USER MOD reduce.3.24.130724 H: found=0, std=0, add=1005, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1003 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 26 ASN : amide:sc= -4.8! C(o=-5.7!,f=-5.6!) USER MOD Set 1.2: A 27 MET CE :methyl 149:sc= -0.902 (180deg=-1.18) USER MOD Set 1.3: A 119 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 95 LYS NZ :NH3+ -155:sc= -0.128 (180deg=-0.78) USER MOD Set 2.2: A 97 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 90 THR OG1 : rot -94:sc= 0.139 USER MOD Set 3.2: A 92 THR OG1 : rot 180:sc= -0.441 USER MOD Set 3.3: A 96 GLN : amide:sc= -0.377! C(o=-0.68!,f=-5.3!) USER MOD Set 4.1: A 60 SER OG : rot 62:sc= 1.93 USER MOD Set 4.2: A 62 TYR OH : rot -66:sc= 0.834 USER MOD Set 5.1: A 18 MET CE :methyl -161:sc= -0.931 (180deg=-2.52) USER MOD Set 5.2: A 36 CYS SG : rot 67:sc= -3.38 USER MOD Set 5.3: A 39 MET CE :methyl -109:sc= -3.83! (180deg=-5.94!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 49:sc= 0.969 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 HIS : no HE2:sc= -2.25! C(o=-2.3!,f=-4.6!) USER MOD Single : A 20 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 28 THR OG1 : rot 54:sc= -0.264 USER MOD Single : A 29 MET CE :methyl 179:sc= 0 (180deg=-0.000578) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 GLN : amide:sc= -0.263 K(o=-0.26,f=-1.9!) USER MOD Single : A 66 ASN : amide:sc= -0.0848 X(o=-0.085,f=-0.085) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot -15:sc= 0.0296! USER MOD Single : A 73 HIS : no HD1:sc= -0.264 X(o=-0.26,f=-0.46) USER MOD Single : A 77 LYS NZ :NH3+ -144:sc= -1.43 (180deg=-3.17!) USER MOD Single : A 80 ASN : amide:sc= -0.603 K(o=-0.6,f=-2!) USER MOD Single : A 83 MET CE :methyl -108:sc= -0.191 (180deg=-1.66) USER MOD Single : A 85 ASN : amide:sc= 0.535 K(o=0.53,f=-3.7!) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 98 MET CE :methyl -149:sc= 0 (180deg=-1.71) USER MOD Single : A 99 HIS : no HD1:sc= -0.103 X(o=-0.1,f=0.018) USER MOD Single : A 104 THR OG1 : rot 180:sc= -0.0599 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 CYS SG : rot 101:sc= -0.805 USER MOD Single : A 110 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 113 CYS SG : rot -18:sc= -1.74! USER MOD Single : A 116 GLN : amide:sc= 0.0365 X(o=0.037,f=-0.058) USER MOD Single : A 117 GLN : amide:sc= -0.913 K(o=-0.91,f=-2.7!) USER MOD Single : A 124 ASN : amide:sc= -4.38 K(o=-4.4,f=-1.2) USER MOD Single : A 125 HIS : no HD1:sc= -0.256 X(o=-0.26,f=-0.38) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.560 -11.121 14.095 1.00 0.00 N ATOM 2 CA GLY A 1 13.252 -11.720 14.281 1.00 0.00 C ATOM 3 C GLY A 1 12.825 -12.561 13.094 1.00 0.00 C ATOM 4 O GLY A 1 12.818 -13.790 13.166 1.00 0.00 O ATOM 0 H1 GLY A 1 14.806 -10.557 14.933 1.00 0.00 H new ATOM 0 H2 GLY A 1 15.269 -11.870 13.962 1.00 0.00 H new ATOM 0 H3 GLY A 1 14.544 -10.506 13.256 1.00 0.00 H new ATOM 0 HA2 GLY A 1 13.264 -12.341 15.177 1.00 0.00 H new ATOM 0 HA3 GLY A 1 12.516 -10.934 14.449 1.00 0.00 H new ATOM 8 N SER A 2 12.468 -11.898 11.999 1.00 0.00 N ATOM 9 CA SER A 2 12.033 -12.592 10.792 1.00 0.00 C ATOM 10 C SER A 2 13.214 -13.258 10.093 1.00 0.00 C ATOM 11 O SER A 2 13.200 -14.463 9.839 1.00 0.00 O ATOM 12 CB SER A 2 11.345 -11.616 9.837 1.00 0.00 C ATOM 13 OG SER A 2 10.162 -11.088 10.412 1.00 0.00 O ATOM 0 H SER A 2 12.471 -10.881 11.922 1.00 0.00 H new ATOM 0 HA SER A 2 11.322 -13.365 11.083 1.00 0.00 H new ATOM 0 HB2 SER A 2 12.027 -10.803 9.590 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.104 -12.125 8.904 1.00 0.00 H new ATOM 0 HG SER A 2 9.742 -10.466 9.782 1.00 0.00 H new ATOM 19 N SER A 3 14.235 -12.466 9.785 1.00 0.00 N ATOM 20 CA SER A 3 15.424 -12.976 9.112 1.00 0.00 C ATOM 21 C SER A 3 16.267 -13.819 10.063 1.00 0.00 C ATOM 22 O SER A 3 16.390 -13.505 11.246 1.00 0.00 O ATOM 23 CB SER A 3 16.259 -11.820 8.559 1.00 0.00 C ATOM 24 OG SER A 3 15.654 -11.258 7.408 1.00 0.00 O ATOM 0 H SER A 3 14.263 -11.467 9.991 1.00 0.00 H new ATOM 0 HA SER A 3 15.100 -13.608 8.285 1.00 0.00 H new ATOM 0 HB2 SER A 3 16.375 -11.052 9.324 1.00 0.00 H new ATOM 0 HB3 SER A 3 17.259 -12.176 8.311 1.00 0.00 H new ATOM 0 HG SER A 3 16.207 -10.520 7.075 1.00 0.00 H new ATOM 30 N GLY A 4 16.847 -14.893 9.536 1.00 0.00 N ATOM 31 CA GLY A 4 17.672 -15.766 10.351 1.00 0.00 C ATOM 32 C GLY A 4 18.218 -16.944 9.569 1.00 0.00 C ATOM 33 O GLY A 4 19.081 -16.780 8.707 1.00 0.00 O ATOM 0 H GLY A 4 16.760 -15.174 8.559 1.00 0.00 H new ATOM 0 HA2 GLY A 4 18.502 -15.194 10.766 1.00 0.00 H new ATOM 0 HA3 GLY A 4 17.085 -16.133 11.193 1.00 0.00 H new ATOM 37 N SER A 5 17.715 -18.137 9.872 1.00 0.00 N ATOM 38 CA SER A 5 18.162 -19.349 9.195 1.00 0.00 C ATOM 39 C SER A 5 17.509 -19.476 7.822 1.00 0.00 C ATOM 40 O SER A 5 18.189 -19.676 6.815 1.00 0.00 O ATOM 41 CB SER A 5 17.837 -20.581 10.042 1.00 0.00 C ATOM 42 OG SER A 5 18.489 -21.733 9.537 1.00 0.00 O ATOM 0 H SER A 5 16.998 -18.290 10.581 1.00 0.00 H new ATOM 0 HA SER A 5 19.242 -19.283 9.061 1.00 0.00 H new ATOM 0 HB2 SER A 5 18.144 -20.408 11.074 1.00 0.00 H new ATOM 0 HB3 SER A 5 16.759 -20.745 10.053 1.00 0.00 H new ATOM 0 HG SER A 5 18.267 -22.506 10.096 1.00 0.00 H new ATOM 48 N SER A 6 16.185 -19.358 7.789 1.00 0.00 N ATOM 49 CA SER A 6 15.439 -19.464 6.541 1.00 0.00 C ATOM 50 C SER A 6 15.348 -18.109 5.846 1.00 0.00 C ATOM 51 O SER A 6 14.399 -17.354 6.054 1.00 0.00 O ATOM 52 CB SER A 6 14.034 -20.008 6.807 1.00 0.00 C ATOM 53 OG SER A 6 13.294 -19.128 7.635 1.00 0.00 O ATOM 0 H SER A 6 15.607 -19.189 8.612 1.00 0.00 H new ATOM 0 HA SER A 6 15.971 -20.154 5.886 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.510 -20.149 5.861 1.00 0.00 H new ATOM 0 HB3 SER A 6 14.104 -20.987 7.282 1.00 0.00 H new ATOM 0 HG SER A 6 13.367 -18.214 7.289 1.00 0.00 H new ATOM 59 N GLY A 7 16.345 -17.807 5.019 1.00 0.00 N ATOM 60 CA GLY A 7 16.360 -16.543 4.306 1.00 0.00 C ATOM 61 C GLY A 7 17.664 -15.791 4.486 1.00 0.00 C ATOM 62 O GLY A 7 17.774 -14.925 5.354 1.00 0.00 O ATOM 0 H GLY A 7 17.142 -18.415 4.830 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.193 -16.726 3.245 1.00 0.00 H new ATOM 0 HA3 GLY A 7 15.535 -15.922 4.656 1.00 0.00 H new ATOM 66 N ASP A 8 18.654 -16.123 3.665 1.00 0.00 N ATOM 67 CA ASP A 8 19.957 -15.473 3.738 1.00 0.00 C ATOM 68 C ASP A 8 19.963 -14.175 2.936 1.00 0.00 C ATOM 69 O ASP A 8 20.317 -13.116 3.454 1.00 0.00 O ATOM 70 CB ASP A 8 21.049 -16.411 3.220 1.00 0.00 C ATOM 71 CG ASP A 8 22.397 -15.727 3.110 1.00 0.00 C ATOM 72 OD1 ASP A 8 22.630 -14.753 3.856 1.00 0.00 O ATOM 73 OD2 ASP A 8 23.219 -16.165 2.278 1.00 0.00 O ATOM 0 H ASP A 8 18.579 -16.838 2.942 1.00 0.00 H new ATOM 0 HA ASP A 8 20.158 -15.235 4.783 1.00 0.00 H new ATOM 0 HB2 ASP A 8 21.134 -17.269 3.888 1.00 0.00 H new ATOM 0 HB3 ASP A 8 20.759 -16.796 2.242 1.00 0.00 H new ATOM 78 N ASP A 9 19.570 -14.266 1.670 1.00 0.00 N ATOM 79 CA ASP A 9 19.530 -13.099 0.797 1.00 0.00 C ATOM 80 C ASP A 9 18.094 -12.760 0.409 1.00 0.00 C ATOM 81 O ASP A 9 17.807 -12.465 -0.751 1.00 0.00 O ATOM 82 CB ASP A 9 20.365 -13.347 -0.460 1.00 0.00 C ATOM 83 CG ASP A 9 21.779 -13.790 -0.138 1.00 0.00 C ATOM 84 OD1 ASP A 9 22.653 -12.913 0.022 1.00 0.00 O ATOM 85 OD2 ASP A 9 22.012 -15.014 -0.046 1.00 0.00 O ATOM 0 H ASP A 9 19.275 -15.135 1.226 1.00 0.00 H new ATOM 0 HA ASP A 9 19.950 -12.254 1.342 1.00 0.00 H new ATOM 0 HB2 ASP A 9 19.879 -14.108 -1.071 1.00 0.00 H new ATOM 0 HB3 ASP A 9 20.400 -12.435 -1.055 1.00 0.00 H new ATOM 90 N ASP A 10 17.196 -12.804 1.388 1.00 0.00 N ATOM 91 CA ASP A 10 15.790 -12.501 1.149 1.00 0.00 C ATOM 92 C ASP A 10 15.640 -11.216 0.341 1.00 0.00 C ATOM 93 O ASP A 10 14.991 -11.202 -0.705 1.00 0.00 O ATOM 94 CB ASP A 10 15.042 -12.374 2.477 1.00 0.00 C ATOM 95 CG ASP A 10 14.856 -13.711 3.168 1.00 0.00 C ATOM 96 OD1 ASP A 10 14.779 -14.738 2.461 1.00 0.00 O ATOM 97 OD2 ASP A 10 14.788 -13.730 4.414 1.00 0.00 O ATOM 0 H ASP A 10 17.417 -13.046 2.354 1.00 0.00 H new ATOM 0 HA ASP A 10 15.359 -13.321 0.575 1.00 0.00 H new ATOM 0 HB2 ASP A 10 15.590 -11.701 3.136 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.066 -11.922 2.299 1.00 0.00 H new ATOM 102 N ILE A 11 16.243 -10.140 0.834 1.00 0.00 N ATOM 103 CA ILE A 11 16.176 -8.850 0.158 1.00 0.00 C ATOM 104 C ILE A 11 16.414 -9.003 -1.341 1.00 0.00 C ATOM 105 O ILE A 11 15.643 -8.496 -2.155 1.00 0.00 O ATOM 106 CB ILE A 11 17.207 -7.860 0.731 1.00 0.00 C ATOM 107 CG1 ILE A 11 16.809 -7.439 2.147 1.00 0.00 C ATOM 108 CG2 ILE A 11 17.332 -6.643 -0.173 1.00 0.00 C ATOM 109 CD1 ILE A 11 15.514 -6.658 2.204 1.00 0.00 C ATOM 0 H ILE A 11 16.784 -10.136 1.699 1.00 0.00 H new ATOM 0 HA ILE A 11 15.174 -8.456 0.327 1.00 0.00 H new ATOM 0 HB ILE A 11 18.177 -8.355 0.778 1.00 0.00 H new ATOM 0 HG12 ILE A 11 16.715 -8.329 2.769 1.00 0.00 H new ATOM 0 HG13 ILE A 11 17.608 -6.834 2.576 1.00 0.00 H new ATOM 0 HG21 ILE A 11 18.064 -5.953 0.245 1.00 0.00 H new ATOM 0 HG22 ILE A 11 17.656 -6.958 -1.165 1.00 0.00 H new ATOM 0 HG23 ILE A 11 16.365 -6.145 -0.248 1.00 0.00 H new ATOM 0 HD11 ILE A 11 15.294 -6.393 3.238 1.00 0.00 H new ATOM 0 HD12 ILE A 11 15.610 -5.750 1.609 1.00 0.00 H new ATOM 0 HD13 ILE A 11 14.703 -7.268 1.806 1.00 0.00 H new ATOM 121 N GLU A 12 17.484 -9.706 -1.696 1.00 0.00 N ATOM 122 CA GLU A 12 17.822 -9.926 -3.098 1.00 0.00 C ATOM 123 C GLU A 12 16.694 -10.658 -3.821 1.00 0.00 C ATOM 124 O GLU A 12 16.257 -10.240 -4.893 1.00 0.00 O ATOM 125 CB GLU A 12 19.120 -10.727 -3.213 1.00 0.00 C ATOM 126 CG GLU A 12 20.366 -9.913 -2.908 1.00 0.00 C ATOM 127 CD GLU A 12 20.885 -9.164 -4.121 1.00 0.00 C ATOM 128 OE1 GLU A 12 20.774 -9.703 -5.242 1.00 0.00 O ATOM 129 OE2 GLU A 12 21.402 -8.040 -3.949 1.00 0.00 O ATOM 0 H GLU A 12 18.132 -10.133 -1.034 1.00 0.00 H new ATOM 0 HA GLU A 12 17.961 -8.953 -3.569 1.00 0.00 H new ATOM 0 HB2 GLU A 12 19.075 -11.576 -2.531 1.00 0.00 H new ATOM 0 HB3 GLU A 12 19.199 -11.132 -4.222 1.00 0.00 H new ATOM 0 HG2 GLU A 12 20.145 -9.201 -2.113 1.00 0.00 H new ATOM 0 HG3 GLU A 12 21.146 -10.576 -2.534 1.00 0.00 H new ATOM 136 N GLN A 13 16.230 -11.752 -3.226 1.00 0.00 N ATOM 137 CA GLN A 13 15.155 -12.542 -3.813 1.00 0.00 C ATOM 138 C GLN A 13 13.897 -11.699 -3.998 1.00 0.00 C ATOM 139 O GLN A 13 13.048 -12.007 -4.836 1.00 0.00 O ATOM 140 CB GLN A 13 14.845 -13.755 -2.934 1.00 0.00 C ATOM 141 CG GLN A 13 15.925 -14.824 -2.970 1.00 0.00 C ATOM 142 CD GLN A 13 15.501 -16.105 -2.279 1.00 0.00 C ATOM 143 OE1 GLN A 13 15.013 -17.037 -2.918 1.00 0.00 O ATOM 144 NE2 GLN A 13 15.685 -16.158 -0.965 1.00 0.00 N ATOM 0 H GLN A 13 16.582 -12.111 -2.338 1.00 0.00 H new ATOM 0 HA GLN A 13 15.486 -12.887 -4.792 1.00 0.00 H new ATOM 0 HB2 GLN A 13 14.709 -13.422 -1.905 1.00 0.00 H new ATOM 0 HB3 GLN A 13 13.900 -14.194 -3.255 1.00 0.00 H new ATOM 0 HG2 GLN A 13 16.180 -15.042 -4.007 1.00 0.00 H new ATOM 0 HG3 GLN A 13 16.827 -14.440 -2.494 1.00 0.00 H new ATOM 0 HE21 GLN A 13 16.093 -15.362 -0.475 1.00 0.00 H new ATOM 0 HE22 GLN A 13 15.418 -16.995 -0.446 1.00 0.00 H new ATOM 153 N LEU A 14 13.784 -10.635 -3.211 1.00 0.00 N ATOM 154 CA LEU A 14 12.629 -9.746 -3.288 1.00 0.00 C ATOM 155 C LEU A 14 12.842 -8.667 -4.344 1.00 0.00 C ATOM 156 O LEU A 14 11.920 -8.313 -5.080 1.00 0.00 O ATOM 157 CB LEU A 14 12.368 -9.100 -1.926 1.00 0.00 C ATOM 158 CG LEU A 14 11.604 -7.775 -1.948 1.00 0.00 C ATOM 159 CD1 LEU A 14 10.272 -7.938 -2.663 1.00 0.00 C ATOM 160 CD2 LEU A 14 11.392 -7.258 -0.533 1.00 0.00 C ATOM 0 H LEU A 14 14.477 -10.367 -2.513 1.00 0.00 H new ATOM 0 HA LEU A 14 11.761 -10.340 -3.574 1.00 0.00 H new ATOM 0 HB2 LEU A 14 11.811 -9.807 -1.311 1.00 0.00 H new ATOM 0 HB3 LEU A 14 13.327 -8.936 -1.434 1.00 0.00 H new ATOM 0 HG LEU A 14 12.199 -7.044 -2.495 1.00 0.00 H new ATOM 0 HD11 LEU A 14 9.743 -6.985 -2.668 1.00 0.00 H new ATOM 0 HD12 LEU A 14 10.447 -8.262 -3.689 1.00 0.00 H new ATOM 0 HD13 LEU A 14 9.670 -8.684 -2.145 1.00 0.00 H new ATOM 0 HD21 LEU A 14 10.847 -6.315 -0.568 1.00 0.00 H new ATOM 0 HD22 LEU A 14 10.818 -7.987 0.039 1.00 0.00 H new ATOM 0 HD23 LEU A 14 12.359 -7.101 -0.054 1.00 0.00 H new ATOM 172 N LEU A 15 14.063 -8.148 -4.414 1.00 0.00 N ATOM 173 CA LEU A 15 14.398 -7.110 -5.383 1.00 0.00 C ATOM 174 C LEU A 15 14.195 -7.610 -6.809 1.00 0.00 C ATOM 175 O LEU A 15 13.509 -6.973 -7.608 1.00 0.00 O ATOM 176 CB LEU A 15 15.846 -6.654 -5.191 1.00 0.00 C ATOM 177 CG LEU A 15 16.132 -5.843 -3.926 1.00 0.00 C ATOM 178 CD1 LEU A 15 17.628 -5.787 -3.656 1.00 0.00 C ATOM 179 CD2 LEU A 15 15.557 -4.440 -4.051 1.00 0.00 C ATOM 0 H LEU A 15 14.837 -8.429 -3.812 1.00 0.00 H new ATOM 0 HA LEU A 15 13.732 -6.264 -5.217 1.00 0.00 H new ATOM 0 HB2 LEU A 15 16.486 -7.536 -5.185 1.00 0.00 H new ATOM 0 HB3 LEU A 15 16.135 -6.056 -6.055 1.00 0.00 H new ATOM 0 HG LEU A 15 15.650 -6.337 -3.083 1.00 0.00 H new ATOM 0 HD11 LEU A 15 17.813 -5.206 -2.752 1.00 0.00 H new ATOM 0 HD12 LEU A 15 18.012 -6.798 -3.522 1.00 0.00 H new ATOM 0 HD13 LEU A 15 18.133 -5.316 -4.500 1.00 0.00 H new ATOM 0 HD21 LEU A 15 15.770 -3.877 -3.142 1.00 0.00 H new ATOM 0 HD22 LEU A 15 16.010 -3.936 -4.904 1.00 0.00 H new ATOM 0 HD23 LEU A 15 14.478 -4.500 -4.196 1.00 0.00 H new ATOM 191 N GLU A 16 14.796 -8.754 -7.121 1.00 0.00 N ATOM 192 CA GLU A 16 14.679 -9.340 -8.451 1.00 0.00 C ATOM 193 C GLU A 16 13.228 -9.331 -8.924 1.00 0.00 C ATOM 194 O GLU A 16 12.952 -9.168 -10.113 1.00 0.00 O ATOM 195 CB GLU A 16 15.218 -10.772 -8.451 1.00 0.00 C ATOM 196 CG GLU A 16 14.647 -11.638 -7.341 1.00 0.00 C ATOM 197 CD GLU A 16 15.180 -13.057 -7.375 1.00 0.00 C ATOM 198 OE1 GLU A 16 16.399 -13.237 -7.171 1.00 0.00 O ATOM 199 OE2 GLU A 16 14.379 -13.987 -7.605 1.00 0.00 O ATOM 0 H GLU A 16 15.368 -9.293 -6.471 1.00 0.00 H new ATOM 0 HA GLU A 16 15.271 -8.737 -9.139 1.00 0.00 H new ATOM 0 HB2 GLU A 16 14.995 -11.235 -9.412 1.00 0.00 H new ATOM 0 HB3 GLU A 16 16.303 -10.743 -8.355 1.00 0.00 H new ATOM 0 HG2 GLU A 16 14.883 -11.188 -6.377 1.00 0.00 H new ATOM 0 HG3 GLU A 16 13.560 -11.660 -7.425 1.00 0.00 H new ATOM 206 N PHE A 17 12.305 -9.508 -7.985 1.00 0.00 N ATOM 207 CA PHE A 17 10.882 -9.522 -8.305 1.00 0.00 C ATOM 208 C PHE A 17 10.399 -8.129 -8.699 1.00 0.00 C ATOM 209 O PHE A 17 9.823 -7.940 -9.770 1.00 0.00 O ATOM 210 CB PHE A 17 10.074 -10.036 -7.112 1.00 0.00 C ATOM 211 CG PHE A 17 8.669 -9.507 -7.066 1.00 0.00 C ATOM 212 CD1 PHE A 17 7.672 -10.086 -7.834 1.00 0.00 C ATOM 213 CD2 PHE A 17 8.347 -8.429 -6.257 1.00 0.00 C ATOM 214 CE1 PHE A 17 6.378 -9.602 -7.794 1.00 0.00 C ATOM 215 CE2 PHE A 17 7.055 -7.941 -6.213 1.00 0.00 C ATOM 216 CZ PHE A 17 6.069 -8.527 -6.983 1.00 0.00 C ATOM 0 H PHE A 17 12.516 -9.644 -6.996 1.00 0.00 H new ATOM 0 HA PHE A 17 10.732 -10.192 -9.152 1.00 0.00 H new ATOM 0 HB2 PHE A 17 10.043 -11.125 -7.147 1.00 0.00 H new ATOM 0 HB3 PHE A 17 10.587 -9.761 -6.190 1.00 0.00 H new ATOM 0 HD1 PHE A 17 7.909 -10.925 -8.471 1.00 0.00 H new ATOM 0 HD2 PHE A 17 9.114 -7.965 -5.654 1.00 0.00 H new ATOM 0 HE1 PHE A 17 5.609 -10.064 -8.396 1.00 0.00 H new ATOM 0 HE2 PHE A 17 6.816 -7.102 -5.577 1.00 0.00 H new ATOM 0 HZ PHE A 17 5.059 -8.146 -6.951 1.00 0.00 H new ATOM 226 N MET A 18 10.638 -7.158 -7.825 1.00 0.00 N ATOM 227 CA MET A 18 10.229 -5.782 -8.081 1.00 0.00 C ATOM 228 C MET A 18 10.705 -5.319 -9.454 1.00 0.00 C ATOM 229 O MET A 18 10.020 -4.556 -10.135 1.00 0.00 O ATOM 230 CB MET A 18 10.780 -4.853 -6.997 1.00 0.00 C ATOM 231 CG MET A 18 9.914 -4.793 -5.749 1.00 0.00 C ATOM 232 SD MET A 18 10.857 -4.385 -4.268 1.00 0.00 S ATOM 233 CE MET A 18 10.822 -2.595 -4.327 1.00 0.00 C ATOM 0 H MET A 18 11.113 -7.298 -6.933 1.00 0.00 H new ATOM 0 HA MET A 18 9.140 -5.744 -8.062 1.00 0.00 H new ATOM 0 HB2 MET A 18 11.780 -5.185 -6.719 1.00 0.00 H new ATOM 0 HB3 MET A 18 10.881 -3.848 -7.408 1.00 0.00 H new ATOM 0 HG2 MET A 18 9.129 -4.050 -5.891 1.00 0.00 H new ATOM 0 HG3 MET A 18 9.421 -5.755 -5.607 1.00 0.00 H new ATOM 0 HE1 MET A 18 11.618 -2.195 -3.700 1.00 0.00 H new ATOM 0 HE2 MET A 18 10.967 -2.262 -5.355 1.00 0.00 H new ATOM 0 HE3 MET A 18 9.859 -2.238 -3.963 1.00 0.00 H new ATOM 243 N HIS A 19 11.884 -5.786 -9.855 1.00 0.00 N ATOM 244 CA HIS A 19 12.451 -5.420 -11.148 1.00 0.00 C ATOM 245 C HIS A 19 11.510 -5.808 -12.284 1.00 0.00 C ATOM 246 O HIS A 19 11.474 -5.151 -13.324 1.00 0.00 O ATOM 247 CB HIS A 19 13.809 -6.096 -11.342 1.00 0.00 C ATOM 248 CG HIS A 19 14.564 -5.592 -12.534 1.00 0.00 C ATOM 249 ND1 HIS A 19 14.013 -5.517 -13.796 1.00 0.00 N ATOM 250 CD2 HIS A 19 15.832 -5.136 -12.650 1.00 0.00 C ATOM 251 CE1 HIS A 19 14.912 -5.038 -14.637 1.00 0.00 C ATOM 252 NE2 HIS A 19 16.024 -4.798 -13.967 1.00 0.00 N ATOM 0 H HIS A 19 12.464 -6.418 -9.303 1.00 0.00 H new ATOM 0 HA HIS A 19 12.585 -4.338 -11.165 1.00 0.00 H new ATOM 0 HB2 HIS A 19 14.413 -5.942 -10.448 1.00 0.00 H new ATOM 0 HB3 HIS A 19 13.659 -7.171 -11.445 1.00 0.00 H new ATOM 0 HD1 HIS A 19 13.061 -5.789 -14.041 1.00 0.00 H new ATOM 0 HD2 HIS A 19 16.558 -5.053 -11.855 1.00 0.00 H new ATOM 0 HE1 HIS A 19 14.763 -4.871 -15.694 1.00 0.00 H new ATOM 261 N GLN A 20 10.750 -6.879 -12.077 1.00 0.00 N ATOM 262 CA GLN A 20 9.810 -7.354 -13.085 1.00 0.00 C ATOM 263 C GLN A 20 8.600 -6.430 -13.180 1.00 0.00 C ATOM 264 O GLN A 20 8.197 -6.029 -14.272 1.00 0.00 O ATOM 265 CB GLN A 20 9.355 -8.778 -12.758 1.00 0.00 C ATOM 266 CG GLN A 20 10.439 -9.824 -12.960 1.00 0.00 C ATOM 267 CD GLN A 20 10.148 -11.116 -12.222 1.00 0.00 C ATOM 268 OE1 GLN A 20 9.022 -11.354 -11.784 1.00 0.00 O ATOM 269 NE2 GLN A 20 11.164 -11.959 -12.079 1.00 0.00 N ATOM 0 H GLN A 20 10.767 -7.433 -11.221 1.00 0.00 H new ATOM 0 HA GLN A 20 10.320 -7.355 -14.049 1.00 0.00 H new ATOM 0 HB2 GLN A 20 9.016 -8.813 -11.723 1.00 0.00 H new ATOM 0 HB3 GLN A 20 8.498 -9.029 -13.383 1.00 0.00 H new ATOM 0 HG2 GLN A 20 10.542 -10.034 -14.025 1.00 0.00 H new ATOM 0 HG3 GLN A 20 11.394 -9.423 -12.620 1.00 0.00 H new ATOM 0 HE21 GLN A 20 12.081 -11.722 -12.458 1.00 0.00 H new ATOM 0 HE22 GLN A 20 11.028 -12.844 -11.590 1.00 0.00 H new ATOM 278 N LEU A 21 8.025 -6.097 -12.030 1.00 0.00 N ATOM 279 CA LEU A 21 6.861 -5.220 -11.982 1.00 0.00 C ATOM 280 C LEU A 21 7.198 -3.837 -12.531 1.00 0.00 C ATOM 281 O LEU A 21 8.274 -3.291 -12.287 1.00 0.00 O ATOM 282 CB LEU A 21 6.346 -5.100 -10.547 1.00 0.00 C ATOM 283 CG LEU A 21 5.849 -6.395 -9.902 1.00 0.00 C ATOM 284 CD1 LEU A 21 5.098 -6.095 -8.614 1.00 0.00 C ATOM 285 CD2 LEU A 21 4.964 -7.167 -10.870 1.00 0.00 C ATOM 0 H LEU A 21 8.346 -6.421 -11.118 1.00 0.00 H new ATOM 0 HA LEU A 21 6.081 -5.658 -12.605 1.00 0.00 H new ATOM 0 HB2 LEU A 21 7.146 -4.693 -9.928 1.00 0.00 H new ATOM 0 HB3 LEU A 21 5.532 -4.375 -10.534 1.00 0.00 H new ATOM 0 HG LEU A 21 6.713 -7.013 -9.659 1.00 0.00 H new ATOM 0 HD11 LEU A 21 4.752 -7.028 -8.169 1.00 0.00 H new ATOM 0 HD12 LEU A 21 5.762 -5.584 -7.916 1.00 0.00 H new ATOM 0 HD13 LEU A 21 4.241 -5.457 -8.832 1.00 0.00 H new ATOM 0 HD21 LEU A 21 4.619 -8.085 -10.395 1.00 0.00 H new ATOM 0 HD22 LEU A 21 4.104 -6.555 -11.144 1.00 0.00 H new ATOM 0 HD23 LEU A 21 5.534 -7.414 -11.766 1.00 0.00 H new ATOM 297 N PRO A 22 6.256 -3.255 -13.288 1.00 0.00 N ATOM 298 CA PRO A 22 6.429 -1.927 -13.885 1.00 0.00 C ATOM 299 C PRO A 22 6.414 -0.816 -12.841 1.00 0.00 C ATOM 300 O PRO A 22 7.168 0.151 -12.939 1.00 0.00 O ATOM 301 CB PRO A 22 5.223 -1.799 -14.819 1.00 0.00 C ATOM 302 CG PRO A 22 4.194 -2.704 -14.237 1.00 0.00 C ATOM 303 CD PRO A 22 4.950 -3.849 -13.621 1.00 0.00 C ATOM 0 HA PRO A 22 7.390 -1.829 -14.390 1.00 0.00 H new ATOM 0 HB2 PRO A 22 4.865 -0.770 -14.864 1.00 0.00 H new ATOM 0 HB3 PRO A 22 5.478 -2.093 -15.837 1.00 0.00 H new ATOM 0 HG2 PRO A 22 3.595 -2.184 -13.489 1.00 0.00 H new ATOM 0 HG3 PRO A 22 3.507 -3.058 -15.005 1.00 0.00 H new ATOM 0 HD2 PRO A 22 4.445 -4.233 -12.734 1.00 0.00 H new ATOM 0 HD3 PRO A 22 5.053 -4.683 -14.316 1.00 0.00 H new ATOM 311 N ALA A 23 5.552 -0.962 -11.840 1.00 0.00 N ATOM 312 CA ALA A 23 5.441 0.028 -10.776 1.00 0.00 C ATOM 313 C ALA A 23 6.762 0.181 -10.030 1.00 0.00 C ATOM 314 O ALA A 23 7.046 1.235 -9.459 1.00 0.00 O ATOM 315 CB ALA A 23 4.329 -0.356 -9.811 1.00 0.00 C ATOM 0 H ALA A 23 4.920 -1.757 -11.744 1.00 0.00 H new ATOM 0 HA ALA A 23 5.196 0.988 -11.230 1.00 0.00 H new ATOM 0 HB1 ALA A 23 4.258 0.392 -9.022 1.00 0.00 H new ATOM 0 HB2 ALA A 23 3.382 -0.408 -10.349 1.00 0.00 H new ATOM 0 HB3 ALA A 23 4.549 -1.328 -9.370 1.00 0.00 H new ATOM 321 N PHE A 24 7.567 -0.876 -10.037 1.00 0.00 N ATOM 322 CA PHE A 24 8.858 -0.859 -9.359 1.00 0.00 C ATOM 323 C PHE A 24 9.997 -0.694 -10.361 1.00 0.00 C ATOM 324 O PHE A 24 11.063 -0.179 -10.026 1.00 0.00 O ATOM 325 CB PHE A 24 9.053 -2.147 -8.556 1.00 0.00 C ATOM 326 CG PHE A 24 8.199 -2.220 -7.323 1.00 0.00 C ATOM 327 CD1 PHE A 24 8.292 -1.248 -6.341 1.00 0.00 C ATOM 328 CD2 PHE A 24 7.301 -3.261 -7.147 1.00 0.00 C ATOM 329 CE1 PHE A 24 7.507 -1.313 -5.205 1.00 0.00 C ATOM 330 CE2 PHE A 24 6.514 -3.332 -6.013 1.00 0.00 C ATOM 331 CZ PHE A 24 6.616 -2.356 -5.041 1.00 0.00 C ATOM 0 H PHE A 24 7.348 -1.756 -10.505 1.00 0.00 H new ATOM 0 HA PHE A 24 8.871 -0.008 -8.678 1.00 0.00 H new ATOM 0 HB2 PHE A 24 8.829 -3.001 -9.195 1.00 0.00 H new ATOM 0 HB3 PHE A 24 10.101 -2.231 -8.268 1.00 0.00 H new ATOM 0 HD1 PHE A 24 8.986 -0.430 -6.464 1.00 0.00 H new ATOM 0 HD2 PHE A 24 7.215 -4.026 -7.905 1.00 0.00 H new ATOM 0 HE1 PHE A 24 7.590 -0.549 -4.446 1.00 0.00 H new ATOM 0 HE2 PHE A 24 5.820 -4.150 -5.887 1.00 0.00 H new ATOM 0 HZ PHE A 24 6.001 -2.408 -4.155 1.00 0.00 H new ATOM 341 N ALA A 25 9.762 -1.134 -11.593 1.00 0.00 N ATOM 342 CA ALA A 25 10.766 -1.034 -12.645 1.00 0.00 C ATOM 343 C ALA A 25 11.251 0.402 -12.805 1.00 0.00 C ATOM 344 O ALA A 25 12.454 0.663 -12.820 1.00 0.00 O ATOM 345 CB ALA A 25 10.205 -1.554 -13.960 1.00 0.00 C ATOM 0 H ALA A 25 8.885 -1.563 -11.887 1.00 0.00 H new ATOM 0 HA ALA A 25 11.620 -1.648 -12.359 1.00 0.00 H new ATOM 0 HB1 ALA A 25 10.965 -1.474 -14.737 1.00 0.00 H new ATOM 0 HB2 ALA A 25 9.914 -2.598 -13.844 1.00 0.00 H new ATOM 0 HB3 ALA A 25 9.333 -0.964 -14.243 1.00 0.00 H new ATOM 351 N ASN A 26 10.308 1.331 -12.925 1.00 0.00 N ATOM 352 CA ASN A 26 10.641 2.742 -13.086 1.00 0.00 C ATOM 353 C ASN A 26 11.799 3.135 -12.173 1.00 0.00 C ATOM 354 O ASN A 26 12.775 3.738 -12.618 1.00 0.00 O ATOM 355 CB ASN A 26 9.420 3.613 -12.783 1.00 0.00 C ATOM 356 CG ASN A 26 8.984 3.513 -11.335 1.00 0.00 C ATOM 357 OD1 ASN A 26 8.653 2.432 -10.847 1.00 0.00 O ATOM 358 ND2 ASN A 26 8.980 4.644 -10.639 1.00 0.00 N ATOM 0 H ASN A 26 9.308 1.132 -12.914 1.00 0.00 H new ATOM 0 HA ASN A 26 10.946 2.902 -14.120 1.00 0.00 H new ATOM 0 HB2 ASN A 26 9.651 4.652 -13.019 1.00 0.00 H new ATOM 0 HB3 ASN A 26 8.595 3.315 -13.430 1.00 0.00 H new ATOM 0 HD21 ASN A 26 8.695 4.639 -9.660 1.00 0.00 H new ATOM 0 HD22 ASN A 26 9.262 5.518 -11.084 1.00 0.00 H new ATOM 365 N MET A 27 11.682 2.788 -10.896 1.00 0.00 N ATOM 366 CA MET A 27 12.720 3.103 -9.921 1.00 0.00 C ATOM 367 C MET A 27 13.941 2.209 -10.118 1.00 0.00 C ATOM 368 O MET A 27 13.884 1.213 -10.840 1.00 0.00 O ATOM 369 CB MET A 27 12.180 2.942 -8.499 1.00 0.00 C ATOM 370 CG MET A 27 10.869 3.674 -8.260 1.00 0.00 C ATOM 371 SD MET A 27 10.076 3.192 -6.715 1.00 0.00 S ATOM 372 CE MET A 27 8.347 3.324 -7.166 1.00 0.00 C ATOM 0 H MET A 27 10.880 2.289 -10.512 1.00 0.00 H new ATOM 0 HA MET A 27 13.022 4.139 -10.072 1.00 0.00 H new ATOM 0 HB2 MET A 27 12.038 1.882 -8.291 1.00 0.00 H new ATOM 0 HB3 MET A 27 12.925 3.308 -7.793 1.00 0.00 H new ATOM 0 HG2 MET A 27 11.054 4.748 -8.249 1.00 0.00 H new ATOM 0 HG3 MET A 27 10.190 3.476 -9.090 1.00 0.00 H new ATOM 0 HE1 MET A 27 7.767 2.593 -6.603 1.00 0.00 H new ATOM 0 HE2 MET A 27 7.987 4.327 -6.937 1.00 0.00 H new ATOM 0 HE3 MET A 27 8.234 3.132 -8.233 1.00 0.00 H new ATOM 382 N THR A 28 15.045 2.571 -9.472 1.00 0.00 N ATOM 383 CA THR A 28 16.279 1.803 -9.578 1.00 0.00 C ATOM 384 C THR A 28 16.427 0.837 -8.408 1.00 0.00 C ATOM 385 O THR A 28 15.607 0.829 -7.490 1.00 0.00 O ATOM 386 CB THR A 28 17.512 2.725 -9.626 1.00 0.00 C ATOM 387 OG1 THR A 28 18.700 1.945 -9.801 1.00 0.00 O ATOM 388 CG2 THR A 28 17.622 3.548 -8.352 1.00 0.00 C ATOM 0 H THR A 28 15.110 3.392 -8.870 1.00 0.00 H new ATOM 0 HA THR A 28 16.221 1.238 -10.508 1.00 0.00 H new ATOM 0 HB THR A 28 17.397 3.405 -10.470 1.00 0.00 H new ATOM 0 HG1 THR A 28 18.600 1.369 -10.588 1.00 0.00 H new ATOM 0 HG21 THR A 28 18.500 4.191 -8.409 1.00 0.00 H new ATOM 0 HG22 THR A 28 16.729 4.162 -8.237 1.00 0.00 H new ATOM 0 HG23 THR A 28 17.716 2.881 -7.495 1.00 0.00 H new ATOM 396 N MET A 29 17.477 0.023 -8.447 1.00 0.00 N ATOM 397 CA MET A 29 17.733 -0.946 -7.389 1.00 0.00 C ATOM 398 C MET A 29 17.703 -0.275 -6.019 1.00 0.00 C ATOM 399 O MET A 29 16.834 -0.561 -5.196 1.00 0.00 O ATOM 400 CB MET A 29 19.085 -1.627 -7.607 1.00 0.00 C ATOM 401 CG MET A 29 19.275 -2.883 -6.771 1.00 0.00 C ATOM 402 SD MET A 29 17.995 -4.117 -7.069 1.00 0.00 S ATOM 403 CE MET A 29 18.985 -5.600 -7.229 1.00 0.00 C ATOM 0 H MET A 29 18.164 0.016 -9.201 1.00 0.00 H new ATOM 0 HA MET A 29 16.946 -1.699 -7.423 1.00 0.00 H new ATOM 0 HB2 MET A 29 19.188 -1.883 -8.661 1.00 0.00 H new ATOM 0 HB3 MET A 29 19.881 -0.920 -7.372 1.00 0.00 H new ATOM 0 HG2 MET A 29 20.250 -3.317 -6.991 1.00 0.00 H new ATOM 0 HG3 MET A 29 19.276 -2.615 -5.715 1.00 0.00 H new ATOM 0 HE1 MET A 29 18.333 -6.456 -7.399 1.00 0.00 H new ATOM 0 HE2 MET A 29 19.669 -5.492 -8.071 1.00 0.00 H new ATOM 0 HE3 MET A 29 19.557 -5.756 -6.314 1.00 0.00 H new ATOM 413 N SER A 30 18.659 0.617 -5.781 1.00 0.00 N ATOM 414 CA SER A 30 18.745 1.325 -4.509 1.00 0.00 C ATOM 415 C SER A 30 17.355 1.670 -3.985 1.00 0.00 C ATOM 416 O SER A 30 16.931 1.171 -2.942 1.00 0.00 O ATOM 417 CB SER A 30 19.574 2.602 -4.667 1.00 0.00 C ATOM 418 OG SER A 30 20.209 2.951 -3.450 1.00 0.00 O ATOM 0 H SER A 30 19.385 0.867 -6.452 1.00 0.00 H new ATOM 0 HA SER A 30 19.234 0.669 -3.789 1.00 0.00 H new ATOM 0 HB2 SER A 30 20.325 2.458 -5.444 1.00 0.00 H new ATOM 0 HB3 SER A 30 18.930 3.419 -4.992 1.00 0.00 H new ATOM 0 HG SER A 30 20.734 3.769 -3.578 1.00 0.00 H new ATOM 424 N VAL A 31 16.649 2.527 -4.716 1.00 0.00 N ATOM 425 CA VAL A 31 15.305 2.938 -4.326 1.00 0.00 C ATOM 426 C VAL A 31 14.481 1.746 -3.854 1.00 0.00 C ATOM 427 O VAL A 31 13.909 1.766 -2.764 1.00 0.00 O ATOM 428 CB VAL A 31 14.570 3.628 -5.490 1.00 0.00 C ATOM 429 CG1 VAL A 31 13.122 3.908 -5.116 1.00 0.00 C ATOM 430 CG2 VAL A 31 15.285 4.912 -5.885 1.00 0.00 C ATOM 0 H VAL A 31 16.985 2.950 -5.581 1.00 0.00 H new ATOM 0 HA VAL A 31 15.416 3.646 -3.505 1.00 0.00 H new ATOM 0 HB VAL A 31 14.575 2.957 -6.349 1.00 0.00 H new ATOM 0 HG11 VAL A 31 12.618 4.396 -5.951 1.00 0.00 H new ATOM 0 HG12 VAL A 31 12.618 2.969 -4.886 1.00 0.00 H new ATOM 0 HG13 VAL A 31 13.091 4.560 -4.243 1.00 0.00 H new ATOM 0 HG21 VAL A 31 14.752 5.387 -6.709 1.00 0.00 H new ATOM 0 HG22 VAL A 31 15.313 5.590 -5.032 1.00 0.00 H new ATOM 0 HG23 VAL A 31 16.303 4.680 -6.197 1.00 0.00 H new ATOM 440 N ARG A 32 14.423 0.708 -4.682 1.00 0.00 N ATOM 441 CA ARG A 32 13.668 -0.493 -4.350 1.00 0.00 C ATOM 442 C ARG A 32 14.090 -1.043 -2.990 1.00 0.00 C ATOM 443 O ARG A 32 13.261 -1.226 -2.099 1.00 0.00 O ATOM 444 CB ARG A 32 13.867 -1.561 -5.427 1.00 0.00 C ATOM 445 CG ARG A 32 13.359 -1.145 -6.798 1.00 0.00 C ATOM 446 CD ARG A 32 13.904 -2.049 -7.892 1.00 0.00 C ATOM 447 NE ARG A 32 13.750 -1.458 -9.219 1.00 0.00 N ATOM 448 CZ ARG A 32 14.176 -2.037 -10.336 1.00 0.00 C ATOM 449 NH1 ARG A 32 14.779 -3.217 -10.286 1.00 0.00 N ATOM 450 NH2 ARG A 32 13.999 -1.436 -11.505 1.00 0.00 N ATOM 0 H ARG A 32 14.890 0.675 -5.588 1.00 0.00 H new ATOM 0 HA ARG A 32 12.612 -0.226 -4.303 1.00 0.00 H new ATOM 0 HB2 ARG A 32 14.928 -1.799 -5.499 1.00 0.00 H new ATOM 0 HB3 ARG A 32 13.356 -2.474 -5.121 1.00 0.00 H new ATOM 0 HG2 ARG A 32 12.269 -1.176 -6.808 1.00 0.00 H new ATOM 0 HG3 ARG A 32 13.651 -0.114 -6.998 1.00 0.00 H new ATOM 0 HD2 ARG A 32 14.959 -2.249 -7.705 1.00 0.00 H new ATOM 0 HD3 ARG A 32 13.387 -3.008 -7.860 1.00 0.00 H new ATOM 0 HE ARG A 32 13.290 -0.551 -9.292 1.00 0.00 H new ATOM 0 HH11 ARG A 32 14.916 -3.682 -9.389 1.00 0.00 H new ATOM 0 HH12 ARG A 32 15.105 -3.660 -11.145 1.00 0.00 H new ATOM 0 HH21 ARG A 32 13.535 -0.528 -11.547 1.00 0.00 H new ATOM 0 HH22 ARG A 32 14.326 -1.881 -12.362 1.00 0.00 H new ATOM 464 N ARG A 33 15.384 -1.304 -2.839 1.00 0.00 N ATOM 465 CA ARG A 33 15.916 -1.834 -1.590 1.00 0.00 C ATOM 466 C ARG A 33 15.465 -0.986 -0.404 1.00 0.00 C ATOM 467 O ARG A 33 14.953 -1.509 0.586 1.00 0.00 O ATOM 468 CB ARG A 33 17.444 -1.884 -1.642 1.00 0.00 C ATOM 469 CG ARG A 33 18.065 -2.706 -0.524 1.00 0.00 C ATOM 470 CD ARG A 33 18.322 -1.861 0.713 1.00 0.00 C ATOM 471 NE ARG A 33 19.061 -2.596 1.735 1.00 0.00 N ATOM 472 CZ ARG A 33 20.353 -2.892 1.637 1.00 0.00 C ATOM 473 NH1 ARG A 33 21.043 -2.517 0.570 1.00 0.00 N ATOM 474 NH2 ARG A 33 20.956 -3.565 2.609 1.00 0.00 N ATOM 0 H ARG A 33 16.084 -1.157 -3.567 1.00 0.00 H new ATOM 0 HA ARG A 33 15.530 -2.845 -1.460 1.00 0.00 H new ATOM 0 HB2 ARG A 33 17.753 -2.299 -2.601 1.00 0.00 H new ATOM 0 HB3 ARG A 33 17.834 -0.867 -1.594 1.00 0.00 H new ATOM 0 HG2 ARG A 33 17.403 -3.534 -0.269 1.00 0.00 H new ATOM 0 HG3 ARG A 33 19.003 -3.142 -0.869 1.00 0.00 H new ATOM 0 HD2 ARG A 33 18.882 -0.969 0.432 1.00 0.00 H new ATOM 0 HD3 ARG A 33 17.371 -1.524 1.126 1.00 0.00 H new ATOM 0 HE ARG A 33 18.559 -2.899 2.569 1.00 0.00 H new ATOM 0 HH11 ARG A 33 20.583 -2.000 -0.179 1.00 0.00 H new ATOM 0 HH12 ARG A 33 22.034 -2.746 0.498 1.00 0.00 H new ATOM 0 HH21 ARG A 33 20.428 -3.855 3.432 1.00 0.00 H new ATOM 0 HH22 ARG A 33 21.948 -3.792 2.533 1.00 0.00 H new ATOM 488 N GLU A 34 15.659 0.325 -0.512 1.00 0.00 N ATOM 489 CA GLU A 34 15.272 1.244 0.552 1.00 0.00 C ATOM 490 C GLU A 34 13.792 1.093 0.891 1.00 0.00 C ATOM 491 O GLU A 34 13.406 1.111 2.060 1.00 0.00 O ATOM 492 CB GLU A 34 15.569 2.688 0.142 1.00 0.00 C ATOM 493 CG GLU A 34 17.030 2.938 -0.191 1.00 0.00 C ATOM 494 CD GLU A 34 17.975 2.256 0.780 1.00 0.00 C ATOM 495 OE1 GLU A 34 17.677 2.249 1.993 1.00 0.00 O ATOM 496 OE2 GLU A 34 19.012 1.729 0.326 1.00 0.00 O ATOM 0 H GLU A 34 16.081 0.774 -1.325 1.00 0.00 H new ATOM 0 HA GLU A 34 15.856 0.999 1.439 1.00 0.00 H new ATOM 0 HB2 GLU A 34 14.959 2.944 -0.724 1.00 0.00 H new ATOM 0 HB3 GLU A 34 15.270 3.355 0.951 1.00 0.00 H new ATOM 0 HG2 GLU A 34 17.234 2.583 -1.201 1.00 0.00 H new ATOM 0 HG3 GLU A 34 17.222 4.011 -0.185 1.00 0.00 H new ATOM 503 N LEU A 35 12.968 0.945 -0.140 1.00 0.00 N ATOM 504 CA LEU A 35 11.529 0.792 0.046 1.00 0.00 C ATOM 505 C LEU A 35 11.212 -0.494 0.803 1.00 0.00 C ATOM 506 O LEU A 35 10.418 -0.492 1.744 1.00 0.00 O ATOM 507 CB LEU A 35 10.817 0.789 -1.308 1.00 0.00 C ATOM 508 CG LEU A 35 10.910 2.082 -2.118 1.00 0.00 C ATOM 509 CD1 LEU A 35 10.856 1.783 -3.608 1.00 0.00 C ATOM 510 CD2 LEU A 35 9.795 3.040 -1.723 1.00 0.00 C ATOM 0 H LEU A 35 13.271 0.928 -1.114 1.00 0.00 H new ATOM 0 HA LEU A 35 11.172 1.637 0.635 1.00 0.00 H new ATOM 0 HB2 LEU A 35 11.226 -0.023 -1.909 1.00 0.00 H new ATOM 0 HB3 LEU A 35 9.764 0.563 -1.142 1.00 0.00 H new ATOM 0 HG LEU A 35 11.866 2.558 -1.898 1.00 0.00 H new ATOM 0 HD11 LEU A 35 10.923 2.715 -4.169 1.00 0.00 H new ATOM 0 HD12 LEU A 35 11.689 1.135 -3.880 1.00 0.00 H new ATOM 0 HD13 LEU A 35 9.916 1.284 -3.845 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.877 3.955 -2.310 1.00 0.00 H new ATOM 0 HD22 LEU A 35 8.829 2.572 -1.913 1.00 0.00 H new ATOM 0 HD23 LEU A 35 9.880 3.280 -0.663 1.00 0.00 H new ATOM 522 N CYS A 36 11.839 -1.589 0.388 1.00 0.00 N ATOM 523 CA CYS A 36 11.625 -2.882 1.028 1.00 0.00 C ATOM 524 C CYS A 36 11.892 -2.797 2.527 1.00 0.00 C ATOM 525 O CYS A 36 11.424 -3.633 3.299 1.00 0.00 O ATOM 526 CB CYS A 36 12.527 -3.943 0.396 1.00 0.00 C ATOM 527 SG CYS A 36 12.205 -4.235 -1.359 1.00 0.00 S ATOM 0 H CYS A 36 12.500 -1.607 -0.389 1.00 0.00 H new ATOM 0 HA CYS A 36 10.583 -3.166 0.878 1.00 0.00 H new ATOM 0 HB2 CYS A 36 13.567 -3.640 0.518 1.00 0.00 H new ATOM 0 HB3 CYS A 36 12.402 -4.880 0.938 1.00 0.00 H new ATOM 0 HG CYS A 36 12.524 -3.175 -2.041 1.00 0.00 H new ATOM 533 N SER A 37 12.649 -1.782 2.932 1.00 0.00 N ATOM 534 CA SER A 37 12.983 -1.591 4.338 1.00 0.00 C ATOM 535 C SER A 37 11.944 -0.714 5.029 1.00 0.00 C ATOM 536 O SER A 37 11.848 -0.694 6.257 1.00 0.00 O ATOM 537 CB SER A 37 14.371 -0.960 4.473 1.00 0.00 C ATOM 538 OG SER A 37 15.378 -1.954 4.544 1.00 0.00 O ATOM 0 H SER A 37 13.042 -1.079 2.306 1.00 0.00 H new ATOM 0 HA SER A 37 12.987 -2.568 4.821 1.00 0.00 H new ATOM 0 HB2 SER A 37 14.561 -0.306 3.622 1.00 0.00 H new ATOM 0 HB3 SER A 37 14.406 -0.338 5.367 1.00 0.00 H new ATOM 0 HG SER A 37 16.255 -1.525 4.628 1.00 0.00 H new ATOM 544 N VAL A 38 11.166 0.011 4.232 1.00 0.00 N ATOM 545 CA VAL A 38 10.132 0.890 4.765 1.00 0.00 C ATOM 546 C VAL A 38 8.755 0.503 4.237 1.00 0.00 C ATOM 547 O VAL A 38 7.813 1.293 4.293 1.00 0.00 O ATOM 548 CB VAL A 38 10.410 2.363 4.411 1.00 0.00 C ATOM 549 CG1 VAL A 38 11.798 2.773 4.880 1.00 0.00 C ATOM 550 CG2 VAL A 38 10.256 2.589 2.914 1.00 0.00 C ATOM 0 H VAL A 38 11.232 0.007 3.214 1.00 0.00 H new ATOM 0 HA VAL A 38 10.148 0.775 5.849 1.00 0.00 H new ATOM 0 HB VAL A 38 9.680 2.986 4.927 1.00 0.00 H new ATOM 0 HG11 VAL A 38 11.976 3.817 4.621 1.00 0.00 H new ATOM 0 HG12 VAL A 38 11.868 2.650 5.961 1.00 0.00 H new ATOM 0 HG13 VAL A 38 12.546 2.146 4.395 1.00 0.00 H new ATOM 0 HG21 VAL A 38 10.456 3.635 2.681 1.00 0.00 H new ATOM 0 HG22 VAL A 38 10.962 1.956 2.376 1.00 0.00 H new ATOM 0 HG23 VAL A 38 9.240 2.338 2.611 1.00 0.00 H new ATOM 560 N MET A 39 8.647 -0.718 3.724 1.00 0.00 N ATOM 561 CA MET A 39 7.383 -1.211 3.187 1.00 0.00 C ATOM 562 C MET A 39 6.815 -2.321 4.066 1.00 0.00 C ATOM 563 O MET A 39 7.562 -3.116 4.637 1.00 0.00 O ATOM 564 CB MET A 39 7.578 -1.724 1.759 1.00 0.00 C ATOM 565 CG MET A 39 7.964 -3.193 1.688 1.00 0.00 C ATOM 566 SD MET A 39 7.985 -3.825 -0.001 1.00 0.00 S ATOM 567 CE MET A 39 8.643 -2.411 -0.883 1.00 0.00 C ATOM 0 H MET A 39 9.418 -1.384 3.669 1.00 0.00 H new ATOM 0 HA MET A 39 6.674 -0.383 3.175 1.00 0.00 H new ATOM 0 HB2 MET A 39 6.656 -1.572 1.198 1.00 0.00 H new ATOM 0 HB3 MET A 39 8.350 -1.130 1.271 1.00 0.00 H new ATOM 0 HG2 MET A 39 8.949 -3.328 2.134 1.00 0.00 H new ATOM 0 HG3 MET A 39 7.262 -3.778 2.282 1.00 0.00 H new ATOM 0 HE1 MET A 39 7.855 -1.959 -1.486 1.00 0.00 H new ATOM 0 HE2 MET A 39 9.018 -1.679 -0.168 1.00 0.00 H new ATOM 0 HE3 MET A 39 9.457 -2.734 -1.532 1.00 0.00 H new ATOM 577 N ILE A 40 5.491 -2.368 4.170 1.00 0.00 N ATOM 578 CA ILE A 40 4.825 -3.381 4.978 1.00 0.00 C ATOM 579 C ILE A 40 4.293 -4.516 4.109 1.00 0.00 C ATOM 580 O ILE A 40 3.890 -4.300 2.966 1.00 0.00 O ATOM 581 CB ILE A 40 3.660 -2.779 5.786 1.00 0.00 C ATOM 582 CG1 ILE A 40 4.096 -1.475 6.457 1.00 0.00 C ATOM 583 CG2 ILE A 40 3.164 -3.775 6.824 1.00 0.00 C ATOM 584 CD1 ILE A 40 2.962 -0.496 6.668 1.00 0.00 C ATOM 0 H ILE A 40 4.859 -1.716 3.705 1.00 0.00 H new ATOM 0 HA ILE A 40 5.571 -3.775 5.668 1.00 0.00 H new ATOM 0 HB ILE A 40 2.840 -2.558 5.103 1.00 0.00 H new ATOM 0 HG12 ILE A 40 4.550 -1.706 7.421 1.00 0.00 H new ATOM 0 HG13 ILE A 40 4.865 -1.002 5.847 1.00 0.00 H new ATOM 0 HG21 ILE A 40 2.341 -3.335 7.387 1.00 0.00 H new ATOM 0 HG22 ILE A 40 2.819 -4.680 6.324 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.977 -4.025 7.506 1.00 0.00 H new ATOM 0 HD11 ILE A 40 3.344 0.405 7.148 1.00 0.00 H new ATOM 0 HD12 ILE A 40 2.522 -0.236 5.705 1.00 0.00 H new ATOM 0 HD13 ILE A 40 2.202 -0.951 7.303 1.00 0.00 H new ATOM 596 N PHE A 41 4.294 -5.725 4.660 1.00 0.00 N ATOM 597 CA PHE A 41 3.811 -6.895 3.936 1.00 0.00 C ATOM 598 C PHE A 41 2.423 -7.301 4.422 1.00 0.00 C ATOM 599 O PHE A 41 2.249 -7.695 5.575 1.00 0.00 O ATOM 600 CB PHE A 41 4.784 -8.063 4.105 1.00 0.00 C ATOM 601 CG PHE A 41 5.986 -7.976 3.208 1.00 0.00 C ATOM 602 CD1 PHE A 41 5.846 -8.052 1.831 1.00 0.00 C ATOM 603 CD2 PHE A 41 7.255 -7.820 3.741 1.00 0.00 C ATOM 604 CE1 PHE A 41 6.950 -7.972 1.003 1.00 0.00 C ATOM 605 CE2 PHE A 41 8.362 -7.739 2.918 1.00 0.00 C ATOM 606 CZ PHE A 41 8.210 -7.816 1.547 1.00 0.00 C ATOM 0 H PHE A 41 4.624 -5.920 5.605 1.00 0.00 H new ATOM 0 HA PHE A 41 3.745 -6.635 2.879 1.00 0.00 H new ATOM 0 HB2 PHE A 41 5.117 -8.101 5.142 1.00 0.00 H new ATOM 0 HB3 PHE A 41 4.258 -8.996 3.904 1.00 0.00 H new ATOM 0 HD1 PHE A 41 4.863 -8.175 1.400 1.00 0.00 H new ATOM 0 HD2 PHE A 41 7.381 -7.761 4.812 1.00 0.00 H new ATOM 0 HE1 PHE A 41 6.827 -8.031 -0.068 1.00 0.00 H new ATOM 0 HE2 PHE A 41 9.346 -7.616 3.346 1.00 0.00 H new ATOM 0 HZ PHE A 41 9.074 -7.754 0.902 1.00 0.00 H new ATOM 616 N GLU A 42 1.438 -7.201 3.534 1.00 0.00 N ATOM 617 CA GLU A 42 0.065 -7.556 3.874 1.00 0.00 C ATOM 618 C GLU A 42 -0.491 -8.579 2.888 1.00 0.00 C ATOM 619 O GLU A 42 -0.127 -8.587 1.712 1.00 0.00 O ATOM 620 CB GLU A 42 -0.820 -6.308 3.885 1.00 0.00 C ATOM 621 CG GLU A 42 -0.833 -5.583 5.220 1.00 0.00 C ATOM 622 CD GLU A 42 -1.733 -6.255 6.240 1.00 0.00 C ATOM 623 OE1 GLU A 42 -2.859 -6.646 5.869 1.00 0.00 O ATOM 624 OE2 GLU A 42 -1.310 -6.388 7.407 1.00 0.00 O ATOM 0 H GLU A 42 1.565 -6.877 2.575 1.00 0.00 H new ATOM 0 HA GLU A 42 0.067 -8.000 4.870 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -0.475 -5.622 3.112 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -1.840 -6.594 3.626 1.00 0.00 H new ATOM 0 HG2 GLU A 42 0.183 -5.535 5.613 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -1.165 -4.556 5.068 1.00 0.00 H new ATOM 631 N VAL A 43 -1.376 -9.442 3.377 1.00 0.00 N ATOM 632 CA VAL A 43 -1.984 -10.470 2.540 1.00 0.00 C ATOM 633 C VAL A 43 -3.471 -10.619 2.845 1.00 0.00 C ATOM 634 O VAL A 43 -3.852 -11.041 3.937 1.00 0.00 O ATOM 635 CB VAL A 43 -1.293 -11.833 2.733 1.00 0.00 C ATOM 636 CG1 VAL A 43 -1.950 -12.893 1.863 1.00 0.00 C ATOM 637 CG2 VAL A 43 0.193 -11.724 2.425 1.00 0.00 C ATOM 0 H VAL A 43 -1.688 -9.450 4.348 1.00 0.00 H new ATOM 0 HA VAL A 43 -1.858 -10.150 1.506 1.00 0.00 H new ATOM 0 HB VAL A 43 -1.404 -12.133 3.775 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -1.448 -13.849 2.013 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.001 -12.988 2.136 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -1.872 -12.603 0.815 1.00 0.00 H new ATOM 0 HG21 VAL A 43 0.666 -12.696 2.566 1.00 0.00 H new ATOM 0 HG22 VAL A 43 0.328 -11.401 1.393 1.00 0.00 H new ATOM 0 HG23 VAL A 43 0.651 -10.997 3.095 1.00 0.00 H new ATOM 647 N VAL A 44 -4.307 -10.269 1.872 1.00 0.00 N ATOM 648 CA VAL A 44 -5.752 -10.365 2.036 1.00 0.00 C ATOM 649 C VAL A 44 -6.249 -11.772 1.723 1.00 0.00 C ATOM 650 O VAL A 44 -6.022 -12.292 0.631 1.00 0.00 O ATOM 651 CB VAL A 44 -6.488 -9.360 1.130 1.00 0.00 C ATOM 652 CG1 VAL A 44 -7.994 -9.514 1.273 1.00 0.00 C ATOM 653 CG2 VAL A 44 -6.056 -7.938 1.453 1.00 0.00 C ATOM 0 H VAL A 44 -4.008 -9.917 0.963 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.968 -10.130 3.078 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.223 -9.570 0.094 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.496 -8.796 0.625 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -8.285 -10.525 0.988 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -8.282 -9.332 2.308 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -6.585 -7.241 0.804 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -6.290 -7.714 2.494 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.982 -7.839 1.293 1.00 0.00 H new ATOM 663 N GLU A 45 -6.927 -12.383 2.689 1.00 0.00 N ATOM 664 CA GLU A 45 -7.456 -13.731 2.515 1.00 0.00 C ATOM 665 C GLU A 45 -8.900 -13.691 2.025 1.00 0.00 C ATOM 666 O GLU A 45 -9.278 -14.428 1.115 1.00 0.00 O ATOM 667 CB GLU A 45 -7.374 -14.508 3.831 1.00 0.00 C ATOM 668 CG GLU A 45 -6.031 -15.183 4.057 1.00 0.00 C ATOM 669 CD GLU A 45 -5.920 -16.516 3.343 1.00 0.00 C ATOM 670 OE1 GLU A 45 -6.887 -17.302 3.400 1.00 0.00 O ATOM 671 OE2 GLU A 45 -4.864 -16.771 2.726 1.00 0.00 O ATOM 0 H GLU A 45 -7.123 -11.967 3.599 1.00 0.00 H new ATOM 0 HA GLU A 45 -6.850 -14.237 1.763 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -7.572 -13.827 4.658 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -8.158 -15.265 3.846 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -5.235 -14.523 3.713 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -5.880 -15.334 5.126 1.00 0.00 H new ATOM 678 N GLN A 46 -9.702 -12.825 2.637 1.00 0.00 N ATOM 679 CA GLN A 46 -11.105 -12.689 2.263 1.00 0.00 C ATOM 680 C GLN A 46 -11.260 -11.776 1.052 1.00 0.00 C ATOM 681 O GLN A 46 -10.972 -10.582 1.122 1.00 0.00 O ATOM 682 CB GLN A 46 -11.916 -12.140 3.438 1.00 0.00 C ATOM 683 CG GLN A 46 -11.522 -10.729 3.843 1.00 0.00 C ATOM 684 CD GLN A 46 -11.923 -10.396 5.266 1.00 0.00 C ATOM 685 OE1 GLN A 46 -11.144 -10.579 6.202 1.00 0.00 O ATOM 686 NE2 GLN A 46 -13.145 -9.904 5.438 1.00 0.00 N ATOM 0 H GLN A 46 -9.405 -12.208 3.393 1.00 0.00 H new ATOM 0 HA GLN A 46 -11.482 -13.677 2.000 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -12.974 -12.152 3.175 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -11.793 -12.803 4.295 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -10.443 -10.613 3.737 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -11.988 -10.016 3.162 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -13.758 -9.768 4.634 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -13.470 -9.662 6.374 1.00 0.00 H new ATOM 695 N ALA A 47 -11.718 -12.346 -0.058 1.00 0.00 N ATOM 696 CA ALA A 47 -11.912 -11.583 -1.285 1.00 0.00 C ATOM 697 C ALA A 47 -12.908 -10.447 -1.072 1.00 0.00 C ATOM 698 O ALA A 47 -13.558 -10.365 -0.031 1.00 0.00 O ATOM 699 CB ALA A 47 -12.384 -12.497 -2.406 1.00 0.00 C ATOM 0 H ALA A 47 -11.962 -13.334 -0.133 1.00 0.00 H new ATOM 0 HA ALA A 47 -10.954 -11.145 -1.567 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -12.525 -11.914 -3.316 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -11.637 -13.271 -2.583 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -13.329 -12.962 -2.123 1.00 0.00 H new ATOM 705 N GLY A 48 -13.021 -9.572 -2.066 1.00 0.00 N ATOM 706 CA GLY A 48 -13.938 -8.452 -1.968 1.00 0.00 C ATOM 707 C GLY A 48 -13.614 -7.538 -0.802 1.00 0.00 C ATOM 708 O GLY A 48 -14.391 -6.642 -0.473 1.00 0.00 O ATOM 0 H GLY A 48 -12.494 -9.619 -2.938 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -13.907 -7.879 -2.895 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -14.955 -8.828 -1.859 1.00 0.00 H new ATOM 712 N ALA A 49 -12.465 -7.766 -0.175 1.00 0.00 N ATOM 713 CA ALA A 49 -12.040 -6.956 0.959 1.00 0.00 C ATOM 714 C ALA A 49 -11.795 -5.510 0.541 1.00 0.00 C ATOM 715 O ALA A 49 -11.264 -5.248 -0.539 1.00 0.00 O ATOM 716 CB ALA A 49 -10.787 -7.545 1.589 1.00 0.00 C ATOM 0 H ALA A 49 -11.812 -8.505 -0.434 1.00 0.00 H new ATOM 0 HA ALA A 49 -12.842 -6.962 1.698 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -10.481 -6.929 2.435 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -10.995 -8.558 1.934 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -9.986 -7.570 0.850 1.00 0.00 H new ATOM 722 N ILE A 50 -12.184 -4.576 1.401 1.00 0.00 N ATOM 723 CA ILE A 50 -12.006 -3.157 1.120 1.00 0.00 C ATOM 724 C ILE A 50 -10.578 -2.712 1.420 1.00 0.00 C ATOM 725 O ILE A 50 -10.102 -2.841 2.548 1.00 0.00 O ATOM 726 CB ILE A 50 -12.983 -2.293 1.939 1.00 0.00 C ATOM 727 CG1 ILE A 50 -14.428 -2.613 1.552 1.00 0.00 C ATOM 728 CG2 ILE A 50 -12.688 -0.815 1.729 1.00 0.00 C ATOM 729 CD1 ILE A 50 -14.818 -4.052 1.809 1.00 0.00 C ATOM 0 H ILE A 50 -12.625 -4.776 2.299 1.00 0.00 H new ATOM 0 HA ILE A 50 -12.213 -3.018 0.059 1.00 0.00 H new ATOM 0 HB ILE A 50 -12.850 -2.523 2.996 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -15.098 -1.958 2.109 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -14.570 -2.390 0.495 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -13.387 -0.218 2.314 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -11.669 -0.598 2.049 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -12.797 -0.569 0.673 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -15.855 -4.207 1.511 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -14.172 -4.713 1.231 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -14.708 -4.275 2.870 1.00 0.00 H new ATOM 741 N ILE A 51 -9.902 -2.187 0.404 1.00 0.00 N ATOM 742 CA ILE A 51 -8.530 -1.721 0.560 1.00 0.00 C ATOM 743 C ILE A 51 -8.491 -0.247 0.949 1.00 0.00 C ATOM 744 O ILE A 51 -7.686 0.164 1.786 1.00 0.00 O ATOM 745 CB ILE A 51 -7.717 -1.920 -0.734 1.00 0.00 C ATOM 746 CG1 ILE A 51 -8.169 -3.191 -1.455 1.00 0.00 C ATOM 747 CG2 ILE A 51 -6.230 -1.982 -0.420 1.00 0.00 C ATOM 748 CD1 ILE A 51 -7.878 -4.459 -0.684 1.00 0.00 C ATOM 0 H ILE A 51 -10.282 -2.074 -0.536 1.00 0.00 H new ATOM 0 HA ILE A 51 -8.083 -2.317 1.356 1.00 0.00 H new ATOM 0 HB ILE A 51 -7.894 -1.069 -1.392 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -9.240 -3.129 -1.646 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -7.675 -3.244 -2.425 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -5.669 -2.123 -1.344 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -5.919 -1.051 0.055 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -6.035 -2.816 0.254 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -8.225 -5.320 -1.255 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -6.804 -4.544 -0.516 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -8.394 -4.428 0.276 1.00 0.00 H new ATOM 760 N LEU A 52 -9.367 0.544 0.339 1.00 0.00 N ATOM 761 CA LEU A 52 -9.435 1.973 0.623 1.00 0.00 C ATOM 762 C LEU A 52 -10.877 2.470 0.574 1.00 0.00 C ATOM 763 O LEU A 52 -11.703 1.933 -0.163 1.00 0.00 O ATOM 764 CB LEU A 52 -8.580 2.753 -0.377 1.00 0.00 C ATOM 765 CG LEU A 52 -7.074 2.498 -0.315 1.00 0.00 C ATOM 766 CD1 LEU A 52 -6.383 3.085 -1.536 1.00 0.00 C ATOM 767 CD2 LEU A 52 -6.487 3.079 0.963 1.00 0.00 C ATOM 0 H LEU A 52 -10.040 0.220 -0.355 1.00 0.00 H new ATOM 0 HA LEU A 52 -9.048 2.138 1.628 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.927 2.517 -1.383 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -8.755 3.818 -0.221 1.00 0.00 H new ATOM 0 HG LEU A 52 -6.907 1.421 -0.311 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -5.312 2.894 -1.475 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -6.783 2.622 -2.438 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -6.558 4.160 -1.571 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.414 2.888 0.990 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.665 4.154 0.989 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -6.961 2.612 1.826 1.00 0.00 H new ATOM 779 N GLU A 53 -11.170 3.499 1.362 1.00 0.00 N ATOM 780 CA GLU A 53 -12.511 4.069 1.407 1.00 0.00 C ATOM 781 C GLU A 53 -12.527 5.470 0.804 1.00 0.00 C ATOM 782 O GLU A 53 -11.576 6.236 0.960 1.00 0.00 O ATOM 783 CB GLU A 53 -13.022 4.116 2.848 1.00 0.00 C ATOM 784 CG GLU A 53 -13.695 2.830 3.298 1.00 0.00 C ATOM 785 CD GLU A 53 -14.568 3.026 4.522 1.00 0.00 C ATOM 786 OE1 GLU A 53 -14.028 3.410 5.581 1.00 0.00 O ATOM 787 OE2 GLU A 53 -15.791 2.796 4.422 1.00 0.00 O ATOM 0 H GLU A 53 -10.497 3.955 1.978 1.00 0.00 H new ATOM 0 HA GLU A 53 -13.169 3.431 0.817 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -12.186 4.331 3.514 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -13.729 4.940 2.947 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -14.302 2.437 2.482 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -12.932 2.082 3.516 1.00 0.00 H new ATOM 794 N ASP A 54 -13.615 5.799 0.115 1.00 0.00 N ATOM 795 CA ASP A 54 -13.756 7.108 -0.512 1.00 0.00 C ATOM 796 C ASP A 54 -13.697 8.219 0.531 1.00 0.00 C ATOM 797 O ASP A 54 -14.442 8.205 1.510 1.00 0.00 O ATOM 798 CB ASP A 54 -15.073 7.187 -1.286 1.00 0.00 C ATOM 799 CG ASP A 54 -16.284 7.110 -0.377 1.00 0.00 C ATOM 800 OD1 ASP A 54 -16.333 6.192 0.469 1.00 0.00 O ATOM 801 OD2 ASP A 54 -17.182 7.967 -0.511 1.00 0.00 O ATOM 0 H ASP A 54 -14.412 5.177 -0.023 1.00 0.00 H new ATOM 0 HA ASP A 54 -12.927 7.242 -1.207 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -15.104 8.119 -1.850 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -15.114 6.374 -2.011 1.00 0.00 H new ATOM 806 N GLY A 55 -12.805 9.181 0.315 1.00 0.00 N ATOM 807 CA GLY A 55 -12.664 10.285 1.246 1.00 0.00 C ATOM 808 C GLY A 55 -11.753 9.950 2.410 1.00 0.00 C ATOM 809 O GLY A 55 -11.879 10.527 3.490 1.00 0.00 O ATOM 0 H GLY A 55 -12.177 9.215 -0.488 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -12.269 11.153 0.718 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -13.647 10.563 1.626 1.00 0.00 H new ATOM 813 N GLN A 56 -10.834 9.015 2.190 1.00 0.00 N ATOM 814 CA GLN A 56 -9.900 8.603 3.231 1.00 0.00 C ATOM 815 C GLN A 56 -8.505 9.156 2.960 1.00 0.00 C ATOM 816 O GLN A 56 -7.809 8.693 2.057 1.00 0.00 O ATOM 817 CB GLN A 56 -9.848 7.077 3.324 1.00 0.00 C ATOM 818 CG GLN A 56 -8.960 6.566 4.447 1.00 0.00 C ATOM 819 CD GLN A 56 -8.972 5.054 4.558 1.00 0.00 C ATOM 820 OE1 GLN A 56 -10.033 4.429 4.572 1.00 0.00 O ATOM 821 NE2 GLN A 56 -7.789 4.457 4.639 1.00 0.00 N ATOM 0 H GLN A 56 -10.716 8.529 1.301 1.00 0.00 H new ATOM 0 HA GLN A 56 -10.252 9.006 4.181 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -10.859 6.695 3.469 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -9.489 6.676 2.376 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -7.938 6.906 4.280 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -9.290 6.999 5.392 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -6.935 5.014 4.624 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -7.735 3.441 4.716 1.00 0.00 H new ATOM 830 N GLU A 57 -8.103 10.148 3.749 1.00 0.00 N ATOM 831 CA GLU A 57 -6.791 10.764 3.592 1.00 0.00 C ATOM 832 C GLU A 57 -5.731 9.714 3.274 1.00 0.00 C ATOM 833 O GLU A 57 -5.326 8.941 4.144 1.00 0.00 O ATOM 834 CB GLU A 57 -6.406 11.526 4.862 1.00 0.00 C ATOM 835 CG GLU A 57 -5.293 12.539 4.650 1.00 0.00 C ATOM 836 CD GLU A 57 -3.920 11.898 4.609 1.00 0.00 C ATOM 837 OE1 GLU A 57 -3.455 11.423 5.666 1.00 0.00 O ATOM 838 OE2 GLU A 57 -3.310 11.872 3.520 1.00 0.00 O ATOM 0 H GLU A 57 -8.667 10.542 4.502 1.00 0.00 H new ATOM 0 HA GLU A 57 -6.844 11.465 2.759 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -7.286 12.041 5.248 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -6.095 10.812 5.624 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -5.468 13.075 3.717 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -5.321 13.277 5.452 1.00 0.00 H new ATOM 845 N LEU A 58 -5.286 9.691 2.023 1.00 0.00 N ATOM 846 CA LEU A 58 -4.273 8.735 1.588 1.00 0.00 C ATOM 847 C LEU A 58 -2.894 9.129 2.107 1.00 0.00 C ATOM 848 O LEU A 58 -2.293 10.093 1.631 1.00 0.00 O ATOM 849 CB LEU A 58 -4.250 8.645 0.061 1.00 0.00 C ATOM 850 CG LEU A 58 -5.542 8.167 -0.603 1.00 0.00 C ATOM 851 CD1 LEU A 58 -5.655 8.725 -2.013 1.00 0.00 C ATOM 852 CD2 LEU A 58 -5.600 6.646 -0.622 1.00 0.00 C ATOM 0 H LEU A 58 -5.610 10.323 1.291 1.00 0.00 H new ATOM 0 HA LEU A 58 -4.530 7.759 1.999 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -4.003 9.629 -0.337 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.444 7.972 -0.231 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.386 8.535 -0.020 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -6.580 8.374 -2.470 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -5.660 9.814 -1.974 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -4.806 8.387 -2.607 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -6.526 6.323 -1.098 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -4.749 6.256 -1.181 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.566 6.268 0.400 1.00 0.00 H new ATOM 864 N ASP A 59 -2.398 8.377 3.083 1.00 0.00 N ATOM 865 CA ASP A 59 -1.088 8.646 3.664 1.00 0.00 C ATOM 866 C ASP A 59 -0.192 7.414 3.579 1.00 0.00 C ATOM 867 O ASP A 59 0.580 7.131 4.495 1.00 0.00 O ATOM 868 CB ASP A 59 -1.233 9.086 5.122 1.00 0.00 C ATOM 869 CG ASP A 59 -1.281 7.912 6.079 1.00 0.00 C ATOM 870 OD1 ASP A 59 -2.300 7.189 6.082 1.00 0.00 O ATOM 871 OD2 ASP A 59 -0.299 7.715 6.825 1.00 0.00 O ATOM 0 H ASP A 59 -2.883 7.577 3.488 1.00 0.00 H new ATOM 0 HA ASP A 59 -0.624 9.451 3.094 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -0.398 9.734 5.388 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -2.142 9.677 5.231 1.00 0.00 H new ATOM 876 N SER A 60 -0.302 6.684 2.474 1.00 0.00 N ATOM 877 CA SER A 60 0.494 5.479 2.271 1.00 0.00 C ATOM 878 C SER A 60 0.299 4.930 0.861 1.00 0.00 C ATOM 879 O SER A 60 -0.830 4.748 0.405 1.00 0.00 O ATOM 880 CB SER A 60 0.116 4.413 3.302 1.00 0.00 C ATOM 881 OG SER A 60 -1.265 4.104 3.234 1.00 0.00 O ATOM 0 H SER A 60 -0.935 6.906 1.705 1.00 0.00 H new ATOM 0 HA SER A 60 1.544 5.742 2.398 1.00 0.00 H new ATOM 0 HB2 SER A 60 0.703 3.511 3.128 1.00 0.00 H new ATOM 0 HB3 SER A 60 0.364 4.767 4.303 1.00 0.00 H new ATOM 0 HG SER A 60 -1.476 3.740 2.349 1.00 0.00 H new ATOM 887 N TRP A 61 1.407 4.669 0.177 1.00 0.00 N ATOM 888 CA TRP A 61 1.359 4.141 -1.182 1.00 0.00 C ATOM 889 C TRP A 61 1.086 2.641 -1.173 1.00 0.00 C ATOM 890 O TRP A 61 1.570 1.917 -0.303 1.00 0.00 O ATOM 891 CB TRP A 61 2.674 4.428 -1.909 1.00 0.00 C ATOM 892 CG TRP A 61 2.683 3.951 -3.330 1.00 0.00 C ATOM 893 CD1 TRP A 61 1.688 4.104 -4.253 1.00 0.00 C ATOM 894 CD2 TRP A 61 3.738 3.242 -3.989 1.00 0.00 C ATOM 895 NE1 TRP A 61 2.060 3.533 -5.445 1.00 0.00 N ATOM 896 CE2 TRP A 61 3.314 2.997 -5.310 1.00 0.00 C ATOM 897 CE3 TRP A 61 5.000 2.791 -3.592 1.00 0.00 C ATOM 898 CZ2 TRP A 61 4.108 2.322 -6.233 1.00 0.00 C ATOM 899 CZ3 TRP A 61 5.786 2.120 -4.509 1.00 0.00 C ATOM 900 CH2 TRP A 61 5.338 1.891 -5.817 1.00 0.00 C ATOM 0 H TRP A 61 2.349 4.814 0.540 1.00 0.00 H new ATOM 0 HA TRP A 61 0.544 4.637 -1.710 1.00 0.00 H new ATOM 0 HB2 TRP A 61 2.863 5.501 -1.892 1.00 0.00 H new ATOM 0 HB3 TRP A 61 3.492 3.952 -1.368 1.00 0.00 H new ATOM 0 HD1 TRP A 61 0.747 4.601 -4.072 1.00 0.00 H new ATOM 0 HE1 TRP A 61 1.495 3.511 -6.294 1.00 0.00 H new ATOM 0 HE3 TRP A 61 5.354 2.964 -2.587 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 3.765 2.145 -7.242 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 6.762 1.766 -4.213 1.00 0.00 H new ATOM 0 HH2 TRP A 61 5.976 1.364 -6.510 1.00 0.00 H new ATOM 911 N TYR A 62 0.309 2.180 -2.147 1.00 0.00 N ATOM 912 CA TYR A 62 -0.030 0.766 -2.250 1.00 0.00 C ATOM 913 C TYR A 62 0.406 0.197 -3.597 1.00 0.00 C ATOM 914 O TYR A 62 0.441 0.908 -4.602 1.00 0.00 O ATOM 915 CB TYR A 62 -1.535 0.565 -2.062 1.00 0.00 C ATOM 916 CG TYR A 62 -2.054 1.082 -0.740 1.00 0.00 C ATOM 917 CD1 TYR A 62 -2.263 2.440 -0.536 1.00 0.00 C ATOM 918 CD2 TYR A 62 -2.337 0.211 0.306 1.00 0.00 C ATOM 919 CE1 TYR A 62 -2.737 2.917 0.671 1.00 0.00 C ATOM 920 CE2 TYR A 62 -2.813 0.679 1.516 1.00 0.00 C ATOM 921 CZ TYR A 62 -3.010 2.032 1.694 1.00 0.00 C ATOM 922 OH TYR A 62 -3.484 2.503 2.897 1.00 0.00 O ATOM 0 H TYR A 62 -0.098 2.765 -2.877 1.00 0.00 H new ATOM 0 HA TYR A 62 0.502 0.233 -1.462 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -2.064 1.067 -2.872 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -1.764 -0.498 -2.142 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.051 3.135 -1.335 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -2.182 -0.849 0.171 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -2.893 3.976 0.813 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -3.030 -0.011 2.318 1.00 0.00 H new ATOM 0 HH TYR A 62 -2.791 3.041 3.334 1.00 0.00 H new ATOM 932 N VAL A 63 0.737 -1.090 -3.610 1.00 0.00 N ATOM 933 CA VAL A 63 1.170 -1.756 -4.832 1.00 0.00 C ATOM 934 C VAL A 63 0.639 -3.184 -4.898 1.00 0.00 C ATOM 935 O VAL A 63 0.836 -3.973 -3.973 1.00 0.00 O ATOM 936 CB VAL A 63 2.705 -1.786 -4.942 1.00 0.00 C ATOM 937 CG1 VAL A 63 3.136 -2.487 -6.222 1.00 0.00 C ATOM 938 CG2 VAL A 63 3.271 -0.375 -4.882 1.00 0.00 C ATOM 0 H VAL A 63 0.713 -1.692 -2.787 1.00 0.00 H new ATOM 0 HA VAL A 63 0.765 -1.182 -5.665 1.00 0.00 H new ATOM 0 HB VAL A 63 3.101 -2.349 -4.097 1.00 0.00 H new ATOM 0 HG11 VAL A 63 4.224 -2.498 -6.282 1.00 0.00 H new ATOM 0 HG12 VAL A 63 2.762 -3.511 -6.220 1.00 0.00 H new ATOM 0 HG13 VAL A 63 2.731 -1.955 -7.083 1.00 0.00 H new ATOM 0 HG21 VAL A 63 4.357 -0.415 -4.961 1.00 0.00 H new ATOM 0 HG22 VAL A 63 2.869 0.214 -5.706 1.00 0.00 H new ATOM 0 HG23 VAL A 63 2.993 0.089 -3.935 1.00 0.00 H new ATOM 948 N ILE A 64 -0.035 -3.509 -5.996 1.00 0.00 N ATOM 949 CA ILE A 64 -0.593 -4.843 -6.182 1.00 0.00 C ATOM 950 C ILE A 64 0.505 -5.864 -6.457 1.00 0.00 C ATOM 951 O ILE A 64 1.063 -5.913 -7.554 1.00 0.00 O ATOM 952 CB ILE A 64 -1.607 -4.872 -7.341 1.00 0.00 C ATOM 953 CG1 ILE A 64 -2.693 -3.816 -7.123 1.00 0.00 C ATOM 954 CG2 ILE A 64 -2.225 -6.256 -7.469 1.00 0.00 C ATOM 955 CD1 ILE A 64 -3.295 -3.295 -8.409 1.00 0.00 C ATOM 0 H ILE A 64 -0.208 -2.867 -6.770 1.00 0.00 H new ATOM 0 HA ILE A 64 -1.105 -5.103 -5.255 1.00 0.00 H new ATOM 0 HB ILE A 64 -1.083 -4.642 -8.269 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -3.485 -4.242 -6.507 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -2.270 -2.981 -6.565 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.939 -6.261 -8.292 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -1.441 -6.988 -7.665 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.738 -6.513 -6.542 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -4.057 -2.550 -8.179 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -2.514 -2.839 -9.018 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.748 -4.120 -8.959 1.00 0.00 H new ATOM 967 N LEU A 65 0.810 -6.681 -5.455 1.00 0.00 N ATOM 968 CA LEU A 65 1.841 -7.705 -5.588 1.00 0.00 C ATOM 969 C LEU A 65 1.284 -8.954 -6.263 1.00 0.00 C ATOM 970 O LEU A 65 1.929 -9.545 -7.127 1.00 0.00 O ATOM 971 CB LEU A 65 2.411 -8.064 -4.215 1.00 0.00 C ATOM 972 CG LEU A 65 2.974 -6.902 -3.397 1.00 0.00 C ATOM 973 CD1 LEU A 65 3.365 -7.370 -2.003 1.00 0.00 C ATOM 974 CD2 LEU A 65 4.168 -6.279 -4.106 1.00 0.00 C ATOM 0 H LEU A 65 0.358 -6.654 -4.541 1.00 0.00 H new ATOM 0 HA LEU A 65 2.639 -7.303 -6.212 1.00 0.00 H new ATOM 0 HB2 LEU A 65 1.625 -8.545 -3.632 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.202 -8.801 -4.354 1.00 0.00 H new ATOM 0 HG LEU A 65 2.198 -6.143 -3.299 1.00 0.00 H new ATOM 0 HD11 LEU A 65 3.764 -6.529 -1.435 1.00 0.00 H new ATOM 0 HD12 LEU A 65 2.488 -7.768 -1.493 1.00 0.00 H new ATOM 0 HD13 LEU A 65 4.124 -8.148 -2.080 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.556 -5.453 -3.509 1.00 0.00 H new ATOM 0 HD22 LEU A 65 4.947 -7.030 -4.235 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.858 -5.906 -5.082 1.00 0.00 H new ATOM 986 N ASN A 66 0.079 -9.349 -5.863 1.00 0.00 N ATOM 987 CA ASN A 66 -0.566 -10.527 -6.430 1.00 0.00 C ATOM 988 C ASN A 66 -2.085 -10.399 -6.367 1.00 0.00 C ATOM 989 O ASN A 66 -2.628 -9.771 -5.460 1.00 0.00 O ATOM 990 CB ASN A 66 -0.119 -11.788 -5.687 1.00 0.00 C ATOM 991 CG ASN A 66 -0.646 -13.056 -6.329 1.00 0.00 C ATOM 992 OD1 ASN A 66 -0.333 -13.359 -7.480 1.00 0.00 O ATOM 993 ND2 ASN A 66 -1.452 -13.805 -5.585 1.00 0.00 N ATOM 0 H ASN A 66 -0.470 -8.870 -5.149 1.00 0.00 H new ATOM 0 HA ASN A 66 -0.268 -10.605 -7.476 1.00 0.00 H new ATOM 0 HB2 ASN A 66 0.970 -11.823 -5.660 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -0.462 -11.738 -4.654 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -1.838 -14.670 -5.963 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -1.685 -13.515 -4.635 1.00 0.00 H new ATOM 1000 N GLY A 67 -2.765 -11.000 -7.339 1.00 0.00 N ATOM 1001 CA GLY A 67 -4.215 -10.941 -7.375 1.00 0.00 C ATOM 1002 C GLY A 67 -4.728 -9.775 -8.196 1.00 0.00 C ATOM 1003 O GLY A 67 -3.952 -9.077 -8.851 1.00 0.00 O ATOM 0 H GLY A 67 -2.338 -11.526 -8.101 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.603 -11.872 -7.789 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -4.598 -10.861 -6.357 1.00 0.00 H new ATOM 1007 N THR A 68 -6.040 -9.562 -8.164 1.00 0.00 N ATOM 1008 CA THR A 68 -6.656 -8.474 -8.913 1.00 0.00 C ATOM 1009 C THR A 68 -7.558 -7.632 -8.018 1.00 0.00 C ATOM 1010 O THR A 68 -8.305 -8.164 -7.197 1.00 0.00 O ATOM 1011 CB THR A 68 -7.480 -9.006 -10.100 1.00 0.00 C ATOM 1012 OG1 THR A 68 -6.643 -9.769 -10.976 1.00 0.00 O ATOM 1013 CG2 THR A 68 -8.119 -7.860 -10.872 1.00 0.00 C ATOM 0 H THR A 68 -6.696 -10.129 -7.627 1.00 0.00 H new ATOM 0 HA THR A 68 -5.845 -7.853 -9.293 1.00 0.00 H new ATOM 0 HB THR A 68 -8.271 -9.645 -9.707 1.00 0.00 H new ATOM 0 HG1 THR A 68 -7.176 -10.105 -11.727 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.696 -8.260 -11.706 1.00 0.00 H new ATOM 0 HG22 THR A 68 -8.779 -7.299 -10.210 1.00 0.00 H new ATOM 0 HG23 THR A 68 -7.340 -7.199 -11.253 1.00 0.00 H new ATOM 1021 N VAL A 69 -7.486 -6.315 -8.183 1.00 0.00 N ATOM 1022 CA VAL A 69 -8.298 -5.400 -7.391 1.00 0.00 C ATOM 1023 C VAL A 69 -9.178 -4.532 -8.284 1.00 0.00 C ATOM 1024 O VAL A 69 -8.830 -4.254 -9.431 1.00 0.00 O ATOM 1025 CB VAL A 69 -7.421 -4.488 -6.511 1.00 0.00 C ATOM 1026 CG1 VAL A 69 -6.718 -5.301 -5.435 1.00 0.00 C ATOM 1027 CG2 VAL A 69 -6.413 -3.734 -7.366 1.00 0.00 C ATOM 0 H VAL A 69 -6.873 -5.858 -8.858 1.00 0.00 H new ATOM 0 HA VAL A 69 -8.930 -6.013 -6.749 1.00 0.00 H new ATOM 0 HB VAL A 69 -8.064 -3.758 -6.019 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -6.103 -4.641 -4.823 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -7.461 -5.791 -4.806 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -6.085 -6.055 -5.904 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -5.802 -3.095 -6.729 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -5.773 -4.446 -7.887 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -6.942 -3.120 -8.096 1.00 0.00 H new ATOM 1037 N GLU A 70 -10.319 -4.108 -7.749 1.00 0.00 N ATOM 1038 CA GLU A 70 -11.249 -3.272 -8.500 1.00 0.00 C ATOM 1039 C GLU A 70 -11.546 -1.979 -7.747 1.00 0.00 C ATOM 1040 O GLU A 70 -11.754 -1.988 -6.533 1.00 0.00 O ATOM 1041 CB GLU A 70 -12.551 -4.031 -8.766 1.00 0.00 C ATOM 1042 CG GLU A 70 -13.461 -3.343 -9.769 1.00 0.00 C ATOM 1043 CD GLU A 70 -14.841 -3.970 -9.830 1.00 0.00 C ATOM 1044 OE1 GLU A 70 -15.604 -3.818 -8.853 1.00 0.00 O ATOM 1045 OE2 GLU A 70 -15.157 -4.612 -10.853 1.00 0.00 O ATOM 0 H GLU A 70 -10.621 -4.329 -6.800 1.00 0.00 H new ATOM 0 HA GLU A 70 -10.783 -3.019 -9.453 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.312 -5.030 -9.131 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.088 -4.155 -7.826 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.556 -2.290 -9.505 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -13.003 -3.384 -10.757 1.00 0.00 H new ATOM 1052 N ILE A 71 -11.563 -0.868 -8.475 1.00 0.00 N ATOM 1053 CA ILE A 71 -11.834 0.434 -7.877 1.00 0.00 C ATOM 1054 C ILE A 71 -13.189 0.972 -8.324 1.00 0.00 C ATOM 1055 O ILE A 71 -13.552 0.873 -9.496 1.00 0.00 O ATOM 1056 CB ILE A 71 -10.743 1.458 -8.239 1.00 0.00 C ATOM 1057 CG1 ILE A 71 -9.394 1.024 -7.663 1.00 0.00 C ATOM 1058 CG2 ILE A 71 -11.123 2.840 -7.727 1.00 0.00 C ATOM 1059 CD1 ILE A 71 -8.218 1.779 -8.242 1.00 0.00 C ATOM 0 H ILE A 71 -11.392 -0.843 -9.480 1.00 0.00 H new ATOM 0 HA ILE A 71 -11.841 0.290 -6.797 1.00 0.00 H new ATOM 0 HB ILE A 71 -10.655 1.505 -9.324 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -9.408 1.163 -6.582 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -9.256 -0.042 -7.845 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -10.342 3.553 -7.991 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -12.065 3.150 -8.180 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -11.235 2.808 -6.643 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -7.295 1.419 -7.788 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -8.178 1.620 -9.320 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -8.332 2.843 -8.037 1.00 0.00 H new ATOM 1071 N SER A 72 -13.933 1.543 -7.382 1.00 0.00 N ATOM 1072 CA SER A 72 -15.250 2.095 -7.678 1.00 0.00 C ATOM 1073 C SER A 72 -15.257 3.610 -7.494 1.00 0.00 C ATOM 1074 O SER A 72 -14.970 4.117 -6.409 1.00 0.00 O ATOM 1075 CB SER A 72 -16.309 1.456 -6.777 1.00 0.00 C ATOM 1076 OG SER A 72 -16.467 2.190 -5.575 1.00 0.00 O ATOM 0 H SER A 72 -13.646 1.635 -6.408 1.00 0.00 H new ATOM 0 HA SER A 72 -15.485 1.871 -8.718 1.00 0.00 H new ATOM 0 HB2 SER A 72 -17.261 1.410 -7.306 1.00 0.00 H new ATOM 0 HB3 SER A 72 -16.023 0.430 -6.545 1.00 0.00 H new ATOM 0 HG SER A 72 -15.706 2.797 -5.460 1.00 0.00 H new ATOM 1082 N HIS A 73 -15.587 4.328 -8.563 1.00 0.00 N ATOM 1083 CA HIS A 73 -15.632 5.785 -8.520 1.00 0.00 C ATOM 1084 C HIS A 73 -17.055 6.277 -8.274 1.00 0.00 C ATOM 1085 O HIS A 73 -18.033 5.663 -8.700 1.00 0.00 O ATOM 1086 CB HIS A 73 -15.097 6.371 -9.827 1.00 0.00 C ATOM 1087 CG HIS A 73 -13.657 6.047 -10.083 1.00 0.00 C ATOM 1088 ND1 HIS A 73 -12.617 6.677 -9.433 1.00 0.00 N ATOM 1089 CD2 HIS A 73 -13.087 5.152 -10.923 1.00 0.00 C ATOM 1090 CE1 HIS A 73 -11.469 6.184 -9.863 1.00 0.00 C ATOM 1091 NE2 HIS A 73 -11.727 5.257 -10.768 1.00 0.00 N ATOM 0 H HIS A 73 -15.827 3.925 -9.469 1.00 0.00 H new ATOM 0 HA HIS A 73 -15.003 6.120 -7.695 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -15.698 5.997 -10.656 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -15.219 7.454 -9.807 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -13.606 4.480 -11.591 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -10.487 6.487 -9.531 1.00 0.00 H new ATOM 0 HE2 HIS A 73 -11.029 4.708 -11.270 1.00 0.00 H new ATOM 1100 N PRO A 74 -17.176 7.412 -7.570 1.00 0.00 N ATOM 1101 CA PRO A 74 -18.475 8.012 -7.250 1.00 0.00 C ATOM 1102 C PRO A 74 -19.166 8.588 -8.482 1.00 0.00 C ATOM 1103 O PRO A 74 -20.381 8.788 -8.487 1.00 0.00 O ATOM 1104 CB PRO A 74 -18.118 9.129 -6.266 1.00 0.00 C ATOM 1105 CG PRO A 74 -16.706 9.478 -6.586 1.00 0.00 C ATOM 1106 CD PRO A 74 -16.053 8.198 -7.031 1.00 0.00 C ATOM 0 HA PRO A 74 -19.174 7.279 -6.848 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -18.776 9.989 -6.388 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -18.219 8.794 -5.234 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -16.659 10.233 -7.371 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -16.199 9.892 -5.714 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -15.289 8.378 -7.787 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -15.566 7.686 -6.201 1.00 0.00 H new ATOM 1114 N ASP A 75 -18.385 8.851 -9.524 1.00 0.00 N ATOM 1115 CA ASP A 75 -18.922 9.402 -10.762 1.00 0.00 C ATOM 1116 C ASP A 75 -19.663 8.332 -11.557 1.00 0.00 C ATOM 1117 O ASP A 75 -20.640 8.621 -12.247 1.00 0.00 O ATOM 1118 CB ASP A 75 -17.798 9.998 -11.610 1.00 0.00 C ATOM 1119 CG ASP A 75 -18.322 10.831 -12.764 1.00 0.00 C ATOM 1120 OD1 ASP A 75 -18.773 11.969 -12.518 1.00 0.00 O ATOM 1121 OD2 ASP A 75 -18.282 10.343 -13.914 1.00 0.00 O ATOM 0 H ASP A 75 -17.378 8.691 -9.536 1.00 0.00 H new ATOM 0 HA ASP A 75 -19.628 10.191 -10.503 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -17.160 10.617 -10.979 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -17.175 9.193 -12.000 1.00 0.00 H new ATOM 1126 N GLY A 76 -19.190 7.093 -11.456 1.00 0.00 N ATOM 1127 CA GLY A 76 -19.819 5.998 -12.172 1.00 0.00 C ATOM 1128 C GLY A 76 -18.834 5.220 -13.022 1.00 0.00 C ATOM 1129 O GLY A 76 -19.200 4.664 -14.057 1.00 0.00 O ATOM 0 H GLY A 76 -18.383 6.828 -10.891 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -20.290 5.323 -11.457 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -20.612 6.392 -12.808 1.00 0.00 H new ATOM 1133 N LYS A 77 -17.580 5.180 -12.584 1.00 0.00 N ATOM 1134 CA LYS A 77 -16.538 4.465 -13.311 1.00 0.00 C ATOM 1135 C LYS A 77 -15.887 3.406 -12.427 1.00 0.00 C ATOM 1136 O LYS A 77 -15.800 3.567 -11.210 1.00 0.00 O ATOM 1137 CB LYS A 77 -15.477 5.444 -13.819 1.00 0.00 C ATOM 1138 CG LYS A 77 -14.804 4.998 -15.105 1.00 0.00 C ATOM 1139 CD LYS A 77 -15.633 5.364 -16.325 1.00 0.00 C ATOM 1140 CE LYS A 77 -15.434 6.820 -16.717 1.00 0.00 C ATOM 1141 NZ LYS A 77 -16.227 7.740 -15.854 1.00 0.00 N ATOM 0 H LYS A 77 -17.261 5.635 -11.729 1.00 0.00 H new ATOM 0 HA LYS A 77 -17.001 3.967 -14.163 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -15.940 6.417 -13.980 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -14.718 5.576 -13.048 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -13.820 5.460 -15.181 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -14.648 3.919 -15.080 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -15.357 4.720 -17.160 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -16.688 5.183 -16.117 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -14.377 7.075 -16.644 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -15.724 6.959 -17.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -16.574 8.538 -16.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -17.036 7.226 -15.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -15.626 8.099 -15.085 1.00 0.00 H new ATOM 1155 N VAL A 78 -15.429 2.323 -13.048 1.00 0.00 N ATOM 1156 CA VAL A 78 -14.782 1.240 -12.317 1.00 0.00 C ATOM 1157 C VAL A 78 -13.453 0.860 -12.960 1.00 0.00 C ATOM 1158 O VAL A 78 -13.421 0.279 -14.044 1.00 0.00 O ATOM 1159 CB VAL A 78 -15.683 -0.008 -12.251 1.00 0.00 C ATOM 1160 CG1 VAL A 78 -14.981 -1.135 -11.509 1.00 0.00 C ATOM 1161 CG2 VAL A 78 -17.012 0.329 -11.591 1.00 0.00 C ATOM 0 H VAL A 78 -15.494 2.173 -14.055 1.00 0.00 H new ATOM 0 HA VAL A 78 -14.602 1.604 -11.305 1.00 0.00 H new ATOM 0 HB VAL A 78 -15.883 -0.344 -13.268 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -15.633 -2.008 -11.472 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -14.058 -1.393 -12.028 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -14.749 -0.813 -10.494 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -17.636 -0.564 -11.553 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -16.834 0.691 -10.578 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -17.519 1.102 -12.168 1.00 0.00 H new ATOM 1171 N GLU A 79 -12.358 1.191 -12.283 1.00 0.00 N ATOM 1172 CA GLU A 79 -11.026 0.885 -12.789 1.00 0.00 C ATOM 1173 C GLU A 79 -10.644 -0.559 -12.475 1.00 0.00 C ATOM 1174 O GLU A 79 -11.034 -1.106 -11.445 1.00 0.00 O ATOM 1175 CB GLU A 79 -9.994 1.840 -12.184 1.00 0.00 C ATOM 1176 CG GLU A 79 -9.781 3.102 -13.002 1.00 0.00 C ATOM 1177 CD GLU A 79 -8.743 4.024 -12.392 1.00 0.00 C ATOM 1178 OE1 GLU A 79 -7.638 3.540 -12.067 1.00 0.00 O ATOM 1179 OE2 GLU A 79 -9.035 5.228 -12.240 1.00 0.00 O ATOM 0 H GLU A 79 -12.368 1.671 -11.383 1.00 0.00 H new ATOM 0 HA GLU A 79 -11.038 1.013 -13.871 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -10.313 2.118 -11.179 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -9.043 1.317 -12.083 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -9.471 2.829 -14.011 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -10.727 3.636 -13.093 1.00 0.00 H new ATOM 1186 N ASN A 80 -9.877 -1.170 -13.373 1.00 0.00 N ATOM 1187 CA ASN A 80 -9.443 -2.551 -13.193 1.00 0.00 C ATOM 1188 C ASN A 80 -7.921 -2.652 -13.236 1.00 0.00 C ATOM 1189 O ASN A 80 -7.305 -2.474 -14.288 1.00 0.00 O ATOM 1190 CB ASN A 80 -10.055 -3.445 -14.273 1.00 0.00 C ATOM 1191 CG ASN A 80 -10.186 -2.734 -15.607 1.00 0.00 C ATOM 1192 OD1 ASN A 80 -10.929 -1.760 -15.733 1.00 0.00 O ATOM 1193 ND2 ASN A 80 -9.463 -3.219 -16.609 1.00 0.00 N ATOM 0 H ASN A 80 -9.544 -0.731 -14.231 1.00 0.00 H new ATOM 0 HA ASN A 80 -9.785 -2.889 -12.215 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -9.437 -4.334 -14.398 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -11.038 -3.783 -13.947 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -9.510 -2.782 -17.530 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -8.861 -4.028 -16.458 1.00 0.00 H new ATOM 1200 N LEU A 81 -7.320 -2.940 -12.087 1.00 0.00 N ATOM 1201 CA LEU A 81 -5.870 -3.066 -11.992 1.00 0.00 C ATOM 1202 C LEU A 81 -5.460 -4.525 -11.825 1.00 0.00 C ATOM 1203 O LEU A 81 -6.227 -5.342 -11.314 1.00 0.00 O ATOM 1204 CB LEU A 81 -5.341 -2.238 -10.820 1.00 0.00 C ATOM 1205 CG LEU A 81 -5.772 -0.771 -10.786 1.00 0.00 C ATOM 1206 CD1 LEU A 81 -5.559 -0.184 -9.400 1.00 0.00 C ATOM 1207 CD2 LEU A 81 -5.010 0.033 -11.830 1.00 0.00 C ATOM 0 H LEU A 81 -7.815 -3.091 -11.208 1.00 0.00 H new ATOM 0 HA LEU A 81 -5.436 -2.690 -12.919 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -5.662 -2.712 -9.892 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -4.252 -2.276 -10.837 1.00 0.00 H new ATOM 0 HG LEU A 81 -6.835 -0.719 -11.021 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.871 0.860 -9.395 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.149 -0.743 -8.674 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.503 -0.248 -9.136 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.329 1.074 -11.792 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -3.941 -0.026 -11.626 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -5.213 -0.373 -12.821 1.00 0.00 H new ATOM 1219 N PHE A 82 -4.245 -4.847 -12.256 1.00 0.00 N ATOM 1220 CA PHE A 82 -3.732 -6.208 -12.152 1.00 0.00 C ATOM 1221 C PHE A 82 -2.302 -6.211 -11.621 1.00 0.00 C ATOM 1222 O PHE A 82 -1.671 -5.161 -11.499 1.00 0.00 O ATOM 1223 CB PHE A 82 -3.783 -6.900 -13.516 1.00 0.00 C ATOM 1224 CG PHE A 82 -5.074 -6.680 -14.252 1.00 0.00 C ATOM 1225 CD1 PHE A 82 -6.150 -7.531 -14.058 1.00 0.00 C ATOM 1226 CD2 PHE A 82 -5.211 -5.623 -15.137 1.00 0.00 C ATOM 1227 CE1 PHE A 82 -7.339 -7.331 -14.735 1.00 0.00 C ATOM 1228 CE2 PHE A 82 -6.397 -5.418 -15.816 1.00 0.00 C ATOM 1229 CZ PHE A 82 -7.463 -6.273 -15.614 1.00 0.00 C ATOM 0 H PHE A 82 -3.597 -4.184 -12.681 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.362 -6.755 -11.451 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.958 -6.538 -14.129 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -3.631 -7.970 -13.377 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -6.059 -8.359 -13.371 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -4.381 -4.951 -15.298 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -8.170 -8.002 -14.576 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.490 -4.590 -16.504 1.00 0.00 H new ATOM 0 HZ PHE A 82 -8.391 -6.114 -16.142 1.00 0.00 H new ATOM 1239 N MET A 83 -1.797 -7.399 -11.306 1.00 0.00 N ATOM 1240 CA MET A 83 -0.441 -7.540 -10.788 1.00 0.00 C ATOM 1241 C MET A 83 0.531 -6.654 -11.561 1.00 0.00 C ATOM 1242 O MET A 83 0.708 -6.815 -12.767 1.00 0.00 O ATOM 1243 CB MET A 83 0.010 -9.000 -10.867 1.00 0.00 C ATOM 1244 CG MET A 83 1.428 -9.227 -10.368 1.00 0.00 C ATOM 1245 SD MET A 83 1.893 -10.969 -10.366 1.00 0.00 S ATOM 1246 CE MET A 83 3.463 -10.898 -9.508 1.00 0.00 C ATOM 0 H MET A 83 -2.306 -8.278 -11.400 1.00 0.00 H new ATOM 0 HA MET A 83 -0.443 -7.224 -9.745 1.00 0.00 H new ATOM 0 HB2 MET A 83 -0.675 -9.615 -10.283 1.00 0.00 H new ATOM 0 HB3 MET A 83 -0.061 -9.338 -11.901 1.00 0.00 H new ATOM 0 HG2 MET A 83 2.123 -8.670 -10.996 1.00 0.00 H new ATOM 0 HG3 MET A 83 1.522 -8.829 -9.358 1.00 0.00 H new ATOM 0 HE1 MET A 83 4.273 -11.076 -10.216 1.00 0.00 H new ATOM 0 HE2 MET A 83 3.586 -9.914 -9.056 1.00 0.00 H new ATOM 0 HE3 MET A 83 3.487 -11.661 -8.730 1.00 0.00 H new ATOM 1256 N GLY A 84 1.159 -5.716 -10.857 1.00 0.00 N ATOM 1257 CA GLY A 84 2.104 -4.818 -11.494 1.00 0.00 C ATOM 1258 C GLY A 84 1.694 -3.364 -11.374 1.00 0.00 C ATOM 1259 O GLY A 84 2.542 -2.475 -11.319 1.00 0.00 O ATOM 0 H GLY A 84 1.030 -5.563 -9.857 1.00 0.00 H new ATOM 0 HA2 GLY A 84 3.088 -4.953 -11.045 1.00 0.00 H new ATOM 0 HA3 GLY A 84 2.196 -5.080 -12.548 1.00 0.00 H new ATOM 1263 N ASN A 85 0.388 -3.121 -11.336 1.00 0.00 N ATOM 1264 CA ASN A 85 -0.134 -1.763 -11.224 1.00 0.00 C ATOM 1265 C ASN A 85 0.093 -1.207 -9.822 1.00 0.00 C ATOM 1266 O ASN A 85 0.348 -1.957 -8.879 1.00 0.00 O ATOM 1267 CB ASN A 85 -1.627 -1.739 -11.559 1.00 0.00 C ATOM 1268 CG ASN A 85 -1.887 -1.862 -13.048 1.00 0.00 C ATOM 1269 OD1 ASN A 85 -2.352 -2.897 -13.525 1.00 0.00 O ATOM 1270 ND2 ASN A 85 -1.586 -0.803 -13.791 1.00 0.00 N ATOM 0 H ASN A 85 -0.328 -3.846 -11.381 1.00 0.00 H new ATOM 0 HA ASN A 85 0.401 -1.135 -11.936 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -2.127 -2.555 -11.037 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -2.064 -0.810 -11.192 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -1.739 -0.827 -14.799 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -1.202 0.035 -13.353 1.00 0.00 H new ATOM 1277 N SER A 86 -0.004 0.112 -9.691 1.00 0.00 N ATOM 1278 CA SER A 86 0.194 0.770 -8.405 1.00 0.00 C ATOM 1279 C SER A 86 -0.899 1.804 -8.150 1.00 0.00 C ATOM 1280 O SER A 86 -1.391 2.446 -9.078 1.00 0.00 O ATOM 1281 CB SER A 86 1.568 1.441 -8.357 1.00 0.00 C ATOM 1282 OG SER A 86 1.728 2.352 -9.430 1.00 0.00 O ATOM 0 H SER A 86 -0.219 0.746 -10.460 1.00 0.00 H new ATOM 0 HA SER A 86 0.141 0.011 -7.625 1.00 0.00 H new ATOM 0 HB2 SER A 86 1.687 1.966 -7.409 1.00 0.00 H new ATOM 0 HB3 SER A 86 2.349 0.682 -8.401 1.00 0.00 H new ATOM 0 HG SER A 86 2.613 2.769 -9.376 1.00 0.00 H new ATOM 1288 N PHE A 87 -1.274 1.960 -6.885 1.00 0.00 N ATOM 1289 CA PHE A 87 -2.309 2.914 -6.506 1.00 0.00 C ATOM 1290 C PHE A 87 -2.092 3.414 -5.080 1.00 0.00 C ATOM 1291 O PHE A 87 -1.452 2.748 -4.268 1.00 0.00 O ATOM 1292 CB PHE A 87 -3.693 2.274 -6.630 1.00 0.00 C ATOM 1293 CG PHE A 87 -3.947 1.195 -5.617 1.00 0.00 C ATOM 1294 CD1 PHE A 87 -4.172 1.513 -4.287 1.00 0.00 C ATOM 1295 CD2 PHE A 87 -3.960 -0.138 -5.994 1.00 0.00 C ATOM 1296 CE1 PHE A 87 -4.405 0.521 -3.353 1.00 0.00 C ATOM 1297 CE2 PHE A 87 -4.193 -1.135 -5.065 1.00 0.00 C ATOM 1298 CZ PHE A 87 -4.417 -0.804 -3.743 1.00 0.00 C ATOM 0 H PHE A 87 -0.876 1.438 -6.104 1.00 0.00 H new ATOM 0 HA PHE A 87 -2.249 3.766 -7.184 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -4.453 3.048 -6.523 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -3.803 1.855 -7.630 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -4.165 2.547 -3.977 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -3.786 -0.402 -7.027 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -4.578 0.782 -2.319 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -4.200 -2.170 -5.372 1.00 0.00 H new ATOM 0 HZ PHE A 87 -4.601 -1.580 -3.015 1.00 0.00 H new ATOM 1308 N GLY A 88 -2.632 4.593 -4.784 1.00 0.00 N ATOM 1309 CA GLY A 88 -2.487 5.162 -3.458 1.00 0.00 C ATOM 1310 C GLY A 88 -2.045 6.612 -3.494 1.00 0.00 C ATOM 1311 O GLY A 88 -2.597 7.417 -4.244 1.00 0.00 O ATOM 0 H GLY A 88 -3.167 5.163 -5.439 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -3.437 5.088 -2.928 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -1.761 4.578 -2.893 1.00 0.00 H new ATOM 1315 N ILE A 89 -1.047 6.945 -2.682 1.00 0.00 N ATOM 1316 CA ILE A 89 -0.532 8.308 -2.625 1.00 0.00 C ATOM 1317 C ILE A 89 0.573 8.521 -3.653 1.00 0.00 C ATOM 1318 O ILE A 89 0.867 7.637 -4.459 1.00 0.00 O ATOM 1319 CB ILE A 89 0.013 8.645 -1.225 1.00 0.00 C ATOM 1320 CG1 ILE A 89 1.184 7.726 -0.874 1.00 0.00 C ATOM 1321 CG2 ILE A 89 -1.091 8.526 -0.184 1.00 0.00 C ATOM 1322 CD1 ILE A 89 2.056 8.256 0.242 1.00 0.00 C ATOM 0 H ILE A 89 -0.579 6.290 -2.055 1.00 0.00 H new ATOM 0 HA ILE A 89 -1.367 8.971 -2.850 1.00 0.00 H new ATOM 0 HB ILE A 89 0.372 9.674 -1.230 1.00 0.00 H new ATOM 0 HG12 ILE A 89 0.795 6.749 -0.587 1.00 0.00 H new ATOM 0 HG13 ILE A 89 1.797 7.577 -1.763 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -0.690 8.767 0.801 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.897 9.218 -0.427 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.478 7.507 -0.179 1.00 0.00 H new ATOM 0 HD11 ILE A 89 2.865 7.552 0.437 1.00 0.00 H new ATOM 0 HD12 ILE A 89 2.475 9.219 -0.050 1.00 0.00 H new ATOM 0 HD13 ILE A 89 1.457 8.379 1.145 1.00 0.00 H new ATOM 1334 N THR A 90 1.185 9.701 -3.620 1.00 0.00 N ATOM 1335 CA THR A 90 2.259 10.031 -4.548 1.00 0.00 C ATOM 1336 C THR A 90 3.580 10.227 -3.814 1.00 0.00 C ATOM 1337 O THR A 90 3.618 10.459 -2.605 1.00 0.00 O ATOM 1338 CB THR A 90 1.937 11.307 -5.349 1.00 0.00 C ATOM 1339 OG1 THR A 90 1.110 12.179 -4.570 1.00 0.00 O ATOM 1340 CG2 THR A 90 1.232 10.964 -6.653 1.00 0.00 C ATOM 0 H THR A 90 0.955 10.444 -2.960 1.00 0.00 H new ATOM 0 HA THR A 90 2.350 9.191 -5.236 1.00 0.00 H new ATOM 0 HB THR A 90 2.876 11.809 -5.582 1.00 0.00 H new ATOM 0 HG1 THR A 90 0.168 12.011 -4.781 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.015 11.881 -7.201 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.875 10.324 -7.257 1.00 0.00 H new ATOM 0 HG23 THR A 90 0.300 10.441 -6.436 1.00 0.00 H new ATOM 1348 N PRO A 91 4.692 10.132 -4.558 1.00 0.00 N ATOM 1349 CA PRO A 91 6.036 10.296 -3.998 1.00 0.00 C ATOM 1350 C PRO A 91 6.319 11.736 -3.583 1.00 0.00 C ATOM 1351 O PRO A 91 7.419 12.059 -3.132 1.00 0.00 O ATOM 1352 CB PRO A 91 6.954 9.882 -5.150 1.00 0.00 C ATOM 1353 CG PRO A 91 6.152 10.129 -6.381 1.00 0.00 C ATOM 1354 CD PRO A 91 4.722 9.857 -6.005 1.00 0.00 C ATOM 0 HA PRO A 91 6.174 9.706 -3.092 1.00 0.00 H new ATOM 0 HB2 PRO A 91 7.874 10.467 -5.153 1.00 0.00 H new ATOM 0 HB3 PRO A 91 7.243 8.834 -5.069 1.00 0.00 H new ATOM 0 HG2 PRO A 91 6.276 11.155 -6.728 1.00 0.00 H new ATOM 0 HG3 PRO A 91 6.473 9.477 -7.193 1.00 0.00 H new ATOM 0 HD2 PRO A 91 4.033 10.502 -6.551 1.00 0.00 H new ATOM 0 HD3 PRO A 91 4.437 8.828 -6.225 1.00 0.00 H new ATOM 1362 N THR A 92 5.320 12.599 -3.736 1.00 0.00 N ATOM 1363 CA THR A 92 5.461 14.004 -3.378 1.00 0.00 C ATOM 1364 C THR A 92 4.758 14.310 -2.061 1.00 0.00 C ATOM 1365 O THR A 92 3.630 13.872 -1.831 1.00 0.00 O ATOM 1366 CB THR A 92 4.893 14.924 -4.476 1.00 0.00 C ATOM 1367 OG1 THR A 92 3.465 14.822 -4.509 1.00 0.00 O ATOM 1368 CG2 THR A 92 5.464 14.558 -5.837 1.00 0.00 C ATOM 0 H THR A 92 4.403 12.349 -4.106 1.00 0.00 H new ATOM 0 HA THR A 92 6.528 14.196 -3.270 1.00 0.00 H new ATOM 0 HB THR A 92 5.179 15.950 -4.244 1.00 0.00 H new ATOM 0 HG1 THR A 92 3.111 15.411 -5.208 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.049 15.221 -6.596 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.549 14.664 -5.817 1.00 0.00 H new ATOM 0 HG23 THR A 92 5.205 13.526 -6.075 1.00 0.00 H new ATOM 1376 N LEU A 93 5.430 15.064 -1.198 1.00 0.00 N ATOM 1377 CA LEU A 93 4.869 15.429 0.098 1.00 0.00 C ATOM 1378 C LEU A 93 3.394 15.797 -0.031 1.00 0.00 C ATOM 1379 O LEU A 93 2.627 15.673 0.923 1.00 0.00 O ATOM 1380 CB LEU A 93 5.648 16.599 0.702 1.00 0.00 C ATOM 1381 CG LEU A 93 7.065 16.285 1.182 1.00 0.00 C ATOM 1382 CD1 LEU A 93 7.587 17.402 2.072 1.00 0.00 C ATOM 1383 CD2 LEU A 93 7.097 14.954 1.919 1.00 0.00 C ATOM 0 H LEU A 93 6.364 15.435 -1.372 1.00 0.00 H new ATOM 0 HA LEU A 93 4.952 14.566 0.758 1.00 0.00 H new ATOM 0 HB2 LEU A 93 5.706 17.394 -0.042 1.00 0.00 H new ATOM 0 HB3 LEU A 93 5.079 16.992 1.545 1.00 0.00 H new ATOM 0 HG LEU A 93 7.714 16.210 0.310 1.00 0.00 H new ATOM 0 HD11 LEU A 93 8.597 17.161 2.404 1.00 0.00 H new ATOM 0 HD12 LEU A 93 7.603 18.337 1.511 1.00 0.00 H new ATOM 0 HD13 LEU A 93 6.936 17.510 2.940 1.00 0.00 H new ATOM 0 HD21 LEU A 93 8.114 14.747 2.253 1.00 0.00 H new ATOM 0 HD22 LEU A 93 6.434 15.000 2.783 1.00 0.00 H new ATOM 0 HD23 LEU A 93 6.767 14.160 1.250 1.00 0.00 H new ATOM 1395 N ASP A 94 3.005 16.249 -1.218 1.00 0.00 N ATOM 1396 CA ASP A 94 1.622 16.633 -1.474 1.00 0.00 C ATOM 1397 C ASP A 94 0.659 15.564 -0.968 1.00 0.00 C ATOM 1398 O ASP A 94 0.842 14.374 -1.227 1.00 0.00 O ATOM 1399 CB ASP A 94 1.403 16.866 -2.970 1.00 0.00 C ATOM 1400 CG ASP A 94 2.226 18.023 -3.502 1.00 0.00 C ATOM 1401 OD1 ASP A 94 3.339 18.247 -2.982 1.00 0.00 O ATOM 1402 OD2 ASP A 94 1.757 18.706 -4.437 1.00 0.00 O ATOM 0 H ASP A 94 3.628 16.358 -2.018 1.00 0.00 H new ATOM 0 HA ASP A 94 1.423 17.560 -0.937 1.00 0.00 H new ATOM 0 HB2 ASP A 94 1.660 15.959 -3.517 1.00 0.00 H new ATOM 0 HB3 ASP A 94 0.346 17.061 -3.154 1.00 0.00 H new ATOM 1407 N LYS A 95 -0.368 15.995 -0.243 1.00 0.00 N ATOM 1408 CA LYS A 95 -1.361 15.076 0.301 1.00 0.00 C ATOM 1409 C LYS A 95 -2.540 14.922 -0.654 1.00 0.00 C ATOM 1410 O LYS A 95 -2.909 15.863 -1.355 1.00 0.00 O ATOM 1411 CB LYS A 95 -1.855 15.573 1.661 1.00 0.00 C ATOM 1412 CG LYS A 95 -0.827 15.430 2.771 1.00 0.00 C ATOM 1413 CD LYS A 95 -0.905 16.585 3.755 1.00 0.00 C ATOM 1414 CE LYS A 95 -2.124 16.468 4.657 1.00 0.00 C ATOM 1415 NZ LYS A 95 -3.347 17.021 4.011 1.00 0.00 N ATOM 0 H LYS A 95 -0.534 16.976 -0.018 1.00 0.00 H new ATOM 0 HA LYS A 95 -0.888 14.102 0.427 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -2.140 16.622 1.574 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -2.754 15.021 1.936 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -0.988 14.490 3.299 1.00 0.00 H new ATOM 0 HG3 LYS A 95 0.173 15.386 2.339 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -0.001 16.607 4.364 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -0.944 17.527 3.209 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -2.289 15.421 4.911 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -1.936 16.997 5.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -4.023 17.317 4.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -3.090 17.842 3.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -3.783 16.292 3.412 1.00 0.00 H new ATOM 1429 N GLN A 96 -3.126 13.729 -0.675 1.00 0.00 N ATOM 1430 CA GLN A 96 -4.264 13.453 -1.544 1.00 0.00 C ATOM 1431 C GLN A 96 -5.339 12.667 -0.801 1.00 0.00 C ATOM 1432 O GLN A 96 -5.081 12.090 0.256 1.00 0.00 O ATOM 1433 CB GLN A 96 -3.811 12.676 -2.782 1.00 0.00 C ATOM 1434 CG GLN A 96 -2.654 11.726 -2.514 1.00 0.00 C ATOM 1435 CD GLN A 96 -1.302 12.381 -2.719 1.00 0.00 C ATOM 1436 OE1 GLN A 96 -1.051 13.005 -3.750 1.00 0.00 O ATOM 1437 NE2 GLN A 96 -0.422 12.244 -1.734 1.00 0.00 N ATOM 0 H GLN A 96 -2.832 12.939 -0.101 1.00 0.00 H new ATOM 0 HA GLN A 96 -4.689 14.407 -1.857 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -4.655 12.107 -3.172 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -3.517 13.383 -3.558 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -2.723 11.355 -1.491 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -2.738 10.862 -3.173 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -0.672 11.718 -0.896 1.00 0.00 H new ATOM 0 HE22 GLN A 96 0.504 12.665 -1.815 1.00 0.00 H new ATOM 1446 N TYR A 97 -6.544 12.648 -1.360 1.00 0.00 N ATOM 1447 CA TYR A 97 -7.659 11.935 -0.748 1.00 0.00 C ATOM 1448 C TYR A 97 -8.300 10.971 -1.742 1.00 0.00 C ATOM 1449 O TYR A 97 -8.454 11.289 -2.921 1.00 0.00 O ATOM 1450 CB TYR A 97 -8.704 12.925 -0.234 1.00 0.00 C ATOM 1451 CG TYR A 97 -8.201 13.813 0.882 1.00 0.00 C ATOM 1452 CD1 TYR A 97 -7.317 14.853 0.623 1.00 0.00 C ATOM 1453 CD2 TYR A 97 -8.608 13.611 2.195 1.00 0.00 C ATOM 1454 CE1 TYR A 97 -6.853 15.666 1.639 1.00 0.00 C ATOM 1455 CE2 TYR A 97 -8.151 14.419 3.217 1.00 0.00 C ATOM 1456 CZ TYR A 97 -7.274 15.445 2.934 1.00 0.00 C ATOM 1457 OH TYR A 97 -6.815 16.253 3.950 1.00 0.00 O ATOM 0 H TYR A 97 -6.774 13.118 -2.236 1.00 0.00 H new ATOM 0 HA TYR A 97 -7.272 11.358 0.092 1.00 0.00 H new ATOM 0 HB2 TYR A 97 -9.038 13.550 -1.062 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -9.574 12.371 0.118 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -6.987 15.029 -0.390 1.00 0.00 H new ATOM 0 HD2 TYR A 97 -9.294 12.808 2.420 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -6.165 16.469 1.421 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -8.478 14.249 4.232 1.00 0.00 H new ATOM 0 HH TYR A 97 -7.208 15.965 4.800 1.00 0.00 H new ATOM 1467 N MET A 98 -8.672 9.791 -1.256 1.00 0.00 N ATOM 1468 CA MET A 98 -9.299 8.781 -2.101 1.00 0.00 C ATOM 1469 C MET A 98 -10.588 9.313 -2.720 1.00 0.00 C ATOM 1470 O MET A 98 -11.443 9.860 -2.023 1.00 0.00 O ATOM 1471 CB MET A 98 -9.593 7.518 -1.289 1.00 0.00 C ATOM 1472 CG MET A 98 -9.668 6.256 -2.134 1.00 0.00 C ATOM 1473 SD MET A 98 -8.173 5.979 -3.102 1.00 0.00 S ATOM 1474 CE MET A 98 -8.813 4.962 -4.430 1.00 0.00 C ATOM 0 H MET A 98 -8.550 9.511 -0.283 1.00 0.00 H new ATOM 0 HA MET A 98 -8.606 8.535 -2.905 1.00 0.00 H new ATOM 0 HB2 MET A 98 -8.818 7.394 -0.533 1.00 0.00 H new ATOM 0 HB3 MET A 98 -10.537 7.648 -0.760 1.00 0.00 H new ATOM 0 HG2 MET A 98 -9.840 5.398 -1.484 1.00 0.00 H new ATOM 0 HG3 MET A 98 -10.524 6.323 -2.806 1.00 0.00 H new ATOM 0 HE1 MET A 98 -8.036 4.279 -4.772 1.00 0.00 H new ATOM 0 HE2 MET A 98 -9.667 4.389 -4.070 1.00 0.00 H new ATOM 0 HE3 MET A 98 -9.126 5.599 -5.257 1.00 0.00 H new ATOM 1484 N HIS A 99 -10.720 9.149 -4.032 1.00 0.00 N ATOM 1485 CA HIS A 99 -11.905 9.613 -4.745 1.00 0.00 C ATOM 1486 C HIS A 99 -12.786 8.437 -5.156 1.00 0.00 C ATOM 1487 O HIS A 99 -13.506 8.507 -6.152 1.00 0.00 O ATOM 1488 CB HIS A 99 -11.501 10.419 -5.980 1.00 0.00 C ATOM 1489 CG HIS A 99 -11.237 11.865 -5.692 1.00 0.00 C ATOM 1490 ND1 HIS A 99 -12.179 12.854 -5.883 1.00 0.00 N ATOM 1491 CD2 HIS A 99 -10.131 12.487 -5.221 1.00 0.00 C ATOM 1492 CE1 HIS A 99 -11.662 14.022 -5.545 1.00 0.00 C ATOM 1493 NE2 HIS A 99 -10.420 13.826 -5.139 1.00 0.00 N ATOM 0 H HIS A 99 -10.021 8.698 -4.623 1.00 0.00 H new ATOM 0 HA HIS A 99 -12.475 10.255 -4.073 1.00 0.00 H new ATOM 0 HB2 HIS A 99 -10.607 9.975 -6.417 1.00 0.00 H new ATOM 0 HB3 HIS A 99 -12.291 10.344 -6.727 1.00 0.00 H new ATOM 0 HD2 HIS A 99 -9.195 12.017 -4.958 1.00 0.00 H new ATOM 0 HE1 HIS A 99 -12.168 14.975 -5.592 1.00 0.00 H new ATOM 0 HE2 HIS A 99 -9.780 14.552 -4.817 1.00 0.00 H new ATOM 1502 N GLY A 100 -12.724 7.358 -4.383 1.00 0.00 N ATOM 1503 CA GLY A 100 -13.520 6.182 -4.684 1.00 0.00 C ATOM 1504 C GLY A 100 -13.402 5.113 -3.616 1.00 0.00 C ATOM 1505 O GLY A 100 -13.072 5.408 -2.467 1.00 0.00 O ATOM 0 H GLY A 100 -12.137 7.277 -3.553 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -14.565 6.472 -4.789 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -13.205 5.770 -5.643 1.00 0.00 H new ATOM 1509 N ILE A 101 -13.674 3.869 -3.995 1.00 0.00 N ATOM 1510 CA ILE A 101 -13.596 2.752 -3.061 1.00 0.00 C ATOM 1511 C ILE A 101 -12.893 1.555 -3.692 1.00 0.00 C ATOM 1512 O ILE A 101 -13.341 1.022 -4.707 1.00 0.00 O ATOM 1513 CB ILE A 101 -14.995 2.319 -2.584 1.00 0.00 C ATOM 1514 CG1 ILE A 101 -15.668 3.454 -1.809 1.00 0.00 C ATOM 1515 CG2 ILE A 101 -14.898 1.068 -1.725 1.00 0.00 C ATOM 1516 CD1 ILE A 101 -17.179 3.375 -1.812 1.00 0.00 C ATOM 0 H ILE A 101 -13.950 3.609 -4.942 1.00 0.00 H new ATOM 0 HA ILE A 101 -13.019 3.098 -2.203 1.00 0.00 H new ATOM 0 HB ILE A 101 -15.605 2.090 -3.457 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -15.314 3.439 -0.778 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -15.361 4.408 -2.238 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -15.895 0.775 -1.396 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -14.456 0.260 -2.308 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -14.274 1.272 -0.855 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -17.588 4.211 -1.244 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -17.544 3.420 -2.838 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -17.495 2.437 -1.356 1.00 0.00 H new ATOM 1528 N VAL A 102 -11.789 1.136 -3.082 1.00 0.00 N ATOM 1529 CA VAL A 102 -11.025 -0.001 -3.581 1.00 0.00 C ATOM 1530 C VAL A 102 -11.501 -1.304 -2.950 1.00 0.00 C ATOM 1531 O VAL A 102 -11.747 -1.368 -1.745 1.00 0.00 O ATOM 1532 CB VAL A 102 -9.519 0.171 -3.305 1.00 0.00 C ATOM 1533 CG1 VAL A 102 -8.712 -0.850 -4.094 1.00 0.00 C ATOM 1534 CG2 VAL A 102 -9.074 1.587 -3.639 1.00 0.00 C ATOM 0 H VAL A 102 -11.404 1.567 -2.242 1.00 0.00 H new ATOM 0 HA VAL A 102 -11.187 -0.043 -4.658 1.00 0.00 H new ATOM 0 HB VAL A 102 -9.340 -0.001 -2.244 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -7.651 -0.714 -3.887 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -9.013 -1.856 -3.801 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -8.894 -0.713 -5.160 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -8.008 1.690 -3.438 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -9.266 1.790 -4.693 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -9.629 2.297 -3.026 1.00 0.00 H new ATOM 1544 N ARG A 103 -11.628 -2.341 -3.770 1.00 0.00 N ATOM 1545 CA ARG A 103 -12.075 -3.644 -3.292 1.00 0.00 C ATOM 1546 C ARG A 103 -11.475 -4.767 -4.132 1.00 0.00 C ATOM 1547 O ARG A 103 -11.518 -4.730 -5.362 1.00 0.00 O ATOM 1548 CB ARG A 103 -13.602 -3.727 -3.327 1.00 0.00 C ATOM 1549 CG ARG A 103 -14.276 -3.066 -2.136 1.00 0.00 C ATOM 1550 CD ARG A 103 -15.700 -3.568 -1.952 1.00 0.00 C ATOM 1551 NE ARG A 103 -16.663 -2.770 -2.706 1.00 0.00 N ATOM 1552 CZ ARG A 103 -17.972 -2.997 -2.697 1.00 0.00 C ATOM 1553 NH1 ARG A 103 -18.471 -3.992 -1.976 1.00 0.00 N ATOM 1554 NH2 ARG A 103 -18.785 -2.227 -3.409 1.00 0.00 N ATOM 0 H ARG A 103 -11.428 -2.305 -4.769 1.00 0.00 H new ATOM 0 HA ARG A 103 -11.734 -3.762 -2.263 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -13.962 -3.259 -4.243 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -13.900 -4.775 -3.366 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -13.699 -3.266 -1.233 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -14.285 -1.985 -2.276 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -15.762 -4.608 -2.272 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -15.959 -3.544 -0.893 1.00 0.00 H new ATOM 0 HE ARG A 103 -16.312 -1.996 -3.270 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -17.849 -4.585 -1.426 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -19.476 -4.164 -1.971 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -18.405 -1.460 -3.964 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -19.790 -2.402 -3.401 1.00 0.00 H new ATOM 1568 N THR A 104 -10.913 -5.767 -3.459 1.00 0.00 N ATOM 1569 CA THR A 104 -10.302 -6.900 -4.142 1.00 0.00 C ATOM 1570 C THR A 104 -11.345 -7.711 -4.904 1.00 0.00 C ATOM 1571 O THR A 104 -12.540 -7.630 -4.617 1.00 0.00 O ATOM 1572 CB THR A 104 -9.572 -7.826 -3.152 1.00 0.00 C ATOM 1573 OG1 THR A 104 -10.486 -8.296 -2.155 1.00 0.00 O ATOM 1574 CG2 THR A 104 -8.414 -7.099 -2.484 1.00 0.00 C ATOM 0 H THR A 104 -10.869 -5.815 -2.441 1.00 0.00 H new ATOM 0 HA THR A 104 -9.578 -6.491 -4.847 1.00 0.00 H new ATOM 0 HB THR A 104 -9.175 -8.675 -3.708 1.00 0.00 H new ATOM 0 HG1 THR A 104 -10.014 -8.886 -1.530 1.00 0.00 H new ATOM 0 HG21 THR A 104 -7.913 -7.773 -1.789 1.00 0.00 H new ATOM 0 HG22 THR A 104 -7.705 -6.769 -3.243 1.00 0.00 H new ATOM 0 HG23 THR A 104 -8.793 -6.233 -1.940 1.00 0.00 H new ATOM 1582 N LYS A 105 -10.887 -8.492 -5.875 1.00 0.00 N ATOM 1583 CA LYS A 105 -11.779 -9.320 -6.678 1.00 0.00 C ATOM 1584 C LYS A 105 -11.566 -10.800 -6.376 1.00 0.00 C ATOM 1585 O LYS A 105 -12.461 -11.621 -6.582 1.00 0.00 O ATOM 1586 CB LYS A 105 -11.553 -9.054 -8.168 1.00 0.00 C ATOM 1587 CG LYS A 105 -12.217 -7.782 -8.667 1.00 0.00 C ATOM 1588 CD LYS A 105 -12.692 -7.928 -10.102 1.00 0.00 C ATOM 1589 CE LYS A 105 -11.594 -7.574 -11.092 1.00 0.00 C ATOM 1590 NZ LYS A 105 -12.148 -7.116 -12.396 1.00 0.00 N ATOM 0 H LYS A 105 -9.901 -8.569 -6.126 1.00 0.00 H new ATOM 0 HA LYS A 105 -12.806 -9.059 -6.421 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -10.482 -8.994 -8.359 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -11.932 -9.900 -8.741 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -13.064 -7.537 -8.026 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -11.514 -6.952 -8.598 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -13.022 -8.952 -10.274 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -13.555 -7.283 -10.268 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -10.964 -6.791 -10.670 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -10.957 -8.444 -11.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -11.367 -6.884 -13.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -12.729 -7.872 -12.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -12.735 -6.271 -12.246 1.00 0.00 H new ATOM 1604 N VAL A 106 -10.377 -11.134 -5.887 1.00 0.00 N ATOM 1605 CA VAL A 106 -10.048 -12.515 -5.554 1.00 0.00 C ATOM 1606 C VAL A 106 -9.436 -12.615 -4.161 1.00 0.00 C ATOM 1607 O VAL A 106 -9.330 -11.618 -3.446 1.00 0.00 O ATOM 1608 CB VAL A 106 -9.068 -13.121 -6.577 1.00 0.00 C ATOM 1609 CG1 VAL A 106 -9.670 -13.092 -7.974 1.00 0.00 C ATOM 1610 CG2 VAL A 106 -7.740 -12.380 -6.545 1.00 0.00 C ATOM 0 H VAL A 106 -9.625 -10.467 -5.712 1.00 0.00 H new ATOM 0 HA VAL A 106 -10.982 -13.077 -5.578 1.00 0.00 H new ATOM 0 HB VAL A 106 -8.885 -14.161 -6.307 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -8.964 -13.524 -8.683 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -10.594 -13.670 -7.984 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -9.884 -12.061 -8.257 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -7.060 -12.821 -7.274 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -7.903 -11.330 -6.790 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -7.304 -12.457 -5.549 1.00 0.00 H new ATOM 1620 N ASP A 107 -9.034 -13.823 -3.783 1.00 0.00 N ATOM 1621 CA ASP A 107 -8.431 -14.053 -2.475 1.00 0.00 C ATOM 1622 C ASP A 107 -6.921 -14.229 -2.597 1.00 0.00 C ATOM 1623 O ASP A 107 -6.379 -14.282 -3.701 1.00 0.00 O ATOM 1624 CB ASP A 107 -9.049 -15.286 -1.814 1.00 0.00 C ATOM 1625 CG ASP A 107 -9.122 -16.472 -2.756 1.00 0.00 C ATOM 1626 OD1 ASP A 107 -8.080 -17.128 -2.965 1.00 0.00 O ATOM 1627 OD2 ASP A 107 -10.220 -16.745 -3.284 1.00 0.00 O ATOM 0 H ASP A 107 -9.115 -14.658 -4.363 1.00 0.00 H new ATOM 0 HA ASP A 107 -8.628 -13.180 -1.853 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -8.461 -15.558 -0.937 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -10.052 -15.042 -1.463 1.00 0.00 H new ATOM 1632 N ASP A 108 -6.247 -14.319 -1.455 1.00 0.00 N ATOM 1633 CA ASP A 108 -4.799 -14.489 -1.434 1.00 0.00 C ATOM 1634 C ASP A 108 -4.102 -13.307 -2.101 1.00 0.00 C ATOM 1635 O ASP A 108 -2.986 -13.435 -2.605 1.00 0.00 O ATOM 1636 CB ASP A 108 -4.406 -15.790 -2.135 1.00 0.00 C ATOM 1637 CG ASP A 108 -4.927 -17.017 -1.413 1.00 0.00 C ATOM 1638 OD1 ASP A 108 -6.146 -17.079 -1.151 1.00 0.00 O ATOM 1639 OD2 ASP A 108 -4.114 -17.916 -1.110 1.00 0.00 O ATOM 0 H ASP A 108 -6.680 -14.277 -0.533 1.00 0.00 H new ATOM 0 HA ASP A 108 -4.480 -14.535 -0.393 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.792 -15.781 -3.154 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -3.320 -15.847 -2.206 1.00 0.00 H new ATOM 1644 N CYS A 109 -4.769 -12.158 -2.101 1.00 0.00 N ATOM 1645 CA CYS A 109 -4.215 -10.953 -2.708 1.00 0.00 C ATOM 1646 C CYS A 109 -3.086 -10.384 -1.856 1.00 0.00 C ATOM 1647 O CYS A 109 -3.232 -10.220 -0.645 1.00 0.00 O ATOM 1648 CB CYS A 109 -5.310 -9.901 -2.894 1.00 0.00 C ATOM 1649 SG CYS A 109 -6.336 -10.154 -4.361 1.00 0.00 S ATOM 0 H CYS A 109 -5.693 -12.036 -1.688 1.00 0.00 H new ATOM 0 HA CYS A 109 -3.809 -11.221 -3.683 1.00 0.00 H new ATOM 0 HB2 CYS A 109 -5.950 -9.899 -2.012 1.00 0.00 H new ATOM 0 HB3 CYS A 109 -4.846 -8.916 -2.954 1.00 0.00 H new ATOM 0 HG CYS A 109 -7.460 -10.707 -4.014 1.00 0.00 H new ATOM 1655 N GLN A 110 -1.959 -10.088 -2.496 1.00 0.00 N ATOM 1656 CA GLN A 110 -0.804 -9.540 -1.795 1.00 0.00 C ATOM 1657 C GLN A 110 -0.676 -8.041 -2.045 1.00 0.00 C ATOM 1658 O GLN A 110 -0.832 -7.574 -3.174 1.00 0.00 O ATOM 1659 CB GLN A 110 0.474 -10.254 -2.239 1.00 0.00 C ATOM 1660 CG GLN A 110 0.652 -11.628 -1.612 1.00 0.00 C ATOM 1661 CD GLN A 110 1.681 -12.471 -2.338 1.00 0.00 C ATOM 1662 OE1 GLN A 110 2.540 -11.948 -3.049 1.00 0.00 O ATOM 1663 NE2 GLN A 110 1.601 -13.785 -2.162 1.00 0.00 N ATOM 0 H GLN A 110 -1.821 -10.218 -3.498 1.00 0.00 H new ATOM 0 HA GLN A 110 -0.949 -9.700 -0.727 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.464 -10.357 -3.324 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.334 -9.634 -1.985 1.00 0.00 H new ATOM 0 HG2 GLN A 110 0.952 -11.512 -0.571 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -0.305 -12.150 -1.612 1.00 0.00 H new ATOM 0 HE21 GLN A 110 0.873 -14.176 -1.564 1.00 0.00 H new ATOM 0 HE22 GLN A 110 2.268 -14.403 -2.625 1.00 0.00 H new ATOM 1672 N PHE A 111 -0.392 -7.291 -0.985 1.00 0.00 N ATOM 1673 CA PHE A 111 -0.244 -5.844 -1.090 1.00 0.00 C ATOM 1674 C PHE A 111 0.892 -5.348 -0.200 1.00 0.00 C ATOM 1675 O PHE A 111 1.383 -6.075 0.663 1.00 0.00 O ATOM 1676 CB PHE A 111 -1.550 -5.148 -0.704 1.00 0.00 C ATOM 1677 CG PHE A 111 -2.726 -5.575 -1.536 1.00 0.00 C ATOM 1678 CD1 PHE A 111 -2.880 -5.110 -2.832 1.00 0.00 C ATOM 1679 CD2 PHE A 111 -3.676 -6.443 -1.022 1.00 0.00 C ATOM 1680 CE1 PHE A 111 -3.961 -5.501 -3.599 1.00 0.00 C ATOM 1681 CE2 PHE A 111 -4.759 -6.838 -1.785 1.00 0.00 C ATOM 1682 CZ PHE A 111 -4.901 -6.367 -3.076 1.00 0.00 C ATOM 0 H PHE A 111 -0.260 -7.661 -0.044 1.00 0.00 H new ATOM 0 HA PHE A 111 -0.003 -5.602 -2.125 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -1.764 -5.351 0.345 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -1.420 -4.070 -0.800 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -2.147 -4.434 -3.247 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -3.569 -6.815 -0.014 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -4.071 -5.129 -4.607 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -5.493 -7.514 -1.372 1.00 0.00 H new ATOM 0 HZ PHE A 111 -5.745 -6.675 -3.675 1.00 0.00 H new ATOM 1692 N VAL A 112 1.306 -4.104 -0.418 1.00 0.00 N ATOM 1693 CA VAL A 112 2.384 -3.509 0.363 1.00 0.00 C ATOM 1694 C VAL A 112 2.105 -2.038 0.653 1.00 0.00 C ATOM 1695 O VAL A 112 1.604 -1.310 -0.205 1.00 0.00 O ATOM 1696 CB VAL A 112 3.736 -3.630 -0.363 1.00 0.00 C ATOM 1697 CG1 VAL A 112 3.680 -2.937 -1.716 1.00 0.00 C ATOM 1698 CG2 VAL A 112 4.854 -3.054 0.494 1.00 0.00 C ATOM 0 H VAL A 112 0.911 -3.489 -1.129 1.00 0.00 H new ATOM 0 HA VAL A 112 2.435 -4.059 1.303 1.00 0.00 H new ATOM 0 HB VAL A 112 3.945 -4.686 -0.531 1.00 0.00 H new ATOM 0 HG11 VAL A 112 4.645 -3.033 -2.214 1.00 0.00 H new ATOM 0 HG12 VAL A 112 2.907 -3.399 -2.330 1.00 0.00 H new ATOM 0 HG13 VAL A 112 3.448 -1.881 -1.575 1.00 0.00 H new ATOM 0 HG21 VAL A 112 5.803 -3.148 -0.034 1.00 0.00 H new ATOM 0 HG22 VAL A 112 4.653 -2.002 0.695 1.00 0.00 H new ATOM 0 HG23 VAL A 112 4.908 -3.599 1.436 1.00 0.00 H new ATOM 1708 N CYS A 113 2.432 -1.608 1.867 1.00 0.00 N ATOM 1709 CA CYS A 113 2.216 -0.223 2.271 1.00 0.00 C ATOM 1710 C CYS A 113 3.545 0.489 2.502 1.00 0.00 C ATOM 1711 O CYS A 113 4.483 -0.089 3.051 1.00 0.00 O ATOM 1712 CB CYS A 113 1.366 -0.167 3.541 1.00 0.00 C ATOM 1713 SG CYS A 113 -0.414 -0.084 3.235 1.00 0.00 S ATOM 0 H CYS A 113 2.847 -2.198 2.588 1.00 0.00 H new ATOM 0 HA CYS A 113 1.687 0.286 1.466 1.00 0.00 H new ATOM 0 HB2 CYS A 113 1.579 -1.048 4.147 1.00 0.00 H new ATOM 0 HB3 CYS A 113 1.664 0.703 4.127 1.00 0.00 H new ATOM 0 HG CYS A 113 -0.626 0.283 2.006 1.00 0.00 H new ATOM 1719 N ILE A 114 3.618 1.746 2.077 1.00 0.00 N ATOM 1720 CA ILE A 114 4.832 2.536 2.237 1.00 0.00 C ATOM 1721 C ILE A 114 4.507 3.964 2.662 1.00 0.00 C ATOM 1722 O ILE A 114 3.733 4.657 2.002 1.00 0.00 O ATOM 1723 CB ILE A 114 5.655 2.575 0.935 1.00 0.00 C ATOM 1724 CG1 ILE A 114 6.323 1.221 0.688 1.00 0.00 C ATOM 1725 CG2 ILE A 114 6.696 3.682 0.999 1.00 0.00 C ATOM 1726 CD1 ILE A 114 6.602 0.941 -0.772 1.00 0.00 C ATOM 0 H ILE A 114 2.851 2.239 1.620 1.00 0.00 H new ATOM 0 HA ILE A 114 5.422 2.053 3.016 1.00 0.00 H new ATOM 0 HB ILE A 114 4.982 2.784 0.103 1.00 0.00 H new ATOM 0 HG12 ILE A 114 7.261 1.181 1.243 1.00 0.00 H new ATOM 0 HG13 ILE A 114 5.684 0.432 1.085 1.00 0.00 H new ATOM 0 HG21 ILE A 114 7.269 3.697 0.072 1.00 0.00 H new ATOM 0 HG22 ILE A 114 6.198 4.642 1.133 1.00 0.00 H new ATOM 0 HG23 ILE A 114 7.368 3.502 1.838 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.076 -0.036 -0.871 1.00 0.00 H new ATOM 0 HD12 ILE A 114 5.665 0.948 -1.329 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.266 1.709 -1.169 1.00 0.00 H new ATOM 1738 N ALA A 115 5.105 4.398 3.767 1.00 0.00 N ATOM 1739 CA ALA A 115 4.882 5.745 4.277 1.00 0.00 C ATOM 1740 C ALA A 115 5.166 6.792 3.206 1.00 0.00 C ATOM 1741 O ALA A 115 5.892 6.531 2.248 1.00 0.00 O ATOM 1742 CB ALA A 115 5.746 5.993 5.504 1.00 0.00 C ATOM 0 H ALA A 115 5.747 3.836 4.326 1.00 0.00 H new ATOM 0 HA ALA A 115 3.833 5.831 4.561 1.00 0.00 H new ATOM 0 HB1 ALA A 115 5.570 7.003 5.875 1.00 0.00 H new ATOM 0 HB2 ALA A 115 5.491 5.272 6.280 1.00 0.00 H new ATOM 0 HB3 ALA A 115 6.797 5.883 5.237 1.00 0.00 H new ATOM 1748 N GLN A 116 4.589 7.977 3.376 1.00 0.00 N ATOM 1749 CA GLN A 116 4.780 9.063 2.422 1.00 0.00 C ATOM 1750 C GLN A 116 6.164 9.685 2.575 1.00 0.00 C ATOM 1751 O GLN A 116 6.923 9.776 1.610 1.00 0.00 O ATOM 1752 CB GLN A 116 3.703 10.133 2.613 1.00 0.00 C ATOM 1753 CG GLN A 116 4.080 11.486 2.032 1.00 0.00 C ATOM 1754 CD GLN A 116 2.871 12.347 1.726 1.00 0.00 C ATOM 1755 OE1 GLN A 116 2.085 12.673 2.616 1.00 0.00 O ATOM 1756 NE2 GLN A 116 2.715 12.722 0.461 1.00 0.00 N ATOM 0 H GLN A 116 3.986 8.209 4.165 1.00 0.00 H new ATOM 0 HA GLN A 116 4.697 8.649 1.417 1.00 0.00 H new ATOM 0 HB2 GLN A 116 2.778 9.792 2.148 1.00 0.00 H new ATOM 0 HB3 GLN A 116 3.501 10.248 3.678 1.00 0.00 H new ATOM 0 HG2 GLN A 116 4.727 12.011 2.735 1.00 0.00 H new ATOM 0 HG3 GLN A 116 4.656 11.337 1.119 1.00 0.00 H new ATOM 0 HE21 GLN A 116 3.391 12.429 -0.245 1.00 0.00 H new ATOM 0 HE22 GLN A 116 1.920 13.303 0.196 1.00 0.00 H new ATOM 1765 N GLN A 117 6.485 10.111 3.792 1.00 0.00 N ATOM 1766 CA GLN A 117 7.778 10.725 4.070 1.00 0.00 C ATOM 1767 C GLN A 117 8.914 9.884 3.498 1.00 0.00 C ATOM 1768 O GLN A 117 9.861 10.414 2.917 1.00 0.00 O ATOM 1769 CB GLN A 117 7.969 10.903 5.577 1.00 0.00 C ATOM 1770 CG GLN A 117 7.255 12.121 6.141 1.00 0.00 C ATOM 1771 CD GLN A 117 7.462 13.362 5.296 1.00 0.00 C ATOM 1772 OE1 GLN A 117 6.510 14.072 4.971 1.00 0.00 O ATOM 1773 NE2 GLN A 117 8.712 13.631 4.935 1.00 0.00 N ATOM 0 H GLN A 117 5.868 10.042 4.601 1.00 0.00 H new ATOM 0 HA GLN A 117 7.797 11.704 3.590 1.00 0.00 H new ATOM 0 HB2 GLN A 117 7.607 10.011 6.089 1.00 0.00 H new ATOM 0 HB3 GLN A 117 9.034 10.984 5.793 1.00 0.00 H new ATOM 0 HG2 GLN A 117 6.188 11.910 6.215 1.00 0.00 H new ATOM 0 HG3 GLN A 117 7.613 12.311 7.153 1.00 0.00 H new ATOM 0 HE21 GLN A 117 9.471 13.015 5.227 1.00 0.00 H new ATOM 0 HE22 GLN A 117 8.913 14.453 4.366 1.00 0.00 H new ATOM 1782 N ASP A 118 8.813 8.570 3.665 1.00 0.00 N ATOM 1783 CA ASP A 118 9.832 7.654 3.165 1.00 0.00 C ATOM 1784 C ASP A 118 9.712 7.482 1.654 1.00 0.00 C ATOM 1785 O ASP A 118 10.691 7.171 0.974 1.00 0.00 O ATOM 1786 CB ASP A 118 9.712 6.296 3.857 1.00 0.00 C ATOM 1787 CG ASP A 118 10.209 6.330 5.289 1.00 0.00 C ATOM 1788 OD1 ASP A 118 11.442 6.329 5.490 1.00 0.00 O ATOM 1789 OD2 ASP A 118 9.365 6.358 6.209 1.00 0.00 O ATOM 0 H ASP A 118 8.035 8.115 4.143 1.00 0.00 H new ATOM 0 HA ASP A 118 10.810 8.080 3.388 1.00 0.00 H new ATOM 0 HB2 ASP A 118 8.670 5.976 3.845 1.00 0.00 H new ATOM 0 HB3 ASP A 118 10.280 5.554 3.296 1.00 0.00 H new ATOM 1794 N TYR A 119 8.506 7.683 1.134 1.00 0.00 N ATOM 1795 CA TYR A 119 8.258 7.546 -0.296 1.00 0.00 C ATOM 1796 C TYR A 119 8.707 8.794 -1.049 1.00 0.00 C ATOM 1797 O TYR A 119 8.736 8.814 -2.280 1.00 0.00 O ATOM 1798 CB TYR A 119 6.772 7.289 -0.554 1.00 0.00 C ATOM 1799 CG TYR A 119 6.464 6.904 -1.984 1.00 0.00 C ATOM 1800 CD1 TYR A 119 7.249 5.978 -2.659 1.00 0.00 C ATOM 1801 CD2 TYR A 119 5.388 7.467 -2.659 1.00 0.00 C ATOM 1802 CE1 TYR A 119 6.972 5.624 -3.966 1.00 0.00 C ATOM 1803 CE2 TYR A 119 5.102 7.118 -3.964 1.00 0.00 C ATOM 1804 CZ TYR A 119 5.897 6.197 -4.614 1.00 0.00 C ATOM 1805 OH TYR A 119 5.617 5.847 -5.915 1.00 0.00 O ATOM 0 H TYR A 119 7.685 7.941 1.682 1.00 0.00 H new ATOM 0 HA TYR A 119 8.836 6.697 -0.660 1.00 0.00 H new ATOM 0 HB2 TYR A 119 6.429 6.495 0.109 1.00 0.00 H new ATOM 0 HB3 TYR A 119 6.207 8.185 -0.298 1.00 0.00 H new ATOM 0 HD1 TYR A 119 8.090 5.527 -2.154 1.00 0.00 H new ATOM 0 HD2 TYR A 119 4.765 8.190 -2.154 1.00 0.00 H new ATOM 0 HE1 TYR A 119 7.593 4.903 -4.477 1.00 0.00 H new ATOM 0 HE2 TYR A 119 4.260 7.564 -4.473 1.00 0.00 H new ATOM 0 HH TYR A 119 4.828 6.340 -6.224 1.00 0.00 H new ATOM 1815 N TRP A 120 9.058 9.834 -0.301 1.00 0.00 N ATOM 1816 CA TRP A 120 9.508 11.087 -0.897 1.00 0.00 C ATOM 1817 C TRP A 120 10.971 11.355 -0.562 1.00 0.00 C ATOM 1818 O TRP A 120 11.591 12.257 -1.126 1.00 0.00 O ATOM 1819 CB TRP A 120 8.639 12.248 -0.409 1.00 0.00 C ATOM 1820 CG TRP A 120 9.254 13.593 -0.652 1.00 0.00 C ATOM 1821 CD1 TRP A 120 9.370 14.237 -1.851 1.00 0.00 C ATOM 1822 CD2 TRP A 120 9.840 14.457 0.328 1.00 0.00 C ATOM 1823 NE1 TRP A 120 9.992 15.450 -1.675 1.00 0.00 N ATOM 1824 CE2 TRP A 120 10.290 15.608 -0.347 1.00 0.00 C ATOM 1825 CE3 TRP A 120 10.027 14.371 1.710 1.00 0.00 C ATOM 1826 CZ2 TRP A 120 10.914 16.662 0.314 1.00 0.00 C ATOM 1827 CZ3 TRP A 120 10.647 15.417 2.365 1.00 0.00 C ATOM 1828 CH2 TRP A 120 11.084 16.551 1.668 1.00 0.00 C ATOM 0 H TRP A 120 9.040 9.835 0.719 1.00 0.00 H new ATOM 0 HA TRP A 120 9.413 11.001 -1.979 1.00 0.00 H new ATOM 0 HB2 TRP A 120 7.671 12.203 -0.909 1.00 0.00 H new ATOM 0 HB3 TRP A 120 8.452 12.129 0.658 1.00 0.00 H new ATOM 0 HD1 TRP A 120 9.024 13.850 -2.798 1.00 0.00 H new ATOM 0 HE1 TRP A 120 10.198 16.123 -2.413 1.00 0.00 H new ATOM 0 HE3 TRP A 120 9.693 13.502 2.257 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 11.252 17.536 -0.222 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 10.798 15.360 3.433 1.00 0.00 H new ATOM 0 HH2 TRP A 120 11.564 17.353 2.209 1.00 0.00 H new ATOM 1839 N ARG A 121 11.517 10.567 0.358 1.00 0.00 N ATOM 1840 CA ARG A 121 12.908 10.720 0.768 1.00 0.00 C ATOM 1841 C ARG A 121 13.802 9.719 0.042 1.00 0.00 C ATOM 1842 O ARG A 121 15.011 9.923 -0.074 1.00 0.00 O ATOM 1843 CB ARG A 121 13.039 10.535 2.281 1.00 0.00 C ATOM 1844 CG ARG A 121 12.954 9.084 2.726 1.00 0.00 C ATOM 1845 CD ARG A 121 14.326 8.429 2.753 1.00 0.00 C ATOM 1846 NE ARG A 121 15.277 9.182 3.566 1.00 0.00 N ATOM 1847 CZ ARG A 121 15.226 9.240 4.892 1.00 0.00 C ATOM 1848 NH1 ARG A 121 14.275 8.592 5.551 1.00 0.00 N ATOM 1849 NH2 ARG A 121 16.127 9.946 5.562 1.00 0.00 N ATOM 0 H ARG A 121 11.017 9.816 0.834 1.00 0.00 H new ATOM 0 HA ARG A 121 13.230 11.727 0.503 1.00 0.00 H new ATOM 0 HB2 ARG A 121 13.992 10.952 2.608 1.00 0.00 H new ATOM 0 HB3 ARG A 121 12.254 11.105 2.778 1.00 0.00 H new ATOM 0 HG2 ARG A 121 12.505 9.032 3.718 1.00 0.00 H new ATOM 0 HG3 ARG A 121 12.300 8.533 2.051 1.00 0.00 H new ATOM 0 HD2 ARG A 121 14.236 7.416 3.145 1.00 0.00 H new ATOM 0 HD3 ARG A 121 14.707 8.344 1.735 1.00 0.00 H new ATOM 0 HE ARG A 121 16.021 9.691 3.089 1.00 0.00 H new ATOM 0 HH11 ARG A 121 13.581 8.047 5.040 1.00 0.00 H new ATOM 0 HH12 ARG A 121 14.238 8.638 6.569 1.00 0.00 H new ATOM 0 HH21 ARG A 121 16.860 10.445 5.059 1.00 0.00 H new ATOM 0 HH22 ARG A 121 16.086 9.990 6.580 1.00 0.00 H new ATOM 1863 N ILE A 122 13.200 8.639 -0.443 1.00 0.00 N ATOM 1864 CA ILE A 122 13.942 7.607 -1.157 1.00 0.00 C ATOM 1865 C ILE A 122 14.038 7.930 -2.644 1.00 0.00 C ATOM 1866 O ILE A 122 15.131 7.976 -3.211 1.00 0.00 O ATOM 1867 CB ILE A 122 13.289 6.223 -0.984 1.00 0.00 C ATOM 1868 CG1 ILE A 122 13.280 5.820 0.492 1.00 0.00 C ATOM 1869 CG2 ILE A 122 14.024 5.184 -1.818 1.00 0.00 C ATOM 1870 CD1 ILE A 122 12.503 4.551 0.766 1.00 0.00 C ATOM 0 H ILE A 122 12.201 8.455 -0.355 1.00 0.00 H new ATOM 0 HA ILE A 122 14.943 7.583 -0.727 1.00 0.00 H new ATOM 0 HB ILE A 122 12.258 6.277 -1.332 1.00 0.00 H new ATOM 0 HG12 ILE A 122 14.308 5.688 0.831 1.00 0.00 H new ATOM 0 HG13 ILE A 122 12.853 6.632 1.080 1.00 0.00 H new ATOM 0 HG21 ILE A 122 13.551 4.211 -1.686 1.00 0.00 H new ATOM 0 HG22 ILE A 122 13.984 5.467 -2.870 1.00 0.00 H new ATOM 0 HG23 ILE A 122 15.064 5.129 -1.497 1.00 0.00 H new ATOM 0 HD11 ILE A 122 12.539 4.325 1.832 1.00 0.00 H new ATOM 0 HD12 ILE A 122 11.466 4.686 0.458 1.00 0.00 H new ATOM 0 HD13 ILE A 122 12.944 3.726 0.206 1.00 0.00 H new ATOM 1882 N LEU A 123 12.889 8.154 -3.271 1.00 0.00 N ATOM 1883 CA LEU A 123 12.843 8.474 -4.694 1.00 0.00 C ATOM 1884 C LEU A 123 13.507 9.819 -4.971 1.00 0.00 C ATOM 1885 O LEU A 123 14.590 9.880 -5.551 1.00 0.00 O ATOM 1886 CB LEU A 123 11.394 8.497 -5.185 1.00 0.00 C ATOM 1887 CG LEU A 123 10.760 7.135 -5.467 1.00 0.00 C ATOM 1888 CD1 LEU A 123 10.080 6.593 -4.219 1.00 0.00 C ATOM 1889 CD2 LEU A 123 9.766 7.237 -6.616 1.00 0.00 C ATOM 0 H LEU A 123 11.976 8.120 -2.817 1.00 0.00 H new ATOM 0 HA LEU A 123 13.391 7.701 -5.233 1.00 0.00 H new ATOM 0 HB2 LEU A 123 10.787 9.011 -4.440 1.00 0.00 H new ATOM 0 HB3 LEU A 123 11.350 9.092 -6.097 1.00 0.00 H new ATOM 0 HG LEU A 123 11.550 6.441 -5.756 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.635 5.623 -4.440 1.00 0.00 H new ATOM 0 HD12 LEU A 123 10.816 6.482 -3.423 1.00 0.00 H new ATOM 0 HD13 LEU A 123 9.301 7.285 -3.899 1.00 0.00 H new ATOM 0 HD21 LEU A 123 9.324 6.258 -6.803 1.00 0.00 H new ATOM 0 HD22 LEU A 123 8.980 7.946 -6.355 1.00 0.00 H new ATOM 0 HD23 LEU A 123 10.281 7.580 -7.513 1.00 0.00 H new ATOM 1901 N ASN A 124 12.850 10.895 -4.549 1.00 0.00 N ATOM 1902 CA ASN A 124 13.378 12.240 -4.751 1.00 0.00 C ATOM 1903 C ASN A 124 14.812 12.343 -4.240 1.00 0.00 C ATOM 1904 O ASN A 124 15.407 11.350 -3.821 1.00 0.00 O ATOM 1905 CB ASN A 124 12.496 13.268 -4.040 1.00 0.00 C ATOM 1906 CG ASN A 124 11.037 13.151 -4.437 1.00 0.00 C ATOM 1907 OD1 ASN A 124 10.561 13.872 -5.314 1.00 0.00 O ATOM 1908 ND2 ASN A 124 10.320 12.240 -3.790 1.00 0.00 N ATOM 0 H ASN A 124 11.952 10.862 -4.066 1.00 0.00 H new ATOM 0 HA ASN A 124 13.376 12.448 -5.821 1.00 0.00 H new ATOM 0 HB2 ASN A 124 12.588 13.138 -2.962 1.00 0.00 H new ATOM 0 HB3 ASN A 124 12.853 14.271 -4.271 1.00 0.00 H new ATOM 0 HD21 ASN A 124 9.332 12.116 -4.013 1.00 0.00 H new ATOM 0 HD22 ASN A 124 10.757 11.664 -3.070 1.00 0.00 H new ATOM 1915 N HIS A 125 15.362 13.553 -4.277 1.00 0.00 N ATOM 1916 CA HIS A 125 16.726 13.787 -3.817 1.00 0.00 C ATOM 1917 C HIS A 125 16.732 14.604 -2.528 1.00 0.00 C ATOM 1918 O HIS A 125 17.397 15.636 -2.438 1.00 0.00 O ATOM 1919 CB HIS A 125 17.534 14.509 -4.896 1.00 0.00 C ATOM 1920 CG HIS A 125 19.000 14.583 -4.597 1.00 0.00 C ATOM 1921 ND1 HIS A 125 19.662 15.771 -4.370 1.00 0.00 N ATOM 1922 CD2 HIS A 125 19.932 13.608 -4.488 1.00 0.00 C ATOM 1923 CE1 HIS A 125 20.939 15.523 -4.135 1.00 0.00 C ATOM 1924 NE2 HIS A 125 21.128 14.217 -4.200 1.00 0.00 N ATOM 0 H HIS A 125 14.884 14.386 -4.621 1.00 0.00 H new ATOM 0 HA HIS A 125 17.186 12.820 -3.616 1.00 0.00 H new ATOM 0 HB2 HIS A 125 17.391 13.998 -5.848 1.00 0.00 H new ATOM 0 HB3 HIS A 125 17.144 15.520 -5.015 1.00 0.00 H new ATOM 0 HD2 HIS A 125 19.766 12.547 -4.606 1.00 0.00 H new ATOM 0 HE1 HIS A 125 21.698 16.262 -3.926 1.00 0.00 H new ATOM 0 HE2 HIS A 125 22.018 13.739 -4.059 1.00 0.00 H new ATOM 1933 N VAL A 126 15.986 14.136 -1.533 1.00 0.00 N ATOM 1934 CA VAL A 126 15.905 14.822 -0.249 1.00 0.00 C ATOM 1935 C VAL A 126 17.228 14.738 0.503 1.00 0.00 C ATOM 1936 O VAL A 126 17.902 13.709 0.479 1.00 0.00 O ATOM 1937 CB VAL A 126 14.787 14.234 0.632 1.00 0.00 C ATOM 1938 CG1 VAL A 126 14.888 14.773 2.051 1.00 0.00 C ATOM 1939 CG2 VAL A 126 13.422 14.537 0.034 1.00 0.00 C ATOM 0 H VAL A 126 15.429 13.284 -1.591 1.00 0.00 H new ATOM 0 HA VAL A 126 15.677 15.867 -0.462 1.00 0.00 H new ATOM 0 HB VAL A 126 14.909 13.151 0.670 1.00 0.00 H new ATOM 0 HG11 VAL A 126 14.090 14.347 2.660 1.00 0.00 H new ATOM 0 HG12 VAL A 126 15.854 14.500 2.476 1.00 0.00 H new ATOM 0 HG13 VAL A 126 14.792 15.859 2.036 1.00 0.00 H new ATOM 0 HG21 VAL A 126 12.644 14.114 0.670 1.00 0.00 H new ATOM 0 HG22 VAL A 126 13.287 15.616 -0.036 1.00 0.00 H new ATOM 0 HG23 VAL A 126 13.355 14.098 -0.962 1.00 0.00 H new ATOM 1949 N GLU A 127 17.594 15.828 1.170 1.00 0.00 N ATOM 1950 CA GLU A 127 18.838 15.877 1.930 1.00 0.00 C ATOM 1951 C GLU A 127 18.851 14.810 3.021 1.00 0.00 C ATOM 1952 O GLU A 127 17.810 14.466 3.582 1.00 0.00 O ATOM 1953 CB GLU A 127 19.027 17.262 2.553 1.00 0.00 C ATOM 1954 CG GLU A 127 19.454 18.325 1.555 1.00 0.00 C ATOM 1955 CD GLU A 127 20.961 18.418 1.411 1.00 0.00 C ATOM 1956 OE1 GLU A 127 21.618 18.889 2.363 1.00 0.00 O ATOM 1957 OE2 GLU A 127 21.482 18.022 0.349 1.00 0.00 O ATOM 0 H GLU A 127 17.047 16.689 1.200 1.00 0.00 H new ATOM 0 HA GLU A 127 19.661 15.680 1.244 1.00 0.00 H new ATOM 0 HB2 GLU A 127 18.093 17.571 3.022 1.00 0.00 H new ATOM 0 HB3 GLU A 127 19.775 17.197 3.344 1.00 0.00 H new ATOM 0 HG2 GLU A 127 19.013 18.104 0.583 1.00 0.00 H new ATOM 0 HG3 GLU A 127 19.062 19.292 1.870 1.00 0.00 H new ATOM 1964 N LYS A 128 20.037 14.289 3.317 1.00 0.00 N ATOM 1965 CA LYS A 128 20.188 13.262 4.340 1.00 0.00 C ATOM 1966 C LYS A 128 19.415 12.002 3.966 1.00 0.00 C ATOM 1967 O LYS A 128 18.766 11.386 4.812 1.00 0.00 O ATOM 1968 CB LYS A 128 19.705 13.787 5.694 1.00 0.00 C ATOM 1969 CG LYS A 128 20.041 12.870 6.857 1.00 0.00 C ATOM 1970 CD LYS A 128 21.376 13.234 7.486 1.00 0.00 C ATOM 1971 CE LYS A 128 22.512 12.417 6.891 1.00 0.00 C ATOM 1972 NZ LYS A 128 23.796 13.173 6.888 1.00 0.00 N ATOM 0 H LYS A 128 20.908 14.562 2.862 1.00 0.00 H new ATOM 0 HA LYS A 128 21.246 13.009 4.411 1.00 0.00 H new ATOM 0 HB2 LYS A 128 20.149 14.766 5.874 1.00 0.00 H new ATOM 0 HB3 LYS A 128 18.625 13.929 5.655 1.00 0.00 H new ATOM 0 HG2 LYS A 128 19.254 12.931 7.609 1.00 0.00 H new ATOM 0 HG3 LYS A 128 20.071 11.837 6.510 1.00 0.00 H new ATOM 0 HD2 LYS A 128 21.573 14.296 7.337 1.00 0.00 H new ATOM 0 HD3 LYS A 128 21.330 13.067 8.562 1.00 0.00 H new ATOM 0 HE2 LYS A 128 22.634 11.496 7.461 1.00 0.00 H new ATOM 0 HE3 LYS A 128 22.257 12.130 5.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 24.546 12.582 6.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 23.687 14.040 6.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 24.052 13.425 7.864 1.00 0.00 H new ATOM 1986 N SER A 129 19.488 11.624 2.694 1.00 0.00 N ATOM 1987 CA SER A 129 18.793 10.439 2.207 1.00 0.00 C ATOM 1988 C SER A 129 19.166 9.212 3.034 1.00 0.00 C ATOM 1989 O SER A 129 20.100 9.249 3.834 1.00 0.00 O ATOM 1990 CB SER A 129 19.126 10.195 0.734 1.00 0.00 C ATOM 1991 OG SER A 129 20.526 10.100 0.536 1.00 0.00 O ATOM 0 H SER A 129 20.022 12.122 1.982 1.00 0.00 H new ATOM 0 HA SER A 129 17.721 10.611 2.306 1.00 0.00 H new ATOM 0 HB2 SER A 129 18.645 9.277 0.397 1.00 0.00 H new ATOM 0 HB3 SER A 129 18.724 11.007 0.128 1.00 0.00 H new ATOM 0 HG SER A 129 20.712 9.942 -0.413 1.00 0.00 H new ATOM 1997 N GLY A 130 18.427 8.125 2.835 1.00 0.00 N ATOM 1998 CA GLY A 130 18.695 6.901 3.569 1.00 0.00 C ATOM 1999 C GLY A 130 17.886 6.804 4.847 1.00 0.00 C ATOM 2000 O GLY A 130 17.980 7.654 5.732 1.00 0.00 O ATOM 0 H GLY A 130 17.648 8.070 2.179 1.00 0.00 H new ATOM 0 HA2 GLY A 130 18.471 6.044 2.934 1.00 0.00 H new ATOM 0 HA3 GLY A 130 19.757 6.850 3.810 1.00 0.00 H new ATOM 2004 N PRO A 131 17.068 5.746 4.955 1.00 0.00 N ATOM 2005 CA PRO A 131 16.223 5.516 6.131 1.00 0.00 C ATOM 2006 C PRO A 131 17.036 5.138 7.364 1.00 0.00 C ATOM 2007 O PRO A 131 18.175 4.684 7.253 1.00 0.00 O ATOM 2008 CB PRO A 131 15.328 4.351 5.702 1.00 0.00 C ATOM 2009 CG PRO A 131 16.112 3.636 4.656 1.00 0.00 C ATOM 2010 CD PRO A 131 16.906 4.693 3.939 1.00 0.00 C ATOM 0 HA PRO A 131 15.672 6.411 6.418 1.00 0.00 H new ATOM 0 HB2 PRO A 131 15.101 3.696 6.543 1.00 0.00 H new ATOM 0 HB3 PRO A 131 14.376 4.707 5.309 1.00 0.00 H new ATOM 0 HG2 PRO A 131 16.769 2.890 5.103 1.00 0.00 H new ATOM 0 HG3 PRO A 131 15.453 3.108 3.967 1.00 0.00 H new ATOM 0 HD2 PRO A 131 17.869 4.311 3.599 1.00 0.00 H new ATOM 0 HD3 PRO A 131 16.381 5.062 3.058 1.00 0.00 H new ATOM 2018 N SER A 132 16.443 5.327 8.539 1.00 0.00 N ATOM 2019 CA SER A 132 17.114 5.009 9.794 1.00 0.00 C ATOM 2020 C SER A 132 17.993 3.771 9.641 1.00 0.00 C ATOM 2021 O SER A 132 17.512 2.695 9.284 1.00 0.00 O ATOM 2022 CB SER A 132 16.086 4.784 10.904 1.00 0.00 C ATOM 2023 OG SER A 132 16.717 4.404 12.114 1.00 0.00 O ATOM 0 H SER A 132 15.499 5.699 8.648 1.00 0.00 H new ATOM 0 HA SER A 132 17.749 5.854 10.062 1.00 0.00 H new ATOM 0 HB2 SER A 132 15.510 5.696 11.061 1.00 0.00 H new ATOM 0 HB3 SER A 132 15.381 4.011 10.600 1.00 0.00 H new ATOM 0 HG SER A 132 16.039 4.268 12.808 1.00 0.00 H new ATOM 2029 N SER A 133 19.284 3.932 9.913 1.00 0.00 N ATOM 2030 CA SER A 133 20.232 2.829 9.803 1.00 0.00 C ATOM 2031 C SER A 133 20.338 2.070 11.122 1.00 0.00 C ATOM 2032 O SER A 133 20.857 2.588 12.109 1.00 0.00 O ATOM 2033 CB SER A 133 21.609 3.352 9.390 1.00 0.00 C ATOM 2034 OG SER A 133 22.405 2.316 8.841 1.00 0.00 O ATOM 0 H SER A 133 19.698 4.815 10.211 1.00 0.00 H new ATOM 0 HA SER A 133 19.867 2.143 9.038 1.00 0.00 H new ATOM 0 HB2 SER A 133 21.493 4.152 8.659 1.00 0.00 H new ATOM 0 HB3 SER A 133 22.113 3.782 10.256 1.00 0.00 H new ATOM 0 HG SER A 133 23.279 2.677 8.584 1.00 0.00 H new ATOM 2040 N GLY A 134 19.842 0.836 11.129 1.00 0.00 N ATOM 2041 CA GLY A 134 19.890 0.024 12.331 1.00 0.00 C ATOM 2042 C GLY A 134 18.889 -1.113 12.303 1.00 0.00 C ATOM 2043 O GLY A 134 19.162 -2.202 12.809 1.00 0.00 O ATOM 0 H GLY A 134 19.408 0.385 10.324 1.00 0.00 H new ATOM 0 HA2 GLY A 134 20.894 -0.383 12.451 1.00 0.00 H new ATOM 0 HA3 GLY A 134 19.696 0.654 13.199 1.00 0.00 H new TER 2047 GLY A 134