USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1118 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 8 HIS : no HD1:sc= -3.05! C(o=-2.6!,f=-2.9!) USER MOD Set 1.2: A 135 ASN : amide:sc= 0.445 K(o=-2.6,f=-3.7) USER MOD Set 1.3: A 136 THR OG1 : rot -160:sc= 0.0408 USER MOD Set 2.1: A 92 THR OG1 : rot 100:sc= -0.0197 USER MOD Set 2.2: A 116 MET CE :methyl 149:sc= -0.0417 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= -0.089 X(o=-0.089,f=-0.33) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 5 HIS : no HE2:sc= 0.00144 X(o=0.0014,f=-0.032) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 7 HIS : no HD1:sc= -0.0464 X(o=-0.046,f=-0.18) USER MOD Single : A 10 MET CE :methyl 173:sc=-0.00427 (180deg=-0.154) USER MOD Single : A 14 HIS : no HD1:sc= -0.0193 X(o=-0.019,f=-0.22) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 CYS SG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= -0.146 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.169 K(o=-0.17,f=-2) USER MOD Single : A 51 TYR OH : rot 30:sc= -0.493 USER MOD Single : A 55 ASN : amide:sc= -3.36 X(o=-3.4,f=-2.9) USER MOD Single : A 60 CYS SG : rot -44:sc= 0.00167 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 158:sc= 0.0267 USER MOD Single : A 72 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 MET CE :methyl -109:sc= -1.44 (180deg=-5.54!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 62:sc= -0.845 USER MOD Single : A 85 LYS NZ :NH3+ -150:sc= 0 (180deg=-0.157) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 151:sc= -0.191 (180deg=-0.839) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot -82:sc= -0.316 USER MOD Single : A 106 SER OG : rot 180:sc= 0.0447 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 THR OG1 : rot -93:sc= 0.632 USER MOD Single : A 137 HIS : no HD1:sc= -0.0814 X(o=-0.081,f=0) USER MOD Single : A 138 HIS : no HD1:sc= -0.12 X(o=-0.12,f=-0.0011) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.633 -1.635 -5.511 1.00 4.55 N ATOM 2 CA MET A 1 -2.626 -1.494 -4.465 1.00 11.33 C ATOM 3 C MET A 1 -1.752 -0.268 -4.713 1.00 33.24 C ATOM 4 O MET A 1 -1.567 0.563 -3.824 1.00 41.25 O ATOM 5 CB MET A 1 -1.755 -2.749 -4.393 1.00 32.41 C ATOM 6 CG MET A 1 -2.381 -3.878 -3.589 1.00 41.22 C ATOM 7 SD MET A 1 -1.695 -4.010 -1.927 1.00 11.31 S ATOM 8 CE MET A 1 -0.830 -5.574 -2.040 1.00 75.25 C ATOM 0 H1 MET A 1 -4.215 -2.475 -5.321 1.00 4.55 H new ATOM 0 H2 MET A 1 -4.239 -0.790 -5.526 1.00 4.55 H new ATOM 0 H3 MET A 1 -3.163 -1.740 -6.433 1.00 4.55 H new ATOM 0 HA MET A 1 -3.142 -1.364 -3.514 1.00 11.33 H new ATOM 0 HB2 MET A 1 -1.556 -3.102 -5.405 1.00 32.41 H new ATOM 0 HB3 MET A 1 -0.793 -2.489 -3.951 1.00 32.41 H new ATOM 0 HG2 MET A 1 -3.457 -3.718 -3.522 1.00 41.22 H new ATOM 0 HG3 MET A 1 -2.231 -4.820 -4.116 1.00 41.22 H new ATOM 0 HE1 MET A 1 -0.352 -5.795 -1.086 1.00 75.25 H new ATOM 0 HE2 MET A 1 -1.539 -6.365 -2.283 1.00 75.25 H new ATOM 0 HE3 MET A 1 -0.072 -5.515 -2.821 1.00 75.25 H new ATOM 18 N ALA A 2 -1.218 -0.163 -5.925 1.00 22.52 N ATOM 19 CA ALA A 2 -0.365 0.961 -6.289 1.00 51.11 C ATOM 20 C ALA A 2 0.764 1.143 -5.281 1.00 23.13 C ATOM 21 O ALA A 2 0.712 2.030 -4.428 1.00 41.13 O ATOM 22 CB ALA A 2 -1.189 2.235 -6.397 1.00 14.43 C ATOM 0 H ALA A 2 -1.361 -0.843 -6.672 1.00 22.52 H new ATOM 0 HA ALA A 2 0.082 0.746 -7.260 1.00 51.11 H new ATOM 0 HB1 ALA A 2 -0.539 3.067 -6.669 1.00 14.43 H new ATOM 0 HB2 ALA A 2 -1.956 2.108 -7.161 1.00 14.43 H new ATOM 0 HB3 ALA A 2 -1.663 2.444 -5.438 1.00 14.43 H new ATOM 28 N HIS A 3 1.785 0.297 -5.383 1.00 35.12 N ATOM 29 CA HIS A 3 2.927 0.365 -4.479 1.00 23.31 C ATOM 30 C HIS A 3 3.589 1.738 -4.542 1.00 0.02 C ATOM 31 O HIS A 3 3.172 2.605 -5.311 1.00 21.21 O ATOM 32 CB HIS A 3 3.945 -0.721 -4.828 1.00 24.34 C ATOM 33 CG HIS A 3 3.556 -2.085 -4.346 1.00 14.24 C ATOM 34 ND1 HIS A 3 2.824 -2.296 -3.196 1.00 0.10 N ATOM 35 CD2 HIS A 3 3.798 -3.311 -4.866 1.00 3.42 C ATOM 36 CE1 HIS A 3 2.635 -3.593 -3.029 1.00 2.32 C ATOM 37 NE2 HIS A 3 3.216 -4.231 -4.029 1.00 1.41 N ATOM 0 H HIS A 3 1.844 -0.443 -6.082 1.00 35.12 H new ATOM 0 HA HIS A 3 2.566 0.202 -3.464 1.00 23.31 H new ATOM 0 HB2 HIS A 3 4.076 -0.751 -5.910 1.00 24.34 H new ATOM 0 HB3 HIS A 3 4.910 -0.454 -4.398 1.00 24.34 H new ATOM 0 HD2 HIS A 3 4.347 -3.526 -5.771 1.00 3.42 H new ATOM 0 HE1 HIS A 3 2.097 -4.053 -2.213 1.00 2.32 H new ATOM 0 HE2 HIS A 3 3.230 -5.243 -4.158 1.00 1.41 H new ATOM 45 N HIS A 4 4.622 1.930 -3.727 1.00 70.24 N ATOM 46 CA HIS A 4 5.341 3.198 -3.690 1.00 42.25 C ATOM 47 C HIS A 4 6.807 3.003 -4.067 1.00 73.23 C ATOM 48 O HIS A 4 7.400 1.963 -3.778 1.00 13.15 O ATOM 49 CB HIS A 4 5.239 3.826 -2.300 1.00 44.22 C ATOM 50 CG HIS A 4 4.119 3.274 -1.474 1.00 21.51 C ATOM 51 ND1 HIS A 4 4.266 2.187 -0.638 1.00 12.14 N ATOM 52 CD2 HIS A 4 2.829 3.665 -1.357 1.00 75.44 C ATOM 53 CE1 HIS A 4 3.113 1.933 -0.044 1.00 24.33 C ATOM 54 NE2 HIS A 4 2.225 2.815 -0.463 1.00 52.30 N ATOM 0 H HIS A 4 4.979 1.224 -3.084 1.00 70.24 H new ATOM 0 HA HIS A 4 4.883 3.868 -4.418 1.00 42.25 H new ATOM 0 HB2 HIS A 4 6.180 3.672 -1.771 1.00 44.22 H new ATOM 0 HB3 HIS A 4 5.105 4.903 -2.406 1.00 44.22 H new ATOM 0 HD2 HIS A 4 2.361 4.492 -1.871 1.00 75.44 H new ATOM 0 HE1 HIS A 4 2.929 1.139 0.664 1.00 24.33 H new ATOM 0 HE2 HIS A 4 1.249 2.858 -0.170 1.00 52.30 H new ATOM 62 N HIS A 5 7.385 4.009 -4.716 1.00 23.24 N ATOM 63 CA HIS A 5 8.782 3.947 -5.132 1.00 53.34 C ATOM 64 C HIS A 5 9.217 5.263 -5.771 1.00 13.13 C ATOM 65 O HIS A 5 8.402 6.163 -5.980 1.00 20.41 O ATOM 66 CB HIS A 5 8.992 2.796 -6.116 1.00 61.21 C ATOM 67 CG HIS A 5 10.177 1.940 -5.791 1.00 61.52 C ATOM 68 ND1 HIS A 5 10.141 0.928 -4.855 1.00 74.31 N ATOM 69 CD2 HIS A 5 11.437 1.948 -6.285 1.00 63.54 C ATOM 70 CE1 HIS A 5 11.327 0.352 -4.786 1.00 64.52 C ATOM 71 NE2 HIS A 5 12.132 0.952 -5.645 1.00 23.55 N ATOM 0 H HIS A 5 6.908 4.876 -4.965 1.00 23.24 H new ATOM 0 HA HIS A 5 9.392 3.774 -4.246 1.00 53.34 H new ATOM 0 HB2 HIS A 5 8.097 2.173 -6.131 1.00 61.21 H new ATOM 0 HB3 HIS A 5 9.113 3.204 -7.119 1.00 61.21 H new ATOM 0 HD1 HIS A 5 9.325 0.665 -4.302 1.00 74.31 H new ATOM 0 HD2 HIS A 5 11.824 2.614 -7.042 1.00 63.54 H new ATOM 0 HE1 HIS A 5 11.594 -0.470 -4.138 1.00 64.52 H new ATOM 79 N HIS A 6 10.506 5.369 -6.077 1.00 72.02 N ATOM 80 CA HIS A 6 11.049 6.575 -6.692 1.00 11.22 C ATOM 81 C HIS A 6 11.134 6.422 -8.207 1.00 64.53 C ATOM 82 O HIS A 6 11.166 5.306 -8.728 1.00 20.23 O ATOM 83 CB HIS A 6 12.433 6.886 -6.120 1.00 74.41 C ATOM 84 CG HIS A 6 12.530 6.676 -4.640 1.00 40.03 C ATOM 85 ND1 HIS A 6 11.612 7.184 -3.746 1.00 54.21 N ATOM 86 CD2 HIS A 6 13.444 6.007 -3.899 1.00 70.02 C ATOM 87 CE1 HIS A 6 11.957 6.838 -2.519 1.00 3.41 C ATOM 88 NE2 HIS A 6 13.066 6.123 -2.584 1.00 53.02 N ATOM 0 H HIS A 6 11.194 4.635 -5.909 1.00 72.02 H new ATOM 0 HA HIS A 6 10.376 7.402 -6.466 1.00 11.22 H new ATOM 0 HB2 HIS A 6 13.172 6.258 -6.617 1.00 74.41 H new ATOM 0 HB3 HIS A 6 12.688 7.921 -6.349 1.00 74.41 H new ATOM 0 HD2 HIS A 6 14.310 5.480 -4.273 1.00 70.02 H new ATOM 0 HE1 HIS A 6 11.423 7.096 -1.616 1.00 3.41 H new ATOM 0 HE2 HIS A 6 13.561 5.722 -1.787 1.00 53.02 H new ATOM 96 N HIS A 7 11.171 7.549 -8.911 1.00 33.04 N ATOM 97 CA HIS A 7 11.252 7.539 -10.367 1.00 2.41 C ATOM 98 C HIS A 7 10.077 6.777 -10.972 1.00 23.12 C ATOM 99 O HIS A 7 10.242 5.673 -11.492 1.00 41.14 O ATOM 100 CB HIS A 7 12.570 6.912 -10.821 1.00 25.32 C ATOM 101 CG HIS A 7 12.843 7.083 -12.283 1.00 41.15 C ATOM 102 ND1 HIS A 7 12.408 8.173 -13.008 1.00 32.24 N ATOM 103 CD2 HIS A 7 13.513 6.296 -13.157 1.00 70.23 C ATOM 104 CE1 HIS A 7 12.796 8.048 -14.264 1.00 25.51 C ATOM 105 NE2 HIS A 7 13.470 6.917 -14.381 1.00 55.11 N ATOM 0 H HIS A 7 11.146 8.481 -8.497 1.00 33.04 H new ATOM 0 HA HIS A 7 11.210 8.571 -10.715 1.00 2.41 H new ATOM 0 HB2 HIS A 7 13.388 7.355 -10.253 1.00 25.32 H new ATOM 0 HB3 HIS A 7 12.557 5.848 -10.584 1.00 25.32 H new ATOM 0 HD2 HIS A 7 13.992 5.354 -12.933 1.00 70.23 H new ATOM 0 HE1 HIS A 7 12.597 8.750 -15.060 1.00 25.51 H new ATOM 0 HE2 HIS A 7 13.890 6.563 -15.241 1.00 55.11 H new ATOM 113 N HIS A 8 8.891 7.372 -10.899 1.00 0.31 N ATOM 114 CA HIS A 8 7.688 6.749 -11.439 1.00 62.13 C ATOM 115 C HIS A 8 7.892 6.350 -12.898 1.00 34.43 C ATOM 116 O HIS A 8 7.915 7.200 -13.787 1.00 14.24 O ATOM 117 CB HIS A 8 6.497 7.701 -11.320 1.00 65.32 C ATOM 118 CG HIS A 8 6.301 8.244 -9.938 1.00 72.05 C ATOM 119 ND1 HIS A 8 6.714 7.580 -8.803 1.00 33.22 N ATOM 120 CD2 HIS A 8 5.733 9.396 -9.513 1.00 14.51 C ATOM 121 CE1 HIS A 8 6.406 8.299 -7.738 1.00 44.43 C ATOM 122 NE2 HIS A 8 5.811 9.407 -8.142 1.00 34.10 N ATOM 0 H HIS A 8 8.737 8.285 -10.471 1.00 0.31 H new ATOM 0 HA HIS A 8 7.483 5.849 -10.859 1.00 62.13 H new ATOM 0 HB2 HIS A 8 6.636 8.532 -12.012 1.00 65.32 H new ATOM 0 HB3 HIS A 8 5.592 7.178 -11.628 1.00 65.32 H new ATOM 0 HD2 HIS A 8 5.299 10.164 -10.136 1.00 14.51 H new ATOM 0 HE1 HIS A 8 6.607 8.027 -6.712 1.00 44.43 H new ATOM 0 HE2 HIS A 8 5.466 10.150 -7.534 1.00 34.10 H new ATOM 130 N ALA A 9 8.039 5.050 -13.135 1.00 43.43 N ATOM 131 CA ALA A 9 8.240 4.539 -14.485 1.00 74.34 C ATOM 132 C ALA A 9 8.173 3.015 -14.511 1.00 15.52 C ATOM 133 O ALA A 9 7.498 2.429 -15.356 1.00 75.30 O ATOM 134 CB ALA A 9 9.572 5.020 -15.040 1.00 25.53 C ATOM 0 H ALA A 9 8.023 4.333 -12.410 1.00 43.43 H new ATOM 0 HA ALA A 9 7.437 4.923 -15.115 1.00 74.34 H new ATOM 0 HB1 ALA A 9 9.708 4.630 -16.049 1.00 25.53 H new ATOM 0 HB2 ALA A 9 9.583 6.110 -15.067 1.00 25.53 H new ATOM 0 HB3 ALA A 9 10.381 4.665 -14.402 1.00 25.53 H new ATOM 140 N MET A 10 8.877 2.381 -13.579 1.00 42.25 N ATOM 141 CA MET A 10 8.897 0.925 -13.496 1.00 14.43 C ATOM 142 C MET A 10 7.647 0.405 -12.792 1.00 63.43 C ATOM 143 O MET A 10 7.027 -0.560 -13.240 1.00 24.21 O ATOM 144 CB MET A 10 10.148 0.453 -12.754 1.00 23.51 C ATOM 145 CG MET A 10 11.413 0.514 -13.595 1.00 72.43 C ATOM 146 SD MET A 10 12.352 2.030 -13.329 1.00 32.32 S ATOM 147 CE MET A 10 12.373 2.710 -14.985 1.00 43.25 C ATOM 0 H MET A 10 9.441 2.852 -12.871 1.00 42.25 H new ATOM 0 HA MET A 10 8.914 0.527 -14.511 1.00 14.43 H new ATOM 0 HB2 MET A 10 10.284 1.065 -11.863 1.00 23.51 H new ATOM 0 HB3 MET A 10 9.995 -0.572 -12.416 1.00 23.51 H new ATOM 0 HG2 MET A 10 12.042 -0.344 -13.360 1.00 72.43 H new ATOM 0 HG3 MET A 10 11.148 0.436 -14.649 1.00 72.43 H new ATOM 0 HE1 MET A 10 12.810 3.709 -14.963 1.00 43.25 H new ATOM 0 HE2 MET A 10 12.968 2.068 -15.634 1.00 43.25 H new ATOM 0 HE3 MET A 10 11.354 2.768 -15.367 1.00 43.25 H new ATOM 157 N VAL A 11 7.283 1.049 -11.688 1.00 50.23 N ATOM 158 CA VAL A 11 6.107 0.651 -10.923 1.00 42.25 C ATOM 159 C VAL A 11 4.862 1.385 -11.408 1.00 40.13 C ATOM 160 O VAL A 11 3.737 0.957 -11.149 1.00 12.30 O ATOM 161 CB VAL A 11 6.297 0.924 -9.419 1.00 63.35 C ATOM 162 CG1 VAL A 11 5.446 -0.027 -8.593 1.00 35.25 C ATOM 163 CG2 VAL A 11 7.765 0.806 -9.039 1.00 24.25 C ATOM 0 H VAL A 11 7.786 1.849 -11.303 1.00 50.23 H new ATOM 0 HA VAL A 11 5.977 -0.420 -11.077 1.00 42.25 H new ATOM 0 HB VAL A 11 5.971 1.942 -9.207 1.00 63.35 H new ATOM 0 HG11 VAL A 11 5.593 0.180 -7.533 1.00 35.25 H new ATOM 0 HG12 VAL A 11 4.395 0.111 -8.847 1.00 35.25 H new ATOM 0 HG13 VAL A 11 5.739 -1.055 -8.805 1.00 35.25 H new ATOM 0 HG21 VAL A 11 7.882 1.002 -7.973 1.00 24.25 H new ATOM 0 HG22 VAL A 11 8.119 -0.200 -9.264 1.00 24.25 H new ATOM 0 HG23 VAL A 11 8.347 1.531 -9.607 1.00 24.25 H new ATOM 173 N ILE A 12 5.071 2.492 -12.114 1.00 22.44 N ATOM 174 CA ILE A 12 3.965 3.284 -12.636 1.00 42.14 C ATOM 175 C ILE A 12 3.459 2.717 -13.958 1.00 73.50 C ATOM 176 O ILE A 12 2.285 2.864 -14.300 1.00 3.22 O ATOM 177 CB ILE A 12 4.375 4.754 -12.845 1.00 62.23 C ATOM 178 CG1 ILE A 12 3.159 5.671 -12.702 1.00 32.25 C ATOM 179 CG2 ILE A 12 5.023 4.934 -14.210 1.00 51.21 C ATOM 180 CD1 ILE A 12 3.118 6.419 -11.387 1.00 71.33 C ATOM 0 H ILE A 12 5.996 2.860 -12.337 1.00 22.44 H new ATOM 0 HA ILE A 12 3.167 3.239 -11.895 1.00 42.14 H new ATOM 0 HB ILE A 12 5.103 5.025 -12.080 1.00 62.23 H new ATOM 0 HG12 ILE A 12 3.159 6.391 -13.520 1.00 32.25 H new ATOM 0 HG13 ILE A 12 2.251 5.076 -12.801 1.00 32.25 H new ATOM 0 HG21 ILE A 12 5.307 5.978 -14.343 1.00 51.21 H new ATOM 0 HG22 ILE A 12 5.911 4.305 -14.277 1.00 51.21 H new ATOM 0 HG23 ILE A 12 4.316 4.648 -14.989 1.00 51.21 H new ATOM 0 HD11 ILE A 12 2.230 7.050 -11.355 1.00 71.33 H new ATOM 0 HD12 ILE A 12 3.087 5.706 -10.563 1.00 71.33 H new ATOM 0 HD13 ILE A 12 4.008 7.041 -11.294 1.00 71.33 H new ATOM 192 N ASP A 13 4.351 2.065 -14.696 1.00 53.43 N ATOM 193 CA ASP A 13 3.994 1.472 -15.980 1.00 10.12 C ATOM 194 C ASP A 13 3.166 0.206 -15.782 1.00 11.31 C ATOM 195 O ASP A 13 2.459 -0.234 -16.689 1.00 13.30 O ATOM 196 CB ASP A 13 5.254 1.151 -16.785 1.00 51.54 C ATOM 197 CG ASP A 13 4.950 0.370 -18.049 1.00 2.52 C ATOM 198 OD1 ASP A 13 4.640 1.005 -19.079 1.00 42.10 O ATOM 199 OD2 ASP A 13 5.023 -0.875 -18.008 1.00 22.33 O ATOM 0 H ASP A 13 5.326 1.934 -14.427 1.00 53.43 H new ATOM 0 HA ASP A 13 3.394 2.195 -16.532 1.00 10.12 H new ATOM 0 HB2 ASP A 13 5.760 2.080 -17.048 1.00 51.54 H new ATOM 0 HB3 ASP A 13 5.942 0.578 -16.164 1.00 51.54 H new ATOM 204 N HIS A 14 3.259 -0.376 -14.591 1.00 5.25 N ATOM 205 CA HIS A 14 2.519 -1.592 -14.274 1.00 22.04 C ATOM 206 C HIS A 14 1.091 -1.264 -13.848 1.00 43.42 C ATOM 207 O HIS A 14 0.137 -1.892 -14.307 1.00 31.21 O ATOM 208 CB HIS A 14 3.228 -2.371 -13.165 1.00 74.21 C ATOM 209 CG HIS A 14 4.258 -3.332 -13.673 1.00 22.11 C ATOM 210 ND1 HIS A 14 3.974 -4.329 -14.582 1.00 63.02 N ATOM 211 CD2 HIS A 14 5.578 -3.443 -13.395 1.00 21.44 C ATOM 212 CE1 HIS A 14 5.075 -5.013 -14.840 1.00 33.10 C ATOM 213 NE2 HIS A 14 6.062 -4.495 -14.132 1.00 65.43 N ATOM 0 H HIS A 14 3.840 -0.025 -13.829 1.00 5.25 H new ATOM 0 HA HIS A 14 2.479 -2.208 -15.172 1.00 22.04 H new ATOM 0 HB2 HIS A 14 3.705 -1.666 -12.485 1.00 74.21 H new ATOM 0 HB3 HIS A 14 2.485 -2.920 -12.586 1.00 74.21 H new ATOM 0 HD2 HIS A 14 6.145 -2.820 -12.719 1.00 21.44 H new ATOM 0 HE1 HIS A 14 5.154 -5.852 -15.515 1.00 33.10 H new ATOM 0 HE2 HIS A 14 7.028 -4.823 -14.133 1.00 65.43 H new ATOM 221 N ILE A 15 0.953 -0.277 -12.969 1.00 41.23 N ATOM 222 CA ILE A 15 -0.358 0.134 -12.483 1.00 10.30 C ATOM 223 C ILE A 15 -1.278 0.515 -13.638 1.00 32.02 C ATOM 224 O ILE A 15 -2.502 0.446 -13.520 1.00 34.14 O ATOM 225 CB ILE A 15 -0.251 1.326 -11.513 1.00 25.41 C ATOM 226 CG1 ILE A 15 0.610 0.951 -10.305 1.00 4.54 C ATOM 227 CG2 ILE A 15 -1.635 1.771 -11.066 1.00 42.41 C ATOM 228 CD1 ILE A 15 1.211 2.146 -9.597 1.00 51.24 C ATOM 0 H ILE A 15 1.733 0.253 -12.579 1.00 41.23 H new ATOM 0 HA ILE A 15 -0.779 -0.720 -11.952 1.00 10.30 H new ATOM 0 HB ILE A 15 0.226 2.157 -12.032 1.00 25.41 H new ATOM 0 HG12 ILE A 15 0.003 0.387 -9.597 1.00 4.54 H new ATOM 0 HG13 ILE A 15 1.413 0.291 -10.632 1.00 4.54 H new ATOM 0 HG21 ILE A 15 -1.543 2.614 -10.381 1.00 42.41 H new ATOM 0 HG22 ILE A 15 -2.219 2.072 -11.936 1.00 42.41 H new ATOM 0 HG23 ILE A 15 -2.137 0.946 -10.560 1.00 42.41 H new ATOM 0 HD11 ILE A 15 1.808 1.805 -8.751 1.00 51.24 H new ATOM 0 HD12 ILE A 15 1.845 2.699 -10.290 1.00 51.24 H new ATOM 0 HD13 ILE A 15 0.413 2.796 -9.239 1.00 51.24 H new ATOM 240 N LEU A 16 -0.681 0.915 -14.755 1.00 54.31 N ATOM 241 CA LEU A 16 -1.447 1.305 -15.934 1.00 11.51 C ATOM 242 C LEU A 16 -2.456 0.225 -16.310 1.00 12.20 C ATOM 243 O LEU A 16 -3.651 0.494 -16.439 1.00 62.21 O ATOM 244 CB LEU A 16 -0.508 1.574 -17.111 1.00 25.41 C ATOM 245 CG LEU A 16 -1.160 1.626 -18.493 1.00 34.04 C ATOM 246 CD1 LEU A 16 -0.655 2.827 -19.277 1.00 24.31 C ATOM 247 CD2 LEU A 16 -0.895 0.337 -19.257 1.00 11.11 C ATOM 0 H LEU A 16 0.331 0.978 -14.869 1.00 54.31 H new ATOM 0 HA LEU A 16 -1.992 2.218 -15.696 1.00 11.51 H new ATOM 0 HB2 LEU A 16 -0.000 2.522 -16.935 1.00 25.41 H new ATOM 0 HB3 LEU A 16 0.259 0.799 -17.122 1.00 25.41 H new ATOM 0 HG LEU A 16 -2.237 1.731 -18.362 1.00 34.04 H new ATOM 0 HD11 LEU A 16 -1.130 2.847 -20.258 1.00 24.31 H new ATOM 0 HD12 LEU A 16 -0.898 3.742 -18.737 1.00 24.31 H new ATOM 0 HD13 LEU A 16 0.426 2.754 -19.399 1.00 24.31 H new ATOM 0 HD21 LEU A 16 -1.367 0.392 -20.238 1.00 11.11 H new ATOM 0 HD22 LEU A 16 0.180 0.200 -19.378 1.00 11.11 H new ATOM 0 HD23 LEU A 16 -1.308 -0.506 -18.703 1.00 11.11 H new ATOM 259 N LYS A 17 -1.968 -0.999 -16.483 1.00 12.53 N ATOM 260 CA LYS A 17 -2.827 -2.122 -16.840 1.00 44.44 C ATOM 261 C LYS A 17 -3.870 -2.375 -15.757 1.00 74.14 C ATOM 262 O LYS A 17 -4.887 -3.026 -16.002 1.00 51.22 O ATOM 263 CB LYS A 17 -1.987 -3.382 -17.060 1.00 30.25 C ATOM 264 CG LYS A 17 -1.083 -3.307 -18.278 1.00 54.01 C ATOM 265 CD LYS A 17 -0.992 -4.647 -18.988 1.00 73.23 C ATOM 266 CE LYS A 17 -0.643 -4.476 -20.459 1.00 33.12 C ATOM 267 NZ LYS A 17 -1.857 -4.485 -21.322 1.00 10.54 N ATOM 0 H LYS A 17 -0.982 -1.238 -16.382 1.00 12.53 H new ATOM 0 HA LYS A 17 -3.345 -1.872 -17.766 1.00 44.44 H new ATOM 0 HB2 LYS A 17 -1.376 -3.560 -16.175 1.00 30.25 H new ATOM 0 HB3 LYS A 17 -2.653 -4.238 -17.165 1.00 30.25 H new ATOM 0 HG2 LYS A 17 -1.463 -2.554 -18.968 1.00 54.01 H new ATOM 0 HG3 LYS A 17 -0.086 -2.987 -17.974 1.00 54.01 H new ATOM 0 HD2 LYS A 17 -0.237 -5.266 -18.503 1.00 73.23 H new ATOM 0 HD3 LYS A 17 -1.942 -5.173 -18.897 1.00 73.23 H new ATOM 0 HE2 LYS A 17 -0.106 -3.538 -20.598 1.00 33.12 H new ATOM 0 HE3 LYS A 17 0.028 -5.277 -20.768 1.00 33.12 H new ATOM 0 HZ1 LYS A 17 -1.577 -4.366 -22.316 1.00 10.54 H new ATOM 0 HZ2 LYS A 17 -2.357 -5.390 -21.209 1.00 10.54 H new ATOM 0 HZ3 LYS A 17 -2.486 -3.705 -21.044 1.00 10.54 H new ATOM 281 N CYS A 18 -3.613 -1.857 -14.562 1.00 14.23 N ATOM 282 CA CYS A 18 -4.532 -2.027 -13.441 1.00 43.12 C ATOM 283 C CYS A 18 -5.724 -1.084 -13.567 1.00 42.13 C ATOM 284 O CYS A 18 -6.856 -1.451 -13.251 1.00 64.24 O ATOM 285 CB CYS A 18 -3.806 -1.777 -12.118 1.00 74.41 C ATOM 286 SG CYS A 18 -4.414 -2.781 -10.742 1.00 55.23 S ATOM 0 H CYS A 18 -2.776 -1.316 -14.343 1.00 14.23 H new ATOM 0 HA CYS A 18 -4.901 -3.053 -13.457 1.00 43.12 H new ATOM 0 HB2 CYS A 18 -2.743 -1.975 -12.256 1.00 74.41 H new ATOM 0 HB3 CYS A 18 -3.903 -0.723 -11.856 1.00 74.41 H new ATOM 0 HG CYS A 18 -3.737 -2.500 -9.668 1.00 55.23 H new ATOM 292 N VAL A 19 -5.462 0.134 -14.030 1.00 2.52 N ATOM 293 CA VAL A 19 -6.513 1.131 -14.197 1.00 43.12 C ATOM 294 C VAL A 19 -7.162 1.019 -15.572 1.00 15.02 C ATOM 295 O VAL A 19 -8.333 1.359 -15.747 1.00 22.12 O ATOM 296 CB VAL A 19 -5.966 2.559 -14.015 1.00 1.41 C ATOM 297 CG1 VAL A 19 -5.976 3.308 -15.339 1.00 13.42 C ATOM 298 CG2 VAL A 19 -6.771 3.308 -12.963 1.00 73.53 C ATOM 0 H VAL A 19 -4.531 0.454 -14.296 1.00 2.52 H new ATOM 0 HA VAL A 19 -7.260 0.935 -13.428 1.00 43.12 H new ATOM 0 HB VAL A 19 -4.934 2.493 -13.671 1.00 1.41 H new ATOM 0 HG11 VAL A 19 -5.586 4.315 -15.190 1.00 13.42 H new ATOM 0 HG12 VAL A 19 -5.352 2.780 -16.060 1.00 13.42 H new ATOM 0 HG13 VAL A 19 -6.997 3.366 -15.716 1.00 13.42 H new ATOM 0 HG21 VAL A 19 -6.371 4.315 -12.847 1.00 73.53 H new ATOM 0 HG22 VAL A 19 -7.814 3.366 -13.276 1.00 73.53 H new ATOM 0 HG23 VAL A 19 -6.706 2.780 -12.011 1.00 73.53 H new ATOM 308 N PHE A 20 -6.396 0.540 -16.545 1.00 65.54 N ATOM 309 CA PHE A 20 -6.896 0.383 -17.906 1.00 31.40 C ATOM 310 C PHE A 20 -7.709 -0.902 -18.042 1.00 10.43 C ATOM 311 O PHE A 20 -8.494 -1.056 -18.977 1.00 71.03 O ATOM 312 CB PHE A 20 -5.734 0.372 -18.901 1.00 72.45 C ATOM 313 CG PHE A 20 -5.952 1.268 -20.087 1.00 1.02 C ATOM 314 CD1 PHE A 20 -7.195 1.346 -20.694 1.00 63.34 C ATOM 315 CD2 PHE A 20 -4.914 2.033 -20.594 1.00 24.32 C ATOM 316 CE1 PHE A 20 -7.399 2.170 -21.785 1.00 64.22 C ATOM 317 CE2 PHE A 20 -5.112 2.859 -21.684 1.00 24.11 C ATOM 318 CZ PHE A 20 -6.355 2.927 -22.281 1.00 72.41 C ATOM 0 H PHE A 20 -5.426 0.253 -16.417 1.00 65.54 H new ATOM 0 HA PHE A 20 -7.547 1.229 -18.127 1.00 31.40 H new ATOM 0 HB2 PHE A 20 -4.823 0.678 -18.387 1.00 72.45 H new ATOM 0 HB3 PHE A 20 -5.575 -0.648 -19.251 1.00 72.45 H new ATOM 0 HD1 PHE A 20 -8.014 0.756 -20.310 1.00 63.34 H new ATOM 0 HD2 PHE A 20 -3.939 1.983 -20.132 1.00 24.32 H new ATOM 0 HE1 PHE A 20 -8.373 2.222 -22.249 1.00 64.22 H new ATOM 0 HE2 PHE A 20 -4.295 3.451 -22.069 1.00 24.11 H new ATOM 0 HZ PHE A 20 -6.511 3.571 -23.134 1.00 72.41 H new ATOM 328 N ASP A 21 -7.514 -1.820 -17.102 1.00 12.12 N ATOM 329 CA ASP A 21 -8.229 -3.091 -17.115 1.00 63.10 C ATOM 330 C ASP A 21 -9.698 -2.892 -16.757 1.00 73.24 C ATOM 331 O ASP A 21 -10.590 -3.242 -17.531 1.00 61.10 O ATOM 332 CB ASP A 21 -7.582 -4.074 -16.138 1.00 61.33 C ATOM 333 CG ASP A 21 -8.451 -5.289 -15.879 1.00 62.33 C ATOM 334 OD1 ASP A 21 -8.573 -6.135 -16.789 1.00 74.34 O ATOM 335 OD2 ASP A 21 -9.009 -5.394 -14.767 1.00 0.22 O ATOM 0 H ASP A 21 -6.867 -1.708 -16.321 1.00 12.12 H new ATOM 0 HA ASP A 21 -8.172 -3.502 -18.123 1.00 63.10 H new ATOM 0 HB2 ASP A 21 -6.620 -4.397 -16.536 1.00 61.33 H new ATOM 0 HB3 ASP A 21 -7.382 -3.566 -15.195 1.00 61.33 H new ATOM 340 N LYS A 22 -9.944 -2.329 -15.579 1.00 52.13 N ATOM 341 CA LYS A 22 -11.305 -2.083 -15.118 1.00 11.24 C ATOM 342 C LYS A 22 -12.111 -1.333 -16.174 1.00 3.24 C ATOM 343 O LYS A 22 -13.280 -1.639 -16.408 1.00 53.42 O ATOM 344 CB LYS A 22 -11.286 -1.284 -13.813 1.00 12.44 C ATOM 345 CG LYS A 22 -10.446 -1.922 -12.720 1.00 71.52 C ATOM 346 CD LYS A 22 -11.298 -2.757 -11.778 1.00 64.02 C ATOM 347 CE LYS A 22 -11.964 -3.914 -12.506 1.00 63.34 C ATOM 348 NZ LYS A 22 -12.128 -5.103 -11.625 1.00 61.41 N ATOM 0 H LYS A 22 -9.218 -2.034 -14.926 1.00 52.13 H new ATOM 0 HA LYS A 22 -11.782 -3.047 -14.940 1.00 11.24 H new ATOM 0 HB2 LYS A 22 -10.904 -0.283 -14.015 1.00 12.44 H new ATOM 0 HB3 LYS A 22 -12.308 -1.168 -13.453 1.00 12.44 H new ATOM 0 HG2 LYS A 22 -9.677 -2.550 -13.170 1.00 71.52 H new ATOM 0 HG3 LYS A 22 -9.932 -1.145 -12.155 1.00 71.52 H new ATOM 0 HD2 LYS A 22 -10.677 -3.144 -10.970 1.00 64.02 H new ATOM 0 HD3 LYS A 22 -12.060 -2.127 -11.320 1.00 64.02 H new ATOM 0 HE2 LYS A 22 -12.940 -3.598 -12.874 1.00 63.34 H new ATOM 0 HE3 LYS A 22 -11.368 -4.187 -13.377 1.00 63.34 H new ATOM 0 HZ1 LYS A 22 -12.586 -5.870 -12.158 1.00 61.41 H new ATOM 0 HZ2 LYS A 22 -11.195 -5.421 -11.294 1.00 61.41 H new ATOM 0 HZ3 LYS A 22 -12.718 -4.850 -10.807 1.00 61.41 H new ATOM 362 N ILE A 23 -11.478 -0.352 -16.808 1.00 4.11 N ATOM 363 CA ILE A 23 -12.135 0.439 -17.841 1.00 15.04 C ATOM 364 C ILE A 23 -12.723 -0.455 -18.927 1.00 61.21 C ATOM 365 O ILE A 23 -13.778 -0.156 -19.488 1.00 61.41 O ATOM 366 CB ILE A 23 -11.162 1.442 -18.487 1.00 61.25 C ATOM 367 CG1 ILE A 23 -10.726 2.494 -17.466 1.00 0.20 C ATOM 368 CG2 ILE A 23 -11.808 2.104 -19.695 1.00 73.32 C ATOM 369 CD1 ILE A 23 -9.435 3.193 -17.832 1.00 30.25 C ATOM 0 H ILE A 23 -10.511 -0.086 -16.624 1.00 4.11 H new ATOM 0 HA ILE A 23 -12.939 0.990 -17.353 1.00 15.04 H new ATOM 0 HB ILE A 23 -10.277 0.901 -18.823 1.00 61.25 H new ATOM 0 HG12 ILE A 23 -11.516 3.238 -17.363 1.00 0.20 H new ATOM 0 HG13 ILE A 23 -10.608 2.017 -16.493 1.00 0.20 H new ATOM 0 HG21 ILE A 23 -11.108 2.810 -20.141 1.00 73.32 H new ATOM 0 HG22 ILE A 23 -12.072 1.343 -20.429 1.00 73.32 H new ATOM 0 HG23 ILE A 23 -12.708 2.634 -19.382 1.00 73.32 H new ATOM 0 HD11 ILE A 23 -9.187 3.925 -17.063 1.00 30.25 H new ATOM 0 HD12 ILE A 23 -8.632 2.459 -17.906 1.00 30.25 H new ATOM 0 HD13 ILE A 23 -9.554 3.699 -18.790 1.00 30.25 H new ATOM 381 N CYS A 24 -12.035 -1.553 -19.218 1.00 24.42 N ATOM 382 CA CYS A 24 -12.489 -2.493 -20.237 1.00 65.00 C ATOM 383 C CYS A 24 -13.558 -3.427 -19.678 1.00 45.54 C ATOM 384 O CYS A 24 -14.333 -4.020 -20.428 1.00 52.54 O ATOM 385 CB CYS A 24 -11.310 -3.309 -20.770 1.00 4.34 C ATOM 386 SG CYS A 24 -10.223 -2.392 -21.887 1.00 22.50 S ATOM 0 H CYS A 24 -11.160 -1.815 -18.763 1.00 24.42 H new ATOM 0 HA CYS A 24 -12.925 -1.920 -21.056 1.00 65.00 H new ATOM 0 HB2 CYS A 24 -10.723 -3.673 -19.927 1.00 4.34 H new ATOM 0 HB3 CYS A 24 -11.695 -4.185 -21.292 1.00 4.34 H new ATOM 0 HG CYS A 24 -9.256 -3.165 -22.283 1.00 22.50 H new ATOM 392 N LYS A 25 -13.592 -3.554 -18.356 1.00 40.02 N ATOM 393 CA LYS A 25 -14.565 -4.416 -17.695 1.00 41.42 C ATOM 394 C LYS A 25 -15.889 -3.686 -17.493 1.00 30.01 C ATOM 395 O LYS A 25 -16.931 -4.124 -17.982 1.00 23.53 O ATOM 396 CB LYS A 25 -14.021 -4.892 -16.346 1.00 55.12 C ATOM 397 CG LYS A 25 -13.476 -6.309 -16.376 1.00 63.04 C ATOM 398 CD LYS A 25 -14.126 -7.180 -15.314 1.00 40.24 C ATOM 399 CE LYS A 25 -13.203 -8.306 -14.875 1.00 61.01 C ATOM 400 NZ LYS A 25 -13.176 -9.419 -15.864 1.00 74.11 N ATOM 0 H LYS A 25 -12.957 -3.071 -17.721 1.00 40.02 H new ATOM 0 HA LYS A 25 -14.741 -5.281 -18.334 1.00 41.42 H new ATOM 0 HB2 LYS A 25 -13.231 -4.214 -16.023 1.00 55.12 H new ATOM 0 HB3 LYS A 25 -14.815 -4.833 -15.602 1.00 55.12 H new ATOM 0 HG2 LYS A 25 -13.648 -6.745 -17.360 1.00 63.04 H new ATOM 0 HG3 LYS A 25 -12.397 -6.288 -16.220 1.00 63.04 H new ATOM 0 HD2 LYS A 25 -14.390 -6.568 -14.452 1.00 40.24 H new ATOM 0 HD3 LYS A 25 -15.054 -7.599 -15.704 1.00 40.24 H new ATOM 0 HE2 LYS A 25 -12.194 -7.916 -14.739 1.00 61.01 H new ATOM 0 HE3 LYS A 25 -13.530 -8.688 -13.908 1.00 61.01 H new ATOM 0 HZ1 LYS A 25 -12.536 -10.166 -15.528 1.00 74.11 H new ATOM 0 HZ2 LYS A 25 -14.134 -9.808 -15.975 1.00 74.11 H new ATOM 0 HZ3 LYS A 25 -12.839 -9.061 -16.781 1.00 74.11 H new ATOM 414 N ILE A 26 -15.841 -2.571 -16.771 1.00 62.35 N ATOM 415 CA ILE A 26 -17.036 -1.780 -16.508 1.00 34.32 C ATOM 416 C ILE A 26 -17.502 -1.052 -17.764 1.00 72.53 C ATOM 417 O ILE A 26 -18.657 -0.641 -17.864 1.00 74.41 O ATOM 418 CB ILE A 26 -16.794 -0.748 -15.391 1.00 23.44 C ATOM 419 CG1 ILE A 26 -18.117 -0.363 -14.726 1.00 20.42 C ATOM 420 CG2 ILE A 26 -16.097 0.483 -15.949 1.00 53.44 C ATOM 421 CD1 ILE A 26 -18.675 -1.440 -13.822 1.00 70.40 C ATOM 0 H ILE A 26 -14.987 -2.196 -16.358 1.00 62.35 H new ATOM 0 HA ILE A 26 -17.810 -2.477 -16.187 1.00 34.32 H new ATOM 0 HB ILE A 26 -16.148 -1.196 -14.637 1.00 23.44 H new ATOM 0 HG12 ILE A 26 -17.971 0.548 -14.145 1.00 20.42 H new ATOM 0 HG13 ILE A 26 -18.850 -0.134 -15.500 1.00 20.42 H new ATOM 0 HG21 ILE A 26 -15.933 1.203 -15.147 1.00 53.44 H new ATOM 0 HG22 ILE A 26 -15.138 0.194 -16.379 1.00 53.44 H new ATOM 0 HG23 ILE A 26 -16.720 0.935 -16.721 1.00 53.44 H new ATOM 0 HD11 ILE A 26 -19.613 -1.098 -13.385 1.00 70.40 H new ATOM 0 HD12 ILE A 26 -18.853 -2.345 -14.402 1.00 70.40 H new ATOM 0 HD13 ILE A 26 -17.961 -1.653 -13.027 1.00 70.40 H new ATOM 433 N GLY A 27 -16.594 -0.898 -18.723 1.00 71.03 N ATOM 434 CA GLY A 27 -16.931 -0.221 -19.962 1.00 31.11 C ATOM 435 C GLY A 27 -17.702 -1.110 -20.917 1.00 62.44 C ATOM 436 O GLY A 27 -18.527 -0.631 -21.696 1.00 44.13 O ATOM 0 H GLY A 27 -15.631 -1.230 -18.664 1.00 71.03 H new ATOM 0 HA2 GLY A 27 -17.523 0.666 -19.738 1.00 31.11 H new ATOM 0 HA3 GLY A 27 -16.016 0.120 -20.446 1.00 31.11 H new ATOM 440 N THR A 28 -17.433 -2.411 -20.861 1.00 23.15 N ATOM 441 CA THR A 28 -18.105 -3.369 -21.729 1.00 65.32 C ATOM 442 C THR A 28 -19.352 -3.936 -21.061 1.00 71.24 C ATOM 443 O THR A 28 -20.250 -4.444 -21.733 1.00 3.31 O ATOM 444 CB THR A 28 -17.169 -4.531 -22.114 1.00 11.02 C ATOM 445 OG1 THR A 28 -17.557 -5.074 -23.381 1.00 13.23 O ATOM 446 CG2 THR A 28 -17.201 -5.624 -21.057 1.00 32.43 C ATOM 0 H THR A 28 -16.754 -2.825 -20.223 1.00 23.15 H new ATOM 0 HA THR A 28 -18.393 -2.830 -22.631 1.00 65.32 H new ATOM 0 HB THR A 28 -16.153 -4.143 -22.182 1.00 11.02 H new ATOM 0 HG1 THR A 28 -16.956 -5.811 -23.619 1.00 13.23 H new ATOM 0 HG21 THR A 28 -16.533 -6.434 -21.350 1.00 32.43 H new ATOM 0 HG22 THR A 28 -16.877 -5.215 -20.100 1.00 32.43 H new ATOM 0 HG23 THR A 28 -18.217 -6.008 -20.962 1.00 32.43 H new ATOM 454 N GLU A 29 -19.401 -3.846 -19.736 1.00 55.51 N ATOM 455 CA GLU A 29 -20.541 -4.350 -18.978 1.00 65.44 C ATOM 456 C GLU A 29 -21.785 -3.507 -19.241 1.00 31.25 C ATOM 457 O GLU A 29 -22.906 -4.016 -19.233 1.00 22.44 O ATOM 458 CB GLU A 29 -20.223 -4.359 -17.482 1.00 4.33 C ATOM 459 CG GLU A 29 -19.311 -5.499 -17.059 1.00 54.14 C ATOM 460 CD GLU A 29 -20.079 -6.688 -16.514 1.00 41.32 C ATOM 461 OE1 GLU A 29 -20.953 -6.481 -15.647 1.00 34.13 O ATOM 462 OE2 GLU A 29 -19.805 -7.824 -16.954 1.00 52.32 O ATOM 0 H GLU A 29 -18.666 -3.429 -19.165 1.00 55.51 H new ATOM 0 HA GLU A 29 -20.740 -5.370 -19.305 1.00 65.44 H new ATOM 0 HB2 GLU A 29 -19.755 -3.412 -17.213 1.00 4.33 H new ATOM 0 HB3 GLU A 29 -21.156 -4.424 -16.922 1.00 4.33 H new ATOM 0 HG2 GLU A 29 -18.713 -5.818 -17.913 1.00 54.14 H new ATOM 0 HG3 GLU A 29 -18.616 -5.141 -16.300 1.00 54.14 H new ATOM 469 N SER A 30 -21.579 -2.215 -19.472 1.00 10.31 N ATOM 470 CA SER A 30 -22.684 -1.299 -19.732 1.00 22.01 C ATOM 471 C SER A 30 -23.118 -1.372 -21.193 1.00 24.32 C ATOM 472 O SER A 30 -24.263 -1.071 -21.528 1.00 72.11 O ATOM 473 CB SER A 30 -22.280 0.134 -19.379 1.00 72.12 C ATOM 474 OG SER A 30 -22.878 1.065 -20.265 1.00 21.32 O ATOM 0 H SER A 30 -20.657 -1.778 -19.485 1.00 10.31 H new ATOM 0 HA SER A 30 -23.525 -1.597 -19.106 1.00 22.01 H new ATOM 0 HB2 SER A 30 -22.579 0.358 -18.355 1.00 72.12 H new ATOM 0 HB3 SER A 30 -21.195 0.231 -19.423 1.00 72.12 H new ATOM 0 HG SER A 30 -22.606 1.973 -20.018 1.00 21.32 H new ATOM 480 N VAL A 31 -22.193 -1.775 -22.059 1.00 1.13 N ATOM 481 CA VAL A 31 -22.478 -1.889 -23.484 1.00 34.31 C ATOM 482 C VAL A 31 -23.413 -3.061 -23.765 1.00 3.31 C ATOM 483 O VAL A 31 -24.065 -3.110 -24.807 1.00 62.52 O ATOM 484 CB VAL A 31 -21.186 -2.070 -24.302 1.00 52.24 C ATOM 485 CG1 VAL A 31 -21.504 -2.170 -25.787 1.00 24.54 C ATOM 486 CG2 VAL A 31 -20.220 -0.926 -24.032 1.00 15.02 C ATOM 0 H VAL A 31 -21.240 -2.028 -21.798 1.00 1.13 H new ATOM 0 HA VAL A 31 -22.963 -0.960 -23.785 1.00 34.31 H new ATOM 0 HB VAL A 31 -20.708 -3.000 -23.993 1.00 52.24 H new ATOM 0 HG11 VAL A 31 -20.579 -2.298 -26.349 1.00 24.54 H new ATOM 0 HG12 VAL A 31 -22.156 -3.025 -25.963 1.00 24.54 H new ATOM 0 HG13 VAL A 31 -22.005 -1.259 -26.114 1.00 24.54 H new ATOM 0 HG21 VAL A 31 -19.312 -1.070 -24.618 1.00 15.02 H new ATOM 0 HG22 VAL A 31 -20.687 0.018 -24.312 1.00 15.02 H new ATOM 0 HG23 VAL A 31 -19.968 -0.905 -22.972 1.00 15.02 H new ATOM 496 N GLU A 32 -23.472 -4.001 -22.827 1.00 72.33 N ATOM 497 CA GLU A 32 -24.327 -5.173 -22.975 1.00 73.21 C ATOM 498 C GLU A 32 -25.734 -4.889 -22.456 1.00 60.21 C ATOM 499 O GLU A 32 -26.718 -5.055 -23.176 1.00 61.22 O ATOM 500 CB GLU A 32 -23.728 -6.367 -22.229 1.00 2.12 C ATOM 501 CG GLU A 32 -22.762 -7.187 -23.068 1.00 13.21 C ATOM 502 CD GLU A 32 -21.318 -6.767 -22.873 1.00 53.11 C ATOM 503 OE1 GLU A 32 -20.719 -7.158 -21.850 1.00 10.43 O ATOM 504 OE2 GLU A 32 -20.788 -6.047 -23.745 1.00 64.21 O ATOM 0 H GLU A 32 -22.939 -3.974 -21.958 1.00 72.33 H new ATOM 0 HA GLU A 32 -24.391 -5.412 -24.036 1.00 73.21 H new ATOM 0 HB2 GLU A 32 -23.209 -6.006 -21.341 1.00 2.12 H new ATOM 0 HB3 GLU A 32 -24.536 -7.013 -21.886 1.00 2.12 H new ATOM 0 HG2 GLU A 32 -22.868 -8.241 -22.811 1.00 13.21 H new ATOM 0 HG3 GLU A 32 -23.026 -7.088 -24.121 1.00 13.21 H new ATOM 511 N ALA A 33 -25.820 -4.461 -21.201 1.00 41.30 N ATOM 512 CA ALA A 33 -27.105 -4.152 -20.585 1.00 64.15 C ATOM 513 C ALA A 33 -27.900 -3.169 -21.438 1.00 22.01 C ATOM 514 O ALA A 33 -29.128 -3.137 -21.383 1.00 13.03 O ATOM 515 CB ALA A 33 -26.898 -3.593 -19.185 1.00 73.05 C ATOM 0 H ALA A 33 -25.015 -4.320 -20.591 1.00 41.30 H new ATOM 0 HA ALA A 33 -27.678 -5.076 -20.514 1.00 64.15 H new ATOM 0 HB1 ALA A 33 -27.865 -3.367 -18.737 1.00 73.05 H new ATOM 0 HB2 ALA A 33 -26.378 -4.329 -18.572 1.00 73.05 H new ATOM 0 HB3 ALA A 33 -26.302 -2.682 -19.241 1.00 73.05 H new ATOM 521 N GLY A 34 -27.190 -2.367 -22.226 1.00 21.01 N ATOM 522 CA GLY A 34 -27.847 -1.393 -23.078 1.00 63.10 C ATOM 523 C GLY A 34 -28.650 -2.042 -24.188 1.00 10.22 C ATOM 524 O GLY A 34 -29.747 -1.589 -24.515 1.00 40.04 O ATOM 0 H GLY A 34 -26.172 -2.374 -22.289 1.00 21.01 H new ATOM 0 HA2 GLY A 34 -28.506 -0.771 -22.472 1.00 63.10 H new ATOM 0 HA3 GLY A 34 -27.098 -0.732 -23.514 1.00 63.10 H new ATOM 528 N ARG A 35 -28.103 -3.104 -24.769 1.00 64.20 N ATOM 529 CA ARG A 35 -28.774 -3.814 -25.851 1.00 35.33 C ATOM 530 C ARG A 35 -29.682 -4.911 -25.300 1.00 42.32 C ATOM 531 O ARG A 35 -30.633 -5.333 -25.959 1.00 13.13 O ATOM 532 CB ARG A 35 -27.746 -4.421 -26.807 1.00 52.12 C ATOM 533 CG ARG A 35 -26.460 -3.618 -26.908 1.00 2.33 C ATOM 534 CD ARG A 35 -26.735 -2.169 -27.279 1.00 12.12 C ATOM 535 NE ARG A 35 -26.211 -1.239 -26.282 1.00 31.43 N ATOM 536 CZ ARG A 35 -25.946 0.037 -26.535 1.00 2.41 C ATOM 537 NH1 ARG A 35 -26.155 0.534 -27.746 1.00 61.34 N ATOM 538 NH2 ARG A 35 -25.471 0.821 -25.575 1.00 22.41 N ATOM 0 H ARG A 35 -27.196 -3.492 -24.509 1.00 64.20 H new ATOM 0 HA ARG A 35 -29.388 -3.097 -26.396 1.00 35.33 H new ATOM 0 HB2 ARG A 35 -27.508 -5.432 -26.477 1.00 52.12 H new ATOM 0 HB3 ARG A 35 -28.190 -4.506 -27.799 1.00 52.12 H new ATOM 0 HG2 ARG A 35 -25.930 -3.657 -25.956 1.00 2.33 H new ATOM 0 HG3 ARG A 35 -25.806 -4.068 -27.655 1.00 2.33 H new ATOM 0 HD2 ARG A 35 -26.286 -1.952 -28.248 1.00 12.12 H new ATOM 0 HD3 ARG A 35 -27.810 -2.020 -27.384 1.00 12.12 H new ATOM 0 HE ARG A 35 -26.039 -1.589 -25.340 1.00 31.43 H new ATOM 0 HH11 ARG A 35 -26.520 -0.064 -28.487 1.00 61.34 H new ATOM 0 HH12 ARG A 35 -25.950 1.515 -27.937 1.00 61.34 H new ATOM 0 HH21 ARG A 35 -25.309 0.443 -24.641 1.00 22.41 H new ATOM 0 HH22 ARG A 35 -25.268 1.801 -25.771 1.00 22.41 H new ATOM 552 N LEU A 36 -29.381 -5.368 -24.090 1.00 1.02 N ATOM 553 CA LEU A 36 -30.169 -6.416 -23.450 1.00 43.02 C ATOM 554 C LEU A 36 -31.467 -5.852 -22.883 1.00 54.41 C ATOM 555 O LEU A 36 -32.504 -6.515 -22.902 1.00 75.14 O ATOM 556 CB LEU A 36 -29.359 -7.082 -22.336 1.00 12.30 C ATOM 557 CG LEU A 36 -28.735 -8.435 -22.677 1.00 31.42 C ATOM 558 CD1 LEU A 36 -29.812 -9.438 -23.060 1.00 71.32 C ATOM 559 CD2 LEU A 36 -27.718 -8.287 -23.799 1.00 54.52 C ATOM 0 H LEU A 36 -28.597 -5.030 -23.532 1.00 1.02 H new ATOM 0 HA LEU A 36 -30.418 -7.161 -24.205 1.00 43.02 H new ATOM 0 HB2 LEU A 36 -28.562 -6.402 -22.038 1.00 12.30 H new ATOM 0 HB3 LEU A 36 -30.008 -7.212 -21.470 1.00 12.30 H new ATOM 0 HG LEU A 36 -28.218 -8.808 -21.793 1.00 31.42 H new ATOM 0 HD11 LEU A 36 -29.349 -10.395 -23.299 1.00 71.32 H new ATOM 0 HD12 LEU A 36 -30.502 -9.567 -22.226 1.00 71.32 H new ATOM 0 HD13 LEU A 36 -30.358 -9.071 -23.929 1.00 71.32 H new ATOM 0 HD21 LEU A 36 -27.284 -9.261 -24.028 1.00 54.52 H new ATOM 0 HD22 LEU A 36 -28.211 -7.891 -24.687 1.00 54.52 H new ATOM 0 HD23 LEU A 36 -26.929 -7.603 -23.487 1.00 54.52 H new ATOM 571 N ILE A 37 -31.403 -4.623 -22.381 1.00 71.01 N ATOM 572 CA ILE A 37 -32.575 -3.969 -21.812 1.00 44.41 C ATOM 573 C ILE A 37 -33.519 -3.482 -22.907 1.00 24.44 C ATOM 574 O ILE A 37 -34.718 -3.756 -22.872 1.00 23.03 O ATOM 575 CB ILE A 37 -32.177 -2.774 -20.925 1.00 21.21 C ATOM 576 CG1 ILE A 37 -31.957 -3.234 -19.482 1.00 52.40 C ATOM 577 CG2 ILE A 37 -33.244 -1.691 -20.985 1.00 62.30 C ATOM 578 CD1 ILE A 37 -31.189 -4.532 -19.372 1.00 4.24 C ATOM 0 H ILE A 37 -30.552 -4.061 -22.357 1.00 71.01 H new ATOM 0 HA ILE A 37 -33.085 -4.712 -21.200 1.00 44.41 H new ATOM 0 HB ILE A 37 -31.243 -2.357 -21.300 1.00 21.21 H new ATOM 0 HG12 ILE A 37 -31.420 -2.456 -18.939 1.00 52.40 H new ATOM 0 HG13 ILE A 37 -32.925 -3.352 -18.995 1.00 52.40 H new ATOM 0 HG21 ILE A 37 -32.948 -0.853 -20.353 1.00 62.30 H new ATOM 0 HG22 ILE A 37 -33.357 -1.348 -22.013 1.00 62.30 H new ATOM 0 HG23 ILE A 37 -34.193 -2.095 -20.631 1.00 62.30 H new ATOM 0 HD11 ILE A 37 -31.071 -4.797 -18.321 1.00 4.24 H new ATOM 0 HD12 ILE A 37 -31.735 -5.323 -19.886 1.00 4.24 H new ATOM 0 HD13 ILE A 37 -30.207 -4.413 -19.829 1.00 4.24 H new ATOM 590 N GLU A 38 -32.968 -2.761 -23.878 1.00 61.22 N ATOM 591 CA GLU A 38 -33.762 -2.238 -24.984 1.00 4.22 C ATOM 592 C GLU A 38 -34.509 -3.361 -25.697 1.00 31.25 C ATOM 593 O GLU A 38 -35.736 -3.333 -25.808 1.00 25.55 O ATOM 594 CB GLU A 38 -32.865 -1.496 -25.978 1.00 14.13 C ATOM 595 CG GLU A 38 -32.166 -0.286 -25.381 1.00 54.22 C ATOM 596 CD GLU A 38 -32.852 1.019 -25.738 1.00 33.31 C ATOM 597 OE1 GLU A 38 -34.051 0.984 -26.086 1.00 62.33 O ATOM 598 OE2 GLU A 38 -32.190 2.075 -25.668 1.00 45.02 O ATOM 0 H GLU A 38 -31.976 -2.526 -23.922 1.00 61.22 H new ATOM 0 HA GLU A 38 -34.494 -1.541 -24.575 1.00 4.22 H new ATOM 0 HB2 GLU A 38 -32.114 -2.186 -26.362 1.00 14.13 H new ATOM 0 HB3 GLU A 38 -33.467 -1.175 -26.828 1.00 14.13 H new ATOM 0 HG2 GLU A 38 -32.132 -0.389 -24.296 1.00 54.22 H new ATOM 0 HG3 GLU A 38 -31.134 -0.258 -25.731 1.00 54.22 H new ATOM 605 N LEU A 39 -33.762 -4.348 -26.178 1.00 62.14 N ATOM 606 CA LEU A 39 -34.352 -5.482 -26.881 1.00 54.13 C ATOM 607 C LEU A 39 -35.480 -6.102 -26.063 1.00 75.12 C ATOM 608 O LEU A 39 -36.489 -6.544 -26.613 1.00 61.42 O ATOM 609 CB LEU A 39 -33.284 -6.535 -27.179 1.00 20.42 C ATOM 610 CG LEU A 39 -32.531 -6.373 -28.500 1.00 31.42 C ATOM 611 CD1 LEU A 39 -32.101 -4.928 -28.695 1.00 43.11 C ATOM 612 CD2 LEU A 39 -31.326 -7.301 -28.544 1.00 22.30 C ATOM 0 H LEU A 39 -32.746 -4.386 -26.094 1.00 62.14 H new ATOM 0 HA LEU A 39 -34.767 -5.119 -27.821 1.00 54.13 H new ATOM 0 HB2 LEU A 39 -32.557 -6.527 -26.366 1.00 20.42 H new ATOM 0 HB3 LEU A 39 -33.758 -7.516 -27.172 1.00 20.42 H new ATOM 0 HG LEU A 39 -33.203 -6.644 -29.315 1.00 31.42 H new ATOM 0 HD11 LEU A 39 -31.567 -4.832 -29.640 1.00 43.11 H new ATOM 0 HD12 LEU A 39 -32.981 -4.285 -28.709 1.00 43.11 H new ATOM 0 HD13 LEU A 39 -31.446 -4.630 -27.876 1.00 43.11 H new ATOM 0 HD21 LEU A 39 -30.802 -7.172 -29.491 1.00 22.30 H new ATOM 0 HD22 LEU A 39 -30.652 -7.062 -27.721 1.00 22.30 H new ATOM 0 HD23 LEU A 39 -31.659 -8.335 -28.451 1.00 22.30 H new ATOM 624 N SER A 40 -35.304 -6.129 -24.746 1.00 42.00 N ATOM 625 CA SER A 40 -36.306 -6.696 -23.852 1.00 32.23 C ATOM 626 C SER A 40 -37.657 -6.015 -24.048 1.00 72.35 C ATOM 627 O SER A 40 -38.703 -6.663 -24.002 1.00 65.24 O ATOM 628 CB SER A 40 -35.859 -6.556 -22.395 1.00 42.14 C ATOM 629 OG SER A 40 -36.374 -7.610 -21.600 1.00 43.30 O ATOM 0 H SER A 40 -34.476 -5.765 -24.274 1.00 42.00 H new ATOM 0 HA SER A 40 -36.413 -7.754 -24.092 1.00 32.23 H new ATOM 0 HB2 SER A 40 -34.770 -6.556 -22.344 1.00 42.14 H new ATOM 0 HB3 SER A 40 -36.197 -5.599 -21.998 1.00 42.14 H new ATOM 0 HG SER A 40 -36.073 -7.499 -20.674 1.00 43.30 H new ATOM 635 N GLN A 41 -37.626 -4.705 -24.268 1.00 0.23 N ATOM 636 CA GLN A 41 -38.848 -3.935 -24.471 1.00 22.43 C ATOM 637 C GLN A 41 -39.286 -3.985 -25.931 1.00 0.03 C ATOM 638 O GLN A 41 -40.476 -4.089 -26.228 1.00 25.23 O ATOM 639 CB GLN A 41 -38.639 -2.483 -24.038 1.00 31.34 C ATOM 640 CG GLN A 41 -37.753 -2.336 -22.811 1.00 52.41 C ATOM 641 CD GLN A 41 -38.324 -3.032 -21.592 1.00 21.34 C ATOM 642 OE1 GLN A 41 -39.481 -3.453 -21.587 1.00 53.44 O ATOM 643 NE2 GLN A 41 -37.513 -3.159 -20.548 1.00 3.31 N ATOM 0 H GLN A 41 -36.768 -4.154 -24.310 1.00 0.23 H new ATOM 0 HA GLN A 41 -39.633 -4.379 -23.860 1.00 22.43 H new ATOM 0 HB2 GLN A 41 -38.197 -1.926 -24.864 1.00 31.34 H new ATOM 0 HB3 GLN A 41 -39.609 -2.031 -23.832 1.00 31.34 H new ATOM 0 HG2 GLN A 41 -36.766 -2.745 -23.029 1.00 52.41 H new ATOM 0 HG3 GLN A 41 -37.618 -1.277 -22.590 1.00 52.41 H new ATOM 0 HE21 GLN A 41 -36.561 -2.796 -20.594 1.00 3.31 H new ATOM 0 HE22 GLN A 41 -37.842 -3.620 -19.700 1.00 3.31 H new ATOM 652 N GLU A 42 -38.317 -3.909 -26.837 1.00 63.14 N ATOM 653 CA GLU A 42 -38.604 -3.944 -28.267 1.00 30.25 C ATOM 654 C GLU A 42 -37.318 -3.854 -29.082 1.00 44.05 C ATOM 655 O GLU A 42 -37.202 -4.457 -30.149 1.00 14.42 O ATOM 656 CB GLU A 42 -39.545 -2.799 -28.649 1.00 24.35 C ATOM 657 CG GLU A 42 -39.655 -2.576 -30.147 1.00 64.45 C ATOM 658 CD GLU A 42 -41.070 -2.258 -30.588 1.00 12.45 C ATOM 659 OE1 GLU A 42 -41.513 -1.109 -30.375 1.00 24.25 O ATOM 660 OE2 GLU A 42 -41.736 -3.156 -31.144 1.00 45.42 O ATOM 0 H GLU A 42 -37.327 -3.823 -26.607 1.00 63.14 H new ATOM 0 HA GLU A 42 -39.090 -4.894 -28.491 1.00 30.25 H new ATOM 0 HB2 GLU A 42 -40.537 -3.006 -28.247 1.00 24.35 H new ATOM 0 HB3 GLU A 42 -39.195 -1.880 -28.178 1.00 24.35 H new ATOM 0 HG2 GLU A 42 -38.996 -1.758 -30.438 1.00 64.45 H new ATOM 0 HG3 GLU A 42 -39.307 -3.467 -30.670 1.00 64.45 H new ATOM 667 N GLY A 43 -36.352 -3.095 -28.572 1.00 71.25 N ATOM 668 CA GLY A 43 -35.087 -2.939 -29.266 1.00 51.43 C ATOM 669 C GLY A 43 -35.066 -1.718 -30.165 1.00 0.13 C ATOM 670 O GLY A 43 -34.005 -1.160 -30.441 1.00 62.21 O ATOM 0 H GLY A 43 -36.423 -2.586 -27.691 1.00 71.25 H new ATOM 0 HA2 GLY A 43 -34.282 -2.862 -28.535 1.00 51.43 H new ATOM 0 HA3 GLY A 43 -34.891 -3.830 -29.863 1.00 51.43 H new ATOM 674 N GLY A 44 -36.243 -1.302 -30.624 1.00 24.12 N ATOM 675 CA GLY A 44 -36.332 -0.144 -31.493 1.00 54.51 C ATOM 676 C GLY A 44 -35.906 -0.451 -32.915 1.00 2.12 C ATOM 677 O GLY A 44 -35.972 -1.597 -33.356 1.00 70.40 O ATOM 0 H GLY A 44 -37.136 -1.747 -30.409 1.00 24.12 H new ATOM 0 HA2 GLY A 44 -37.357 0.226 -31.496 1.00 54.51 H new ATOM 0 HA3 GLY A 44 -35.706 0.654 -31.094 1.00 54.51 H new ATOM 681 N GLY A 45 -35.468 0.577 -33.635 1.00 43.22 N ATOM 682 CA GLY A 45 -35.037 0.391 -35.008 1.00 70.24 C ATOM 683 C GLY A 45 -34.055 1.455 -35.458 1.00 20.54 C ATOM 684 O GLY A 45 -34.011 2.547 -34.893 1.00 61.30 O ATOM 0 H GLY A 45 -35.404 1.535 -33.292 1.00 43.22 H new ATOM 0 HA2 GLY A 45 -34.576 -0.591 -35.111 1.00 70.24 H new ATOM 0 HA3 GLY A 45 -35.908 0.404 -35.664 1.00 70.24 H new ATOM 688 N GLY A 46 -33.263 1.135 -36.477 1.00 20.44 N ATOM 689 CA GLY A 46 -32.286 2.081 -36.982 1.00 70.04 C ATOM 690 C GLY A 46 -30.941 1.947 -36.297 1.00 44.42 C ATOM 691 O GLY A 46 -30.780 2.350 -35.146 1.00 22.22 O ATOM 0 H GLY A 46 -33.281 0.238 -36.961 1.00 20.44 H new ATOM 0 HA2 GLY A 46 -32.161 1.931 -38.054 1.00 70.04 H new ATOM 0 HA3 GLY A 46 -32.661 3.095 -36.843 1.00 70.04 H new ATOM 695 N GLY A 47 -29.970 1.379 -37.007 1.00 35.54 N ATOM 696 CA GLY A 47 -28.645 1.201 -36.443 1.00 12.15 C ATOM 697 C GLY A 47 -28.627 0.193 -35.311 1.00 11.24 C ATOM 698 O GLY A 47 -29.523 0.180 -34.468 1.00 30.34 O ATOM 0 H GLY A 47 -30.078 1.039 -37.963 1.00 35.54 H new ATOM 0 HA2 GLY A 47 -27.961 0.875 -37.226 1.00 12.15 H new ATOM 0 HA3 GLY A 47 -28.277 2.160 -36.077 1.00 12.15 H new ATOM 702 N GLY A 48 -27.604 -0.655 -35.292 1.00 24.51 N ATOM 703 CA GLY A 48 -27.493 -1.661 -34.252 1.00 21.33 C ATOM 704 C GLY A 48 -26.481 -1.286 -33.188 1.00 3.04 C ATOM 705 O GLY A 48 -26.046 -0.138 -33.091 1.00 14.00 O ATOM 0 H GLY A 48 -26.850 -0.664 -35.978 1.00 24.51 H new ATOM 0 HA2 GLY A 48 -28.468 -1.807 -33.787 1.00 21.33 H new ATOM 0 HA3 GLY A 48 -27.208 -2.613 -34.700 1.00 21.33 H new ATOM 709 N PRO A 49 -26.090 -2.270 -32.363 1.00 55.53 N ATOM 710 CA PRO A 49 -25.119 -2.060 -31.285 1.00 73.44 C ATOM 711 C PRO A 49 -23.711 -1.812 -31.814 1.00 41.22 C ATOM 712 O PRO A 49 -22.809 -1.446 -31.059 1.00 63.33 O ATOM 713 CB PRO A 49 -25.172 -3.374 -30.501 1.00 2.32 C ATOM 714 CG PRO A 49 -25.635 -4.387 -31.489 1.00 74.25 C ATOM 715 CD PRO A 49 -26.567 -3.662 -32.420 1.00 40.35 C ATOM 0 HA PRO A 49 -25.357 -1.180 -30.687 1.00 73.44 H new ATOM 0 HB2 PRO A 49 -24.193 -3.634 -30.097 1.00 2.32 H new ATOM 0 HB3 PRO A 49 -25.857 -3.303 -29.656 1.00 2.32 H new ATOM 0 HG2 PRO A 49 -24.793 -4.814 -32.034 1.00 74.25 H new ATOM 0 HG3 PRO A 49 -26.144 -5.213 -30.992 1.00 74.25 H new ATOM 0 HD2 PRO A 49 -26.516 -4.063 -33.432 1.00 40.35 H new ATOM 0 HD3 PRO A 49 -27.604 -3.745 -32.096 1.00 40.35 H new ATOM 723 N LEU A 50 -23.529 -2.011 -33.115 1.00 24.42 N ATOM 724 CA LEU A 50 -22.229 -1.808 -33.745 1.00 62.43 C ATOM 725 C LEU A 50 -21.933 -0.322 -33.917 1.00 0.24 C ATOM 726 O LEU A 50 -20.805 0.125 -33.707 1.00 50.23 O ATOM 727 CB LEU A 50 -22.184 -2.509 -35.104 1.00 52.14 C ATOM 728 CG LEU A 50 -22.503 -4.004 -35.099 1.00 64.45 C ATOM 729 CD1 LEU A 50 -23.226 -4.400 -36.377 1.00 65.55 C ATOM 730 CD2 LEU A 50 -21.229 -4.820 -34.930 1.00 72.22 C ATOM 0 H LEU A 50 -24.265 -2.313 -33.754 1.00 24.42 H new ATOM 0 HA LEU A 50 -21.467 -2.238 -33.095 1.00 62.43 H new ATOM 0 HB2 LEU A 50 -22.887 -2.010 -35.771 1.00 52.14 H new ATOM 0 HB3 LEU A 50 -21.190 -2.372 -35.528 1.00 52.14 H new ATOM 0 HG LEU A 50 -23.160 -4.213 -34.255 1.00 64.45 H new ATOM 0 HD11 LEU A 50 -23.445 -5.468 -36.355 1.00 65.55 H new ATOM 0 HD12 LEU A 50 -24.158 -3.840 -36.456 1.00 65.55 H new ATOM 0 HD13 LEU A 50 -22.594 -4.176 -37.237 1.00 65.55 H new ATOM 0 HD21 LEU A 50 -21.475 -5.882 -34.929 1.00 72.22 H new ATOM 0 HD22 LEU A 50 -20.548 -4.606 -35.754 1.00 72.22 H new ATOM 0 HD23 LEU A 50 -20.751 -4.557 -33.986 1.00 72.22 H new ATOM 742 N TYR A 51 -22.953 0.439 -34.296 1.00 54.02 N ATOM 743 CA TYR A 51 -22.803 1.876 -34.496 1.00 30.45 C ATOM 744 C TYR A 51 -22.541 2.585 -33.171 1.00 21.15 C ATOM 745 O TYR A 51 -21.780 3.551 -33.110 1.00 14.30 O ATOM 746 CB TYR A 51 -24.055 2.454 -35.157 1.00 70.33 C ATOM 747 CG TYR A 51 -24.406 3.844 -34.679 1.00 4.53 C ATOM 748 CD1 TYR A 51 -23.877 4.969 -35.301 1.00 21.41 C ATOM 749 CD2 TYR A 51 -25.267 4.034 -33.605 1.00 5.23 C ATOM 750 CE1 TYR A 51 -24.194 6.241 -34.866 1.00 61.04 C ATOM 751 CE2 TYR A 51 -25.590 5.303 -33.164 1.00 73.02 C ATOM 752 CZ TYR A 51 -25.051 6.403 -33.798 1.00 11.00 C ATOM 753 OH TYR A 51 -25.371 7.669 -33.363 1.00 65.10 O ATOM 0 H TYR A 51 -23.893 0.085 -34.471 1.00 54.02 H new ATOM 0 HA TYR A 51 -21.947 2.039 -35.151 1.00 30.45 H new ATOM 0 HB2 TYR A 51 -23.908 2.477 -36.237 1.00 70.33 H new ATOM 0 HB3 TYR A 51 -24.897 1.789 -34.964 1.00 70.33 H new ATOM 0 HD1 TYR A 51 -23.207 4.846 -36.139 1.00 21.41 H new ATOM 0 HD2 TYR A 51 -25.691 3.175 -33.106 1.00 5.23 H new ATOM 0 HE1 TYR A 51 -23.773 7.104 -35.360 1.00 61.04 H new ATOM 0 HE2 TYR A 51 -26.261 5.433 -32.328 1.00 73.02 H new ATOM 0 HH TYR A 51 -25.339 8.292 -34.119 1.00 65.10 H new ATOM 763 N PHE A 52 -23.176 2.097 -32.110 1.00 51.21 N ATOM 764 CA PHE A 52 -23.013 2.683 -30.785 1.00 10.32 C ATOM 765 C PHE A 52 -21.575 2.533 -30.297 1.00 31.13 C ATOM 766 O PHE A 52 -20.994 3.467 -29.745 1.00 0.24 O ATOM 767 CB PHE A 52 -23.972 2.025 -29.791 1.00 73.21 C ATOM 768 CG PHE A 52 -23.527 2.141 -28.361 1.00 70.23 C ATOM 769 CD1 PHE A 52 -23.791 3.288 -27.631 1.00 5.32 C ATOM 770 CD2 PHE A 52 -22.845 1.102 -27.748 1.00 15.23 C ATOM 771 CE1 PHE A 52 -23.381 3.398 -26.315 1.00 71.23 C ATOM 772 CE2 PHE A 52 -22.434 1.206 -26.432 1.00 61.22 C ATOM 773 CZ PHE A 52 -22.703 2.355 -25.715 1.00 32.11 C ATOM 0 H PHE A 52 -23.808 1.297 -32.142 1.00 51.21 H new ATOM 0 HA PHE A 52 -23.246 3.746 -30.854 1.00 10.32 H new ATOM 0 HB2 PHE A 52 -24.957 2.479 -29.894 1.00 73.21 H new ATOM 0 HB3 PHE A 52 -24.079 0.970 -30.045 1.00 73.21 H new ATOM 0 HD1 PHE A 52 -24.323 4.106 -28.095 1.00 5.32 H new ATOM 0 HD2 PHE A 52 -22.632 0.201 -28.304 1.00 15.23 H new ATOM 0 HE1 PHE A 52 -23.591 4.299 -25.757 1.00 71.23 H new ATOM 0 HE2 PHE A 52 -21.903 0.389 -25.965 1.00 61.22 H new ATOM 0 HZ PHE A 52 -22.384 2.438 -24.687 1.00 32.11 H new ATOM 783 N VAL A 53 -21.007 1.349 -30.504 1.00 41.21 N ATOM 784 CA VAL A 53 -19.637 1.075 -30.086 1.00 51.15 C ATOM 785 C VAL A 53 -18.634 1.667 -31.070 1.00 1.22 C ATOM 786 O VAL A 53 -17.519 2.029 -30.694 1.00 1.23 O ATOM 787 CB VAL A 53 -19.382 -0.438 -29.958 1.00 63.43 C ATOM 788 CG1 VAL A 53 -17.897 -0.716 -29.780 1.00 21.35 C ATOM 789 CG2 VAL A 53 -20.184 -1.018 -28.803 1.00 2.33 C ATOM 0 H VAL A 53 -21.474 0.564 -30.959 1.00 41.21 H new ATOM 0 HA VAL A 53 -19.504 1.542 -29.110 1.00 51.15 H new ATOM 0 HB VAL A 53 -19.710 -0.923 -30.877 1.00 63.43 H new ATOM 0 HG11 VAL A 53 -17.736 -1.790 -29.691 1.00 21.35 H new ATOM 0 HG12 VAL A 53 -17.350 -0.337 -30.643 1.00 21.35 H new ATOM 0 HG13 VAL A 53 -17.540 -0.220 -28.878 1.00 21.35 H new ATOM 0 HG21 VAL A 53 -19.991 -2.088 -28.728 1.00 2.33 H new ATOM 0 HG22 VAL A 53 -19.889 -0.530 -27.874 1.00 2.33 H new ATOM 0 HG23 VAL A 53 -21.247 -0.852 -28.979 1.00 2.33 H new ATOM 799 N VAL A 54 -19.038 1.764 -32.333 1.00 24.33 N ATOM 800 CA VAL A 54 -18.175 2.314 -33.371 1.00 62.12 C ATOM 801 C VAL A 54 -18.109 3.834 -33.283 1.00 10.44 C ATOM 802 O VAL A 54 -17.095 4.443 -33.623 1.00 33.33 O ATOM 803 CB VAL A 54 -18.662 1.913 -34.776 1.00 51.13 C ATOM 804 CG1 VAL A 54 -18.101 2.859 -35.826 1.00 44.45 C ATOM 805 CG2 VAL A 54 -18.277 0.474 -35.083 1.00 65.11 C ATOM 0 H VAL A 54 -19.957 1.469 -32.662 1.00 24.33 H new ATOM 0 HA VAL A 54 -17.180 1.900 -33.207 1.00 62.12 H new ATOM 0 HB VAL A 54 -19.749 1.987 -34.799 1.00 51.13 H new ATOM 0 HG11 VAL A 54 -18.456 2.560 -36.812 1.00 44.45 H new ATOM 0 HG12 VAL A 54 -18.432 3.876 -35.614 1.00 44.45 H new ATOM 0 HG13 VAL A 54 -17.012 2.821 -35.805 1.00 44.45 H new ATOM 0 HG21 VAL A 54 -18.629 0.208 -36.080 1.00 65.11 H new ATOM 0 HG22 VAL A 54 -17.193 0.371 -35.042 1.00 65.11 H new ATOM 0 HG23 VAL A 54 -18.733 -0.189 -34.348 1.00 65.11 H new ATOM 815 N ASN A 55 -19.198 4.442 -32.823 1.00 4.45 N ATOM 816 CA ASN A 55 -19.264 5.893 -32.689 1.00 0.21 C ATOM 817 C ASN A 55 -18.753 6.338 -31.322 1.00 23.52 C ATOM 818 O ASN A 55 -18.302 7.471 -31.154 1.00 25.41 O ATOM 819 CB ASN A 55 -20.700 6.380 -32.891 1.00 74.34 C ATOM 820 CG ASN A 55 -21.083 6.458 -34.357 1.00 31.22 C ATOM 821 OD1 ASN A 55 -21.571 7.485 -34.828 1.00 71.04 O ATOM 822 ND2 ASN A 55 -20.863 5.369 -35.084 1.00 50.04 N ATOM 0 H ASN A 55 -20.046 3.953 -32.537 1.00 4.45 H new ATOM 0 HA ASN A 55 -18.626 6.332 -33.456 1.00 0.21 H new ATOM 0 HB2 ASN A 55 -21.385 5.708 -32.375 1.00 74.34 H new ATOM 0 HB3 ASN A 55 -20.815 7.364 -32.435 1.00 74.34 H new ATOM 0 HD21 ASN A 55 -21.101 5.361 -36.076 1.00 50.04 H new ATOM 0 HD22 ASN A 55 -20.456 4.540 -34.651 1.00 50.04 H new ATOM 829 N VAL A 56 -18.826 5.437 -30.347 1.00 60.42 N ATOM 830 CA VAL A 56 -18.369 5.734 -28.995 1.00 11.30 C ATOM 831 C VAL A 56 -16.878 5.453 -28.844 1.00 53.23 C ATOM 832 O VAL A 56 -16.142 6.250 -28.262 1.00 41.44 O ATOM 833 CB VAL A 56 -19.144 4.913 -27.947 1.00 63.13 C ATOM 834 CG1 VAL A 56 -18.373 4.855 -26.637 1.00 42.42 C ATOM 835 CG2 VAL A 56 -20.532 5.497 -27.733 1.00 60.23 C ATOM 0 H VAL A 56 -19.198 4.495 -30.469 1.00 60.42 H new ATOM 0 HA VAL A 56 -18.555 6.794 -28.824 1.00 11.30 H new ATOM 0 HB VAL A 56 -19.257 3.895 -28.320 1.00 63.13 H new ATOM 0 HG11 VAL A 56 -18.936 4.271 -25.909 1.00 42.42 H new ATOM 0 HG12 VAL A 56 -17.403 4.387 -26.806 1.00 42.42 H new ATOM 0 HG13 VAL A 56 -18.226 5.866 -26.256 1.00 42.42 H new ATOM 0 HG21 VAL A 56 -21.065 4.905 -26.990 1.00 60.23 H new ATOM 0 HG22 VAL A 56 -20.444 6.525 -27.382 1.00 60.23 H new ATOM 0 HG23 VAL A 56 -21.083 5.480 -28.673 1.00 60.23 H new ATOM 845 N ILE A 57 -16.440 4.316 -29.373 1.00 31.55 N ATOM 846 CA ILE A 57 -15.036 3.930 -29.298 1.00 13.10 C ATOM 847 C ILE A 57 -14.191 4.740 -30.275 1.00 11.30 C ATOM 848 O ILE A 57 -12.984 4.892 -30.088 1.00 54.05 O ATOM 849 CB ILE A 57 -14.848 2.431 -29.595 1.00 23.44 C ATOM 850 CG1 ILE A 57 -15.604 1.586 -28.567 1.00 54.14 C ATOM 851 CG2 ILE A 57 -13.369 2.073 -29.596 1.00 60.04 C ATOM 852 CD1 ILE A 57 -15.001 1.637 -27.181 1.00 71.01 C ATOM 0 H ILE A 57 -17.037 3.646 -29.858 1.00 31.55 H new ATOM 0 HA ILE A 57 -14.706 4.134 -28.279 1.00 13.10 H new ATOM 0 HB ILE A 57 -15.255 2.218 -30.583 1.00 23.44 H new ATOM 0 HG12 ILE A 57 -16.638 1.928 -28.517 1.00 54.14 H new ATOM 0 HG13 ILE A 57 -15.627 0.550 -28.906 1.00 54.14 H new ATOM 0 HG21 ILE A 57 -13.252 1.010 -29.807 1.00 60.04 H new ATOM 0 HG22 ILE A 57 -12.855 2.654 -30.361 1.00 60.04 H new ATOM 0 HG23 ILE A 57 -12.939 2.298 -28.620 1.00 60.04 H new ATOM 0 HD11 ILE A 57 -15.589 1.015 -26.506 1.00 71.01 H new ATOM 0 HD12 ILE A 57 -13.976 1.267 -27.216 1.00 71.01 H new ATOM 0 HD13 ILE A 57 -15.003 2.666 -26.821 1.00 71.01 H new ATOM 864 N GLU A 58 -14.834 5.260 -31.316 1.00 15.02 N ATOM 865 CA GLU A 58 -14.141 6.056 -32.322 1.00 11.13 C ATOM 866 C GLU A 58 -13.335 7.175 -31.669 1.00 2.21 C ATOM 867 O GLU A 58 -12.113 7.251 -31.799 1.00 2.25 O ATOM 868 CB GLU A 58 -15.143 6.647 -33.316 1.00 1.43 C ATOM 869 CG GLU A 58 -14.993 6.104 -34.727 1.00 0.22 C ATOM 870 CD GLU A 58 -16.213 6.369 -35.587 1.00 14.53 C ATOM 871 OE1 GLU A 58 -16.829 7.444 -35.426 1.00 35.00 O ATOM 872 OE2 GLU A 58 -16.553 5.503 -36.420 1.00 3.33 O ATOM 0 H GLU A 58 -15.833 5.144 -31.484 1.00 15.02 H new ATOM 0 HA GLU A 58 -13.454 5.401 -32.857 1.00 11.13 H new ATOM 0 HB2 GLU A 58 -16.154 6.444 -32.963 1.00 1.43 H new ATOM 0 HB3 GLU A 58 -15.024 7.730 -33.338 1.00 1.43 H new ATOM 0 HG2 GLU A 58 -14.118 6.556 -35.195 1.00 0.22 H new ATOM 0 HG3 GLU A 58 -14.811 5.030 -34.682 1.00 0.22 H new ATOM 879 N PRO A 59 -14.034 8.066 -30.950 1.00 51.02 N ATOM 880 CA PRO A 59 -13.405 9.197 -30.263 1.00 3.43 C ATOM 881 C PRO A 59 -12.559 8.755 -29.074 1.00 3.24 C ATOM 882 O PRO A 59 -11.639 9.461 -28.657 1.00 53.02 O ATOM 883 CB PRO A 59 -14.597 10.033 -29.790 1.00 21.35 C ATOM 884 CG PRO A 59 -15.719 9.060 -29.674 1.00 71.21 C ATOM 885 CD PRO A 59 -15.493 8.037 -30.753 1.00 11.00 C ATOM 0 HA PRO A 59 -12.719 9.739 -30.914 1.00 3.43 H new ATOM 0 HB2 PRO A 59 -14.389 10.514 -28.834 1.00 21.35 H new ATOM 0 HB3 PRO A 59 -14.832 10.825 -30.501 1.00 21.35 H new ATOM 0 HG2 PRO A 59 -15.730 8.593 -28.689 1.00 71.21 H new ATOM 0 HG3 PRO A 59 -16.681 9.556 -29.802 1.00 71.21 H new ATOM 0 HD2 PRO A 59 -15.838 7.049 -30.448 1.00 11.00 H new ATOM 0 HD3 PRO A 59 -16.027 8.293 -31.668 1.00 11.00 H new ATOM 893 N CYS A 60 -12.874 7.584 -28.532 1.00 15.22 N ATOM 894 CA CYS A 60 -12.143 7.048 -27.390 1.00 2.05 C ATOM 895 C CYS A 60 -10.711 6.693 -27.779 1.00 13.54 C ATOM 896 O CYS A 60 -9.788 6.823 -26.975 1.00 65.20 O ATOM 897 CB CYS A 60 -12.854 5.813 -26.836 1.00 35.23 C ATOM 898 SG CYS A 60 -13.345 5.959 -25.101 1.00 64.25 S ATOM 0 H CYS A 60 -13.631 6.987 -28.865 1.00 15.22 H new ATOM 0 HA CYS A 60 -12.111 7.817 -26.618 1.00 2.05 H new ATOM 0 HB2 CYS A 60 -13.741 5.617 -27.438 1.00 35.23 H new ATOM 0 HB3 CYS A 60 -12.198 4.950 -26.945 1.00 35.23 H new ATOM 0 HG CYS A 60 -12.367 6.472 -24.415 1.00 64.25 H new ATOM 904 N LYS A 61 -10.534 6.244 -29.016 1.00 73.14 N ATOM 905 CA LYS A 61 -9.216 5.869 -29.514 1.00 2.53 C ATOM 906 C LYS A 61 -8.209 6.993 -29.286 1.00 31.54 C ATOM 907 O LYS A 61 -7.186 6.800 -28.628 1.00 35.33 O ATOM 908 CB LYS A 61 -9.288 5.530 -31.004 1.00 62.41 C ATOM 909 CG LYS A 61 -9.979 4.209 -31.294 1.00 60.40 C ATOM 910 CD LYS A 61 -10.486 4.147 -32.725 1.00 72.10 C ATOM 911 CE LYS A 61 -9.434 3.580 -33.666 1.00 5.54 C ATOM 912 NZ LYS A 61 -9.571 4.125 -35.045 1.00 13.13 N ATOM 0 H LYS A 61 -11.288 6.131 -29.694 1.00 73.14 H new ATOM 0 HA LYS A 61 -8.884 4.989 -28.963 1.00 2.53 H new ATOM 0 HB2 LYS A 61 -9.816 6.329 -31.525 1.00 62.41 H new ATOM 0 HB3 LYS A 61 -8.277 5.499 -31.410 1.00 62.41 H new ATOM 0 HG2 LYS A 61 -9.285 3.388 -31.117 1.00 60.40 H new ATOM 0 HG3 LYS A 61 -10.813 4.075 -30.605 1.00 60.40 H new ATOM 0 HD2 LYS A 61 -11.384 3.530 -32.767 1.00 72.10 H new ATOM 0 HD3 LYS A 61 -10.770 5.146 -33.055 1.00 72.10 H new ATOM 0 HE2 LYS A 61 -8.441 3.811 -33.281 1.00 5.54 H new ATOM 0 HE3 LYS A 61 -9.520 2.494 -33.695 1.00 5.54 H new ATOM 0 HZ1 LYS A 61 -8.836 3.714 -35.655 1.00 13.13 H new ATOM 0 HZ2 LYS A 61 -10.509 3.883 -35.422 1.00 13.13 H new ATOM 0 HZ3 LYS A 61 -9.463 5.159 -35.022 1.00 13.13 H new ATOM 926 N LYS A 62 -8.506 8.167 -29.832 1.00 63.31 N ATOM 927 CA LYS A 62 -7.629 9.322 -29.686 1.00 43.42 C ATOM 928 C LYS A 62 -7.368 9.625 -28.214 1.00 42.12 C ATOM 929 O LYS A 62 -6.345 10.213 -27.863 1.00 1.41 O ATOM 930 CB LYS A 62 -8.246 10.546 -30.368 1.00 23.12 C ATOM 931 CG LYS A 62 -7.577 10.912 -31.682 1.00 30.14 C ATOM 932 CD LYS A 62 -8.479 10.614 -32.868 1.00 44.50 C ATOM 933 CE LYS A 62 -8.314 11.652 -33.968 1.00 4.45 C ATOM 934 NZ LYS A 62 -9.627 12.130 -34.482 1.00 32.54 N ATOM 0 H LYS A 62 -9.348 8.344 -30.380 1.00 63.31 H new ATOM 0 HA LYS A 62 -6.678 9.087 -30.164 1.00 43.42 H new ATOM 0 HB2 LYS A 62 -9.304 10.356 -30.549 1.00 23.12 H new ATOM 0 HB3 LYS A 62 -8.187 11.398 -29.690 1.00 23.12 H new ATOM 0 HG2 LYS A 62 -7.318 11.971 -31.677 1.00 30.14 H new ATOM 0 HG3 LYS A 62 -6.645 10.357 -31.784 1.00 30.14 H new ATOM 0 HD2 LYS A 62 -8.248 9.624 -33.262 1.00 44.50 H new ATOM 0 HD3 LYS A 62 -9.518 10.592 -32.540 1.00 44.50 H new ATOM 0 HE2 LYS A 62 -7.744 12.499 -33.586 1.00 4.45 H new ATOM 0 HE3 LYS A 62 -7.737 11.224 -34.788 1.00 4.45 H new ATOM 0 HZ1 LYS A 62 -9.471 12.836 -35.230 1.00 32.54 H new ATOM 0 HZ2 LYS A 62 -10.161 11.327 -34.870 1.00 32.54 H new ATOM 0 HZ3 LYS A 62 -10.167 12.562 -33.705 1.00 32.54 H new ATOM 948 N PHE A 63 -8.298 9.218 -27.357 1.00 53.11 N ATOM 949 CA PHE A 63 -8.168 9.446 -25.923 1.00 33.54 C ATOM 950 C PHE A 63 -7.320 8.356 -25.274 1.00 23.21 C ATOM 951 O PHE A 63 -6.715 8.568 -24.223 1.00 11.11 O ATOM 952 CB PHE A 63 -9.549 9.492 -25.265 1.00 30.42 C ATOM 953 CG PHE A 63 -9.595 8.825 -23.920 1.00 3.35 C ATOM 954 CD1 PHE A 63 -9.327 9.545 -22.766 1.00 30.40 C ATOM 955 CD2 PHE A 63 -9.905 7.479 -23.809 1.00 2.44 C ATOM 956 CE1 PHE A 63 -9.369 8.935 -21.526 1.00 64.43 C ATOM 957 CE2 PHE A 63 -9.948 6.864 -22.572 1.00 13.23 C ATOM 958 CZ PHE A 63 -9.679 7.592 -21.429 1.00 44.34 C ATOM 0 H PHE A 63 -9.150 8.729 -27.631 1.00 53.11 H new ATOM 0 HA PHE A 63 -7.671 10.405 -25.777 1.00 33.54 H new ATOM 0 HB2 PHE A 63 -9.856 10.532 -25.156 1.00 30.42 H new ATOM 0 HB3 PHE A 63 -10.273 9.013 -25.924 1.00 30.42 H new ATOM 0 HD1 PHE A 63 -9.083 10.595 -22.836 1.00 30.40 H new ATOM 0 HD2 PHE A 63 -10.115 6.904 -24.699 1.00 2.44 H new ATOM 0 HE1 PHE A 63 -9.160 9.507 -20.634 1.00 64.43 H new ATOM 0 HE2 PHE A 63 -10.192 5.814 -22.499 1.00 13.23 H new ATOM 0 HZ PHE A 63 -9.711 7.112 -20.462 1.00 44.34 H new ATOM 968 N SER A 64 -7.280 7.188 -25.908 1.00 55.43 N ATOM 969 CA SER A 64 -6.510 6.063 -25.392 1.00 1.32 C ATOM 970 C SER A 64 -5.057 6.463 -25.156 1.00 24.05 C ATOM 971 O SER A 64 -4.444 6.059 -24.168 1.00 61.41 O ATOM 972 CB SER A 64 -6.575 4.884 -26.364 1.00 42.25 C ATOM 973 OG SER A 64 -6.898 3.682 -25.688 1.00 25.25 O ATOM 0 H SER A 64 -7.772 6.997 -26.780 1.00 55.43 H new ATOM 0 HA SER A 64 -6.946 5.763 -24.439 1.00 1.32 H new ATOM 0 HB2 SER A 64 -7.321 5.084 -27.133 1.00 42.25 H new ATOM 0 HB3 SER A 64 -5.616 4.773 -26.871 1.00 42.25 H new ATOM 0 HG SER A 64 -6.935 2.944 -26.332 1.00 25.25 H new ATOM 979 N GLU A 65 -4.512 7.260 -26.070 1.00 33.30 N ATOM 980 CA GLU A 65 -3.131 7.714 -25.962 1.00 21.24 C ATOM 981 C GLU A 65 -2.948 8.615 -24.744 1.00 33.24 C ATOM 982 O GLU A 65 -1.851 8.721 -24.195 1.00 22.15 O ATOM 983 CB GLU A 65 -2.716 8.462 -27.230 1.00 43.01 C ATOM 984 CG GLU A 65 -2.750 7.603 -28.483 1.00 34.44 C ATOM 985 CD GLU A 65 -2.824 8.426 -29.754 1.00 0.55 C ATOM 986 OE1 GLU A 65 -1.959 9.308 -29.939 1.00 51.21 O ATOM 987 OE2 GLU A 65 -3.746 8.190 -30.562 1.00 3.10 O ATOM 0 H GLU A 65 -5.006 7.604 -26.893 1.00 33.30 H new ATOM 0 HA GLU A 65 -2.496 6.837 -25.842 1.00 21.24 H new ATOM 0 HB2 GLU A 65 -3.376 9.318 -27.369 1.00 43.01 H new ATOM 0 HB3 GLU A 65 -1.708 8.855 -27.096 1.00 43.01 H new ATOM 0 HG2 GLU A 65 -1.859 6.975 -28.513 1.00 34.44 H new ATOM 0 HG3 GLU A 65 -3.610 6.934 -28.437 1.00 34.44 H new ATOM 994 N LEU A 66 -4.031 9.262 -24.327 1.00 3.42 N ATOM 995 CA LEU A 66 -3.991 10.155 -23.174 1.00 14.50 C ATOM 996 C LEU A 66 -3.753 9.373 -21.887 1.00 20.33 C ATOM 997 O LEU A 66 -3.089 9.854 -20.968 1.00 1.01 O ATOM 998 CB LEU A 66 -5.298 10.944 -23.070 1.00 50.12 C ATOM 999 CG LEU A 66 -5.743 11.675 -24.337 1.00 52.23 C ATOM 1000 CD1 LEU A 66 -7.077 12.370 -24.112 1.00 1.32 C ATOM 1001 CD2 LEU A 66 -4.685 12.677 -24.775 1.00 3.13 C ATOM 0 H LEU A 66 -4.947 9.185 -24.770 1.00 3.42 H new ATOM 0 HA LEU A 66 -3.163 10.850 -23.313 1.00 14.50 H new ATOM 0 HB2 LEU A 66 -6.091 10.257 -22.773 1.00 50.12 H new ATOM 0 HB3 LEU A 66 -5.194 11.676 -22.269 1.00 50.12 H new ATOM 0 HG LEU A 66 -5.869 10.940 -25.132 1.00 52.23 H new ATOM 0 HD11 LEU A 66 -7.378 12.885 -25.025 1.00 1.32 H new ATOM 0 HD12 LEU A 66 -7.833 11.630 -23.847 1.00 1.32 H new ATOM 0 HD13 LEU A 66 -6.978 13.094 -23.303 1.00 1.32 H new ATOM 0 HD21 LEU A 66 -5.019 13.188 -25.678 1.00 3.13 H new ATOM 0 HD22 LEU A 66 -4.526 13.408 -23.982 1.00 3.13 H new ATOM 0 HD23 LEU A 66 -3.751 12.154 -24.979 1.00 3.13 H new ATOM 1013 N THR A 67 -4.297 8.161 -21.827 1.00 55.31 N ATOM 1014 CA THR A 67 -4.143 7.311 -20.654 1.00 15.04 C ATOM 1015 C THR A 67 -2.679 6.958 -20.419 1.00 13.14 C ATOM 1016 O THR A 67 -2.295 6.563 -19.319 1.00 63.50 O ATOM 1017 CB THR A 67 -4.958 6.011 -20.791 1.00 65.43 C ATOM 1018 OG1 THR A 67 -6.276 6.306 -21.265 1.00 70.14 O ATOM 1019 CG2 THR A 67 -5.044 5.282 -19.458 1.00 44.35 C ATOM 0 H THR A 67 -4.849 7.747 -22.578 1.00 55.31 H new ATOM 0 HA THR A 67 -4.518 7.878 -19.802 1.00 15.04 H new ATOM 0 HB THR A 67 -4.451 5.365 -21.508 1.00 65.43 H new ATOM 0 HG1 THR A 67 -6.663 5.505 -21.675 1.00 70.14 H new ATOM 0 HG21 THR A 67 -5.624 4.367 -19.580 1.00 44.35 H new ATOM 0 HG22 THR A 67 -4.040 5.032 -19.115 1.00 44.35 H new ATOM 0 HG23 THR A 67 -5.529 5.924 -18.723 1.00 44.35 H new ATOM 1027 N GLY A 68 -1.865 7.104 -21.460 1.00 13.51 N ATOM 1028 CA GLY A 68 -0.452 6.797 -21.345 1.00 43.23 C ATOM 1029 C GLY A 68 0.396 8.036 -21.133 1.00 15.11 C ATOM 1030 O GLY A 68 1.569 7.940 -20.770 1.00 51.43 O ATOM 0 H GLY A 68 -2.159 7.429 -22.381 1.00 13.51 H new ATOM 0 HA2 GLY A 68 -0.299 6.110 -20.513 1.00 43.23 H new ATOM 0 HA3 GLY A 68 -0.120 6.284 -22.248 1.00 43.23 H new ATOM 1034 N LEU A 69 -0.198 9.203 -21.360 1.00 61.40 N ATOM 1035 CA LEU A 69 0.511 10.467 -21.193 1.00 34.12 C ATOM 1036 C LEU A 69 0.337 11.005 -19.776 1.00 40.12 C ATOM 1037 O LEU A 69 0.994 11.969 -19.382 1.00 22.41 O ATOM 1038 CB LEU A 69 0.006 11.495 -22.207 1.00 11.03 C ATOM 1039 CG LEU A 69 1.014 12.558 -22.643 1.00 43.31 C ATOM 1040 CD1 LEU A 69 2.237 11.908 -23.272 1.00 51.32 C ATOM 1041 CD2 LEU A 69 0.370 13.538 -23.613 1.00 63.13 C ATOM 0 H LEU A 69 -1.168 9.300 -21.660 1.00 61.40 H new ATOM 0 HA LEU A 69 1.572 10.287 -21.366 1.00 34.12 H new ATOM 0 HB2 LEU A 69 -0.337 10.963 -23.094 1.00 11.03 H new ATOM 0 HB3 LEU A 69 -0.862 11.999 -21.782 1.00 11.03 H new ATOM 0 HG LEU A 69 1.335 13.110 -21.760 1.00 43.31 H new ATOM 0 HD11 LEU A 69 2.944 12.680 -23.576 1.00 51.32 H new ATOM 0 HD12 LEU A 69 2.712 11.247 -22.546 1.00 51.32 H new ATOM 0 HD13 LEU A 69 1.933 11.330 -24.145 1.00 51.32 H new ATOM 0 HD21 LEU A 69 1.102 14.288 -23.913 1.00 63.13 H new ATOM 0 HD22 LEU A 69 0.019 13.001 -24.494 1.00 63.13 H new ATOM 0 HD23 LEU A 69 -0.474 14.029 -23.128 1.00 63.13 H new ATOM 1053 N VAL A 70 -0.551 10.375 -19.014 1.00 31.11 N ATOM 1054 CA VAL A 70 -0.809 10.788 -17.640 1.00 1.14 C ATOM 1055 C VAL A 70 0.024 9.974 -16.656 1.00 35.04 C ATOM 1056 O VAL A 70 0.417 10.470 -15.600 1.00 2.03 O ATOM 1057 CB VAL A 70 -2.299 10.641 -17.279 1.00 72.44 C ATOM 1058 CG1 VAL A 70 -2.471 10.461 -15.779 1.00 23.13 C ATOM 1059 CG2 VAL A 70 -3.088 11.843 -17.774 1.00 51.43 C ATOM 0 H VAL A 70 -1.104 9.576 -19.325 1.00 31.11 H new ATOM 0 HA VAL A 70 -0.528 11.839 -17.568 1.00 1.14 H new ATOM 0 HB VAL A 70 -2.688 9.751 -17.774 1.00 72.44 H new ATOM 0 HG11 VAL A 70 -3.530 10.359 -15.544 1.00 23.13 H new ATOM 0 HG12 VAL A 70 -1.940 9.565 -15.457 1.00 23.13 H new ATOM 0 HG13 VAL A 70 -2.066 11.330 -15.260 1.00 23.13 H new ATOM 0 HG21 VAL A 70 -4.139 11.722 -17.510 1.00 51.43 H new ATOM 0 HG22 VAL A 70 -2.699 12.750 -17.310 1.00 51.43 H new ATOM 0 HG23 VAL A 70 -2.992 11.920 -18.857 1.00 51.43 H new ATOM 1069 N PHE A 71 0.289 8.721 -17.009 1.00 31.31 N ATOM 1070 CA PHE A 71 1.075 7.836 -16.156 1.00 52.25 C ATOM 1071 C PHE A 71 2.530 7.791 -16.614 1.00 74.24 C ATOM 1072 O PHE A 71 3.353 7.082 -16.034 1.00 54.04 O ATOM 1073 CB PHE A 71 0.482 6.426 -16.164 1.00 74.24 C ATOM 1074 CG PHE A 71 -0.863 6.337 -15.501 1.00 51.31 C ATOM 1075 CD1 PHE A 71 -1.986 6.878 -16.107 1.00 21.03 C ATOM 1076 CD2 PHE A 71 -1.004 5.713 -14.272 1.00 74.13 C ATOM 1077 CE1 PHE A 71 -3.224 6.799 -15.498 1.00 31.51 C ATOM 1078 CE2 PHE A 71 -2.240 5.630 -13.659 1.00 13.11 C ATOM 1079 CZ PHE A 71 -3.352 6.173 -14.273 1.00 63.32 C ATOM 0 H PHE A 71 -0.029 8.295 -17.880 1.00 31.31 H new ATOM 0 HA PHE A 71 1.044 8.229 -15.140 1.00 52.25 H new ATOM 0 HB2 PHE A 71 0.393 6.084 -17.195 1.00 74.24 H new ATOM 0 HB3 PHE A 71 1.171 5.748 -15.661 1.00 74.24 H new ATOM 0 HD1 PHE A 71 -1.893 7.367 -17.066 1.00 21.03 H new ATOM 0 HD2 PHE A 71 -0.138 5.287 -13.787 1.00 74.13 H new ATOM 0 HE1 PHE A 71 -4.091 7.226 -15.979 1.00 31.51 H new ATOM 0 HE2 PHE A 71 -2.336 5.141 -12.701 1.00 13.11 H new ATOM 0 HZ PHE A 71 -4.319 6.108 -13.797 1.00 63.32 H new ATOM 1089 N TYR A 72 2.839 8.551 -17.659 1.00 13.44 N ATOM 1090 CA TYR A 72 4.193 8.597 -18.197 1.00 71.52 C ATOM 1091 C TYR A 72 4.729 10.025 -18.204 1.00 22.22 C ATOM 1092 O TYR A 72 5.759 10.317 -17.594 1.00 13.02 O ATOM 1093 CB TYR A 72 4.220 8.023 -19.615 1.00 53.31 C ATOM 1094 CG TYR A 72 5.601 7.622 -20.080 1.00 24.12 C ATOM 1095 CD1 TYR A 72 6.261 6.540 -19.510 1.00 33.21 C ATOM 1096 CD2 TYR A 72 6.247 8.324 -21.090 1.00 1.40 C ATOM 1097 CE1 TYR A 72 7.523 6.170 -19.931 1.00 43.21 C ATOM 1098 CE2 TYR A 72 7.509 7.961 -21.518 1.00 62.05 C ATOM 1099 CZ TYR A 72 8.143 6.884 -20.936 1.00 23.44 C ATOM 1100 OH TYR A 72 9.401 6.518 -21.359 1.00 35.31 O ATOM 0 H TYR A 72 2.170 9.144 -18.150 1.00 13.44 H new ATOM 0 HA TYR A 72 4.833 7.992 -17.554 1.00 71.52 H new ATOM 0 HB2 TYR A 72 3.565 7.153 -19.658 1.00 53.31 H new ATOM 0 HB3 TYR A 72 3.814 8.763 -20.305 1.00 53.31 H new ATOM 0 HD1 TYR A 72 5.778 5.979 -18.724 1.00 33.21 H new ATOM 0 HD2 TYR A 72 5.754 9.168 -21.548 1.00 1.40 H new ATOM 0 HE1 TYR A 72 8.022 5.327 -19.476 1.00 43.21 H new ATOM 0 HE2 TYR A 72 7.997 8.518 -22.304 1.00 62.05 H new ATOM 0 HH TYR A 72 9.695 7.122 -22.073 1.00 35.31 H new ATOM 1110 N LEU A 73 4.024 10.911 -18.897 1.00 53.33 N ATOM 1111 CA LEU A 73 4.427 12.311 -18.984 1.00 34.40 C ATOM 1112 C LEU A 73 3.415 13.213 -18.285 1.00 21.15 C ATOM 1113 O LEU A 73 2.639 13.927 -18.920 1.00 44.03 O ATOM 1114 CB LEU A 73 4.574 12.730 -20.448 1.00 23.52 C ATOM 1115 CG LEU A 73 5.536 13.887 -20.721 1.00 73.30 C ATOM 1116 CD1 LEU A 73 5.897 13.943 -22.197 1.00 40.32 C ATOM 1117 CD2 LEU A 73 4.926 15.205 -20.269 1.00 14.35 C ATOM 0 H LEU A 73 3.170 10.686 -19.407 1.00 53.33 H new ATOM 0 HA LEU A 73 5.389 12.418 -18.483 1.00 34.40 H new ATOM 0 HB2 LEU A 73 4.906 11.865 -21.021 1.00 23.52 H new ATOM 0 HB3 LEU A 73 3.590 13.005 -20.827 1.00 23.52 H new ATOM 0 HG LEU A 73 6.449 13.718 -20.151 1.00 73.30 H new ATOM 0 HD11 LEU A 73 6.582 14.772 -22.373 1.00 40.32 H new ATOM 0 HD12 LEU A 73 6.375 13.009 -22.490 1.00 40.32 H new ATOM 0 HD13 LEU A 73 4.992 14.088 -22.788 1.00 40.32 H new ATOM 0 HD21 LEU A 73 5.624 16.017 -20.471 1.00 14.35 H new ATOM 0 HD22 LEU A 73 3.997 15.381 -20.812 1.00 14.35 H new ATOM 0 HD23 LEU A 73 4.719 15.162 -19.200 1.00 14.35 H new ATOM 1129 N PRO A 74 3.423 13.183 -16.944 1.00 1.24 N ATOM 1130 CA PRO A 74 2.514 13.994 -16.128 1.00 41.44 C ATOM 1131 C PRO A 74 2.846 15.481 -16.195 1.00 4.20 C ATOM 1132 O PRO A 74 3.993 15.882 -15.993 1.00 63.22 O ATOM 1133 CB PRO A 74 2.736 13.460 -14.711 1.00 60.13 C ATOM 1134 CG PRO A 74 4.114 12.894 -14.731 1.00 50.12 C ATOM 1135 CD PRO A 74 4.320 12.356 -16.120 1.00 25.30 C ATOM 0 HA PRO A 74 1.482 13.917 -16.470 1.00 41.44 H new ATOM 0 HB2 PRO A 74 2.645 14.254 -13.970 1.00 60.13 H new ATOM 0 HB3 PRO A 74 1.999 12.699 -14.455 1.00 60.13 H new ATOM 0 HG2 PRO A 74 4.854 13.659 -14.495 1.00 50.12 H new ATOM 0 HG3 PRO A 74 4.223 12.105 -13.987 1.00 50.12 H new ATOM 0 HD2 PRO A 74 5.358 12.451 -16.438 1.00 25.30 H new ATOM 0 HD3 PRO A 74 4.063 11.299 -16.183 1.00 25.30 H new ATOM 1143 N THR A 75 1.836 16.297 -16.479 1.00 74.20 N ATOM 1144 CA THR A 75 2.021 17.739 -16.573 1.00 14.33 C ATOM 1145 C THR A 75 1.491 18.443 -15.329 1.00 2.53 C ATOM 1146 O THR A 75 1.808 19.607 -15.080 1.00 61.11 O ATOM 1147 CB THR A 75 1.316 18.317 -17.815 1.00 33.44 C ATOM 1148 OG1 THR A 75 1.742 17.617 -18.989 1.00 54.02 O ATOM 1149 CG2 THR A 75 1.615 19.801 -17.966 1.00 34.53 C ATOM 0 H THR A 75 0.880 15.983 -16.648 1.00 74.20 H new ATOM 0 HA THR A 75 3.093 17.915 -16.659 1.00 14.33 H new ATOM 0 HB THR A 75 0.241 18.191 -17.687 1.00 33.44 H new ATOM 0 HG1 THR A 75 1.288 17.989 -19.774 1.00 54.02 H new ATOM 0 HG21 THR A 75 1.106 20.187 -18.850 1.00 34.53 H new ATOM 0 HG22 THR A 75 1.263 20.335 -17.083 1.00 34.53 H new ATOM 0 HG23 THR A 75 2.690 19.946 -18.074 1.00 34.53 H new ATOM 1157 N ASP A 76 0.684 17.731 -14.550 1.00 3.41 N ATOM 1158 CA ASP A 76 0.112 18.288 -13.330 1.00 1.15 C ATOM 1159 C ASP A 76 -0.734 17.248 -12.602 1.00 65.40 C ATOM 1160 O ASP A 76 -0.727 16.069 -12.958 1.00 0.14 O ATOM 1161 CB ASP A 76 -0.738 19.518 -13.654 1.00 63.30 C ATOM 1162 CG ASP A 76 -0.626 20.595 -12.593 1.00 74.20 C ATOM 1163 OD1 ASP A 76 -0.161 20.282 -11.477 1.00 43.25 O ATOM 1164 OD2 ASP A 76 -1.006 21.750 -12.878 1.00 2.21 O ATOM 0 H ASP A 76 0.411 16.767 -14.742 1.00 3.41 H new ATOM 0 HA ASP A 76 0.933 18.585 -12.677 1.00 1.15 H new ATOM 0 HB2 ASP A 76 -0.429 19.926 -14.616 1.00 63.30 H new ATOM 0 HB3 ASP A 76 -1.781 19.219 -13.755 1.00 63.30 H new ATOM 1169 N SER A 77 -1.460 17.691 -11.581 1.00 42.41 N ATOM 1170 CA SER A 77 -2.307 16.798 -10.800 1.00 21.30 C ATOM 1171 C SER A 77 -3.412 16.201 -11.667 1.00 0.45 C ATOM 1172 O SER A 77 -4.041 15.212 -11.296 1.00 34.35 O ATOM 1173 CB SER A 77 -2.920 17.548 -9.616 1.00 34.41 C ATOM 1174 OG SER A 77 -2.639 16.888 -8.394 1.00 2.24 O ATOM 0 H SER A 77 -1.479 18.664 -11.275 1.00 42.41 H new ATOM 0 HA SER A 77 -1.686 15.985 -10.423 1.00 21.30 H new ATOM 0 HB2 SER A 77 -2.528 18.564 -9.583 1.00 34.41 H new ATOM 0 HB3 SER A 77 -3.999 17.627 -9.751 1.00 34.41 H new ATOM 0 HG SER A 77 -3.040 17.388 -7.653 1.00 2.24 H new ATOM 1180 N GLY A 78 -3.642 16.813 -12.825 1.00 31.42 N ATOM 1181 CA GLY A 78 -4.671 16.329 -13.727 1.00 0.40 C ATOM 1182 C GLY A 78 -4.759 17.149 -14.999 1.00 3.42 C ATOM 1183 O GLY A 78 -5.850 17.399 -15.509 1.00 51.12 O ATOM 0 H GLY A 78 -3.135 17.634 -13.154 1.00 31.42 H new ATOM 0 HA2 GLY A 78 -4.467 15.289 -13.982 1.00 0.40 H new ATOM 0 HA3 GLY A 78 -5.635 16.349 -13.218 1.00 0.40 H new ATOM 1187 N GLU A 79 -3.606 17.570 -15.510 1.00 52.44 N ATOM 1188 CA GLU A 79 -3.559 18.369 -16.729 1.00 42.43 C ATOM 1189 C GLU A 79 -4.016 17.552 -17.934 1.00 35.02 C ATOM 1190 O GLU A 79 -4.932 17.948 -18.656 1.00 63.20 O ATOM 1191 CB GLU A 79 -2.142 18.896 -16.965 1.00 42.34 C ATOM 1192 CG GLU A 79 -1.976 20.368 -16.628 1.00 3.53 C ATOM 1193 CD GLU A 79 -2.745 21.274 -17.570 1.00 73.50 C ATOM 1194 OE1 GLU A 79 -3.987 21.336 -17.449 1.00 42.43 O ATOM 1195 OE2 GLU A 79 -2.107 21.918 -18.428 1.00 1.43 O ATOM 0 H GLU A 79 -2.694 17.371 -15.100 1.00 52.44 H new ATOM 0 HA GLU A 79 -4.238 19.213 -16.606 1.00 42.43 H new ATOM 0 HB2 GLU A 79 -1.442 18.314 -16.366 1.00 42.34 H new ATOM 0 HB3 GLU A 79 -1.874 18.739 -18.010 1.00 42.34 H new ATOM 0 HG2 GLU A 79 -2.313 20.543 -15.606 1.00 3.53 H new ATOM 0 HG3 GLU A 79 -0.918 20.628 -16.664 1.00 3.53 H new ATOM 1202 N LYS A 80 -3.373 16.409 -18.145 1.00 4.01 N ATOM 1203 CA LYS A 80 -3.712 15.534 -19.261 1.00 21.13 C ATOM 1204 C LYS A 80 -4.985 14.746 -18.967 1.00 5.02 C ATOM 1205 O LYS A 80 -5.639 14.243 -19.880 1.00 1.33 O ATOM 1206 CB LYS A 80 -2.558 14.571 -19.549 1.00 72.41 C ATOM 1207 CG LYS A 80 -1.510 15.141 -20.489 1.00 74.34 C ATOM 1208 CD LYS A 80 -2.090 15.421 -21.866 1.00 2.12 C ATOM 1209 CE LYS A 80 -1.712 16.810 -22.357 1.00 63.14 C ATOM 1210 NZ LYS A 80 -2.412 17.160 -23.624 1.00 72.32 N ATOM 0 H LYS A 80 -2.613 16.066 -17.557 1.00 4.01 H new ATOM 0 HA LYS A 80 -3.886 16.156 -20.139 1.00 21.13 H new ATOM 0 HB2 LYS A 80 -2.080 14.298 -18.608 1.00 72.41 H new ATOM 0 HB3 LYS A 80 -2.960 13.654 -19.980 1.00 72.41 H new ATOM 0 HG2 LYS A 80 -1.106 16.062 -20.069 1.00 74.34 H new ATOM 0 HG3 LYS A 80 -0.680 14.440 -20.578 1.00 74.34 H new ATOM 0 HD2 LYS A 80 -1.730 14.673 -22.573 1.00 2.12 H new ATOM 0 HD3 LYS A 80 -3.176 15.329 -21.830 1.00 2.12 H new ATOM 0 HE2 LYS A 80 -1.958 17.545 -21.591 1.00 63.14 H new ATOM 0 HE3 LYS A 80 -0.634 16.860 -22.512 1.00 63.14 H new ATOM 0 HZ1 LYS A 80 -2.128 18.114 -23.926 1.00 72.32 H new ATOM 0 HZ2 LYS A 80 -2.158 16.473 -24.362 1.00 72.32 H new ATOM 0 HZ3 LYS A 80 -3.440 17.138 -23.470 1.00 72.32 H new ATOM 1224 N MET A 81 -5.330 14.644 -17.687 1.00 43.04 N ATOM 1225 CA MET A 81 -6.526 13.919 -17.275 1.00 11.44 C ATOM 1226 C MET A 81 -7.774 14.776 -17.465 1.00 44.24 C ATOM 1227 O MET A 81 -8.747 14.346 -18.085 1.00 21.41 O ATOM 1228 CB MET A 81 -6.408 13.489 -15.811 1.00 61.34 C ATOM 1229 CG MET A 81 -5.075 12.839 -15.475 1.00 14.22 C ATOM 1230 SD MET A 81 -4.885 12.519 -13.711 1.00 4.24 S ATOM 1231 CE MET A 81 -3.143 12.874 -13.489 1.00 11.24 C ATOM 0 H MET A 81 -4.799 15.054 -16.919 1.00 43.04 H new ATOM 0 HA MET A 81 -6.617 13.032 -17.902 1.00 11.44 H new ATOM 0 HB2 MET A 81 -6.549 14.361 -15.172 1.00 61.34 H new ATOM 0 HB3 MET A 81 -7.212 12.791 -15.580 1.00 61.34 H new ATOM 0 HG2 MET A 81 -4.984 11.901 -16.023 1.00 14.22 H new ATOM 0 HG3 MET A 81 -4.265 13.485 -15.813 1.00 14.22 H new ATOM 0 HE1 MET A 81 -2.602 11.945 -13.310 1.00 11.24 H new ATOM 0 HE2 MET A 81 -2.752 13.354 -14.386 1.00 11.24 H new ATOM 0 HE3 MET A 81 -3.013 13.539 -12.635 1.00 11.24 H new ATOM 1241 N THR A 82 -7.739 15.992 -16.929 1.00 1.22 N ATOM 1242 CA THR A 82 -8.867 16.909 -17.039 1.00 22.53 C ATOM 1243 C THR A 82 -9.245 17.143 -18.497 1.00 5.12 C ATOM 1244 O THR A 82 -10.396 17.444 -18.808 1.00 14.11 O ATOM 1245 CB THR A 82 -8.556 18.264 -16.376 1.00 71.03 C ATOM 1246 OG1 THR A 82 -9.773 18.971 -16.113 1.00 51.23 O ATOM 1247 CG2 THR A 82 -7.656 19.107 -17.266 1.00 44.42 C ATOM 0 H THR A 82 -6.941 16.365 -16.414 1.00 1.22 H new ATOM 0 HA THR A 82 -9.705 16.443 -16.520 1.00 22.53 H new ATOM 0 HB THR A 82 -8.037 18.074 -15.437 1.00 71.03 H new ATOM 0 HG1 THR A 82 -9.567 19.831 -15.690 1.00 51.23 H new ATOM 0 HG21 THR A 82 -7.450 20.059 -16.777 1.00 44.42 H new ATOM 0 HG22 THR A 82 -6.719 18.578 -17.441 1.00 44.42 H new ATOM 0 HG23 THR A 82 -8.153 19.288 -18.219 1.00 44.42 H new ATOM 1255 N GLU A 83 -8.267 17.003 -19.387 1.00 21.43 N ATOM 1256 CA GLU A 83 -8.499 17.200 -20.813 1.00 23.13 C ATOM 1257 C GLU A 83 -9.020 15.921 -21.461 1.00 75.12 C ATOM 1258 O GLU A 83 -9.614 15.956 -22.539 1.00 12.21 O ATOM 1259 CB GLU A 83 -7.209 17.646 -21.505 1.00 0.13 C ATOM 1260 CG GLU A 83 -6.735 19.025 -21.078 1.00 0.21 C ATOM 1261 CD GLU A 83 -7.319 20.133 -21.932 1.00 54.33 C ATOM 1262 OE1 GLU A 83 -8.156 19.828 -22.808 1.00 34.15 O ATOM 1263 OE2 GLU A 83 -6.940 21.305 -21.726 1.00 71.12 O ATOM 0 H GLU A 83 -7.308 16.754 -19.146 1.00 21.43 H new ATOM 0 HA GLU A 83 -9.253 17.979 -20.928 1.00 23.13 H new ATOM 0 HB2 GLU A 83 -6.424 16.920 -21.294 1.00 0.13 H new ATOM 0 HB3 GLU A 83 -7.365 17.643 -22.584 1.00 0.13 H new ATOM 0 HG2 GLU A 83 -7.008 19.192 -20.036 1.00 0.21 H new ATOM 0 HG3 GLU A 83 -5.647 19.064 -21.133 1.00 0.21 H new ATOM 1270 N SER A 84 -8.794 14.792 -20.796 1.00 43.45 N ATOM 1271 CA SER A 84 -9.236 13.501 -21.309 1.00 54.12 C ATOM 1272 C SER A 84 -10.702 13.253 -20.965 1.00 40.40 C ATOM 1273 O SER A 84 -11.401 12.519 -21.664 1.00 1.04 O ATOM 1274 CB SER A 84 -8.370 12.377 -20.738 1.00 3.31 C ATOM 1275 OG SER A 84 -7.032 12.484 -21.192 1.00 44.02 O ATOM 0 H SER A 84 -8.307 14.746 -19.901 1.00 43.45 H new ATOM 0 HA SER A 84 -9.132 13.514 -22.394 1.00 54.12 H new ATOM 0 HB2 SER A 84 -8.392 12.414 -19.649 1.00 3.31 H new ATOM 0 HB3 SER A 84 -8.781 11.411 -21.032 1.00 3.31 H new ATOM 0 HG SER A 84 -6.647 13.330 -20.880 1.00 44.02 H new ATOM 1281 N LYS A 85 -11.161 13.872 -19.882 1.00 75.25 N ATOM 1282 CA LYS A 85 -12.544 13.721 -19.444 1.00 3.44 C ATOM 1283 C LYS A 85 -13.477 14.594 -20.277 1.00 12.04 C ATOM 1284 O LYS A 85 -14.595 14.192 -20.599 1.00 11.02 O ATOM 1285 CB LYS A 85 -12.673 14.087 -17.963 1.00 60.50 C ATOM 1286 CG LYS A 85 -13.794 13.350 -17.250 1.00 63.54 C ATOM 1287 CD LYS A 85 -14.042 13.919 -15.864 1.00 30.14 C ATOM 1288 CE LYS A 85 -12.965 13.484 -14.881 1.00 72.24 C ATOM 1289 NZ LYS A 85 -11.912 14.523 -14.717 1.00 43.31 N ATOM 0 H LYS A 85 -10.596 14.483 -19.292 1.00 75.25 H new ATOM 0 HA LYS A 85 -12.831 12.679 -19.582 1.00 3.44 H new ATOM 0 HB2 LYS A 85 -11.730 13.871 -17.460 1.00 60.50 H new ATOM 0 HB3 LYS A 85 -12.842 15.160 -17.876 1.00 60.50 H new ATOM 0 HG2 LYS A 85 -14.708 13.417 -17.841 1.00 63.54 H new ATOM 0 HG3 LYS A 85 -13.542 12.292 -17.170 1.00 63.54 H new ATOM 0 HD2 LYS A 85 -14.070 15.007 -15.916 1.00 30.14 H new ATOM 0 HD3 LYS A 85 -15.018 13.592 -15.505 1.00 30.14 H new ATOM 0 HE2 LYS A 85 -13.420 13.273 -13.914 1.00 72.24 H new ATOM 0 HE3 LYS A 85 -12.509 12.557 -15.228 1.00 72.24 H new ATOM 0 HZ1 LYS A 85 -11.005 14.066 -14.493 1.00 43.31 H new ATOM 0 HZ2 LYS A 85 -11.818 15.065 -15.600 1.00 43.31 H new ATOM 0 HZ3 LYS A 85 -12.176 15.166 -13.943 1.00 43.31 H new ATOM 1303 N SER A 86 -13.010 15.789 -20.623 1.00 52.31 N ATOM 1304 CA SER A 86 -13.805 16.719 -21.417 1.00 5.50 C ATOM 1305 C SER A 86 -14.119 16.131 -22.789 1.00 50.52 C ATOM 1306 O SER A 86 -15.029 16.590 -23.480 1.00 33.51 O ATOM 1307 CB SER A 86 -13.064 18.048 -21.577 1.00 5.43 C ATOM 1308 OG SER A 86 -13.026 18.451 -22.935 1.00 12.53 O ATOM 0 H SER A 86 -12.086 16.136 -20.366 1.00 52.31 H new ATOM 0 HA SER A 86 -14.744 16.895 -20.893 1.00 5.50 H new ATOM 0 HB2 SER A 86 -13.556 18.816 -20.980 1.00 5.43 H new ATOM 0 HB3 SER A 86 -12.048 17.950 -21.195 1.00 5.43 H new ATOM 0 HG SER A 86 -12.549 19.304 -23.010 1.00 12.53 H new ATOM 1314 N VAL A 87 -13.359 15.113 -23.178 1.00 65.10 N ATOM 1315 CA VAL A 87 -13.555 14.460 -24.467 1.00 13.31 C ATOM 1316 C VAL A 87 -14.770 13.539 -24.437 1.00 2.23 C ATOM 1317 O VAL A 87 -15.485 13.404 -25.430 1.00 55.41 O ATOM 1318 CB VAL A 87 -12.316 13.644 -24.878 1.00 24.23 C ATOM 1319 CG1 VAL A 87 -12.357 13.321 -26.363 1.00 72.54 C ATOM 1320 CG2 VAL A 87 -11.042 14.395 -24.523 1.00 4.34 C ATOM 0 H VAL A 87 -12.601 14.722 -22.619 1.00 65.10 H new ATOM 0 HA VAL A 87 -13.719 15.250 -25.200 1.00 13.31 H new ATOM 0 HB VAL A 87 -12.323 12.704 -24.326 1.00 24.23 H new ATOM 0 HG11 VAL A 87 -11.473 12.744 -26.634 1.00 72.54 H new ATOM 0 HG12 VAL A 87 -13.252 12.739 -26.584 1.00 72.54 H new ATOM 0 HG13 VAL A 87 -12.375 14.248 -26.937 1.00 72.54 H new ATOM 0 HG21 VAL A 87 -10.176 13.804 -24.821 1.00 4.34 H new ATOM 0 HG22 VAL A 87 -11.026 15.351 -25.046 1.00 4.34 H new ATOM 0 HG23 VAL A 87 -11.010 14.569 -23.447 1.00 4.34 H new ATOM 1330 N LEU A 88 -14.998 12.907 -23.291 1.00 5.23 N ATOM 1331 CA LEU A 88 -16.127 11.998 -23.130 1.00 22.23 C ATOM 1332 C LEU A 88 -17.386 12.759 -22.726 1.00 64.11 C ATOM 1333 O LEU A 88 -18.497 12.387 -23.102 1.00 71.55 O ATOM 1334 CB LEU A 88 -15.803 10.932 -22.081 1.00 73.13 C ATOM 1335 CG LEU A 88 -14.582 10.058 -22.368 1.00 20.42 C ATOM 1336 CD1 LEU A 88 -14.285 9.151 -21.184 1.00 33.53 C ATOM 1337 CD2 LEU A 88 -14.799 9.236 -23.630 1.00 45.13 C ATOM 0 H LEU A 88 -14.416 13.007 -22.460 1.00 5.23 H new ATOM 0 HA LEU A 88 -16.310 11.512 -24.088 1.00 22.23 H new ATOM 0 HB2 LEU A 88 -15.652 11.428 -21.122 1.00 73.13 H new ATOM 0 HB3 LEU A 88 -16.672 10.283 -21.971 1.00 73.13 H new ATOM 0 HG LEU A 88 -13.722 10.709 -22.526 1.00 20.42 H new ATOM 0 HD11 LEU A 88 -13.413 8.536 -21.406 1.00 33.53 H new ATOM 0 HD12 LEU A 88 -14.085 9.759 -20.301 1.00 33.53 H new ATOM 0 HD13 LEU A 88 -15.144 8.507 -20.994 1.00 33.53 H new ATOM 0 HD21 LEU A 88 -13.920 8.620 -23.819 1.00 45.13 H new ATOM 0 HD22 LEU A 88 -15.671 8.594 -23.501 1.00 45.13 H new ATOM 0 HD23 LEU A 88 -14.962 9.904 -24.476 1.00 45.13 H new ATOM 1349 N LYS A 89 -17.204 13.829 -21.959 1.00 65.52 N ATOM 1350 CA LYS A 89 -18.323 14.646 -21.507 1.00 31.55 C ATOM 1351 C LYS A 89 -18.868 15.501 -22.646 1.00 2.33 C ATOM 1352 O LYS A 89 -20.077 15.702 -22.761 1.00 21.23 O ATOM 1353 CB LYS A 89 -17.890 15.541 -20.344 1.00 12.34 C ATOM 1354 CG LYS A 89 -18.370 15.053 -18.988 1.00 74.50 C ATOM 1355 CD LYS A 89 -18.789 16.208 -18.095 1.00 3.33 C ATOM 1356 CE LYS A 89 -20.257 16.558 -18.286 1.00 63.50 C ATOM 1357 NZ LYS A 89 -20.836 17.201 -17.075 1.00 11.24 N ATOM 0 H LYS A 89 -16.291 14.150 -21.637 1.00 65.52 H new ATOM 0 HA LYS A 89 -19.115 13.978 -21.168 1.00 31.55 H new ATOM 0 HB2 LYS A 89 -16.802 15.606 -20.333 1.00 12.34 H new ATOM 0 HB3 LYS A 89 -18.268 16.549 -20.512 1.00 12.34 H new ATOM 0 HG2 LYS A 89 -19.211 14.372 -19.122 1.00 74.50 H new ATOM 0 HG3 LYS A 89 -17.576 14.486 -18.502 1.00 74.50 H new ATOM 0 HD2 LYS A 89 -18.609 15.946 -17.052 1.00 3.33 H new ATOM 0 HD3 LYS A 89 -18.174 17.081 -18.315 1.00 3.33 H new ATOM 0 HE2 LYS A 89 -20.362 17.229 -19.139 1.00 63.50 H new ATOM 0 HE3 LYS A 89 -20.818 15.654 -18.520 1.00 63.50 H new ATOM 0 HZ1 LYS A 89 -21.837 17.424 -17.246 1.00 11.24 H new ATOM 0 HZ2 LYS A 89 -20.759 16.551 -16.266 1.00 11.24 H new ATOM 0 HZ3 LYS A 89 -20.317 18.078 -16.866 1.00 11.24 H new ATOM 1371 N SER A 90 -17.968 16.002 -23.486 1.00 50.21 N ATOM 1372 CA SER A 90 -18.359 16.838 -24.615 1.00 42.21 C ATOM 1373 C SER A 90 -18.833 15.983 -25.786 1.00 35.22 C ATOM 1374 O SER A 90 -19.535 16.463 -26.677 1.00 42.51 O ATOM 1375 CB SER A 90 -17.187 17.719 -25.054 1.00 74.12 C ATOM 1376 OG SER A 90 -17.640 18.836 -25.799 1.00 55.10 O ATOM 0 H SER A 90 -16.964 15.844 -23.406 1.00 50.21 H new ATOM 0 HA SER A 90 -19.184 17.475 -24.295 1.00 42.21 H new ATOM 0 HB2 SER A 90 -16.637 18.061 -24.177 1.00 74.12 H new ATOM 0 HB3 SER A 90 -16.493 17.133 -25.657 1.00 74.12 H new ATOM 0 HG SER A 90 -16.873 19.384 -26.066 1.00 55.10 H new ATOM 1382 N LEU A 91 -18.446 14.712 -25.777 1.00 13.10 N ATOM 1383 CA LEU A 91 -18.832 13.787 -26.838 1.00 5.55 C ATOM 1384 C LEU A 91 -20.274 13.325 -26.659 1.00 71.03 C ATOM 1385 O LEU A 91 -21.068 13.354 -27.600 1.00 52.12 O ATOM 1386 CB LEU A 91 -17.894 12.578 -26.852 1.00 55.53 C ATOM 1387 CG LEU A 91 -18.508 11.260 -27.324 1.00 21.41 C ATOM 1388 CD1 LEU A 91 -19.035 11.394 -28.744 1.00 35.21 C ATOM 1389 CD2 LEU A 91 -17.486 10.135 -27.237 1.00 35.05 C ATOM 0 H LEU A 91 -17.866 14.298 -25.047 1.00 13.10 H new ATOM 0 HA LEU A 91 -18.754 14.311 -27.791 1.00 5.55 H new ATOM 0 HB2 LEU A 91 -17.044 12.810 -27.493 1.00 55.53 H new ATOM 0 HB3 LEU A 91 -17.504 12.434 -25.845 1.00 55.53 H new ATOM 0 HG LEU A 91 -19.345 11.016 -26.670 1.00 21.41 H new ATOM 0 HD11 LEU A 91 -19.468 10.446 -29.062 1.00 35.21 H new ATOM 0 HD12 LEU A 91 -19.799 12.171 -28.777 1.00 35.21 H new ATOM 0 HD13 LEU A 91 -18.216 11.661 -29.412 1.00 35.21 H new ATOM 0 HD21 LEU A 91 -17.940 9.204 -27.577 1.00 35.05 H new ATOM 0 HD22 LEU A 91 -16.629 10.372 -27.868 1.00 35.05 H new ATOM 0 HD23 LEU A 91 -17.156 10.022 -26.204 1.00 35.05 H new ATOM 1401 N THR A 92 -20.608 12.900 -25.445 1.00 31.23 N ATOM 1402 CA THR A 92 -21.955 12.432 -25.142 1.00 40.32 C ATOM 1403 C THR A 92 -22.999 13.472 -25.534 1.00 62.12 C ATOM 1404 O THR A 92 -24.141 13.132 -25.840 1.00 51.23 O ATOM 1405 CB THR A 92 -22.112 12.102 -23.646 1.00 13.42 C ATOM 1406 OG1 THR A 92 -23.258 11.267 -23.446 1.00 62.32 O ATOM 1407 CG2 THR A 92 -22.257 13.374 -22.824 1.00 4.14 C ATOM 0 H THR A 92 -19.964 12.870 -24.655 1.00 31.23 H new ATOM 0 HA THR A 92 -22.113 11.525 -25.725 1.00 40.32 H new ATOM 0 HB THR A 92 -21.216 11.575 -23.317 1.00 13.42 H new ATOM 0 HG1 THR A 92 -22.971 10.335 -23.353 1.00 62.32 H new ATOM 0 HG21 THR A 92 -22.367 13.116 -21.771 1.00 4.14 H new ATOM 0 HG22 THR A 92 -21.371 13.995 -22.955 1.00 4.14 H new ATOM 0 HG23 THR A 92 -23.138 13.924 -23.156 1.00 4.14 H new ATOM 1415 N GLU A 93 -22.598 14.739 -25.523 1.00 52.50 N ATOM 1416 CA GLU A 93 -23.501 15.828 -25.878 1.00 1.31 C ATOM 1417 C GLU A 93 -24.171 15.563 -27.223 1.00 44.22 C ATOM 1418 O GLU A 93 -25.350 15.861 -27.412 1.00 34.41 O ATOM 1419 CB GLU A 93 -22.741 17.155 -25.927 1.00 4.21 C ATOM 1420 CG GLU A 93 -23.279 18.201 -24.966 1.00 15.43 C ATOM 1421 CD GLU A 93 -22.822 19.604 -25.314 1.00 41.51 C ATOM 1422 OE1 GLU A 93 -22.291 19.797 -26.428 1.00 21.33 O ATOM 1423 OE2 GLU A 93 -22.995 20.511 -24.472 1.00 75.51 O ATOM 0 H GLU A 93 -21.655 15.037 -25.273 1.00 52.50 H new ATOM 0 HA GLU A 93 -24.274 15.889 -25.112 1.00 1.31 H new ATOM 0 HB2 GLU A 93 -21.691 16.971 -25.700 1.00 4.21 H new ATOM 0 HB3 GLU A 93 -22.783 17.551 -26.942 1.00 4.21 H new ATOM 0 HG2 GLU A 93 -24.368 18.166 -24.970 1.00 15.43 H new ATOM 0 HG3 GLU A 93 -22.956 17.959 -23.953 1.00 15.43 H new ATOM 1430 N LYS A 94 -23.409 15.002 -28.156 1.00 40.22 N ATOM 1431 CA LYS A 94 -23.926 14.696 -29.484 1.00 74.54 C ATOM 1432 C LYS A 94 -24.655 13.356 -29.488 1.00 72.44 C ATOM 1433 O LYS A 94 -25.503 13.101 -30.345 1.00 63.31 O ATOM 1434 CB LYS A 94 -22.786 14.671 -30.505 1.00 55.12 C ATOM 1435 CG LYS A 94 -22.176 16.037 -30.768 1.00 71.22 C ATOM 1436 CD LYS A 94 -22.728 16.659 -32.040 1.00 32.21 C ATOM 1437 CE LYS A 94 -23.992 17.460 -31.766 1.00 23.05 C ATOM 1438 NZ LYS A 94 -23.955 18.795 -32.424 1.00 15.45 N ATOM 0 H LYS A 94 -22.431 14.750 -28.016 1.00 40.22 H new ATOM 0 HA LYS A 94 -24.635 15.477 -29.759 1.00 74.54 H new ATOM 0 HB2 LYS A 94 -22.007 13.996 -30.151 1.00 55.12 H new ATOM 0 HB3 LYS A 94 -23.159 14.262 -31.444 1.00 55.12 H new ATOM 0 HG2 LYS A 94 -22.378 16.695 -29.923 1.00 71.22 H new ATOM 0 HG3 LYS A 94 -21.093 15.944 -30.848 1.00 71.22 H new ATOM 0 HD2 LYS A 94 -21.974 17.308 -32.486 1.00 32.21 H new ATOM 0 HD3 LYS A 94 -22.943 15.875 -32.766 1.00 32.21 H new ATOM 0 HE2 LYS A 94 -24.859 16.903 -32.122 1.00 23.05 H new ATOM 0 HE3 LYS A 94 -24.115 17.588 -30.691 1.00 23.05 H new ATOM 0 HZ1 LYS A 94 -24.834 19.310 -32.214 1.00 15.45 H new ATOM 0 HZ2 LYS A 94 -23.142 19.336 -32.066 1.00 15.45 H new ATOM 0 HZ3 LYS A 94 -23.863 18.673 -33.453 1.00 15.45 H new ATOM 1452 N LEU A 95 -24.322 12.503 -28.526 1.00 4.13 N ATOM 1453 CA LEU A 95 -24.946 11.189 -28.417 1.00 41.11 C ATOM 1454 C LEU A 95 -26.329 11.294 -27.782 1.00 41.15 C ATOM 1455 O LEU A 95 -27.179 10.423 -27.971 1.00 44.33 O ATOM 1456 CB LEU A 95 -24.064 10.250 -27.592 1.00 42.24 C ATOM 1457 CG LEU A 95 -24.357 8.756 -27.735 1.00 0.23 C ATOM 1458 CD1 LEU A 95 -24.246 8.327 -29.189 1.00 64.43 C ATOM 1459 CD2 LEU A 95 -23.413 7.942 -26.862 1.00 63.14 C ATOM 0 H LEU A 95 -23.623 12.698 -27.809 1.00 4.13 H new ATOM 0 HA LEU A 95 -25.058 10.783 -29.422 1.00 41.11 H new ATOM 0 HB2 LEU A 95 -23.024 10.424 -27.869 1.00 42.24 H new ATOM 0 HB3 LEU A 95 -24.164 10.520 -26.541 1.00 42.24 H new ATOM 0 HG LEU A 95 -25.378 8.572 -27.401 1.00 0.23 H new ATOM 0 HD11 LEU A 95 -24.458 7.261 -29.271 1.00 64.43 H new ATOM 0 HD12 LEU A 95 -24.963 8.887 -29.789 1.00 64.43 H new ATOM 0 HD13 LEU A 95 -23.237 8.525 -29.551 1.00 64.43 H new ATOM 0 HD21 LEU A 95 -23.636 6.881 -26.976 1.00 63.14 H new ATOM 0 HD22 LEU A 95 -22.383 8.131 -27.165 1.00 63.14 H new ATOM 0 HD23 LEU A 95 -23.543 8.230 -25.819 1.00 63.14 H new ATOM 1471 N LYS A 96 -26.549 12.367 -27.030 1.00 52.25 N ATOM 1472 CA LYS A 96 -27.830 12.590 -26.370 1.00 60.51 C ATOM 1473 C LYS A 96 -28.935 12.832 -27.393 1.00 61.13 C ATOM 1474 O LYS A 96 -30.093 12.479 -27.168 1.00 24.11 O ATOM 1475 CB LYS A 96 -27.734 13.781 -25.415 1.00 15.32 C ATOM 1476 CG LYS A 96 -27.067 13.448 -24.092 1.00 2.42 C ATOM 1477 CD LYS A 96 -27.208 14.586 -23.094 1.00 63.03 C ATOM 1478 CE LYS A 96 -27.040 14.097 -21.664 1.00 33.22 C ATOM 1479 NZ LYS A 96 -26.460 15.148 -20.783 1.00 32.34 N ATOM 0 H LYS A 96 -25.856 13.096 -26.862 1.00 52.25 H new ATOM 0 HA LYS A 96 -28.077 11.694 -25.800 1.00 60.51 H new ATOM 0 HB2 LYS A 96 -27.177 14.582 -25.901 1.00 15.32 H new ATOM 0 HB3 LYS A 96 -28.737 14.162 -25.221 1.00 15.32 H new ATOM 0 HG2 LYS A 96 -27.510 12.543 -23.678 1.00 2.42 H new ATOM 0 HG3 LYS A 96 -26.011 13.238 -24.259 1.00 2.42 H new ATOM 0 HD2 LYS A 96 -26.463 15.353 -23.307 1.00 63.03 H new ATOM 0 HD3 LYS A 96 -28.187 15.052 -23.208 1.00 63.03 H new ATOM 0 HE2 LYS A 96 -28.008 13.787 -21.270 1.00 33.22 H new ATOM 0 HE3 LYS A 96 -26.395 13.218 -21.654 1.00 33.22 H new ATOM 0 HZ1 LYS A 96 -26.361 14.776 -19.817 1.00 32.34 H new ATOM 0 HZ2 LYS A 96 -25.525 15.426 -21.144 1.00 32.34 H new ATOM 0 HZ3 LYS A 96 -27.088 15.977 -20.772 1.00 32.34 H new ATOM 1493 N LYS A 97 -28.570 13.435 -28.520 1.00 10.25 N ATOM 1494 CA LYS A 97 -29.529 13.723 -29.580 1.00 30.44 C ATOM 1495 C LYS A 97 -30.019 12.435 -30.233 1.00 75.34 C ATOM 1496 O LYS A 97 -30.995 12.442 -30.985 1.00 64.13 O ATOM 1497 CB LYS A 97 -28.897 14.634 -30.634 1.00 60.11 C ATOM 1498 CG LYS A 97 -29.584 15.982 -30.763 1.00 51.34 C ATOM 1499 CD LYS A 97 -30.716 15.936 -31.776 1.00 12.41 C ATOM 1500 CE LYS A 97 -32.024 15.505 -31.130 1.00 70.34 C ATOM 1501 NZ LYS A 97 -32.461 16.457 -30.072 1.00 53.14 N ATOM 0 H LYS A 97 -27.616 13.734 -28.723 1.00 10.25 H new ATOM 0 HA LYS A 97 -30.384 14.232 -29.135 1.00 30.44 H new ATOM 0 HB2 LYS A 97 -27.848 14.793 -30.383 1.00 60.11 H new ATOM 0 HB3 LYS A 97 -28.921 14.129 -31.600 1.00 60.11 H new ATOM 0 HG2 LYS A 97 -29.975 16.286 -29.792 1.00 51.34 H new ATOM 0 HG3 LYS A 97 -28.856 16.735 -31.064 1.00 51.34 H new ATOM 0 HD2 LYS A 97 -30.840 16.919 -32.230 1.00 12.41 H new ATOM 0 HD3 LYS A 97 -30.460 15.244 -32.578 1.00 12.41 H new ATOM 0 HE2 LYS A 97 -32.798 15.430 -31.893 1.00 70.34 H new ATOM 0 HE3 LYS A 97 -31.905 14.511 -30.698 1.00 70.34 H new ATOM 0 HZ1 LYS A 97 -33.499 16.446 -30.002 1.00 53.14 H new ATOM 0 HZ2 LYS A 97 -32.049 16.175 -29.160 1.00 53.14 H new ATOM 0 HZ3 LYS A 97 -32.141 17.416 -30.314 1.00 53.14 H new ATOM 1515 N ILE A 98 -29.339 11.332 -29.941 1.00 63.31 N ATOM 1516 CA ILE A 98 -29.708 10.037 -30.499 1.00 24.41 C ATOM 1517 C ILE A 98 -31.184 9.737 -30.263 1.00 20.20 C ATOM 1518 O ILE A 98 -31.797 8.963 -30.998 1.00 63.34 O ATOM 1519 CB ILE A 98 -28.862 8.901 -29.893 1.00 44.22 C ATOM 1520 CG1 ILE A 98 -28.920 7.660 -30.786 1.00 71.00 C ATOM 1521 CG2 ILE A 98 -29.344 8.573 -28.488 1.00 70.12 C ATOM 1522 CD1 ILE A 98 -27.696 7.484 -31.658 1.00 13.35 C ATOM 0 H ILE A 98 -28.529 11.309 -29.321 1.00 63.31 H new ATOM 0 HA ILE A 98 -29.517 10.090 -31.571 1.00 24.41 H new ATOM 0 HB ILE A 98 -27.826 9.233 -29.832 1.00 44.22 H new ATOM 0 HG12 ILE A 98 -29.039 6.777 -30.159 1.00 71.00 H new ATOM 0 HG13 ILE A 98 -29.803 7.721 -31.422 1.00 71.00 H new ATOM 0 HG21 ILE A 98 -28.736 7.769 -28.073 1.00 70.12 H new ATOM 0 HG22 ILE A 98 -29.255 9.457 -27.857 1.00 70.12 H new ATOM 0 HG23 ILE A 98 -30.387 8.258 -28.525 1.00 70.12 H new ATOM 0 HD11 ILE A 98 -27.807 6.584 -32.264 1.00 13.35 H new ATOM 0 HD12 ILE A 98 -27.587 8.350 -32.311 1.00 13.35 H new ATOM 0 HD13 ILE A 98 -26.811 7.391 -31.028 1.00 13.35 H new ATOM 1534 N VAL A 99 -31.751 10.357 -29.233 1.00 22.33 N ATOM 1535 CA VAL A 99 -33.157 10.159 -28.901 1.00 23.12 C ATOM 1536 C VAL A 99 -34.057 10.543 -30.070 1.00 64.40 C ATOM 1537 O VAL A 99 -35.211 10.124 -30.140 1.00 74.31 O ATOM 1538 CB VAL A 99 -33.562 10.982 -27.663 1.00 74.45 C ATOM 1539 CG1 VAL A 99 -33.708 12.452 -28.024 1.00 1.10 C ATOM 1540 CG2 VAL A 99 -34.852 10.441 -27.064 1.00 62.11 C ATOM 0 H VAL A 99 -31.258 11.001 -28.614 1.00 22.33 H new ATOM 0 HA VAL A 99 -33.285 9.099 -28.681 1.00 23.12 H new ATOM 0 HB VAL A 99 -32.775 10.893 -26.915 1.00 74.45 H new ATOM 0 HG11 VAL A 99 -33.994 13.018 -27.137 1.00 1.10 H new ATOM 0 HG12 VAL A 99 -32.759 12.829 -28.404 1.00 1.10 H new ATOM 0 HG13 VAL A 99 -34.476 12.564 -28.790 1.00 1.10 H new ATOM 0 HG21 VAL A 99 -35.124 11.033 -26.190 1.00 62.11 H new ATOM 0 HG22 VAL A 99 -35.650 10.499 -27.805 1.00 62.11 H new ATOM 0 HG23 VAL A 99 -34.708 9.402 -26.767 1.00 62.11 H new ATOM 1550 N GLU A 100 -33.519 11.342 -30.986 1.00 62.33 N ATOM 1551 CA GLU A 100 -34.274 11.782 -32.153 1.00 55.20 C ATOM 1552 C GLU A 100 -34.130 10.788 -33.302 1.00 10.12 C ATOM 1553 O GLU A 100 -34.880 10.836 -34.278 1.00 11.33 O ATOM 1554 CB GLU A 100 -33.803 13.167 -32.600 1.00 51.44 C ATOM 1555 CG GLU A 100 -34.496 13.670 -33.855 1.00 55.35 C ATOM 1556 CD GLU A 100 -34.897 15.129 -33.756 1.00 12.43 C ATOM 1557 OE1 GLU A 100 -35.675 15.469 -32.839 1.00 42.03 O ATOM 1558 OE2 GLU A 100 -34.434 15.931 -34.593 1.00 42.14 O ATOM 0 H GLU A 100 -32.564 11.697 -30.942 1.00 62.33 H new ATOM 0 HA GLU A 100 -35.326 11.837 -31.873 1.00 55.20 H new ATOM 0 HB2 GLU A 100 -33.973 13.878 -31.791 1.00 51.44 H new ATOM 0 HB3 GLU A 100 -32.728 13.136 -32.776 1.00 51.44 H new ATOM 0 HG2 GLU A 100 -33.833 13.537 -34.710 1.00 55.35 H new ATOM 0 HG3 GLU A 100 -35.383 13.065 -34.043 1.00 55.35 H new ATOM 1565 N LEU A 101 -33.161 9.888 -33.179 1.00 44.20 N ATOM 1566 CA LEU A 101 -32.916 8.882 -34.207 1.00 32.15 C ATOM 1567 C LEU A 101 -33.278 7.489 -33.701 1.00 61.14 C ATOM 1568 O LEU A 101 -34.254 6.889 -34.152 1.00 60.43 O ATOM 1569 CB LEU A 101 -31.450 8.914 -34.641 1.00 50.45 C ATOM 1570 CG LEU A 101 -31.185 9.377 -36.075 1.00 31.43 C ATOM 1571 CD1 LEU A 101 -31.790 10.752 -36.313 1.00 21.44 C ATOM 1572 CD2 LEU A 101 -29.691 9.392 -36.363 1.00 0.14 C ATOM 0 H LEU A 101 -32.532 9.834 -32.378 1.00 44.20 H new ATOM 0 HA LEU A 101 -33.547 9.113 -35.065 1.00 32.15 H new ATOM 0 HB2 LEU A 101 -30.905 9.570 -33.962 1.00 50.45 H new ATOM 0 HB3 LEU A 101 -31.034 7.914 -34.521 1.00 50.45 H new ATOM 0 HG LEU A 101 -31.659 8.672 -36.757 1.00 31.43 H new ATOM 0 HD11 LEU A 101 -31.591 11.064 -37.338 1.00 21.44 H new ATOM 0 HD12 LEU A 101 -32.867 10.709 -36.149 1.00 21.44 H new ATOM 0 HD13 LEU A 101 -31.346 11.469 -35.623 1.00 21.44 H new ATOM 0 HD21 LEU A 101 -29.521 9.724 -37.387 1.00 0.14 H new ATOM 0 HD22 LEU A 101 -29.194 10.075 -35.673 1.00 0.14 H new ATOM 0 HD23 LEU A 101 -29.286 8.388 -36.235 1.00 0.14 H new ATOM 1584 N ILE A 102 -32.487 6.982 -32.762 1.00 65.23 N ATOM 1585 CA ILE A 102 -32.726 5.661 -32.194 1.00 2.13 C ATOM 1586 C ILE A 102 -32.919 5.740 -30.683 1.00 70.31 C ATOM 1587 O ILE A 102 -32.062 5.329 -29.900 1.00 71.14 O ATOM 1588 CB ILE A 102 -31.565 4.697 -32.502 1.00 31.21 C ATOM 1589 CG1 ILE A 102 -30.948 5.025 -33.863 1.00 52.30 C ATOM 1590 CG2 ILE A 102 -32.051 3.256 -32.468 1.00 61.54 C ATOM 1591 CD1 ILE A 102 -31.948 5.012 -34.998 1.00 65.05 C ATOM 0 H ILE A 102 -31.675 7.466 -32.378 1.00 65.23 H new ATOM 0 HA ILE A 102 -33.637 5.279 -32.655 1.00 2.13 H new ATOM 0 HB ILE A 102 -30.798 4.820 -31.738 1.00 31.21 H new ATOM 0 HG12 ILE A 102 -30.480 6.008 -33.813 1.00 52.30 H new ATOM 0 HG13 ILE A 102 -30.158 4.306 -34.078 1.00 52.30 H new ATOM 0 HG21 ILE A 102 -31.219 2.586 -32.688 1.00 61.54 H new ATOM 0 HG22 ILE A 102 -32.448 3.029 -31.479 1.00 61.54 H new ATOM 0 HG23 ILE A 102 -32.834 3.118 -33.214 1.00 61.54 H new ATOM 0 HD11 ILE A 102 -31.441 5.253 -35.932 1.00 65.05 H new ATOM 0 HD12 ILE A 102 -32.399 4.023 -35.074 1.00 65.05 H new ATOM 0 HD13 ILE A 102 -32.726 5.751 -34.806 1.00 65.05 H new ATOM 1603 N PRO A 103 -34.073 6.279 -30.261 1.00 63.45 N ATOM 1604 CA PRO A 103 -34.407 6.422 -28.841 1.00 72.44 C ATOM 1605 C PRO A 103 -34.676 5.079 -28.171 1.00 71.41 C ATOM 1606 O PRO A 103 -34.444 4.023 -28.760 1.00 74.20 O ATOM 1607 CB PRO A 103 -35.679 7.274 -28.861 1.00 23.44 C ATOM 1608 CG PRO A 103 -36.289 7.014 -30.195 1.00 5.21 C ATOM 1609 CD PRO A 103 -35.140 6.789 -31.139 1.00 4.34 C ATOM 0 HA PRO A 103 -33.589 6.865 -28.272 1.00 72.44 H new ATOM 0 HB2 PRO A 103 -36.356 6.993 -28.055 1.00 23.44 H new ATOM 0 HB3 PRO A 103 -35.449 8.331 -28.730 1.00 23.44 H new ATOM 0 HG2 PRO A 103 -36.943 6.143 -30.162 1.00 5.21 H new ATOM 0 HG3 PRO A 103 -36.899 7.858 -30.517 1.00 5.21 H new ATOM 0 HD2 PRO A 103 -35.395 6.072 -31.919 1.00 4.34 H new ATOM 0 HD3 PRO A 103 -34.843 7.711 -31.638 1.00 4.34 H new ATOM 1617 N SER A 104 -35.167 5.126 -26.937 1.00 5.23 N ATOM 1618 CA SER A 104 -35.464 3.913 -26.185 1.00 23.51 C ATOM 1619 C SER A 104 -36.888 3.947 -25.638 1.00 4.20 C ATOM 1620 O SER A 104 -37.683 4.817 -25.996 1.00 65.01 O ATOM 1621 CB SER A 104 -34.468 3.742 -25.036 1.00 0.30 C ATOM 1622 OG SER A 104 -34.769 4.621 -23.966 1.00 31.13 O ATOM 0 H SER A 104 -35.368 5.992 -26.437 1.00 5.23 H new ATOM 0 HA SER A 104 -35.374 3.064 -26.863 1.00 23.51 H new ATOM 0 HB2 SER A 104 -34.490 2.711 -24.682 1.00 0.30 H new ATOM 0 HB3 SER A 104 -33.457 3.934 -25.395 1.00 0.30 H new ATOM 0 HG SER A 104 -34.120 4.491 -23.244 1.00 31.13 H new ATOM 1628 N THR A 105 -37.204 2.994 -24.767 1.00 23.11 N ATOM 1629 CA THR A 105 -38.531 2.913 -24.171 1.00 10.04 C ATOM 1630 C THR A 105 -38.628 3.786 -22.925 1.00 13.31 C ATOM 1631 O THR A 105 -37.671 4.466 -22.555 1.00 64.51 O ATOM 1632 CB THR A 105 -38.891 1.463 -23.796 1.00 75.15 C ATOM 1633 OG1 THR A 105 -37.982 0.972 -22.805 1.00 41.15 O ATOM 1634 CG2 THR A 105 -38.850 0.562 -25.021 1.00 64.33 C ATOM 0 H THR A 105 -36.558 2.267 -24.459 1.00 23.11 H new ATOM 0 HA THR A 105 -39.236 3.273 -24.920 1.00 10.04 H new ATOM 0 HB THR A 105 -39.904 1.456 -23.393 1.00 75.15 H new ATOM 0 HG1 THR A 105 -37.160 0.663 -23.240 1.00 41.15 H new ATOM 0 HG21 THR A 105 -39.108 -0.457 -24.732 1.00 64.33 H new ATOM 0 HG22 THR A 105 -39.565 0.921 -25.761 1.00 64.33 H new ATOM 0 HG23 THR A 105 -37.848 0.575 -25.449 1.00 64.33 H new ATOM 1642 N SER A 106 -39.791 3.763 -22.281 1.00 2.31 N ATOM 1643 CA SER A 106 -40.014 4.556 -21.077 1.00 62.15 C ATOM 1644 C SER A 106 -39.445 3.851 -19.850 1.00 2.33 C ATOM 1645 O SER A 106 -39.411 4.416 -18.756 1.00 60.23 O ATOM 1646 CB SER A 106 -41.509 4.817 -20.883 1.00 23.33 C ATOM 1647 OG SER A 106 -42.254 4.372 -22.003 1.00 11.11 O ATOM 0 H SER A 106 -40.593 3.204 -22.573 1.00 2.31 H new ATOM 0 HA SER A 106 -39.499 5.509 -21.198 1.00 62.15 H new ATOM 0 HB2 SER A 106 -41.857 4.307 -19.985 1.00 23.33 H new ATOM 0 HB3 SER A 106 -41.678 5.883 -20.730 1.00 23.33 H new ATOM 0 HG SER A 106 -43.206 4.549 -21.854 1.00 11.11 H new ATOM 1653 N SER A 107 -38.998 2.614 -20.039 1.00 75.33 N ATOM 1654 CA SER A 107 -38.434 1.829 -18.947 1.00 72.04 C ATOM 1655 C SER A 107 -36.920 1.710 -19.090 1.00 61.22 C ATOM 1656 O SER A 107 -36.196 1.637 -18.098 1.00 22.21 O ATOM 1657 CB SER A 107 -39.066 0.436 -18.913 1.00 22.11 C ATOM 1658 OG SER A 107 -39.542 0.124 -17.615 1.00 54.14 O ATOM 0 H SER A 107 -39.015 2.133 -20.938 1.00 75.33 H new ATOM 0 HA SER A 107 -38.654 2.343 -18.011 1.00 72.04 H new ATOM 0 HB2 SER A 107 -39.889 0.389 -19.627 1.00 22.11 H new ATOM 0 HB3 SER A 107 -38.332 -0.308 -19.223 1.00 22.11 H new ATOM 0 HG SER A 107 -39.943 -0.770 -17.620 1.00 54.14 H new ATOM 1664 N ALA A 108 -36.449 1.691 -20.333 1.00 23.33 N ATOM 1665 CA ALA A 108 -35.021 1.582 -20.607 1.00 12.51 C ATOM 1666 C ALA A 108 -34.330 2.934 -20.461 1.00 52.02 C ATOM 1667 O ALA A 108 -33.107 3.008 -20.344 1.00 21.32 O ATOM 1668 CB ALA A 108 -34.793 1.018 -22.001 1.00 41.44 C ATOM 0 H ALA A 108 -37.035 1.750 -21.166 1.00 23.33 H new ATOM 0 HA ALA A 108 -34.586 0.900 -19.876 1.00 12.51 H new ATOM 0 HB1 ALA A 108 -33.723 0.942 -22.192 1.00 41.44 H new ATOM 0 HB2 ALA A 108 -35.245 0.029 -22.072 1.00 41.44 H new ATOM 0 HB3 ALA A 108 -35.247 1.678 -22.740 1.00 41.44 H new ATOM 1674 N VAL A 109 -35.121 4.002 -20.470 1.00 55.11 N ATOM 1675 CA VAL A 109 -34.586 5.352 -20.339 1.00 24.35 C ATOM 1676 C VAL A 109 -33.767 5.496 -19.061 1.00 23.43 C ATOM 1677 O VAL A 109 -32.587 5.847 -19.086 1.00 51.31 O ATOM 1678 CB VAL A 109 -35.710 6.404 -20.336 1.00 10.31 C ATOM 1679 CG1 VAL A 109 -35.325 7.595 -19.471 1.00 41.14 C ATOM 1680 CG2 VAL A 109 -36.028 6.847 -21.756 1.00 74.31 C ATOM 0 H VAL A 109 -36.135 3.958 -20.567 1.00 55.11 H new ATOM 0 HA VAL A 109 -33.942 5.522 -21.202 1.00 24.35 H new ATOM 0 HB VAL A 109 -36.606 5.952 -19.911 1.00 10.31 H new ATOM 0 HG11 VAL A 109 -36.132 8.328 -19.481 1.00 41.14 H new ATOM 0 HG12 VAL A 109 -35.151 7.261 -18.448 1.00 41.14 H new ATOM 0 HG13 VAL A 109 -34.416 8.051 -19.863 1.00 41.14 H new ATOM 0 HG21 VAL A 109 -36.825 7.591 -21.735 1.00 74.31 H new ATOM 0 HG22 VAL A 109 -35.137 7.282 -22.210 1.00 74.31 H new ATOM 0 HG23 VAL A 109 -36.350 5.986 -22.342 1.00 74.31 H new ATOM 1690 N PRO A 110 -34.405 5.217 -17.914 1.00 40.13 N ATOM 1691 CA PRO A 110 -33.754 5.307 -16.604 1.00 13.21 C ATOM 1692 C PRO A 110 -32.708 4.217 -16.400 1.00 43.11 C ATOM 1693 O PRO A 110 -31.784 4.371 -15.600 1.00 63.03 O ATOM 1694 CB PRO A 110 -34.913 5.127 -15.620 1.00 4.15 C ATOM 1695 CG PRO A 110 -35.936 4.353 -16.377 1.00 12.45 C ATOM 1696 CD PRO A 110 -35.811 4.792 -17.809 1.00 50.23 C ATOM 0 HA PRO A 110 -33.213 6.245 -16.481 1.00 13.21 H new ATOM 0 HB2 PRO A 110 -34.594 4.592 -14.726 1.00 4.15 H new ATOM 0 HB3 PRO A 110 -35.307 6.089 -15.292 1.00 4.15 H new ATOM 0 HG2 PRO A 110 -35.764 3.281 -16.281 1.00 12.45 H new ATOM 0 HG3 PRO A 110 -36.937 4.551 -15.994 1.00 12.45 H new ATOM 0 HD2 PRO A 110 -36.038 3.980 -18.500 1.00 50.23 H new ATOM 0 HD3 PRO A 110 -36.496 5.608 -18.040 1.00 50.23 H new ATOM 1704 N LEU A 111 -32.858 3.116 -17.128 1.00 43.11 N ATOM 1705 CA LEU A 111 -31.925 1.999 -17.027 1.00 45.35 C ATOM 1706 C LEU A 111 -30.588 2.346 -17.676 1.00 73.03 C ATOM 1707 O LEU A 111 -29.547 2.339 -17.018 1.00 74.45 O ATOM 1708 CB LEU A 111 -32.517 0.753 -17.688 1.00 1.03 C ATOM 1709 CG LEU A 111 -33.080 -0.306 -16.739 1.00 13.41 C ATOM 1710 CD1 LEU A 111 -34.324 -0.947 -17.333 1.00 73.44 C ATOM 1711 CD2 LEU A 111 -32.028 -1.361 -16.432 1.00 61.24 C ATOM 0 H LEU A 111 -33.617 2.973 -17.795 1.00 43.11 H new ATOM 0 HA LEU A 111 -31.753 1.795 -15.970 1.00 45.35 H new ATOM 0 HB2 LEU A 111 -33.313 1.067 -18.363 1.00 1.03 H new ATOM 0 HB3 LEU A 111 -31.744 0.289 -18.301 1.00 1.03 H new ATOM 0 HG LEU A 111 -33.359 0.182 -15.805 1.00 13.41 H new ATOM 0 HD11 LEU A 111 -34.711 -1.698 -16.644 1.00 73.44 H new ATOM 0 HD12 LEU A 111 -35.083 -0.183 -17.500 1.00 73.44 H new ATOM 0 HD13 LEU A 111 -34.072 -1.421 -18.282 1.00 73.44 H new ATOM 0 HD21 LEU A 111 -32.447 -2.106 -15.755 1.00 61.24 H new ATOM 0 HD22 LEU A 111 -31.717 -1.845 -17.358 1.00 61.24 H new ATOM 0 HD23 LEU A 111 -31.165 -0.889 -15.962 1.00 61.24 H new ATOM 1723 N ILE A 112 -30.626 2.651 -18.969 1.00 2.10 N ATOM 1724 CA ILE A 112 -29.418 3.004 -19.705 1.00 53.13 C ATOM 1725 C ILE A 112 -28.837 4.323 -19.208 1.00 23.14 C ATOM 1726 O ILE A 112 -27.637 4.568 -19.325 1.00 40.25 O ATOM 1727 CB ILE A 112 -29.693 3.115 -21.217 1.00 22.23 C ATOM 1728 CG1 ILE A 112 -28.379 3.275 -21.985 1.00 75.23 C ATOM 1729 CG2 ILE A 112 -30.625 4.283 -21.501 1.00 72.25 C ATOM 1730 CD1 ILE A 112 -27.468 2.072 -21.881 1.00 51.02 C ATOM 0 H ILE A 112 -31.479 2.661 -19.528 1.00 2.10 H new ATOM 0 HA ILE A 112 -28.698 2.204 -19.532 1.00 53.13 H new ATOM 0 HB ILE A 112 -30.179 2.199 -21.552 1.00 22.23 H new ATOM 0 HG12 ILE A 112 -28.602 3.462 -23.035 1.00 75.23 H new ATOM 0 HG13 ILE A 112 -27.853 4.153 -21.610 1.00 75.23 H new ATOM 0 HG21 ILE A 112 -30.810 4.349 -22.573 1.00 72.25 H new ATOM 0 HG22 ILE A 112 -31.569 4.130 -20.979 1.00 72.25 H new ATOM 0 HG23 ILE A 112 -30.165 5.208 -21.155 1.00 72.25 H new ATOM 0 HD11 ILE A 112 -26.556 2.256 -22.449 1.00 51.02 H new ATOM 0 HD12 ILE A 112 -27.215 1.897 -20.835 1.00 51.02 H new ATOM 0 HD13 ILE A 112 -27.976 1.195 -22.283 1.00 51.02 H new ATOM 1742 N GLY A 113 -29.697 5.169 -18.649 1.00 5.34 N ATOM 1743 CA GLY A 113 -29.249 6.453 -18.139 1.00 73.43 C ATOM 1744 C GLY A 113 -28.278 6.311 -16.984 1.00 13.30 C ATOM 1745 O GLY A 113 -27.455 7.195 -16.743 1.00 33.42 O ATOM 0 H GLY A 113 -30.695 4.989 -18.540 1.00 5.34 H new ATOM 0 HA2 GLY A 113 -28.773 7.014 -18.943 1.00 73.43 H new ATOM 0 HA3 GLY A 113 -30.113 7.033 -17.814 1.00 73.43 H new ATOM 1749 N LYS A 114 -28.374 5.198 -16.266 1.00 31.35 N ATOM 1750 CA LYS A 114 -27.498 4.943 -15.128 1.00 70.42 C ATOM 1751 C LYS A 114 -26.177 4.332 -15.585 1.00 71.22 C ATOM 1752 O LYS A 114 -25.105 4.749 -15.147 1.00 22.21 O ATOM 1753 CB LYS A 114 -28.185 4.009 -14.128 1.00 42.44 C ATOM 1754 CG LYS A 114 -27.215 3.172 -13.312 1.00 41.54 C ATOM 1755 CD LYS A 114 -27.926 2.421 -12.200 1.00 34.31 C ATOM 1756 CE LYS A 114 -28.740 1.257 -12.745 1.00 54.43 C ATOM 1757 NZ LYS A 114 -30.205 1.496 -12.615 1.00 64.20 N ATOM 0 H LYS A 114 -29.050 4.457 -16.452 1.00 31.35 H new ATOM 0 HA LYS A 114 -27.289 5.896 -14.642 1.00 70.42 H new ATOM 0 HB2 LYS A 114 -28.798 4.603 -13.450 1.00 42.44 H new ATOM 0 HB3 LYS A 114 -28.860 3.345 -14.668 1.00 42.44 H new ATOM 0 HG2 LYS A 114 -26.707 2.462 -13.965 1.00 41.54 H new ATOM 0 HG3 LYS A 114 -26.447 3.817 -12.884 1.00 41.54 H new ATOM 0 HD2 LYS A 114 -27.193 2.050 -11.484 1.00 34.31 H new ATOM 0 HD3 LYS A 114 -28.582 3.104 -11.660 1.00 34.31 H new ATOM 0 HE2 LYS A 114 -28.490 1.098 -13.794 1.00 54.43 H new ATOM 0 HE3 LYS A 114 -28.472 0.345 -12.212 1.00 54.43 H new ATOM 0 HZ1 LYS A 114 -30.725 0.681 -12.997 1.00 64.20 H new ATOM 0 HZ2 LYS A 114 -30.448 1.622 -11.612 1.00 64.20 H new ATOM 0 HZ3 LYS A 114 -30.465 2.352 -13.145 1.00 64.20 H new ATOM 1771 N TYR A 115 -26.262 3.343 -16.469 1.00 0.54 N ATOM 1772 CA TYR A 115 -25.073 2.675 -16.984 1.00 51.01 C ATOM 1773 C TYR A 115 -24.125 3.676 -17.637 1.00 2.45 C ATOM 1774 O TYR A 115 -22.911 3.615 -17.443 1.00 70.04 O ATOM 1775 CB TYR A 115 -25.467 1.596 -17.994 1.00 62.12 C ATOM 1776 CG TYR A 115 -26.158 0.405 -17.369 1.00 61.04 C ATOM 1777 CD1 TYR A 115 -25.542 -0.334 -16.367 1.00 10.32 C ATOM 1778 CD2 TYR A 115 -27.428 0.019 -17.781 1.00 43.24 C ATOM 1779 CE1 TYR A 115 -26.170 -1.423 -15.794 1.00 5.10 C ATOM 1780 CE2 TYR A 115 -28.063 -1.068 -17.213 1.00 55.21 C ATOM 1781 CZ TYR A 115 -27.430 -1.786 -16.220 1.00 51.22 C ATOM 1782 OH TYR A 115 -28.059 -2.869 -15.651 1.00 72.30 O ATOM 0 H TYR A 115 -27.142 2.987 -16.843 1.00 0.54 H new ATOM 0 HA TYR A 115 -24.557 2.208 -16.145 1.00 51.01 H new ATOM 0 HB2 TYR A 115 -26.125 2.035 -18.744 1.00 62.12 H new ATOM 0 HB3 TYR A 115 -24.573 1.254 -18.515 1.00 62.12 H new ATOM 0 HD1 TYR A 115 -24.555 -0.052 -16.030 1.00 10.32 H new ATOM 0 HD2 TYR A 115 -27.927 0.579 -18.559 1.00 43.24 H new ATOM 0 HE1 TYR A 115 -25.676 -1.987 -15.016 1.00 5.10 H new ATOM 0 HE2 TYR A 115 -29.050 -1.354 -17.545 1.00 55.21 H new ATOM 0 HH TYR A 115 -28.940 -2.989 -16.063 1.00 72.30 H new ATOM 1792 N MET A 116 -24.689 4.598 -18.410 1.00 10.54 N ATOM 1793 CA MET A 116 -23.895 5.615 -19.090 1.00 22.03 C ATOM 1794 C MET A 116 -22.977 6.336 -18.107 1.00 73.41 C ATOM 1795 O MET A 116 -21.753 6.261 -18.217 1.00 4.52 O ATOM 1796 CB MET A 116 -24.809 6.625 -19.787 1.00 24.23 C ATOM 1797 CG MET A 116 -24.533 6.768 -21.275 1.00 4.34 C ATOM 1798 SD MET A 116 -23.679 8.305 -21.678 1.00 35.23 S ATOM 1799 CE MET A 116 -25.064 9.430 -21.832 1.00 51.41 C ATOM 0 H MET A 116 -25.692 4.662 -18.581 1.00 10.54 H new ATOM 0 HA MET A 116 -23.278 5.118 -19.838 1.00 22.03 H new ATOM 0 HB2 MET A 116 -25.846 6.322 -19.646 1.00 24.23 H new ATOM 0 HB3 MET A 116 -24.693 7.598 -19.309 1.00 24.23 H new ATOM 0 HG2 MET A 116 -23.932 5.924 -21.612 1.00 4.34 H new ATOM 0 HG3 MET A 116 -25.475 6.726 -21.821 1.00 4.34 H new ATOM 0 HE1 MET A 116 -24.754 10.432 -21.534 1.00 51.41 H new ATOM 0 HE2 MET A 116 -25.404 9.449 -22.867 1.00 51.41 H new ATOM 0 HE3 MET A 116 -25.878 9.095 -21.189 1.00 51.41 H new ATOM 1809 N LEU A 117 -23.576 7.032 -17.148 1.00 11.43 N ATOM 1810 CA LEU A 117 -22.812 7.767 -16.145 1.00 53.22 C ATOM 1811 C LEU A 117 -21.946 6.821 -15.320 1.00 1.43 C ATOM 1812 O LEU A 117 -20.910 7.218 -14.785 1.00 52.44 O ATOM 1813 CB LEU A 117 -23.755 8.546 -15.227 1.00 35.15 C ATOM 1814 CG LEU A 117 -23.126 9.691 -14.433 1.00 43.43 C ATOM 1815 CD1 LEU A 117 -23.389 11.023 -15.119 1.00 4.20 C ATOM 1816 CD2 LEU A 117 -23.658 9.709 -13.008 1.00 12.11 C ATOM 0 H LEU A 117 -24.588 7.103 -17.043 1.00 11.43 H new ATOM 0 HA LEU A 117 -22.159 8.469 -16.663 1.00 53.22 H new ATOM 0 HB2 LEU A 117 -24.565 8.953 -15.832 1.00 35.15 H new ATOM 0 HB3 LEU A 117 -24.204 7.846 -14.522 1.00 35.15 H new ATOM 0 HG LEU A 117 -22.048 9.531 -14.394 1.00 43.43 H new ATOM 0 HD11 LEU A 117 -22.934 11.827 -14.540 1.00 4.20 H new ATOM 0 HD12 LEU A 117 -22.958 11.008 -16.120 1.00 4.20 H new ATOM 0 HD13 LEU A 117 -24.464 11.190 -15.189 1.00 4.20 H new ATOM 0 HD21 LEU A 117 -23.199 10.531 -12.459 1.00 12.11 H new ATOM 0 HD22 LEU A 117 -24.740 9.844 -13.025 1.00 12.11 H new ATOM 0 HD23 LEU A 117 -23.417 8.766 -12.518 1.00 12.11 H new ATOM 1828 N PHE A 118 -22.376 5.568 -15.221 1.00 63.22 N ATOM 1829 CA PHE A 118 -21.639 4.564 -14.462 1.00 2.42 C ATOM 1830 C PHE A 118 -20.178 4.516 -14.899 1.00 5.53 C ATOM 1831 O PHE A 118 -19.270 4.759 -14.102 1.00 53.41 O ATOM 1832 CB PHE A 118 -22.281 3.187 -14.639 1.00 31.15 C ATOM 1833 CG PHE A 118 -22.372 2.400 -13.363 1.00 23.43 C ATOM 1834 CD1 PHE A 118 -23.458 2.551 -12.515 1.00 63.25 C ATOM 1835 CD2 PHE A 118 -21.371 1.508 -13.011 1.00 33.03 C ATOM 1836 CE1 PHE A 118 -23.543 1.828 -11.341 1.00 0.15 C ATOM 1837 CE2 PHE A 118 -21.451 0.782 -11.837 1.00 53.11 C ATOM 1838 CZ PHE A 118 -22.539 0.942 -11.002 1.00 33.25 C ATOM 0 H PHE A 118 -23.231 5.223 -15.657 1.00 63.22 H new ATOM 0 HA PHE A 118 -21.676 4.842 -13.409 1.00 2.42 H new ATOM 0 HB2 PHE A 118 -23.282 3.312 -15.052 1.00 31.15 H new ATOM 0 HB3 PHE A 118 -21.705 2.617 -15.368 1.00 31.15 H new ATOM 0 HD1 PHE A 118 -24.247 3.242 -12.775 1.00 63.25 H new ATOM 0 HD2 PHE A 118 -20.519 1.379 -13.661 1.00 33.03 H new ATOM 0 HE1 PHE A 118 -24.394 1.955 -10.688 1.00 0.15 H new ATOM 0 HE2 PHE A 118 -20.664 0.091 -11.574 1.00 53.11 H new ATOM 0 HZ PHE A 118 -22.605 0.375 -10.085 1.00 33.25 H new ATOM 1848 N THR A 119 -19.956 4.201 -16.171 1.00 75.51 N ATOM 1849 CA THR A 119 -18.607 4.118 -16.715 1.00 2.52 C ATOM 1850 C THR A 119 -17.871 5.445 -16.562 1.00 21.41 C ATOM 1851 O THR A 119 -16.709 5.479 -16.156 1.00 31.14 O ATOM 1852 CB THR A 119 -18.624 3.723 -18.203 1.00 60.43 C ATOM 1853 OG1 THR A 119 -19.137 2.394 -18.351 1.00 54.00 O ATOM 1854 CG2 THR A 119 -17.227 3.801 -18.800 1.00 41.13 C ATOM 0 H THR A 119 -20.695 3.999 -16.845 1.00 75.51 H new ATOM 0 HA THR A 119 -18.085 3.347 -16.148 1.00 2.52 H new ATOM 0 HB THR A 119 -19.269 4.423 -18.734 1.00 60.43 H new ATOM 0 HG1 THR A 119 -19.146 2.151 -19.300 1.00 54.00 H new ATOM 0 HG21 THR A 119 -17.264 3.517 -19.852 1.00 41.13 H new ATOM 0 HG22 THR A 119 -16.850 4.820 -18.712 1.00 41.13 H new ATOM 0 HG23 THR A 119 -16.564 3.121 -18.264 1.00 41.13 H new ATOM 1862 N LYS A 120 -18.554 6.536 -16.889 1.00 51.21 N ATOM 1863 CA LYS A 120 -17.966 7.867 -16.787 1.00 35.35 C ATOM 1864 C LYS A 120 -17.487 8.142 -15.365 1.00 33.32 C ATOM 1865 O LYS A 120 -16.503 8.851 -15.159 1.00 30.23 O ATOM 1866 CB LYS A 120 -18.984 8.930 -17.208 1.00 25.22 C ATOM 1867 CG LYS A 120 -18.364 10.108 -17.939 1.00 72.04 C ATOM 1868 CD LYS A 120 -19.119 11.397 -17.661 1.00 32.22 C ATOM 1869 CE LYS A 120 -18.437 12.220 -16.579 1.00 20.43 C ATOM 1870 NZ LYS A 120 -19.270 12.318 -15.348 1.00 71.43 N ATOM 0 H LYS A 120 -19.516 6.525 -17.227 1.00 51.21 H new ATOM 0 HA LYS A 120 -17.107 7.910 -17.456 1.00 35.35 H new ATOM 0 HB2 LYS A 120 -19.734 8.469 -17.850 1.00 25.22 H new ATOM 0 HB3 LYS A 120 -19.503 9.295 -16.322 1.00 25.22 H new ATOM 0 HG2 LYS A 120 -17.324 10.221 -17.632 1.00 72.04 H new ATOM 0 HG3 LYS A 120 -18.361 9.911 -19.011 1.00 72.04 H new ATOM 0 HD2 LYS A 120 -19.188 11.984 -18.577 1.00 32.22 H new ATOM 0 HD3 LYS A 120 -20.139 11.164 -17.354 1.00 32.22 H new ATOM 0 HE2 LYS A 120 -17.476 11.770 -16.332 1.00 20.43 H new ATOM 0 HE3 LYS A 120 -18.232 13.221 -16.959 1.00 20.43 H new ATOM 0 HZ1 LYS A 120 -18.770 12.887 -14.635 1.00 71.43 H new ATOM 0 HZ2 LYS A 120 -20.177 12.771 -15.578 1.00 71.43 H new ATOM 0 HZ3 LYS A 120 -19.445 11.365 -14.970 1.00 71.43 H new ATOM 1884 N GLU A 121 -18.189 7.575 -14.388 1.00 60.44 N ATOM 1885 CA GLU A 121 -17.833 7.759 -12.986 1.00 53.33 C ATOM 1886 C GLU A 121 -16.615 6.917 -12.618 1.00 75.44 C ATOM 1887 O GLU A 121 -15.900 7.223 -11.664 1.00 71.42 O ATOM 1888 CB GLU A 121 -19.013 7.391 -12.085 1.00 35.41 C ATOM 1889 CG GLU A 121 -19.121 8.254 -10.839 1.00 62.12 C ATOM 1890 CD GLU A 121 -19.666 7.492 -9.647 1.00 15.31 C ATOM 1891 OE1 GLU A 121 -18.881 6.777 -8.990 1.00 44.42 O ATOM 1892 OE2 GLU A 121 -20.878 7.611 -9.371 1.00 34.44 O ATOM 0 H GLU A 121 -19.007 6.985 -14.542 1.00 60.44 H new ATOM 0 HA GLU A 121 -17.584 8.810 -12.836 1.00 53.33 H new ATOM 0 HB2 GLU A 121 -19.937 7.477 -12.657 1.00 35.41 H new ATOM 0 HB3 GLU A 121 -18.919 6.347 -11.786 1.00 35.41 H new ATOM 0 HG2 GLU A 121 -18.137 8.653 -10.592 1.00 62.12 H new ATOM 0 HG3 GLU A 121 -19.768 9.107 -11.047 1.00 62.12 H new ATOM 1899 N PHE A 122 -16.387 5.853 -13.382 1.00 5.30 N ATOM 1900 CA PHE A 122 -15.257 4.965 -13.136 1.00 63.33 C ATOM 1901 C PHE A 122 -13.972 5.544 -13.722 1.00 30.31 C ATOM 1902 O PHE A 122 -12.872 5.223 -13.272 1.00 63.35 O ATOM 1903 CB PHE A 122 -15.527 3.584 -13.737 1.00 20.53 C ATOM 1904 CG PHE A 122 -14.829 2.468 -13.013 1.00 5.12 C ATOM 1905 CD1 PHE A 122 -13.463 2.282 -13.153 1.00 3.05 C ATOM 1906 CD2 PHE A 122 -15.538 1.605 -12.193 1.00 10.30 C ATOM 1907 CE1 PHE A 122 -12.817 1.257 -12.487 1.00 63.25 C ATOM 1908 CE2 PHE A 122 -14.898 0.579 -11.525 1.00 65.32 C ATOM 1909 CZ PHE A 122 -13.535 0.403 -11.674 1.00 15.54 C ATOM 0 H PHE A 122 -16.969 5.585 -14.176 1.00 5.30 H new ATOM 0 HA PHE A 122 -15.132 4.867 -12.058 1.00 63.33 H new ATOM 0 HB2 PHE A 122 -16.601 3.396 -13.728 1.00 20.53 H new ATOM 0 HB3 PHE A 122 -15.212 3.583 -14.780 1.00 20.53 H new ATOM 0 HD1 PHE A 122 -12.896 2.945 -13.790 1.00 3.05 H new ATOM 0 HD2 PHE A 122 -16.603 1.736 -12.075 1.00 10.30 H new ATOM 0 HE1 PHE A 122 -11.751 1.125 -12.603 1.00 63.25 H new ATOM 0 HE2 PHE A 122 -15.462 -0.085 -10.887 1.00 65.32 H new ATOM 0 HZ PHE A 122 -13.033 -0.401 -11.156 1.00 15.54 H new ATOM 1919 N VAL A 123 -14.120 6.399 -14.729 1.00 35.14 N ATOM 1920 CA VAL A 123 -12.973 7.024 -15.376 1.00 74.23 C ATOM 1921 C VAL A 123 -12.139 7.813 -14.374 1.00 51.40 C ATOM 1922 O VAL A 123 -10.952 8.053 -14.593 1.00 12.23 O ATOM 1923 CB VAL A 123 -13.415 7.964 -16.514 1.00 25.11 C ATOM 1924 CG1 VAL A 123 -12.205 8.603 -17.178 1.00 65.12 C ATOM 1925 CG2 VAL A 123 -14.255 7.209 -17.532 1.00 54.03 C ATOM 0 H VAL A 123 -15.023 6.675 -15.114 1.00 35.14 H new ATOM 0 HA VAL A 123 -12.367 6.220 -15.793 1.00 74.23 H new ATOM 0 HB VAL A 123 -14.028 8.758 -16.089 1.00 25.11 H new ATOM 0 HG11 VAL A 123 -12.536 9.264 -17.979 1.00 65.12 H new ATOM 0 HG12 VAL A 123 -11.647 9.179 -16.440 1.00 65.12 H new ATOM 0 HG13 VAL A 123 -11.563 7.825 -17.591 1.00 65.12 H new ATOM 0 HG21 VAL A 123 -14.559 7.888 -18.329 1.00 54.03 H new ATOM 0 HG22 VAL A 123 -13.668 6.393 -17.954 1.00 54.03 H new ATOM 0 HG23 VAL A 123 -15.141 6.804 -17.044 1.00 54.03 H new ATOM 1935 N GLU A 124 -12.769 8.214 -13.274 1.00 3.41 N ATOM 1936 CA GLU A 124 -12.083 8.978 -12.238 1.00 33.34 C ATOM 1937 C GLU A 124 -11.057 8.112 -11.513 1.00 64.33 C ATOM 1938 O GLU A 124 -10.103 8.622 -10.926 1.00 23.43 O ATOM 1939 CB GLU A 124 -13.093 9.538 -11.234 1.00 11.12 C ATOM 1940 CG GLU A 124 -13.910 10.699 -11.776 1.00 3.23 C ATOM 1941 CD GLU A 124 -13.424 12.042 -11.266 1.00 43.23 C ATOM 1942 OE1 GLU A 124 -12.266 12.405 -11.563 1.00 22.34 O ATOM 1943 OE2 GLU A 124 -14.200 12.730 -10.572 1.00 13.34 O ATOM 0 H GLU A 124 -13.751 8.023 -13.077 1.00 3.41 H new ATOM 0 HA GLU A 124 -11.561 9.805 -12.718 1.00 33.34 H new ATOM 0 HB2 GLU A 124 -13.770 8.740 -10.928 1.00 11.12 H new ATOM 0 HB3 GLU A 124 -12.561 9.865 -10.340 1.00 11.12 H new ATOM 0 HG2 GLU A 124 -13.868 10.691 -12.865 1.00 3.23 H new ATOM 0 HG3 GLU A 124 -14.955 10.565 -11.497 1.00 3.23 H new ATOM 1950 N SER A 125 -11.260 6.799 -11.560 1.00 12.03 N ATOM 1951 CA SER A 125 -10.355 5.862 -10.905 1.00 34.52 C ATOM 1952 C SER A 125 -8.919 6.075 -11.374 1.00 74.52 C ATOM 1953 O SER A 125 -7.968 5.794 -10.645 1.00 13.43 O ATOM 1954 CB SER A 125 -10.788 4.421 -11.187 1.00 2.33 C ATOM 1955 OG SER A 125 -10.507 3.579 -10.082 1.00 43.13 O ATOM 0 H SER A 125 -12.043 6.360 -12.045 1.00 12.03 H new ATOM 0 HA SER A 125 -10.398 6.044 -9.831 1.00 34.52 H new ATOM 0 HB2 SER A 125 -11.855 4.395 -11.406 1.00 2.33 H new ATOM 0 HB3 SER A 125 -10.272 4.049 -12.072 1.00 2.33 H new ATOM 0 HG SER A 125 -10.794 2.665 -10.286 1.00 43.13 H new ATOM 1961 N SER A 126 -8.771 6.572 -12.598 1.00 11.23 N ATOM 1962 CA SER A 126 -7.452 6.820 -13.167 1.00 61.25 C ATOM 1963 C SER A 126 -6.662 7.798 -12.303 1.00 62.14 C ATOM 1964 O SER A 126 -5.461 7.626 -12.091 1.00 71.44 O ATOM 1965 CB SER A 126 -7.582 7.368 -14.590 1.00 10.33 C ATOM 1966 OG SER A 126 -7.685 6.317 -15.534 1.00 43.04 O ATOM 0 H SER A 126 -9.548 6.811 -13.214 1.00 11.23 H new ATOM 0 HA SER A 126 -6.913 5.873 -13.198 1.00 61.25 H new ATOM 0 HB2 SER A 126 -8.461 8.009 -14.657 1.00 10.33 H new ATOM 0 HB3 SER A 126 -6.717 7.988 -14.825 1.00 10.33 H new ATOM 0 HG SER A 126 -7.769 6.694 -16.435 1.00 43.04 H new ATOM 1972 N ILE A 127 -7.345 8.824 -11.808 1.00 5.34 N ATOM 1973 CA ILE A 127 -6.708 9.830 -10.966 1.00 23.41 C ATOM 1974 C ILE A 127 -6.649 9.372 -9.512 1.00 53.43 C ATOM 1975 O ILE A 127 -5.662 9.608 -8.815 1.00 34.33 O ATOM 1976 CB ILE A 127 -7.450 11.177 -11.039 1.00 43.20 C ATOM 1977 CG1 ILE A 127 -7.885 11.467 -12.477 1.00 33.11 C ATOM 1978 CG2 ILE A 127 -6.566 12.298 -10.512 1.00 30.35 C ATOM 1979 CD1 ILE A 127 -9.339 11.144 -12.745 1.00 24.23 C ATOM 0 H ILE A 127 -8.339 8.981 -11.975 1.00 5.34 H new ATOM 0 HA ILE A 127 -5.694 9.963 -11.344 1.00 23.41 H new ATOM 0 HB ILE A 127 -8.341 11.118 -10.414 1.00 43.20 H new ATOM 0 HG12 ILE A 127 -7.709 12.520 -12.696 1.00 33.11 H new ATOM 0 HG13 ILE A 127 -7.261 10.891 -13.160 1.00 33.11 H new ATOM 0 HG21 ILE A 127 -7.105 13.244 -10.570 1.00 30.35 H new ATOM 0 HG22 ILE A 127 -6.300 12.095 -9.475 1.00 30.35 H new ATOM 0 HG23 ILE A 127 -5.659 12.359 -11.113 1.00 30.35 H new ATOM 0 HD11 ILE A 127 -9.577 11.374 -13.783 1.00 24.23 H new ATOM 0 HD12 ILE A 127 -9.517 10.085 -12.558 1.00 24.23 H new ATOM 0 HD13 ILE A 127 -9.971 11.740 -12.087 1.00 24.23 H new ATOM 1991 N LYS A 128 -7.713 8.716 -9.061 1.00 63.22 N ATOM 1992 CA LYS A 128 -7.783 8.221 -7.691 1.00 41.52 C ATOM 1993 C LYS A 128 -6.561 7.372 -7.356 1.00 0.42 C ATOM 1994 O LYS A 128 -5.905 7.588 -6.336 1.00 60.22 O ATOM 1995 CB LYS A 128 -9.059 7.401 -7.488 1.00 63.01 C ATOM 1996 CG LYS A 128 -9.758 7.681 -6.169 1.00 72.32 C ATOM 1997 CD LYS A 128 -11.009 8.521 -6.368 1.00 65.23 C ATOM 1998 CE LYS A 128 -12.264 7.662 -6.362 1.00 1.01 C ATOM 1999 NZ LYS A 128 -13.174 8.018 -5.238 1.00 42.22 N ATOM 0 H LYS A 128 -8.539 8.515 -9.625 1.00 63.22 H new ATOM 0 HA LYS A 128 -7.801 9.081 -7.021 1.00 41.52 H new ATOM 0 HB2 LYS A 128 -9.748 7.609 -8.306 1.00 63.01 H new ATOM 0 HB3 LYS A 128 -8.812 6.341 -7.541 1.00 63.01 H new ATOM 0 HG2 LYS A 128 -10.024 6.739 -5.690 1.00 72.32 H new ATOM 0 HG3 LYS A 128 -9.074 8.199 -5.496 1.00 72.32 H new ATOM 0 HD2 LYS A 128 -11.075 9.269 -5.578 1.00 65.23 H new ATOM 0 HD3 LYS A 128 -10.940 9.060 -7.313 1.00 65.23 H new ATOM 0 HE2 LYS A 128 -12.791 7.783 -7.308 1.00 1.01 H new ATOM 0 HE3 LYS A 128 -11.985 6.611 -6.284 1.00 1.01 H new ATOM 0 HZ1 LYS A 128 -14.018 7.410 -5.269 1.00 42.22 H new ATOM 0 HZ2 LYS A 128 -12.680 7.879 -4.334 1.00 42.22 H new ATOM 0 HZ3 LYS A 128 -13.461 9.014 -5.326 1.00 42.22 H new ATOM 2013 N ILE A 129 -6.260 6.409 -8.220 1.00 35.20 N ATOM 2014 CA ILE A 129 -5.116 5.530 -8.016 1.00 22.13 C ATOM 2015 C ILE A 129 -3.814 6.323 -7.978 1.00 23.30 C ATOM 2016 O ILE A 129 -3.048 6.236 -7.018 1.00 22.25 O ATOM 2017 CB ILE A 129 -5.022 4.462 -9.121 1.00 64.04 C ATOM 2018 CG1 ILE A 129 -5.993 3.315 -8.837 1.00 31.32 C ATOM 2019 CG2 ILE A 129 -3.597 3.941 -9.235 1.00 23.05 C ATOM 2020 CD1 ILE A 129 -6.106 2.322 -9.973 1.00 5.22 C ATOM 0 H ILE A 129 -6.793 6.218 -9.068 1.00 35.20 H new ATOM 0 HA ILE A 129 -5.265 5.035 -7.056 1.00 22.13 H new ATOM 0 HB ILE A 129 -5.298 4.919 -10.071 1.00 64.04 H new ATOM 0 HG12 ILE A 129 -5.670 2.791 -7.938 1.00 31.32 H new ATOM 0 HG13 ILE A 129 -6.979 3.729 -8.627 1.00 31.32 H new ATOM 0 HG21 ILE A 129 -3.547 3.187 -10.020 1.00 23.05 H new ATOM 0 HG22 ILE A 129 -2.927 4.765 -9.480 1.00 23.05 H new ATOM 0 HG23 ILE A 129 -3.295 3.497 -8.286 1.00 23.05 H new ATOM 0 HD11 ILE A 129 -6.811 1.537 -9.701 1.00 5.22 H new ATOM 0 HD12 ILE A 129 -6.459 2.833 -10.869 1.00 5.22 H new ATOM 0 HD13 ILE A 129 -5.129 1.880 -10.169 1.00 5.22 H new ATOM 2032 N THR A 130 -3.569 7.099 -9.030 1.00 22.55 N ATOM 2033 CA THR A 130 -2.360 7.908 -9.117 1.00 52.11 C ATOM 2034 C THR A 130 -2.256 8.869 -7.938 1.00 44.25 C ATOM 2035 O THR A 130 -1.167 9.329 -7.596 1.00 63.21 O ATOM 2036 CB THR A 130 -2.318 8.715 -10.428 1.00 54.33 C ATOM 2037 OG1 THR A 130 -3.649 9.028 -10.854 1.00 35.41 O ATOM 2038 CG2 THR A 130 -1.601 7.937 -11.521 1.00 21.45 C ATOM 0 H THR A 130 -4.192 7.184 -9.833 1.00 22.55 H new ATOM 0 HA THR A 130 -1.516 7.219 -9.096 1.00 52.11 H new ATOM 0 HB THR A 130 -1.769 9.638 -10.242 1.00 54.33 H new ATOM 0 HG1 THR A 130 -3.967 8.335 -11.469 1.00 35.41 H new ATOM 0 HG21 THR A 130 -1.584 8.528 -12.437 1.00 21.45 H new ATOM 0 HG22 THR A 130 -0.579 7.726 -11.207 1.00 21.45 H new ATOM 0 HG23 THR A 130 -2.125 6.999 -11.704 1.00 21.45 H new ATOM 2046 N GLU A 131 -3.395 9.168 -7.322 1.00 4.05 N ATOM 2047 CA GLU A 131 -3.429 10.075 -6.181 1.00 13.44 C ATOM 2048 C GLU A 131 -2.573 9.543 -5.036 1.00 23.24 C ATOM 2049 O GLU A 131 -2.192 10.288 -4.134 1.00 2.33 O ATOM 2050 CB GLU A 131 -4.869 10.276 -5.704 1.00 54.30 C ATOM 2051 CG GLU A 131 -5.194 11.715 -5.337 1.00 72.44 C ATOM 2052 CD GLU A 131 -6.466 11.836 -4.521 1.00 73.50 C ATOM 2053 OE1 GLU A 131 -6.927 10.807 -3.983 1.00 41.12 O ATOM 2054 OE2 GLU A 131 -7.001 12.960 -4.420 1.00 71.32 O ATOM 0 H GLU A 131 -4.305 8.796 -7.593 1.00 4.05 H new ATOM 0 HA GLU A 131 -3.022 11.034 -6.501 1.00 13.44 H new ATOM 0 HB2 GLU A 131 -5.552 9.947 -6.487 1.00 54.30 H new ATOM 0 HB3 GLU A 131 -5.048 9.640 -4.837 1.00 54.30 H new ATOM 0 HG2 GLU A 131 -4.363 12.139 -4.773 1.00 72.44 H new ATOM 0 HG3 GLU A 131 -5.294 12.305 -6.248 1.00 72.44 H new ATOM 2061 N GLU A 132 -2.275 8.248 -5.080 1.00 22.02 N ATOM 2062 CA GLU A 132 -1.465 7.615 -4.045 1.00 44.54 C ATOM 2063 C GLU A 132 0.023 7.805 -4.327 1.00 50.54 C ATOM 2064 O GLU A 132 0.842 7.836 -3.408 1.00 54.04 O ATOM 2065 CB GLU A 132 -1.791 6.123 -3.952 1.00 42.42 C ATOM 2066 CG GLU A 132 -1.508 5.523 -2.585 1.00 60.25 C ATOM 2067 CD GLU A 132 -2.774 5.223 -1.807 1.00 11.44 C ATOM 2068 OE1 GLU A 132 -3.401 4.177 -2.074 1.00 70.23 O ATOM 2069 OE2 GLU A 132 -3.138 6.035 -0.930 1.00 71.22 O ATOM 0 H GLU A 132 -2.582 7.617 -5.820 1.00 22.02 H new ATOM 0 HA GLU A 132 -1.701 8.091 -3.093 1.00 44.54 H new ATOM 0 HB2 GLU A 132 -2.843 5.974 -4.194 1.00 42.42 H new ATOM 0 HB3 GLU A 132 -1.212 5.585 -4.703 1.00 42.42 H new ATOM 0 HG2 GLU A 132 -0.935 4.604 -2.707 1.00 60.25 H new ATOM 0 HG3 GLU A 132 -0.888 6.212 -2.011 1.00 60.25 H new ATOM 2076 N VAL A 133 0.366 7.932 -5.605 1.00 54.25 N ATOM 2077 CA VAL A 133 1.754 8.120 -6.010 1.00 32.31 C ATOM 2078 C VAL A 133 2.309 9.435 -5.475 1.00 24.45 C ATOM 2079 O VAL A 133 3.524 9.619 -5.391 1.00 61.32 O ATOM 2080 CB VAL A 133 1.899 8.100 -7.543 1.00 63.11 C ATOM 2081 CG1 VAL A 133 1.740 9.501 -8.113 1.00 11.21 C ATOM 2082 CG2 VAL A 133 3.240 7.502 -7.943 1.00 12.20 C ATOM 0 H VAL A 133 -0.299 7.908 -6.378 1.00 54.25 H new ATOM 0 HA VAL A 133 2.322 7.291 -5.588 1.00 32.31 H new ATOM 0 HB VAL A 133 1.109 7.474 -7.957 1.00 63.11 H new ATOM 0 HG11 VAL A 133 1.846 9.467 -9.197 1.00 11.21 H new ATOM 0 HG12 VAL A 133 0.754 9.888 -7.856 1.00 11.21 H new ATOM 0 HG13 VAL A 133 2.506 10.153 -7.694 1.00 11.21 H new ATOM 0 HG21 VAL A 133 3.326 7.495 -9.030 1.00 12.20 H new ATOM 0 HG22 VAL A 133 4.046 8.100 -7.519 1.00 12.20 H new ATOM 0 HG23 VAL A 133 3.310 6.481 -7.567 1.00 12.20 H new ATOM 2092 N ILE A 134 1.413 10.346 -5.113 1.00 35.35 N ATOM 2093 CA ILE A 134 1.813 11.643 -4.583 1.00 43.33 C ATOM 2094 C ILE A 134 2.578 11.490 -3.273 1.00 11.21 C ATOM 2095 O ILE A 134 3.350 12.367 -2.887 1.00 15.13 O ATOM 2096 CB ILE A 134 0.596 12.557 -4.350 1.00 75.14 C ATOM 2097 CG1 ILE A 134 -0.178 12.106 -3.110 1.00 22.15 C ATOM 2098 CG2 ILE A 134 -0.309 12.556 -5.574 1.00 3.41 C ATOM 2099 CD1 ILE A 134 0.190 12.870 -1.857 1.00 43.32 C ATOM 0 H ILE A 134 0.404 10.210 -5.177 1.00 35.35 H new ATOM 0 HA ILE A 134 2.463 12.101 -5.329 1.00 43.33 H new ATOM 0 HB ILE A 134 0.951 13.574 -4.184 1.00 75.14 H new ATOM 0 HG12 ILE A 134 -1.246 12.222 -3.296 1.00 22.15 H new ATOM 0 HG13 ILE A 134 0.003 11.044 -2.945 1.00 22.15 H new ATOM 0 HG21 ILE A 134 -1.165 13.207 -5.394 1.00 3.41 H new ATOM 0 HG22 ILE A 134 0.247 12.919 -6.438 1.00 3.41 H new ATOM 0 HG23 ILE A 134 -0.658 11.542 -5.767 1.00 3.41 H new ATOM 0 HD11 ILE A 134 -0.397 12.497 -1.018 1.00 43.32 H new ATOM 0 HD12 ILE A 134 1.251 12.734 -1.646 1.00 43.32 H new ATOM 0 HD13 ILE A 134 -0.018 13.930 -2.003 1.00 43.32 H new ATOM 2111 N ASN A 135 2.359 10.369 -2.594 1.00 30.21 N ATOM 2112 CA ASN A 135 3.028 10.100 -1.327 1.00 25.45 C ATOM 2113 C ASN A 135 4.539 10.268 -1.463 1.00 13.04 C ATOM 2114 O ASN A 135 5.219 10.664 -0.515 1.00 52.24 O ATOM 2115 CB ASN A 135 2.703 8.684 -0.845 1.00 3.33 C ATOM 2116 CG ASN A 135 3.632 7.643 -1.439 1.00 50.44 C ATOM 2117 OD1 ASN A 135 4.471 7.073 -0.742 1.00 33.41 O ATOM 2118 ND2 ASN A 135 3.486 7.392 -2.735 1.00 60.21 N ATOM 0 H ASN A 135 1.723 9.632 -2.900 1.00 30.21 H new ATOM 0 HA ASN A 135 2.664 10.819 -0.593 1.00 25.45 H new ATOM 0 HB2 ASN A 135 2.771 8.649 0.242 1.00 3.33 H new ATOM 0 HB3 ASN A 135 1.674 8.441 -1.108 1.00 3.33 H new ATOM 0 HD21 ASN A 135 4.083 6.702 -3.191 1.00 60.21 H new ATOM 0 HD22 ASN A 135 2.777 7.889 -3.274 1.00 60.21 H new ATOM 2125 N THR A 136 5.058 9.965 -2.648 1.00 62.12 N ATOM 2126 CA THR A 136 6.487 10.082 -2.909 1.00 23.10 C ATOM 2127 C THR A 136 6.823 11.430 -3.536 1.00 42.11 C ATOM 2128 O THR A 136 7.866 12.018 -3.248 1.00 23.33 O ATOM 2129 CB THR A 136 6.982 8.958 -3.839 1.00 5.20 C ATOM 2130 OG1 THR A 136 5.867 8.300 -4.449 1.00 33.21 O ATOM 2131 CG2 THR A 136 7.816 7.946 -3.068 1.00 70.31 C ATOM 0 H THR A 136 4.510 9.636 -3.443 1.00 62.12 H new ATOM 0 HA THR A 136 6.992 9.996 -1.947 1.00 23.10 H new ATOM 0 HB THR A 136 7.606 9.405 -4.613 1.00 5.20 H new ATOM 0 HG1 THR A 136 6.145 7.417 -4.772 1.00 33.21 H new ATOM 0 HG21 THR A 136 8.154 7.162 -3.745 1.00 70.31 H new ATOM 0 HG22 THR A 136 8.680 8.445 -2.630 1.00 70.31 H new ATOM 0 HG23 THR A 136 7.212 7.505 -2.275 1.00 70.31 H new ATOM 2139 N HIS A 137 5.933 11.916 -4.395 1.00 51.32 N ATOM 2140 CA HIS A 137 6.135 13.197 -5.063 1.00 0.44 C ATOM 2141 C HIS A 137 6.114 14.344 -4.056 1.00 33.31 C ATOM 2142 O HIS A 137 6.618 15.433 -4.330 1.00 14.52 O ATOM 2143 CB HIS A 137 5.059 13.417 -6.127 1.00 2.45 C ATOM 2144 CG HIS A 137 5.607 13.856 -7.450 1.00 35.10 C ATOM 2145 ND1 HIS A 137 5.081 13.442 -8.656 1.00 2.31 N ATOM 2146 CD2 HIS A 137 6.638 14.678 -7.753 1.00 1.22 C ATOM 2147 CE1 HIS A 137 5.767 13.990 -9.643 1.00 61.23 C ATOM 2148 NE2 HIS A 137 6.717 14.745 -9.122 1.00 63.21 N ATOM 0 H HIS A 137 5.065 11.442 -4.645 1.00 51.32 H new ATOM 0 HA HIS A 137 7.113 13.177 -5.545 1.00 0.44 H new ATOM 0 HB2 HIS A 137 4.500 12.491 -6.264 1.00 2.45 H new ATOM 0 HB3 HIS A 137 4.353 14.166 -5.769 1.00 2.45 H new ATOM 0 HD2 HIS A 137 7.280 15.187 -7.049 1.00 1.22 H new ATOM 0 HE1 HIS A 137 5.582 13.845 -10.697 1.00 61.23 H new ATOM 0 HE2 HIS A 137 7.399 15.289 -9.651 1.00 63.21 H new ATOM 2156 N HIS A 138 5.527 14.091 -2.890 1.00 74.35 N ATOM 2157 CA HIS A 138 5.440 15.102 -1.843 1.00 33.22 C ATOM 2158 C HIS A 138 6.687 15.083 -0.964 1.00 60.53 C ATOM 2159 O HIS A 138 7.261 16.129 -0.662 1.00 62.30 O ATOM 2160 CB HIS A 138 4.194 14.873 -0.986 1.00 25.43 C ATOM 2161 CG HIS A 138 3.758 16.087 -0.226 1.00 4.50 C ATOM 2162 ND1 HIS A 138 3.211 16.028 1.038 1.00 13.21 N ATOM 2163 CD2 HIS A 138 3.793 17.399 -0.558 1.00 45.21 C ATOM 2164 CE1 HIS A 138 2.926 17.251 1.450 1.00 61.30 C ATOM 2165 NE2 HIS A 138 3.271 18.101 0.500 1.00 54.21 N ATOM 0 H HIS A 138 5.105 13.195 -2.647 1.00 74.35 H new ATOM 0 HA HIS A 138 5.369 16.079 -2.321 1.00 33.22 H new ATOM 0 HB2 HIS A 138 3.377 14.544 -1.628 1.00 25.43 H new ATOM 0 HB3 HIS A 138 4.391 14.065 -0.282 1.00 25.43 H new ATOM 0 HD2 HIS A 138 4.163 17.816 -1.483 1.00 45.21 H new ATOM 0 HE1 HIS A 138 2.486 17.511 2.401 1.00 61.30 H new ATOM 0 HE2 HIS A 138 3.167 19.115 0.545 1.00 54.21 H new ATOM 2173 N ARG A 139 7.100 13.887 -0.557 1.00 70.45 N ATOM 2174 CA ARG A 139 8.278 13.732 0.288 1.00 73.23 C ATOM 2175 C ARG A 139 9.493 14.402 -0.346 1.00 3.34 C ATOM 2176 O ARG A 139 9.935 15.460 0.102 1.00 13.53 O ATOM 2177 CB ARG A 139 8.568 12.249 0.529 1.00 55.23 C ATOM 2178 CG ARG A 139 7.647 11.607 1.554 1.00 41.50 C ATOM 2179 CD ARG A 139 7.493 10.115 1.308 1.00 65.23 C ATOM 2180 NE ARG A 139 8.481 9.334 2.048 1.00 71.53 N ATOM 2181 CZ ARG A 139 8.798 8.078 1.750 1.00 40.41 C ATOM 2182 NH1 ARG A 139 8.209 7.466 0.732 1.00 32.13 N ATOM 2183 NH2 ARG A 139 9.707 7.434 2.470 1.00 32.44 N ATOM 0 H ARG A 139 6.636 13.011 -0.799 1.00 70.45 H new ATOM 0 HA ARG A 139 8.075 14.215 1.244 1.00 73.23 H new ATOM 0 HB2 ARG A 139 8.478 11.712 -0.415 1.00 55.23 H new ATOM 0 HB3 ARG A 139 9.600 12.139 0.861 1.00 55.23 H new ATOM 0 HG2 ARG A 139 8.044 11.773 2.556 1.00 41.50 H new ATOM 0 HG3 ARG A 139 6.669 12.086 1.516 1.00 41.50 H new ATOM 0 HD2 ARG A 139 6.491 9.801 1.599 1.00 65.23 H new ATOM 0 HD3 ARG A 139 7.594 9.911 0.242 1.00 65.23 H new ATOM 0 HE ARG A 139 8.953 9.777 2.836 1.00 71.53 H new ATOM 0 HH11 ARG A 139 7.511 7.959 0.175 1.00 32.13 H new ATOM 0 HH12 ARG A 139 8.454 6.502 0.505 1.00 32.13 H new ATOM 0 HH21 ARG A 139 10.163 7.903 3.253 1.00 32.44 H new ATOM 0 HH22 ARG A 139 9.950 6.470 2.241 1.00 32.44 H new ATOM 2197 N SER A 140 10.030 13.778 -1.389 1.00 50.55 N ATOM 2198 CA SER A 140 11.197 14.312 -2.082 1.00 1.22 C ATOM 2199 C SER A 140 10.832 14.763 -3.493 1.00 4.20 C ATOM 2200 O SER A 140 9.659 14.797 -3.861 1.00 23.23 O ATOM 2201 CB SER A 140 12.307 13.260 -2.141 1.00 15.50 C ATOM 2202 OG SER A 140 13.017 13.199 -0.916 1.00 74.32 O ATOM 0 H SER A 140 9.676 12.902 -1.773 1.00 50.55 H new ATOM 0 HA SER A 140 11.556 15.177 -1.525 1.00 1.22 H new ATOM 0 HB2 SER A 140 11.876 12.284 -2.364 1.00 15.50 H new ATOM 0 HB3 SER A 140 12.995 13.498 -2.952 1.00 15.50 H new ATOM 0 HG SER A 140 13.719 12.519 -0.979 1.00 74.32 H new TER 2208 SER A 140