2 LYS A 134 25.840 -11.682 -55.777 1.00 15.00 H new ATOM 0 HD3 LYS A 134 25.231 -11.285 -57.372 1.00 15.00 H new ATOM 0 HE2 LYS A 134 27.760 -10.923 -57.981 1.00 41.55 H new ATOM 0 HE3 LYS A 134 28.075 -11.847 -56.526 1.00 41.55 H new ATOM 0 HZ1 LYS A 134 27.989 -13.266 -58.465 1.00 14.32 H new ATOM 0 HZ2 LYS A 134 26.715 -13.649 -57.409 1.00 14.32 H new ATOM 0 HZ3 LYS A 134 26.410 -12.752 -58.819 1.00 14.32 H new ATOM 1671 N GLU A 135 24.983 -6.310 -59.309 1.00 20.01 N ATOM 1672 CA GLU A 135 24.893 -5.663 -60.607 1.00 55.33 C ATOM 1673 C GLU A 135 25.325 -4.205 -60.485 1.00 52.13 C ATOM 1674 O GLU A 135 26.020 -3.662 -61.345 1.00 3.55 O ATOM 1675 CB GLU A 135 23.446 -5.756 -61.102 1.00 70.13 C ATOM 1676 CG GLU A 135 23.273 -5.572 -62.599 1.00 35.15 C ATOM 1677 CD GLU A 135 23.938 -6.673 -63.402 1.00 10.12 C ATOM 1678 OE1 GLU A 135 23.715 -7.863 -63.096 1.00 3.12 O ATOM 1679 OE2 GLU A 135 24.693 -6.353 -64.341 1.00 5.33 O ATOM 0 H GLU A 135 24.079 -6.534 -58.892 1.00 20.01 H new ATOM 0 HA GLU A 135 25.551 -6.157 -61.321 1.00 55.33 H new ATOM 0 HB2 GLU A 135 23.042 -6.728 -60.820 1.00 70.13 H new ATOM 0 HB3 GLU A 135 22.851 -5.002 -60.586 1.00 70.13 H new ATOM 0 HG2 GLU A 135 22.210 -5.545 -62.838 1.00 35.15 H new ATOM 0 HG3 GLU A 135 23.691 -4.609 -62.894 1.00 35.15 H new ATOM 1686 N LYS A 136 24.908 -3.584 -59.391 1.00 43.15 N ATOM 1687 CA LYS A 136 25.252 -2.197 -59.118 1.00 35.44 C ATOM 1688 C LYS A 136 26.663 -2.069 -58.559 1.00 3.31 C ATOM 1689 O LYS A 136 27.381 -1.123 -58.877 1.00 54.22 O ATOM 1690 CB LYS A 136 24.241 -1.563 -58.162 1.00 34.14 C ATOM 1691 CG LYS A 136 23.779 -2.458 -57.023 1.00 42.43 C ATOM 1692 CD LYS A 136 22.593 -1.843 -56.307 1.00 32.11 C ATOM 1693 CE LYS A 136 21.429 -1.643 -57.263 1.00 51.12 C ATOM 1694 NZ LYS A 136 20.413 -0.702 -56.726 1.00 5.51 N ATOM 0 H LYS A 136 24.328 -4.022 -58.675 1.00 43.15 H new ATOM 0 HA LYS A 136 25.218 -1.661 -60.067 1.00 35.44 H new ATOM 0 HB2 LYS A 136 24.682 -0.661 -57.738 1.00 34.14 H new ATOM 0 HB3 LYS A 136 23.368 -1.252 -58.736 1.00 34.14 H new ATOM 0 HG2 LYS A 136 23.507 -3.439 -57.412 1.00 42.43 H new ATOM 0 HG3 LYS A 136 24.597 -2.610 -56.319 1.00 42.43 H new ATOM 0 HD2 LYS A 136 22.286 -2.487 -55.483 1.00 32.11 H new ATOM 0 HD3 LYS A 136 22.881 -0.886 -55.873 1.00 32.11 H new ATOM 0 HE2 LYS A 136 21.804 -1.265 -58.214 1.00 51.12 H new ATOM 0 HE3 LYS A 136 20.959 -2.605 -57.465 1.00 51.12 H new ATOM 0 HZ1 LYS A 136 19.647 -0.585 -57.420 1.00 5.51 H new ATOM 0 HZ2 LYS A 136 20.022 -1.082 -55.840 1.00 5.51 H new ATOM 0 HZ3 LYS A 136 20.857 0.220 -56.541 1.00 5.51 H new ATOM 1708 N TYR A 137 27.058 -3.021 -57.730 1.00 73.44 N ATOM 1709 CA TYR A 137 28.403 -3.032 -57.172 1.00 53.41 C ATOM 1710 C TYR A 137 29.294 -3.950 -58.000 1.00 33.51 C ATOM 1711 O TYR A 137 30.212 -4.594 -57.490 1.00 55.42 O ATOM 1712 CB TYR A 137 28.368 -3.457 -55.701 1.00 11.22 C ATOM 1713 CG TYR A 137 27.614 -2.479 -54.824 1.00 54.11 C ATOM 1714 CD1 TYR A 137 28.062 -1.174 -54.663 1.00 14.02 C ATOM 1715 CD2 TYR A 137 26.443 -2.852 -54.178 1.00 30.32 C ATOM 1716 CE1 TYR A 137 27.369 -0.274 -53.880 1.00 45.42 C ATOM 1717 CE2 TYR A 137 25.740 -1.955 -53.397 1.00 23.43 C ATOM 1718 CZ TYR A 137 26.208 -0.667 -53.251 1.00 13.23 C ATOM 1719 OH TYR A 137 25.507 0.236 -52.482 1.00 21.21 O ATOM 0 H TYR A 137 26.468 -3.796 -57.428 1.00 73.44 H new ATOM 0 HA TYR A 137 28.820 -2.026 -57.211 1.00 53.41 H new ATOM 0 HB2 TYR A 137 27.904 -4.440 -55.623 1.00 11.22 H new ATOM 0 HB3 TYR A 137 29.389 -3.556 -55.332 1.00 11.22 H new ATOM 0 HD1 TYR A 137 28.968 -0.859 -55.159 1.00 14.02 H new ATOM 0 HD2 TYR A 137 26.075 -3.861 -54.288 1.00 30.32 H new ATOM 0 HE1 TYR A 137 27.735 0.735 -53.761 1.00 45.42 H new ATOM 0 HE2 TYR A 137 24.829 -2.261 -52.904 1.00 23.43 H new ATOM 0 HH TYR A 137 24.712 -0.199 -52.109 1.00 21.21 H new ATOM 1729 N LYS A 138 28.992 -3.986 -59.293 1.00 12.12 N ATOM 1730 CA LYS A 138 29.724 -4.785 -60.269 1.00 40.44 C ATOM 1731 C LYS A 138 31.194 -4.379 -60.320 1.00 50.11 C ATOM 1732 O LYS A 138 31.523 -3.199 -60.169 1.00 51.43 O ATOM 1733 CB LYS A 138 29.088 -4.581 -61.649 1.00 43.32 C ATOM 1734 CG LYS A 138 29.727 -5.388 -62.768 1.00 62.34 C ATOM 1735 CD LYS A 138 29.251 -4.919 -64.135 1.00 12.45 C ATOM 1736 CE LYS A 138 27.743 -5.044 -64.286 1.00 12.24 C ATOM 1737 NZ LYS A 138 27.295 -6.459 -64.263 1.00 32.44 N ATOM 0 H LYS A 138 28.222 -3.454 -59.698 1.00 12.12 H new ATOM 0 HA LYS A 138 29.672 -5.834 -59.976 1.00 40.44 H new ATOM 0 HB2 LYS A 138 28.031 -4.841 -61.589 1.00 43.32 H new ATOM 0 HB3 LYS A 138 29.141 -3.523 -61.906 1.00 43.32 H new ATOM 0 HG2 LYS A 138 30.812 -5.299 -62.709 1.00 62.34 H new ATOM 0 HG3 LYS A 138 29.487 -6.443 -62.640 1.00 62.34 H new ATOM 0 HD2 LYS A 138 29.546 -3.880 -64.285 1.00 12.45 H new ATOM 0 HD3 LYS A 138 29.743 -5.505 -64.911 1.00 12.45 H new ATOM 0 HE2 LYS A 138 27.252 -4.496 -63.482 1.00 12.24 H new ATOM 0 HE3 LYS A 138 27.433 -4.581 -65.223 1.00 12.24 H new ATOM 0 HZ1 LYS A 138 26.308 -6.516 -64.585 1.00 32.44 H new ATOM 0 HZ2 LYS A 138 27.898 -7.024 -64.894 1.00 32.44 H new ATOM 0 HZ3 LYS A 138 27.365 -6.829 -63.294 1.00 32.44 H new ATOM 1751 N PRO A 139 32.102 -5.352 -60.516 1.00 1.24 N ATOM 1752 CA PRO A 139 33.525 -5.078 -60.733 1.00 32.11 C ATOM 1753 C PRO A 139 33.771 -4.318 -62.040 1.00 20.51 C ATOM 1754 O PRO A 139 34.248 -4.885 -63.027 1.00 35.34 O ATOM 1755 CB PRO A 139 34.167 -6.470 -60.792 1.00 21.24 C ATOM 1756 CG PRO A 139 33.160 -7.393 -60.195 1.00 41.24 C ATOM 1757 CD PRO A 139 31.821 -6.796 -60.505 1.00 31.41 C ATOM 0 HA PRO A 139 33.939 -4.446 -59.947 1.00 32.11 H new ATOM 0 HB2 PRO A 139 34.400 -6.753 -61.819 1.00 21.24 H new ATOM 0 HB3 PRO A 139 35.103 -6.495 -60.234 1.00 21.24 H new ATOM 0 HG2 PRO A 139 33.249 -8.394 -60.618 1.00 41.24 H new ATOM 0 HG3 PRO A 139 33.306 -7.487 -59.119 1.00 41.24 H new ATOM 0 HD2 PRO A 139 31.437 -7.141 -61.465 1.00 31.41 H new ATOM 0 HD3 PRO A 139 31.078 -7.058 -59.752 1.00 31.41 H new ATOM 1765 N VAL A 140 33.403 -3.040 -62.048 1.00 4.41 N ATOM 1766 CA VAL A 140 33.645 -2.166 -63.190 1.00 62.11 C ATOM 1767 C VAL A 140 34.994 -1.473 -63.048 1.00 41.44 C ATOM 1768 O VAL A 140 35.402 -0.686 -63.902 1.00 14.40 O ATOM 1769 CB VAL A 140 32.537 -1.103 -63.340 1.00 2.32 C ATOM 1770 CG1 VAL A 140 31.206 -1.756 -63.677 1.00 51.34 C ATOM 1771 CG2 VAL A 140 32.410 -0.267 -62.073 1.00 34.44 C ATOM 0 H VAL A 140 32.931 -2.584 -61.267 1.00 4.41 H new ATOM 0 HA VAL A 140 33.643 -2.791 -64.083 1.00 62.11 H new ATOM 0 HB VAL A 140 32.816 -0.442 -64.161 1.00 2.32 H new ATOM 0 HG11 VAL A 140 30.439 -0.988 -63.778 1.00 51.34 H new ATOM 0 HG12 VAL A 140 31.297 -2.304 -64.615 1.00 51.34 H new ATOM 0 HG13 VAL A 140 30.927 -2.445 -62.880 1.00 51.34 H new ATOM 0 HG21 VAL A 140 31.622 0.475 -62.204 1.00 34.44 H new ATOM 0 HG22 VAL A 140 32.162 -0.915 -61.233 1.00 34.44 H new ATOM 0 HG23 VAL A 140 33.355 0.238 -61.874 1.00 34.44 H new ATOM 1781 N VAL A 141 35.673 -1.770 -61.951 1.00 20.53 N ATOM 1782 CA VAL A 141 37.003 -1.243 -61.704 1.00 13.20 C ATOM 1783 C VAL A 141 37.971 -1.815 -62.730 1.00 43.43 C ATOM 1784 O VAL A 141 37.782 -2.940 -63.197 1.00 32.34 O ATOM 1785 CB VAL A 141 37.488 -1.595 -60.280 1.00 35.54 C ATOM 1786 CG1 VAL A 141 38.813 -0.914 -59.974 1.00 12.12 C ATOM 1787 CG2 VAL A 141 36.441 -1.212 -59.247 1.00 43.14 C ATOM 0 H VAL A 141 35.320 -2.379 -61.213 1.00 20.53 H new ATOM 0 HA VAL A 141 36.965 -0.157 -61.791 1.00 13.20 H new ATOM 0 HB VAL A 141 37.641 -2.673 -60.233 1.00 35.54 H new ATOM 0 HG11 VAL A 141 39.133 -1.177 -58.966 1.00 12.12 H new ATOM 0 HG12 VAL A 141 39.565 -1.243 -60.691 1.00 12.12 H new ATOM 0 HG13 VAL A 141 38.692 0.167 -60.045 1.00 12.12 H new ATOM 0 HG21 VAL A 141 36.802 -1.468 -58.251 1.00 43.14 H new ATOM 0 HG22 VAL A 141 36.253 -0.140 -59.300 1.00 43.14 H new ATOM 0 HG23 VAL A 141 35.516 -1.753 -59.448 1.00 43.14 H new ATOM 1797 N ASP A 142 38.981 -1.031 -63.100 1.00 42.02 N ATOM 1798 CA ASP A 142 39.975 -1.466 -64.076 1.00 4.14 C ATOM 1799 C ASP A 142 40.632 -2.770 -63.635 1.00 71.21 C ATOM 1800 O ASP A 142 41.226 -2.848 -62.559 1.00 34.32 O ATOM 1801 CB ASP A 142 41.042 -0.378 -64.299 1.00 14.25 C ATOM 1802 CG ASP A 142 41.863 -0.059 -63.061 1.00 12.01 C ATOM 1803 OD1 ASP A 142 41.393 0.736 -62.213 1.00 65.35 O ATOM 1804 OD2 ASP A 142 42.994 -0.572 -62.938 1.00 32.32 O ATOM 0 H ASP A 142 39.132 -0.090 -62.737 1.00 42.02 H new ATOM 0 HA ASP A 142 39.461 -1.640 -65.021 1.00 4.14 H new ATOM 0 HB2 ASP A 142 41.713 -0.699 -65.096 1.00 14.25 H new ATOM 0 HB3 ASP A 142 40.552 0.533 -64.643 1.00 14.25 H new ATOM 1809 N PRO A 143 40.490 -3.824 -64.449 1.00 74.21 N ATOM 1810 CA PRO A 143 41.095 -5.126 -64.173 1.00 34.55 C ATOM 1811 C PRO A 143 42.613 -5.059 -64.254 1.00 70.52 C ATOM 1812 O PRO A 143 43.169 -4.191 -64.932 1.00 41.25 O ATOM 1813 CB PRO A 143 40.536 -6.034 -65.277 1.00 32.03 C ATOM 1814 CG PRO A 143 39.392 -5.283 -65.870 1.00 44.45 C ATOM 1815 CD PRO A 143 39.727 -3.831 -65.702 1.00 3.22 C ATOM 0 HA PRO A 143 40.866 -5.484 -63.169 1.00 34.55 H new ATOM 0 HB2 PRO A 143 41.295 -6.251 -66.029 1.00 32.03 H new ATOM 0 HB3 PRO A 143 40.209 -6.991 -64.870 1.00 32.03 H new ATOM 0 HG2 PRO A 143 39.262 -5.535 -66.922 1.00 44.45 H new ATOM 0 HG3 PRO A 143 38.458 -5.530 -65.365 1.00 44.45 H new ATOM 0 HD2 PRO A 143 40.315 -3.451 -66.537 1.00 3.22 H new ATOM 0 HD3 PRO A 143 38.832 -3.213 -65.635 1.00 3.22 H new ATOM 1823 N ASN A 144 43.284 -5.967 -63.569 1.00 70.22 N ATOM 1824 CA ASN A 144 44.735 -5.929 -63.515 1.00 72.25 C ATOM 1825 C ASN A 144 45.340 -6.577 -64.756 1.00 52.22 C ATOM 1826 O ASN A 144 44.899 -7.640 -65.199 1.00 31.11 O ATOM 1827 CB ASN A 144 45.266 -6.600 -62.238 1.00 12.32 C ATOM 1828 CG ASN A 144 45.148 -8.116 -62.241 1.00 52.13 C ATOM 1829 OD1 ASN A 144 44.121 -8.671 -61.846 1.00 72.55 O ATOM 1830 ND2 ASN A 144 46.206 -8.795 -62.672 1.00 61.25 N ATOM 0 H ASN A 144 42.854 -6.731 -63.048 1.00 70.22 H new ATOM 0 HA ASN A 144 45.038 -4.882 -63.491 1.00 72.25 H new ATOM 0 HB2 ASN A 144 46.313 -6.328 -62.105 1.00 12.32 H new ATOM 0 HB3 ASN A 144 44.723 -6.205 -61.380 1.00 12.32 H new ATOM 0 HD21 ASN A 144 46.187 -9.815 -62.684 1.00 61.25 H new ATOM 0 HD22 ASN A 144 47.037 -8.296 -62.991 1.00 61.25 H new ATOM 1837 N PRO A 145 46.338 -5.912 -65.350 1.00 32.14 N ATOM 1838 CA PRO A 145 47.091 -6.450 -66.489 1.00 50.23 C ATOM 1839 C PRO A 145 48.066 -7.543 -66.035 1.00 20.24 C ATOM 1840 O PRO A 145 48.031 -7.940 -64.868 1.00 13.40 O ATOM 1841 CB PRO A 145 47.834 -5.214 -67.011 1.00 2.22 C ATOM 1842 CG PRO A 145 48.018 -4.349 -65.816 1.00 10.34 C ATOM 1843 CD PRO A 145 46.805 -4.570 -64.957 1.00 33.01 C ATOM 0 HA PRO A 145 46.464 -6.924 -67.244 1.00 50.23 H new ATOM 0 HB2 PRO A 145 48.792 -5.486 -67.454 1.00 2.22 H new ATOM 0 HB3 PRO A 145 47.259 -4.704 -67.784 1.00 2.22 H new ATOM 0 HG2 PRO A 145 48.930 -4.612 -65.280 1.00 10.34 H new ATOM 0 HG3 PRO A 145 48.108 -3.301 -66.102 1.00 10.34 H new ATOM 0 HD2 PRO A 145 47.052 -4.527 -63.896 1.00 33.01 H new ATOM 0 HD3 PRO A 145 46.043 -3.812 -65.138 1.00 33.01 H new ATOM 1851 N PRO A 146 48.916 -8.080 -66.943 1.00 73.54 N ATOM 1852 CA PRO A 146 49.961 -9.044 -66.580 1.00 41.44 C ATOM 1853 C PRO A 146 50.745 -8.608 -65.343 1.00 11.24 C ATOM 1854 O PRO A 146 51.593 -7.711 -65.412 1.00 42.22 O ATOM 1855 CB PRO A 146 50.881 -9.082 -67.815 1.00 22.42 C ATOM 1856 CG PRO A 146 50.363 -8.030 -68.744 1.00 34.24 C ATOM 1857 CD PRO A 146 48.918 -7.833 -68.389 1.00 22.12 C ATOM 0 HA PRO A 146 49.539 -10.016 -66.326 1.00 41.44 H new ATOM 0 HB2 PRO A 146 51.916 -8.883 -67.537 1.00 22.42 H new ATOM 0 HB3 PRO A 146 50.861 -10.064 -68.287 1.00 22.42 H new ATOM 0 HG2 PRO A 146 50.922 -7.101 -68.631 1.00 34.24 H new ATOM 0 HG3 PRO A 146 50.470 -8.341 -69.783 1.00 34.24 H new ATOM 0 HD2 PRO A 146 48.573 -6.828 -68.630 1.00 22.12 H new ATOM 0 HD3 PRO A 146 48.270 -8.529 -68.922 1.00 22.12 H new ATOM 1865 N ALA A 147 50.425 -9.230 -64.213 1.00 72.24 N ATOM 1866 CA ALA A 147 51.032 -8.899 -62.934 1.00 43.41 C ATOM 1867 C ALA A 147 50.669 -9.959 -61.900 1.00 74.31 C ATOM 1868 O ALA A 147 51.500 -10.855 -61.649 1.00 36.88 O ATOM 1869 CB ALA A 147 50.582 -7.522 -62.460 1.00 44.33 C ATOM 1870 OXT ALA A 147 49.544 -9.908 -61.362 1.00 36.88 O ATOM 0 H ALA A 147 49.735 -9.980 -64.161 1.00 72.24 H new ATOM 0 HA ALA A 147 52.115 -8.877 -63.059 1.00 43.41 H new ATOM 0 HB1 ALA A 147 51.049 -7.297 -61.501 1.00 44.33 H new ATOM 0 HB2 ALA A 147 50.877 -6.771 -63.193 1.00 44.33 H new ATOM 0 HB3 ALA A 147 49.498 -7.513 -62.346 1.00 44.33 H new TER 1876 ALA A 147