USER MOD reduce.3.24.130724 H: found=0, std=0, add=1036, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1035 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 79 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: B 133 HIS : no HD1:sc= 0.569 K(o=0.57,f=-2.8) USER MOD Set 2.1: A 57 CYS SG : rot 25:sc= -0.0937! USER MOD Set 2.2: A 68 CYS SG : rot -57:sc= 0.198 USER MOD Set 2.3: A 80 CYS SG : rot 137:sc= -0.148! USER MOD Set 3.1: A 46 LYS NZ :NH3+ -172:sc= 2.28 (180deg=2.33) USER MOD Set 3.2: B 117 ASN : amide:sc= 0.667 K(o=2.9,f=-10!) USER MOD Set 4.1: A 34 SER OG : rot -108:sc= 0.931 USER MOD Set 4.2: A 36 SER OG : rot -170:sc= 0.846 USER MOD Set 5.1: A 30 GLN : amide:sc= 0.884 K(o=0.41,f=-3.3) USER MOD Set 5.2: A 38 HIS : no HE2:sc= -0.47 K(o=0.41,f=-8.3!) USER MOD Single : A 5 SER OG : rot 36:sc= 0.234 USER MOD Single : A 8 CYS SG : rot 180:sc=-0.00599 USER MOD Single : A 9 MET CE :methyl 180:sc= -0.0186 (180deg=-0.0186) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 SER OG : rot 124:sc= 1.27 USER MOD Single : A 15 ASN : amide:sc= -0.0965 K(o=-0.097,f=-1.1!) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 160:sc= -0.246 USER MOD Single : A 24 MET CE :methyl 165:sc=-0.000492 (180deg=-0.165) USER MOD Single : A 25 SER OG : rot -41:sc= 1.32 USER MOD Single : A 29 CYS SG : rot -42:sc= -3.47! USER MOD Single : A 35 GLN : amide:sc= -0.703 K(o=-0.7,f=-0.13) USER MOD Single : A 40 HIS : no HD1:sc= 0.942 K(o=0.94,f=-5.4!) USER MOD Single : A 42 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= 0.145 K(o=0.14,f=-4.3!) USER MOD Single : A 50 LYS NZ :NH3+ 127:sc= 1.22 (180deg=0.478) USER MOD Single : A 51 ASN : amide:sc= 0.805 K(o=0.81,f=-1.5!) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= 0.308 K(o=0.31,f=-4.3!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -0.249 K(o=-0.25,f=-7.9!) USER MOD Single : A 70 THR OG1 : rot 92:sc= 1.31 USER MOD Single : A 71 THR OG1 : rot -160:sc= -0.0504 USER MOD Single : A 74 ASN : amide:sc= -0.379 K(o=-0.38,f=-3.9!) USER MOD Single : A 75 LYS NZ :NH3+ 152:sc= 1.23 (180deg=1.04) USER MOD Single : A 85 CYS SG : rot 65:sc= 0.147 USER MOD Single : B 102 SER OG : rot 180:sc= 0 USER MOD Single : B 105 LYS NZ :NH3+ 153:sc= 2.28 (180deg=1.87) USER MOD Single : B 107 THR OG1 : rot -77:sc= 1.39 USER MOD Single : B 113 GLN : amide:sc= -0.331 K(o=-0.33,f=-4.2!) USER MOD Single : B 116 LYS NZ :NH3+ -160:sc= 1.26 (180deg=1.07) USER MOD Single : B 129 LYS NZ :NH3+ -158:sc= 2.12 (180deg=0.944!) USER MOD Single : B 130 SER OG : rot 180:sc= 0.00481 USER MOD Single : B 135 HIS : no HD1:sc= -0.0247 X(o=-0.025,f=-0.016) USER MOD Single : B 137 LYS NZ :NH3+ -175:sc= 1.07 (180deg=1.05) USER MOD Single : B 138 LYS NZ :NH3+ -165:sc= -0.0249 (180deg=-0.204) USER MOD Single : B 143 LYS NZ :NH3+ -156:sc= 3.39 (180deg=1.7) USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 152 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 75 N SER A 5 -25.995 7.121 -5.322 1.00 15.00 N ATOM 76 CA SER A 5 -25.707 5.727 -5.047 1.00 15.00 C ATOM 77 C SER A 5 -25.663 5.495 -3.539 1.00 15.00 C ATOM 78 O SER A 5 -25.213 6.360 -2.784 1.00 15.00 O ATOM 79 CB SER A 5 -24.380 5.331 -5.697 1.00 15.00 C ATOM 80 OG SER A 5 -24.334 5.754 -7.054 1.00 15.00 O ATOM 0 HA SER A 5 -26.496 5.104 -5.469 1.00 15.00 H new ATOM 0 HB2 SER A 5 -23.553 5.776 -5.145 1.00 15.00 H new ATOM 0 HB3 SER A 5 -24.253 4.250 -5.644 1.00 15.00 H new ATOM 0 HG SER A 5 -24.796 6.614 -7.144 1.00 15.00 H new ATOM 86 N GLU A 6 -26.145 4.338 -3.106 1.00 15.00 N ATOM 87 CA GLU A 6 -26.171 4.002 -1.691 1.00 15.00 C ATOM 88 C GLU A 6 -25.733 2.560 -1.479 1.00 15.00 C ATOM 89 O GLU A 6 -26.324 1.635 -2.034 1.00 15.00 O ATOM 90 CB GLU A 6 -27.581 4.212 -1.135 1.00 15.00 C ATOM 91 CG GLU A 6 -27.688 4.016 0.369 1.00 15.00 C ATOM 92 CD GLU A 6 -26.830 4.989 1.148 1.00 15.00 C ATOM 93 OE1 GLU A 6 -25.829 4.550 1.754 1.00 15.00 O ATOM 94 OE2 GLU A 6 -27.151 6.196 1.165 1.00 15.00 O1- ATOM 0 H GLU A 6 -26.524 3.615 -3.717 1.00 15.00 H new ATOM 0 HA GLU A 6 -25.477 4.655 -1.161 1.00 15.00 H new ATOM 0 HB2 GLU A 6 -27.912 5.220 -1.384 1.00 15.00 H new ATOM 0 HB3 GLU A 6 -28.263 3.521 -1.631 1.00 15.00 H new ATOM 0 HG2 GLU A 6 -28.728 4.132 0.673 1.00 15.00 H new ATOM 0 HG3 GLU A 6 -27.394 2.997 0.620 1.00 15.00 H new ATOM 101 N GLU A 7 -24.695 2.374 -0.683 1.00 15.00 N ATOM 102 CA GLU A 7 -24.185 1.042 -0.406 1.00 15.00 C ATOM 103 C GLU A 7 -23.341 1.038 0.862 1.00 15.00 C ATOM 104 O GLU A 7 -22.842 2.080 1.290 1.00 15.00 O ATOM 105 CB GLU A 7 -23.364 0.521 -1.592 1.00 15.00 C ATOM 106 CG GLU A 7 -22.218 1.433 -2.007 1.00 15.00 C ATOM 107 CD GLU A 7 -21.579 1.001 -3.313 1.00 15.00 C ATOM 108 OE1 GLU A 7 -21.202 1.878 -4.116 1.00 15.00 O ATOM 109 OE2 GLU A 7 -21.455 -0.222 -3.548 1.00 15.00 O1- ATOM 0 H GLU A 7 -24.189 3.127 -0.217 1.00 15.00 H new ATOM 0 HA GLU A 7 -25.037 0.379 -0.254 1.00 15.00 H new ATOM 0 HB2 GLU A 7 -22.960 -0.459 -1.337 1.00 15.00 H new ATOM 0 HB3 GLU A 7 -24.028 0.380 -2.445 1.00 15.00 H new ATOM 0 HG2 GLU A 7 -22.587 2.454 -2.107 1.00 15.00 H new ATOM 0 HG3 GLU A 7 -21.462 1.443 -1.222 1.00 15.00 H new ATOM 116 N CYS A 8 -23.201 -0.131 1.464 1.00 15.00 N ATOM 117 CA CYS A 8 -22.418 -0.276 2.678 1.00 15.00 C ATOM 118 C CYS A 8 -21.525 -1.505 2.572 1.00 15.00 C ATOM 119 O CYS A 8 -21.831 -2.437 1.826 1.00 15.00 O ATOM 120 CB CYS A 8 -23.344 -0.393 3.890 1.00 15.00 C ATOM 121 SG CYS A 8 -24.368 1.067 4.185 1.00 15.00 S ATOM 0 H CYS A 8 -23.622 -0.997 1.129 1.00 15.00 H new ATOM 0 HA CYS A 8 -21.790 0.606 2.806 1.00 15.00 H new ATOM 0 HB2 CYS A 8 -23.994 -1.257 3.754 1.00 15.00 H new ATOM 0 HB3 CYS A 8 -22.740 -0.585 4.777 1.00 15.00 H new ATOM 0 HG CYS A 8 -25.116 0.868 5.229 1.00 15.00 H new ATOM 127 N MET A 9 -20.418 -1.503 3.299 1.00 15.00 N ATOM 128 CA MET A 9 -19.489 -2.626 3.270 1.00 15.00 C ATOM 129 C MET A 9 -19.438 -3.317 4.624 1.00 15.00 C ATOM 130 O MET A 9 -19.858 -2.749 5.637 1.00 15.00 O ATOM 131 CB MET A 9 -18.092 -2.157 2.864 1.00 15.00 C ATOM 132 CG MET A 9 -18.068 -1.365 1.565 1.00 15.00 C ATOM 133 SD MET A 9 -18.789 -2.266 0.179 1.00 15.00 S ATOM 134 CE MET A 9 -19.019 -0.943 -1.007 1.00 15.00 C ATOM 0 H MET A 9 -20.140 -0.739 3.915 1.00 15.00 H new ATOM 0 HA MET A 9 -19.845 -3.342 2.529 1.00 15.00 H new ATOM 0 HB2 MET A 9 -17.678 -1.541 3.663 1.00 15.00 H new ATOM 0 HB3 MET A 9 -17.442 -3.026 2.762 1.00 15.00 H new ATOM 0 HG2 MET A 9 -18.611 -0.430 1.705 1.00 15.00 H new ATOM 0 HG3 MET A 9 -17.038 -1.103 1.325 1.00 15.00 H new ATOM 0 HE1 MET A 9 -19.459 -1.345 -1.920 1.00 15.00 H new ATOM 0 HE2 MET A 9 -19.684 -0.188 -0.586 1.00 15.00 H new ATOM 0 HE3 MET A 9 -18.055 -0.489 -1.238 1.00 15.00 H new ATOM 144 N HIS A 10 -18.914 -4.534 4.638 1.00 15.00 N ATOM 145 CA HIS A 10 -18.826 -5.315 5.863 1.00 15.00 C ATOM 146 C HIS A 10 -17.568 -4.975 6.656 1.00 15.00 C ATOM 147 O HIS A 10 -16.488 -5.501 6.383 1.00 15.00 O ATOM 148 CB HIS A 10 -18.859 -6.813 5.527 1.00 15.00 C ATOM 149 CG HIS A 10 -19.009 -7.705 6.722 1.00 15.00 C ATOM 150 ND1 HIS A 10 -20.249 -8.016 7.229 1.00 15.00 N ATOM 151 CD2 HIS A 10 -18.059 -8.334 7.455 1.00 15.00 C ATOM 152 CE1 HIS A 10 -20.028 -8.817 8.258 1.00 15.00 C ATOM 153 NE2 HIS A 10 -18.717 -9.034 8.432 1.00 15.00 N ATOM 0 H HIS A 10 -18.542 -5.003 3.812 1.00 15.00 H new ATOM 0 HA HIS A 10 -19.684 -5.065 6.487 1.00 15.00 H new ATOM 0 HB2 HIS A 10 -19.684 -7.002 4.840 1.00 15.00 H new ATOM 0 HB3 HIS A 10 -17.941 -7.077 5.003 1.00 15.00 H new ATOM 0 HD2 HIS A 10 -16.991 -8.292 7.300 1.00 15.00 H new ATOM 0 HE1 HIS A 10 -20.804 -9.241 8.878 1.00 15.00 H new ATOM 0 HE2 HIS A 10 -18.289 -9.612 9.156 1.00 15.00 H new ATOM 161 N GLY A 11 -17.734 -4.094 7.640 1.00 15.00 N ATOM 162 CA GLY A 11 -16.637 -3.680 8.504 1.00 15.00 C ATOM 163 C GLY A 11 -15.382 -3.257 7.761 1.00 15.00 C ATOM 164 O GLY A 11 -15.346 -2.198 7.126 1.00 15.00 O ATOM 0 H GLY A 11 -18.627 -3.651 7.858 1.00 15.00 H new ATOM 0 HA2 GLY A 11 -16.973 -2.851 9.127 1.00 15.00 H new ATOM 0 HA3 GLY A 11 -16.388 -4.502 9.175 1.00 15.00 H new ATOM 168 N SER A 12 -14.352 -4.091 7.844 1.00 15.00 N ATOM 169 CA SER A 12 -13.076 -3.820 7.205 1.00 15.00 C ATOM 170 C SER A 12 -13.172 -3.980 5.689 1.00 15.00 C ATOM 171 O SER A 12 -12.694 -3.130 4.936 1.00 15.00 O ATOM 172 CB SER A 12 -12.012 -4.767 7.770 1.00 15.00 C ATOM 173 OG SER A 12 -10.839 -4.762 6.976 1.00 15.00 O ATOM 0 H SER A 12 -14.381 -4.973 8.356 1.00 15.00 H new ATOM 0 HA SER A 12 -12.796 -2.788 7.414 1.00 15.00 H new ATOM 0 HB2 SER A 12 -11.764 -4.471 8.789 1.00 15.00 H new ATOM 0 HB3 SER A 12 -12.414 -5.779 7.821 1.00 15.00 H new ATOM 0 HG SER A 12 -10.068 -4.528 7.533 1.00 15.00 H new ATOM 179 N GLY A 13 -13.810 -5.055 5.249 1.00 15.00 N ATOM 180 CA GLY A 13 -13.931 -5.303 3.826 1.00 15.00 C ATOM 181 C GLY A 13 -12.720 -6.032 3.278 1.00 15.00 C ATOM 182 O GLY A 13 -12.131 -5.614 2.282 1.00 15.00 O ATOM 0 H GLY A 13 -14.244 -5.757 5.848 1.00 15.00 H new ATOM 0 HA2 GLY A 13 -14.828 -5.892 3.634 1.00 15.00 H new ATOM 0 HA3 GLY A 13 -14.054 -4.356 3.301 1.00 15.00 H new ATOM 186 N GLU A 14 -12.348 -7.120 3.939 1.00 15.00 N ATOM 187 CA GLU A 14 -11.205 -7.925 3.522 1.00 15.00 C ATOM 188 C GLU A 14 -11.489 -8.577 2.175 1.00 15.00 C ATOM 189 O GLU A 14 -10.612 -8.689 1.321 1.00 15.00 O ATOM 190 CB GLU A 14 -10.916 -9.000 4.576 1.00 15.00 C ATOM 191 CG GLU A 14 -10.016 -10.126 4.084 1.00 15.00 C ATOM 192 CD GLU A 14 -10.098 -11.374 4.943 1.00 15.00 C ATOM 193 OE1 GLU A 14 -9.197 -12.232 4.834 1.00 15.00 O ATOM 194 OE2 GLU A 14 -11.067 -11.507 5.726 1.00 15.00 O1- ATOM 0 H GLU A 14 -12.824 -7.468 4.771 1.00 15.00 H new ATOM 0 HA GLU A 14 -10.332 -7.280 3.423 1.00 15.00 H new ATOM 0 HB2 GLU A 14 -10.451 -8.529 5.442 1.00 15.00 H new ATOM 0 HB3 GLU A 14 -11.861 -9.426 4.914 1.00 15.00 H new ATOM 0 HG2 GLU A 14 -10.289 -10.379 3.059 1.00 15.00 H new ATOM 0 HG3 GLU A 14 -8.984 -9.775 4.062 1.00 15.00 H new ATOM 201 N ASN A 15 -12.736 -8.975 1.991 1.00 15.00 N ATOM 202 CA ASN A 15 -13.165 -9.629 0.766 1.00 15.00 C ATOM 203 C ASN A 15 -13.780 -8.631 -0.206 1.00 15.00 C ATOM 204 O ASN A 15 -14.646 -8.988 -1.007 1.00 15.00 O ATOM 205 CB ASN A 15 -14.172 -10.732 1.083 1.00 15.00 C ATOM 206 CG ASN A 15 -13.504 -12.046 1.429 1.00 15.00 C ATOM 207 OD1 ASN A 15 -12.463 -12.391 0.875 1.00 15.00 O ATOM 208 ND2 ASN A 15 -14.094 -12.784 2.353 1.00 15.00 N ATOM 0 H ASN A 15 -13.476 -8.855 2.682 1.00 15.00 H new ATOM 0 HA ASN A 15 -12.286 -10.067 0.294 1.00 15.00 H new ATOM 0 HB2 ASN A 15 -14.800 -10.417 1.916 1.00 15.00 H new ATOM 0 HB3 ASN A 15 -14.829 -10.877 0.225 1.00 15.00 H new ATOM 0 HD21 ASN A 15 -13.686 -13.677 2.630 1.00 15.00 H new ATOM 0 HD22 ASN A 15 -14.958 -12.461 2.789 1.00 15.00 H new ATOM 215 N TYR A 16 -13.352 -7.378 -0.126 1.00 15.00 N ATOM 216 CA TYR A 16 -13.867 -6.342 -1.009 1.00 15.00 C ATOM 217 C TYR A 16 -13.361 -6.563 -2.432 1.00 15.00 C ATOM 218 O TYR A 16 -12.186 -6.349 -2.727 1.00 15.00 O ATOM 219 CB TYR A 16 -13.447 -4.958 -0.502 1.00 15.00 C ATOM 220 CG TYR A 16 -13.980 -3.805 -1.329 1.00 15.00 C ATOM 221 CD1 TYR A 16 -15.326 -3.455 -1.283 1.00 15.00 C ATOM 222 CD2 TYR A 16 -13.139 -3.061 -2.147 1.00 15.00 C ATOM 223 CE1 TYR A 16 -15.815 -2.398 -2.031 1.00 15.00 C ATOM 224 CE2 TYR A 16 -13.621 -2.005 -2.897 1.00 15.00 C ATOM 225 CZ TYR A 16 -14.957 -1.676 -2.836 1.00 15.00 C ATOM 226 OH TYR A 16 -15.438 -0.623 -3.585 1.00 15.00 O ATOM 0 H TYR A 16 -12.651 -7.056 0.541 1.00 15.00 H new ATOM 0 HA TYR A 16 -14.956 -6.395 -1.015 1.00 15.00 H new ATOM 0 HB2 TYR A 16 -13.789 -4.841 0.526 1.00 15.00 H new ATOM 0 HB3 TYR A 16 -12.358 -4.905 -0.484 1.00 15.00 H new ATOM 0 HD1 TYR A 16 -16.000 -4.017 -0.654 1.00 15.00 H new ATOM 0 HD2 TYR A 16 -12.090 -3.312 -2.198 1.00 15.00 H new ATOM 0 HE1 TYR A 16 -16.863 -2.139 -1.985 1.00 15.00 H new ATOM 0 HE2 TYR A 16 -12.952 -1.440 -3.529 1.00 15.00 H new ATOM 0 HH TYR A 16 -14.703 -0.221 -4.094 1.00 15.00 H new ATOM 236 N ASP A 17 -14.260 -6.989 -3.311 1.00 15.00 N ATOM 237 CA ASP A 17 -13.922 -7.238 -4.708 1.00 15.00 C ATOM 238 C ASP A 17 -14.532 -6.145 -5.576 1.00 15.00 C ATOM 239 O ASP A 17 -14.928 -6.377 -6.720 1.00 15.00 O ATOM 240 CB ASP A 17 -14.441 -8.613 -5.148 1.00 15.00 C ATOM 241 CG ASP A 17 -13.567 -9.264 -6.208 1.00 15.00 C ATOM 242 OD1 ASP A 17 -12.810 -10.196 -5.863 1.00 15.00 O ATOM 243 OD2 ASP A 17 -13.644 -8.866 -7.389 1.00 15.00 O1- ATOM 0 H ASP A 17 -15.236 -7.171 -3.079 1.00 15.00 H new ATOM 0 HA ASP A 17 -12.838 -7.229 -4.821 1.00 15.00 H new ATOM 0 HB2 ASP A 17 -14.499 -9.269 -4.279 1.00 15.00 H new ATOM 0 HB3 ASP A 17 -15.454 -8.506 -5.535 1.00 15.00 H new ATOM 248 N GLY A 18 -14.625 -4.953 -5.008 1.00 15.00 N ATOM 249 CA GLY A 18 -15.190 -3.833 -5.726 1.00 15.00 C ATOM 250 C GLY A 18 -14.206 -3.217 -6.699 1.00 15.00 C ATOM 251 O GLY A 18 -12.993 -3.410 -6.582 1.00 15.00 O ATOM 0 H GLY A 18 -14.318 -4.742 -4.059 1.00 15.00 H new ATOM 0 HA2 GLY A 18 -16.076 -4.162 -6.269 1.00 15.00 H new ATOM 0 HA3 GLY A 18 -15.516 -3.075 -5.014 1.00 15.00 H new ATOM 255 N LYS A 19 -14.730 -2.471 -7.654 1.00 15.00 N ATOM 256 CA LYS A 19 -13.906 -1.821 -8.658 1.00 15.00 C ATOM 257 C LYS A 19 -13.546 -0.407 -8.218 1.00 15.00 C ATOM 258 O LYS A 19 -14.409 0.471 -8.140 1.00 15.00 O ATOM 259 CB LYS A 19 -14.638 -1.791 -9.999 1.00 15.00 C ATOM 260 CG LYS A 19 -14.939 -3.172 -10.554 1.00 15.00 C ATOM 261 CD LYS A 19 -16.160 -3.158 -11.459 1.00 15.00 C ATOM 262 CE LYS A 19 -15.911 -2.372 -12.735 1.00 15.00 C ATOM 263 NZ LYS A 19 -17.141 -2.255 -13.561 1.00 15.00 N1+ ATOM 0 H LYS A 19 -15.730 -2.299 -7.756 1.00 15.00 H new ATOM 0 HA LYS A 19 -12.984 -2.390 -8.775 1.00 15.00 H new ATOM 0 HB2 LYS A 19 -15.573 -1.243 -9.882 1.00 15.00 H new ATOM 0 HB3 LYS A 19 -14.035 -1.241 -10.721 1.00 15.00 H new ATOM 0 HG2 LYS A 19 -14.076 -3.536 -11.112 1.00 15.00 H new ATOM 0 HG3 LYS A 19 -15.103 -3.867 -9.731 1.00 15.00 H new ATOM 0 HD2 LYS A 19 -16.436 -4.182 -11.711 1.00 15.00 H new ATOM 0 HD3 LYS A 19 -17.004 -2.723 -10.923 1.00 15.00 H new ATOM 0 HE2 LYS A 19 -15.547 -1.376 -12.483 1.00 15.00 H new ATOM 0 HE3 LYS A 19 -15.128 -2.860 -13.316 1.00 15.00 H new ATOM 0 HZ1 LYS A 19 -16.930 -1.712 -14.423 1.00 15.00 H new ATOM 0 HZ2 LYS A 19 -17.475 -3.204 -13.823 1.00 15.00 H new ATOM 0 HZ3 LYS A 19 -17.880 -1.766 -13.016 1.00 15.00 H new ATOM 277 N ILE A 20 -12.274 -0.199 -7.913 1.00 15.00 N ATOM 278 CA ILE A 20 -11.785 1.097 -7.480 1.00 15.00 C ATOM 279 C ILE A 20 -10.265 1.155 -7.631 1.00 15.00 C ATOM 280 O ILE A 20 -9.555 0.220 -7.244 1.00 15.00 O ATOM 281 CB ILE A 20 -12.198 1.395 -6.016 1.00 15.00 C ATOM 282 CG1 ILE A 20 -11.634 2.741 -5.555 1.00 15.00 C ATOM 283 CG2 ILE A 20 -11.744 0.275 -5.092 1.00 15.00 C ATOM 284 CD1 ILE A 20 -12.169 3.195 -4.213 1.00 15.00 C ATOM 0 H ILE A 20 -11.556 -0.922 -7.959 1.00 15.00 H new ATOM 0 HA ILE A 20 -12.236 1.862 -8.112 1.00 15.00 H new ATOM 0 HB ILE A 20 -13.286 1.452 -5.974 1.00 15.00 H new ATOM 0 HG12 ILE A 20 -10.548 2.670 -5.499 1.00 15.00 H new ATOM 0 HG13 ILE A 20 -11.866 3.498 -6.304 1.00 15.00 H new ATOM 0 HG21 ILE A 20 -12.043 0.503 -4.069 1.00 15.00 H new ATOM 0 HG22 ILE A 20 -12.204 -0.663 -5.404 1.00 15.00 H new ATOM 0 HG23 ILE A 20 -10.659 0.181 -5.140 1.00 15.00 H new ATOM 0 HD11 ILE A 20 -11.726 4.156 -3.951 1.00 15.00 H new ATOM 0 HD12 ILE A 20 -13.253 3.299 -4.269 1.00 15.00 H new ATOM 0 HD13 ILE A 20 -11.914 2.458 -3.452 1.00 15.00 H new ATOM 296 N SER A 21 -9.776 2.236 -8.216 1.00 15.00 N ATOM 297 CA SER A 21 -8.349 2.407 -8.431 1.00 15.00 C ATOM 298 C SER A 21 -7.884 3.782 -7.952 1.00 15.00 C ATOM 299 O SER A 21 -6.850 4.290 -8.389 1.00 15.00 O ATOM 300 CB SER A 21 -8.029 2.219 -9.915 1.00 15.00 C ATOM 301 OG SER A 21 -9.119 2.627 -10.729 1.00 15.00 O ATOM 0 H SER A 21 -10.349 3.011 -8.551 1.00 15.00 H new ATOM 0 HA SER A 21 -7.814 1.655 -7.851 1.00 15.00 H new ATOM 0 HB2 SER A 21 -7.141 2.796 -10.175 1.00 15.00 H new ATOM 0 HB3 SER A 21 -7.797 1.172 -10.110 1.00 15.00 H new ATOM 0 HG SER A 21 -8.889 2.498 -11.673 1.00 15.00 H new ATOM 307 N LYS A 22 -8.648 4.374 -7.046 1.00 15.00 N ATOM 308 CA LYS A 22 -8.316 5.685 -6.503 1.00 15.00 C ATOM 309 C LYS A 22 -8.419 5.670 -4.985 1.00 15.00 C ATOM 310 O LYS A 22 -9.392 5.159 -4.427 1.00 15.00 O ATOM 311 CB LYS A 22 -9.235 6.766 -7.079 1.00 15.00 C ATOM 312 CG LYS A 22 -8.859 7.213 -8.486 1.00 15.00 C ATOM 313 CD LYS A 22 -9.723 8.377 -8.948 1.00 15.00 C ATOM 314 CE LYS A 22 -11.152 7.942 -9.223 1.00 15.00 C ATOM 315 NZ LYS A 22 -12.021 9.085 -9.604 1.00 15.00 N1+ ATOM 0 H LYS A 22 -9.504 3.967 -6.670 1.00 15.00 H new ATOM 0 HA LYS A 22 -7.290 5.918 -6.788 1.00 15.00 H new ATOM 0 HB2 LYS A 22 -10.258 6.391 -7.089 1.00 15.00 H new ATOM 0 HB3 LYS A 22 -9.220 7.632 -6.417 1.00 15.00 H new ATOM 0 HG2 LYS A 22 -7.809 7.506 -8.508 1.00 15.00 H new ATOM 0 HG3 LYS A 22 -8.971 6.378 -9.177 1.00 15.00 H new ATOM 0 HD2 LYS A 22 -9.720 9.157 -8.186 1.00 15.00 H new ATOM 0 HD3 LYS A 22 -9.295 8.812 -9.851 1.00 15.00 H new ATOM 0 HE2 LYS A 22 -11.157 7.201 -10.022 1.00 15.00 H new ATOM 0 HE3 LYS A 22 -11.560 7.457 -8.336 1.00 15.00 H new ATOM 0 HZ1 LYS A 22 -12.987 8.743 -9.782 1.00 15.00 H new ATOM 0 HZ2 LYS A 22 -12.038 9.781 -8.831 1.00 15.00 H new ATOM 0 HZ3 LYS A 22 -11.648 9.533 -10.465 1.00 15.00 H new ATOM 329 N THR A 23 -7.426 6.248 -4.323 1.00 15.00 N ATOM 330 CA THR A 23 -7.396 6.300 -2.867 1.00 15.00 C ATOM 331 C THR A 23 -8.349 7.370 -2.334 1.00 15.00 C ATOM 332 O THR A 23 -9.072 8.006 -3.103 1.00 15.00 O ATOM 333 CB THR A 23 -5.969 6.592 -2.370 1.00 15.00 C ATOM 334 OG1 THR A 23 -5.429 7.715 -3.085 1.00 15.00 O ATOM 335 CG2 THR A 23 -5.075 5.378 -2.576 1.00 15.00 C ATOM 0 H THR A 23 -6.625 6.690 -4.774 1.00 15.00 H new ATOM 0 HA THR A 23 -7.718 5.328 -2.494 1.00 15.00 H new ATOM 0 HB THR A 23 -6.009 6.821 -1.305 1.00 15.00 H new ATOM 0 HG1 THR A 23 -4.685 8.100 -2.576 1.00 15.00 H new ATOM 0 HG21 THR A 23 -4.070 5.602 -2.219 1.00 15.00 H new ATOM 0 HG22 THR A 23 -5.477 4.531 -2.020 1.00 15.00 H new ATOM 0 HG23 THR A 23 -5.037 5.130 -3.637 1.00 15.00 H new ATOM 343 N MET A 24 -8.337 7.577 -1.018 1.00 15.00 N ATOM 344 CA MET A 24 -9.204 8.574 -0.384 1.00 15.00 C ATOM 345 C MET A 24 -8.887 9.983 -0.885 1.00 15.00 C ATOM 346 O MET A 24 -9.765 10.845 -0.936 1.00 15.00 O ATOM 347 CB MET A 24 -9.081 8.514 1.150 1.00 15.00 C ATOM 348 CG MET A 24 -7.690 8.836 1.691 1.00 15.00 C ATOM 349 SD MET A 24 -7.454 10.587 2.055 1.00 15.00 S ATOM 350 CE MET A 24 -8.421 10.754 3.554 1.00 15.00 C ATOM 0 H MET A 24 -7.737 7.068 -0.368 1.00 15.00 H new ATOM 0 HA MET A 24 -10.232 8.337 -0.660 1.00 15.00 H new ATOM 0 HB2 MET A 24 -9.796 9.212 1.586 1.00 15.00 H new ATOM 0 HB3 MET A 24 -9.364 7.516 1.485 1.00 15.00 H new ATOM 0 HG2 MET A 24 -7.518 8.257 2.598 1.00 15.00 H new ATOM 0 HG3 MET A 24 -6.943 8.519 0.964 1.00 15.00 H new ATOM 0 HE1 MET A 24 -8.167 11.692 4.048 1.00 15.00 H new ATOM 0 HE2 MET A 24 -9.482 10.750 3.305 1.00 15.00 H new ATOM 0 HE3 MET A 24 -8.203 9.921 4.223 1.00 15.00 H new ATOM 360 N SER A 25 -7.636 10.208 -1.267 1.00 15.00 N ATOM 361 CA SER A 25 -7.209 11.512 -1.758 1.00 15.00 C ATOM 362 C SER A 25 -7.422 11.626 -3.267 1.00 15.00 C ATOM 363 O SER A 25 -7.083 12.638 -3.876 1.00 15.00 O ATOM 364 CB SER A 25 -5.740 11.737 -1.406 1.00 15.00 C ATOM 365 OG SER A 25 -5.382 11.009 -0.240 1.00 15.00 O ATOM 0 H SER A 25 -6.899 9.503 -1.246 1.00 15.00 H new ATOM 0 HA SER A 25 -7.814 12.281 -1.278 1.00 15.00 H new ATOM 0 HB2 SER A 25 -5.110 11.428 -2.240 1.00 15.00 H new ATOM 0 HB3 SER A 25 -5.559 12.800 -1.246 1.00 15.00 H new ATOM 0 HG SER A 25 -6.105 11.070 0.418 1.00 15.00 H new ATOM 371 N GLY A 26 -7.977 10.578 -3.865 1.00 15.00 N ATOM 372 CA GLY A 26 -8.235 10.587 -5.291 1.00 15.00 C ATOM 373 C GLY A 26 -6.991 10.332 -6.117 1.00 15.00 C ATOM 374 O GLY A 26 -6.983 10.573 -7.322 1.00 15.00 O ATOM 0 H GLY A 26 -8.253 9.721 -3.386 1.00 15.00 H new ATOM 0 HA2 GLY A 26 -8.982 9.828 -5.525 1.00 15.00 H new ATOM 0 HA3 GLY A 26 -8.660 11.550 -5.572 1.00 15.00 H new ATOM 378 N LEU A 27 -5.942 9.839 -5.475 1.00 15.00 N ATOM 379 CA LEU A 27 -4.693 9.558 -6.165 1.00 15.00 C ATOM 380 C LEU A 27 -4.807 8.250 -6.938 1.00 15.00 C ATOM 381 O LEU A 27 -5.544 7.345 -6.534 1.00 15.00 O ATOM 382 CB LEU A 27 -3.536 9.493 -5.165 1.00 15.00 C ATOM 383 CG LEU A 27 -3.304 10.770 -4.356 1.00 15.00 C ATOM 384 CD1 LEU A 27 -2.397 10.490 -3.168 1.00 15.00 C ATOM 385 CD2 LEU A 27 -2.711 11.860 -5.234 1.00 15.00 C ATOM 0 H LEU A 27 -5.931 9.626 -4.478 1.00 15.00 H new ATOM 0 HA LEU A 27 -4.491 10.363 -6.871 1.00 15.00 H new ATOM 0 HB2 LEU A 27 -3.721 8.672 -4.473 1.00 15.00 H new ATOM 0 HB3 LEU A 27 -2.621 9.254 -5.707 1.00 15.00 H new ATOM 0 HG LEU A 27 -4.266 11.118 -3.981 1.00 15.00 H new ATOM 0 HD11 LEU A 27 -2.243 11.410 -2.603 1.00 15.00 H new ATOM 0 HD12 LEU A 27 -2.861 9.743 -2.524 1.00 15.00 H new ATOM 0 HD13 LEU A 27 -1.437 10.117 -3.524 1.00 15.00 H new ATOM 0 HD21 LEU A 27 -2.553 12.760 -4.640 1.00 15.00 H new ATOM 0 HD22 LEU A 27 -1.758 11.522 -5.640 1.00 15.00 H new ATOM 0 HD23 LEU A 27 -3.396 12.081 -6.053 1.00 15.00 H new ATOM 397 N GLU A 28 -4.080 8.158 -8.043 1.00 15.00 N ATOM 398 CA GLU A 28 -4.111 6.977 -8.892 1.00 15.00 C ATOM 399 C GLU A 28 -3.339 5.818 -8.265 1.00 15.00 C ATOM 400 O GLU A 28 -2.199 5.977 -7.819 1.00 15.00 O ATOM 401 CB GLU A 28 -3.532 7.304 -10.269 1.00 15.00 C ATOM 402 CG GLU A 28 -4.159 8.525 -10.924 1.00 15.00 C ATOM 403 CD GLU A 28 -3.696 8.719 -12.352 1.00 15.00 C ATOM 404 OE1 GLU A 28 -4.556 8.838 -13.249 1.00 15.00 O ATOM 405 OE2 GLU A 28 -2.465 8.754 -12.587 1.00 15.00 O1- ATOM 0 H GLU A 28 -3.457 8.895 -8.374 1.00 15.00 H new ATOM 0 HA GLU A 28 -5.151 6.670 -9.000 1.00 15.00 H new ATOM 0 HB2 GLU A 28 -2.458 7.466 -10.172 1.00 15.00 H new ATOM 0 HB3 GLU A 28 -3.667 6.443 -10.923 1.00 15.00 H new ATOM 0 HG2 GLU A 28 -5.244 8.425 -10.908 1.00 15.00 H new ATOM 0 HG3 GLU A 28 -3.912 9.413 -10.342 1.00 15.00 H new ATOM 412 N CYS A 29 -3.974 4.657 -8.232 1.00 15.00 N ATOM 413 CA CYS A 29 -3.363 3.464 -7.676 1.00 15.00 C ATOM 414 C CYS A 29 -2.462 2.782 -8.701 1.00 15.00 C ATOM 415 O CYS A 29 -2.785 2.716 -9.892 1.00 15.00 O ATOM 416 CB CYS A 29 -4.441 2.484 -7.204 1.00 15.00 C ATOM 417 SG CYS A 29 -3.810 0.855 -6.736 1.00 15.00 S ATOM 0 H CYS A 29 -4.920 4.517 -8.587 1.00 15.00 H new ATOM 0 HA CYS A 29 -2.754 3.766 -6.824 1.00 15.00 H new ATOM 0 HB2 CYS A 29 -4.962 2.918 -6.351 1.00 15.00 H new ATOM 0 HB3 CYS A 29 -5.177 2.361 -7.998 1.00 15.00 H new ATOM 0 HG CYS A 29 -2.915 0.472 -7.598 1.00 15.00 H new ATOM 423 N GLN A 30 -1.328 2.290 -8.229 1.00 15.00 N ATOM 424 CA GLN A 30 -0.381 1.586 -9.075 1.00 15.00 C ATOM 425 C GLN A 30 -0.779 0.117 -9.162 1.00 15.00 C ATOM 426 O GLN A 30 -1.300 -0.441 -8.198 1.00 15.00 O ATOM 427 CB GLN A 30 1.036 1.712 -8.500 1.00 15.00 C ATOM 428 CG GLN A 30 2.073 0.858 -9.215 1.00 15.00 C ATOM 429 CD GLN A 30 3.358 0.704 -8.422 1.00 15.00 C ATOM 430 OE1 GLN A 30 3.765 1.603 -7.688 1.00 15.00 O ATOM 431 NE2 GLN A 30 3.996 -0.448 -8.551 1.00 15.00 N ATOM 0 H GLN A 30 -1.040 2.367 -7.254 1.00 15.00 H new ATOM 0 HA GLN A 30 -0.392 2.025 -10.072 1.00 15.00 H new ATOM 0 HB2 GLN A 30 1.345 2.756 -8.548 1.00 15.00 H new ATOM 0 HB3 GLN A 30 1.015 1.434 -7.446 1.00 15.00 H new ATOM 0 HG2 GLN A 30 1.652 -0.128 -9.411 1.00 15.00 H new ATOM 0 HG3 GLN A 30 2.300 1.305 -10.183 1.00 15.00 H new ATOM 0 HE21 GLN A 30 3.626 -1.169 -9.170 1.00 15.00 H new ATOM 0 HE22 GLN A 30 4.858 -0.615 -8.031 1.00 15.00 H new ATOM 440 N ALA A 31 -0.560 -0.499 -10.313 1.00 15.00 N ATOM 441 CA ALA A 31 -0.891 -1.903 -10.483 1.00 15.00 C ATOM 442 C ALA A 31 0.053 -2.767 -9.657 1.00 15.00 C ATOM 443 O ALA A 31 1.261 -2.517 -9.620 1.00 15.00 O ATOM 444 CB ALA A 31 -0.839 -2.292 -11.952 1.00 15.00 C ATOM 0 H ALA A 31 -0.158 -0.052 -11.137 1.00 15.00 H new ATOM 0 HA ALA A 31 -1.909 -2.069 -10.129 1.00 15.00 H new ATOM 0 HB1 ALA A 31 -1.090 -3.347 -12.058 1.00 15.00 H new ATOM 0 HB2 ALA A 31 -1.554 -1.691 -12.513 1.00 15.00 H new ATOM 0 HB3 ALA A 31 0.165 -2.117 -12.339 1.00 15.00 H new ATOM 450 N TRP A 32 -0.501 -3.780 -9.001 1.00 15.00 N ATOM 451 CA TRP A 32 0.285 -4.684 -8.165 1.00 15.00 C ATOM 452 C TRP A 32 1.305 -5.448 -9.008 1.00 15.00 C ATOM 453 O TRP A 32 2.315 -5.929 -8.499 1.00 15.00 O ATOM 454 CB TRP A 32 -0.632 -5.673 -7.432 1.00 15.00 C ATOM 455 CG TRP A 32 -1.697 -5.016 -6.600 1.00 15.00 C ATOM 456 CD1 TRP A 32 -3.005 -4.821 -6.944 1.00 15.00 C ATOM 457 CD2 TRP A 32 -1.546 -4.475 -5.284 1.00 15.00 C ATOM 458 NE1 TRP A 32 -3.673 -4.184 -5.926 1.00 15.00 N ATOM 459 CE2 TRP A 32 -2.800 -3.964 -4.895 1.00 15.00 C ATOM 460 CE3 TRP A 32 -0.472 -4.372 -4.393 1.00 15.00 C ATOM 461 CZ2 TRP A 32 -3.008 -3.360 -3.656 1.00 15.00 C ATOM 462 CZ3 TRP A 32 -0.680 -3.770 -3.163 1.00 15.00 C ATOM 463 CH2 TRP A 32 -1.938 -3.272 -2.807 1.00 15.00 C ATOM 0 H TRP A 32 -1.497 -3.998 -9.032 1.00 15.00 H new ATOM 0 HA TRP A 32 0.819 -4.085 -7.428 1.00 15.00 H new ATOM 0 HB2 TRP A 32 -1.108 -6.324 -8.166 1.00 15.00 H new ATOM 0 HB3 TRP A 32 -0.024 -6.309 -6.789 1.00 15.00 H new ATOM 0 HD1 TRP A 32 -3.450 -5.124 -7.881 1.00 15.00 H new ATOM 0 HE1 TRP A 32 -4.658 -3.919 -5.937 1.00 15.00 H new ATOM 0 HE3 TRP A 32 0.502 -4.755 -4.660 1.00 15.00 H new ATOM 0 HZ2 TRP A 32 -3.978 -2.976 -3.376 1.00 15.00 H new ATOM 0 HZ3 TRP A 32 0.142 -3.684 -2.468 1.00 15.00 H new ATOM 0 HH2 TRP A 32 -2.068 -2.808 -1.841 1.00 15.00 H new ATOM 474 N ASP A 33 1.027 -5.559 -10.300 1.00 15.00 N ATOM 475 CA ASP A 33 1.914 -6.260 -11.216 1.00 15.00 C ATOM 476 C ASP A 33 2.753 -5.282 -12.042 1.00 15.00 C ATOM 477 O ASP A 33 3.480 -5.687 -12.953 1.00 15.00 O ATOM 478 CB ASP A 33 1.099 -7.167 -12.141 1.00 15.00 C ATOM 479 CG ASP A 33 0.211 -6.390 -13.090 1.00 15.00 C ATOM 480 OD1 ASP A 33 0.600 -6.209 -14.263 1.00 15.00 O ATOM 481 OD2 ASP A 33 -0.884 -5.965 -12.672 1.00 15.00 O1- ATOM 0 H ASP A 33 0.191 -5.171 -10.738 1.00 15.00 H new ATOM 0 HA ASP A 33 2.598 -6.868 -10.624 1.00 15.00 H new ATOM 0 HB2 ASP A 33 1.778 -7.795 -12.718 1.00 15.00 H new ATOM 0 HB3 ASP A 33 0.483 -7.834 -11.538 1.00 15.00 H new ATOM 486 N SER A 34 2.666 -3.999 -11.718 1.00 15.00 N ATOM 487 CA SER A 34 3.425 -2.983 -12.435 1.00 15.00 C ATOM 488 C SER A 34 4.812 -2.848 -11.827 1.00 15.00 C ATOM 489 O SER A 34 4.967 -2.861 -10.607 1.00 15.00 O ATOM 490 CB SER A 34 2.695 -1.637 -12.395 1.00 15.00 C ATOM 491 OG SER A 34 3.341 -0.666 -13.205 1.00 15.00 O ATOM 0 H SER A 34 2.079 -3.638 -10.966 1.00 15.00 H new ATOM 0 HA SER A 34 3.522 -3.289 -13.477 1.00 15.00 H new ATOM 0 HB2 SER A 34 1.668 -1.770 -12.735 1.00 15.00 H new ATOM 0 HB3 SER A 34 2.647 -1.279 -11.366 1.00 15.00 H new ATOM 0 HG SER A 34 3.779 -0.002 -12.633 1.00 15.00 H new ATOM 497 N GLN A 35 5.818 -2.706 -12.673 1.00 15.00 N ATOM 498 CA GLN A 35 7.184 -2.591 -12.200 1.00 15.00 C ATOM 499 C GLN A 35 7.608 -1.132 -12.041 1.00 15.00 C ATOM 500 O GLN A 35 8.751 -0.768 -12.325 1.00 15.00 O ATOM 501 CB GLN A 35 8.138 -3.335 -13.136 1.00 15.00 C ATOM 502 CG GLN A 35 9.519 -3.588 -12.534 1.00 15.00 C ATOM 503 CD GLN A 35 9.484 -4.424 -11.265 1.00 15.00 C ATOM 504 OE1 GLN A 35 10.277 -4.210 -10.349 1.00 15.00 O ATOM 505 NE2 GLN A 35 8.584 -5.393 -11.208 1.00 15.00 N ATOM 0 H GLN A 35 5.714 -2.668 -13.687 1.00 15.00 H new ATOM 0 HA GLN A 35 7.232 -3.052 -11.213 1.00 15.00 H new ATOM 0 HB2 GLN A 35 7.691 -4.290 -13.411 1.00 15.00 H new ATOM 0 HB3 GLN A 35 8.252 -2.760 -14.055 1.00 15.00 H new ATOM 0 HG2 GLN A 35 10.142 -4.091 -13.274 1.00 15.00 H new ATOM 0 HG3 GLN A 35 9.992 -2.631 -12.316 1.00 15.00 H new ATOM 0 HE21 GLN A 35 7.943 -5.540 -11.988 1.00 15.00 H new ATOM 0 HE22 GLN A 35 8.532 -5.993 -10.384 1.00 15.00 H new ATOM 514 N SER A 36 6.689 -0.286 -11.601 1.00 15.00 N ATOM 515 CA SER A 36 7.027 1.102 -11.346 1.00 15.00 C ATOM 516 C SER A 36 7.982 1.074 -10.161 1.00 15.00 C ATOM 517 O SER A 36 7.772 0.272 -9.247 1.00 15.00 O ATOM 518 CB SER A 36 5.764 1.905 -11.023 1.00 15.00 C ATOM 519 OG SER A 36 4.642 1.378 -11.717 1.00 15.00 O ATOM 0 H SER A 36 5.717 -0.533 -11.416 1.00 15.00 H new ATOM 0 HA SER A 36 7.485 1.581 -12.211 1.00 15.00 H new ATOM 0 HB2 SER A 36 5.577 1.882 -9.949 1.00 15.00 H new ATOM 0 HB3 SER A 36 5.911 2.949 -11.299 1.00 15.00 H new ATOM 0 HG SER A 36 3.883 1.991 -11.626 1.00 15.00 H new ATOM 525 N PRO A 37 9.044 1.890 -10.118 1.00 15.00 N ATOM 526 CA PRO A 37 9.973 1.767 -9.009 1.00 15.00 C ATOM 527 C PRO A 37 9.432 2.323 -7.699 1.00 15.00 C ATOM 528 O PRO A 37 9.444 3.529 -7.439 1.00 15.00 O ATOM 529 CB PRO A 37 11.174 2.585 -9.493 1.00 15.00 C ATOM 530 CG PRO A 37 10.611 3.591 -10.442 1.00 15.00 C ATOM 531 CD PRO A 37 9.406 2.948 -11.075 1.00 15.00 C ATOM 0 HA PRO A 37 10.196 0.726 -8.777 1.00 15.00 H new ATOM 0 HB2 PRO A 37 11.680 3.071 -8.659 1.00 15.00 H new ATOM 0 HB3 PRO A 37 11.910 1.949 -9.985 1.00 15.00 H new ATOM 0 HG2 PRO A 37 10.333 4.506 -9.919 1.00 15.00 H new ATOM 0 HG3 PRO A 37 11.347 3.867 -11.198 1.00 15.00 H new ATOM 0 HD2 PRO A 37 8.594 3.662 -11.211 1.00 15.00 H new ATOM 0 HD3 PRO A 37 9.638 2.539 -12.058 1.00 15.00 H new ATOM 539 N HIS A 38 8.952 1.393 -6.896 1.00 15.00 N ATOM 540 CA HIS A 38 8.461 1.644 -5.555 1.00 15.00 C ATOM 541 C HIS A 38 9.259 0.781 -4.589 1.00 15.00 C ATOM 542 O HIS A 38 9.929 -0.155 -5.029 1.00 15.00 O ATOM 543 CB HIS A 38 6.962 1.348 -5.452 1.00 15.00 C ATOM 544 CG HIS A 38 6.166 2.526 -4.975 1.00 15.00 C ATOM 545 ND1 HIS A 38 4.897 2.834 -5.413 1.00 15.00 N ATOM 546 CD2 HIS A 38 6.490 3.484 -4.072 1.00 15.00 C ATOM 547 CE1 HIS A 38 4.500 3.941 -4.776 1.00 15.00 C ATOM 548 NE2 HIS A 38 5.431 4.376 -3.950 1.00 15.00 N ATOM 0 H HIS A 38 8.891 0.412 -7.168 1.00 15.00 H new ATOM 0 HA HIS A 38 8.591 2.697 -5.304 1.00 15.00 H new ATOM 0 HB2 HIS A 38 6.590 1.036 -6.428 1.00 15.00 H new ATOM 0 HB3 HIS A 38 6.808 0.512 -4.770 1.00 15.00 H new ATOM 0 HD1 HIS A 38 4.356 2.311 -6.101 1.00 15.00 H new ATOM 0 HD2 HIS A 38 7.424 3.545 -3.533 1.00 15.00 H new ATOM 0 HE1 HIS A 38 3.541 4.417 -4.920 1.00 15.00 H new ATOM 556 N ALA A 39 9.217 1.058 -3.299 1.00 15.00 N ATOM 557 CA ALA A 39 9.913 0.189 -2.364 1.00 15.00 C ATOM 558 C ALA A 39 8.881 -0.722 -1.716 1.00 15.00 C ATOM 559 O ALA A 39 8.050 -0.262 -0.930 1.00 15.00 O ATOM 560 CB ALA A 39 10.649 1.009 -1.317 1.00 15.00 C ATOM 0 H ALA A 39 8.727 1.850 -2.883 1.00 15.00 H new ATOM 0 HA ALA A 39 10.660 -0.408 -2.887 1.00 15.00 H new ATOM 0 HB1 ALA A 39 11.163 0.340 -0.627 1.00 15.00 H new ATOM 0 HB2 ALA A 39 11.377 1.655 -1.807 1.00 15.00 H new ATOM 0 HB3 ALA A 39 9.935 1.620 -0.765 1.00 15.00 H new ATOM 566 N HIS A 40 8.932 -2.010 -2.038 1.00 15.00 N ATOM 567 CA HIS A 40 7.973 -2.968 -1.496 1.00 15.00 C ATOM 568 C HIS A 40 8.357 -4.400 -1.865 1.00 15.00 C ATOM 569 O HIS A 40 9.395 -4.633 -2.481 1.00 15.00 O ATOM 570 CB HIS A 40 6.548 -2.646 -1.993 1.00 15.00 C ATOM 571 CG HIS A 40 6.259 -3.054 -3.409 1.00 15.00 C ATOM 572 ND1 HIS A 40 5.441 -4.122 -3.690 1.00 15.00 N ATOM 573 CD2 HIS A 40 6.681 -2.503 -4.574 1.00 15.00 C ATOM 574 CE1 HIS A 40 5.383 -4.199 -5.010 1.00 15.00 C ATOM 575 NE2 HIS A 40 6.122 -3.241 -5.584 1.00 15.00 N ATOM 0 H HIS A 40 9.624 -2.414 -2.669 1.00 15.00 H new ATOM 0 HA HIS A 40 7.991 -2.884 -0.409 1.00 15.00 H new ATOM 0 HB2 HIS A 40 5.831 -3.138 -1.336 1.00 15.00 H new ATOM 0 HB3 HIS A 40 6.381 -1.573 -1.899 1.00 15.00 H new ATOM 0 HD2 HIS A 40 7.332 -1.648 -4.684 1.00 15.00 H new ATOM 0 HE1 HIS A 40 4.814 -4.938 -5.554 1.00 15.00 H new ATOM 0 HE2 HIS A 40 6.246 -3.089 -6.585 1.00 15.00 H new ATOM 583 N GLY A 41 7.505 -5.348 -1.484 1.00 15.00 N ATOM 584 CA GLY A 41 7.741 -6.746 -1.786 1.00 15.00 C ATOM 585 C GLY A 41 6.438 -7.496 -2.000 1.00 15.00 C ATOM 586 O GLY A 41 6.340 -8.692 -1.711 1.00 15.00 O ATOM 0 H GLY A 41 6.646 -5.167 -0.965 1.00 15.00 H new ATOM 0 HA2 GLY A 41 8.360 -6.827 -2.680 1.00 15.00 H new ATOM 0 HA3 GLY A 41 8.298 -7.207 -0.970 1.00 15.00 H new ATOM 590 N TYR A 42 5.434 -6.787 -2.511 1.00 15.00 N ATOM 591 CA TYR A 42 4.119 -7.369 -2.754 1.00 15.00 C ATOM 592 C TYR A 42 4.001 -7.860 -4.189 1.00 15.00 C ATOM 593 O TYR A 42 4.042 -7.073 -5.131 1.00 15.00 O ATOM 594 CB TYR A 42 3.011 -6.346 -2.469 1.00 15.00 C ATOM 595 CG TYR A 42 2.974 -5.850 -1.043 1.00 15.00 C ATOM 596 CD1 TYR A 42 3.881 -4.901 -0.597 1.00 15.00 C ATOM 597 CD2 TYR A 42 2.026 -6.323 -0.147 1.00 15.00 C ATOM 598 CE1 TYR A 42 3.846 -4.435 0.702 1.00 15.00 C ATOM 599 CE2 TYR A 42 1.984 -5.864 1.154 1.00 15.00 C ATOM 600 CZ TYR A 42 2.896 -4.920 1.574 1.00 15.00 C ATOM 601 OH TYR A 42 2.855 -4.452 2.868 1.00 15.00 O ATOM 0 H TYR A 42 5.509 -5.802 -2.766 1.00 15.00 H new ATOM 0 HA TYR A 42 4.002 -8.217 -2.079 1.00 15.00 H new ATOM 0 HB2 TYR A 42 3.141 -5.493 -3.135 1.00 15.00 H new ATOM 0 HB3 TYR A 42 2.047 -6.795 -2.710 1.00 15.00 H new ATOM 0 HD1 TYR A 42 4.628 -4.520 -1.278 1.00 15.00 H new ATOM 0 HD2 TYR A 42 1.309 -7.062 -0.473 1.00 15.00 H new ATOM 0 HE1 TYR A 42 4.559 -3.695 1.033 1.00 15.00 H new ATOM 0 HE2 TYR A 42 1.240 -6.243 1.839 1.00 15.00 H new ATOM 0 HH TYR A 42 2.127 -4.894 3.353 1.00 15.00 H new ATOM 611 N ILE A 43 3.868 -9.166 -4.346 1.00 15.00 N ATOM 612 CA ILE A 43 3.726 -9.774 -5.660 1.00 15.00 C ATOM 613 C ILE A 43 2.354 -10.437 -5.757 1.00 15.00 C ATOM 614 O ILE A 43 1.959 -11.156 -4.839 1.00 15.00 O ATOM 615 CB ILE A 43 4.833 -10.827 -5.919 1.00 15.00 C ATOM 616 CG1 ILE A 43 6.225 -10.185 -5.815 1.00 15.00 C ATOM 617 CG2 ILE A 43 4.655 -11.493 -7.278 1.00 15.00 C ATOM 618 CD1 ILE A 43 6.475 -9.098 -6.843 1.00 15.00 C ATOM 0 H ILE A 43 3.855 -9.831 -3.573 1.00 15.00 H new ATOM 0 HA ILE A 43 3.823 -8.993 -6.415 1.00 15.00 H new ATOM 0 HB ILE A 43 4.746 -11.597 -5.153 1.00 15.00 H new ATOM 0 HG12 ILE A 43 6.347 -9.764 -4.817 1.00 15.00 H new ATOM 0 HG13 ILE A 43 6.982 -10.961 -5.928 1.00 15.00 H new ATOM 0 HG21 ILE A 43 5.447 -12.226 -7.430 1.00 15.00 H new ATOM 0 HG22 ILE A 43 3.686 -11.992 -7.315 1.00 15.00 H new ATOM 0 HG23 ILE A 43 4.704 -10.738 -8.062 1.00 15.00 H new ATOM 0 HD11 ILE A 43 7.477 -8.692 -6.707 1.00 15.00 H new ATOM 0 HD12 ILE A 43 6.386 -9.518 -7.845 1.00 15.00 H new ATOM 0 HD13 ILE A 43 5.741 -8.302 -6.717 1.00 15.00 H new ATOM 630 N PRO A 44 1.603 -10.191 -6.846 1.00 15.00 N ATOM 631 CA PRO A 44 0.268 -10.778 -7.041 1.00 15.00 C ATOM 632 C PRO A 44 0.258 -12.298 -6.874 1.00 15.00 C ATOM 633 O PRO A 44 -0.682 -12.861 -6.314 1.00 15.00 O ATOM 634 CB PRO A 44 -0.081 -10.397 -8.483 1.00 15.00 C ATOM 635 CG PRO A 44 0.724 -9.180 -8.770 1.00 15.00 C ATOM 636 CD PRO A 44 1.987 -9.306 -7.963 1.00 15.00 C ATOM 0 HA PRO A 44 -0.444 -10.412 -6.301 1.00 15.00 H new ATOM 0 HB2 PRO A 44 0.164 -11.204 -9.174 1.00 15.00 H new ATOM 0 HB3 PRO A 44 -1.147 -10.198 -8.591 1.00 15.00 H new ATOM 0 HG2 PRO A 44 0.949 -9.105 -9.834 1.00 15.00 H new ATOM 0 HG3 PRO A 44 0.176 -8.278 -8.496 1.00 15.00 H new ATOM 0 HD2 PRO A 44 2.798 -9.734 -8.553 1.00 15.00 H new ATOM 0 HD3 PRO A 44 2.332 -8.336 -7.605 1.00 15.00 H new ATOM 644 N SER A 45 1.320 -12.950 -7.339 1.00 15.00 N ATOM 645 CA SER A 45 1.433 -14.402 -7.243 1.00 15.00 C ATOM 646 C SER A 45 1.703 -14.850 -5.800 1.00 15.00 C ATOM 647 O SER A 45 1.558 -16.023 -5.467 1.00 15.00 O ATOM 648 CB SER A 45 2.545 -14.900 -8.169 1.00 15.00 C ATOM 649 OG SER A 45 2.333 -14.463 -9.503 1.00 15.00 O ATOM 0 H SER A 45 2.116 -12.495 -7.787 1.00 15.00 H new ATOM 0 HA SER A 45 0.483 -14.837 -7.553 1.00 15.00 H new ATOM 0 HB2 SER A 45 3.509 -14.537 -7.813 1.00 15.00 H new ATOM 0 HB3 SER A 45 2.585 -15.989 -8.142 1.00 15.00 H new ATOM 0 HG SER A 45 3.058 -14.793 -10.074 1.00 15.00 H new ATOM 655 N LYS A 46 2.084 -13.904 -4.947 1.00 15.00 N ATOM 656 CA LYS A 46 2.370 -14.207 -3.548 1.00 15.00 C ATOM 657 C LYS A 46 1.098 -14.161 -2.718 1.00 15.00 C ATOM 658 O LYS A 46 1.018 -14.773 -1.652 1.00 15.00 O ATOM 659 CB LYS A 46 3.386 -13.217 -2.976 1.00 15.00 C ATOM 660 CG LYS A 46 4.829 -13.564 -3.297 1.00 15.00 C ATOM 661 CD LYS A 46 5.783 -12.450 -2.889 1.00 15.00 C ATOM 662 CE LYS A 46 5.750 -12.195 -1.392 1.00 15.00 C ATOM 663 NZ LYS A 46 6.858 -11.303 -0.967 1.00 15.00 N1+ ATOM 0 H LYS A 46 2.202 -12.923 -5.199 1.00 15.00 H new ATOM 0 HA LYS A 46 2.789 -15.212 -3.505 1.00 15.00 H new ATOM 0 HB2 LYS A 46 3.167 -12.222 -3.363 1.00 15.00 H new ATOM 0 HB3 LYS A 46 3.265 -13.172 -1.894 1.00 15.00 H new ATOM 0 HG2 LYS A 46 5.104 -14.485 -2.783 1.00 15.00 H new ATOM 0 HG3 LYS A 46 4.928 -13.754 -4.366 1.00 15.00 H new ATOM 0 HD2 LYS A 46 6.797 -12.712 -3.190 1.00 15.00 H new ATOM 0 HD3 LYS A 46 5.520 -11.535 -3.419 1.00 15.00 H new ATOM 0 HE2 LYS A 46 4.795 -11.746 -1.119 1.00 15.00 H new ATOM 0 HE3 LYS A 46 5.820 -13.143 -0.859 1.00 15.00 H new ATOM 0 HZ1 LYS A 46 6.889 -11.258 0.072 1.00 15.00 H new ATOM 0 HZ2 LYS A 46 7.761 -11.676 -1.324 1.00 15.00 H new ATOM 0 HZ3 LYS A 46 6.702 -10.349 -1.350 1.00 15.00 H new ATOM 677 N PHE A 47 0.103 -13.433 -3.209 1.00 15.00 N ATOM 678 CA PHE A 47 -1.166 -13.307 -2.505 1.00 15.00 C ATOM 679 C PHE A 47 -2.351 -13.544 -3.453 1.00 15.00 C ATOM 680 O PHE A 47 -3.186 -12.658 -3.647 1.00 15.00 O ATOM 681 CB PHE A 47 -1.283 -11.919 -1.858 1.00 15.00 C ATOM 682 CG PHE A 47 -0.146 -11.579 -0.933 1.00 15.00 C ATOM 683 CD1 PHE A 47 -0.032 -12.197 0.301 1.00 15.00 C ATOM 684 CD2 PHE A 47 0.806 -10.641 -1.298 1.00 15.00 C ATOM 685 CE1 PHE A 47 1.009 -11.888 1.153 1.00 15.00 C ATOM 686 CE2 PHE A 47 1.852 -10.327 -0.448 1.00 15.00 C ATOM 687 CZ PHE A 47 1.952 -10.952 0.779 1.00 15.00 C ATOM 0 H PHE A 47 0.150 -12.922 -4.090 1.00 15.00 H new ATOM 0 HA PHE A 47 -1.193 -14.068 -1.725 1.00 15.00 H new ATOM 0 HB2 PHE A 47 -1.336 -11.166 -2.644 1.00 15.00 H new ATOM 0 HB3 PHE A 47 -2.219 -11.866 -1.302 1.00 15.00 H new ATOM 0 HD1 PHE A 47 -0.767 -12.930 0.600 1.00 15.00 H new ATOM 0 HD2 PHE A 47 0.731 -10.149 -2.257 1.00 15.00 H new ATOM 0 HE1 PHE A 47 1.086 -12.378 2.112 1.00 15.00 H new ATOM 0 HE2 PHE A 47 2.589 -9.595 -0.744 1.00 15.00 H new ATOM 0 HZ PHE A 47 2.767 -10.709 1.445 1.00 15.00 H new ATOM 697 N PRO A 48 -2.456 -14.750 -4.048 1.00 15.00 N ATOM 698 CA PRO A 48 -3.547 -15.071 -4.970 1.00 15.00 C ATOM 699 C PRO A 48 -4.854 -15.317 -4.230 1.00 15.00 C ATOM 700 O PRO A 48 -5.933 -15.339 -4.829 1.00 15.00 O ATOM 701 CB PRO A 48 -3.062 -16.348 -5.654 1.00 15.00 C ATOM 702 CG PRO A 48 -2.157 -17.001 -4.671 1.00 15.00 C ATOM 703 CD PRO A 48 -1.534 -15.892 -3.863 1.00 15.00 C ATOM 0 HA PRO A 48 -3.760 -14.260 -5.666 1.00 15.00 H new ATOM 0 HB2 PRO A 48 -3.898 -16.998 -5.911 1.00 15.00 H new ATOM 0 HB3 PRO A 48 -2.537 -16.122 -6.582 1.00 15.00 H new ATOM 0 HG2 PRO A 48 -2.711 -17.686 -4.028 1.00 15.00 H new ATOM 0 HG3 PRO A 48 -1.392 -17.589 -5.178 1.00 15.00 H new ATOM 0 HD2 PRO A 48 -1.445 -16.166 -2.812 1.00 15.00 H new ATOM 0 HD3 PRO A 48 -0.531 -15.656 -4.217 1.00 15.00 H new ATOM 711 N ASN A 49 -4.745 -15.483 -2.918 1.00 15.00 N ATOM 712 CA ASN A 49 -5.898 -15.731 -2.063 1.00 15.00 C ATOM 713 C ASN A 49 -6.607 -14.429 -1.710 1.00 15.00 C ATOM 714 O ASN A 49 -7.704 -14.441 -1.155 1.00 15.00 O ATOM 715 CB ASN A 49 -5.474 -16.454 -0.776 1.00 15.00 C ATOM 716 CG ASN A 49 -4.532 -15.627 0.088 1.00 15.00 C ATOM 717 OD1 ASN A 49 -3.659 -14.920 -0.415 1.00 15.00 O ATOM 718 ND2 ASN A 49 -4.710 -15.701 1.399 1.00 15.00 N ATOM 0 H ASN A 49 -3.857 -15.450 -2.418 1.00 15.00 H new ATOM 0 HA ASN A 49 -6.589 -16.366 -2.617 1.00 15.00 H new ATOM 0 HB2 ASN A 49 -6.363 -16.705 -0.197 1.00 15.00 H new ATOM 0 HB3 ASN A 49 -4.988 -17.394 -1.037 1.00 15.00 H new ATOM 0 HD21 ASN A 49 -4.113 -15.161 2.026 1.00 15.00 H new ATOM 0 HD22 ASN A 49 -5.444 -16.298 1.781 1.00 15.00 H new ATOM 725 N LYS A 50 -5.967 -13.305 -2.017 1.00 15.00 N ATOM 726 CA LYS A 50 -6.549 -11.999 -1.738 1.00 15.00 C ATOM 727 C LYS A 50 -6.984 -11.326 -3.032 1.00 15.00 C ATOM 728 O LYS A 50 -7.347 -10.150 -3.049 1.00 15.00 O ATOM 729 CB LYS A 50 -5.557 -11.116 -0.974 1.00 15.00 C ATOM 730 CG LYS A 50 -5.226 -11.634 0.421 1.00 15.00 C ATOM 731 CD LYS A 50 -6.477 -11.792 1.277 1.00 15.00 C ATOM 732 CE LYS A 50 -6.134 -12.218 2.695 1.00 15.00 C ATOM 733 NZ LYS A 50 -7.163 -13.127 3.275 1.00 15.00 N1+ ATOM 0 H LYS A 50 -5.048 -13.273 -2.458 1.00 15.00 H new ATOM 0 HA LYS A 50 -7.429 -12.140 -1.110 1.00 15.00 H new ATOM 0 HB2 LYS A 50 -4.636 -11.037 -1.551 1.00 15.00 H new ATOM 0 HB3 LYS A 50 -5.969 -10.110 -0.891 1.00 15.00 H new ATOM 0 HG2 LYS A 50 -4.717 -12.594 0.341 1.00 15.00 H new ATOM 0 HG3 LYS A 50 -4.535 -10.947 0.910 1.00 15.00 H new ATOM 0 HD2 LYS A 50 -7.023 -10.849 1.302 1.00 15.00 H new ATOM 0 HD3 LYS A 50 -7.138 -12.531 0.824 1.00 15.00 H new ATOM 0 HE2 LYS A 50 -5.166 -12.719 2.698 1.00 15.00 H new ATOM 0 HE3 LYS A 50 -6.037 -11.334 3.325 1.00 15.00 H new ATOM 0 HZ1 LYS A 50 -6.703 -13.989 3.631 1.00 15.00 H new ATOM 0 HZ2 LYS A 50 -7.650 -12.646 4.058 1.00 15.00 H new ATOM 0 HZ3 LYS A 50 -7.855 -13.381 2.541 1.00 15.00 H new ATOM 747 N ASN A 51 -6.938 -12.103 -4.112 1.00 15.00 N ATOM 748 CA ASN A 51 -7.337 -11.655 -5.447 1.00 15.00 C ATOM 749 C ASN A 51 -6.668 -10.339 -5.848 1.00 15.00 C ATOM 750 O ASN A 51 -7.339 -9.335 -6.109 1.00 15.00 O ATOM 751 CB ASN A 51 -8.863 -11.525 -5.540 1.00 15.00 C ATOM 752 CG ASN A 51 -9.351 -11.489 -6.978 1.00 15.00 C ATOM 753 OD1 ASN A 51 -8.686 -11.992 -7.885 1.00 15.00 O ATOM 754 ND2 ASN A 51 -10.525 -10.918 -7.193 1.00 15.00 N ATOM 0 H ASN A 51 -6.620 -13.072 -4.086 1.00 15.00 H new ATOM 0 HA ASN A 51 -6.998 -12.416 -6.149 1.00 15.00 H new ATOM 0 HB2 ASN A 51 -9.329 -12.363 -5.021 1.00 15.00 H new ATOM 0 HB3 ASN A 51 -9.180 -10.616 -5.028 1.00 15.00 H new ATOM 0 HD21 ASN A 51 -10.910 -10.883 -8.137 1.00 15.00 H new ATOM 0 HD22 ASN A 51 -11.045 -10.513 -6.415 1.00 15.00 H new ATOM 761 N LEU A 52 -5.342 -10.343 -5.880 1.00 15.00 N ATOM 762 CA LEU A 52 -4.589 -9.164 -6.284 1.00 15.00 C ATOM 763 C LEU A 52 -4.550 -9.093 -7.806 1.00 15.00 C ATOM 764 O LEU A 52 -3.904 -9.920 -8.451 1.00 15.00 O ATOM 765 CB LEU A 52 -3.160 -9.216 -5.734 1.00 15.00 C ATOM 766 CG LEU A 52 -2.895 -8.382 -4.477 1.00 15.00 C ATOM 767 CD1 LEU A 52 -3.707 -8.899 -3.303 1.00 15.00 C ATOM 768 CD2 LEU A 52 -1.412 -8.392 -4.143 1.00 15.00 C ATOM 0 H LEU A 52 -4.767 -11.148 -5.632 1.00 15.00 H new ATOM 0 HA LEU A 52 -5.080 -8.278 -5.881 1.00 15.00 H new ATOM 0 HB2 LEU A 52 -2.913 -10.255 -5.516 1.00 15.00 H new ATOM 0 HB3 LEU A 52 -2.478 -8.884 -6.517 1.00 15.00 H new ATOM 0 HG LEU A 52 -3.203 -7.355 -4.675 1.00 15.00 H new ATOM 0 HD11 LEU A 52 -3.501 -8.290 -2.422 1.00 15.00 H new ATOM 0 HD12 LEU A 52 -4.769 -8.844 -3.543 1.00 15.00 H new ATOM 0 HD13 LEU A 52 -3.434 -9.935 -3.100 1.00 15.00 H new ATOM 0 HD21 LEU A 52 -1.237 -7.796 -3.248 1.00 15.00 H new ATOM 0 HD22 LEU A 52 -1.086 -9.417 -3.966 1.00 15.00 H new ATOM 0 HD23 LEU A 52 -0.849 -7.971 -4.976 1.00 15.00 H new ATOM 780 N LYS A 53 -5.237 -8.112 -8.378 1.00 15.00 N ATOM 781 CA LYS A 53 -5.288 -7.965 -9.827 1.00 15.00 C ATOM 782 C LYS A 53 -5.243 -6.498 -10.241 1.00 15.00 C ATOM 783 O LYS A 53 -5.949 -5.659 -9.675 1.00 15.00 O ATOM 784 CB LYS A 53 -6.564 -8.615 -10.390 1.00 15.00 C ATOM 785 CG LYS A 53 -6.669 -10.117 -10.144 1.00 15.00 C ATOM 786 CD LYS A 53 -5.605 -10.894 -10.909 1.00 15.00 C ATOM 787 CE LYS A 53 -5.603 -12.363 -10.518 1.00 15.00 C ATOM 788 NZ LYS A 53 -4.515 -13.118 -11.195 1.00 15.00 N1+ ATOM 0 H LYS A 53 -5.765 -7.408 -7.862 1.00 15.00 H new ATOM 0 HA LYS A 53 -4.412 -8.468 -10.236 1.00 15.00 H new ATOM 0 HB2 LYS A 53 -7.432 -8.125 -9.948 1.00 15.00 H new ATOM 0 HB3 LYS A 53 -6.607 -8.431 -11.464 1.00 15.00 H new ATOM 0 HG2 LYS A 53 -6.569 -10.318 -9.077 1.00 15.00 H new ATOM 0 HG3 LYS A 53 -7.658 -10.465 -10.442 1.00 15.00 H new ATOM 0 HD2 LYS A 53 -5.784 -10.801 -11.980 1.00 15.00 H new ATOM 0 HD3 LYS A 53 -4.624 -10.462 -10.711 1.00 15.00 H new ATOM 0 HE2 LYS A 53 -5.487 -12.451 -9.438 1.00 15.00 H new ATOM 0 HE3 LYS A 53 -6.565 -12.807 -10.772 1.00 15.00 H new ATOM 0 HZ1 LYS A 53 -4.549 -14.115 -10.901 1.00 15.00 H new ATOM 0 HZ2 LYS A 53 -4.639 -13.057 -12.226 1.00 15.00 H new ATOM 0 HZ3 LYS A 53 -3.595 -12.711 -10.932 1.00 15.00 H new ATOM 802 N LYS A 54 -4.400 -6.212 -11.230 1.00 15.00 N ATOM 803 CA LYS A 54 -4.235 -4.867 -11.786 1.00 15.00 C ATOM 804 C LYS A 54 -3.964 -3.829 -10.694 1.00 15.00 C ATOM 805 O LYS A 54 -3.142 -4.053 -9.811 1.00 15.00 O ATOM 806 CB LYS A 54 -5.473 -4.481 -12.607 1.00 15.00 C ATOM 807 CG LYS A 54 -5.847 -5.504 -13.665 1.00 15.00 C ATOM 808 CD LYS A 54 -4.727 -5.706 -14.674 1.00 15.00 C ATOM 809 CE LYS A 54 -5.059 -6.820 -15.653 1.00 15.00 C ATOM 810 NZ LYS A 54 -3.938 -7.096 -16.591 1.00 15.00 N1+ ATOM 0 H LYS A 54 -3.806 -6.912 -11.674 1.00 15.00 H new ATOM 0 HA LYS A 54 -3.364 -4.880 -12.441 1.00 15.00 H new ATOM 0 HB2 LYS A 54 -6.318 -4.344 -11.932 1.00 15.00 H new ATOM 0 HB3 LYS A 54 -5.293 -3.521 -13.090 1.00 15.00 H new ATOM 0 HG2 LYS A 54 -6.080 -6.455 -13.185 1.00 15.00 H new ATOM 0 HG3 LYS A 54 -6.749 -5.178 -14.183 1.00 15.00 H new ATOM 0 HD2 LYS A 54 -4.555 -4.778 -15.220 1.00 15.00 H new ATOM 0 HD3 LYS A 54 -3.801 -5.944 -14.150 1.00 15.00 H new ATOM 0 HE2 LYS A 54 -5.300 -7.728 -15.100 1.00 15.00 H new ATOM 0 HE3 LYS A 54 -5.948 -6.548 -16.222 1.00 15.00 H new ATOM 0 HZ1 LYS A 54 -4.209 -7.862 -17.240 1.00 15.00 H new ATOM 0 HZ2 LYS A 54 -3.724 -6.238 -17.139 1.00 15.00 H new ATOM 0 HZ3 LYS A 54 -3.096 -7.381 -16.051 1.00 15.00 H new ATOM 824 N ASN A 55 -4.653 -2.697 -10.765 1.00 15.00 N ATOM 825 CA ASN A 55 -4.477 -1.625 -9.792 1.00 15.00 C ATOM 826 C ASN A 55 -5.753 -1.408 -8.986 1.00 15.00 C ATOM 827 O ASN A 55 -6.152 -0.276 -8.707 1.00 15.00 O ATOM 828 CB ASN A 55 -4.059 -0.326 -10.495 1.00 15.00 C ATOM 829 CG ASN A 55 -5.118 0.231 -11.433 1.00 15.00 C ATOM 830 OD1 ASN A 55 -5.913 -0.513 -12.017 1.00 15.00 O ATOM 831 ND2 ASN A 55 -5.121 1.546 -11.595 1.00 15.00 N ATOM 0 H ASN A 55 -5.342 -2.497 -11.490 1.00 15.00 H new ATOM 0 HA ASN A 55 -3.685 -1.918 -9.103 1.00 15.00 H new ATOM 0 HB2 ASN A 55 -3.823 0.425 -9.741 1.00 15.00 H new ATOM 0 HB3 ASN A 55 -3.145 -0.508 -11.060 1.00 15.00 H new ATOM 0 HD21 ASN A 55 -5.798 1.981 -12.222 1.00 15.00 H new ATOM 0 HD22 ASN A 55 -4.446 2.123 -11.093 1.00 15.00 H new ATOM 838 N TYR A 56 -6.393 -2.503 -8.615 1.00 15.00 N ATOM 839 CA TYR A 56 -7.618 -2.431 -7.838 1.00 15.00 C ATOM 840 C TYR A 56 -7.305 -2.488 -6.350 1.00 15.00 C ATOM 841 O TYR A 56 -6.455 -3.271 -5.913 1.00 15.00 O ATOM 842 CB TYR A 56 -8.573 -3.562 -8.235 1.00 15.00 C ATOM 843 CG TYR A 56 -9.030 -3.470 -9.673 1.00 15.00 C ATOM 844 CD1 TYR A 56 -8.767 -4.492 -10.577 1.00 15.00 C ATOM 845 CD2 TYR A 56 -9.710 -2.350 -10.130 1.00 15.00 C ATOM 846 CE1 TYR A 56 -9.166 -4.397 -11.897 1.00 15.00 C ATOM 847 CE2 TYR A 56 -10.118 -2.250 -11.443 1.00 15.00 C ATOM 848 CZ TYR A 56 -9.841 -3.275 -12.324 1.00 15.00 C ATOM 849 OH TYR A 56 -10.228 -3.167 -13.639 1.00 15.00 O ATOM 0 H TYR A 56 -6.086 -3.450 -8.838 1.00 15.00 H new ATOM 0 HA TYR A 56 -8.109 -1.481 -8.050 1.00 15.00 H new ATOM 0 HB2 TYR A 56 -8.078 -4.520 -8.077 1.00 15.00 H new ATOM 0 HB3 TYR A 56 -9.444 -3.541 -7.580 1.00 15.00 H new ATOM 0 HD1 TYR A 56 -8.242 -5.375 -10.243 1.00 15.00 H new ATOM 0 HD2 TYR A 56 -9.923 -1.543 -9.445 1.00 15.00 H new ATOM 0 HE1 TYR A 56 -8.950 -5.197 -12.589 1.00 15.00 H new ATOM 0 HE2 TYR A 56 -10.652 -1.374 -11.780 1.00 15.00 H new ATOM 0 HH TYR A 56 -10.694 -2.315 -13.774 1.00 15.00 H new ATOM 859 N CYS A 57 -7.976 -1.640 -5.584 1.00 15.00 N ATOM 860 CA CYS A 57 -7.782 -1.580 -4.145 1.00 15.00 C ATOM 861 C CYS A 57 -8.184 -2.891 -3.484 1.00 15.00 C ATOM 862 O CYS A 57 -9.257 -3.440 -3.756 1.00 15.00 O ATOM 863 CB CYS A 57 -8.589 -0.429 -3.550 1.00 15.00 C ATOM 864 SG CYS A 57 -8.360 -0.199 -1.772 1.00 15.00 S ATOM 0 H CYS A 57 -8.666 -0.979 -5.941 1.00 15.00 H new ATOM 0 HA CYS A 57 -6.722 -1.410 -3.955 1.00 15.00 H new ATOM 0 HB2 CYS A 57 -8.315 0.494 -4.062 1.00 15.00 H new ATOM 0 HB3 CYS A 57 -9.647 -0.602 -3.749 1.00 15.00 H new ATOM 0 HG CYS A 57 -7.205 -0.680 -1.417 1.00 15.00 H new ATOM 870 N ARG A 58 -7.313 -3.382 -2.613 1.00 15.00 N ATOM 871 CA ARG A 58 -7.547 -4.629 -1.896 1.00 15.00 C ATOM 872 C ARG A 58 -7.086 -4.491 -0.449 1.00 15.00 C ATOM 873 O ARG A 58 -6.352 -3.562 -0.113 1.00 15.00 O ATOM 874 CB ARG A 58 -6.775 -5.786 -2.550 1.00 15.00 C ATOM 875 CG ARG A 58 -7.127 -6.045 -4.009 1.00 15.00 C ATOM 876 CD ARG A 58 -8.414 -6.841 -4.150 1.00 15.00 C ATOM 877 NE ARG A 58 -9.475 -6.052 -4.776 1.00 15.00 N ATOM 878 CZ ARG A 58 -10.120 -6.411 -5.887 1.00 15.00 C ATOM 879 NH1 ARG A 58 -9.816 -7.551 -6.504 1.00 15.00 N1+ ATOM 880 NH2 ARG A 58 -11.070 -5.627 -6.388 1.00 15.00 N ATOM 0 H ARG A 58 -6.428 -2.930 -2.384 1.00 15.00 H new ATOM 0 HA ARG A 58 -8.615 -4.843 -1.931 1.00 15.00 H new ATOM 0 HB2 ARG A 58 -5.707 -5.577 -2.480 1.00 15.00 H new ATOM 0 HB3 ARG A 58 -6.960 -6.696 -1.979 1.00 15.00 H new ATOM 0 HG2 ARG A 58 -7.229 -5.094 -4.532 1.00 15.00 H new ATOM 0 HG3 ARG A 58 -6.311 -6.586 -4.488 1.00 15.00 H new ATOM 0 HD2 ARG A 58 -8.226 -7.734 -4.746 1.00 15.00 H new ATOM 0 HD3 ARG A 58 -8.743 -7.177 -3.167 1.00 15.00 H new ATOM 0 HE ARG A 58 -9.738 -5.171 -4.335 1.00 15.00 H new ATOM 0 HH11 ARG A 58 -9.086 -8.156 -6.127 1.00 15.00 H new ATOM 0 HH12 ARG A 58 -10.313 -7.820 -7.353 1.00 15.00 H new ATOM 0 HH21 ARG A 58 -11.306 -4.750 -5.923 1.00 15.00 H new ATOM 0 HH22 ARG A 58 -11.563 -5.902 -7.238 1.00 15.00 H new ATOM 894 N ASN A 59 -7.523 -5.404 0.401 1.00 15.00 N ATOM 895 CA ASN A 59 -7.109 -5.411 1.800 1.00 15.00 C ATOM 896 C ASN A 59 -6.515 -6.777 2.120 1.00 15.00 C ATOM 897 O ASN A 59 -7.189 -7.658 2.652 1.00 15.00 O ATOM 898 CB ASN A 59 -8.280 -5.097 2.739 1.00 15.00 C ATOM 899 CG ASN A 59 -7.813 -4.746 4.145 1.00 15.00 C ATOM 900 OD1 ASN A 59 -6.754 -5.186 4.590 1.00 15.00 O ATOM 901 ND2 ASN A 59 -8.604 -3.955 4.858 1.00 15.00 N ATOM 0 H ASN A 59 -8.167 -6.154 0.149 1.00 15.00 H new ATOM 0 HA ASN A 59 -6.363 -4.632 1.955 1.00 15.00 H new ATOM 0 HB2 ASN A 59 -8.857 -4.267 2.332 1.00 15.00 H new ATOM 0 HB3 ASN A 59 -8.948 -5.957 2.784 1.00 15.00 H new ATOM 0 HD21 ASN A 59 -8.341 -3.693 5.808 1.00 15.00 H new ATOM 0 HD22 ASN A 59 -9.475 -3.609 4.456 1.00 15.00 H new ATOM 908 N PRO A 60 -5.234 -6.972 1.786 1.00 15.00 N ATOM 909 CA PRO A 60 -4.558 -8.245 1.990 1.00 15.00 C ATOM 910 C PRO A 60 -4.096 -8.477 3.429 1.00 15.00 C ATOM 911 O PRO A 60 -3.695 -9.586 3.777 1.00 15.00 O ATOM 912 CB PRO A 60 -3.356 -8.147 1.055 1.00 15.00 C ATOM 913 CG PRO A 60 -3.042 -6.694 0.975 1.00 15.00 C ATOM 914 CD PRO A 60 -4.341 -5.960 1.181 1.00 15.00 C ATOM 0 HA PRO A 60 -5.225 -9.084 1.789 1.00 15.00 H new ATOM 0 HB2 PRO A 60 -2.508 -8.712 1.442 1.00 15.00 H new ATOM 0 HB3 PRO A 60 -3.588 -8.555 0.071 1.00 15.00 H new ATOM 0 HG2 PRO A 60 -2.313 -6.413 1.735 1.00 15.00 H new ATOM 0 HG3 PRO A 60 -2.606 -6.445 0.008 1.00 15.00 H new ATOM 0 HD2 PRO A 60 -4.213 -5.099 1.836 1.00 15.00 H new ATOM 0 HD3 PRO A 60 -4.742 -5.587 0.239 1.00 15.00 H new ATOM 922 N ASP A 61 -4.148 -7.449 4.272 1.00 15.00 N ATOM 923 CA ASP A 61 -3.695 -7.610 5.654 1.00 15.00 C ATOM 924 C ASP A 61 -4.846 -7.565 6.650 1.00 15.00 C ATOM 925 O ASP A 61 -4.634 -7.673 7.858 1.00 15.00 O ATOM 926 CB ASP A 61 -2.650 -6.561 6.016 1.00 15.00 C ATOM 927 CG ASP A 61 -1.734 -7.049 7.124 1.00 15.00 C ATOM 928 OD1 ASP A 61 -1.639 -6.374 8.163 1.00 15.00 O ATOM 929 OD2 ASP A 61 -1.120 -8.127 6.959 1.00 15.00 O1- ATOM 0 H ASP A 61 -4.490 -6.518 4.033 1.00 15.00 H new ATOM 0 HA ASP A 61 -3.241 -8.599 5.717 1.00 15.00 H new ATOM 0 HB2 ASP A 61 -2.058 -6.316 5.134 1.00 15.00 H new ATOM 0 HB3 ASP A 61 -3.147 -5.644 6.331 1.00 15.00 H new ATOM 934 N ARG A 62 -6.064 -7.411 6.133 1.00 15.00 N ATOM 935 CA ARG A 62 -7.271 -7.371 6.962 1.00 15.00 C ATOM 936 C ARG A 62 -7.178 -6.270 8.016 1.00 15.00 C ATOM 937 O ARG A 62 -7.637 -6.437 9.148 1.00 15.00 O ATOM 938 CB ARG A 62 -7.495 -8.727 7.642 1.00 15.00 C ATOM 939 CG ARG A 62 -7.322 -9.913 6.708 1.00 15.00 C ATOM 940 CD ARG A 62 -7.305 -11.224 7.472 1.00 15.00 C ATOM 941 NE ARG A 62 -6.190 -11.298 8.418 1.00 15.00 N ATOM 942 CZ ARG A 62 -6.081 -12.222 9.373 1.00 15.00 C ATOM 943 NH1 ARG A 62 -7.011 -13.160 9.510 1.00 15.00 N1+ ATOM 944 NH2 ARG A 62 -5.043 -12.204 10.198 1.00 15.00 N ATOM 0 H ARG A 62 -6.243 -7.311 5.134 1.00 15.00 H new ATOM 0 HA ARG A 62 -8.118 -7.153 6.311 1.00 15.00 H new ATOM 0 HB2 ARG A 62 -6.798 -8.826 8.474 1.00 15.00 H new ATOM 0 HB3 ARG A 62 -8.500 -8.751 8.063 1.00 15.00 H new ATOM 0 HG2 ARG A 62 -8.133 -9.925 5.980 1.00 15.00 H new ATOM 0 HG3 ARG A 62 -6.393 -9.805 6.149 1.00 15.00 H new ATOM 0 HD2 ARG A 62 -8.245 -11.341 8.011 1.00 15.00 H new ATOM 0 HD3 ARG A 62 -7.237 -12.053 6.767 1.00 15.00 H new ATOM 0 HE ARG A 62 -5.451 -10.599 8.342 1.00 15.00 H new ATOM 0 HH11 ARG A 62 -7.815 -13.177 8.882 1.00 15.00 H new ATOM 0 HH12 ARG A 62 -6.921 -13.864 10.243 1.00 15.00 H new ATOM 0 HH21 ARG A 62 -4.328 -11.483 10.102 1.00 15.00 H new ATOM 0 HH22 ARG A 62 -4.960 -12.911 10.929 1.00 15.00 H new ATOM 958 N ASP A 63 -6.590 -5.145 7.639 1.00 15.00 N ATOM 959 CA ASP A 63 -6.433 -4.022 8.556 1.00 15.00 C ATOM 960 C ASP A 63 -7.722 -3.206 8.649 1.00 15.00 C ATOM 961 O ASP A 63 -8.776 -3.638 8.180 1.00 15.00 O ATOM 962 CB ASP A 63 -5.245 -3.134 8.166 1.00 15.00 C ATOM 963 CG ASP A 63 -5.472 -2.355 6.895 1.00 15.00 C ATOM 964 OD1 ASP A 63 -6.106 -1.280 6.964 1.00 15.00 O ATOM 965 OD2 ASP A 63 -5.005 -2.816 5.833 1.00 15.00 O1- ATOM 0 H ASP A 63 -6.213 -4.984 6.705 1.00 15.00 H new ATOM 0 HA ASP A 63 -6.221 -4.433 9.543 1.00 15.00 H new ATOM 0 HB2 ASP A 63 -5.039 -2.437 8.979 1.00 15.00 H new ATOM 0 HB3 ASP A 63 -4.358 -3.757 8.048 1.00 15.00 H new ATOM 970 N LEU A 64 -7.633 -2.049 9.293 1.00 15.00 N ATOM 971 CA LEU A 64 -8.781 -1.172 9.502 1.00 15.00 C ATOM 972 C LEU A 64 -9.569 -0.879 8.220 1.00 15.00 C ATOM 973 O LEU A 64 -10.801 -0.899 8.240 1.00 15.00 O ATOM 974 CB LEU A 64 -8.320 0.144 10.125 1.00 15.00 C ATOM 975 CG LEU A 64 -7.705 0.024 11.521 1.00 15.00 C ATOM 976 CD1 LEU A 64 -7.091 1.345 11.945 1.00 15.00 C ATOM 977 CD2 LEU A 64 -8.749 -0.415 12.536 1.00 15.00 C ATOM 0 H LEU A 64 -6.763 -1.691 9.686 1.00 15.00 H new ATOM 0 HA LEU A 64 -9.456 -1.703 10.173 1.00 15.00 H new ATOM 0 HB2 LEU A 64 -7.588 0.605 9.462 1.00 15.00 H new ATOM 0 HB3 LEU A 64 -9.173 0.821 10.178 1.00 15.00 H new ATOM 0 HG LEU A 64 -6.922 -0.733 11.481 1.00 15.00 H new ATOM 0 HD11 LEU A 64 -6.658 1.242 12.940 1.00 15.00 H new ATOM 0 HD12 LEU A 64 -6.311 1.628 11.238 1.00 15.00 H new ATOM 0 HD13 LEU A 64 -7.862 2.116 11.962 1.00 15.00 H new ATOM 0 HD21 LEU A 64 -8.289 -0.493 13.521 1.00 15.00 H new ATOM 0 HD22 LEU A 64 -9.555 0.318 12.569 1.00 15.00 H new ATOM 0 HD23 LEU A 64 -9.153 -1.385 12.246 1.00 15.00 H new ATOM 989 N ARG A 65 -8.885 -0.623 7.108 1.00 15.00 N ATOM 990 CA ARG A 65 -9.581 -0.308 5.861 1.00 15.00 C ATOM 991 C ARG A 65 -8.709 -0.577 4.640 1.00 15.00 C ATOM 992 O ARG A 65 -7.493 -0.441 4.699 1.00 15.00 O ATOM 993 CB ARG A 65 -10.020 1.161 5.864 1.00 15.00 C ATOM 994 CG ARG A 65 -8.865 2.136 6.011 1.00 15.00 C ATOM 995 CD ARG A 65 -9.311 3.571 5.810 1.00 15.00 C ATOM 996 NE ARG A 65 -10.216 4.020 6.862 1.00 15.00 N ATOM 997 CZ ARG A 65 -11.286 4.776 6.651 1.00 15.00 C ATOM 998 NH1 ARG A 65 -11.598 5.168 5.421 1.00 15.00 N1+ ATOM 999 NH2 ARG A 65 -12.048 5.137 7.677 1.00 15.00 N ATOM 0 H ARG A 65 -7.867 -0.627 7.043 1.00 15.00 H new ATOM 0 HA ARG A 65 -10.454 -0.957 5.799 1.00 15.00 H new ATOM 0 HB2 ARG A 65 -10.551 1.376 4.937 1.00 15.00 H new ATOM 0 HB3 ARG A 65 -10.726 1.320 6.679 1.00 15.00 H new ATOM 0 HG2 ARG A 65 -8.422 2.028 7.001 1.00 15.00 H new ATOM 0 HG3 ARG A 65 -8.088 1.892 5.286 1.00 15.00 H new ATOM 0 HD2 ARG A 65 -8.436 4.221 5.784 1.00 15.00 H new ATOM 0 HD3 ARG A 65 -9.806 3.664 4.843 1.00 15.00 H new ATOM 0 HE ARG A 65 -10.014 3.735 7.820 1.00 15.00 H new ATOM 0 HH11 ARG A 65 -11.014 4.888 4.633 1.00 15.00 H new ATOM 0 HH12 ARG A 65 -12.422 5.749 5.264 1.00 15.00 H new ATOM 0 HH21 ARG A 65 -11.810 4.833 8.621 1.00 15.00 H new ATOM 0 HH22 ARG A 65 -12.872 5.718 7.521 1.00 15.00 H new ATOM 1013 N PRO A 66 -9.334 -0.954 3.508 1.00 15.00 N ATOM 1014 CA PRO A 66 -8.616 -1.237 2.259 1.00 15.00 C ATOM 1015 C PRO A 66 -7.784 -0.048 1.778 1.00 15.00 C ATOM 1016 O PRO A 66 -8.166 1.114 1.952 1.00 15.00 O ATOM 1017 CB PRO A 66 -9.732 -1.552 1.253 1.00 15.00 C ATOM 1018 CG PRO A 66 -10.989 -1.047 1.873 1.00 15.00 C ATOM 1019 CD PRO A 66 -10.786 -1.138 3.356 1.00 15.00 C ATOM 0 HA PRO A 66 -7.902 -2.051 2.386 1.00 15.00 H new ATOM 0 HB2 PRO A 66 -9.545 -1.065 0.296 1.00 15.00 H new ATOM 0 HB3 PRO A 66 -9.794 -2.623 1.060 1.00 15.00 H new ATOM 0 HG2 PRO A 66 -11.188 -0.019 1.569 1.00 15.00 H new ATOM 0 HG3 PRO A 66 -11.846 -1.644 1.559 1.00 15.00 H new ATOM 0 HD2 PRO A 66 -11.347 -0.369 3.887 1.00 15.00 H new ATOM 0 HD3 PRO A 66 -11.113 -2.101 3.749 1.00 15.00 H new ATOM 1027 N TRP A 67 -6.652 -0.356 1.166 1.00 15.00 N ATOM 1028 CA TRP A 67 -5.739 0.652 0.658 1.00 15.00 C ATOM 1029 C TRP A 67 -5.072 0.144 -0.609 1.00 15.00 C ATOM 1030 O TRP A 67 -5.397 -0.946 -1.093 1.00 15.00 O ATOM 1031 CB TRP A 67 -4.676 0.991 1.710 1.00 15.00 C ATOM 1032 CG TRP A 67 -4.053 -0.222 2.334 1.00 15.00 C ATOM 1033 CD1 TRP A 67 -4.589 -0.991 3.324 1.00 15.00 C ATOM 1034 CD2 TRP A 67 -2.787 -0.813 2.011 1.00 15.00 C ATOM 1035 NE1 TRP A 67 -3.742 -2.023 3.635 1.00 15.00 N ATOM 1036 CE2 TRP A 67 -2.623 -1.933 2.854 1.00 15.00 C ATOM 1037 CE3 TRP A 67 -1.769 -0.502 1.103 1.00 15.00 C ATOM 1038 CZ2 TRP A 67 -1.490 -2.746 2.803 1.00 15.00 C ATOM 1039 CZ3 TRP A 67 -0.647 -1.311 1.056 1.00 15.00 C ATOM 1040 CH2 TRP A 67 -0.514 -2.417 1.905 1.00 15.00 C ATOM 0 H TRP A 67 -6.341 -1.314 1.008 1.00 15.00 H new ATOM 0 HA TRP A 67 -6.303 1.557 0.432 1.00 15.00 H new ATOM 0 HB2 TRP A 67 -3.895 1.595 1.247 1.00 15.00 H new ATOM 0 HB3 TRP A 67 -5.129 1.601 2.491 1.00 15.00 H new ATOM 0 HD1 TRP A 67 -5.544 -0.813 3.796 1.00 15.00 H new ATOM 0 HE1 TRP A 67 -3.918 -2.742 4.336 1.00 15.00 H new ATOM 0 HE3 TRP A 67 -1.857 0.354 0.450 1.00 15.00 H new ATOM 0 HZ2 TRP A 67 -1.388 -3.605 3.450 1.00 15.00 H new ATOM 0 HZ3 TRP A 67 0.140 -1.085 0.352 1.00 15.00 H new ATOM 0 HH2 TRP A 67 0.379 -3.022 1.849 1.00 15.00 H new ATOM 1051 N CYS A 68 -4.146 0.928 -1.146 1.00 15.00 N ATOM 1052 CA CYS A 68 -3.430 0.550 -2.357 1.00 15.00 C ATOM 1053 C CYS A 68 -2.221 1.455 -2.572 1.00 15.00 C ATOM 1054 O CYS A 68 -2.190 2.587 -2.080 1.00 15.00 O ATOM 1055 CB CYS A 68 -4.365 0.615 -3.565 1.00 15.00 C ATOM 1056 SG CYS A 68 -5.580 1.954 -3.497 1.00 15.00 S ATOM 0 H CYS A 68 -3.873 1.832 -0.761 1.00 15.00 H new ATOM 0 HA CYS A 68 -3.075 -0.474 -2.243 1.00 15.00 H new ATOM 0 HB2 CYS A 68 -3.765 0.730 -4.468 1.00 15.00 H new ATOM 0 HB3 CYS A 68 -4.893 -0.335 -3.652 1.00 15.00 H new ATOM 0 HG CYS A 68 -6.289 1.842 -2.413 1.00 15.00 H new ATOM 1062 N PHE A 69 -1.221 0.948 -3.291 1.00 15.00 N ATOM 1063 CA PHE A 69 -0.016 1.714 -3.578 1.00 15.00 C ATOM 1064 C PHE A 69 -0.322 2.789 -4.616 1.00 15.00 C ATOM 1065 O PHE A 69 -1.117 2.571 -5.529 1.00 15.00 O ATOM 1066 CB PHE A 69 1.110 0.793 -4.070 1.00 15.00 C ATOM 1067 CG PHE A 69 1.941 0.208 -2.960 1.00 15.00 C ATOM 1068 CD1 PHE A 69 3.096 0.845 -2.532 1.00 15.00 C ATOM 1069 CD2 PHE A 69 1.570 -0.980 -2.347 1.00 15.00 C ATOM 1070 CE1 PHE A 69 3.864 0.312 -1.515 1.00 15.00 C ATOM 1071 CE2 PHE A 69 2.334 -1.517 -1.328 1.00 15.00 C ATOM 1072 CZ PHE A 69 3.483 -0.871 -0.911 1.00 15.00 C ATOM 0 H PHE A 69 -1.225 0.007 -3.685 1.00 15.00 H new ATOM 0 HA PHE A 69 0.321 2.195 -2.660 1.00 15.00 H new ATOM 0 HB2 PHE A 69 0.675 -0.019 -4.653 1.00 15.00 H new ATOM 0 HB3 PHE A 69 1.760 1.355 -4.741 1.00 15.00 H new ATOM 0 HD1 PHE A 69 3.399 1.770 -3.000 1.00 15.00 H new ATOM 0 HD2 PHE A 69 0.675 -1.491 -2.669 1.00 15.00 H new ATOM 0 HE1 PHE A 69 4.761 0.819 -1.192 1.00 15.00 H new ATOM 0 HE2 PHE A 69 2.033 -2.441 -0.857 1.00 15.00 H new ATOM 0 HZ PHE A 69 4.081 -1.290 -0.115 1.00 15.00 H new ATOM 1082 N THR A 70 0.302 3.943 -4.470 1.00 15.00 N ATOM 1083 CA THR A 70 0.075 5.053 -5.380 1.00 15.00 C ATOM 1084 C THR A 70 1.115 5.087 -6.494 1.00 15.00 C ATOM 1085 O THR A 70 2.027 4.263 -6.525 1.00 15.00 O ATOM 1086 CB THR A 70 0.104 6.381 -4.605 1.00 15.00 C ATOM 1087 OG1 THR A 70 0.680 6.172 -3.309 1.00 15.00 O ATOM 1088 CG2 THR A 70 -1.297 6.942 -4.447 1.00 15.00 C ATOM 0 H THR A 70 0.973 4.138 -3.727 1.00 15.00 H new ATOM 0 HA THR A 70 -0.905 4.914 -5.836 1.00 15.00 H new ATOM 0 HB THR A 70 0.707 7.094 -5.167 1.00 15.00 H new ATOM 0 HG1 THR A 70 1.646 6.329 -3.351 1.00 15.00 H new ATOM 0 HG21 THR A 70 -1.253 7.881 -3.896 1.00 15.00 H new ATOM 0 HG22 THR A 70 -1.731 7.119 -5.431 1.00 15.00 H new ATOM 0 HG23 THR A 70 -1.915 6.229 -3.900 1.00 15.00 H new ATOM 1096 N THR A 71 0.961 6.026 -7.418 1.00 15.00 N ATOM 1097 CA THR A 71 1.902 6.173 -8.518 1.00 15.00 C ATOM 1098 C THR A 71 2.687 7.469 -8.354 1.00 15.00 C ATOM 1099 O THR A 71 3.478 7.858 -9.215 1.00 15.00 O ATOM 1100 CB THR A 71 1.185 6.171 -9.887 1.00 15.00 C ATOM 1101 OG1 THR A 71 -0.205 6.483 -9.722 1.00 15.00 O ATOM 1102 CG2 THR A 71 1.324 4.819 -10.565 1.00 15.00 C ATOM 0 H THR A 71 0.193 6.697 -7.427 1.00 15.00 H new ATOM 0 HA THR A 71 2.581 5.321 -8.493 1.00 15.00 H new ATOM 0 HB THR A 71 1.653 6.930 -10.514 1.00 15.00 H new ATOM 0 HG1 THR A 71 -0.704 6.177 -10.508 1.00 15.00 H new ATOM 0 HG21 THR A 71 0.812 4.840 -11.527 1.00 15.00 H new ATOM 0 HG22 THR A 71 2.380 4.597 -10.721 1.00 15.00 H new ATOM 0 HG23 THR A 71 0.880 4.048 -9.935 1.00 15.00 H new ATOM 1110 N ASP A 72 2.448 8.125 -7.231 1.00 15.00 N ATOM 1111 CA ASP A 72 3.096 9.383 -6.908 1.00 15.00 C ATOM 1112 C ASP A 72 4.452 9.130 -6.267 1.00 15.00 C ATOM 1113 O ASP A 72 4.557 8.358 -5.319 1.00 15.00 O ATOM 1114 CB ASP A 72 2.216 10.188 -5.950 1.00 15.00 C ATOM 1115 CG ASP A 72 0.850 10.498 -6.531 1.00 15.00 C ATOM 1116 OD1 ASP A 72 0.529 11.692 -6.693 1.00 15.00 O ATOM 1117 OD2 ASP A 72 0.094 9.550 -6.836 1.00 15.00 O1- ATOM 0 H ASP A 72 1.797 7.799 -6.516 1.00 15.00 H new ATOM 0 HA ASP A 72 3.241 9.948 -7.829 1.00 15.00 H new ATOM 0 HB2 ASP A 72 2.093 9.631 -5.021 1.00 15.00 H new ATOM 0 HB3 ASP A 72 2.720 11.121 -5.698 1.00 15.00 H new ATOM 1122 N PRO A 73 5.512 9.792 -6.759 1.00 15.00 N ATOM 1123 CA PRO A 73 6.868 9.618 -6.222 1.00 15.00 C ATOM 1124 C PRO A 73 7.000 10.109 -4.780 1.00 15.00 C ATOM 1125 O PRO A 73 7.985 9.815 -4.100 1.00 15.00 O ATOM 1126 CB PRO A 73 7.743 10.474 -7.148 1.00 15.00 C ATOM 1127 CG PRO A 73 6.906 10.772 -8.344 1.00 15.00 C ATOM 1128 CD PRO A 73 5.481 10.751 -7.876 1.00 15.00 C ATOM 0 HA PRO A 73 7.150 8.565 -6.195 1.00 15.00 H new ATOM 0 HB2 PRO A 73 8.055 11.393 -6.651 1.00 15.00 H new ATOM 0 HB3 PRO A 73 8.651 9.941 -7.430 1.00 15.00 H new ATOM 0 HG2 PRO A 73 7.162 11.744 -8.766 1.00 15.00 H new ATOM 0 HG3 PRO A 73 7.069 10.032 -9.127 1.00 15.00 H new ATOM 0 HD2 PRO A 73 5.148 11.737 -7.552 1.00 15.00 H new ATOM 0 HD3 PRO A 73 4.802 10.429 -8.665 1.00 15.00 H new ATOM 1136 N ASN A 74 6.005 10.853 -4.317 1.00 15.00 N ATOM 1137 CA ASN A 74 6.019 11.394 -2.963 1.00 15.00 C ATOM 1138 C ASN A 74 5.007 10.687 -2.062 1.00 15.00 C ATOM 1139 O ASN A 74 4.873 11.029 -0.889 1.00 15.00 O ATOM 1140 CB ASN A 74 5.742 12.908 -2.974 1.00 15.00 C ATOM 1141 CG ASN A 74 4.505 13.287 -3.769 1.00 15.00 C ATOM 1142 OD1 ASN A 74 3.558 12.510 -3.890 1.00 15.00 O ATOM 1143 ND2 ASN A 74 4.507 14.487 -4.321 1.00 15.00 N ATOM 0 H ASN A 74 5.176 11.097 -4.859 1.00 15.00 H new ATOM 0 HA ASN A 74 7.016 11.218 -2.558 1.00 15.00 H new ATOM 0 HB2 ASN A 74 5.627 13.257 -1.948 1.00 15.00 H new ATOM 0 HB3 ASN A 74 6.606 13.425 -3.391 1.00 15.00 H new ATOM 0 HD21 ASN A 74 3.705 14.797 -4.870 1.00 15.00 H new ATOM 0 HD22 ASN A 74 5.310 15.103 -4.199 1.00 15.00 H new ATOM 1150 N LYS A 75 4.305 9.696 -2.601 1.00 15.00 N ATOM 1151 CA LYS A 75 3.307 8.964 -1.828 1.00 15.00 C ATOM 1152 C LYS A 75 3.483 7.461 -2.005 1.00 15.00 C ATOM 1153 O LYS A 75 3.298 6.932 -3.100 1.00 15.00 O ATOM 1154 CB LYS A 75 1.896 9.379 -2.256 1.00 15.00 C ATOM 1155 CG LYS A 75 1.075 10.020 -1.147 1.00 15.00 C ATOM 1156 CD LYS A 75 1.579 11.412 -0.809 1.00 15.00 C ATOM 1157 CE LYS A 75 0.680 12.101 0.203 1.00 15.00 C ATOM 1158 NZ LYS A 75 0.659 11.393 1.512 1.00 15.00 N1+ ATOM 0 H LYS A 75 4.407 9.382 -3.566 1.00 15.00 H new ATOM 0 HA LYS A 75 3.446 9.208 -0.775 1.00 15.00 H new ATOM 0 HB2 LYS A 75 1.971 10.078 -3.089 1.00 15.00 H new ATOM 0 HB3 LYS A 75 1.366 8.501 -2.624 1.00 15.00 H new ATOM 0 HG2 LYS A 75 0.030 10.075 -1.453 1.00 15.00 H new ATOM 0 HG3 LYS A 75 1.113 9.393 -0.256 1.00 15.00 H new ATOM 0 HD2 LYS A 75 2.592 11.346 -0.412 1.00 15.00 H new ATOM 0 HD3 LYS A 75 1.631 12.011 -1.718 1.00 15.00 H new ATOM 0 HE2 LYS A 75 1.022 13.125 0.352 1.00 15.00 H new ATOM 0 HE3 LYS A 75 -0.334 12.158 -0.194 1.00 15.00 H new ATOM 0 HZ1 LYS A 75 0.462 12.075 2.272 1.00 15.00 H new ATOM 0 HZ2 LYS A 75 -0.082 10.663 1.500 1.00 15.00 H new ATOM 0 HZ3 LYS A 75 1.583 10.946 1.680 1.00 15.00 H new ATOM 1172 N ARG A 76 3.833 6.781 -0.920 1.00 15.00 N ATOM 1173 CA ARG A 76 4.041 5.336 -0.951 1.00 15.00 C ATOM 1174 C ARG A 76 2.713 4.620 -1.175 1.00 15.00 C ATOM 1175 O ARG A 76 2.504 3.963 -2.195 1.00 15.00 O ATOM 1176 CB ARG A 76 4.670 4.865 0.364 1.00 15.00 C ATOM 1177 CG ARG A 76 5.847 5.711 0.822 1.00 15.00 C ATOM 1178 CD ARG A 76 7.175 5.131 0.364 1.00 15.00 C ATOM 1179 NE ARG A 76 7.559 3.961 1.148 1.00 15.00 N ATOM 1180 CZ ARG A 76 8.801 3.481 1.221 1.00 15.00 C ATOM 1181 NH1 ARG A 76 9.791 4.070 0.557 1.00 15.00 N1+ ATOM 1182 NH2 ARG A 76 9.048 2.396 1.939 1.00 15.00 N ATOM 0 H ARG A 76 3.979 7.207 -0.005 1.00 15.00 H new ATOM 0 HA ARG A 76 4.716 5.098 -1.773 1.00 15.00 H new ATOM 0 HB2 ARG A 76 3.907 4.870 1.142 1.00 15.00 H new ATOM 0 HB3 ARG A 76 5.000 3.833 0.248 1.00 15.00 H new ATOM 0 HG2 ARG A 76 5.740 6.723 0.433 1.00 15.00 H new ATOM 0 HG3 ARG A 76 5.839 5.785 1.909 1.00 15.00 H new ATOM 0 HD2 ARG A 76 7.107 4.856 -0.689 1.00 15.00 H new ATOM 0 HD3 ARG A 76 7.951 5.892 0.445 1.00 15.00 H new ATOM 0 HE ARG A 76 6.830 3.479 1.674 1.00 15.00 H new ATOM 0 HH11 ARG A 76 9.603 4.895 -0.013 1.00 15.00 H new ATOM 0 HH12 ARG A 76 10.738 3.697 0.618 1.00 15.00 H new ATOM 0 HH21 ARG A 76 8.289 1.929 2.435 1.00 15.00 H new ATOM 0 HH22 ARG A 76 9.997 2.027 1.996 1.00 15.00 H new ATOM 1196 N TRP A 77 1.812 4.772 -0.218 1.00 15.00 N ATOM 1197 CA TRP A 77 0.491 4.171 -0.296 1.00 15.00 C ATOM 1198 C TRP A 77 -0.473 4.954 0.578 1.00 15.00 C ATOM 1199 O TRP A 77 -0.083 5.488 1.619 1.00 15.00 O ATOM 1200 CB TRP A 77 0.510 2.682 0.107 1.00 15.00 C ATOM 1201 CG TRP A 77 1.236 2.369 1.391 1.00 15.00 C ATOM 1202 CD1 TRP A 77 2.515 1.897 1.515 1.00 15.00 C ATOM 1203 CD2 TRP A 77 0.723 2.473 2.731 1.00 15.00 C ATOM 1204 NE1 TRP A 77 2.823 1.706 2.840 1.00 15.00 N ATOM 1205 CE2 TRP A 77 1.746 2.055 3.604 1.00 15.00 C ATOM 1206 CE3 TRP A 77 -0.497 2.881 3.278 1.00 15.00 C ATOM 1207 CZ2 TRP A 77 1.587 2.033 4.987 1.00 15.00 C ATOM 1208 CZ3 TRP A 77 -0.652 2.862 4.651 1.00 15.00 C ATOM 1209 CH2 TRP A 77 0.385 2.440 5.492 1.00 15.00 C ATOM 0 H TRP A 77 1.975 5.313 0.631 1.00 15.00 H new ATOM 0 HA TRP A 77 0.157 4.213 -1.333 1.00 15.00 H new ATOM 0 HB2 TRP A 77 -0.519 2.334 0.197 1.00 15.00 H new ATOM 0 HB3 TRP A 77 0.970 2.111 -0.699 1.00 15.00 H new ATOM 0 HD1 TRP A 77 3.185 1.703 0.690 1.00 15.00 H new ATOM 0 HE1 TRP A 77 3.714 1.359 3.196 1.00 15.00 H new ATOM 0 HE3 TRP A 77 -1.305 3.205 2.639 1.00 15.00 H new ATOM 0 HZ2 TRP A 77 2.385 1.706 5.637 1.00 15.00 H new ATOM 0 HZ3 TRP A 77 -1.590 3.178 5.083 1.00 15.00 H new ATOM 0 HH2 TRP A 77 0.231 2.436 6.561 1.00 15.00 H new ATOM 1220 N GLU A 78 -1.721 5.040 0.155 1.00 15.00 N ATOM 1221 CA GLU A 78 -2.723 5.770 0.911 1.00 15.00 C ATOM 1222 C GLU A 78 -3.943 4.896 1.169 1.00 15.00 C ATOM 1223 O GLU A 78 -4.168 3.903 0.474 1.00 15.00 O ATOM 1224 CB GLU A 78 -3.132 7.055 0.175 1.00 15.00 C ATOM 1225 CG GLU A 78 -2.015 8.081 0.048 1.00 15.00 C ATOM 1226 CD GLU A 78 -1.507 8.569 1.392 1.00 15.00 C ATOM 1227 OE1 GLU A 78 -0.319 8.943 1.483 1.00 15.00 O ATOM 1228 OE2 GLU A 78 -2.291 8.581 2.364 1.00 15.00 O1- ATOM 0 H GLU A 78 -2.065 4.615 -0.706 1.00 15.00 H new ATOM 0 HA GLU A 78 -2.287 6.048 1.871 1.00 15.00 H new ATOM 0 HB2 GLU A 78 -3.485 6.793 -0.822 1.00 15.00 H new ATOM 0 HB3 GLU A 78 -3.971 7.511 0.701 1.00 15.00 H new ATOM 0 HG2 GLU A 78 -1.188 7.643 -0.510 1.00 15.00 H new ATOM 0 HG3 GLU A 78 -2.374 8.932 -0.530 1.00 15.00 H new ATOM 1235 N TYR A 79 -4.722 5.278 2.167 1.00 15.00 N ATOM 1236 CA TYR A 79 -5.927 4.552 2.543 1.00 15.00 C ATOM 1237 C TYR A 79 -7.096 4.956 1.656 1.00 15.00 C ATOM 1238 O TYR A 79 -7.051 5.986 0.979 1.00 15.00 O ATOM 1239 CB TYR A 79 -6.295 4.834 4.001 1.00 15.00 C ATOM 1240 CG TYR A 79 -5.313 4.307 5.026 1.00 15.00 C ATOM 1241 CD1 TYR A 79 -4.383 5.150 5.626 1.00 15.00 C ATOM 1242 CD2 TYR A 79 -5.335 2.974 5.417 1.00 15.00 C ATOM 1243 CE1 TYR A 79 -3.506 4.679 6.586 1.00 15.00 C ATOM 1244 CE2 TYR A 79 -4.456 2.494 6.372 1.00 15.00 C ATOM 1245 CZ TYR A 79 -3.546 3.351 6.953 1.00 15.00 C ATOM 1246 OH TYR A 79 -2.681 2.883 7.918 1.00 15.00 O ATOM 0 H TYR A 79 -4.538 6.101 2.741 1.00 15.00 H new ATOM 0 HA TYR A 79 -5.724 3.488 2.417 1.00 15.00 H new ATOM 0 HB2 TYR A 79 -6.391 5.912 4.133 1.00 15.00 H new ATOM 0 HB3 TYR A 79 -7.274 4.400 4.203 1.00 15.00 H new ATOM 0 HD1 TYR A 79 -4.345 6.190 5.337 1.00 15.00 H new ATOM 0 HD2 TYR A 79 -6.050 2.301 4.968 1.00 15.00 H new ATOM 0 HE1 TYR A 79 -2.794 5.348 7.046 1.00 15.00 H new ATOM 0 HE2 TYR A 79 -4.483 1.454 6.661 1.00 15.00 H new ATOM 0 HH TYR A 79 -2.838 1.926 8.062 1.00 15.00 H new ATOM 1256 N CYS A 80 -8.132 4.135 1.643 1.00 15.00 N ATOM 1257 CA CYS A 80 -9.327 4.425 0.868 1.00 15.00 C ATOM 1258 C CYS A 80 -10.510 4.564 1.821 1.00 15.00 C ATOM 1259 O CYS A 80 -10.530 3.947 2.889 1.00 15.00 O ATOM 1260 CB CYS A 80 -9.585 3.321 -0.158 1.00 15.00 C ATOM 1261 SG CYS A 80 -8.244 3.114 -1.351 1.00 15.00 S ATOM 0 H CYS A 80 -8.170 3.258 2.163 1.00 15.00 H new ATOM 0 HA CYS A 80 -9.190 5.358 0.321 1.00 15.00 H new ATOM 0 HB2 CYS A 80 -9.742 2.379 0.367 1.00 15.00 H new ATOM 0 HB3 CYS A 80 -10.507 3.544 -0.695 1.00 15.00 H new ATOM 0 HG CYS A 80 -8.009 1.847 -1.524 1.00 15.00 H new ATOM 1267 N ASP A 81 -11.478 5.390 1.457 1.00 15.00 N ATOM 1268 CA ASP A 81 -12.636 5.614 2.311 1.00 15.00 C ATOM 1269 C ASP A 81 -13.900 5.020 1.704 1.00 15.00 C ATOM 1270 O ASP A 81 -14.398 5.497 0.684 1.00 15.00 O ATOM 1271 CB ASP A 81 -12.825 7.109 2.561 1.00 15.00 C ATOM 1272 CG ASP A 81 -13.787 7.384 3.697 1.00 15.00 C ATOM 1273 OD1 ASP A 81 -13.484 6.988 4.842 1.00 15.00 O ATOM 1274 OD2 ASP A 81 -14.847 7.997 3.452 1.00 15.00 O1- ATOM 0 H ASP A 81 -11.487 5.914 0.582 1.00 15.00 H new ATOM 0 HA ASP A 81 -12.453 5.111 3.261 1.00 15.00 H new ATOM 0 HB2 ASP A 81 -11.860 7.562 2.787 1.00 15.00 H new ATOM 0 HB3 ASP A 81 -13.195 7.583 1.652 1.00 15.00 H new ATOM 1279 N ILE A 82 -14.403 3.963 2.324 1.00 15.00 N ATOM 1280 CA ILE A 82 -15.613 3.306 1.851 1.00 15.00 C ATOM 1281 C ILE A 82 -16.623 3.188 2.992 1.00 15.00 C ATOM 1282 O ILE A 82 -16.272 2.757 4.092 1.00 15.00 O ATOM 1283 CB ILE A 82 -15.322 1.897 1.281 1.00 15.00 C ATOM 1284 CG1 ILE A 82 -13.990 1.881 0.522 1.00 15.00 C ATOM 1285 CG2 ILE A 82 -16.452 1.451 0.365 1.00 15.00 C ATOM 1286 CD1 ILE A 82 -13.618 0.521 -0.035 1.00 15.00 C ATOM 0 H ILE A 82 -13.992 3.541 3.157 1.00 15.00 H new ATOM 0 HA ILE A 82 -16.022 3.919 1.048 1.00 15.00 H new ATOM 0 HB ILE A 82 -15.251 1.201 2.117 1.00 15.00 H new ATOM 0 HG12 ILE A 82 -14.042 2.597 -0.298 1.00 15.00 H new ATOM 0 HG13 ILE A 82 -13.198 2.218 1.190 1.00 15.00 H new ATOM 0 HG21 ILE A 82 -16.232 0.458 -0.028 1.00 15.00 H new ATOM 0 HG22 ILE A 82 -17.385 1.420 0.927 1.00 15.00 H new ATOM 0 HG23 ILE A 82 -16.549 2.155 -0.462 1.00 15.00 H new ATOM 0 HD11 ILE A 82 -12.664 0.591 -0.558 1.00 15.00 H new ATOM 0 HD12 ILE A 82 -13.533 -0.196 0.782 1.00 15.00 H new ATOM 0 HD13 ILE A 82 -14.389 0.189 -0.730 1.00 15.00 H new ATOM 1298 N PRO A 83 -17.882 3.590 2.753 1.00 15.00 N ATOM 1299 CA PRO A 83 -18.943 3.534 3.768 1.00 15.00 C ATOM 1300 C PRO A 83 -19.210 2.116 4.276 1.00 15.00 C ATOM 1301 O PRO A 83 -19.459 1.197 3.496 1.00 15.00 O ATOM 1302 CB PRO A 83 -20.176 4.070 3.031 1.00 15.00 C ATOM 1303 CG PRO A 83 -19.856 3.957 1.584 1.00 15.00 C ATOM 1304 CD PRO A 83 -18.374 4.138 1.477 1.00 15.00 C ATOM 0 HA PRO A 83 -18.671 4.105 4.656 1.00 15.00 H new ATOM 0 HB2 PRO A 83 -21.065 3.492 3.282 1.00 15.00 H new ATOM 0 HB3 PRO A 83 -20.380 5.104 3.308 1.00 15.00 H new ATOM 0 HG2 PRO A 83 -20.161 2.987 1.191 1.00 15.00 H new ATOM 0 HG3 PRO A 83 -20.385 4.715 1.006 1.00 15.00 H new ATOM 0 HD2 PRO A 83 -17.962 3.602 0.622 1.00 15.00 H new ATOM 0 HD3 PRO A 83 -18.103 5.187 1.357 1.00 15.00 H new ATOM 1312 N ARG A 84 -19.153 1.947 5.588 1.00 15.00 N ATOM 1313 CA ARG A 84 -19.390 0.651 6.207 1.00 15.00 C ATOM 1314 C ARG A 84 -20.769 0.629 6.862 1.00 15.00 C ATOM 1315 O ARG A 84 -21.354 1.683 7.117 1.00 15.00 O ATOM 1316 CB ARG A 84 -18.308 0.334 7.247 1.00 15.00 C ATOM 1317 CG ARG A 84 -18.332 1.255 8.459 1.00 15.00 C ATOM 1318 CD ARG A 84 -17.207 2.279 8.414 1.00 15.00 C ATOM 1319 NE ARG A 84 -17.484 3.426 9.280 1.00 15.00 N ATOM 1320 CZ ARG A 84 -16.631 4.427 9.503 1.00 15.00 C ATOM 1321 NH1 ARG A 84 -15.437 4.433 8.927 1.00 15.00 N1+ ATOM 1322 NH2 ARG A 84 -16.983 5.427 10.305 1.00 15.00 N ATOM 0 H ARG A 84 -18.943 2.696 6.248 1.00 15.00 H new ATOM 0 HA ARG A 84 -19.350 -0.112 5.430 1.00 15.00 H new ATOM 0 HB2 ARG A 84 -18.430 -0.696 7.582 1.00 15.00 H new ATOM 0 HB3 ARG A 84 -17.330 0.400 6.771 1.00 15.00 H new ATOM 0 HG2 ARG A 84 -19.291 1.771 8.504 1.00 15.00 H new ATOM 0 HG3 ARG A 84 -18.246 0.661 9.369 1.00 15.00 H new ATOM 0 HD2 ARG A 84 -16.274 1.808 8.722 1.00 15.00 H new ATOM 0 HD3 ARG A 84 -17.068 2.622 7.389 1.00 15.00 H new ATOM 0 HE ARG A 84 -18.391 3.462 9.745 1.00 15.00 H new ATOM 0 HH11 ARG A 84 -15.165 3.669 8.309 1.00 15.00 H new ATOM 0 HH12 ARG A 84 -14.790 5.202 9.102 1.00 15.00 H new ATOM 0 HH21 ARG A 84 -17.902 5.427 10.747 1.00 15.00 H new ATOM 0 HH22 ARG A 84 -16.334 6.194 10.478 1.00 15.00 H new ATOM 1336 N CYS A 85 -21.280 -0.565 7.131 1.00 15.00 N ATOM 1337 CA CYS A 85 -22.585 -0.716 7.766 1.00 15.00 C ATOM 1338 C CYS A 85 -22.553 -0.174 9.197 1.00 15.00 C ATOM 1339 O CYS A 85 -21.481 -0.045 9.795 1.00 15.00 O ATOM 1340 CB CYS A 85 -23.003 -2.186 7.773 1.00 15.00 C ATOM 1341 SG CYS A 85 -23.011 -2.959 6.136 1.00 15.00 S ATOM 0 H CYS A 85 -20.811 -1.445 6.919 1.00 15.00 H new ATOM 0 HA CYS A 85 -23.314 -0.143 7.193 1.00 15.00 H new ATOM 0 HB2 CYS A 85 -22.327 -2.742 8.422 1.00 15.00 H new ATOM 0 HB3 CYS A 85 -24.000 -2.267 8.206 1.00 15.00 H new ATOM 0 HG CYS A 85 -21.798 -3.004 5.671 1.00 15.00 H new ATOM 1347 N ALA A 86 -23.723 0.161 9.729 1.00 15.00 N ATOM 1348 CA ALA A 86 -23.825 0.689 11.084 1.00 15.00 C ATOM 1349 C ALA A 86 -23.400 -0.349 12.114 1.00 15.00 C ATOM 1350 O ALA A 86 -22.777 -0.016 13.122 1.00 15.00 O ATOM 1351 CB ALA A 86 -25.241 1.165 11.363 1.00 15.00 C ATOM 0 H ALA A 86 -24.615 0.076 9.242 1.00 15.00 H new ATOM 0 HA ALA A 86 -23.147 1.539 11.165 1.00 15.00 H new ATOM 0 HB1 ALA A 86 -25.300 1.556 12.379 1.00 15.00 H new ATOM 0 HB2 ALA A 86 -25.507 1.951 10.656 1.00 15.00 H new ATOM 0 HB3 ALA A 86 -25.933 0.330 11.255 1.00 15.00 H new ATOM 1357 N ALA A 87 -23.737 -1.605 11.858 1.00 15.00 N ATOM 1358 CA ALA A 87 -23.382 -2.686 12.761 1.00 15.00 C ATOM 1359 C ALA A 87 -22.036 -3.285 12.378 1.00 15.00 C ATOM 1360 O ALA A 87 -22.018 -4.288 11.633 1.00 15.00 O ATOM 1361 CB ALA A 87 -24.462 -3.754 12.760 1.00 15.00 C ATOM 1362 OXT ALA A 87 -20.996 -2.743 12.812 1.00 15.00 O1- ATOM 0 H ALA A 87 -24.256 -1.899 11.031 1.00 15.00 H new ATOM 0 HA ALA A 87 -23.300 -2.279 13.769 1.00 15.00 H new ATOM 0 HB1 ALA A 87 -24.181 -4.557 13.442 1.00 15.00 H new ATOM 0 HB2 ALA A 87 -25.406 -3.317 13.084 1.00 15.00 H new ATOM 0 HB3 ALA A 87 -24.575 -4.156 11.753 1.00 15.00 H new ATOM 1369 N GLY B 101 20.755 3.455 -14.767 1.00 15.00 N ATOM 1370 CA GLY B 101 19.913 2.357 -14.238 1.00 15.00 C ATOM 1371 C GLY B 101 18.701 2.884 -13.506 1.00 15.00 C ATOM 1372 O GLY B 101 18.324 4.043 -13.678 1.00 15.00 O ATOM 0 HA2 GLY B 101 19.592 1.717 -15.060 1.00 15.00 H new ATOM 0 HA3 GLY B 101 20.504 1.738 -13.564 1.00 15.00 H new ATOM 1378 N SER B 102 18.092 2.036 -12.691 1.00 15.00 N ATOM 1379 CA SER B 102 16.914 2.417 -11.926 1.00 15.00 C ATOM 1380 C SER B 102 17.312 3.094 -10.613 1.00 15.00 C ATOM 1381 O SER B 102 18.498 3.327 -10.360 1.00 15.00 O ATOM 1382 CB SER B 102 16.050 1.182 -11.659 1.00 15.00 C ATOM 1383 OG SER B 102 15.724 0.519 -12.875 1.00 15.00 O ATOM 0 H SER B 102 18.396 1.074 -12.542 1.00 15.00 H new ATOM 0 HA SER B 102 16.335 3.135 -12.507 1.00 15.00 H new ATOM 0 HB2 SER B 102 16.581 0.497 -10.998 1.00 15.00 H new ATOM 0 HB3 SER B 102 15.136 1.477 -11.144 1.00 15.00 H new ATOM 0 HG SER B 102 15.173 -0.268 -12.681 1.00 15.00 H new ATOM 1389 N VAL B 103 16.319 3.418 -9.792 1.00 15.00 N ATOM 1390 CA VAL B 103 16.565 4.065 -8.511 1.00 15.00 C ATOM 1391 C VAL B 103 17.295 3.125 -7.544 1.00 15.00 C ATOM 1392 O VAL B 103 16.709 2.205 -6.966 1.00 15.00 O ATOM 1393 CB VAL B 103 15.252 4.593 -7.875 1.00 15.00 C ATOM 1394 CG1 VAL B 103 14.186 3.509 -7.815 1.00 15.00 C ATOM 1395 CG2 VAL B 103 15.511 5.166 -6.489 1.00 15.00 C ATOM 0 H VAL B 103 15.334 3.242 -9.993 1.00 15.00 H new ATOM 0 HA VAL B 103 17.210 4.923 -8.703 1.00 15.00 H new ATOM 0 HB VAL B 103 14.878 5.393 -8.514 1.00 15.00 H new ATOM 0 HG11 VAL B 103 13.280 3.914 -7.364 1.00 15.00 H new ATOM 0 HG12 VAL B 103 13.964 3.160 -8.824 1.00 15.00 H new ATOM 0 HG13 VAL B 103 14.549 2.675 -7.214 1.00 15.00 H new ATOM 0 HG21 VAL B 103 14.575 5.529 -6.065 1.00 15.00 H new ATOM 0 HG22 VAL B 103 15.924 4.389 -5.845 1.00 15.00 H new ATOM 0 HG23 VAL B 103 16.220 5.991 -6.563 1.00 15.00 H new ATOM 1405 N GLU B 104 18.591 3.351 -7.399 1.00 15.00 N ATOM 1406 CA GLU B 104 19.413 2.550 -6.508 1.00 15.00 C ATOM 1407 C GLU B 104 20.061 3.444 -5.461 1.00 15.00 C ATOM 1408 O GLU B 104 21.092 3.101 -4.882 1.00 15.00 O ATOM 1409 CB GLU B 104 20.481 1.787 -7.295 1.00 15.00 C ATOM 1410 CG GLU B 104 19.920 0.661 -8.151 1.00 15.00 C ATOM 1411 CD GLU B 104 20.982 -0.330 -8.576 1.00 15.00 C ATOM 1412 OE1 GLU B 104 21.243 -0.450 -9.795 1.00 15.00 O ATOM 1413 OE2 GLU B 104 21.563 -0.997 -7.695 1.00 15.00 O1- ATOM 0 H GLU B 104 19.098 4.087 -7.890 1.00 15.00 H new ATOM 0 HA GLU B 104 18.777 1.820 -6.007 1.00 15.00 H new ATOM 0 HB2 GLU B 104 21.017 2.487 -7.936 1.00 15.00 H new ATOM 0 HB3 GLU B 104 21.208 1.373 -6.597 1.00 15.00 H new ATOM 0 HG2 GLU B 104 19.143 0.138 -7.594 1.00 15.00 H new ATOM 0 HG3 GLU B 104 19.447 1.084 -9.037 1.00 15.00 H new ATOM 1420 N LYS B 105 19.432 4.591 -5.223 1.00 15.00 N ATOM 1421 CA LYS B 105 19.917 5.557 -4.246 1.00 15.00 C ATOM 1422 C LYS B 105 19.989 4.923 -2.860 1.00 15.00 C ATOM 1423 O LYS B 105 21.041 4.907 -2.223 1.00 15.00 O ATOM 1424 CB LYS B 105 18.992 6.773 -4.221 1.00 15.00 C ATOM 1425 CG LYS B 105 19.559 7.966 -3.476 1.00 15.00 C ATOM 1426 CD LYS B 105 18.611 9.151 -3.523 1.00 15.00 C ATOM 1427 CE LYS B 105 19.214 10.364 -2.843 1.00 15.00 C ATOM 1428 NZ LYS B 105 18.256 11.498 -2.775 1.00 15.00 N1+ ATOM 0 H LYS B 105 18.576 4.875 -5.700 1.00 15.00 H new ATOM 0 HA LYS B 105 20.920 5.875 -4.532 1.00 15.00 H new ATOM 0 HB2 LYS B 105 18.772 7.070 -5.246 1.00 15.00 H new ATOM 0 HB3 LYS B 105 18.046 6.487 -3.761 1.00 15.00 H new ATOM 0 HG2 LYS B 105 19.750 7.692 -2.438 1.00 15.00 H new ATOM 0 HG3 LYS B 105 20.517 8.247 -3.913 1.00 15.00 H new ATOM 0 HD2 LYS B 105 18.377 9.391 -4.560 1.00 15.00 H new ATOM 0 HD3 LYS B 105 17.672 8.888 -3.037 1.00 15.00 H new ATOM 0 HE2 LYS B 105 19.529 10.095 -1.835 1.00 15.00 H new ATOM 0 HE3 LYS B 105 20.107 10.676 -3.384 1.00 15.00 H new ATOM 0 HZ1 LYS B 105 18.488 12.100 -1.959 1.00 15.00 H new ATOM 0 HZ2 LYS B 105 18.320 12.059 -3.648 1.00 15.00 H new ATOM 0 HZ3 LYS B 105 17.289 11.130 -2.670 1.00 15.00 H new ATOM 1442 N LEU B 106 18.864 4.391 -2.411 1.00 15.00 N ATOM 1443 CA LEU B 106 18.796 3.738 -1.115 1.00 15.00 C ATOM 1444 C LEU B 106 18.854 2.227 -1.307 1.00 15.00 C ATOM 1445 O LEU B 106 17.895 1.509 -1.016 1.00 15.00 O ATOM 1446 CB LEU B 106 17.517 4.140 -0.365 1.00 15.00 C ATOM 1447 CG LEU B 106 17.686 5.237 0.698 1.00 15.00 C ATOM 1448 CD1 LEU B 106 18.760 4.853 1.707 1.00 15.00 C ATOM 1449 CD2 LEU B 106 18.015 6.571 0.047 1.00 15.00 C ATOM 0 H LEU B 106 17.984 4.399 -2.926 1.00 15.00 H new ATOM 0 HA LEU B 106 19.647 4.057 -0.512 1.00 15.00 H new ATOM 0 HB2 LEU B 106 16.780 4.477 -1.095 1.00 15.00 H new ATOM 0 HB3 LEU B 106 17.106 3.253 0.117 1.00 15.00 H new ATOM 0 HG LEU B 106 16.741 5.340 1.231 1.00 15.00 H new ATOM 0 HD11 LEU B 106 18.862 5.645 2.449 1.00 15.00 H new ATOM 0 HD12 LEU B 106 18.478 3.924 2.203 1.00 15.00 H new ATOM 0 HD13 LEU B 106 19.711 4.715 1.192 1.00 15.00 H new ATOM 0 HD21 LEU B 106 18.130 7.333 0.818 1.00 15.00 H new ATOM 0 HD22 LEU B 106 18.944 6.482 -0.517 1.00 15.00 H new ATOM 0 HD23 LEU B 106 17.207 6.856 -0.627 1.00 15.00 H new ATOM 1461 N THR B 107 19.989 1.759 -1.813 1.00 15.00 N ATOM 1462 CA THR B 107 20.206 0.342 -2.080 1.00 15.00 C ATOM 1463 C THR B 107 20.188 -0.484 -0.796 1.00 15.00 C ATOM 1464 O THR B 107 19.660 -1.597 -0.769 1.00 15.00 O ATOM 1465 CB THR B 107 21.549 0.145 -2.796 1.00 15.00 C ATOM 1466 OG1 THR B 107 22.169 1.422 -3.001 1.00 15.00 O ATOM 1467 CG2 THR B 107 21.344 -0.542 -4.135 1.00 15.00 C ATOM 0 H THR B 107 20.785 2.351 -2.050 1.00 15.00 H new ATOM 0 HA THR B 107 19.391 -0.003 -2.716 1.00 15.00 H new ATOM 0 HB THR B 107 22.190 -0.483 -2.177 1.00 15.00 H new ATOM 0 HG1 THR B 107 21.735 1.880 -3.751 1.00 15.00 H new ATOM 0 HG21 THR B 107 22.307 -0.673 -4.628 1.00 15.00 H new ATOM 0 HG22 THR B 107 20.882 -1.516 -3.977 1.00 15.00 H new ATOM 0 HG23 THR B 107 20.696 0.070 -4.762 1.00 15.00 H new ATOM 1475 N ALA B 108 20.748 0.076 0.270 1.00 15.00 N ATOM 1476 CA ALA B 108 20.798 -0.602 1.560 1.00 15.00 C ATOM 1477 C ALA B 108 19.392 -0.830 2.106 1.00 15.00 C ATOM 1478 O ALA B 108 19.091 -1.883 2.668 1.00 15.00 O ATOM 1479 CB ALA B 108 21.627 0.205 2.548 1.00 15.00 C ATOM 0 H ALA B 108 21.176 1.002 0.266 1.00 15.00 H new ATOM 0 HA ALA B 108 21.270 -1.574 1.419 1.00 15.00 H new ATOM 0 HB1 ALA B 108 21.656 -0.313 3.507 1.00 15.00 H new ATOM 0 HB2 ALA B 108 22.641 0.317 2.165 1.00 15.00 H new ATOM 0 HB3 ALA B 108 21.178 1.189 2.681 1.00 15.00 H new ATOM 1485 N ASP B 109 18.529 0.162 1.910 1.00 15.00 N ATOM 1486 CA ASP B 109 17.146 0.097 2.376 1.00 15.00 C ATOM 1487 C ASP B 109 16.396 -1.028 1.674 1.00 15.00 C ATOM 1488 O ASP B 109 15.571 -1.719 2.276 1.00 15.00 O ATOM 1489 CB ASP B 109 16.443 1.430 2.111 1.00 15.00 C ATOM 1490 CG ASP B 109 15.680 1.942 3.317 1.00 15.00 C ATOM 1491 OD1 ASP B 109 16.126 2.939 3.926 1.00 15.00 O ATOM 1492 OD2 ASP B 109 14.632 1.360 3.661 1.00 15.00 O1- ATOM 0 H ASP B 109 18.765 1.029 1.427 1.00 15.00 H new ATOM 0 HA ASP B 109 17.152 -0.102 3.448 1.00 15.00 H new ATOM 0 HB2 ASP B 109 17.183 2.173 1.813 1.00 15.00 H new ATOM 0 HB3 ASP B 109 15.754 1.312 1.274 1.00 15.00 H new ATOM 1497 N ALA B 110 16.708 -1.221 0.399 1.00 15.00 N ATOM 1498 CA ALA B 110 16.072 -2.257 -0.400 1.00 15.00 C ATOM 1499 C ALA B 110 16.601 -3.636 -0.023 1.00 15.00 C ATOM 1500 O ALA B 110 15.835 -4.591 0.097 1.00 15.00 O ATOM 1501 CB ALA B 110 16.293 -1.988 -1.881 1.00 15.00 C ATOM 0 H ALA B 110 17.402 -0.669 -0.105 1.00 15.00 H new ATOM 0 HA ALA B 110 15.001 -2.239 -0.196 1.00 15.00 H new ATOM 0 HB1 ALA B 110 15.812 -2.770 -2.469 1.00 15.00 H new ATOM 0 HB2 ALA B 110 15.863 -1.021 -2.143 1.00 15.00 H new ATOM 0 HB3 ALA B 110 17.362 -1.980 -2.094 1.00 15.00 H new ATOM 1507 N GLU B 111 17.914 -3.723 0.177 1.00 15.00 N ATOM 1508 CA GLU B 111 18.567 -4.980 0.542 1.00 15.00 C ATOM 1509 C GLU B 111 17.992 -5.540 1.841 1.00 15.00 C ATOM 1510 O GLU B 111 17.588 -6.705 1.900 1.00 15.00 O ATOM 1511 CB GLU B 111 20.078 -4.771 0.688 1.00 15.00 C ATOM 1512 CG GLU B 111 20.826 -6.006 1.169 1.00 15.00 C ATOM 1513 CD GLU B 111 22.318 -5.777 1.265 1.00 15.00 C ATOM 1514 OE1 GLU B 111 23.034 -6.070 0.280 1.00 15.00 O ATOM 1515 OE2 GLU B 111 22.783 -5.307 2.325 1.00 15.00 O1- ATOM 0 H GLU B 111 18.552 -2.932 0.092 1.00 15.00 H new ATOM 0 HA GLU B 111 18.380 -5.700 -0.255 1.00 15.00 H new ATOM 0 HB2 GLU B 111 20.487 -4.462 -0.274 1.00 15.00 H new ATOM 0 HB3 GLU B 111 20.256 -3.954 1.388 1.00 15.00 H new ATOM 0 HG2 GLU B 111 20.443 -6.301 2.146 1.00 15.00 H new ATOM 0 HG3 GLU B 111 20.632 -6.834 0.487 1.00 15.00 H new ATOM 1522 N LEU B 112 17.940 -4.698 2.868 1.00 15.00 N ATOM 1523 CA LEU B 112 17.419 -5.099 4.170 1.00 15.00 C ATOM 1524 C LEU B 112 16.009 -5.667 4.053 1.00 15.00 C ATOM 1525 O LEU B 112 15.714 -6.747 4.571 1.00 15.00 O ATOM 1526 CB LEU B 112 17.405 -3.904 5.127 1.00 15.00 C ATOM 1527 CG LEU B 112 18.778 -3.423 5.594 1.00 15.00 C ATOM 1528 CD1 LEU B 112 18.650 -2.123 6.370 1.00 15.00 C ATOM 1529 CD2 LEU B 112 19.455 -4.486 6.443 1.00 15.00 C ATOM 0 H LEU B 112 18.254 -3.729 2.823 1.00 15.00 H new ATOM 0 HA LEU B 112 18.075 -5.876 4.562 1.00 15.00 H new ATOM 0 HB2 LEU B 112 16.895 -3.074 4.638 1.00 15.00 H new ATOM 0 HB3 LEU B 112 16.814 -4.169 6.004 1.00 15.00 H new ATOM 0 HG LEU B 112 19.396 -3.240 4.715 1.00 15.00 H new ATOM 0 HD11 LEU B 112 19.637 -1.795 6.695 1.00 15.00 H new ATOM 0 HD12 LEU B 112 18.206 -1.360 5.731 1.00 15.00 H new ATOM 0 HD13 LEU B 112 18.015 -2.281 7.242 1.00 15.00 H new ATOM 0 HD21 LEU B 112 20.432 -4.126 6.767 1.00 15.00 H new ATOM 0 HD22 LEU B 112 18.840 -4.700 7.317 1.00 15.00 H new ATOM 0 HD23 LEU B 112 19.580 -5.396 5.856 1.00 15.00 H new ATOM 1541 N GLN B 113 15.144 -4.944 3.356 1.00 15.00 N ATOM 1542 CA GLN B 113 13.766 -5.372 3.185 1.00 15.00 C ATOM 1543 C GLN B 113 13.663 -6.616 2.304 1.00 15.00 C ATOM 1544 O GLN B 113 12.807 -7.468 2.534 1.00 15.00 O ATOM 1545 CB GLN B 113 12.921 -4.238 2.606 1.00 15.00 C ATOM 1546 CG GLN B 113 11.422 -4.448 2.779 1.00 15.00 C ATOM 1547 CD GLN B 113 11.049 -4.903 4.180 1.00 15.00 C ATOM 1548 OE1 GLN B 113 10.851 -4.092 5.077 1.00 15.00 O ATOM 1549 NE2 GLN B 113 10.957 -6.208 4.378 1.00 15.00 N ATOM 0 H GLN B 113 15.373 -4.060 2.901 1.00 15.00 H new ATOM 0 HA GLN B 113 13.380 -5.634 4.170 1.00 15.00 H new ATOM 0 HB2 GLN B 113 13.206 -3.302 3.085 1.00 15.00 H new ATOM 0 HB3 GLN B 113 13.145 -4.134 1.544 1.00 15.00 H new ATOM 0 HG2 GLN B 113 10.901 -3.518 2.553 1.00 15.00 H new ATOM 0 HG3 GLN B 113 11.078 -5.189 2.058 1.00 15.00 H new ATOM 0 HE21 GLN B 113 11.129 -6.854 3.608 1.00 15.00 H new ATOM 0 HE22 GLN B 113 10.714 -6.568 5.301 1.00 15.00 H new ATOM 1558 N ARG B 114 14.537 -6.727 1.310 1.00 15.00 N ATOM 1559 CA ARG B 114 14.523 -7.878 0.413 1.00 15.00 C ATOM 1560 C ARG B 114 14.857 -9.151 1.182 1.00 15.00 C ATOM 1561 O ARG B 114 14.140 -10.148 1.089 1.00 15.00 O ATOM 1562 CB ARG B 114 15.510 -7.683 -0.742 1.00 15.00 C ATOM 1563 CG ARG B 114 15.466 -8.799 -1.774 1.00 15.00 C ATOM 1564 CD ARG B 114 16.088 -8.371 -3.091 1.00 15.00 C ATOM 1565 NE ARG B 114 15.303 -7.334 -3.754 1.00 15.00 N ATOM 1566 CZ ARG B 114 15.353 -7.069 -5.059 1.00 15.00 C ATOM 1567 NH1 ARG B 114 16.164 -7.761 -5.854 1.00 15.00 N1+ ATOM 1568 NH2 ARG B 114 14.599 -6.101 -5.562 1.00 15.00 N ATOM 0 H ARG B 114 15.261 -6.038 1.105 1.00 15.00 H new ATOM 0 HA ARG B 114 13.521 -7.971 -0.006 1.00 15.00 H new ATOM 0 HB2 ARG B 114 15.297 -6.735 -1.235 1.00 15.00 H new ATOM 0 HB3 ARG B 114 16.520 -7.612 -0.338 1.00 15.00 H new ATOM 0 HG2 ARG B 114 15.994 -9.672 -1.389 1.00 15.00 H new ATOM 0 HG3 ARG B 114 14.432 -9.100 -1.941 1.00 15.00 H new ATOM 0 HD2 ARG B 114 17.098 -8.003 -2.912 1.00 15.00 H new ATOM 0 HD3 ARG B 114 16.176 -9.236 -3.749 1.00 15.00 H new ATOM 0 HE ARG B 114 14.673 -6.774 -3.179 1.00 15.00 H new ATOM 0 HH11 ARG B 114 16.752 -8.499 -5.466 1.00 15.00 H new ATOM 0 HH12 ARG B 114 16.198 -7.554 -6.852 1.00 15.00 H new ATOM 0 HH21 ARG B 114 13.985 -5.563 -4.951 1.00 15.00 H new ATOM 0 HH22 ARG B 114 14.634 -5.894 -6.560 1.00 15.00 H new ATOM 1582 N LEU B 115 15.941 -9.104 1.949 1.00 15.00 N ATOM 1583 CA LEU B 115 16.369 -10.250 2.745 1.00 15.00 C ATOM 1584 C LEU B 115 15.308 -10.607 3.781 1.00 15.00 C ATOM 1585 O LEU B 115 14.968 -11.780 3.964 1.00 15.00 O ATOM 1586 CB LEU B 115 17.697 -9.941 3.441 1.00 15.00 C ATOM 1587 CG LEU B 115 18.327 -11.108 4.204 1.00 15.00 C ATOM 1588 CD1 LEU B 115 18.943 -12.106 3.241 1.00 15.00 C ATOM 1589 CD2 LEU B 115 19.370 -10.595 5.181 1.00 15.00 C ATOM 0 H LEU B 115 16.541 -8.283 2.037 1.00 15.00 H new ATOM 0 HA LEU B 115 16.506 -11.102 2.079 1.00 15.00 H new ATOM 0 HB2 LEU B 115 18.408 -9.594 2.691 1.00 15.00 H new ATOM 0 HB3 LEU B 115 17.539 -9.117 4.137 1.00 15.00 H new ATOM 0 HG LEU B 115 17.544 -11.617 4.767 1.00 15.00 H new ATOM 0 HD11 LEU B 115 19.386 -12.928 3.803 1.00 15.00 H new ATOM 0 HD12 LEU B 115 18.171 -12.495 2.577 1.00 15.00 H new ATOM 0 HD13 LEU B 115 19.715 -11.613 2.651 1.00 15.00 H new ATOM 0 HD21 LEU B 115 19.811 -11.435 5.717 1.00 15.00 H new ATOM 0 HD22 LEU B 115 20.150 -10.064 4.635 1.00 15.00 H new ATOM 0 HD23 LEU B 115 18.899 -9.917 5.893 1.00 15.00 H new ATOM 1601 N LYS B 116 14.780 -9.584 4.443 1.00 15.00 N ATOM 1602 CA LYS B 116 13.752 -9.765 5.462 1.00 15.00 C ATOM 1603 C LYS B 116 12.510 -10.420 4.865 1.00 15.00 C ATOM 1604 O LYS B 116 11.952 -11.364 5.429 1.00 15.00 O ATOM 1605 CB LYS B 116 13.374 -8.410 6.061 1.00 15.00 C ATOM 1606 CG LYS B 116 13.092 -8.448 7.551 1.00 15.00 C ATOM 1607 CD LYS B 116 12.435 -7.158 8.012 1.00 15.00 C ATOM 1608 CE LYS B 116 12.750 -6.847 9.464 1.00 15.00 C ATOM 1609 NZ LYS B 116 12.123 -5.570 9.895 1.00 15.00 N1+ ATOM 0 H LYS B 116 15.050 -8.612 4.290 1.00 15.00 H new ATOM 0 HA LYS B 116 14.150 -10.414 6.242 1.00 15.00 H new ATOM 0 HB2 LYS B 116 14.183 -7.704 5.873 1.00 15.00 H new ATOM 0 HB3 LYS B 116 12.492 -8.030 5.545 1.00 15.00 H new ATOM 0 HG2 LYS B 116 12.443 -9.293 7.781 1.00 15.00 H new ATOM 0 HG3 LYS B 116 14.022 -8.602 8.097 1.00 15.00 H new ATOM 0 HD2 LYS B 116 12.773 -6.334 7.383 1.00 15.00 H new ATOM 0 HD3 LYS B 116 11.355 -7.235 7.884 1.00 15.00 H new ATOM 0 HE2 LYS B 116 12.395 -7.660 10.097 1.00 15.00 H new ATOM 0 HE3 LYS B 116 13.830 -6.787 9.599 1.00 15.00 H new ATOM 0 HZ1 LYS B 116 12.609 -5.213 10.742 1.00 15.00 H new ATOM 0 HZ2 LYS B 116 12.201 -4.870 9.130 1.00 15.00 H new ATOM 0 HZ3 LYS B 116 11.120 -5.733 10.115 1.00 15.00 H new ATOM 1623 N ASN B 117 12.093 -9.908 3.716 1.00 15.00 N ATOM 1624 CA ASN B 117 10.922 -10.421 3.018 1.00 15.00 C ATOM 1625 C ASN B 117 11.135 -11.867 2.585 1.00 15.00 C ATOM 1626 O ASN B 117 10.250 -12.701 2.748 1.00 15.00 O ATOM 1627 CB ASN B 117 10.605 -9.540 1.801 1.00 15.00 C ATOM 1628 CG ASN B 117 9.740 -10.245 0.772 1.00 15.00 C ATOM 1629 OD1 ASN B 117 8.515 -10.284 0.895 1.00 15.00 O ATOM 1630 ND2 ASN B 117 10.373 -10.791 -0.258 1.00 15.00 N ATOM 0 H ASN B 117 12.553 -9.130 3.243 1.00 15.00 H new ATOM 0 HA ASN B 117 10.075 -10.395 3.704 1.00 15.00 H new ATOM 0 HB2 ASN B 117 10.098 -8.635 2.136 1.00 15.00 H new ATOM 0 HB3 ASN B 117 11.538 -9.228 1.332 1.00 15.00 H new ATOM 0 HD21 ASN B 117 9.843 -11.267 -0.988 1.00 15.00 H new ATOM 0 HD22 ASN B 117 11.390 -10.735 -0.320 1.00 15.00 H new ATOM 1637 N GLU B 118 12.321 -12.153 2.052 1.00 15.00 N ATOM 1638 CA GLU B 118 12.658 -13.495 1.582 1.00 15.00 C ATOM 1639 C GLU B 118 12.492 -14.529 2.690 1.00 15.00 C ATOM 1640 O GLU B 118 11.867 -15.573 2.493 1.00 15.00 O ATOM 1641 CB GLU B 118 14.096 -13.525 1.056 1.00 15.00 C ATOM 1642 CG GLU B 118 14.508 -14.878 0.503 1.00 15.00 C ATOM 1643 CD GLU B 118 15.861 -14.844 -0.172 1.00 15.00 C ATOM 1644 OE1 GLU B 118 16.858 -15.252 0.461 1.00 15.00 O ATOM 1645 OE2 GLU B 118 15.931 -14.409 -1.340 1.00 15.00 O1- ATOM 0 H GLU B 118 13.069 -11.469 1.934 1.00 15.00 H new ATOM 0 HA GLU B 118 11.971 -13.748 0.774 1.00 15.00 H new ATOM 0 HB2 GLU B 118 14.205 -12.773 0.275 1.00 15.00 H new ATOM 0 HB3 GLU B 118 14.776 -13.248 1.862 1.00 15.00 H new ATOM 0 HG2 GLU B 118 14.529 -15.606 1.314 1.00 15.00 H new ATOM 0 HG3 GLU B 118 13.758 -15.218 -0.212 1.00 15.00 H new ATOM 1652 N ALA B 119 13.042 -14.224 3.858 1.00 15.00 N ATOM 1653 CA ALA B 119 12.963 -15.126 5.000 1.00 15.00 C ATOM 1654 C ALA B 119 11.528 -15.267 5.498 1.00 15.00 C ATOM 1655 O ALA B 119 11.105 -16.349 5.910 1.00 15.00 O ATOM 1656 CB ALA B 119 13.865 -14.632 6.121 1.00 15.00 C ATOM 0 H ALA B 119 13.548 -13.358 4.040 1.00 15.00 H new ATOM 0 HA ALA B 119 13.302 -16.110 4.677 1.00 15.00 H new ATOM 0 HB1 ALA B 119 13.798 -15.314 6.969 1.00 15.00 H new ATOM 0 HB2 ALA B 119 14.895 -14.592 5.768 1.00 15.00 H new ATOM 0 HB3 ALA B 119 13.549 -13.636 6.430 1.00 15.00 H new ATOM 1662 N ALA B 120 10.780 -14.175 5.445 1.00 15.00 N ATOM 1663 CA ALA B 120 9.399 -14.168 5.907 1.00 15.00 C ATOM 1664 C ALA B 120 8.470 -14.897 4.941 1.00 15.00 C ATOM 1665 O ALA B 120 7.487 -15.500 5.363 1.00 15.00 O ATOM 1666 CB ALA B 120 8.927 -12.739 6.118 1.00 15.00 C ATOM 0 H ALA B 120 11.107 -13.279 5.085 1.00 15.00 H new ATOM 0 HA ALA B 120 9.365 -14.703 6.856 1.00 15.00 H new ATOM 0 HB1 ALA B 120 7.893 -12.745 6.463 1.00 15.00 H new ATOM 0 HB2 ALA B 120 9.556 -12.254 6.864 1.00 15.00 H new ATOM 0 HB3 ALA B 120 8.992 -12.192 5.178 1.00 15.00 H new ATOM 1672 N GLU B 121 8.803 -14.866 3.654 1.00 15.00 N ATOM 1673 CA GLU B 121 7.990 -15.505 2.617 1.00 15.00 C ATOM 1674 C GLU B 121 7.721 -16.985 2.902 1.00 15.00 C ATOM 1675 O GLU B 121 6.772 -17.560 2.367 1.00 15.00 O ATOM 1676 CB GLU B 121 8.663 -15.353 1.254 1.00 15.00 C ATOM 1677 CG GLU B 121 8.333 -14.036 0.569 1.00 15.00 C ATOM 1678 CD GLU B 121 8.828 -13.967 -0.861 1.00 15.00 C ATOM 1679 OE1 GLU B 121 8.951 -12.840 -1.396 1.00 15.00 O ATOM 1680 OE2 GLU B 121 9.077 -15.028 -1.464 1.00 15.00 O1- ATOM 0 H GLU B 121 9.638 -14.401 3.299 1.00 15.00 H new ATOM 0 HA GLU B 121 7.025 -14.998 2.615 1.00 15.00 H new ATOM 0 HB2 GLU B 121 9.743 -15.430 1.378 1.00 15.00 H new ATOM 0 HB3 GLU B 121 8.356 -16.177 0.610 1.00 15.00 H new ATOM 0 HG2 GLU B 121 7.253 -13.889 0.580 1.00 15.00 H new ATOM 0 HG3 GLU B 121 8.773 -13.217 1.139 1.00 15.00 H new ATOM 1687 N GLU B 122 8.543 -17.595 3.748 1.00 15.00 N ATOM 1688 CA GLU B 122 8.371 -18.998 4.084 1.00 15.00 C ATOM 1689 C GLU B 122 7.117 -19.216 4.932 1.00 15.00 C ATOM 1690 O GLU B 122 6.362 -20.159 4.696 1.00 15.00 O ATOM 1691 CB GLU B 122 9.605 -19.529 4.817 1.00 15.00 C ATOM 1692 CG GLU B 122 9.545 -21.022 5.095 1.00 15.00 C ATOM 1693 CD GLU B 122 10.847 -21.574 5.633 1.00 15.00 C ATOM 1694 OE1 GLU B 122 11.103 -21.434 6.847 1.00 15.00 O ATOM 1695 OE2 GLU B 122 11.614 -22.166 4.849 1.00 15.00 O1- ATOM 0 H GLU B 122 9.330 -17.141 4.210 1.00 15.00 H new ATOM 0 HA GLU B 122 8.249 -19.551 3.153 1.00 15.00 H new ATOM 0 HB2 GLU B 122 10.493 -19.313 4.223 1.00 15.00 H new ATOM 0 HB3 GLU B 122 9.716 -18.995 5.761 1.00 15.00 H new ATOM 0 HG2 GLU B 122 8.748 -21.221 5.812 1.00 15.00 H new ATOM 0 HG3 GLU B 122 9.286 -21.547 4.176 1.00 15.00 H new ATOM 1702 N ALA B 123 6.881 -18.333 5.903 1.00 15.00 N ATOM 1703 CA ALA B 123 5.720 -18.466 6.785 1.00 15.00 C ATOM 1704 C ALA B 123 5.319 -17.133 7.409 1.00 15.00 C ATOM 1705 O ALA B 123 4.137 -16.789 7.449 1.00 15.00 O ATOM 1706 CB ALA B 123 6.003 -19.488 7.876 1.00 15.00 C ATOM 0 H ALA B 123 7.472 -17.525 6.098 1.00 15.00 H new ATOM 0 HA ALA B 123 4.885 -18.808 6.174 1.00 15.00 H new ATOM 0 HB1 ALA B 123 5.132 -19.578 8.525 1.00 15.00 H new ATOM 0 HB2 ALA B 123 6.218 -20.455 7.422 1.00 15.00 H new ATOM 0 HB3 ALA B 123 6.862 -19.164 8.464 1.00 15.00 H new ATOM 1712 N GLU B 124 6.305 -16.371 7.868 1.00 15.00 N ATOM 1713 CA GLU B 124 6.060 -15.077 8.509 1.00 15.00 C ATOM 1714 C GLU B 124 5.641 -13.998 7.504 1.00 15.00 C ATOM 1715 O GLU B 124 5.747 -12.804 7.787 1.00 15.00 O ATOM 1716 CB GLU B 124 7.316 -14.619 9.254 1.00 15.00 C ATOM 1717 CG GLU B 124 7.561 -15.359 10.553 1.00 15.00 C ATOM 1718 CD GLU B 124 6.695 -14.849 11.684 1.00 15.00 C ATOM 1719 OE1 GLU B 124 5.581 -15.378 11.872 1.00 15.00 O ATOM 1720 OE2 GLU B 124 7.132 -13.919 12.397 1.00 15.00 O1- ATOM 0 H GLU B 124 7.291 -16.627 7.809 1.00 15.00 H new ATOM 0 HA GLU B 124 5.236 -15.215 9.209 1.00 15.00 H new ATOM 0 HB2 GLU B 124 8.181 -14.750 8.604 1.00 15.00 H new ATOM 0 HB3 GLU B 124 7.234 -13.553 9.464 1.00 15.00 H new ATOM 0 HG2 GLU B 124 7.369 -16.421 10.404 1.00 15.00 H new ATOM 0 HG3 GLU B 124 8.610 -15.261 10.831 1.00 15.00 H new ATOM 1727 N LEU B 125 5.156 -14.420 6.342 1.00 15.00 N ATOM 1728 CA LEU B 125 4.732 -13.504 5.291 1.00 15.00 C ATOM 1729 C LEU B 125 3.520 -12.693 5.736 1.00 15.00 C ATOM 1730 O LEU B 125 3.357 -11.535 5.347 1.00 15.00 O ATOM 1731 CB LEU B 125 4.406 -14.292 4.014 1.00 15.00 C ATOM 1732 CG LEU B 125 4.108 -13.448 2.769 1.00 15.00 C ATOM 1733 CD1 LEU B 125 5.263 -12.500 2.473 1.00 15.00 C ATOM 1734 CD2 LEU B 125 3.833 -14.349 1.574 1.00 15.00 C ATOM 0 H LEU B 125 5.046 -15.405 6.103 1.00 15.00 H new ATOM 0 HA LEU B 125 5.547 -12.810 5.085 1.00 15.00 H new ATOM 0 HB2 LEU B 125 5.246 -14.951 3.791 1.00 15.00 H new ATOM 0 HB3 LEU B 125 3.545 -14.930 4.213 1.00 15.00 H new ATOM 0 HG LEU B 125 3.218 -12.848 2.962 1.00 15.00 H new ATOM 0 HD11 LEU B 125 5.032 -11.910 1.586 1.00 15.00 H new ATOM 0 HD12 LEU B 125 5.414 -11.834 3.322 1.00 15.00 H new ATOM 0 HD13 LEU B 125 6.171 -13.077 2.299 1.00 15.00 H new ATOM 0 HD21 LEU B 125 3.623 -13.736 0.697 1.00 15.00 H new ATOM 0 HD22 LEU B 125 4.706 -14.973 1.380 1.00 15.00 H new ATOM 0 HD23 LEU B 125 2.973 -14.984 1.787 1.00 15.00 H new ATOM 1746 N GLU B 126 2.684 -13.300 6.564 1.00 15.00 N ATOM 1747 CA GLU B 126 1.497 -12.630 7.063 1.00 15.00 C ATOM 1748 C GLU B 126 1.887 -11.502 8.008 1.00 15.00 C ATOM 1749 O GLU B 126 1.354 -10.395 7.920 1.00 15.00 O ATOM 1750 CB GLU B 126 0.573 -13.626 7.767 1.00 15.00 C ATOM 1751 CG GLU B 126 -0.347 -14.370 6.817 1.00 15.00 C ATOM 1752 CD GLU B 126 -1.365 -13.457 6.162 1.00 15.00 C ATOM 1753 OE1 GLU B 126 -1.971 -13.866 5.147 1.00 15.00 O ATOM 1754 OE2 GLU B 126 -1.564 -12.328 6.657 1.00 15.00 O1- ATOM 0 H GLU B 126 2.807 -14.254 6.903 1.00 15.00 H new ATOM 0 HA GLU B 126 0.958 -12.204 6.217 1.00 15.00 H new ATOM 0 HB2 GLU B 126 1.179 -14.348 8.314 1.00 15.00 H new ATOM 0 HB3 GLU B 126 -0.030 -13.094 8.502 1.00 15.00 H new ATOM 0 HG2 GLU B 126 0.249 -14.857 6.045 1.00 15.00 H new ATOM 0 HG3 GLU B 126 -0.867 -15.157 7.362 1.00 15.00 H new ATOM 1761 N ARG B 127 2.831 -11.781 8.897 1.00 15.00 N ATOM 1762 CA ARG B 127 3.295 -10.778 9.846 1.00 15.00 C ATOM 1763 C ARG B 127 4.122 -9.713 9.129 1.00 15.00 C ATOM 1764 O ARG B 127 4.084 -8.537 9.491 1.00 15.00 O ATOM 1765 CB ARG B 127 4.113 -11.418 10.966 1.00 15.00 C ATOM 1766 CG ARG B 127 4.284 -10.502 12.165 1.00 15.00 C ATOM 1767 CD ARG B 127 5.274 -11.061 13.173 1.00 15.00 C ATOM 1768 NE ARG B 127 6.599 -11.262 12.593 1.00 15.00 N ATOM 1769 CZ ARG B 127 7.441 -10.275 12.280 1.00 15.00 C ATOM 1770 NH1 ARG B 127 7.099 -9.004 12.485 1.00 15.00 N1+ ATOM 1771 NH2 ARG B 127 8.630 -10.563 11.771 1.00 15.00 N ATOM 0 H ARG B 127 3.288 -12.689 8.981 1.00 15.00 H new ATOM 0 HA ARG B 127 2.421 -10.305 10.293 1.00 15.00 H new ATOM 0 HB2 ARG B 127 3.626 -12.340 11.285 1.00 15.00 H new ATOM 0 HB3 ARG B 127 5.095 -11.693 10.581 1.00 15.00 H new ATOM 0 HG2 ARG B 127 4.624 -9.523 11.827 1.00 15.00 H new ATOM 0 HG3 ARG B 127 3.319 -10.354 12.649 1.00 15.00 H new ATOM 0 HD2 ARG B 127 5.350 -10.380 14.021 1.00 15.00 H new ATOM 0 HD3 ARG B 127 4.901 -12.010 13.559 1.00 15.00 H new ATOM 0 HE ARG B 127 6.901 -12.220 12.415 1.00 15.00 H new ATOM 0 HH11 ARG B 127 6.188 -8.779 12.884 1.00 15.00 H new ATOM 0 HH12 ARG B 127 7.749 -8.256 12.243 1.00 15.00 H new ATOM 0 HH21 ARG B 127 8.898 -11.535 11.620 1.00 15.00 H new ATOM 0 HH22 ARG B 127 9.277 -9.812 11.530 1.00 15.00 H new ATOM 1785 N LEU B 128 4.869 -10.139 8.109 1.00 15.00 N ATOM 1786 CA LEU B 128 5.689 -9.225 7.314 1.00 15.00 C ATOM 1787 C LEU B 128 4.799 -8.150 6.698 1.00 15.00 C ATOM 1788 O LEU B 128 5.154 -6.970 6.651 1.00 15.00 O ATOM 1789 CB LEU B 128 6.432 -10.013 6.220 1.00 15.00 C ATOM 1790 CG LEU B 128 7.454 -9.236 5.369 1.00 15.00 C ATOM 1791 CD1 LEU B 128 6.788 -8.620 4.141 1.00 15.00 C ATOM 1792 CD2 LEU B 128 8.155 -8.164 6.195 1.00 15.00 C ATOM 0 H LEU B 128 4.923 -11.114 7.814 1.00 15.00 H new ATOM 0 HA LEU B 128 6.429 -8.742 7.953 1.00 15.00 H new ATOM 0 HB2 LEU B 128 6.951 -10.845 6.696 1.00 15.00 H new ATOM 0 HB3 LEU B 128 5.689 -10.442 5.548 1.00 15.00 H new ATOM 0 HG LEU B 128 8.208 -9.946 5.027 1.00 15.00 H new ATOM 0 HD11 LEU B 128 7.532 -8.077 3.558 1.00 15.00 H new ATOM 0 HD12 LEU B 128 6.352 -9.410 3.529 1.00 15.00 H new ATOM 0 HD13 LEU B 128 6.004 -7.933 4.459 1.00 15.00 H new ATOM 0 HD21 LEU B 128 8.871 -7.632 5.568 1.00 15.00 H new ATOM 0 HD22 LEU B 128 7.417 -7.461 6.580 1.00 15.00 H new ATOM 0 HD23 LEU B 128 8.680 -8.632 7.028 1.00 15.00 H new ATOM 1804 N LYS B 129 3.631 -8.578 6.242 1.00 15.00 N ATOM 1805 CA LYS B 129 2.656 -7.685 5.640 1.00 15.00 C ATOM 1806 C LYS B 129 2.224 -6.614 6.640 1.00 15.00 C ATOM 1807 O LYS B 129 2.222 -5.423 6.328 1.00 15.00 O ATOM 1808 CB LYS B 129 1.439 -8.485 5.187 1.00 15.00 C ATOM 1809 CG LYS B 129 0.988 -8.184 3.769 1.00 15.00 C ATOM 1810 CD LYS B 129 -0.405 -8.739 3.487 1.00 15.00 C ATOM 1811 CE LYS B 129 -0.591 -10.149 4.040 1.00 15.00 C ATOM 1812 NZ LYS B 129 -1.452 -10.150 5.252 1.00 15.00 N1+ ATOM 0 H LYS B 129 3.334 -9.553 6.279 1.00 15.00 H new ATOM 0 HA LYS B 129 3.113 -7.196 4.779 1.00 15.00 H new ATOM 0 HB2 LYS B 129 1.667 -9.548 5.266 1.00 15.00 H new ATOM 0 HB3 LYS B 129 0.613 -8.285 5.869 1.00 15.00 H new ATOM 0 HG2 LYS B 129 0.989 -7.106 3.609 1.00 15.00 H new ATOM 0 HG3 LYS B 129 1.699 -8.612 3.063 1.00 15.00 H new ATOM 0 HD2 LYS B 129 -1.152 -8.078 3.926 1.00 15.00 H new ATOM 0 HD3 LYS B 129 -0.579 -8.748 2.411 1.00 15.00 H new ATOM 0 HE2 LYS B 129 -1.037 -10.785 3.275 1.00 15.00 H new ATOM 0 HE3 LYS B 129 0.382 -10.577 4.283 1.00 15.00 H new ATOM 0 HZ1 LYS B 129 -1.267 -11.009 5.808 1.00 15.00 H new ATOM 0 HZ2 LYS B 129 -1.240 -9.311 5.829 1.00 15.00 H new ATOM 0 HZ3 LYS B 129 -2.452 -10.130 4.967 1.00 15.00 H new ATOM 1826 N SER B 130 1.880 -7.054 7.846 1.00 15.00 N ATOM 1827 CA SER B 130 1.444 -6.153 8.900 1.00 15.00 C ATOM 1828 C SER B 130 2.589 -5.259 9.372 1.00 15.00 C ATOM 1829 O SER B 130 2.377 -4.099 9.728 1.00 15.00 O ATOM 1830 CB SER B 130 0.888 -6.967 10.069 1.00 15.00 C ATOM 1831 OG SER B 130 0.115 -8.059 9.595 1.00 15.00 O ATOM 0 H SER B 130 1.896 -8.037 8.116 1.00 15.00 H new ATOM 0 HA SER B 130 0.662 -5.506 8.503 1.00 15.00 H new ATOM 0 HB2 SER B 130 1.708 -7.335 10.685 1.00 15.00 H new ATOM 0 HB3 SER B 130 0.274 -6.329 10.704 1.00 15.00 H new ATOM 0 HG SER B 130 -0.232 -8.569 10.356 1.00 15.00 H new ATOM 1837 N GLU B 131 3.806 -5.802 9.363 1.00 15.00 N ATOM 1838 CA GLU B 131 4.976 -5.048 9.792 1.00 15.00 C ATOM 1839 C GLU B 131 5.261 -3.901 8.833 1.00 15.00 C ATOM 1840 O GLU B 131 5.519 -2.778 9.267 1.00 15.00 O ATOM 1841 CB GLU B 131 6.208 -5.951 9.912 1.00 15.00 C ATOM 1842 CG GLU B 131 7.367 -5.267 10.618 1.00 15.00 C ATOM 1843 CD GLU B 131 8.599 -6.136 10.719 1.00 15.00 C ATOM 1844 OE1 GLU B 131 8.663 -6.970 11.648 1.00 15.00 O ATOM 1845 OE2 GLU B 131 9.515 -5.979 9.885 1.00 15.00 O1- ATOM 0 H GLU B 131 4.004 -6.757 9.064 1.00 15.00 H new ATOM 0 HA GLU B 131 4.757 -4.637 10.777 1.00 15.00 H new ATOM 0 HB2 GLU B 131 5.939 -6.856 10.456 1.00 15.00 H new ATOM 0 HB3 GLU B 131 6.526 -6.260 8.916 1.00 15.00 H new ATOM 0 HG2 GLU B 131 7.619 -4.351 10.084 1.00 15.00 H new ATOM 0 HG3 GLU B 131 7.053 -4.976 11.620 1.00 15.00 H new ATOM 1852 N ARG B 132 5.196 -4.180 7.531 1.00 15.00 N ATOM 1853 CA ARG B 132 5.437 -3.156 6.518 1.00 15.00 C ATOM 1854 C ARG B 132 4.471 -1.998 6.709 1.00 15.00 C ATOM 1855 O ARG B 132 4.839 -0.842 6.532 1.00 15.00 O ATOM 1856 CB ARG B 132 5.279 -3.720 5.104 1.00 15.00 C ATOM 1857 CG ARG B 132 6.521 -3.561 4.236 1.00 15.00 C ATOM 1858 CD ARG B 132 7.135 -2.170 4.357 1.00 15.00 C ATOM 1859 NE ARG B 132 8.421 -2.203 5.057 1.00 15.00 N ATOM 1860 CZ ARG B 132 9.321 -1.217 5.027 1.00 15.00 C ATOM 1861 NH1 ARG B 132 9.089 -0.105 4.342 1.00 15.00 N1+ ATOM 1862 NH2 ARG B 132 10.466 -1.355 5.683 1.00 15.00 N ATOM 0 H ARG B 132 4.979 -5.103 7.155 1.00 15.00 H new ATOM 0 HA ARG B 132 6.463 -2.807 6.637 1.00 15.00 H new ATOM 0 HB2 ARG B 132 5.027 -4.778 5.171 1.00 15.00 H new ATOM 0 HB3 ARG B 132 4.440 -3.223 4.616 1.00 15.00 H new ATOM 0 HG2 ARG B 132 7.260 -4.309 4.523 1.00 15.00 H new ATOM 0 HG3 ARG B 132 6.261 -3.752 3.195 1.00 15.00 H new ATOM 0 HD2 ARG B 132 7.273 -1.746 3.363 1.00 15.00 H new ATOM 0 HD3 ARG B 132 6.447 -1.514 4.891 1.00 15.00 H new ATOM 0 HE ARG B 132 8.644 -3.035 5.604 1.00 15.00 H new ATOM 0 HH11 ARG B 132 8.214 0.005 3.829 1.00 15.00 H new ATOM 0 HH12 ARG B 132 9.786 0.640 4.328 1.00 15.00 H new ATOM 0 HH21 ARG B 132 10.654 -2.210 6.206 1.00 15.00 H new ATOM 0 HH22 ARG B 132 11.158 -0.606 5.664 1.00 15.00 H new ATOM 1876 N HIS B 133 3.241 -2.333 7.079 1.00 15.00 N ATOM 1877 CA HIS B 133 2.195 -1.349 7.316 1.00 15.00 C ATOM 1878 C HIS B 133 2.643 -0.315 8.351 1.00 15.00 C ATOM 1879 O HIS B 133 2.490 0.890 8.155 1.00 15.00 O ATOM 1880 CB HIS B 133 0.934 -2.062 7.814 1.00 15.00 C ATOM 1881 CG HIS B 133 -0.334 -1.609 7.161 1.00 15.00 C ATOM 1882 ND1 HIS B 133 -0.637 -0.276 7.030 1.00 15.00 N ATOM 1883 CD2 HIS B 133 -1.343 -2.348 6.646 1.00 15.00 C ATOM 1884 CE1 HIS B 133 -1.823 -0.234 6.441 1.00 15.00 C ATOM 1885 NE2 HIS B 133 -2.286 -1.464 6.195 1.00 15.00 N ATOM 0 H HIS B 133 2.941 -3.297 7.223 1.00 15.00 H new ATOM 0 HA HIS B 133 1.985 -0.830 6.381 1.00 15.00 H new ATOM 0 HB2 HIS B 133 1.049 -3.133 7.651 1.00 15.00 H new ATOM 0 HB3 HIS B 133 0.848 -1.911 8.890 1.00 15.00 H new ATOM 0 HD2 HIS B 133 -1.395 -3.426 6.600 1.00 15.00 H new ATOM 0 HE1 HIS B 133 -2.348 0.676 6.192 1.00 15.00 H new ATOM 0 HE2 HIS B 133 -3.175 -1.699 5.754 1.00 15.00 H new ATOM 1893 N ASP B 134 3.225 -0.797 9.442 1.00 15.00 N ATOM 1894 CA ASP B 134 3.677 0.079 10.523 1.00 15.00 C ATOM 1895 C ASP B 134 5.078 0.634 10.262 1.00 15.00 C ATOM 1896 O ASP B 134 5.431 1.711 10.749 1.00 15.00 O ATOM 1897 CB ASP B 134 3.656 -0.672 11.854 1.00 15.00 C ATOM 1898 CG ASP B 134 3.512 0.263 13.036 1.00 15.00 C ATOM 1899 OD1 ASP B 134 4.431 0.316 13.880 1.00 15.00 O ATOM 1900 OD2 ASP B 134 2.477 0.959 13.123 1.00 15.00 O1- ATOM 0 H ASP B 134 3.396 -1.789 9.605 1.00 15.00 H new ATOM 0 HA ASP B 134 2.989 0.923 10.568 1.00 15.00 H new ATOM 0 HB2 ASP B 134 2.831 -1.385 11.854 1.00 15.00 H new ATOM 0 HB3 ASP B 134 4.575 -1.248 11.959 1.00 15.00 H new ATOM 1905 N HIS B 135 5.873 -0.102 9.502 1.00 15.00 N ATOM 1906 CA HIS B 135 7.237 0.314 9.187 1.00 15.00 C ATOM 1907 C HIS B 135 7.264 1.398 8.114 1.00 15.00 C ATOM 1908 O HIS B 135 7.979 2.388 8.242 1.00 15.00 O ATOM 1909 CB HIS B 135 8.069 -0.888 8.731 1.00 15.00 C ATOM 1910 CG HIS B 135 8.780 -1.583 9.851 1.00 15.00 C ATOM 1911 ND1 HIS B 135 10.049 -2.083 9.692 1.00 15.00 N ATOM 1912 CD2 HIS B 135 8.362 -1.829 11.117 1.00 15.00 C ATOM 1913 CE1 HIS B 135 10.377 -2.617 10.856 1.00 15.00 C ATOM 1914 NE2 HIS B 135 9.384 -2.488 11.747 1.00 15.00 N ATOM 0 H HIS B 135 5.599 -0.994 9.089 1.00 15.00 H new ATOM 0 HA HIS B 135 7.669 0.730 10.097 1.00 15.00 H new ATOM 0 HB2 HIS B 135 7.416 -1.601 8.228 1.00 15.00 H new ATOM 0 HB3 HIS B 135 8.803 -0.554 7.997 1.00 15.00 H new ATOM 0 HD2 HIS B 135 7.408 -1.558 11.545 1.00 15.00 H new ATOM 0 HE1 HIS B 135 11.323 -3.095 11.062 1.00 15.00 H new ATOM 0 HE2 HIS B 135 9.389 -2.818 12.712 1.00 15.00 H new ATOM 1922 N ASP B 136 6.460 1.221 7.073 1.00 15.00 N ATOM 1923 CA ASP B 136 6.413 2.173 5.968 1.00 15.00 C ATOM 1924 C ASP B 136 5.912 3.533 6.431 1.00 15.00 C ATOM 1925 O ASP B 136 6.443 4.567 6.028 1.00 15.00 O ATOM 1926 CB ASP B 136 5.532 1.646 4.839 1.00 15.00 C ATOM 1927 CG ASP B 136 6.171 1.847 3.483 1.00 15.00 C ATOM 1928 OD1 ASP B 136 7.060 1.046 3.120 1.00 15.00 O ATOM 1929 OD2 ASP B 136 5.796 2.803 2.780 1.00 15.00 O1- ATOM 0 H ASP B 136 5.830 0.426 6.970 1.00 15.00 H new ATOM 0 HA ASP B 136 7.430 2.294 5.594 1.00 15.00 H new ATOM 0 HB2 ASP B 136 5.338 0.585 4.995 1.00 15.00 H new ATOM 0 HB3 ASP B 136 4.568 2.153 4.864 1.00 15.00 H new ATOM 1934 N LYS B 137 4.901 3.533 7.300 1.00 15.00 N ATOM 1935 CA LYS B 137 4.349 4.780 7.822 1.00 15.00 C ATOM 1936 C LYS B 137 5.396 5.511 8.661 1.00 15.00 C ATOM 1937 O LYS B 137 5.345 6.727 8.814 1.00 15.00 O ATOM 1938 CB LYS B 137 3.085 4.517 8.653 1.00 15.00 C ATOM 1939 CG LYS B 137 3.364 3.917 10.021 1.00 15.00 C ATOM 1940 CD LYS B 137 2.112 3.851 10.880 1.00 15.00 C ATOM 1941 CE LYS B 137 1.121 2.821 10.360 1.00 15.00 C ATOM 1942 NZ LYS B 137 0.438 2.102 11.467 1.00 15.00 N1+ ATOM 0 H LYS B 137 4.451 2.689 7.654 1.00 15.00 H new ATOM 0 HA LYS B 137 4.072 5.411 6.977 1.00 15.00 H new ATOM 0 HB2 LYS B 137 2.544 5.455 8.781 1.00 15.00 H new ATOM 0 HB3 LYS B 137 2.430 3.845 8.098 1.00 15.00 H new ATOM 0 HG2 LYS B 137 3.774 2.914 9.900 1.00 15.00 H new ATOM 0 HG3 LYS B 137 4.122 4.512 10.530 1.00 15.00 H new ATOM 0 HD2 LYS B 137 2.388 3.604 11.905 1.00 15.00 H new ATOM 0 HD3 LYS B 137 1.637 4.832 10.905 1.00 15.00 H new ATOM 0 HE2 LYS B 137 0.378 3.316 9.735 1.00 15.00 H new ATOM 0 HE3 LYS B 137 1.642 2.103 9.727 1.00 15.00 H new ATOM 0 HZ1 LYS B 137 -0.165 1.352 11.074 1.00 15.00 H new ATOM 0 HZ2 LYS B 137 1.149 1.679 12.097 1.00 15.00 H new ATOM 0 HZ3 LYS B 137 -0.148 2.771 12.006 1.00 15.00 H new ATOM 1956 N LYS B 138 6.351 4.756 9.186 1.00 15.00 N ATOM 1957 CA LYS B 138 7.423 5.316 9.994 1.00 15.00 C ATOM 1958 C LYS B 138 8.521 5.839 9.074 1.00 15.00 C ATOM 1959 O LYS B 138 9.158 6.858 9.346 1.00 15.00 O ATOM 1960 CB LYS B 138 7.978 4.237 10.931 1.00 15.00 C ATOM 1961 CG LYS B 138 8.956 4.756 11.971 1.00 15.00 C ATOM 1962 CD LYS B 138 8.243 5.513 13.078 1.00 15.00 C ATOM 1963 CE LYS B 138 9.198 5.899 14.199 1.00 15.00 C ATOM 1964 NZ LYS B 138 9.711 4.708 14.928 1.00 15.00 N1+ ATOM 0 H LYS B 138 6.404 3.745 9.064 1.00 15.00 H new ATOM 0 HA LYS B 138 7.042 6.139 10.598 1.00 15.00 H new ATOM 0 HB2 LYS B 138 7.146 3.752 11.442 1.00 15.00 H new ATOM 0 HB3 LYS B 138 8.474 3.472 10.333 1.00 15.00 H new ATOM 0 HG2 LYS B 138 9.511 3.921 12.399 1.00 15.00 H new ATOM 0 HG3 LYS B 138 9.684 5.410 11.492 1.00 15.00 H new ATOM 0 HD2 LYS B 138 7.782 6.411 12.667 1.00 15.00 H new ATOM 0 HD3 LYS B 138 7.439 4.898 13.481 1.00 15.00 H new ATOM 0 HE2 LYS B 138 10.036 6.459 13.785 1.00 15.00 H new ATOM 0 HE3 LYS B 138 8.687 6.560 14.899 1.00 15.00 H new ATOM 0 HZ1 LYS B 138 10.144 5.009 15.824 1.00 15.00 H new ATOM 0 HZ2 LYS B 138 8.925 4.057 15.125 1.00 15.00 H new ATOM 0 HZ3 LYS B 138 10.423 4.224 14.345 1.00 15.00 H new ATOM 1978 N GLU B 139 8.715 5.130 7.970 1.00 15.00 N ATOM 1979 CA GLU B 139 9.716 5.491 6.977 1.00 15.00 C ATOM 1980 C GLU B 139 9.357 6.800 6.293 1.00 15.00 C ATOM 1981 O GLU B 139 10.236 7.537 5.855 1.00 15.00 O ATOM 1982 CB GLU B 139 9.842 4.384 5.930 1.00 15.00 C ATOM 1983 CG GLU B 139 10.725 3.235 6.371 1.00 15.00 C ATOM 1984 CD GLU B 139 12.161 3.664 6.566 1.00 15.00 C ATOM 1985 OE1 GLU B 139 12.872 3.860 5.559 1.00 15.00 O ATOM 1986 OE2 GLU B 139 12.589 3.812 7.727 1.00 15.00 O1- ATOM 0 H GLU B 139 8.184 4.290 7.739 1.00 15.00 H new ATOM 0 HA GLU B 139 10.670 5.617 7.490 1.00 15.00 H new ATOM 0 HB2 GLU B 139 8.849 4.000 5.697 1.00 15.00 H new ATOM 0 HB3 GLU B 139 10.244 4.809 5.010 1.00 15.00 H new ATOM 0 HG2 GLU B 139 10.341 2.820 7.303 1.00 15.00 H new ATOM 0 HG3 GLU B 139 10.683 2.439 5.627 1.00 15.00 H new ATOM 1993 N ALA B 140 8.065 7.080 6.210 1.00 15.00 N ATOM 1994 CA ALA B 140 7.567 8.297 5.577 1.00 15.00 C ATOM 1995 C ALA B 140 8.244 9.548 6.139 1.00 15.00 C ATOM 1996 O ALA B 140 8.629 10.443 5.386 1.00 15.00 O ATOM 1997 CB ALA B 140 6.058 8.395 5.740 1.00 15.00 C ATOM 0 H ALA B 140 7.332 6.473 6.578 1.00 15.00 H new ATOM 0 HA ALA B 140 7.810 8.240 4.516 1.00 15.00 H new ATOM 0 HB1 ALA B 140 5.699 9.307 5.263 1.00 15.00 H new ATOM 0 HB2 ALA B 140 5.585 7.531 5.273 1.00 15.00 H new ATOM 0 HB3 ALA B 140 5.807 8.417 6.801 1.00 15.00 H new ATOM 2003 N GLU B 141 8.394 9.604 7.458 1.00 15.00 N ATOM 2004 CA GLU B 141 9.025 10.750 8.102 1.00 15.00 C ATOM 2005 C GLU B 141 10.541 10.704 7.947 1.00 15.00 C ATOM 2006 O GLU B 141 11.173 11.712 7.634 1.00 15.00 O ATOM 2007 CB GLU B 141 8.658 10.803 9.587 1.00 15.00 C ATOM 2008 CG GLU B 141 7.336 11.503 9.865 1.00 15.00 C ATOM 2009 CD GLU B 141 6.169 10.543 9.944 1.00 15.00 C ATOM 2010 OE1 GLU B 141 5.591 10.214 8.890 1.00 15.00 O ATOM 2011 OE2 GLU B 141 5.820 10.120 11.069 1.00 15.00 O1- ATOM 0 H GLU B 141 8.089 8.872 8.100 1.00 15.00 H new ATOM 0 HA GLU B 141 8.654 11.650 7.611 1.00 15.00 H new ATOM 0 HB2 GLU B 141 8.610 9.786 9.977 1.00 15.00 H new ATOM 0 HB3 GLU B 141 9.452 11.315 10.130 1.00 15.00 H new ATOM 0 HG2 GLU B 141 7.412 12.053 10.803 1.00 15.00 H new ATOM 0 HG3 GLU B 141 7.146 12.235 9.080 1.00 15.00 H new ATOM 2018 N ARG B 142 11.120 9.526 8.147 1.00 15.00 N ATOM 2019 CA ARG B 142 12.565 9.365 8.043 1.00 15.00 C ATOM 2020 C ARG B 142 13.062 9.665 6.628 1.00 15.00 C ATOM 2021 O ARG B 142 14.031 10.404 6.452 1.00 15.00 O ATOM 2022 CB ARG B 142 12.990 7.954 8.456 1.00 15.00 C ATOM 2023 CG ARG B 142 14.493 7.818 8.674 1.00 15.00 C ATOM 2024 CD ARG B 142 14.872 6.442 9.196 1.00 15.00 C ATOM 2025 NE ARG B 142 14.712 5.407 8.176 1.00 15.00 N ATOM 2026 CZ ARG B 142 15.712 4.903 7.453 1.00 15.00 C ATOM 2027 NH1 ARG B 142 16.956 5.326 7.634 1.00 15.00 N1+ ATOM 2028 NH2 ARG B 142 15.454 3.975 6.537 1.00 15.00 N ATOM 0 H ARG B 142 10.614 8.672 8.381 1.00 15.00 H new ATOM 0 HA ARG B 142 13.019 10.084 8.725 1.00 15.00 H new ATOM 0 HB2 ARG B 142 12.470 7.679 9.374 1.00 15.00 H new ATOM 0 HB3 ARG B 142 12.676 7.248 7.688 1.00 15.00 H new ATOM 0 HG2 ARG B 142 15.014 8.005 7.735 1.00 15.00 H new ATOM 0 HG3 ARG B 142 14.827 8.578 9.380 1.00 15.00 H new ATOM 0 HD2 ARG B 142 15.907 6.456 9.539 1.00 15.00 H new ATOM 0 HD3 ARG B 142 14.253 6.199 10.060 1.00 15.00 H new ATOM 0 HE ARG B 142 13.773 5.047 8.006 1.00 15.00 H new ATOM 0 HH11 ARG B 142 17.154 6.043 8.332 1.00 15.00 H new ATOM 0 HH12 ARG B 142 17.714 4.934 7.076 1.00 15.00 H new ATOM 0 HH21 ARG B 142 14.497 3.654 6.392 1.00 15.00 H new ATOM 0 HH22 ARG B 142 16.213 3.584 5.979 1.00 15.00 H new ATOM 2042 N LYS B 143 12.385 9.109 5.630 1.00 15.00 N ATOM 2043 CA LYS B 143 12.760 9.311 4.233 1.00 15.00 C ATOM 2044 C LYS B 143 12.649 10.777 3.826 1.00 15.00 C ATOM 2045 O LYS B 143 13.411 11.251 2.986 1.00 15.00 O ATOM 2046 CB LYS B 143 11.876 8.461 3.323 1.00 15.00 C ATOM 2047 CG LYS B 143 12.261 6.990 3.295 1.00 15.00 C ATOM 2048 CD LYS B 143 13.430 6.732 2.355 1.00 15.00 C ATOM 2049 CE LYS B 143 13.931 5.301 2.461 1.00 15.00 C ATOM 2050 NZ LYS B 143 14.537 5.030 3.787 1.00 15.00 N1+ ATOM 0 H LYS B 143 11.569 8.511 5.762 1.00 15.00 H new ATOM 0 HA LYS B 143 13.801 9.006 4.125 1.00 15.00 H new ATOM 0 HB2 LYS B 143 10.840 8.550 3.651 1.00 15.00 H new ATOM 0 HB3 LYS B 143 11.924 8.859 2.310 1.00 15.00 H new ATOM 0 HG2 LYS B 143 12.524 6.663 4.301 1.00 15.00 H new ATOM 0 HG3 LYS B 143 11.403 6.395 2.981 1.00 15.00 H new ATOM 0 HD2 LYS B 143 13.124 6.935 1.329 1.00 15.00 H new ATOM 0 HD3 LYS B 143 14.243 7.420 2.587 1.00 15.00 H new ATOM 0 HE2 LYS B 143 13.104 4.612 2.291 1.00 15.00 H new ATOM 0 HE3 LYS B 143 14.667 5.114 1.679 1.00 15.00 H new ATOM 0 HZ1 LYS B 143 15.207 4.239 3.707 1.00 15.00 H new ATOM 0 HZ2 LYS B 143 15.040 5.878 4.118 1.00 15.00 H new ATOM 0 HZ3 LYS B 143 13.789 4.783 4.467 1.00 15.00 H new ATOM 2064 N ALA B 144 11.710 11.491 4.438 1.00 15.00 N ATOM 2065 CA ALA B 144 11.493 12.900 4.129 1.00 15.00 C ATOM 2066 C ALA B 144 12.764 13.722 4.327 1.00 15.00 C ATOM 2067 O ALA B 144 13.101 14.566 3.496 1.00 15.00 O ATOM 2068 CB ALA B 144 10.368 13.463 4.982 1.00 15.00 C ATOM 0 H ALA B 144 11.086 11.116 5.152 1.00 15.00 H new ATOM 0 HA ALA B 144 11.212 12.966 3.078 1.00 15.00 H new ATOM 0 HB1 ALA B 144 10.219 14.515 4.739 1.00 15.00 H new ATOM 0 HB2 ALA B 144 9.449 12.911 4.783 1.00 15.00 H new ATOM 0 HB3 ALA B 144 10.628 13.367 6.036 1.00 15.00 H new ATOM 2074 N LEU B 145 13.466 13.475 5.426 1.00 15.00 N ATOM 2075 CA LEU B 145 14.698 14.201 5.717 1.00 15.00 C ATOM 2076 C LEU B 145 15.908 13.488 5.120 1.00 15.00 C ATOM 2077 O LEU B 145 16.858 14.127 4.676 1.00 15.00 O ATOM 2078 CB LEU B 145 14.887 14.365 7.233 1.00 15.00 C ATOM 2079 CG LEU B 145 14.001 15.414 7.912 1.00 15.00 C ATOM 2080 CD1 LEU B 145 13.864 16.653 7.041 1.00 15.00 C ATOM 2081 CD2 LEU B 145 12.633 14.833 8.243 1.00 15.00 C ATOM 0 H LEU B 145 13.206 12.782 6.128 1.00 15.00 H new ATOM 0 HA LEU B 145 14.616 15.188 5.261 1.00 15.00 H new ATOM 0 HB2 LEU B 145 14.704 13.401 7.708 1.00 15.00 H new ATOM 0 HB3 LEU B 145 15.929 14.621 7.423 1.00 15.00 H new ATOM 0 HG LEU B 145 14.480 15.708 8.846 1.00 15.00 H new ATOM 0 HD11 LEU B 145 13.230 17.383 7.544 1.00 15.00 H new ATOM 0 HD12 LEU B 145 14.849 17.086 6.867 1.00 15.00 H new ATOM 0 HD13 LEU B 145 13.414 16.379 6.087 1.00 15.00 H new ATOM 0 HD21 LEU B 145 12.021 15.595 8.725 1.00 15.00 H new ATOM 0 HD22 LEU B 145 12.146 14.503 7.325 1.00 15.00 H new ATOM 0 HD23 LEU B 145 12.751 13.984 8.916 1.00 15.00 H new ATOM 2093 N GLU B 146 15.851 12.164 5.100 1.00 15.00 N ATOM 2094 CA GLU B 146 16.938 11.341 4.577 1.00 15.00 C ATOM 2095 C GLU B 146 17.218 11.648 3.109 1.00 15.00 C ATOM 2096 O GLU B 146 18.353 11.942 2.733 1.00 15.00 O ATOM 2097 CB GLU B 146 16.584 9.864 4.753 1.00 15.00 C ATOM 2098 CG GLU B 146 17.653 8.893 4.279 1.00 15.00 C ATOM 2099 CD GLU B 146 17.351 7.468 4.693 1.00 15.00 C ATOM 2100 OE1 GLU B 146 16.289 6.939 4.302 1.00 15.00 O ATOM 2101 OE2 GLU B 146 18.171 6.874 5.424 1.00 15.00 O1- ATOM 0 H GLU B 146 15.054 11.629 5.444 1.00 15.00 H new ATOM 0 HA GLU B 146 17.845 11.571 5.136 1.00 15.00 H new ATOM 0 HB2 GLU B 146 16.384 9.676 5.808 1.00 15.00 H new ATOM 0 HB3 GLU B 146 15.660 9.659 4.212 1.00 15.00 H new ATOM 0 HG2 GLU B 146 17.734 8.945 3.193 1.00 15.00 H new ATOM 0 HG3 GLU B 146 18.619 9.191 4.686 1.00 15.00 H new ATOM 2108 N ASP B 147 16.175 11.611 2.292 1.00 15.00 N ATOM 2109 CA ASP B 147 16.315 11.868 0.863 1.00 15.00 C ATOM 2110 C ASP B 147 16.634 13.333 0.596 1.00 15.00 C ATOM 2111 O ASP B 147 17.228 13.675 -0.427 1.00 15.00 O ATOM 2112 CB ASP B 147 15.041 11.466 0.119 1.00 15.00 C ATOM 2113 CG ASP B 147 15.184 11.620 -1.381 1.00 15.00 C ATOM 2114 OD1 ASP B 147 15.890 10.802 -2.000 1.00 15.00 O ATOM 2115 OD2 ASP B 147 14.593 12.562 -1.948 1.00 15.00 O1- ATOM 0 H ASP B 147 15.222 11.406 2.593 1.00 15.00 H new ATOM 0 HA ASP B 147 17.145 11.265 0.496 1.00 15.00 H new ATOM 0 HB2 ASP B 147 14.796 10.431 0.355 1.00 15.00 H new ATOM 0 HB3 ASP B 147 14.209 12.078 0.468 1.00 15.00 H new ATOM 2120 N LYS B 148 16.250 14.193 1.527 1.00 15.00 N ATOM 2121 CA LYS B 148 16.494 15.623 1.397 1.00 15.00 C ATOM 2122 C LYS B 148 17.971 15.939 1.620 1.00 15.00 C ATOM 2123 O LYS B 148 18.555 16.770 0.918 1.00 15.00 O ATOM 2124 CB LYS B 148 15.635 16.402 2.398 1.00 15.00 C ATOM 2125 CG LYS B 148 15.724 17.911 2.240 1.00 15.00 C ATOM 2126 CD LYS B 148 14.750 18.628 3.158 1.00 15.00 C ATOM 2127 CE LYS B 148 14.636 20.099 2.798 1.00 15.00 C ATOM 2128 NZ LYS B 148 13.820 20.851 3.784 1.00 15.00 N1+ ATOM 0 H LYS B 148 15.766 13.925 2.384 1.00 15.00 H new ATOM 0 HA LYS B 148 16.222 15.926 0.386 1.00 15.00 H new ATOM 0 HB2 LYS B 148 14.595 16.095 2.286 1.00 15.00 H new ATOM 0 HB3 LYS B 148 15.939 16.134 3.410 1.00 15.00 H new ATOM 0 HG2 LYS B 148 16.740 18.241 2.458 1.00 15.00 H new ATOM 0 HG3 LYS B 148 15.516 18.182 1.205 1.00 15.00 H new ATOM 0 HD2 LYS B 148 13.769 18.157 3.090 1.00 15.00 H new ATOM 0 HD3 LYS B 148 15.081 18.529 4.192 1.00 15.00 H new ATOM 0 HE2 LYS B 148 15.633 20.537 2.743 1.00 15.00 H new ATOM 0 HE3 LYS B 148 14.190 20.197 1.808 1.00 15.00 H new ATOM 0 HZ1 LYS B 148 13.767 21.850 3.501 1.00 15.00 H new ATOM 0 HZ2 LYS B 148 12.861 20.450 3.819 1.00 15.00 H new ATOM 0 HZ3 LYS B 148 14.259 20.780 4.724 1.00 15.00 H new ATOM 2142 N LEU B 149 18.576 15.271 2.595 1.00 15.00 N ATOM 2143 CA LEU B 149 19.979 15.491 2.906 1.00 15.00 C ATOM 2144 C LEU B 149 20.874 14.770 1.905 1.00 15.00 C ATOM 2145 O LEU B 149 21.716 15.388 1.253 1.00 15.00 O ATOM 2146 CB LEU B 149 20.293 15.022 4.329 1.00 15.00 C ATOM 2147 CG LEU B 149 21.634 15.507 4.888 1.00 15.00 C ATOM 2148 CD1 LEU B 149 21.652 17.025 4.995 1.00 15.00 C ATOM 2149 CD2 LEU B 149 21.902 14.874 6.244 1.00 15.00 C ATOM 0 H LEU B 149 18.116 14.574 3.181 1.00 15.00 H new ATOM 0 HA LEU B 149 20.177 16.561 2.838 1.00 15.00 H new ATOM 0 HB2 LEU B 149 19.496 15.361 4.991 1.00 15.00 H new ATOM 0 HB3 LEU B 149 20.281 13.932 4.347 1.00 15.00 H new ATOM 0 HG LEU B 149 22.424 15.203 4.201 1.00 15.00 H new ATOM 0 HD11 LEU B 149 22.613 17.350 5.394 1.00 15.00 H new ATOM 0 HD12 LEU B 149 21.503 17.461 4.007 1.00 15.00 H new ATOM 0 HD13 LEU B 149 20.853 17.352 5.660 1.00 15.00 H new ATOM 0 HD21 LEU B 149 22.858 15.228 6.628 1.00 15.00 H new ATOM 0 HD22 LEU B 149 21.108 15.150 6.938 1.00 15.00 H new ATOM 0 HD23 LEU B 149 21.932 13.789 6.140 1.00 15.00 H new ATOM 2161 N ALA B 150 20.685 13.465 1.776 1.00 15.00 N ATOM 2162 CA ALA B 150 21.480 12.675 0.846 1.00 15.00 C ATOM 2163 C ALA B 150 21.027 12.936 -0.583 1.00 15.00 C ATOM 2164 O ALA B 150 19.885 12.648 -0.938 1.00 15.00 O ATOM 2165 CB ALA B 150 21.365 11.194 1.180 1.00 15.00 C ATOM 0 H ALA B 150 19.991 12.932 2.301 1.00 15.00 H new ATOM 0 HA ALA B 150 22.525 12.969 0.938 1.00 15.00 H new ATOM 0 HB1 ALA B 150 21.964 10.615 0.477 1.00 15.00 H new ATOM 0 HB2 ALA B 150 21.726 11.021 2.194 1.00 15.00 H new ATOM 0 HB3 ALA B 150 20.322 10.885 1.109 1.00 15.00 H new ATOM 2171 N ASP B 151 21.910 13.496 -1.399 1.00 15.00 N ATOM 2172 CA ASP B 151 21.569 13.795 -2.784 1.00 15.00 C ATOM 2173 C ASP B 151 22.048 12.692 -3.716 1.00 15.00 C ATOM 2174 O ASP B 151 21.644 12.633 -4.877 1.00 15.00 O ATOM 2175 CB ASP B 151 22.135 15.160 -3.211 1.00 15.00 C ATOM 2176 CG ASP B 151 23.651 15.190 -3.310 1.00 15.00 C ATOM 2177 OD1 ASP B 151 24.329 14.888 -2.302 1.00 15.00 O ATOM 2178 OD2 ASP B 151 24.173 15.549 -4.390 1.00 15.00 O1- ATOM 0 H ASP B 151 22.860 13.751 -1.129 1.00 15.00 H new ATOM 0 HA ASP B 151 20.483 13.846 -2.855 1.00 15.00 H new ATOM 0 HB2 ASP B 151 21.711 15.432 -4.178 1.00 15.00 H new ATOM 0 HB3 ASP B 151 21.812 15.917 -2.496 1.00 15.00 H new ATOM 2183 N TYR B 152 22.881 11.804 -3.193 1.00 15.00 N ATOM 2184 CA TYR B 152 23.409 10.692 -3.969 1.00 15.00 C ATOM 2185 C TYR B 152 23.708 9.518 -3.057 1.00 15.00 C ATOM 2186 O TYR B 152 24.189 8.477 -3.556 1.00 15.00 O ATOM 2187 CB TYR B 152 24.677 11.095 -4.720 1.00 15.00 C ATOM 2188 CG TYR B 152 24.407 11.714 -6.071 1.00 15.00 C ATOM 2189 CD1 TYR B 152 24.979 12.928 -6.425 1.00 15.00 C ATOM 2190 CD2 TYR B 152 23.573 11.088 -6.989 1.00 15.00 C ATOM 2191 CE1 TYR B 152 24.725 13.500 -7.656 1.00 15.00 C ATOM 2192 CE2 TYR B 152 23.318 11.654 -8.220 1.00 15.00 C ATOM 2193 CZ TYR B 152 23.894 12.859 -8.548 1.00 15.00 C ATOM 2194 OH TYR B 152 23.635 13.426 -9.773 1.00 15.00 O ATOM 2195 OXT TYR B 152 23.476 9.648 -1.838 1.00 15.00 O1- ATOM 0 H TYR B 152 23.208 11.833 -2.227 1.00 15.00 H new ATOM 0 HA TYR B 152 22.654 10.404 -4.700 1.00 15.00 H new ATOM 0 HB2 TYR B 152 25.241 11.802 -4.111 1.00 15.00 H new ATOM 0 HB3 TYR B 152 25.307 10.215 -4.852 1.00 15.00 H new ATOM 0 HD1 TYR B 152 25.632 13.432 -5.728 1.00 15.00 H new ATOM 0 HD2 TYR B 152 23.117 10.143 -6.734 1.00 15.00 H new ATOM 0 HE1 TYR B 152 25.176 14.446 -7.918 1.00 15.00 H new ATOM 0 HE2 TYR B 152 22.669 11.153 -8.923 1.00 15.00 H new ATOM 0 HH TYR B 152 23.031 12.845 -10.281 1.00 15.00 H new