USER MOD reduce.3.24.130724 H: found=0, std=0, add=904, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 902 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 89 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 93 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 53 THR OG1 : rot 75:sc= 0.00772 USER MOD Set 2.2: A 107 LYS NZ :NH3+ -127:sc= -0.156 (180deg=-2.16!) USER MOD Set 3.1: A 37 CYS SG : rot -129:sc= 0.803 USER MOD Set 3.2: A 40 CYS SG : rot -70:sc= -0.877 USER MOD Set 4.1: A 27 ASN : amide:sc= -0.989 X(o=-2.5,f=-2.7) USER MOD Set 4.2: A 59 ASN : amide:sc= -1.48 X(o=-2.5,f=-3) USER MOD Single : A 1 GLY N :NH3+ -175:sc= 0 (180deg=-0.019) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0.0125 USER MOD Single : A 6 SER OG : rot 14:sc= 0.174! USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -2.11! C(o=-2.1!,f=-4.7!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 132:sc= -0.302! (180deg=-2.56!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HD1:sc= -0.021 X(o=-0.021,f=-0.021) USER MOD Single : A 41 LYS NZ :NH3+ 126:sc= -0.126 (180deg=-0.688) USER MOD Single : A 42 GLN : amide:sc= -0.021 K(o=-0.021,f=-1.8) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= -0.5 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 HIS : no HD1:sc= -4.49! C(o=-4.5!,f=-9.2!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 MET CE :methyl -159:sc= 0 (180deg=-0.599) USER MOD Single : A 67 SER OG : rot -37:sc= -0.811 USER MOD Single : A 68 THR OG1 : rot -60:sc= -0.552 USER MOD Single : A 70 ASN : amide:sc= -0.484 K(o=-0.48,f=-1.9!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 HIS : no HE2:sc= -0.0854 K(o=-0.085,f=-0.59) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 83:sc= 0.933 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 TYR OH : rot -106:sc= 0.436 USER MOD Single : A 98 ASN : amide:sc= -0.0505 X(o=-0.051,f=-0.49) USER MOD Single : A 102 THR OG1 : rot -134:sc= -0.705 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 71:sc= 1.3 USER MOD Single : A 115 GLN : amide:sc=-0.00746 X(o=-0.0075,f=0) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.068 -24.696 7.688 1.00 0.00 N ATOM 2 CA GLY A 1 -14.816 -23.761 6.869 1.00 0.00 C ATOM 3 C GLY A 1 -15.385 -24.409 5.622 1.00 0.00 C ATOM 4 O GLY A 1 -16.532 -24.157 5.252 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.772 -24.227 8.568 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.668 -25.514 7.916 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.227 -25.018 7.168 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.629 -23.337 7.458 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.166 -22.934 6.581 1.00 0.00 H new ATOM 8 N SER A 2 -14.582 -25.245 4.972 1.00 0.00 N ATOM 9 CA SER A 2 -15.011 -25.926 3.756 1.00 0.00 C ATOM 10 C SER A 2 -15.585 -24.933 2.750 1.00 0.00 C ATOM 11 O SER A 2 -16.617 -25.188 2.130 1.00 0.00 O ATOM 12 CB SER A 2 -16.054 -26.995 4.087 1.00 0.00 C ATOM 13 OG SER A 2 -16.026 -28.047 3.137 1.00 0.00 O ATOM 0 H SER A 2 -13.631 -25.467 5.267 1.00 0.00 H new ATOM 0 HA SER A 2 -14.139 -26.404 3.310 1.00 0.00 H new ATOM 0 HB2 SER A 2 -15.865 -27.395 5.083 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.047 -26.545 4.107 1.00 0.00 H new ATOM 0 HG SER A 2 -16.701 -28.718 3.372 1.00 0.00 H new ATOM 19 N SER A 3 -14.908 -23.800 2.594 1.00 0.00 N ATOM 20 CA SER A 3 -15.352 -22.766 1.667 1.00 0.00 C ATOM 21 C SER A 3 -14.386 -22.638 0.493 1.00 0.00 C ATOM 22 O SER A 3 -14.800 -22.583 -0.664 1.00 0.00 O ATOM 23 CB SER A 3 -15.475 -21.423 2.389 1.00 0.00 C ATOM 24 OG SER A 3 -14.277 -21.099 3.073 1.00 0.00 O ATOM 0 H SER A 3 -14.050 -23.575 3.098 1.00 0.00 H new ATOM 0 HA SER A 3 -16.330 -23.054 1.281 1.00 0.00 H new ATOM 0 HB2 SER A 3 -15.709 -20.639 1.668 1.00 0.00 H new ATOM 0 HB3 SER A 3 -16.303 -21.462 3.097 1.00 0.00 H new ATOM 0 HG SER A 3 -14.381 -20.236 3.525 1.00 0.00 H new ATOM 30 N GLY A 4 -13.093 -22.591 0.801 1.00 0.00 N ATOM 31 CA GLY A 4 -12.087 -22.470 -0.238 1.00 0.00 C ATOM 32 C GLY A 4 -12.080 -21.098 -0.881 1.00 0.00 C ATOM 33 O GLY A 4 -12.549 -20.930 -2.006 1.00 0.00 O ATOM 0 H GLY A 4 -12.725 -22.635 1.751 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.104 -22.674 0.187 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -12.266 -23.225 -1.003 1.00 0.00 H new ATOM 37 N SER A 5 -11.547 -20.113 -0.165 1.00 0.00 N ATOM 38 CA SER A 5 -11.486 -18.746 -0.670 1.00 0.00 C ATOM 39 C SER A 5 -10.327 -18.581 -1.649 1.00 0.00 C ATOM 40 O SER A 5 -9.570 -19.519 -1.896 1.00 0.00 O ATOM 41 CB SER A 5 -11.336 -17.758 0.488 1.00 0.00 C ATOM 42 OG SER A 5 -11.791 -16.468 0.120 1.00 0.00 O ATOM 0 H SER A 5 -11.151 -20.236 0.767 1.00 0.00 H new ATOM 0 HA SER A 5 -12.417 -18.537 -1.197 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.901 -18.114 1.349 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.291 -17.705 0.792 1.00 0.00 H new ATOM 0 HG SER A 5 -11.686 -15.856 0.878 1.00 0.00 H new ATOM 48 N SER A 6 -10.197 -17.380 -2.203 1.00 0.00 N ATOM 49 CA SER A 6 -9.133 -17.090 -3.158 1.00 0.00 C ATOM 50 C SER A 6 -8.811 -15.599 -3.177 1.00 0.00 C ATOM 51 O SER A 6 -9.703 -14.761 -3.305 1.00 0.00 O ATOM 52 CB SER A 6 -9.537 -17.554 -4.559 1.00 0.00 C ATOM 53 OG SER A 6 -10.505 -16.687 -5.124 1.00 0.00 O ATOM 0 H SER A 6 -10.815 -16.592 -2.007 1.00 0.00 H new ATOM 0 HA SER A 6 -8.240 -17.632 -2.846 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.657 -17.590 -5.201 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.937 -18.567 -4.509 1.00 0.00 H new ATOM 0 HG SER A 6 -10.550 -15.861 -4.599 1.00 0.00 H new ATOM 59 N GLY A 7 -7.528 -15.275 -3.048 1.00 0.00 N ATOM 60 CA GLY A 7 -7.109 -13.886 -3.052 1.00 0.00 C ATOM 61 C GLY A 7 -5.973 -13.620 -2.085 1.00 0.00 C ATOM 62 O GLY A 7 -6.093 -13.834 -0.879 1.00 0.00 O ATOM 0 H GLY A 7 -6.771 -15.950 -2.941 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -6.798 -13.607 -4.059 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -7.958 -13.253 -2.793 1.00 0.00 H new ATOM 66 N PRO A 8 -4.837 -13.143 -2.617 1.00 0.00 N ATOM 67 CA PRO A 8 -3.652 -12.839 -1.810 1.00 0.00 C ATOM 68 C PRO A 8 -3.858 -11.623 -0.914 1.00 0.00 C ATOM 69 O PRO A 8 -3.589 -11.671 0.287 1.00 0.00 O ATOM 70 CB PRO A 8 -2.573 -12.554 -2.858 1.00 0.00 C ATOM 71 CG PRO A 8 -3.325 -12.107 -4.064 1.00 0.00 C ATOM 72 CD PRO A 8 -4.624 -12.865 -4.047 1.00 0.00 C ATOM 0 HA PRO A 8 -3.401 -13.654 -1.131 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -1.881 -11.785 -2.515 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -1.980 -13.444 -3.068 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -3.500 -11.032 -4.038 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -2.763 -12.316 -4.974 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -5.439 -12.276 -4.468 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -4.561 -13.784 -4.630 1.00 0.00 H new ATOM 80 N VAL A 9 -4.336 -10.532 -1.504 1.00 0.00 N ATOM 81 CA VAL A 9 -4.580 -9.303 -0.758 1.00 0.00 C ATOM 82 C VAL A 9 -6.052 -8.912 -0.809 1.00 0.00 C ATOM 83 O VAL A 9 -6.690 -8.987 -1.859 1.00 0.00 O ATOM 84 CB VAL A 9 -3.731 -8.139 -1.303 1.00 0.00 C ATOM 85 CG1 VAL A 9 -3.596 -8.238 -2.814 1.00 0.00 C ATOM 86 CG2 VAL A 9 -4.339 -6.804 -0.900 1.00 0.00 C ATOM 0 H VAL A 9 -4.562 -10.474 -2.497 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.295 -9.498 0.276 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.733 -8.205 -0.869 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -2.993 -7.407 -3.181 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -3.113 -9.180 -3.075 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.585 -8.198 -3.271 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -3.727 -5.992 -1.293 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -5.348 -6.727 -1.305 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -4.378 -6.735 0.187 1.00 0.00 H new ATOM 96 N LYS A 10 -6.587 -8.494 0.333 1.00 0.00 N ATOM 97 CA LYS A 10 -7.985 -8.088 0.420 1.00 0.00 C ATOM 98 C LYS A 10 -8.220 -6.779 -0.328 1.00 0.00 C ATOM 99 O LYS A 10 -7.330 -5.933 -0.412 1.00 0.00 O ATOM 100 CB LYS A 10 -8.402 -7.933 1.884 1.00 0.00 C ATOM 101 CG LYS A 10 -9.819 -8.402 2.166 1.00 0.00 C ATOM 102 CD LYS A 10 -10.463 -7.593 3.279 1.00 0.00 C ATOM 103 CE LYS A 10 -11.981 -7.634 3.192 1.00 0.00 C ATOM 104 NZ LYS A 10 -12.525 -8.956 3.608 1.00 0.00 N ATOM 0 H LYS A 10 -6.073 -8.427 1.212 1.00 0.00 H new ATOM 0 HA LYS A 10 -8.592 -8.865 -0.044 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -7.711 -8.495 2.511 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -8.311 -6.885 2.170 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -10.418 -8.317 1.260 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -9.806 -9.456 2.442 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -10.142 -7.982 4.245 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -10.122 -6.559 3.223 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -12.402 -6.853 3.825 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -12.292 -7.419 2.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -13.562 -8.943 3.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -12.143 -9.699 2.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -12.250 -9.151 4.592 1.00 0.00 H new ATOM 118 N VAL A 11 -9.423 -6.619 -0.868 1.00 0.00 N ATOM 119 CA VAL A 11 -9.776 -5.412 -1.606 1.00 0.00 C ATOM 120 C VAL A 11 -10.786 -4.571 -0.834 1.00 0.00 C ATOM 121 O VAL A 11 -11.982 -4.863 -0.832 1.00 0.00 O ATOM 122 CB VAL A 11 -10.358 -5.751 -2.991 1.00 0.00 C ATOM 123 CG1 VAL A 11 -10.675 -4.479 -3.763 1.00 0.00 C ATOM 124 CG2 VAL A 11 -9.396 -6.633 -3.772 1.00 0.00 C ATOM 0 H VAL A 11 -10.171 -7.310 -0.808 1.00 0.00 H new ATOM 0 HA VAL A 11 -8.857 -4.841 -1.736 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.287 -6.303 -2.850 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -11.085 -4.738 -4.739 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -11.404 -3.889 -3.208 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -9.763 -3.897 -3.896 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -9.824 -6.863 -4.748 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -8.449 -6.110 -3.905 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -9.225 -7.559 -3.224 1.00 0.00 H new ATOM 134 N LEU A 12 -10.297 -3.523 -0.179 1.00 0.00 N ATOM 135 CA LEU A 12 -11.157 -2.637 0.598 1.00 0.00 C ATOM 136 C LEU A 12 -11.897 -1.662 -0.312 1.00 0.00 C ATOM 137 O LEU A 12 -11.387 -1.263 -1.359 1.00 0.00 O ATOM 138 CB LEU A 12 -10.330 -1.865 1.627 1.00 0.00 C ATOM 139 CG LEU A 12 -9.476 -2.710 2.573 1.00 0.00 C ATOM 140 CD1 LEU A 12 -8.485 -1.834 3.323 1.00 0.00 C ATOM 141 CD2 LEU A 12 -10.359 -3.476 3.547 1.00 0.00 C ATOM 0 H LEU A 12 -9.310 -3.266 -0.171 1.00 0.00 H new ATOM 0 HA LEU A 12 -11.893 -3.249 1.119 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -9.674 -1.177 1.094 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -11.008 -1.258 2.227 1.00 0.00 H new ATOM 0 HG LEU A 12 -8.914 -3.431 1.979 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -7.886 -2.452 3.991 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -7.831 -1.332 2.610 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.026 -1.089 3.906 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -9.735 -4.072 4.213 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -10.948 -2.772 4.135 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -11.028 -4.133 2.992 1.00 0.00 H new ATOM 153 N VAL A 13 -13.104 -1.280 0.095 1.00 0.00 N ATOM 154 CA VAL A 13 -13.914 -0.349 -0.681 1.00 0.00 C ATOM 155 C VAL A 13 -14.379 0.822 0.177 1.00 0.00 C ATOM 156 O VAL A 13 -14.449 0.719 1.401 1.00 0.00 O ATOM 157 CB VAL A 13 -15.145 -1.048 -1.289 1.00 0.00 C ATOM 158 CG1 VAL A 13 -14.730 -1.962 -2.431 1.00 0.00 C ATOM 159 CG2 VAL A 13 -15.898 -1.824 -0.220 1.00 0.00 C ATOM 0 H VAL A 13 -13.542 -1.601 0.958 1.00 0.00 H new ATOM 0 HA VAL A 13 -13.283 0.024 -1.487 1.00 0.00 H new ATOM 0 HB VAL A 13 -15.813 -0.286 -1.690 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -15.613 -2.447 -2.848 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -14.238 -1.375 -3.207 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -14.041 -2.720 -2.058 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -16.765 -2.311 -0.667 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -15.241 -2.578 0.213 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -16.229 -1.140 0.561 1.00 0.00 H new ATOM 169 N GLY A 14 -14.698 1.936 -0.474 1.00 0.00 N ATOM 170 CA GLY A 14 -15.154 3.111 0.245 1.00 0.00 C ATOM 171 C GLY A 14 -16.484 2.888 0.937 1.00 0.00 C ATOM 172 O GLY A 14 -16.985 3.769 1.636 1.00 0.00 O ATOM 0 H GLY A 14 -14.649 2.046 -1.487 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -14.406 3.393 0.986 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -15.245 3.946 -0.450 1.00 0.00 H new ATOM 176 N LYS A 15 -17.060 1.707 0.741 1.00 0.00 N ATOM 177 CA LYS A 15 -18.340 1.369 1.351 1.00 0.00 C ATOM 178 C LYS A 15 -18.137 0.661 2.686 1.00 0.00 C ATOM 179 O LYS A 15 -18.786 0.989 3.678 1.00 0.00 O ATOM 180 CB LYS A 15 -19.158 0.481 0.410 1.00 0.00 C ATOM 181 CG LYS A 15 -20.600 0.295 0.849 1.00 0.00 C ATOM 182 CD LYS A 15 -21.356 -0.627 -0.094 1.00 0.00 C ATOM 183 CE LYS A 15 -21.671 0.063 -1.412 1.00 0.00 C ATOM 184 NZ LYS A 15 -22.458 -0.815 -2.323 1.00 0.00 N ATOM 0 H LYS A 15 -16.660 0.967 0.164 1.00 0.00 H new ATOM 0 HA LYS A 15 -18.884 2.296 1.531 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -19.145 0.916 -0.589 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -18.680 -0.496 0.339 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -20.624 -0.116 1.858 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -21.097 1.264 0.888 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -20.763 -1.522 -0.283 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -22.283 -0.952 0.378 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -22.229 0.979 -1.218 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -20.741 0.354 -1.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -22.653 -0.309 -3.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -21.915 -1.678 -2.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -23.357 -1.072 -1.867 1.00 0.00 H new ATOM 198 N ASN A 16 -17.231 -0.312 2.704 1.00 0.00 N ATOM 199 CA ASN A 16 -16.943 -1.065 3.918 1.00 0.00 C ATOM 200 C ASN A 16 -15.461 -0.979 4.273 1.00 0.00 C ATOM 201 O ASN A 16 -14.924 -1.850 4.958 1.00 0.00 O ATOM 202 CB ASN A 16 -17.352 -2.529 3.745 1.00 0.00 C ATOM 203 CG ASN A 16 -16.551 -3.230 2.664 1.00 0.00 C ATOM 204 OD1 ASN A 16 -17.042 -3.449 1.556 1.00 0.00 O ATOM 205 ND2 ASN A 16 -15.312 -3.585 2.983 1.00 0.00 N ATOM 0 H ASN A 16 -16.684 -0.597 1.891 1.00 0.00 H new ATOM 0 HA ASN A 16 -17.520 -0.627 4.732 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -17.219 -3.055 4.691 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -18.413 -2.580 3.498 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -14.725 -4.060 2.297 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -14.947 -3.383 3.914 1.00 0.00 H new ATOM 212 N PHE A 17 -14.806 0.077 3.802 1.00 0.00 N ATOM 213 CA PHE A 17 -13.387 0.278 4.069 1.00 0.00 C ATOM 214 C PHE A 17 -13.100 0.211 5.566 1.00 0.00 C ATOM 215 O PHE A 17 -12.403 -0.688 6.035 1.00 0.00 O ATOM 216 CB PHE A 17 -12.927 1.625 3.509 1.00 0.00 C ATOM 217 CG PHE A 17 -11.703 2.170 4.189 1.00 0.00 C ATOM 218 CD1 PHE A 17 -10.467 1.571 4.005 1.00 0.00 C ATOM 219 CD2 PHE A 17 -11.788 3.282 5.011 1.00 0.00 C ATOM 220 CE1 PHE A 17 -9.340 2.070 4.629 1.00 0.00 C ATOM 221 CE2 PHE A 17 -10.664 3.786 5.638 1.00 0.00 C ATOM 222 CZ PHE A 17 -9.438 3.179 5.446 1.00 0.00 C ATOM 0 H PHE A 17 -15.236 0.807 3.233 1.00 0.00 H new ATOM 0 HA PHE A 17 -12.833 -0.521 3.575 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -12.723 1.516 2.444 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -13.738 2.346 3.606 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -10.384 0.704 3.366 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -12.744 3.761 5.164 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -8.383 1.593 4.478 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -10.744 4.653 6.277 1.00 0.00 H new ATOM 0 HZ PHE A 17 -8.558 3.571 5.934 1.00 0.00 H new ATOM 232 N GLU A 18 -13.642 1.171 6.310 1.00 0.00 N ATOM 233 CA GLU A 18 -13.443 1.222 7.753 1.00 0.00 C ATOM 234 C GLU A 18 -13.919 -0.069 8.414 1.00 0.00 C ATOM 235 O GLU A 18 -13.352 -0.513 9.413 1.00 0.00 O ATOM 236 CB GLU A 18 -14.187 2.418 8.351 1.00 0.00 C ATOM 237 CG GLU A 18 -13.826 3.744 7.704 1.00 0.00 C ATOM 238 CD GLU A 18 -14.534 4.920 8.349 1.00 0.00 C ATOM 239 OE1 GLU A 18 -14.510 5.017 9.594 1.00 0.00 O ATOM 240 OE2 GLU A 18 -15.112 5.742 7.608 1.00 0.00 O ATOM 0 H GLU A 18 -14.222 1.923 5.937 1.00 0.00 H new ATOM 0 HA GLU A 18 -12.376 1.335 7.943 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -15.260 2.255 8.251 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -13.971 2.473 9.418 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -12.748 3.894 7.768 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -14.080 3.708 6.645 1.00 0.00 H new ATOM 247 N ASP A 19 -14.962 -0.666 7.849 1.00 0.00 N ATOM 248 CA ASP A 19 -15.515 -1.906 8.382 1.00 0.00 C ATOM 249 C ASP A 19 -14.446 -2.993 8.448 1.00 0.00 C ATOM 250 O ASP A 19 -14.369 -3.744 9.420 1.00 0.00 O ATOM 251 CB ASP A 19 -16.687 -2.378 7.521 1.00 0.00 C ATOM 252 CG ASP A 19 -17.993 -1.709 7.904 1.00 0.00 C ATOM 253 OD1 ASP A 19 -18.128 -1.299 9.076 1.00 0.00 O ATOM 254 OD2 ASP A 19 -18.879 -1.596 7.032 1.00 0.00 O ATOM 0 H ASP A 19 -15.442 -0.312 7.022 1.00 0.00 H new ATOM 0 HA ASP A 19 -15.873 -1.711 9.393 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -16.470 -2.172 6.473 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -16.793 -3.458 7.618 1.00 0.00 H new ATOM 259 N VAL A 20 -13.624 -3.071 7.407 1.00 0.00 N ATOM 260 CA VAL A 20 -12.559 -4.066 7.346 1.00 0.00 C ATOM 261 C VAL A 20 -11.214 -3.455 7.724 1.00 0.00 C ATOM 262 O VAL A 20 -10.568 -3.893 8.675 1.00 0.00 O ATOM 263 CB VAL A 20 -12.452 -4.688 5.941 1.00 0.00 C ATOM 264 CG1 VAL A 20 -11.265 -5.636 5.866 1.00 0.00 C ATOM 265 CG2 VAL A 20 -13.742 -5.407 5.577 1.00 0.00 C ATOM 0 H VAL A 20 -13.675 -2.457 6.594 1.00 0.00 H new ATOM 0 HA VAL A 20 -12.814 -4.847 8.062 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.293 -3.887 5.219 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -11.205 -6.066 4.866 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -10.348 -5.088 6.081 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -11.390 -6.434 6.597 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -13.649 -5.840 4.581 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -13.934 -6.199 6.301 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -14.569 -4.698 5.588 1.00 0.00 H new ATOM 275 N ALA A 21 -10.799 -2.441 6.972 1.00 0.00 N ATOM 276 CA ALA A 21 -9.532 -1.768 7.229 1.00 0.00 C ATOM 277 C ALA A 21 -9.345 -1.500 8.718 1.00 0.00 C ATOM 278 O ALA A 21 -8.354 -1.920 9.316 1.00 0.00 O ATOM 279 CB ALA A 21 -9.456 -0.468 6.443 1.00 0.00 C ATOM 0 H ALA A 21 -11.322 -2.068 6.180 1.00 0.00 H new ATOM 0 HA ALA A 21 -8.727 -2.425 6.901 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -8.504 0.024 6.645 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -9.535 -0.682 5.377 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -10.274 0.187 6.743 1.00 0.00 H new ATOM 285 N PHE A 22 -10.304 -0.797 9.313 1.00 0.00 N ATOM 286 CA PHE A 22 -10.244 -0.471 10.733 1.00 0.00 C ATOM 287 C PHE A 22 -10.837 -1.596 11.575 1.00 0.00 C ATOM 288 O PHE A 22 -12.038 -1.618 11.845 1.00 0.00 O ATOM 289 CB PHE A 22 -10.990 0.836 11.009 1.00 0.00 C ATOM 290 CG PHE A 22 -10.175 2.064 10.723 1.00 0.00 C ATOM 291 CD1 PHE A 22 -9.063 2.368 11.492 1.00 0.00 C ATOM 292 CD2 PHE A 22 -10.520 2.915 9.686 1.00 0.00 C ATOM 293 CE1 PHE A 22 -8.311 3.498 11.231 1.00 0.00 C ATOM 294 CE2 PHE A 22 -9.772 4.047 9.420 1.00 0.00 C ATOM 295 CZ PHE A 22 -8.666 4.338 10.193 1.00 0.00 C ATOM 0 H PHE A 22 -11.132 -0.442 8.834 1.00 0.00 H new ATOM 0 HA PHE A 22 -9.196 -0.349 11.009 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -11.896 0.862 10.404 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -11.303 0.853 12.053 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -8.781 1.715 12.304 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -11.384 2.692 9.078 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -7.447 3.724 11.838 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -10.053 4.702 8.609 1.00 0.00 H new ATOM 0 HZ PHE A 22 -8.079 5.221 9.987 1.00 0.00 H new ATOM 305 N ASP A 23 -9.986 -2.530 11.986 1.00 0.00 N ATOM 306 CA ASP A 23 -10.425 -3.660 12.798 1.00 0.00 C ATOM 307 C ASP A 23 -9.616 -3.748 14.088 1.00 0.00 C ATOM 308 O ASP A 23 -8.386 -3.713 14.064 1.00 0.00 O ATOM 309 CB ASP A 23 -10.293 -4.964 12.009 1.00 0.00 C ATOM 310 CG ASP A 23 -11.425 -5.158 11.019 1.00 0.00 C ATOM 311 OD1 ASP A 23 -12.471 -4.494 11.176 1.00 0.00 O ATOM 312 OD2 ASP A 23 -11.264 -5.973 10.087 1.00 0.00 O ATOM 0 H ASP A 23 -8.989 -2.527 11.771 1.00 0.00 H new ATOM 0 HA ASP A 23 -11.473 -3.505 13.057 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -9.343 -4.968 11.475 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -10.273 -5.805 12.703 1.00 0.00 H new ATOM 317 N GLU A 24 -10.315 -3.861 15.213 1.00 0.00 N ATOM 318 CA GLU A 24 -9.661 -3.952 16.513 1.00 0.00 C ATOM 319 C GLU A 24 -8.985 -5.309 16.688 1.00 0.00 C ATOM 320 O GLU A 24 -9.455 -6.321 16.168 1.00 0.00 O ATOM 321 CB GLU A 24 -10.676 -3.727 17.636 1.00 0.00 C ATOM 322 CG GLU A 24 -10.137 -4.055 19.018 1.00 0.00 C ATOM 323 CD GLU A 24 -9.290 -2.938 19.595 1.00 0.00 C ATOM 324 OE1 GLU A 24 -8.701 -2.172 18.803 1.00 0.00 O ATOM 325 OE2 GLU A 24 -9.215 -2.829 20.836 1.00 0.00 O ATOM 0 H GLU A 24 -11.334 -3.892 15.250 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.897 -3.176 16.562 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.999 -2.686 17.619 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.558 -4.338 17.445 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -10.971 -4.258 19.690 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -9.542 -4.967 18.965 1.00 0.00 H new ATOM 332 N LYS A 25 -7.878 -5.321 17.423 1.00 0.00 N ATOM 333 CA LYS A 25 -7.136 -6.552 17.669 1.00 0.00 C ATOM 334 C LYS A 25 -6.673 -7.179 16.358 1.00 0.00 C ATOM 335 O LYS A 25 -6.510 -8.396 16.263 1.00 0.00 O ATOM 336 CB LYS A 25 -8.001 -7.547 18.445 1.00 0.00 C ATOM 337 CG LYS A 25 -7.974 -7.333 19.949 1.00 0.00 C ATOM 338 CD LYS A 25 -6.738 -7.953 20.578 1.00 0.00 C ATOM 339 CE LYS A 25 -6.635 -7.612 22.057 1.00 0.00 C ATOM 340 NZ LYS A 25 -7.444 -8.538 22.897 1.00 0.00 N ATOM 0 H LYS A 25 -7.475 -4.492 17.859 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.257 -6.304 18.263 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.030 -7.472 18.094 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -7.662 -8.559 18.224 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -7.997 -6.265 20.166 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.868 -7.768 20.396 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -6.770 -9.036 20.454 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -5.847 -7.599 20.059 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -5.591 -7.657 22.368 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -6.972 -6.588 22.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -7.347 -8.273 23.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -8.444 -8.476 22.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -7.106 -9.513 22.763 1.00 0.00 H new ATOM 354 N LYS A 26 -6.462 -6.341 15.348 1.00 0.00 N ATOM 355 CA LYS A 26 -6.015 -6.812 14.043 1.00 0.00 C ATOM 356 C LYS A 26 -5.224 -5.730 13.315 1.00 0.00 C ATOM 357 O LYS A 26 -5.706 -4.612 13.134 1.00 0.00 O ATOM 358 CB LYS A 26 -7.214 -7.240 13.194 1.00 0.00 C ATOM 359 CG LYS A 26 -6.875 -7.466 11.731 1.00 0.00 C ATOM 360 CD LYS A 26 -6.333 -8.866 11.494 1.00 0.00 C ATOM 361 CE LYS A 26 -7.342 -9.930 11.900 1.00 0.00 C ATOM 362 NZ LYS A 26 -7.140 -10.378 13.306 1.00 0.00 N ATOM 0 H LYS A 26 -6.594 -5.331 15.409 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.363 -7.671 14.199 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -7.632 -8.158 13.607 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -7.989 -6.477 13.265 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -7.766 -7.312 11.122 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -6.138 -6.730 11.409 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -6.080 -8.986 10.441 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -5.412 -9.002 12.061 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -8.352 -9.535 11.786 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -7.257 -10.786 11.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -8.053 -10.378 13.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -6.743 -11.339 13.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -6.483 -9.730 13.786 1.00 0.00 H new ATOM 376 N ASN A 27 -4.009 -6.070 12.899 1.00 0.00 N ATOM 377 CA ASN A 27 -3.152 -5.126 12.190 1.00 0.00 C ATOM 378 C ASN A 27 -3.353 -5.236 10.681 1.00 0.00 C ATOM 379 O ASN A 27 -2.807 -6.130 10.035 1.00 0.00 O ATOM 380 CB ASN A 27 -1.684 -5.376 12.539 1.00 0.00 C ATOM 381 CG ASN A 27 -1.448 -5.435 14.036 1.00 0.00 C ATOM 382 OD1 ASN A 27 -1.243 -4.408 14.684 1.00 0.00 O ATOM 383 ND2 ASN A 27 -1.475 -6.640 14.593 1.00 0.00 N ATOM 0 H ASN A 27 -3.595 -6.992 13.040 1.00 0.00 H new ATOM 0 HA ASN A 27 -3.427 -4.119 12.503 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -1.360 -6.313 12.086 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -1.071 -4.584 12.108 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.322 -6.742 15.596 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -1.649 -7.464 14.018 1.00 0.00 H new ATOM 390 N VAL A 28 -4.141 -4.321 10.126 1.00 0.00 N ATOM 391 CA VAL A 28 -4.414 -4.313 8.694 1.00 0.00 C ATOM 392 C VAL A 28 -3.584 -3.250 7.983 1.00 0.00 C ATOM 393 O VAL A 28 -3.629 -2.072 8.338 1.00 0.00 O ATOM 394 CB VAL A 28 -5.906 -4.061 8.408 1.00 0.00 C ATOM 395 CG1 VAL A 28 -6.166 -4.037 6.910 1.00 0.00 C ATOM 396 CG2 VAL A 28 -6.764 -5.116 9.090 1.00 0.00 C ATOM 0 H VAL A 28 -4.602 -3.575 10.647 1.00 0.00 H new ATOM 0 HA VAL A 28 -4.141 -5.297 8.314 1.00 0.00 H new ATOM 0 HB VAL A 28 -6.177 -3.087 8.815 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -7.226 -3.858 6.727 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -5.579 -3.241 6.452 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -5.880 -4.995 6.476 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -7.815 -4.923 8.878 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -6.493 -6.103 8.715 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -6.599 -5.079 10.167 1.00 0.00 H new ATOM 406 N PHE A 29 -2.828 -3.673 6.975 1.00 0.00 N ATOM 407 CA PHE A 29 -1.987 -2.758 6.213 1.00 0.00 C ATOM 408 C PHE A 29 -2.631 -2.417 4.872 1.00 0.00 C ATOM 409 O PHE A 29 -2.559 -3.195 3.920 1.00 0.00 O ATOM 410 CB PHE A 29 -0.604 -3.371 5.986 1.00 0.00 C ATOM 411 CG PHE A 29 0.367 -2.433 5.327 1.00 0.00 C ATOM 412 CD1 PHE A 29 0.079 -1.083 5.216 1.00 0.00 C ATOM 413 CD2 PHE A 29 1.566 -2.903 4.817 1.00 0.00 C ATOM 414 CE1 PHE A 29 0.970 -0.217 4.610 1.00 0.00 C ATOM 415 CE2 PHE A 29 2.461 -2.042 4.210 1.00 0.00 C ATOM 416 CZ PHE A 29 2.162 -0.698 4.105 1.00 0.00 C ATOM 0 H PHE A 29 -2.781 -4.644 6.667 1.00 0.00 H new ATOM 0 HA PHE A 29 -1.879 -1.839 6.789 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -0.195 -3.690 6.945 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -0.708 -4.265 5.371 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -0.853 -0.702 5.608 1.00 0.00 H new ATOM 0 HD2 PHE A 29 1.804 -3.954 4.894 1.00 0.00 H new ATOM 0 HE1 PHE A 29 0.734 0.834 4.532 1.00 0.00 H new ATOM 0 HE2 PHE A 29 3.394 -2.420 3.818 1.00 0.00 H new ATOM 0 HZ PHE A 29 2.859 -0.024 3.629 1.00 0.00 H new ATOM 426 N VAL A 30 -3.261 -1.249 4.805 1.00 0.00 N ATOM 427 CA VAL A 30 -3.918 -0.803 3.582 1.00 0.00 C ATOM 428 C VAL A 30 -2.921 -0.157 2.627 1.00 0.00 C ATOM 429 O VAL A 30 -1.832 0.248 3.032 1.00 0.00 O ATOM 430 CB VAL A 30 -5.047 0.200 3.884 1.00 0.00 C ATOM 431 CG1 VAL A 30 -5.876 0.463 2.636 1.00 0.00 C ATOM 432 CG2 VAL A 30 -5.923 -0.310 5.018 1.00 0.00 C ATOM 0 H VAL A 30 -3.330 -0.594 5.584 1.00 0.00 H new ATOM 0 HA VAL A 30 -4.346 -1.689 3.112 1.00 0.00 H new ATOM 0 HB VAL A 30 -4.598 1.142 4.198 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -6.669 1.174 2.869 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -5.237 0.875 1.855 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -6.317 -0.471 2.289 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -6.716 0.411 5.218 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -6.365 -1.265 4.735 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.317 -0.442 5.915 1.00 0.00 H new ATOM 442 N GLU A 31 -3.302 -0.062 1.357 1.00 0.00 N ATOM 443 CA GLU A 31 -2.440 0.535 0.344 1.00 0.00 C ATOM 444 C GLU A 31 -3.257 1.353 -0.653 1.00 0.00 C ATOM 445 O GLU A 31 -3.939 0.799 -1.515 1.00 0.00 O ATOM 446 CB GLU A 31 -1.653 -0.550 -0.394 1.00 0.00 C ATOM 447 CG GLU A 31 -1.103 -0.098 -1.736 1.00 0.00 C ATOM 448 CD GLU A 31 -0.579 -1.251 -2.570 1.00 0.00 C ATOM 449 OE1 GLU A 31 -1.389 -1.884 -3.280 1.00 0.00 O ATOM 450 OE2 GLU A 31 0.639 -1.520 -2.514 1.00 0.00 O ATOM 0 H GLU A 31 -4.201 -0.391 1.005 1.00 0.00 H new ATOM 0 HA GLU A 31 -1.740 1.201 0.848 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.826 -0.879 0.236 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -2.299 -1.414 -0.548 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.886 0.419 -2.290 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.300 0.621 -1.572 1.00 0.00 H new ATOM 457 N PHE A 32 -3.183 2.674 -0.526 1.00 0.00 N ATOM 458 CA PHE A 32 -3.916 3.568 -1.414 1.00 0.00 C ATOM 459 C PHE A 32 -3.162 3.774 -2.724 1.00 0.00 C ATOM 460 O PHE A 32 -2.189 4.526 -2.782 1.00 0.00 O ATOM 461 CB PHE A 32 -4.152 4.918 -0.732 1.00 0.00 C ATOM 462 CG PHE A 32 -4.999 4.824 0.505 1.00 0.00 C ATOM 463 CD1 PHE A 32 -6.382 4.817 0.415 1.00 0.00 C ATOM 464 CD2 PHE A 32 -4.413 4.743 1.758 1.00 0.00 C ATOM 465 CE1 PHE A 32 -7.165 4.731 1.551 1.00 0.00 C ATOM 466 CE2 PHE A 32 -5.190 4.655 2.897 1.00 0.00 C ATOM 467 CZ PHE A 32 -6.568 4.651 2.794 1.00 0.00 C ATOM 0 H PHE A 32 -2.623 3.148 0.183 1.00 0.00 H new ATOM 0 HA PHE A 32 -4.878 3.107 -1.638 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -3.189 5.358 -0.471 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -4.630 5.595 -1.440 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -6.854 4.879 -0.555 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -3.337 4.749 1.845 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -8.242 4.726 1.467 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -4.721 4.589 3.867 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.177 4.585 3.684 1.00 0.00 H new ATOM 477 N TYR A 33 -3.617 3.098 -3.774 1.00 0.00 N ATOM 478 CA TYR A 33 -2.984 3.203 -5.083 1.00 0.00 C ATOM 479 C TYR A 33 -3.860 3.995 -6.050 1.00 0.00 C ATOM 480 O TYR A 33 -5.013 4.302 -5.750 1.00 0.00 O ATOM 481 CB TYR A 33 -2.707 1.810 -5.652 1.00 0.00 C ATOM 482 CG TYR A 33 -3.959 1.051 -6.030 1.00 0.00 C ATOM 483 CD1 TYR A 33 -4.624 1.317 -7.221 1.00 0.00 C ATOM 484 CD2 TYR A 33 -4.476 0.067 -5.197 1.00 0.00 C ATOM 485 CE1 TYR A 33 -5.768 0.626 -7.569 1.00 0.00 C ATOM 486 CE2 TYR A 33 -5.619 -0.630 -5.538 1.00 0.00 C ATOM 487 CZ TYR A 33 -6.262 -0.347 -6.725 1.00 0.00 C ATOM 488 OH TYR A 33 -7.400 -1.038 -7.069 1.00 0.00 O ATOM 0 H TYR A 33 -4.422 2.472 -3.744 1.00 0.00 H new ATOM 0 HA TYR A 33 -2.039 3.733 -4.960 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -2.071 1.906 -6.532 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -2.149 1.231 -4.917 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -4.240 2.077 -7.885 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -3.976 -0.157 -4.266 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -6.274 0.846 -8.498 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -6.007 -1.392 -4.879 1.00 0.00 H new ATOM 0 HH TYR A 33 -7.613 -1.688 -6.367 1.00 0.00 H new ATOM 498 N ALA A 34 -3.302 4.321 -7.211 1.00 0.00 N ATOM 499 CA ALA A 34 -4.031 5.074 -8.224 1.00 0.00 C ATOM 500 C ALA A 34 -3.968 4.377 -9.578 1.00 0.00 C ATOM 501 O ALA A 34 -2.917 3.903 -10.010 1.00 0.00 O ATOM 502 CB ALA A 34 -3.479 6.488 -8.329 1.00 0.00 C ATOM 0 H ALA A 34 -2.347 4.075 -7.473 1.00 0.00 H new ATOM 0 HA ALA A 34 -5.077 5.126 -7.921 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -4.033 7.039 -9.089 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.583 6.991 -7.368 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.425 6.448 -8.605 1.00 0.00 H new ATOM 508 N PRO A 35 -5.118 4.312 -10.266 1.00 0.00 N ATOM 509 CA PRO A 35 -5.218 3.674 -11.582 1.00 0.00 C ATOM 510 C PRO A 35 -4.500 4.469 -12.667 1.00 0.00 C ATOM 511 O PRO A 35 -4.426 4.039 -13.818 1.00 0.00 O ATOM 512 CB PRO A 35 -6.725 3.646 -11.848 1.00 0.00 C ATOM 513 CG PRO A 35 -7.274 4.769 -11.038 1.00 0.00 C ATOM 514 CD PRO A 35 -6.408 4.857 -9.812 1.00 0.00 C ATOM 0 HA PRO A 35 -4.751 2.689 -11.595 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -6.942 3.779 -12.908 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -7.162 2.693 -11.550 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -7.251 5.703 -11.600 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -8.314 4.584 -10.769 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -6.309 5.885 -9.463 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -6.821 4.278 -8.986 1.00 0.00 H new ATOM 522 N TRP A 36 -3.972 5.629 -12.294 1.00 0.00 N ATOM 523 CA TRP A 36 -3.259 6.483 -13.236 1.00 0.00 C ATOM 524 C TRP A 36 -1.845 6.773 -12.746 1.00 0.00 C ATOM 525 O TRP A 36 -1.043 7.378 -13.459 1.00 0.00 O ATOM 526 CB TRP A 36 -4.019 7.794 -13.444 1.00 0.00 C ATOM 527 CG TRP A 36 -4.795 8.228 -12.237 1.00 0.00 C ATOM 528 CD1 TRP A 36 -6.116 7.990 -11.983 1.00 0.00 C ATOM 529 CD2 TRP A 36 -4.298 8.977 -11.123 1.00 0.00 C ATOM 530 NE1 TRP A 36 -6.470 8.546 -10.777 1.00 0.00 N ATOM 531 CE2 TRP A 36 -5.373 9.156 -10.229 1.00 0.00 C ATOM 532 CE3 TRP A 36 -3.051 9.512 -10.791 1.00 0.00 C ATOM 533 CZ2 TRP A 36 -5.235 9.848 -9.029 1.00 0.00 C ATOM 534 CZ3 TRP A 36 -2.915 10.199 -9.600 1.00 0.00 C ATOM 535 CH2 TRP A 36 -4.002 10.362 -8.730 1.00 0.00 C ATOM 0 H TRP A 36 -4.024 6.000 -11.345 1.00 0.00 H new ATOM 0 HA TRP A 36 -3.192 5.955 -14.187 1.00 0.00 H new ATOM 0 HB2 TRP A 36 -3.311 8.578 -13.713 1.00 0.00 H new ATOM 0 HB3 TRP A 36 -4.703 7.680 -14.285 1.00 0.00 H new ATOM 0 HD1 TRP A 36 -6.784 7.445 -12.634 1.00 0.00 H new ATOM 0 HE1 TRP A 36 -7.399 8.510 -10.358 1.00 0.00 H new ATOM 0 HE3 TRP A 36 -2.207 9.391 -11.454 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 -6.071 9.975 -8.358 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 -1.955 10.617 -9.335 1.00 0.00 H new ATOM 0 HH2 TRP A 36 -3.864 10.904 -7.806 1.00 0.00 H new ATOM 546 N CYS A 37 -1.545 6.339 -11.527 1.00 0.00 N ATOM 547 CA CYS A 37 -0.226 6.553 -10.942 1.00 0.00 C ATOM 548 C CYS A 37 0.761 5.496 -11.426 1.00 0.00 C ATOM 549 O CYS A 37 0.574 4.303 -11.191 1.00 0.00 O ATOM 550 CB CYS A 37 -0.313 6.527 -9.415 1.00 0.00 C ATOM 551 SG CYS A 37 1.294 6.520 -8.585 1.00 0.00 S ATOM 0 H CYS A 37 -2.197 5.837 -10.924 1.00 0.00 H new ATOM 0 HA CYS A 37 0.132 7.532 -11.262 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -0.880 7.395 -9.079 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -0.872 5.643 -9.108 1.00 0.00 H new ATOM 0 HG CYS A 37 1.326 5.559 -7.710 1.00 0.00 H new ATOM 557 N GLY A 38 1.813 5.944 -12.105 1.00 0.00 N ATOM 558 CA GLY A 38 2.814 5.024 -12.613 1.00 0.00 C ATOM 559 C GLY A 38 3.515 4.260 -11.507 1.00 0.00 C ATOM 560 O GLY A 38 3.430 3.034 -11.439 1.00 0.00 O ATOM 0 H GLY A 38 1.990 6.927 -12.312 1.00 0.00 H new ATOM 0 HA2 GLY A 38 2.341 4.317 -13.295 1.00 0.00 H new ATOM 0 HA3 GLY A 38 3.553 5.579 -13.191 1.00 0.00 H new ATOM 564 N HIS A 39 4.211 4.986 -10.638 1.00 0.00 N ATOM 565 CA HIS A 39 4.931 4.369 -9.530 1.00 0.00 C ATOM 566 C HIS A 39 4.110 3.242 -8.909 1.00 0.00 C ATOM 567 O HIS A 39 4.661 2.251 -8.429 1.00 0.00 O ATOM 568 CB HIS A 39 5.268 5.415 -8.467 1.00 0.00 C ATOM 569 CG HIS A 39 6.230 6.461 -8.940 1.00 0.00 C ATOM 570 ND1 HIS A 39 7.591 6.252 -9.016 1.00 0.00 N ATOM 571 CD2 HIS A 39 6.021 7.729 -9.365 1.00 0.00 C ATOM 572 CE1 HIS A 39 8.178 7.347 -9.465 1.00 0.00 C ATOM 573 NE2 HIS A 39 7.247 8.258 -9.685 1.00 0.00 N ATOM 0 H HIS A 39 4.292 6.002 -10.680 1.00 0.00 H new ATOM 0 HA HIS A 39 5.857 3.948 -9.921 1.00 0.00 H new ATOM 0 HB2 HIS A 39 4.348 5.900 -8.142 1.00 0.00 H new ATOM 0 HB3 HIS A 39 5.689 4.913 -7.596 1.00 0.00 H new ATOM 0 HD2 HIS A 39 5.068 8.231 -9.439 1.00 0.00 H new ATOM 0 HE1 HIS A 39 9.238 7.476 -9.625 1.00 0.00 H new ATOM 0 HE2 HIS A 39 7.412 9.201 -10.036 1.00 0.00 H new ATOM 582 N CYS A 40 2.791 3.402 -8.922 1.00 0.00 N ATOM 583 CA CYS A 40 1.894 2.399 -8.359 1.00 0.00 C ATOM 584 C CYS A 40 1.962 1.100 -9.155 1.00 0.00 C ATOM 585 O CYS A 40 2.030 0.011 -8.584 1.00 0.00 O ATOM 586 CB CYS A 40 0.458 2.923 -8.337 1.00 0.00 C ATOM 587 SG CYS A 40 0.015 3.801 -6.819 1.00 0.00 S ATOM 0 H CYS A 40 2.319 4.216 -9.316 1.00 0.00 H new ATOM 0 HA CYS A 40 2.214 2.195 -7.337 1.00 0.00 H new ATOM 0 HB2 CYS A 40 0.314 3.591 -9.186 1.00 0.00 H new ATOM 0 HB3 CYS A 40 -0.225 2.085 -8.472 1.00 0.00 H new ATOM 0 HG CYS A 40 -0.062 2.955 -5.835 1.00 0.00 H new ATOM 593 N LYS A 41 1.943 1.222 -10.478 1.00 0.00 N ATOM 594 CA LYS A 41 2.002 0.058 -11.355 1.00 0.00 C ATOM 595 C LYS A 41 3.067 -0.926 -10.882 1.00 0.00 C ATOM 596 O LYS A 41 2.918 -2.137 -11.040 1.00 0.00 O ATOM 597 CB LYS A 41 2.295 0.492 -12.793 1.00 0.00 C ATOM 598 CG LYS A 41 1.058 0.918 -13.565 1.00 0.00 C ATOM 599 CD LYS A 41 0.916 2.430 -13.600 1.00 0.00 C ATOM 600 CE LYS A 41 -0.510 2.848 -13.926 1.00 0.00 C ATOM 601 NZ LYS A 41 -1.470 2.413 -12.874 1.00 0.00 N ATOM 0 H LYS A 41 1.887 2.116 -10.967 1.00 0.00 H new ATOM 0 HA LYS A 41 1.033 -0.440 -11.323 1.00 0.00 H new ATOM 0 HB2 LYS A 41 3.005 1.319 -12.776 1.00 0.00 H new ATOM 0 HB3 LYS A 41 2.777 -0.331 -13.321 1.00 0.00 H new ATOM 0 HG2 LYS A 41 1.113 0.533 -14.583 1.00 0.00 H new ATOM 0 HG3 LYS A 41 0.172 0.479 -13.106 1.00 0.00 H new ATOM 0 HD2 LYS A 41 1.207 2.846 -12.636 1.00 0.00 H new ATOM 0 HD3 LYS A 41 1.597 2.843 -14.344 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -0.555 3.932 -14.033 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -0.804 2.420 -14.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -2.014 3.234 -12.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -2.120 1.704 -13.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -0.947 1.997 -12.077 1.00 0.00 H new ATOM 615 N GLN A 42 4.138 -0.397 -10.301 1.00 0.00 N ATOM 616 CA GLN A 42 5.227 -1.231 -9.805 1.00 0.00 C ATOM 617 C GLN A 42 4.869 -1.849 -8.458 1.00 0.00 C ATOM 618 O GLN A 42 5.343 -2.933 -8.114 1.00 0.00 O ATOM 619 CB GLN A 42 6.510 -0.407 -9.676 1.00 0.00 C ATOM 620 CG GLN A 42 7.037 0.109 -11.005 1.00 0.00 C ATOM 621 CD GLN A 42 7.752 -0.962 -11.806 1.00 0.00 C ATOM 622 OE1 GLN A 42 7.736 -2.139 -11.442 1.00 0.00 O ATOM 623 NE2 GLN A 42 8.383 -0.560 -12.902 1.00 0.00 N ATOM 0 H GLN A 42 4.276 0.604 -10.162 1.00 0.00 H new ATOM 0 HA GLN A 42 5.390 -2.036 -10.522 1.00 0.00 H new ATOM 0 HB2 GLN A 42 6.323 0.439 -9.015 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.278 -1.018 -9.202 1.00 0.00 H new ATOM 0 HG2 GLN A 42 6.207 0.503 -11.592 1.00 0.00 H new ATOM 0 HG3 GLN A 42 7.721 0.938 -10.823 1.00 0.00 H new ATOM 0 HE21 GLN A 42 8.370 0.425 -13.166 1.00 0.00 H new ATOM 0 HE22 GLN A 42 8.881 -1.236 -13.481 1.00 0.00 H new ATOM 632 N LEU A 43 4.029 -1.154 -7.698 1.00 0.00 N ATOM 633 CA LEU A 43 3.606 -1.635 -6.387 1.00 0.00 C ATOM 634 C LEU A 43 2.550 -2.727 -6.522 1.00 0.00 C ATOM 635 O LEU A 43 2.438 -3.605 -5.667 1.00 0.00 O ATOM 636 CB LEU A 43 3.057 -0.478 -5.551 1.00 0.00 C ATOM 637 CG LEU A 43 3.163 -0.637 -4.034 1.00 0.00 C ATOM 638 CD1 LEU A 43 4.620 -0.715 -3.606 1.00 0.00 C ATOM 639 CD2 LEU A 43 2.458 0.511 -3.327 1.00 0.00 C ATOM 0 H LEU A 43 3.628 -0.256 -7.967 1.00 0.00 H new ATOM 0 HA LEU A 43 4.476 -2.058 -5.884 1.00 0.00 H new ATOM 0 HB2 LEU A 43 3.582 0.433 -5.838 1.00 0.00 H new ATOM 0 HB3 LEU A 43 2.008 -0.336 -5.809 1.00 0.00 H new ATOM 0 HG LEU A 43 2.672 -1.568 -3.750 1.00 0.00 H new ATOM 0 HD11 LEU A 43 4.676 -0.828 -2.523 1.00 0.00 H new ATOM 0 HD12 LEU A 43 5.095 -1.571 -4.085 1.00 0.00 H new ATOM 0 HD13 LEU A 43 5.136 0.198 -3.902 1.00 0.00 H new ATOM 0 HD21 LEU A 43 2.544 0.381 -2.248 1.00 0.00 H new ATOM 0 HD22 LEU A 43 2.919 1.455 -3.617 1.00 0.00 H new ATOM 0 HD23 LEU A 43 1.405 0.520 -3.609 1.00 0.00 H new ATOM 651 N ALA A 44 1.779 -2.667 -7.603 1.00 0.00 N ATOM 652 CA ALA A 44 0.734 -3.652 -7.852 1.00 0.00 C ATOM 653 C ALA A 44 1.207 -5.056 -7.491 1.00 0.00 C ATOM 654 O ALA A 44 0.589 -5.759 -6.690 1.00 0.00 O ATOM 655 CB ALA A 44 0.295 -3.599 -9.308 1.00 0.00 C ATOM 0 H ALA A 44 1.859 -1.946 -8.320 1.00 0.00 H new ATOM 0 HA ALA A 44 -0.119 -3.409 -7.218 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -0.486 -4.340 -9.480 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -0.091 -2.605 -9.536 1.00 0.00 H new ATOM 0 HB3 ALA A 44 1.147 -3.814 -9.953 1.00 0.00 H new ATOM 661 N PRO A 45 2.329 -5.477 -8.094 1.00 0.00 N ATOM 662 CA PRO A 45 2.909 -6.802 -7.851 1.00 0.00 C ATOM 663 C PRO A 45 3.498 -6.928 -6.451 1.00 0.00 C ATOM 664 O PRO A 45 3.190 -7.871 -5.721 1.00 0.00 O ATOM 665 CB PRO A 45 4.013 -6.904 -8.907 1.00 0.00 C ATOM 666 CG PRO A 45 4.382 -5.493 -9.208 1.00 0.00 C ATOM 667 CD PRO A 45 3.117 -4.693 -9.060 1.00 0.00 C ATOM 0 HA PRO A 45 2.162 -7.593 -7.917 1.00 0.00 H new ATOM 0 HB2 PRO A 45 4.869 -7.465 -8.532 1.00 0.00 H new ATOM 0 HB3 PRO A 45 3.660 -7.420 -9.800 1.00 0.00 H new ATOM 0 HG2 PRO A 45 5.151 -5.136 -8.523 1.00 0.00 H new ATOM 0 HG3 PRO A 45 4.786 -5.402 -10.216 1.00 0.00 H new ATOM 0 HD2 PRO A 45 3.318 -3.687 -8.692 1.00 0.00 H new ATOM 0 HD3 PRO A 45 2.596 -4.586 -10.011 1.00 0.00 H new ATOM 675 N ILE A 46 4.346 -5.974 -6.082 1.00 0.00 N ATOM 676 CA ILE A 46 4.976 -5.979 -4.768 1.00 0.00 C ATOM 677 C ILE A 46 3.932 -6.024 -3.657 1.00 0.00 C ATOM 678 O ILE A 46 4.200 -6.513 -2.560 1.00 0.00 O ATOM 679 CB ILE A 46 5.869 -4.740 -4.567 1.00 0.00 C ATOM 680 CG1 ILE A 46 6.893 -4.634 -5.698 1.00 0.00 C ATOM 681 CG2 ILE A 46 6.568 -4.804 -3.217 1.00 0.00 C ATOM 682 CD1 ILE A 46 7.281 -3.210 -6.031 1.00 0.00 C ATOM 0 H ILE A 46 4.612 -5.188 -6.675 1.00 0.00 H new ATOM 0 HA ILE A 46 5.595 -6.875 -4.719 1.00 0.00 H new ATOM 0 HB ILE A 46 5.240 -3.850 -4.587 1.00 0.00 H new ATOM 0 HG12 ILE A 46 7.788 -5.190 -5.420 1.00 0.00 H new ATOM 0 HG13 ILE A 46 6.487 -5.109 -6.591 1.00 0.00 H new ATOM 0 HG21 ILE A 46 7.195 -3.922 -3.090 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.823 -4.837 -2.422 1.00 0.00 H new ATOM 0 HG23 ILE A 46 7.188 -5.699 -3.170 1.00 0.00 H new ATOM 0 HD11 ILE A 46 8.010 -3.212 -6.841 1.00 0.00 H new ATOM 0 HD12 ILE A 46 6.396 -2.655 -6.340 1.00 0.00 H new ATOM 0 HD13 ILE A 46 7.717 -2.737 -5.151 1.00 0.00 H new ATOM 694 N TRP A 47 2.742 -5.514 -3.951 1.00 0.00 N ATOM 695 CA TRP A 47 1.656 -5.498 -2.977 1.00 0.00 C ATOM 696 C TRP A 47 0.848 -6.789 -3.042 1.00 0.00 C ATOM 697 O TRP A 47 0.298 -7.239 -2.037 1.00 0.00 O ATOM 698 CB TRP A 47 0.741 -4.297 -3.222 1.00 0.00 C ATOM 699 CG TRP A 47 -0.164 -3.994 -2.067 1.00 0.00 C ATOM 700 CD1 TRP A 47 -1.525 -4.102 -2.043 1.00 0.00 C ATOM 701 CD2 TRP A 47 0.227 -3.532 -0.770 1.00 0.00 C ATOM 702 NE1 TRP A 47 -2.004 -3.735 -0.808 1.00 0.00 N ATOM 703 CE2 TRP A 47 -0.949 -3.382 -0.009 1.00 0.00 C ATOM 704 CE3 TRP A 47 1.456 -3.232 -0.176 1.00 0.00 C ATOM 705 CZ2 TRP A 47 -0.929 -2.945 1.313 1.00 0.00 C ATOM 706 CZ3 TRP A 47 1.474 -2.798 1.136 1.00 0.00 C ATOM 707 CH2 TRP A 47 0.288 -2.658 1.869 1.00 0.00 C ATOM 0 H TRP A 47 2.504 -5.106 -4.855 1.00 0.00 H new ATOM 0 HA TRP A 47 2.095 -5.415 -1.983 1.00 0.00 H new ATOM 0 HB2 TRP A 47 1.353 -3.420 -3.434 1.00 0.00 H new ATOM 0 HB3 TRP A 47 0.136 -4.485 -4.109 1.00 0.00 H new ATOM 0 HD1 TRP A 47 -2.135 -4.428 -2.872 1.00 0.00 H new ATOM 0 HE1 TRP A 47 -2.986 -3.727 -0.531 1.00 0.00 H new ATOM 0 HE3 TRP A 47 2.376 -3.337 -0.733 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 -1.842 -2.836 1.880 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 2.418 -2.563 1.604 1.00 0.00 H new ATOM 0 HH2 TRP A 47 0.335 -2.317 2.893 1.00 0.00 H new ATOM 718 N ASP A 48 0.781 -7.381 -4.229 1.00 0.00 N ATOM 719 CA ASP A 48 0.041 -8.623 -4.424 1.00 0.00 C ATOM 720 C ASP A 48 0.865 -9.824 -3.971 1.00 0.00 C ATOM 721 O ASP A 48 0.326 -10.902 -3.721 1.00 0.00 O ATOM 722 CB ASP A 48 -0.351 -8.783 -5.894 1.00 0.00 C ATOM 723 CG ASP A 48 -1.751 -8.276 -6.178 1.00 0.00 C ATOM 724 OD1 ASP A 48 -2.692 -8.708 -5.479 1.00 0.00 O ATOM 725 OD2 ASP A 48 -1.906 -7.447 -7.099 1.00 0.00 O ATOM 0 H ASP A 48 1.230 -7.021 -5.071 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.864 -8.577 -3.818 1.00 0.00 H new ATOM 0 HB2 ASP A 48 0.361 -8.243 -6.518 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.285 -9.835 -6.172 1.00 0.00 H new ATOM 730 N LYS A 49 2.176 -9.630 -3.868 1.00 0.00 N ATOM 731 CA LYS A 49 3.076 -10.696 -3.444 1.00 0.00 C ATOM 732 C LYS A 49 3.202 -10.731 -1.925 1.00 0.00 C ATOM 733 O LYS A 49 3.489 -11.776 -1.339 1.00 0.00 O ATOM 734 CB LYS A 49 4.457 -10.507 -4.077 1.00 0.00 C ATOM 735 CG LYS A 49 4.569 -11.086 -5.477 1.00 0.00 C ATOM 736 CD LYS A 49 5.579 -10.323 -6.317 1.00 0.00 C ATOM 737 CE LYS A 49 6.998 -10.806 -6.058 1.00 0.00 C ATOM 738 NZ LYS A 49 7.911 -10.475 -7.187 1.00 0.00 N ATOM 0 H LYS A 49 2.639 -8.744 -4.072 1.00 0.00 H new ATOM 0 HA LYS A 49 2.657 -11.645 -3.777 1.00 0.00 H new ATOM 0 HB2 LYS A 49 4.688 -9.442 -4.114 1.00 0.00 H new ATOM 0 HB3 LYS A 49 5.207 -10.974 -3.439 1.00 0.00 H new ATOM 0 HG2 LYS A 49 4.863 -12.134 -5.416 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.594 -11.056 -5.963 1.00 0.00 H new ATOM 0 HD2 LYS A 49 5.340 -10.443 -7.374 1.00 0.00 H new ATOM 0 HD3 LYS A 49 5.509 -9.258 -6.094 1.00 0.00 H new ATOM 0 HE2 LYS A 49 7.375 -10.352 -5.141 1.00 0.00 H new ATOM 0 HE3 LYS A 49 6.992 -11.885 -5.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 8.868 -10.821 -6.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 7.566 -10.929 -8.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 7.937 -9.444 -7.321 1.00 0.00 H new ATOM 752 N LEU A 50 2.984 -9.584 -1.291 1.00 0.00 N ATOM 753 CA LEU A 50 3.072 -9.484 0.161 1.00 0.00 C ATOM 754 C LEU A 50 1.749 -9.873 0.815 1.00 0.00 C ATOM 755 O LEU A 50 1.728 -10.449 1.902 1.00 0.00 O ATOM 756 CB LEU A 50 3.457 -8.061 0.572 1.00 0.00 C ATOM 757 CG LEU A 50 2.949 -7.596 1.937 1.00 0.00 C ATOM 758 CD1 LEU A 50 3.816 -8.161 3.050 1.00 0.00 C ATOM 759 CD2 LEU A 50 2.915 -6.076 2.003 1.00 0.00 C ATOM 0 H LEU A 50 2.745 -8.710 -1.760 1.00 0.00 H new ATOM 0 HA LEU A 50 3.843 -10.176 0.502 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.544 -7.984 0.566 1.00 0.00 H new ATOM 0 HB3 LEU A 50 3.084 -7.372 -0.186 1.00 0.00 H new ATOM 0 HG LEU A 50 1.934 -7.968 2.072 1.00 0.00 H new ATOM 0 HD11 LEU A 50 3.439 -7.819 4.014 1.00 0.00 H new ATOM 0 HD12 LEU A 50 3.789 -9.250 3.015 1.00 0.00 H new ATOM 0 HD13 LEU A 50 4.843 -7.819 2.920 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.551 -5.762 2.981 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.919 -5.682 1.846 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.250 -5.693 1.229 1.00 0.00 H new ATOM 771 N GLY A 51 0.647 -9.557 0.142 1.00 0.00 N ATOM 772 CA GLY A 51 -0.664 -9.883 0.672 1.00 0.00 C ATOM 773 C GLY A 51 -0.861 -11.375 0.855 1.00 0.00 C ATOM 774 O GLY A 51 -1.521 -11.809 1.798 1.00 0.00 O ATOM 0 H GLY A 51 0.639 -9.081 -0.760 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -0.800 -9.381 1.630 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -1.430 -9.498 -0.001 1.00 0.00 H new ATOM 778 N GLU A 52 -0.288 -12.161 -0.051 1.00 0.00 N ATOM 779 CA GLU A 52 -0.406 -13.613 0.015 1.00 0.00 C ATOM 780 C GLU A 52 0.410 -14.174 1.176 1.00 0.00 C ATOM 781 O GLU A 52 0.105 -15.242 1.706 1.00 0.00 O ATOM 782 CB GLU A 52 0.057 -14.245 -1.300 1.00 0.00 C ATOM 783 CG GLU A 52 1.563 -14.428 -1.390 1.00 0.00 C ATOM 784 CD GLU A 52 2.014 -14.883 -2.764 1.00 0.00 C ATOM 785 OE1 GLU A 52 1.864 -14.101 -3.726 1.00 0.00 O ATOM 786 OE2 GLU A 52 2.516 -16.021 -2.878 1.00 0.00 O ATOM 0 H GLU A 52 0.262 -11.817 -0.838 1.00 0.00 H new ATOM 0 HA GLU A 52 -1.455 -13.859 0.179 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -0.426 -15.215 -1.417 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -0.275 -13.621 -2.130 1.00 0.00 H new ATOM 0 HG2 GLU A 52 2.055 -13.487 -1.143 1.00 0.00 H new ATOM 0 HG3 GLU A 52 1.882 -15.159 -0.647 1.00 0.00 H new ATOM 793 N THR A 53 1.451 -13.445 1.566 1.00 0.00 N ATOM 794 CA THR A 53 2.313 -13.869 2.663 1.00 0.00 C ATOM 795 C THR A 53 1.602 -13.735 4.004 1.00 0.00 C ATOM 796 O THR A 53 1.881 -14.480 4.943 1.00 0.00 O ATOM 797 CB THR A 53 3.617 -13.049 2.702 1.00 0.00 C ATOM 798 OG1 THR A 53 4.353 -13.242 1.489 1.00 0.00 O ATOM 799 CG2 THR A 53 4.474 -13.453 3.891 1.00 0.00 C ATOM 0 H THR A 53 1.718 -12.558 1.139 1.00 0.00 H new ATOM 0 HA THR A 53 2.556 -14.917 2.487 1.00 0.00 H new ATOM 0 HB THR A 53 3.356 -11.996 2.804 1.00 0.00 H new ATOM 0 HG1 THR A 53 3.928 -12.738 0.764 1.00 0.00 H new ATOM 0 HG21 THR A 53 5.389 -12.861 3.898 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.921 -13.278 4.814 1.00 0.00 H new ATOM 0 HG23 THR A 53 4.727 -14.511 3.815 1.00 0.00 H new ATOM 807 N TYR A 54 0.681 -12.780 4.088 1.00 0.00 N ATOM 808 CA TYR A 54 -0.069 -12.548 5.316 1.00 0.00 C ATOM 809 C TYR A 54 -1.572 -12.610 5.057 1.00 0.00 C ATOM 810 O TYR A 54 -2.358 -11.944 5.731 1.00 0.00 O ATOM 811 CB TYR A 54 0.301 -11.190 5.915 1.00 0.00 C ATOM 812 CG TYR A 54 1.786 -11.007 6.128 1.00 0.00 C ATOM 813 CD1 TYR A 54 2.624 -10.675 5.071 1.00 0.00 C ATOM 814 CD2 TYR A 54 2.352 -11.164 7.388 1.00 0.00 C ATOM 815 CE1 TYR A 54 3.982 -10.508 5.262 1.00 0.00 C ATOM 816 CE2 TYR A 54 3.708 -10.997 7.588 1.00 0.00 C ATOM 817 CZ TYR A 54 4.519 -10.670 6.522 1.00 0.00 C ATOM 818 OH TYR A 54 5.871 -10.502 6.716 1.00 0.00 O ATOM 0 H TYR A 54 0.437 -12.155 3.320 1.00 0.00 H new ATOM 0 HA TYR A 54 0.192 -13.334 6.025 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -0.063 -10.401 5.257 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -0.212 -11.071 6.869 1.00 0.00 H new ATOM 0 HD1 TYR A 54 2.207 -10.545 4.083 1.00 0.00 H new ATOM 0 HD2 TYR A 54 1.720 -11.421 8.225 1.00 0.00 H new ATOM 0 HE1 TYR A 54 4.620 -10.252 4.429 1.00 0.00 H new ATOM 0 HE2 TYR A 54 4.131 -11.122 8.574 1.00 0.00 H new ATOM 0 HH TYR A 54 6.087 -10.651 7.660 1.00 0.00 H new ATOM 828 N LYS A 55 -1.963 -13.414 4.074 1.00 0.00 N ATOM 829 CA LYS A 55 -3.370 -13.567 3.724 1.00 0.00 C ATOM 830 C LYS A 55 -4.093 -14.439 4.746 1.00 0.00 C ATOM 831 O LYS A 55 -5.285 -14.258 4.998 1.00 0.00 O ATOM 832 CB LYS A 55 -3.506 -14.178 2.328 1.00 0.00 C ATOM 833 CG LYS A 55 -3.366 -15.691 2.310 1.00 0.00 C ATOM 834 CD LYS A 55 -2.829 -16.185 0.978 1.00 0.00 C ATOM 835 CE LYS A 55 -3.761 -15.823 -0.168 1.00 0.00 C ATOM 836 NZ LYS A 55 -4.772 -16.888 -0.418 1.00 0.00 N ATOM 0 H LYS A 55 -1.325 -13.970 3.505 1.00 0.00 H new ATOM 0 HA LYS A 55 -3.829 -12.578 3.727 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -4.477 -13.906 1.915 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -2.749 -13.744 1.675 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -2.698 -16.005 3.112 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -4.335 -16.149 2.505 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -1.845 -15.752 0.798 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -2.700 -17.267 1.015 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -4.269 -14.886 0.059 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -3.177 -15.657 -1.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -5.388 -16.604 -1.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -4.288 -17.776 -0.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -5.347 -17.029 0.437 1.00 0.00 H new ATOM 850 N ASP A 56 -3.365 -15.383 5.331 1.00 0.00 N ATOM 851 CA ASP A 56 -3.937 -16.282 6.328 1.00 0.00 C ATOM 852 C ASP A 56 -3.319 -16.035 7.700 1.00 0.00 C ATOM 853 O ASP A 56 -3.346 -16.906 8.571 1.00 0.00 O ATOM 854 CB ASP A 56 -3.725 -17.739 5.913 1.00 0.00 C ATOM 855 CG ASP A 56 -2.257 -18.104 5.812 1.00 0.00 C ATOM 856 OD1 ASP A 56 -1.430 -17.190 5.608 1.00 0.00 O ATOM 857 OD2 ASP A 56 -1.934 -19.303 5.937 1.00 0.00 O ATOM 0 H ASP A 56 -2.378 -15.546 5.133 1.00 0.00 H new ATOM 0 HA ASP A 56 -5.007 -16.083 6.391 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -4.210 -18.394 6.636 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -4.207 -17.914 4.951 1.00 0.00 H new ATOM 862 N HIS A 57 -2.760 -14.844 7.887 1.00 0.00 N ATOM 863 CA HIS A 57 -2.134 -14.483 9.154 1.00 0.00 C ATOM 864 C HIS A 57 -3.164 -14.449 10.279 1.00 0.00 C ATOM 865 O HIS A 57 -4.328 -14.791 10.076 1.00 0.00 O ATOM 866 CB HIS A 57 -1.444 -13.123 9.037 1.00 0.00 C ATOM 867 CG HIS A 57 -0.148 -13.043 9.783 1.00 0.00 C ATOM 868 ND1 HIS A 57 -0.054 -12.595 11.083 1.00 0.00 N ATOM 869 CD2 HIS A 57 1.113 -13.360 9.403 1.00 0.00 C ATOM 870 CE1 HIS A 57 1.209 -12.637 11.471 1.00 0.00 C ATOM 871 NE2 HIS A 57 1.937 -13.098 10.470 1.00 0.00 N ATOM 0 H HIS A 57 -2.728 -14.112 7.177 1.00 0.00 H new ATOM 0 HA HIS A 57 -1.388 -15.241 9.391 1.00 0.00 H new ATOM 0 HB2 HIS A 57 -1.262 -12.907 7.984 1.00 0.00 H new ATOM 0 HB3 HIS A 57 -2.117 -12.350 9.410 1.00 0.00 H new ATOM 0 HD2 HIS A 57 1.414 -13.747 8.441 1.00 0.00 H new ATOM 0 HE1 HIS A 57 1.582 -12.344 12.441 1.00 0.00 H new ATOM 0 HE2 HIS A 57 2.947 -13.237 10.487 1.00 0.00 H new ATOM 880 N GLU A 58 -2.726 -14.035 11.463 1.00 0.00 N ATOM 881 CA GLU A 58 -3.611 -13.958 12.620 1.00 0.00 C ATOM 882 C GLU A 58 -4.025 -12.515 12.894 1.00 0.00 C ATOM 883 O GLU A 58 -5.206 -12.220 13.070 1.00 0.00 O ATOM 884 CB GLU A 58 -2.925 -14.547 13.855 1.00 0.00 C ATOM 885 CG GLU A 58 -1.737 -13.731 14.338 1.00 0.00 C ATOM 886 CD GLU A 58 -0.823 -14.519 15.255 1.00 0.00 C ATOM 887 OE1 GLU A 58 -0.713 -15.749 15.071 1.00 0.00 O ATOM 888 OE2 GLU A 58 -0.216 -13.905 16.157 1.00 0.00 O ATOM 0 H GLU A 58 -1.765 -13.748 11.647 1.00 0.00 H new ATOM 0 HA GLU A 58 -4.507 -14.539 12.399 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -3.653 -14.626 14.662 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -2.591 -15.559 13.627 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -1.168 -13.381 13.477 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -2.098 -12.847 14.863 1.00 0.00 H new ATOM 895 N ASN A 59 -3.043 -11.620 12.928 1.00 0.00 N ATOM 896 CA ASN A 59 -3.304 -10.208 13.181 1.00 0.00 C ATOM 897 C ASN A 59 -2.908 -9.357 11.978 1.00 0.00 C ATOM 898 O ASN A 59 -3.388 -8.235 11.815 1.00 0.00 O ATOM 899 CB ASN A 59 -2.542 -9.742 14.423 1.00 0.00 C ATOM 900 CG ASN A 59 -1.041 -9.719 14.206 1.00 0.00 C ATOM 901 OD1 ASN A 59 -0.502 -8.783 13.615 1.00 0.00 O ATOM 902 ND2 ASN A 59 -0.359 -10.753 14.684 1.00 0.00 N ATOM 0 H ASN A 59 -2.059 -11.848 12.784 1.00 0.00 H new ATOM 0 HA ASN A 59 -4.374 -10.087 13.352 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -2.881 -8.744 14.701 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.776 -10.402 15.258 1.00 0.00 H new ATOM 0 HD21 ASN A 59 0.654 -10.794 14.568 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.848 -11.507 15.167 1.00 0.00 H new ATOM 909 N ILE A 60 -2.031 -9.899 11.140 1.00 0.00 N ATOM 910 CA ILE A 60 -1.572 -9.191 9.952 1.00 0.00 C ATOM 911 C ILE A 60 -2.484 -9.466 8.761 1.00 0.00 C ATOM 912 O ILE A 60 -2.509 -10.575 8.228 1.00 0.00 O ATOM 913 CB ILE A 60 -0.131 -9.587 9.582 1.00 0.00 C ATOM 914 CG1 ILE A 60 0.798 -9.398 10.784 1.00 0.00 C ATOM 915 CG2 ILE A 60 0.356 -8.767 8.396 1.00 0.00 C ATOM 916 CD1 ILE A 60 2.243 -9.731 10.489 1.00 0.00 C ATOM 0 H ILE A 60 -1.624 -10.826 11.262 1.00 0.00 H new ATOM 0 HA ILE A 60 -1.598 -8.127 10.189 1.00 0.00 H new ATOM 0 HB ILE A 60 -0.121 -10.640 9.300 1.00 0.00 H new ATOM 0 HG12 ILE A 60 0.734 -8.364 11.123 1.00 0.00 H new ATOM 0 HG13 ILE A 60 0.449 -10.025 11.605 1.00 0.00 H new ATOM 0 HG21 ILE A 60 1.376 -9.059 8.146 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -0.293 -8.947 7.539 1.00 0.00 H new ATOM 0 HG23 ILE A 60 0.334 -7.708 8.652 1.00 0.00 H new ATOM 0 HD11 ILE A 60 2.843 -9.574 11.385 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.320 -10.773 10.179 1.00 0.00 H new ATOM 0 HD13 ILE A 60 2.609 -9.086 9.690 1.00 0.00 H new ATOM 928 N VAL A 61 -3.233 -8.448 8.348 1.00 0.00 N ATOM 929 CA VAL A 61 -4.145 -8.578 7.218 1.00 0.00 C ATOM 930 C VAL A 61 -3.870 -7.512 6.164 1.00 0.00 C ATOM 931 O VAL A 61 -4.156 -6.332 6.372 1.00 0.00 O ATOM 932 CB VAL A 61 -5.614 -8.474 7.668 1.00 0.00 C ATOM 933 CG1 VAL A 61 -6.491 -7.993 6.522 1.00 0.00 C ATOM 934 CG2 VAL A 61 -6.104 -9.812 8.200 1.00 0.00 C ATOM 0 H VAL A 61 -3.226 -7.524 8.780 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.975 -9.564 6.785 1.00 0.00 H new ATOM 0 HB VAL A 61 -5.678 -7.743 8.474 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -7.525 -7.926 6.859 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -6.152 -7.011 6.192 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -6.425 -8.697 5.693 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -7.144 -9.720 8.514 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -6.026 -10.566 7.416 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -5.493 -10.110 9.052 1.00 0.00 H new ATOM 944 N ILE A 62 -3.315 -7.934 5.034 1.00 0.00 N ATOM 945 CA ILE A 62 -3.004 -7.015 3.946 1.00 0.00 C ATOM 946 C ILE A 62 -4.248 -6.694 3.125 1.00 0.00 C ATOM 947 O ILE A 62 -5.053 -7.576 2.828 1.00 0.00 O ATOM 948 CB ILE A 62 -1.922 -7.592 3.014 1.00 0.00 C ATOM 949 CG1 ILE A 62 -0.651 -7.906 3.806 1.00 0.00 C ATOM 950 CG2 ILE A 62 -1.621 -6.617 1.885 1.00 0.00 C ATOM 951 CD1 ILE A 62 0.056 -6.675 4.328 1.00 0.00 C ATOM 0 H ILE A 62 -3.071 -8.907 4.847 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.628 -6.100 4.403 1.00 0.00 H new ATOM 0 HB ILE A 62 -2.295 -8.519 2.578 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -0.907 -8.552 4.646 1.00 0.00 H new ATOM 0 HG13 ILE A 62 0.034 -8.466 3.170 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -0.855 -7.039 1.235 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -2.528 -6.438 1.308 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.265 -5.675 2.303 1.00 0.00 H new ATOM 0 HD11 ILE A 62 0.948 -6.974 4.879 1.00 0.00 H new ATOM 0 HD12 ILE A 62 0.343 -6.038 3.491 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -0.612 -6.125 4.990 1.00 0.00 H new ATOM 963 N ALA A 63 -4.397 -5.425 2.758 1.00 0.00 N ATOM 964 CA ALA A 63 -5.540 -4.987 1.967 1.00 0.00 C ATOM 965 C ALA A 63 -5.172 -3.805 1.077 1.00 0.00 C ATOM 966 O ALA A 63 -4.258 -3.041 1.388 1.00 0.00 O ATOM 967 CB ALA A 63 -6.703 -4.622 2.878 1.00 0.00 C ATOM 0 H ALA A 63 -3.740 -4.682 2.996 1.00 0.00 H new ATOM 0 HA ALA A 63 -5.842 -5.813 1.323 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -7.550 -4.297 2.274 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -6.991 -5.493 3.467 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.402 -3.815 3.546 1.00 0.00 H new ATOM 973 N LYS A 64 -5.888 -3.661 -0.033 1.00 0.00 N ATOM 974 CA LYS A 64 -5.637 -2.572 -0.970 1.00 0.00 C ATOM 975 C LYS A 64 -6.926 -1.819 -1.286 1.00 0.00 C ATOM 976 O LYS A 64 -8.002 -2.412 -1.348 1.00 0.00 O ATOM 977 CB LYS A 64 -5.020 -3.114 -2.261 1.00 0.00 C ATOM 978 CG LYS A 64 -5.983 -3.943 -3.093 1.00 0.00 C ATOM 979 CD LYS A 64 -5.408 -4.255 -4.465 1.00 0.00 C ATOM 980 CE LYS A 64 -6.425 -4.961 -5.348 1.00 0.00 C ATOM 981 NZ LYS A 64 -5.770 -5.748 -6.429 1.00 0.00 N ATOM 0 H LYS A 64 -6.647 -4.285 -0.306 1.00 0.00 H new ATOM 0 HA LYS A 64 -4.937 -1.879 -0.504 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -4.661 -2.278 -2.861 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -4.151 -3.723 -2.011 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -6.208 -4.873 -2.572 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -6.924 -3.405 -3.206 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -5.087 -3.330 -4.945 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -4.523 -4.881 -4.356 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -7.038 -5.624 -4.737 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -7.095 -4.224 -5.791 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -6.497 -6.214 -7.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -5.205 -5.112 -7.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -5.150 -6.468 -6.007 1.00 0.00 H new ATOM 995 N MET A 65 -6.807 -0.511 -1.487 1.00 0.00 N ATOM 996 CA MET A 65 -7.963 0.321 -1.799 1.00 0.00 C ATOM 997 C MET A 65 -7.599 1.398 -2.817 1.00 0.00 C ATOM 998 O MET A 65 -6.478 1.908 -2.820 1.00 0.00 O ATOM 999 CB MET A 65 -8.511 0.970 -0.527 1.00 0.00 C ATOM 1000 CG MET A 65 -9.922 1.513 -0.680 1.00 0.00 C ATOM 1001 SD MET A 65 -10.671 1.958 0.899 1.00 0.00 S ATOM 1002 CE MET A 65 -10.990 3.702 0.642 1.00 0.00 C ATOM 0 H MET A 65 -5.923 -0.005 -1.439 1.00 0.00 H new ATOM 0 HA MET A 65 -8.732 -0.318 -2.232 1.00 0.00 H new ATOM 0 HB2 MET A 65 -8.498 0.237 0.279 1.00 0.00 H new ATOM 0 HB3 MET A 65 -7.848 1.783 -0.229 1.00 0.00 H new ATOM 0 HG2 MET A 65 -9.901 2.389 -1.328 1.00 0.00 H new ATOM 0 HG3 MET A 65 -10.543 0.766 -1.174 1.00 0.00 H new ATOM 0 HE1 MET A 65 -11.095 4.199 1.607 1.00 0.00 H new ATOM 0 HE2 MET A 65 -10.160 4.147 0.093 1.00 0.00 H new ATOM 0 HE3 MET A 65 -11.910 3.823 0.070 1.00 0.00 H new ATOM 1012 N ASP A 66 -8.551 1.738 -3.679 1.00 0.00 N ATOM 1013 CA ASP A 66 -8.329 2.754 -4.700 1.00 0.00 C ATOM 1014 C ASP A 66 -8.803 4.122 -4.218 1.00 0.00 C ATOM 1015 O ASP A 66 -10.000 4.410 -4.214 1.00 0.00 O ATOM 1016 CB ASP A 66 -9.055 2.376 -5.992 1.00 0.00 C ATOM 1017 CG ASP A 66 -8.590 3.196 -7.180 1.00 0.00 C ATOM 1018 OD1 ASP A 66 -7.871 4.194 -6.965 1.00 0.00 O ATOM 1019 OD2 ASP A 66 -8.945 2.840 -8.323 1.00 0.00 O ATOM 0 H ASP A 66 -9.483 1.325 -3.691 1.00 0.00 H new ATOM 0 HA ASP A 66 -7.258 2.809 -4.896 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -8.894 1.318 -6.199 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -10.128 2.515 -5.856 1.00 0.00 H new ATOM 1024 N SER A 67 -7.856 4.961 -3.810 1.00 0.00 N ATOM 1025 CA SER A 67 -8.177 6.296 -3.321 1.00 0.00 C ATOM 1026 C SER A 67 -8.861 7.122 -4.406 1.00 0.00 C ATOM 1027 O SER A 67 -9.632 8.038 -4.113 1.00 0.00 O ATOM 1028 CB SER A 67 -6.908 7.008 -2.848 1.00 0.00 C ATOM 1029 OG SER A 67 -7.212 8.018 -1.901 1.00 0.00 O ATOM 0 H SER A 67 -6.860 4.739 -3.809 1.00 0.00 H new ATOM 0 HA SER A 67 -8.863 6.192 -2.480 1.00 0.00 H new ATOM 0 HB2 SER A 67 -6.225 6.284 -2.405 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.395 7.449 -3.703 1.00 0.00 H new ATOM 0 HG SER A 67 -8.053 8.456 -2.148 1.00 0.00 H new ATOM 1035 N THR A 68 -8.575 6.793 -5.661 1.00 0.00 N ATOM 1036 CA THR A 68 -9.161 7.503 -6.791 1.00 0.00 C ATOM 1037 C THR A 68 -10.559 6.982 -7.103 1.00 0.00 C ATOM 1038 O THR A 68 -11.379 7.689 -7.688 1.00 0.00 O ATOM 1039 CB THR A 68 -8.284 7.376 -8.051 1.00 0.00 C ATOM 1040 OG1 THR A 68 -8.601 6.166 -8.748 1.00 0.00 O ATOM 1041 CG2 THR A 68 -6.807 7.384 -7.686 1.00 0.00 C ATOM 0 H THR A 68 -7.940 6.038 -5.921 1.00 0.00 H new ATOM 0 HA THR A 68 -9.223 8.553 -6.506 1.00 0.00 H new ATOM 0 HB THR A 68 -8.487 8.231 -8.696 1.00 0.00 H new ATOM 0 HG1 THR A 68 -8.432 5.398 -8.163 1.00 0.00 H new ATOM 0 HG21 THR A 68 -6.208 7.293 -8.592 1.00 0.00 H new ATOM 0 HG22 THR A 68 -6.562 8.318 -7.181 1.00 0.00 H new ATOM 0 HG23 THR A 68 -6.592 6.546 -7.023 1.00 0.00 H new ATOM 1049 N ALA A 69 -10.824 5.741 -6.709 1.00 0.00 N ATOM 1050 CA ALA A 69 -12.124 5.126 -6.945 1.00 0.00 C ATOM 1051 C ALA A 69 -12.994 5.184 -5.693 1.00 0.00 C ATOM 1052 O ALA A 69 -14.210 5.012 -5.763 1.00 0.00 O ATOM 1053 CB ALA A 69 -11.952 3.685 -7.403 1.00 0.00 C ATOM 0 H ALA A 69 -10.155 5.142 -6.225 1.00 0.00 H new ATOM 0 HA ALA A 69 -12.626 5.688 -7.732 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -12.931 3.239 -7.575 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -11.376 3.664 -8.328 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -11.426 3.119 -6.634 1.00 0.00 H new ATOM 1059 N ASN A 70 -12.362 5.426 -4.550 1.00 0.00 N ATOM 1060 CA ASN A 70 -13.079 5.505 -3.282 1.00 0.00 C ATOM 1061 C ASN A 70 -12.482 6.587 -2.386 1.00 0.00 C ATOM 1062 O ASN A 70 -11.264 6.744 -2.314 1.00 0.00 O ATOM 1063 CB ASN A 70 -13.040 4.155 -2.565 1.00 0.00 C ATOM 1064 CG ASN A 70 -13.563 3.025 -3.431 1.00 0.00 C ATOM 1065 OD1 ASN A 70 -14.766 2.765 -3.471 1.00 0.00 O ATOM 1066 ND2 ASN A 70 -12.659 2.347 -4.128 1.00 0.00 N ATOM 0 H ASN A 70 -11.355 5.571 -4.475 1.00 0.00 H new ATOM 0 HA ASN A 70 -14.116 5.766 -3.495 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -12.015 3.935 -2.266 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -13.633 4.214 -1.652 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -12.951 1.575 -4.728 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -11.672 2.598 -4.064 1.00 0.00 H new ATOM 1073 N GLU A 71 -13.350 7.329 -1.706 1.00 0.00 N ATOM 1074 CA GLU A 71 -12.908 8.396 -0.815 1.00 0.00 C ATOM 1075 C GLU A 71 -13.477 8.203 0.588 1.00 0.00 C ATOM 1076 O GLU A 71 -14.616 7.768 0.754 1.00 0.00 O ATOM 1077 CB GLU A 71 -13.332 9.759 -1.366 1.00 0.00 C ATOM 1078 CG GLU A 71 -12.444 10.903 -0.908 1.00 0.00 C ATOM 1079 CD GLU A 71 -12.727 11.326 0.521 1.00 0.00 C ATOM 1080 OE1 GLU A 71 -13.797 11.926 0.760 1.00 0.00 O ATOM 1081 OE2 GLU A 71 -11.881 11.058 1.398 1.00 0.00 O ATOM 0 H GLU A 71 -14.362 7.211 -1.755 1.00 0.00 H new ATOM 0 HA GLU A 71 -11.820 8.358 -0.756 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -13.326 9.719 -2.455 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -14.358 9.962 -1.060 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -11.399 10.604 -0.994 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -12.587 11.757 -1.571 1.00 0.00 H new ATOM 1088 N VAL A 72 -12.674 8.531 1.595 1.00 0.00 N ATOM 1089 CA VAL A 72 -13.096 8.396 2.984 1.00 0.00 C ATOM 1090 C VAL A 72 -12.520 9.515 3.845 1.00 0.00 C ATOM 1091 O VAL A 72 -11.412 9.990 3.602 1.00 0.00 O ATOM 1092 CB VAL A 72 -12.665 7.038 3.572 1.00 0.00 C ATOM 1093 CG1 VAL A 72 -13.404 5.900 2.883 1.00 0.00 C ATOM 1094 CG2 VAL A 72 -11.160 6.858 3.449 1.00 0.00 C ATOM 0 H VAL A 72 -11.728 8.892 1.475 1.00 0.00 H new ATOM 0 HA VAL A 72 -14.184 8.459 2.992 1.00 0.00 H new ATOM 0 HB VAL A 72 -12.925 7.021 4.630 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -13.087 4.949 3.311 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -14.477 6.023 3.027 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -13.177 5.912 1.817 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -10.873 5.894 3.869 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -10.874 6.895 2.398 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -10.653 7.656 3.992 1.00 0.00 H new ATOM 1104 N GLU A 73 -13.282 9.930 4.853 1.00 0.00 N ATOM 1105 CA GLU A 73 -12.847 10.994 5.750 1.00 0.00 C ATOM 1106 C GLU A 73 -11.835 10.470 6.765 1.00 0.00 C ATOM 1107 O GLU A 73 -10.999 11.220 7.268 1.00 0.00 O ATOM 1108 CB GLU A 73 -14.048 11.601 6.477 1.00 0.00 C ATOM 1109 CG GLU A 73 -14.713 10.647 7.456 1.00 0.00 C ATOM 1110 CD GLU A 73 -14.116 10.729 8.847 1.00 0.00 C ATOM 1111 OE1 GLU A 73 -14.144 11.827 9.442 1.00 0.00 O ATOM 1112 OE2 GLU A 73 -13.621 9.695 9.342 1.00 0.00 O ATOM 0 H GLU A 73 -14.202 9.546 5.068 1.00 0.00 H new ATOM 0 HA GLU A 73 -12.367 11.767 5.150 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -13.724 12.492 7.014 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -14.784 11.923 5.740 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -15.779 10.870 7.508 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -14.619 9.627 7.084 1.00 0.00 H new ATOM 1119 N ALA A 74 -11.919 9.177 7.061 1.00 0.00 N ATOM 1120 CA ALA A 74 -11.010 8.552 8.015 1.00 0.00 C ATOM 1121 C ALA A 74 -9.572 8.590 7.509 1.00 0.00 C ATOM 1122 O ALA A 74 -8.627 8.443 8.284 1.00 0.00 O ATOM 1123 CB ALA A 74 -11.438 7.118 8.289 1.00 0.00 C ATOM 0 H ALA A 74 -12.606 8.542 6.655 1.00 0.00 H new ATOM 0 HA ALA A 74 -11.054 9.117 8.946 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -10.751 6.663 9.003 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -12.447 7.112 8.702 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -11.423 6.550 7.359 1.00 0.00 H new ATOM 1129 N VAL A 75 -9.414 8.787 6.204 1.00 0.00 N ATOM 1130 CA VAL A 75 -8.090 8.844 5.595 1.00 0.00 C ATOM 1131 C VAL A 75 -8.108 9.683 4.322 1.00 0.00 C ATOM 1132 O VAL A 75 -8.751 9.323 3.336 1.00 0.00 O ATOM 1133 CB VAL A 75 -7.564 7.436 5.261 1.00 0.00 C ATOM 1134 CG1 VAL A 75 -6.434 7.514 4.246 1.00 0.00 C ATOM 1135 CG2 VAL A 75 -7.107 6.725 6.526 1.00 0.00 C ATOM 0 H VAL A 75 -10.186 8.910 5.548 1.00 0.00 H new ATOM 0 HA VAL A 75 -7.426 9.308 6.324 1.00 0.00 H new ATOM 0 HB VAL A 75 -8.377 6.859 4.820 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.075 6.509 4.023 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.798 7.981 3.331 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.617 8.108 4.656 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.738 5.731 6.272 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -6.309 7.299 6.998 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.946 6.635 7.216 1.00 0.00 H new ATOM 1145 N LYS A 76 -7.395 10.804 4.349 1.00 0.00 N ATOM 1146 CA LYS A 76 -7.326 11.695 3.197 1.00 0.00 C ATOM 1147 C LYS A 76 -5.998 11.533 2.463 1.00 0.00 C ATOM 1148 O LYS A 76 -4.961 12.009 2.924 1.00 0.00 O ATOM 1149 CB LYS A 76 -7.502 13.149 3.639 1.00 0.00 C ATOM 1150 CG LYS A 76 -8.933 13.506 4.000 1.00 0.00 C ATOM 1151 CD LYS A 76 -9.780 13.740 2.760 1.00 0.00 C ATOM 1152 CE LYS A 76 -11.257 13.516 3.043 1.00 0.00 C ATOM 1153 NZ LYS A 76 -11.851 14.643 3.814 1.00 0.00 N ATOM 0 H LYS A 76 -6.856 11.117 5.157 1.00 0.00 H new ATOM 0 HA LYS A 76 -8.133 11.429 2.515 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -6.861 13.338 4.500 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -7.163 13.807 2.839 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -9.370 12.703 4.594 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -8.940 14.402 4.621 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -9.628 14.758 2.401 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -9.455 13.069 1.964 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -11.793 13.398 2.101 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -11.383 12.588 3.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -12.859 14.452 3.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -11.356 14.740 4.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -11.754 15.525 3.271 1.00 0.00 H new ATOM 1167 N VAL A 77 -6.038 10.859 1.318 1.00 0.00 N ATOM 1168 CA VAL A 77 -4.839 10.637 0.519 1.00 0.00 C ATOM 1169 C VAL A 77 -4.757 11.628 -0.637 1.00 0.00 C ATOM 1170 O VAL A 77 -5.671 11.716 -1.459 1.00 0.00 O ATOM 1171 CB VAL A 77 -4.797 9.204 -0.044 1.00 0.00 C ATOM 1172 CG1 VAL A 77 -3.429 8.903 -0.638 1.00 0.00 C ATOM 1173 CG2 VAL A 77 -5.150 8.196 1.040 1.00 0.00 C ATOM 0 H VAL A 77 -6.888 10.457 0.923 1.00 0.00 H new ATOM 0 HA VAL A 77 -3.986 10.785 1.181 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.538 9.123 -0.840 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.419 7.886 -1.031 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -3.220 9.606 -1.445 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -2.667 9.001 0.135 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -5.116 7.189 0.625 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.434 8.276 1.858 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.153 8.400 1.414 1.00 0.00 H new ATOM 1183 N HIS A 78 -3.657 12.371 -0.695 1.00 0.00 N ATOM 1184 CA HIS A 78 -3.455 13.356 -1.752 1.00 0.00 C ATOM 1185 C HIS A 78 -2.296 12.951 -2.658 1.00 0.00 C ATOM 1186 O HIS A 78 -2.110 13.517 -3.735 1.00 0.00 O ATOM 1187 CB HIS A 78 -3.189 14.736 -1.149 1.00 0.00 C ATOM 1188 CG HIS A 78 -4.028 15.035 0.054 1.00 0.00 C ATOM 1189 ND1 HIS A 78 -3.501 15.200 1.318 1.00 0.00 N ATOM 1190 CD2 HIS A 78 -5.366 15.202 0.182 1.00 0.00 C ATOM 1191 CE1 HIS A 78 -4.478 15.453 2.171 1.00 0.00 C ATOM 1192 NE2 HIS A 78 -5.620 15.461 1.506 1.00 0.00 N ATOM 0 H HIS A 78 -2.892 12.310 -0.023 1.00 0.00 H new ATOM 0 HA HIS A 78 -4.364 13.400 -2.352 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -2.137 14.807 -0.875 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -3.372 15.497 -1.908 1.00 0.00 H new ATOM 0 HD1 HIS A 78 -2.511 15.137 1.557 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -6.097 15.142 -0.610 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -4.363 15.624 3.231 1.00 0.00 H new ATOM 1201 N SER A 79 -1.519 11.969 -2.213 1.00 0.00 N ATOM 1202 CA SER A 79 -0.375 11.491 -2.981 1.00 0.00 C ATOM 1203 C SER A 79 -0.429 9.976 -3.151 1.00 0.00 C ATOM 1204 O SER A 79 -1.212 9.293 -2.490 1.00 0.00 O ATOM 1205 CB SER A 79 0.931 11.892 -2.292 1.00 0.00 C ATOM 1206 OG SER A 79 0.951 11.458 -0.943 1.00 0.00 O ATOM 0 H SER A 79 -1.661 11.489 -1.324 1.00 0.00 H new ATOM 0 HA SER A 79 -0.414 11.951 -3.968 1.00 0.00 H new ATOM 0 HB2 SER A 79 1.776 11.461 -2.829 1.00 0.00 H new ATOM 0 HB3 SER A 79 1.048 12.975 -2.331 1.00 0.00 H new ATOM 0 HG SER A 79 1.797 11.725 -0.526 1.00 0.00 H new ATOM 1212 N PHE A 80 0.408 9.457 -4.043 1.00 0.00 N ATOM 1213 CA PHE A 80 0.456 8.023 -4.302 1.00 0.00 C ATOM 1214 C PHE A 80 1.779 7.632 -4.956 1.00 0.00 C ATOM 1215 O PHE A 80 2.411 8.422 -5.657 1.00 0.00 O ATOM 1216 CB PHE A 80 -0.711 7.606 -5.199 1.00 0.00 C ATOM 1217 CG PHE A 80 -1.999 8.305 -4.869 1.00 0.00 C ATOM 1218 CD1 PHE A 80 -2.832 7.819 -3.875 1.00 0.00 C ATOM 1219 CD2 PHE A 80 -2.377 9.449 -5.554 1.00 0.00 C ATOM 1220 CE1 PHE A 80 -4.018 8.460 -3.569 1.00 0.00 C ATOM 1221 CE2 PHE A 80 -3.561 10.094 -5.252 1.00 0.00 C ATOM 1222 CZ PHE A 80 -4.383 9.599 -4.259 1.00 0.00 C ATOM 0 H PHE A 80 1.062 10.008 -4.599 1.00 0.00 H new ATOM 0 HA PHE A 80 0.375 7.504 -3.347 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -0.452 7.810 -6.238 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -0.859 6.529 -5.113 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -2.552 6.928 -3.332 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -1.739 9.841 -6.332 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -4.658 8.070 -2.791 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -3.844 10.985 -5.793 1.00 0.00 H new ATOM 0 HZ PHE A 80 -5.309 10.102 -4.023 1.00 0.00 H new ATOM 1232 N PRO A 81 2.208 6.384 -4.720 1.00 0.00 N ATOM 1233 CA PRO A 81 1.465 5.435 -3.886 1.00 0.00 C ATOM 1234 C PRO A 81 1.481 5.823 -2.411 1.00 0.00 C ATOM 1235 O PRO A 81 2.478 6.338 -1.904 1.00 0.00 O ATOM 1236 CB PRO A 81 2.211 4.115 -4.099 1.00 0.00 C ATOM 1237 CG PRO A 81 3.594 4.519 -4.479 1.00 0.00 C ATOM 1238 CD PRO A 81 3.454 5.803 -5.249 1.00 0.00 C ATOM 0 HA PRO A 81 0.410 5.393 -4.158 1.00 0.00 H new ATOM 0 HB2 PRO A 81 2.210 3.509 -3.193 1.00 0.00 H new ATOM 0 HB3 PRO A 81 1.744 3.518 -4.882 1.00 0.00 H new ATOM 0 HG2 PRO A 81 4.216 4.660 -3.595 1.00 0.00 H new ATOM 0 HG3 PRO A 81 4.072 3.750 -5.086 1.00 0.00 H new ATOM 0 HD2 PRO A 81 4.306 6.464 -5.087 1.00 0.00 H new ATOM 0 HD3 PRO A 81 3.390 5.623 -6.322 1.00 0.00 H new ATOM 1246 N THR A 82 0.369 5.574 -1.727 1.00 0.00 N ATOM 1247 CA THR A 82 0.255 5.898 -0.310 1.00 0.00 C ATOM 1248 C THR A 82 -0.021 4.649 0.519 1.00 0.00 C ATOM 1249 O THR A 82 -1.004 3.943 0.289 1.00 0.00 O ATOM 1250 CB THR A 82 -0.865 6.926 -0.058 1.00 0.00 C ATOM 1251 OG1 THR A 82 -0.419 8.236 -0.425 1.00 0.00 O ATOM 1252 CG2 THR A 82 -1.286 6.919 1.404 1.00 0.00 C ATOM 0 H THR A 82 -0.466 5.149 -2.131 1.00 0.00 H new ATOM 0 HA THR A 82 1.209 6.329 -0.006 1.00 0.00 H new ATOM 0 HB THR A 82 -1.725 6.651 -0.669 1.00 0.00 H new ATOM 0 HG1 THR A 82 -0.530 8.361 -1.391 1.00 0.00 H new ATOM 0 HG21 THR A 82 -2.077 7.652 1.558 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.652 5.928 1.672 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.430 7.172 2.030 1.00 0.00 H new ATOM 1260 N LEU A 83 0.851 4.382 1.485 1.00 0.00 N ATOM 1261 CA LEU A 83 0.701 3.217 2.350 1.00 0.00 C ATOM 1262 C LEU A 83 0.447 3.640 3.794 1.00 0.00 C ATOM 1263 O LEU A 83 1.147 4.497 4.333 1.00 0.00 O ATOM 1264 CB LEU A 83 1.951 2.338 2.277 1.00 0.00 C ATOM 1265 CG LEU A 83 2.400 1.926 0.874 1.00 0.00 C ATOM 1266 CD1 LEU A 83 3.641 1.050 0.947 1.00 0.00 C ATOM 1267 CD2 LEU A 83 1.276 1.203 0.146 1.00 0.00 C ATOM 0 H LEU A 83 1.669 4.956 1.689 1.00 0.00 H new ATOM 0 HA LEU A 83 -0.159 2.645 2.001 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.772 2.868 2.759 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.770 1.434 2.859 1.00 0.00 H new ATOM 0 HG LEU A 83 2.649 2.827 0.313 1.00 0.00 H new ATOM 0 HD11 LEU A 83 3.946 0.766 -0.060 1.00 0.00 H new ATOM 0 HD12 LEU A 83 4.448 1.602 1.429 1.00 0.00 H new ATOM 0 HD13 LEU A 83 3.420 0.153 1.525 1.00 0.00 H new ATOM 0 HD21 LEU A 83 1.613 0.917 -0.850 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.996 0.310 0.705 1.00 0.00 H new ATOM 0 HD23 LEU A 83 0.413 1.864 0.062 1.00 0.00 H new ATOM 1279 N LYS A 84 -0.558 3.032 4.415 1.00 0.00 N ATOM 1280 CA LYS A 84 -0.903 3.342 5.797 1.00 0.00 C ATOM 1281 C LYS A 84 -1.166 2.067 6.592 1.00 0.00 C ATOM 1282 O LYS A 84 -1.998 1.245 6.208 1.00 0.00 O ATOM 1283 CB LYS A 84 -2.135 4.249 5.846 1.00 0.00 C ATOM 1284 CG LYS A 84 -2.052 5.439 4.906 1.00 0.00 C ATOM 1285 CD LYS A 84 -2.817 6.634 5.451 1.00 0.00 C ATOM 1286 CE LYS A 84 -2.476 7.907 4.692 1.00 0.00 C ATOM 1287 NZ LYS A 84 -1.281 8.589 5.261 1.00 0.00 N ATOM 0 H LYS A 84 -1.148 2.321 3.983 1.00 0.00 H new ATOM 0 HA LYS A 84 -0.058 3.862 6.248 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -3.019 3.661 5.597 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -2.269 4.611 6.865 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -1.008 5.712 4.755 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -2.453 5.163 3.931 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -3.888 6.444 5.382 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -2.584 6.766 6.508 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -2.293 7.667 3.645 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -3.329 8.585 4.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -1.081 9.452 4.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -1.465 8.841 6.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -0.461 7.951 5.212 1.00 0.00 H new ATOM 1301 N PHE A 85 -0.452 1.909 7.701 1.00 0.00 N ATOM 1302 CA PHE A 85 -0.608 0.734 8.550 1.00 0.00 C ATOM 1303 C PHE A 85 -1.628 0.993 9.655 1.00 0.00 C ATOM 1304 O PHE A 85 -1.500 1.947 10.422 1.00 0.00 O ATOM 1305 CB PHE A 85 0.737 0.339 9.164 1.00 0.00 C ATOM 1306 CG PHE A 85 0.621 -0.698 10.244 1.00 0.00 C ATOM 1307 CD1 PHE A 85 0.664 -2.048 9.934 1.00 0.00 C ATOM 1308 CD2 PHE A 85 0.470 -0.323 11.569 1.00 0.00 C ATOM 1309 CE1 PHE A 85 0.558 -3.004 10.926 1.00 0.00 C ATOM 1310 CE2 PHE A 85 0.363 -1.275 12.566 1.00 0.00 C ATOM 1311 CZ PHE A 85 0.408 -2.618 12.244 1.00 0.00 C ATOM 0 H PHE A 85 0.241 2.580 8.033 1.00 0.00 H new ATOM 0 HA PHE A 85 -0.971 -0.086 7.930 1.00 0.00 H new ATOM 0 HB2 PHE A 85 1.390 -0.039 8.377 1.00 0.00 H new ATOM 0 HB3 PHE A 85 1.215 1.228 9.575 1.00 0.00 H new ATOM 0 HD1 PHE A 85 0.782 -2.356 8.906 1.00 0.00 H new ATOM 0 HD2 PHE A 85 0.435 0.725 11.826 1.00 0.00 H new ATOM 0 HE1 PHE A 85 0.592 -4.053 10.671 1.00 0.00 H new ATOM 0 HE2 PHE A 85 0.244 -0.969 13.595 1.00 0.00 H new ATOM 0 HZ PHE A 85 0.326 -3.364 13.021 1.00 0.00 H new ATOM 1321 N PHE A 86 -2.641 0.136 9.729 1.00 0.00 N ATOM 1322 CA PHE A 86 -3.685 0.272 10.739 1.00 0.00 C ATOM 1323 C PHE A 86 -3.443 -0.683 11.904 1.00 0.00 C ATOM 1324 O PHE A 86 -3.660 -1.891 11.805 1.00 0.00 O ATOM 1325 CB PHE A 86 -5.059 0.004 10.122 1.00 0.00 C ATOM 1326 CG PHE A 86 -5.400 0.933 8.992 1.00 0.00 C ATOM 1327 CD1 PHE A 86 -4.631 2.059 8.746 1.00 0.00 C ATOM 1328 CD2 PHE A 86 -6.490 0.679 8.175 1.00 0.00 C ATOM 1329 CE1 PHE A 86 -4.942 2.915 7.707 1.00 0.00 C ATOM 1330 CE2 PHE A 86 -6.806 1.532 7.133 1.00 0.00 C ATOM 1331 CZ PHE A 86 -6.032 2.651 6.900 1.00 0.00 C ATOM 0 H PHE A 86 -2.761 -0.660 9.102 1.00 0.00 H new ATOM 0 HA PHE A 86 -3.658 1.294 11.118 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -5.092 -1.023 9.760 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -5.820 0.093 10.897 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -3.778 2.270 9.374 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -7.099 -0.195 8.354 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -4.334 3.789 7.526 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -7.657 1.323 6.502 1.00 0.00 H new ATOM 0 HZ PHE A 86 -6.278 3.319 6.088 1.00 0.00 H new ATOM 1341 N PRO A 87 -2.981 -0.130 13.035 1.00 0.00 N ATOM 1342 CA PRO A 87 -2.698 -0.914 14.241 1.00 0.00 C ATOM 1343 C PRO A 87 -3.968 -1.440 14.901 1.00 0.00 C ATOM 1344 O PRO A 87 -5.075 -1.033 14.551 1.00 0.00 O ATOM 1345 CB PRO A 87 -1.994 0.088 15.159 1.00 0.00 C ATOM 1346 CG PRO A 87 -2.481 1.422 14.708 1.00 0.00 C ATOM 1347 CD PRO A 87 -2.699 1.302 13.225 1.00 0.00 C ATOM 0 HA PRO A 87 -2.104 -1.801 14.020 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -2.242 -0.091 16.205 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -0.910 0.012 15.071 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -3.405 1.693 15.218 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -1.752 2.201 14.934 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -3.530 1.923 12.890 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -1.819 1.616 12.663 1.00 0.00 H new ATOM 1355 N ALA A 88 -3.800 -2.347 15.858 1.00 0.00 N ATOM 1356 CA ALA A 88 -4.933 -2.927 16.569 1.00 0.00 C ATOM 1357 C ALA A 88 -5.494 -1.950 17.597 1.00 0.00 C ATOM 1358 O ALA A 88 -5.540 -2.249 18.791 1.00 0.00 O ATOM 1359 CB ALA A 88 -4.524 -4.228 17.242 1.00 0.00 C ATOM 0 H ALA A 88 -2.890 -2.696 16.159 1.00 0.00 H new ATOM 0 HA ALA A 88 -5.717 -3.138 15.842 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -5.380 -4.650 17.769 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -4.178 -4.935 16.488 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -3.720 -4.033 17.952 1.00 0.00 H new ATOM 1365 N SER A 89 -5.919 -0.782 17.127 1.00 0.00 N ATOM 1366 CA SER A 89 -6.472 0.241 18.008 1.00 0.00 C ATOM 1367 C SER A 89 -7.924 0.540 17.647 1.00 0.00 C ATOM 1368 O SER A 89 -8.310 0.482 16.480 1.00 0.00 O ATOM 1369 CB SER A 89 -5.640 1.521 17.923 1.00 0.00 C ATOM 1370 OG SER A 89 -5.831 2.330 19.071 1.00 0.00 O ATOM 0 H SER A 89 -5.891 -0.520 16.142 1.00 0.00 H new ATOM 0 HA SER A 89 -6.440 -0.137 19.030 1.00 0.00 H new ATOM 0 HB2 SER A 89 -4.585 1.267 17.825 1.00 0.00 H new ATOM 0 HB3 SER A 89 -5.918 2.080 17.030 1.00 0.00 H new ATOM 0 HG SER A 89 -5.287 3.142 18.993 1.00 0.00 H new ATOM 1376 N ALA A 90 -8.725 0.859 18.658 1.00 0.00 N ATOM 1377 CA ALA A 90 -10.134 1.169 18.449 1.00 0.00 C ATOM 1378 C ALA A 90 -10.348 2.672 18.298 1.00 0.00 C ATOM 1379 O ALA A 90 -11.452 3.175 18.508 1.00 0.00 O ATOM 1380 CB ALA A 90 -10.970 0.628 19.599 1.00 0.00 C ATOM 0 H ALA A 90 -8.422 0.910 19.631 1.00 0.00 H new ATOM 0 HA ALA A 90 -10.454 0.688 17.525 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -12.020 0.867 19.429 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -10.849 -0.454 19.659 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -10.641 1.083 20.533 1.00 0.00 H new ATOM 1386 N ASP A 91 -9.287 3.382 17.932 1.00 0.00 N ATOM 1387 CA ASP A 91 -9.360 4.827 17.752 1.00 0.00 C ATOM 1388 C ASP A 91 -9.003 5.215 16.320 1.00 0.00 C ATOM 1389 O ASP A 91 -8.267 6.175 16.091 1.00 0.00 O ATOM 1390 CB ASP A 91 -8.422 5.533 18.733 1.00 0.00 C ATOM 1391 CG ASP A 91 -8.890 5.411 20.170 1.00 0.00 C ATOM 1392 OD1 ASP A 91 -10.086 5.121 20.381 1.00 0.00 O ATOM 1393 OD2 ASP A 91 -8.060 5.607 21.083 1.00 0.00 O ATOM 0 H ASP A 91 -8.366 2.981 17.754 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.385 5.141 17.950 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -7.421 5.110 18.643 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -8.348 6.587 18.466 1.00 0.00 H new ATOM 1398 N ARG A 92 -9.529 4.461 15.360 1.00 0.00 N ATOM 1399 CA ARG A 92 -9.264 4.725 13.951 1.00 0.00 C ATOM 1400 C ARG A 92 -7.838 5.229 13.750 1.00 0.00 C ATOM 1401 O ARG A 92 -7.581 6.077 12.895 1.00 0.00 O ATOM 1402 CB ARG A 92 -10.260 5.750 13.406 1.00 0.00 C ATOM 1403 CG ARG A 92 -11.689 5.516 13.867 1.00 0.00 C ATOM 1404 CD ARG A 92 -12.438 4.597 12.916 1.00 0.00 C ATOM 1405 NE ARG A 92 -12.243 3.188 13.248 1.00 0.00 N ATOM 1406 CZ ARG A 92 -12.947 2.547 14.173 1.00 0.00 C ATOM 1407 NH1 ARG A 92 -13.888 3.184 14.855 1.00 0.00 N ATOM 1408 NH2 ARG A 92 -12.710 1.264 14.418 1.00 0.00 N ATOM 0 H ARG A 92 -10.141 3.663 15.532 1.00 0.00 H new ATOM 0 HA ARG A 92 -9.380 3.789 13.404 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -9.947 6.748 13.714 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -10.231 5.729 12.317 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -11.683 5.081 14.866 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -12.210 6.471 13.938 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -13.502 4.833 12.947 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -12.101 4.779 11.896 1.00 0.00 H new ATOM 0 HE ARG A 92 -11.527 2.668 12.741 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -14.073 4.170 14.670 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -14.427 2.688 15.565 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -11.987 0.770 13.895 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -13.251 0.772 15.129 1.00 0.00 H new ATOM 1422 N THR A 93 -6.912 4.702 14.545 1.00 0.00 N ATOM 1423 CA THR A 93 -5.512 5.099 14.457 1.00 0.00 C ATOM 1424 C THR A 93 -4.889 4.629 13.148 1.00 0.00 C ATOM 1425 O THR A 93 -5.191 3.540 12.660 1.00 0.00 O ATOM 1426 CB THR A 93 -4.693 4.534 15.633 1.00 0.00 C ATOM 1427 OG1 THR A 93 -5.280 4.936 16.876 1.00 0.00 O ATOM 1428 CG2 THR A 93 -3.252 5.016 15.569 1.00 0.00 C ATOM 0 H THR A 93 -7.107 3.999 15.258 1.00 0.00 H new ATOM 0 HA THR A 93 -5.489 6.188 14.497 1.00 0.00 H new ATOM 0 HB THR A 93 -4.700 3.446 15.563 1.00 0.00 H new ATOM 0 HG1 THR A 93 -4.755 4.572 17.619 1.00 0.00 H new ATOM 0 HG21 THR A 93 -2.693 4.604 16.409 1.00 0.00 H new ATOM 0 HG22 THR A 93 -2.799 4.685 14.635 1.00 0.00 H new ATOM 0 HG23 THR A 93 -3.230 6.105 15.617 1.00 0.00 H new ATOM 1436 N VAL A 94 -4.017 5.458 12.582 1.00 0.00 N ATOM 1437 CA VAL A 94 -3.350 5.127 11.329 1.00 0.00 C ATOM 1438 C VAL A 94 -1.870 5.489 11.382 1.00 0.00 C ATOM 1439 O VAL A 94 -1.501 6.569 11.845 1.00 0.00 O ATOM 1440 CB VAL A 94 -4.002 5.851 10.137 1.00 0.00 C ATOM 1441 CG1 VAL A 94 -3.089 5.807 8.920 1.00 0.00 C ATOM 1442 CG2 VAL A 94 -5.358 5.239 9.819 1.00 0.00 C ATOM 0 H VAL A 94 -3.756 6.364 12.972 1.00 0.00 H new ATOM 0 HA VAL A 94 -3.453 4.051 11.191 1.00 0.00 H new ATOM 0 HB VAL A 94 -4.155 6.895 10.409 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -3.567 6.324 8.088 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -2.144 6.296 9.156 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -2.901 4.770 8.643 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -5.805 5.763 8.974 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -5.232 4.186 9.567 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -6.010 5.329 10.687 1.00 0.00 H new ATOM 1452 N ILE A 95 -1.026 4.580 10.904 1.00 0.00 N ATOM 1453 CA ILE A 95 0.414 4.805 10.896 1.00 0.00 C ATOM 1454 C ILE A 95 0.927 5.029 9.477 1.00 0.00 C ATOM 1455 O ILE A 95 0.518 4.340 8.542 1.00 0.00 O ATOM 1456 CB ILE A 95 1.172 3.621 11.524 1.00 0.00 C ATOM 1457 CG1 ILE A 95 0.739 3.423 12.977 1.00 0.00 C ATOM 1458 CG2 ILE A 95 2.674 3.850 11.439 1.00 0.00 C ATOM 1459 CD1 ILE A 95 1.390 2.232 13.645 1.00 0.00 C ATOM 0 H ILE A 95 -1.315 3.681 10.517 1.00 0.00 H new ATOM 0 HA ILE A 95 0.598 5.699 11.491 1.00 0.00 H new ATOM 0 HB ILE A 95 0.930 2.716 10.967 1.00 0.00 H new ATOM 0 HG12 ILE A 95 0.977 4.323 13.544 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -0.344 3.302 13.012 1.00 0.00 H new ATOM 0 HG21 ILE A 95 3.197 3.005 11.887 1.00 0.00 H new ATOM 0 HG22 ILE A 95 2.969 3.947 10.394 1.00 0.00 H new ATOM 0 HG23 ILE A 95 2.934 4.763 11.975 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.036 2.153 14.673 1.00 0.00 H new ATOM 0 HD12 ILE A 95 1.131 1.323 13.101 1.00 0.00 H new ATOM 0 HD13 ILE A 95 2.472 2.360 13.643 1.00 0.00 H new ATOM 1471 N ASP A 96 1.827 5.994 9.325 1.00 0.00 N ATOM 1472 CA ASP A 96 2.399 6.307 8.021 1.00 0.00 C ATOM 1473 C ASP A 96 3.615 5.430 7.736 1.00 0.00 C ATOM 1474 O ASP A 96 4.510 5.303 8.572 1.00 0.00 O ATOM 1475 CB ASP A 96 2.793 7.784 7.953 1.00 0.00 C ATOM 1476 CG ASP A 96 1.589 8.705 7.977 1.00 0.00 C ATOM 1477 OD1 ASP A 96 0.541 8.298 8.519 1.00 0.00 O ATOM 1478 OD2 ASP A 96 1.695 9.834 7.452 1.00 0.00 O ATOM 0 H ASP A 96 2.176 6.573 10.089 1.00 0.00 H new ATOM 0 HA ASP A 96 1.642 6.106 7.263 1.00 0.00 H new ATOM 0 HB2 ASP A 96 3.446 8.022 8.793 1.00 0.00 H new ATOM 0 HB3 ASP A 96 3.366 7.963 7.043 1.00 0.00 H new ATOM 1483 N TYR A 97 3.639 4.828 6.553 1.00 0.00 N ATOM 1484 CA TYR A 97 4.743 3.961 6.159 1.00 0.00 C ATOM 1485 C TYR A 97 5.778 4.731 5.345 1.00 0.00 C ATOM 1486 O TYR A 97 5.520 5.131 4.211 1.00 0.00 O ATOM 1487 CB TYR A 97 4.222 2.773 5.349 1.00 0.00 C ATOM 1488 CG TYR A 97 5.284 1.745 5.028 1.00 0.00 C ATOM 1489 CD1 TYR A 97 6.258 2.000 4.071 1.00 0.00 C ATOM 1490 CD2 TYR A 97 5.313 0.520 5.682 1.00 0.00 C ATOM 1491 CE1 TYR A 97 7.230 1.065 3.774 1.00 0.00 C ATOM 1492 CE2 TYR A 97 6.282 -0.421 5.393 1.00 0.00 C ATOM 1493 CZ TYR A 97 7.239 -0.144 4.438 1.00 0.00 C ATOM 1494 OH TYR A 97 8.205 -1.080 4.146 1.00 0.00 O ATOM 0 H TYR A 97 2.907 4.924 5.850 1.00 0.00 H new ATOM 0 HA TYR A 97 5.222 3.592 7.066 1.00 0.00 H new ATOM 0 HB2 TYR A 97 3.418 2.291 5.904 1.00 0.00 H new ATOM 0 HB3 TYR A 97 3.791 3.140 4.418 1.00 0.00 H new ATOM 0 HD1 TYR A 97 6.255 2.946 3.550 1.00 0.00 H new ATOM 0 HD2 TYR A 97 4.565 0.299 6.429 1.00 0.00 H new ATOM 0 HE1 TYR A 97 7.979 1.279 3.026 1.00 0.00 H new ATOM 0 HE2 TYR A 97 6.291 -1.368 5.912 1.00 0.00 H new ATOM 0 HH TYR A 97 7.810 -1.804 3.618 1.00 0.00 H new ATOM 1504 N ASN A 98 6.952 4.935 5.935 1.00 0.00 N ATOM 1505 CA ASN A 98 8.028 5.657 5.266 1.00 0.00 C ATOM 1506 C ASN A 98 9.324 4.852 5.294 1.00 0.00 C ATOM 1507 O ASN A 98 10.279 5.218 5.977 1.00 0.00 O ATOM 1508 CB ASN A 98 8.246 7.019 5.929 1.00 0.00 C ATOM 1509 CG ASN A 98 7.306 8.081 5.391 1.00 0.00 C ATOM 1510 OD1 ASN A 98 7.100 8.189 4.183 1.00 0.00 O ATOM 1511 ND2 ASN A 98 6.732 8.872 6.290 1.00 0.00 N ATOM 0 H ASN A 98 7.182 4.611 6.874 1.00 0.00 H new ATOM 0 HA ASN A 98 7.738 5.809 4.226 1.00 0.00 H new ATOM 0 HB2 ASN A 98 8.103 6.923 7.005 1.00 0.00 H new ATOM 0 HB3 ASN A 98 9.277 7.336 5.771 1.00 0.00 H new ATOM 0 HD21 ASN A 98 6.091 9.606 5.988 1.00 0.00 H new ATOM 0 HD22 ASN A 98 6.932 8.746 7.282 1.00 0.00 H new ATOM 1518 N GLY A 99 9.348 3.753 4.546 1.00 0.00 N ATOM 1519 CA GLY A 99 10.530 2.913 4.499 1.00 0.00 C ATOM 1520 C GLY A 99 10.961 2.598 3.080 1.00 0.00 C ATOM 1521 O GLY A 99 10.742 3.394 2.167 1.00 0.00 O ATOM 0 H GLY A 99 8.570 3.430 3.972 1.00 0.00 H new ATOM 0 HA2 GLY A 99 11.347 3.411 5.022 1.00 0.00 H new ATOM 0 HA3 GLY A 99 10.332 1.982 5.030 1.00 0.00 H new ATOM 1525 N GLU A 100 11.578 1.435 2.895 1.00 0.00 N ATOM 1526 CA GLU A 100 12.042 1.018 1.577 1.00 0.00 C ATOM 1527 C GLU A 100 10.870 0.847 0.616 1.00 0.00 C ATOM 1528 O GLU A 100 11.012 1.035 -0.592 1.00 0.00 O ATOM 1529 CB GLU A 100 12.829 -0.290 1.679 1.00 0.00 C ATOM 1530 CG GLU A 100 12.066 -1.406 2.375 1.00 0.00 C ATOM 1531 CD GLU A 100 12.984 -2.450 2.980 1.00 0.00 C ATOM 1532 OE1 GLU A 100 13.768 -3.061 2.224 1.00 0.00 O ATOM 1533 OE2 GLU A 100 12.918 -2.657 4.210 1.00 0.00 O ATOM 0 H GLU A 100 11.768 0.765 3.641 1.00 0.00 H new ATOM 0 HA GLU A 100 12.697 1.797 1.187 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.103 -0.619 0.677 1.00 0.00 H new ATOM 0 HB3 GLU A 100 13.758 -0.105 2.219 1.00 0.00 H new ATOM 0 HG2 GLU A 100 11.440 -0.979 3.159 1.00 0.00 H new ATOM 0 HG3 GLU A 100 11.398 -1.886 1.660 1.00 0.00 H new ATOM 1540 N ARG A 101 9.713 0.488 1.162 1.00 0.00 N ATOM 1541 CA ARG A 101 8.516 0.288 0.353 1.00 0.00 C ATOM 1542 C ARG A 101 8.682 -0.908 -0.579 1.00 0.00 C ATOM 1543 O ARG A 101 8.310 -0.853 -1.751 1.00 0.00 O ATOM 1544 CB ARG A 101 8.211 1.546 -0.463 1.00 0.00 C ATOM 1545 CG ARG A 101 6.839 1.530 -1.116 1.00 0.00 C ATOM 1546 CD ARG A 101 6.481 2.890 -1.694 1.00 0.00 C ATOM 1547 NE ARG A 101 7.554 3.432 -2.522 1.00 0.00 N ATOM 1548 CZ ARG A 101 7.846 2.980 -3.737 1.00 0.00 C ATOM 1549 NH1 ARG A 101 7.147 1.982 -4.262 1.00 0.00 N ATOM 1550 NH2 ARG A 101 8.838 3.525 -4.429 1.00 0.00 N ATOM 0 H ARG A 101 9.579 0.330 2.161 1.00 0.00 H new ATOM 0 HA ARG A 101 7.682 0.088 1.026 1.00 0.00 H new ATOM 0 HB2 ARG A 101 8.284 2.418 0.188 1.00 0.00 H new ATOM 0 HB3 ARG A 101 8.971 1.660 -1.236 1.00 0.00 H new ATOM 0 HG2 ARG A 101 6.820 0.781 -1.907 1.00 0.00 H new ATOM 0 HG3 ARG A 101 6.089 1.237 -0.382 1.00 0.00 H new ATOM 0 HD2 ARG A 101 5.572 2.803 -2.290 1.00 0.00 H new ATOM 0 HD3 ARG A 101 6.264 3.584 -0.882 1.00 0.00 H new ATOM 0 HE ARG A 101 8.110 4.200 -2.147 1.00 0.00 H new ATOM 0 HH11 ARG A 101 6.384 1.560 -3.733 1.00 0.00 H new ATOM 0 HH12 ARG A 101 7.373 1.637 -5.195 1.00 0.00 H new ATOM 0 HH21 ARG A 101 9.378 4.292 -4.029 1.00 0.00 H new ATOM 0 HH22 ARG A 101 9.061 3.177 -5.361 1.00 0.00 H new ATOM 1564 N THR A 102 9.246 -1.990 -0.050 1.00 0.00 N ATOM 1565 CA THR A 102 9.463 -3.199 -0.834 1.00 0.00 C ATOM 1566 C THR A 102 8.778 -4.401 -0.193 1.00 0.00 C ATOM 1567 O THR A 102 8.345 -4.341 0.959 1.00 0.00 O ATOM 1568 CB THR A 102 10.965 -3.504 -0.992 1.00 0.00 C ATOM 1569 OG1 THR A 102 11.569 -3.673 0.296 1.00 0.00 O ATOM 1570 CG2 THR A 102 11.668 -2.384 -1.744 1.00 0.00 C ATOM 0 H THR A 102 9.561 -2.053 0.918 1.00 0.00 H new ATOM 0 HA THR A 102 9.030 -3.019 -1.818 1.00 0.00 H new ATOM 0 HB THR A 102 11.068 -4.426 -1.565 1.00 0.00 H new ATOM 0 HG1 THR A 102 12.410 -3.171 0.332 1.00 0.00 H new ATOM 0 HG21 THR A 102 12.727 -2.621 -1.843 1.00 0.00 H new ATOM 0 HG22 THR A 102 11.226 -2.277 -2.734 1.00 0.00 H new ATOM 0 HG23 THR A 102 11.556 -1.450 -1.194 1.00 0.00 H new ATOM 1578 N LEU A 103 8.682 -5.492 -0.945 1.00 0.00 N ATOM 1579 CA LEU A 103 8.049 -6.709 -0.450 1.00 0.00 C ATOM 1580 C LEU A 103 8.697 -7.170 0.851 1.00 0.00 C ATOM 1581 O LEU A 103 8.013 -7.411 1.846 1.00 0.00 O ATOM 1582 CB LEU A 103 8.141 -7.818 -1.499 1.00 0.00 C ATOM 1583 CG LEU A 103 7.587 -9.182 -1.085 1.00 0.00 C ATOM 1584 CD1 LEU A 103 6.077 -9.116 -0.915 1.00 0.00 C ATOM 1585 CD2 LEU A 103 7.965 -10.244 -2.107 1.00 0.00 C ATOM 0 H LEU A 103 9.035 -5.559 -1.900 1.00 0.00 H new ATOM 0 HA LEU A 103 7.000 -6.489 -0.254 1.00 0.00 H new ATOM 0 HB2 LEU A 103 7.611 -7.489 -2.393 1.00 0.00 H new ATOM 0 HB3 LEU A 103 9.188 -7.942 -1.776 1.00 0.00 H new ATOM 0 HG LEU A 103 8.028 -9.456 -0.127 1.00 0.00 H new ATOM 0 HD11 LEU A 103 5.701 -10.096 -0.620 1.00 0.00 H new ATOM 0 HD12 LEU A 103 5.829 -8.386 -0.145 1.00 0.00 H new ATOM 0 HD13 LEU A 103 5.617 -8.819 -1.858 1.00 0.00 H new ATOM 0 HD21 LEU A 103 7.562 -11.208 -1.796 1.00 0.00 H new ATOM 0 HD22 LEU A 103 7.553 -9.976 -3.080 1.00 0.00 H new ATOM 0 HD23 LEU A 103 9.051 -10.310 -2.178 1.00 0.00 H new ATOM 1597 N ASP A 104 10.021 -7.287 0.838 1.00 0.00 N ATOM 1598 CA ASP A 104 10.763 -7.715 2.018 1.00 0.00 C ATOM 1599 C ASP A 104 10.742 -6.634 3.095 1.00 0.00 C ATOM 1600 O ASP A 104 10.770 -6.932 4.288 1.00 0.00 O ATOM 1601 CB ASP A 104 12.207 -8.052 1.644 1.00 0.00 C ATOM 1602 CG ASP A 104 12.353 -9.465 1.115 1.00 0.00 C ATOM 1603 OD1 ASP A 104 12.203 -9.659 -0.110 1.00 0.00 O ATOM 1604 OD2 ASP A 104 12.619 -10.377 1.925 1.00 0.00 O ATOM 0 H ASP A 104 10.602 -7.091 0.023 1.00 0.00 H new ATOM 0 HA ASP A 104 10.281 -8.608 2.416 1.00 0.00 H new ATOM 0 HB2 ASP A 104 12.558 -7.347 0.891 1.00 0.00 H new ATOM 0 HB3 ASP A 104 12.845 -7.927 2.519 1.00 0.00 H new ATOM 1609 N GLY A 105 10.693 -5.377 2.664 1.00 0.00 N ATOM 1610 CA GLY A 105 10.670 -4.271 3.603 1.00 0.00 C ATOM 1611 C GLY A 105 9.389 -4.223 4.411 1.00 0.00 C ATOM 1612 O GLY A 105 9.412 -3.947 5.611 1.00 0.00 O ATOM 0 H GLY A 105 10.669 -5.105 1.681 1.00 0.00 H new ATOM 0 HA2 GLY A 105 11.520 -4.356 4.280 1.00 0.00 H new ATOM 0 HA3 GLY A 105 10.788 -3.334 3.059 1.00 0.00 H new ATOM 1616 N PHE A 106 8.266 -4.491 3.753 1.00 0.00 N ATOM 1617 CA PHE A 106 6.968 -4.475 4.418 1.00 0.00 C ATOM 1618 C PHE A 106 6.917 -5.509 5.538 1.00 0.00 C ATOM 1619 O PHE A 106 6.425 -5.233 6.633 1.00 0.00 O ATOM 1620 CB PHE A 106 5.850 -4.745 3.408 1.00 0.00 C ATOM 1621 CG PHE A 106 5.747 -3.700 2.334 1.00 0.00 C ATOM 1622 CD1 PHE A 106 5.673 -2.356 2.662 1.00 0.00 C ATOM 1623 CD2 PHE A 106 5.724 -4.061 0.997 1.00 0.00 C ATOM 1624 CE1 PHE A 106 5.576 -1.392 1.677 1.00 0.00 C ATOM 1625 CE2 PHE A 106 5.628 -3.102 0.006 1.00 0.00 C ATOM 1626 CZ PHE A 106 5.556 -1.765 0.347 1.00 0.00 C ATOM 0 H PHE A 106 8.228 -4.722 2.760 1.00 0.00 H new ATOM 0 HA PHE A 106 6.824 -3.486 4.854 1.00 0.00 H new ATOM 0 HB2 PHE A 106 6.018 -5.717 2.943 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.899 -4.805 3.938 1.00 0.00 H new ATOM 0 HD1 PHE A 106 5.691 -2.058 3.700 1.00 0.00 H new ATOM 0 HD2 PHE A 106 5.782 -5.105 0.725 1.00 0.00 H new ATOM 0 HE1 PHE A 106 5.516 -0.348 1.947 1.00 0.00 H new ATOM 0 HE2 PHE A 106 5.609 -3.397 -1.033 1.00 0.00 H new ATOM 0 HZ PHE A 106 5.484 -1.013 -0.425 1.00 0.00 H new ATOM 1636 N LYS A 107 7.428 -6.703 5.257 1.00 0.00 N ATOM 1637 CA LYS A 107 7.443 -7.780 6.239 1.00 0.00 C ATOM 1638 C LYS A 107 8.090 -7.320 7.542 1.00 0.00 C ATOM 1639 O LYS A 107 7.578 -7.586 8.629 1.00 0.00 O ATOM 1640 CB LYS A 107 8.194 -8.993 5.685 1.00 0.00 C ATOM 1641 CG LYS A 107 7.652 -9.490 4.356 1.00 0.00 C ATOM 1642 CD LYS A 107 7.858 -10.986 4.194 1.00 0.00 C ATOM 1643 CE LYS A 107 7.784 -11.404 2.734 1.00 0.00 C ATOM 1644 NZ LYS A 107 7.625 -12.877 2.586 1.00 0.00 N ATOM 0 H LYS A 107 7.838 -6.949 4.356 1.00 0.00 H new ATOM 0 HA LYS A 107 6.411 -8.063 6.446 1.00 0.00 H new ATOM 0 HB2 LYS A 107 9.246 -8.734 5.565 1.00 0.00 H new ATOM 0 HB3 LYS A 107 8.146 -9.803 6.413 1.00 0.00 H new ATOM 0 HG2 LYS A 107 6.589 -9.259 4.286 1.00 0.00 H new ATOM 0 HG3 LYS A 107 8.147 -8.963 3.540 1.00 0.00 H new ATOM 0 HD2 LYS A 107 8.827 -11.267 4.605 1.00 0.00 H new ATOM 0 HD3 LYS A 107 7.101 -11.523 4.766 1.00 0.00 H new ATOM 0 HE2 LYS A 107 6.946 -10.898 2.254 1.00 0.00 H new ATOM 0 HE3 LYS A 107 8.689 -11.083 2.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 8.361 -13.243 1.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 7.716 -13.331 3.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 6.687 -13.087 2.189 1.00 0.00 H new ATOM 1658 N LYS A 108 9.217 -6.627 7.425 1.00 0.00 N ATOM 1659 CA LYS A 108 9.933 -6.126 8.592 1.00 0.00 C ATOM 1660 C LYS A 108 9.074 -5.139 9.376 1.00 0.00 C ATOM 1661 O LYS A 108 9.062 -5.152 10.607 1.00 0.00 O ATOM 1662 CB LYS A 108 11.240 -5.454 8.165 1.00 0.00 C ATOM 1663 CG LYS A 108 11.923 -6.140 6.995 1.00 0.00 C ATOM 1664 CD LYS A 108 13.411 -5.835 6.961 1.00 0.00 C ATOM 1665 CE LYS A 108 14.208 -6.860 7.752 1.00 0.00 C ATOM 1666 NZ LYS A 108 14.444 -8.104 6.969 1.00 0.00 N ATOM 0 H LYS A 108 9.655 -6.399 6.532 1.00 0.00 H new ATOM 0 HA LYS A 108 10.162 -6.974 9.238 1.00 0.00 H new ATOM 0 HB2 LYS A 108 11.035 -4.417 7.898 1.00 0.00 H new ATOM 0 HB3 LYS A 108 11.923 -5.436 9.014 1.00 0.00 H new ATOM 0 HG2 LYS A 108 11.773 -7.217 7.066 1.00 0.00 H new ATOM 0 HG3 LYS A 108 11.463 -5.815 6.062 1.00 0.00 H new ATOM 0 HD2 LYS A 108 13.757 -5.822 5.928 1.00 0.00 H new ATOM 0 HD3 LYS A 108 13.589 -4.840 7.369 1.00 0.00 H new ATOM 0 HE2 LYS A 108 15.165 -6.428 8.045 1.00 0.00 H new ATOM 0 HE3 LYS A 108 13.674 -7.105 8.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 14.990 -8.777 7.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 13.531 -8.530 6.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 14.976 -7.875 6.105 1.00 0.00 H new ATOM 1680 N PHE A 109 8.354 -4.286 8.655 1.00 0.00 N ATOM 1681 CA PHE A 109 7.491 -3.293 9.283 1.00 0.00 C ATOM 1682 C PHE A 109 6.333 -3.964 10.016 1.00 0.00 C ATOM 1683 O PHE A 109 5.991 -3.587 11.137 1.00 0.00 O ATOM 1684 CB PHE A 109 6.949 -2.320 8.233 1.00 0.00 C ATOM 1685 CG PHE A 109 6.128 -1.206 8.816 1.00 0.00 C ATOM 1686 CD1 PHE A 109 4.764 -1.360 9.009 1.00 0.00 C ATOM 1687 CD2 PHE A 109 6.719 -0.004 9.170 1.00 0.00 C ATOM 1688 CE1 PHE A 109 4.006 -0.337 9.545 1.00 0.00 C ATOM 1689 CE2 PHE A 109 5.966 1.023 9.707 1.00 0.00 C ATOM 1690 CZ PHE A 109 4.607 0.857 9.894 1.00 0.00 C ATOM 0 H PHE A 109 8.351 -4.263 7.635 1.00 0.00 H new ATOM 0 HA PHE A 109 8.086 -2.739 10.009 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.785 -1.893 7.679 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.341 -2.872 7.517 1.00 0.00 H new ATOM 0 HD1 PHE A 109 4.288 -2.291 8.737 1.00 0.00 H new ATOM 0 HD2 PHE A 109 7.780 0.132 9.025 1.00 0.00 H new ATOM 0 HE1 PHE A 109 2.944 -0.471 9.691 1.00 0.00 H new ATOM 0 HE2 PHE A 109 6.439 1.954 9.980 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.016 1.659 10.312 1.00 0.00 H new ATOM 1700 N LEU A 110 5.733 -4.960 9.374 1.00 0.00 N ATOM 1701 CA LEU A 110 4.612 -5.685 9.964 1.00 0.00 C ATOM 1702 C LEU A 110 5.080 -6.564 11.120 1.00 0.00 C ATOM 1703 O LEU A 110 4.641 -6.395 12.257 1.00 0.00 O ATOM 1704 CB LEU A 110 3.920 -6.543 8.904 1.00 0.00 C ATOM 1705 CG LEU A 110 3.243 -5.784 7.762 1.00 0.00 C ATOM 1706 CD1 LEU A 110 3.103 -6.674 6.537 1.00 0.00 C ATOM 1707 CD2 LEU A 110 1.883 -5.261 8.203 1.00 0.00 C ATOM 0 H LEU A 110 6.003 -5.284 8.445 1.00 0.00 H new ATOM 0 HA LEU A 110 3.902 -4.954 10.352 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.658 -7.221 8.475 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.170 -7.160 9.398 1.00 0.00 H new ATOM 0 HG LEU A 110 3.869 -4.932 7.496 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.619 -6.116 5.735 1.00 0.00 H new ATOM 0 HD12 LEU A 110 4.090 -6.999 6.208 1.00 0.00 H new ATOM 0 HD13 LEU A 110 2.499 -7.546 6.788 1.00 0.00 H new ATOM 0 HD21 LEU A 110 1.415 -4.723 7.378 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.249 -6.098 8.497 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.010 -4.587 9.050 1.00 0.00 H new ATOM 1719 N GLU A 111 5.975 -7.500 10.820 1.00 0.00 N ATOM 1720 CA GLU A 111 6.502 -8.404 11.836 1.00 0.00 C ATOM 1721 C GLU A 111 6.806 -7.652 13.128 1.00 0.00 C ATOM 1722 O GLU A 111 6.578 -8.163 14.225 1.00 0.00 O ATOM 1723 CB GLU A 111 7.768 -9.096 11.326 1.00 0.00 C ATOM 1724 CG GLU A 111 7.494 -10.208 10.327 1.00 0.00 C ATOM 1725 CD GLU A 111 8.619 -11.222 10.258 1.00 0.00 C ATOM 1726 OE1 GLU A 111 8.815 -11.959 11.246 1.00 0.00 O ATOM 1727 OE2 GLU A 111 9.304 -11.277 9.215 1.00 0.00 O ATOM 0 H GLU A 111 6.350 -7.652 9.884 1.00 0.00 H new ATOM 0 HA GLU A 111 5.743 -9.158 12.045 1.00 0.00 H new ATOM 0 HB2 GLU A 111 8.416 -8.353 10.861 1.00 0.00 H new ATOM 0 HB3 GLU A 111 8.314 -9.508 12.175 1.00 0.00 H new ATOM 0 HG2 GLU A 111 6.569 -10.716 10.599 1.00 0.00 H new ATOM 0 HG3 GLU A 111 7.340 -9.774 9.339 1.00 0.00 H new ATOM 1734 N SER A 112 7.323 -6.435 12.991 1.00 0.00 N ATOM 1735 CA SER A 112 7.662 -5.614 14.146 1.00 0.00 C ATOM 1736 C SER A 112 6.405 -5.177 14.891 1.00 0.00 C ATOM 1737 O SER A 112 6.365 -5.182 16.121 1.00 0.00 O ATOM 1738 CB SER A 112 8.461 -4.385 13.708 1.00 0.00 C ATOM 1739 OG SER A 112 9.709 -4.760 13.150 1.00 0.00 O ATOM 0 H SER A 112 7.516 -5.996 12.091 1.00 0.00 H new ATOM 0 HA SER A 112 8.272 -6.215 14.820 1.00 0.00 H new ATOM 0 HB2 SER A 112 7.888 -3.817 12.976 1.00 0.00 H new ATOM 0 HB3 SER A 112 8.624 -3.729 14.563 1.00 0.00 H new ATOM 0 HG SER A 112 9.564 -5.178 12.276 1.00 0.00 H new ATOM 1745 N GLY A 113 5.377 -4.800 14.136 1.00 0.00 N ATOM 1746 CA GLY A 113 4.132 -4.366 14.740 1.00 0.00 C ATOM 1747 C GLY A 113 3.826 -2.909 14.455 1.00 0.00 C ATOM 1748 O GLY A 113 3.303 -2.197 15.312 1.00 0.00 O ATOM 0 H GLY A 113 5.385 -4.788 13.116 1.00 0.00 H new ATOM 0 HA2 GLY A 113 3.316 -4.985 14.367 1.00 0.00 H new ATOM 0 HA3 GLY A 113 4.182 -4.519 15.818 1.00 0.00 H new ATOM 1752 N GLY A 114 4.154 -2.462 13.247 1.00 0.00 N ATOM 1753 CA GLY A 114 3.906 -1.082 12.873 1.00 0.00 C ATOM 1754 C GLY A 114 4.802 -0.110 13.614 1.00 0.00 C ATOM 1755 O GLY A 114 4.351 0.946 14.057 1.00 0.00 O ATOM 0 H GLY A 114 4.587 -3.031 12.520 1.00 0.00 H new ATOM 0 HA2 GLY A 114 4.059 -0.967 11.800 1.00 0.00 H new ATOM 0 HA3 GLY A 114 2.863 -0.836 13.074 1.00 0.00 H new ATOM 1759 N GLN A 115 6.075 -0.468 13.751 1.00 0.00 N ATOM 1760 CA GLN A 115 7.036 0.380 14.447 1.00 0.00 C ATOM 1761 C GLN A 115 7.715 1.342 13.477 1.00 0.00 C ATOM 1762 O GLN A 115 8.348 0.920 12.509 1.00 0.00 O ATOM 1763 CB GLN A 115 8.088 -0.478 15.153 1.00 0.00 C ATOM 1764 CG GLN A 115 7.621 -1.036 16.488 1.00 0.00 C ATOM 1765 CD GLN A 115 7.850 -0.072 17.635 1.00 0.00 C ATOM 1766 OE1 GLN A 115 8.883 -0.119 18.304 1.00 0.00 O ATOM 1767 NE2 GLN A 115 6.885 0.810 17.869 1.00 0.00 N ATOM 0 H GLN A 115 6.464 -1.339 13.390 1.00 0.00 H new ATOM 0 HA GLN A 115 6.495 0.964 15.191 1.00 0.00 H new ATOM 0 HB2 GLN A 115 8.368 -1.305 14.501 1.00 0.00 H new ATOM 0 HB3 GLN A 115 8.985 0.120 15.312 1.00 0.00 H new ATOM 0 HG2 GLN A 115 6.559 -1.276 16.426 1.00 0.00 H new ATOM 0 HG3 GLN A 115 8.147 -1.969 16.692 1.00 0.00 H new ATOM 0 HE21 GLN A 115 6.046 0.813 17.290 1.00 0.00 H new ATOM 0 HE22 GLN A 115 6.983 1.484 18.628 1.00 0.00 H new ATOM 1776 N SER A 116 7.578 2.637 13.743 1.00 0.00 N ATOM 1777 CA SER A 116 8.175 3.659 12.891 1.00 0.00 C ATOM 1778 C SER A 116 9.337 4.347 13.601 1.00 0.00 C ATOM 1779 O SER A 116 9.467 4.269 14.822 1.00 0.00 O ATOM 1780 CB SER A 116 7.123 4.695 12.489 1.00 0.00 C ATOM 1781 OG SER A 116 6.587 5.347 13.628 1.00 0.00 O ATOM 0 H SER A 116 7.059 3.003 14.541 1.00 0.00 H new ATOM 0 HA SER A 116 8.557 3.172 11.994 1.00 0.00 H new ATOM 0 HB2 SER A 116 7.570 5.432 11.821 1.00 0.00 H new ATOM 0 HB3 SER A 116 6.321 4.207 11.934 1.00 0.00 H new ATOM 0 HG SER A 116 5.919 6.005 13.344 1.00 0.00 H new ATOM 1787 N GLY A 117 10.180 5.022 12.825 1.00 0.00 N ATOM 1788 CA GLY A 117 11.321 5.714 13.396 1.00 0.00 C ATOM 1789 C GLY A 117 11.271 7.210 13.157 1.00 0.00 C ATOM 1790 O GLY A 117 10.897 7.676 12.081 1.00 0.00 O ATOM 0 H GLY A 117 10.093 5.102 11.812 1.00 0.00 H new ATOM 0 HA2 GLY A 117 11.359 5.522 14.468 1.00 0.00 H new ATOM 0 HA3 GLY A 117 12.238 5.311 12.967 1.00 0.00 H new ATOM 1794 N PRO A 118 11.652 7.990 14.180 1.00 0.00 N ATOM 1795 CA PRO A 118 11.657 9.453 14.100 1.00 0.00 C ATOM 1796 C PRO A 118 12.741 9.980 13.166 1.00 0.00 C ATOM 1797 O PRO A 118 13.624 9.235 12.743 1.00 0.00 O ATOM 1798 CB PRO A 118 11.937 9.886 15.542 1.00 0.00 C ATOM 1799 CG PRO A 118 12.665 8.736 16.148 1.00 0.00 C ATOM 1800 CD PRO A 118 12.110 7.502 15.492 1.00 0.00 C ATOM 0 HA PRO A 118 10.722 9.842 13.697 1.00 0.00 H new ATOM 0 HB2 PRO A 118 12.537 10.795 15.573 1.00 0.00 H new ATOM 0 HB3 PRO A 118 11.012 10.096 16.079 1.00 0.00 H new ATOM 0 HG2 PRO A 118 13.738 8.820 15.977 1.00 0.00 H new ATOM 0 HG3 PRO A 118 12.516 8.705 17.227 1.00 0.00 H new ATOM 0 HD2 PRO A 118 12.868 6.726 15.390 1.00 0.00 H new ATOM 0 HD3 PRO A 118 11.291 7.074 16.070 1.00 0.00 H new ATOM 1808 N SER A 119 12.667 11.269 12.849 1.00 0.00 N ATOM 1809 CA SER A 119 13.641 11.894 11.962 1.00 0.00 C ATOM 1810 C SER A 119 14.682 12.672 12.760 1.00 0.00 C ATOM 1811 O SER A 119 14.391 13.201 13.833 1.00 0.00 O ATOM 1812 CB SER A 119 12.937 12.828 10.975 1.00 0.00 C ATOM 1813 OG SER A 119 13.868 13.438 10.098 1.00 0.00 O ATOM 0 H SER A 119 11.943 11.900 13.193 1.00 0.00 H new ATOM 0 HA SER A 119 14.149 11.105 11.407 1.00 0.00 H new ATOM 0 HB2 SER A 119 12.203 12.266 10.398 1.00 0.00 H new ATOM 0 HB3 SER A 119 12.391 13.596 11.523 1.00 0.00 H new ATOM 0 HG SER A 119 13.393 14.028 9.476 1.00 0.00 H new ATOM 1819 N SER A 120 15.899 12.736 12.229 1.00 0.00 N ATOM 1820 CA SER A 120 16.987 13.445 12.893 1.00 0.00 C ATOM 1821 C SER A 120 17.460 14.625 12.050 1.00 0.00 C ATOM 1822 O SER A 120 17.209 14.684 10.847 1.00 0.00 O ATOM 1823 CB SER A 120 18.155 12.494 13.161 1.00 0.00 C ATOM 1824 OG SER A 120 18.590 11.870 11.965 1.00 0.00 O ATOM 0 H SER A 120 16.156 12.305 11.341 1.00 0.00 H new ATOM 0 HA SER A 120 16.613 13.826 13.843 1.00 0.00 H new ATOM 0 HB2 SER A 120 18.982 13.046 13.608 1.00 0.00 H new ATOM 0 HB3 SER A 120 17.852 11.734 13.882 1.00 0.00 H new ATOM 0 HG SER A 120 19.338 11.269 12.163 1.00 0.00 H new ATOM 1830 N GLY A 121 18.146 15.566 12.693 1.00 0.00 N ATOM 1831 CA GLY A 121 18.644 16.733 11.988 1.00 0.00 C ATOM 1832 C GLY A 121 20.039 17.126 12.431 1.00 0.00 C ATOM 1833 O GLY A 121 20.971 17.144 11.626 1.00 0.00 O ATOM 0 H GLY A 121 18.365 15.541 13.689 1.00 0.00 H new ATOM 0 HA2 GLY A 121 18.650 16.532 10.917 1.00 0.00 H new ATOM 0 HA3 GLY A 121 17.965 17.570 12.152 1.00 0.00 H new TER 1837 GLY A 121