USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1066 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 18 MET CE :methyl -111:sc= -0.038 (180deg=-0.0891) USER MOD Set 1.2: A 60 ASN :FLIP amide:sc= 0.308 F(o=-2.5!,f=-0.28) USER MOD Set 1.3: A 100 ASN : amide:sc= -0.546 K(o=-0.28,f=-3.3!) USER MOD Set 2.1: A 59 LYS NZ :NH3+ -170:sc= 0.383 (180deg=-0.297) USER MOD Set 2.2: A 61 GLN : amide:sc= 0.685 K(o=1.1,f=-9!) USER MOD Set 2.3: A 91 GLN : amide:sc= 0 K(o=1.1,f=-0.42) USER MOD Set 3.1: A 20 LYS NZ :NH3+ 180:sc= 0.469 (180deg=0.432) USER MOD Set 3.2: A 58 ASN : amide:sc= 0.33 K(o=0.8,f=-3.1) USER MOD Set 4.1: A 9 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 21 MET CE :methyl -165:sc= 0 (180deg=-0.415) USER MOD Set 5.1: A 4 THR OG1 : rot -126:sc= 0.643 USER MOD Set 5.2: A 114 GLN : amide:sc= 1 K(o=1.6,f=0.33) USER MOD Single : A 1 ALA N :NH3+ -112:sc= 0.992 (180deg=-0.423) USER MOD Single : A 2 THR OG1 : rot 180:sc= -0.1 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 33:sc= 0.57 USER MOD Single : A 11 GLN : amide:sc= -0.421 X(o=-0.42,f=-0.0037) USER MOD Single : A 12 SER OG : rot -2:sc= 0.113! USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 17 GLN : amide:sc= -0.383 K(o=-0.38,f=-1.5) USER MOD Single : A 19 ASN : amide:sc= 1.85 K(o=1.8,f=-6.7!) USER MOD Single : A 25 ASN : amide:sc= -0.323 K(o=-0.32,f=-1.7!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 35 SER OG : rot -160:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot -3:sc= -0.0319 USER MOD Single : A 46 THR OG1 : rot -110:sc= 0.791 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 86:sc= 1.3 USER MOD Single : A 53 SER OG : rot 1:sc= 0.399 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 15:sc= -0.0437 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 24:sc= 0.271 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 TYR OH : rot 150:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0.247 USER MOD Single : A 93 THR OG1 : rot 66:sc= 1.05 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0608 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -144:sc= 0.424 (180deg=-0.0299) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= -0.0448 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= 0.0924 K(o=0.092,f=-5!) USER MOD Single : A 118 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= 0.143 X(o=0.14,f=0) USER MOD Single : A 126 SER OG : rot 53:sc= 1.25 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 SER OG : rot 50:sc= 1.22 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -4.392 -23.687 -3.173 1.00 0.00 N ATOM 2 CA ALA A 1 -5.060 -22.565 -2.498 1.00 0.00 C ATOM 3 C ALA A 1 -4.323 -22.210 -1.221 1.00 0.00 C ATOM 4 O ALA A 1 -4.111 -23.096 -0.382 1.00 0.00 O ATOM 5 CB ALA A 1 -6.511 -22.892 -2.157 1.00 0.00 C ATOM 0 H1 ALA A 1 -3.967 -23.354 -4.062 1.00 0.00 H new ATOM 0 H2 ALA A 1 -3.648 -24.070 -2.556 1.00 0.00 H new ATOM 0 H3 ALA A 1 -5.088 -24.432 -3.379 1.00 0.00 H new ATOM 0 HA ALA A 1 -5.048 -21.720 -3.187 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -6.969 -22.037 -1.659 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -7.059 -23.115 -3.073 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -6.543 -23.757 -1.495 1.00 0.00 H new ATOM 11 N THR A 2 -3.943 -20.938 -1.065 1.00 0.00 N ATOM 12 CA THR A 2 -3.297 -20.464 0.157 1.00 0.00 C ATOM 13 C THR A 2 -3.639 -18.986 0.353 1.00 0.00 C ATOM 14 O THR A 2 -3.806 -18.265 -0.639 1.00 0.00 O ATOM 15 CB THR A 2 -1.771 -20.659 0.067 1.00 0.00 C ATOM 16 OG1 THR A 2 -1.413 -21.829 -0.654 1.00 0.00 O ATOM 17 CG2 THR A 2 -1.127 -20.731 1.444 1.00 0.00 C ATOM 0 H THR A 2 -4.074 -20.217 -1.775 1.00 0.00 H new ATOM 0 HA THR A 2 -3.658 -21.038 1.010 1.00 0.00 H new ATOM 0 HB THR A 2 -1.401 -19.784 -0.468 1.00 0.00 H new ATOM 0 HG1 THR A 2 -0.437 -21.908 -0.685 1.00 0.00 H new ATOM 0 HG21 THR A 2 -0.051 -20.869 1.336 1.00 0.00 H new ATOM 0 HG22 THR A 2 -1.322 -19.805 1.986 1.00 0.00 H new ATOM 0 HG23 THR A 2 -1.546 -21.571 1.998 1.00 0.00 H new ATOM 25 N SER A 3 -3.670 -18.524 1.604 1.00 0.00 N ATOM 26 CA SER A 3 -3.857 -17.135 1.981 1.00 0.00 C ATOM 27 C SER A 3 -2.574 -16.551 2.580 1.00 0.00 C ATOM 28 O SER A 3 -1.694 -17.267 3.067 1.00 0.00 O ATOM 29 CB SER A 3 -5.025 -17.046 2.964 1.00 0.00 C ATOM 30 OG SER A 3 -6.249 -16.858 2.282 1.00 0.00 O ATOM 0 H SER A 3 -3.560 -19.139 2.411 1.00 0.00 H new ATOM 0 HA SER A 3 -4.089 -16.543 1.096 1.00 0.00 H new ATOM 0 HB2 SER A 3 -5.073 -17.957 3.560 1.00 0.00 H new ATOM 0 HB3 SER A 3 -4.860 -16.220 3.656 1.00 0.00 H new ATOM 0 HG SER A 3 -6.981 -16.806 2.932 1.00 0.00 H new ATOM 36 N THR A 4 -2.487 -15.221 2.555 1.00 0.00 N ATOM 37 CA THR A 4 -1.374 -14.422 3.050 1.00 0.00 C ATOM 38 C THR A 4 -2.007 -13.253 3.814 1.00 0.00 C ATOM 39 O THR A 4 -2.580 -12.353 3.198 1.00 0.00 O ATOM 40 CB THR A 4 -0.504 -13.980 1.854 1.00 0.00 C ATOM 41 OG1 THR A 4 0.066 -15.099 1.198 1.00 0.00 O ATOM 42 CG2 THR A 4 0.613 -13.010 2.231 1.00 0.00 C ATOM 0 H THR A 4 -3.233 -14.644 2.167 1.00 0.00 H new ATOM 0 HA THR A 4 -0.708 -14.966 3.720 1.00 0.00 H new ATOM 0 HB THR A 4 -1.186 -13.453 1.186 1.00 0.00 H new ATOM 0 HG1 THR A 4 1.037 -14.982 1.136 1.00 0.00 H new ATOM 0 HG21 THR A 4 1.181 -12.745 1.339 1.00 0.00 H new ATOM 0 HG22 THR A 4 0.181 -12.109 2.667 1.00 0.00 H new ATOM 0 HG23 THR A 4 1.276 -13.482 2.956 1.00 0.00 H new ATOM 50 N VAL A 5 -1.980 -13.311 5.145 1.00 0.00 N ATOM 51 CA VAL A 5 -2.459 -12.251 6.031 1.00 0.00 C ATOM 52 C VAL A 5 -1.235 -11.477 6.530 1.00 0.00 C ATOM 53 O VAL A 5 -0.186 -12.081 6.762 1.00 0.00 O ATOM 54 CB VAL A 5 -3.303 -12.855 7.173 1.00 0.00 C ATOM 55 CG1 VAL A 5 -4.673 -13.295 6.652 1.00 0.00 C ATOM 56 CG2 VAL A 5 -2.638 -14.050 7.864 1.00 0.00 C ATOM 0 H VAL A 5 -1.615 -14.118 5.650 1.00 0.00 H new ATOM 0 HA VAL A 5 -3.117 -11.557 5.509 1.00 0.00 H new ATOM 0 HB VAL A 5 -3.404 -12.061 7.913 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -5.255 -13.719 7.471 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -5.199 -12.434 6.240 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -4.542 -14.046 5.873 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -3.289 -14.421 8.655 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -2.465 -14.842 7.135 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.686 -13.738 8.294 1.00 0.00 H new ATOM 66 N THR A 6 -1.327 -10.147 6.613 1.00 0.00 N ATOM 67 CA THR A 6 -0.163 -9.274 6.724 1.00 0.00 C ATOM 68 C THR A 6 -0.508 -8.051 7.569 1.00 0.00 C ATOM 69 O THR A 6 -1.404 -7.290 7.189 1.00 0.00 O ATOM 70 CB THR A 6 0.304 -8.841 5.322 1.00 0.00 C ATOM 71 OG1 THR A 6 -0.719 -8.140 4.627 1.00 0.00 O ATOM 72 CG2 THR A 6 0.723 -10.023 4.442 1.00 0.00 C ATOM 0 H THR A 6 -2.216 -9.647 6.605 1.00 0.00 H new ATOM 0 HA THR A 6 0.647 -9.818 7.210 1.00 0.00 H new ATOM 0 HB THR A 6 1.166 -8.197 5.498 1.00 0.00 H new ATOM 0 HG1 THR A 6 -1.256 -7.627 5.266 1.00 0.00 H new ATOM 0 HG21 THR A 6 1.042 -9.655 3.467 1.00 0.00 H new ATOM 0 HG22 THR A 6 1.547 -10.556 4.916 1.00 0.00 H new ATOM 0 HG23 THR A 6 -0.122 -10.700 4.316 1.00 0.00 H new ATOM 80 N GLY A 7 0.187 -7.868 8.687 1.00 0.00 N ATOM 81 CA GLY A 7 0.070 -6.741 9.593 1.00 0.00 C ATOM 82 C GLY A 7 1.465 -6.205 9.894 1.00 0.00 C ATOM 83 O GLY A 7 2.180 -6.750 10.745 1.00 0.00 O ATOM 0 H GLY A 7 0.885 -8.543 8.999 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.546 -5.960 9.147 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.423 -7.048 10.515 1.00 0.00 H new ATOM 87 N GLY A 8 1.856 -5.156 9.177 1.00 0.00 N ATOM 88 CA GLY A 8 3.014 -4.312 9.422 1.00 0.00 C ATOM 89 C GLY A 8 2.542 -2.911 9.784 1.00 0.00 C ATOM 90 O GLY A 8 1.352 -2.708 10.044 1.00 0.00 O ATOM 0 H GLY A 8 1.334 -4.855 8.354 1.00 0.00 H new ATOM 0 HA2 GLY A 8 3.617 -4.726 10.230 1.00 0.00 H new ATOM 0 HA3 GLY A 8 3.648 -4.278 8.536 1.00 0.00 H new ATOM 94 N TYR A 9 3.467 -1.952 9.809 1.00 0.00 N ATOM 95 CA TYR A 9 3.173 -0.533 9.977 1.00 0.00 C ATOM 96 C TYR A 9 3.523 0.165 8.659 1.00 0.00 C ATOM 97 O TYR A 9 4.550 -0.166 8.061 1.00 0.00 O ATOM 98 CB TYR A 9 3.975 0.042 11.164 1.00 0.00 C ATOM 99 CG TYR A 9 3.221 1.015 12.059 1.00 0.00 C ATOM 100 CD1 TYR A 9 2.524 2.119 11.527 1.00 0.00 C ATOM 101 CD2 TYR A 9 3.205 0.803 13.452 1.00 0.00 C ATOM 102 CE1 TYR A 9 1.765 2.957 12.360 1.00 0.00 C ATOM 103 CE2 TYR A 9 2.486 1.666 14.296 1.00 0.00 C ATOM 104 CZ TYR A 9 1.731 2.727 13.752 1.00 0.00 C ATOM 105 OH TYR A 9 0.960 3.499 14.568 1.00 0.00 O ATOM 0 H TYR A 9 4.463 -2.147 9.711 1.00 0.00 H new ATOM 0 HA TYR A 9 2.119 -0.373 10.206 1.00 0.00 H new ATOM 0 HB2 TYR A 9 4.328 -0.788 11.776 1.00 0.00 H new ATOM 0 HB3 TYR A 9 4.858 0.547 10.772 1.00 0.00 H new ATOM 0 HD1 TYR A 9 2.574 2.322 10.468 1.00 0.00 H new ATOM 0 HD2 TYR A 9 3.749 -0.029 13.874 1.00 0.00 H new ATOM 0 HE1 TYR A 9 1.207 3.778 11.935 1.00 0.00 H new ATOM 0 HE2 TYR A 9 2.511 1.517 15.365 1.00 0.00 H new ATOM 0 HH TYR A 9 1.060 3.196 15.495 1.00 0.00 H new ATOM 115 N ALA A 10 2.713 1.129 8.217 1.00 0.00 N ATOM 116 CA ALA A 10 2.984 1.979 7.065 1.00 0.00 C ATOM 117 C ALA A 10 2.854 3.459 7.449 1.00 0.00 C ATOM 118 O ALA A 10 1.994 3.842 8.251 1.00 0.00 O ATOM 119 CB ALA A 10 2.018 1.618 5.933 1.00 0.00 C ATOM 0 H ALA A 10 1.823 1.343 8.668 1.00 0.00 H new ATOM 0 HA ALA A 10 4.006 1.814 6.723 1.00 0.00 H new ATOM 0 HB1 ALA A 10 2.217 2.252 5.069 1.00 0.00 H new ATOM 0 HB2 ALA A 10 2.156 0.573 5.656 1.00 0.00 H new ATOM 0 HB3 ALA A 10 0.992 1.772 6.267 1.00 0.00 H new ATOM 125 N GLN A 11 3.673 4.301 6.817 1.00 0.00 N ATOM 126 CA GLN A 11 3.779 5.738 7.034 1.00 0.00 C ATOM 127 C GLN A 11 4.062 6.431 5.698 1.00 0.00 C ATOM 128 O GLN A 11 4.387 5.759 4.713 1.00 0.00 O ATOM 129 CB GLN A 11 4.835 6.031 8.123 1.00 0.00 C ATOM 130 CG GLN A 11 6.275 5.571 7.825 1.00 0.00 C ATOM 131 CD GLN A 11 7.112 6.649 7.141 1.00 0.00 C ATOM 132 OE1 GLN A 11 7.343 6.608 5.936 1.00 0.00 O ATOM 133 NE2 GLN A 11 7.585 7.634 7.886 1.00 0.00 N ATOM 0 H GLN A 11 4.318 3.974 6.097 1.00 0.00 H new ATOM 0 HA GLN A 11 2.839 6.144 7.408 1.00 0.00 H new ATOM 0 HB2 GLN A 11 4.850 7.106 8.303 1.00 0.00 H new ATOM 0 HB3 GLN A 11 4.510 5.557 9.049 1.00 0.00 H new ATOM 0 HG2 GLN A 11 6.758 5.279 8.757 1.00 0.00 H new ATOM 0 HG3 GLN A 11 6.244 4.685 7.191 1.00 0.00 H new ATOM 0 HE21 GLN A 11 7.386 7.658 8.886 1.00 0.00 H new ATOM 0 HE22 GLN A 11 8.148 8.370 7.460 1.00 0.00 H new ATOM 142 N SER A 12 3.891 7.756 5.628 1.00 0.00 N ATOM 143 CA SER A 12 4.248 8.517 4.435 1.00 0.00 C ATOM 144 C SER A 12 5.068 9.736 4.845 1.00 0.00 C ATOM 145 O SER A 12 4.578 10.592 5.597 1.00 0.00 O ATOM 146 CB SER A 12 2.991 8.876 3.619 1.00 0.00 C ATOM 147 OG SER A 12 2.495 10.175 3.897 1.00 0.00 O ATOM 0 H SER A 12 3.507 8.320 6.386 1.00 0.00 H new ATOM 0 HA SER A 12 4.868 7.911 3.774 1.00 0.00 H new ATOM 0 HB2 SER A 12 3.223 8.803 2.556 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.210 8.144 3.826 1.00 0.00 H new ATOM 0 HG SER A 12 3.039 10.590 4.599 1.00 0.00 H new ATOM 153 N ASP A 13 6.266 9.868 4.292 1.00 0.00 N ATOM 154 CA ASP A 13 7.151 10.997 4.527 1.00 0.00 C ATOM 155 C ASP A 13 7.701 11.476 3.180 1.00 0.00 C ATOM 156 O ASP A 13 7.452 10.834 2.156 1.00 0.00 O ATOM 157 CB ASP A 13 8.247 10.571 5.516 1.00 0.00 C ATOM 158 CG ASP A 13 8.645 11.705 6.452 1.00 0.00 C ATOM 159 OD1 ASP A 13 8.701 12.873 6.002 1.00 0.00 O ATOM 160 OD2 ASP A 13 8.835 11.452 7.664 1.00 0.00 O ATOM 0 H ASP A 13 6.657 9.176 3.653 1.00 0.00 H new ATOM 0 HA ASP A 13 6.625 11.838 4.978 1.00 0.00 H new ATOM 0 HB2 ASP A 13 7.895 9.723 6.103 1.00 0.00 H new ATOM 0 HB3 ASP A 13 9.123 10.234 4.962 1.00 0.00 H new ATOM 165 N ALA A 14 8.386 12.616 3.152 1.00 0.00 N ATOM 166 CA ALA A 14 9.085 13.139 1.985 1.00 0.00 C ATOM 167 C ALA A 14 10.286 13.933 2.477 1.00 0.00 C ATOM 168 O ALA A 14 10.256 14.407 3.620 1.00 0.00 O ATOM 169 CB ALA A 14 8.152 14.062 1.191 1.00 0.00 C ATOM 0 H ALA A 14 8.472 13.220 3.969 1.00 0.00 H new ATOM 0 HA ALA A 14 9.404 12.322 1.337 1.00 0.00 H new ATOM 0 HB1 ALA A 14 8.679 14.450 0.320 1.00 0.00 H new ATOM 0 HB2 ALA A 14 7.276 13.501 0.865 1.00 0.00 H new ATOM 0 HB3 ALA A 14 7.836 14.892 1.824 1.00 0.00 H new ATOM 175 N GLN A 15 11.278 14.180 1.611 1.00 0.00 N ATOM 176 CA GLN A 15 12.331 15.144 1.916 1.00 0.00 C ATOM 177 C GLN A 15 11.729 16.549 1.874 1.00 0.00 C ATOM 178 O GLN A 15 11.796 17.247 0.859 1.00 0.00 O ATOM 179 CB GLN A 15 13.533 15.016 0.971 1.00 0.00 C ATOM 180 CG GLN A 15 14.684 15.902 1.480 1.00 0.00 C ATOM 181 CD GLN A 15 15.861 16.013 0.525 1.00 0.00 C ATOM 182 OE1 GLN A 15 15.777 15.688 -0.660 1.00 0.00 O ATOM 183 NE2 GLN A 15 16.968 16.534 1.019 1.00 0.00 N ATOM 0 H GLN A 15 11.369 13.727 0.702 1.00 0.00 H new ATOM 0 HA GLN A 15 12.719 14.939 2.914 1.00 0.00 H new ATOM 0 HB2 GLN A 15 13.857 13.977 0.916 1.00 0.00 H new ATOM 0 HB3 GLN A 15 13.249 15.315 -0.038 1.00 0.00 H new ATOM 0 HG2 GLN A 15 14.297 16.902 1.678 1.00 0.00 H new ATOM 0 HG3 GLN A 15 15.039 15.504 2.431 1.00 0.00 H new ATOM 0 HE21 GLN A 15 17.013 16.795 2.004 1.00 0.00 H new ATOM 0 HE22 GLN A 15 17.778 16.675 0.416 1.00 0.00 H new ATOM 192 N GLY A 16 11.090 16.958 2.956 1.00 0.00 N ATOM 193 CA GLY A 16 10.363 18.191 3.066 1.00 0.00 C ATOM 194 C GLY A 16 9.738 18.179 4.443 1.00 0.00 C ATOM 195 O GLY A 16 10.394 17.858 5.440 1.00 0.00 O ATOM 0 H GLY A 16 11.069 16.408 3.815 1.00 0.00 H new ATOM 0 HA2 GLY A 16 11.026 19.048 2.945 1.00 0.00 H new ATOM 0 HA3 GLY A 16 9.600 18.266 2.291 1.00 0.00 H new ATOM 199 N GLN A 17 8.468 18.533 4.507 1.00 0.00 N ATOM 200 CA GLN A 17 7.754 18.756 5.742 1.00 0.00 C ATOM 201 C GLN A 17 6.303 18.395 5.432 1.00 0.00 C ATOM 202 O GLN A 17 5.591 19.171 4.796 1.00 0.00 O ATOM 203 CB GLN A 17 7.985 20.227 6.148 1.00 0.00 C ATOM 204 CG GLN A 17 8.020 20.484 7.656 1.00 0.00 C ATOM 205 CD GLN A 17 6.672 20.282 8.338 1.00 0.00 C ATOM 206 OE1 GLN A 17 5.612 20.603 7.817 1.00 0.00 O ATOM 207 NE2 GLN A 17 6.665 19.762 9.547 1.00 0.00 N ATOM 0 H GLN A 17 7.893 18.676 3.677 1.00 0.00 H new ATOM 0 HA GLN A 17 8.081 18.156 6.591 1.00 0.00 H new ATOM 0 HB2 GLN A 17 8.927 20.564 5.715 1.00 0.00 H new ATOM 0 HB3 GLN A 17 7.196 20.838 5.709 1.00 0.00 H new ATOM 0 HG2 GLN A 17 8.753 19.819 8.113 1.00 0.00 H new ATOM 0 HG3 GLN A 17 8.360 21.504 7.835 1.00 0.00 H new ATOM 0 HE21 GLN A 17 7.543 19.491 9.991 1.00 0.00 H new ATOM 0 HE22 GLN A 17 5.782 19.630 10.040 1.00 0.00 H new ATOM 216 N MET A 18 5.906 17.163 5.759 1.00 0.00 N ATOM 217 CA MET A 18 4.563 16.662 5.465 1.00 0.00 C ATOM 218 C MET A 18 4.136 15.465 6.340 1.00 0.00 C ATOM 219 O MET A 18 2.985 15.041 6.270 1.00 0.00 O ATOM 220 CB MET A 18 4.521 16.292 3.967 1.00 0.00 C ATOM 221 CG MET A 18 3.147 16.540 3.339 1.00 0.00 C ATOM 222 SD MET A 18 3.178 17.468 1.777 1.00 0.00 S ATOM 223 CE MET A 18 3.003 19.154 2.406 1.00 0.00 C ATOM 0 H MET A 18 6.505 16.487 6.233 1.00 0.00 H new ATOM 0 HA MET A 18 3.846 17.448 5.701 1.00 0.00 H new ATOM 0 HB2 MET A 18 5.272 16.873 3.432 1.00 0.00 H new ATOM 0 HB3 MET A 18 4.787 15.242 3.848 1.00 0.00 H new ATOM 0 HG2 MET A 18 2.664 15.578 3.164 1.00 0.00 H new ATOM 0 HG3 MET A 18 2.529 17.082 4.055 1.00 0.00 H new ATOM 0 HE1 MET A 18 2.026 19.548 2.125 1.00 0.00 H new ATOM 0 HE2 MET A 18 3.093 19.148 3.492 1.00 0.00 H new ATOM 0 HE3 MET A 18 3.784 19.784 1.981 1.00 0.00 H new ATOM 233 N ASN A 19 5.059 14.956 7.164 1.00 0.00 N ATOM 234 CA ASN A 19 5.122 13.662 7.838 1.00 0.00 C ATOM 235 C ASN A 19 3.762 13.189 8.359 1.00 0.00 C ATOM 236 O ASN A 19 3.134 13.837 9.210 1.00 0.00 O ATOM 237 CB ASN A 19 6.143 13.694 9.005 1.00 0.00 C ATOM 238 CG ASN A 19 7.412 14.507 8.744 1.00 0.00 C ATOM 239 OD1 ASN A 19 7.339 15.722 8.558 1.00 0.00 O ATOM 240 ND2 ASN A 19 8.594 13.921 8.815 1.00 0.00 N ATOM 0 H ASN A 19 5.879 15.515 7.400 1.00 0.00 H new ATOM 0 HA ASN A 19 5.449 12.947 7.083 1.00 0.00 H new ATOM 0 HB2 ASN A 19 5.648 14.099 9.888 1.00 0.00 H new ATOM 0 HB3 ASN A 19 6.430 12.670 9.242 1.00 0.00 H new ATOM 0 HD21 ASN A 19 9.445 14.475 8.716 1.00 0.00 H new ATOM 0 HD22 ASN A 19 8.656 12.915 8.969 1.00 0.00 H new ATOM 247 N LYS A 20 3.341 12.027 7.864 1.00 0.00 N ATOM 248 CA LYS A 20 2.150 11.281 8.259 1.00 0.00 C ATOM 249 C LYS A 20 2.503 9.825 8.560 1.00 0.00 C ATOM 250 O LYS A 20 3.422 9.273 7.963 1.00 0.00 O ATOM 251 CB LYS A 20 1.093 11.336 7.144 1.00 0.00 C ATOM 252 CG LYS A 20 0.659 12.763 6.777 1.00 0.00 C ATOM 253 CD LYS A 20 -0.817 12.821 6.366 1.00 0.00 C ATOM 254 CE LYS A 20 -1.249 14.196 5.834 1.00 0.00 C ATOM 255 NZ LYS A 20 -0.772 15.340 6.649 1.00 0.00 N ATOM 0 H LYS A 20 3.859 11.550 7.126 1.00 0.00 H new ATOM 0 HA LYS A 20 1.744 11.739 9.161 1.00 0.00 H new ATOM 0 HB2 LYS A 20 1.489 10.846 6.255 1.00 0.00 H new ATOM 0 HB3 LYS A 20 0.217 10.768 7.457 1.00 0.00 H new ATOM 0 HG2 LYS A 20 0.826 13.424 7.628 1.00 0.00 H new ATOM 0 HG3 LYS A 20 1.279 13.133 5.960 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -1.003 12.068 5.600 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -1.436 12.561 7.225 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -0.880 14.311 4.815 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -2.337 14.228 5.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -1.104 16.230 6.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -1.145 15.256 7.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 0.268 15.337 6.677 1.00 0.00 H new ATOM 269 N MET A 21 1.738 9.167 9.427 1.00 0.00 N ATOM 270 CA MET A 21 1.967 7.800 9.891 1.00 0.00 C ATOM 271 C MET A 21 0.617 7.081 9.917 1.00 0.00 C ATOM 272 O MET A 21 -0.049 7.027 10.946 1.00 0.00 O ATOM 273 CB MET A 21 2.674 7.910 11.250 1.00 0.00 C ATOM 274 CG MET A 21 2.981 6.609 11.992 1.00 0.00 C ATOM 275 SD MET A 21 4.007 6.949 13.451 1.00 0.00 S ATOM 276 CE MET A 21 3.377 5.719 14.617 1.00 0.00 C ATOM 0 H MET A 21 0.907 9.588 9.843 1.00 0.00 H new ATOM 0 HA MET A 21 2.609 7.204 9.242 1.00 0.00 H new ATOM 0 HB2 MET A 21 3.614 8.441 11.098 1.00 0.00 H new ATOM 0 HB3 MET A 21 2.058 8.531 11.900 1.00 0.00 H new ATOM 0 HG2 MET A 21 2.052 6.127 12.296 1.00 0.00 H new ATOM 0 HG3 MET A 21 3.498 5.916 11.328 1.00 0.00 H new ATOM 0 HE1 MET A 21 3.709 5.969 15.625 1.00 0.00 H new ATOM 0 HE2 MET A 21 2.287 5.712 14.585 1.00 0.00 H new ATOM 0 HE3 MET A 21 3.754 4.733 14.345 1.00 0.00 H new ATOM 286 N GLY A 22 0.216 6.551 8.758 1.00 0.00 N ATOM 287 CA GLY A 22 -1.096 5.981 8.497 1.00 0.00 C ATOM 288 C GLY A 22 -1.531 4.923 9.495 1.00 0.00 C ATOM 289 O GLY A 22 -2.447 5.168 10.281 1.00 0.00 O ATOM 0 H GLY A 22 0.829 6.509 7.944 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -1.833 6.784 8.493 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -1.096 5.543 7.499 1.00 0.00 H new ATOM 293 N GLY A 23 -0.926 3.744 9.418 1.00 0.00 N ATOM 294 CA GLY A 23 -1.423 2.558 10.083 1.00 0.00 C ATOM 295 C GLY A 23 -0.828 1.340 9.413 1.00 0.00 C ATOM 296 O GLY A 23 0.308 1.002 9.727 1.00 0.00 O ATOM 0 H GLY A 23 -0.070 3.589 8.886 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -1.155 2.577 11.139 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -2.511 2.524 10.031 1.00 0.00 H new ATOM 300 N PHE A 24 -1.541 0.692 8.487 1.00 0.00 N ATOM 301 CA PHE A 24 -1.114 -0.585 7.925 1.00 0.00 C ATOM 302 C PHE A 24 -1.550 -0.695 6.465 1.00 0.00 C ATOM 303 O PHE A 24 -2.257 0.187 5.954 1.00 0.00 O ATOM 304 CB PHE A 24 -1.629 -1.740 8.805 1.00 0.00 C ATOM 305 CG PHE A 24 -3.136 -1.875 8.956 1.00 0.00 C ATOM 306 CD1 PHE A 24 -3.825 -1.128 9.931 1.00 0.00 C ATOM 307 CD2 PHE A 24 -3.848 -2.799 8.168 1.00 0.00 C ATOM 308 CE1 PHE A 24 -5.212 -1.290 10.096 1.00 0.00 C ATOM 309 CE2 PHE A 24 -5.234 -2.960 8.328 1.00 0.00 C ATOM 310 CZ PHE A 24 -5.916 -2.202 9.292 1.00 0.00 C ATOM 0 H PHE A 24 -2.424 1.038 8.111 1.00 0.00 H new ATOM 0 HA PHE A 24 -0.026 -0.649 7.924 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -1.245 -2.674 8.396 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -1.198 -1.626 9.800 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -3.287 -0.429 10.554 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -3.323 -3.390 7.433 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -5.737 -0.712 10.842 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -5.773 -3.664 7.712 1.00 0.00 H new ATOM 0 HZ PHE A 24 -6.982 -2.320 9.416 1.00 0.00 H new ATOM 320 N ASN A 25 -1.120 -1.768 5.792 1.00 0.00 N ATOM 321 CA ASN A 25 -1.625 -2.198 4.487 1.00 0.00 C ATOM 322 C ASN A 25 -2.304 -3.563 4.634 1.00 0.00 C ATOM 323 O ASN A 25 -2.075 -4.269 5.619 1.00 0.00 O ATOM 324 CB ASN A 25 -0.532 -2.181 3.395 1.00 0.00 C ATOM 325 CG ASN A 25 0.526 -3.282 3.467 1.00 0.00 C ATOM 326 OD1 ASN A 25 0.508 -4.159 4.318 1.00 0.00 O ATOM 327 ND2 ASN A 25 1.491 -3.272 2.561 1.00 0.00 N ATOM 0 H ASN A 25 -0.388 -2.379 6.154 1.00 0.00 H new ATOM 0 HA ASN A 25 -2.370 -1.480 4.144 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -1.021 -2.242 2.423 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -0.024 -1.217 3.437 1.00 0.00 H new ATOM 0 HD21 ASN A 25 2.212 -3.993 2.576 1.00 0.00 H new ATOM 0 HD22 ASN A 25 1.513 -2.543 1.847 1.00 0.00 H new ATOM 334 N LEU A 26 -3.141 -3.951 3.673 1.00 0.00 N ATOM 335 CA LEU A 26 -3.891 -5.200 3.738 1.00 0.00 C ATOM 336 C LEU A 26 -3.861 -5.834 2.357 1.00 0.00 C ATOM 337 O LEU A 26 -4.320 -5.215 1.390 1.00 0.00 O ATOM 338 CB LEU A 26 -5.316 -4.922 4.260 1.00 0.00 C ATOM 339 CG LEU A 26 -6.052 -6.109 4.914 1.00 0.00 C ATOM 340 CD1 LEU A 26 -6.312 -7.281 3.967 1.00 0.00 C ATOM 341 CD2 LEU A 26 -5.313 -6.633 6.153 1.00 0.00 C ATOM 0 H LEU A 26 -3.317 -3.407 2.828 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.447 -5.906 4.439 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -5.261 -4.112 4.987 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.920 -4.562 3.427 1.00 0.00 H new ATOM 0 HG LEU A 26 -7.018 -5.695 5.203 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -6.833 -8.074 4.504 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -6.926 -6.944 3.132 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -5.363 -7.661 3.590 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -5.867 -7.468 6.581 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -4.316 -6.967 5.867 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -5.231 -5.836 6.892 1.00 0.00 H new ATOM 353 N LYS A 27 -3.296 -7.041 2.254 1.00 0.00 N ATOM 354 CA LYS A 27 -3.136 -7.783 1.008 1.00 0.00 C ATOM 355 C LYS A 27 -4.175 -8.903 0.965 1.00 0.00 C ATOM 356 O LYS A 27 -4.452 -9.495 2.013 1.00 0.00 O ATOM 357 CB LYS A 27 -1.715 -8.368 0.974 1.00 0.00 C ATOM 358 CG LYS A 27 -1.277 -8.658 -0.463 1.00 0.00 C ATOM 359 CD LYS A 27 0.033 -9.456 -0.566 1.00 0.00 C ATOM 360 CE LYS A 27 1.277 -8.824 0.059 1.00 0.00 C ATOM 361 NZ LYS A 27 1.571 -7.482 -0.469 1.00 0.00 N ATOM 0 H LYS A 27 -2.927 -7.541 3.063 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.281 -7.133 0.145 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -1.019 -7.669 1.436 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -1.681 -9.286 1.561 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -2.068 -9.211 -0.969 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -1.158 -7.713 -0.994 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -0.124 -10.429 -0.100 1.00 0.00 H new ATOM 0 HD3 LYS A 27 0.238 -9.638 -1.621 1.00 0.00 H new ATOM 0 HE2 LYS A 27 1.142 -8.761 1.139 1.00 0.00 H new ATOM 0 HE3 LYS A 27 2.135 -9.473 -0.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 2.424 -7.107 -0.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 1.729 -7.540 -1.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.767 -6.850 -0.278 1.00 0.00 H new ATOM 375 N TYR A 28 -4.711 -9.240 -0.211 1.00 0.00 N ATOM 376 CA TYR A 28 -5.613 -10.375 -0.356 1.00 0.00 C ATOM 377 C TYR A 28 -5.362 -11.020 -1.710 1.00 0.00 C ATOM 378 O TYR A 28 -5.243 -10.306 -2.711 1.00 0.00 O ATOM 379 CB TYR A 28 -7.073 -9.932 -0.209 1.00 0.00 C ATOM 380 CG TYR A 28 -7.978 -11.056 0.246 1.00 0.00 C ATOM 381 CD1 TYR A 28 -8.075 -11.336 1.621 1.00 0.00 C ATOM 382 CD2 TYR A 28 -8.695 -11.831 -0.684 1.00 0.00 C ATOM 383 CE1 TYR A 28 -8.918 -12.364 2.071 1.00 0.00 C ATOM 384 CE2 TYR A 28 -9.534 -12.866 -0.234 1.00 0.00 C ATOM 385 CZ TYR A 28 -9.663 -13.125 1.149 1.00 0.00 C ATOM 386 OH TYR A 28 -10.525 -14.069 1.620 1.00 0.00 O ATOM 0 H TYR A 28 -4.531 -8.736 -1.079 1.00 0.00 H new ATOM 0 HA TYR A 28 -5.422 -11.104 0.431 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -7.130 -9.112 0.507 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -7.430 -9.547 -1.164 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -7.500 -10.760 2.331 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -8.601 -11.631 -1.741 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -8.996 -12.572 3.128 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -10.081 -13.464 -0.947 1.00 0.00 H new ATOM 0 HH TYR A 28 -10.969 -14.512 0.867 1.00 0.00 H new ATOM 396 N ARG A 29 -5.309 -12.352 -1.746 1.00 0.00 N ATOM 397 CA ARG A 29 -5.168 -13.186 -2.940 1.00 0.00 C ATOM 398 C ARG A 29 -6.366 -14.099 -3.022 1.00 0.00 C ATOM 399 O ARG A 29 -7.037 -14.329 -2.012 1.00 0.00 O ATOM 400 CB ARG A 29 -3.876 -14.024 -2.919 1.00 0.00 C ATOM 401 CG ARG A 29 -3.770 -15.051 -1.774 1.00 0.00 C ATOM 402 CD ARG A 29 -2.331 -15.549 -1.556 1.00 0.00 C ATOM 403 NE ARG A 29 -1.974 -16.722 -2.382 1.00 0.00 N ATOM 404 CZ ARG A 29 -0.833 -16.888 -3.072 1.00 0.00 C ATOM 405 NH1 ARG A 29 -0.081 -15.854 -3.432 1.00 0.00 N ATOM 406 NH2 ARG A 29 -0.442 -18.095 -3.462 1.00 0.00 N ATOM 0 H ARG A 29 -5.367 -12.910 -0.894 1.00 0.00 H new ATOM 0 HA ARG A 29 -5.110 -12.534 -3.812 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -3.792 -14.554 -3.868 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -3.025 -13.346 -2.856 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -4.138 -14.601 -0.852 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -4.415 -15.902 -1.993 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -1.638 -14.737 -1.776 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -2.200 -15.803 -0.504 1.00 0.00 H new ATOM 0 HE ARG A 29 -2.658 -17.477 -2.433 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -0.365 -14.906 -3.185 1.00 0.00 H new ATOM 0 HH12 ARG A 29 0.781 -16.008 -3.955 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -1.010 -18.912 -3.239 1.00 0.00 H new ATOM 0 HH22 ARG A 29 0.427 -18.205 -3.985 1.00 0.00 H new ATOM 420 N TYR A 30 -6.584 -14.681 -4.194 1.00 0.00 N ATOM 421 CA TYR A 30 -7.411 -15.861 -4.274 1.00 0.00 C ATOM 422 C TYR A 30 -6.685 -16.826 -5.185 1.00 0.00 C ATOM 423 O TYR A 30 -6.543 -16.562 -6.380 1.00 0.00 O ATOM 424 CB TYR A 30 -8.823 -15.476 -4.722 1.00 0.00 C ATOM 425 CG TYR A 30 -9.896 -16.487 -4.383 1.00 0.00 C ATOM 426 CD1 TYR A 30 -10.057 -16.914 -3.050 1.00 0.00 C ATOM 427 CD2 TYR A 30 -10.783 -16.944 -5.376 1.00 0.00 C ATOM 428 CE1 TYR A 30 -11.112 -17.777 -2.710 1.00 0.00 C ATOM 429 CE2 TYR A 30 -11.849 -17.792 -5.036 1.00 0.00 C ATOM 430 CZ TYR A 30 -12.026 -18.202 -3.694 1.00 0.00 C ATOM 431 OH TYR A 30 -13.072 -18.991 -3.331 1.00 0.00 O ATOM 0 H TYR A 30 -6.204 -14.357 -5.083 1.00 0.00 H new ATOM 0 HA TYR A 30 -7.560 -16.354 -3.314 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -9.086 -14.522 -4.265 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -8.817 -15.322 -5.801 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -9.369 -16.577 -2.289 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -10.643 -16.641 -6.403 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -11.223 -18.116 -1.691 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -12.534 -18.131 -5.799 1.00 0.00 H new ATOM 0 HH TYR A 30 -13.614 -19.200 -4.121 1.00 0.00 H new ATOM 441 N GLU A 31 -6.143 -17.887 -4.600 1.00 0.00 N ATOM 442 CA GLU A 31 -5.437 -18.948 -5.291 1.00 0.00 C ATOM 443 C GLU A 31 -6.313 -20.175 -5.063 1.00 0.00 C ATOM 444 O GLU A 31 -6.671 -20.460 -3.920 1.00 0.00 O ATOM 445 CB GLU A 31 -4.012 -19.043 -4.711 1.00 0.00 C ATOM 446 CG GLU A 31 -2.991 -19.633 -5.697 1.00 0.00 C ATOM 447 CD GLU A 31 -3.018 -21.156 -5.856 1.00 0.00 C ATOM 448 OE1 GLU A 31 -3.750 -21.877 -5.142 1.00 0.00 O ATOM 449 OE2 GLU A 31 -2.317 -21.649 -6.767 1.00 0.00 O ATOM 0 H GLU A 31 -6.187 -18.033 -3.592 1.00 0.00 H new ATOM 0 HA GLU A 31 -5.291 -18.804 -6.362 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -3.683 -18.048 -4.410 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -4.034 -19.657 -3.811 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -3.157 -19.182 -6.675 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.992 -19.338 -5.375 1.00 0.00 H new ATOM 456 N GLU A 32 -6.765 -20.807 -6.137 1.00 0.00 N ATOM 457 CA GLU A 32 -7.602 -21.993 -6.165 1.00 0.00 C ATOM 458 C GLU A 32 -7.068 -22.835 -7.324 1.00 0.00 C ATOM 459 O GLU A 32 -6.078 -22.449 -7.961 1.00 0.00 O ATOM 460 CB GLU A 32 -9.075 -21.608 -6.371 1.00 0.00 C ATOM 461 CG GLU A 32 -10.063 -22.656 -5.838 1.00 0.00 C ATOM 462 CD GLU A 32 -10.270 -22.477 -4.334 1.00 0.00 C ATOM 463 OE1 GLU A 32 -11.113 -21.623 -3.978 1.00 0.00 O ATOM 464 OE2 GLU A 32 -9.562 -23.106 -3.515 1.00 0.00 O ATOM 0 H GLU A 32 -6.539 -20.480 -7.076 1.00 0.00 H new ATOM 0 HA GLU A 32 -7.567 -22.548 -5.228 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -9.266 -20.656 -5.876 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -9.257 -21.457 -7.435 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -11.017 -22.562 -6.357 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -9.686 -23.658 -6.043 1.00 0.00 H new ATOM 471 N ASP A 33 -7.647 -24.007 -7.581 1.00 0.00 N ATOM 472 CA ASP A 33 -7.534 -24.560 -8.926 1.00 0.00 C ATOM 473 C ASP A 33 -8.499 -23.826 -9.860 1.00 0.00 C ATOM 474 O ASP A 33 -8.084 -23.273 -10.878 1.00 0.00 O ATOM 475 CB ASP A 33 -7.780 -26.069 -8.956 1.00 0.00 C ATOM 476 CG ASP A 33 -7.307 -26.563 -10.320 1.00 0.00 C ATOM 477 OD1 ASP A 33 -6.072 -26.726 -10.453 1.00 0.00 O ATOM 478 OD2 ASP A 33 -8.134 -26.693 -11.251 1.00 0.00 O ATOM 0 H ASP A 33 -8.174 -24.568 -6.912 1.00 0.00 H new ATOM 0 HA ASP A 33 -6.511 -24.409 -9.270 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -7.235 -26.566 -8.154 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -8.837 -26.292 -8.809 1.00 0.00 H new ATOM 483 N ASN A 34 -9.788 -23.815 -9.504 1.00 0.00 N ATOM 484 CA ASN A 34 -10.872 -23.482 -10.429 1.00 0.00 C ATOM 485 C ASN A 34 -10.959 -21.984 -10.706 1.00 0.00 C ATOM 486 O ASN A 34 -11.218 -21.599 -11.843 1.00 0.00 O ATOM 487 CB ASN A 34 -12.223 -23.979 -9.893 1.00 0.00 C ATOM 488 CG ASN A 34 -12.213 -25.478 -9.640 1.00 0.00 C ATOM 489 OD1 ASN A 34 -11.722 -25.926 -8.607 1.00 0.00 O ATOM 490 ND2 ASN A 34 -12.740 -26.287 -10.539 1.00 0.00 N ATOM 0 H ASN A 34 -10.108 -24.038 -8.562 1.00 0.00 H new ATOM 0 HA ASN A 34 -10.642 -23.987 -11.367 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -12.461 -23.456 -8.967 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -13.009 -23.736 -10.608 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -12.742 -27.294 -10.379 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -13.145 -25.905 -11.394 1.00 0.00 H new ATOM 497 N SER A 35 -10.778 -21.132 -9.694 1.00 0.00 N ATOM 498 CA SER A 35 -10.603 -19.699 -9.908 1.00 0.00 C ATOM 499 C SER A 35 -9.118 -19.470 -10.219 1.00 0.00 C ATOM 500 O SER A 35 -8.294 -19.708 -9.331 1.00 0.00 O ATOM 501 CB SER A 35 -11.040 -18.907 -8.672 1.00 0.00 C ATOM 502 OG SER A 35 -12.428 -19.080 -8.435 1.00 0.00 O ATOM 0 H SER A 35 -10.749 -21.415 -8.714 1.00 0.00 H new ATOM 0 HA SER A 35 -11.222 -19.352 -10.735 1.00 0.00 H new ATOM 0 HB2 SER A 35 -10.473 -19.238 -7.802 1.00 0.00 H new ATOM 0 HB3 SER A 35 -10.819 -17.849 -8.814 1.00 0.00 H new ATOM 0 HG SER A 35 -12.756 -18.352 -7.868 1.00 0.00 H new ATOM 508 N PRO A 36 -8.748 -19.036 -11.439 1.00 0.00 N ATOM 509 CA PRO A 36 -7.348 -18.903 -11.815 1.00 0.00 C ATOM 510 C PRO A 36 -6.657 -17.849 -10.947 1.00 0.00 C ATOM 511 O PRO A 36 -7.266 -16.840 -10.564 1.00 0.00 O ATOM 512 CB PRO A 36 -7.349 -18.543 -13.305 1.00 0.00 C ATOM 513 CG PRO A 36 -8.718 -17.904 -13.530 1.00 0.00 C ATOM 514 CD PRO A 36 -9.615 -18.653 -12.546 1.00 0.00 C ATOM 0 HA PRO A 36 -6.784 -19.822 -11.653 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -6.541 -17.853 -13.549 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -7.213 -19.426 -13.929 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -8.702 -16.833 -13.326 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -9.057 -18.028 -14.559 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -10.434 -18.021 -12.202 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -10.064 -19.529 -13.014 1.00 0.00 H new ATOM 522 N LEU A 37 -5.380 -18.087 -10.628 1.00 0.00 N ATOM 523 CA LEU A 37 -4.531 -17.118 -9.947 1.00 0.00 C ATOM 524 C LEU A 37 -4.164 -16.042 -10.964 1.00 0.00 C ATOM 525 O LEU A 37 -3.961 -16.328 -12.143 1.00 0.00 O ATOM 526 CB LEU A 37 -3.294 -17.832 -9.373 1.00 0.00 C ATOM 527 CG LEU A 37 -2.384 -17.035 -8.409 1.00 0.00 C ATOM 528 CD1 LEU A 37 -1.324 -16.170 -9.101 1.00 0.00 C ATOM 529 CD2 LEU A 37 -3.144 -16.205 -7.364 1.00 0.00 C ATOM 0 H LEU A 37 -4.908 -18.966 -10.839 1.00 0.00 H new ATOM 0 HA LEU A 37 -5.041 -16.650 -9.105 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.636 -18.725 -8.850 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.682 -18.168 -10.210 1.00 0.00 H new ATOM 0 HG LEU A 37 -1.857 -17.828 -7.879 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -0.733 -15.648 -8.349 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.671 -16.805 -9.700 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.814 -15.442 -9.747 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.431 -15.678 -6.729 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -3.784 -15.482 -7.869 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -3.757 -16.865 -6.751 1.00 0.00 H new ATOM 541 N GLY A 38 -4.049 -14.805 -10.500 1.00 0.00 N ATOM 542 CA GLY A 38 -3.958 -13.639 -11.351 1.00 0.00 C ATOM 543 C GLY A 38 -4.352 -12.362 -10.612 1.00 0.00 C ATOM 544 O GLY A 38 -4.574 -11.348 -11.268 1.00 0.00 O ATOM 0 H GLY A 38 -4.016 -14.586 -9.504 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -2.939 -13.542 -11.726 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -4.605 -13.771 -12.218 1.00 0.00 H new ATOM 548 N VAL A 39 -4.475 -12.388 -9.277 1.00 0.00 N ATOM 549 CA VAL A 39 -5.128 -11.331 -8.525 1.00 0.00 C ATOM 550 C VAL A 39 -4.307 -10.976 -7.295 1.00 0.00 C ATOM 551 O VAL A 39 -3.774 -11.868 -6.626 1.00 0.00 O ATOM 552 CB VAL A 39 -6.555 -11.792 -8.157 1.00 0.00 C ATOM 553 CG1 VAL A 39 -7.399 -11.847 -9.426 1.00 0.00 C ATOM 554 CG2 VAL A 39 -6.625 -13.173 -7.475 1.00 0.00 C ATOM 0 H VAL A 39 -4.121 -13.148 -8.696 1.00 0.00 H new ATOM 0 HA VAL A 39 -5.202 -10.427 -9.129 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.929 -11.065 -7.436 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.409 -12.172 -9.177 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.438 -10.857 -9.881 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.954 -12.552 -10.129 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.664 -13.416 -7.252 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -6.210 -13.929 -8.141 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.051 -13.151 -6.549 1.00 0.00 H new ATOM 564 N ILE A 40 -4.220 -9.687 -6.981 1.00 0.00 N ATOM 565 CA ILE A 40 -3.977 -9.199 -5.633 1.00 0.00 C ATOM 566 C ILE A 40 -4.953 -8.031 -5.448 1.00 0.00 C ATOM 567 O ILE A 40 -5.280 -7.335 -6.411 1.00 0.00 O ATOM 568 CB ILE A 40 -2.504 -8.759 -5.370 1.00 0.00 C ATOM 569 CG1 ILE A 40 -1.372 -9.540 -6.082 1.00 0.00 C ATOM 570 CG2 ILE A 40 -2.222 -8.860 -3.859 1.00 0.00 C ATOM 571 CD1 ILE A 40 -1.277 -9.307 -7.598 1.00 0.00 C ATOM 0 H ILE A 40 -4.319 -8.942 -7.670 1.00 0.00 H new ATOM 0 HA ILE A 40 -4.136 -10.000 -4.911 1.00 0.00 H new ATOM 0 HB ILE A 40 -2.468 -7.752 -5.787 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -0.420 -9.266 -5.627 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -1.517 -10.605 -5.902 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -1.195 -8.555 -3.659 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -2.906 -8.207 -3.317 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.365 -9.889 -3.530 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -0.456 -9.896 -8.006 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -2.211 -9.610 -8.072 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -1.097 -8.250 -7.793 1.00 0.00 H new ATOM 583 N GLY A 41 -5.391 -7.779 -4.221 1.00 0.00 N ATOM 584 CA GLY A 41 -5.972 -6.510 -3.819 1.00 0.00 C ATOM 585 C GLY A 41 -5.046 -5.941 -2.761 1.00 0.00 C ATOM 586 O GLY A 41 -4.725 -6.654 -1.803 1.00 0.00 O ATOM 0 H GLY A 41 -5.351 -8.464 -3.466 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -6.056 -5.833 -4.669 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -6.978 -6.650 -3.423 1.00 0.00 H new ATOM 590 N SER A 42 -4.586 -4.702 -2.923 1.00 0.00 N ATOM 591 CA SER A 42 -3.708 -4.022 -1.981 1.00 0.00 C ATOM 592 C SER A 42 -4.396 -2.718 -1.584 1.00 0.00 C ATOM 593 O SER A 42 -4.737 -1.906 -2.446 1.00 0.00 O ATOM 594 CB SER A 42 -2.337 -3.784 -2.633 1.00 0.00 C ATOM 595 OG SER A 42 -1.279 -3.775 -1.686 1.00 0.00 O ATOM 0 H SER A 42 -4.821 -4.131 -3.735 1.00 0.00 H new ATOM 0 HA SER A 42 -3.530 -4.619 -1.087 1.00 0.00 H new ATOM 0 HB2 SER A 42 -2.151 -4.562 -3.374 1.00 0.00 H new ATOM 0 HB3 SER A 42 -2.352 -2.833 -3.166 1.00 0.00 H new ATOM 0 HG SER A 42 -0.428 -3.622 -2.148 1.00 0.00 H new ATOM 601 N PHE A 43 -4.603 -2.515 -0.285 1.00 0.00 N ATOM 602 CA PHE A 43 -5.215 -1.318 0.286 1.00 0.00 C ATOM 603 C PHE A 43 -4.236 -0.723 1.290 1.00 0.00 C ATOM 604 O PHE A 43 -3.616 -1.467 2.056 1.00 0.00 O ATOM 605 CB PHE A 43 -6.554 -1.673 0.950 1.00 0.00 C ATOM 606 CG PHE A 43 -7.518 -2.409 0.038 1.00 0.00 C ATOM 607 CD1 PHE A 43 -8.126 -1.735 -1.034 1.00 0.00 C ATOM 608 CD2 PHE A 43 -7.765 -3.781 0.221 1.00 0.00 C ATOM 609 CE1 PHE A 43 -8.949 -2.432 -1.937 1.00 0.00 C ATOM 610 CE2 PHE A 43 -8.585 -4.481 -0.682 1.00 0.00 C ATOM 611 CZ PHE A 43 -9.172 -3.808 -1.768 1.00 0.00 C ATOM 0 H PHE A 43 -4.341 -3.202 0.422 1.00 0.00 H new ATOM 0 HA PHE A 43 -5.426 -0.585 -0.492 1.00 0.00 H new ATOM 0 HB2 PHE A 43 -6.360 -2.288 1.829 1.00 0.00 H new ATOM 0 HB3 PHE A 43 -7.029 -0.756 1.300 1.00 0.00 H new ATOM 0 HD1 PHE A 43 -7.961 -0.676 -1.166 1.00 0.00 H new ATOM 0 HD2 PHE A 43 -7.323 -4.300 1.059 1.00 0.00 H new ATOM 0 HE1 PHE A 43 -9.410 -1.908 -2.761 1.00 0.00 H new ATOM 0 HE2 PHE A 43 -8.764 -5.537 -0.541 1.00 0.00 H new ATOM 0 HZ PHE A 43 -9.792 -4.347 -2.469 1.00 0.00 H new ATOM 621 N THR A 44 -3.977 0.581 1.231 1.00 0.00 N ATOM 622 CA THR A 44 -3.322 1.326 2.307 1.00 0.00 C ATOM 623 C THR A 44 -4.174 2.566 2.611 1.00 0.00 C ATOM 624 O THR A 44 -4.896 3.016 1.718 1.00 0.00 O ATOM 625 CB THR A 44 -1.850 1.566 1.926 1.00 0.00 C ATOM 626 OG1 THR A 44 -1.321 0.303 1.548 1.00 0.00 O ATOM 627 CG2 THR A 44 -0.995 2.097 3.079 1.00 0.00 C ATOM 0 H THR A 44 -4.218 1.158 0.426 1.00 0.00 H new ATOM 0 HA THR A 44 -3.266 0.780 3.249 1.00 0.00 H new ATOM 0 HB THR A 44 -1.823 2.317 1.136 1.00 0.00 H new ATOM 0 HG1 THR A 44 -0.380 0.405 1.294 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.029 2.242 2.736 1.00 0.00 H new ATOM 0 HG22 THR A 44 -1.400 3.048 3.424 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.005 1.380 3.900 1.00 0.00 H new ATOM 635 N TYR A 45 -4.148 3.083 3.846 1.00 0.00 N ATOM 636 CA TYR A 45 -4.775 4.360 4.202 1.00 0.00 C ATOM 637 C TYR A 45 -3.744 5.227 4.927 1.00 0.00 C ATOM 638 O TYR A 45 -2.786 4.683 5.481 1.00 0.00 O ATOM 639 CB TYR A 45 -6.026 4.134 5.068 1.00 0.00 C ATOM 640 CG TYR A 45 -5.742 3.654 6.483 1.00 0.00 C ATOM 641 CD1 TYR A 45 -5.653 2.278 6.762 1.00 0.00 C ATOM 642 CD2 TYR A 45 -5.563 4.586 7.525 1.00 0.00 C ATOM 643 CE1 TYR A 45 -5.387 1.831 8.068 1.00 0.00 C ATOM 644 CE2 TYR A 45 -5.288 4.150 8.833 1.00 0.00 C ATOM 645 CZ TYR A 45 -5.204 2.766 9.109 1.00 0.00 C ATOM 646 OH TYR A 45 -4.968 2.322 10.373 1.00 0.00 O ATOM 0 H TYR A 45 -3.688 2.623 4.631 1.00 0.00 H new ATOM 0 HA TYR A 45 -5.103 4.873 3.298 1.00 0.00 H new ATOM 0 HB2 TYR A 45 -6.588 5.067 5.121 1.00 0.00 H new ATOM 0 HB3 TYR A 45 -6.667 3.404 4.573 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -5.790 1.560 5.967 1.00 0.00 H new ATOM 0 HD2 TYR A 45 -5.638 5.643 7.317 1.00 0.00 H new ATOM 0 HE1 TYR A 45 -5.323 0.773 8.274 1.00 0.00 H new ATOM 0 HE2 TYR A 45 -5.141 4.870 9.624 1.00 0.00 H new ATOM 0 HH TYR A 45 -5.007 1.343 10.388 1.00 0.00 H new ATOM 656 N THR A 46 -3.912 6.552 4.953 1.00 0.00 N ATOM 657 CA THR A 46 -3.080 7.427 5.783 1.00 0.00 C ATOM 658 C THR A 46 -3.964 8.171 6.788 1.00 0.00 C ATOM 659 O THR A 46 -5.166 8.332 6.574 1.00 0.00 O ATOM 660 CB THR A 46 -2.235 8.393 4.930 1.00 0.00 C ATOM 661 OG1 THR A 46 -1.978 7.896 3.636 1.00 0.00 O ATOM 662 CG2 THR A 46 -0.887 8.718 5.578 1.00 0.00 C ATOM 0 H THR A 46 -4.619 7.043 4.407 1.00 0.00 H new ATOM 0 HA THR A 46 -2.369 6.813 6.336 1.00 0.00 H new ATOM 0 HB THR A 46 -2.841 9.296 4.860 1.00 0.00 H new ATOM 0 HG1 THR A 46 -1.029 7.665 3.557 1.00 0.00 H new ATOM 0 HG21 THR A 46 -0.331 9.402 4.937 1.00 0.00 H new ATOM 0 HG22 THR A 46 -1.053 9.185 6.549 1.00 0.00 H new ATOM 0 HG23 THR A 46 -0.316 7.799 5.710 1.00 0.00 H new ATOM 670 N GLU A 47 -3.372 8.651 7.879 1.00 0.00 N ATOM 671 CA GLU A 47 -4.044 9.368 8.952 1.00 0.00 C ATOM 672 C GLU A 47 -2.958 10.241 9.588 1.00 0.00 C ATOM 673 O GLU A 47 -2.027 9.676 10.159 1.00 0.00 O ATOM 674 CB GLU A 47 -4.614 8.332 9.945 1.00 0.00 C ATOM 675 CG GLU A 47 -5.452 8.962 11.065 1.00 0.00 C ATOM 676 CD GLU A 47 -5.393 8.133 12.346 1.00 0.00 C ATOM 677 OE1 GLU A 47 -4.478 8.378 13.164 1.00 0.00 O ATOM 678 OE2 GLU A 47 -6.250 7.253 12.592 1.00 0.00 O ATOM 0 H GLU A 47 -2.371 8.545 8.043 1.00 0.00 H new ATOM 0 HA GLU A 47 -4.878 9.986 8.618 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.229 7.616 9.399 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.790 7.772 10.388 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -5.091 9.971 11.267 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -6.488 9.054 10.738 1.00 0.00 H new ATOM 685 N LYS A 48 -2.959 11.571 9.388 1.00 0.00 N ATOM 686 CA LYS A 48 -2.155 12.531 10.169 1.00 0.00 C ATOM 687 C LYS A 48 -2.437 13.984 9.782 1.00 0.00 C ATOM 688 O LYS A 48 -2.626 14.295 8.603 1.00 0.00 O ATOM 689 CB LYS A 48 -0.637 12.244 10.132 1.00 0.00 C ATOM 690 CG LYS A 48 -0.093 11.734 11.480 1.00 0.00 C ATOM 691 CD LYS A 48 0.235 12.874 12.448 1.00 0.00 C ATOM 692 CE LYS A 48 0.141 12.415 13.900 1.00 0.00 C ATOM 693 NZ LYS A 48 0.564 13.480 14.833 1.00 0.00 N ATOM 0 H LYS A 48 -3.527 12.017 8.668 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.479 12.386 11.200 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -0.430 11.504 9.359 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -0.106 13.154 9.852 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -0.828 11.073 11.938 1.00 0.00 H new ATOM 0 HG3 LYS A 48 0.804 11.140 11.305 1.00 0.00 H new ATOM 0 HD2 LYS A 48 1.239 13.247 12.247 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -0.452 13.704 12.282 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -0.884 12.120 14.124 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.765 11.533 14.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 0.488 13.135 15.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 1.550 13.744 14.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -0.048 14.312 14.711 1.00 0.00 H new ATOM 707 N SER A 49 -2.352 14.877 10.754 1.00 0.00 N ATOM 708 CA SER A 49 -2.219 16.326 10.614 1.00 0.00 C ATOM 709 C SER A 49 -0.741 16.709 10.774 1.00 0.00 C ATOM 710 O SER A 49 0.065 15.926 11.292 1.00 0.00 O ATOM 711 CB SER A 49 -3.133 17.109 11.577 1.00 0.00 C ATOM 712 OG SER A 49 -3.877 16.307 12.481 1.00 0.00 O ATOM 0 H SER A 49 -2.375 14.593 11.733 1.00 0.00 H new ATOM 0 HA SER A 49 -2.556 16.609 9.617 1.00 0.00 H new ATOM 0 HB2 SER A 49 -2.520 17.804 12.151 1.00 0.00 H new ATOM 0 HB3 SER A 49 -3.828 17.707 10.988 1.00 0.00 H new ATOM 0 HG SER A 49 -4.426 16.883 13.053 1.00 0.00 H new ATOM 718 N ARG A 50 -0.337 17.857 10.236 1.00 0.00 N ATOM 719 CA ARG A 50 0.980 18.442 10.487 1.00 0.00 C ATOM 720 C ARG A 50 0.653 19.870 10.912 1.00 0.00 C ATOM 721 O ARG A 50 0.266 20.666 10.063 1.00 0.00 O ATOM 722 CB ARG A 50 1.804 18.312 9.187 1.00 0.00 C ATOM 723 CG ARG A 50 3.281 18.728 9.233 1.00 0.00 C ATOM 724 CD ARG A 50 4.246 17.624 9.700 1.00 0.00 C ATOM 725 NE ARG A 50 4.632 17.790 11.109 1.00 0.00 N ATOM 726 CZ ARG A 50 5.718 17.317 11.730 1.00 0.00 C ATOM 727 NH1 ARG A 50 6.634 16.614 11.081 1.00 0.00 N ATOM 728 NH2 ARG A 50 5.909 17.578 13.013 1.00 0.00 N ATOM 0 H ARG A 50 -0.918 18.413 9.608 1.00 0.00 H new ATOM 0 HA ARG A 50 1.589 17.968 11.257 1.00 0.00 H new ATOM 0 HB2 ARG A 50 1.759 17.272 8.864 1.00 0.00 H new ATOM 0 HB3 ARG A 50 1.312 18.907 8.417 1.00 0.00 H new ATOM 0 HG2 ARG A 50 3.582 19.058 8.239 1.00 0.00 H new ATOM 0 HG3 ARG A 50 3.382 19.585 9.898 1.00 0.00 H new ATOM 0 HD2 ARG A 50 3.775 16.650 9.565 1.00 0.00 H new ATOM 0 HD3 ARG A 50 5.139 17.635 9.076 1.00 0.00 H new ATOM 0 HE ARG A 50 3.991 18.335 11.686 1.00 0.00 H new ATOM 0 HH11 ARG A 50 6.520 16.423 10.086 1.00 0.00 H new ATOM 0 HH12 ARG A 50 7.454 16.264 11.577 1.00 0.00 H new ATOM 0 HH21 ARG A 50 5.229 18.139 13.526 1.00 0.00 H new ATOM 0 HH22 ARG A 50 6.736 17.218 13.489 1.00 0.00 H new ATOM 742 N THR A 51 0.650 20.167 12.212 1.00 0.00 N ATOM 743 CA THR A 51 0.088 21.411 12.726 1.00 0.00 C ATOM 744 C THR A 51 0.673 21.767 14.099 1.00 0.00 C ATOM 745 O THR A 51 1.460 21.003 14.666 1.00 0.00 O ATOM 746 CB THR A 51 -1.451 21.282 12.747 1.00 0.00 C ATOM 747 OG1 THR A 51 -2.098 22.539 12.809 1.00 0.00 O ATOM 748 CG2 THR A 51 -1.992 20.378 13.856 1.00 0.00 C ATOM 0 H THR A 51 1.035 19.555 12.932 1.00 0.00 H new ATOM 0 HA THR A 51 0.358 22.240 12.072 1.00 0.00 H new ATOM 0 HB THR A 51 -1.685 20.803 11.796 1.00 0.00 H new ATOM 0 HG1 THR A 51 -2.200 22.900 11.903 1.00 0.00 H new ATOM 0 HG21 THR A 51 -3.080 20.343 13.799 1.00 0.00 H new ATOM 0 HG22 THR A 51 -1.590 19.372 13.734 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.692 20.774 14.826 1.00 0.00 H new ATOM 756 N ALA A 52 0.189 22.888 14.633 1.00 0.00 N ATOM 757 CA ALA A 52 0.428 23.536 15.914 1.00 0.00 C ATOM 758 C ALA A 52 1.614 24.488 15.781 1.00 0.00 C ATOM 759 O ALA A 52 2.615 24.365 16.496 1.00 0.00 O ATOM 760 CB ALA A 52 0.536 22.548 17.082 1.00 0.00 C ATOM 0 H ALA A 52 -0.478 23.439 14.092 1.00 0.00 H new ATOM 0 HA ALA A 52 -0.446 24.132 16.177 1.00 0.00 H new ATOM 0 HB1 ALA A 52 0.714 23.096 18.007 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -0.392 21.983 17.168 1.00 0.00 H new ATOM 0 HB3 ALA A 52 1.363 21.861 16.902 1.00 0.00 H new ATOM 766 N SER A 53 1.506 25.433 14.847 1.00 0.00 N ATOM 767 CA SER A 53 2.368 26.598 14.748 1.00 0.00 C ATOM 768 C SER A 53 1.556 27.778 14.216 1.00 0.00 C ATOM 769 O SER A 53 1.350 28.734 14.965 1.00 0.00 O ATOM 770 CB SER A 53 3.606 26.304 13.891 1.00 0.00 C ATOM 771 OG SER A 53 4.374 25.262 14.473 1.00 0.00 O ATOM 0 H SER A 53 0.792 25.403 14.119 1.00 0.00 H new ATOM 0 HA SER A 53 2.743 26.859 15.738 1.00 0.00 H new ATOM 0 HB2 SER A 53 3.300 26.020 12.884 1.00 0.00 H new ATOM 0 HB3 SER A 53 4.214 27.204 13.798 1.00 0.00 H new ATOM 0 HG SER A 53 3.936 24.952 15.293 1.00 0.00 H new ATOM 777 N SER A 54 1.078 27.737 12.968 1.00 0.00 N ATOM 778 CA SER A 54 0.686 28.959 12.255 1.00 0.00 C ATOM 779 C SER A 54 -0.748 28.923 11.712 1.00 0.00 C ATOM 780 O SER A 54 -1.117 29.771 10.903 1.00 0.00 O ATOM 781 CB SER A 54 1.713 29.243 11.152 1.00 0.00 C ATOM 782 OG SER A 54 3.040 29.048 11.627 1.00 0.00 O ATOM 0 H SER A 54 0.953 26.878 12.433 1.00 0.00 H new ATOM 0 HA SER A 54 0.684 29.779 12.973 1.00 0.00 H new ATOM 0 HB2 SER A 54 1.528 28.588 10.301 1.00 0.00 H new ATOM 0 HB3 SER A 54 1.597 30.267 10.797 1.00 0.00 H new ATOM 0 HG SER A 54 3.676 29.233 10.905 1.00 0.00 H new ATOM 788 N GLY A 55 -1.567 27.957 12.141 1.00 0.00 N ATOM 789 CA GLY A 55 -2.886 27.738 11.563 1.00 0.00 C ATOM 790 C GLY A 55 -2.680 26.888 10.321 1.00 0.00 C ATOM 791 O GLY A 55 -2.816 27.353 9.185 1.00 0.00 O ATOM 0 H GLY A 55 -1.331 27.311 12.895 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.541 27.234 12.273 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.360 28.686 11.309 1.00 0.00 H new ATOM 795 N ASP A 56 -2.282 25.639 10.551 1.00 0.00 N ATOM 796 CA ASP A 56 -1.885 24.702 9.514 1.00 0.00 C ATOM 797 C ASP A 56 -2.919 23.593 9.504 1.00 0.00 C ATOM 798 O ASP A 56 -2.778 22.612 10.243 1.00 0.00 O ATOM 799 CB ASP A 56 -0.479 24.155 9.814 1.00 0.00 C ATOM 800 CG ASP A 56 0.620 25.169 9.539 1.00 0.00 C ATOM 801 OD1 ASP A 56 0.612 25.697 8.406 1.00 0.00 O ATOM 802 OD2 ASP A 56 1.470 25.422 10.430 1.00 0.00 O ATOM 0 H ASP A 56 -2.227 25.245 11.490 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.840 25.181 8.536 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -0.429 23.847 10.858 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -0.304 23.264 9.210 1.00 0.00 H new ATOM 807 N TYR A 57 -3.972 23.723 8.692 1.00 0.00 N ATOM 808 CA TYR A 57 -4.809 22.579 8.382 1.00 0.00 C ATOM 809 C TYR A 57 -4.302 21.998 7.076 1.00 0.00 C ATOM 810 O TYR A 57 -4.341 22.656 6.031 1.00 0.00 O ATOM 811 CB TYR A 57 -6.299 22.926 8.344 1.00 0.00 C ATOM 812 CG TYR A 57 -7.060 22.357 9.534 1.00 0.00 C ATOM 813 CD1 TYR A 57 -6.895 22.903 10.821 1.00 0.00 C ATOM 814 CD2 TYR A 57 -7.884 21.227 9.373 1.00 0.00 C ATOM 815 CE1 TYR A 57 -7.571 22.356 11.925 1.00 0.00 C ATOM 816 CE2 TYR A 57 -8.544 20.659 10.478 1.00 0.00 C ATOM 817 CZ TYR A 57 -8.395 21.221 11.765 1.00 0.00 C ATOM 818 OH TYR A 57 -9.001 20.639 12.838 1.00 0.00 O ATOM 0 H TYR A 57 -4.255 24.596 8.248 1.00 0.00 H new ATOM 0 HA TYR A 57 -4.735 21.834 9.174 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -6.416 24.010 8.326 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -6.735 22.543 7.421 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -6.242 23.752 10.961 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -8.011 20.792 8.393 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -7.460 22.806 12.900 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -9.168 19.788 10.341 1.00 0.00 H new ATOM 0 HH TYR A 57 -9.530 19.870 12.538 1.00 0.00 H new ATOM 828 N ASN A 58 -3.815 20.765 7.161 1.00 0.00 N ATOM 829 CA ASN A 58 -3.565 19.890 6.040 1.00 0.00 C ATOM 830 C ASN A 58 -4.022 18.494 6.433 1.00 0.00 C ATOM 831 O ASN A 58 -3.968 18.070 7.590 1.00 0.00 O ATOM 832 CB ASN A 58 -2.085 19.880 5.624 1.00 0.00 C ATOM 833 CG ASN A 58 -1.149 19.521 6.769 1.00 0.00 C ATOM 834 OD1 ASN A 58 -0.975 18.346 7.103 1.00 0.00 O ATOM 835 ND2 ASN A 58 -0.563 20.540 7.376 1.00 0.00 N ATOM 0 H ASN A 58 -3.576 20.337 8.055 1.00 0.00 H new ATOM 0 HA ASN A 58 -4.119 20.251 5.174 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -1.946 19.167 4.811 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -1.816 20.862 5.236 1.00 0.00 H new ATOM 0 HD21 ASN A 58 0.067 20.372 8.160 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -0.741 21.493 7.060 1.00 0.00 H new ATOM 842 N LYS A 59 -4.482 17.776 5.424 1.00 0.00 N ATOM 843 CA LYS A 59 -4.697 16.345 5.360 1.00 0.00 C ATOM 844 C LYS A 59 -4.581 16.018 3.874 1.00 0.00 C ATOM 845 O LYS A 59 -4.510 16.932 3.050 1.00 0.00 O ATOM 846 CB LYS A 59 -6.050 15.945 5.976 1.00 0.00 C ATOM 847 CG LYS A 59 -5.828 15.220 7.312 1.00 0.00 C ATOM 848 CD LYS A 59 -7.133 14.871 8.034 1.00 0.00 C ATOM 849 CE LYS A 59 -7.697 13.493 7.666 1.00 0.00 C ATOM 850 NZ LYS A 59 -8.400 13.460 6.372 1.00 0.00 N ATOM 0 H LYS A 59 -4.738 18.226 4.545 1.00 0.00 H new ATOM 0 HA LYS A 59 -3.974 15.777 5.945 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -6.664 16.832 6.132 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -6.594 15.298 5.288 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -5.264 14.305 7.132 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -5.218 15.848 7.961 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -6.963 14.907 9.110 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -7.879 15.632 7.803 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -6.880 12.772 7.643 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -8.384 13.172 8.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -8.895 12.551 6.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -9.090 14.237 6.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -7.712 13.568 5.600 1.00 0.00 H new ATOM 864 N ASN A 60 -4.454 14.734 3.578 1.00 0.00 N ATOM 865 CA ASN A 60 -3.896 14.153 2.366 1.00 0.00 C ATOM 866 C ASN A 60 -3.771 12.680 2.750 1.00 0.00 C ATOM 867 O ASN A 60 -3.040 12.383 3.704 1.00 0.00 O ATOM 868 CB ASN A 60 -2.491 14.731 2.067 1.00 0.00 C ATOM 869 CG ASN A 60 -2.395 15.512 0.767 1.00 0.00 C ATOM 870 OD1 ASN A 60 -2.236 14.833 -0.350 1.00 0.00 O flip ATOM 871 ND2 ASN A 60 -2.360 16.735 0.745 1.00 0.00 N flip ATOM 0 H ASN A 60 -4.763 14.014 4.231 1.00 0.00 H new ATOM 0 HA ASN A 60 -4.499 14.344 1.479 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -2.197 15.382 2.890 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -1.773 13.911 2.038 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -2.483 17.264 1.608 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -2.208 17.225 -0.137 1.00 0.00 H new ATOM 878 N GLN A 61 -4.486 11.761 2.102 1.00 0.00 N ATOM 879 CA GLN A 61 -4.374 10.332 2.379 1.00 0.00 C ATOM 880 C GLN A 61 -4.100 9.598 1.079 1.00 0.00 C ATOM 881 O GLN A 61 -4.714 9.909 0.058 1.00 0.00 O ATOM 882 CB GLN A 61 -5.629 9.769 3.064 1.00 0.00 C ATOM 883 CG GLN A 61 -5.950 10.417 4.419 1.00 0.00 C ATOM 884 CD GLN A 61 -6.614 11.784 4.305 1.00 0.00 C ATOM 885 OE1 GLN A 61 -6.120 12.779 4.835 1.00 0.00 O ATOM 886 NE2 GLN A 61 -7.765 11.865 3.662 1.00 0.00 N ATOM 0 H GLN A 61 -5.159 11.988 1.370 1.00 0.00 H new ATOM 0 HA GLN A 61 -3.548 10.183 3.075 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -6.483 9.901 2.399 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -5.500 8.696 3.208 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -6.604 9.752 4.984 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -5.027 10.518 4.991 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -8.165 11.034 3.226 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -8.253 12.758 3.601 1.00 0.00 H new ATOM 895 N TYR A 62 -3.188 8.631 1.128 1.00 0.00 N ATOM 896 CA TYR A 62 -2.868 7.788 -0.002 1.00 0.00 C ATOM 897 C TYR A 62 -4.001 6.792 -0.169 1.00 0.00 C ATOM 898 O TYR A 62 -4.359 6.096 0.779 1.00 0.00 O ATOM 899 CB TYR A 62 -1.521 7.083 0.203 1.00 0.00 C ATOM 900 CG TYR A 62 -0.363 8.025 -0.048 1.00 0.00 C ATOM 901 CD1 TYR A 62 0.164 8.807 0.995 1.00 0.00 C ATOM 902 CD2 TYR A 62 0.113 8.203 -1.359 1.00 0.00 C ATOM 903 CE1 TYR A 62 1.149 9.770 0.730 1.00 0.00 C ATOM 904 CE2 TYR A 62 1.099 9.168 -1.628 1.00 0.00 C ATOM 905 CZ TYR A 62 1.624 9.956 -0.583 1.00 0.00 C ATOM 906 OH TYR A 62 2.553 10.909 -0.851 1.00 0.00 O ATOM 0 H TYR A 62 -2.649 8.415 1.966 1.00 0.00 H new ATOM 0 HA TYR A 62 -2.767 8.387 -0.907 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.463 6.694 1.220 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -1.449 6.228 -0.470 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -0.191 8.666 2.005 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -0.280 7.597 -2.162 1.00 0.00 H new ATOM 0 HE1 TYR A 62 1.545 10.371 1.536 1.00 0.00 H new ATOM 0 HE2 TYR A 62 1.456 9.306 -2.638 1.00 0.00 H new ATOM 0 HH TYR A 62 2.961 11.213 -0.013 1.00 0.00 H new ATOM 916 N TYR A 63 -4.553 6.742 -1.379 1.00 0.00 N ATOM 917 CA TYR A 63 -5.338 5.628 -1.866 1.00 0.00 C ATOM 918 C TYR A 63 -4.870 5.366 -3.285 1.00 0.00 C ATOM 919 O TYR A 63 -5.028 6.221 -4.161 1.00 0.00 O ATOM 920 CB TYR A 63 -6.843 5.931 -1.847 1.00 0.00 C ATOM 921 CG TYR A 63 -7.448 6.108 -0.470 1.00 0.00 C ATOM 922 CD1 TYR A 63 -7.302 5.095 0.496 1.00 0.00 C ATOM 923 CD2 TYR A 63 -8.183 7.269 -0.159 1.00 0.00 C ATOM 924 CE1 TYR A 63 -7.855 5.246 1.776 1.00 0.00 C ATOM 925 CE2 TYR A 63 -8.743 7.427 1.121 1.00 0.00 C ATOM 926 CZ TYR A 63 -8.571 6.419 2.097 1.00 0.00 C ATOM 927 OH TYR A 63 -9.100 6.581 3.338 1.00 0.00 O ATOM 0 H TYR A 63 -4.460 7.497 -2.059 1.00 0.00 H new ATOM 0 HA TYR A 63 -5.196 4.759 -1.224 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -7.022 6.838 -2.424 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -7.367 5.121 -2.355 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -6.760 4.194 0.250 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -8.316 8.039 -0.905 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -7.733 4.467 2.514 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -9.305 8.318 1.358 1.00 0.00 H new ATOM 0 HH TYR A 63 -9.559 7.445 3.388 1.00 0.00 H new ATOM 937 N GLY A 64 -4.321 4.178 -3.505 1.00 0.00 N ATOM 938 CA GLY A 64 -4.045 3.656 -4.827 1.00 0.00 C ATOM 939 C GLY A 64 -4.962 2.479 -5.085 1.00 0.00 C ATOM 940 O GLY A 64 -5.623 1.980 -4.173 1.00 0.00 O ATOM 0 H GLY A 64 -4.052 3.543 -2.753 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -4.202 4.429 -5.579 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -3.003 3.346 -4.901 1.00 0.00 H new ATOM 944 N ILE A 65 -4.971 2.019 -6.327 1.00 0.00 N ATOM 945 CA ILE A 65 -5.474 0.719 -6.720 1.00 0.00 C ATOM 946 C ILE A 65 -4.266 0.030 -7.346 1.00 0.00 C ATOM 947 O ILE A 65 -3.420 0.690 -7.952 1.00 0.00 O ATOM 948 CB ILE A 65 -6.693 0.851 -7.667 1.00 0.00 C ATOM 949 CG1 ILE A 65 -7.868 1.576 -6.966 1.00 0.00 C ATOM 950 CG2 ILE A 65 -7.187 -0.531 -8.134 1.00 0.00 C ATOM 951 CD1 ILE A 65 -7.864 3.092 -7.190 1.00 0.00 C ATOM 0 H ILE A 65 -4.615 2.562 -7.113 1.00 0.00 H new ATOM 0 HA ILE A 65 -5.864 0.131 -5.889 1.00 0.00 H new ATOM 0 HB ILE A 65 -6.362 1.433 -8.527 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -8.809 1.164 -7.330 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -7.824 1.374 -5.896 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -8.043 -0.406 -8.797 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -6.386 -1.042 -8.668 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -7.482 -1.124 -7.268 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -8.713 3.539 -6.672 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -6.938 3.515 -6.800 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -7.938 3.302 -8.257 1.00 0.00 H new ATOM 963 N THR A 66 -4.182 -1.277 -7.159 1.00 0.00 N ATOM 964 CA THR A 66 -3.131 -2.144 -7.667 1.00 0.00 C ATOM 965 C THR A 66 -3.843 -3.239 -8.458 1.00 0.00 C ATOM 966 O THR A 66 -4.818 -3.785 -7.926 1.00 0.00 O ATOM 967 CB THR A 66 -2.352 -2.718 -6.465 1.00 0.00 C ATOM 968 OG1 THR A 66 -3.219 -3.445 -5.605 1.00 0.00 O ATOM 969 CG2 THR A 66 -1.715 -1.613 -5.617 1.00 0.00 C ATOM 0 H THR A 66 -4.881 -1.788 -6.621 1.00 0.00 H new ATOM 0 HA THR A 66 -2.415 -1.628 -8.306 1.00 0.00 H new ATOM 0 HB THR A 66 -1.579 -3.362 -6.885 1.00 0.00 H new ATOM 0 HG1 THR A 66 -4.001 -3.751 -6.111 1.00 0.00 H new ATOM 0 HG21 THR A 66 -1.176 -2.060 -4.782 1.00 0.00 H new ATOM 0 HG22 THR A 66 -1.021 -1.038 -6.230 1.00 0.00 H new ATOM 0 HG23 THR A 66 -2.494 -0.953 -5.235 1.00 0.00 H new ATOM 977 N ALA A 67 -3.418 -3.581 -9.683 1.00 0.00 N ATOM 978 CA ALA A 67 -4.046 -4.721 -10.353 1.00 0.00 C ATOM 979 C ALA A 67 -3.143 -5.368 -11.395 1.00 0.00 C ATOM 980 O ALA A 67 -2.556 -4.669 -12.227 1.00 0.00 O ATOM 981 CB ALA A 67 -5.354 -4.264 -11.004 1.00 0.00 C ATOM 0 H ALA A 67 -2.680 -3.110 -10.206 1.00 0.00 H new ATOM 0 HA ALA A 67 -4.241 -5.480 -9.595 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -5.826 -5.109 -11.505 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -6.025 -3.875 -10.238 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -5.144 -3.482 -11.733 1.00 0.00 H new ATOM 987 N GLY A 68 -3.145 -6.701 -11.432 1.00 0.00 N ATOM 988 CA GLY A 68 -2.496 -7.504 -12.458 1.00 0.00 C ATOM 989 C GLY A 68 -2.182 -8.902 -11.930 1.00 0.00 C ATOM 990 O GLY A 68 -2.238 -9.123 -10.717 1.00 0.00 O ATOM 0 H GLY A 68 -3.615 -7.265 -10.724 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -3.142 -7.577 -13.333 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.576 -7.017 -12.781 1.00 0.00 H new ATOM 994 N PRO A 69 -1.829 -9.857 -12.806 1.00 0.00 N ATOM 995 CA PRO A 69 -1.481 -11.199 -12.381 1.00 0.00 C ATOM 996 C PRO A 69 -0.161 -11.208 -11.629 1.00 0.00 C ATOM 997 O PRO A 69 0.729 -10.404 -11.926 1.00 0.00 O ATOM 998 CB PRO A 69 -1.438 -12.047 -13.655 1.00 0.00 C ATOM 999 CG PRO A 69 -1.049 -11.026 -14.719 1.00 0.00 C ATOM 1000 CD PRO A 69 -1.769 -9.757 -14.253 1.00 0.00 C ATOM 0 HA PRO A 69 -2.211 -11.605 -11.681 1.00 0.00 H new ATOM 0 HB2 PRO A 69 -0.709 -12.854 -13.581 1.00 0.00 H new ATOM 0 HB3 PRO A 69 -2.402 -12.508 -13.868 1.00 0.00 H new ATOM 0 HG2 PRO A 69 0.031 -10.884 -14.767 1.00 0.00 H new ATOM 0 HG3 PRO A 69 -1.375 -11.334 -15.713 1.00 0.00 H new ATOM 0 HD2 PRO A 69 -1.229 -8.862 -14.563 1.00 0.00 H new ATOM 0 HD3 PRO A 69 -2.768 -9.691 -14.684 1.00 0.00 H new ATOM 1008 N ALA A 70 -0.032 -12.152 -10.691 1.00 0.00 N ATOM 1009 CA ALA A 70 1.228 -12.408 -9.991 1.00 0.00 C ATOM 1010 C ALA A 70 1.658 -13.861 -10.134 1.00 0.00 C ATOM 1011 O ALA A 70 0.936 -14.677 -10.711 1.00 0.00 O ATOM 1012 CB ALA A 70 1.101 -12.029 -8.520 1.00 0.00 C ATOM 0 H ALA A 70 -0.798 -12.758 -10.397 1.00 0.00 H new ATOM 0 HA ALA A 70 1.999 -11.789 -10.449 1.00 0.00 H new ATOM 0 HB1 ALA A 70 2.045 -12.224 -8.011 1.00 0.00 H new ATOM 0 HB2 ALA A 70 0.856 -10.970 -8.437 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.311 -12.621 -8.059 1.00 0.00 H new ATOM 1018 N TYR A 71 2.831 -14.201 -9.599 1.00 0.00 N ATOM 1019 CA TYR A 71 3.389 -15.533 -9.739 1.00 0.00 C ATOM 1020 C TYR A 71 2.904 -16.412 -8.593 1.00 0.00 C ATOM 1021 O TYR A 71 3.393 -16.285 -7.467 1.00 0.00 O ATOM 1022 CB TYR A 71 4.923 -15.452 -9.805 1.00 0.00 C ATOM 1023 CG TYR A 71 5.479 -15.239 -11.203 1.00 0.00 C ATOM 1024 CD1 TYR A 71 5.038 -14.169 -11.999 1.00 0.00 C ATOM 1025 CD2 TYR A 71 6.397 -16.156 -11.746 1.00 0.00 C ATOM 1026 CE1 TYR A 71 5.475 -14.038 -13.326 1.00 0.00 C ATOM 1027 CE2 TYR A 71 6.834 -16.037 -13.077 1.00 0.00 C ATOM 1028 CZ TYR A 71 6.369 -14.977 -13.881 1.00 0.00 C ATOM 1029 OH TYR A 71 6.771 -14.858 -15.174 1.00 0.00 O ATOM 0 H TYR A 71 3.413 -13.560 -9.060 1.00 0.00 H new ATOM 0 HA TYR A 71 3.049 -15.988 -10.669 1.00 0.00 H new ATOM 0 HB2 TYR A 71 5.260 -14.637 -9.165 1.00 0.00 H new ATOM 0 HB3 TYR A 71 5.342 -16.372 -9.397 1.00 0.00 H new ATOM 0 HD1 TYR A 71 4.356 -13.440 -11.586 1.00 0.00 H new ATOM 0 HD2 TYR A 71 6.771 -16.962 -11.132 1.00 0.00 H new ATOM 0 HE1 TYR A 71 5.124 -13.212 -13.927 1.00 0.00 H new ATOM 0 HE2 TYR A 71 7.527 -16.759 -13.484 1.00 0.00 H new ATOM 0 HH TYR A 71 7.387 -15.588 -15.393 1.00 0.00 H new ATOM 1039 N ARG A 72 1.996 -17.359 -8.876 1.00 0.00 N ATOM 1040 CA ARG A 72 2.013 -18.607 -8.116 1.00 0.00 C ATOM 1041 C ARG A 72 3.321 -19.301 -8.475 1.00 0.00 C ATOM 1042 O ARG A 72 3.398 -20.036 -9.457 1.00 0.00 O ATOM 1043 CB ARG A 72 0.782 -19.519 -8.341 1.00 0.00 C ATOM 1044 CG ARG A 72 0.358 -19.811 -9.800 1.00 0.00 C ATOM 1045 CD ARG A 72 0.116 -21.307 -10.080 1.00 0.00 C ATOM 1046 NE ARG A 72 -1.022 -21.870 -9.323 1.00 0.00 N ATOM 1047 CZ ARG A 72 -1.698 -22.986 -9.625 1.00 0.00 C ATOM 1048 NH1 ARG A 72 -1.349 -23.750 -10.652 1.00 0.00 N ATOM 1049 NH2 ARG A 72 -2.741 -23.336 -8.891 1.00 0.00 N ATOM 0 H ARG A 72 1.274 -17.288 -9.593 1.00 0.00 H new ATOM 0 HA ARG A 72 1.952 -18.382 -7.051 1.00 0.00 H new ATOM 0 HB2 ARG A 72 0.978 -20.473 -7.852 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -0.068 -19.067 -7.829 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -0.553 -19.255 -10.024 1.00 0.00 H new ATOM 0 HG3 ARG A 72 1.130 -19.443 -10.475 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -0.063 -21.445 -11.146 1.00 0.00 H new ATOM 0 HD3 ARG A 72 1.019 -21.866 -9.833 1.00 0.00 H new ATOM 0 HE ARG A 72 -1.321 -21.360 -8.492 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -0.550 -23.492 -11.231 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -1.880 -24.595 -10.862 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -3.026 -22.757 -8.101 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -3.261 -24.185 -9.115 1.00 0.00 H new ATOM 1063 N ILE A 73 4.374 -19.027 -7.717 1.00 0.00 N ATOM 1064 CA ILE A 73 5.448 -19.979 -7.524 1.00 0.00 C ATOM 1065 C ILE A 73 4.803 -21.117 -6.725 1.00 0.00 C ATOM 1066 O ILE A 73 3.846 -20.877 -5.976 1.00 0.00 O ATOM 1067 CB ILE A 73 6.588 -19.304 -6.731 1.00 0.00 C ATOM 1068 CG1 ILE A 73 7.092 -17.962 -7.315 1.00 0.00 C ATOM 1069 CG2 ILE A 73 7.778 -20.252 -6.496 1.00 0.00 C ATOM 1070 CD1 ILE A 73 7.793 -18.075 -8.670 1.00 0.00 C ATOM 0 H ILE A 73 4.503 -18.144 -7.224 1.00 0.00 H new ATOM 0 HA ILE A 73 5.885 -20.342 -8.454 1.00 0.00 H new ATOM 0 HB ILE A 73 6.122 -19.063 -5.776 1.00 0.00 H new ATOM 0 HG12 ILE A 73 6.244 -17.285 -7.416 1.00 0.00 H new ATOM 0 HG13 ILE A 73 7.780 -17.507 -6.602 1.00 0.00 H new ATOM 0 HG21 ILE A 73 8.553 -19.731 -5.934 1.00 0.00 H new ATOM 0 HG22 ILE A 73 7.444 -21.122 -5.931 1.00 0.00 H new ATOM 0 HG23 ILE A 73 8.181 -20.575 -7.456 1.00 0.00 H new ATOM 0 HD11 ILE A 73 8.111 -17.086 -8.999 1.00 0.00 H new ATOM 0 HD12 ILE A 73 8.664 -18.723 -8.576 1.00 0.00 H new ATOM 0 HD13 ILE A 73 7.104 -18.497 -9.402 1.00 0.00 H new ATOM 1082 N ASN A 74 5.323 -22.335 -6.862 1.00 0.00 N ATOM 1083 CA ASN A 74 4.929 -23.441 -5.998 1.00 0.00 C ATOM 1084 C ASN A 74 5.515 -23.189 -4.611 1.00 0.00 C ATOM 1085 O ASN A 74 4.876 -22.526 -3.799 1.00 0.00 O ATOM 1086 CB ASN A 74 5.316 -24.809 -6.588 1.00 0.00 C ATOM 1087 CG ASN A 74 4.299 -25.231 -7.640 1.00 0.00 C ATOM 1088 OD1 ASN A 74 4.352 -24.775 -8.779 1.00 0.00 O ATOM 1089 ND2 ASN A 74 3.351 -26.082 -7.291 1.00 0.00 N ATOM 0 H ASN A 74 6.020 -22.579 -7.566 1.00 0.00 H new ATOM 0 HA ASN A 74 3.843 -23.483 -5.917 1.00 0.00 H new ATOM 0 HB2 ASN A 74 6.310 -24.754 -7.033 1.00 0.00 H new ATOM 0 HB3 ASN A 74 5.362 -25.556 -5.795 1.00 0.00 H new ATOM 0 HD21 ASN A 74 2.648 -26.370 -7.972 1.00 0.00 H new ATOM 0 HD22 ASN A 74 3.322 -26.451 -6.341 1.00 0.00 H new ATOM 1096 N ASP A 75 6.730 -23.668 -4.328 1.00 0.00 N ATOM 1097 CA ASP A 75 7.252 -23.698 -2.963 1.00 0.00 C ATOM 1098 C ASP A 75 8.764 -23.506 -3.025 1.00 0.00 C ATOM 1099 O ASP A 75 9.523 -24.470 -3.127 1.00 0.00 O ATOM 1100 CB ASP A 75 6.802 -24.986 -2.249 1.00 0.00 C ATOM 1101 CG ASP A 75 6.356 -24.698 -0.817 1.00 0.00 C ATOM 1102 OD1 ASP A 75 5.377 -23.934 -0.624 1.00 0.00 O ATOM 1103 OD2 ASP A 75 6.917 -25.290 0.130 1.00 0.00 O ATOM 0 H ASP A 75 7.370 -24.041 -5.029 1.00 0.00 H new ATOM 0 HA ASP A 75 6.849 -22.884 -2.360 1.00 0.00 H new ATOM 0 HB2 ASP A 75 5.982 -25.444 -2.803 1.00 0.00 H new ATOM 0 HB3 ASP A 75 7.621 -25.705 -2.240 1.00 0.00 H new ATOM 1108 N TRP A 76 9.174 -22.242 -3.092 1.00 0.00 N ATOM 1109 CA TRP A 76 10.548 -21.740 -3.161 1.00 0.00 C ATOM 1110 C TRP A 76 10.512 -20.282 -2.697 1.00 0.00 C ATOM 1111 O TRP A 76 11.227 -19.878 -1.785 1.00 0.00 O ATOM 1112 CB TRP A 76 11.104 -21.819 -4.593 1.00 0.00 C ATOM 1113 CG TRP A 76 11.452 -23.181 -5.113 1.00 0.00 C ATOM 1114 CD1 TRP A 76 10.771 -23.862 -6.060 1.00 0.00 C ATOM 1115 CD2 TRP A 76 12.592 -24.027 -4.768 1.00 0.00 C ATOM 1116 NE1 TRP A 76 11.404 -25.059 -6.325 1.00 0.00 N ATOM 1117 CE2 TRP A 76 12.549 -25.202 -5.575 1.00 0.00 C ATOM 1118 CE3 TRP A 76 13.669 -23.921 -3.866 1.00 0.00 C ATOM 1119 CZ2 TRP A 76 13.539 -26.195 -5.513 1.00 0.00 C ATOM 1120 CZ3 TRP A 76 14.672 -24.907 -3.802 1.00 0.00 C ATOM 1121 CH2 TRP A 76 14.624 -26.034 -4.638 1.00 0.00 C ATOM 0 H TRP A 76 8.499 -21.477 -3.100 1.00 0.00 H new ATOM 0 HA TRP A 76 11.199 -22.346 -2.531 1.00 0.00 H new ATOM 0 HB2 TRP A 76 10.370 -21.377 -5.266 1.00 0.00 H new ATOM 0 HB3 TRP A 76 11.998 -21.198 -4.644 1.00 0.00 H new ATOM 0 HD1 TRP A 76 9.865 -23.520 -6.539 1.00 0.00 H new ATOM 0 HE1 TRP A 76 11.066 -25.751 -6.993 1.00 0.00 H new ATOM 0 HE3 TRP A 76 13.726 -23.065 -3.210 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 13.466 -27.076 -6.134 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 15.487 -24.795 -3.102 1.00 0.00 H new ATOM 0 HH2 TRP A 76 15.414 -26.770 -4.608 1.00 0.00 H new ATOM 1132 N ALA A 77 9.617 -19.504 -3.305 1.00 0.00 N ATOM 1133 CA ALA A 77 9.248 -18.148 -2.920 1.00 0.00 C ATOM 1134 C ALA A 77 7.767 -17.964 -3.248 1.00 0.00 C ATOM 1135 O ALA A 77 7.098 -18.933 -3.610 1.00 0.00 O ATOM 1136 CB ALA A 77 10.108 -17.135 -3.690 1.00 0.00 C ATOM 0 H ALA A 77 9.103 -19.824 -4.126 1.00 0.00 H new ATOM 0 HA ALA A 77 9.417 -17.984 -1.856 1.00 0.00 H new ATOM 0 HB1 ALA A 77 9.827 -16.123 -3.398 1.00 0.00 H new ATOM 0 HB2 ALA A 77 11.160 -17.301 -3.459 1.00 0.00 H new ATOM 0 HB3 ALA A 77 9.948 -17.261 -4.761 1.00 0.00 H new ATOM 1142 N SER A 78 7.263 -16.738 -3.181 1.00 0.00 N ATOM 1143 CA SER A 78 6.162 -16.258 -4.002 1.00 0.00 C ATOM 1144 C SER A 78 6.420 -14.762 -4.201 1.00 0.00 C ATOM 1145 O SER A 78 6.869 -14.102 -3.256 1.00 0.00 O ATOM 1146 CB SER A 78 4.806 -16.606 -3.365 1.00 0.00 C ATOM 1147 OG SER A 78 4.764 -16.379 -1.963 1.00 0.00 O ATOM 0 H SER A 78 7.619 -16.032 -2.536 1.00 0.00 H new ATOM 0 HA SER A 78 6.112 -16.742 -4.977 1.00 0.00 H new ATOM 0 HB2 SER A 78 4.026 -16.015 -3.844 1.00 0.00 H new ATOM 0 HB3 SER A 78 4.579 -17.654 -3.563 1.00 0.00 H new ATOM 0 HG SER A 78 3.878 -16.617 -1.619 1.00 0.00 H new ATOM 1153 N ILE A 79 6.204 -14.228 -5.407 1.00 0.00 N ATOM 1154 CA ILE A 79 6.540 -12.840 -5.718 1.00 0.00 C ATOM 1155 C ILE A 79 5.405 -12.200 -6.516 1.00 0.00 C ATOM 1156 O ILE A 79 4.627 -12.891 -7.184 1.00 0.00 O ATOM 1157 CB ILE A 79 7.936 -12.696 -6.398 1.00 0.00 C ATOM 1158 CG1 ILE A 79 7.989 -12.836 -7.938 1.00 0.00 C ATOM 1159 CG2 ILE A 79 9.016 -13.599 -5.762 1.00 0.00 C ATOM 1160 CD1 ILE A 79 7.908 -14.268 -8.465 1.00 0.00 C ATOM 0 H ILE A 79 5.795 -14.742 -6.187 1.00 0.00 H new ATOM 0 HA ILE A 79 6.637 -12.290 -4.782 1.00 0.00 H new ATOM 0 HB ILE A 79 8.157 -11.648 -6.196 1.00 0.00 H new ATOM 0 HG12 ILE A 79 7.169 -12.261 -8.367 1.00 0.00 H new ATOM 0 HG13 ILE A 79 8.915 -12.386 -8.296 1.00 0.00 H new ATOM 0 HG21 ILE A 79 9.964 -13.452 -6.280 1.00 0.00 H new ATOM 0 HG22 ILE A 79 9.133 -13.340 -4.710 1.00 0.00 H new ATOM 0 HG23 ILE A 79 8.714 -14.643 -5.847 1.00 0.00 H new ATOM 0 HD11 ILE A 79 7.953 -14.258 -9.554 1.00 0.00 H new ATOM 0 HD12 ILE A 79 8.743 -14.848 -8.072 1.00 0.00 H new ATOM 0 HD13 ILE A 79 6.970 -14.721 -8.145 1.00 0.00 H new ATOM 1172 N TYR A 80 5.343 -10.870 -6.478 1.00 0.00 N ATOM 1173 CA TYR A 80 4.442 -10.066 -7.287 1.00 0.00 C ATOM 1174 C TYR A 80 5.218 -8.853 -7.797 1.00 0.00 C ATOM 1175 O TYR A 80 6.289 -8.518 -7.283 1.00 0.00 O ATOM 1176 CB TYR A 80 3.186 -9.629 -6.497 1.00 0.00 C ATOM 1177 CG TYR A 80 2.982 -10.229 -5.115 1.00 0.00 C ATOM 1178 CD1 TYR A 80 2.327 -11.464 -4.960 1.00 0.00 C ATOM 1179 CD2 TYR A 80 3.456 -9.552 -3.976 1.00 0.00 C ATOM 1180 CE1 TYR A 80 2.123 -11.999 -3.678 1.00 0.00 C ATOM 1181 CE2 TYR A 80 3.237 -10.069 -2.691 1.00 0.00 C ATOM 1182 CZ TYR A 80 2.545 -11.287 -2.537 1.00 0.00 C ATOM 1183 OH TYR A 80 2.327 -11.794 -1.297 1.00 0.00 O ATOM 0 H TYR A 80 5.936 -10.311 -5.865 1.00 0.00 H new ATOM 0 HA TYR A 80 4.081 -10.664 -8.124 1.00 0.00 H new ATOM 0 HB2 TYR A 80 3.215 -8.544 -6.392 1.00 0.00 H new ATOM 0 HB3 TYR A 80 2.310 -9.867 -7.100 1.00 0.00 H new ATOM 0 HD1 TYR A 80 1.980 -12.002 -5.830 1.00 0.00 H new ATOM 0 HD2 TYR A 80 3.995 -8.623 -4.093 1.00 0.00 H new ATOM 0 HE1 TYR A 80 1.641 -12.959 -3.566 1.00 0.00 H new ATOM 0 HE2 TYR A 80 3.597 -9.536 -1.823 1.00 0.00 H new ATOM 0 HH TYR A 80 3.035 -11.491 -0.691 1.00 0.00 H new ATOM 1193 N GLY A 81 4.642 -8.182 -8.782 1.00 0.00 N ATOM 1194 CA GLY A 81 5.104 -6.963 -9.411 1.00 0.00 C ATOM 1195 C GLY A 81 3.871 -6.362 -10.065 1.00 0.00 C ATOM 1196 O GLY A 81 3.363 -6.928 -11.035 1.00 0.00 O ATOM 0 H GLY A 81 3.767 -8.507 -9.193 1.00 0.00 H new ATOM 0 HA2 GLY A 81 5.534 -6.280 -8.678 1.00 0.00 H new ATOM 0 HA3 GLY A 81 5.880 -7.170 -10.148 1.00 0.00 H new ATOM 1200 N VAL A 82 3.317 -5.317 -9.464 1.00 0.00 N ATOM 1201 CA VAL A 82 2.088 -4.655 -9.892 1.00 0.00 C ATOM 1202 C VAL A 82 2.370 -3.157 -10.092 1.00 0.00 C ATOM 1203 O VAL A 82 3.523 -2.716 -10.031 1.00 0.00 O ATOM 1204 CB VAL A 82 0.906 -4.996 -8.939 1.00 0.00 C ATOM 1205 CG1 VAL A 82 0.169 -6.249 -9.431 1.00 0.00 C ATOM 1206 CG2 VAL A 82 1.291 -5.236 -7.466 1.00 0.00 C ATOM 0 H VAL A 82 3.726 -4.890 -8.633 1.00 0.00 H new ATOM 0 HA VAL A 82 1.757 -5.032 -10.860 1.00 0.00 H new ATOM 0 HB VAL A 82 0.280 -4.104 -8.966 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -0.655 -6.475 -8.755 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.222 -6.071 -10.433 1.00 0.00 H new ATOM 0 HG13 VAL A 82 0.860 -7.092 -9.456 1.00 0.00 H new ATOM 0 HG21 VAL A 82 0.395 -5.466 -6.889 1.00 0.00 H new ATOM 0 HG22 VAL A 82 1.988 -6.072 -7.404 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.763 -4.340 -7.063 1.00 0.00 H new ATOM 1216 N VAL A 83 1.340 -2.390 -10.448 1.00 0.00 N ATOM 1217 CA VAL A 83 1.430 -0.982 -10.789 1.00 0.00 C ATOM 1218 C VAL A 83 0.316 -0.284 -10.022 1.00 0.00 C ATOM 1219 O VAL A 83 -0.845 -0.712 -10.100 1.00 0.00 O ATOM 1220 CB VAL A 83 1.271 -0.759 -12.312 1.00 0.00 C ATOM 1221 CG1 VAL A 83 1.950 0.554 -12.723 1.00 0.00 C ATOM 1222 CG2 VAL A 83 1.801 -1.909 -13.183 1.00 0.00 C ATOM 0 H VAL A 83 0.388 -2.751 -10.507 1.00 0.00 H new ATOM 0 HA VAL A 83 2.408 -0.581 -10.521 1.00 0.00 H new ATOM 0 HB VAL A 83 0.197 -0.715 -12.493 1.00 0.00 H new ATOM 0 HG11 VAL A 83 1.833 0.703 -13.796 1.00 0.00 H new ATOM 0 HG12 VAL A 83 1.489 1.385 -12.189 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.011 0.508 -12.476 1.00 0.00 H new ATOM 0 HG21 VAL A 83 1.649 -1.668 -14.235 1.00 0.00 H new ATOM 0 HG22 VAL A 83 2.865 -2.049 -12.993 1.00 0.00 H new ATOM 0 HG23 VAL A 83 1.265 -2.827 -12.940 1.00 0.00 H new ATOM 1232 N GLY A 84 0.661 0.803 -9.339 1.00 0.00 N ATOM 1233 CA GLY A 84 -0.253 1.572 -8.521 1.00 0.00 C ATOM 1234 C GLY A 84 -0.124 3.066 -8.780 1.00 0.00 C ATOM 1235 O GLY A 84 0.666 3.528 -9.607 1.00 0.00 O ATOM 0 H GLY A 84 1.610 1.178 -9.343 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -1.276 1.255 -8.723 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -0.058 1.368 -7.468 1.00 0.00 H new ATOM 1239 N VAL A 85 -0.922 3.833 -8.047 1.00 0.00 N ATOM 1240 CA VAL A 85 -1.172 5.247 -8.270 1.00 0.00 C ATOM 1241 C VAL A 85 -1.269 5.931 -6.905 1.00 0.00 C ATOM 1242 O VAL A 85 -1.604 5.282 -5.908 1.00 0.00 O ATOM 1243 CB VAL A 85 -2.438 5.386 -9.146 1.00 0.00 C ATOM 1244 CG1 VAL A 85 -3.725 5.012 -8.405 1.00 0.00 C ATOM 1245 CG2 VAL A 85 -2.609 6.797 -9.701 1.00 0.00 C ATOM 0 H VAL A 85 -1.435 3.467 -7.245 1.00 0.00 H new ATOM 0 HA VAL A 85 -0.367 5.741 -8.813 1.00 0.00 H new ATOM 0 HB VAL A 85 -2.279 4.683 -9.964 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -4.577 5.131 -9.074 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -3.666 3.975 -8.073 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -3.849 5.663 -7.540 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -3.512 6.842 -10.309 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.691 7.505 -8.876 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.746 7.054 -10.315 1.00 0.00 H new ATOM 1255 N GLY A 86 -0.921 7.214 -6.828 1.00 0.00 N ATOM 1256 CA GLY A 86 -1.334 8.076 -5.730 1.00 0.00 C ATOM 1257 C GLY A 86 -1.932 9.345 -6.320 1.00 0.00 C ATOM 1258 O GLY A 86 -1.613 9.714 -7.451 1.00 0.00 O ATOM 0 H GLY A 86 -0.344 7.682 -7.527 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -2.066 7.567 -5.102 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -0.482 8.317 -5.095 1.00 0.00 H new ATOM 1262 N TYR A 87 -2.754 10.044 -5.552 1.00 0.00 N ATOM 1263 CA TYR A 87 -3.387 11.298 -5.917 1.00 0.00 C ATOM 1264 C TYR A 87 -3.435 12.128 -4.639 1.00 0.00 C ATOM 1265 O TYR A 87 -4.052 11.703 -3.662 1.00 0.00 O ATOM 1266 CB TYR A 87 -4.787 10.983 -6.464 1.00 0.00 C ATOM 1267 CG TYR A 87 -5.495 12.140 -7.136 1.00 0.00 C ATOM 1268 CD1 TYR A 87 -6.180 13.102 -6.370 1.00 0.00 C ATOM 1269 CD2 TYR A 87 -5.519 12.219 -8.541 1.00 0.00 C ATOM 1270 CE1 TYR A 87 -6.899 14.132 -7.005 1.00 0.00 C ATOM 1271 CE2 TYR A 87 -6.234 13.245 -9.177 1.00 0.00 C ATOM 1272 CZ TYR A 87 -6.939 14.199 -8.415 1.00 0.00 C ATOM 1273 OH TYR A 87 -7.666 15.153 -9.058 1.00 0.00 O ATOM 0 H TYR A 87 -3.008 9.736 -4.614 1.00 0.00 H new ATOM 0 HA TYR A 87 -2.853 11.851 -6.690 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -4.704 10.165 -7.179 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -5.408 10.626 -5.642 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -6.154 13.050 -5.292 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -4.986 11.488 -9.131 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -7.420 14.871 -6.414 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -6.244 13.304 -10.255 1.00 0.00 H new ATOM 0 HH TYR A 87 -7.570 15.040 -10.027 1.00 0.00 H new ATOM 1283 N GLY A 88 -2.755 13.273 -4.603 1.00 0.00 N ATOM 1284 CA GLY A 88 -2.787 14.125 -3.430 1.00 0.00 C ATOM 1285 C GLY A 88 -4.070 14.944 -3.426 1.00 0.00 C ATOM 1286 O GLY A 88 -4.630 15.258 -4.479 1.00 0.00 O ATOM 0 H GLY A 88 -2.181 13.624 -5.370 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -2.729 13.518 -2.526 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -1.921 14.787 -3.426 1.00 0.00 H new ATOM 1290 N LYS A 89 -4.537 15.313 -2.236 1.00 0.00 N ATOM 1291 CA LYS A 89 -5.811 15.985 -2.053 1.00 0.00 C ATOM 1292 C LYS A 89 -5.651 16.951 -0.895 1.00 0.00 C ATOM 1293 O LYS A 89 -5.707 16.540 0.263 1.00 0.00 O ATOM 1294 CB LYS A 89 -6.909 14.932 -1.820 1.00 0.00 C ATOM 1295 CG LYS A 89 -8.311 15.463 -2.142 1.00 0.00 C ATOM 1296 CD LYS A 89 -8.596 15.420 -3.651 1.00 0.00 C ATOM 1297 CE LYS A 89 -9.973 16.041 -3.895 1.00 0.00 C ATOM 1298 NZ LYS A 89 -10.256 16.332 -5.315 1.00 0.00 N ATOM 0 H LYS A 89 -4.032 15.150 -1.365 1.00 0.00 H new ATOM 0 HA LYS A 89 -6.112 16.554 -2.933 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -6.705 14.057 -2.437 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -6.878 14.604 -0.781 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -9.056 14.870 -1.613 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -8.405 16.488 -1.782 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -7.829 15.968 -4.198 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -8.573 14.392 -4.013 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -10.738 15.365 -3.514 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -10.050 16.965 -3.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -11.204 16.750 -5.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -9.548 17.001 -5.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -10.215 15.450 -5.865 1.00 0.00 H new ATOM 1312 N PHE A 90 -5.378 18.214 -1.216 1.00 0.00 N ATOM 1313 CA PHE A 90 -5.203 19.268 -0.230 1.00 0.00 C ATOM 1314 C PHE A 90 -6.449 19.388 0.647 1.00 0.00 C ATOM 1315 O PHE A 90 -7.564 19.406 0.129 1.00 0.00 O ATOM 1316 CB PHE A 90 -4.901 20.605 -0.935 1.00 0.00 C ATOM 1317 CG PHE A 90 -5.822 20.972 -2.092 1.00 0.00 C ATOM 1318 CD1 PHE A 90 -5.515 20.540 -3.398 1.00 0.00 C ATOM 1319 CD2 PHE A 90 -6.992 21.727 -1.873 1.00 0.00 C ATOM 1320 CE1 PHE A 90 -6.389 20.821 -4.461 1.00 0.00 C ATOM 1321 CE2 PHE A 90 -7.856 22.024 -2.942 1.00 0.00 C ATOM 1322 CZ PHE A 90 -7.564 21.557 -4.235 1.00 0.00 C ATOM 0 H PHE A 90 -5.272 18.533 -2.179 1.00 0.00 H new ATOM 0 HA PHE A 90 -4.359 19.016 0.411 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -4.946 21.403 -0.193 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -3.877 20.574 -1.307 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -4.604 19.990 -3.582 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -7.226 22.079 -0.879 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -6.157 20.470 -5.456 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -8.745 22.612 -2.769 1.00 0.00 H new ATOM 0 HZ PHE A 90 -8.240 21.763 -5.052 1.00 0.00 H new ATOM 1332 N GLN A 91 -6.253 19.555 1.957 1.00 0.00 N ATOM 1333 CA GLN A 91 -7.309 19.893 2.905 1.00 0.00 C ATOM 1334 C GLN A 91 -6.978 21.240 3.572 1.00 0.00 C ATOM 1335 O GLN A 91 -6.821 21.346 4.788 1.00 0.00 O ATOM 1336 CB GLN A 91 -7.573 18.717 3.870 1.00 0.00 C ATOM 1337 CG GLN A 91 -8.989 18.805 4.459 1.00 0.00 C ATOM 1338 CD GLN A 91 -9.344 17.683 5.440 1.00 0.00 C ATOM 1339 OE1 GLN A 91 -9.108 16.503 5.189 1.00 0.00 O ATOM 1340 NE2 GLN A 91 -9.946 18.019 6.569 1.00 0.00 N ATOM 0 H GLN A 91 -5.337 19.456 2.394 1.00 0.00 H new ATOM 0 HA GLN A 91 -8.263 20.040 2.398 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -7.452 17.772 3.341 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -6.838 18.728 4.675 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -9.097 19.763 4.968 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -9.709 18.796 3.641 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -10.139 19.000 6.772 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -10.217 17.297 7.237 1.00 0.00 H new ATOM 1349 N THR A 92 -6.921 22.285 2.748 1.00 0.00 N ATOM 1350 CA THR A 92 -6.732 23.692 3.034 1.00 0.00 C ATOM 1351 C THR A 92 -7.974 24.142 3.811 1.00 0.00 C ATOM 1352 O THR A 92 -9.078 24.151 3.258 1.00 0.00 O ATOM 1353 CB THR A 92 -6.628 24.355 1.641 1.00 0.00 C ATOM 1354 OG1 THR A 92 -5.448 23.900 0.990 1.00 0.00 O ATOM 1355 CG2 THR A 92 -6.681 25.881 1.584 1.00 0.00 C ATOM 0 H THR A 92 -7.019 22.138 1.743 1.00 0.00 H new ATOM 0 HA THR A 92 -5.854 23.943 3.629 1.00 0.00 H new ATOM 0 HB THR A 92 -7.540 24.042 1.132 1.00 0.00 H new ATOM 0 HG1 THR A 92 -5.380 24.317 0.106 1.00 0.00 H new ATOM 0 HG21 THR A 92 -6.597 26.210 0.548 1.00 0.00 H new ATOM 0 HG22 THR A 92 -7.627 26.228 1.999 1.00 0.00 H new ATOM 0 HG23 THR A 92 -5.856 26.296 2.164 1.00 0.00 H new ATOM 1363 N THR A 93 -7.803 24.375 5.114 1.00 0.00 N ATOM 1364 CA THR A 93 -8.912 24.608 6.050 1.00 0.00 C ATOM 1365 C THR A 93 -8.567 25.625 7.160 1.00 0.00 C ATOM 1366 O THR A 93 -9.268 25.680 8.174 1.00 0.00 O ATOM 1367 CB THR A 93 -9.415 23.265 6.640 1.00 0.00 C ATOM 1368 OG1 THR A 93 -9.266 22.168 5.752 1.00 0.00 O ATOM 1369 CG2 THR A 93 -10.900 23.302 6.998 1.00 0.00 C ATOM 0 H THR A 93 -6.884 24.408 5.556 1.00 0.00 H new ATOM 0 HA THR A 93 -9.721 25.061 5.478 1.00 0.00 H new ATOM 0 HB THR A 93 -8.793 23.131 7.525 1.00 0.00 H new ATOM 0 HG1 THR A 93 -8.313 21.999 5.598 1.00 0.00 H new ATOM 0 HG21 THR A 93 -11.200 22.337 7.407 1.00 0.00 H new ATOM 0 HG22 THR A 93 -11.076 24.081 7.740 1.00 0.00 H new ATOM 0 HG23 THR A 93 -11.485 23.515 6.103 1.00 0.00 H new ATOM 1377 N GLU A 94 -7.506 26.425 7.017 1.00 0.00 N ATOM 1378 CA GLU A 94 -7.179 27.517 7.929 1.00 0.00 C ATOM 1379 C GLU A 94 -6.954 28.782 7.108 1.00 0.00 C ATOM 1380 O GLU A 94 -5.824 29.241 6.927 1.00 0.00 O ATOM 1381 CB GLU A 94 -6.036 27.150 8.891 1.00 0.00 C ATOM 1382 CG GLU A 94 -6.500 26.320 10.094 1.00 0.00 C ATOM 1383 CD GLU A 94 -7.215 27.115 11.191 1.00 0.00 C ATOM 1384 OE1 GLU A 94 -8.293 27.699 10.920 1.00 0.00 O ATOM 1385 OE2 GLU A 94 -6.713 27.066 12.339 1.00 0.00 O ATOM 0 H GLU A 94 -6.841 26.327 6.250 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.013 27.713 8.602 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -5.276 26.592 8.345 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -5.564 28.065 9.250 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -7.169 25.536 9.739 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -5.633 25.825 10.531 1.00 0.00 H new ATOM 1392 N TYR A 95 -8.089 29.333 6.657 1.00 0.00 N ATOM 1393 CA TYR A 95 -8.294 30.659 6.076 1.00 0.00 C ATOM 1394 C TYR A 95 -7.593 30.838 4.720 1.00 0.00 C ATOM 1395 O TYR A 95 -6.796 29.995 4.310 1.00 0.00 O ATOM 1396 CB TYR A 95 -7.930 31.719 7.137 1.00 0.00 C ATOM 1397 CG TYR A 95 -8.925 31.746 8.283 1.00 0.00 C ATOM 1398 CD1 TYR A 95 -10.118 32.485 8.162 1.00 0.00 C ATOM 1399 CD2 TYR A 95 -8.692 30.981 9.441 1.00 0.00 C ATOM 1400 CE1 TYR A 95 -11.076 32.453 9.191 1.00 0.00 C ATOM 1401 CE2 TYR A 95 -9.646 30.944 10.472 1.00 0.00 C ATOM 1402 CZ TYR A 95 -10.846 31.679 10.351 1.00 0.00 C ATOM 1403 OH TYR A 95 -11.793 31.629 11.327 1.00 0.00 O ATOM 0 H TYR A 95 -8.964 28.811 6.695 1.00 0.00 H new ATOM 0 HA TYR A 95 -9.345 30.790 5.820 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -6.934 31.513 7.528 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -7.891 32.702 6.668 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -10.297 33.077 7.277 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -7.775 30.419 9.538 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -11.989 33.021 9.095 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -9.462 30.353 11.357 1.00 0.00 H new ATOM 0 HH TYR A 95 -11.481 31.053 12.056 1.00 0.00 H new ATOM 1413 N PRO A 96 -7.849 31.927 3.970 1.00 0.00 N ATOM 1414 CA PRO A 96 -7.055 32.216 2.780 1.00 0.00 C ATOM 1415 C PRO A 96 -5.574 32.459 3.113 1.00 0.00 C ATOM 1416 O PRO A 96 -4.751 32.359 2.202 1.00 0.00 O ATOM 1417 CB PRO A 96 -7.715 33.429 2.116 1.00 0.00 C ATOM 1418 CG PRO A 96 -8.502 34.084 3.250 1.00 0.00 C ATOM 1419 CD PRO A 96 -8.934 32.890 4.098 1.00 0.00 C ATOM 0 HA PRO A 96 -7.042 31.363 2.101 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -6.973 34.110 1.699 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -8.369 33.130 1.297 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -7.887 34.782 3.818 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -9.358 34.645 2.876 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -9.086 33.178 5.138 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -9.876 32.473 3.742 1.00 0.00 H new ATOM 1427 N THR A 97 -5.257 32.743 4.381 1.00 0.00 N ATOM 1428 CA THR A 97 -3.948 33.033 4.942 1.00 0.00 C ATOM 1429 C THR A 97 -2.894 32.028 4.483 1.00 0.00 C ATOM 1430 O THR A 97 -1.871 32.451 3.943 1.00 0.00 O ATOM 1431 CB THR A 97 -4.082 33.056 6.478 1.00 0.00 C ATOM 1432 OG1 THR A 97 -5.251 33.774 6.844 1.00 0.00 O ATOM 1433 CG2 THR A 97 -2.873 33.708 7.153 1.00 0.00 C ATOM 0 H THR A 97 -5.981 32.777 5.099 1.00 0.00 H new ATOM 0 HA THR A 97 -3.605 34.004 4.585 1.00 0.00 H new ATOM 0 HB THR A 97 -4.142 32.021 6.814 1.00 0.00 H new ATOM 0 HG1 THR A 97 -5.335 33.786 7.820 1.00 0.00 H new ATOM 0 HG21 THR A 97 -3.012 33.701 8.234 1.00 0.00 H new ATOM 0 HG22 THR A 97 -1.971 33.151 6.900 1.00 0.00 H new ATOM 0 HG23 THR A 97 -2.774 34.737 6.806 1.00 0.00 H new ATOM 1441 N TYR A 98 -3.127 30.723 4.661 1.00 0.00 N ATOM 1442 CA TYR A 98 -2.223 29.715 4.136 1.00 0.00 C ATOM 1443 C TYR A 98 -3.029 28.517 3.658 1.00 0.00 C ATOM 1444 O TYR A 98 -4.254 28.472 3.795 1.00 0.00 O ATOM 1445 CB TYR A 98 -1.128 29.352 5.156 1.00 0.00 C ATOM 1446 CG TYR A 98 0.211 29.120 4.482 1.00 0.00 C ATOM 1447 CD1 TYR A 98 0.894 30.218 3.926 1.00 0.00 C ATOM 1448 CD2 TYR A 98 0.746 27.824 4.352 1.00 0.00 C ATOM 1449 CE1 TYR A 98 2.092 30.025 3.219 1.00 0.00 C ATOM 1450 CE2 TYR A 98 1.941 27.621 3.637 1.00 0.00 C ATOM 1451 CZ TYR A 98 2.614 28.723 3.063 1.00 0.00 C ATOM 1452 OH TYR A 98 3.743 28.560 2.322 1.00 0.00 O ATOM 0 H TYR A 98 -3.932 30.349 5.163 1.00 0.00 H new ATOM 0 HA TYR A 98 -1.687 30.115 3.275 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -1.033 30.153 5.889 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -1.421 28.455 5.701 1.00 0.00 H new ATOM 0 HD1 TYR A 98 0.495 31.214 4.044 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.238 26.984 4.802 1.00 0.00 H new ATOM 0 HE1 TYR A 98 2.613 30.871 2.796 1.00 0.00 H new ATOM 0 HE2 TYR A 98 2.343 26.625 3.527 1.00 0.00 H new ATOM 0 HH TYR A 98 3.987 27.611 2.302 1.00 0.00 H new ATOM 1462 N LYS A 99 -2.355 27.584 2.996 1.00 0.00 N ATOM 1463 CA LYS A 99 -2.979 26.464 2.304 1.00 0.00 C ATOM 1464 C LYS A 99 -2.067 25.263 2.476 1.00 0.00 C ATOM 1465 O LYS A 99 -0.926 25.432 2.908 1.00 0.00 O ATOM 1466 CB LYS A 99 -3.209 26.815 0.816 1.00 0.00 C ATOM 1467 CG LYS A 99 -3.777 28.234 0.598 1.00 0.00 C ATOM 1468 CD LYS A 99 -4.239 28.511 -0.834 1.00 0.00 C ATOM 1469 CE LYS A 99 -4.358 30.018 -1.121 1.00 0.00 C ATOM 1470 NZ LYS A 99 -5.104 30.779 -0.093 1.00 0.00 N ATOM 0 H LYS A 99 -1.338 27.586 2.924 1.00 0.00 H new ATOM 0 HA LYS A 99 -3.960 26.236 2.721 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -2.265 26.724 0.279 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -3.894 26.087 0.381 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.618 28.385 1.275 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -3.015 28.964 0.870 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -3.535 28.063 -1.535 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -5.204 28.033 -1.002 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -3.356 30.439 -1.211 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -4.849 30.154 -2.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -5.656 31.532 -0.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -5.747 30.138 0.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -4.434 31.202 0.580 1.00 0.00 H new ATOM 1484 N ASN A 100 -2.536 24.060 2.131 1.00 0.00 N ATOM 1485 CA ASN A 100 -1.683 22.875 2.206 1.00 0.00 C ATOM 1486 C ASN A 100 -0.588 22.914 1.121 1.00 0.00 C ATOM 1487 O ASN A 100 0.490 23.450 1.367 1.00 0.00 O ATOM 1488 CB ASN A 100 -2.538 21.603 2.192 1.00 0.00 C ATOM 1489 CG ASN A 100 -1.714 20.360 1.884 1.00 0.00 C ATOM 1490 OD1 ASN A 100 -2.034 19.669 0.925 1.00 0.00 O ATOM 1491 ND2 ASN A 100 -0.647 20.073 2.609 1.00 0.00 N ATOM 0 H ASN A 100 -3.486 23.884 1.803 1.00 0.00 H new ATOM 0 HA ASN A 100 -1.147 22.868 3.155 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -3.025 21.484 3.160 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -3.328 21.707 1.448 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -0.073 19.263 2.374 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -0.397 20.661 3.404 1.00 0.00 H new ATOM 1498 N ASP A 101 -0.828 22.350 -0.067 1.00 0.00 N ATOM 1499 CA ASP A 101 0.167 22.194 -1.134 1.00 0.00 C ATOM 1500 C ASP A 101 -0.554 21.696 -2.392 1.00 0.00 C ATOM 1501 O ASP A 101 -1.757 21.433 -2.310 1.00 0.00 O ATOM 1502 CB ASP A 101 1.268 21.194 -0.723 1.00 0.00 C ATOM 1503 CG ASP A 101 2.470 21.287 -1.659 1.00 0.00 C ATOM 1504 OD1 ASP A 101 2.698 22.383 -2.218 1.00 0.00 O ATOM 1505 OD2 ASP A 101 3.170 20.272 -1.866 1.00 0.00 O ATOM 0 H ASP A 101 -1.744 21.979 -0.320 1.00 0.00 H new ATOM 0 HA ASP A 101 0.648 23.153 -1.325 1.00 0.00 H new ATOM 0 HB2 ASP A 101 1.583 21.396 0.301 1.00 0.00 H new ATOM 0 HB3 ASP A 101 0.868 20.180 -0.739 1.00 0.00 H new ATOM 1510 N THR A 102 0.114 21.548 -3.542 1.00 0.00 N ATOM 1511 CA THR A 102 -0.539 21.126 -4.783 1.00 0.00 C ATOM 1512 C THR A 102 0.320 20.068 -5.500 1.00 0.00 C ATOM 1513 O THR A 102 1.300 20.377 -6.182 1.00 0.00 O ATOM 1514 CB THR A 102 -0.951 22.392 -5.577 1.00 0.00 C ATOM 1515 OG1 THR A 102 -2.192 22.217 -6.243 1.00 0.00 O ATOM 1516 CG2 THR A 102 0.061 23.015 -6.536 1.00 0.00 C ATOM 0 H THR A 102 1.116 21.716 -3.637 1.00 0.00 H new ATOM 0 HA THR A 102 -1.477 20.595 -4.617 1.00 0.00 H new ATOM 0 HB THR A 102 -1.025 23.124 -4.772 1.00 0.00 H new ATOM 0 HG1 THR A 102 -2.420 23.036 -6.731 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.380 23.891 -7.012 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.951 23.313 -5.982 1.00 0.00 H new ATOM 0 HG23 THR A 102 0.335 22.287 -7.299 1.00 0.00 H new ATOM 1524 N SER A 103 -0.019 18.792 -5.319 1.00 0.00 N ATOM 1525 CA SER A 103 0.608 17.661 -5.998 1.00 0.00 C ATOM 1526 C SER A 103 -0.427 16.539 -6.089 1.00 0.00 C ATOM 1527 O SER A 103 -1.154 16.299 -5.122 1.00 0.00 O ATOM 1528 CB SER A 103 1.860 17.183 -5.247 1.00 0.00 C ATOM 1529 OG SER A 103 2.588 18.247 -4.655 1.00 0.00 O ATOM 0 H SER A 103 -0.759 18.510 -4.677 1.00 0.00 H new ATOM 0 HA SER A 103 0.932 17.962 -6.994 1.00 0.00 H new ATOM 0 HB2 SER A 103 1.565 16.476 -4.472 1.00 0.00 H new ATOM 0 HB3 SER A 103 2.509 16.646 -5.938 1.00 0.00 H new ATOM 0 HG SER A 103 3.372 17.888 -4.190 1.00 0.00 H new ATOM 1535 N ASP A 104 -0.519 15.879 -7.236 1.00 0.00 N ATOM 1536 CA ASP A 104 -1.421 14.780 -7.568 1.00 0.00 C ATOM 1537 C ASP A 104 -0.960 14.122 -8.873 1.00 0.00 C ATOM 1538 O ASP A 104 0.059 14.517 -9.440 1.00 0.00 O ATOM 1539 CB ASP A 104 -2.907 15.203 -7.593 1.00 0.00 C ATOM 1540 CG ASP A 104 -3.315 16.390 -8.475 1.00 0.00 C ATOM 1541 OD1 ASP A 104 -2.461 17.178 -8.933 1.00 0.00 O ATOM 1542 OD2 ASP A 104 -4.538 16.643 -8.555 1.00 0.00 O ATOM 0 H ASP A 104 0.084 16.117 -8.024 1.00 0.00 H new ATOM 0 HA ASP A 104 -1.367 14.038 -6.772 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -3.492 14.339 -7.908 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -3.204 15.433 -6.570 1.00 0.00 H new ATOM 1547 N TYR A 105 -1.632 13.044 -9.289 1.00 0.00 N ATOM 1548 CA TYR A 105 -1.236 12.190 -10.409 1.00 0.00 C ATOM 1549 C TYR A 105 0.176 11.620 -10.180 1.00 0.00 C ATOM 1550 O TYR A 105 1.136 11.960 -10.877 1.00 0.00 O ATOM 1551 CB TYR A 105 -1.411 12.955 -11.743 1.00 0.00 C ATOM 1552 CG TYR A 105 -1.886 12.133 -12.929 1.00 0.00 C ATOM 1553 CD1 TYR A 105 -1.500 10.791 -13.114 1.00 0.00 C ATOM 1554 CD2 TYR A 105 -2.751 12.730 -13.863 1.00 0.00 C ATOM 1555 CE1 TYR A 105 -2.036 10.041 -14.175 1.00 0.00 C ATOM 1556 CE2 TYR A 105 -3.301 11.985 -14.915 1.00 0.00 C ATOM 1557 CZ TYR A 105 -2.970 10.625 -15.061 1.00 0.00 C ATOM 1558 OH TYR A 105 -3.615 9.891 -16.005 1.00 0.00 O ATOM 0 H TYR A 105 -2.494 12.733 -8.840 1.00 0.00 H new ATOM 0 HA TYR A 105 -1.891 11.321 -10.473 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -2.121 13.767 -11.582 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -0.457 13.413 -12.003 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -0.790 10.337 -12.439 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -2.995 13.778 -13.768 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -1.733 9.014 -14.314 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -3.978 12.454 -15.613 1.00 0.00 H new ATOM 0 HH TYR A 105 -4.218 10.471 -16.515 1.00 0.00 H new ATOM 1568 N GLY A 106 0.324 10.754 -9.174 1.00 0.00 N ATOM 1569 CA GLY A 106 1.561 10.041 -8.903 1.00 0.00 C ATOM 1570 C GLY A 106 1.633 8.739 -9.698 1.00 0.00 C ATOM 1571 O GLY A 106 0.673 8.334 -10.358 1.00 0.00 O ATOM 0 H GLY A 106 -0.426 10.530 -8.520 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.412 10.673 -9.158 1.00 0.00 H new ATOM 0 HA3 GLY A 106 1.633 9.824 -7.837 1.00 0.00 H new ATOM 1575 N PHE A 107 2.766 8.055 -9.583 1.00 0.00 N ATOM 1576 CA PHE A 107 3.015 6.699 -10.058 1.00 0.00 C ATOM 1577 C PHE A 107 3.555 5.876 -8.886 1.00 0.00 C ATOM 1578 O PHE A 107 4.255 6.417 -8.026 1.00 0.00 O ATOM 1579 CB PHE A 107 4.062 6.745 -11.181 1.00 0.00 C ATOM 1580 CG PHE A 107 3.528 7.047 -12.563 1.00 0.00 C ATOM 1581 CD1 PHE A 107 2.992 6.004 -13.343 1.00 0.00 C ATOM 1582 CD2 PHE A 107 3.606 8.347 -13.095 1.00 0.00 C ATOM 1583 CE1 PHE A 107 2.571 6.250 -14.659 1.00 0.00 C ATOM 1584 CE2 PHE A 107 3.153 8.597 -14.402 1.00 0.00 C ATOM 1585 CZ PHE A 107 2.647 7.549 -15.188 1.00 0.00 C ATOM 0 H PHE A 107 3.585 8.457 -9.128 1.00 0.00 H new ATOM 0 HA PHE A 107 2.098 6.251 -10.441 1.00 0.00 H new ATOM 0 HB2 PHE A 107 4.808 7.498 -10.927 1.00 0.00 H new ATOM 0 HB3 PHE A 107 4.577 5.785 -11.212 1.00 0.00 H new ATOM 0 HD1 PHE A 107 2.905 5.011 -12.927 1.00 0.00 H new ATOM 0 HD2 PHE A 107 4.013 9.151 -12.500 1.00 0.00 H new ATOM 0 HE1 PHE A 107 2.189 5.441 -15.264 1.00 0.00 H new ATOM 0 HE2 PHE A 107 3.194 9.599 -14.803 1.00 0.00 H new ATOM 0 HZ PHE A 107 2.317 7.742 -16.198 1.00 0.00 H new ATOM 1595 N SER A 108 3.267 4.580 -8.860 1.00 0.00 N ATOM 1596 CA SER A 108 3.837 3.623 -7.927 1.00 0.00 C ATOM 1597 C SER A 108 4.089 2.336 -8.715 1.00 0.00 C ATOM 1598 O SER A 108 3.333 2.028 -9.648 1.00 0.00 O ATOM 1599 CB SER A 108 2.849 3.449 -6.774 1.00 0.00 C ATOM 1600 OG SER A 108 3.415 2.748 -5.696 1.00 0.00 O ATOM 0 H SER A 108 2.607 4.155 -9.511 1.00 0.00 H new ATOM 0 HA SER A 108 4.783 3.944 -7.491 1.00 0.00 H new ATOM 0 HB2 SER A 108 2.514 4.429 -6.433 1.00 0.00 H new ATOM 0 HB3 SER A 108 1.967 2.916 -7.130 1.00 0.00 H new ATOM 0 HG SER A 108 2.752 2.659 -4.979 1.00 0.00 H new ATOM 1606 N TYR A 109 5.172 1.620 -8.413 1.00 0.00 N ATOM 1607 CA TYR A 109 5.547 0.408 -9.126 1.00 0.00 C ATOM 1608 C TYR A 109 6.348 -0.485 -8.193 1.00 0.00 C ATOM 1609 O TYR A 109 7.321 -0.033 -7.577 1.00 0.00 O ATOM 1610 CB TYR A 109 6.388 0.771 -10.361 1.00 0.00 C ATOM 1611 CG TYR A 109 6.766 -0.399 -11.247 1.00 0.00 C ATOM 1612 CD1 TYR A 109 5.762 -1.228 -11.783 1.00 0.00 C ATOM 1613 CD2 TYR A 109 8.116 -0.651 -11.556 1.00 0.00 C ATOM 1614 CE1 TYR A 109 6.101 -2.318 -12.600 1.00 0.00 C ATOM 1615 CE2 TYR A 109 8.460 -1.720 -12.401 1.00 0.00 C ATOM 1616 CZ TYR A 109 7.453 -2.565 -12.915 1.00 0.00 C ATOM 1617 OH TYR A 109 7.768 -3.611 -13.719 1.00 0.00 O ATOM 0 H TYR A 109 5.815 1.870 -7.662 1.00 0.00 H new ATOM 0 HA TYR A 109 4.652 -0.120 -9.456 1.00 0.00 H new ATOM 0 HB2 TYR A 109 5.834 1.495 -10.958 1.00 0.00 H new ATOM 0 HB3 TYR A 109 7.301 1.264 -10.028 1.00 0.00 H new ATOM 0 HD1 TYR A 109 4.724 -1.024 -11.564 1.00 0.00 H new ATOM 0 HD2 TYR A 109 8.890 -0.021 -11.143 1.00 0.00 H new ATOM 0 HE1 TYR A 109 5.328 -2.966 -12.986 1.00 0.00 H new ATOM 0 HE2 TYR A 109 9.495 -1.895 -12.657 1.00 0.00 H new ATOM 0 HH TYR A 109 8.739 -3.648 -13.843 1.00 0.00 H new ATOM 1627 N GLY A 110 5.982 -1.757 -8.116 1.00 0.00 N ATOM 1628 CA GLY A 110 6.601 -2.724 -7.234 1.00 0.00 C ATOM 1629 C GLY A 110 5.523 -3.622 -6.677 1.00 0.00 C ATOM 1630 O GLY A 110 4.473 -3.775 -7.298 1.00 0.00 O ATOM 0 H GLY A 110 5.228 -2.150 -8.680 1.00 0.00 H new ATOM 0 HA2 GLY A 110 7.341 -3.312 -7.776 1.00 0.00 H new ATOM 0 HA3 GLY A 110 7.127 -2.217 -6.425 1.00 0.00 H new ATOM 1634 N ALA A 111 5.789 -4.250 -5.534 1.00 0.00 N ATOM 1635 CA ALA A 111 4.763 -4.933 -4.773 1.00 0.00 C ATOM 1636 C ALA A 111 5.353 -5.207 -3.400 1.00 0.00 C ATOM 1637 O ALA A 111 5.142 -4.435 -2.463 1.00 0.00 O ATOM 1638 CB ALA A 111 4.288 -6.224 -5.461 1.00 0.00 C ATOM 0 H ALA A 111 6.719 -4.296 -5.117 1.00 0.00 H new ATOM 0 HA ALA A 111 3.871 -4.312 -4.695 1.00 0.00 H new ATOM 0 HB1 ALA A 111 3.519 -6.699 -4.852 1.00 0.00 H new ATOM 0 HB2 ALA A 111 3.877 -5.984 -6.442 1.00 0.00 H new ATOM 0 HB3 ALA A 111 5.131 -6.905 -5.578 1.00 0.00 H new ATOM 1644 N GLY A 112 6.090 -6.302 -3.261 1.00 0.00 N ATOM 1645 CA GLY A 112 6.584 -6.776 -1.991 1.00 0.00 C ATOM 1646 C GLY A 112 6.810 -8.272 -2.082 1.00 0.00 C ATOM 1647 O GLY A 112 6.423 -8.917 -3.061 1.00 0.00 O ATOM 0 H GLY A 112 6.362 -6.891 -4.048 1.00 0.00 H new ATOM 0 HA2 GLY A 112 7.514 -6.269 -1.735 1.00 0.00 H new ATOM 0 HA3 GLY A 112 5.869 -6.550 -1.200 1.00 0.00 H new ATOM 1651 N LEU A 113 7.463 -8.804 -1.059 1.00 0.00 N ATOM 1652 CA LEU A 113 7.943 -10.171 -0.979 1.00 0.00 C ATOM 1653 C LEU A 113 7.583 -10.667 0.421 1.00 0.00 C ATOM 1654 O LEU A 113 7.491 -9.861 1.354 1.00 0.00 O ATOM 1655 CB LEU A 113 9.471 -10.195 -1.203 1.00 0.00 C ATOM 1656 CG LEU A 113 10.019 -10.014 -2.641 1.00 0.00 C ATOM 1657 CD1 LEU A 113 9.510 -11.107 -3.577 1.00 0.00 C ATOM 1658 CD2 LEU A 113 9.764 -8.667 -3.328 1.00 0.00 C ATOM 0 H LEU A 113 7.682 -8.265 -0.222 1.00 0.00 H new ATOM 0 HA LEU A 113 7.494 -10.810 -1.739 1.00 0.00 H new ATOM 0 HB2 LEU A 113 9.907 -9.412 -0.583 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.845 -11.147 -0.825 1.00 0.00 H new ATOM 0 HG LEU A 113 11.094 -10.071 -2.473 1.00 0.00 H new ATOM 0 HD11 LEU A 113 9.915 -10.948 -4.576 1.00 0.00 H new ATOM 0 HD12 LEU A 113 9.830 -12.081 -3.207 1.00 0.00 H new ATOM 0 HD13 LEU A 113 8.421 -11.074 -3.617 1.00 0.00 H new ATOM 0 HD21 LEU A 113 10.201 -8.679 -4.326 1.00 0.00 H new ATOM 0 HD22 LEU A 113 8.690 -8.495 -3.404 1.00 0.00 H new ATOM 0 HD23 LEU A 113 10.219 -7.868 -2.743 1.00 0.00 H new ATOM 1670 N GLN A 114 7.380 -11.969 0.599 1.00 0.00 N ATOM 1671 CA GLN A 114 7.199 -12.583 1.912 1.00 0.00 C ATOM 1672 C GLN A 114 8.206 -13.713 2.048 1.00 0.00 C ATOM 1673 O GLN A 114 8.682 -14.252 1.042 1.00 0.00 O ATOM 1674 CB GLN A 114 5.759 -13.087 2.160 1.00 0.00 C ATOM 1675 CG GLN A 114 5.307 -14.165 1.163 1.00 0.00 C ATOM 1676 CD GLN A 114 4.051 -14.917 1.596 1.00 0.00 C ATOM 1677 OE1 GLN A 114 2.984 -14.788 0.997 1.00 0.00 O ATOM 1678 NE2 GLN A 114 4.151 -15.752 2.617 1.00 0.00 N ATOM 0 H GLN A 114 7.336 -12.635 -0.172 1.00 0.00 H new ATOM 0 HA GLN A 114 7.369 -11.821 2.673 1.00 0.00 H new ATOM 0 HB2 GLN A 114 5.692 -13.488 3.171 1.00 0.00 H new ATOM 0 HB3 GLN A 114 5.072 -12.242 2.106 1.00 0.00 H new ATOM 0 HG2 GLN A 114 5.124 -13.698 0.195 1.00 0.00 H new ATOM 0 HG3 GLN A 114 6.117 -14.880 1.023 1.00 0.00 H new ATOM 0 HE21 GLN A 114 5.039 -15.853 3.108 1.00 0.00 H new ATOM 0 HE22 GLN A 114 3.340 -16.295 2.913 1.00 0.00 H new ATOM 1687 N PHE A 115 8.475 -14.101 3.286 1.00 0.00 N ATOM 1688 CA PHE A 115 9.125 -15.352 3.610 1.00 0.00 C ATOM 1689 C PHE A 115 8.060 -16.422 3.867 1.00 0.00 C ATOM 1690 O PHE A 115 6.850 -16.183 3.757 1.00 0.00 O ATOM 1691 CB PHE A 115 10.145 -15.165 4.746 1.00 0.00 C ATOM 1692 CG PHE A 115 11.513 -14.759 4.228 1.00 0.00 C ATOM 1693 CD1 PHE A 115 12.258 -15.671 3.452 1.00 0.00 C ATOM 1694 CD2 PHE A 115 12.032 -13.474 4.479 1.00 0.00 C ATOM 1695 CE1 PHE A 115 13.506 -15.300 2.921 1.00 0.00 C ATOM 1696 CE2 PHE A 115 13.299 -13.119 3.979 1.00 0.00 C ATOM 1697 CZ PHE A 115 14.037 -14.029 3.202 1.00 0.00 C ATOM 0 H PHE A 115 8.241 -13.541 4.106 1.00 0.00 H new ATOM 0 HA PHE A 115 9.719 -15.707 2.768 1.00 0.00 H new ATOM 0 HB2 PHE A 115 9.780 -14.406 5.438 1.00 0.00 H new ATOM 0 HB3 PHE A 115 10.233 -16.094 5.310 1.00 0.00 H new ATOM 0 HD1 PHE A 115 11.868 -16.660 3.264 1.00 0.00 H new ATOM 0 HD2 PHE A 115 11.459 -12.762 5.054 1.00 0.00 H new ATOM 0 HE1 PHE A 115 14.056 -15.990 2.298 1.00 0.00 H new ATOM 0 HE2 PHE A 115 13.706 -12.142 4.193 1.00 0.00 H new ATOM 0 HZ PHE A 115 15.009 -13.752 2.822 1.00 0.00 H new ATOM 1707 N ASN A 116 8.562 -17.642 4.015 1.00 0.00 N ATOM 1708 CA ASN A 116 7.851 -18.891 4.215 1.00 0.00 C ATOM 1709 C ASN A 116 7.086 -18.853 5.539 1.00 0.00 C ATOM 1710 O ASN A 116 7.708 -18.973 6.597 1.00 0.00 O ATOM 1711 CB ASN A 116 8.828 -20.073 4.164 1.00 0.00 C ATOM 1712 CG ASN A 116 10.084 -19.967 5.040 1.00 0.00 C ATOM 1713 OD1 ASN A 116 10.583 -18.889 5.351 1.00 0.00 O ATOM 1714 ND2 ASN A 116 10.687 -21.091 5.379 1.00 0.00 N ATOM 0 H ASN A 116 9.571 -17.791 3.996 1.00 0.00 H new ATOM 0 HA ASN A 116 7.126 -19.024 3.412 1.00 0.00 H new ATOM 0 HB2 ASN A 116 8.287 -20.974 4.452 1.00 0.00 H new ATOM 0 HB3 ASN A 116 9.145 -20.208 3.130 1.00 0.00 H new ATOM 0 HD21 ASN A 116 11.565 -21.062 5.898 1.00 0.00 H new ATOM 0 HD22 ASN A 116 10.275 -21.988 5.122 1.00 0.00 H new ATOM 1721 N PRO A 117 5.757 -18.670 5.492 1.00 0.00 N ATOM 1722 CA PRO A 117 4.955 -18.355 6.655 1.00 0.00 C ATOM 1723 C PRO A 117 4.710 -19.609 7.488 1.00 0.00 C ATOM 1724 O PRO A 117 3.984 -20.521 7.081 1.00 0.00 O ATOM 1725 CB PRO A 117 3.681 -17.745 6.085 1.00 0.00 C ATOM 1726 CG PRO A 117 3.494 -18.484 4.771 1.00 0.00 C ATOM 1727 CD PRO A 117 4.918 -18.749 4.305 1.00 0.00 C ATOM 0 HA PRO A 117 5.437 -17.659 7.342 1.00 0.00 H new ATOM 0 HB2 PRO A 117 2.832 -17.891 6.753 1.00 0.00 H new ATOM 0 HB3 PRO A 117 3.784 -16.671 5.931 1.00 0.00 H new ATOM 0 HG2 PRO A 117 2.938 -19.411 4.908 1.00 0.00 H new ATOM 0 HG3 PRO A 117 2.941 -17.884 4.049 1.00 0.00 H new ATOM 0 HD2 PRO A 117 4.998 -19.730 3.837 1.00 0.00 H new ATOM 0 HD3 PRO A 117 5.227 -18.015 3.561 1.00 0.00 H new ATOM 1735 N MET A 118 5.316 -19.650 8.666 1.00 0.00 N ATOM 1736 CA MET A 118 5.139 -20.696 9.645 1.00 0.00 C ATOM 1737 C MET A 118 5.554 -20.096 10.986 1.00 0.00 C ATOM 1738 O MET A 118 6.573 -19.405 11.036 1.00 0.00 O ATOM 1739 CB MET A 118 6.044 -21.876 9.257 1.00 0.00 C ATOM 1740 CG MET A 118 5.818 -23.085 10.159 1.00 0.00 C ATOM 1741 SD MET A 118 6.992 -24.436 9.886 1.00 0.00 S ATOM 1742 CE MET A 118 6.283 -25.641 11.032 1.00 0.00 C ATOM 0 H MET A 118 5.967 -18.926 8.971 1.00 0.00 H new ATOM 0 HA MET A 118 4.113 -21.061 9.699 1.00 0.00 H new ATOM 0 HB2 MET A 118 5.853 -22.155 8.221 1.00 0.00 H new ATOM 0 HB3 MET A 118 7.088 -21.568 9.317 1.00 0.00 H new ATOM 0 HG2 MET A 118 5.882 -22.766 11.199 1.00 0.00 H new ATOM 0 HG3 MET A 118 4.806 -23.459 10.002 1.00 0.00 H new ATOM 0 HE1 MET A 118 6.874 -26.557 11.009 1.00 0.00 H new ATOM 0 HE2 MET A 118 6.289 -25.230 12.042 1.00 0.00 H new ATOM 0 HE3 MET A 118 5.257 -25.864 10.737 1.00 0.00 H new ATOM 1752 N GLU A 119 4.787 -20.387 12.038 1.00 0.00 N ATOM 1753 CA GLU A 119 5.047 -20.235 13.487 1.00 0.00 C ATOM 1754 C GLU A 119 3.978 -19.331 14.130 1.00 0.00 C ATOM 1755 O GLU A 119 4.234 -18.604 15.090 1.00 0.00 O ATOM 1756 CB GLU A 119 6.496 -19.818 13.833 1.00 0.00 C ATOM 1757 CG GLU A 119 6.871 -20.076 15.298 1.00 0.00 C ATOM 1758 CD GLU A 119 7.821 -19.027 15.871 1.00 0.00 C ATOM 1759 OE1 GLU A 119 7.531 -17.813 15.819 1.00 0.00 O ATOM 1760 OE2 GLU A 119 8.791 -19.432 16.553 1.00 0.00 O ATOM 0 H GLU A 119 3.859 -20.781 11.886 1.00 0.00 H new ATOM 0 HA GLU A 119 4.959 -21.226 13.932 1.00 0.00 H new ATOM 0 HB2 GLU A 119 7.186 -20.361 13.188 1.00 0.00 H new ATOM 0 HB3 GLU A 119 6.623 -18.758 13.614 1.00 0.00 H new ATOM 0 HG2 GLU A 119 5.962 -20.101 15.900 1.00 0.00 H new ATOM 0 HG3 GLU A 119 7.334 -21.059 15.380 1.00 0.00 H new ATOM 1767 N ASN A 120 2.763 -19.338 13.568 1.00 0.00 N ATOM 1768 CA ASN A 120 1.715 -18.351 13.845 1.00 0.00 C ATOM 1769 C ASN A 120 2.181 -16.958 13.420 1.00 0.00 C ATOM 1770 O ASN A 120 1.821 -15.959 14.038 1.00 0.00 O ATOM 1771 CB ASN A 120 1.151 -18.457 15.284 1.00 0.00 C ATOM 1772 CG ASN A 120 0.031 -19.477 15.329 1.00 0.00 C ATOM 1773 OD1 ASN A 120 0.262 -20.672 15.516 1.00 0.00 O ATOM 1774 ND2 ASN A 120 -1.188 -19.055 15.035 1.00 0.00 N ATOM 0 H ASN A 120 2.476 -20.047 12.893 1.00 0.00 H new ATOM 0 HA ASN A 120 0.843 -18.576 13.231 1.00 0.00 H new ATOM 0 HB2 ASN A 120 1.944 -18.745 15.974 1.00 0.00 H new ATOM 0 HB3 ASN A 120 0.782 -17.485 15.611 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -1.955 -19.723 14.960 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -1.361 -18.061 14.883 1.00 0.00 H new ATOM 1781 N VAL A 121 2.974 -16.907 12.347 1.00 0.00 N ATOM 1782 CA VAL A 121 3.459 -15.700 11.698 1.00 0.00 C ATOM 1783 C VAL A 121 3.540 -15.918 10.178 1.00 0.00 C ATOM 1784 O VAL A 121 3.404 -17.047 9.689 1.00 0.00 O ATOM 1785 CB VAL A 121 4.791 -15.227 12.321 1.00 0.00 C ATOM 1786 CG1 VAL A 121 4.545 -14.404 13.589 1.00 0.00 C ATOM 1787 CG2 VAL A 121 5.721 -16.388 12.675 1.00 0.00 C ATOM 0 H VAL A 121 3.309 -17.754 11.888 1.00 0.00 H new ATOM 0 HA VAL A 121 2.751 -14.889 11.867 1.00 0.00 H new ATOM 0 HB VAL A 121 5.273 -14.614 11.559 1.00 0.00 H new ATOM 0 HG11 VAL A 121 5.500 -14.084 14.006 1.00 0.00 H new ATOM 0 HG12 VAL A 121 3.945 -13.528 13.343 1.00 0.00 H new ATOM 0 HG13 VAL A 121 4.015 -15.013 14.321 1.00 0.00 H new ATOM 0 HG21 VAL A 121 6.641 -15.998 13.109 1.00 0.00 H new ATOM 0 HG22 VAL A 121 5.229 -17.042 13.395 1.00 0.00 H new ATOM 0 HG23 VAL A 121 5.956 -16.954 11.773 1.00 0.00 H new ATOM 1797 N ALA A 122 3.718 -14.817 9.447 1.00 0.00 N ATOM 1798 CA ALA A 122 4.119 -14.708 8.055 1.00 0.00 C ATOM 1799 C ALA A 122 4.932 -13.422 7.958 1.00 0.00 C ATOM 1800 O ALA A 122 4.390 -12.372 8.290 1.00 0.00 O ATOM 1801 CB ALA A 122 2.888 -14.627 7.143 1.00 0.00 C ATOM 0 H ALA A 122 3.570 -13.896 9.859 1.00 0.00 H new ATOM 0 HA ALA A 122 4.696 -15.577 7.738 1.00 0.00 H new ATOM 0 HB1 ALA A 122 3.209 -14.546 6.105 1.00 0.00 H new ATOM 0 HB2 ALA A 122 2.284 -15.526 7.267 1.00 0.00 H new ATOM 0 HB3 ALA A 122 2.295 -13.752 7.409 1.00 0.00 H new ATOM 1807 N LEU A 123 6.202 -13.475 7.564 1.00 0.00 N ATOM 1808 CA LEU A 123 7.063 -12.293 7.510 1.00 0.00 C ATOM 1809 C LEU A 123 6.856 -11.656 6.143 1.00 0.00 C ATOM 1810 O LEU A 123 7.143 -12.275 5.116 1.00 0.00 O ATOM 1811 CB LEU A 123 8.539 -12.693 7.707 1.00 0.00 C ATOM 1812 CG LEU A 123 9.023 -12.739 9.170 1.00 0.00 C ATOM 1813 CD1 LEU A 123 9.210 -11.323 9.722 1.00 0.00 C ATOM 1814 CD2 LEU A 123 8.108 -13.538 10.107 1.00 0.00 C ATOM 0 H LEU A 123 6.664 -14.337 7.273 1.00 0.00 H new ATOM 0 HA LEU A 123 6.811 -11.590 8.304 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.694 -13.675 7.260 1.00 0.00 H new ATOM 0 HB3 LEU A 123 9.165 -11.990 7.157 1.00 0.00 H new ATOM 0 HG LEU A 123 9.978 -13.264 9.143 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.552 -11.378 10.756 1.00 0.00 H new ATOM 0 HD12 LEU A 123 9.950 -10.794 9.122 1.00 0.00 H new ATOM 0 HD13 LEU A 123 8.261 -10.788 9.682 1.00 0.00 H new ATOM 0 HD21 LEU A 123 8.518 -13.522 11.117 1.00 0.00 H new ATOM 0 HD22 LEU A 123 7.114 -13.092 10.112 1.00 0.00 H new ATOM 0 HD23 LEU A 123 8.041 -14.569 9.759 1.00 0.00 H new ATOM 1826 N ASP A 124 6.329 -10.434 6.127 1.00 0.00 N ATOM 1827 CA ASP A 124 5.844 -9.746 4.933 1.00 0.00 C ATOM 1828 C ASP A 124 6.487 -8.369 4.833 1.00 0.00 C ATOM 1829 O ASP A 124 6.494 -7.628 5.820 1.00 0.00 O ATOM 1830 CB ASP A 124 4.319 -9.613 4.995 1.00 0.00 C ATOM 1831 CG ASP A 124 3.798 -8.666 3.915 1.00 0.00 C ATOM 1832 OD1 ASP A 124 3.906 -9.005 2.718 1.00 0.00 O ATOM 1833 OD2 ASP A 124 3.271 -7.581 4.256 1.00 0.00 O ATOM 0 H ASP A 124 6.224 -9.876 6.974 1.00 0.00 H new ATOM 0 HA ASP A 124 6.113 -10.326 4.050 1.00 0.00 H new ATOM 0 HB2 ASP A 124 3.861 -10.595 4.872 1.00 0.00 H new ATOM 0 HB3 ASP A 124 4.024 -9.244 5.977 1.00 0.00 H new ATOM 1838 N PHE A 125 7.017 -8.034 3.653 1.00 0.00 N ATOM 1839 CA PHE A 125 7.672 -6.765 3.354 1.00 0.00 C ATOM 1840 C PHE A 125 7.107 -6.195 2.051 1.00 0.00 C ATOM 1841 O PHE A 125 6.712 -6.943 1.152 1.00 0.00 O ATOM 1842 CB PHE A 125 9.196 -6.962 3.236 1.00 0.00 C ATOM 1843 CG PHE A 125 9.956 -6.944 4.552 1.00 0.00 C ATOM 1844 CD1 PHE A 125 9.785 -7.977 5.493 1.00 0.00 C ATOM 1845 CD2 PHE A 125 10.845 -5.889 4.840 1.00 0.00 C ATOM 1846 CE1 PHE A 125 10.464 -7.934 6.722 1.00 0.00 C ATOM 1847 CE2 PHE A 125 11.541 -5.857 6.061 1.00 0.00 C ATOM 1848 CZ PHE A 125 11.348 -6.879 7.006 1.00 0.00 C ATOM 0 H PHE A 125 6.999 -8.666 2.852 1.00 0.00 H new ATOM 0 HA PHE A 125 7.480 -6.063 4.166 1.00 0.00 H new ATOM 0 HB2 PHE A 125 9.386 -7.913 2.739 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.598 -6.180 2.592 1.00 0.00 H new ATOM 0 HD1 PHE A 125 9.129 -8.806 5.269 1.00 0.00 H new ATOM 0 HD2 PHE A 125 10.993 -5.100 4.118 1.00 0.00 H new ATOM 0 HE1 PHE A 125 10.306 -8.715 7.451 1.00 0.00 H new ATOM 0 HE2 PHE A 125 12.224 -5.047 6.273 1.00 0.00 H new ATOM 0 HZ PHE A 125 11.877 -6.854 7.947 1.00 0.00 H new ATOM 1858 N SER A 126 7.106 -4.873 1.925 1.00 0.00 N ATOM 1859 CA SER A 126 6.793 -4.105 0.731 1.00 0.00 C ATOM 1860 C SER A 126 7.698 -2.873 0.759 1.00 0.00 C ATOM 1861 O SER A 126 7.963 -2.321 1.836 1.00 0.00 O ATOM 1862 CB SER A 126 5.299 -3.756 0.770 1.00 0.00 C ATOM 1863 OG SER A 126 4.847 -2.942 -0.297 1.00 0.00 O ATOM 0 H SER A 126 7.341 -4.269 2.712 1.00 0.00 H new ATOM 0 HA SER A 126 6.971 -4.647 -0.198 1.00 0.00 H new ATOM 0 HB2 SER A 126 4.725 -4.682 0.769 1.00 0.00 H new ATOM 0 HB3 SER A 126 5.084 -3.249 1.711 1.00 0.00 H new ATOM 0 HG SER A 126 5.103 -3.350 -1.151 1.00 0.00 H new ATOM 1869 N TYR A 127 8.184 -2.463 -0.410 1.00 0.00 N ATOM 1870 CA TYR A 127 8.953 -1.245 -0.606 1.00 0.00 C ATOM 1871 C TYR A 127 8.555 -0.750 -1.984 1.00 0.00 C ATOM 1872 O TYR A 127 8.701 -1.493 -2.965 1.00 0.00 O ATOM 1873 CB TYR A 127 10.469 -1.514 -0.532 1.00 0.00 C ATOM 1874 CG TYR A 127 11.141 -0.971 0.715 1.00 0.00 C ATOM 1875 CD1 TYR A 127 11.589 0.363 0.748 1.00 0.00 C ATOM 1876 CD2 TYR A 127 11.312 -1.789 1.847 1.00 0.00 C ATOM 1877 CE1 TYR A 127 12.190 0.884 1.907 1.00 0.00 C ATOM 1878 CE2 TYR A 127 11.887 -1.265 3.021 1.00 0.00 C ATOM 1879 CZ TYR A 127 12.328 0.077 3.055 1.00 0.00 C ATOM 1880 OH TYR A 127 12.850 0.604 4.196 1.00 0.00 O ATOM 0 H TYR A 127 8.047 -2.989 -1.273 1.00 0.00 H new ATOM 0 HA TYR A 127 8.747 -0.509 0.172 1.00 0.00 H new ATOM 0 HB2 TYR A 127 10.638 -2.590 -0.582 1.00 0.00 H new ATOM 0 HB3 TYR A 127 10.947 -1.075 -1.408 1.00 0.00 H new ATOM 0 HD1 TYR A 127 11.470 0.990 -0.123 1.00 0.00 H new ATOM 0 HD2 TYR A 127 11.001 -2.823 1.815 1.00 0.00 H new ATOM 0 HE1 TYR A 127 12.546 1.903 1.918 1.00 0.00 H new ATOM 0 HE2 TYR A 127 11.991 -1.889 3.896 1.00 0.00 H new ATOM 0 HH TYR A 127 12.875 -0.085 4.893 1.00 0.00 H new ATOM 1890 N GLU A 128 8.050 0.477 -2.067 1.00 0.00 N ATOM 1891 CA GLU A 128 7.665 1.110 -3.319 1.00 0.00 C ATOM 1892 C GLU A 128 8.256 2.514 -3.346 1.00 0.00 C ATOM 1893 O GLU A 128 8.470 3.118 -2.291 1.00 0.00 O ATOM 1894 CB GLU A 128 6.137 1.146 -3.454 1.00 0.00 C ATOM 1895 CG GLU A 128 5.519 -0.262 -3.448 1.00 0.00 C ATOM 1896 CD GLU A 128 4.038 -0.223 -3.812 1.00 0.00 C ATOM 1897 OE1 GLU A 128 3.268 0.571 -3.215 1.00 0.00 O ATOM 1898 OE2 GLU A 128 3.627 -0.960 -4.733 1.00 0.00 O ATOM 0 H GLU A 128 7.895 1.068 -1.250 1.00 0.00 H new ATOM 0 HA GLU A 128 8.049 0.539 -4.164 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.715 1.729 -2.635 1.00 0.00 H new ATOM 0 HB3 GLU A 128 5.868 1.655 -4.380 1.00 0.00 H new ATOM 0 HG2 GLU A 128 6.052 -0.898 -4.155 1.00 0.00 H new ATOM 0 HG3 GLU A 128 5.641 -0.710 -2.462 1.00 0.00 H new ATOM 1905 N GLN A 129 8.500 3.053 -4.540 1.00 0.00 N ATOM 1906 CA GLN A 129 8.987 4.413 -4.724 1.00 0.00 C ATOM 1907 C GLN A 129 7.930 5.193 -5.497 1.00 0.00 C ATOM 1908 O GLN A 129 7.262 4.656 -6.389 1.00 0.00 O ATOM 1909 CB GLN A 129 10.367 4.419 -5.408 1.00 0.00 C ATOM 1910 CG GLN A 129 10.322 4.054 -6.900 1.00 0.00 C ATOM 1911 CD GLN A 129 11.717 3.925 -7.506 1.00 0.00 C ATOM 1912 OE1 GLN A 129 12.591 4.775 -7.330 1.00 0.00 O ATOM 1913 NE2 GLN A 129 11.969 2.849 -8.225 1.00 0.00 N ATOM 0 H GLN A 129 8.362 2.548 -5.416 1.00 0.00 H new ATOM 0 HA GLN A 129 9.141 4.901 -3.762 1.00 0.00 H new ATOM 0 HB2 GLN A 129 10.812 5.408 -5.299 1.00 0.00 H new ATOM 0 HB3 GLN A 129 11.021 3.717 -4.891 1.00 0.00 H new ATOM 0 HG2 GLN A 129 9.785 3.114 -7.026 1.00 0.00 H new ATOM 0 HG3 GLN A 129 9.762 4.816 -7.442 1.00 0.00 H new ATOM 0 HE21 GLN A 129 11.241 2.149 -8.367 1.00 0.00 H new ATOM 0 HE22 GLN A 129 12.892 2.717 -8.639 1.00 0.00 H new ATOM 1922 N SER A 130 7.789 6.465 -5.150 1.00 0.00 N ATOM 1923 CA SER A 130 6.835 7.384 -5.735 1.00 0.00 C ATOM 1924 C SER A 130 7.514 8.745 -5.885 1.00 0.00 C ATOM 1925 O SER A 130 8.429 9.072 -5.120 1.00 0.00 O ATOM 1926 CB SER A 130 5.574 7.437 -4.853 1.00 0.00 C ATOM 1927 OG SER A 130 5.760 6.994 -3.514 1.00 0.00 O ATOM 0 H SER A 130 8.361 6.897 -4.424 1.00 0.00 H new ATOM 0 HA SER A 130 6.515 7.057 -6.724 1.00 0.00 H new ATOM 0 HB2 SER A 130 5.205 8.463 -4.833 1.00 0.00 H new ATOM 0 HB3 SER A 130 4.798 6.828 -5.317 1.00 0.00 H new ATOM 0 HG SER A 130 6.540 7.443 -3.126 1.00 0.00 H new ATOM 1933 N ARG A 131 7.083 9.561 -6.845 1.00 0.00 N ATOM 1934 CA ARG A 131 7.496 10.953 -6.923 1.00 0.00 C ATOM 1935 C ARG A 131 6.283 11.706 -7.427 1.00 0.00 C ATOM 1936 O ARG A 131 6.071 11.764 -8.635 1.00 0.00 O ATOM 1937 CB ARG A 131 8.730 11.100 -7.831 1.00 0.00 C ATOM 1938 CG ARG A 131 9.415 12.475 -7.738 1.00 0.00 C ATOM 1939 CD ARG A 131 10.460 12.539 -8.859 1.00 0.00 C ATOM 1940 NE ARG A 131 11.548 13.512 -8.632 1.00 0.00 N ATOM 1941 CZ ARG A 131 12.843 13.182 -8.502 1.00 0.00 C ATOM 1942 NH1 ARG A 131 13.190 11.946 -8.158 1.00 0.00 N ATOM 1943 NH2 ARG A 131 13.791 14.081 -8.765 1.00 0.00 N ATOM 0 H ARG A 131 6.442 9.274 -7.585 1.00 0.00 H new ATOM 0 HA ARG A 131 7.810 11.357 -5.960 1.00 0.00 H new ATOM 0 HB2 ARG A 131 9.453 10.327 -7.572 1.00 0.00 H new ATOM 0 HB3 ARG A 131 8.431 10.923 -8.864 1.00 0.00 H new ATOM 0 HG2 ARG A 131 8.685 13.277 -7.847 1.00 0.00 H new ATOM 0 HG3 ARG A 131 9.887 12.604 -6.764 1.00 0.00 H new ATOM 0 HD2 ARG A 131 10.897 11.549 -8.987 1.00 0.00 H new ATOM 0 HD3 ARG A 131 9.957 12.788 -9.793 1.00 0.00 H new ATOM 0 HE ARG A 131 11.299 14.499 -8.570 1.00 0.00 H new ATOM 0 HH11 ARG A 131 12.471 11.242 -7.991 1.00 0.00 H new ATOM 0 HH12 ARG A 131 14.175 11.701 -8.061 1.00 0.00 H new ATOM 0 HH21 ARG A 131 13.533 15.021 -9.065 1.00 0.00 H new ATOM 0 HH22 ARG A 131 14.774 13.829 -8.666 1.00 0.00 H new ATOM 1957 N ILE A 132 5.501 12.298 -6.526 1.00 0.00 N ATOM 1958 CA ILE A 132 4.390 13.136 -6.953 1.00 0.00 C ATOM 1959 C ILE A 132 4.986 14.522 -7.118 1.00 0.00 C ATOM 1960 O ILE A 132 5.416 15.136 -6.146 1.00 0.00 O ATOM 1961 CB ILE A 132 3.173 13.104 -6.002 1.00 0.00 C ATOM 1962 CG1 ILE A 132 2.686 11.669 -5.709 1.00 0.00 C ATOM 1963 CG2 ILE A 132 1.999 13.823 -6.687 1.00 0.00 C ATOM 1964 CD1 ILE A 132 3.249 11.107 -4.407 1.00 0.00 C ATOM 0 H ILE A 132 5.615 12.214 -5.516 1.00 0.00 H new ATOM 0 HA ILE A 132 3.961 12.767 -7.885 1.00 0.00 H new ATOM 0 HB ILE A 132 3.484 13.576 -5.070 1.00 0.00 H new ATOM 0 HG12 ILE A 132 1.597 11.663 -5.661 1.00 0.00 H new ATOM 0 HG13 ILE A 132 2.973 11.017 -6.534 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.130 13.810 -6.029 1.00 0.00 H new ATOM 0 HG22 ILE A 132 2.278 14.855 -6.899 1.00 0.00 H new ATOM 0 HG23 ILE A 132 1.755 13.314 -7.620 1.00 0.00 H new ATOM 0 HD11 ILE A 132 2.872 10.096 -4.254 1.00 0.00 H new ATOM 0 HD12 ILE A 132 4.337 11.084 -4.461 1.00 0.00 H new ATOM 0 HD13 ILE A 132 2.940 11.739 -3.574 1.00 0.00 H new ATOM 1976 N ARG A 133 5.077 14.988 -8.356 1.00 0.00 N ATOM 1977 CA ARG A 133 5.505 16.313 -8.791 1.00 0.00 C ATOM 1978 C ARG A 133 7.012 16.463 -8.693 1.00 0.00 C ATOM 1979 O ARG A 133 7.686 16.685 -9.702 1.00 0.00 O ATOM 1980 CB ARG A 133 4.786 17.423 -7.995 1.00 0.00 C ATOM 1981 CG ARG A 133 4.863 18.729 -8.774 1.00 0.00 C ATOM 1982 CD ARG A 133 4.272 19.885 -7.974 1.00 0.00 C ATOM 1983 NE ARG A 133 3.937 20.997 -8.863 1.00 0.00 N ATOM 1984 CZ ARG A 133 3.337 22.128 -8.496 1.00 0.00 C ATOM 1985 NH1 ARG A 133 3.270 22.479 -7.213 1.00 0.00 N ATOM 1986 NH2 ARG A 133 2.801 22.891 -9.436 1.00 0.00 N ATOM 0 H ARG A 133 4.832 14.398 -9.151 1.00 0.00 H new ATOM 0 HA ARG A 133 5.226 16.421 -9.839 1.00 0.00 H new ATOM 0 HB2 ARG A 133 3.745 17.148 -7.824 1.00 0.00 H new ATOM 0 HB3 ARG A 133 5.249 17.542 -7.015 1.00 0.00 H new ATOM 0 HG2 ARG A 133 5.902 18.948 -9.020 1.00 0.00 H new ATOM 0 HG3 ARG A 133 4.327 18.625 -9.717 1.00 0.00 H new ATOM 0 HD2 ARG A 133 3.379 19.551 -7.445 1.00 0.00 H new ATOM 0 HD3 ARG A 133 4.985 20.216 -7.219 1.00 0.00 H new ATOM 0 HE ARG A 133 4.184 20.898 -9.848 1.00 0.00 H new ATOM 0 HH11 ARG A 133 3.681 21.879 -6.498 1.00 0.00 H new ATOM 0 HH12 ARG A 133 2.808 23.348 -6.945 1.00 0.00 H new ATOM 0 HH21 ARG A 133 2.853 22.607 -10.414 1.00 0.00 H new ATOM 0 HH22 ARG A 133 2.336 23.762 -9.182 1.00 0.00 H new ATOM 2000 N SER A 134 7.497 16.413 -7.462 1.00 0.00 N ATOM 2001 CA SER A 134 8.831 16.714 -6.998 1.00 0.00 C ATOM 2002 C SER A 134 9.078 15.997 -5.659 1.00 0.00 C ATOM 2003 O SER A 134 10.189 16.101 -5.132 1.00 0.00 O ATOM 2004 CB SER A 134 8.916 18.241 -6.809 1.00 0.00 C ATOM 2005 OG SER A 134 10.115 18.800 -7.304 1.00 0.00 O ATOM 0 H SER A 134 6.898 16.130 -6.687 1.00 0.00 H new ATOM 0 HA SER A 134 9.583 16.378 -7.711 1.00 0.00 H new ATOM 0 HB2 SER A 134 8.070 18.710 -7.312 1.00 0.00 H new ATOM 0 HB3 SER A 134 8.825 18.474 -5.748 1.00 0.00 H new ATOM 0 HG SER A 134 10.109 19.769 -7.157 1.00 0.00 H new ATOM 2011 N VAL A 135 8.082 15.298 -5.085 1.00 0.00 N ATOM 2012 CA VAL A 135 8.167 14.834 -3.698 1.00 0.00 C ATOM 2013 C VAL A 135 8.499 13.342 -3.685 1.00 0.00 C ATOM 2014 O VAL A 135 7.659 12.527 -4.068 1.00 0.00 O ATOM 2015 CB VAL A 135 6.960 15.283 -2.836 1.00 0.00 C ATOM 2016 CG1 VAL A 135 6.852 16.820 -2.854 1.00 0.00 C ATOM 2017 CG2 VAL A 135 5.570 14.700 -3.150 1.00 0.00 C ATOM 0 H VAL A 135 7.216 15.046 -5.561 1.00 0.00 H new ATOM 0 HA VAL A 135 8.994 15.327 -3.188 1.00 0.00 H new ATOM 0 HB VAL A 135 7.206 14.867 -1.859 1.00 0.00 H new ATOM 0 HG11 VAL A 135 6.002 17.132 -2.247 1.00 0.00 H new ATOM 0 HG12 VAL A 135 7.766 17.254 -2.449 1.00 0.00 H new ATOM 0 HG13 VAL A 135 6.711 17.163 -3.879 1.00 0.00 H new ATOM 0 HG21 VAL A 135 4.837 15.114 -2.458 1.00 0.00 H new ATOM 0 HG22 VAL A 135 5.290 14.957 -4.172 1.00 0.00 H new ATOM 0 HG23 VAL A 135 5.598 13.616 -3.043 1.00 0.00 H new ATOM 2027 N ASP A 136 9.742 12.979 -3.342 1.00 0.00 N ATOM 2028 CA ASP A 136 10.228 11.599 -3.430 1.00 0.00 C ATOM 2029 C ASP A 136 9.775 10.854 -2.178 1.00 0.00 C ATOM 2030 O ASP A 136 10.518 10.723 -1.199 1.00 0.00 O ATOM 2031 CB ASP A 136 11.751 11.527 -3.641 1.00 0.00 C ATOM 2032 CG ASP A 136 12.134 11.756 -5.102 1.00 0.00 C ATOM 2033 OD1 ASP A 136 11.832 10.885 -5.957 1.00 0.00 O ATOM 2034 OD2 ASP A 136 12.728 12.813 -5.398 1.00 0.00 O ATOM 0 H ASP A 136 10.439 13.637 -2.995 1.00 0.00 H new ATOM 0 HA ASP A 136 9.801 11.118 -4.310 1.00 0.00 H new ATOM 0 HB2 ASP A 136 12.240 12.274 -3.016 1.00 0.00 H new ATOM 0 HB3 ASP A 136 12.117 10.552 -3.318 1.00 0.00 H new ATOM 2039 N VAL A 137 8.525 10.402 -2.206 1.00 0.00 N ATOM 2040 CA VAL A 137 7.877 9.634 -1.155 1.00 0.00 C ATOM 2041 C VAL A 137 8.222 8.172 -1.418 1.00 0.00 C ATOM 2042 O VAL A 137 8.165 7.737 -2.574 1.00 0.00 O ATOM 2043 CB VAL A 137 6.354 9.889 -1.232 1.00 0.00 C ATOM 2044 CG1 VAL A 137 5.571 9.037 -0.219 1.00 0.00 C ATOM 2045 CG2 VAL A 137 6.039 11.379 -1.014 1.00 0.00 C ATOM 0 H VAL A 137 7.909 10.571 -3.002 1.00 0.00 H new ATOM 0 HA VAL A 137 8.208 9.915 -0.155 1.00 0.00 H new ATOM 0 HB VAL A 137 6.035 9.595 -2.232 1.00 0.00 H new ATOM 0 HG11 VAL A 137 4.506 9.250 -0.310 1.00 0.00 H new ATOM 0 HG12 VAL A 137 5.748 7.980 -0.419 1.00 0.00 H new ATOM 0 HG13 VAL A 137 5.904 9.276 0.791 1.00 0.00 H new ATOM 0 HG21 VAL A 137 4.962 11.536 -1.072 1.00 0.00 H new ATOM 0 HG22 VAL A 137 6.398 11.687 -0.032 1.00 0.00 H new ATOM 0 HG23 VAL A 137 6.534 11.972 -1.783 1.00 0.00 H new ATOM 2055 N GLY A 138 8.501 7.384 -0.386 1.00 0.00 N ATOM 2056 CA GLY A 138 8.680 5.948 -0.532 1.00 0.00 C ATOM 2057 C GLY A 138 8.007 5.272 0.642 1.00 0.00 C ATOM 2058 O GLY A 138 8.420 5.475 1.789 1.00 0.00 O ATOM 0 H GLY A 138 8.609 7.722 0.570 1.00 0.00 H new ATOM 0 HA2 GLY A 138 8.246 5.603 -1.471 1.00 0.00 H new ATOM 0 HA3 GLY A 138 9.740 5.697 -0.560 1.00 0.00 H new ATOM 2062 N THR A 139 6.961 4.497 0.381 1.00 0.00 N ATOM 2063 CA THR A 139 6.285 3.741 1.420 1.00 0.00 C ATOM 2064 C THR A 139 7.071 2.450 1.628 1.00 0.00 C ATOM 2065 O THR A 139 7.523 1.817 0.668 1.00 0.00 O ATOM 2066 CB THR A 139 4.820 3.484 1.036 1.00 0.00 C ATOM 2067 OG1 THR A 139 4.228 4.707 0.628 1.00 0.00 O ATOM 2068 CG2 THR A 139 4.017 2.941 2.224 1.00 0.00 C ATOM 0 H THR A 139 6.562 4.377 -0.550 1.00 0.00 H new ATOM 0 HA THR A 139 6.254 4.298 2.357 1.00 0.00 H new ATOM 0 HB THR A 139 4.806 2.748 0.232 1.00 0.00 H new ATOM 0 HG1 THR A 139 3.293 4.551 0.380 1.00 0.00 H new ATOM 0 HG21 THR A 139 2.985 2.770 1.918 1.00 0.00 H new ATOM 0 HG22 THR A 139 4.456 2.002 2.561 1.00 0.00 H new ATOM 0 HG23 THR A 139 4.039 3.665 3.039 1.00 0.00 H new ATOM 2076 N TRP A 140 7.231 2.084 2.895 1.00 0.00 N ATOM 2077 CA TRP A 140 7.836 0.852 3.335 1.00 0.00 C ATOM 2078 C TRP A 140 6.866 0.268 4.348 1.00 0.00 C ATOM 2079 O TRP A 140 6.346 0.999 5.196 1.00 0.00 O ATOM 2080 CB TRP A 140 9.229 1.121 3.920 1.00 0.00 C ATOM 2081 CG TRP A 140 9.321 2.010 5.130 1.00 0.00 C ATOM 2082 CD1 TRP A 140 9.021 3.329 5.172 1.00 0.00 C ATOM 2083 CD2 TRP A 140 9.757 1.666 6.481 1.00 0.00 C ATOM 2084 NE1 TRP A 140 9.231 3.820 6.443 1.00 0.00 N ATOM 2085 CE2 TRP A 140 9.680 2.835 7.297 1.00 0.00 C ATOM 2086 CE3 TRP A 140 10.207 0.481 7.104 1.00 0.00 C ATOM 2087 CZ2 TRP A 140 10.016 2.825 8.659 1.00 0.00 C ATOM 2088 CZ3 TRP A 140 10.546 0.459 8.471 1.00 0.00 C ATOM 2089 CH2 TRP A 140 10.442 1.624 9.251 1.00 0.00 C ATOM 0 H TRP A 140 6.926 2.671 3.671 1.00 0.00 H new ATOM 0 HA TRP A 140 8.001 0.145 2.522 1.00 0.00 H new ATOM 0 HB2 TRP A 140 9.676 0.160 4.175 1.00 0.00 H new ATOM 0 HB3 TRP A 140 9.843 1.560 3.134 1.00 0.00 H new ATOM 0 HD1 TRP A 140 8.669 3.911 4.333 1.00 0.00 H new ATOM 0 HE1 TRP A 140 9.074 4.790 6.717 1.00 0.00 H new ATOM 0 HE3 TRP A 140 10.293 -0.425 6.522 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 9.948 3.729 9.245 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 10.888 -0.460 8.923 1.00 0.00 H new ATOM 0 HH2 TRP A 140 10.689 1.596 10.302 1.00 0.00 H new ATOM 2100 N ILE A 141 6.587 -1.026 4.229 1.00 0.00 N ATOM 2101 CA ILE A 141 5.773 -1.770 5.173 1.00 0.00 C ATOM 2102 C ILE A 141 6.581 -3.021 5.464 1.00 0.00 C ATOM 2103 O ILE A 141 7.010 -3.710 4.534 1.00 0.00 O ATOM 2104 CB ILE A 141 4.362 -2.102 4.630 1.00 0.00 C ATOM 2105 CG1 ILE A 141 3.630 -0.899 3.993 1.00 0.00 C ATOM 2106 CG2 ILE A 141 3.502 -2.647 5.785 1.00 0.00 C ATOM 2107 CD1 ILE A 141 3.886 -0.740 2.492 1.00 0.00 C ATOM 0 H ILE A 141 6.930 -1.595 3.455 1.00 0.00 H new ATOM 0 HA ILE A 141 5.571 -1.186 6.071 1.00 0.00 H new ATOM 0 HB ILE A 141 4.501 -2.837 3.837 1.00 0.00 H new ATOM 0 HG12 ILE A 141 2.558 -1.009 4.159 1.00 0.00 H new ATOM 0 HG13 ILE A 141 3.939 0.013 4.503 1.00 0.00 H new ATOM 0 HG21 ILE A 141 2.505 -2.885 5.415 1.00 0.00 H new ATOM 0 HG22 ILE A 141 3.964 -3.548 6.189 1.00 0.00 H new ATOM 0 HG23 ILE A 141 3.428 -1.894 6.570 1.00 0.00 H new ATOM 0 HD11 ILE A 141 3.338 0.125 2.119 1.00 0.00 H new ATOM 0 HD12 ILE A 141 4.952 -0.597 2.318 1.00 0.00 H new ATOM 0 HD13 ILE A 141 3.550 -1.635 1.969 1.00 0.00 H new ATOM 2119 N ALA A 142 6.848 -3.281 6.734 1.00 0.00 N ATOM 2120 CA ALA A 142 7.487 -4.493 7.207 1.00 0.00 C ATOM 2121 C ALA A 142 6.664 -4.954 8.397 1.00 0.00 C ATOM 2122 O ALA A 142 6.183 -4.112 9.165 1.00 0.00 O ATOM 2123 CB ALA A 142 8.929 -4.181 7.603 1.00 0.00 C ATOM 0 H ALA A 142 6.617 -2.632 7.486 1.00 0.00 H new ATOM 0 HA ALA A 142 7.528 -5.274 6.448 1.00 0.00 H new ATOM 0 HB1 ALA A 142 9.413 -5.090 7.959 1.00 0.00 H new ATOM 0 HB2 ALA A 142 9.469 -3.798 6.737 1.00 0.00 H new ATOM 0 HB3 ALA A 142 8.935 -3.432 8.395 1.00 0.00 H new ATOM 2129 N GLY A 143 6.485 -6.259 8.557 1.00 0.00 N ATOM 2130 CA GLY A 143 5.495 -6.763 9.484 1.00 0.00 C ATOM 2131 C GLY A 143 5.547 -8.270 9.620 1.00 0.00 C ATOM 2132 O GLY A 143 6.484 -8.930 9.156 1.00 0.00 O ATOM 0 H GLY A 143 7.010 -6.978 8.059 1.00 0.00 H new ATOM 0 HA2 GLY A 143 5.651 -6.307 10.462 1.00 0.00 H new ATOM 0 HA3 GLY A 143 4.502 -6.465 9.148 1.00 0.00 H new ATOM 2136 N VAL A 144 4.523 -8.777 10.297 1.00 0.00 N ATOM 2137 CA VAL A 144 4.264 -10.177 10.582 1.00 0.00 C ATOM 2138 C VAL A 144 2.831 -10.488 10.124 1.00 0.00 C ATOM 2139 O VAL A 144 2.157 -9.635 9.538 1.00 0.00 O ATOM 2140 CB VAL A 144 4.544 -10.494 12.066 1.00 0.00 C ATOM 2141 CG1 VAL A 144 6.045 -10.367 12.364 1.00 0.00 C ATOM 2142 CG2 VAL A 144 3.731 -9.616 13.028 1.00 0.00 C ATOM 0 H VAL A 144 3.801 -8.172 10.688 1.00 0.00 H new ATOM 0 HA VAL A 144 4.939 -10.832 10.032 1.00 0.00 H new ATOM 0 HB VAL A 144 4.225 -11.523 12.235 1.00 0.00 H new ATOM 0 HG11 VAL A 144 6.228 -10.593 13.414 1.00 0.00 H new ATOM 0 HG12 VAL A 144 6.600 -11.067 11.740 1.00 0.00 H new ATOM 0 HG13 VAL A 144 6.374 -9.350 12.149 1.00 0.00 H new ATOM 0 HG21 VAL A 144 3.970 -9.885 14.057 1.00 0.00 H new ATOM 0 HG22 VAL A 144 3.978 -8.568 12.860 1.00 0.00 H new ATOM 0 HG23 VAL A 144 2.667 -9.771 12.851 1.00 0.00 H new ATOM 2152 N GLY A 145 2.338 -11.699 10.355 1.00 0.00 N ATOM 2153 CA GLY A 145 1.109 -12.201 9.761 1.00 0.00 C ATOM 2154 C GLY A 145 0.707 -13.466 10.491 1.00 0.00 C ATOM 2155 O GLY A 145 0.962 -13.570 11.686 1.00 0.00 O ATOM 0 H GLY A 145 2.792 -12.371 10.973 1.00 0.00 H new ATOM 0 HA2 GLY A 145 0.319 -11.453 9.835 1.00 0.00 H new ATOM 0 HA3 GLY A 145 1.256 -12.406 8.701 1.00 0.00 H new ATOM 2159 N TYR A 146 0.125 -14.423 9.778 1.00 0.00 N ATOM 2160 CA TYR A 146 -0.114 -15.809 10.161 1.00 0.00 C ATOM 2161 C TYR A 146 -0.086 -16.614 8.857 1.00 0.00 C ATOM 2162 O TYR A 146 -0.206 -16.042 7.769 1.00 0.00 O ATOM 2163 CB TYR A 146 -1.475 -15.987 10.865 1.00 0.00 C ATOM 2164 CG TYR A 146 -1.609 -15.310 12.216 1.00 0.00 C ATOM 2165 CD1 TYR A 146 -2.023 -13.968 12.306 1.00 0.00 C ATOM 2166 CD2 TYR A 146 -1.291 -16.022 13.386 1.00 0.00 C ATOM 2167 CE1 TYR A 146 -2.072 -13.326 13.555 1.00 0.00 C ATOM 2168 CE2 TYR A 146 -1.352 -15.391 14.642 1.00 0.00 C ATOM 2169 CZ TYR A 146 -1.714 -14.030 14.724 1.00 0.00 C ATOM 2170 OH TYR A 146 -1.742 -13.408 15.934 1.00 0.00 O ATOM 0 H TYR A 146 -0.221 -14.233 8.838 1.00 0.00 H new ATOM 0 HA TYR A 146 0.642 -16.144 10.871 1.00 0.00 H new ATOM 0 HB2 TYR A 146 -2.256 -15.604 10.208 1.00 0.00 H new ATOM 0 HB3 TYR A 146 -1.660 -17.053 10.993 1.00 0.00 H new ATOM 0 HD1 TYR A 146 -2.304 -13.430 11.413 1.00 0.00 H new ATOM 0 HD2 TYR A 146 -0.998 -17.059 13.320 1.00 0.00 H new ATOM 0 HE1 TYR A 146 -2.384 -12.294 13.620 1.00 0.00 H new ATOM 0 HE2 TYR A 146 -1.123 -15.946 15.540 1.00 0.00 H new ATOM 0 HH TYR A 146 -1.467 -14.038 16.632 1.00 0.00 H new ATOM 2180 N ARG A 147 0.028 -17.939 8.936 1.00 0.00 N ATOM 2181 CA ARG A 147 -0.182 -18.799 7.772 1.00 0.00 C ATOM 2182 C ARG A 147 -1.642 -19.225 7.760 1.00 0.00 C ATOM 2183 O ARG A 147 -2.152 -19.634 8.808 1.00 0.00 O ATOM 2184 CB ARG A 147 0.736 -20.029 7.843 1.00 0.00 C ATOM 2185 CG ARG A 147 0.713 -20.824 6.525 1.00 0.00 C ATOM 2186 CD ARG A 147 0.518 -22.324 6.717 1.00 0.00 C ATOM 2187 NE ARG A 147 1.736 -22.983 7.224 1.00 0.00 N ATOM 2188 CZ ARG A 147 1.813 -23.783 8.294 1.00 0.00 C ATOM 2189 NH1 ARG A 147 0.794 -23.907 9.134 1.00 0.00 N ATOM 2190 NH2 ARG A 147 2.898 -24.507 8.535 1.00 0.00 N ATOM 0 H ARG A 147 0.264 -18.440 9.793 1.00 0.00 H new ATOM 0 HA ARG A 147 0.058 -18.258 6.856 1.00 0.00 H new ATOM 0 HB2 ARG A 147 1.756 -19.712 8.060 1.00 0.00 H new ATOM 0 HB3 ARG A 147 0.421 -20.673 8.664 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -0.088 -20.440 5.894 1.00 0.00 H new ATOM 0 HG3 ARG A 147 1.648 -20.654 5.992 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -0.303 -22.496 7.413 1.00 0.00 H new ATOM 0 HD3 ARG A 147 0.231 -22.776 5.768 1.00 0.00 H new ATOM 0 HE ARG A 147 2.601 -22.813 6.711 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -0.068 -23.387 8.970 1.00 0.00 H new ATOM 0 HH12 ARG A 147 0.873 -24.522 9.944 1.00 0.00 H new ATOM 0 HH21 ARG A 147 3.694 -24.460 7.899 1.00 0.00 H new ATOM 0 HH22 ARG A 147 2.936 -25.111 9.356 1.00 0.00 H new ATOM 2204 N PHE A 148 -2.291 -19.230 6.597 1.00 0.00 N ATOM 2205 CA PHE A 148 -3.561 -19.906 6.410 1.00 0.00 C ATOM 2206 C PHE A 148 -3.467 -20.722 5.143 1.00 0.00 C ATOM 2207 O PHE A 148 -3.461 -20.145 4.037 1.00 0.00 O ATOM 2208 CB PHE A 148 -4.729 -18.920 6.413 1.00 0.00 C ATOM 2209 CG PHE A 148 -5.057 -18.413 7.801 1.00 0.00 C ATOM 2210 CD1 PHE A 148 -5.617 -19.291 8.747 1.00 0.00 C ATOM 2211 CD2 PHE A 148 -4.777 -17.084 8.168 1.00 0.00 C ATOM 2212 CE1 PHE A 148 -5.859 -18.859 10.062 1.00 0.00 C ATOM 2213 CE2 PHE A 148 -5.043 -16.645 9.478 1.00 0.00 C ATOM 2214 CZ PHE A 148 -5.570 -17.536 10.429 1.00 0.00 C ATOM 0 H PHE A 148 -1.945 -18.762 5.759 1.00 0.00 H new ATOM 0 HA PHE A 148 -3.765 -20.578 7.244 1.00 0.00 H new ATOM 0 HB2 PHE A 148 -4.488 -18.075 5.769 1.00 0.00 H new ATOM 0 HB3 PHE A 148 -5.609 -19.403 5.989 1.00 0.00 H new ATOM 0 HD1 PHE A 148 -5.862 -20.303 8.461 1.00 0.00 H new ATOM 0 HD2 PHE A 148 -4.358 -16.401 7.444 1.00 0.00 H new ATOM 0 HE1 PHE A 148 -6.267 -19.545 10.790 1.00 0.00 H new ATOM 0 HE2 PHE A 148 -4.842 -15.620 9.754 1.00 0.00 H new ATOM 0 HZ PHE A 148 -5.752 -17.203 11.440 1.00 0.00 H new TER 2224 PHE A 148