USER MOD reduce.3.24.130724 H: found=0, std=0, add=1309, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1329 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 34 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 127 HIS : no HD1:sc= -0.532 X(o=-0.53,f=-0.079) USER MOD Set 2.1: A 22 TYR OH : rot -30:sc= 0.234 USER MOD Set 2.2: A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 HIS : no HE2:sc= -6.96! C(o=-7!,f=-10!) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -0.695 K(o=-0.69,f=-4.3!) USER MOD Single : A 20 SER OG : rot 79:sc= 0.365 USER MOD Single : A 21 GLN : amide:sc= -1.93 K(o=-1.9,f=-8!) USER MOD Single : A 23 HIS :FLIP no HD1:sc= -1.03 F(o=-2.9!,f=-1) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot -150:sc= 1.18 USER MOD Single : A 36 ASN : amide:sc= -0.0296 X(o=-0.03,f=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 TYR OH : rot 180:sc= -1.66 USER MOD Single : A 41 LYS NZ :NH3+ -114:sc= -0.878 (180deg=-3.89!) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 180:sc= -0.27 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 120:sc= -0.433 USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 HIS :FLIP no HE2:sc= -0.782 F(o=-1.6!,f=-0.78) USER MOD Single : A 87 SER OG : rot 180:sc= -0.667 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.101 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 170:sc= -1.2 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00789) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= -1.19 K(o=-1.2,f=-8.8!) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot -133:sc= -2.11 USER MOD Single : A 106 ASN : amide:sc= -4.26! C(o=-4.3!,f=-7.1!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 ASN :FLIP amide:sc= -0.634 F(o=-1.3,f=-0.63) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 TYR OH : rot 180:sc= -0.785 USER MOD Single : A 114 SER OG : rot 95:sc= 0.55 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 HIS :FLIP no HE2:sc= -5.42 F(o=-6.4!,f=-5.4) USER MOD Single : A 132 SER OG : rot -115:sc= 1.46 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 135 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc=-0.00929 USER MOD Single : A 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= -0.237 K(o=-0.24,f=-0.93) USER MOD Single : A 148 TYR OH : rot 165:sc= -0.919 USER MOD Single : A 152 SER OG : rot -101:sc= -1.03! USER MOD Single : A 157 SER OG : rot 180:sc= -0.0379 USER MOD Single : A 158 GLN : amide:sc= -0.0185 X(o=-0.019,f=0) USER MOD Single : A 159 LYS NZ :NH3+ -128:sc= 0.0459 (180deg=0) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot -147:sc= 0.00164 USER MOD Single : A 166 SER OG : rot 180:sc= 0 USER MOD Single : A 171 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 14 N VAL A 2 -9.643 10.816 1.174 1.00 0.00 N ATOM 15 CA VAL A 2 -10.950 10.879 1.807 1.00 0.00 C ATOM 16 C VAL A 2 -10.781 11.261 3.279 1.00 0.00 C ATOM 17 O VAL A 2 -9.846 10.808 3.938 1.00 0.00 O ATOM 18 CB VAL A 2 -11.690 9.554 1.614 1.00 0.00 C ATOM 19 CG1 VAL A 2 -12.004 9.312 0.136 1.00 0.00 C ATOM 20 CG2 VAL A 2 -10.892 8.390 2.203 1.00 0.00 C ATOM 0 HA VAL A 2 -11.564 11.649 1.340 1.00 0.00 H new ATOM 0 HB VAL A 2 -12.636 9.617 2.151 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -12.530 8.364 0.026 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -12.631 10.120 -0.240 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -11.075 9.279 -0.433 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -11.440 7.460 2.052 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -9.924 8.325 1.707 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -10.743 8.554 3.270 1.00 0.00 H new ATOM 30 N TYR A 3 -11.699 12.090 3.752 1.00 0.00 N ATOM 31 CA TYR A 3 -11.664 12.538 5.134 1.00 0.00 C ATOM 32 C TYR A 3 -12.765 11.865 5.956 1.00 0.00 C ATOM 33 O TYR A 3 -13.834 11.557 5.433 1.00 0.00 O ATOM 34 CB TYR A 3 -11.921 14.046 5.095 1.00 0.00 C ATOM 35 CG TYR A 3 -12.281 14.650 6.454 1.00 0.00 C ATOM 36 CD1 TYR A 3 -11.363 14.627 7.484 1.00 0.00 C ATOM 37 CD2 TYR A 3 -13.523 15.218 6.649 1.00 0.00 C ATOM 38 CE1 TYR A 3 -11.701 15.196 8.763 1.00 0.00 C ATOM 39 CE2 TYR A 3 -13.862 15.787 7.928 1.00 0.00 C ATOM 40 CZ TYR A 3 -12.934 15.748 8.922 1.00 0.00 C ATOM 41 OH TYR A 3 -13.254 16.286 10.129 1.00 0.00 O ATOM 0 H TYR A 3 -12.473 12.464 3.202 1.00 0.00 H new ATOM 0 HA TYR A 3 -10.708 12.289 5.595 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -11.032 14.546 4.710 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -12.730 14.249 4.393 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -10.391 14.182 7.331 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -14.241 15.236 5.843 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -10.992 15.185 9.577 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -14.831 16.234 8.094 1.00 0.00 H new ATOM 0 HH TYR A 3 -14.165 16.644 10.096 1.00 0.00 H new ATOM 51 N HIS A 4 -12.464 11.658 7.230 1.00 0.00 N ATOM 52 CA HIS A 4 -13.415 11.028 8.130 1.00 0.00 C ATOM 53 C HIS A 4 -13.095 11.423 9.573 1.00 0.00 C ATOM 54 O HIS A 4 -12.023 11.959 9.851 1.00 0.00 O ATOM 55 CB HIS A 4 -13.439 9.513 7.921 1.00 0.00 C ATOM 56 CG HIS A 4 -13.503 9.093 6.472 1.00 0.00 C ATOM 57 ND1 HIS A 4 -14.642 8.557 5.897 1.00 0.00 N ATOM 58 CD2 HIS A 4 -12.559 9.138 5.489 1.00 0.00 C ATOM 59 CE1 HIS A 4 -14.383 8.294 4.624 1.00 0.00 C ATOM 60 NE2 HIS A 4 -13.092 8.654 4.374 1.00 0.00 N ATOM 0 H HIS A 4 -11.576 11.915 7.660 1.00 0.00 H new ATOM 0 HA HIS A 4 -14.421 11.383 7.908 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -12.548 9.080 8.375 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -14.299 9.098 8.447 1.00 0.00 H new ATOM 0 HD1 HIS A 4 -15.530 8.392 6.372 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -11.549 9.505 5.599 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -15.073 7.869 3.910 1.00 0.00 H new ATOM 68 N ASP A 5 -14.044 11.143 10.454 1.00 0.00 N ATOM 69 CA ASP A 5 -13.877 11.462 11.862 1.00 0.00 C ATOM 70 C ASP A 5 -13.708 10.166 12.657 1.00 0.00 C ATOM 71 O ASP A 5 -14.289 9.140 12.309 1.00 0.00 O ATOM 72 CB ASP A 5 -15.102 12.197 12.409 1.00 0.00 C ATOM 73 CG ASP A 5 -14.810 13.191 13.535 1.00 0.00 C ATOM 74 OD1 ASP A 5 -14.203 12.753 14.536 1.00 0.00 O ATOM 75 OD2 ASP A 5 -15.200 14.367 13.369 1.00 0.00 O ATOM 0 H ASP A 5 -14.932 10.698 10.220 1.00 0.00 H new ATOM 0 HA ASP A 5 -12.999 12.101 11.962 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -15.583 12.731 11.589 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -15.817 11.459 12.772 1.00 0.00 H new ATOM 81 N GLY A 6 -12.910 10.256 13.711 1.00 0.00 N ATOM 82 CA GLY A 6 -12.658 9.104 14.560 1.00 0.00 C ATOM 83 C GLY A 6 -11.434 8.324 14.075 1.00 0.00 C ATOM 84 O GLY A 6 -10.398 8.913 13.771 1.00 0.00 O ATOM 0 H GLY A 6 -12.429 11.109 13.996 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -12.501 9.432 15.588 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -13.531 8.452 14.563 1.00 0.00 H new ATOM 88 N ALA A 7 -11.595 7.010 14.017 1.00 0.00 N ATOM 89 CA ALA A 7 -10.516 6.143 13.574 1.00 0.00 C ATOM 90 C ALA A 7 -10.956 5.388 12.319 1.00 0.00 C ATOM 91 O ALA A 7 -12.061 5.598 11.820 1.00 0.00 O ATOM 92 CB ALA A 7 -10.118 5.201 14.712 1.00 0.00 C ATOM 0 H ALA A 7 -12.456 6.525 14.269 1.00 0.00 H new ATOM 0 HA ALA A 7 -9.635 6.730 13.313 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -9.309 4.551 14.380 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.785 5.786 15.569 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -10.977 4.594 14.999 1.00 0.00 H new ATOM 98 N CYS A 8 -10.070 4.525 11.845 1.00 0.00 N ATOM 99 CA CYS A 8 -10.354 3.737 10.657 1.00 0.00 C ATOM 100 C CYS A 8 -11.740 3.109 10.817 1.00 0.00 C ATOM 101 O CYS A 8 -12.142 2.757 11.925 1.00 0.00 O ATOM 102 CB CYS A 8 -9.274 2.683 10.406 1.00 0.00 C ATOM 103 SG CYS A 8 -7.557 3.310 10.482 1.00 0.00 S ATOM 0 H CYS A 8 -9.155 4.354 12.262 1.00 0.00 H new ATOM 0 HA CYS A 8 -10.349 4.383 9.779 1.00 0.00 H new ATOM 0 HB2 CYS A 8 -9.387 1.885 11.140 1.00 0.00 H new ATOM 0 HB3 CYS A 8 -9.441 2.239 9.425 1.00 0.00 H new ATOM 109 N PRO A 9 -12.450 2.982 9.664 1.00 0.00 N ATOM 110 CA PRO A 9 -13.782 2.402 9.666 1.00 0.00 C ATOM 111 C PRO A 9 -13.718 0.883 9.834 1.00 0.00 C ATOM 112 O PRO A 9 -12.655 0.329 10.109 1.00 0.00 O ATOM 113 CB PRO A 9 -14.399 2.828 8.344 1.00 0.00 C ATOM 114 CG PRO A 9 -13.236 3.235 7.454 1.00 0.00 C ATOM 115 CD PRO A 9 -12.006 3.387 8.334 1.00 0.00 C ATOM 0 HA PRO A 9 -14.389 2.747 10.503 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -14.966 2.012 7.897 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -15.092 3.658 8.485 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -13.064 2.483 6.684 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -13.457 4.171 6.942 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -11.187 2.760 7.982 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -11.643 4.415 8.333 1.00 0.00 H new ATOM 123 N GLU A 10 -14.870 0.251 9.660 1.00 0.00 N ATOM 124 CA GLU A 10 -14.958 -1.194 9.789 1.00 0.00 C ATOM 125 C GLU A 10 -14.366 -1.873 8.553 1.00 0.00 C ATOM 126 O GLU A 10 -14.867 -1.698 7.443 1.00 0.00 O ATOM 127 CB GLU A 10 -16.405 -1.636 10.017 1.00 0.00 C ATOM 128 CG GLU A 10 -16.729 -1.702 11.511 1.00 0.00 C ATOM 129 CD GLU A 10 -18.241 -1.706 11.745 1.00 0.00 C ATOM 130 OE1 GLU A 10 -18.743 -2.758 12.195 1.00 0.00 O ATOM 131 OE2 GLU A 10 -18.861 -0.656 11.468 1.00 0.00 O ATOM 0 H GLU A 10 -15.750 0.713 9.431 1.00 0.00 H new ATOM 0 HA GLU A 10 -14.378 -1.498 10.660 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -17.084 -0.940 9.524 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -16.566 -2.614 9.563 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -16.288 -2.601 11.943 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -16.281 -0.850 12.022 1.00 0.00 H new ATOM 139 N VAL A 11 -13.307 -2.635 8.787 1.00 0.00 N ATOM 140 CA VAL A 11 -12.641 -3.342 7.706 1.00 0.00 C ATOM 141 C VAL A 11 -11.980 -4.606 8.261 1.00 0.00 C ATOM 142 O VAL A 11 -11.050 -4.524 9.062 1.00 0.00 O ATOM 143 CB VAL A 11 -11.652 -2.410 7.002 1.00 0.00 C ATOM 144 CG1 VAL A 11 -12.376 -1.477 6.030 1.00 0.00 C ATOM 145 CG2 VAL A 11 -10.831 -1.614 8.018 1.00 0.00 C ATOM 0 H VAL A 11 -12.894 -2.778 9.709 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.363 -3.656 6.953 1.00 0.00 H new ATOM 0 HB VAL A 11 -10.963 -3.026 6.424 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -11.651 -0.825 5.543 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -12.896 -2.069 5.276 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -13.098 -0.871 6.577 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -10.136 -0.960 7.492 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -11.499 -1.013 8.635 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.272 -2.302 8.653 1.00 0.00 H new ATOM 155 N LYS A 12 -12.486 -5.745 7.812 1.00 0.00 N ATOM 156 CA LYS A 12 -11.957 -7.025 8.253 1.00 0.00 C ATOM 157 C LYS A 12 -10.581 -7.247 7.622 1.00 0.00 C ATOM 158 O LYS A 12 -10.471 -7.421 6.409 1.00 0.00 O ATOM 159 CB LYS A 12 -12.956 -8.147 7.963 1.00 0.00 C ATOM 160 CG LYS A 12 -12.907 -9.220 9.052 1.00 0.00 C ATOM 161 CD LYS A 12 -14.099 -10.172 8.938 1.00 0.00 C ATOM 162 CE LYS A 12 -14.167 -11.113 10.143 1.00 0.00 C ATOM 163 NZ LYS A 12 -15.564 -11.529 10.397 1.00 0.00 N ATOM 0 H LYS A 12 -13.257 -5.808 7.147 1.00 0.00 H new ATOM 0 HA LYS A 12 -11.817 -7.028 9.334 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -13.963 -7.735 7.899 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -12.733 -8.596 6.995 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -11.978 -9.784 8.970 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -12.908 -8.747 10.034 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -15.023 -9.597 8.868 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -14.017 -10.755 8.021 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -13.547 -11.991 9.962 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -13.764 -10.615 11.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -15.592 -12.167 11.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -16.146 -10.689 10.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -15.936 -12.023 9.561 1.00 0.00 H new ATOM 177 N PRO A 13 -9.539 -7.235 8.496 1.00 0.00 N ATOM 178 CA PRO A 13 -8.175 -7.434 8.036 1.00 0.00 C ATOM 179 C PRO A 13 -7.919 -8.904 7.698 1.00 0.00 C ATOM 180 O PRO A 13 -8.665 -9.782 8.126 1.00 0.00 O ATOM 181 CB PRO A 13 -7.300 -6.924 9.170 1.00 0.00 C ATOM 182 CG PRO A 13 -8.191 -6.892 10.401 1.00 0.00 C ATOM 183 CD PRO A 13 -9.631 -7.033 9.939 1.00 0.00 C ATOM 0 HA PRO A 13 -7.960 -6.898 7.112 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -6.442 -7.578 9.326 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -6.908 -5.932 8.945 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -7.928 -7.701 11.083 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -8.055 -5.958 10.946 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -10.123 -7.875 10.426 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -10.213 -6.143 10.178 1.00 0.00 H new ATOM 191 N VAL A 14 -6.861 -9.126 6.932 1.00 0.00 N ATOM 192 CA VAL A 14 -6.497 -10.474 6.531 1.00 0.00 C ATOM 193 C VAL A 14 -6.511 -11.388 7.758 1.00 0.00 C ATOM 194 O VAL A 14 -5.817 -11.126 8.739 1.00 0.00 O ATOM 195 CB VAL A 14 -5.147 -10.460 5.811 1.00 0.00 C ATOM 196 CG1 VAL A 14 -5.263 -9.791 4.440 1.00 0.00 C ATOM 197 CG2 VAL A 14 -4.078 -9.777 6.666 1.00 0.00 C ATOM 0 H VAL A 14 -6.244 -8.395 6.578 1.00 0.00 H new ATOM 0 HA VAL A 14 -7.224 -10.871 5.822 1.00 0.00 H new ATOM 0 HB VAL A 14 -4.840 -11.494 5.653 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -4.289 -9.795 3.950 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -5.980 -10.338 3.828 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -5.603 -8.763 4.564 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -3.128 -9.780 6.132 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -4.377 -8.749 6.869 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.967 -10.315 7.607 1.00 0.00 H new ATOM 207 N ASP A 15 -7.310 -12.441 7.663 1.00 0.00 N ATOM 208 CA ASP A 15 -7.423 -13.395 8.753 1.00 0.00 C ATOM 209 C ASP A 15 -6.092 -14.129 8.923 1.00 0.00 C ATOM 210 O ASP A 15 -5.723 -14.503 10.036 1.00 0.00 O ATOM 211 CB ASP A 15 -8.504 -14.438 8.462 1.00 0.00 C ATOM 212 CG ASP A 15 -8.550 -14.936 7.016 1.00 0.00 C ATOM 213 OD1 ASP A 15 -9.236 -14.272 6.209 1.00 0.00 O ATOM 214 OD2 ASP A 15 -7.898 -15.968 6.750 1.00 0.00 O ATOM 0 H ASP A 15 -7.885 -12.654 6.848 1.00 0.00 H new ATOM 0 HA ASP A 15 -7.686 -12.845 9.656 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -8.349 -15.293 9.120 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -9.475 -14.013 8.715 1.00 0.00 H new ATOM 220 N ASN A 16 -5.407 -14.313 7.804 1.00 0.00 N ATOM 221 CA ASN A 16 -4.124 -14.996 7.816 1.00 0.00 C ATOM 222 C ASN A 16 -3.299 -14.542 6.610 1.00 0.00 C ATOM 223 O ASN A 16 -3.287 -15.208 5.575 1.00 0.00 O ATOM 224 CB ASN A 16 -4.306 -16.512 7.721 1.00 0.00 C ATOM 225 CG ASN A 16 -2.963 -17.234 7.844 1.00 0.00 C ATOM 226 OD1 ASN A 16 -1.900 -16.644 7.745 1.00 0.00 O ATOM 227 ND2 ASN A 16 -3.070 -18.541 8.065 1.00 0.00 N ATOM 0 H ASN A 16 -5.716 -14.001 6.883 1.00 0.00 H new ATOM 0 HA ASN A 16 -3.620 -14.752 8.751 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -4.979 -16.851 8.509 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -4.774 -16.767 6.770 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -2.231 -19.112 8.162 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -3.992 -18.972 8.137 1.00 0.00 H new ATOM 234 N PHE A 17 -2.628 -13.413 6.783 1.00 0.00 N ATOM 235 CA PHE A 17 -1.802 -12.862 5.722 1.00 0.00 C ATOM 236 C PHE A 17 -0.613 -13.777 5.423 1.00 0.00 C ATOM 237 O PHE A 17 -0.076 -14.418 6.325 1.00 0.00 O ATOM 238 CB PHE A 17 -1.281 -11.512 6.216 1.00 0.00 C ATOM 239 CG PHE A 17 -1.230 -10.431 5.134 1.00 0.00 C ATOM 240 CD1 PHE A 17 -2.199 -10.376 4.182 1.00 0.00 C ATOM 241 CD2 PHE A 17 -0.216 -9.524 5.126 1.00 0.00 C ATOM 242 CE1 PHE A 17 -2.152 -9.373 3.178 1.00 0.00 C ATOM 243 CE2 PHE A 17 -0.169 -8.521 4.122 1.00 0.00 C ATOM 244 CZ PHE A 17 -1.138 -8.467 3.169 1.00 0.00 C ATOM 0 H PHE A 17 -2.639 -12.864 7.643 1.00 0.00 H new ATOM 0 HA PHE A 17 -2.387 -12.761 4.808 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -1.916 -11.166 7.032 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -0.280 -11.648 6.626 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -3.005 -11.095 4.189 1.00 0.00 H new ATOM 0 HD2 PHE A 17 0.553 -9.567 5.883 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -2.922 -9.330 2.422 1.00 0.00 H new ATOM 0 HE2 PHE A 17 0.636 -7.801 4.115 1.00 0.00 H new ATOM 0 HZ PHE A 17 -1.102 -7.704 2.405 1.00 0.00 H new ATOM 254 N ASP A 18 -0.235 -13.807 4.154 1.00 0.00 N ATOM 255 CA ASP A 18 0.882 -14.632 3.725 1.00 0.00 C ATOM 256 C ASP A 18 1.537 -13.997 2.497 1.00 0.00 C ATOM 257 O ASP A 18 0.874 -13.757 1.489 1.00 0.00 O ATOM 258 CB ASP A 18 0.412 -16.036 3.338 1.00 0.00 C ATOM 259 CG ASP A 18 1.234 -17.180 3.935 1.00 0.00 C ATOM 260 OD1 ASP A 18 2.460 -16.985 4.076 1.00 0.00 O ATOM 261 OD2 ASP A 18 0.617 -18.224 4.237 1.00 0.00 O ATOM 0 H ASP A 18 -0.682 -13.273 3.409 1.00 0.00 H new ATOM 0 HA ASP A 18 1.587 -14.703 4.553 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -0.626 -16.154 3.649 1.00 0.00 H new ATOM 0 HB3 ASP A 18 0.432 -16.123 2.252 1.00 0.00 H new ATOM 267 N TRP A 19 2.832 -13.744 2.621 1.00 0.00 N ATOM 268 CA TRP A 19 3.584 -13.142 1.534 1.00 0.00 C ATOM 269 C TRP A 19 4.079 -14.266 0.622 1.00 0.00 C ATOM 270 O TRP A 19 4.856 -14.025 -0.301 1.00 0.00 O ATOM 271 CB TRP A 19 4.717 -12.265 2.071 1.00 0.00 C ATOM 272 CG TRP A 19 4.473 -11.728 3.482 1.00 0.00 C ATOM 273 CD1 TRP A 19 4.735 -12.329 4.651 1.00 0.00 C ATOM 274 CD2 TRP A 19 3.903 -10.448 3.828 1.00 0.00 C ATOM 275 NE1 TRP A 19 4.378 -11.533 5.720 1.00 0.00 N ATOM 276 CE2 TRP A 19 3.855 -10.353 5.204 1.00 0.00 C ATOM 277 CE3 TRP A 19 3.443 -9.405 3.006 1.00 0.00 C ATOM 278 CZ2 TRP A 19 3.355 -9.233 5.879 1.00 0.00 C ATOM 279 CZ3 TRP A 19 2.946 -8.292 3.695 1.00 0.00 C ATOM 280 CH2 TRP A 19 2.891 -8.181 5.080 1.00 0.00 C ATOM 0 H TRP A 19 3.379 -13.945 3.458 1.00 0.00 H new ATOM 0 HA TRP A 19 2.950 -12.474 0.950 1.00 0.00 H new ATOM 0 HB2 TRP A 19 5.642 -12.842 2.068 1.00 0.00 H new ATOM 0 HB3 TRP A 19 4.864 -11.424 1.394 1.00 0.00 H new ATOM 0 HD1 TRP A 19 5.171 -13.313 4.744 1.00 0.00 H new ATOM 0 HE1 TRP A 19 4.479 -11.767 6.708 1.00 0.00 H new ATOM 0 HE3 TRP A 19 3.471 -9.458 1.928 1.00 0.00 H new ATOM 0 HZ2 TRP A 19 3.329 -9.183 6.958 1.00 0.00 H new ATOM 0 HZ3 TRP A 19 2.580 -7.462 3.110 1.00 0.00 H new ATOM 0 HH2 TRP A 19 2.492 -7.288 5.537 1.00 0.00 H new ATOM 291 N SER A 20 3.610 -15.471 0.912 1.00 0.00 N ATOM 292 CA SER A 20 3.995 -16.633 0.130 1.00 0.00 C ATOM 293 C SER A 20 3.896 -16.314 -1.364 1.00 0.00 C ATOM 294 O SER A 20 4.723 -16.766 -2.154 1.00 0.00 O ATOM 295 CB SER A 20 3.122 -17.842 0.473 1.00 0.00 C ATOM 296 OG SER A 20 3.550 -18.486 1.670 1.00 0.00 O ATOM 0 H SER A 20 2.966 -15.667 1.678 1.00 0.00 H new ATOM 0 HA SER A 20 5.027 -16.883 0.375 1.00 0.00 H new ATOM 0 HB2 SER A 20 2.086 -17.522 0.584 1.00 0.00 H new ATOM 0 HB3 SER A 20 3.149 -18.554 -0.352 1.00 0.00 H new ATOM 0 HG SER A 20 3.226 -17.983 2.446 1.00 0.00 H new ATOM 302 N GLN A 21 2.878 -15.538 -1.705 1.00 0.00 N ATOM 303 CA GLN A 21 2.661 -15.154 -3.089 1.00 0.00 C ATOM 304 C GLN A 21 2.751 -13.634 -3.239 1.00 0.00 C ATOM 305 O GLN A 21 3.700 -13.120 -3.830 1.00 0.00 O ATOM 306 CB GLN A 21 1.316 -15.676 -3.599 1.00 0.00 C ATOM 307 CG GLN A 21 0.330 -15.867 -2.445 1.00 0.00 C ATOM 308 CD GLN A 21 0.406 -17.291 -1.889 1.00 0.00 C ATOM 309 OE1 GLN A 21 1.460 -17.899 -1.812 1.00 0.00 O ATOM 310 NE2 GLN A 21 -0.768 -17.786 -1.508 1.00 0.00 N ATOM 0 H GLN A 21 2.194 -15.165 -1.047 1.00 0.00 H new ATOM 0 HA GLN A 21 3.444 -15.607 -3.698 1.00 0.00 H new ATOM 0 HB2 GLN A 21 0.901 -14.976 -4.324 1.00 0.00 H new ATOM 0 HB3 GLN A 21 1.462 -16.623 -4.118 1.00 0.00 H new ATOM 0 HG2 GLN A 21 0.549 -15.151 -1.653 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -0.683 -15.661 -2.790 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -1.613 -17.222 -1.600 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -0.823 -18.729 -1.124 1.00 0.00 H new ATOM 319 N TYR A 22 1.751 -12.957 -2.693 1.00 0.00 N ATOM 320 CA TYR A 22 1.706 -11.507 -2.758 1.00 0.00 C ATOM 321 C TYR A 22 3.072 -10.900 -2.430 1.00 0.00 C ATOM 322 O TYR A 22 3.428 -10.761 -1.261 1.00 0.00 O ATOM 323 CB TYR A 22 0.697 -11.068 -1.694 1.00 0.00 C ATOM 324 CG TYR A 22 1.113 -9.815 -0.921 1.00 0.00 C ATOM 325 CD1 TYR A 22 1.700 -8.757 -1.586 1.00 0.00 C ATOM 326 CD2 TYR A 22 0.902 -9.742 0.441 1.00 0.00 C ATOM 327 CE1 TYR A 22 2.091 -7.578 -0.859 1.00 0.00 C ATOM 328 CE2 TYR A 22 1.294 -8.563 1.168 1.00 0.00 C ATOM 329 CZ TYR A 22 1.869 -7.539 0.483 1.00 0.00 C ATOM 330 OH TYR A 22 2.239 -6.425 1.170 1.00 0.00 O ATOM 0 H TYR A 22 0.966 -13.387 -2.204 1.00 0.00 H new ATOM 0 HA TYR A 22 1.429 -11.176 -3.759 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -0.264 -10.884 -2.174 1.00 0.00 H new ATOM 0 HB3 TYR A 22 0.550 -11.886 -0.988 1.00 0.00 H new ATOM 0 HD1 TYR A 22 1.866 -8.814 -2.652 1.00 0.00 H new ATOM 0 HD2 TYR A 22 0.443 -10.569 0.961 1.00 0.00 H new ATOM 0 HE1 TYR A 22 2.550 -6.743 -1.367 1.00 0.00 H new ATOM 0 HE2 TYR A 22 1.135 -8.493 2.234 1.00 0.00 H new ATOM 0 HH TYR A 22 3.012 -6.012 0.732 1.00 0.00 H new ATOM 340 N HIS A 23 3.799 -10.555 -3.482 1.00 0.00 N ATOM 341 CA HIS A 23 5.117 -9.967 -3.321 1.00 0.00 C ATOM 342 C HIS A 23 5.677 -9.578 -4.690 1.00 0.00 C ATOM 343 O HIS A 23 4.939 -9.516 -5.672 1.00 0.00 O ATOM 344 CB HIS A 23 6.042 -10.909 -2.548 1.00 0.00 C ATOM 345 CG HIS A 23 6.515 -12.099 -3.349 1.00 0.00 C ATOM 346 ND1 HIS A 23 6.293 -12.442 -4.650 1.00 0.00 N flip ATOM 347 CD2 HIS A 23 7.315 -13.093 -2.813 1.00 0.00 C flip ATOM 348 CE1 HIS A 23 6.924 -13.584 -4.896 1.00 0.00 C flip ATOM 349 NE2 HIS A 23 7.558 -13.989 -3.758 1.00 0.00 N flip ATOM 0 H HIS A 23 3.500 -10.672 -4.450 1.00 0.00 H new ATOM 0 HA HIS A 23 5.042 -9.057 -2.726 1.00 0.00 H new ATOM 0 HB2 HIS A 23 6.910 -10.347 -2.204 1.00 0.00 H new ATOM 0 HB3 HIS A 23 5.521 -11.266 -1.660 1.00 0.00 H new ATOM 0 HD2 HIS A 23 7.679 -13.132 -1.797 1.00 0.00 H new ATOM 0 HE1 HIS A 23 6.934 -14.106 -5.841 1.00 0.00 H new ATOM 0 HE2 HIS A 23 8.120 -14.833 -3.653 1.00 0.00 H new ATOM 357 N GLY A 24 6.978 -9.327 -4.713 1.00 0.00 N ATOM 358 CA GLY A 24 7.646 -8.946 -5.946 1.00 0.00 C ATOM 359 C GLY A 24 7.207 -7.552 -6.399 1.00 0.00 C ATOM 360 O GLY A 24 6.905 -6.693 -5.573 1.00 0.00 O ATOM 0 H GLY A 24 7.588 -9.380 -3.897 1.00 0.00 H new ATOM 0 HA2 GLY A 24 8.726 -8.961 -5.798 1.00 0.00 H new ATOM 0 HA3 GLY A 24 7.421 -9.674 -6.726 1.00 0.00 H new ATOM 364 N LYS A 25 7.185 -7.371 -7.712 1.00 0.00 N ATOM 365 CA LYS A 25 6.788 -6.097 -8.285 1.00 0.00 C ATOM 366 C LYS A 25 5.280 -6.105 -8.540 1.00 0.00 C ATOM 367 O LYS A 25 4.740 -7.078 -9.064 1.00 0.00 O ATOM 368 CB LYS A 25 7.621 -5.787 -9.530 1.00 0.00 C ATOM 369 CG LYS A 25 8.832 -4.921 -9.179 1.00 0.00 C ATOM 370 CD LYS A 25 10.138 -5.685 -9.408 1.00 0.00 C ATOM 371 CE LYS A 25 10.795 -5.266 -10.725 1.00 0.00 C ATOM 372 NZ LYS A 25 11.939 -6.151 -11.037 1.00 0.00 N ATOM 0 H LYS A 25 7.436 -8.086 -8.395 1.00 0.00 H new ATOM 0 HA LYS A 25 6.989 -5.286 -7.585 1.00 0.00 H new ATOM 0 HB2 LYS A 25 7.956 -6.717 -9.989 1.00 0.00 H new ATOM 0 HB3 LYS A 25 7.003 -5.273 -10.266 1.00 0.00 H new ATOM 0 HG2 LYS A 25 8.825 -4.016 -9.787 1.00 0.00 H new ATOM 0 HG3 LYS A 25 8.769 -4.606 -8.137 1.00 0.00 H new ATOM 0 HD2 LYS A 25 10.823 -5.498 -8.581 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.939 -6.757 -9.422 1.00 0.00 H new ATOM 0 HE2 LYS A 25 10.064 -5.308 -11.533 1.00 0.00 H new ATOM 0 HE3 LYS A 25 11.135 -4.233 -10.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.374 -5.853 -11.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 12.643 -6.090 -10.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 11.605 -7.132 -11.123 1.00 0.00 H new ATOM 386 N TRP A 26 4.641 -5.008 -8.157 1.00 0.00 N ATOM 387 CA TRP A 26 3.206 -4.877 -8.338 1.00 0.00 C ATOM 388 C TRP A 26 2.917 -3.448 -8.804 1.00 0.00 C ATOM 389 O TRP A 26 3.422 -2.489 -8.224 1.00 0.00 O ATOM 390 CB TRP A 26 2.455 -5.252 -7.059 1.00 0.00 C ATOM 391 CG TRP A 26 2.292 -6.759 -6.852 1.00 0.00 C ATOM 392 CD1 TRP A 26 3.253 -7.690 -6.777 1.00 0.00 C ATOM 393 CD2 TRP A 26 1.050 -7.476 -6.695 1.00 0.00 C ATOM 394 NE1 TRP A 26 2.723 -8.950 -6.584 1.00 0.00 N ATOM 395 CE2 TRP A 26 1.340 -8.815 -6.533 1.00 0.00 C ATOM 396 CE3 TRP A 26 -0.276 -7.008 -6.690 1.00 0.00 C ATOM 397 CZ2 TRP A 26 0.358 -9.797 -6.354 1.00 0.00 C ATOM 398 CZ3 TRP A 26 -1.246 -8.002 -6.511 1.00 0.00 C ATOM 399 CH2 TRP A 26 -0.970 -9.354 -6.346 1.00 0.00 C ATOM 0 H TRP A 26 5.091 -4.203 -7.722 1.00 0.00 H new ATOM 0 HA TRP A 26 2.848 -5.571 -9.099 1.00 0.00 H new ATOM 0 HB2 TRP A 26 2.984 -4.833 -6.203 1.00 0.00 H new ATOM 0 HB3 TRP A 26 1.468 -4.790 -7.081 1.00 0.00 H new ATOM 0 HD1 TRP A 26 4.309 -7.481 -6.857 1.00 0.00 H new ATOM 0 HE1 TRP A 26 3.249 -9.819 -6.495 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -0.526 -5.965 -6.814 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 0.611 -10.839 -6.229 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -2.282 -7.696 -6.500 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -1.776 -10.060 -6.212 1.00 0.00 H new ATOM 410 N TRP A 27 2.104 -3.353 -9.846 1.00 0.00 N ATOM 411 CA TRP A 27 1.742 -2.058 -10.396 1.00 0.00 C ATOM 412 C TRP A 27 0.337 -1.710 -9.901 1.00 0.00 C ATOM 413 O TRP A 27 -0.574 -2.533 -9.980 1.00 0.00 O ATOM 414 CB TRP A 27 1.855 -2.059 -11.922 1.00 0.00 C ATOM 415 CG TRP A 27 3.294 -2.104 -12.440 1.00 0.00 C ATOM 416 CD1 TRP A 27 4.158 -1.088 -12.563 1.00 0.00 C ATOM 417 CD2 TRP A 27 4.005 -3.272 -12.902 1.00 0.00 C ATOM 418 NE1 TRP A 27 5.370 -1.513 -13.069 1.00 0.00 N ATOM 419 CE2 TRP A 27 5.274 -2.883 -13.282 1.00 0.00 C ATOM 420 CE3 TRP A 27 3.590 -4.612 -12.997 1.00 0.00 C ATOM 421 CZ2 TRP A 27 6.231 -3.774 -13.781 1.00 0.00 C ATOM 422 CZ3 TRP A 27 4.559 -5.490 -13.498 1.00 0.00 C ATOM 423 CH2 TRP A 27 5.840 -5.115 -13.884 1.00 0.00 C ATOM 0 H TRP A 27 1.686 -4.151 -10.324 1.00 0.00 H new ATOM 0 HA TRP A 27 2.433 -1.287 -10.054 1.00 0.00 H new ATOM 0 HB2 TRP A 27 1.311 -2.918 -12.316 1.00 0.00 H new ATOM 0 HB3 TRP A 27 1.367 -1.166 -12.313 1.00 0.00 H new ATOM 0 HD1 TRP A 27 3.935 -0.065 -12.299 1.00 0.00 H new ATOM 0 HE1 TRP A 27 6.186 -0.929 -13.253 1.00 0.00 H new ATOM 0 HE3 TRP A 27 2.602 -4.938 -12.707 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 7.218 -3.445 -14.071 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 4.292 -6.532 -13.591 1.00 0.00 H new ATOM 0 HH2 TRP A 27 6.531 -5.854 -14.262 1.00 0.00 H new ATOM 434 N GLU A 28 0.206 -0.490 -9.401 1.00 0.00 N ATOM 435 CA GLU A 28 -1.073 -0.024 -8.893 1.00 0.00 C ATOM 436 C GLU A 28 -2.141 -0.106 -9.986 1.00 0.00 C ATOM 437 O GLU A 28 -1.817 -0.185 -11.170 1.00 0.00 O ATOM 438 CB GLU A 28 -0.959 1.400 -8.344 1.00 0.00 C ATOM 439 CG GLU A 28 -0.830 2.417 -9.480 1.00 0.00 C ATOM 440 CD GLU A 28 -2.207 2.868 -9.970 1.00 0.00 C ATOM 441 OE1 GLU A 28 -2.328 3.095 -11.194 1.00 0.00 O ATOM 442 OE2 GLU A 28 -3.109 2.976 -9.111 1.00 0.00 O ATOM 0 H GLU A 28 0.964 0.189 -9.337 1.00 0.00 H new ATOM 0 HA GLU A 28 -1.373 -0.673 -8.070 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -1.837 1.632 -7.741 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -0.093 1.472 -7.687 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -0.261 3.281 -9.137 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -0.272 1.976 -10.306 1.00 0.00 H new ATOM 450 N VAL A 29 -3.392 -0.084 -9.549 1.00 0.00 N ATOM 451 CA VAL A 29 -4.509 -0.155 -10.476 1.00 0.00 C ATOM 452 C VAL A 29 -5.406 1.069 -10.281 1.00 0.00 C ATOM 453 O VAL A 29 -5.248 2.075 -10.971 1.00 0.00 O ATOM 454 CB VAL A 29 -5.255 -1.478 -10.295 1.00 0.00 C ATOM 455 CG1 VAL A 29 -5.166 -2.335 -11.560 1.00 0.00 C ATOM 456 CG2 VAL A 29 -4.730 -2.242 -9.078 1.00 0.00 C ATOM 0 H VAL A 29 -3.657 -0.018 -8.566 1.00 0.00 H new ATOM 0 HA VAL A 29 -4.153 -0.136 -11.506 1.00 0.00 H new ATOM 0 HB VAL A 29 -6.306 -1.248 -10.119 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -5.704 -3.270 -11.405 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.609 -1.796 -12.397 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -4.121 -2.551 -11.781 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.278 -3.179 -8.972 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -3.669 -2.455 -9.212 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -4.869 -1.638 -8.181 1.00 0.00 H new ATOM 466 N ALA A 30 -6.328 0.943 -9.338 1.00 0.00 N ATOM 467 CA ALA A 30 -7.251 2.026 -9.044 1.00 0.00 C ATOM 468 C ALA A 30 -7.056 2.477 -7.595 1.00 0.00 C ATOM 469 O ALA A 30 -7.348 1.728 -6.664 1.00 0.00 O ATOM 470 CB ALA A 30 -8.683 1.567 -9.324 1.00 0.00 C ATOM 0 H ALA A 30 -6.456 0.107 -8.767 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.053 2.884 -9.686 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.375 2.380 -9.103 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -8.776 1.286 -10.373 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.919 0.708 -8.696 1.00 0.00 H new ATOM 476 N LYS A 31 -6.563 3.698 -7.450 1.00 0.00 N ATOM 477 CA LYS A 31 -6.326 4.257 -6.130 1.00 0.00 C ATOM 478 C LYS A 31 -6.797 5.712 -6.105 1.00 0.00 C ATOM 479 O LYS A 31 -6.725 6.409 -7.116 1.00 0.00 O ATOM 480 CB LYS A 31 -4.861 4.078 -5.727 1.00 0.00 C ATOM 481 CG LYS A 31 -3.999 5.220 -6.270 1.00 0.00 C ATOM 482 CD LYS A 31 -3.511 6.125 -5.138 1.00 0.00 C ATOM 483 CE LYS A 31 -2.036 5.865 -4.825 1.00 0.00 C ATOM 484 NZ LYS A 31 -1.669 6.463 -3.522 1.00 0.00 N ATOM 0 H LYS A 31 -6.321 4.316 -8.225 1.00 0.00 H new ATOM 0 HA LYS A 31 -6.907 3.720 -5.380 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -4.781 4.042 -4.641 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -4.490 3.126 -6.106 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -3.144 4.811 -6.807 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -4.575 5.806 -6.986 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -3.648 7.169 -5.418 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -4.112 5.953 -4.245 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -1.846 4.792 -4.806 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -1.411 6.285 -5.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -0.665 6.277 -3.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -1.831 7.490 -3.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -2.252 6.043 -2.771 1.00 0.00 H new ATOM 498 N TYR A 32 -7.268 6.128 -4.938 1.00 0.00 N ATOM 499 CA TYR A 32 -7.751 7.488 -4.769 1.00 0.00 C ATOM 500 C TYR A 32 -6.875 8.481 -5.536 1.00 0.00 C ATOM 501 O TYR A 32 -5.736 8.172 -5.880 1.00 0.00 O ATOM 502 CB TYR A 32 -7.649 7.788 -3.272 1.00 0.00 C ATOM 503 CG TYR A 32 -8.632 6.993 -2.410 1.00 0.00 C ATOM 504 CD1 TYR A 32 -9.950 6.869 -2.802 1.00 0.00 C ATOM 505 CD2 TYR A 32 -8.201 6.400 -1.241 1.00 0.00 C ATOM 506 CE1 TYR A 32 -10.874 6.120 -1.990 1.00 0.00 C ATOM 507 CE2 TYR A 32 -9.126 5.651 -0.429 1.00 0.00 C ATOM 508 CZ TYR A 32 -10.417 5.548 -0.844 1.00 0.00 C ATOM 509 OH TYR A 32 -11.290 4.841 -0.078 1.00 0.00 O ATOM 0 H TYR A 32 -7.325 5.548 -4.101 1.00 0.00 H new ATOM 0 HA TYR A 32 -8.769 7.583 -5.147 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -6.634 7.575 -2.938 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -7.820 8.853 -3.113 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -10.288 7.333 -3.717 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -7.170 6.497 -0.935 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -11.908 6.015 -2.285 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -8.802 5.182 0.488 1.00 0.00 H new ATOM 0 HH TYR A 32 -11.025 4.904 0.863 1.00 0.00 H new ATOM 519 N PRO A 33 -7.456 9.684 -5.788 1.00 0.00 N ATOM 520 CA PRO A 33 -6.741 10.724 -6.508 1.00 0.00 C ATOM 521 C PRO A 33 -5.686 11.382 -5.617 1.00 0.00 C ATOM 522 O PRO A 33 -5.048 12.354 -6.018 1.00 0.00 O ATOM 523 CB PRO A 33 -7.817 11.694 -6.969 1.00 0.00 C ATOM 524 CG PRO A 33 -9.032 11.413 -6.100 1.00 0.00 C ATOM 525 CD PRO A 33 -8.804 10.086 -5.396 1.00 0.00 C ATOM 0 HA PRO A 33 -6.181 10.337 -7.359 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -7.486 12.726 -6.856 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -8.049 11.547 -8.024 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -9.174 12.212 -5.372 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -9.935 11.372 -6.709 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -8.886 10.193 -4.314 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -9.542 9.344 -5.700 1.00 0.00 H new ATOM 533 N SER A 34 -5.533 10.825 -4.425 1.00 0.00 N ATOM 534 CA SER A 34 -4.566 11.345 -3.474 1.00 0.00 C ATOM 535 C SER A 34 -5.010 12.721 -2.975 1.00 0.00 C ATOM 536 O SER A 34 -5.911 13.332 -3.548 1.00 0.00 O ATOM 537 CB SER A 34 -3.172 11.430 -4.098 1.00 0.00 C ATOM 538 OG SER A 34 -2.352 10.325 -3.728 1.00 0.00 O ATOM 0 H SER A 34 -6.063 10.018 -4.096 1.00 0.00 H new ATOM 0 HA SER A 34 -4.515 10.659 -2.628 1.00 0.00 H new ATOM 0 HB2 SER A 34 -3.263 11.466 -5.184 1.00 0.00 H new ATOM 0 HB3 SER A 34 -2.692 12.358 -3.787 1.00 0.00 H new ATOM 0 HG SER A 34 -1.471 10.416 -4.148 1.00 0.00 H new ATOM 544 N PRO A 35 -4.339 13.182 -1.886 1.00 0.00 N ATOM 545 CA PRO A 35 -4.655 14.475 -1.304 1.00 0.00 C ATOM 546 C PRO A 35 -4.106 15.613 -2.167 1.00 0.00 C ATOM 547 O PRO A 35 -4.746 16.654 -2.308 1.00 0.00 O ATOM 548 CB PRO A 35 -4.047 14.439 0.089 1.00 0.00 C ATOM 549 CG PRO A 35 -3.020 13.318 0.066 1.00 0.00 C ATOM 550 CD PRO A 35 -3.265 12.486 -1.182 1.00 0.00 C ATOM 0 HA PRO A 35 -5.728 14.662 -1.251 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -3.579 15.392 0.336 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -4.811 14.254 0.844 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -2.009 13.726 0.060 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -3.109 12.701 0.960 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -2.367 12.419 -1.796 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -3.554 11.466 -0.928 1.00 0.00 H new ATOM 558 N ASN A 36 -2.926 15.377 -2.721 1.00 0.00 N ATOM 559 CA ASN A 36 -2.284 16.369 -3.566 1.00 0.00 C ATOM 560 C ASN A 36 -2.856 16.274 -4.982 1.00 0.00 C ATOM 561 O ASN A 36 -2.351 16.915 -5.903 1.00 0.00 O ATOM 562 CB ASN A 36 -0.775 16.129 -3.648 1.00 0.00 C ATOM 563 CG ASN A 36 0.003 17.383 -3.243 1.00 0.00 C ATOM 564 OD1 ASN A 36 -0.015 17.814 -2.102 1.00 0.00 O ATOM 565 ND2 ASN A 36 0.685 17.942 -4.239 1.00 0.00 N ATOM 0 H ASN A 36 -2.398 14.513 -2.601 1.00 0.00 H new ATOM 0 HA ASN A 36 -2.470 17.352 -3.133 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -0.499 15.300 -2.997 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -0.504 15.841 -4.664 1.00 0.00 H new ATOM 0 HD21 ASN A 36 1.236 18.783 -4.070 1.00 0.00 H new ATOM 0 HD22 ASN A 36 0.657 17.529 -5.171 1.00 0.00 H new ATOM 572 N GLY A 37 -3.901 15.470 -5.111 1.00 0.00 N ATOM 573 CA GLY A 37 -4.546 15.283 -6.399 1.00 0.00 C ATOM 574 C GLY A 37 -3.523 14.929 -7.480 1.00 0.00 C ATOM 575 O GLY A 37 -3.571 15.466 -8.585 1.00 0.00 O ATOM 0 H GLY A 37 -4.317 14.941 -4.345 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -5.291 14.490 -6.325 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -5.076 16.193 -6.679 1.00 0.00 H new ATOM 579 N LYS A 38 -2.619 14.028 -7.122 1.00 0.00 N ATOM 580 CA LYS A 38 -1.586 13.597 -8.047 1.00 0.00 C ATOM 581 C LYS A 38 -1.616 12.072 -8.164 1.00 0.00 C ATOM 582 O LYS A 38 -2.521 11.423 -7.639 1.00 0.00 O ATOM 583 CB LYS A 38 -0.224 14.154 -7.627 1.00 0.00 C ATOM 584 CG LYS A 38 0.161 15.364 -8.482 1.00 0.00 C ATOM 585 CD LYS A 38 1.630 15.737 -8.274 1.00 0.00 C ATOM 586 CE LYS A 38 1.766 17.186 -7.803 1.00 0.00 C ATOM 587 NZ LYS A 38 2.003 18.085 -8.955 1.00 0.00 N ATOM 0 H LYS A 38 -2.581 13.585 -6.204 1.00 0.00 H new ATOM 0 HA LYS A 38 -1.776 13.998 -9.043 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -0.253 14.441 -6.576 1.00 0.00 H new ATOM 0 HB3 LYS A 38 0.536 13.379 -7.725 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -0.016 15.141 -9.534 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -0.473 16.212 -8.225 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.078 15.068 -7.539 1.00 0.00 H new ATOM 0 HD3 LYS A 38 2.179 15.601 -9.206 1.00 0.00 H new ATOM 0 HE2 LYS A 38 0.861 17.490 -7.277 1.00 0.00 H new ATOM 0 HE3 LYS A 38 2.590 17.268 -7.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 2.093 19.065 -8.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 2.879 17.804 -9.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.204 18.019 -9.617 1.00 0.00 H new ATOM 601 N TYR A 39 -0.617 11.543 -8.854 1.00 0.00 N ATOM 602 CA TYR A 39 -0.518 10.106 -9.046 1.00 0.00 C ATOM 603 C TYR A 39 0.930 9.686 -9.309 1.00 0.00 C ATOM 604 O TYR A 39 1.798 10.533 -9.513 1.00 0.00 O ATOM 605 CB TYR A 39 -1.361 9.787 -10.282 1.00 0.00 C ATOM 606 CG TYR A 39 -2.869 9.906 -10.054 1.00 0.00 C ATOM 607 CD1 TYR A 39 -3.491 9.106 -9.118 1.00 0.00 C ATOM 608 CD2 TYR A 39 -3.608 10.814 -10.785 1.00 0.00 C ATOM 609 CE1 TYR A 39 -4.911 9.218 -8.903 1.00 0.00 C ATOM 610 CE2 TYR A 39 -5.027 10.927 -10.571 1.00 0.00 C ATOM 611 CZ TYR A 39 -5.609 10.123 -9.640 1.00 0.00 C ATOM 612 OH TYR A 39 -6.949 10.230 -9.437 1.00 0.00 O ATOM 0 H TYR A 39 0.132 12.084 -9.287 1.00 0.00 H new ATOM 0 HA TYR A 39 -0.861 9.576 -8.157 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -1.072 10.459 -11.090 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -1.133 8.774 -10.613 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -2.913 8.395 -8.546 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -3.121 11.440 -11.518 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -5.410 8.597 -8.173 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -5.616 11.634 -11.136 1.00 0.00 H new ATOM 0 HH TYR A 39 -7.316 10.917 -10.032 1.00 0.00 H new ATOM 622 N GLY A 40 1.145 8.379 -9.296 1.00 0.00 N ATOM 623 CA GLY A 40 2.473 7.837 -9.531 1.00 0.00 C ATOM 624 C GLY A 40 2.393 6.440 -10.150 1.00 0.00 C ATOM 625 O GLY A 40 1.799 5.533 -9.569 1.00 0.00 O ATOM 0 H GLY A 40 0.422 7.679 -9.126 1.00 0.00 H new ATOM 0 HA2 GLY A 40 3.029 8.501 -10.193 1.00 0.00 H new ATOM 0 HA3 GLY A 40 3.023 7.791 -8.591 1.00 0.00 H new ATOM 629 N LYS A 41 3.000 6.311 -11.320 1.00 0.00 N ATOM 630 CA LYS A 41 3.005 5.040 -12.024 1.00 0.00 C ATOM 631 C LYS A 41 4.381 4.816 -12.654 1.00 0.00 C ATOM 632 O LYS A 41 5.328 5.544 -12.360 1.00 0.00 O ATOM 633 CB LYS A 41 1.852 4.979 -13.028 1.00 0.00 C ATOM 634 CG LYS A 41 0.515 4.766 -12.316 1.00 0.00 C ATOM 635 CD LYS A 41 -0.240 6.088 -12.162 1.00 0.00 C ATOM 636 CE LYS A 41 -1.202 6.036 -10.974 1.00 0.00 C ATOM 637 NZ LYS A 41 -2.598 6.224 -11.427 1.00 0.00 N ATOM 0 H LYS A 41 3.492 7.066 -11.798 1.00 0.00 H new ATOM 0 HA LYS A 41 2.835 4.219 -11.328 1.00 0.00 H new ATOM 0 HB2 LYS A 41 1.818 5.904 -13.604 1.00 0.00 H new ATOM 0 HB3 LYS A 41 2.024 4.168 -13.736 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -0.093 4.059 -12.880 1.00 0.00 H new ATOM 0 HG3 LYS A 41 0.688 4.325 -11.334 1.00 0.00 H new ATOM 0 HD2 LYS A 41 0.471 6.903 -12.023 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -0.796 6.302 -13.075 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -1.106 5.078 -10.462 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -0.940 6.810 -10.253 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -2.968 7.120 -11.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -2.625 6.249 -12.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -3.183 5.436 -11.084 1.00 0.00 H new ATOM 651 N CYS A 42 4.449 3.805 -13.508 1.00 0.00 N ATOM 652 CA CYS A 42 5.693 3.476 -14.182 1.00 0.00 C ATOM 653 C CYS A 42 6.756 3.196 -13.117 1.00 0.00 C ATOM 654 O CYS A 42 7.952 3.314 -13.383 1.00 0.00 O ATOM 655 CB CYS A 42 6.127 4.585 -15.143 1.00 0.00 C ATOM 656 SG CYS A 42 6.457 4.031 -16.855 1.00 0.00 S ATOM 0 H CYS A 42 3.662 3.203 -13.749 1.00 0.00 H new ATOM 0 HA CYS A 42 5.552 2.587 -14.797 1.00 0.00 H new ATOM 0 HB2 CYS A 42 5.351 5.350 -15.167 1.00 0.00 H new ATOM 0 HB3 CYS A 42 7.027 5.056 -14.749 1.00 0.00 H new ATOM 662 N GLY A 43 6.282 2.831 -11.935 1.00 0.00 N ATOM 663 CA GLY A 43 7.177 2.533 -10.830 1.00 0.00 C ATOM 664 C GLY A 43 7.297 1.023 -10.613 1.00 0.00 C ATOM 665 O GLY A 43 6.621 0.241 -11.280 1.00 0.00 O ATOM 0 H GLY A 43 5.290 2.735 -11.718 1.00 0.00 H new ATOM 0 HA2 GLY A 43 8.162 2.954 -11.031 1.00 0.00 H new ATOM 0 HA3 GLY A 43 6.808 3.006 -9.920 1.00 0.00 H new ATOM 669 N TRP A 44 8.163 0.659 -9.679 1.00 0.00 N ATOM 670 CA TRP A 44 8.381 -0.743 -9.366 1.00 0.00 C ATOM 671 C TRP A 44 8.565 -0.867 -7.852 1.00 0.00 C ATOM 672 O TRP A 44 9.447 -0.232 -7.277 1.00 0.00 O ATOM 673 CB TRP A 44 9.562 -1.305 -10.160 1.00 0.00 C ATOM 674 CG TRP A 44 10.818 -0.432 -10.109 1.00 0.00 C ATOM 675 CD1 TRP A 44 11.665 -0.264 -9.084 1.00 0.00 C ATOM 676 CD2 TRP A 44 11.336 0.392 -11.174 1.00 0.00 C ATOM 677 NE1 TRP A 44 12.688 0.603 -9.410 1.00 0.00 N ATOM 678 CE2 TRP A 44 12.481 1.015 -10.721 1.00 0.00 C ATOM 679 CE3 TRP A 44 10.854 0.604 -12.478 1.00 0.00 C ATOM 680 CZ2 TRP A 44 13.240 1.891 -11.507 1.00 0.00 C ATOM 681 CZ3 TRP A 44 11.623 1.482 -13.251 1.00 0.00 C ATOM 682 CH2 TRP A 44 12.778 2.117 -12.810 1.00 0.00 C ATOM 0 H TRP A 44 8.722 1.311 -9.129 1.00 0.00 H new ATOM 0 HA TRP A 44 7.520 -1.342 -9.662 1.00 0.00 H new ATOM 0 HB2 TRP A 44 9.805 -2.296 -9.777 1.00 0.00 H new ATOM 0 HB3 TRP A 44 9.261 -1.430 -11.200 1.00 0.00 H new ATOM 0 HD1 TRP A 44 11.560 -0.747 -8.124 1.00 0.00 H new ATOM 0 HE1 TRP A 44 13.455 0.889 -8.801 1.00 0.00 H new ATOM 0 HE3 TRP A 44 9.961 0.127 -12.854 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 14.133 2.366 -11.129 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 11.296 1.680 -14.261 1.00 0.00 H new ATOM 0 HH2 TRP A 44 13.317 2.782 -13.469 1.00 0.00 H new ATOM 693 N ALA A 45 7.718 -1.689 -7.251 1.00 0.00 N ATOM 694 CA ALA A 45 7.776 -1.905 -5.815 1.00 0.00 C ATOM 695 C ALA A 45 8.010 -3.390 -5.536 1.00 0.00 C ATOM 696 O ALA A 45 7.093 -4.201 -5.660 1.00 0.00 O ATOM 697 CB ALA A 45 6.490 -1.385 -5.168 1.00 0.00 C ATOM 0 H ALA A 45 6.987 -2.214 -7.732 1.00 0.00 H new ATOM 0 HA ALA A 45 8.607 -1.353 -5.377 1.00 0.00 H new ATOM 0 HB1 ALA A 45 6.533 -1.547 -4.091 1.00 0.00 H new ATOM 0 HB2 ALA A 45 6.386 -0.319 -5.371 1.00 0.00 H new ATOM 0 HB3 ALA A 45 5.634 -1.918 -5.581 1.00 0.00 H new ATOM 703 N GLU A 46 9.243 -3.702 -5.164 1.00 0.00 N ATOM 704 CA GLU A 46 9.609 -5.077 -4.866 1.00 0.00 C ATOM 705 C GLU A 46 9.591 -5.315 -3.354 1.00 0.00 C ATOM 706 O GLU A 46 9.677 -4.370 -2.572 1.00 0.00 O ATOM 707 CB GLU A 46 10.978 -5.420 -5.458 1.00 0.00 C ATOM 708 CG GLU A 46 12.035 -4.405 -5.019 1.00 0.00 C ATOM 709 CD GLU A 46 12.297 -3.375 -6.121 1.00 0.00 C ATOM 710 OE1 GLU A 46 11.810 -2.236 -5.960 1.00 0.00 O ATOM 711 OE2 GLU A 46 12.979 -3.752 -7.099 1.00 0.00 O ATOM 0 H GLU A 46 10.001 -3.027 -5.062 1.00 0.00 H new ATOM 0 HA GLU A 46 8.874 -5.737 -5.327 1.00 0.00 H new ATOM 0 HB2 GLU A 46 11.275 -6.420 -5.141 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.914 -5.436 -6.546 1.00 0.00 H new ATOM 0 HG2 GLU A 46 11.703 -3.897 -4.113 1.00 0.00 H new ATOM 0 HG3 GLU A 46 12.962 -4.923 -4.773 1.00 0.00 H new ATOM 719 N TYR A 47 9.477 -6.583 -2.989 1.00 0.00 N ATOM 720 CA TYR A 47 9.445 -6.958 -1.585 1.00 0.00 C ATOM 721 C TYR A 47 10.558 -7.956 -1.259 1.00 0.00 C ATOM 722 O TYR A 47 10.682 -8.989 -1.915 1.00 0.00 O ATOM 723 CB TYR A 47 8.090 -7.632 -1.359 1.00 0.00 C ATOM 724 CG TYR A 47 6.910 -6.659 -1.322 1.00 0.00 C ATOM 725 CD1 TYR A 47 6.472 -6.061 -2.486 1.00 0.00 C ATOM 726 CD2 TYR A 47 6.284 -6.378 -0.125 1.00 0.00 C ATOM 727 CE1 TYR A 47 5.361 -5.145 -2.452 1.00 0.00 C ATOM 728 CE2 TYR A 47 5.174 -5.462 -0.090 1.00 0.00 C ATOM 729 CZ TYR A 47 4.767 -4.891 -1.255 1.00 0.00 C ATOM 730 OH TYR A 47 3.718 -4.026 -1.222 1.00 0.00 O ATOM 0 H TYR A 47 9.406 -7.364 -3.641 1.00 0.00 H new ATOM 0 HA TYR A 47 9.588 -6.083 -0.951 1.00 0.00 H new ATOM 0 HB2 TYR A 47 7.922 -8.361 -2.151 1.00 0.00 H new ATOM 0 HB3 TYR A 47 8.122 -8.184 -0.420 1.00 0.00 H new ATOM 0 HD1 TYR A 47 6.963 -6.280 -3.423 1.00 0.00 H new ATOM 0 HD2 TYR A 47 6.627 -6.845 0.786 1.00 0.00 H new ATOM 0 HE1 TYR A 47 5.008 -4.671 -3.356 1.00 0.00 H new ATOM 0 HE2 TYR A 47 4.676 -5.233 0.841 1.00 0.00 H new ATOM 0 HH TYR A 47 3.393 -3.941 -0.301 1.00 0.00 H new ATOM 740 N THR A 48 11.340 -7.612 -0.246 1.00 0.00 N ATOM 741 CA THR A 48 12.438 -8.465 0.175 1.00 0.00 C ATOM 742 C THR A 48 12.074 -9.206 1.463 1.00 0.00 C ATOM 743 O THR A 48 11.971 -8.596 2.526 1.00 0.00 O ATOM 744 CB THR A 48 13.689 -7.594 0.307 1.00 0.00 C ATOM 745 OG1 THR A 48 14.055 -7.306 -1.039 1.00 0.00 O ATOM 746 CG2 THR A 48 14.886 -8.369 0.861 1.00 0.00 C ATOM 0 H THR A 48 11.235 -6.754 0.295 1.00 0.00 H new ATOM 0 HA THR A 48 12.641 -9.241 -0.562 1.00 0.00 H new ATOM 0 HB THR A 48 13.474 -6.746 0.957 1.00 0.00 H new ATOM 0 HG1 THR A 48 14.857 -6.743 -1.047 1.00 0.00 H new ATOM 0 HG21 THR A 48 15.747 -7.705 0.935 1.00 0.00 H new ATOM 0 HG22 THR A 48 14.642 -8.758 1.850 1.00 0.00 H new ATOM 0 HG23 THR A 48 15.123 -9.198 0.194 1.00 0.00 H new ATOM 754 N PRO A 49 11.886 -10.545 1.322 1.00 0.00 N ATOM 755 CA PRO A 49 11.536 -11.376 2.462 1.00 0.00 C ATOM 756 C PRO A 49 12.749 -11.607 3.365 1.00 0.00 C ATOM 757 O PRO A 49 13.751 -12.174 2.932 1.00 0.00 O ATOM 758 CB PRO A 49 10.991 -12.661 1.860 1.00 0.00 C ATOM 759 CG PRO A 49 11.484 -12.689 0.422 1.00 0.00 C ATOM 760 CD PRO A 49 12.001 -11.302 0.079 1.00 0.00 C ATOM 0 HA PRO A 49 10.794 -10.909 3.110 1.00 0.00 H new ATOM 0 HB2 PRO A 49 11.345 -13.532 2.412 1.00 0.00 H new ATOM 0 HB3 PRO A 49 9.902 -12.680 1.900 1.00 0.00 H new ATOM 0 HG2 PRO A 49 12.274 -13.431 0.304 1.00 0.00 H new ATOM 0 HG3 PRO A 49 10.676 -12.973 -0.253 1.00 0.00 H new ATOM 0 HD2 PRO A 49 13.034 -11.339 -0.268 1.00 0.00 H new ATOM 0 HD3 PRO A 49 11.413 -10.846 -0.718 1.00 0.00 H new ATOM 768 N GLU A 50 12.619 -11.154 4.604 1.00 0.00 N ATOM 769 CA GLU A 50 13.693 -11.305 5.572 1.00 0.00 C ATOM 770 C GLU A 50 13.117 -11.543 6.969 1.00 0.00 C ATOM 771 O GLU A 50 13.486 -10.857 7.922 1.00 0.00 O ATOM 772 CB GLU A 50 14.616 -10.085 5.560 1.00 0.00 C ATOM 773 CG GLU A 50 16.030 -10.472 5.123 1.00 0.00 C ATOM 774 CD GLU A 50 16.919 -10.760 6.335 1.00 0.00 C ATOM 775 OE1 GLU A 50 16.627 -11.757 7.029 1.00 0.00 O ATOM 776 OE2 GLU A 50 17.871 -9.975 6.539 1.00 0.00 O ATOM 0 H GLU A 50 11.787 -10.683 4.959 1.00 0.00 H new ATOM 0 HA GLU A 50 14.289 -12.174 5.293 1.00 0.00 H new ATOM 0 HB2 GLU A 50 14.217 -9.329 4.884 1.00 0.00 H new ATOM 0 HB3 GLU A 50 14.648 -9.639 6.554 1.00 0.00 H new ATOM 0 HG2 GLU A 50 15.988 -11.352 4.481 1.00 0.00 H new ATOM 0 HG3 GLU A 50 16.465 -9.666 4.532 1.00 0.00 H new ATOM 784 N GLY A 51 12.223 -12.518 7.048 1.00 0.00 N ATOM 785 CA GLY A 51 11.593 -12.855 8.313 1.00 0.00 C ATOM 786 C GLY A 51 10.083 -12.614 8.256 1.00 0.00 C ATOM 787 O GLY A 51 9.534 -12.347 7.188 1.00 0.00 O ATOM 0 H GLY A 51 11.920 -13.085 6.256 1.00 0.00 H new ATOM 0 HA2 GLY A 51 11.789 -13.900 8.554 1.00 0.00 H new ATOM 0 HA3 GLY A 51 12.030 -12.256 9.112 1.00 0.00 H new ATOM 791 N LYS A 52 9.455 -12.718 9.418 1.00 0.00 N ATOM 792 CA LYS A 52 8.020 -12.515 9.513 1.00 0.00 C ATOM 793 C LYS A 52 7.639 -11.237 8.763 1.00 0.00 C ATOM 794 O LYS A 52 6.539 -11.135 8.222 1.00 0.00 O ATOM 795 CB LYS A 52 7.573 -12.526 10.976 1.00 0.00 C ATOM 796 CG LYS A 52 6.299 -13.356 11.154 1.00 0.00 C ATOM 797 CD LYS A 52 6.353 -14.172 12.447 1.00 0.00 C ATOM 798 CE LYS A 52 6.060 -15.649 12.176 1.00 0.00 C ATOM 799 NZ LYS A 52 7.232 -16.482 12.526 1.00 0.00 N ATOM 0 H LYS A 52 9.914 -12.940 10.301 1.00 0.00 H new ATOM 0 HA LYS A 52 7.487 -13.337 9.035 1.00 0.00 H new ATOM 0 HB2 LYS A 52 8.368 -12.935 11.600 1.00 0.00 H new ATOM 0 HB3 LYS A 52 7.396 -11.505 11.314 1.00 0.00 H new ATOM 0 HG2 LYS A 52 5.431 -12.697 11.171 1.00 0.00 H new ATOM 0 HG3 LYS A 52 6.174 -14.025 10.302 1.00 0.00 H new ATOM 0 HD2 LYS A 52 7.337 -14.071 12.904 1.00 0.00 H new ATOM 0 HD3 LYS A 52 5.628 -13.779 13.160 1.00 0.00 H new ATOM 0 HE2 LYS A 52 5.194 -15.967 12.757 1.00 0.00 H new ATOM 0 HE3 LYS A 52 5.808 -15.789 11.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 7.017 -17.482 12.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 8.049 -16.189 11.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 7.455 -16.361 13.535 1.00 0.00 H new ATOM 813 N SER A 53 8.569 -10.294 8.756 1.00 0.00 N ATOM 814 CA SER A 53 8.345 -9.026 8.082 1.00 0.00 C ATOM 815 C SER A 53 8.874 -9.096 6.648 1.00 0.00 C ATOM 816 O SER A 53 9.675 -9.969 6.319 1.00 0.00 O ATOM 817 CB SER A 53 9.011 -7.875 8.838 1.00 0.00 C ATOM 818 OG SER A 53 9.645 -8.318 10.034 1.00 0.00 O ATOM 0 H SER A 53 9.480 -10.382 9.206 1.00 0.00 H new ATOM 0 HA SER A 53 7.272 -8.836 8.058 1.00 0.00 H new ATOM 0 HB2 SER A 53 9.748 -7.396 8.193 1.00 0.00 H new ATOM 0 HB3 SER A 53 8.263 -7.121 9.082 1.00 0.00 H new ATOM 0 HG SER A 53 10.060 -7.554 10.487 1.00 0.00 H new ATOM 824 N VAL A 54 8.404 -8.163 5.832 1.00 0.00 N ATOM 825 CA VAL A 54 8.819 -8.108 4.441 1.00 0.00 C ATOM 826 C VAL A 54 9.129 -6.658 4.063 1.00 0.00 C ATOM 827 O VAL A 54 8.263 -5.790 4.156 1.00 0.00 O ATOM 828 CB VAL A 54 7.749 -8.742 3.549 1.00 0.00 C ATOM 829 CG1 VAL A 54 7.609 -10.237 3.841 1.00 0.00 C ATOM 830 CG2 VAL A 54 6.408 -8.023 3.708 1.00 0.00 C ATOM 0 H VAL A 54 7.740 -7.440 6.108 1.00 0.00 H new ATOM 0 HA VAL A 54 9.731 -8.686 4.292 1.00 0.00 H new ATOM 0 HB VAL A 54 8.067 -8.632 2.512 1.00 0.00 H new ATOM 0 HG11 VAL A 54 6.843 -10.664 3.194 1.00 0.00 H new ATOM 0 HG12 VAL A 54 8.560 -10.735 3.654 1.00 0.00 H new ATOM 0 HG13 VAL A 54 7.324 -10.379 4.884 1.00 0.00 H new ATOM 0 HG21 VAL A 54 5.665 -8.493 3.064 1.00 0.00 H new ATOM 0 HG22 VAL A 54 6.081 -8.088 4.746 1.00 0.00 H new ATOM 0 HG23 VAL A 54 6.521 -6.976 3.428 1.00 0.00 H new ATOM 840 N LYS A 55 10.368 -6.441 3.645 1.00 0.00 N ATOM 841 CA LYS A 55 10.803 -5.111 3.253 1.00 0.00 C ATOM 842 C LYS A 55 10.049 -4.683 1.993 1.00 0.00 C ATOM 843 O LYS A 55 9.692 -5.519 1.165 1.00 0.00 O ATOM 844 CB LYS A 55 12.325 -5.068 3.103 1.00 0.00 C ATOM 845 CG LYS A 55 13.008 -4.966 4.469 1.00 0.00 C ATOM 846 CD LYS A 55 14.257 -4.086 4.393 1.00 0.00 C ATOM 847 CE LYS A 55 15.479 -4.905 3.971 1.00 0.00 C ATOM 848 NZ LYS A 55 16.608 -4.667 4.899 1.00 0.00 N ATOM 0 H LYS A 55 11.084 -7.164 3.569 1.00 0.00 H new ATOM 0 HA LYS A 55 10.561 -4.387 4.031 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.669 -5.964 2.587 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.609 -4.216 2.486 1.00 0.00 H new ATOM 0 HG2 LYS A 55 12.311 -4.552 5.198 1.00 0.00 H new ATOM 0 HG3 LYS A 55 13.281 -5.962 4.818 1.00 0.00 H new ATOM 0 HD2 LYS A 55 14.093 -3.277 3.681 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.441 -3.625 5.363 1.00 0.00 H new ATOM 0 HE2 LYS A 55 15.227 -5.965 3.960 1.00 0.00 H new ATOM 0 HE3 LYS A 55 15.772 -4.636 2.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 17.429 -5.230 4.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 16.858 -3.658 4.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 16.331 -4.946 5.862 1.00 0.00 H new ATOM 862 N VAL A 56 9.828 -3.381 1.888 1.00 0.00 N ATOM 863 CA VAL A 56 9.122 -2.832 0.742 1.00 0.00 C ATOM 864 C VAL A 56 9.829 -1.557 0.276 1.00 0.00 C ATOM 865 O VAL A 56 10.014 -0.625 1.057 1.00 0.00 O ATOM 866 CB VAL A 56 7.651 -2.604 1.094 1.00 0.00 C ATOM 867 CG1 VAL A 56 6.872 -2.085 -0.116 1.00 0.00 C ATOM 868 CG2 VAL A 56 7.016 -3.881 1.648 1.00 0.00 C ATOM 0 H VAL A 56 10.125 -2.690 2.577 1.00 0.00 H new ATOM 0 HA VAL A 56 9.138 -3.536 -0.090 1.00 0.00 H new ATOM 0 HB VAL A 56 7.607 -1.843 1.873 1.00 0.00 H new ATOM 0 HG11 VAL A 56 5.829 -1.931 0.161 1.00 0.00 H new ATOM 0 HG12 VAL A 56 7.302 -1.140 -0.448 1.00 0.00 H new ATOM 0 HG13 VAL A 56 6.929 -2.813 -0.925 1.00 0.00 H new ATOM 0 HG21 VAL A 56 5.970 -3.692 1.890 1.00 0.00 H new ATOM 0 HG22 VAL A 56 7.078 -4.672 0.901 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.547 -4.190 2.548 1.00 0.00 H new ATOM 878 N SER A 57 10.205 -1.558 -0.995 1.00 0.00 N ATOM 879 CA SER A 57 10.888 -0.414 -1.574 1.00 0.00 C ATOM 880 C SER A 57 10.089 0.125 -2.762 1.00 0.00 C ATOM 881 O SER A 57 9.886 -0.580 -3.749 1.00 0.00 O ATOM 882 CB SER A 57 12.307 -0.782 -2.011 1.00 0.00 C ATOM 883 OG SER A 57 12.861 -1.819 -1.206 1.00 0.00 O ATOM 0 H SER A 57 10.049 -2.333 -1.640 1.00 0.00 H new ATOM 0 HA SER A 57 10.962 0.362 -0.812 1.00 0.00 H new ATOM 0 HB2 SER A 57 12.294 -1.100 -3.054 1.00 0.00 H new ATOM 0 HB3 SER A 57 12.944 0.101 -1.954 1.00 0.00 H new ATOM 0 HG SER A 57 13.767 -2.027 -1.518 1.00 0.00 H new ATOM 889 N ARG A 58 9.657 1.371 -2.628 1.00 0.00 N ATOM 890 CA ARG A 58 8.886 2.012 -3.679 1.00 0.00 C ATOM 891 C ARG A 58 9.688 3.154 -4.305 1.00 0.00 C ATOM 892 O ARG A 58 10.299 3.951 -3.595 1.00 0.00 O ATOM 893 CB ARG A 58 7.567 2.564 -3.134 1.00 0.00 C ATOM 894 CG ARG A 58 6.370 1.917 -3.836 1.00 0.00 C ATOM 895 CD ARG A 58 5.161 1.846 -2.902 1.00 0.00 C ATOM 896 NE ARG A 58 4.213 2.939 -3.215 1.00 0.00 N ATOM 897 CZ ARG A 58 3.385 2.936 -4.269 1.00 0.00 C ATOM 898 NH1 ARG A 58 3.382 1.898 -5.116 1.00 0.00 N ATOM 899 NH2 ARG A 58 2.560 3.971 -4.475 1.00 0.00 N ATOM 0 H ARG A 58 9.827 1.953 -1.808 1.00 0.00 H new ATOM 0 HA ARG A 58 8.668 1.259 -4.437 1.00 0.00 H new ATOM 0 HB2 ARG A 58 7.507 2.380 -2.061 1.00 0.00 H new ATOM 0 HB3 ARG A 58 7.535 3.644 -3.274 1.00 0.00 H new ATOM 0 HG2 ARG A 58 6.113 2.490 -4.727 1.00 0.00 H new ATOM 0 HG3 ARG A 58 6.637 0.914 -4.168 1.00 0.00 H new ATOM 0 HD2 ARG A 58 4.665 0.882 -3.009 1.00 0.00 H new ATOM 0 HD3 ARG A 58 5.488 1.923 -1.865 1.00 0.00 H new ATOM 0 HE ARG A 58 4.188 3.744 -2.590 1.00 0.00 H new ATOM 0 HH11 ARG A 58 4.010 1.110 -4.959 1.00 0.00 H new ATOM 0 HH12 ARG A 58 2.752 1.896 -5.918 1.00 0.00 H new ATOM 0 HH21 ARG A 58 2.562 4.761 -3.830 1.00 0.00 H new ATOM 0 HH22 ARG A 58 1.930 3.969 -5.277 1.00 0.00 H new ATOM 913 N TYR A 59 9.661 3.197 -5.629 1.00 0.00 N ATOM 914 CA TYR A 59 10.379 4.228 -6.360 1.00 0.00 C ATOM 915 C TYR A 59 9.723 4.497 -7.716 1.00 0.00 C ATOM 916 O TYR A 59 9.616 3.596 -8.547 1.00 0.00 O ATOM 917 CB TYR A 59 11.789 3.680 -6.588 1.00 0.00 C ATOM 918 CG TYR A 59 12.832 4.754 -6.900 1.00 0.00 C ATOM 919 CD1 TYR A 59 12.995 5.201 -8.196 1.00 0.00 C ATOM 920 CD2 TYR A 59 13.608 5.278 -5.887 1.00 0.00 C ATOM 921 CE1 TYR A 59 13.977 6.212 -8.490 1.00 0.00 C ATOM 922 CE2 TYR A 59 14.590 6.289 -6.181 1.00 0.00 C ATOM 923 CZ TYR A 59 14.726 6.707 -7.469 1.00 0.00 C ATOM 924 OH TYR A 59 15.653 7.662 -7.746 1.00 0.00 O ATOM 0 H TYR A 59 9.153 2.534 -6.215 1.00 0.00 H new ATOM 0 HA TYR A 59 10.380 5.164 -5.801 1.00 0.00 H new ATOM 0 HB2 TYR A 59 12.102 3.131 -5.700 1.00 0.00 H new ATOM 0 HB3 TYR A 59 11.761 2.966 -7.411 1.00 0.00 H new ATOM 0 HD1 TYR A 59 12.386 4.792 -8.989 1.00 0.00 H new ATOM 0 HD2 TYR A 59 13.479 4.930 -4.873 1.00 0.00 H new ATOM 0 HE1 TYR A 59 14.116 6.569 -9.500 1.00 0.00 H new ATOM 0 HE2 TYR A 59 15.205 6.706 -5.397 1.00 0.00 H new ATOM 0 HH TYR A 59 16.112 7.922 -6.920 1.00 0.00 H new ATOM 934 N ASP A 60 9.302 5.740 -7.898 1.00 0.00 N ATOM 935 CA ASP A 60 8.660 6.138 -9.139 1.00 0.00 C ATOM 936 C ASP A 60 8.818 7.648 -9.328 1.00 0.00 C ATOM 937 O ASP A 60 9.510 8.305 -8.552 1.00 0.00 O ATOM 938 CB ASP A 60 7.164 5.819 -9.112 1.00 0.00 C ATOM 939 CG ASP A 60 6.370 6.531 -8.015 1.00 0.00 C ATOM 940 OD1 ASP A 60 6.018 7.708 -8.243 1.00 0.00 O ATOM 941 OD2 ASP A 60 6.134 5.882 -6.973 1.00 0.00 O ATOM 0 H ASP A 60 9.393 6.485 -7.207 1.00 0.00 H new ATOM 0 HA ASP A 60 9.131 5.589 -9.954 1.00 0.00 H new ATOM 0 HB2 ASP A 60 6.735 6.081 -10.079 1.00 0.00 H new ATOM 0 HB3 ASP A 60 7.040 4.743 -8.989 1.00 0.00 H new ATOM 947 N VAL A 61 8.165 8.154 -10.364 1.00 0.00 N ATOM 948 CA VAL A 61 8.224 9.574 -10.665 1.00 0.00 C ATOM 949 C VAL A 61 6.804 10.140 -10.717 1.00 0.00 C ATOM 950 O VAL A 61 5.914 9.538 -11.317 1.00 0.00 O ATOM 951 CB VAL A 61 9.007 9.803 -11.959 1.00 0.00 C ATOM 952 CG1 VAL A 61 8.319 9.119 -13.143 1.00 0.00 C ATOM 953 CG2 VAL A 61 9.202 11.296 -12.226 1.00 0.00 C ATOM 0 H VAL A 61 7.592 7.606 -11.006 1.00 0.00 H new ATOM 0 HA VAL A 61 8.758 10.109 -9.879 1.00 0.00 H new ATOM 0 HB VAL A 61 9.993 9.354 -11.838 1.00 0.00 H new ATOM 0 HG11 VAL A 61 8.895 9.297 -14.051 1.00 0.00 H new ATOM 0 HG12 VAL A 61 8.256 8.047 -12.957 1.00 0.00 H new ATOM 0 HG13 VAL A 61 7.315 9.526 -13.265 1.00 0.00 H new ATOM 0 HG21 VAL A 61 9.762 11.430 -13.152 1.00 0.00 H new ATOM 0 HG22 VAL A 61 8.229 11.779 -12.317 1.00 0.00 H new ATOM 0 HG23 VAL A 61 9.754 11.744 -11.400 1.00 0.00 H new ATOM 963 N ILE A 62 6.635 11.290 -10.082 1.00 0.00 N ATOM 964 CA ILE A 62 5.338 11.943 -10.048 1.00 0.00 C ATOM 965 C ILE A 62 5.490 13.395 -10.508 1.00 0.00 C ATOM 966 O ILE A 62 6.136 14.198 -9.836 1.00 0.00 O ATOM 967 CB ILE A 62 4.701 11.800 -8.664 1.00 0.00 C ATOM 968 CG1 ILE A 62 4.527 10.327 -8.291 1.00 0.00 C ATOM 969 CG2 ILE A 62 3.381 12.571 -8.585 1.00 0.00 C ATOM 970 CD1 ILE A 62 3.961 10.183 -6.876 1.00 0.00 C ATOM 0 H ILE A 62 7.375 11.787 -9.587 1.00 0.00 H new ATOM 0 HA ILE A 62 4.650 11.459 -10.741 1.00 0.00 H new ATOM 0 HB ILE A 62 5.376 12.241 -7.930 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.860 9.844 -9.005 1.00 0.00 H new ATOM 0 HG13 ILE A 62 5.487 9.816 -8.356 1.00 0.00 H new ATOM 0 HG21 ILE A 62 2.949 12.453 -7.591 1.00 0.00 H new ATOM 0 HG22 ILE A 62 3.565 13.628 -8.777 1.00 0.00 H new ATOM 0 HG23 ILE A 62 2.687 12.182 -9.330 1.00 0.00 H new ATOM 0 HD11 ILE A 62 3.847 9.126 -6.636 1.00 0.00 H new ATOM 0 HD12 ILE A 62 4.643 10.646 -6.163 1.00 0.00 H new ATOM 0 HD13 ILE A 62 2.990 10.674 -6.821 1.00 0.00 H new ATOM 982 N HIS A 63 4.886 13.687 -11.650 1.00 0.00 N ATOM 983 CA HIS A 63 4.947 15.028 -12.207 1.00 0.00 C ATOM 984 C HIS A 63 6.340 15.616 -11.977 1.00 0.00 C ATOM 985 O HIS A 63 6.535 16.426 -11.072 1.00 0.00 O ATOM 986 CB HIS A 63 3.831 15.905 -11.635 1.00 0.00 C ATOM 987 CG HIS A 63 2.580 15.937 -12.480 1.00 0.00 C ATOM 988 ND1 HIS A 63 1.975 17.116 -12.880 1.00 0.00 N ATOM 989 CD2 HIS A 63 1.828 14.923 -12.997 1.00 0.00 C ATOM 990 CE1 HIS A 63 0.908 16.813 -13.604 1.00 0.00 C ATOM 991 NE2 HIS A 63 0.818 15.454 -13.675 1.00 0.00 N ATOM 0 H HIS A 63 4.352 13.018 -12.205 1.00 0.00 H new ATOM 0 HA HIS A 63 4.781 14.987 -13.284 1.00 0.00 H new ATOM 0 HB2 HIS A 63 3.575 15.545 -10.639 1.00 0.00 H new ATOM 0 HB3 HIS A 63 4.205 16.922 -11.520 1.00 0.00 H new ATOM 0 HD2 HIS A 63 2.022 13.867 -12.875 1.00 0.00 H new ATOM 0 HE1 HIS A 63 0.228 17.519 -14.059 1.00 0.00 H new ATOM 0 HE2 HIS A 63 0.094 14.932 -14.168 1.00 0.00 H new ATOM 999 N GLY A 64 7.274 15.186 -12.813 1.00 0.00 N ATOM 1000 CA GLY A 64 8.644 15.660 -12.713 1.00 0.00 C ATOM 1001 C GLY A 64 9.093 15.734 -11.252 1.00 0.00 C ATOM 1002 O GLY A 64 9.621 16.754 -10.812 1.00 0.00 O ATOM 0 H GLY A 64 7.109 14.514 -13.563 1.00 0.00 H new ATOM 0 HA2 GLY A 64 9.305 14.993 -13.267 1.00 0.00 H new ATOM 0 HA3 GLY A 64 8.726 16.645 -13.173 1.00 0.00 H new ATOM 1006 N LYS A 65 8.865 14.640 -10.540 1.00 0.00 N ATOM 1007 CA LYS A 65 9.240 14.569 -9.138 1.00 0.00 C ATOM 1008 C LYS A 65 9.512 13.111 -8.761 1.00 0.00 C ATOM 1009 O LYS A 65 8.587 12.306 -8.670 1.00 0.00 O ATOM 1010 CB LYS A 65 8.178 15.241 -8.265 1.00 0.00 C ATOM 1011 CG LYS A 65 8.809 16.288 -7.344 1.00 0.00 C ATOM 1012 CD LYS A 65 8.041 16.392 -6.025 1.00 0.00 C ATOM 1013 CE LYS A 65 8.449 15.274 -5.063 1.00 0.00 C ATOM 1014 NZ LYS A 65 9.577 15.710 -4.211 1.00 0.00 N ATOM 0 H LYS A 65 8.426 13.796 -10.908 1.00 0.00 H new ATOM 0 HA LYS A 65 10.162 15.123 -8.962 1.00 0.00 H new ATOM 0 HB2 LYS A 65 7.427 15.713 -8.898 1.00 0.00 H new ATOM 0 HB3 LYS A 65 7.663 14.488 -7.668 1.00 0.00 H new ATOM 0 HG2 LYS A 65 9.847 16.023 -7.144 1.00 0.00 H new ATOM 0 HG3 LYS A 65 8.817 17.258 -7.842 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.232 17.361 -5.564 1.00 0.00 H new ATOM 0 HD3 LYS A 65 6.970 16.337 -6.219 1.00 0.00 H new ATOM 0 HE2 LYS A 65 7.600 14.996 -4.438 1.00 0.00 H new ATOM 0 HE3 LYS A 65 8.734 14.386 -5.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.841 14.940 -3.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.391 15.953 -4.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 9.293 16.544 -3.658 1.00 0.00 H new ATOM 1028 N GLU A 66 10.787 12.816 -8.552 1.00 0.00 N ATOM 1029 CA GLU A 66 11.193 11.469 -8.187 1.00 0.00 C ATOM 1030 C GLU A 66 10.588 11.080 -6.837 1.00 0.00 C ATOM 1031 O GLU A 66 10.950 11.642 -5.805 1.00 0.00 O ATOM 1032 CB GLU A 66 12.717 11.344 -8.162 1.00 0.00 C ATOM 1033 CG GLU A 66 13.257 10.930 -9.532 1.00 0.00 C ATOM 1034 CD GLU A 66 14.293 11.935 -10.040 1.00 0.00 C ATOM 1035 OE1 GLU A 66 14.108 12.413 -11.180 1.00 0.00 O ATOM 1036 OE2 GLU A 66 15.246 12.202 -9.277 1.00 0.00 O ATOM 0 H GLU A 66 11.552 13.486 -8.628 1.00 0.00 H new ATOM 0 HA GLU A 66 10.818 10.779 -8.943 1.00 0.00 H new ATOM 0 HB2 GLU A 66 13.158 12.296 -7.866 1.00 0.00 H new ATOM 0 HB3 GLU A 66 13.013 10.609 -7.414 1.00 0.00 H new ATOM 0 HG2 GLU A 66 13.708 9.940 -9.465 1.00 0.00 H new ATOM 0 HG3 GLU A 66 12.435 10.858 -10.244 1.00 0.00 H new ATOM 1044 N TYR A 67 9.676 10.120 -6.888 1.00 0.00 N ATOM 1045 CA TYR A 67 9.017 9.649 -5.681 1.00 0.00 C ATOM 1046 C TYR A 67 9.813 8.516 -5.029 1.00 0.00 C ATOM 1047 O TYR A 67 10.639 7.879 -5.679 1.00 0.00 O ATOM 1048 CB TYR A 67 7.657 9.109 -6.127 1.00 0.00 C ATOM 1049 CG TYR A 67 6.495 9.528 -5.224 1.00 0.00 C ATOM 1050 CD1 TYR A 67 6.228 10.867 -5.019 1.00 0.00 C ATOM 1051 CD2 TYR A 67 5.714 8.568 -4.613 1.00 0.00 C ATOM 1052 CE1 TYR A 67 5.134 11.261 -4.169 1.00 0.00 C ATOM 1053 CE2 TYR A 67 4.621 8.962 -3.763 1.00 0.00 C ATOM 1054 CZ TYR A 67 4.385 10.289 -3.583 1.00 0.00 C ATOM 1055 OH TYR A 67 3.352 10.662 -2.780 1.00 0.00 O ATOM 0 H TYR A 67 9.378 9.656 -7.746 1.00 0.00 H new ATOM 0 HA TYR A 67 8.929 10.455 -4.952 1.00 0.00 H new ATOM 0 HB2 TYR A 67 7.457 9.452 -7.142 1.00 0.00 H new ATOM 0 HB3 TYR A 67 7.703 8.021 -6.161 1.00 0.00 H new ATOM 0 HD1 TYR A 67 6.839 11.619 -5.496 1.00 0.00 H new ATOM 0 HD2 TYR A 67 5.923 7.521 -4.773 1.00 0.00 H new ATOM 0 HE1 TYR A 67 4.914 12.305 -4.001 1.00 0.00 H new ATOM 0 HE2 TYR A 67 4.003 8.220 -3.279 1.00 0.00 H new ATOM 0 HH TYR A 67 2.904 9.863 -2.431 1.00 0.00 H new ATOM 1065 N PHE A 68 9.535 8.301 -3.751 1.00 0.00 N ATOM 1066 CA PHE A 68 10.215 7.257 -3.004 1.00 0.00 C ATOM 1067 C PHE A 68 9.494 6.969 -1.685 1.00 0.00 C ATOM 1068 O PHE A 68 8.921 7.872 -1.077 1.00 0.00 O ATOM 1069 CB PHE A 68 11.624 7.769 -2.700 1.00 0.00 C ATOM 1070 CG PHE A 68 12.442 6.842 -1.798 1.00 0.00 C ATOM 1071 CD1 PHE A 68 12.123 6.719 -0.482 1.00 0.00 C ATOM 1072 CD2 PHE A 68 13.487 6.140 -2.313 1.00 0.00 C ATOM 1073 CE1 PHE A 68 12.882 5.859 0.355 1.00 0.00 C ATOM 1074 CE2 PHE A 68 14.246 5.280 -1.476 1.00 0.00 C ATOM 1075 CZ PHE A 68 13.928 5.158 -0.160 1.00 0.00 C ATOM 0 H PHE A 68 8.849 8.832 -3.215 1.00 0.00 H new ATOM 0 HA PHE A 68 10.234 6.335 -3.586 1.00 0.00 H new ATOM 0 HB2 PHE A 68 12.159 7.910 -3.639 1.00 0.00 H new ATOM 0 HB3 PHE A 68 11.549 8.748 -2.226 1.00 0.00 H new ATOM 0 HD1 PHE A 68 11.292 7.275 -0.073 1.00 0.00 H new ATOM 0 HD2 PHE A 68 13.739 6.237 -3.359 1.00 0.00 H new ATOM 0 HE1 PHE A 68 12.629 5.761 1.400 1.00 0.00 H new ATOM 0 HE2 PHE A 68 15.076 4.723 -1.885 1.00 0.00 H new ATOM 0 HZ PHE A 68 14.506 4.504 0.477 1.00 0.00 H new ATOM 1085 N MET A 69 9.546 5.708 -1.282 1.00 0.00 N ATOM 1086 CA MET A 69 8.905 5.290 -0.046 1.00 0.00 C ATOM 1087 C MET A 69 9.234 3.831 0.276 1.00 0.00 C ATOM 1088 O MET A 69 8.980 2.940 -0.533 1.00 0.00 O ATOM 1089 CB MET A 69 7.390 5.455 -0.176 1.00 0.00 C ATOM 1090 CG MET A 69 6.870 6.523 0.789 1.00 0.00 C ATOM 1091 SD MET A 69 5.250 6.070 1.386 1.00 0.00 S ATOM 1092 CE MET A 69 4.683 7.656 1.978 1.00 0.00 C ATOM 0 H MET A 69 10.022 4.962 -1.789 1.00 0.00 H new ATOM 0 HA MET A 69 9.279 5.915 0.765 1.00 0.00 H new ATOM 0 HB2 MET A 69 7.137 5.731 -1.200 1.00 0.00 H new ATOM 0 HB3 MET A 69 6.898 4.504 0.029 1.00 0.00 H new ATOM 0 HG2 MET A 69 7.558 6.633 1.627 1.00 0.00 H new ATOM 0 HG3 MET A 69 6.824 7.489 0.285 1.00 0.00 H new ATOM 0 HE1 MET A 69 3.678 7.553 2.388 1.00 0.00 H new ATOM 0 HE2 MET A 69 5.357 8.016 2.756 1.00 0.00 H new ATOM 0 HE3 MET A 69 4.668 8.368 1.153 1.00 0.00 H new ATOM 1102 N GLU A 70 9.796 3.632 1.459 1.00 0.00 N ATOM 1103 CA GLU A 70 10.162 2.297 1.899 1.00 0.00 C ATOM 1104 C GLU A 70 9.579 2.015 3.285 1.00 0.00 C ATOM 1105 O GLU A 70 9.137 2.933 3.974 1.00 0.00 O ATOM 1106 CB GLU A 70 11.682 2.117 1.896 1.00 0.00 C ATOM 1107 CG GLU A 70 12.272 2.459 0.527 1.00 0.00 C ATOM 1108 CD GLU A 70 13.656 1.829 0.354 1.00 0.00 C ATOM 1109 OE1 GLU A 70 14.018 1.007 1.223 1.00 0.00 O ATOM 1110 OE2 GLU A 70 14.321 2.185 -0.643 1.00 0.00 O ATOM 0 H GLU A 70 10.007 4.374 2.127 1.00 0.00 H new ATOM 0 HA GLU A 70 9.742 1.577 1.197 1.00 0.00 H new ATOM 0 HB2 GLU A 70 12.129 2.755 2.658 1.00 0.00 H new ATOM 0 HB3 GLU A 70 11.930 1.088 2.156 1.00 0.00 H new ATOM 0 HG2 GLU A 70 11.606 2.104 -0.259 1.00 0.00 H new ATOM 0 HG3 GLU A 70 12.345 3.541 0.418 1.00 0.00 H new ATOM 1118 N GLY A 71 9.596 0.742 3.651 1.00 0.00 N ATOM 1119 CA GLY A 71 9.074 0.328 4.942 1.00 0.00 C ATOM 1120 C GLY A 71 8.654 -1.143 4.918 1.00 0.00 C ATOM 1121 O GLY A 71 7.932 -1.572 4.018 1.00 0.00 O ATOM 0 H GLY A 71 9.963 -0.016 3.076 1.00 0.00 H new ATOM 0 HA2 GLY A 71 9.832 0.481 5.711 1.00 0.00 H new ATOM 0 HA3 GLY A 71 8.219 0.950 5.209 1.00 0.00 H new ATOM 1125 N THR A 72 9.124 -1.877 5.916 1.00 0.00 N ATOM 1126 CA THR A 72 8.807 -3.291 6.020 1.00 0.00 C ATOM 1127 C THR A 72 7.352 -3.480 6.455 1.00 0.00 C ATOM 1128 O THR A 72 6.708 -2.535 6.910 1.00 0.00 O ATOM 1129 CB THR A 72 9.815 -3.933 6.976 1.00 0.00 C ATOM 1130 OG1 THR A 72 9.462 -5.313 6.976 1.00 0.00 O ATOM 1131 CG2 THR A 72 9.607 -3.494 8.427 1.00 0.00 C ATOM 0 H THR A 72 9.722 -1.519 6.660 1.00 0.00 H new ATOM 0 HA THR A 72 8.892 -3.788 5.053 1.00 0.00 H new ATOM 0 HB THR A 72 10.827 -3.678 6.662 1.00 0.00 H new ATOM 0 HG1 THR A 72 10.222 -5.845 6.660 1.00 0.00 H new ATOM 0 HG21 THR A 72 10.348 -3.978 9.063 1.00 0.00 H new ATOM 0 HG22 THR A 72 9.718 -2.412 8.499 1.00 0.00 H new ATOM 0 HG23 THR A 72 8.607 -3.779 8.753 1.00 0.00 H new ATOM 1139 N ALA A 73 6.876 -4.707 6.300 1.00 0.00 N ATOM 1140 CA ALA A 73 5.510 -5.032 6.671 1.00 0.00 C ATOM 1141 C ALA A 73 5.524 -6.097 7.770 1.00 0.00 C ATOM 1142 O ALA A 73 5.944 -7.229 7.536 1.00 0.00 O ATOM 1143 CB ALA A 73 4.738 -5.484 5.430 1.00 0.00 C ATOM 0 H ALA A 73 7.413 -5.488 5.922 1.00 0.00 H new ATOM 0 HA ALA A 73 5.001 -4.154 7.070 1.00 0.00 H new ATOM 0 HB1 ALA A 73 3.713 -5.728 5.708 1.00 0.00 H new ATOM 0 HB2 ALA A 73 4.733 -4.681 4.692 1.00 0.00 H new ATOM 0 HB3 ALA A 73 5.218 -6.365 5.004 1.00 0.00 H new ATOM 1149 N TYR A 74 5.058 -5.696 8.944 1.00 0.00 N ATOM 1150 CA TYR A 74 5.012 -6.602 10.079 1.00 0.00 C ATOM 1151 C TYR A 74 3.651 -6.540 10.775 1.00 0.00 C ATOM 1152 O TYR A 74 3.007 -5.492 10.795 1.00 0.00 O ATOM 1153 CB TYR A 74 6.090 -6.118 11.050 1.00 0.00 C ATOM 1154 CG TYR A 74 6.290 -7.028 12.263 1.00 0.00 C ATOM 1155 CD1 TYR A 74 5.486 -6.883 13.374 1.00 0.00 C ATOM 1156 CD2 TYR A 74 7.275 -7.995 12.245 1.00 0.00 C ATOM 1157 CE1 TYR A 74 5.675 -7.741 14.516 1.00 0.00 C ATOM 1158 CE2 TYR A 74 7.464 -8.852 13.386 1.00 0.00 C ATOM 1159 CZ TYR A 74 6.654 -8.683 14.466 1.00 0.00 C ATOM 1160 OH TYR A 74 6.832 -9.492 15.544 1.00 0.00 O ATOM 0 H TYR A 74 4.709 -4.756 9.133 1.00 0.00 H new ATOM 0 HA TYR A 74 5.173 -7.630 9.755 1.00 0.00 H new ATOM 0 HB2 TYR A 74 7.035 -6.032 10.514 1.00 0.00 H new ATOM 0 HB3 TYR A 74 5.829 -5.119 11.398 1.00 0.00 H new ATOM 0 HD1 TYR A 74 4.715 -6.127 13.388 1.00 0.00 H new ATOM 0 HD2 TYR A 74 7.904 -8.109 11.374 1.00 0.00 H new ATOM 0 HE1 TYR A 74 5.053 -7.638 15.393 1.00 0.00 H new ATOM 0 HE2 TYR A 74 8.231 -9.612 13.385 1.00 0.00 H new ATOM 0 HH TYR A 74 7.565 -10.117 15.366 1.00 0.00 H new ATOM 1170 N PRO A 75 3.242 -7.706 11.343 1.00 0.00 N ATOM 1171 CA PRO A 75 1.969 -7.793 12.038 1.00 0.00 C ATOM 1172 C PRO A 75 2.043 -7.112 13.406 1.00 0.00 C ATOM 1173 O PRO A 75 3.013 -7.292 14.141 1.00 0.00 O ATOM 1174 CB PRO A 75 1.673 -9.281 12.131 1.00 0.00 C ATOM 1175 CG PRO A 75 3.001 -9.986 11.903 1.00 0.00 C ATOM 1176 CD PRO A 75 3.978 -8.967 11.339 1.00 0.00 C ATOM 0 HA PRO A 75 1.167 -7.272 11.514 1.00 0.00 H new ATOM 0 HB2 PRO A 75 1.258 -9.536 13.106 1.00 0.00 H new ATOM 0 HB3 PRO A 75 0.939 -9.580 11.383 1.00 0.00 H new ATOM 0 HG2 PRO A 75 3.379 -10.400 12.838 1.00 0.00 H new ATOM 0 HG3 PRO A 75 2.877 -10.820 11.212 1.00 0.00 H new ATOM 0 HD2 PRO A 75 4.879 -8.902 11.950 1.00 0.00 H new ATOM 0 HD3 PRO A 75 4.295 -9.237 10.332 1.00 0.00 H new ATOM 1184 N VAL A 76 1.006 -6.345 13.707 1.00 0.00 N ATOM 1185 CA VAL A 76 0.941 -5.636 14.974 1.00 0.00 C ATOM 1186 C VAL A 76 0.491 -6.602 16.071 1.00 0.00 C ATOM 1187 O VAL A 76 1.134 -6.705 17.115 1.00 0.00 O ATOM 1188 CB VAL A 76 0.031 -4.413 14.843 1.00 0.00 C ATOM 1189 CG1 VAL A 76 -0.944 -4.328 16.018 1.00 0.00 C ATOM 1190 CG2 VAL A 76 0.854 -3.129 14.719 1.00 0.00 C ATOM 0 H VAL A 76 0.203 -6.199 13.095 1.00 0.00 H new ATOM 0 HA VAL A 76 1.926 -5.263 15.254 1.00 0.00 H new ATOM 0 HB VAL A 76 -0.554 -4.526 13.930 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -1.579 -3.450 15.901 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.564 -5.224 16.042 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -0.384 -4.249 16.950 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.184 -2.275 14.627 1.00 0.00 H new ATOM 0 HG22 VAL A 76 1.476 -3.008 15.606 1.00 0.00 H new ATOM 0 HG23 VAL A 76 1.490 -3.188 13.835 1.00 0.00 H new ATOM 1200 N GLY A 77 -0.611 -7.285 15.798 1.00 0.00 N ATOM 1201 CA GLY A 77 -1.155 -8.239 16.750 1.00 0.00 C ATOM 1202 C GLY A 77 -1.053 -9.668 16.212 1.00 0.00 C ATOM 1203 O GLY A 77 0.003 -10.083 15.737 1.00 0.00 O ATOM 0 H GLY A 77 -1.142 -7.197 14.932 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -0.617 -8.163 17.695 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -2.198 -7.998 16.957 1.00 0.00 H new ATOM 1207 N ASP A 78 -2.166 -10.382 16.306 1.00 0.00 N ATOM 1208 CA ASP A 78 -2.215 -11.756 15.835 1.00 0.00 C ATOM 1209 C ASP A 78 -1.552 -11.843 14.459 1.00 0.00 C ATOM 1210 O ASP A 78 -2.052 -11.278 13.488 1.00 0.00 O ATOM 1211 CB ASP A 78 -3.660 -12.238 15.695 1.00 0.00 C ATOM 1212 CG ASP A 78 -4.131 -13.197 16.789 1.00 0.00 C ATOM 1213 OD1 ASP A 78 -3.263 -13.627 17.580 1.00 0.00 O ATOM 1214 OD2 ASP A 78 -5.349 -13.480 16.812 1.00 0.00 O ATOM 0 H ASP A 78 -3.040 -10.035 16.701 1.00 0.00 H new ATOM 0 HA ASP A 78 -1.695 -12.381 16.561 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.318 -11.369 15.687 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -3.771 -12.730 14.729 1.00 0.00 H new ATOM 1220 N SER A 79 -0.435 -12.555 14.420 1.00 0.00 N ATOM 1221 CA SER A 79 0.302 -12.724 13.179 1.00 0.00 C ATOM 1222 C SER A 79 -0.669 -12.980 12.025 1.00 0.00 C ATOM 1223 O SER A 79 -0.691 -12.231 11.049 1.00 0.00 O ATOM 1224 CB SER A 79 1.311 -13.869 13.289 1.00 0.00 C ATOM 1225 OG SER A 79 2.271 -13.637 14.316 1.00 0.00 O ATOM 0 H SER A 79 -0.023 -13.021 15.228 1.00 0.00 H new ATOM 0 HA SER A 79 0.856 -11.806 12.982 1.00 0.00 H new ATOM 0 HB2 SER A 79 0.782 -14.800 13.491 1.00 0.00 H new ATOM 0 HB3 SER A 79 1.823 -13.994 12.335 1.00 0.00 H new ATOM 0 HG SER A 79 2.896 -14.391 14.356 1.00 0.00 H new ATOM 1231 N LYS A 80 -1.448 -14.042 12.173 1.00 0.00 N ATOM 1232 CA LYS A 80 -2.418 -14.406 11.155 1.00 0.00 C ATOM 1233 C LYS A 80 -3.209 -13.163 10.742 1.00 0.00 C ATOM 1234 O LYS A 80 -3.170 -12.756 9.582 1.00 0.00 O ATOM 1235 CB LYS A 80 -3.297 -15.561 11.641 1.00 0.00 C ATOM 1236 CG LYS A 80 -3.926 -15.237 12.998 1.00 0.00 C ATOM 1237 CD LYS A 80 -4.258 -16.517 13.768 1.00 0.00 C ATOM 1238 CE LYS A 80 -3.985 -16.344 15.263 1.00 0.00 C ATOM 1239 NZ LYS A 80 -4.545 -17.481 16.027 1.00 0.00 N ATOM 0 H LYS A 80 -1.427 -14.662 12.983 1.00 0.00 H new ATOM 0 HA LYS A 80 -1.913 -14.774 10.262 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -4.081 -15.758 10.910 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -2.699 -16.469 11.720 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -3.241 -14.624 13.583 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -4.833 -14.651 12.852 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -5.305 -16.777 13.614 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -3.664 -17.344 13.379 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -2.911 -16.275 15.437 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -4.425 -15.411 15.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -4.351 -17.348 17.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -5.573 -17.529 15.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -4.105 -18.366 15.704 1.00 0.00 H new ATOM 1253 N ILE A 81 -3.908 -12.596 11.713 1.00 0.00 N ATOM 1254 CA ILE A 81 -4.707 -11.408 11.465 1.00 0.00 C ATOM 1255 C ILE A 81 -3.844 -10.356 10.763 1.00 0.00 C ATOM 1256 O ILE A 81 -2.619 -10.388 10.860 1.00 0.00 O ATOM 1257 CB ILE A 81 -5.347 -10.911 12.763 1.00 0.00 C ATOM 1258 CG1 ILE A 81 -6.827 -11.291 12.825 1.00 0.00 C ATOM 1259 CG2 ILE A 81 -5.133 -9.406 12.939 1.00 0.00 C ATOM 1260 CD1 ILE A 81 -7.019 -12.790 12.581 1.00 0.00 C ATOM 0 H ILE A 81 -3.938 -12.937 12.674 1.00 0.00 H new ATOM 0 HA ILE A 81 -5.536 -11.640 10.797 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.853 -11.406 13.599 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -7.235 -11.022 13.800 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -7.383 -10.723 12.079 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.598 -9.079 13.869 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -4.065 -9.192 12.972 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.584 -8.874 12.101 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -8.080 -13.034 12.630 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -6.632 -13.051 11.596 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -6.481 -13.354 13.343 1.00 0.00 H new ATOM 1272 N GLY A 82 -4.519 -9.450 10.072 1.00 0.00 N ATOM 1273 CA GLY A 82 -3.830 -8.391 9.354 1.00 0.00 C ATOM 1274 C GLY A 82 -3.036 -7.504 10.315 1.00 0.00 C ATOM 1275 O GLY A 82 -2.003 -7.918 10.838 1.00 0.00 O ATOM 0 H GLY A 82 -5.536 -9.427 9.994 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -3.157 -8.826 8.615 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -4.554 -7.786 8.809 1.00 0.00 H new ATOM 1279 N LYS A 83 -3.549 -6.299 10.518 1.00 0.00 N ATOM 1280 CA LYS A 83 -2.901 -5.350 11.407 1.00 0.00 C ATOM 1281 C LYS A 83 -1.394 -5.356 11.141 1.00 0.00 C ATOM 1282 O LYS A 83 -0.599 -5.547 12.061 1.00 0.00 O ATOM 1283 CB LYS A 83 -3.270 -5.640 12.862 1.00 0.00 C ATOM 1284 CG LYS A 83 -3.709 -4.363 13.582 1.00 0.00 C ATOM 1285 CD LYS A 83 -5.218 -4.368 13.837 1.00 0.00 C ATOM 1286 CE LYS A 83 -5.566 -3.550 15.082 1.00 0.00 C ATOM 1287 NZ LYS A 83 -5.658 -4.427 16.270 1.00 0.00 N ATOM 0 H LYS A 83 -4.406 -5.958 10.082 1.00 0.00 H new ATOM 0 HA LYS A 83 -3.256 -4.339 11.209 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -4.073 -6.376 12.897 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -2.415 -6.077 13.378 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -3.177 -4.274 14.529 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -3.441 -3.493 12.983 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -5.738 -3.958 12.971 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -5.566 -5.393 13.962 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -4.807 -2.785 15.245 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -6.513 -3.032 14.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -5.895 -3.855 17.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -6.398 -5.141 16.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -4.745 -4.902 16.423 1.00 0.00 H new ATOM 1301 N ILE A 84 -1.046 -5.146 9.880 1.00 0.00 N ATOM 1302 CA ILE A 84 0.351 -5.125 9.483 1.00 0.00 C ATOM 1303 C ILE A 84 0.839 -3.676 9.426 1.00 0.00 C ATOM 1304 O ILE A 84 0.462 -2.924 8.529 1.00 0.00 O ATOM 1305 CB ILE A 84 0.547 -5.891 8.173 1.00 0.00 C ATOM 1306 CG1 ILE A 84 -0.380 -7.107 8.105 1.00 0.00 C ATOM 1307 CG2 ILE A 84 2.014 -6.278 7.978 1.00 0.00 C ATOM 1308 CD1 ILE A 84 -1.632 -6.796 7.283 1.00 0.00 C ATOM 0 H ILE A 84 -1.708 -4.989 9.120 1.00 0.00 H new ATOM 0 HA ILE A 84 0.965 -5.640 10.222 1.00 0.00 H new ATOM 0 HB ILE A 84 0.276 -5.232 7.348 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.151 -7.949 7.661 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -0.667 -7.407 9.113 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.125 -6.821 7.040 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.627 -5.377 7.951 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.336 -6.912 8.804 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -2.274 -7.676 7.250 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -2.173 -5.969 7.743 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -1.342 -6.520 6.269 1.00 0.00 H new ATOM 1320 N TYR A 85 1.672 -3.327 10.396 1.00 0.00 N ATOM 1321 CA TYR A 85 2.216 -1.982 10.468 1.00 0.00 C ATOM 1322 C TYR A 85 3.448 -1.840 9.573 1.00 0.00 C ATOM 1323 O TYR A 85 4.307 -2.721 9.549 1.00 0.00 O ATOM 1324 CB TYR A 85 2.631 -1.772 11.925 1.00 0.00 C ATOM 1325 CG TYR A 85 4.072 -2.190 12.227 1.00 0.00 C ATOM 1326 CD1 TYR A 85 5.124 -1.441 11.741 1.00 0.00 C ATOM 1327 CD2 TYR A 85 4.319 -3.316 12.986 1.00 0.00 C ATOM 1328 CE1 TYR A 85 6.480 -1.833 12.026 1.00 0.00 C ATOM 1329 CE2 TYR A 85 5.675 -3.709 13.271 1.00 0.00 C ATOM 1330 CZ TYR A 85 6.689 -2.948 12.776 1.00 0.00 C ATOM 1331 OH TYR A 85 7.969 -3.319 13.045 1.00 0.00 O ATOM 0 H TYR A 85 1.983 -3.953 11.139 1.00 0.00 H new ATOM 0 HA TYR A 85 1.479 -1.252 10.134 1.00 0.00 H new ATOM 0 HB2 TYR A 85 2.508 -0.719 12.179 1.00 0.00 H new ATOM 0 HB3 TYR A 85 1.957 -2.336 12.569 1.00 0.00 H new ATOM 0 HD1 TYR A 85 4.930 -0.560 11.147 1.00 0.00 H new ATOM 0 HD2 TYR A 85 3.496 -3.902 13.366 1.00 0.00 H new ATOM 0 HE1 TYR A 85 7.312 -1.255 11.653 1.00 0.00 H new ATOM 0 HE2 TYR A 85 5.882 -4.588 13.864 1.00 0.00 H new ATOM 0 HH TYR A 85 7.966 -4.133 13.591 1.00 0.00 H new ATOM 1341 N HIS A 86 3.496 -0.725 8.859 1.00 0.00 N ATOM 1342 CA HIS A 86 4.610 -0.457 7.964 1.00 0.00 C ATOM 1343 C HIS A 86 5.507 0.624 8.571 1.00 0.00 C ATOM 1344 O HIS A 86 5.049 1.731 8.850 1.00 0.00 O ATOM 1345 CB HIS A 86 4.108 -0.094 6.565 1.00 0.00 C ATOM 1346 CG HIS A 86 3.593 -1.272 5.773 1.00 0.00 C ATOM 1347 ND1 HIS A 86 2.622 -2.185 6.062 1.00 0.00 N flip ATOM 1348 CD2 HIS A 86 4.091 -1.613 4.527 1.00 0.00 C flip ATOM 1349 CE1 HIS A 86 2.530 -3.036 5.048 1.00 0.00 C flip ATOM 1350 NE2 HIS A 86 3.440 -2.683 4.095 1.00 0.00 N flip ATOM 0 H HIS A 86 2.782 0.003 8.882 1.00 0.00 H new ATOM 0 HA HIS A 86 5.213 -1.358 7.848 1.00 0.00 H new ATOM 0 HB2 HIS A 86 3.312 0.645 6.656 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.919 0.377 6.010 1.00 0.00 H new ATOM 0 HD1 HIS A 86 2.061 -2.210 6.914 1.00 0.00 H new ATOM 0 HD2 HIS A 86 4.877 -1.095 3.997 1.00 0.00 H new ATOM 0 HE1 HIS A 86 1.847 -3.871 4.987 1.00 0.00 H new ATOM 1358 N SER A 87 6.768 0.265 8.759 1.00 0.00 N ATOM 1359 CA SER A 87 7.733 1.190 9.328 1.00 0.00 C ATOM 1360 C SER A 87 8.316 2.080 8.228 1.00 0.00 C ATOM 1361 O SER A 87 9.103 1.619 7.403 1.00 0.00 O ATOM 1362 CB SER A 87 8.853 0.441 10.053 1.00 0.00 C ATOM 1363 OG SER A 87 8.990 0.866 11.406 1.00 0.00 O ATOM 0 H SER A 87 7.144 -0.654 8.527 1.00 0.00 H new ATOM 0 HA SER A 87 7.218 1.815 10.058 1.00 0.00 H new ATOM 0 HB2 SER A 87 8.649 -0.629 10.028 1.00 0.00 H new ATOM 0 HB3 SER A 87 9.794 0.598 9.526 1.00 0.00 H new ATOM 0 HG SER A 87 9.714 0.363 11.835 1.00 0.00 H new ATOM 1369 N ARG A 88 7.906 3.340 8.251 1.00 0.00 N ATOM 1370 CA ARG A 88 8.377 4.299 7.267 1.00 0.00 C ATOM 1371 C ARG A 88 9.414 5.235 7.891 1.00 0.00 C ATOM 1372 O ARG A 88 9.114 5.952 8.844 1.00 0.00 O ATOM 1373 CB ARG A 88 7.220 5.130 6.709 1.00 0.00 C ATOM 1374 CG ARG A 88 6.754 6.173 7.727 1.00 0.00 C ATOM 1375 CD ARG A 88 5.333 6.648 7.414 1.00 0.00 C ATOM 1376 NE ARG A 88 4.917 7.677 8.392 1.00 0.00 N ATOM 1377 CZ ARG A 88 3.646 8.055 8.589 1.00 0.00 C ATOM 1378 NH1 ARG A 88 2.661 7.492 7.877 1.00 0.00 N ATOM 1379 NH2 ARG A 88 3.361 8.997 9.499 1.00 0.00 N ATOM 0 H ARG A 88 7.252 3.719 8.936 1.00 0.00 H new ATOM 0 HA ARG A 88 8.833 3.739 6.451 1.00 0.00 H new ATOM 0 HB2 ARG A 88 7.534 5.627 5.791 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.389 4.474 6.448 1.00 0.00 H new ATOM 0 HG2 ARG A 88 6.786 5.747 8.730 1.00 0.00 H new ATOM 0 HG3 ARG A 88 7.436 7.024 7.720 1.00 0.00 H new ATOM 0 HD2 ARG A 88 5.291 7.056 6.404 1.00 0.00 H new ATOM 0 HD3 ARG A 88 4.643 5.804 7.446 1.00 0.00 H new ATOM 0 HE ARG A 88 5.642 8.127 8.951 1.00 0.00 H new ATOM 0 HH11 ARG A 88 2.878 6.775 7.184 1.00 0.00 H new ATOM 0 HH12 ARG A 88 1.694 7.780 8.027 1.00 0.00 H new ATOM 0 HH21 ARG A 88 4.111 9.426 10.041 1.00 0.00 H new ATOM 0 HH22 ARG A 88 2.394 9.285 9.649 1.00 0.00 H new ATOM 1393 N THR A 89 10.613 5.197 7.329 1.00 0.00 N ATOM 1394 CA THR A 89 11.696 6.033 7.819 1.00 0.00 C ATOM 1395 C THR A 89 11.895 7.240 6.900 1.00 0.00 C ATOM 1396 O THR A 89 11.776 7.124 5.681 1.00 0.00 O ATOM 1397 CB THR A 89 12.944 5.159 7.953 1.00 0.00 C ATOM 1398 OG1 THR A 89 12.832 4.226 6.882 1.00 0.00 O ATOM 1399 CG2 THR A 89 12.917 4.289 9.211 1.00 0.00 C ATOM 0 H THR A 89 10.859 4.600 6.539 1.00 0.00 H new ATOM 0 HA THR A 89 11.464 6.446 8.801 1.00 0.00 H new ATOM 0 HB THR A 89 13.831 5.793 7.969 1.00 0.00 H new ATOM 0 HG1 THR A 89 13.603 3.621 6.893 1.00 0.00 H new ATOM 0 HG21 THR A 89 13.826 3.689 9.258 1.00 0.00 H new ATOM 0 HG22 THR A 89 12.858 4.927 10.093 1.00 0.00 H new ATOM 0 HG23 THR A 89 12.049 3.631 9.180 1.00 0.00 H new ATOM 1407 N VAL A 90 12.195 8.372 7.520 1.00 0.00 N ATOM 1408 CA VAL A 90 12.412 9.600 6.773 1.00 0.00 C ATOM 1409 C VAL A 90 13.569 10.378 7.404 1.00 0.00 C ATOM 1410 O VAL A 90 13.358 11.189 8.304 1.00 0.00 O ATOM 1411 CB VAL A 90 11.115 10.408 6.706 1.00 0.00 C ATOM 1412 CG1 VAL A 90 11.397 11.871 6.361 1.00 0.00 C ATOM 1413 CG2 VAL A 90 10.134 9.789 5.708 1.00 0.00 C ATOM 0 H VAL A 90 12.293 8.465 8.531 1.00 0.00 H new ATOM 0 HA VAL A 90 12.693 9.376 5.744 1.00 0.00 H new ATOM 0 HB VAL A 90 10.652 10.380 7.692 1.00 0.00 H new ATOM 0 HG11 VAL A 90 10.458 12.423 6.320 1.00 0.00 H new ATOM 0 HG12 VAL A 90 12.041 12.307 7.125 1.00 0.00 H new ATOM 0 HG13 VAL A 90 11.894 11.927 5.392 1.00 0.00 H new ATOM 0 HG21 VAL A 90 9.220 10.383 5.680 1.00 0.00 H new ATOM 0 HG22 VAL A 90 10.586 9.772 4.716 1.00 0.00 H new ATOM 0 HG23 VAL A 90 9.896 8.771 6.016 1.00 0.00 H new ATOM 1423 N GLY A 91 14.766 10.103 6.906 1.00 0.00 N ATOM 1424 CA GLY A 91 15.956 10.766 7.409 1.00 0.00 C ATOM 1425 C GLY A 91 16.015 10.703 8.937 1.00 0.00 C ATOM 1426 O GLY A 91 16.562 9.757 9.502 1.00 0.00 O ATOM 0 H GLY A 91 14.937 9.430 6.159 1.00 0.00 H new ATOM 0 HA2 GLY A 91 16.844 10.295 6.988 1.00 0.00 H new ATOM 0 HA3 GLY A 91 15.962 11.806 7.084 1.00 0.00 H new ATOM 1430 N GLY A 92 15.443 11.722 9.562 1.00 0.00 N ATOM 1431 CA GLY A 92 15.423 11.794 11.013 1.00 0.00 C ATOM 1432 C GLY A 92 13.988 11.805 11.542 1.00 0.00 C ATOM 1433 O GLY A 92 13.717 12.369 12.601 1.00 0.00 O ATOM 0 H GLY A 92 14.990 12.504 9.090 1.00 0.00 H new ATOM 0 HA2 GLY A 92 15.962 10.943 11.430 1.00 0.00 H new ATOM 0 HA3 GLY A 92 15.943 12.693 11.343 1.00 0.00 H new ATOM 1437 N TYR A 93 13.105 11.176 10.780 1.00 0.00 N ATOM 1438 CA TYR A 93 11.704 11.107 11.159 1.00 0.00 C ATOM 1439 C TYR A 93 11.110 9.740 10.814 1.00 0.00 C ATOM 1440 O TYR A 93 10.649 9.524 9.694 1.00 0.00 O ATOM 1441 CB TYR A 93 10.991 12.182 10.336 1.00 0.00 C ATOM 1442 CG TYR A 93 9.824 12.851 11.064 1.00 0.00 C ATOM 1443 CD1 TYR A 93 8.591 12.234 11.105 1.00 0.00 C ATOM 1444 CD2 TYR A 93 10.005 14.073 11.681 1.00 0.00 C ATOM 1445 CE1 TYR A 93 7.492 12.864 11.791 1.00 0.00 C ATOM 1446 CE2 TYR A 93 8.907 14.703 12.367 1.00 0.00 C ATOM 1447 CZ TYR A 93 7.705 14.068 12.388 1.00 0.00 C ATOM 1448 OH TYR A 93 6.667 14.663 13.035 1.00 0.00 O ATOM 0 H TYR A 93 13.333 10.710 9.902 1.00 0.00 H new ATOM 0 HA TYR A 93 11.589 11.257 12.232 1.00 0.00 H new ATOM 0 HB2 TYR A 93 11.714 12.946 10.051 1.00 0.00 H new ATOM 0 HB3 TYR A 93 10.621 11.733 9.414 1.00 0.00 H new ATOM 0 HD1 TYR A 93 8.449 11.278 10.623 1.00 0.00 H new ATOM 0 HD2 TYR A 93 10.970 14.556 11.649 1.00 0.00 H new ATOM 0 HE1 TYR A 93 6.522 12.392 11.831 1.00 0.00 H new ATOM 0 HE2 TYR A 93 9.035 15.658 12.854 1.00 0.00 H new ATOM 0 HH TYR A 93 6.964 15.516 13.414 1.00 0.00 H new ATOM 1458 N THR A 94 11.140 8.852 11.797 1.00 0.00 N ATOM 1459 CA THR A 94 10.610 7.512 11.611 1.00 0.00 C ATOM 1460 C THR A 94 9.285 7.354 12.362 1.00 0.00 C ATOM 1461 O THR A 94 9.143 7.834 13.485 1.00 0.00 O ATOM 1462 CB THR A 94 11.682 6.514 12.054 1.00 0.00 C ATOM 1463 OG1 THR A 94 12.788 6.791 11.199 1.00 0.00 O ATOM 1464 CG2 THR A 94 11.308 5.068 11.723 1.00 0.00 C ATOM 0 H THR A 94 11.523 9.034 12.725 1.00 0.00 H new ATOM 0 HA THR A 94 10.379 7.319 10.563 1.00 0.00 H new ATOM 0 HB THR A 94 11.846 6.610 13.127 1.00 0.00 H new ATOM 0 HG1 THR A 94 13.578 6.307 11.518 1.00 0.00 H new ATOM 0 HG21 THR A 94 12.102 4.401 12.058 1.00 0.00 H new ATOM 0 HG22 THR A 94 10.378 4.808 12.229 1.00 0.00 H new ATOM 0 HG23 THR A 94 11.177 4.963 10.646 1.00 0.00 H new ATOM 1472 N LYS A 95 8.350 6.678 11.710 1.00 0.00 N ATOM 1473 CA LYS A 95 7.043 6.451 12.301 1.00 0.00 C ATOM 1474 C LYS A 95 6.505 5.096 11.834 1.00 0.00 C ATOM 1475 O LYS A 95 6.683 4.720 10.676 1.00 0.00 O ATOM 1476 CB LYS A 95 6.106 7.622 11.998 1.00 0.00 C ATOM 1477 CG LYS A 95 4.733 7.407 12.639 1.00 0.00 C ATOM 1478 CD LYS A 95 4.748 7.811 14.114 1.00 0.00 C ATOM 1479 CE LYS A 95 3.376 7.594 14.755 1.00 0.00 C ATOM 1480 NZ LYS A 95 3.380 8.060 16.160 1.00 0.00 N ATOM 0 H LYS A 95 8.472 6.281 10.779 1.00 0.00 H new ATOM 0 HA LYS A 95 7.119 6.407 13.387 1.00 0.00 H new ATOM 0 HB2 LYS A 95 6.544 8.548 12.370 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.994 7.733 10.919 1.00 0.00 H new ATOM 0 HG2 LYS A 95 3.983 7.991 12.106 1.00 0.00 H new ATOM 0 HG3 LYS A 95 4.445 6.360 12.548 1.00 0.00 H new ATOM 0 HD2 LYS A 95 5.499 7.228 14.647 1.00 0.00 H new ATOM 0 HD3 LYS A 95 5.034 8.859 14.205 1.00 0.00 H new ATOM 0 HE2 LYS A 95 2.615 8.132 14.190 1.00 0.00 H new ATOM 0 HE3 LYS A 95 3.114 6.537 14.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 2.441 7.905 16.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 4.093 7.529 16.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 3.609 9.074 16.189 1.00 0.00 H new ATOM 1494 N LYS A 96 5.858 4.402 12.758 1.00 0.00 N ATOM 1495 CA LYS A 96 5.294 3.097 12.455 1.00 0.00 C ATOM 1496 C LYS A 96 3.809 3.254 12.121 1.00 0.00 C ATOM 1497 O LYS A 96 3.000 3.551 12.998 1.00 0.00 O ATOM 1498 CB LYS A 96 5.567 2.117 13.598 1.00 0.00 C ATOM 1499 CG LYS A 96 7.014 2.227 14.080 1.00 0.00 C ATOM 1500 CD LYS A 96 7.703 0.860 14.064 1.00 0.00 C ATOM 1501 CE LYS A 96 7.691 0.224 15.455 1.00 0.00 C ATOM 1502 NZ LYS A 96 6.316 -0.173 15.832 1.00 0.00 N ATOM 0 H LYS A 96 5.711 4.718 13.717 1.00 0.00 H new ATOM 0 HA LYS A 96 5.776 2.668 11.576 1.00 0.00 H new ATOM 0 HB2 LYS A 96 4.888 2.320 14.426 1.00 0.00 H new ATOM 0 HB3 LYS A 96 5.367 1.099 13.264 1.00 0.00 H new ATOM 0 HG2 LYS A 96 7.561 2.922 13.443 1.00 0.00 H new ATOM 0 HG3 LYS A 96 7.035 2.637 15.090 1.00 0.00 H new ATOM 0 HD2 LYS A 96 7.199 0.203 13.355 1.00 0.00 H new ATOM 0 HD3 LYS A 96 8.731 0.971 13.720 1.00 0.00 H new ATOM 0 HE2 LYS A 96 8.344 -0.649 15.468 1.00 0.00 H new ATOM 0 HE3 LYS A 96 8.086 0.929 16.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 6.331 -0.634 16.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 5.710 0.671 15.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 5.940 -0.836 15.124 1.00 0.00 H new ATOM 1516 N THR A 97 3.496 3.047 10.850 1.00 0.00 N ATOM 1517 CA THR A 97 2.123 3.162 10.389 1.00 0.00 C ATOM 1518 C THR A 97 1.431 1.798 10.431 1.00 0.00 C ATOM 1519 O THR A 97 2.076 0.765 10.258 1.00 0.00 O ATOM 1520 CB THR A 97 2.144 3.791 8.994 1.00 0.00 C ATOM 1521 OG1 THR A 97 0.769 4.023 8.698 1.00 0.00 O ATOM 1522 CG2 THR A 97 2.597 2.806 7.914 1.00 0.00 C ATOM 0 H THR A 97 4.170 2.800 10.125 1.00 0.00 H new ATOM 0 HA THR A 97 1.538 3.808 11.044 1.00 0.00 H new ATOM 0 HB THR A 97 2.806 4.657 8.996 1.00 0.00 H new ATOM 0 HG1 THR A 97 0.690 4.432 7.811 1.00 0.00 H new ATOM 0 HG21 THR A 97 2.594 3.303 6.944 1.00 0.00 H new ATOM 0 HG22 THR A 97 3.605 2.457 8.140 1.00 0.00 H new ATOM 0 HG23 THR A 97 1.916 1.956 7.888 1.00 0.00 H new ATOM 1530 N VAL A 98 0.127 1.839 10.661 1.00 0.00 N ATOM 1531 CA VAL A 98 -0.660 0.620 10.728 1.00 0.00 C ATOM 1532 C VAL A 98 -1.448 0.454 9.427 1.00 0.00 C ATOM 1533 O VAL A 98 -2.108 1.389 8.973 1.00 0.00 O ATOM 1534 CB VAL A 98 -1.554 0.641 11.969 1.00 0.00 C ATOM 1535 CG1 VAL A 98 -2.366 -0.651 12.082 1.00 0.00 C ATOM 1536 CG2 VAL A 98 -0.729 0.882 13.235 1.00 0.00 C ATOM 0 H VAL A 98 -0.404 2.698 10.803 1.00 0.00 H new ATOM 0 HA VAL A 98 -0.009 -0.249 10.827 1.00 0.00 H new ATOM 0 HB VAL A 98 -2.255 1.469 11.863 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -2.993 -0.610 12.973 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -2.996 -0.763 11.200 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -1.688 -1.502 12.154 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -1.389 0.892 14.103 1.00 0.00 H new ATOM 0 HG22 VAL A 98 0.006 0.085 13.347 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -0.216 1.841 13.158 1.00 0.00 H new ATOM 1546 N PHE A 99 -1.353 -0.741 8.863 1.00 0.00 N ATOM 1547 CA PHE A 99 -2.049 -1.040 7.623 1.00 0.00 C ATOM 1548 C PHE A 99 -2.778 -2.382 7.713 1.00 0.00 C ATOM 1549 O PHE A 99 -2.144 -3.435 7.756 1.00 0.00 O ATOM 1550 CB PHE A 99 -0.988 -1.123 6.523 1.00 0.00 C ATOM 1551 CG PHE A 99 -1.560 -1.113 5.104 1.00 0.00 C ATOM 1552 CD1 PHE A 99 -1.877 0.066 4.506 1.00 0.00 C ATOM 1553 CD2 PHE A 99 -1.752 -2.285 4.441 1.00 0.00 C ATOM 1554 CE1 PHE A 99 -2.408 0.075 3.189 1.00 0.00 C ATOM 1555 CE2 PHE A 99 -2.283 -2.277 3.124 1.00 0.00 C ATOM 1556 CZ PHE A 99 -2.600 -1.097 2.526 1.00 0.00 C ATOM 0 H PHE A 99 -0.805 -1.513 9.242 1.00 0.00 H new ATOM 0 HA PHE A 99 -2.790 -0.267 7.417 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -0.300 -0.285 6.632 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -0.405 -2.034 6.662 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -1.725 0.996 5.033 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -1.501 -3.222 4.916 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -2.659 1.012 2.714 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -2.435 -3.207 2.597 1.00 0.00 H new ATOM 0 HZ PHE A 99 -3.004 -1.091 1.525 1.00 0.00 H new ATOM 1566 N ASN A 100 -4.100 -2.301 7.740 1.00 0.00 N ATOM 1567 CA ASN A 100 -4.922 -3.496 7.824 1.00 0.00 C ATOM 1568 C ASN A 100 -5.397 -3.884 6.423 1.00 0.00 C ATOM 1569 O ASN A 100 -6.237 -3.202 5.837 1.00 0.00 O ATOM 1570 CB ASN A 100 -6.158 -3.254 8.692 1.00 0.00 C ATOM 1571 CG ASN A 100 -5.804 -3.312 10.180 1.00 0.00 C ATOM 1572 OD1 ASN A 100 -5.861 -4.351 10.817 1.00 0.00 O ATOM 1573 ND2 ASN A 100 -5.437 -2.142 10.695 1.00 0.00 N ATOM 0 H ASN A 100 -4.623 -1.426 7.705 1.00 0.00 H new ATOM 0 HA ASN A 100 -4.319 -4.289 8.267 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -6.588 -2.281 8.455 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -6.918 -4.002 8.466 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -5.181 -2.076 11.680 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -5.411 -1.311 10.105 1.00 0.00 H new ATOM 1580 N VAL A 101 -4.838 -4.977 5.925 1.00 0.00 N ATOM 1581 CA VAL A 101 -5.194 -5.464 4.602 1.00 0.00 C ATOM 1582 C VAL A 101 -6.548 -6.173 4.672 1.00 0.00 C ATOM 1583 O VAL A 101 -6.634 -7.310 5.132 1.00 0.00 O ATOM 1584 CB VAL A 101 -4.079 -6.357 4.056 1.00 0.00 C ATOM 1585 CG1 VAL A 101 -4.490 -6.997 2.728 1.00 0.00 C ATOM 1586 CG2 VAL A 101 -2.773 -5.573 3.905 1.00 0.00 C ATOM 0 H VAL A 101 -4.141 -5.539 6.413 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.298 -4.633 3.904 1.00 0.00 H new ATOM 0 HB VAL A 101 -3.908 -7.158 4.776 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -3.679 -7.627 2.361 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.382 -7.605 2.878 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.701 -6.216 1.998 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -1.997 -6.231 3.515 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -2.925 -4.743 3.215 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -2.466 -5.186 4.877 1.00 0.00 H new ATOM 1596 N LEU A 102 -7.572 -5.472 4.209 1.00 0.00 N ATOM 1597 CA LEU A 102 -8.918 -6.020 4.212 1.00 0.00 C ATOM 1598 C LEU A 102 -8.851 -7.526 3.952 1.00 0.00 C ATOM 1599 O LEU A 102 -8.818 -8.321 4.890 1.00 0.00 O ATOM 1600 CB LEU A 102 -9.807 -5.264 3.224 1.00 0.00 C ATOM 1601 CG LEU A 102 -10.708 -4.182 3.823 1.00 0.00 C ATOM 1602 CD1 LEU A 102 -11.522 -3.481 2.734 1.00 0.00 C ATOM 1603 CD2 LEU A 102 -11.600 -4.759 4.924 1.00 0.00 C ATOM 0 H LEU A 102 -7.497 -4.528 3.829 1.00 0.00 H new ATOM 0 HA LEU A 102 -9.382 -5.885 5.189 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -9.168 -4.801 2.472 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -10.437 -5.987 2.706 1.00 0.00 H new ATOM 0 HG LEU A 102 -10.073 -3.427 4.286 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -12.154 -2.717 3.187 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -10.846 -3.015 2.017 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -12.147 -4.211 2.220 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -12.230 -3.969 5.333 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -12.229 -5.546 4.508 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -10.977 -5.173 5.717 1.00 0.00 H new ATOM 1615 N SER A 103 -8.832 -7.873 2.673 1.00 0.00 N ATOM 1616 CA SER A 103 -8.770 -9.270 2.278 1.00 0.00 C ATOM 1617 C SER A 103 -8.238 -9.385 0.848 1.00 0.00 C ATOM 1618 O SER A 103 -8.977 -9.174 -0.112 1.00 0.00 O ATOM 1619 CB SER A 103 -10.143 -9.936 2.389 1.00 0.00 C ATOM 1620 OG SER A 103 -10.186 -10.899 3.438 1.00 0.00 O ATOM 0 H SER A 103 -8.858 -7.211 1.897 1.00 0.00 H new ATOM 0 HA SER A 103 -8.090 -9.787 2.955 1.00 0.00 H new ATOM 0 HB2 SER A 103 -10.902 -9.174 2.565 1.00 0.00 H new ATOM 0 HB3 SER A 103 -10.389 -10.419 1.443 1.00 0.00 H new ATOM 0 HG SER A 103 -11.079 -11.300 3.477 1.00 0.00 H new ATOM 1626 N THR A 104 -6.959 -9.720 0.751 1.00 0.00 N ATOM 1627 CA THR A 104 -6.320 -9.866 -0.545 1.00 0.00 C ATOM 1628 C THR A 104 -6.466 -11.302 -1.053 1.00 0.00 C ATOM 1629 O THR A 104 -6.645 -12.228 -0.264 1.00 0.00 O ATOM 1630 CB THR A 104 -4.864 -9.416 -0.407 1.00 0.00 C ATOM 1631 OG1 THR A 104 -4.295 -9.683 -1.687 1.00 0.00 O ATOM 1632 CG2 THR A 104 -4.064 -10.303 0.549 1.00 0.00 C ATOM 0 H THR A 104 -6.349 -9.894 1.549 1.00 0.00 H new ATOM 0 HA THR A 104 -6.800 -9.238 -1.296 1.00 0.00 H new ATOM 0 HB THR A 104 -4.835 -8.385 -0.054 1.00 0.00 H new ATOM 0 HG1 THR A 104 -3.437 -10.142 -1.574 1.00 0.00 H new ATOM 0 HG21 THR A 104 -3.038 -9.940 0.610 1.00 0.00 H new ATOM 0 HG22 THR A 104 -4.519 -10.274 1.539 1.00 0.00 H new ATOM 0 HG23 THR A 104 -4.064 -11.329 0.180 1.00 0.00 H new ATOM 1640 N ASP A 105 -6.385 -11.441 -2.368 1.00 0.00 N ATOM 1641 CA ASP A 105 -6.507 -12.748 -2.991 1.00 0.00 C ATOM 1642 C ASP A 105 -5.118 -13.375 -3.126 1.00 0.00 C ATOM 1643 O ASP A 105 -4.970 -14.593 -3.029 1.00 0.00 O ATOM 1644 CB ASP A 105 -7.113 -12.636 -4.392 1.00 0.00 C ATOM 1645 CG ASP A 105 -8.584 -13.045 -4.494 1.00 0.00 C ATOM 1646 OD1 ASP A 105 -9.288 -12.891 -3.473 1.00 0.00 O ATOM 1647 OD2 ASP A 105 -8.971 -13.501 -5.592 1.00 0.00 O ATOM 0 H ASP A 105 -6.236 -10.670 -3.019 1.00 0.00 H new ATOM 0 HA ASP A 105 -7.156 -13.361 -2.365 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.013 -11.606 -4.733 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -6.531 -13.256 -5.074 1.00 0.00 H new ATOM 1653 N ASN A 106 -4.134 -12.515 -3.347 1.00 0.00 N ATOM 1654 CA ASN A 106 -2.762 -12.970 -3.495 1.00 0.00 C ATOM 1655 C ASN A 106 -2.647 -13.825 -4.759 1.00 0.00 C ATOM 1656 O ASN A 106 -1.948 -14.837 -4.766 1.00 0.00 O ATOM 1657 CB ASN A 106 -2.334 -13.828 -2.303 1.00 0.00 C ATOM 1658 CG ASN A 106 -2.912 -13.279 -0.997 1.00 0.00 C ATOM 1659 OD1 ASN A 106 -2.348 -12.407 -0.357 1.00 0.00 O ATOM 1660 ND2 ASN A 106 -4.065 -13.837 -0.639 1.00 0.00 N ATOM 0 H ASN A 106 -4.260 -11.506 -3.427 1.00 0.00 H new ATOM 0 HA ASN A 106 -2.120 -12.091 -3.555 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -2.669 -14.855 -2.450 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -1.246 -13.854 -2.241 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -4.531 -13.539 0.218 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -4.483 -14.563 -1.221 1.00 0.00 H new ATOM 1667 N LYS A 107 -3.343 -13.387 -5.797 1.00 0.00 N ATOM 1668 CA LYS A 107 -3.328 -14.099 -7.063 1.00 0.00 C ATOM 1669 C LYS A 107 -2.889 -13.145 -8.175 1.00 0.00 C ATOM 1670 O LYS A 107 -1.929 -13.422 -8.893 1.00 0.00 O ATOM 1671 CB LYS A 107 -4.682 -14.763 -7.321 1.00 0.00 C ATOM 1672 CG LYS A 107 -4.505 -16.207 -7.794 1.00 0.00 C ATOM 1673 CD LYS A 107 -5.097 -17.191 -6.783 1.00 0.00 C ATOM 1674 CE LYS A 107 -6.517 -17.598 -7.182 1.00 0.00 C ATOM 1675 NZ LYS A 107 -7.081 -18.546 -6.195 1.00 0.00 N ATOM 0 H LYS A 107 -3.922 -12.547 -5.787 1.00 0.00 H new ATOM 0 HA LYS A 107 -2.601 -14.911 -7.034 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -5.279 -14.746 -6.409 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -5.232 -14.196 -8.072 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -4.989 -16.339 -8.762 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -3.445 -16.420 -7.936 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -4.465 -18.077 -6.719 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -5.110 -16.737 -5.792 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -7.150 -16.713 -7.248 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -6.506 -18.057 -8.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -8.045 -18.812 -6.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -6.485 -19.397 -6.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -7.110 -18.096 -5.258 1.00 0.00 H new ATOM 1689 N ASN A 108 -3.612 -12.040 -8.283 1.00 0.00 N ATOM 1690 CA ASN A 108 -3.309 -11.043 -9.296 1.00 0.00 C ATOM 1691 C ASN A 108 -3.493 -9.646 -8.701 1.00 0.00 C ATOM 1692 O ASN A 108 -2.624 -8.787 -8.842 1.00 0.00 O ATOM 1693 CB ASN A 108 -4.249 -11.173 -10.496 1.00 0.00 C ATOM 1694 CG ASN A 108 -5.116 -12.429 -10.380 1.00 0.00 C ATOM 1695 OD1 ASN A 108 -6.129 -12.310 -9.527 1.00 0.00 O flip ATOM 1696 ND2 ASN A 108 -4.880 -13.439 -11.022 1.00 0.00 N flip ATOM 0 H ASN A 108 -4.407 -11.813 -7.686 1.00 0.00 H new ATOM 0 HA ASN A 108 -2.281 -11.198 -9.625 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -4.887 -10.291 -10.560 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -3.666 -11.213 -11.416 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -4.085 -13.463 -11.660 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -5.478 -14.259 -10.920 1.00 0.00 H new ATOM 1703 N TYR A 109 -4.631 -9.461 -8.047 1.00 0.00 N ATOM 1704 CA TYR A 109 -4.940 -8.182 -7.430 1.00 0.00 C ATOM 1705 C TYR A 109 -4.763 -8.249 -5.912 1.00 0.00 C ATOM 1706 O TYR A 109 -4.807 -9.329 -5.325 1.00 0.00 O ATOM 1707 CB TYR A 109 -6.411 -7.905 -7.748 1.00 0.00 C ATOM 1708 CG TYR A 109 -7.358 -8.143 -6.570 1.00 0.00 C ATOM 1709 CD1 TYR A 109 -7.631 -9.429 -6.153 1.00 0.00 C ATOM 1710 CD2 TYR A 109 -7.938 -7.070 -5.924 1.00 0.00 C ATOM 1711 CE1 TYR A 109 -8.522 -9.653 -5.044 1.00 0.00 C ATOM 1712 CE2 TYR A 109 -8.829 -7.293 -4.815 1.00 0.00 C ATOM 1713 CZ TYR A 109 -9.077 -8.574 -4.430 1.00 0.00 C ATOM 1714 OH TYR A 109 -9.919 -8.785 -3.382 1.00 0.00 O ATOM 0 H TYR A 109 -5.350 -10.175 -7.931 1.00 0.00 H new ATOM 0 HA TYR A 109 -4.277 -7.404 -7.807 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -6.512 -6.871 -8.079 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -6.717 -8.538 -8.581 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -7.176 -10.268 -6.658 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -7.724 -6.063 -6.250 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -8.744 -10.655 -4.708 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -9.290 -6.463 -4.301 1.00 0.00 H new ATOM 0 HH TYR A 109 -10.239 -7.924 -3.041 1.00 0.00 H new ATOM 1724 N ILE A 110 -4.565 -7.081 -5.319 1.00 0.00 N ATOM 1725 CA ILE A 110 -4.381 -6.993 -3.881 1.00 0.00 C ATOM 1726 C ILE A 110 -5.252 -5.863 -3.327 1.00 0.00 C ATOM 1727 O ILE A 110 -5.174 -4.728 -3.795 1.00 0.00 O ATOM 1728 CB ILE A 110 -2.897 -6.849 -3.538 1.00 0.00 C ATOM 1729 CG1 ILE A 110 -2.349 -8.138 -2.922 1.00 0.00 C ATOM 1730 CG2 ILE A 110 -2.657 -5.635 -2.638 1.00 0.00 C ATOM 1731 CD1 ILE A 110 -0.880 -8.343 -3.296 1.00 0.00 C ATOM 0 H ILE A 110 -4.528 -6.187 -5.809 1.00 0.00 H new ATOM 0 HA ILE A 110 -4.708 -7.914 -3.399 1.00 0.00 H new ATOM 0 HB ILE A 110 -2.348 -6.676 -4.463 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -2.450 -8.098 -1.837 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -2.938 -8.989 -3.266 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -1.594 -5.556 -2.409 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -2.986 -4.731 -3.151 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -3.220 -5.752 -1.712 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -0.515 -9.266 -2.845 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -0.786 -8.407 -4.380 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -0.291 -7.503 -2.929 1.00 0.00 H new ATOM 1743 N ILE A 111 -6.062 -6.214 -2.339 1.00 0.00 N ATOM 1744 CA ILE A 111 -6.947 -5.244 -1.717 1.00 0.00 C ATOM 1745 C ILE A 111 -6.370 -4.829 -0.362 1.00 0.00 C ATOM 1746 O ILE A 111 -5.450 -5.467 0.147 1.00 0.00 O ATOM 1747 CB ILE A 111 -8.372 -5.793 -1.636 1.00 0.00 C ATOM 1748 CG1 ILE A 111 -9.398 -4.709 -1.974 1.00 0.00 C ATOM 1749 CG2 ILE A 111 -8.639 -6.428 -0.269 1.00 0.00 C ATOM 1750 CD1 ILE A 111 -9.219 -4.215 -3.411 1.00 0.00 C ATOM 0 H ILE A 111 -6.124 -7.157 -1.954 1.00 0.00 H new ATOM 0 HA ILE A 111 -7.012 -4.342 -2.326 1.00 0.00 H new ATOM 0 HB ILE A 111 -8.477 -6.580 -2.383 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -10.406 -5.104 -1.844 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -9.291 -3.873 -1.282 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -9.659 -6.810 -0.238 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -7.939 -7.248 -0.106 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -8.509 -5.679 0.512 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -9.960 -3.445 -3.626 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -8.219 -3.799 -3.531 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -9.351 -5.048 -4.101 1.00 0.00 H new ATOM 1762 N GLY A 112 -6.934 -3.762 0.184 1.00 0.00 N ATOM 1763 CA GLY A 112 -6.487 -3.254 1.470 1.00 0.00 C ATOM 1764 C GLY A 112 -7.208 -1.952 1.826 1.00 0.00 C ATOM 1765 O GLY A 112 -7.932 -1.394 1.003 1.00 0.00 O ATOM 0 H GLY A 112 -7.697 -3.235 -0.241 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -6.672 -3.999 2.244 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -5.411 -3.082 1.443 1.00 0.00 H new ATOM 1769 N TYR A 113 -6.983 -1.505 3.053 1.00 0.00 N ATOM 1770 CA TYR A 113 -7.601 -0.279 3.528 1.00 0.00 C ATOM 1771 C TYR A 113 -6.952 0.194 4.830 1.00 0.00 C ATOM 1772 O TYR A 113 -7.057 -0.473 5.858 1.00 0.00 O ATOM 1773 CB TYR A 113 -9.067 -0.623 3.798 1.00 0.00 C ATOM 1774 CG TYR A 113 -9.994 0.593 3.841 1.00 0.00 C ATOM 1775 CD1 TYR A 113 -10.209 1.255 5.033 1.00 0.00 C ATOM 1776 CD2 TYR A 113 -10.617 1.027 2.689 1.00 0.00 C ATOM 1777 CE1 TYR A 113 -11.082 2.400 5.073 1.00 0.00 C ATOM 1778 CE2 TYR A 113 -11.489 2.172 2.729 1.00 0.00 C ATOM 1779 CZ TYR A 113 -11.679 2.802 3.919 1.00 0.00 C ATOM 1780 OH TYR A 113 -12.503 3.883 3.958 1.00 0.00 O ATOM 0 H TYR A 113 -6.381 -1.970 3.733 1.00 0.00 H new ATOM 0 HA TYR A 113 -7.487 0.518 2.793 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -9.417 -1.307 3.025 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -9.136 -1.153 4.748 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -9.723 0.915 5.935 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -10.451 0.508 1.757 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -11.259 2.928 5.999 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -11.981 2.523 1.834 1.00 0.00 H new ATOM 0 HH TYR A 113 -12.858 4.056 3.061 1.00 0.00 H new ATOM 1790 N SER A 114 -6.295 1.341 4.744 1.00 0.00 N ATOM 1791 CA SER A 114 -5.629 1.911 5.903 1.00 0.00 C ATOM 1792 C SER A 114 -6.100 3.350 6.122 1.00 0.00 C ATOM 1793 O SER A 114 -6.777 3.922 5.269 1.00 0.00 O ATOM 1794 CB SER A 114 -4.108 1.869 5.740 1.00 0.00 C ATOM 1795 OG SER A 114 -3.436 2.456 6.851 1.00 0.00 O ATOM 0 H SER A 114 -6.209 1.891 3.889 1.00 0.00 H new ATOM 0 HA SER A 114 -5.890 1.313 6.776 1.00 0.00 H new ATOM 0 HB2 SER A 114 -3.784 0.835 5.626 1.00 0.00 H new ATOM 0 HB3 SER A 114 -3.826 2.394 4.827 1.00 0.00 H new ATOM 0 HG SER A 114 -3.197 1.757 7.495 1.00 0.00 H new ATOM 1801 N CYS A 115 -5.724 3.894 7.270 1.00 0.00 N ATOM 1802 CA CYS A 115 -6.099 5.255 7.612 1.00 0.00 C ATOM 1803 C CYS A 115 -5.098 5.786 8.640 1.00 0.00 C ATOM 1804 O CYS A 115 -4.809 5.118 9.632 1.00 0.00 O ATOM 1805 CB CYS A 115 -7.539 5.333 8.125 1.00 0.00 C ATOM 1806 SG CYS A 115 -7.713 5.224 9.943 1.00 0.00 S ATOM 0 H CYS A 115 -5.163 3.416 7.975 1.00 0.00 H new ATOM 0 HA CYS A 115 -6.066 5.879 6.719 1.00 0.00 H new ATOM 0 HB2 CYS A 115 -7.980 6.271 7.788 1.00 0.00 H new ATOM 0 HB3 CYS A 115 -8.116 4.528 7.670 1.00 0.00 H new ATOM 1812 N ARG A 116 -4.596 6.981 8.367 1.00 0.00 N ATOM 1813 CA ARG A 116 -3.633 7.609 9.256 1.00 0.00 C ATOM 1814 C ARG A 116 -4.331 8.624 10.163 1.00 0.00 C ATOM 1815 O ARG A 116 -5.176 9.392 9.706 1.00 0.00 O ATOM 1816 CB ARG A 116 -2.531 8.316 8.464 1.00 0.00 C ATOM 1817 CG ARG A 116 -1.793 9.332 9.338 1.00 0.00 C ATOM 1818 CD ARG A 116 -2.227 10.761 9.004 1.00 0.00 C ATOM 1819 NE ARG A 116 -1.180 11.719 9.425 1.00 0.00 N ATOM 1820 CZ ARG A 116 0.046 11.776 8.888 1.00 0.00 C ATOM 1821 NH1 ARG A 116 0.387 10.930 7.905 1.00 0.00 N ATOM 1822 NH2 ARG A 116 0.931 12.678 9.333 1.00 0.00 N ATOM 0 H ARG A 116 -4.838 7.531 7.543 1.00 0.00 H new ATOM 0 HA ARG A 116 -3.182 6.824 9.863 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -1.825 7.580 8.080 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -2.965 8.821 7.601 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -1.991 9.124 10.390 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -0.718 9.231 9.190 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -2.408 10.854 7.933 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -3.166 10.992 9.507 1.00 0.00 H new ATOM 0 HE ARG A 116 -1.406 12.377 10.171 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -0.287 10.243 7.566 1.00 0.00 H new ATOM 0 HH12 ARG A 116 1.320 10.973 7.496 1.00 0.00 H new ATOM 0 HH21 ARG A 116 0.671 13.321 10.081 1.00 0.00 H new ATOM 0 HH22 ARG A 116 1.864 12.721 8.924 1.00 0.00 H new ATOM 1836 N TYR A 117 -3.952 8.594 11.433 1.00 0.00 N ATOM 1837 CA TYR A 117 -4.531 9.502 12.408 1.00 0.00 C ATOM 1838 C TYR A 117 -4.002 10.924 12.215 1.00 0.00 C ATOM 1839 O TYR A 117 -2.827 11.117 11.908 1.00 0.00 O ATOM 1840 CB TYR A 117 -4.087 8.987 13.779 1.00 0.00 C ATOM 1841 CG TYR A 117 -5.065 9.308 14.911 1.00 0.00 C ATOM 1842 CD1 TYR A 117 -6.345 8.792 14.885 1.00 0.00 C ATOM 1843 CD2 TYR A 117 -4.667 10.114 15.958 1.00 0.00 C ATOM 1844 CE1 TYR A 117 -7.265 9.095 15.950 1.00 0.00 C ATOM 1845 CE2 TYR A 117 -5.588 10.417 17.024 1.00 0.00 C ATOM 1846 CZ TYR A 117 -6.841 9.892 16.967 1.00 0.00 C ATOM 1847 OH TYR A 117 -7.711 10.177 17.973 1.00 0.00 O ATOM 0 H TYR A 117 -3.251 7.955 11.809 1.00 0.00 H new ATOM 0 HA TYR A 117 -5.616 9.535 12.305 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -3.953 7.907 13.724 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -3.115 9.417 14.020 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -6.656 8.161 14.066 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -3.665 10.518 15.978 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -8.269 8.698 15.941 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -5.290 11.047 17.849 1.00 0.00 H new ATOM 0 HH TYR A 117 -7.272 10.756 18.631 1.00 0.00 H new ATOM 1857 N ASP A 118 -4.896 11.884 12.402 1.00 0.00 N ATOM 1858 CA ASP A 118 -4.534 13.283 12.253 1.00 0.00 C ATOM 1859 C ASP A 118 -4.856 14.030 13.549 1.00 0.00 C ATOM 1860 O ASP A 118 -6.015 14.113 13.950 1.00 0.00 O ATOM 1861 CB ASP A 118 -5.327 13.939 11.120 1.00 0.00 C ATOM 1862 CG ASP A 118 -4.532 14.196 9.839 1.00 0.00 C ATOM 1863 OD1 ASP A 118 -4.782 15.252 9.217 1.00 0.00 O ATOM 1864 OD2 ASP A 118 -3.691 13.332 9.509 1.00 0.00 O ATOM 0 H ASP A 118 -5.870 11.720 12.655 1.00 0.00 H new ATOM 0 HA ASP A 118 -3.469 13.333 12.025 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -6.180 13.305 10.879 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -5.726 14.888 11.478 1.00 0.00 H new ATOM 1870 N GLU A 119 -3.808 14.555 14.167 1.00 0.00 N ATOM 1871 CA GLU A 119 -3.964 15.292 15.409 1.00 0.00 C ATOM 1872 C GLU A 119 -4.584 16.664 15.138 1.00 0.00 C ATOM 1873 O GLU A 119 -5.656 16.978 15.653 1.00 0.00 O ATOM 1874 CB GLU A 119 -2.625 15.430 16.137 1.00 0.00 C ATOM 1875 CG GLU A 119 -2.798 15.238 17.645 1.00 0.00 C ATOM 1876 CD GLU A 119 -1.914 14.099 18.157 1.00 0.00 C ATOM 1877 OE1 GLU A 119 -0.910 14.418 18.829 1.00 0.00 O ATOM 1878 OE2 GLU A 119 -2.262 12.935 17.865 1.00 0.00 O ATOM 0 H GLU A 119 -2.848 14.484 13.831 1.00 0.00 H new ATOM 0 HA GLU A 119 -4.637 14.732 16.058 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -1.920 14.693 15.752 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -2.199 16.413 15.939 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -2.544 16.162 18.164 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -3.842 15.022 17.870 1.00 0.00 H new ATOM 1886 N ASP A 120 -3.884 17.446 14.329 1.00 0.00 N ATOM 1887 CA ASP A 120 -4.353 18.777 13.983 1.00 0.00 C ATOM 1888 C ASP A 120 -5.820 18.701 13.557 1.00 0.00 C ATOM 1889 O ASP A 120 -6.684 19.312 14.183 1.00 0.00 O ATOM 1890 CB ASP A 120 -3.551 19.357 12.816 1.00 0.00 C ATOM 1891 CG ASP A 120 -3.345 20.872 12.863 1.00 0.00 C ATOM 1892 OD1 ASP A 120 -4.276 21.557 13.341 1.00 0.00 O ATOM 1893 OD2 ASP A 120 -2.263 21.313 12.420 1.00 0.00 O ATOM 0 H ASP A 120 -2.995 17.183 13.903 1.00 0.00 H new ATOM 0 HA ASP A 120 -4.231 19.416 14.858 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -2.575 18.873 12.790 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -4.058 19.103 11.885 1.00 0.00 H new ATOM 1899 N LYS A 121 -6.056 17.946 12.494 1.00 0.00 N ATOM 1900 CA LYS A 121 -7.404 17.782 11.976 1.00 0.00 C ATOM 1901 C LYS A 121 -8.241 16.993 12.985 1.00 0.00 C ATOM 1902 O LYS A 121 -9.469 17.031 12.943 1.00 0.00 O ATOM 1903 CB LYS A 121 -7.370 17.156 10.581 1.00 0.00 C ATOM 1904 CG LYS A 121 -7.351 18.234 9.496 1.00 0.00 C ATOM 1905 CD LYS A 121 -8.730 18.877 9.337 1.00 0.00 C ATOM 1906 CE LYS A 121 -8.641 20.400 9.458 1.00 0.00 C ATOM 1907 NZ LYS A 121 -9.988 21.007 9.362 1.00 0.00 N ATOM 0 H LYS A 121 -5.336 17.441 11.977 1.00 0.00 H new ATOM 0 HA LYS A 121 -7.885 18.752 11.852 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -6.488 16.522 10.484 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -8.240 16.514 10.445 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -6.617 18.998 9.751 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -7.039 17.795 8.548 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -9.151 18.609 8.368 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -9.407 18.487 10.097 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -8.181 20.669 10.409 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -8.000 20.797 8.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -9.910 22.041 9.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -10.413 20.765 8.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -10.589 20.642 10.128 1.00 0.00 H new ATOM 1921 N LYS A 122 -7.541 16.296 13.869 1.00 0.00 N ATOM 1922 CA LYS A 122 -8.204 15.498 14.886 1.00 0.00 C ATOM 1923 C LYS A 122 -8.700 14.192 14.262 1.00 0.00 C ATOM 1924 O LYS A 122 -8.340 13.107 14.717 1.00 0.00 O ATOM 1925 CB LYS A 122 -9.306 16.311 15.570 1.00 0.00 C ATOM 1926 CG LYS A 122 -9.172 16.244 17.093 1.00 0.00 C ATOM 1927 CD LYS A 122 -9.619 17.557 17.740 1.00 0.00 C ATOM 1928 CE LYS A 122 -9.334 17.551 19.243 1.00 0.00 C ATOM 1929 NZ LYS A 122 -10.548 17.169 19.999 1.00 0.00 N ATOM 0 H LYS A 122 -6.522 16.268 13.902 1.00 0.00 H new ATOM 0 HA LYS A 122 -7.502 15.227 15.675 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.254 17.349 15.242 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -10.283 15.931 15.270 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -9.773 15.421 17.479 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -8.136 16.036 17.362 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -9.100 18.393 17.271 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.685 17.707 17.569 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -8.526 16.853 19.463 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -8.997 18.538 19.559 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -10.337 17.170 21.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -11.308 17.851 19.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -10.852 16.218 19.709 1.00 0.00 H new ATOM 1943 N GLY A 123 -9.519 14.340 13.231 1.00 0.00 N ATOM 1944 CA GLY A 123 -10.067 13.186 12.540 1.00 0.00 C ATOM 1945 C GLY A 123 -8.953 12.316 11.955 1.00 0.00 C ATOM 1946 O GLY A 123 -7.830 12.319 12.457 1.00 0.00 O ATOM 0 H GLY A 123 -9.816 15.242 12.858 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -10.669 12.596 13.231 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -10.731 13.517 11.742 1.00 0.00 H new ATOM 1950 N HIS A 124 -9.302 11.592 10.902 1.00 0.00 N ATOM 1951 CA HIS A 124 -8.345 10.719 10.243 1.00 0.00 C ATOM 1952 C HIS A 124 -8.546 10.787 8.728 1.00 0.00 C ATOM 1953 O HIS A 124 -9.453 11.466 8.249 1.00 0.00 O ATOM 1954 CB HIS A 124 -8.444 9.293 10.791 1.00 0.00 C ATOM 1955 CG HIS A 124 -9.803 8.660 10.614 1.00 0.00 C ATOM 1956 ND1 HIS A 124 -11.007 8.959 11.182 1.00 0.00 N flip ATOM 1957 CD2 HIS A 124 -10.026 7.587 9.769 1.00 0.00 C flip ATOM 1958 CE1 HIS A 124 -11.915 8.116 10.709 1.00 0.00 C flip ATOM 1959 NE2 HIS A 124 -11.309 7.264 9.833 1.00 0.00 N flip ATOM 0 H HIS A 124 -10.234 11.592 10.489 1.00 0.00 H new ATOM 0 HA HIS A 124 -7.331 11.059 10.455 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -7.698 8.672 10.296 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -8.195 9.304 11.852 1.00 0.00 H new ATOM 0 HD1 HIS A 124 -11.180 9.705 11.856 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -9.281 7.096 9.161 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -12.962 8.106 10.974 1.00 0.00 H new ATOM 1967 N TRP A 125 -7.685 10.075 8.016 1.00 0.00 N ATOM 1968 CA TRP A 125 -7.757 10.046 6.565 1.00 0.00 C ATOM 1969 C TRP A 125 -7.469 8.616 6.106 1.00 0.00 C ATOM 1970 O TRP A 125 -6.561 7.966 6.621 1.00 0.00 O ATOM 1971 CB TRP A 125 -6.807 11.075 5.949 1.00 0.00 C ATOM 1972 CG TRP A 125 -7.019 12.502 6.459 1.00 0.00 C ATOM 1973 CD1 TRP A 125 -6.692 13.008 7.656 1.00 0.00 C ATOM 1974 CD2 TRP A 125 -7.622 13.593 5.733 1.00 0.00 C ATOM 1975 NE1 TRP A 125 -7.039 14.340 7.754 1.00 0.00 N ATOM 1976 CE2 TRP A 125 -7.623 14.707 6.548 1.00 0.00 C ATOM 1977 CE3 TRP A 125 -8.151 13.638 4.431 1.00 0.00 C ATOM 1978 CZ2 TRP A 125 -8.139 15.947 6.151 1.00 0.00 C ATOM 1979 CZ3 TRP A 125 -8.663 14.884 4.050 1.00 0.00 C ATOM 1980 CH2 TRP A 125 -8.671 16.015 4.858 1.00 0.00 C ATOM 0 H TRP A 125 -6.934 9.514 8.417 1.00 0.00 H new ATOM 0 HA TRP A 125 -8.753 10.327 6.222 1.00 0.00 H new ATOM 0 HB2 TRP A 125 -5.780 10.775 6.156 1.00 0.00 H new ATOM 0 HB3 TRP A 125 -6.930 11.065 4.866 1.00 0.00 H new ATOM 0 HD1 TRP A 125 -6.217 12.444 8.445 1.00 0.00 H new ATOM 0 HE1 TRP A 125 -6.894 14.944 8.563 1.00 0.00 H new ATOM 0 HE3 TRP A 125 -8.162 12.779 3.776 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 -8.127 16.805 6.807 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 -9.081 14.973 3.058 1.00 0.00 H new ATOM 0 HH2 TRP A 125 -9.086 16.942 4.490 1.00 0.00 H new ATOM 1991 N ASP A 126 -8.259 8.168 5.141 1.00 0.00 N ATOM 1992 CA ASP A 126 -8.100 6.826 4.607 1.00 0.00 C ATOM 1993 C ASP A 126 -7.313 6.894 3.296 1.00 0.00 C ATOM 1994 O ASP A 126 -7.867 7.236 2.253 1.00 0.00 O ATOM 1995 CB ASP A 126 -9.459 6.187 4.310 1.00 0.00 C ATOM 1996 CG ASP A 126 -9.446 5.122 3.211 1.00 0.00 C ATOM 1997 OD1 ASP A 126 -8.721 4.122 3.399 1.00 0.00 O ATOM 1998 OD2 ASP A 126 -10.162 5.333 2.209 1.00 0.00 O ATOM 0 H ASP A 126 -9.011 8.710 4.715 1.00 0.00 H new ATOM 0 HA ASP A 126 -7.574 6.227 5.350 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -9.840 5.737 5.227 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -10.159 6.973 4.026 1.00 0.00 H new ATOM 2004 N HIS A 127 -6.034 6.561 3.394 1.00 0.00 N ATOM 2005 CA HIS A 127 -5.166 6.580 2.229 1.00 0.00 C ATOM 2006 C HIS A 127 -4.657 5.166 1.946 1.00 0.00 C ATOM 2007 O HIS A 127 -3.734 4.690 2.606 1.00 0.00 O ATOM 2008 CB HIS A 127 -4.033 7.592 2.412 1.00 0.00 C ATOM 2009 CG HIS A 127 -3.060 7.640 1.259 1.00 0.00 C ATOM 2010 ND1 HIS A 127 -2.949 8.733 0.416 1.00 0.00 N ATOM 2011 CD2 HIS A 127 -2.154 6.721 0.818 1.00 0.00 C ATOM 2012 CE1 HIS A 127 -2.017 8.471 -0.488 1.00 0.00 C ATOM 2013 NE2 HIS A 127 -1.525 7.223 -0.237 1.00 0.00 N ATOM 0 H HIS A 127 -5.579 6.277 4.261 1.00 0.00 H new ATOM 0 HA HIS A 127 -5.730 6.908 1.356 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -4.464 8.583 2.552 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -3.488 7.350 3.324 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -1.978 5.749 1.254 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -1.702 9.129 -1.284 1.00 0.00 H new ATOM 0 HE2 HIS A 127 -0.794 6.754 -0.772 1.00 0.00 H new ATOM 2021 N VAL A 128 -5.280 4.532 0.963 1.00 0.00 N ATOM 2022 CA VAL A 128 -4.902 3.181 0.585 1.00 0.00 C ATOM 2023 C VAL A 128 -4.379 3.187 -0.853 1.00 0.00 C ATOM 2024 O VAL A 128 -4.488 4.193 -1.553 1.00 0.00 O ATOM 2025 CB VAL A 128 -6.083 2.230 0.788 1.00 0.00 C ATOM 2026 CG1 VAL A 128 -7.245 2.595 -0.138 1.00 0.00 C ATOM 2027 CG2 VAL A 128 -5.656 0.775 0.586 1.00 0.00 C ATOM 0 H VAL A 128 -6.044 4.929 0.417 1.00 0.00 H new ATOM 0 HA VAL A 128 -4.097 2.817 1.223 1.00 0.00 H new ATOM 0 HB VAL A 128 -6.428 2.337 1.816 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -8.072 1.904 0.026 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -7.574 3.612 0.075 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -6.918 2.529 -1.176 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -6.514 0.120 0.736 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -5.273 0.645 -0.426 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -4.876 0.522 1.304 1.00 0.00 H new ATOM 2037 N TRP A 129 -3.824 2.052 -1.252 1.00 0.00 N ATOM 2038 CA TRP A 129 -3.284 1.914 -2.594 1.00 0.00 C ATOM 2039 C TRP A 129 -3.678 0.533 -3.122 1.00 0.00 C ATOM 2040 O TRP A 129 -3.497 -0.473 -2.437 1.00 0.00 O ATOM 2041 CB TRP A 129 -1.772 2.148 -2.604 1.00 0.00 C ATOM 2042 CG TRP A 129 -1.022 1.423 -1.484 1.00 0.00 C ATOM 2043 CD1 TRP A 129 -0.761 0.113 -1.380 1.00 0.00 C ATOM 2044 CD2 TRP A 129 -0.444 2.025 -0.307 1.00 0.00 C ATOM 2045 NE1 TRP A 129 -0.060 -0.173 -0.227 1.00 0.00 N ATOM 2046 CE2 TRP A 129 0.139 1.027 0.447 1.00 0.00 C ATOM 2047 CE3 TRP A 129 -0.415 3.368 0.108 1.00 0.00 C ATOM 2048 CZ2 TRP A 129 0.794 1.266 1.661 1.00 0.00 C ATOM 2049 CZ3 TRP A 129 0.243 3.591 1.323 1.00 0.00 C ATOM 2050 CH2 TRP A 129 0.835 2.597 2.094 1.00 0.00 C ATOM 0 H TRP A 129 -3.737 1.219 -0.669 1.00 0.00 H new ATOM 0 HA TRP A 129 -3.700 2.673 -3.257 1.00 0.00 H new ATOM 0 HB2 TRP A 129 -1.371 1.824 -3.564 1.00 0.00 H new ATOM 0 HB3 TRP A 129 -1.580 3.218 -2.523 1.00 0.00 H new ATOM 0 HD1 TRP A 129 -1.062 -0.626 -2.108 1.00 0.00 H new ATOM 0 HE1 TRP A 129 0.255 -1.095 0.076 1.00 0.00 H new ATOM 0 HE3 TRP A 129 -0.865 4.165 -0.466 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 1.243 0.467 2.232 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 0.294 4.606 1.687 1.00 0.00 H new ATOM 0 HH2 TRP A 129 1.324 2.850 3.023 1.00 0.00 H new ATOM 2061 N VAL A 130 -4.211 0.528 -4.335 1.00 0.00 N ATOM 2062 CA VAL A 130 -4.632 -0.713 -4.962 1.00 0.00 C ATOM 2063 C VAL A 130 -3.502 -1.240 -5.849 1.00 0.00 C ATOM 2064 O VAL A 130 -2.883 -0.479 -6.590 1.00 0.00 O ATOM 2065 CB VAL A 130 -5.939 -0.495 -5.727 1.00 0.00 C ATOM 2066 CG1 VAL A 130 -6.356 -1.764 -6.473 1.00 0.00 C ATOM 2067 CG2 VAL A 130 -7.051 -0.020 -4.789 1.00 0.00 C ATOM 0 H VAL A 130 -4.361 1.364 -4.900 1.00 0.00 H new ATOM 0 HA VAL A 130 -4.835 -1.473 -4.207 1.00 0.00 H new ATOM 0 HB VAL A 130 -5.768 0.287 -6.466 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -7.288 -1.582 -7.008 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -5.577 -2.041 -7.184 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -6.500 -2.575 -5.759 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -7.969 0.127 -5.358 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -7.220 -0.770 -4.016 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -6.757 0.921 -4.324 1.00 0.00 H new ATOM 2077 N LEU A 131 -3.268 -2.540 -5.742 1.00 0.00 N ATOM 2078 CA LEU A 131 -2.223 -3.179 -6.525 1.00 0.00 C ATOM 2079 C LEU A 131 -2.861 -4.118 -7.549 1.00 0.00 C ATOM 2080 O LEU A 131 -4.010 -4.529 -7.390 1.00 0.00 O ATOM 2081 CB LEU A 131 -1.211 -3.866 -5.607 1.00 0.00 C ATOM 2082 CG LEU A 131 -0.917 -3.159 -4.282 1.00 0.00 C ATOM 2083 CD1 LEU A 131 0.486 -3.500 -3.777 1.00 0.00 C ATOM 2084 CD2 LEU A 131 -1.130 -1.649 -4.408 1.00 0.00 C ATOM 0 H LEU A 131 -3.784 -3.168 -5.125 1.00 0.00 H new ATOM 0 HA LEU A 131 -1.657 -2.435 -7.085 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -1.573 -4.870 -5.387 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -0.274 -3.978 -6.152 1.00 0.00 H new ATOM 0 HG LEU A 131 -1.624 -3.523 -3.536 1.00 0.00 H new ATOM 0 HD11 LEU A 131 0.669 -2.984 -2.834 1.00 0.00 H new ATOM 0 HD12 LEU A 131 0.566 -4.576 -3.623 1.00 0.00 H new ATOM 0 HD13 LEU A 131 1.225 -3.183 -4.513 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -0.914 -1.170 -3.453 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -0.463 -1.250 -5.173 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -2.164 -1.450 -4.689 1.00 0.00 H new ATOM 2096 N SER A 132 -2.089 -4.432 -8.579 1.00 0.00 N ATOM 2097 CA SER A 132 -2.565 -5.316 -9.630 1.00 0.00 C ATOM 2098 C SER A 132 -1.391 -6.088 -10.235 1.00 0.00 C ATOM 2099 O SER A 132 -0.301 -5.541 -10.397 1.00 0.00 O ATOM 2100 CB SER A 132 -3.302 -4.532 -10.717 1.00 0.00 C ATOM 2101 OG SER A 132 -3.320 -5.230 -11.959 1.00 0.00 O ATOM 0 H SER A 132 -1.137 -4.090 -8.708 1.00 0.00 H new ATOM 0 HA SER A 132 -3.269 -6.023 -9.190 1.00 0.00 H new ATOM 0 HB2 SER A 132 -4.325 -4.339 -10.394 1.00 0.00 H new ATOM 0 HB3 SER A 132 -2.823 -3.562 -10.853 1.00 0.00 H new ATOM 0 HG SER A 132 -2.806 -4.727 -12.624 1.00 0.00 H new ATOM 2107 N ARG A 133 -1.654 -7.347 -10.554 1.00 0.00 N ATOM 2108 CA ARG A 133 -0.633 -8.200 -11.139 1.00 0.00 C ATOM 2109 C ARG A 133 0.063 -7.479 -12.295 1.00 0.00 C ATOM 2110 O ARG A 133 1.220 -7.761 -12.601 1.00 0.00 O ATOM 2111 CB ARG A 133 -1.236 -9.509 -11.651 1.00 0.00 C ATOM 2112 CG ARG A 133 -0.215 -10.646 -11.584 1.00 0.00 C ATOM 2113 CD ARG A 133 -0.747 -11.902 -12.277 1.00 0.00 C ATOM 2114 NE ARG A 133 -0.636 -11.756 -13.746 1.00 0.00 N ATOM 2115 CZ ARG A 133 -1.308 -12.507 -14.628 1.00 0.00 C ATOM 2116 NH1 ARG A 133 -2.142 -13.463 -14.197 1.00 0.00 N ATOM 2117 NH2 ARG A 133 -1.145 -12.304 -15.943 1.00 0.00 N ATOM 0 H ARG A 133 -2.559 -7.797 -10.418 1.00 0.00 H new ATOM 0 HA ARG A 133 0.094 -8.429 -10.360 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -2.112 -9.767 -11.056 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -1.575 -9.380 -12.679 1.00 0.00 H new ATOM 0 HG2 ARG A 133 0.716 -10.332 -12.057 1.00 0.00 H new ATOM 0 HG3 ARG A 133 0.016 -10.871 -10.543 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -0.185 -12.775 -11.947 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -1.787 -12.068 -11.998 1.00 0.00 H new ATOM 0 HE ARG A 133 -0.008 -11.039 -14.109 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -2.265 -13.619 -13.197 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -2.654 -14.035 -14.869 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -0.509 -11.577 -16.272 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -1.657 -12.876 -16.615 1.00 0.00 H new ATOM 2131 N SER A 134 -0.673 -6.562 -12.907 1.00 0.00 N ATOM 2132 CA SER A 134 -0.141 -5.799 -14.023 1.00 0.00 C ATOM 2133 C SER A 134 -0.576 -4.336 -13.911 1.00 0.00 C ATOM 2134 O SER A 134 -1.260 -3.959 -12.961 1.00 0.00 O ATOM 2135 CB SER A 134 -0.598 -6.387 -15.360 1.00 0.00 C ATOM 2136 OG SER A 134 -0.845 -7.788 -15.270 1.00 0.00 O ATOM 0 H SER A 134 -1.633 -6.331 -12.651 1.00 0.00 H new ATOM 0 HA SER A 134 0.947 -5.852 -13.986 1.00 0.00 H new ATOM 0 HB2 SER A 134 -1.505 -5.879 -15.688 1.00 0.00 H new ATOM 0 HB3 SER A 134 0.164 -6.201 -16.117 1.00 0.00 H new ATOM 0 HG SER A 134 -1.136 -8.126 -16.143 1.00 0.00 H new ATOM 2142 N MET A 135 -0.162 -3.552 -14.896 1.00 0.00 N ATOM 2143 CA MET A 135 -0.500 -2.139 -14.920 1.00 0.00 C ATOM 2144 C MET A 135 -2.016 -1.937 -14.865 1.00 0.00 C ATOM 2145 O MET A 135 -2.493 -0.937 -14.331 1.00 0.00 O ATOM 2146 CB MET A 135 0.054 -1.503 -16.196 1.00 0.00 C ATOM 2147 CG MET A 135 -0.420 -2.262 -17.437 1.00 0.00 C ATOM 2148 SD MET A 135 0.895 -2.342 -18.642 1.00 0.00 S ATOM 2149 CE MET A 135 0.604 -3.971 -19.310 1.00 0.00 C ATOM 0 H MET A 135 0.404 -3.869 -15.683 1.00 0.00 H new ATOM 0 HA MET A 135 -0.057 -1.664 -14.045 1.00 0.00 H new ATOM 0 HB2 MET A 135 -0.266 -0.463 -16.257 1.00 0.00 H new ATOM 0 HB3 MET A 135 1.143 -1.499 -16.161 1.00 0.00 H new ATOM 0 HG2 MET A 135 -0.733 -3.269 -17.160 1.00 0.00 H new ATOM 0 HG3 MET A 135 -1.289 -1.765 -17.868 1.00 0.00 H new ATOM 0 HE1 MET A 135 1.343 -4.185 -20.083 1.00 0.00 H new ATOM 0 HE2 MET A 135 0.687 -4.711 -18.514 1.00 0.00 H new ATOM 0 HE3 MET A 135 -0.396 -4.014 -19.742 1.00 0.00 H new ATOM 2159 N VAL A 136 -2.730 -2.903 -15.424 1.00 0.00 N ATOM 2160 CA VAL A 136 -4.182 -2.844 -15.445 1.00 0.00 C ATOM 2161 C VAL A 136 -4.749 -4.180 -14.962 1.00 0.00 C ATOM 2162 O VAL A 136 -4.166 -5.233 -15.212 1.00 0.00 O ATOM 2163 CB VAL A 136 -4.669 -2.458 -16.843 1.00 0.00 C ATOM 2164 CG1 VAL A 136 -5.821 -3.360 -17.291 1.00 0.00 C ATOM 2165 CG2 VAL A 136 -5.075 -0.984 -16.895 1.00 0.00 C ATOM 0 H VAL A 136 -2.330 -3.731 -15.866 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.543 -2.073 -14.765 1.00 0.00 H new ATOM 0 HB VAL A 136 -3.841 -2.602 -17.537 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.148 -3.064 -18.288 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -5.484 -4.397 -17.312 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -6.652 -3.263 -16.593 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -5.417 -0.736 -17.900 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -5.880 -0.803 -16.183 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -4.218 -0.361 -16.640 1.00 0.00 H new ATOM 2175 N LEU A 137 -5.881 -4.093 -14.278 1.00 0.00 N ATOM 2176 CA LEU A 137 -6.534 -5.282 -13.757 1.00 0.00 C ATOM 2177 C LEU A 137 -7.214 -6.029 -14.906 1.00 0.00 C ATOM 2178 O LEU A 137 -7.741 -5.410 -15.829 1.00 0.00 O ATOM 2179 CB LEU A 137 -7.484 -4.915 -12.615 1.00 0.00 C ATOM 2180 CG LEU A 137 -7.560 -5.914 -11.459 1.00 0.00 C ATOM 2181 CD1 LEU A 137 -6.192 -6.092 -10.797 1.00 0.00 C ATOM 2182 CD2 LEU A 137 -8.636 -5.504 -10.451 1.00 0.00 C ATOM 0 H LEU A 137 -6.362 -3.217 -14.073 1.00 0.00 H new ATOM 0 HA LEU A 137 -5.800 -5.961 -13.324 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -7.182 -3.948 -12.214 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -8.485 -4.790 -13.028 1.00 0.00 H new ATOM 0 HG LEU A 137 -7.850 -6.884 -11.864 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -6.274 -6.807 -9.979 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -5.477 -6.462 -11.532 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -5.849 -5.133 -10.408 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -8.670 -6.231 -9.639 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -8.400 -4.519 -10.047 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -9.606 -5.470 -10.948 1.00 0.00 H new ATOM 2194 N THR A 138 -7.179 -7.350 -14.812 1.00 0.00 N ATOM 2195 CA THR A 138 -7.785 -8.189 -15.832 1.00 0.00 C ATOM 2196 C THR A 138 -8.216 -9.530 -15.234 1.00 0.00 C ATOM 2197 O THR A 138 -8.272 -9.680 -14.014 1.00 0.00 O ATOM 2198 CB THR A 138 -6.787 -8.330 -16.983 1.00 0.00 C ATOM 2199 OG1 THR A 138 -5.891 -9.347 -16.543 1.00 0.00 O ATOM 2200 CG2 THR A 138 -5.899 -7.094 -17.143 1.00 0.00 C ATOM 0 H THR A 138 -6.740 -7.860 -14.045 1.00 0.00 H new ATOM 0 HA THR A 138 -8.695 -7.737 -16.225 1.00 0.00 H new ATOM 0 HB THR A 138 -7.328 -8.511 -17.912 1.00 0.00 H new ATOM 0 HG1 THR A 138 -5.211 -9.504 -17.231 1.00 0.00 H new ATOM 0 HG21 THR A 138 -5.209 -7.246 -17.973 1.00 0.00 H new ATOM 0 HG22 THR A 138 -6.522 -6.222 -17.344 1.00 0.00 H new ATOM 0 HG23 THR A 138 -5.333 -6.932 -16.226 1.00 0.00 H new ATOM 2208 N GLY A 139 -8.508 -10.470 -16.120 1.00 0.00 N ATOM 2209 CA GLY A 139 -8.932 -11.794 -15.694 1.00 0.00 C ATOM 2210 C GLY A 139 -9.795 -11.714 -14.434 1.00 0.00 C ATOM 2211 O GLY A 139 -10.435 -10.695 -14.178 1.00 0.00 O ATOM 0 H GLY A 139 -8.460 -10.342 -17.131 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -9.494 -12.275 -16.494 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -8.057 -12.415 -15.501 1.00 0.00 H new ATOM 2215 N GLU A 140 -9.785 -12.803 -13.679 1.00 0.00 N ATOM 2216 CA GLU A 140 -10.559 -12.869 -12.451 1.00 0.00 C ATOM 2217 C GLU A 140 -10.169 -11.723 -11.515 1.00 0.00 C ATOM 2218 O GLU A 140 -10.932 -11.359 -10.622 1.00 0.00 O ATOM 2219 CB GLU A 140 -10.382 -14.224 -11.763 1.00 0.00 C ATOM 2220 CG GLU A 140 -11.721 -14.759 -11.251 1.00 0.00 C ATOM 2221 CD GLU A 140 -12.482 -15.485 -12.362 1.00 0.00 C ATOM 2222 OE1 GLU A 140 -12.564 -14.905 -13.466 1.00 0.00 O ATOM 2223 OE2 GLU A 140 -12.964 -16.603 -12.082 1.00 0.00 O ATOM 0 H GLU A 140 -9.253 -13.646 -13.894 1.00 0.00 H new ATOM 0 HA GLU A 140 -11.614 -12.762 -12.704 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -9.945 -14.937 -12.463 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -9.684 -14.125 -10.932 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -11.550 -15.440 -10.417 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -12.324 -13.935 -10.870 1.00 0.00 H new ATOM 2231 N ALA A 141 -8.980 -11.188 -11.751 1.00 0.00 N ATOM 2232 CA ALA A 141 -8.479 -10.091 -10.940 1.00 0.00 C ATOM 2233 C ALA A 141 -9.518 -8.968 -10.910 1.00 0.00 C ATOM 2234 O ALA A 141 -9.835 -8.439 -9.846 1.00 0.00 O ATOM 2235 CB ALA A 141 -7.130 -9.624 -11.490 1.00 0.00 C ATOM 0 H ALA A 141 -8.349 -11.494 -12.492 1.00 0.00 H new ATOM 0 HA ALA A 141 -8.317 -10.416 -9.912 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -6.754 -8.801 -10.882 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -6.420 -10.450 -11.461 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -7.254 -9.287 -12.519 1.00 0.00 H new ATOM 2241 N LYS A 142 -10.018 -8.637 -12.092 1.00 0.00 N ATOM 2242 CA LYS A 142 -11.014 -7.587 -12.215 1.00 0.00 C ATOM 2243 C LYS A 142 -12.237 -7.947 -11.368 1.00 0.00 C ATOM 2244 O LYS A 142 -12.829 -7.081 -10.727 1.00 0.00 O ATOM 2245 CB LYS A 142 -11.341 -7.328 -13.687 1.00 0.00 C ATOM 2246 CG LYS A 142 -10.533 -6.146 -14.228 1.00 0.00 C ATOM 2247 CD LYS A 142 -11.320 -5.389 -15.300 1.00 0.00 C ATOM 2248 CE LYS A 142 -10.957 -5.888 -16.700 1.00 0.00 C ATOM 2249 NZ LYS A 142 -11.113 -4.802 -17.694 1.00 0.00 N ATOM 0 H LYS A 142 -9.752 -9.078 -12.972 1.00 0.00 H new ATOM 0 HA LYS A 142 -10.624 -6.646 -11.828 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -11.124 -8.220 -14.274 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -12.406 -7.125 -13.796 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -10.280 -5.469 -13.412 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -9.593 -6.505 -14.647 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -12.389 -5.517 -15.130 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -11.111 -4.322 -15.225 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -9.929 -6.251 -16.708 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -11.595 -6.730 -16.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -10.863 -5.158 -18.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -12.100 -4.474 -17.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -10.486 -4.010 -17.445 1.00 0.00 H new ATOM 2263 N THR A 143 -12.577 -9.227 -11.393 1.00 0.00 N ATOM 2264 CA THR A 143 -13.718 -9.713 -10.636 1.00 0.00 C ATOM 2265 C THR A 143 -13.441 -9.619 -9.134 1.00 0.00 C ATOM 2266 O THR A 143 -14.288 -9.157 -8.371 1.00 0.00 O ATOM 2267 CB THR A 143 -14.029 -11.135 -11.108 1.00 0.00 C ATOM 2268 OG1 THR A 143 -14.323 -10.984 -12.495 1.00 0.00 O ATOM 2269 CG2 THR A 143 -15.327 -11.680 -10.510 1.00 0.00 C ATOM 0 H THR A 143 -12.082 -9.943 -11.926 1.00 0.00 H new ATOM 0 HA THR A 143 -14.600 -9.097 -10.812 1.00 0.00 H new ATOM 0 HB THR A 143 -13.202 -11.794 -10.843 1.00 0.00 H new ATOM 0 HG1 THR A 143 -14.535 -11.859 -12.882 1.00 0.00 H new ATOM 0 HG21 THR A 143 -15.500 -12.691 -10.877 1.00 0.00 H new ATOM 0 HG22 THR A 143 -15.248 -11.697 -9.423 1.00 0.00 H new ATOM 0 HG23 THR A 143 -16.159 -11.040 -10.803 1.00 0.00 H new ATOM 2277 N ALA A 144 -12.252 -10.064 -8.755 1.00 0.00 N ATOM 2278 CA ALA A 144 -11.853 -10.036 -7.359 1.00 0.00 C ATOM 2279 C ALA A 144 -12.011 -8.614 -6.816 1.00 0.00 C ATOM 2280 O ALA A 144 -12.510 -8.420 -5.709 1.00 0.00 O ATOM 2281 CB ALA A 144 -10.419 -10.554 -7.227 1.00 0.00 C ATOM 0 H ALA A 144 -11.552 -10.446 -9.391 1.00 0.00 H new ATOM 0 HA ALA A 144 -12.492 -10.689 -6.764 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -10.120 -10.533 -6.179 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -10.366 -11.577 -7.599 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -9.749 -9.921 -7.809 1.00 0.00 H new ATOM 2287 N VAL A 145 -11.576 -7.656 -7.622 1.00 0.00 N ATOM 2288 CA VAL A 145 -11.663 -6.257 -7.236 1.00 0.00 C ATOM 2289 C VAL A 145 -13.120 -5.798 -7.324 1.00 0.00 C ATOM 2290 O VAL A 145 -13.600 -5.075 -6.453 1.00 0.00 O ATOM 2291 CB VAL A 145 -10.719 -5.417 -8.098 1.00 0.00 C ATOM 2292 CG1 VAL A 145 -11.497 -4.616 -9.143 1.00 0.00 C ATOM 2293 CG2 VAL A 145 -9.858 -4.497 -7.231 1.00 0.00 C ATOM 0 H VAL A 145 -11.163 -7.821 -8.540 1.00 0.00 H new ATOM 0 HA VAL A 145 -11.342 -6.125 -6.203 1.00 0.00 H new ATOM 0 HB VAL A 145 -10.053 -6.099 -8.627 1.00 0.00 H new ATOM 0 HG11 VAL A 145 -10.802 -4.028 -9.742 1.00 0.00 H new ATOM 0 HG12 VAL A 145 -12.046 -5.300 -9.791 1.00 0.00 H new ATOM 0 HG13 VAL A 145 -12.199 -3.949 -8.642 1.00 0.00 H new ATOM 0 HG21 VAL A 145 -9.196 -3.911 -7.868 1.00 0.00 H new ATOM 0 HG22 VAL A 145 -10.502 -3.826 -6.662 1.00 0.00 H new ATOM 0 HG23 VAL A 145 -9.262 -5.098 -6.544 1.00 0.00 H new ATOM 2303 N GLU A 146 -13.783 -6.238 -8.384 1.00 0.00 N ATOM 2304 CA GLU A 146 -15.175 -5.882 -8.598 1.00 0.00 C ATOM 2305 C GLU A 146 -16.042 -6.425 -7.461 1.00 0.00 C ATOM 2306 O GLU A 146 -16.728 -5.665 -6.780 1.00 0.00 O ATOM 2307 CB GLU A 146 -15.669 -6.388 -9.954 1.00 0.00 C ATOM 2308 CG GLU A 146 -15.361 -5.377 -11.061 1.00 0.00 C ATOM 2309 CD GLU A 146 -16.453 -4.309 -11.148 1.00 0.00 C ATOM 2310 OE1 GLU A 146 -16.873 -3.837 -10.070 1.00 0.00 O ATOM 2311 OE2 GLU A 146 -16.844 -3.989 -12.292 1.00 0.00 O ATOM 0 H GLU A 146 -13.381 -6.838 -9.104 1.00 0.00 H new ATOM 0 HA GLU A 146 -15.255 -4.795 -8.603 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.195 -7.342 -10.185 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -16.743 -6.569 -9.910 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -14.399 -4.903 -10.868 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -15.276 -5.894 -12.017 1.00 0.00 H new ATOM 2319 N ASN A 147 -15.984 -7.738 -7.290 1.00 0.00 N ATOM 2320 CA ASN A 147 -16.755 -8.393 -6.248 1.00 0.00 C ATOM 2321 C ASN A 147 -16.495 -7.694 -4.912 1.00 0.00 C ATOM 2322 O ASN A 147 -17.433 -7.301 -4.219 1.00 0.00 O ATOM 2323 CB ASN A 147 -16.349 -9.860 -6.101 1.00 0.00 C ATOM 2324 CG ASN A 147 -17.516 -10.789 -6.443 1.00 0.00 C ATOM 2325 OD1 ASN A 147 -18.675 -10.480 -6.220 1.00 0.00 O ATOM 2326 ND2 ASN A 147 -17.146 -11.941 -6.994 1.00 0.00 N ATOM 0 H ASN A 147 -15.414 -8.366 -7.857 1.00 0.00 H new ATOM 0 HA ASN A 147 -17.808 -8.337 -6.523 1.00 0.00 H new ATOM 0 HB2 ASN A 147 -15.505 -10.075 -6.756 1.00 0.00 H new ATOM 0 HB3 ASN A 147 -16.017 -10.048 -5.080 1.00 0.00 H new ATOM 0 HD21 ASN A 147 -17.851 -12.630 -7.258 1.00 0.00 H new ATOM 0 HD22 ASN A 147 -16.158 -12.136 -7.153 1.00 0.00 H new ATOM 2333 N TYR A 148 -15.217 -7.560 -4.590 1.00 0.00 N ATOM 2334 CA TYR A 148 -14.821 -6.916 -3.349 1.00 0.00 C ATOM 2335 C TYR A 148 -15.472 -5.538 -3.215 1.00 0.00 C ATOM 2336 O TYR A 148 -16.122 -5.249 -2.212 1.00 0.00 O ATOM 2337 CB TYR A 148 -13.303 -6.744 -3.428 1.00 0.00 C ATOM 2338 CG TYR A 148 -12.777 -5.510 -2.692 1.00 0.00 C ATOM 2339 CD1 TYR A 148 -12.754 -5.487 -1.313 1.00 0.00 C ATOM 2340 CD2 TYR A 148 -12.325 -4.420 -3.408 1.00 0.00 C ATOM 2341 CE1 TYR A 148 -12.259 -4.326 -0.620 1.00 0.00 C ATOM 2342 CE2 TYR A 148 -11.830 -3.259 -2.715 1.00 0.00 C ATOM 2343 CZ TYR A 148 -11.821 -3.269 -1.355 1.00 0.00 C ATOM 2344 OH TYR A 148 -11.354 -2.172 -0.701 1.00 0.00 O ATOM 0 H TYR A 148 -14.442 -7.887 -5.167 1.00 0.00 H new ATOM 0 HA TYR A 148 -15.130 -7.514 -2.491 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -12.825 -7.632 -3.014 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -13.009 -6.682 -4.476 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -13.107 -6.340 -0.753 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -12.343 -4.438 -4.488 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -12.236 -4.295 0.459 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -11.474 -2.399 -3.263 1.00 0.00 H new ATOM 0 HH TYR A 148 -10.861 -1.603 -1.328 1.00 0.00 H new ATOM 2354 N LEU A 149 -15.274 -4.723 -4.241 1.00 0.00 N ATOM 2355 CA LEU A 149 -15.834 -3.382 -4.250 1.00 0.00 C ATOM 2356 C LEU A 149 -17.312 -3.449 -3.863 1.00 0.00 C ATOM 2357 O LEU A 149 -17.807 -2.587 -3.137 1.00 0.00 O ATOM 2358 CB LEU A 149 -15.581 -2.706 -5.599 1.00 0.00 C ATOM 2359 CG LEU A 149 -14.143 -2.256 -5.865 1.00 0.00 C ATOM 2360 CD1 LEU A 149 -13.911 -2.019 -7.359 1.00 0.00 C ATOM 2361 CD2 LEU A 149 -13.789 -1.026 -5.027 1.00 0.00 C ATOM 0 H LEU A 149 -14.734 -4.965 -5.072 1.00 0.00 H new ATOM 0 HA LEU A 149 -15.338 -2.756 -3.508 1.00 0.00 H new ATOM 0 HB2 LEU A 149 -15.877 -3.396 -6.390 1.00 0.00 H new ATOM 0 HB3 LEU A 149 -16.233 -1.836 -5.675 1.00 0.00 H new ATOM 0 HG LEU A 149 -13.471 -3.058 -5.558 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -12.881 -1.700 -7.521 1.00 0.00 H new ATOM 0 HD12 LEU A 149 -14.095 -2.943 -7.907 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -14.591 -1.245 -7.714 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -12.762 -0.727 -5.235 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -14.463 -0.208 -5.279 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -13.890 -1.266 -3.968 1.00 0.00 H new ATOM 2373 N ILE A 150 -17.977 -4.479 -4.364 1.00 0.00 N ATOM 2374 CA ILE A 150 -19.389 -4.670 -4.080 1.00 0.00 C ATOM 2375 C ILE A 150 -19.561 -5.052 -2.608 1.00 0.00 C ATOM 2376 O ILE A 150 -20.478 -4.574 -1.942 1.00 0.00 O ATOM 2377 CB ILE A 150 -20.000 -5.679 -5.053 1.00 0.00 C ATOM 2378 CG1 ILE A 150 -19.882 -5.189 -6.498 1.00 0.00 C ATOM 2379 CG2 ILE A 150 -21.448 -6.000 -4.674 1.00 0.00 C ATOM 2380 CD1 ILE A 150 -20.503 -6.194 -7.470 1.00 0.00 C ATOM 0 H ILE A 150 -17.563 -5.191 -4.966 1.00 0.00 H new ATOM 0 HA ILE A 150 -19.938 -3.741 -4.235 1.00 0.00 H new ATOM 0 HB ILE A 150 -19.434 -6.608 -4.980 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -20.379 -4.224 -6.600 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -18.833 -5.035 -6.749 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -21.858 -6.720 -5.382 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -21.476 -6.423 -3.670 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -22.042 -5.086 -4.700 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -20.406 -5.822 -8.490 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -19.988 -7.151 -7.382 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -21.558 -6.327 -7.231 1.00 0.00 H new ATOM 2392 N GLY A 151 -18.665 -5.911 -2.144 1.00 0.00 N ATOM 2393 CA GLY A 151 -18.707 -6.363 -0.764 1.00 0.00 C ATOM 2394 C GLY A 151 -18.003 -5.367 0.160 1.00 0.00 C ATOM 2395 O GLY A 151 -17.986 -5.550 1.377 1.00 0.00 O ATOM 0 H GLY A 151 -17.906 -6.306 -2.699 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -19.743 -6.487 -0.449 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -18.230 -7.340 -0.683 1.00 0.00 H new ATOM 2399 N SER A 152 -17.440 -4.337 -0.452 1.00 0.00 N ATOM 2400 CA SER A 152 -16.736 -3.312 0.301 1.00 0.00 C ATOM 2401 C SER A 152 -17.740 -2.397 1.003 1.00 0.00 C ATOM 2402 O SER A 152 -18.736 -1.988 0.408 1.00 0.00 O ATOM 2403 CB SER A 152 -15.818 -2.493 -0.609 1.00 0.00 C ATOM 2404 OG SER A 152 -14.634 -3.207 -0.954 1.00 0.00 O ATOM 0 H SER A 152 -17.456 -4.189 -1.461 1.00 0.00 H new ATOM 0 HA SER A 152 -16.116 -3.803 1.050 1.00 0.00 H new ATOM 0 HB2 SER A 152 -16.356 -2.222 -1.518 1.00 0.00 H new ATOM 0 HB3 SER A 152 -15.548 -1.563 -0.109 1.00 0.00 H new ATOM 0 HG SER A 152 -13.891 -2.897 -0.396 1.00 0.00 H new ATOM 2410 N PRO A 153 -17.437 -2.094 2.294 1.00 0.00 N ATOM 2411 CA PRO A 153 -18.302 -1.234 3.084 1.00 0.00 C ATOM 2412 C PRO A 153 -18.148 0.230 2.668 1.00 0.00 C ATOM 2413 O PRO A 153 -19.048 1.039 2.885 1.00 0.00 O ATOM 2414 CB PRO A 153 -17.895 -1.487 4.527 1.00 0.00 C ATOM 2415 CG PRO A 153 -16.516 -2.122 4.467 1.00 0.00 C ATOM 2416 CD PRO A 153 -16.267 -2.559 3.032 1.00 0.00 C ATOM 0 HA PRO A 153 -19.360 -1.452 2.937 1.00 0.00 H new ATOM 0 HB2 PRO A 153 -17.872 -0.557 5.095 1.00 0.00 H new ATOM 0 HB3 PRO A 153 -18.607 -2.146 5.024 1.00 0.00 H new ATOM 0 HG2 PRO A 153 -15.754 -1.411 4.787 1.00 0.00 H new ATOM 0 HG3 PRO A 153 -16.459 -2.976 5.142 1.00 0.00 H new ATOM 0 HD2 PRO A 153 -15.350 -2.120 2.638 1.00 0.00 H new ATOM 0 HD3 PRO A 153 -16.159 -3.641 2.961 1.00 0.00 H new ATOM 2424 N VAL A 154 -17.000 0.527 2.077 1.00 0.00 N ATOM 2425 CA VAL A 154 -16.716 1.879 1.628 1.00 0.00 C ATOM 2426 C VAL A 154 -15.977 1.823 0.290 1.00 0.00 C ATOM 2427 O VAL A 154 -16.472 1.241 -0.674 1.00 0.00 O ATOM 2428 CB VAL A 154 -15.942 2.637 2.708 1.00 0.00 C ATOM 2429 CG1 VAL A 154 -16.829 2.920 3.922 1.00 0.00 C ATOM 2430 CG2 VAL A 154 -14.680 1.874 3.116 1.00 0.00 C ATOM 0 H VAL A 154 -16.255 -0.147 1.899 1.00 0.00 H new ATOM 0 HA VAL A 154 -17.642 2.430 1.464 1.00 0.00 H new ATOM 0 HB VAL A 154 -15.633 3.595 2.289 1.00 0.00 H new ATOM 0 HG11 VAL A 154 -16.254 3.460 4.675 1.00 0.00 H new ATOM 0 HG12 VAL A 154 -17.683 3.524 3.616 1.00 0.00 H new ATOM 0 HG13 VAL A 154 -17.182 1.978 4.342 1.00 0.00 H new ATOM 0 HG21 VAL A 154 -14.148 2.435 3.885 1.00 0.00 H new ATOM 0 HG22 VAL A 154 -14.957 0.895 3.507 1.00 0.00 H new ATOM 0 HG23 VAL A 154 -14.034 1.748 2.247 1.00 0.00 H new ATOM 2440 N VAL A 155 -14.803 2.437 0.273 1.00 0.00 N ATOM 2441 CA VAL A 155 -13.990 2.465 -0.931 1.00 0.00 C ATOM 2442 C VAL A 155 -14.902 2.571 -2.155 1.00 0.00 C ATOM 2443 O VAL A 155 -15.247 1.561 -2.766 1.00 0.00 O ATOM 2444 CB VAL A 155 -13.074 1.240 -0.973 1.00 0.00 C ATOM 2445 CG1 VAL A 155 -13.871 -0.048 -0.752 1.00 0.00 C ATOM 2446 CG2 VAL A 155 -12.294 1.183 -2.288 1.00 0.00 C ATOM 0 H VAL A 155 -14.395 2.919 1.074 1.00 0.00 H new ATOM 0 HA VAL A 155 -13.340 3.340 -0.932 1.00 0.00 H new ATOM 0 HB VAL A 155 -12.354 1.332 -0.160 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -13.197 -0.904 -0.787 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -14.360 -0.011 0.221 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -14.625 -0.148 -1.533 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -11.651 0.303 -2.292 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -12.992 1.126 -3.123 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -11.682 2.080 -2.387 1.00 0.00 H new ATOM 2456 N ASP A 156 -15.268 3.804 -2.476 1.00 0.00 N ATOM 2457 CA ASP A 156 -16.133 4.055 -3.615 1.00 0.00 C ATOM 2458 C ASP A 156 -15.298 4.047 -4.897 1.00 0.00 C ATOM 2459 O ASP A 156 -14.581 5.005 -5.181 1.00 0.00 O ATOM 2460 CB ASP A 156 -16.811 5.422 -3.502 1.00 0.00 C ATOM 2461 CG ASP A 156 -15.952 6.519 -2.871 1.00 0.00 C ATOM 2462 OD1 ASP A 156 -16.539 7.559 -2.502 1.00 0.00 O ATOM 2463 OD2 ASP A 156 -14.726 6.294 -2.772 1.00 0.00 O ATOM 0 H ASP A 156 -14.981 4.640 -1.966 1.00 0.00 H new ATOM 0 HA ASP A 156 -16.894 3.275 -3.637 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -17.112 5.745 -4.499 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -17.722 5.311 -2.914 1.00 0.00 H new ATOM 2469 N SER A 157 -15.417 2.954 -5.636 1.00 0.00 N ATOM 2470 CA SER A 157 -14.681 2.808 -6.881 1.00 0.00 C ATOM 2471 C SER A 157 -14.994 3.979 -7.814 1.00 0.00 C ATOM 2472 O SER A 157 -14.105 4.494 -8.490 1.00 0.00 O ATOM 2473 CB SER A 157 -15.014 1.481 -7.565 1.00 0.00 C ATOM 2474 OG SER A 157 -16.128 1.598 -8.445 1.00 0.00 O ATOM 0 H SER A 157 -16.012 2.161 -5.397 1.00 0.00 H new ATOM 0 HA SER A 157 -13.616 2.810 -6.651 1.00 0.00 H new ATOM 0 HB2 SER A 157 -14.145 1.134 -8.124 1.00 0.00 H new ATOM 0 HB3 SER A 157 -15.228 0.727 -6.808 1.00 0.00 H new ATOM 0 HG SER A 157 -16.307 0.730 -8.863 1.00 0.00 H new ATOM 2480 N GLN A 158 -16.262 4.366 -7.821 1.00 0.00 N ATOM 2481 CA GLN A 158 -16.703 5.467 -8.660 1.00 0.00 C ATOM 2482 C GLN A 158 -15.846 6.708 -8.403 1.00 0.00 C ATOM 2483 O GLN A 158 -15.757 7.593 -9.252 1.00 0.00 O ATOM 2484 CB GLN A 158 -18.186 5.769 -8.433 1.00 0.00 C ATOM 2485 CG GLN A 158 -19.066 4.664 -9.020 1.00 0.00 C ATOM 2486 CD GLN A 158 -20.506 4.784 -8.515 1.00 0.00 C ATOM 2487 OE1 GLN A 158 -21.148 5.814 -8.632 1.00 0.00 O ATOM 2488 NE2 GLN A 158 -20.975 3.676 -7.948 1.00 0.00 N ATOM 0 H GLN A 158 -16.997 3.937 -7.259 1.00 0.00 H new ATOM 0 HA GLN A 158 -16.580 5.175 -9.703 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -18.382 5.866 -7.365 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -18.441 6.724 -8.892 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -19.052 4.723 -10.108 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -18.661 3.689 -8.748 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -20.384 2.847 -7.882 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -21.926 3.655 -7.579 1.00 0.00 H new ATOM 2497 N LYS A 159 -15.235 6.732 -7.227 1.00 0.00 N ATOM 2498 CA LYS A 159 -14.387 7.850 -6.848 1.00 0.00 C ATOM 2499 C LYS A 159 -12.940 7.543 -7.239 1.00 0.00 C ATOM 2500 O LYS A 159 -12.254 8.390 -7.808 1.00 0.00 O ATOM 2501 CB LYS A 159 -14.567 8.179 -5.364 1.00 0.00 C ATOM 2502 CG LYS A 159 -13.414 9.044 -4.851 1.00 0.00 C ATOM 2503 CD LYS A 159 -13.940 10.299 -4.150 1.00 0.00 C ATOM 2504 CE LYS A 159 -14.506 9.959 -2.770 1.00 0.00 C ATOM 2505 NZ LYS A 159 -15.856 10.541 -2.605 1.00 0.00 N ATOM 0 H LYS A 159 -15.310 5.996 -6.525 1.00 0.00 H new ATOM 0 HA LYS A 159 -14.679 8.750 -7.389 1.00 0.00 H new ATOM 0 HB2 LYS A 159 -15.512 8.701 -5.216 1.00 0.00 H new ATOM 0 HB3 LYS A 159 -14.619 7.256 -4.787 1.00 0.00 H new ATOM 0 HG2 LYS A 159 -12.801 8.466 -4.159 1.00 0.00 H new ATOM 0 HG3 LYS A 159 -12.771 9.330 -5.683 1.00 0.00 H new ATOM 0 HD2 LYS A 159 -13.135 11.027 -4.048 1.00 0.00 H new ATOM 0 HD3 LYS A 159 -14.714 10.763 -4.760 1.00 0.00 H new ATOM 0 HE2 LYS A 159 -14.553 8.877 -2.646 1.00 0.00 H new ATOM 0 HE3 LYS A 159 -13.842 10.340 -1.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 -15.892 11.091 -1.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 -16.066 11.165 -3.410 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 -16.561 9.777 -2.566 1.00 0.00 H new ATOM 2519 N LEU A 160 -12.519 6.328 -6.918 1.00 0.00 N ATOM 2520 CA LEU A 160 -11.166 5.899 -7.228 1.00 0.00 C ATOM 2521 C LEU A 160 -10.855 6.227 -8.690 1.00 0.00 C ATOM 2522 O LEU A 160 -11.724 6.695 -9.423 1.00 0.00 O ATOM 2523 CB LEU A 160 -10.979 4.421 -6.876 1.00 0.00 C ATOM 2524 CG LEU A 160 -11.069 4.069 -5.390 1.00 0.00 C ATOM 2525 CD1 LEU A 160 -11.684 2.683 -5.191 1.00 0.00 C ATOM 2526 CD2 LEU A 160 -9.703 4.193 -4.713 1.00 0.00 C ATOM 0 H LEU A 160 -13.091 5.628 -6.446 1.00 0.00 H new ATOM 0 HA LEU A 160 -10.444 6.442 -6.618 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -11.731 3.842 -7.412 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -10.006 4.100 -7.247 1.00 0.00 H new ATOM 0 HG LEU A 160 -11.733 4.787 -4.909 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -11.736 2.458 -4.126 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -12.688 2.666 -5.615 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -11.067 1.936 -5.690 1.00 0.00 H new ATOM 0 HD21 LEU A 160 -9.795 3.937 -3.657 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -8.997 3.513 -5.191 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -9.342 5.217 -4.808 1.00 0.00 H new ATOM 2538 N VAL A 161 -9.612 5.967 -9.069 1.00 0.00 N ATOM 2539 CA VAL A 161 -9.175 6.229 -10.430 1.00 0.00 C ATOM 2540 C VAL A 161 -8.125 5.192 -10.832 1.00 0.00 C ATOM 2541 O VAL A 161 -7.158 4.968 -10.105 1.00 0.00 O ATOM 2542 CB VAL A 161 -8.670 7.669 -10.549 1.00 0.00 C ATOM 2543 CG1 VAL A 161 -7.968 7.894 -11.890 1.00 0.00 C ATOM 2544 CG2 VAL A 161 -9.811 8.668 -10.353 1.00 0.00 C ATOM 0 H VAL A 161 -8.894 5.578 -8.458 1.00 0.00 H new ATOM 0 HA VAL A 161 -10.009 6.133 -11.125 1.00 0.00 H new ATOM 0 HB VAL A 161 -7.940 7.835 -9.757 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -7.619 8.925 -11.949 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -7.118 7.217 -11.974 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -8.667 7.700 -12.704 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -9.425 9.683 -10.442 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -10.575 8.502 -11.113 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -10.248 8.532 -9.364 1.00 0.00 H new ATOM 2554 N TYR A 162 -8.350 4.586 -11.989 1.00 0.00 N ATOM 2555 CA TYR A 162 -7.435 3.578 -12.496 1.00 0.00 C ATOM 2556 C TYR A 162 -6.148 4.219 -13.019 1.00 0.00 C ATOM 2557 O TYR A 162 -6.113 5.419 -13.288 1.00 0.00 O ATOM 2558 CB TYR A 162 -8.161 2.897 -13.659 1.00 0.00 C ATOM 2559 CG TYR A 162 -8.852 1.586 -13.278 1.00 0.00 C ATOM 2560 CD1 TYR A 162 -10.123 1.607 -12.742 1.00 0.00 C ATOM 2561 CD2 TYR A 162 -8.204 0.383 -13.472 1.00 0.00 C ATOM 2562 CE1 TYR A 162 -10.774 0.373 -12.384 1.00 0.00 C ATOM 2563 CE2 TYR A 162 -8.854 -0.851 -13.114 1.00 0.00 C ATOM 2564 CZ TYR A 162 -10.107 -0.795 -12.588 1.00 0.00 C ATOM 2565 OH TYR A 162 -10.721 -1.961 -12.250 1.00 0.00 O ATOM 0 H TYR A 162 -9.153 4.774 -12.589 1.00 0.00 H new ATOM 0 HA TYR A 162 -7.159 2.878 -11.707 1.00 0.00 H new ATOM 0 HB2 TYR A 162 -8.905 3.584 -14.062 1.00 0.00 H new ATOM 0 HB3 TYR A 162 -7.444 2.700 -14.456 1.00 0.00 H new ATOM 0 HD1 TYR A 162 -10.630 2.549 -12.591 1.00 0.00 H new ATOM 0 HD2 TYR A 162 -7.209 0.367 -13.892 1.00 0.00 H new ATOM 0 HE1 TYR A 162 -11.769 0.375 -11.963 1.00 0.00 H new ATOM 0 HE2 TYR A 162 -8.358 -1.799 -13.260 1.00 0.00 H new ATOM 0 HH TYR A 162 -10.127 -2.714 -12.452 1.00 0.00 H new ATOM 2575 N SER A 163 -5.123 3.390 -13.149 1.00 0.00 N ATOM 2576 CA SER A 163 -3.837 3.861 -13.635 1.00 0.00 C ATOM 2577 C SER A 163 -4.043 4.896 -14.742 1.00 0.00 C ATOM 2578 O SER A 163 -5.088 4.916 -15.391 1.00 0.00 O ATOM 2579 CB SER A 163 -2.983 2.699 -14.146 1.00 0.00 C ATOM 2580 OG SER A 163 -3.588 2.039 -15.255 1.00 0.00 O ATOM 0 H SER A 163 -5.157 2.395 -12.926 1.00 0.00 H new ATOM 0 HA SER A 163 -3.307 4.328 -12.805 1.00 0.00 H new ATOM 0 HB2 SER A 163 -2.001 3.072 -14.438 1.00 0.00 H new ATOM 0 HB3 SER A 163 -2.826 1.983 -13.340 1.00 0.00 H new ATOM 0 HG SER A 163 -3.369 1.084 -15.227 1.00 0.00 H new ATOM 2586 N ASP A 164 -3.030 5.730 -14.925 1.00 0.00 N ATOM 2587 CA ASP A 164 -3.088 6.765 -15.943 1.00 0.00 C ATOM 2588 C ASP A 164 -2.038 7.835 -15.636 1.00 0.00 C ATOM 2589 O ASP A 164 -2.305 8.775 -14.888 1.00 0.00 O ATOM 2590 CB ASP A 164 -4.460 7.441 -15.965 1.00 0.00 C ATOM 2591 CG ASP A 164 -5.328 7.104 -17.179 1.00 0.00 C ATOM 2592 OD1 ASP A 164 -6.118 7.988 -17.574 1.00 0.00 O ATOM 2593 OD2 ASP A 164 -5.182 5.970 -17.684 1.00 0.00 O ATOM 0 H ASP A 164 -2.165 5.710 -14.386 1.00 0.00 H new ATOM 0 HA ASP A 164 -2.902 6.298 -16.910 1.00 0.00 H new ATOM 0 HB2 ASP A 164 -5.001 7.160 -15.061 1.00 0.00 H new ATOM 0 HB3 ASP A 164 -4.317 8.521 -15.928 1.00 0.00 H new ATOM 2599 N PHE A 165 -0.867 7.657 -16.229 1.00 0.00 N ATOM 2600 CA PHE A 165 0.224 8.596 -16.028 1.00 0.00 C ATOM 2601 C PHE A 165 0.671 9.210 -17.356 1.00 0.00 C ATOM 2602 O PHE A 165 0.787 10.429 -17.473 1.00 0.00 O ATOM 2603 CB PHE A 165 1.389 7.806 -15.428 1.00 0.00 C ATOM 2604 CG PHE A 165 1.532 6.388 -15.984 1.00 0.00 C ATOM 2605 CD1 PHE A 165 0.672 5.412 -15.587 1.00 0.00 C ATOM 2606 CD2 PHE A 165 2.519 6.104 -16.876 1.00 0.00 C ATOM 2607 CE1 PHE A 165 0.804 4.096 -16.104 1.00 0.00 C ATOM 2608 CE2 PHE A 165 2.651 4.788 -17.392 1.00 0.00 C ATOM 2609 CZ PHE A 165 1.791 3.812 -16.995 1.00 0.00 C ATOM 0 H PHE A 165 -0.649 6.877 -16.849 1.00 0.00 H new ATOM 0 HA PHE A 165 -0.098 9.406 -15.374 1.00 0.00 H new ATOM 0 HB2 PHE A 165 2.315 8.351 -15.609 1.00 0.00 H new ATOM 0 HB3 PHE A 165 1.258 7.750 -14.347 1.00 0.00 H new ATOM 0 HD1 PHE A 165 -0.111 5.638 -14.879 1.00 0.00 H new ATOM 0 HD2 PHE A 165 3.202 6.879 -17.191 1.00 0.00 H new ATOM 0 HE1 PHE A 165 0.121 3.321 -15.790 1.00 0.00 H new ATOM 0 HE2 PHE A 165 3.435 4.562 -18.100 1.00 0.00 H new ATOM 0 HZ PHE A 165 1.892 2.811 -17.388 1.00 0.00 H new ATOM 2619 N SER A 166 0.909 8.338 -18.325 1.00 0.00 N ATOM 2620 CA SER A 166 1.340 8.779 -19.640 1.00 0.00 C ATOM 2621 C SER A 166 2.850 9.025 -19.640 1.00 0.00 C ATOM 2622 O SER A 166 3.424 9.390 -18.615 1.00 0.00 O ATOM 2623 CB SER A 166 0.596 10.045 -20.068 1.00 0.00 C ATOM 2624 OG SER A 166 0.158 9.976 -21.422 1.00 0.00 O ATOM 0 H SER A 166 0.811 7.328 -18.225 1.00 0.00 H new ATOM 0 HA SER A 166 1.106 7.993 -20.358 1.00 0.00 H new ATOM 0 HB2 SER A 166 -0.264 10.197 -19.416 1.00 0.00 H new ATOM 0 HB3 SER A 166 1.249 10.909 -19.942 1.00 0.00 H new ATOM 0 HG SER A 166 -0.314 10.803 -21.656 1.00 0.00 H new ATOM 2630 N GLU A 167 3.451 8.815 -20.802 1.00 0.00 N ATOM 2631 CA GLU A 167 4.884 9.010 -20.950 1.00 0.00 C ATOM 2632 C GLU A 167 5.310 10.326 -20.297 1.00 0.00 C ATOM 2633 O GLU A 167 6.407 10.424 -19.747 1.00 0.00 O ATOM 2634 CB GLU A 167 5.294 8.971 -22.423 1.00 0.00 C ATOM 2635 CG GLU A 167 6.040 7.675 -22.750 1.00 0.00 C ATOM 2636 CD GLU A 167 5.061 6.551 -23.093 1.00 0.00 C ATOM 2637 OE1 GLU A 167 4.832 6.347 -24.305 1.00 0.00 O ATOM 2638 OE2 GLU A 167 4.564 5.919 -22.135 1.00 0.00 O ATOM 0 H GLU A 167 2.972 8.512 -21.650 1.00 0.00 H new ATOM 0 HA GLU A 167 5.396 8.192 -20.443 1.00 0.00 H new ATOM 0 HB2 GLU A 167 4.408 9.054 -23.053 1.00 0.00 H new ATOM 0 HB3 GLU A 167 5.929 9.828 -22.650 1.00 0.00 H new ATOM 0 HG2 GLU A 167 6.716 7.842 -23.589 1.00 0.00 H new ATOM 0 HG3 GLU A 167 6.654 7.380 -21.899 1.00 0.00 H new ATOM 2646 N ALA A 168 4.422 11.306 -20.379 1.00 0.00 N ATOM 2647 CA ALA A 168 4.693 12.612 -19.803 1.00 0.00 C ATOM 2648 C ALA A 168 5.031 12.450 -18.320 1.00 0.00 C ATOM 2649 O ALA A 168 5.889 13.159 -17.794 1.00 0.00 O ATOM 2650 CB ALA A 168 3.490 13.530 -20.030 1.00 0.00 C ATOM 0 H ALA A 168 3.514 11.222 -20.836 1.00 0.00 H new ATOM 0 HA ALA A 168 5.552 13.075 -20.288 1.00 0.00 H new ATOM 0 HB1 ALA A 168 3.693 14.510 -19.598 1.00 0.00 H new ATOM 0 HB2 ALA A 168 3.310 13.636 -21.100 1.00 0.00 H new ATOM 0 HB3 ALA A 168 2.609 13.099 -19.554 1.00 0.00 H new ATOM 2656 N ALA A 169 4.340 11.514 -17.686 1.00 0.00 N ATOM 2657 CA ALA A 169 4.557 11.250 -16.274 1.00 0.00 C ATOM 2658 C ALA A 169 5.779 10.344 -16.110 1.00 0.00 C ATOM 2659 O ALA A 169 6.737 10.704 -15.428 1.00 0.00 O ATOM 2660 CB ALA A 169 3.292 10.638 -15.669 1.00 0.00 C ATOM 0 H ALA A 169 3.629 10.929 -18.125 1.00 0.00 H new ATOM 0 HA ALA A 169 4.760 12.177 -15.737 1.00 0.00 H new ATOM 0 HB1 ALA A 169 3.455 10.440 -14.610 1.00 0.00 H new ATOM 0 HB2 ALA A 169 2.460 11.333 -15.785 1.00 0.00 H new ATOM 0 HB3 ALA A 169 3.059 9.705 -16.181 1.00 0.00 H new ATOM 2666 N CYS A 170 5.706 9.185 -16.748 1.00 0.00 N ATOM 2667 CA CYS A 170 6.794 8.225 -16.682 1.00 0.00 C ATOM 2668 C CYS A 170 8.104 8.961 -16.970 1.00 0.00 C ATOM 2669 O CYS A 170 9.094 8.773 -16.265 1.00 0.00 O ATOM 2670 CB CYS A 170 6.575 7.054 -17.643 1.00 0.00 C ATOM 2671 SG CYS A 170 7.724 5.648 -17.415 1.00 0.00 S ATOM 0 H CYS A 170 4.910 8.889 -17.313 1.00 0.00 H new ATOM 0 HA CYS A 170 6.836 7.788 -15.684 1.00 0.00 H new ATOM 0 HB2 CYS A 170 5.553 6.693 -17.526 1.00 0.00 H new ATOM 0 HB3 CYS A 170 6.669 7.419 -18.666 1.00 0.00 H new ATOM 2677 N LYS A 171 8.066 9.786 -18.006 1.00 0.00 N ATOM 2678 CA LYS A 171 9.238 10.552 -18.396 1.00 0.00 C ATOM 2679 C LYS A 171 9.711 11.391 -17.208 1.00 0.00 C ATOM 2680 O LYS A 171 8.939 12.163 -16.641 1.00 0.00 O ATOM 2681 CB LYS A 171 8.946 11.375 -19.653 1.00 0.00 C ATOM 2682 CG LYS A 171 10.228 11.999 -20.209 1.00 0.00 C ATOM 2683 CD LYS A 171 10.223 11.989 -21.739 1.00 0.00 C ATOM 2684 CE LYS A 171 9.316 13.091 -22.291 1.00 0.00 C ATOM 2685 NZ LYS A 171 9.230 12.999 -23.766 1.00 0.00 N ATOM 0 H LYS A 171 7.242 9.941 -18.587 1.00 0.00 H new ATOM 0 HA LYS A 171 10.058 9.885 -18.663 1.00 0.00 H new ATOM 0 HB2 LYS A 171 8.489 10.739 -20.411 1.00 0.00 H new ATOM 0 HB3 LYS A 171 8.227 12.160 -19.419 1.00 0.00 H new ATOM 0 HG2 LYS A 171 10.324 13.023 -19.849 1.00 0.00 H new ATOM 0 HG3 LYS A 171 11.094 11.449 -19.841 1.00 0.00 H new ATOM 0 HD2 LYS A 171 11.238 12.128 -22.111 1.00 0.00 H new ATOM 0 HD3 LYS A 171 9.882 11.018 -22.099 1.00 0.00 H new ATOM 0 HE2 LYS A 171 8.320 13.003 -21.856 1.00 0.00 H new ATOM 0 HE3 LYS A 171 9.704 14.068 -22.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 171 8.611 13.753 -24.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 171 10.180 13.105 -24.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 171 8.839 12.073 -24.034 1.00 0.00 H new ATOM 2699 N VAL A 172 10.978 11.212 -16.865 1.00 0.00 N ATOM 2700 CA VAL A 172 11.564 11.943 -15.754 1.00 0.00 C ATOM 2701 C VAL A 172 12.477 13.043 -16.298 1.00 0.00 C ATOM 2702 O VAL A 172 13.069 12.892 -17.366 1.00 0.00 O ATOM 2703 CB VAL A 172 12.287 10.976 -14.815 1.00 0.00 C ATOM 2704 CG1 VAL A 172 12.976 11.731 -13.676 1.00 0.00 C ATOM 2705 CG2 VAL A 172 11.325 9.919 -14.269 1.00 0.00 C ATOM 0 H VAL A 172 11.616 10.571 -17.337 1.00 0.00 H new ATOM 0 HA VAL A 172 10.787 12.428 -15.164 1.00 0.00 H new ATOM 0 HB VAL A 172 13.057 10.462 -15.391 1.00 0.00 H new ATOM 0 HG11 VAL A 172 13.483 11.021 -13.023 1.00 0.00 H new ATOM 0 HG12 VAL A 172 13.705 12.427 -14.090 1.00 0.00 H new ATOM 0 HG13 VAL A 172 12.231 12.284 -13.103 1.00 0.00 H new ATOM 0 HG21 VAL A 172 11.865 9.244 -13.604 1.00 0.00 H new ATOM 0 HG22 VAL A 172 10.523 10.408 -13.716 1.00 0.00 H new ATOM 0 HG23 VAL A 172 10.901 9.350 -15.097 1.00 0.00 H new