USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 877 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 29 ASN : amide:sc= 0.792 K(o=2,f=-12!) USER MOD Set 1.2: A 33 LYS NZ :NH3+ -168:sc= 1.22 (180deg=-0.0254) USER MOD Set 2.1: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 87:sc= 0.868 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0211 USER MOD Single : A 9 CYS SG : rot -90:sc= 1.37 USER MOD Single : A 11 TYR OH : rot -149:sc= -1.71 USER MOD Single : A 12 SER OG : rot 75:sc= 0.858 USER MOD Single : A 17 HIS : no HE2:sc= -4.05! C(o=-4!,f=-11!) USER MOD Single : A 24 THR OG1 : rot 159:sc= -2.83! USER MOD Single : A 38 ASN : amide:sc= 0.0906 K(o=0.091,f=-2.9!) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc=-0.00791 X(o=-0.0079,f=0) USER MOD Single : A 55 ASN :FLIP amide:sc= -0.0476 F(o=-1.6!,f=-0.048) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : B 103 TYR OH : rot 180:sc= -0.255 USER MOD Single : B 106 SER OG : rot 180:sc= -0.284 USER MOD Single : B 107 TYR OH : rot 150:sc= -0.764 USER MOD Single : B 115 ASN : amide:sc= -1.67! X(o=-1.7!,f=-1.3) USER MOD Single : B 116 SER OG : rot 180:sc= 0 USER MOD Single : B 117 SER OG : rot 180:sc= 0 USER MOD Single : B 119 SER OG : rot -61:sc= 1.19 USER MOD Single : B 121 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0065) USER MOD Single : B 124 LYS NZ :NH3+ -117:sc= -0.0727 (180deg=-1.18) USER MOD Single : B 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 129 SER OG : rot -66:sc= 1.18 USER MOD Single : B 140 ASN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : B 141 LYS NZ :NH3+ 176:sc= 0.911 (180deg=0.84) USER MOD Single : B 144 SER OG : rot 180:sc= 0 USER MOD Single : B 147 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : B 149 LYS NZ :NH3+ -170:sc= 1.17 (180deg=1.08) USER MOD Single : B 150 ASN : amide:sc= -0.0822 K(o=-0.082,f=-2.7!) USER MOD Single : B 157 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 30 N SER A 3 -2.341 6.630 -11.706 1.00 0.00 N ATOM 31 CA SER A 3 -2.324 5.365 -12.390 1.00 0.00 C ATOM 32 C SER A 3 -2.289 4.285 -11.334 1.00 0.00 C ATOM 33 O SER A 3 -1.440 4.308 -10.441 1.00 0.00 O ATOM 34 CB SER A 3 -1.109 5.262 -13.309 1.00 0.00 C ATOM 35 OG SER A 3 -0.918 6.467 -14.030 1.00 0.00 O ATOM 0 HA SER A 3 -3.209 5.258 -13.018 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.219 5.041 -12.719 1.00 0.00 H new ATOM 0 HB3 SER A 3 -1.243 4.434 -14.005 1.00 0.00 H new ATOM 0 HG SER A 3 -0.371 7.083 -13.499 1.00 0.00 H new ATOM 41 N VAL A 4 -3.246 3.380 -11.412 1.00 0.00 N ATOM 42 CA VAL A 4 -3.368 2.282 -10.470 1.00 0.00 C ATOM 43 C VAL A 4 -2.056 1.503 -10.335 1.00 0.00 C ATOM 44 O VAL A 4 -1.804 0.882 -9.313 1.00 0.00 O ATOM 45 CB VAL A 4 -4.530 1.361 -10.905 1.00 0.00 C ATOM 46 CG1 VAL A 4 -4.289 -0.101 -10.549 1.00 0.00 C ATOM 47 CG2 VAL A 4 -5.826 1.859 -10.289 1.00 0.00 C ATOM 0 H VAL A 4 -3.965 3.385 -12.135 1.00 0.00 H new ATOM 0 HA VAL A 4 -3.589 2.690 -9.484 1.00 0.00 H new ATOM 0 HB VAL A 4 -4.597 1.403 -11.992 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -5.138 -0.700 -10.878 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -3.383 -0.451 -11.044 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -4.173 -0.198 -9.470 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -6.647 1.210 -10.595 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -5.740 1.848 -9.202 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -6.022 2.876 -10.627 1.00 0.00 H new ATOM 57 N SER A 5 -1.207 1.573 -11.348 1.00 0.00 N ATOM 58 CA SER A 5 0.106 0.959 -11.283 1.00 0.00 C ATOM 59 C SER A 5 0.959 1.701 -10.265 1.00 0.00 C ATOM 60 O SER A 5 1.493 1.116 -9.319 1.00 0.00 O ATOM 61 CB SER A 5 0.763 1.010 -12.663 1.00 0.00 C ATOM 62 OG SER A 5 0.683 2.316 -13.212 1.00 0.00 O ATOM 0 H SER A 5 -1.406 2.051 -12.227 1.00 0.00 H new ATOM 0 HA SER A 5 0.012 -0.083 -10.976 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.807 0.707 -12.585 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.274 0.300 -13.330 1.00 0.00 H new ATOM 0 HG SER A 5 1.111 2.327 -14.094 1.00 0.00 H new ATOM 68 N GLU A 6 1.047 3.007 -10.455 1.00 0.00 N ATOM 69 CA GLU A 6 1.799 3.866 -9.567 1.00 0.00 C ATOM 70 C GLU A 6 1.265 3.729 -8.148 1.00 0.00 C ATOM 71 O GLU A 6 2.014 3.459 -7.210 1.00 0.00 O ATOM 72 CB GLU A 6 1.698 5.321 -10.030 1.00 0.00 C ATOM 73 CG GLU A 6 1.982 5.500 -11.512 1.00 0.00 C ATOM 74 CD GLU A 6 1.773 6.923 -11.989 1.00 0.00 C ATOM 75 OE1 GLU A 6 0.624 7.410 -11.933 1.00 0.00 O ATOM 76 OE2 GLU A 6 2.749 7.546 -12.451 1.00 0.00 O ATOM 0 H GLU A 6 0.599 3.497 -11.229 1.00 0.00 H new ATOM 0 HA GLU A 6 2.847 3.567 -9.584 1.00 0.00 H new ATOM 0 HB2 GLU A 6 0.699 5.697 -9.810 1.00 0.00 H new ATOM 0 HB3 GLU A 6 2.399 5.927 -9.457 1.00 0.00 H new ATOM 0 HG2 GLU A 6 3.010 5.201 -11.718 1.00 0.00 H new ATOM 0 HG3 GLU A 6 1.336 4.833 -12.083 1.00 0.00 H new ATOM 83 N LEU A 7 -0.044 3.893 -8.022 1.00 0.00 N ATOM 84 CA LEU A 7 -0.741 3.754 -6.761 1.00 0.00 C ATOM 85 C LEU A 7 -0.526 2.363 -6.140 1.00 0.00 C ATOM 86 O LEU A 7 -0.407 2.238 -4.921 1.00 0.00 O ATOM 87 CB LEU A 7 -2.231 4.050 -6.984 1.00 0.00 C ATOM 88 CG LEU A 7 -2.860 4.958 -5.963 1.00 0.00 C ATOM 89 CD1 LEU A 7 -2.343 6.376 -6.115 1.00 0.00 C ATOM 90 CD2 LEU A 7 -4.365 4.897 -6.129 1.00 0.00 C ATOM 0 H LEU A 7 -0.655 4.129 -8.804 1.00 0.00 H new ATOM 0 HA LEU A 7 -0.334 4.471 -6.047 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -2.353 4.498 -7.970 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -2.776 3.106 -6.993 1.00 0.00 H new ATOM 0 HG LEU A 7 -2.595 4.629 -4.958 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -2.811 7.016 -5.367 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -1.262 6.386 -5.976 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -2.584 6.746 -7.111 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -4.839 5.550 -5.396 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -4.634 5.224 -7.134 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -4.707 3.873 -5.977 1.00 0.00 H new ATOM 102 N ALA A 8 -0.449 1.326 -6.972 1.00 0.00 N ATOM 103 CA ALA A 8 -0.214 -0.033 -6.483 1.00 0.00 C ATOM 104 C ALA A 8 1.170 -0.159 -5.877 1.00 0.00 C ATOM 105 O ALA A 8 1.358 -0.797 -4.837 1.00 0.00 O ATOM 106 CB ALA A 8 -0.370 -1.050 -7.599 1.00 0.00 C ATOM 0 H ALA A 8 -0.545 1.399 -7.985 1.00 0.00 H new ATOM 0 HA ALA A 8 -0.960 -0.235 -5.714 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -0.190 -2.051 -7.207 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -1.381 -0.995 -8.003 1.00 0.00 H new ATOM 0 HB3 ALA A 8 0.349 -0.835 -8.390 1.00 0.00 H new ATOM 112 N CYS A 9 2.136 0.469 -6.521 1.00 0.00 N ATOM 113 CA CYS A 9 3.505 0.433 -6.048 1.00 0.00 C ATOM 114 C CYS A 9 3.558 1.161 -4.725 1.00 0.00 C ATOM 115 O CYS A 9 4.219 0.731 -3.772 1.00 0.00 O ATOM 116 CB CYS A 9 4.422 1.114 -7.049 1.00 0.00 C ATOM 117 SG CYS A 9 6.169 0.713 -6.848 1.00 0.00 S ATOM 0 H CYS A 9 1.997 1.011 -7.374 1.00 0.00 H new ATOM 0 HA CYS A 9 3.836 -0.599 -5.929 1.00 0.00 H new ATOM 0 HB2 CYS A 9 4.111 0.836 -8.056 1.00 0.00 H new ATOM 0 HB3 CYS A 9 4.297 2.193 -6.963 1.00 0.00 H new ATOM 0 HG CYS A 9 6.721 1.570 -6.042 1.00 0.00 H new ATOM 123 N ILE A 10 2.824 2.267 -4.696 1.00 0.00 N ATOM 124 CA ILE A 10 2.609 3.034 -3.494 1.00 0.00 C ATOM 125 C ILE A 10 2.207 2.109 -2.353 1.00 0.00 C ATOM 126 O ILE A 10 2.891 2.029 -1.337 1.00 0.00 O ATOM 127 CB ILE A 10 1.502 4.091 -3.718 1.00 0.00 C ATOM 128 CG1 ILE A 10 1.957 5.189 -4.673 1.00 0.00 C ATOM 129 CG2 ILE A 10 1.051 4.710 -2.413 1.00 0.00 C ATOM 130 CD1 ILE A 10 0.887 6.228 -4.918 1.00 0.00 C ATOM 0 H ILE A 10 2.361 2.653 -5.519 1.00 0.00 H new ATOM 0 HA ILE A 10 3.538 3.544 -3.238 1.00 0.00 H new ATOM 0 HB ILE A 10 0.659 3.566 -4.167 1.00 0.00 H new ATOM 0 HG12 ILE A 10 2.843 5.675 -4.266 1.00 0.00 H new ATOM 0 HG13 ILE A 10 2.247 4.741 -5.623 1.00 0.00 H new ATOM 0 HG21 ILE A 10 0.273 5.448 -2.610 1.00 0.00 H new ATOM 0 HG22 ILE A 10 0.657 3.933 -1.759 1.00 0.00 H new ATOM 0 HG23 ILE A 10 1.898 5.196 -1.929 1.00 0.00 H new ATOM 0 HD11 ILE A 10 1.265 6.985 -5.605 1.00 0.00 H new ATOM 0 HD12 ILE A 10 0.009 5.750 -5.352 1.00 0.00 H new ATOM 0 HD13 ILE A 10 0.614 6.699 -3.974 1.00 0.00 H new ATOM 142 N TYR A 11 1.130 1.365 -2.560 1.00 0.00 N ATOM 143 CA TYR A 11 0.559 0.537 -1.497 1.00 0.00 C ATOM 144 C TYR A 11 1.499 -0.581 -1.095 1.00 0.00 C ATOM 145 O TYR A 11 1.621 -0.880 0.083 1.00 0.00 O ATOM 146 CB TYR A 11 -0.771 -0.067 -1.919 1.00 0.00 C ATOM 147 CG TYR A 11 -1.769 0.968 -2.323 1.00 0.00 C ATOM 148 CD1 TYR A 11 -1.888 2.146 -1.607 1.00 0.00 C ATOM 149 CD2 TYR A 11 -2.585 0.774 -3.423 1.00 0.00 C ATOM 150 CE1 TYR A 11 -2.793 3.107 -1.976 1.00 0.00 C ATOM 151 CE2 TYR A 11 -3.498 1.728 -3.800 1.00 0.00 C ATOM 152 CZ TYR A 11 -3.601 2.888 -3.075 1.00 0.00 C ATOM 153 OH TYR A 11 -4.520 3.825 -3.443 1.00 0.00 O ATOM 0 H TYR A 11 0.633 1.315 -3.449 1.00 0.00 H new ATOM 0 HA TYR A 11 0.402 1.196 -0.643 1.00 0.00 H new ATOM 0 HB2 TYR A 11 -0.607 -0.753 -2.750 1.00 0.00 H new ATOM 0 HB3 TYR A 11 -1.176 -0.655 -1.096 1.00 0.00 H new ATOM 0 HD1 TYR A 11 -1.259 2.311 -0.745 1.00 0.00 H new ATOM 0 HD2 TYR A 11 -2.503 -0.140 -3.993 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -2.874 4.026 -1.414 1.00 0.00 H new ATOM 0 HE2 TYR A 11 -4.130 1.566 -4.661 1.00 0.00 H new ATOM 0 HH TYR A 11 -5.287 3.383 -3.864 1.00 0.00 H new ATOM 163 N SER A 12 2.150 -1.207 -2.067 1.00 0.00 N ATOM 164 CA SER A 12 3.134 -2.239 -1.769 1.00 0.00 C ATOM 165 C SER A 12 4.174 -1.686 -0.791 1.00 0.00 C ATOM 166 O SER A 12 4.529 -2.324 0.215 1.00 0.00 O ATOM 167 CB SER A 12 3.800 -2.718 -3.064 1.00 0.00 C ATOM 168 OG SER A 12 2.828 -3.067 -4.038 1.00 0.00 O ATOM 0 H SER A 12 2.016 -1.020 -3.061 1.00 0.00 H new ATOM 0 HA SER A 12 2.640 -3.093 -1.306 1.00 0.00 H new ATOM 0 HB2 SER A 12 4.447 -1.933 -3.456 1.00 0.00 H new ATOM 0 HB3 SER A 12 4.435 -3.579 -2.854 1.00 0.00 H new ATOM 0 HG SER A 12 2.438 -2.252 -4.417 1.00 0.00 H new ATOM 174 N ALA A 13 4.602 -0.455 -1.056 1.00 0.00 N ATOM 175 CA ALA A 13 5.534 0.228 -0.187 1.00 0.00 C ATOM 176 C ALA A 13 4.875 0.540 1.146 1.00 0.00 C ATOM 177 O ALA A 13 5.521 0.535 2.190 1.00 0.00 O ATOM 178 CB ALA A 13 6.000 1.503 -0.848 1.00 0.00 C ATOM 0 H ALA A 13 4.312 0.085 -1.871 1.00 0.00 H new ATOM 0 HA ALA A 13 6.394 -0.417 -0.007 1.00 0.00 H new ATOM 0 HB1 ALA A 13 6.703 2.017 -0.192 1.00 0.00 H new ATOM 0 HB2 ALA A 13 6.492 1.265 -1.791 1.00 0.00 H new ATOM 0 HB3 ALA A 13 5.143 2.148 -1.039 1.00 0.00 H new ATOM 184 N LEU A 14 3.575 0.792 1.098 1.00 0.00 N ATOM 185 CA LEU A 14 2.807 1.094 2.284 1.00 0.00 C ATOM 186 C LEU A 14 2.828 -0.097 3.241 1.00 0.00 C ATOM 187 O LEU A 14 3.262 0.041 4.382 1.00 0.00 O ATOM 188 CB LEU A 14 1.382 1.463 1.927 1.00 0.00 C ATOM 189 CG LEU A 14 1.061 2.958 1.928 1.00 0.00 C ATOM 190 CD1 LEU A 14 1.771 3.689 3.049 1.00 0.00 C ATOM 191 CD2 LEU A 14 1.350 3.597 0.600 1.00 0.00 C ATOM 0 H LEU A 14 3.030 0.792 0.236 1.00 0.00 H new ATOM 0 HA LEU A 14 3.262 1.952 2.779 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.161 1.064 0.937 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.712 0.966 2.628 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.011 3.044 2.106 1.00 0.00 H new ATOM 0 HD11 LEU A 14 1.515 4.748 3.012 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.461 3.274 4.008 1.00 0.00 H new ATOM 0 HD13 LEU A 14 2.849 3.572 2.934 1.00 0.00 H new ATOM 0 HD21 LEU A 14 1.107 4.659 0.647 1.00 0.00 H new ATOM 0 HD22 LEU A 14 2.406 3.476 0.360 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.746 3.120 -0.172 1.00 0.00 H new ATOM 203 N ILE A 15 2.389 -1.274 2.769 1.00 0.00 N ATOM 204 CA ILE A 15 2.423 -2.489 3.596 1.00 0.00 C ATOM 205 C ILE A 15 3.830 -2.719 4.119 1.00 0.00 C ATOM 206 O ILE A 15 4.022 -3.055 5.287 1.00 0.00 O ATOM 207 CB ILE A 15 1.969 -3.771 2.860 1.00 0.00 C ATOM 208 CG1 ILE A 15 1.564 -3.516 1.404 1.00 0.00 C ATOM 209 CG2 ILE A 15 0.811 -4.381 3.624 1.00 0.00 C ATOM 210 CD1 ILE A 15 0.094 -3.199 1.222 1.00 0.00 C ATOM 0 H ILE A 15 2.011 -1.409 1.831 1.00 0.00 H new ATOM 0 HA ILE A 15 1.713 -2.310 4.404 1.00 0.00 H new ATOM 0 HB ILE A 15 2.817 -4.455 2.825 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.155 -2.688 1.012 1.00 0.00 H new ATOM 0 HG13 ILE A 15 1.812 -4.395 0.809 1.00 0.00 H new ATOM 0 HG21 ILE A 15 0.478 -5.287 3.118 1.00 0.00 H new ATOM 0 HG22 ILE A 15 1.132 -4.628 4.636 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.012 -3.667 3.669 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -0.114 -3.031 0.165 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -0.506 -4.035 1.582 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -0.158 -2.302 1.788 1.00 0.00 H new ATOM 222 N LEU A 16 4.816 -2.516 3.251 1.00 0.00 N ATOM 223 CA LEU A 16 6.213 -2.635 3.642 1.00 0.00 C ATOM 224 C LEU A 16 6.543 -1.705 4.812 1.00 0.00 C ATOM 225 O LEU A 16 7.293 -2.073 5.712 1.00 0.00 O ATOM 226 CB LEU A 16 7.103 -2.323 2.441 1.00 0.00 C ATOM 227 CG LEU A 16 8.289 -3.262 2.257 1.00 0.00 C ATOM 228 CD1 LEU A 16 7.843 -4.698 2.466 1.00 0.00 C ATOM 229 CD2 LEU A 16 8.882 -3.080 0.872 1.00 0.00 C ATOM 0 H LEU A 16 4.672 -2.268 2.272 1.00 0.00 H new ATOM 0 HA LEU A 16 6.397 -3.657 3.974 1.00 0.00 H new ATOM 0 HB2 LEU A 16 6.493 -2.352 1.538 1.00 0.00 H new ATOM 0 HB3 LEU A 16 7.477 -1.304 2.540 1.00 0.00 H new ATOM 0 HG LEU A 16 9.057 -3.026 2.994 1.00 0.00 H new ATOM 0 HD11 LEU A 16 8.694 -5.366 2.334 1.00 0.00 H new ATOM 0 HD12 LEU A 16 7.445 -4.812 3.474 1.00 0.00 H new ATOM 0 HD13 LEU A 16 7.069 -4.948 1.740 1.00 0.00 H new ATOM 0 HD21 LEU A 16 9.729 -3.754 0.748 1.00 0.00 H new ATOM 0 HD22 LEU A 16 8.126 -3.305 0.120 1.00 0.00 H new ATOM 0 HD23 LEU A 16 9.218 -2.050 0.752 1.00 0.00 H new ATOM 241 N HIS A 17 5.959 -0.512 4.804 1.00 0.00 N ATOM 242 CA HIS A 17 6.174 0.465 5.880 1.00 0.00 C ATOM 243 C HIS A 17 5.370 0.141 7.129 1.00 0.00 C ATOM 244 O HIS A 17 5.552 0.782 8.162 1.00 0.00 O ATOM 245 CB HIS A 17 5.789 1.880 5.458 1.00 0.00 C ATOM 246 CG HIS A 17 6.689 2.490 4.447 1.00 0.00 C ATOM 247 ND1 HIS A 17 8.051 2.573 4.595 1.00 0.00 N ATOM 248 CD2 HIS A 17 6.398 3.063 3.269 1.00 0.00 C ATOM 249 CE1 HIS A 17 8.570 3.172 3.541 1.00 0.00 C ATOM 250 NE2 HIS A 17 7.586 3.481 2.715 1.00 0.00 N ATOM 0 H HIS A 17 5.331 -0.192 4.066 1.00 0.00 H new ATOM 0 HA HIS A 17 7.241 0.408 6.096 1.00 0.00 H new ATOM 0 HB2 HIS A 17 4.775 1.863 5.059 1.00 0.00 H new ATOM 0 HB3 HIS A 17 5.773 2.517 6.342 1.00 0.00 H new ATOM 0 HD1 HIS A 17 8.579 2.226 5.395 1.00 0.00 H new ATOM 0 HD2 HIS A 17 5.415 3.175 2.836 1.00 0.00 H new ATOM 0 HE1 HIS A 17 9.619 3.375 3.381 1.00 0.00 H new ATOM 259 N ASP A 18 4.459 -0.813 7.052 1.00 0.00 N ATOM 260 CA ASP A 18 3.636 -1.111 8.210 1.00 0.00 C ATOM 261 C ASP A 18 4.422 -1.952 9.196 1.00 0.00 C ATOM 262 O ASP A 18 4.212 -1.872 10.404 1.00 0.00 O ATOM 263 CB ASP A 18 2.335 -1.800 7.825 1.00 0.00 C ATOM 264 CG ASP A 18 1.236 -1.472 8.815 1.00 0.00 C ATOM 265 OD1 ASP A 18 1.003 -0.261 9.058 1.00 0.00 O ATOM 266 OD2 ASP A 18 0.607 -2.400 9.353 1.00 0.00 O ATOM 0 H ASP A 18 4.273 -1.380 6.225 1.00 0.00 H new ATOM 0 HA ASP A 18 3.365 -0.166 8.681 1.00 0.00 H new ATOM 0 HB2 ASP A 18 2.035 -1.486 6.825 1.00 0.00 H new ATOM 0 HB3 ASP A 18 2.487 -2.879 7.789 1.00 0.00 H new ATOM 271 N ASP A 19 5.354 -2.737 8.670 1.00 0.00 N ATOM 272 CA ASP A 19 6.271 -3.493 9.507 1.00 0.00 C ATOM 273 C ASP A 19 7.646 -2.851 9.423 1.00 0.00 C ATOM 274 O ASP A 19 8.564 -3.179 10.176 1.00 0.00 O ATOM 275 CB ASP A 19 6.325 -4.955 9.053 1.00 0.00 C ATOM 276 CG ASP A 19 7.180 -5.823 9.956 1.00 0.00 C ATOM 277 OD1 ASP A 19 6.745 -6.111 11.092 1.00 0.00 O ATOM 278 OD2 ASP A 19 8.280 -6.239 9.537 1.00 0.00 O ATOM 0 H ASP A 19 5.493 -2.865 7.668 1.00 0.00 H new ATOM 0 HA ASP A 19 5.926 -3.480 10.541 1.00 0.00 H new ATOM 0 HB2 ASP A 19 5.313 -5.358 9.022 1.00 0.00 H new ATOM 0 HB3 ASP A 19 6.717 -5.000 8.037 1.00 0.00 H new ATOM 283 N GLU A 20 7.739 -1.889 8.502 1.00 0.00 N ATOM 284 CA GLU A 20 8.980 -1.208 8.168 1.00 0.00 C ATOM 285 C GLU A 20 10.069 -2.208 7.857 1.00 0.00 C ATOM 286 O GLU A 20 11.184 -2.131 8.372 1.00 0.00 O ATOM 287 CB GLU A 20 9.387 -0.241 9.267 1.00 0.00 C ATOM 288 CG GLU A 20 8.575 1.035 9.201 1.00 0.00 C ATOM 289 CD GLU A 20 9.075 2.001 8.142 1.00 0.00 C ATOM 290 OE1 GLU A 20 8.943 1.701 6.936 1.00 0.00 O ATOM 291 OE2 GLU A 20 9.586 3.079 8.510 1.00 0.00 O ATOM 0 H GLU A 20 6.938 -1.560 7.962 1.00 0.00 H new ATOM 0 HA GLU A 20 8.817 -0.614 7.269 1.00 0.00 H new ATOM 0 HB2 GLU A 20 9.249 -0.713 10.240 1.00 0.00 H new ATOM 0 HB3 GLU A 20 10.447 -0.006 9.174 1.00 0.00 H new ATOM 0 HG2 GLU A 20 7.534 0.787 8.996 1.00 0.00 H new ATOM 0 HG3 GLU A 20 8.600 1.526 10.174 1.00 0.00 H new ATOM 298 N VAL A 21 9.730 -3.138 6.986 1.00 0.00 N ATOM 299 CA VAL A 21 10.587 -4.228 6.661 1.00 0.00 C ATOM 300 C VAL A 21 11.305 -3.910 5.354 1.00 0.00 C ATOM 301 O VAL A 21 10.959 -2.943 4.674 1.00 0.00 O ATOM 302 CB VAL A 21 9.756 -5.532 6.600 1.00 0.00 C ATOM 303 CG1 VAL A 21 8.630 -5.417 5.590 1.00 0.00 C ATOM 304 CG2 VAL A 21 10.625 -6.756 6.340 1.00 0.00 C ATOM 0 H VAL A 21 8.840 -3.146 6.487 1.00 0.00 H new ATOM 0 HA VAL A 21 11.350 -4.378 7.425 1.00 0.00 H new ATOM 0 HB VAL A 21 9.306 -5.674 7.583 1.00 0.00 H new ATOM 0 HG11 VAL A 21 8.063 -6.348 5.569 1.00 0.00 H new ATOM 0 HG12 VAL A 21 7.970 -4.597 5.873 1.00 0.00 H new ATOM 0 HG13 VAL A 21 9.046 -5.223 4.601 1.00 0.00 H new ATOM 0 HG21 VAL A 21 9.998 -7.647 6.306 1.00 0.00 H new ATOM 0 HG22 VAL A 21 11.142 -6.639 5.388 1.00 0.00 H new ATOM 0 HG23 VAL A 21 11.358 -6.859 7.140 1.00 0.00 H new ATOM 314 N THR A 22 12.298 -4.705 5.032 1.00 0.00 N ATOM 315 CA THR A 22 13.225 -4.420 3.940 1.00 0.00 C ATOM 316 C THR A 22 12.533 -4.122 2.627 1.00 0.00 C ATOM 317 O THR A 22 11.546 -4.760 2.249 1.00 0.00 O ATOM 318 CB THR A 22 14.215 -5.567 3.755 1.00 0.00 C ATOM 319 OG1 THR A 22 13.535 -6.812 3.550 1.00 0.00 O ATOM 320 CG2 THR A 22 15.087 -5.668 4.967 1.00 0.00 C ATOM 0 H THR A 22 12.495 -5.579 5.520 1.00 0.00 H new ATOM 0 HA THR A 22 13.760 -3.516 4.231 1.00 0.00 H new ATOM 0 HB THR A 22 14.820 -5.360 2.872 1.00 0.00 H new ATOM 0 HG1 THR A 22 14.193 -7.529 3.433 1.00 0.00 H new ATOM 0 HG21 THR A 22 15.795 -6.486 4.838 1.00 0.00 H new ATOM 0 HG22 THR A 22 15.632 -4.734 5.102 1.00 0.00 H new ATOM 0 HG23 THR A 22 14.469 -5.857 5.845 1.00 0.00 H new ATOM 328 N VAL A 23 13.080 -3.145 1.935 1.00 0.00 N ATOM 329 CA VAL A 23 12.494 -2.647 0.719 1.00 0.00 C ATOM 330 C VAL A 23 13.333 -3.048 -0.479 1.00 0.00 C ATOM 331 O VAL A 23 14.415 -2.503 -0.709 1.00 0.00 O ATOM 332 CB VAL A 23 12.367 -1.121 0.761 1.00 0.00 C ATOM 333 CG1 VAL A 23 11.739 -0.611 -0.525 1.00 0.00 C ATOM 334 CG2 VAL A 23 11.561 -0.689 1.977 1.00 0.00 C ATOM 0 H VAL A 23 13.945 -2.676 2.204 1.00 0.00 H new ATOM 0 HA VAL A 23 11.500 -3.084 0.625 1.00 0.00 H new ATOM 0 HB VAL A 23 13.362 -0.685 0.847 1.00 0.00 H new ATOM 0 HG11 VAL A 23 11.654 0.475 -0.483 1.00 0.00 H new ATOM 0 HG12 VAL A 23 12.364 -0.893 -1.372 1.00 0.00 H new ATOM 0 HG13 VAL A 23 10.748 -1.048 -0.644 1.00 0.00 H new ATOM 0 HG21 VAL A 23 11.480 0.398 1.992 1.00 0.00 H new ATOM 0 HG22 VAL A 23 10.564 -1.127 1.927 1.00 0.00 H new ATOM 0 HG23 VAL A 23 12.061 -1.028 2.884 1.00 0.00 H new ATOM 344 N THR A 24 12.832 -4.001 -1.236 1.00 0.00 N ATOM 345 CA THR A 24 13.510 -4.460 -2.430 1.00 0.00 C ATOM 346 C THR A 24 12.537 -4.505 -3.594 1.00 0.00 C ATOM 347 O THR A 24 11.322 -4.614 -3.389 1.00 0.00 O ATOM 348 CB THR A 24 14.143 -5.861 -2.262 1.00 0.00 C ATOM 349 OG1 THR A 24 13.144 -6.828 -1.928 1.00 0.00 O ATOM 350 CG2 THR A 24 15.223 -5.867 -1.199 1.00 0.00 C ATOM 0 H THR A 24 11.950 -4.476 -1.044 1.00 0.00 H new ATOM 0 HA THR A 24 14.314 -3.749 -2.621 1.00 0.00 H new ATOM 0 HB THR A 24 14.600 -6.122 -3.217 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.468 -7.725 -2.154 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.642 -6.869 -1.112 1.00 0.00 H new ATOM 0 HG22 THR A 24 16.011 -5.167 -1.477 1.00 0.00 H new ATOM 0 HG23 THR A 24 14.794 -5.569 -0.242 1.00 0.00 H new ATOM 358 N GLU A 25 13.059 -4.422 -4.803 1.00 0.00 N ATOM 359 CA GLU A 25 12.229 -4.480 -5.992 1.00 0.00 C ATOM 360 C GLU A 25 11.372 -5.743 -5.965 1.00 0.00 C ATOM 361 O GLU A 25 10.169 -5.704 -6.226 1.00 0.00 O ATOM 362 CB GLU A 25 13.115 -4.442 -7.238 1.00 0.00 C ATOM 363 CG GLU A 25 12.345 -4.432 -8.540 1.00 0.00 C ATOM 364 CD GLU A 25 12.487 -5.728 -9.306 1.00 0.00 C ATOM 365 OE1 GLU A 25 13.635 -6.161 -9.544 1.00 0.00 O ATOM 366 OE2 GLU A 25 11.451 -6.327 -9.667 1.00 0.00 O ATOM 0 H GLU A 25 14.056 -4.314 -4.988 1.00 0.00 H new ATOM 0 HA GLU A 25 11.562 -3.618 -6.017 1.00 0.00 H new ATOM 0 HB2 GLU A 25 13.747 -3.555 -7.195 1.00 0.00 H new ATOM 0 HB3 GLU A 25 13.778 -5.307 -7.226 1.00 0.00 H new ATOM 0 HG2 GLU A 25 11.290 -4.249 -8.333 1.00 0.00 H new ATOM 0 HG3 GLU A 25 12.696 -3.607 -9.160 1.00 0.00 H new ATOM 373 N ASP A 26 12.002 -6.847 -5.589 1.00 0.00 N ATOM 374 CA ASP A 26 11.329 -8.139 -5.514 1.00 0.00 C ATOM 375 C ASP A 26 10.298 -8.169 -4.381 1.00 0.00 C ATOM 376 O ASP A 26 9.328 -8.920 -4.440 1.00 0.00 O ATOM 377 CB ASP A 26 12.353 -9.269 -5.333 1.00 0.00 C ATOM 378 CG ASP A 26 12.821 -9.445 -3.901 1.00 0.00 C ATOM 379 OD1 ASP A 26 12.186 -10.219 -3.153 1.00 0.00 O ATOM 380 OD2 ASP A 26 13.837 -8.824 -3.524 1.00 0.00 O ATOM 0 H ASP A 26 12.988 -6.874 -5.329 1.00 0.00 H new ATOM 0 HA ASP A 26 10.798 -8.291 -6.454 1.00 0.00 H new ATOM 0 HB2 ASP A 26 11.914 -10.204 -5.680 1.00 0.00 H new ATOM 0 HB3 ASP A 26 13.217 -9.069 -5.966 1.00 0.00 H new ATOM 385 N LYS A 27 10.501 -7.339 -3.361 1.00 0.00 N ATOM 386 CA LYS A 27 9.583 -7.259 -2.242 1.00 0.00 C ATOM 387 C LYS A 27 8.294 -6.604 -2.728 1.00 0.00 C ATOM 388 O LYS A 27 7.190 -7.147 -2.581 1.00 0.00 O ATOM 389 CB LYS A 27 10.231 -6.410 -1.141 1.00 0.00 C ATOM 390 CG LYS A 27 9.752 -6.690 0.271 1.00 0.00 C ATOM 391 CD LYS A 27 10.401 -7.929 0.882 1.00 0.00 C ATOM 392 CE LYS A 27 11.901 -7.980 0.631 1.00 0.00 C ATOM 393 NZ LYS A 27 12.517 -9.186 1.242 1.00 0.00 N ATOM 0 H LYS A 27 11.301 -6.710 -3.292 1.00 0.00 H new ATOM 0 HA LYS A 27 9.358 -8.249 -1.844 1.00 0.00 H new ATOM 0 HB2 LYS A 27 11.310 -6.563 -1.177 1.00 0.00 H new ATOM 0 HB3 LYS A 27 10.051 -5.359 -1.365 1.00 0.00 H new ATOM 0 HG2 LYS A 27 9.966 -5.826 0.900 1.00 0.00 H new ATOM 0 HG3 LYS A 27 8.670 -6.819 0.264 1.00 0.00 H new ATOM 0 HD2 LYS A 27 10.214 -7.942 1.956 1.00 0.00 H new ATOM 0 HD3 LYS A 27 9.935 -8.823 0.467 1.00 0.00 H new ATOM 0 HE2 LYS A 27 12.091 -7.978 -0.442 1.00 0.00 H new ATOM 0 HE3 LYS A 27 12.370 -7.085 1.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 13.539 -9.188 1.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 12.357 -9.175 2.269 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 12.087 -10.040 0.834 1.00 0.00 H new ATOM 407 N ILE A 28 8.466 -5.447 -3.356 1.00 0.00 N ATOM 408 CA ILE A 28 7.356 -4.702 -3.927 1.00 0.00 C ATOM 409 C ILE A 28 6.661 -5.529 -5.002 1.00 0.00 C ATOM 410 O ILE A 28 5.435 -5.556 -5.082 1.00 0.00 O ATOM 411 CB ILE A 28 7.846 -3.366 -4.527 1.00 0.00 C ATOM 412 CG1 ILE A 28 8.542 -2.536 -3.444 1.00 0.00 C ATOM 413 CG2 ILE A 28 6.690 -2.587 -5.144 1.00 0.00 C ATOM 414 CD1 ILE A 28 9.144 -1.246 -3.950 1.00 0.00 C ATOM 0 H ILE A 28 9.375 -5.002 -3.482 1.00 0.00 H new ATOM 0 HA ILE A 28 6.645 -4.486 -3.129 1.00 0.00 H new ATOM 0 HB ILE A 28 8.560 -3.582 -5.321 1.00 0.00 H new ATOM 0 HG12 ILE A 28 7.822 -2.305 -2.659 1.00 0.00 H new ATOM 0 HG13 ILE A 28 9.328 -3.138 -2.989 1.00 0.00 H new ATOM 0 HG21 ILE A 28 7.063 -1.651 -5.559 1.00 0.00 H new ATOM 0 HG22 ILE A 28 6.234 -3.180 -5.937 1.00 0.00 H new ATOM 0 HG23 ILE A 28 5.945 -2.373 -4.377 1.00 0.00 H new ATOM 0 HD11 ILE A 28 9.618 -0.717 -3.123 1.00 0.00 H new ATOM 0 HD12 ILE A 28 9.889 -1.467 -4.714 1.00 0.00 H new ATOM 0 HD13 ILE A 28 8.360 -0.622 -4.379 1.00 0.00 H new ATOM 426 N ASN A 29 7.462 -6.223 -5.807 1.00 0.00 N ATOM 427 CA ASN A 29 6.949 -7.113 -6.844 1.00 0.00 C ATOM 428 C ASN A 29 6.096 -8.210 -6.213 1.00 0.00 C ATOM 429 O ASN A 29 5.047 -8.582 -6.740 1.00 0.00 O ATOM 430 CB ASN A 29 8.117 -7.726 -7.632 1.00 0.00 C ATOM 431 CG ASN A 29 7.689 -8.444 -8.904 1.00 0.00 C ATOM 432 OD1 ASN A 29 6.607 -9.023 -8.991 1.00 0.00 O ATOM 433 ND2 ASN A 29 8.550 -8.406 -9.908 1.00 0.00 N ATOM 0 H ASN A 29 8.480 -6.184 -5.759 1.00 0.00 H new ATOM 0 HA ASN A 29 6.327 -6.541 -7.532 1.00 0.00 H new ATOM 0 HB2 ASN A 29 8.822 -6.937 -7.891 1.00 0.00 H new ATOM 0 HB3 ASN A 29 8.647 -8.429 -6.990 1.00 0.00 H new ATOM 0 HD21 ASN A 29 8.326 -8.866 -10.790 1.00 0.00 H new ATOM 0 HD22 ASN A 29 9.438 -7.916 -9.800 1.00 0.00 H new ATOM 440 N ALA A 30 6.541 -8.711 -5.066 1.00 0.00 N ATOM 441 CA ALA A 30 5.791 -9.724 -4.339 1.00 0.00 C ATOM 442 C ALA A 30 4.419 -9.200 -3.930 1.00 0.00 C ATOM 443 O ALA A 30 3.420 -9.906 -4.083 1.00 0.00 O ATOM 444 CB ALA A 30 6.566 -10.199 -3.122 1.00 0.00 C ATOM 0 H ALA A 30 7.416 -8.432 -4.622 1.00 0.00 H new ATOM 0 HA ALA A 30 5.644 -10.574 -5.005 1.00 0.00 H new ATOM 0 HB1 ALA A 30 5.986 -10.956 -2.594 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.517 -10.627 -3.440 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.752 -9.355 -2.457 1.00 0.00 H new ATOM 450 N LEU A 31 4.363 -7.966 -3.412 1.00 0.00 N ATOM 451 CA LEU A 31 3.067 -7.334 -3.114 1.00 0.00 C ATOM 452 C LEU A 31 2.229 -7.217 -4.386 1.00 0.00 C ATOM 453 O LEU A 31 1.052 -7.597 -4.411 1.00 0.00 O ATOM 454 CB LEU A 31 3.228 -5.937 -2.501 1.00 0.00 C ATOM 455 CG LEU A 31 3.594 -5.871 -1.014 1.00 0.00 C ATOM 456 CD1 LEU A 31 2.909 -6.978 -0.234 1.00 0.00 C ATOM 457 CD2 LEU A 31 5.097 -5.913 -0.820 1.00 0.00 C ATOM 0 H LEU A 31 5.179 -7.394 -3.194 1.00 0.00 H new ATOM 0 HA LEU A 31 2.567 -7.973 -2.386 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.996 -5.406 -3.063 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.294 -5.393 -2.645 1.00 0.00 H new ATOM 0 HG LEU A 31 3.235 -4.919 -0.623 1.00 0.00 H new ATOM 0 HD11 LEU A 31 3.186 -6.907 0.818 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.828 -6.877 -0.332 1.00 0.00 H new ATOM 0 HD13 LEU A 31 3.220 -7.946 -0.627 1.00 0.00 H new ATOM 0 HD21 LEU A 31 5.328 -5.865 0.244 1.00 0.00 H new ATOM 0 HD22 LEU A 31 5.492 -6.840 -1.235 1.00 0.00 H new ATOM 0 HD23 LEU A 31 5.553 -5.064 -1.329 1.00 0.00 H new ATOM 469 N ILE A 32 2.859 -6.687 -5.433 1.00 0.00 N ATOM 470 CA ILE A 32 2.243 -6.529 -6.750 1.00 0.00 C ATOM 471 C ILE A 32 1.529 -7.806 -7.187 1.00 0.00 C ATOM 472 O ILE A 32 0.341 -7.785 -7.539 1.00 0.00 O ATOM 473 CB ILE A 32 3.316 -6.160 -7.805 1.00 0.00 C ATOM 474 CG1 ILE A 32 3.814 -4.731 -7.580 1.00 0.00 C ATOM 475 CG2 ILE A 32 2.783 -6.326 -9.220 1.00 0.00 C ATOM 476 CD1 ILE A 32 4.997 -4.355 -8.451 1.00 0.00 C ATOM 0 H ILE A 32 3.821 -6.352 -5.391 1.00 0.00 H new ATOM 0 HA ILE A 32 1.509 -5.727 -6.674 1.00 0.00 H new ATOM 0 HB ILE A 32 4.155 -6.846 -7.685 1.00 0.00 H new ATOM 0 HG12 ILE A 32 2.997 -4.036 -7.772 1.00 0.00 H new ATOM 0 HG13 ILE A 32 4.093 -4.613 -6.533 1.00 0.00 H new ATOM 0 HG21 ILE A 32 3.561 -6.059 -9.935 1.00 0.00 H new ATOM 0 HG22 ILE A 32 2.486 -7.363 -9.377 1.00 0.00 H new ATOM 0 HG23 ILE A 32 1.920 -5.675 -9.362 1.00 0.00 H new ATOM 0 HD11 ILE A 32 5.295 -3.329 -8.237 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.830 -5.026 -8.242 1.00 0.00 H new ATOM 0 HD13 ILE A 32 4.717 -4.440 -9.501 1.00 0.00 H new ATOM 488 N LYS A 33 2.257 -8.913 -7.139 1.00 0.00 N ATOM 489 CA LYS A 33 1.738 -10.195 -7.584 1.00 0.00 C ATOM 490 C LYS A 33 0.706 -10.750 -6.609 1.00 0.00 C ATOM 491 O LYS A 33 -0.247 -11.415 -7.017 1.00 0.00 O ATOM 492 CB LYS A 33 2.868 -11.194 -7.768 1.00 0.00 C ATOM 493 CG LYS A 33 3.838 -10.797 -8.859 1.00 0.00 C ATOM 494 CD LYS A 33 3.163 -10.750 -10.219 1.00 0.00 C ATOM 495 CE LYS A 33 4.179 -10.644 -11.348 1.00 0.00 C ATOM 496 NZ LYS A 33 5.074 -9.465 -11.209 1.00 0.00 N ATOM 0 H LYS A 33 3.216 -8.946 -6.793 1.00 0.00 H new ATOM 0 HA LYS A 33 1.245 -10.033 -8.543 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.410 -11.298 -6.828 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.446 -12.171 -8.003 1.00 0.00 H new ATOM 0 HG2 LYS A 33 4.264 -9.820 -8.630 1.00 0.00 H new ATOM 0 HG3 LYS A 33 4.665 -11.507 -8.887 1.00 0.00 H new ATOM 0 HD2 LYS A 33 2.558 -11.646 -10.356 1.00 0.00 H new ATOM 0 HD3 LYS A 33 2.484 -9.898 -10.259 1.00 0.00 H new ATOM 0 HE2 LYS A 33 4.782 -11.551 -11.374 1.00 0.00 H new ATOM 0 HE3 LYS A 33 3.652 -10.584 -12.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 5.603 -9.324 -12.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 4.504 -8.618 -11.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 5.742 -9.626 -10.428 1.00 0.00 H new ATOM 510 N ALA A 34 0.899 -10.472 -5.323 1.00 0.00 N ATOM 511 CA ALA A 34 -0.004 -10.960 -4.291 1.00 0.00 C ATOM 512 C ALA A 34 -1.401 -10.394 -4.476 1.00 0.00 C ATOM 513 O ALA A 34 -2.391 -11.118 -4.367 1.00 0.00 O ATOM 514 CB ALA A 34 0.519 -10.609 -2.909 1.00 0.00 C ATOM 0 H ALA A 34 1.675 -9.910 -4.972 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.056 -12.045 -4.382 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.171 -10.983 -2.153 1.00 0.00 H new ATOM 0 HB2 ALA A 34 1.498 -11.065 -2.764 1.00 0.00 H new ATOM 0 HB3 ALA A 34 0.606 -9.526 -2.817 1.00 0.00 H new ATOM 520 N ALA A 35 -1.476 -9.099 -4.753 1.00 0.00 N ATOM 521 CA ALA A 35 -2.757 -8.450 -4.978 1.00 0.00 C ATOM 522 C ALA A 35 -3.233 -8.668 -6.407 1.00 0.00 C ATOM 523 O ALA A 35 -4.431 -8.727 -6.674 1.00 0.00 O ATOM 524 CB ALA A 35 -2.662 -6.965 -4.677 1.00 0.00 C ATOM 0 H ALA A 35 -0.668 -8.481 -4.827 1.00 0.00 H new ATOM 0 HA ALA A 35 -3.485 -8.898 -4.302 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -3.630 -6.496 -4.851 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -2.372 -6.823 -3.636 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -1.916 -6.509 -5.327 1.00 0.00 H new ATOM 530 N GLY A 36 -2.276 -8.791 -7.320 1.00 0.00 N ATOM 531 CA GLY A 36 -2.599 -8.976 -8.718 1.00 0.00 C ATOM 532 C GLY A 36 -2.595 -7.664 -9.473 1.00 0.00 C ATOM 533 O GLY A 36 -3.094 -7.577 -10.596 1.00 0.00 O ATOM 0 H GLY A 36 -1.278 -8.765 -7.113 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -1.879 -9.658 -9.170 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -3.580 -9.443 -8.806 1.00 0.00 H new ATOM 537 N VAL A 37 -2.005 -6.643 -8.866 1.00 0.00 N ATOM 538 CA VAL A 37 -2.032 -5.307 -9.434 1.00 0.00 C ATOM 539 C VAL A 37 -0.629 -4.850 -9.800 1.00 0.00 C ATOM 540 O VAL A 37 0.255 -4.732 -8.953 1.00 0.00 O ATOM 541 CB VAL A 37 -2.739 -4.298 -8.492 1.00 0.00 C ATOM 542 CG1 VAL A 37 -2.136 -4.293 -7.093 1.00 0.00 C ATOM 543 CG2 VAL A 37 -2.739 -2.901 -9.101 1.00 0.00 C ATOM 0 H VAL A 37 -1.503 -6.717 -7.981 1.00 0.00 H new ATOM 0 HA VAL A 37 -2.620 -5.345 -10.351 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.773 -4.625 -8.384 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -2.665 -3.571 -6.471 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -2.228 -5.286 -6.654 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.083 -4.019 -7.152 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -3.240 -2.209 -8.424 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -1.712 -2.573 -9.260 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.266 -2.920 -10.055 1.00 0.00 H new ATOM 553 N ASN A 38 -0.452 -4.591 -11.087 1.00 0.00 N ATOM 554 CA ASN A 38 0.862 -4.401 -11.679 1.00 0.00 C ATOM 555 C ASN A 38 1.211 -2.932 -11.780 1.00 0.00 C ATOM 556 O ASN A 38 0.340 -2.064 -11.777 1.00 0.00 O ATOM 557 CB ASN A 38 0.889 -5.056 -13.062 1.00 0.00 C ATOM 558 CG ASN A 38 2.281 -5.100 -13.668 1.00 0.00 C ATOM 559 OD1 ASN A 38 3.279 -5.193 -12.953 1.00 0.00 O ATOM 560 ND2 ASN A 38 2.361 -5.029 -14.986 1.00 0.00 N ATOM 0 H ASN A 38 -1.220 -4.506 -11.753 1.00 0.00 H new ATOM 0 HA ASN A 38 1.608 -4.870 -11.038 1.00 0.00 H new ATOM 0 HB2 ASN A 38 0.499 -6.071 -12.985 1.00 0.00 H new ATOM 0 HB3 ASN A 38 0.224 -4.509 -13.731 1.00 0.00 H new ATOM 0 HD21 ASN A 38 3.272 -5.051 -15.444 1.00 0.00 H new ATOM 0 HD22 ASN A 38 1.511 -4.953 -15.545 1.00 0.00 H new ATOM 567 N VAL A 39 2.503 -2.671 -11.878 1.00 0.00 N ATOM 568 CA VAL A 39 3.033 -1.334 -11.816 1.00 0.00 C ATOM 569 C VAL A 39 3.934 -1.060 -13.013 1.00 0.00 C ATOM 570 O VAL A 39 4.350 -1.985 -13.709 1.00 0.00 O ATOM 571 CB VAL A 39 3.838 -1.183 -10.526 1.00 0.00 C ATOM 572 CG1 VAL A 39 4.445 0.208 -10.391 1.00 0.00 C ATOM 573 CG2 VAL A 39 2.980 -1.522 -9.321 1.00 0.00 C ATOM 0 H VAL A 39 3.214 -3.392 -12.004 1.00 0.00 H new ATOM 0 HA VAL A 39 2.209 -0.620 -11.833 1.00 0.00 H new ATOM 0 HB VAL A 39 4.667 -1.889 -10.572 1.00 0.00 H new ATOM 0 HG11 VAL A 39 5.008 0.270 -9.460 1.00 0.00 H new ATOM 0 HG12 VAL A 39 5.112 0.397 -11.232 1.00 0.00 H new ATOM 0 HG13 VAL A 39 3.649 0.953 -10.384 1.00 0.00 H new ATOM 0 HG21 VAL A 39 3.570 -1.409 -8.411 1.00 0.00 H new ATOM 0 HG22 VAL A 39 2.123 -0.850 -9.284 1.00 0.00 H new ATOM 0 HG23 VAL A 39 2.630 -2.551 -9.401 1.00 0.00 H new ATOM 583 N GLU A 40 4.207 0.215 -13.258 1.00 0.00 N ATOM 584 CA GLU A 40 5.238 0.615 -14.181 1.00 0.00 C ATOM 585 C GLU A 40 6.580 0.293 -13.534 1.00 0.00 C ATOM 586 O GLU A 40 6.988 0.968 -12.600 1.00 0.00 O ATOM 587 CB GLU A 40 5.109 2.103 -14.463 1.00 0.00 C ATOM 588 CG GLU A 40 6.167 2.600 -15.401 1.00 0.00 C ATOM 589 CD GLU A 40 5.933 2.178 -16.835 1.00 0.00 C ATOM 590 OE1 GLU A 40 5.118 2.823 -17.529 1.00 0.00 O ATOM 591 OE2 GLU A 40 6.559 1.191 -17.274 1.00 0.00 O ATOM 0 H GLU A 40 3.715 0.993 -12.818 1.00 0.00 H new ATOM 0 HA GLU A 40 5.152 0.086 -15.130 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.126 2.306 -14.888 1.00 0.00 H new ATOM 0 HB3 GLU A 40 5.171 2.655 -13.525 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.207 3.688 -15.350 1.00 0.00 H new ATOM 0 HG3 GLU A 40 7.138 2.230 -15.073 1.00 0.00 H new ATOM 598 N PRO A 41 7.263 -0.757 -14.018 1.00 0.00 N ATOM 599 CA PRO A 41 8.388 -1.404 -13.312 1.00 0.00 C ATOM 600 C PRO A 41 9.499 -0.456 -12.825 1.00 0.00 C ATOM 601 O PRO A 41 10.201 -0.753 -11.834 1.00 0.00 O ATOM 602 CB PRO A 41 8.940 -2.374 -14.353 1.00 0.00 C ATOM 603 CG PRO A 41 7.767 -2.698 -15.201 1.00 0.00 C ATOM 604 CD PRO A 41 6.979 -1.424 -15.298 1.00 0.00 C ATOM 0 HA PRO A 41 8.035 -1.862 -12.388 1.00 0.00 H new ATOM 0 HB2 PRO A 41 9.741 -1.920 -14.937 1.00 0.00 H new ATOM 0 HB3 PRO A 41 9.354 -3.268 -13.886 1.00 0.00 H new ATOM 0 HG2 PRO A 41 8.079 -3.043 -16.187 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.171 -3.496 -14.758 1.00 0.00 H new ATOM 0 HD2 PRO A 41 7.295 -0.818 -16.147 1.00 0.00 H new ATOM 0 HD3 PRO A 41 5.914 -1.618 -15.424 1.00 0.00 H new ATOM 612 N PHE A 42 9.679 0.672 -13.507 1.00 0.00 N ATOM 613 CA PHE A 42 10.671 1.650 -13.082 1.00 0.00 C ATOM 614 C PHE A 42 10.319 2.158 -11.688 1.00 0.00 C ATOM 615 O PHE A 42 11.201 2.543 -10.922 1.00 0.00 O ATOM 616 CB PHE A 42 10.785 2.816 -14.081 1.00 0.00 C ATOM 617 CG PHE A 42 10.001 4.049 -13.714 1.00 0.00 C ATOM 618 CD1 PHE A 42 10.553 5.012 -12.885 1.00 0.00 C ATOM 619 CD2 PHE A 42 8.722 4.245 -14.202 1.00 0.00 C ATOM 620 CE1 PHE A 42 9.840 6.146 -12.548 1.00 0.00 C ATOM 621 CE2 PHE A 42 8.006 5.376 -13.870 1.00 0.00 C ATOM 622 CZ PHE A 42 8.565 6.328 -13.041 1.00 0.00 C ATOM 0 H PHE A 42 9.157 0.928 -14.345 1.00 0.00 H new ATOM 0 HA PHE A 42 11.646 1.163 -13.051 1.00 0.00 H new ATOM 0 HB2 PHE A 42 11.836 3.088 -14.180 1.00 0.00 H new ATOM 0 HB3 PHE A 42 10.452 2.470 -15.059 1.00 0.00 H new ATOM 0 HD1 PHE A 42 11.552 4.875 -12.498 1.00 0.00 H new ATOM 0 HD2 PHE A 42 8.279 3.504 -14.851 1.00 0.00 H new ATOM 0 HE1 PHE A 42 10.280 6.889 -11.899 1.00 0.00 H new ATOM 0 HE2 PHE A 42 7.008 5.517 -14.258 1.00 0.00 H new ATOM 0 HZ PHE A 42 8.005 7.213 -12.779 1.00 0.00 H new ATOM 632 N TRP A 43 9.026 2.138 -11.371 1.00 0.00 N ATOM 633 CA TRP A 43 8.558 2.513 -10.050 1.00 0.00 C ATOM 634 C TRP A 43 9.071 1.544 -8.996 1.00 0.00 C ATOM 635 O TRP A 43 9.748 1.979 -8.099 1.00 0.00 O ATOM 636 CB TRP A 43 7.034 2.590 -9.986 1.00 0.00 C ATOM 637 CG TRP A 43 6.457 3.855 -10.487 1.00 0.00 C ATOM 638 CD1 TRP A 43 5.528 3.971 -11.453 1.00 0.00 C ATOM 639 CD2 TRP A 43 6.753 5.174 -10.044 1.00 0.00 C ATOM 640 NE1 TRP A 43 5.185 5.273 -11.622 1.00 0.00 N ATOM 641 CE2 TRP A 43 5.932 6.046 -10.766 1.00 0.00 C ATOM 642 CE3 TRP A 43 7.623 5.693 -9.097 1.00 0.00 C ATOM 643 CZ2 TRP A 43 5.962 7.428 -10.560 1.00 0.00 C ATOM 644 CZ3 TRP A 43 7.659 7.057 -8.894 1.00 0.00 C ATOM 645 CH2 TRP A 43 6.828 7.911 -9.619 1.00 0.00 C ATOM 0 H TRP A 43 8.286 1.864 -12.017 1.00 0.00 H new ATOM 0 HA TRP A 43 8.955 3.507 -9.843 1.00 0.00 H new ATOM 0 HB2 TRP A 43 6.618 1.764 -10.562 1.00 0.00 H new ATOM 0 HB3 TRP A 43 6.720 2.448 -8.952 1.00 0.00 H new ATOM 0 HD1 TRP A 43 5.114 3.146 -12.014 1.00 0.00 H new ATOM 0 HE1 TRP A 43 4.486 5.621 -12.278 1.00 0.00 H new ATOM 0 HE3 TRP A 43 8.264 5.038 -8.526 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 5.323 8.091 -11.125 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 8.340 7.469 -8.164 1.00 0.00 H new ATOM 0 HH2 TRP A 43 6.870 8.974 -9.433 1.00 0.00 H new ATOM 656 N PRO A 44 8.766 0.221 -9.061 1.00 0.00 N ATOM 657 CA PRO A 44 9.343 -0.751 -8.127 1.00 0.00 C ATOM 658 C PRO A 44 10.847 -0.551 -7.955 1.00 0.00 C ATOM 659 O PRO A 44 11.365 -0.585 -6.832 1.00 0.00 O ATOM 660 CB PRO A 44 9.044 -2.093 -8.791 1.00 0.00 C ATOM 661 CG PRO A 44 7.775 -1.860 -9.529 1.00 0.00 C ATOM 662 CD PRO A 44 7.821 -0.428 -9.993 1.00 0.00 C ATOM 0 HA PRO A 44 8.929 -0.662 -7.123 1.00 0.00 H new ATOM 0 HB2 PRO A 44 9.847 -2.392 -9.464 1.00 0.00 H new ATOM 0 HB3 PRO A 44 8.935 -2.887 -8.052 1.00 0.00 H new ATOM 0 HG2 PRO A 44 7.685 -2.541 -10.375 1.00 0.00 H new ATOM 0 HG3 PRO A 44 6.912 -2.034 -8.886 1.00 0.00 H new ATOM 0 HD2 PRO A 44 8.164 -0.354 -11.025 1.00 0.00 H new ATOM 0 HD3 PRO A 44 6.836 0.037 -9.950 1.00 0.00 H new ATOM 670 N GLY A 45 11.540 -0.312 -9.071 1.00 0.00 N ATOM 671 CA GLY A 45 12.963 -0.021 -9.001 1.00 0.00 C ATOM 672 C GLY A 45 13.264 1.228 -8.179 1.00 0.00 C ATOM 673 O GLY A 45 13.937 1.157 -7.148 1.00 0.00 O ATOM 0 H GLY A 45 11.145 -0.315 -10.011 1.00 0.00 H new ATOM 0 HA2 GLY A 45 13.484 -0.873 -8.565 1.00 0.00 H new ATOM 0 HA3 GLY A 45 13.354 0.109 -10.010 1.00 0.00 H new ATOM 677 N LEU A 46 12.735 2.363 -8.628 1.00 0.00 N ATOM 678 CA LEU A 46 12.967 3.659 -7.995 1.00 0.00 C ATOM 679 C LEU A 46 12.412 3.707 -6.563 1.00 0.00 C ATOM 680 O LEU A 46 12.964 4.374 -5.687 1.00 0.00 O ATOM 681 CB LEU A 46 12.346 4.738 -8.891 1.00 0.00 C ATOM 682 CG LEU A 46 11.955 6.051 -8.220 1.00 0.00 C ATOM 683 CD1 LEU A 46 13.181 6.768 -7.676 1.00 0.00 C ATOM 684 CD2 LEU A 46 11.217 6.936 -9.210 1.00 0.00 C ATOM 0 H LEU A 46 12.129 2.410 -9.447 1.00 0.00 H new ATOM 0 HA LEU A 46 14.038 3.836 -7.896 1.00 0.00 H new ATOM 0 HB2 LEU A 46 13.052 4.963 -9.691 1.00 0.00 H new ATOM 0 HB3 LEU A 46 11.456 4.319 -9.360 1.00 0.00 H new ATOM 0 HG LEU A 46 11.296 5.830 -7.381 1.00 0.00 H new ATOM 0 HD11 LEU A 46 12.876 7.701 -7.202 1.00 0.00 H new ATOM 0 HD12 LEU A 46 13.678 6.134 -6.942 1.00 0.00 H new ATOM 0 HD13 LEU A 46 13.869 6.984 -8.493 1.00 0.00 H new ATOM 0 HD21 LEU A 46 10.940 7.872 -8.725 1.00 0.00 H new ATOM 0 HD22 LEU A 46 11.863 7.146 -10.062 1.00 0.00 H new ATOM 0 HD23 LEU A 46 10.317 6.426 -9.554 1.00 0.00 H new ATOM 696 N PHE A 47 11.334 2.986 -6.334 1.00 0.00 N ATOM 697 CA PHE A 47 10.739 2.866 -5.013 1.00 0.00 C ATOM 698 C PHE A 47 11.700 2.171 -4.067 1.00 0.00 C ATOM 699 O PHE A 47 11.953 2.650 -2.964 1.00 0.00 O ATOM 700 CB PHE A 47 9.428 2.078 -5.085 1.00 0.00 C ATOM 701 CG PHE A 47 8.193 2.924 -5.219 1.00 0.00 C ATOM 702 CD1 PHE A 47 8.051 3.844 -6.248 1.00 0.00 C ATOM 703 CD2 PHE A 47 7.163 2.790 -4.305 1.00 0.00 C ATOM 704 CE1 PHE A 47 6.902 4.610 -6.357 1.00 0.00 C ATOM 705 CE2 PHE A 47 6.018 3.550 -4.412 1.00 0.00 C ATOM 706 CZ PHE A 47 5.885 4.461 -5.439 1.00 0.00 C ATOM 0 H PHE A 47 10.842 2.464 -7.059 1.00 0.00 H new ATOM 0 HA PHE A 47 10.529 3.868 -4.639 1.00 0.00 H new ATOM 0 HB2 PHE A 47 9.477 1.394 -5.932 1.00 0.00 H new ATOM 0 HB3 PHE A 47 9.338 1.467 -4.187 1.00 0.00 H new ATOM 0 HD1 PHE A 47 8.844 3.964 -6.971 1.00 0.00 H new ATOM 0 HD2 PHE A 47 7.257 2.080 -3.497 1.00 0.00 H new ATOM 0 HE1 PHE A 47 6.803 5.324 -7.161 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.223 3.432 -3.690 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.987 5.055 -5.523 1.00 0.00 H new ATOM 716 N ALA A 48 12.258 1.052 -4.518 1.00 0.00 N ATOM 717 CA ALA A 48 13.188 0.292 -3.697 1.00 0.00 C ATOM 718 C ALA A 48 14.444 1.122 -3.454 1.00 0.00 C ATOM 719 O ALA A 48 15.094 1.018 -2.413 1.00 0.00 O ATOM 720 CB ALA A 48 13.528 -1.035 -4.360 1.00 0.00 C ATOM 0 H ALA A 48 12.083 0.655 -5.441 1.00 0.00 H new ATOM 0 HA ALA A 48 12.722 0.070 -2.737 1.00 0.00 H new ATOM 0 HB1 ALA A 48 14.225 -1.588 -3.730 1.00 0.00 H new ATOM 0 HB2 ALA A 48 12.617 -1.619 -4.494 1.00 0.00 H new ATOM 0 HB3 ALA A 48 13.986 -0.850 -5.332 1.00 0.00 H new ATOM 726 N LYS A 49 14.759 1.945 -4.440 1.00 0.00 N ATOM 727 CA LYS A 49 15.829 2.924 -4.343 1.00 0.00 C ATOM 728 C LYS A 49 15.595 3.908 -3.194 1.00 0.00 C ATOM 729 O LYS A 49 16.436 4.058 -2.307 1.00 0.00 O ATOM 730 CB LYS A 49 15.918 3.688 -5.650 1.00 0.00 C ATOM 731 CG LYS A 49 16.480 2.869 -6.795 1.00 0.00 C ATOM 732 CD LYS A 49 17.877 3.292 -7.120 1.00 0.00 C ATOM 733 CE LYS A 49 17.898 4.642 -7.821 1.00 0.00 C ATOM 734 NZ LYS A 49 19.278 5.079 -8.161 1.00 0.00 N ATOM 0 H LYS A 49 14.275 1.953 -5.338 1.00 0.00 H new ATOM 0 HA LYS A 49 16.760 2.394 -4.143 1.00 0.00 H new ATOM 0 HB2 LYS A 49 14.924 4.043 -5.922 1.00 0.00 H new ATOM 0 HB3 LYS A 49 16.542 4.569 -5.504 1.00 0.00 H new ATOM 0 HG2 LYS A 49 16.468 1.812 -6.531 1.00 0.00 H new ATOM 0 HG3 LYS A 49 15.847 2.985 -7.675 1.00 0.00 H new ATOM 0 HD2 LYS A 49 18.465 3.347 -6.204 1.00 0.00 H new ATOM 0 HD3 LYS A 49 18.347 2.542 -7.756 1.00 0.00 H new ATOM 0 HE2 LYS A 49 17.302 4.585 -8.732 1.00 0.00 H new ATOM 0 HE3 LYS A 49 17.430 5.389 -7.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 19.242 6.003 -8.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 19.841 5.159 -7.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 19.717 4.381 -8.794 1.00 0.00 H new ATOM 748 N ALA A 50 14.437 4.553 -3.204 1.00 0.00 N ATOM 749 CA ALA A 50 14.178 5.684 -2.319 1.00 0.00 C ATOM 750 C ALA A 50 13.649 5.281 -0.940 1.00 0.00 C ATOM 751 O ALA A 50 14.091 5.818 0.075 1.00 0.00 O ATOM 752 CB ALA A 50 13.197 6.634 -2.984 1.00 0.00 C ATOM 0 H ALA A 50 13.658 4.313 -3.817 1.00 0.00 H new ATOM 0 HA ALA A 50 15.138 6.171 -2.150 1.00 0.00 H new ATOM 0 HB1 ALA A 50 13.004 7.479 -2.323 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.620 6.996 -3.921 1.00 0.00 H new ATOM 0 HB3 ALA A 50 12.263 6.110 -3.186 1.00 0.00 H new ATOM 758 N LEU A 51 12.713 4.340 -0.903 1.00 0.00 N ATOM 759 CA LEU A 51 11.953 4.041 0.320 1.00 0.00 C ATOM 760 C LEU A 51 12.805 3.460 1.446 1.00 0.00 C ATOM 761 O LEU A 51 12.322 3.293 2.564 1.00 0.00 O ATOM 762 CB LEU A 51 10.815 3.089 -0.003 1.00 0.00 C ATOM 763 CG LEU A 51 9.768 3.653 -0.941 1.00 0.00 C ATOM 764 CD1 LEU A 51 9.035 2.513 -1.594 1.00 0.00 C ATOM 765 CD2 LEU A 51 8.804 4.569 -0.193 1.00 0.00 C ATOM 0 H LEU A 51 12.456 3.765 -1.706 1.00 0.00 H new ATOM 0 HA LEU A 51 11.568 4.994 0.684 1.00 0.00 H new ATOM 0 HB2 LEU A 51 11.231 2.184 -0.446 1.00 0.00 H new ATOM 0 HB3 LEU A 51 10.330 2.795 0.928 1.00 0.00 H new ATOM 0 HG LEU A 51 10.254 4.255 -1.709 1.00 0.00 H new ATOM 0 HD11 LEU A 51 8.278 2.908 -2.272 1.00 0.00 H new ATOM 0 HD12 LEU A 51 9.741 1.900 -2.155 1.00 0.00 H new ATOM 0 HD13 LEU A 51 8.554 1.904 -0.829 1.00 0.00 H new ATOM 0 HD21 LEU A 51 8.062 4.961 -0.888 1.00 0.00 H new ATOM 0 HD22 LEU A 51 8.302 4.005 0.593 1.00 0.00 H new ATOM 0 HD23 LEU A 51 9.358 5.396 0.251 1.00 0.00 H new ATOM 777 N ALA A 52 14.062 3.157 1.159 1.00 0.00 N ATOM 778 CA ALA A 52 14.977 2.671 2.183 1.00 0.00 C ATOM 779 C ALA A 52 15.535 3.838 2.997 1.00 0.00 C ATOM 780 O ALA A 52 16.298 3.641 3.944 1.00 0.00 O ATOM 781 CB ALA A 52 16.105 1.872 1.552 1.00 0.00 C ATOM 0 H ALA A 52 14.472 3.238 0.228 1.00 0.00 H new ATOM 0 HA ALA A 52 14.426 2.014 2.856 1.00 0.00 H new ATOM 0 HB1 ALA A 52 16.779 1.517 2.331 1.00 0.00 H new ATOM 0 HB2 ALA A 52 15.690 1.019 1.014 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.656 2.506 0.857 1.00 0.00 H new ATOM 787 N ASN A 53 15.143 5.051 2.617 1.00 0.00 N ATOM 788 CA ASN A 53 15.603 6.257 3.296 1.00 0.00 C ATOM 789 C ASN A 53 14.491 7.306 3.378 1.00 0.00 C ATOM 790 O ASN A 53 14.318 7.958 4.412 1.00 0.00 O ATOM 791 CB ASN A 53 16.829 6.833 2.577 1.00 0.00 C ATOM 792 CG ASN A 53 17.337 8.112 3.217 1.00 0.00 C ATOM 793 OD1 ASN A 53 18.104 8.075 4.178 1.00 0.00 O ATOM 794 ND2 ASN A 53 16.935 9.249 2.673 1.00 0.00 N ATOM 0 H ASN A 53 14.506 5.224 1.840 1.00 0.00 H new ATOM 0 HA ASN A 53 15.883 5.987 4.314 1.00 0.00 H new ATOM 0 HB2 ASN A 53 17.627 6.090 2.576 1.00 0.00 H new ATOM 0 HB3 ASN A 53 16.575 7.029 1.535 1.00 0.00 H new ATOM 0 HD21 ASN A 53 17.262 10.138 3.050 1.00 0.00 H new ATOM 0 HD22 ASN A 53 16.298 9.236 1.876 1.00 0.00 H new ATOM 801 N VAL A 54 13.736 7.470 2.295 1.00 0.00 N ATOM 802 CA VAL A 54 12.672 8.463 2.257 1.00 0.00 C ATOM 803 C VAL A 54 11.407 7.916 2.896 1.00 0.00 C ATOM 804 O VAL A 54 11.363 6.777 3.359 1.00 0.00 O ATOM 805 CB VAL A 54 12.333 8.910 0.815 1.00 0.00 C ATOM 806 CG1 VAL A 54 13.597 9.250 0.044 1.00 0.00 C ATOM 807 CG2 VAL A 54 11.514 7.849 0.089 1.00 0.00 C ATOM 0 H VAL A 54 13.842 6.929 1.437 1.00 0.00 H new ATOM 0 HA VAL A 54 13.040 9.326 2.813 1.00 0.00 H new ATOM 0 HB VAL A 54 11.724 9.812 0.876 1.00 0.00 H new ATOM 0 HG11 VAL A 54 13.334 9.562 -0.967 1.00 0.00 H new ATOM 0 HG12 VAL A 54 14.124 10.060 0.548 1.00 0.00 H new ATOM 0 HG13 VAL A 54 14.242 8.372 -0.003 1.00 0.00 H new ATOM 0 HG21 VAL A 54 11.291 8.190 -0.922 1.00 0.00 H new ATOM 0 HG22 VAL A 54 12.083 6.920 0.041 1.00 0.00 H new ATOM 0 HG23 VAL A 54 10.582 7.677 0.628 1.00 0.00 H new ATOM 817 N ASN A 55 10.379 8.734 2.906 1.00 0.00 N ATOM 818 CA ASN A 55 9.097 8.328 3.440 1.00 0.00 C ATOM 819 C ASN A 55 8.055 8.222 2.341 1.00 0.00 C ATOM 820 O ASN A 55 8.172 8.849 1.289 1.00 0.00 O ATOM 821 CB ASN A 55 8.623 9.298 4.527 1.00 0.00 C ATOM 822 CG ASN A 55 9.463 9.233 5.793 1.00 0.00 C ATOM 823 OD1 ASN A 55 10.060 8.080 6.062 1.00 0.00 O flip ATOM 824 ND2 ASN A 55 9.576 10.215 6.529 1.00 0.00 N flip ATOM 0 H ASN A 55 10.405 9.689 2.549 1.00 0.00 H new ATOM 0 HA ASN A 55 9.225 7.343 3.888 1.00 0.00 H new ATOM 0 HB2 ASN A 55 8.647 10.314 4.134 1.00 0.00 H new ATOM 0 HB3 ASN A 55 7.585 9.077 4.775 1.00 0.00 H new ATOM 0 HD21 ASN A 55 9.103 11.087 6.292 1.00 0.00 H new ATOM 0 HD22 ASN A 55 10.143 10.156 7.375 1.00 0.00 H new ATOM 831 N ILE A 56 7.041 7.412 2.613 1.00 0.00 N ATOM 832 CA ILE A 56 5.929 7.171 1.697 1.00 0.00 C ATOM 833 C ILE A 56 5.190 8.471 1.386 1.00 0.00 C ATOM 834 O ILE A 56 4.550 8.595 0.346 1.00 0.00 O ATOM 835 CB ILE A 56 4.973 6.125 2.322 1.00 0.00 C ATOM 836 CG1 ILE A 56 4.024 5.543 1.284 1.00 0.00 C ATOM 837 CG2 ILE A 56 4.198 6.704 3.492 1.00 0.00 C ATOM 838 CD1 ILE A 56 4.624 4.373 0.543 1.00 0.00 C ATOM 0 H ILE A 56 6.965 6.895 3.489 1.00 0.00 H new ATOM 0 HA ILE A 56 6.316 6.783 0.755 1.00 0.00 H new ATOM 0 HB ILE A 56 5.595 5.314 2.701 1.00 0.00 H new ATOM 0 HG12 ILE A 56 3.105 5.225 1.775 1.00 0.00 H new ATOM 0 HG13 ILE A 56 3.751 6.320 0.570 1.00 0.00 H new ATOM 0 HG21 ILE A 56 3.538 5.941 3.904 1.00 0.00 H new ATOM 0 HG22 ILE A 56 4.895 7.036 4.262 1.00 0.00 H new ATOM 0 HG23 ILE A 56 3.604 7.552 3.151 1.00 0.00 H new ATOM 0 HD11 ILE A 56 3.905 3.996 -0.185 1.00 0.00 H new ATOM 0 HD12 ILE A 56 5.529 4.694 0.027 1.00 0.00 H new ATOM 0 HD13 ILE A 56 4.872 3.582 1.251 1.00 0.00 H new ATOM 850 N GLY A 57 5.340 9.460 2.259 1.00 0.00 N ATOM 851 CA GLY A 57 4.722 10.745 2.033 1.00 0.00 C ATOM 852 C GLY A 57 5.375 11.476 0.883 1.00 0.00 C ATOM 853 O GLY A 57 4.816 12.431 0.347 1.00 0.00 O ATOM 0 H GLY A 57 5.881 9.391 3.121 1.00 0.00 H new ATOM 0 HA2 GLY A 57 3.661 10.608 1.824 1.00 0.00 H new ATOM 0 HA3 GLY A 57 4.793 11.349 2.938 1.00 0.00 H new ATOM 857 N SER A 58 6.559 11.013 0.486 1.00 0.00 N ATOM 858 CA SER A 58 7.269 11.616 -0.624 1.00 0.00 C ATOM 859 C SER A 58 6.629 11.189 -1.937 1.00 0.00 C ATOM 860 O SER A 58 6.736 11.872 -2.957 1.00 0.00 O ATOM 861 CB SER A 58 8.743 11.216 -0.597 1.00 0.00 C ATOM 862 OG SER A 58 9.472 11.847 -1.637 1.00 0.00 O ATOM 0 H SER A 58 7.040 10.225 0.919 1.00 0.00 H new ATOM 0 HA SER A 58 7.207 12.701 -0.534 1.00 0.00 H new ATOM 0 HB2 SER A 58 9.176 11.484 0.367 1.00 0.00 H new ATOM 0 HB3 SER A 58 8.829 10.134 -0.696 1.00 0.00 H new ATOM 0 HG SER A 58 10.411 11.572 -1.592 1.00 0.00 H new ATOM 868 N LEU A 59 5.930 10.061 -1.888 1.00 0.00 N ATOM 869 CA LEU A 59 5.284 9.497 -3.061 1.00 0.00 C ATOM 870 C LEU A 59 4.181 10.411 -3.566 1.00 0.00 C ATOM 871 O LEU A 59 3.829 10.403 -4.746 1.00 0.00 O ATOM 872 CB LEU A 59 4.699 8.144 -2.705 1.00 0.00 C ATOM 873 CG LEU A 59 5.674 7.114 -2.213 1.00 0.00 C ATOM 874 CD1 LEU A 59 5.004 5.762 -2.238 1.00 0.00 C ATOM 875 CD2 LEU A 59 6.962 7.128 -3.022 1.00 0.00 C ATOM 0 H LEU A 59 5.797 9.516 -1.036 1.00 0.00 H new ATOM 0 HA LEU A 59 6.027 9.388 -3.851 1.00 0.00 H new ATOM 0 HB2 LEU A 59 3.938 8.290 -1.939 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.194 7.746 -3.585 1.00 0.00 H new ATOM 0 HG LEU A 59 5.962 7.349 -1.188 1.00 0.00 H new ATOM 0 HD11 LEU A 59 5.702 5.004 -1.883 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.126 5.779 -1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 59 4.699 5.526 -3.258 1.00 0.00 H new ATOM 0 HD21 LEU A 59 7.642 6.369 -2.636 1.00 0.00 H new ATOM 0 HD22 LEU A 59 6.737 6.916 -4.067 1.00 0.00 H new ATOM 0 HD23 LEU A 59 7.430 8.109 -2.943 1.00 0.00 H new ATOM 887 N ILE A 60 3.648 11.201 -2.649 1.00 0.00 N ATOM 888 CA ILE A 60 2.607 12.161 -2.948 1.00 0.00 C ATOM 889 C ILE A 60 3.149 13.284 -3.833 1.00 0.00 C ATOM 890 O ILE A 60 2.399 13.978 -4.523 1.00 0.00 O ATOM 891 CB ILE A 60 2.049 12.692 -1.607 1.00 0.00 C ATOM 892 CG1 ILE A 60 0.706 12.051 -1.306 1.00 0.00 C ATOM 893 CG2 ILE A 60 1.943 14.210 -1.566 1.00 0.00 C ATOM 894 CD1 ILE A 60 0.506 11.818 0.166 1.00 0.00 C ATOM 0 H ILE A 60 3.930 11.191 -1.669 1.00 0.00 H new ATOM 0 HA ILE A 60 1.799 11.691 -3.509 1.00 0.00 H new ATOM 0 HB ILE A 60 2.764 12.413 -0.833 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -0.093 12.690 -1.683 1.00 0.00 H new ATOM 0 HG13 ILE A 60 0.631 11.101 -1.836 1.00 0.00 H new ATOM 0 HG21 ILE A 60 1.545 14.521 -0.600 1.00 0.00 H new ATOM 0 HG22 ILE A 60 2.931 14.648 -1.710 1.00 0.00 H new ATOM 0 HG23 ILE A 60 1.277 14.550 -2.359 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -0.468 11.358 0.333 1.00 0.00 H new ATOM 0 HD12 ILE A 60 1.288 11.157 0.539 1.00 0.00 H new ATOM 0 HD13 ILE A 60 0.553 12.770 0.695 1.00 0.00 H new ATOM 1057 N TYR B 103 -3.559 -2.046 7.969 1.00 0.00 N ATOM 1058 CA TYR B 103 -3.864 -2.874 6.804 1.00 0.00 C ATOM 1059 C TYR B 103 -4.628 -2.118 5.712 1.00 0.00 C ATOM 1060 O TYR B 103 -5.055 -2.716 4.711 1.00 0.00 O ATOM 1061 CB TYR B 103 -4.689 -4.064 7.295 1.00 0.00 C ATOM 1062 CG TYR B 103 -4.061 -4.758 8.487 1.00 0.00 C ATOM 1063 CD1 TYR B 103 -3.039 -5.680 8.324 1.00 0.00 C ATOM 1064 CD2 TYR B 103 -4.480 -4.474 9.785 1.00 0.00 C ATOM 1065 CE1 TYR B 103 -2.453 -6.298 9.410 1.00 0.00 C ATOM 1066 CE2 TYR B 103 -3.897 -5.087 10.872 1.00 0.00 C ATOM 1067 CZ TYR B 103 -2.888 -5.997 10.682 1.00 0.00 C ATOM 1068 OH TYR B 103 -2.315 -6.612 11.773 1.00 0.00 O ATOM 0 HA TYR B 103 -2.927 -3.192 6.346 1.00 0.00 H new ATOM 0 HB2 TYR B 103 -5.688 -3.722 7.564 1.00 0.00 H new ATOM 0 HB3 TYR B 103 -4.805 -4.781 6.482 1.00 0.00 H new ATOM 0 HD1 TYR B 103 -2.695 -5.919 7.329 1.00 0.00 H new ATOM 0 HD2 TYR B 103 -5.276 -3.761 9.942 1.00 0.00 H new ATOM 0 HE1 TYR B 103 -1.658 -7.014 9.263 1.00 0.00 H new ATOM 0 HE2 TYR B 103 -4.233 -4.852 11.871 1.00 0.00 H new ATOM 0 HH TYR B 103 -2.739 -6.284 12.593 1.00 0.00 H new ATOM 1078 N VAL B 104 -4.789 -0.810 5.905 1.00 0.00 N ATOM 1079 CA VAL B 104 -5.446 0.041 4.919 1.00 0.00 C ATOM 1080 C VAL B 104 -4.837 -0.184 3.552 1.00 0.00 C ATOM 1081 O VAL B 104 -5.531 -0.430 2.571 1.00 0.00 O ATOM 1082 CB VAL B 104 -5.273 1.536 5.251 1.00 0.00 C ATOM 1083 CG1 VAL B 104 -6.044 2.393 4.261 1.00 0.00 C ATOM 1084 CG2 VAL B 104 -5.691 1.836 6.681 1.00 0.00 C ATOM 0 H VAL B 104 -4.471 -0.316 6.739 1.00 0.00 H new ATOM 0 HA VAL B 104 -6.504 -0.220 4.932 1.00 0.00 H new ATOM 0 HB VAL B 104 -4.215 1.783 5.163 1.00 0.00 H new ATOM 0 HG11 VAL B 104 -5.911 3.446 4.510 1.00 0.00 H new ATOM 0 HG12 VAL B 104 -5.672 2.209 3.253 1.00 0.00 H new ATOM 0 HG13 VAL B 104 -7.103 2.140 4.308 1.00 0.00 H new ATOM 0 HG21 VAL B 104 -5.557 2.899 6.884 1.00 0.00 H new ATOM 0 HG22 VAL B 104 -6.739 1.570 6.817 1.00 0.00 H new ATOM 0 HG23 VAL B 104 -5.077 1.255 7.369 1.00 0.00 H new ATOM 1094 N ALA B 105 -3.521 -0.123 3.519 1.00 0.00 N ATOM 1095 CA ALA B 105 -2.782 -0.171 2.279 1.00 0.00 C ATOM 1096 C ALA B 105 -2.950 -1.507 1.573 1.00 0.00 C ATOM 1097 O ALA B 105 -3.058 -1.563 0.347 1.00 0.00 O ATOM 1098 CB ALA B 105 -1.325 0.094 2.557 1.00 0.00 C ATOM 0 H ALA B 105 -2.937 -0.039 4.351 1.00 0.00 H new ATOM 0 HA ALA B 105 -3.178 0.597 1.615 1.00 0.00 H new ATOM 0 HB1 ALA B 105 -0.764 0.059 1.623 1.00 0.00 H new ATOM 0 HB2 ALA B 105 -1.214 1.079 3.010 1.00 0.00 H new ATOM 0 HB3 ALA B 105 -0.941 -0.664 3.240 1.00 0.00 H new ATOM 1104 N SER B 106 -2.961 -2.579 2.354 1.00 0.00 N ATOM 1105 CA SER B 106 -3.159 -3.914 1.816 1.00 0.00 C ATOM 1106 C SER B 106 -4.524 -3.983 1.141 1.00 0.00 C ATOM 1107 O SER B 106 -4.693 -4.583 0.069 1.00 0.00 O ATOM 1108 CB SER B 106 -3.093 -4.930 2.951 1.00 0.00 C ATOM 1109 OG SER B 106 -2.226 -4.477 3.979 1.00 0.00 O ATOM 0 H SER B 106 -2.834 -2.547 3.366 1.00 0.00 H new ATOM 0 HA SER B 106 -2.381 -4.139 1.086 1.00 0.00 H new ATOM 0 HB2 SER B 106 -4.091 -5.095 3.357 1.00 0.00 H new ATOM 0 HB3 SER B 106 -2.742 -5.888 2.568 1.00 0.00 H new ATOM 0 HG SER B 106 -2.198 -5.141 4.699 1.00 0.00 H new ATOM 1115 N TYR B 107 -5.483 -3.322 1.786 1.00 0.00 N ATOM 1116 CA TYR B 107 -6.843 -3.244 1.306 1.00 0.00 C ATOM 1117 C TYR B 107 -6.854 -2.546 -0.039 1.00 0.00 C ATOM 1118 O TYR B 107 -7.430 -3.032 -1.010 1.00 0.00 O ATOM 1119 CB TYR B 107 -7.667 -2.472 2.338 1.00 0.00 C ATOM 1120 CG TYR B 107 -9.139 -2.368 2.044 1.00 0.00 C ATOM 1121 CD1 TYR B 107 -9.630 -1.399 1.178 1.00 0.00 C ATOM 1122 CD2 TYR B 107 -10.040 -3.219 2.663 1.00 0.00 C ATOM 1123 CE1 TYR B 107 -10.982 -1.282 0.928 1.00 0.00 C ATOM 1124 CE2 TYR B 107 -11.394 -3.115 2.420 1.00 0.00 C ATOM 1125 CZ TYR B 107 -11.862 -2.146 1.553 1.00 0.00 C ATOM 1126 OH TYR B 107 -13.211 -2.042 1.310 1.00 0.00 O ATOM 0 H TYR B 107 -5.327 -2.825 2.663 1.00 0.00 H new ATOM 0 HA TYR B 107 -7.274 -4.237 1.176 1.00 0.00 H new ATOM 0 HB2 TYR B 107 -7.541 -2.950 3.309 1.00 0.00 H new ATOM 0 HB3 TYR B 107 -7.259 -1.465 2.423 1.00 0.00 H new ATOM 0 HD1 TYR B 107 -8.941 -0.725 0.691 1.00 0.00 H new ATOM 0 HD2 TYR B 107 -9.678 -3.974 3.345 1.00 0.00 H new ATOM 0 HE1 TYR B 107 -11.349 -0.524 0.252 1.00 0.00 H new ATOM 0 HE2 TYR B 107 -12.085 -3.788 2.905 1.00 0.00 H new ATOM 0 HH TYR B 107 -13.628 -2.925 1.397 1.00 0.00 H new ATOM 1136 N LEU B 108 -6.174 -1.413 -0.094 1.00 0.00 N ATOM 1137 CA LEU B 108 -6.087 -0.642 -1.313 1.00 0.00 C ATOM 1138 C LEU B 108 -5.486 -1.464 -2.451 1.00 0.00 C ATOM 1139 O LEU B 108 -6.009 -1.458 -3.562 1.00 0.00 O ATOM 1140 CB LEU B 108 -5.258 0.617 -1.087 1.00 0.00 C ATOM 1141 CG LEU B 108 -5.911 1.741 -0.273 1.00 0.00 C ATOM 1142 CD1 LEU B 108 -7.355 1.434 0.106 1.00 0.00 C ATOM 1143 CD2 LEU B 108 -5.081 2.060 0.962 1.00 0.00 C ATOM 0 H LEU B 108 -5.674 -1.009 0.698 1.00 0.00 H new ATOM 0 HA LEU B 108 -7.100 -0.358 -1.598 1.00 0.00 H new ATOM 0 HB2 LEU B 108 -4.333 0.329 -0.587 1.00 0.00 H new ATOM 0 HB3 LEU B 108 -4.981 1.020 -2.061 1.00 0.00 H new ATOM 0 HG LEU B 108 -5.940 2.621 -0.916 1.00 0.00 H new ATOM 0 HD11 LEU B 108 -7.765 2.265 0.681 1.00 0.00 H new ATOM 0 HD12 LEU B 108 -7.946 1.292 -0.799 1.00 0.00 H new ATOM 0 HD13 LEU B 108 -7.388 0.526 0.707 1.00 0.00 H new ATOM 0 HD21 LEU B 108 -5.561 2.860 1.526 1.00 0.00 H new ATOM 0 HD22 LEU B 108 -5.003 1.171 1.588 1.00 0.00 H new ATOM 0 HD23 LEU B 108 -4.084 2.378 0.658 1.00 0.00 H new ATOM 1155 N LEU B 109 -4.391 -2.167 -2.166 1.00 0.00 N ATOM 1156 CA LEU B 109 -3.735 -3.019 -3.154 1.00 0.00 C ATOM 1157 C LEU B 109 -4.722 -4.009 -3.753 1.00 0.00 C ATOM 1158 O LEU B 109 -4.916 -4.069 -4.983 1.00 0.00 O ATOM 1159 CB LEU B 109 -2.607 -3.804 -2.493 1.00 0.00 C ATOM 1160 CG LEU B 109 -1.388 -4.073 -3.380 1.00 0.00 C ATOM 1161 CD1 LEU B 109 -0.825 -2.772 -3.916 1.00 0.00 C ATOM 1162 CD2 LEU B 109 -0.323 -4.818 -2.595 1.00 0.00 C ATOM 0 H LEU B 109 -3.938 -2.162 -1.252 1.00 0.00 H new ATOM 0 HA LEU B 109 -3.340 -2.378 -3.942 1.00 0.00 H new ATOM 0 HB2 LEU B 109 -2.278 -3.260 -1.608 1.00 0.00 H new ATOM 0 HB3 LEU B 109 -3.004 -4.760 -2.150 1.00 0.00 H new ATOM 0 HG LEU B 109 -1.702 -4.689 -4.222 1.00 0.00 H new ATOM 0 HD11 LEU B 109 0.041 -2.982 -4.544 1.00 0.00 H new ATOM 0 HD12 LEU B 109 -1.586 -2.262 -4.506 1.00 0.00 H new ATOM 0 HD13 LEU B 109 -0.524 -2.136 -3.084 1.00 0.00 H new ATOM 0 HD21 LEU B 109 0.539 -5.003 -3.236 1.00 0.00 H new ATOM 0 HD22 LEU B 109 -0.016 -4.218 -1.739 1.00 0.00 H new ATOM 0 HD23 LEU B 109 -0.727 -5.768 -2.246 1.00 0.00 H new ATOM 1174 N ALA B 110 -5.351 -4.781 -2.869 1.00 0.00 N ATOM 1175 CA ALA B 110 -6.289 -5.803 -3.291 1.00 0.00 C ATOM 1176 C ALA B 110 -7.388 -5.192 -4.148 1.00 0.00 C ATOM 1177 O ALA B 110 -7.771 -5.746 -5.169 1.00 0.00 O ATOM 1178 CB ALA B 110 -6.887 -6.520 -2.087 1.00 0.00 C ATOM 0 H ALA B 110 -5.224 -4.714 -1.859 1.00 0.00 H new ATOM 0 HA ALA B 110 -5.749 -6.537 -3.889 1.00 0.00 H new ATOM 0 HB1 ALA B 110 -7.588 -7.282 -2.428 1.00 0.00 H new ATOM 0 HB2 ALA B 110 -6.090 -6.991 -1.511 1.00 0.00 H new ATOM 0 HB3 ALA B 110 -7.412 -5.800 -1.459 1.00 0.00 H new ATOM 1184 N ALA B 111 -7.860 -4.026 -3.738 1.00 0.00 N ATOM 1185 CA ALA B 111 -8.941 -3.353 -4.437 1.00 0.00 C ATOM 1186 C ALA B 111 -8.470 -2.722 -5.731 1.00 0.00 C ATOM 1187 O ALA B 111 -9.267 -2.482 -6.641 1.00 0.00 O ATOM 1188 CB ALA B 111 -9.573 -2.308 -3.537 1.00 0.00 C ATOM 0 H ALA B 111 -7.510 -3.525 -2.922 1.00 0.00 H new ATOM 0 HA ALA B 111 -9.688 -4.104 -4.695 1.00 0.00 H new ATOM 0 HB1 ALA B 111 -10.382 -1.809 -4.071 1.00 0.00 H new ATOM 0 HB2 ALA B 111 -9.970 -2.790 -2.643 1.00 0.00 H new ATOM 0 HB3 ALA B 111 -8.821 -1.573 -3.249 1.00 0.00 H new ATOM 1194 N LEU B 112 -7.181 -2.465 -5.815 1.00 0.00 N ATOM 1195 CA LEU B 112 -6.621 -1.819 -6.978 1.00 0.00 C ATOM 1196 C LEU B 112 -6.483 -2.810 -8.119 1.00 0.00 C ATOM 1197 O LEU B 112 -6.755 -2.476 -9.275 1.00 0.00 O ATOM 1198 CB LEU B 112 -5.258 -1.215 -6.652 1.00 0.00 C ATOM 1199 CG LEU B 112 -5.041 0.187 -7.206 1.00 0.00 C ATOM 1200 CD1 LEU B 112 -6.089 1.145 -6.670 1.00 0.00 C ATOM 1201 CD2 LEU B 112 -3.651 0.677 -6.866 1.00 0.00 C ATOM 0 H LEU B 112 -6.503 -2.695 -5.089 1.00 0.00 H new ATOM 0 HA LEU B 112 -7.297 -1.020 -7.281 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -5.136 -1.187 -5.569 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -4.481 -1.871 -7.043 1.00 0.00 H new ATOM 0 HG LEU B 112 -5.140 0.147 -8.291 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -5.915 2.140 -7.079 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -7.081 0.801 -6.963 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -6.025 1.183 -5.583 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -3.510 1.680 -7.268 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -3.528 0.700 -5.783 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -2.912 0.005 -7.301 1.00 0.00 H new ATOM 1213 N GLY B 113 -6.082 -4.036 -7.802 1.00 0.00 N ATOM 1214 CA GLY B 113 -5.823 -4.982 -8.872 1.00 0.00 C ATOM 1215 C GLY B 113 -6.288 -6.397 -8.606 1.00 0.00 C ATOM 1216 O GLY B 113 -5.666 -7.345 -9.081 1.00 0.00 O ATOM 0 H GLY B 113 -5.935 -4.385 -6.855 1.00 0.00 H new ATOM 0 HA2 GLY B 113 -6.308 -4.622 -9.779 1.00 0.00 H new ATOM 0 HA3 GLY B 113 -4.751 -5.000 -9.069 1.00 0.00 H new ATOM 1220 N GLY B 114 -7.379 -6.568 -7.878 1.00 0.00 N ATOM 1221 CA GLY B 114 -7.886 -7.906 -7.666 1.00 0.00 C ATOM 1222 C GLY B 114 -9.341 -7.928 -7.267 1.00 0.00 C ATOM 1223 O GLY B 114 -10.136 -8.689 -7.819 1.00 0.00 O ATOM 0 H GLY B 114 -7.914 -5.820 -7.437 1.00 0.00 H new ATOM 0 HA2 GLY B 114 -7.756 -8.487 -8.579 1.00 0.00 H new ATOM 0 HA3 GLY B 114 -7.295 -8.394 -6.891 1.00 0.00 H new ATOM 1227 N ASN B 115 -9.692 -7.085 -6.316 1.00 0.00 N ATOM 1228 CA ASN B 115 -11.013 -7.099 -5.733 1.00 0.00 C ATOM 1229 C ASN B 115 -11.301 -5.752 -5.099 1.00 0.00 C ATOM 1230 O ASN B 115 -10.718 -5.413 -4.076 1.00 0.00 O ATOM 1231 CB ASN B 115 -11.062 -8.212 -4.695 1.00 0.00 C ATOM 1232 CG ASN B 115 -12.224 -8.108 -3.737 1.00 0.00 C ATOM 1233 OD1 ASN B 115 -13.332 -7.711 -4.110 1.00 0.00 O ATOM 1234 ND2 ASN B 115 -11.958 -8.428 -2.483 1.00 0.00 N ATOM 0 H ASN B 115 -9.070 -6.375 -5.929 1.00 0.00 H new ATOM 0 HA ASN B 115 -11.771 -7.282 -6.495 1.00 0.00 H new ATOM 0 HB2 ASN B 115 -11.113 -9.172 -5.209 1.00 0.00 H new ATOM 0 HB3 ASN B 115 -10.133 -8.204 -4.125 1.00 0.00 H new ATOM 0 HD21 ASN B 115 -12.685 -8.352 -1.772 1.00 0.00 H new ATOM 0 HD22 ASN B 115 -11.025 -8.751 -2.226 1.00 0.00 H new ATOM 1241 N SER B 116 -12.242 -5.022 -5.676 1.00 0.00 N ATOM 1242 CA SER B 116 -12.472 -3.619 -5.332 1.00 0.00 C ATOM 1243 C SER B 116 -13.302 -3.497 -4.058 1.00 0.00 C ATOM 1244 O SER B 116 -14.028 -2.529 -3.842 1.00 0.00 O ATOM 1245 CB SER B 116 -13.151 -2.908 -6.483 1.00 0.00 C ATOM 1246 OG SER B 116 -12.515 -3.223 -7.714 1.00 0.00 O ATOM 0 H SER B 116 -12.870 -5.380 -6.396 1.00 0.00 H new ATOM 0 HA SER B 116 -11.507 -3.146 -5.147 1.00 0.00 H new ATOM 0 HB2 SER B 116 -14.201 -3.197 -6.526 1.00 0.00 H new ATOM 0 HB3 SER B 116 -13.123 -1.831 -6.319 1.00 0.00 H new ATOM 0 HG SER B 116 -12.969 -2.755 -8.446 1.00 0.00 H new ATOM 1252 N SER B 117 -13.156 -4.505 -3.231 1.00 0.00 N ATOM 1253 CA SER B 117 -13.801 -4.595 -1.934 1.00 0.00 C ATOM 1254 C SER B 117 -13.157 -5.743 -1.165 1.00 0.00 C ATOM 1255 O SER B 117 -13.744 -6.802 -0.941 1.00 0.00 O ATOM 1256 CB SER B 117 -15.298 -4.790 -2.099 1.00 0.00 C ATOM 1257 OG SER B 117 -15.976 -4.762 -0.853 1.00 0.00 O ATOM 0 H SER B 117 -12.569 -5.311 -3.444 1.00 0.00 H new ATOM 0 HA SER B 117 -13.667 -3.671 -1.372 1.00 0.00 H new ATOM 0 HB2 SER B 117 -15.697 -4.009 -2.747 1.00 0.00 H new ATOM 0 HB3 SER B 117 -15.488 -5.742 -2.594 1.00 0.00 H new ATOM 0 HG SER B 117 -16.936 -4.889 -1.000 1.00 0.00 H new ATOM 1263 N PRO B 118 -11.900 -5.514 -0.801 1.00 0.00 N ATOM 1264 CA PRO B 118 -11.003 -6.499 -0.183 1.00 0.00 C ATOM 1265 C PRO B 118 -11.470 -6.920 1.194 1.00 0.00 C ATOM 1266 O PRO B 118 -12.181 -6.178 1.868 1.00 0.00 O ATOM 1267 CB PRO B 118 -9.677 -5.746 -0.075 1.00 0.00 C ATOM 1268 CG PRO B 118 -9.817 -4.627 -1.042 1.00 0.00 C ATOM 1269 CD PRO B 118 -11.248 -4.230 -0.971 1.00 0.00 C ATOM 0 HA PRO B 118 -10.949 -7.419 -0.765 1.00 0.00 H new ATOM 0 HB2 PRO B 118 -9.508 -5.379 0.937 1.00 0.00 H new ATOM 0 HB3 PRO B 118 -8.832 -6.387 -0.327 1.00 0.00 H new ATOM 0 HG2 PRO B 118 -9.164 -3.795 -0.779 1.00 0.00 H new ATOM 0 HG3 PRO B 118 -9.544 -4.940 -2.050 1.00 0.00 H new ATOM 0 HD2 PRO B 118 -11.445 -3.557 -0.137 1.00 0.00 H new ATOM 0 HD3 PRO B 118 -11.577 -3.720 -1.877 1.00 0.00 H new ATOM 1277 N SER B 119 -11.069 -8.102 1.617 1.00 0.00 N ATOM 1278 CA SER B 119 -11.428 -8.560 2.937 1.00 0.00 C ATOM 1279 C SER B 119 -10.207 -8.984 3.730 1.00 0.00 C ATOM 1280 O SER B 119 -9.078 -8.852 3.256 1.00 0.00 O ATOM 1281 CB SER B 119 -12.453 -9.684 2.872 1.00 0.00 C ATOM 1282 OG SER B 119 -11.928 -10.818 2.201 1.00 0.00 O ATOM 0 H SER B 119 -10.503 -8.752 1.072 1.00 0.00 H new ATOM 0 HA SER B 119 -11.885 -7.719 3.459 1.00 0.00 H new ATOM 0 HB2 SER B 119 -12.755 -9.963 3.881 1.00 0.00 H new ATOM 0 HB3 SER B 119 -13.348 -9.335 2.356 1.00 0.00 H new ATOM 0 HG SER B 119 -11.686 -10.572 1.284 1.00 0.00 H new ATOM 1288 N ALA B 120 -10.437 -9.494 4.925 1.00 0.00 N ATOM 1289 CA ALA B 120 -9.365 -9.736 5.879 1.00 0.00 C ATOM 1290 C ALA B 120 -8.414 -10.765 5.315 1.00 0.00 C ATOM 1291 O ALA B 120 -7.194 -10.682 5.462 1.00 0.00 O ATOM 1292 CB ALA B 120 -9.939 -10.201 7.203 1.00 0.00 C ATOM 0 H ALA B 120 -11.364 -9.752 5.263 1.00 0.00 H new ATOM 0 HA ALA B 120 -8.818 -8.810 6.054 1.00 0.00 H new ATOM 0 HB1 ALA B 120 -9.128 -10.379 7.909 1.00 0.00 H new ATOM 0 HB2 ALA B 120 -10.604 -9.434 7.600 1.00 0.00 H new ATOM 0 HB3 ALA B 120 -10.498 -11.124 7.053 1.00 0.00 H new ATOM 1298 N LYS B 121 -9.013 -11.707 4.620 1.00 0.00 N ATOM 1299 CA LYS B 121 -8.303 -12.780 3.970 1.00 0.00 C ATOM 1300 C LYS B 121 -7.467 -12.255 2.814 1.00 0.00 C ATOM 1301 O LYS B 121 -6.372 -12.759 2.551 1.00 0.00 O ATOM 1302 CB LYS B 121 -9.309 -13.807 3.496 1.00 0.00 C ATOM 1303 CG LYS B 121 -9.746 -14.775 4.584 1.00 0.00 C ATOM 1304 CD LYS B 121 -10.483 -14.071 5.692 1.00 0.00 C ATOM 1305 CE LYS B 121 -10.745 -14.982 6.872 1.00 0.00 C ATOM 1306 NZ LYS B 121 -11.658 -16.100 6.526 1.00 0.00 N ATOM 0 H LYS B 121 -10.024 -11.747 4.490 1.00 0.00 H new ATOM 0 HA LYS B 121 -7.615 -13.246 4.675 1.00 0.00 H new ATOM 0 HB2 LYS B 121 -10.186 -13.291 3.106 1.00 0.00 H new ATOM 0 HB3 LYS B 121 -8.878 -14.372 2.670 1.00 0.00 H new ATOM 0 HG2 LYS B 121 -10.387 -15.543 4.152 1.00 0.00 H new ATOM 0 HG3 LYS B 121 -8.872 -15.282 4.993 1.00 0.00 H new ATOM 0 HD2 LYS B 121 -9.903 -13.209 6.022 1.00 0.00 H new ATOM 0 HD3 LYS B 121 -11.431 -13.690 5.311 1.00 0.00 H new ATOM 0 HE2 LYS B 121 -9.799 -15.386 7.234 1.00 0.00 H new ATOM 0 HE3 LYS B 121 -11.177 -14.402 7.688 1.00 0.00 H new ATOM 0 HZ1 LYS B 121 -11.836 -16.678 7.372 1.00 0.00 H new ATOM 0 HZ2 LYS B 121 -12.558 -15.717 6.173 1.00 0.00 H new ATOM 0 HZ3 LYS B 121 -11.221 -16.690 5.790 1.00 0.00 H new ATOM 1320 N ASP B 122 -7.961 -11.208 2.155 1.00 0.00 N ATOM 1321 CA ASP B 122 -7.216 -10.607 1.049 1.00 0.00 C ATOM 1322 C ASP B 122 -6.019 -9.867 1.611 1.00 0.00 C ATOM 1323 O ASP B 122 -4.935 -9.859 1.025 1.00 0.00 O ATOM 1324 CB ASP B 122 -8.087 -9.639 0.234 1.00 0.00 C ATOM 1325 CG ASP B 122 -9.262 -10.317 -0.437 1.00 0.00 C ATOM 1326 OD1 ASP B 122 -10.342 -10.387 0.183 1.00 0.00 O ATOM 1327 OD2 ASP B 122 -9.116 -10.771 -1.590 1.00 0.00 O ATOM 0 H ASP B 122 -8.856 -10.765 2.362 1.00 0.00 H new ATOM 0 HA ASP B 122 -6.894 -11.403 0.378 1.00 0.00 H new ATOM 0 HB2 ASP B 122 -8.457 -8.852 0.891 1.00 0.00 H new ATOM 0 HB3 ASP B 122 -7.471 -9.157 -0.526 1.00 0.00 H new ATOM 1332 N ILE B 123 -6.224 -9.252 2.766 1.00 0.00 N ATOM 1333 CA ILE B 123 -5.151 -8.565 3.460 1.00 0.00 C ATOM 1334 C ILE B 123 -4.069 -9.553 3.856 1.00 0.00 C ATOM 1335 O ILE B 123 -2.890 -9.324 3.590 1.00 0.00 O ATOM 1336 CB ILE B 123 -5.650 -7.839 4.723 1.00 0.00 C ATOM 1337 CG1 ILE B 123 -6.847 -6.956 4.390 1.00 0.00 C ATOM 1338 CG2 ILE B 123 -4.533 -7.010 5.337 1.00 0.00 C ATOM 1339 CD1 ILE B 123 -6.580 -5.948 3.295 1.00 0.00 C ATOM 0 H ILE B 123 -7.126 -9.216 3.241 1.00 0.00 H new ATOM 0 HA ILE B 123 -4.751 -7.820 2.772 1.00 0.00 H new ATOM 0 HB ILE B 123 -5.963 -8.588 5.451 1.00 0.00 H new ATOM 0 HG12 ILE B 123 -7.682 -7.590 4.091 1.00 0.00 H new ATOM 0 HG13 ILE B 123 -7.156 -6.426 5.291 1.00 0.00 H new ATOM 0 HG21 ILE B 123 -4.903 -6.504 6.228 1.00 0.00 H new ATOM 0 HG22 ILE B 123 -3.703 -7.662 5.608 1.00 0.00 H new ATOM 0 HG23 ILE B 123 -4.191 -6.269 4.615 1.00 0.00 H new ATOM 0 HD11 ILE B 123 -7.479 -5.358 3.116 1.00 0.00 H new ATOM 0 HD12 ILE B 123 -5.767 -5.288 3.598 1.00 0.00 H new ATOM 0 HD13 ILE B 123 -6.301 -6.470 2.380 1.00 0.00 H new ATOM 1351 N LYS B 124 -4.486 -10.671 4.463 1.00 0.00 N ATOM 1352 CA LYS B 124 -3.556 -11.692 4.906 1.00 0.00 C ATOM 1353 C LYS B 124 -2.751 -12.165 3.728 1.00 0.00 C ATOM 1354 O LYS B 124 -1.550 -12.284 3.816 1.00 0.00 O ATOM 1355 CB LYS B 124 -4.283 -12.871 5.563 1.00 0.00 C ATOM 1356 CG LYS B 124 -4.960 -12.504 6.866 1.00 0.00 C ATOM 1357 CD LYS B 124 -3.955 -12.078 7.925 1.00 0.00 C ATOM 1358 CE LYS B 124 -3.364 -13.272 8.655 1.00 0.00 C ATOM 1359 NZ LYS B 124 -2.174 -13.857 7.971 1.00 0.00 N ATOM 0 H LYS B 124 -5.465 -10.883 4.654 1.00 0.00 H new ATOM 0 HA LYS B 124 -2.896 -11.260 5.658 1.00 0.00 H new ATOM 0 HB2 LYS B 124 -5.029 -13.260 4.871 1.00 0.00 H new ATOM 0 HB3 LYS B 124 -3.568 -13.674 5.746 1.00 0.00 H new ATOM 0 HG2 LYS B 124 -5.669 -11.695 6.692 1.00 0.00 H new ATOM 0 HG3 LYS B 124 -5.533 -13.357 7.231 1.00 0.00 H new ATOM 0 HD2 LYS B 124 -3.154 -11.506 7.457 1.00 0.00 H new ATOM 0 HD3 LYS B 124 -4.441 -11.417 8.643 1.00 0.00 H new ATOM 0 HE2 LYS B 124 -3.081 -12.968 9.663 1.00 0.00 H new ATOM 0 HE3 LYS B 124 -4.130 -14.041 8.757 1.00 0.00 H new ATOM 0 HZ1 LYS B 124 -2.385 -14.833 7.682 1.00 0.00 H new ATOM 0 HZ2 LYS B 124 -1.943 -13.289 7.131 1.00 0.00 H new ATOM 0 HZ3 LYS B 124 -1.364 -13.856 8.623 1.00 0.00 H new ATOM 1373 N LYS B 125 -3.430 -12.408 2.625 1.00 0.00 N ATOM 1374 CA LYS B 125 -2.815 -12.715 1.387 1.00 0.00 C ATOM 1375 C LYS B 125 -1.669 -11.761 1.042 1.00 0.00 C ATOM 1376 O LYS B 125 -0.492 -12.170 0.960 1.00 0.00 O ATOM 1377 CB LYS B 125 -3.907 -12.645 0.350 1.00 0.00 C ATOM 1378 CG LYS B 125 -3.488 -13.176 -0.972 1.00 0.00 C ATOM 1379 CD LYS B 125 -2.903 -14.539 -0.748 1.00 0.00 C ATOM 1380 CE LYS B 125 -1.438 -14.598 -1.145 1.00 0.00 C ATOM 1381 NZ LYS B 125 -0.875 -15.966 -1.002 1.00 0.00 N ATOM 0 H LYS B 125 -4.449 -12.393 2.583 1.00 0.00 H new ATOM 0 HA LYS B 125 -2.358 -13.704 1.430 1.00 0.00 H new ATOM 0 HB2 LYS B 125 -4.772 -13.206 0.703 1.00 0.00 H new ATOM 0 HB3 LYS B 125 -4.225 -11.609 0.235 1.00 0.00 H new ATOM 0 HG2 LYS B 125 -4.340 -13.231 -1.650 1.00 0.00 H new ATOM 0 HG3 LYS B 125 -2.755 -12.516 -1.435 1.00 0.00 H new ATOM 0 HD2 LYS B 125 -3.006 -14.810 0.303 1.00 0.00 H new ATOM 0 HD3 LYS B 125 -3.465 -15.275 -1.323 1.00 0.00 H new ATOM 0 HE2 LYS B 125 -1.329 -14.268 -2.178 1.00 0.00 H new ATOM 0 HE3 LYS B 125 -0.867 -13.905 -0.527 1.00 0.00 H new ATOM 0 HZ1 LYS B 125 0.126 -15.961 -1.283 1.00 0.00 H new ATOM 0 HZ2 LYS B 125 -0.955 -16.272 -0.011 1.00 0.00 H new ATOM 0 HZ3 LYS B 125 -1.402 -16.624 -1.611 1.00 0.00 H new ATOM 1395 N ILE B 126 -2.021 -10.496 0.857 1.00 0.00 N ATOM 1396 CA ILE B 126 -1.063 -9.497 0.417 1.00 0.00 C ATOM 1397 C ILE B 126 0.135 -9.418 1.365 1.00 0.00 C ATOM 1398 O ILE B 126 1.278 -9.429 0.919 1.00 0.00 O ATOM 1399 CB ILE B 126 -1.729 -8.101 0.246 1.00 0.00 C ATOM 1400 CG1 ILE B 126 -2.365 -7.964 -1.149 1.00 0.00 C ATOM 1401 CG2 ILE B 126 -0.732 -6.969 0.477 1.00 0.00 C ATOM 1402 CD1 ILE B 126 -3.493 -8.934 -1.426 1.00 0.00 C ATOM 0 H ILE B 126 -2.965 -10.139 1.006 1.00 0.00 H new ATOM 0 HA ILE B 126 -0.697 -9.811 -0.561 1.00 0.00 H new ATOM 0 HB ILE B 126 -2.511 -8.023 1.001 1.00 0.00 H new ATOM 0 HG12 ILE B 126 -2.741 -6.947 -1.264 1.00 0.00 H new ATOM 0 HG13 ILE B 126 -1.590 -8.104 -1.902 1.00 0.00 H new ATOM 0 HG21 ILE B 126 -1.234 -6.010 0.349 1.00 0.00 H new ATOM 0 HG22 ILE B 126 -0.332 -7.037 1.489 1.00 0.00 H new ATOM 0 HG23 ILE B 126 0.084 -7.050 -0.241 1.00 0.00 H new ATOM 0 HD11 ILE B 126 -3.880 -8.765 -2.431 1.00 0.00 H new ATOM 0 HD12 ILE B 126 -3.122 -9.956 -1.348 1.00 0.00 H new ATOM 0 HD13 ILE B 126 -4.291 -8.781 -0.699 1.00 0.00 H new ATOM 1414 N LEU B 127 -0.110 -9.386 2.668 1.00 0.00 N ATOM 1415 CA LEU B 127 0.988 -9.263 3.620 1.00 0.00 C ATOM 1416 C LEU B 127 1.710 -10.592 3.832 1.00 0.00 C ATOM 1417 O LEU B 127 2.889 -10.608 4.182 1.00 0.00 O ATOM 1418 CB LEU B 127 0.512 -8.670 4.952 1.00 0.00 C ATOM 1419 CG LEU B 127 -0.791 -9.229 5.516 1.00 0.00 C ATOM 1420 CD1 LEU B 127 -0.563 -10.530 6.268 1.00 0.00 C ATOM 1421 CD2 LEU B 127 -1.450 -8.192 6.403 1.00 0.00 C ATOM 0 H LEU B 127 -1.039 -9.442 3.085 1.00 0.00 H new ATOM 0 HA LEU B 127 1.709 -8.570 3.187 1.00 0.00 H new ATOM 0 HB2 LEU B 127 1.297 -8.820 5.693 1.00 0.00 H new ATOM 0 HB3 LEU B 127 0.395 -7.594 4.825 1.00 0.00 H new ATOM 0 HG LEU B 127 -1.457 -9.457 4.684 1.00 0.00 H new ATOM 0 HD11 LEU B 127 -1.513 -10.898 6.655 1.00 0.00 H new ATOM 0 HD12 LEU B 127 -0.135 -11.271 5.592 1.00 0.00 H new ATOM 0 HD13 LEU B 127 0.123 -10.356 7.097 1.00 0.00 H new ATOM 0 HD21 LEU B 127 -2.380 -8.594 6.804 1.00 0.00 H new ATOM 0 HD22 LEU B 127 -0.781 -7.938 7.225 1.00 0.00 H new ATOM 0 HD23 LEU B 127 -1.664 -7.297 5.819 1.00 0.00 H new ATOM 1433 N ASP B 128 1.020 -11.703 3.593 1.00 0.00 N ATOM 1434 CA ASP B 128 1.618 -13.027 3.762 1.00 0.00 C ATOM 1435 C ASP B 128 2.704 -13.234 2.727 1.00 0.00 C ATOM 1436 O ASP B 128 3.730 -13.850 3.005 1.00 0.00 O ATOM 1437 CB ASP B 128 0.558 -14.125 3.619 1.00 0.00 C ATOM 1438 CG ASP B 128 1.056 -15.502 4.009 1.00 0.00 C ATOM 1439 OD1 ASP B 128 1.571 -16.224 3.129 1.00 0.00 O ATOM 1440 OD2 ASP B 128 0.892 -15.880 5.189 1.00 0.00 O ATOM 0 H ASP B 128 0.049 -11.715 3.282 1.00 0.00 H new ATOM 0 HA ASP B 128 2.048 -13.086 4.762 1.00 0.00 H new ATOM 0 HB2 ASP B 128 -0.303 -13.870 4.237 1.00 0.00 H new ATOM 0 HB3 ASP B 128 0.212 -14.152 2.586 1.00 0.00 H new ATOM 1445 N SER B 129 2.473 -12.698 1.532 1.00 0.00 N ATOM 1446 CA SER B 129 3.432 -12.838 0.438 1.00 0.00 C ATOM 1447 C SER B 129 4.816 -12.260 0.795 1.00 0.00 C ATOM 1448 O SER B 129 5.837 -12.743 0.300 1.00 0.00 O ATOM 1449 CB SER B 129 2.888 -12.183 -0.832 1.00 0.00 C ATOM 1450 OG SER B 129 2.836 -10.773 -0.709 1.00 0.00 O ATOM 0 H SER B 129 1.636 -12.166 1.296 1.00 0.00 H new ATOM 0 HA SER B 129 3.568 -13.905 0.261 1.00 0.00 H new ATOM 0 HB2 SER B 129 3.518 -12.452 -1.680 1.00 0.00 H new ATOM 0 HB3 SER B 129 1.890 -12.568 -1.042 1.00 0.00 H new ATOM 0 HG SER B 129 2.182 -10.529 -0.021 1.00 0.00 H new ATOM 1456 N VAL B 130 4.852 -11.234 1.652 1.00 0.00 N ATOM 1457 CA VAL B 130 6.121 -10.643 2.088 1.00 0.00 C ATOM 1458 C VAL B 130 6.429 -10.989 3.543 1.00 0.00 C ATOM 1459 O VAL B 130 7.398 -10.494 4.118 1.00 0.00 O ATOM 1460 CB VAL B 130 6.153 -9.112 1.904 1.00 0.00 C ATOM 1461 CG1 VAL B 130 6.409 -8.758 0.447 1.00 0.00 C ATOM 1462 CG2 VAL B 130 4.858 -8.479 2.394 1.00 0.00 C ATOM 0 H VAL B 130 4.023 -10.798 2.055 1.00 0.00 H new ATOM 0 HA VAL B 130 6.889 -11.077 1.448 1.00 0.00 H new ATOM 0 HB VAL B 130 6.970 -8.712 2.504 1.00 0.00 H new ATOM 0 HG11 VAL B 130 6.429 -7.674 0.334 1.00 0.00 H new ATOM 0 HG12 VAL B 130 7.367 -9.173 0.135 1.00 0.00 H new ATOM 0 HG13 VAL B 130 5.615 -9.173 -0.173 1.00 0.00 H new ATOM 0 HG21 VAL B 130 4.905 -7.399 2.254 1.00 0.00 H new ATOM 0 HG22 VAL B 130 4.019 -8.882 1.827 1.00 0.00 H new ATOM 0 HG23 VAL B 130 4.722 -8.702 3.452 1.00 0.00 H new ATOM 1472 N GLY B 131 5.601 -11.843 4.131 1.00 0.00 N ATOM 1473 CA GLY B 131 5.849 -12.319 5.480 1.00 0.00 C ATOM 1474 C GLY B 131 5.558 -11.286 6.556 1.00 0.00 C ATOM 1475 O GLY B 131 6.189 -11.293 7.613 1.00 0.00 O ATOM 0 H GLY B 131 4.758 -12.217 3.696 1.00 0.00 H new ATOM 0 HA2 GLY B 131 5.237 -13.202 5.662 1.00 0.00 H new ATOM 0 HA3 GLY B 131 6.890 -12.630 5.560 1.00 0.00 H new ATOM 1479 N ILE B 132 4.602 -10.403 6.299 1.00 0.00 N ATOM 1480 CA ILE B 132 4.194 -9.416 7.287 1.00 0.00 C ATOM 1481 C ILE B 132 3.065 -9.975 8.149 1.00 0.00 C ATOM 1482 O ILE B 132 2.096 -10.517 7.625 1.00 0.00 O ATOM 1483 CB ILE B 132 3.791 -8.085 6.627 1.00 0.00 C ATOM 1484 CG1 ILE B 132 5.068 -7.500 6.068 1.00 0.00 C ATOM 1485 CG2 ILE B 132 3.146 -7.139 7.636 1.00 0.00 C ATOM 1486 CD1 ILE B 132 4.932 -6.090 5.539 1.00 0.00 C ATOM 0 H ILE B 132 4.096 -10.351 5.415 1.00 0.00 H new ATOM 0 HA ILE B 132 5.048 -9.203 7.930 1.00 0.00 H new ATOM 0 HB ILE B 132 3.048 -8.239 5.845 1.00 0.00 H new ATOM 0 HG12 ILE B 132 5.829 -7.510 6.848 1.00 0.00 H new ATOM 0 HG13 ILE B 132 5.426 -8.143 5.264 1.00 0.00 H new ATOM 0 HG21 ILE B 132 2.873 -6.208 7.139 1.00 0.00 H new ATOM 0 HG22 ILE B 132 2.252 -7.604 8.051 1.00 0.00 H new ATOM 0 HG23 ILE B 132 3.852 -6.928 8.439 1.00 0.00 H new ATOM 0 HD11 ILE B 132 5.895 -5.750 5.158 1.00 0.00 H new ATOM 0 HD12 ILE B 132 4.197 -6.073 4.735 1.00 0.00 H new ATOM 0 HD13 ILE B 132 4.606 -5.430 6.343 1.00 0.00 H new ATOM 1498 N GLU B 133 3.205 -9.875 9.467 1.00 0.00 N ATOM 1499 CA GLU B 133 2.241 -10.482 10.376 1.00 0.00 C ATOM 1500 C GLU B 133 1.017 -9.602 10.534 1.00 0.00 C ATOM 1501 O GLU B 133 1.111 -8.374 10.497 1.00 0.00 O ATOM 1502 CB GLU B 133 2.858 -10.746 11.745 1.00 0.00 C ATOM 1503 CG GLU B 133 3.985 -11.764 11.725 1.00 0.00 C ATOM 1504 CD GLU B 133 4.430 -12.144 13.117 1.00 0.00 C ATOM 1505 OE1 GLU B 133 5.112 -11.326 13.768 1.00 0.00 O ATOM 1506 OE2 GLU B 133 4.091 -13.257 13.572 1.00 0.00 O ATOM 0 H GLU B 133 3.971 -9.383 9.926 1.00 0.00 H new ATOM 0 HA GLU B 133 1.942 -11.435 9.938 1.00 0.00 H new ATOM 0 HB2 GLU B 133 3.236 -9.807 12.149 1.00 0.00 H new ATOM 0 HB3 GLU B 133 2.079 -11.094 12.423 1.00 0.00 H new ATOM 0 HG2 GLU B 133 3.657 -12.657 11.193 1.00 0.00 H new ATOM 0 HG3 GLU B 133 4.832 -11.357 11.172 1.00 0.00 H new ATOM 1513 N ALA B 134 -0.127 -10.236 10.715 1.00 0.00 N ATOM 1514 CA ALA B 134 -1.379 -9.525 10.795 1.00 0.00 C ATOM 1515 C ALA B 134 -2.345 -10.199 11.751 1.00 0.00 C ATOM 1516 O ALA B 134 -2.394 -11.427 11.835 1.00 0.00 O ATOM 1517 CB ALA B 134 -1.984 -9.470 9.419 1.00 0.00 C ATOM 0 H ALA B 134 -0.209 -11.248 10.809 1.00 0.00 H new ATOM 0 HA ALA B 134 -1.189 -8.521 11.174 1.00 0.00 H new ATOM 0 HB1 ALA B 134 -2.933 -8.935 9.460 1.00 0.00 H new ATOM 0 HB2 ALA B 134 -1.304 -8.952 8.743 1.00 0.00 H new ATOM 0 HB3 ALA B 134 -2.154 -10.483 9.056 1.00 0.00 H new ATOM 1523 N ASP B 135 -3.122 -9.397 12.462 1.00 0.00 N ATOM 1524 CA ASP B 135 -4.167 -9.934 13.311 1.00 0.00 C ATOM 1525 C ASP B 135 -5.487 -9.958 12.547 1.00 0.00 C ATOM 1526 O ASP B 135 -5.890 -8.948 11.929 1.00 0.00 O ATOM 1527 CB ASP B 135 -4.308 -9.122 14.593 1.00 0.00 C ATOM 1528 CG ASP B 135 -3.101 -9.215 15.497 1.00 0.00 C ATOM 1529 OD1 ASP B 135 -3.002 -10.197 16.263 1.00 0.00 O ATOM 1530 OD2 ASP B 135 -2.256 -8.299 15.461 1.00 0.00 O ATOM 0 H ASP B 135 -3.048 -8.380 12.467 1.00 0.00 H new ATOM 0 HA ASP B 135 -3.895 -10.951 13.592 1.00 0.00 H new ATOM 0 HB2 ASP B 135 -4.480 -8.077 14.335 1.00 0.00 H new ATOM 0 HB3 ASP B 135 -5.188 -9.465 15.137 1.00 0.00 H new ATOM 1535 N ASP B 136 -6.174 -11.097 12.627 1.00 0.00 N ATOM 1536 CA ASP B 136 -7.300 -11.398 11.755 1.00 0.00 C ATOM 1537 C ASP B 136 -8.508 -10.557 12.098 1.00 0.00 C ATOM 1538 O ASP B 136 -9.479 -10.515 11.345 1.00 0.00 O ATOM 1539 CB ASP B 136 -7.670 -12.877 11.816 1.00 0.00 C ATOM 1540 CG ASP B 136 -6.579 -13.781 11.278 1.00 0.00 C ATOM 1541 OD1 ASP B 136 -5.631 -14.082 12.033 1.00 0.00 O ATOM 1542 OD2 ASP B 136 -6.669 -14.200 10.105 1.00 0.00 O ATOM 0 H ASP B 136 -5.963 -11.834 13.299 1.00 0.00 H new ATOM 0 HA ASP B 136 -6.986 -11.156 10.740 1.00 0.00 H new ATOM 0 HB2 ASP B 136 -7.885 -13.150 12.849 1.00 0.00 H new ATOM 0 HB3 ASP B 136 -8.585 -13.041 11.246 1.00 0.00 H new ATOM 1547 N ASP B 137 -8.455 -9.885 13.226 1.00 0.00 N ATOM 1548 CA ASP B 137 -9.506 -8.971 13.569 1.00 0.00 C ATOM 1549 C ASP B 137 -9.118 -7.557 13.199 1.00 0.00 C ATOM 1550 O ASP B 137 -9.969 -6.751 12.831 1.00 0.00 O ATOM 1551 CB ASP B 137 -9.857 -9.022 15.053 1.00 0.00 C ATOM 1552 CG ASP B 137 -10.223 -10.408 15.546 1.00 0.00 C ATOM 1553 OD1 ASP B 137 -11.417 -10.762 15.497 1.00 0.00 O ATOM 1554 OD2 ASP B 137 -9.320 -11.134 16.011 1.00 0.00 O ATOM 0 H ASP B 137 -7.702 -9.956 13.910 1.00 0.00 H new ATOM 0 HA ASP B 137 -10.386 -9.277 13.003 1.00 0.00 H new ATOM 0 HB2 ASP B 137 -9.009 -8.653 15.631 1.00 0.00 H new ATOM 0 HB3 ASP B 137 -10.691 -8.346 15.243 1.00 0.00 H new ATOM 1559 N ARG B 138 -7.825 -7.268 13.258 1.00 0.00 N ATOM 1560 CA ARG B 138 -7.349 -5.914 13.030 1.00 0.00 C ATOM 1561 C ARG B 138 -7.612 -5.521 11.600 1.00 0.00 C ATOM 1562 O ARG B 138 -8.079 -4.415 11.309 1.00 0.00 O ATOM 1563 CB ARG B 138 -5.865 -5.790 13.312 1.00 0.00 C ATOM 1564 CG ARG B 138 -5.500 -6.250 14.690 1.00 0.00 C ATOM 1565 CD ARG B 138 -5.751 -5.197 15.750 1.00 0.00 C ATOM 1566 NE ARG B 138 -5.396 -5.697 17.075 1.00 0.00 N ATOM 1567 CZ ARG B 138 -6.282 -5.979 18.028 1.00 0.00 C ATOM 1568 NH1 ARG B 138 -7.578 -5.796 17.816 1.00 0.00 N ATOM 1569 NH2 ARG B 138 -5.875 -6.458 19.197 1.00 0.00 N ATOM 0 H ARG B 138 -7.093 -7.949 13.460 1.00 0.00 H new ATOM 0 HA ARG B 138 -7.885 -5.253 13.711 1.00 0.00 H new ATOM 0 HB2 ARG B 138 -5.310 -6.375 12.579 1.00 0.00 H new ATOM 0 HB3 ARG B 138 -5.561 -4.751 13.187 1.00 0.00 H new ATOM 0 HG2 ARG B 138 -6.073 -7.145 14.932 1.00 0.00 H new ATOM 0 HG3 ARG B 138 -4.447 -6.531 14.707 1.00 0.00 H new ATOM 0 HD2 ARG B 138 -5.168 -4.303 15.526 1.00 0.00 H new ATOM 0 HD3 ARG B 138 -6.801 -4.905 15.736 1.00 0.00 H new ATOM 0 HE ARG B 138 -4.408 -5.839 17.284 1.00 0.00 H new ATOM 0 HH11 ARG B 138 -7.902 -5.437 16.918 1.00 0.00 H new ATOM 0 HH12 ARG B 138 -8.251 -6.014 18.551 1.00 0.00 H new ATOM 0 HH21 ARG B 138 -4.881 -6.611 19.367 1.00 0.00 H new ATOM 0 HH22 ARG B 138 -6.556 -6.673 19.925 1.00 0.00 H new ATOM 1583 N LEU B 139 -7.320 -6.442 10.703 1.00 0.00 N ATOM 1584 CA LEU B 139 -7.540 -6.174 9.292 1.00 0.00 C ATOM 1585 C LEU B 139 -9.014 -6.261 8.934 1.00 0.00 C ATOM 1586 O LEU B 139 -9.506 -5.473 8.143 1.00 0.00 O ATOM 1587 CB LEU B 139 -6.707 -7.089 8.399 1.00 0.00 C ATOM 1588 CG LEU B 139 -6.268 -8.402 9.023 1.00 0.00 C ATOM 1589 CD1 LEU B 139 -7.469 -9.284 9.286 1.00 0.00 C ATOM 1590 CD2 LEU B 139 -5.264 -9.089 8.122 1.00 0.00 C ATOM 0 H LEU B 139 -6.938 -7.363 10.917 1.00 0.00 H new ATOM 0 HA LEU B 139 -7.208 -5.152 9.109 1.00 0.00 H new ATOM 0 HB2 LEU B 139 -7.283 -7.310 7.500 1.00 0.00 H new ATOM 0 HB3 LEU B 139 -5.818 -6.544 8.082 1.00 0.00 H new ATOM 0 HG LEU B 139 -5.785 -8.204 9.980 1.00 0.00 H new ATOM 0 HD11 LEU B 139 -7.140 -10.222 9.733 1.00 0.00 H new ATOM 0 HD12 LEU B 139 -8.151 -8.776 9.968 1.00 0.00 H new ATOM 0 HD13 LEU B 139 -7.982 -9.490 8.346 1.00 0.00 H new ATOM 0 HD21 LEU B 139 -4.953 -10.030 8.575 1.00 0.00 H new ATOM 0 HD22 LEU B 139 -5.721 -9.287 7.152 1.00 0.00 H new ATOM 0 HD23 LEU B 139 -4.394 -8.445 7.989 1.00 0.00 H new ATOM 1602 N ASN B 140 -9.730 -7.183 9.542 1.00 0.00 N ATOM 1603 CA ASN B 140 -11.157 -7.295 9.289 1.00 0.00 C ATOM 1604 C ASN B 140 -11.839 -6.010 9.755 1.00 0.00 C ATOM 1605 O ASN B 140 -12.880 -5.609 9.241 1.00 0.00 O ATOM 1606 CB ASN B 140 -11.741 -8.511 10.016 1.00 0.00 C ATOM 1607 CG ASN B 140 -13.192 -8.767 9.656 1.00 0.00 C ATOM 1608 OD1 ASN B 140 -13.621 -8.521 8.524 1.00 0.00 O ATOM 1609 ND2 ASN B 140 -13.963 -9.261 10.611 1.00 0.00 N ATOM 0 H ASN B 140 -9.357 -7.860 10.208 1.00 0.00 H new ATOM 0 HA ASN B 140 -11.330 -7.435 8.222 1.00 0.00 H new ATOM 0 HB2 ASN B 140 -11.149 -9.393 9.772 1.00 0.00 H new ATOM 0 HB3 ASN B 140 -11.659 -8.360 11.092 1.00 0.00 H new ATOM 0 HD21 ASN B 140 -14.947 -9.451 10.424 1.00 0.00 H new ATOM 0 HD22 ASN B 140 -13.573 -9.451 11.534 1.00 0.00 H new ATOM 1616 N LYS B 141 -11.195 -5.359 10.713 1.00 0.00 N ATOM 1617 CA LYS B 141 -11.651 -4.089 11.260 1.00 0.00 C ATOM 1618 C LYS B 141 -11.349 -2.945 10.299 1.00 0.00 C ATOM 1619 O LYS B 141 -12.225 -2.129 10.005 1.00 0.00 O ATOM 1620 CB LYS B 141 -10.983 -3.842 12.621 1.00 0.00 C ATOM 1621 CG LYS B 141 -10.847 -2.375 12.999 1.00 0.00 C ATOM 1622 CD LYS B 141 -12.194 -1.723 13.293 1.00 0.00 C ATOM 1623 CE LYS B 141 -12.026 -0.261 13.688 1.00 0.00 C ATOM 1624 NZ LYS B 141 -13.332 0.422 13.895 1.00 0.00 N ATOM 0 H LYS B 141 -10.333 -5.701 11.137 1.00 0.00 H new ATOM 0 HA LYS B 141 -12.731 -4.134 11.397 1.00 0.00 H new ATOM 0 HB2 LYS B 141 -11.560 -4.351 13.393 1.00 0.00 H new ATOM 0 HB3 LYS B 141 -9.992 -4.296 12.613 1.00 0.00 H new ATOM 0 HG2 LYS B 141 -10.205 -2.286 13.875 1.00 0.00 H new ATOM 0 HG3 LYS B 141 -10.356 -1.838 12.188 1.00 0.00 H new ATOM 0 HD2 LYS B 141 -12.834 -1.793 12.414 1.00 0.00 H new ATOM 0 HD3 LYS B 141 -12.695 -2.264 14.096 1.00 0.00 H new ATOM 0 HE2 LYS B 141 -11.437 -0.200 14.603 1.00 0.00 H new ATOM 0 HE3 LYS B 141 -11.465 0.260 12.913 1.00 0.00 H new ATOM 0 HZ1 LYS B 141 -13.167 1.393 14.227 1.00 0.00 H new ATOM 0 HZ2 LYS B 141 -13.856 0.448 12.997 1.00 0.00 H new ATOM 0 HZ3 LYS B 141 -13.887 -0.097 14.605 1.00 0.00 H new ATOM 1638 N VAL B 142 -10.109 -2.880 9.812 1.00 0.00 N ATOM 1639 CA VAL B 142 -9.730 -1.824 8.877 1.00 0.00 C ATOM 1640 C VAL B 142 -10.634 -1.876 7.647 1.00 0.00 C ATOM 1641 O VAL B 142 -11.162 -0.866 7.206 1.00 0.00 O ATOM 1642 CB VAL B 142 -8.237 -1.904 8.468 1.00 0.00 C ATOM 1643 CG1 VAL B 142 -7.909 -3.169 7.683 1.00 0.00 C ATOM 1644 CG2 VAL B 142 -7.842 -0.668 7.681 1.00 0.00 C ATOM 0 H VAL B 142 -9.362 -3.535 10.045 1.00 0.00 H new ATOM 0 HA VAL B 142 -9.862 -0.868 9.384 1.00 0.00 H new ATOM 0 HB VAL B 142 -7.654 -1.947 9.388 1.00 0.00 H new ATOM 0 HG11 VAL B 142 -6.850 -3.172 7.423 1.00 0.00 H new ATOM 0 HG12 VAL B 142 -8.135 -4.044 8.292 1.00 0.00 H new ATOM 0 HG13 VAL B 142 -8.506 -3.197 6.772 1.00 0.00 H new ATOM 0 HG21 VAL B 142 -6.791 -0.736 7.400 1.00 0.00 H new ATOM 0 HG22 VAL B 142 -8.455 -0.598 6.782 1.00 0.00 H new ATOM 0 HG23 VAL B 142 -7.996 0.219 8.295 1.00 0.00 H new ATOM 1654 N ILE B 143 -10.819 -3.078 7.140 1.00 0.00 N ATOM 1655 CA ILE B 143 -11.740 -3.372 6.062 1.00 0.00 C ATOM 1656 C ILE B 143 -13.154 -2.988 6.402 1.00 0.00 C ATOM 1657 O ILE B 143 -13.850 -2.383 5.600 1.00 0.00 O ATOM 1658 CB ILE B 143 -11.638 -4.862 5.822 1.00 0.00 C ATOM 1659 CG1 ILE B 143 -10.301 -5.094 5.189 1.00 0.00 C ATOM 1660 CG2 ILE B 143 -12.761 -5.434 4.987 1.00 0.00 C ATOM 1661 CD1 ILE B 143 -9.799 -6.456 5.414 1.00 0.00 C ATOM 0 H ILE B 143 -10.318 -3.900 7.477 1.00 0.00 H new ATOM 0 HA ILE B 143 -11.481 -2.796 5.174 1.00 0.00 H new ATOM 0 HB ILE B 143 -11.734 -5.388 6.772 1.00 0.00 H new ATOM 0 HG12 ILE B 143 -10.374 -4.910 4.117 1.00 0.00 H new ATOM 0 HG13 ILE B 143 -9.585 -4.376 5.588 1.00 0.00 H new ATOM 0 HG21 ILE B 143 -12.612 -6.507 4.863 1.00 0.00 H new ATOM 0 HG22 ILE B 143 -13.713 -5.256 5.487 1.00 0.00 H new ATOM 0 HG23 ILE B 143 -12.769 -4.953 4.009 1.00 0.00 H new ATOM 0 HD11 ILE B 143 -8.827 -6.570 4.934 1.00 0.00 H new ATOM 0 HD12 ILE B 143 -9.698 -6.634 6.485 1.00 0.00 H new ATOM 0 HD13 ILE B 143 -10.499 -7.176 4.991 1.00 0.00 H new ATOM 1673 N SER B 144 -13.567 -3.358 7.587 1.00 0.00 N ATOM 1674 CA SER B 144 -14.880 -2.990 8.089 1.00 0.00 C ATOM 1675 C SER B 144 -15.111 -1.476 7.963 1.00 0.00 C ATOM 1676 O SER B 144 -16.206 -1.032 7.613 1.00 0.00 O ATOM 1677 CB SER B 144 -15.040 -3.448 9.535 1.00 0.00 C ATOM 1678 OG SER B 144 -16.315 -3.116 10.055 1.00 0.00 O ATOM 0 H SER B 144 -13.012 -3.919 8.233 1.00 0.00 H new ATOM 0 HA SER B 144 -15.634 -3.492 7.483 1.00 0.00 H new ATOM 0 HB2 SER B 144 -14.894 -4.527 9.593 1.00 0.00 H new ATOM 0 HB3 SER B 144 -14.266 -2.988 10.149 1.00 0.00 H new ATOM 0 HG SER B 144 -16.381 -3.426 10.982 1.00 0.00 H new ATOM 1684 N GLU B 145 -14.061 -0.697 8.234 1.00 0.00 N ATOM 1685 CA GLU B 145 -14.102 0.756 8.064 1.00 0.00 C ATOM 1686 C GLU B 145 -14.056 1.122 6.577 1.00 0.00 C ATOM 1687 O GLU B 145 -14.875 1.892 6.073 1.00 0.00 O ATOM 1688 CB GLU B 145 -12.905 1.400 8.764 1.00 0.00 C ATOM 1689 CG GLU B 145 -12.812 1.071 10.238 1.00 0.00 C ATOM 1690 CD GLU B 145 -13.702 1.934 11.099 1.00 0.00 C ATOM 1691 OE1 GLU B 145 -13.434 3.147 11.209 1.00 0.00 O ATOM 1692 OE2 GLU B 145 -14.654 1.391 11.698 1.00 0.00 O ATOM 0 H GLU B 145 -13.167 -1.052 8.574 1.00 0.00 H new ATOM 0 HA GLU B 145 -15.030 1.123 8.502 1.00 0.00 H new ATOM 0 HB2 GLU B 145 -11.989 1.076 8.270 1.00 0.00 H new ATOM 0 HB3 GLU B 145 -12.965 2.482 8.645 1.00 0.00 H new ATOM 0 HG2 GLU B 145 -13.078 0.024 10.387 1.00 0.00 H new ATOM 0 HG3 GLU B 145 -11.779 1.187 10.565 1.00 0.00 H new ATOM 1699 N LEU B 146 -13.073 0.545 5.897 1.00 0.00 N ATOM 1700 CA LEU B 146 -12.781 0.811 4.491 1.00 0.00 C ATOM 1701 C LEU B 146 -13.938 0.448 3.563 1.00 0.00 C ATOM 1702 O LEU B 146 -14.127 1.076 2.524 1.00 0.00 O ATOM 1703 CB LEU B 146 -11.567 -0.007 4.081 1.00 0.00 C ATOM 1704 CG LEU B 146 -10.199 0.655 4.239 1.00 0.00 C ATOM 1705 CD1 LEU B 146 -9.934 1.607 3.082 1.00 0.00 C ATOM 1706 CD2 LEU B 146 -10.072 1.399 5.560 1.00 0.00 C ATOM 0 H LEU B 146 -12.441 -0.137 6.316 1.00 0.00 H new ATOM 0 HA LEU B 146 -12.603 1.882 4.396 1.00 0.00 H new ATOM 0 HB2 LEU B 146 -11.567 -0.928 4.664 1.00 0.00 H new ATOM 0 HB3 LEU B 146 -11.687 -0.291 3.036 1.00 0.00 H new ATOM 0 HG LEU B 146 -9.454 -0.141 4.234 1.00 0.00 H new ATOM 0 HD11 LEU B 146 -8.956 2.071 3.209 1.00 0.00 H new ATOM 0 HD12 LEU B 146 -9.954 1.053 2.143 1.00 0.00 H new ATOM 0 HD13 LEU B 146 -10.702 2.380 3.064 1.00 0.00 H new ATOM 0 HD21 LEU B 146 -9.084 1.853 5.628 1.00 0.00 H new ATOM 0 HD22 LEU B 146 -10.833 2.177 5.614 1.00 0.00 H new ATOM 0 HD23 LEU B 146 -10.208 0.700 6.386 1.00 0.00 H new ATOM 1718 N ASN B 147 -14.679 -0.583 3.937 1.00 0.00 N ATOM 1719 CA ASN B 147 -15.724 -1.152 3.089 1.00 0.00 C ATOM 1720 C ASN B 147 -16.729 -0.097 2.648 1.00 0.00 C ATOM 1721 O ASN B 147 -17.420 0.509 3.468 1.00 0.00 O ATOM 1722 CB ASN B 147 -16.424 -2.294 3.825 1.00 0.00 C ATOM 1723 CG ASN B 147 -17.482 -2.983 2.987 1.00 0.00 C ATOM 1724 OD1 ASN B 147 -17.397 -3.021 1.760 1.00 0.00 O ATOM 1725 ND2 ASN B 147 -18.479 -3.550 3.651 1.00 0.00 N ATOM 0 H ASN B 147 -14.576 -1.052 4.837 1.00 0.00 H new ATOM 0 HA ASN B 147 -15.253 -1.543 2.187 1.00 0.00 H new ATOM 0 HB2 ASN B 147 -15.680 -3.028 4.135 1.00 0.00 H new ATOM 0 HB3 ASN B 147 -16.885 -1.904 4.733 1.00 0.00 H new ATOM 0 HD21 ASN B 147 -19.215 -4.042 3.144 1.00 0.00 H new ATOM 0 HD22 ASN B 147 -18.511 -3.494 4.669 1.00 0.00 H new ATOM 1732 N GLY B 148 -16.790 0.123 1.343 1.00 0.00 N ATOM 1733 CA GLY B 148 -17.697 1.107 0.790 1.00 0.00 C ATOM 1734 C GLY B 148 -17.009 2.421 0.486 1.00 0.00 C ATOM 1735 O GLY B 148 -17.596 3.487 0.663 1.00 0.00 O ATOM 0 H GLY B 148 -16.222 -0.367 0.652 1.00 0.00 H new ATOM 0 HA2 GLY B 148 -18.142 0.713 -0.124 1.00 0.00 H new ATOM 0 HA3 GLY B 148 -18.512 1.281 1.493 1.00 0.00 H new ATOM 1739 N LYS B 149 -15.761 2.352 0.037 1.00 0.00 N ATOM 1740 CA LYS B 149 -15.016 3.546 -0.331 1.00 0.00 C ATOM 1741 C LYS B 149 -14.388 3.366 -1.707 1.00 0.00 C ATOM 1742 O LYS B 149 -14.282 2.247 -2.210 1.00 0.00 O ATOM 1743 CB LYS B 149 -13.931 3.855 0.709 1.00 0.00 C ATOM 1744 CG LYS B 149 -14.221 5.083 1.570 1.00 0.00 C ATOM 1745 CD LYS B 149 -15.420 4.879 2.485 1.00 0.00 C ATOM 1746 CE LYS B 149 -15.164 3.775 3.498 1.00 0.00 C ATOM 1747 NZ LYS B 149 -16.331 3.533 4.384 1.00 0.00 N ATOM 0 H LYS B 149 -15.245 1.480 -0.080 1.00 0.00 H new ATOM 0 HA LYS B 149 -15.709 4.387 -0.362 1.00 0.00 H new ATOM 0 HB2 LYS B 149 -13.810 2.989 1.360 1.00 0.00 H new ATOM 0 HB3 LYS B 149 -12.981 4.002 0.194 1.00 0.00 H new ATOM 0 HG2 LYS B 149 -13.343 5.317 2.172 1.00 0.00 H new ATOM 0 HG3 LYS B 149 -14.402 5.942 0.924 1.00 0.00 H new ATOM 0 HD2 LYS B 149 -15.643 5.809 3.007 1.00 0.00 H new ATOM 0 HD3 LYS B 149 -16.297 4.630 1.888 1.00 0.00 H new ATOM 0 HE2 LYS B 149 -14.915 2.854 2.971 1.00 0.00 H new ATOM 0 HE3 LYS B 149 -14.299 4.038 4.106 1.00 0.00 H new ATOM 0 HZ1 LYS B 149 -16.053 2.898 5.159 1.00 0.00 H new ATOM 0 HZ2 LYS B 149 -16.660 4.437 4.779 1.00 0.00 H new ATOM 0 HZ3 LYS B 149 -17.098 3.095 3.836 1.00 0.00 H new ATOM 1761 N ASN B 150 -13.967 4.469 -2.300 1.00 0.00 N ATOM 1762 CA ASN B 150 -13.379 4.457 -3.625 1.00 0.00 C ATOM 1763 C ASN B 150 -11.878 4.571 -3.490 1.00 0.00 C ATOM 1764 O ASN B 150 -11.332 5.673 -3.453 1.00 0.00 O ATOM 1765 CB ASN B 150 -13.927 5.606 -4.479 1.00 0.00 C ATOM 1766 CG ASN B 150 -15.392 5.432 -4.835 1.00 0.00 C ATOM 1767 OD1 ASN B 150 -16.152 4.786 -4.114 1.00 0.00 O ATOM 1768 ND2 ASN B 150 -15.803 6.017 -5.947 1.00 0.00 N ATOM 0 H ASN B 150 -14.023 5.395 -1.877 1.00 0.00 H new ATOM 0 HA ASN B 150 -13.637 3.523 -4.125 1.00 0.00 H new ATOM 0 HB2 ASN B 150 -13.798 6.545 -3.941 1.00 0.00 H new ATOM 0 HB3 ASN B 150 -13.342 5.681 -5.396 1.00 0.00 H new ATOM 0 HD21 ASN B 150 -16.779 5.941 -6.232 1.00 0.00 H new ATOM 0 HD22 ASN B 150 -15.144 6.544 -6.519 1.00 0.00 H new ATOM 1775 N ILE B 151 -11.243 3.408 -3.394 1.00 0.00 N ATOM 1776 CA ILE B 151 -9.814 3.280 -3.107 1.00 0.00 C ATOM 1777 C ILE B 151 -8.970 4.405 -3.720 1.00 0.00 C ATOM 1778 O ILE B 151 -8.433 5.238 -2.988 1.00 0.00 O ATOM 1779 CB ILE B 151 -9.295 1.906 -3.557 1.00 0.00 C ATOM 1780 CG1 ILE B 151 -9.629 0.831 -2.518 1.00 0.00 C ATOM 1781 CG2 ILE B 151 -7.802 1.960 -3.774 1.00 0.00 C ATOM 1782 CD1 ILE B 151 -11.105 0.588 -2.323 1.00 0.00 C ATOM 0 H ILE B 151 -11.713 2.511 -3.515 1.00 0.00 H new ATOM 0 HA ILE B 151 -9.706 3.370 -2.026 1.00 0.00 H new ATOM 0 HB ILE B 151 -9.786 1.647 -4.495 1.00 0.00 H new ATOM 0 HG12 ILE B 151 -9.156 -0.104 -2.816 1.00 0.00 H new ATOM 0 HG13 ILE B 151 -9.191 1.119 -1.562 1.00 0.00 H new ATOM 0 HG21 ILE B 151 -7.445 0.981 -4.093 1.00 0.00 H new ATOM 0 HG22 ILE B 151 -7.573 2.698 -4.543 1.00 0.00 H new ATOM 0 HG23 ILE B 151 -7.309 2.241 -2.843 1.00 0.00 H new ATOM 0 HD11 ILE B 151 -11.250 -0.187 -1.571 1.00 0.00 H new ATOM 0 HD12 ILE B 151 -11.585 1.509 -1.992 1.00 0.00 H new ATOM 0 HD13 ILE B 151 -11.548 0.267 -3.265 1.00 0.00 H new ATOM 1794 N GLU B 152 -8.860 4.436 -5.048 1.00 0.00 N ATOM 1795 CA GLU B 152 -8.076 5.452 -5.723 1.00 0.00 C ATOM 1796 C GLU B 152 -8.347 6.843 -5.191 1.00 0.00 C ATOM 1797 O GLU B 152 -7.433 7.498 -4.736 1.00 0.00 O ATOM 1798 CB GLU B 152 -8.334 5.402 -7.222 1.00 0.00 C ATOM 1799 CG GLU B 152 -7.350 4.536 -7.953 1.00 0.00 C ATOM 1800 CD GLU B 152 -6.319 5.363 -8.713 1.00 0.00 C ATOM 1801 OE1 GLU B 152 -6.181 6.575 -8.422 1.00 0.00 O ATOM 1802 OE2 GLU B 152 -5.663 4.812 -9.615 1.00 0.00 O ATOM 0 H GLU B 152 -9.307 3.765 -5.672 1.00 0.00 H new ATOM 0 HA GLU B 152 -7.027 5.233 -5.525 1.00 0.00 H new ATOM 0 HB2 GLU B 152 -9.342 5.028 -7.400 1.00 0.00 H new ATOM 0 HB3 GLU B 152 -8.292 6.413 -7.627 1.00 0.00 H new ATOM 0 HG2 GLU B 152 -6.841 3.885 -7.242 1.00 0.00 H new ATOM 0 HG3 GLU B 152 -7.883 3.890 -8.651 1.00 0.00 H new ATOM 1809 N ASP B 153 -9.594 7.283 -5.214 1.00 0.00 N ATOM 1810 CA ASP B 153 -9.924 8.629 -4.742 1.00 0.00 C ATOM 1811 C ASP B 153 -9.484 8.843 -3.296 1.00 0.00 C ATOM 1812 O ASP B 153 -9.085 9.949 -2.928 1.00 0.00 O ATOM 1813 CB ASP B 153 -11.411 8.913 -4.833 1.00 0.00 C ATOM 1814 CG ASP B 153 -11.949 8.887 -6.244 1.00 0.00 C ATOM 1815 OD1 ASP B 153 -12.068 7.788 -6.821 1.00 0.00 O ATOM 1816 OD2 ASP B 153 -12.270 9.970 -6.778 1.00 0.00 O ATOM 0 H ASP B 153 -10.390 6.740 -5.549 1.00 0.00 H new ATOM 0 HA ASP B 153 -9.384 9.314 -5.396 1.00 0.00 H new ATOM 0 HB2 ASP B 153 -11.950 8.178 -4.235 1.00 0.00 H new ATOM 0 HB3 ASP B 153 -11.613 9.890 -4.395 1.00 0.00 H new ATOM 1821 N VAL B 154 -9.583 7.796 -2.480 1.00 0.00 N ATOM 1822 CA VAL B 154 -9.139 7.865 -1.089 1.00 0.00 C ATOM 1823 C VAL B 154 -7.665 8.249 -1.028 1.00 0.00 C ATOM 1824 O VAL B 154 -7.283 9.224 -0.373 1.00 0.00 O ATOM 1825 CB VAL B 154 -9.326 6.515 -0.339 1.00 0.00 C ATOM 1826 CG1 VAL B 154 -8.847 6.637 1.099 1.00 0.00 C ATOM 1827 CG2 VAL B 154 -10.772 6.039 -0.383 1.00 0.00 C ATOM 0 H VAL B 154 -9.966 6.892 -2.757 1.00 0.00 H new ATOM 0 HA VAL B 154 -9.756 8.619 -0.601 1.00 0.00 H new ATOM 0 HB VAL B 154 -8.721 5.767 -0.851 1.00 0.00 H new ATOM 0 HG11 VAL B 154 -8.985 5.684 1.610 1.00 0.00 H new ATOM 0 HG12 VAL B 154 -7.791 6.905 1.109 1.00 0.00 H new ATOM 0 HG13 VAL B 154 -9.422 7.409 1.610 1.00 0.00 H new ATOM 0 HG21 VAL B 154 -10.860 5.093 0.152 1.00 0.00 H new ATOM 0 HG22 VAL B 154 -11.415 6.783 0.087 1.00 0.00 H new ATOM 0 HG23 VAL B 154 -11.078 5.899 -1.420 1.00 0.00 H new ATOM 1837 N ILE B 155 -6.848 7.490 -1.738 1.00 0.00 N ATOM 1838 CA ILE B 155 -5.401 7.650 -1.667 1.00 0.00 C ATOM 1839 C ILE B 155 -4.900 8.686 -2.660 1.00 0.00 C ATOM 1840 O ILE B 155 -3.824 9.234 -2.494 1.00 0.00 O ATOM 1841 CB ILE B 155 -4.670 6.312 -1.910 1.00 0.00 C ATOM 1842 CG1 ILE B 155 -5.049 5.291 -0.838 1.00 0.00 C ATOM 1843 CG2 ILE B 155 -3.159 6.504 -1.933 1.00 0.00 C ATOM 1844 CD1 ILE B 155 -6.426 4.708 -1.025 1.00 0.00 C ATOM 0 H ILE B 155 -7.160 6.755 -2.372 1.00 0.00 H new ATOM 0 HA ILE B 155 -5.178 7.996 -0.658 1.00 0.00 H new ATOM 0 HB ILE B 155 -4.982 5.937 -2.885 1.00 0.00 H new ATOM 0 HG12 ILE B 155 -4.317 4.483 -0.842 1.00 0.00 H new ATOM 0 HG13 ILE B 155 -4.994 5.766 0.141 1.00 0.00 H new ATOM 0 HG21 ILE B 155 -2.673 5.544 -2.106 1.00 0.00 H new ATOM 0 HG22 ILE B 155 -2.892 7.195 -2.733 1.00 0.00 H new ATOM 0 HG23 ILE B 155 -2.829 6.911 -0.977 1.00 0.00 H new ATOM 0 HD11 ILE B 155 -6.629 3.991 -0.229 1.00 0.00 H new ATOM 0 HD12 ILE B 155 -7.167 5.507 -0.992 1.00 0.00 H new ATOM 0 HD13 ILE B 155 -6.480 4.204 -1.990 1.00 0.00 H new ATOM 1856 N ALA B 156 -5.690 8.983 -3.673 1.00 0.00 N ATOM 1857 CA ALA B 156 -5.315 9.969 -4.681 1.00 0.00 C ATOM 1858 C ALA B 156 -5.019 11.324 -4.036 1.00 0.00 C ATOM 1859 O ALA B 156 -4.395 12.193 -4.644 1.00 0.00 O ATOM 1860 CB ALA B 156 -6.407 10.069 -5.736 1.00 0.00 C ATOM 0 H ALA B 156 -6.603 8.555 -3.825 1.00 0.00 H new ATOM 0 HA ALA B 156 -4.398 9.645 -5.173 1.00 0.00 H new ATOM 0 HB1 ALA B 156 -6.122 10.807 -6.486 1.00 0.00 H new ATOM 0 HB2 ALA B 156 -6.541 9.099 -6.214 1.00 0.00 H new ATOM 0 HB3 ALA B 156 -7.341 10.374 -5.265 1.00 0.00 H new ATOM 1866 N GLN B 157 -5.467 11.484 -2.796 1.00 0.00 N ATOM 1867 CA GLN B 157 -5.094 12.621 -1.974 1.00 0.00 C ATOM 1868 C GLN B 157 -4.636 12.140 -0.596 1.00 0.00 C ATOM 1869 O GLN B 157 -4.725 12.867 0.392 1.00 0.00 O ATOM 1870 CB GLN B 157 -6.268 13.584 -1.827 1.00 0.00 C ATOM 1871 CG GLN B 157 -6.704 14.221 -3.136 1.00 0.00 C ATOM 1872 CD GLN B 157 -7.804 15.246 -2.944 1.00 0.00 C ATOM 1873 OE1 GLN B 157 -8.990 14.929 -3.028 1.00 0.00 O ATOM 1874 NE2 GLN B 157 -7.417 16.476 -2.649 1.00 0.00 N ATOM 0 H GLN B 157 -6.098 10.828 -2.336 1.00 0.00 H new ATOM 0 HA GLN B 157 -4.273 13.148 -2.461 1.00 0.00 H new ATOM 0 HB2 GLN B 157 -7.113 13.049 -1.394 1.00 0.00 H new ATOM 0 HB3 GLN B 157 -5.995 14.371 -1.124 1.00 0.00 H new ATOM 0 HG2 GLN B 157 -5.845 14.698 -3.608 1.00 0.00 H new ATOM 0 HG3 GLN B 157 -7.051 13.444 -3.817 1.00 0.00 H new ATOM 0 HE21 GLN B 157 -6.423 16.697 -2.589 1.00 0.00 H new ATOM 0 HE22 GLN B 157 -8.112 17.203 -2.481 1.00 0.00 H new ATOM 1883 N GLY B 158 -4.132 10.912 -0.546 1.00 0.00 N ATOM 1884 CA GLY B 158 -3.817 10.281 0.721 1.00 0.00 C ATOM 1885 C GLY B 158 -2.833 9.120 0.607 1.00 0.00 C ATOM 1886 O GLY B 158 -3.079 8.054 1.162 1.00 0.00 O ATOM 0 H GLY B 158 -3.935 10.339 -1.367 1.00 0.00 H new ATOM 0 HA2 GLY B 158 -3.403 11.030 1.396 1.00 0.00 H new ATOM 0 HA3 GLY B 158 -4.740 9.919 1.175 1.00 0.00 H new ATOM 1890 N ILE B 159 -1.736 9.316 -0.134 1.00 0.00 N ATOM 1891 CA ILE B 159 -0.621 8.345 -0.184 1.00 0.00 C ATOM 1892 C ILE B 159 -0.006 8.167 1.223 1.00 0.00 C ATOM 1893 O ILE B 159 0.726 7.213 1.498 1.00 0.00 O ATOM 1894 CB ILE B 159 0.460 8.782 -1.213 1.00 0.00 C ATOM 1895 CG1 ILE B 159 0.036 8.477 -2.640 1.00 0.00 C ATOM 1896 CG2 ILE B 159 1.764 8.106 -0.958 1.00 0.00 C ATOM 1897 CD1 ILE B 159 -1.107 9.306 -3.091 1.00 0.00 C ATOM 0 H ILE B 159 -1.590 10.143 -0.713 1.00 0.00 H new ATOM 0 HA ILE B 159 -1.017 7.385 -0.514 1.00 0.00 H new ATOM 0 HB ILE B 159 0.575 9.859 -1.091 1.00 0.00 H new ATOM 0 HG12 ILE B 159 0.882 8.639 -3.308 1.00 0.00 H new ATOM 0 HG13 ILE B 159 -0.233 7.423 -2.717 1.00 0.00 H new ATOM 0 HG21 ILE B 159 2.495 8.436 -1.696 1.00 0.00 H new ATOM 0 HG22 ILE B 159 2.117 8.361 0.041 1.00 0.00 H new ATOM 0 HG23 ILE B 159 1.635 7.026 -1.032 1.00 0.00 H new ATOM 0 HD11 ILE B 159 -1.365 9.043 -4.117 1.00 0.00 H new ATOM 0 HD12 ILE B 159 -1.965 9.125 -2.444 1.00 0.00 H new ATOM 0 HD13 ILE B 159 -0.833 10.360 -3.044 1.00 0.00 H new ATOM 1909 N GLY B 160 -0.386 9.059 2.131 1.00 0.00 N ATOM 1910 CA GLY B 160 0.122 9.036 3.477 1.00 0.00 C ATOM 1911 C GLY B 160 -1.010 9.211 4.458 1.00 0.00 C ATOM 1912 O GLY B 160 -2.085 9.670 4.079 1.00 0.00 O ATOM 0 H GLY B 160 -1.051 9.810 1.946 1.00 0.00 H new ATOM 0 HA2 GLY B 160 0.635 8.093 3.665 1.00 0.00 H new ATOM 0 HA3 GLY B 160 0.856 9.830 3.611 1.00 0.00 H new