USER MOD reduce.3.24.130724 H: found=0, std=0, add=1466, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1470 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: B 28 MET CE :methyl -144:sc= -4.11! (180deg=-5.98!) USER MOD Set 1.2: D 20 LYS NZ :NH3+ -176:sc= -0.0969 (180deg=-0.0991) USER MOD Set 2.1: B 39 TYR OH : rot -38:sc= -1.42 USER MOD Set 2.2: B 43 GLN :FLIP amide:sc= -1.48! F(o=-16,f=-13!) USER MOD Set 2.3: D 19 MET CE :methyl -174:sc= -4.15! (180deg=-2.7!) USER MOD Set 2.4: D 22 LYS NZ :NH3+ -172:sc= -5.67! (180deg=-5.1!) USER MOD Set 3.1: A 19 MET CE :methyl -172:sc= -4.29! (180deg=-2.62!) USER MOD Set 3.2: A 22 LYS NZ :NH3+ -175:sc= -6.01! (180deg=-4.91!) USER MOD Set 3.3: C 39 TYR OH : rot -50:sc= -1.24 USER MOD Set 3.4: C 43 GLN :FLIP amide:sc= -1.31! F(o=-16,f=-13!) USER MOD Set 3.5: C 44 GLN :FLIP amide:sc= -0.243 F(o=-15,f=-13) USER MOD Set 4.1: A 28 MET CE :methyl -140:sc= -3.87! (180deg=-5.89!) USER MOD Set 4.2: C 20 LYS NZ :NH3+ -179:sc= -0.185 (180deg=-0.092) USER MOD Set 5.1: B 24 SER OG : rot -31:sc= -0.252! USER MOD Set 5.2: D 24 SER OG : rot 113:sc= -1.52! USER MOD Set 6.1: B 20 LYS NZ :NH3+ -176:sc= -0.0992 (180deg=-0.0946) USER MOD Set 6.2: D 28 MET CE :methyl -144:sc= -4.04! (180deg=-5.9!) USER MOD Set 7.1: B 19 MET CE :methyl -171:sc= -3.95! (180deg=-2.77!) USER MOD Set 7.2: B 22 LYS NZ :NH3+ -166:sc= -5.94! (180deg=-4.98!) USER MOD Set 7.3: D 39 TYR OH : rot -38:sc= -1.37 USER MOD Set 7.4: D 43 GLN :FLIP amide:sc= -1.32! F(o=-15,f=-13!) USER MOD Set 8.1: A 39 TYR OH : rot -50:sc= -1.28 USER MOD Set 8.2: A 43 GLN :FLIP amide:sc= -1.42! F(o=-15,f=-13!) USER MOD Set 8.3: A 44 GLN :FLIP amide:sc= -0.203 F(o=-15,f=-13) USER MOD Set 8.4: C 19 MET CE :methyl -176:sc= -4.47! (180deg=-2.67!) USER MOD Set 8.5: C 22 LYS NZ :NH3+ -175:sc= -5.65! (180deg=-4.78!) USER MOD Set 9.1: A 24 SER OG : rot -27:sc= -0.208! USER MOD Set 9.2: C 24 SER OG : rot 112:sc= -1.57! USER MOD Set10.1: A 20 LYS NZ :NH3+ -178:sc= -0.159 (180deg=-0.106) USER MOD Set10.2: C 28 MET CE :methyl -141:sc= -3.97! (180deg=-6.03!) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0375 USER MOD Single : A 5 TYR OH : rot 70:sc= -1.55! USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -2.69! C(o=-2.7!,f=-4.8!) USER MOD Single : A 14 ASN : amide:sc= -1.99! C(o=-2!,f=-4.7!) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 SER OG : rot 85:sc= 0.124 USER MOD Single : A 41 GLN :FLIP amide:sc= -0.0531 F(o=-0.9,f=-0.053) USER MOD Single : A 42 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0.035 USER MOD Single : B 5 TYR OH : rot 70:sc= -1.57! USER MOD Single : B 6 TYR OH : rot 180:sc= 0 USER MOD Single : B 8 GLN : amide:sc= -2.68! C(o=-2.7!,f=-4.9!) USER MOD Single : B 14 ASN : amide:sc= -1.99! C(o=-2!,f=-4.7!) USER MOD Single : B 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 38 SER OG : rot 85:sc= 0.122 USER MOD Single : B 41 GLN : amide:sc= -0.177 X(o=-0.18,f=-0.03) USER MOD Single : B 42 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : C 4 THR OG1 : rot 180:sc= 0.0527 USER MOD Single : C 5 TYR OH : rot 70:sc= -1.54! USER MOD Single : C 6 TYR OH : rot 180:sc= 0 USER MOD Single : C 8 GLN : amide:sc= -2.69! C(o=-2.7!,f=-4.8!) USER MOD Single : C 14 ASN : amide:sc= -2! C(o=-2!,f=-4.7!) USER MOD Single : C 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 38 SER OG : rot 84:sc= 0.122 USER MOD Single : C 41 GLN :FLIP amide:sc= -0.0282 F(o=-0.88,f=-0.028) USER MOD Single : C 42 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : D 4 THR OG1 : rot 180:sc= 0.0361 USER MOD Single : D 5 TYR OH : rot 70:sc= -1.57! USER MOD Single : D 6 TYR OH : rot 180:sc= 0 USER MOD Single : D 8 GLN : amide:sc= -2.68! C(o=-2.7!,f=-4.9!) USER MOD Single : D 14 ASN : amide:sc= -1.97! C(o=-2!,f=-4.6!) USER MOD Single : D 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : D 38 SER OG : rot 85:sc= 0.119 USER MOD Single : D 41 GLN : amide:sc= -0.167 X(o=-0.17,f=-0.026) USER MOD Single : D 42 GLN : amide:sc= 0 K(o=0,f=-0.65) USER MOD ----------------------------------------------------------------- ATOM 13 N GLU A 2 -6.740 -13.627 -12.837 1.00 0.00 N ATOM 14 CA GLU A 2 -6.849 -12.322 -12.194 1.00 0.00 C ATOM 15 C GLU A 2 -7.668 -12.415 -10.911 1.00 0.00 C ATOM 16 O GLU A 2 -8.058 -11.398 -10.341 1.00 0.00 O ATOM 17 CB GLU A 2 -7.484 -11.308 -13.149 1.00 0.00 C ATOM 18 CG GLU A 2 -8.888 -11.687 -13.594 1.00 0.00 C ATOM 19 CD GLU A 2 -9.477 -10.690 -14.573 1.00 0.00 C ATOM 20 OE1 GLU A 2 -10.077 -9.694 -14.116 1.00 0.00 O ATOM 21 OE2 GLU A 2 -9.339 -10.905 -15.795 1.00 0.00 O ATOM 0 HA GLU A 2 -5.844 -11.986 -11.938 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -7.517 -10.334 -12.661 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -6.849 -11.203 -14.029 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -8.865 -12.674 -14.056 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -9.535 -11.759 -12.720 1.00 0.00 H new ATOM 28 N ASP A 3 -7.928 -13.639 -10.464 1.00 0.00 N ATOM 29 CA ASP A 3 -8.695 -13.857 -9.242 1.00 0.00 C ATOM 30 C ASP A 3 -7.814 -13.628 -8.017 1.00 0.00 C ATOM 31 O ASP A 3 -6.957 -12.746 -8.027 1.00 0.00 O ATOM 32 CB ASP A 3 -9.279 -15.270 -9.226 1.00 0.00 C ATOM 33 CG ASP A 3 -8.212 -16.341 -9.343 1.00 0.00 C ATOM 34 OD1 ASP A 3 -7.853 -16.697 -10.485 1.00 0.00 O ATOM 35 OD2 ASP A 3 -7.737 -16.823 -8.294 1.00 0.00 O ATOM 0 H ASP A 3 -7.620 -14.494 -10.928 1.00 0.00 H new ATOM 0 HA ASP A 3 -9.519 -13.143 -9.214 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -9.838 -15.418 -8.302 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -9.987 -15.376 -10.048 1.00 0.00 H new ATOM 40 N THR A 4 -8.023 -14.411 -6.960 1.00 0.00 N ATOM 41 CA THR A 4 -7.222 -14.260 -5.758 1.00 0.00 C ATOM 42 C THR A 4 -5.808 -14.766 -5.989 1.00 0.00 C ATOM 43 O THR A 4 -5.582 -15.754 -6.688 1.00 0.00 O ATOM 44 CB THR A 4 -7.843 -14.969 -4.545 1.00 0.00 C ATOM 45 OG1 THR A 4 -9.225 -15.253 -4.795 1.00 0.00 O ATOM 46 CG2 THR A 4 -7.716 -14.110 -3.290 1.00 0.00 C ATOM 0 H THR A 4 -8.730 -15.144 -6.915 1.00 0.00 H new ATOM 0 HA THR A 4 -7.192 -13.194 -5.533 1.00 0.00 H new ATOM 0 HB THR A 4 -7.304 -15.903 -4.385 1.00 0.00 H new ATOM 0 HG1 THR A 4 -9.612 -15.706 -4.017 1.00 0.00 H new ATOM 0 HG21 THR A 4 -8.163 -14.633 -2.444 1.00 0.00 H new ATOM 0 HG22 THR A 4 -6.663 -13.920 -3.084 1.00 0.00 H new ATOM 0 HG23 THR A 4 -8.232 -13.162 -3.444 1.00 0.00 H new ATOM 54 N TYR A 5 -4.873 -14.063 -5.387 1.00 0.00 N ATOM 55 CA TYR A 5 -3.462 -14.355 -5.518 1.00 0.00 C ATOM 56 C TYR A 5 -2.824 -14.512 -4.156 1.00 0.00 C ATOM 57 O TYR A 5 -3.439 -14.165 -3.158 1.00 0.00 O ATOM 58 CB TYR A 5 -2.793 -13.185 -6.226 1.00 0.00 C ATOM 59 CG TYR A 5 -3.102 -13.124 -7.701 1.00 0.00 C ATOM 60 CD1 TYR A 5 -2.464 -13.971 -8.596 1.00 0.00 C ATOM 61 CD2 TYR A 5 -4.025 -12.215 -8.198 1.00 0.00 C ATOM 62 CE1 TYR A 5 -2.737 -13.914 -9.948 1.00 0.00 C ATOM 63 CE2 TYR A 5 -4.305 -12.152 -9.549 1.00 0.00 C ATOM 64 CZ TYR A 5 -3.658 -13.004 -10.420 1.00 0.00 C ATOM 65 OH TYR A 5 -3.931 -12.948 -11.765 1.00 0.00 O ATOM 0 H TYR A 5 -5.074 -13.264 -4.786 1.00 0.00 H new ATOM 0 HA TYR A 5 -3.340 -15.281 -6.080 1.00 0.00 H new ATOM 0 HB2 TYR A 5 -3.112 -12.255 -5.756 1.00 0.00 H new ATOM 0 HB3 TYR A 5 -1.714 -13.257 -6.091 1.00 0.00 H new ATOM 0 HD1 TYR A 5 -1.743 -14.686 -8.229 1.00 0.00 H new ATOM 0 HD2 TYR A 5 -4.532 -11.547 -7.518 1.00 0.00 H new ATOM 0 HE1 TYR A 5 -2.231 -14.579 -10.632 1.00 0.00 H new ATOM 0 HE2 TYR A 5 -5.026 -11.440 -9.921 1.00 0.00 H new ATOM 0 HH TYR A 5 -4.420 -13.754 -12.033 1.00 0.00 H new ATOM 75 N TYR A 6 -1.612 -15.037 -4.089 1.00 0.00 N ATOM 76 CA TYR A 6 -0.939 -15.138 -2.801 1.00 0.00 C ATOM 77 C TYR A 6 0.295 -14.248 -2.790 1.00 0.00 C ATOM 78 O TYR A 6 1.152 -14.329 -3.671 1.00 0.00 O ATOM 79 CB TYR A 6 -0.578 -16.585 -2.463 1.00 0.00 C ATOM 80 CG TYR A 6 -1.682 -17.574 -2.773 1.00 0.00 C ATOM 81 CD1 TYR A 6 -3.009 -17.260 -2.515 1.00 0.00 C ATOM 82 CD2 TYR A 6 -1.399 -18.819 -3.321 1.00 0.00 C ATOM 83 CE1 TYR A 6 -4.024 -18.152 -2.791 1.00 0.00 C ATOM 84 CE2 TYR A 6 -2.410 -19.721 -3.601 1.00 0.00 C ATOM 85 CZ TYR A 6 -3.721 -19.383 -3.334 1.00 0.00 C ATOM 86 OH TYR A 6 -4.729 -20.277 -3.611 1.00 0.00 O ATOM 0 H TYR A 6 -1.084 -15.392 -4.886 1.00 0.00 H new ATOM 0 HA TYR A 6 -1.628 -14.794 -2.029 1.00 0.00 H new ATOM 0 HB2 TYR A 6 0.317 -16.866 -3.018 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -0.330 -16.651 -1.404 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -3.252 -16.298 -2.089 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -0.374 -19.087 -3.532 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -5.050 -17.888 -2.583 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -2.174 -20.685 -4.027 1.00 0.00 H new ATOM 0 HH TYR A 6 -4.346 -21.095 -3.991 1.00 0.00 H new ATOM 96 N LEU A 7 0.366 -13.399 -1.774 1.00 0.00 N ATOM 97 CA LEU A 7 1.451 -12.442 -1.623 1.00 0.00 C ATOM 98 C LEU A 7 2.286 -12.776 -0.401 1.00 0.00 C ATOM 99 O LEU A 7 1.841 -12.584 0.727 1.00 0.00 O ATOM 100 CB LEU A 7 0.810 -11.066 -1.437 1.00 0.00 C ATOM 101 CG LEU A 7 1.411 -9.862 -2.166 1.00 0.00 C ATOM 102 CD1 LEU A 7 2.060 -10.227 -3.484 1.00 0.00 C ATOM 103 CD2 LEU A 7 0.312 -8.836 -2.379 1.00 0.00 C ATOM 0 H LEU A 7 -0.330 -13.355 -1.030 1.00 0.00 H new ATOM 0 HA LEU A 7 2.103 -12.465 -2.496 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -0.234 -11.146 -1.739 1.00 0.00 H new ATOM 0 HB3 LEU A 7 0.817 -10.842 -0.370 1.00 0.00 H new ATOM 0 HG LEU A 7 2.209 -9.453 -1.546 1.00 0.00 H new ATOM 0 HD11 LEU A 7 2.466 -9.330 -3.950 1.00 0.00 H new ATOM 0 HD12 LEU A 7 2.865 -10.941 -3.308 1.00 0.00 H new ATOM 0 HD13 LEU A 7 1.317 -10.674 -4.144 1.00 0.00 H new ATOM 0 HD21 LEU A 7 0.720 -7.968 -2.898 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.485 -9.276 -2.978 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.089 -8.526 -1.414 1.00 0.00 H new ATOM 115 N GLN A 8 3.508 -13.244 -0.607 1.00 0.00 N ATOM 116 CA GLN A 8 4.350 -13.561 0.526 1.00 0.00 C ATOM 117 C GLN A 8 5.022 -12.308 1.052 1.00 0.00 C ATOM 118 O GLN A 8 5.849 -11.701 0.378 1.00 0.00 O ATOM 119 CB GLN A 8 5.384 -14.619 0.158 1.00 0.00 C ATOM 120 CG GLN A 8 5.570 -15.678 1.230 1.00 0.00 C ATOM 121 CD GLN A 8 6.911 -16.392 1.157 1.00 0.00 C ATOM 122 OE1 GLN A 8 7.401 -16.911 2.160 1.00 0.00 O ATOM 123 NE2 GLN A 8 7.521 -16.419 -0.023 1.00 0.00 N ATOM 0 H GLN A 8 3.926 -13.408 -1.523 1.00 0.00 H new ATOM 0 HA GLN A 8 3.721 -13.971 1.316 1.00 0.00 H new ATOM 0 HB2 GLN A 8 5.084 -15.102 -0.772 1.00 0.00 H new ATOM 0 HB3 GLN A 8 6.341 -14.132 -0.031 1.00 0.00 H new ATOM 0 HG2 GLN A 8 5.469 -15.212 2.210 1.00 0.00 H new ATOM 0 HG3 GLN A 8 4.771 -16.414 1.144 1.00 0.00 H new ATOM 0 HE21 GLN A 8 7.085 -15.978 -0.833 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.425 -16.881 -0.119 1.00 0.00 H new ATOM 132 N VAL A 9 4.668 -11.934 2.271 1.00 0.00 N ATOM 133 CA VAL A 9 5.215 -10.731 2.865 1.00 0.00 C ATOM 134 C VAL A 9 5.986 -11.040 4.140 1.00 0.00 C ATOM 135 O VAL A 9 5.445 -11.610 5.079 1.00 0.00 O ATOM 136 CB VAL A 9 4.101 -9.712 3.144 1.00 0.00 C ATOM 137 CG1 VAL A 9 4.592 -8.599 4.048 1.00 0.00 C ATOM 138 CG2 VAL A 9 3.555 -9.163 1.839 1.00 0.00 C ATOM 0 H VAL A 9 4.010 -12.443 2.862 1.00 0.00 H new ATOM 0 HA VAL A 9 5.914 -10.298 2.150 1.00 0.00 H new ATOM 0 HB VAL A 9 3.291 -10.220 3.667 1.00 0.00 H new ATOM 0 HG11 VAL A 9 3.782 -7.892 4.228 1.00 0.00 H new ATOM 0 HG12 VAL A 9 4.924 -9.021 4.997 1.00 0.00 H new ATOM 0 HG13 VAL A 9 5.424 -8.082 3.570 1.00 0.00 H new ATOM 0 HG21 VAL A 9 2.766 -8.441 2.050 1.00 0.00 H new ATOM 0 HG22 VAL A 9 4.357 -8.673 1.287 1.00 0.00 H new ATOM 0 HG23 VAL A 9 3.150 -9.980 1.242 1.00 0.00 H new ATOM 148 N ARG A 10 7.234 -10.594 4.194 1.00 0.00 N ATOM 149 CA ARG A 10 8.080 -10.875 5.347 1.00 0.00 C ATOM 150 C ARG A 10 8.057 -9.714 6.330 1.00 0.00 C ATOM 151 O ARG A 10 8.061 -8.548 5.936 1.00 0.00 O ATOM 152 CB ARG A 10 9.514 -11.176 4.906 1.00 0.00 C ATOM 153 CG ARG A 10 10.309 -11.997 5.911 1.00 0.00 C ATOM 154 CD ARG A 10 10.935 -11.123 6.988 1.00 0.00 C ATOM 155 NE ARG A 10 11.708 -11.908 7.949 1.00 0.00 N ATOM 156 CZ ARG A 10 12.325 -11.384 9.005 1.00 0.00 C ATOM 157 NH1 ARG A 10 12.261 -10.080 9.237 1.00 0.00 N ATOM 158 NH2 ARG A 10 13.007 -12.167 9.830 1.00 0.00 N ATOM 0 H ARG A 10 7.680 -10.042 3.461 1.00 0.00 H new ATOM 0 HA ARG A 10 7.683 -11.757 5.850 1.00 0.00 H new ATOM 0 HB2 ARG A 10 9.487 -11.710 3.956 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.034 -10.235 4.728 1.00 0.00 H new ATOM 0 HG2 ARG A 10 9.655 -12.734 6.376 1.00 0.00 H new ATOM 0 HG3 ARG A 10 11.092 -12.549 5.391 1.00 0.00 H new ATOM 0 HD2 ARG A 10 11.583 -10.381 6.522 1.00 0.00 H new ATOM 0 HD3 ARG A 10 10.151 -10.577 7.513 1.00 0.00 H new ATOM 0 HE ARG A 10 11.778 -12.915 7.802 1.00 0.00 H new ATOM 0 HH11 ARG A 10 11.737 -9.475 8.605 1.00 0.00 H new ATOM 0 HH12 ARG A 10 12.735 -9.682 10.048 1.00 0.00 H new ATOM 0 HH21 ARG A 10 13.058 -13.171 9.655 1.00 0.00 H new ATOM 0 HH22 ARG A 10 13.480 -11.766 10.640 1.00 0.00 H new ATOM 172 N GLY A 11 8.031 -10.048 7.609 1.00 0.00 N ATOM 173 CA GLY A 11 7.992 -9.022 8.631 1.00 0.00 C ATOM 174 C GLY A 11 6.571 -8.638 8.987 1.00 0.00 C ATOM 175 O GLY A 11 5.790 -8.251 8.118 1.00 0.00 O ATOM 0 H GLY A 11 8.036 -11.006 7.959 1.00 0.00 H new ATOM 0 HA2 GLY A 11 8.507 -9.378 9.523 1.00 0.00 H new ATOM 0 HA3 GLY A 11 8.530 -8.141 8.282 1.00 0.00 H new ATOM 179 N ARG A 12 6.236 -8.751 10.266 1.00 0.00 N ATOM 180 CA ARG A 12 4.896 -8.428 10.746 1.00 0.00 C ATOM 181 C ARG A 12 4.448 -7.023 10.335 1.00 0.00 C ATOM 182 O ARG A 12 3.336 -6.853 9.839 1.00 0.00 O ATOM 183 CB ARG A 12 4.819 -8.583 12.265 1.00 0.00 C ATOM 184 CG ARG A 12 3.407 -8.798 12.780 1.00 0.00 C ATOM 185 CD ARG A 12 2.897 -10.188 12.435 1.00 0.00 C ATOM 186 NE ARG A 12 1.503 -10.372 12.830 1.00 0.00 N ATOM 187 CZ ARG A 12 1.034 -11.480 13.397 1.00 0.00 C ATOM 188 NH1 ARG A 12 1.849 -12.494 13.655 1.00 0.00 N ATOM 189 NH2 ARG A 12 -0.250 -11.572 13.712 1.00 0.00 N ATOM 0 H ARG A 12 6.877 -9.066 10.994 1.00 0.00 H new ATOM 0 HA ARG A 12 4.213 -9.135 10.275 1.00 0.00 H new ATOM 0 HB2 ARG A 12 5.440 -9.426 12.568 1.00 0.00 H new ATOM 0 HB3 ARG A 12 5.237 -7.693 12.735 1.00 0.00 H new ATOM 0 HG2 ARG A 12 3.387 -8.659 13.861 1.00 0.00 H new ATOM 0 HG3 ARG A 12 2.743 -8.048 12.350 1.00 0.00 H new ATOM 0 HD2 ARG A 12 2.995 -10.354 11.362 1.00 0.00 H new ATOM 0 HD3 ARG A 12 3.516 -10.935 12.931 1.00 0.00 H new ATOM 0 HE ARG A 12 0.851 -9.606 12.661 1.00 0.00 H new ATOM 0 HH11 ARG A 12 2.839 -12.426 13.419 1.00 0.00 H new ATOM 0 HH12 ARG A 12 1.486 -13.342 14.090 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -0.879 -10.793 13.520 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -0.609 -12.422 14.147 1.00 0.00 H new ATOM 203 N GLU A 13 5.298 -6.020 10.542 1.00 0.00 N ATOM 204 CA GLU A 13 4.944 -4.642 10.196 1.00 0.00 C ATOM 205 C GLU A 13 4.481 -4.517 8.743 1.00 0.00 C ATOM 206 O GLU A 13 3.464 -3.883 8.461 1.00 0.00 O ATOM 207 CB GLU A 13 6.133 -3.711 10.454 1.00 0.00 C ATOM 208 CG GLU A 13 5.855 -2.251 10.127 1.00 0.00 C ATOM 209 CD GLU A 13 6.923 -1.324 10.674 1.00 0.00 C ATOM 210 OE1 GLU A 13 8.083 -1.420 10.221 1.00 0.00 O ATOM 211 OE2 GLU A 13 6.601 -0.506 11.561 1.00 0.00 O ATOM 0 H GLU A 13 6.229 -6.132 10.944 1.00 0.00 H new ATOM 0 HA GLU A 13 4.109 -4.348 10.832 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.423 -3.790 11.502 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.983 -4.050 9.862 1.00 0.00 H new ATOM 0 HG2 GLU A 13 5.791 -2.129 9.046 1.00 0.00 H new ATOM 0 HG3 GLU A 13 4.886 -1.967 10.538 1.00 0.00 H new ATOM 218 N ASN A 14 5.232 -5.121 7.827 1.00 0.00 N ATOM 219 CA ASN A 14 4.901 -5.074 6.405 1.00 0.00 C ATOM 220 C ASN A 14 3.617 -5.854 6.114 1.00 0.00 C ATOM 221 O ASN A 14 2.758 -5.391 5.365 1.00 0.00 O ATOM 222 CB ASN A 14 6.057 -5.640 5.582 1.00 0.00 C ATOM 223 CG ASN A 14 7.389 -5.020 5.957 1.00 0.00 C ATOM 224 OD1 ASN A 14 7.448 -3.881 6.421 1.00 0.00 O ATOM 225 ND2 ASN A 14 8.468 -5.765 5.751 1.00 0.00 N ATOM 0 H ASN A 14 6.076 -5.650 8.044 1.00 0.00 H new ATOM 0 HA ASN A 14 4.737 -4.033 6.126 1.00 0.00 H new ATOM 0 HB2 ASN A 14 6.108 -6.719 5.726 1.00 0.00 H new ATOM 0 HB3 ASN A 14 5.864 -5.468 4.523 1.00 0.00 H new ATOM 0 HD21 ASN A 14 9.392 -5.398 5.979 1.00 0.00 H new ATOM 0 HD22 ASN A 14 8.373 -6.704 5.364 1.00 0.00 H new ATOM 232 N PHE A 15 3.498 -7.039 6.708 1.00 0.00 N ATOM 233 CA PHE A 15 2.321 -7.885 6.523 1.00 0.00 C ATOM 234 C PHE A 15 1.043 -7.167 6.947 1.00 0.00 C ATOM 235 O PHE A 15 0.043 -7.235 6.254 1.00 0.00 O ATOM 236 CB PHE A 15 2.481 -9.179 7.321 1.00 0.00 C ATOM 237 CG PHE A 15 1.366 -10.163 7.106 1.00 0.00 C ATOM 238 CD1 PHE A 15 0.902 -10.444 5.828 1.00 0.00 C ATOM 239 CD2 PHE A 15 0.782 -10.810 8.184 1.00 0.00 C ATOM 240 CE1 PHE A 15 -0.116 -11.349 5.633 1.00 0.00 C ATOM 241 CE2 PHE A 15 -0.244 -11.718 7.989 1.00 0.00 C ATOM 242 CZ PHE A 15 -0.690 -11.987 6.708 1.00 0.00 C ATOM 0 H PHE A 15 4.206 -7.437 7.325 1.00 0.00 H new ATOM 0 HA PHE A 15 2.238 -8.118 5.461 1.00 0.00 H new ATOM 0 HB2 PHE A 15 3.426 -9.649 7.049 1.00 0.00 H new ATOM 0 HB3 PHE A 15 2.540 -8.936 8.382 1.00 0.00 H new ATOM 0 HD1 PHE A 15 1.345 -9.947 4.978 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.131 -10.604 9.185 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -0.465 -11.559 4.633 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -0.695 -12.215 8.835 1.00 0.00 H new ATOM 0 HZ PHE A 15 -1.488 -12.697 6.552 1.00 0.00 H new ATOM 252 N GLU A 16 1.079 -6.509 8.102 1.00 0.00 N ATOM 253 CA GLU A 16 -0.078 -5.768 8.617 1.00 0.00 C ATOM 254 C GLU A 16 -0.445 -4.598 7.715 1.00 0.00 C ATOM 255 O GLU A 16 -1.620 -4.399 7.408 1.00 0.00 O ATOM 256 CB GLU A 16 0.206 -5.262 10.033 1.00 0.00 C ATOM 257 CG GLU A 16 0.422 -6.375 11.045 1.00 0.00 C ATOM 258 CD GLU A 16 0.680 -5.850 12.443 1.00 0.00 C ATOM 259 OE1 GLU A 16 1.838 -5.489 12.738 1.00 0.00 O ATOM 260 OE2 GLU A 16 -0.278 -5.798 13.244 1.00 0.00 O ATOM 0 H GLU A 16 1.900 -6.471 8.706 1.00 0.00 H new ATOM 0 HA GLU A 16 -0.925 -6.454 8.638 1.00 0.00 H new ATOM 0 HB2 GLU A 16 1.090 -4.625 10.012 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -0.627 -4.640 10.361 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -0.455 -7.022 11.060 1.00 0.00 H new ATOM 0 HG3 GLU A 16 1.266 -6.989 10.730 1.00 0.00 H new ATOM 267 N ILE A 17 0.542 -3.823 7.292 1.00 0.00 N ATOM 268 CA ILE A 17 0.267 -2.691 6.423 1.00 0.00 C ATOM 269 C ILE A 17 -0.351 -3.168 5.113 1.00 0.00 C ATOM 270 O ILE A 17 -1.326 -2.590 4.625 1.00 0.00 O ATOM 271 CB ILE A 17 1.546 -1.864 6.159 1.00 0.00 C ATOM 272 CG1 ILE A 17 1.597 -0.678 7.126 1.00 0.00 C ATOM 273 CG2 ILE A 17 1.609 -1.375 4.718 1.00 0.00 C ATOM 274 CD1 ILE A 17 2.974 -0.096 7.308 1.00 0.00 C ATOM 0 H ILE A 17 1.525 -3.954 7.532 1.00 0.00 H new ATOM 0 HA ILE A 17 -0.447 -2.041 6.928 1.00 0.00 H new ATOM 0 HB ILE A 17 2.410 -2.508 6.324 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.929 0.103 6.763 1.00 0.00 H new ATOM 0 HG13 ILE A 17 1.217 -0.997 8.097 1.00 0.00 H new ATOM 0 HG21 ILE A 17 2.521 -0.797 4.569 1.00 0.00 H new ATOM 0 HG22 ILE A 17 1.607 -2.231 4.043 1.00 0.00 H new ATOM 0 HG23 ILE A 17 0.744 -0.746 4.509 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.927 0.739 8.007 1.00 0.00 H new ATOM 0 HD12 ILE A 17 3.643 -0.861 7.702 1.00 0.00 H new ATOM 0 HD13 ILE A 17 3.350 0.256 6.347 1.00 0.00 H new ATOM 286 N LEU A 18 0.203 -4.239 4.560 1.00 0.00 N ATOM 287 CA LEU A 18 -0.287 -4.789 3.310 1.00 0.00 C ATOM 288 C LEU A 18 -1.613 -5.520 3.511 1.00 0.00 C ATOM 289 O LEU A 18 -2.465 -5.492 2.637 1.00 0.00 O ATOM 290 CB LEU A 18 0.749 -5.753 2.729 1.00 0.00 C ATOM 291 CG LEU A 18 1.919 -5.091 2.001 1.00 0.00 C ATOM 292 CD1 LEU A 18 3.202 -5.869 2.234 1.00 0.00 C ATOM 293 CD2 LEU A 18 1.628 -4.996 0.512 1.00 0.00 C ATOM 0 H LEU A 18 0.994 -4.743 4.961 1.00 0.00 H new ATOM 0 HA LEU A 18 -0.453 -3.964 2.617 1.00 0.00 H new ATOM 0 HB2 LEU A 18 1.146 -6.366 3.539 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.246 -6.427 2.036 1.00 0.00 H new ATOM 0 HG LEU A 18 2.046 -4.085 2.400 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.023 -5.382 1.708 1.00 0.00 H new ATOM 0 HD12 LEU A 18 3.421 -5.898 3.301 1.00 0.00 H new ATOM 0 HD13 LEU A 18 3.084 -6.886 1.860 1.00 0.00 H new ATOM 0 HD21 LEU A 18 2.470 -4.523 0.006 1.00 0.00 H new ATOM 0 HD22 LEU A 18 1.477 -5.996 0.106 1.00 0.00 H new ATOM 0 HD23 LEU A 18 0.729 -4.401 0.354 1.00 0.00 H new ATOM 305 N MET A 19 -1.769 -6.200 4.652 1.00 0.00 N ATOM 306 CA MET A 19 -3.004 -6.947 4.936 1.00 0.00 C ATOM 307 C MET A 19 -4.192 -5.993 4.980 1.00 0.00 C ATOM 308 O MET A 19 -5.213 -6.251 4.341 1.00 0.00 O ATOM 309 CB MET A 19 -2.891 -7.753 6.237 1.00 0.00 C ATOM 310 CG MET A 19 -3.684 -9.053 6.247 1.00 0.00 C ATOM 311 SD MET A 19 -5.440 -8.816 5.942 1.00 0.00 S ATOM 312 CE MET A 19 -5.918 -10.504 5.592 1.00 0.00 C ATOM 0 H MET A 19 -1.065 -6.250 5.388 1.00 0.00 H new ATOM 0 HA MET A 19 -3.162 -7.664 4.130 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.841 -7.982 6.417 1.00 0.00 H new ATOM 0 HB3 MET A 19 -3.228 -7.130 7.066 1.00 0.00 H new ATOM 0 HG2 MET A 19 -3.278 -9.724 5.490 1.00 0.00 H new ATOM 0 HG3 MET A 19 -3.553 -9.543 7.212 1.00 0.00 H new ATOM 0 HE1 MET A 19 -6.950 -10.525 5.241 1.00 0.00 H new ATOM 0 HE2 MET A 19 -5.265 -10.915 4.822 1.00 0.00 H new ATOM 0 HE3 MET A 19 -5.831 -11.102 6.499 1.00 0.00 H new ATOM 322 N LYS A 20 -4.074 -4.897 5.727 1.00 0.00 N ATOM 323 CA LYS A 20 -5.139 -3.904 5.769 1.00 0.00 C ATOM 324 C LYS A 20 -5.422 -3.426 4.368 1.00 0.00 C ATOM 325 O LYS A 20 -6.570 -3.242 3.968 1.00 0.00 O ATOM 326 CB LYS A 20 -4.737 -2.687 6.596 1.00 0.00 C ATOM 327 CG LYS A 20 -5.628 -1.477 6.321 1.00 0.00 C ATOM 328 CD LYS A 20 -6.337 -1.019 7.569 1.00 0.00 C ATOM 329 CE LYS A 20 -7.107 0.269 7.337 1.00 0.00 C ATOM 330 NZ LYS A 20 -8.283 0.063 6.445 1.00 0.00 N ATOM 0 H LYS A 20 -3.262 -4.678 6.304 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.013 -4.374 6.220 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -4.787 -2.938 7.655 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -3.701 -2.429 6.378 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -5.024 -0.661 5.924 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.362 -1.731 5.556 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.022 -1.797 7.905 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -5.609 -0.869 8.367 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -7.443 0.668 8.294 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -6.444 1.014 6.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -8.761 0.973 6.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -7.964 -0.325 5.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.946 -0.602 6.892 1.00 0.00 H new ATOM 344 N LEU A 21 -4.344 -3.233 3.631 1.00 0.00 N ATOM 345 CA LEU A 21 -4.436 -2.748 2.274 1.00 0.00 C ATOM 346 C LEU A 21 -5.170 -3.752 1.395 1.00 0.00 C ATOM 347 O LEU A 21 -6.035 -3.383 0.606 1.00 0.00 O ATOM 348 CB LEU A 21 -3.037 -2.459 1.729 1.00 0.00 C ATOM 349 CG LEU A 21 -2.941 -1.476 0.566 1.00 0.00 C ATOM 350 CD1 LEU A 21 -1.624 -1.653 -0.162 1.00 0.00 C ATOM 351 CD2 LEU A 21 -4.096 -1.629 -0.408 1.00 0.00 C ATOM 0 H LEU A 21 -3.392 -3.407 3.955 1.00 0.00 H new ATOM 0 HA LEU A 21 -5.008 -1.820 2.267 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -2.426 -2.078 2.547 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -2.594 -3.403 1.413 1.00 0.00 H new ATOM 0 HG LEU A 21 -2.994 -0.471 0.985 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.568 -0.946 -0.990 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -0.800 -1.471 0.528 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -1.556 -2.670 -0.548 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -3.986 -0.909 -1.219 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.096 -2.639 -0.817 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.037 -1.448 0.112 1.00 0.00 H new ATOM 363 N LYS A 22 -4.835 -5.023 1.551 1.00 0.00 N ATOM 364 CA LYS A 22 -5.474 -6.079 0.795 1.00 0.00 C ATOM 365 C LYS A 22 -6.977 -5.986 0.994 1.00 0.00 C ATOM 366 O LYS A 22 -7.756 -6.183 0.063 1.00 0.00 O ATOM 367 CB LYS A 22 -4.920 -7.430 1.261 1.00 0.00 C ATOM 368 CG LYS A 22 -5.897 -8.589 1.178 1.00 0.00 C ATOM 369 CD LYS A 22 -5.388 -9.778 1.975 1.00 0.00 C ATOM 370 CE LYS A 22 -6.508 -10.737 2.329 1.00 0.00 C ATOM 371 NZ LYS A 22 -7.677 -10.033 2.923 1.00 0.00 N ATOM 0 H LYS A 22 -4.118 -5.346 2.201 1.00 0.00 H new ATOM 0 HA LYS A 22 -5.266 -5.978 -0.270 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -4.042 -7.671 0.662 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -4.584 -7.331 2.293 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -6.870 -8.279 1.559 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -6.040 -8.877 0.136 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -4.627 -10.304 1.398 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -4.908 -9.426 2.888 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -6.824 -11.272 1.434 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -6.138 -11.483 3.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -8.385 -10.731 3.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -7.366 -9.474 3.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -8.099 -9.401 2.213 1.00 0.00 H new ATOM 385 N GLU A 23 -7.372 -5.679 2.225 1.00 0.00 N ATOM 386 CA GLU A 23 -8.776 -5.520 2.557 1.00 0.00 C ATOM 387 C GLU A 23 -9.348 -4.278 1.882 1.00 0.00 C ATOM 388 O GLU A 23 -10.438 -4.330 1.325 1.00 0.00 O ATOM 389 CB GLU A 23 -8.972 -5.444 4.073 1.00 0.00 C ATOM 390 CG GLU A 23 -8.603 -6.728 4.801 1.00 0.00 C ATOM 391 CD GLU A 23 -8.654 -6.580 6.309 1.00 0.00 C ATOM 392 OE1 GLU A 23 -7.630 -6.178 6.901 1.00 0.00 O ATOM 393 OE2 GLU A 23 -9.717 -6.867 6.899 1.00 0.00 O ATOM 0 H GLU A 23 -6.735 -5.536 3.009 1.00 0.00 H new ATOM 0 HA GLU A 23 -9.313 -6.393 2.188 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -8.369 -4.626 4.468 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -10.014 -5.203 4.284 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -9.283 -7.523 4.495 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -7.600 -7.034 4.504 1.00 0.00 H new ATOM 400 N SER A 24 -8.626 -3.154 1.938 1.00 0.00 N ATOM 401 CA SER A 24 -9.105 -1.924 1.307 1.00 0.00 C ATOM 402 C SER A 24 -9.287 -2.097 -0.206 1.00 0.00 C ATOM 403 O SER A 24 -10.315 -1.707 -0.759 1.00 0.00 O ATOM 404 CB SER A 24 -8.162 -0.756 1.602 1.00 0.00 C ATOM 405 OG SER A 24 -6.887 -0.966 1.024 1.00 0.00 O ATOM 0 H SER A 24 -7.723 -3.072 2.406 1.00 0.00 H new ATOM 0 HA SER A 24 -10.082 -1.699 1.736 1.00 0.00 H new ATOM 0 HB2 SER A 24 -8.592 0.168 1.215 1.00 0.00 H new ATOM 0 HB3 SER A 24 -8.059 -0.632 2.680 1.00 0.00 H new ATOM 0 HG SER A 24 -6.722 -1.928 0.937 1.00 0.00 H new ATOM 411 N LEU A 25 -8.288 -2.679 -0.869 1.00 0.00 N ATOM 412 CA LEU A 25 -8.343 -2.907 -2.314 1.00 0.00 C ATOM 413 C LEU A 25 -9.459 -3.880 -2.678 1.00 0.00 C ATOM 414 O LEU A 25 -10.224 -3.638 -3.612 1.00 0.00 O ATOM 415 CB LEU A 25 -7.003 -3.450 -2.821 1.00 0.00 C ATOM 416 CG LEU A 25 -5.941 -2.391 -3.134 1.00 0.00 C ATOM 417 CD1 LEU A 25 -4.586 -3.044 -3.343 1.00 0.00 C ATOM 418 CD2 LEU A 25 -6.322 -1.588 -4.366 1.00 0.00 C ATOM 0 H LEU A 25 -7.428 -3.002 -0.427 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.549 -1.949 -2.792 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.601 -4.133 -2.073 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -7.185 -4.035 -3.722 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.882 -1.713 -2.283 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -3.843 -2.278 -3.564 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.297 -3.579 -2.439 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.644 -3.744 -4.176 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -5.552 -0.843 -4.567 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -6.413 -2.256 -5.222 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -7.275 -1.088 -4.194 1.00 0.00 H new ATOM 430 N GLU A 26 -9.548 -4.981 -1.937 1.00 0.00 N ATOM 431 CA GLU A 26 -10.569 -5.990 -2.192 1.00 0.00 C ATOM 432 C GLU A 26 -11.963 -5.442 -1.903 1.00 0.00 C ATOM 433 O GLU A 26 -12.898 -5.662 -2.668 1.00 0.00 O ATOM 434 CB GLU A 26 -10.315 -7.240 -1.345 1.00 0.00 C ATOM 435 CG GLU A 26 -9.168 -8.098 -1.855 1.00 0.00 C ATOM 436 CD GLU A 26 -9.131 -9.468 -1.206 1.00 0.00 C ATOM 437 OE1 GLU A 26 -9.897 -10.352 -1.644 1.00 0.00 O ATOM 438 OE2 GLU A 26 -8.338 -9.657 -0.261 1.00 0.00 O ATOM 0 H GLU A 26 -8.927 -5.196 -1.157 1.00 0.00 H new ATOM 0 HA GLU A 26 -10.514 -6.260 -3.247 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.103 -6.937 -0.320 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.224 -7.841 -1.318 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -9.258 -8.214 -2.935 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -8.224 -7.586 -1.667 1.00 0.00 H new ATOM 445 N LEU A 27 -12.089 -4.725 -0.791 1.00 0.00 N ATOM 446 CA LEU A 27 -13.357 -4.126 -0.392 1.00 0.00 C ATOM 447 C LEU A 27 -13.802 -3.045 -1.369 1.00 0.00 C ATOM 448 O LEU A 27 -14.994 -2.852 -1.574 1.00 0.00 O ATOM 449 CB LEU A 27 -13.249 -3.538 1.018 1.00 0.00 C ATOM 450 CG LEU A 27 -13.367 -4.559 2.155 1.00 0.00 C ATOM 451 CD1 LEU A 27 -12.947 -3.943 3.477 1.00 0.00 C ATOM 452 CD2 LEU A 27 -14.788 -5.086 2.251 1.00 0.00 C ATOM 0 H LEU A 27 -11.321 -4.544 -0.145 1.00 0.00 H new ATOM 0 HA LEU A 27 -14.107 -4.916 -0.399 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -12.292 -3.024 1.109 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -14.028 -2.786 1.143 1.00 0.00 H new ATOM 0 HG LEU A 27 -12.699 -5.391 1.934 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -13.039 -4.685 4.270 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.911 -3.609 3.410 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -13.589 -3.091 3.702 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -14.854 -5.810 3.063 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -15.470 -4.259 2.446 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -15.061 -5.568 1.313 1.00 0.00 H new ATOM 464 N MET A 28 -12.870 -2.328 -1.977 1.00 0.00 N ATOM 465 CA MET A 28 -13.268 -1.278 -2.907 1.00 0.00 C ATOM 466 C MET A 28 -14.190 -1.827 -4.004 1.00 0.00 C ATOM 467 O MET A 28 -14.814 -1.056 -4.733 1.00 0.00 O ATOM 468 CB MET A 28 -12.053 -0.566 -3.510 1.00 0.00 C ATOM 469 CG MET A 28 -12.409 0.722 -4.230 1.00 0.00 C ATOM 470 SD MET A 28 -11.201 1.200 -5.482 1.00 0.00 S ATOM 471 CE MET A 28 -10.010 2.089 -4.486 1.00 0.00 C ATOM 0 H MET A 28 -11.865 -2.445 -1.852 1.00 0.00 H new ATOM 0 HA MET A 28 -13.830 -0.537 -2.338 1.00 0.00 H new ATOM 0 HB2 MET A 28 -11.339 -0.345 -2.717 1.00 0.00 H new ATOM 0 HB3 MET A 28 -11.556 -1.239 -4.208 1.00 0.00 H new ATOM 0 HG2 MET A 28 -13.385 0.608 -4.702 1.00 0.00 H new ATOM 0 HG3 MET A 28 -12.501 1.525 -3.499 1.00 0.00 H new ATOM 0 HE1 MET A 28 -9.664 2.968 -5.030 1.00 0.00 H new ATOM 0 HE2 MET A 28 -10.477 2.401 -3.552 1.00 0.00 H new ATOM 0 HE3 MET A 28 -9.162 1.440 -4.268 1.00 0.00 H new ATOM 481 N GLU A 29 -14.271 -3.150 -4.134 1.00 0.00 N ATOM 482 CA GLU A 29 -15.124 -3.768 -5.146 1.00 0.00 C ATOM 483 C GLU A 29 -16.535 -4.044 -4.614 1.00 0.00 C ATOM 484 O GLU A 29 -17.485 -4.142 -5.391 1.00 0.00 O ATOM 485 CB GLU A 29 -14.494 -5.078 -5.635 1.00 0.00 C ATOM 486 CG GLU A 29 -14.877 -6.298 -4.809 1.00 0.00 C ATOM 487 CD GLU A 29 -14.140 -7.550 -5.244 1.00 0.00 C ATOM 488 OE1 GLU A 29 -14.600 -8.207 -6.201 1.00 0.00 O ATOM 489 OE2 GLU A 29 -13.103 -7.874 -4.627 1.00 0.00 O ATOM 0 H GLU A 29 -13.758 -3.813 -3.553 1.00 0.00 H new ATOM 0 HA GLU A 29 -15.209 -3.065 -5.975 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -14.789 -5.246 -6.671 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -13.409 -4.972 -5.626 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -14.665 -6.102 -3.758 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -15.951 -6.466 -4.891 1.00 0.00 H new ATOM 496 N LEU A 30 -16.669 -4.170 -3.292 1.00 0.00 N ATOM 497 CA LEU A 30 -17.961 -4.473 -2.685 1.00 0.00 C ATOM 498 C LEU A 30 -18.734 -3.201 -2.366 1.00 0.00 C ATOM 499 O LEU A 30 -19.829 -3.250 -1.802 1.00 0.00 O ATOM 500 CB LEU A 30 -17.767 -5.357 -1.440 1.00 0.00 C ATOM 501 CG LEU A 30 -17.938 -4.680 -0.076 1.00 0.00 C ATOM 502 CD1 LEU A 30 -17.910 -5.722 1.032 1.00 0.00 C ATOM 503 CD2 LEU A 30 -16.859 -3.640 0.159 1.00 0.00 C ATOM 0 H LEU A 30 -15.902 -4.067 -2.627 1.00 0.00 H new ATOM 0 HA LEU A 30 -18.561 -5.032 -3.403 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -18.473 -6.185 -1.499 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -16.767 -5.788 -1.482 1.00 0.00 H new ATOM 0 HG LEU A 30 -18.903 -4.174 -0.068 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -18.032 -5.230 1.997 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -18.721 -6.434 0.882 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -16.956 -6.249 1.012 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -17.006 -3.177 1.135 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -15.880 -4.118 0.129 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -16.914 -2.877 -0.617 1.00 0.00 H new ATOM 515 N VAL A 31 -18.168 -2.066 -2.746 1.00 0.00 N ATOM 516 CA VAL A 31 -18.832 -0.796 -2.520 1.00 0.00 C ATOM 517 C VAL A 31 -19.530 -0.354 -3.804 1.00 0.00 C ATOM 518 O VAL A 31 -18.891 -0.249 -4.851 1.00 0.00 O ATOM 519 CB VAL A 31 -17.859 0.304 -2.053 1.00 0.00 C ATOM 520 CG1 VAL A 31 -16.644 0.381 -2.960 1.00 0.00 C ATOM 521 CG2 VAL A 31 -18.573 1.647 -1.990 1.00 0.00 C ATOM 0 H VAL A 31 -17.261 -2.000 -3.207 1.00 0.00 H new ATOM 0 HA VAL A 31 -19.559 -0.943 -1.722 1.00 0.00 H new ATOM 0 HB VAL A 31 -17.510 0.049 -1.053 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -15.975 1.166 -2.606 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -16.120 -0.575 -2.949 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -16.963 0.608 -3.977 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -17.874 2.415 -1.659 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -18.953 1.904 -2.979 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -19.404 1.585 -1.287 1.00 0.00 H new ATOM 531 N PRO A 32 -20.852 -0.104 -3.746 1.00 0.00 N ATOM 532 CA PRO A 32 -21.621 0.319 -4.913 1.00 0.00 C ATOM 533 C PRO A 32 -20.862 1.325 -5.771 1.00 0.00 C ATOM 534 O PRO A 32 -20.339 2.319 -5.266 1.00 0.00 O ATOM 535 CB PRO A 32 -22.859 0.954 -4.287 1.00 0.00 C ATOM 536 CG PRO A 32 -23.072 0.183 -3.028 1.00 0.00 C ATOM 537 CD PRO A 32 -21.705 -0.243 -2.550 1.00 0.00 C ATOM 0 HA PRO A 32 -21.844 -0.505 -5.591 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -22.703 2.013 -4.083 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -23.722 0.881 -4.949 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -23.572 0.796 -2.278 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -23.708 -0.684 -3.207 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -21.353 0.387 -1.733 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -21.712 -1.269 -2.181 1.00 0.00 H new ATOM 545 N GLN A 33 -20.803 1.048 -7.071 1.00 0.00 N ATOM 546 CA GLN A 33 -20.104 1.911 -8.021 1.00 0.00 C ATOM 547 C GLN A 33 -20.465 3.392 -7.843 1.00 0.00 C ATOM 548 O GLN A 33 -19.579 4.245 -7.863 1.00 0.00 O ATOM 549 CB GLN A 33 -20.403 1.467 -9.456 1.00 0.00 C ATOM 550 CG GLN A 33 -19.675 2.283 -10.513 1.00 0.00 C ATOM 551 CD GLN A 33 -19.989 1.822 -11.923 1.00 0.00 C ATOM 552 OE1 GLN A 33 -19.303 0.961 -12.473 1.00 0.00 O ATOM 553 NE2 GLN A 33 -21.029 2.396 -12.515 1.00 0.00 N ATOM 0 H GLN A 33 -21.234 0.226 -7.494 1.00 0.00 H new ATOM 0 HA GLN A 33 -19.037 1.812 -7.820 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -20.129 0.418 -9.567 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -21.476 1.536 -9.632 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.948 3.333 -10.408 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -18.600 2.215 -10.343 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -21.570 3.106 -12.021 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -21.288 2.127 -13.464 1.00 0.00 H new ATOM 562 N PRO A 34 -21.764 3.731 -7.675 1.00 0.00 N ATOM 563 CA PRO A 34 -22.192 5.127 -7.508 1.00 0.00 C ATOM 564 C PRO A 34 -21.490 5.845 -6.355 1.00 0.00 C ATOM 565 O PRO A 34 -21.282 7.059 -6.407 1.00 0.00 O ATOM 566 CB PRO A 34 -23.692 5.014 -7.224 1.00 0.00 C ATOM 567 CG PRO A 34 -24.094 3.715 -7.828 1.00 0.00 C ATOM 568 CD PRO A 34 -22.915 2.804 -7.653 1.00 0.00 C ATOM 0 HA PRO A 34 -21.947 5.719 -8.390 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -23.895 5.032 -6.153 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -24.243 5.844 -7.667 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -24.978 3.311 -7.335 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -24.344 3.834 -8.882 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -22.969 2.252 -6.715 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -22.854 2.067 -8.454 1.00 0.00 H new ATOM 576 N LEU A 35 -21.112 5.092 -5.320 1.00 0.00 N ATOM 577 CA LEU A 35 -20.448 5.665 -4.150 1.00 0.00 C ATOM 578 C LEU A 35 -18.979 5.952 -4.434 1.00 0.00 C ATOM 579 O LEU A 35 -18.420 6.926 -3.930 1.00 0.00 O ATOM 580 CB LEU A 35 -20.573 4.720 -2.953 1.00 0.00 C ATOM 581 CG LEU A 35 -21.729 5.028 -2.005 1.00 0.00 C ATOM 582 CD1 LEU A 35 -22.272 3.748 -1.390 1.00 0.00 C ATOM 583 CD2 LEU A 35 -21.279 5.991 -0.916 1.00 0.00 C ATOM 0 H LEU A 35 -21.255 4.083 -5.269 1.00 0.00 H new ATOM 0 HA LEU A 35 -20.940 6.609 -3.915 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -20.689 3.702 -3.324 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -19.642 4.749 -2.387 1.00 0.00 H new ATOM 0 HG LEU A 35 -22.528 5.500 -2.578 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -23.095 3.988 -0.717 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -22.630 3.088 -2.180 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -21.481 3.249 -0.831 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -22.114 6.201 -0.248 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -20.464 5.543 -0.348 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -20.936 6.920 -1.371 1.00 0.00 H new ATOM 595 N VAL A 36 -18.357 5.102 -5.241 1.00 0.00 N ATOM 596 CA VAL A 36 -16.956 5.286 -5.588 1.00 0.00 C ATOM 597 C VAL A 36 -16.802 6.502 -6.491 1.00 0.00 C ATOM 598 O VAL A 36 -15.856 7.275 -6.347 1.00 0.00 O ATOM 599 CB VAL A 36 -16.348 4.039 -6.261 1.00 0.00 C ATOM 600 CG1 VAL A 36 -14.982 4.355 -6.856 1.00 0.00 C ATOM 601 CG2 VAL A 36 -16.243 2.897 -5.262 1.00 0.00 C ATOM 0 H VAL A 36 -18.797 4.285 -5.664 1.00 0.00 H new ATOM 0 HA VAL A 36 -16.408 5.446 -4.660 1.00 0.00 H new ATOM 0 HB VAL A 36 -17.008 3.733 -7.072 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -14.574 3.460 -7.325 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -15.084 5.142 -7.603 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.310 4.690 -6.066 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -15.812 2.024 -5.752 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -15.606 3.198 -4.431 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -17.236 2.649 -4.887 1.00 0.00 H new ATOM 611 N ASP A 37 -17.731 6.665 -7.425 1.00 0.00 N ATOM 612 CA ASP A 37 -17.704 7.808 -8.325 1.00 0.00 C ATOM 613 C ASP A 37 -17.787 9.092 -7.511 1.00 0.00 C ATOM 614 O ASP A 37 -17.012 10.025 -7.728 1.00 0.00 O ATOM 615 CB ASP A 37 -18.875 7.742 -9.305 1.00 0.00 C ATOM 616 CG ASP A 37 -18.848 8.872 -10.316 1.00 0.00 C ATOM 617 OD1 ASP A 37 -19.404 9.950 -10.015 1.00 0.00 O ATOM 618 OD2 ASP A 37 -18.272 8.680 -11.407 1.00 0.00 O ATOM 0 H ASP A 37 -18.509 6.023 -7.578 1.00 0.00 H new ATOM 0 HA ASP A 37 -16.774 7.792 -8.893 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -18.852 6.787 -9.831 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -19.812 7.777 -8.750 1.00 0.00 H new ATOM 623 N SER A 38 -18.729 9.137 -6.574 1.00 0.00 N ATOM 624 CA SER A 38 -18.915 10.319 -5.740 1.00 0.00 C ATOM 625 C SER A 38 -17.661 10.644 -4.931 1.00 0.00 C ATOM 626 O SER A 38 -17.255 11.803 -4.849 1.00 0.00 O ATOM 627 CB SER A 38 -20.104 10.112 -4.802 1.00 0.00 C ATOM 628 OG SER A 38 -21.325 10.095 -5.522 1.00 0.00 O ATOM 0 H SER A 38 -19.373 8.372 -6.374 1.00 0.00 H new ATOM 0 HA SER A 38 -19.112 11.164 -6.399 1.00 0.00 H new ATOM 0 HB2 SER A 38 -19.985 9.174 -4.260 1.00 0.00 H new ATOM 0 HB3 SER A 38 -20.128 10.909 -4.059 1.00 0.00 H new ATOM 0 HG SER A 38 -21.487 9.193 -5.870 1.00 0.00 H new ATOM 634 N TYR A 39 -17.049 9.623 -4.333 1.00 0.00 N ATOM 635 CA TYR A 39 -15.838 9.819 -3.544 1.00 0.00 C ATOM 636 C TYR A 39 -14.713 10.368 -4.411 1.00 0.00 C ATOM 637 O TYR A 39 -14.024 11.315 -4.029 1.00 0.00 O ATOM 638 CB TYR A 39 -15.394 8.503 -2.904 1.00 0.00 C ATOM 639 CG TYR A 39 -13.929 8.491 -2.526 1.00 0.00 C ATOM 640 CD1 TYR A 39 -13.492 9.068 -1.342 1.00 0.00 C ATOM 641 CD2 TYR A 39 -12.982 7.915 -3.364 1.00 0.00 C ATOM 642 CE1 TYR A 39 -12.154 9.069 -1.002 1.00 0.00 C ATOM 643 CE2 TYR A 39 -11.645 7.913 -3.033 1.00 0.00 C ATOM 644 CZ TYR A 39 -11.234 8.490 -1.850 1.00 0.00 C ATOM 645 OH TYR A 39 -9.899 8.491 -1.517 1.00 0.00 O ATOM 0 H TYR A 39 -17.371 8.656 -4.380 1.00 0.00 H new ATOM 0 HA TYR A 39 -16.064 10.540 -2.758 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -15.994 8.318 -2.013 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -15.591 7.685 -3.596 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -14.210 9.523 -0.676 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -13.300 7.461 -4.291 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -11.830 9.521 -0.076 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -10.922 7.462 -3.697 1.00 0.00 H new ATOM 0 HH TYR A 39 -9.625 9.398 -1.268 1.00 0.00 H new ATOM 655 N ARG A 40 -14.533 9.760 -5.577 1.00 0.00 N ATOM 656 CA ARG A 40 -13.489 10.176 -6.500 1.00 0.00 C ATOM 657 C ARG A 40 -13.629 11.655 -6.833 1.00 0.00 C ATOM 658 O ARG A 40 -12.636 12.347 -7.045 1.00 0.00 O ATOM 659 CB ARG A 40 -13.531 9.329 -7.767 1.00 0.00 C ATOM 660 CG ARG A 40 -12.935 7.948 -7.573 1.00 0.00 C ATOM 661 CD ARG A 40 -12.860 7.188 -8.882 1.00 0.00 C ATOM 662 NE ARG A 40 -11.957 7.824 -9.838 1.00 0.00 N ATOM 663 CZ ARG A 40 -11.885 7.486 -11.122 1.00 0.00 C ATOM 664 NH1 ARG A 40 -12.662 6.524 -11.603 1.00 0.00 N ATOM 665 NH2 ARG A 40 -11.035 8.109 -11.927 1.00 0.00 N ATOM 0 H ARG A 40 -15.098 8.977 -5.904 1.00 0.00 H new ATOM 0 HA ARG A 40 -12.522 10.026 -6.021 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -14.565 9.230 -8.098 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -12.990 9.844 -8.561 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -11.936 8.038 -7.145 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -13.538 7.387 -6.859 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -12.524 6.169 -8.690 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -13.857 7.118 -9.317 1.00 0.00 H new ATOM 0 HE ARG A 40 -11.347 8.569 -9.502 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -13.317 6.042 -10.987 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -12.605 6.267 -12.588 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -10.435 8.849 -11.561 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -10.981 7.849 -12.912 1.00 0.00 H new ATOM 679 N GLN A 41 -14.869 12.134 -6.878 1.00 0.00 N ATOM 680 CA GLN A 41 -15.134 13.542 -7.137 1.00 0.00 C ATOM 681 C GLN A 41 -14.609 14.384 -5.978 1.00 0.00 C ATOM 682 O GLN A 41 -13.991 15.430 -6.189 1.00 0.00 O ATOM 683 CB GLN A 41 -16.630 13.781 -7.321 1.00 0.00 C ATOM 684 CG GLN A 41 -16.957 15.197 -7.753 1.00 0.00 C ATOM 685 CD GLN A 41 -16.556 15.475 -9.189 1.00 0.00 C ATOM 686 OE1 GLN A 41 -15.325 15.935 -9.382 1.00 0.00 O flip ATOM 687 NE2 GLN A 41 -17.342 15.275 -10.115 1.00 0.00 N flip ATOM 0 H GLN A 41 -15.705 11.566 -6.738 1.00 0.00 H new ATOM 0 HA GLN A 41 -14.624 13.833 -8.055 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -17.015 13.083 -8.064 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -17.144 13.565 -6.385 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -18.027 15.370 -7.638 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -16.448 15.901 -7.095 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -18.279 14.921 -9.921 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -17.057 15.463 -11.076 1.00 0.00 H new ATOM 696 N GLN A 42 -14.849 13.918 -4.754 1.00 0.00 N ATOM 697 CA GLN A 42 -14.380 14.626 -3.569 1.00 0.00 C ATOM 698 C GLN A 42 -12.862 14.742 -3.613 1.00 0.00 C ATOM 699 O GLN A 42 -12.276 15.668 -3.053 1.00 0.00 O ATOM 700 CB GLN A 42 -14.818 13.895 -2.298 1.00 0.00 C ATOM 701 CG GLN A 42 -14.462 14.633 -1.017 1.00 0.00 C ATOM 702 CD GLN A 42 -14.900 13.887 0.229 1.00 0.00 C ATOM 703 OE1 GLN A 42 -14.964 12.657 0.241 1.00 0.00 O ATOM 704 NE2 GLN A 42 -15.204 14.630 1.286 1.00 0.00 N ATOM 0 H GLN A 42 -15.362 13.058 -4.559 1.00 0.00 H new ATOM 0 HA GLN A 42 -14.817 15.624 -3.556 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -15.897 13.741 -2.331 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -14.356 12.908 -2.279 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -13.384 14.791 -0.981 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -14.928 15.618 -1.028 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -15.137 15.646 1.231 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -15.505 14.185 2.153 1.00 0.00 H new ATOM 713 N GLN A 43 -12.239 13.782 -4.288 1.00 0.00 N ATOM 714 CA GLN A 43 -10.792 13.758 -4.445 1.00 0.00 C ATOM 715 C GLN A 43 -10.383 14.640 -5.619 1.00 0.00 C ATOM 716 O GLN A 43 -9.348 15.307 -5.580 1.00 0.00 O ATOM 717 CB GLN A 43 -10.315 12.320 -4.663 1.00 0.00 C ATOM 718 CG GLN A 43 -8.830 12.195 -4.963 1.00 0.00 C ATOM 719 CD GLN A 43 -8.517 12.296 -6.445 1.00 0.00 C ATOM 720 OE1 GLN A 43 -8.564 11.163 -7.137 1.00 0.00 O flip ATOM 721 NE2 GLN A 43 -8.237 13.377 -6.963 1.00 0.00 N flip ATOM 0 H GLN A 43 -12.721 13.004 -4.739 1.00 0.00 H new ATOM 0 HA GLN A 43 -10.326 14.146 -3.539 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -10.545 11.734 -3.773 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -10.879 11.883 -5.487 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -8.289 12.976 -4.428 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -8.467 11.240 -4.584 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -8.212 14.224 -6.395 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -8.030 13.426 -7.961 1.00 0.00 H new ATOM 730 N GLN A 44 -11.211 14.638 -6.661 1.00 0.00 N ATOM 731 CA GLN A 44 -10.956 15.440 -7.851 1.00 0.00 C ATOM 732 C GLN A 44 -10.881 16.914 -7.486 1.00 0.00 C ATOM 733 O GLN A 44 -10.293 17.717 -8.211 1.00 0.00 O ATOM 734 CB GLN A 44 -12.046 15.214 -8.899 1.00 0.00 C ATOM 735 CG GLN A 44 -11.908 13.895 -9.641 1.00 0.00 C ATOM 736 CD GLN A 44 -10.669 13.844 -10.515 1.00 0.00 C ATOM 737 OE1 GLN A 44 -9.562 13.380 -9.946 1.00 0.00 O flip ATOM 738 NE2 GLN A 44 -10.706 14.218 -11.687 1.00 0.00 N flip ATOM 0 H GLN A 44 -12.068 14.086 -6.703 1.00 0.00 H new ATOM 0 HA GLN A 44 -10.000 15.131 -8.274 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -13.020 15.248 -8.412 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -12.022 16.032 -9.619 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -11.873 13.079 -8.920 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -12.791 13.736 -10.260 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -11.578 14.567 -12.084 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -9.864 14.178 -12.262 1.00 0.00 H new ATOM 747 N LEU A 45 -11.488 17.260 -6.355 1.00 0.00 N ATOM 748 CA LEU A 45 -11.488 18.636 -5.879 1.00 0.00 C ATOM 749 C LEU A 45 -10.059 19.156 -5.755 1.00 0.00 C ATOM 750 O LEU A 45 -9.739 20.239 -6.246 1.00 0.00 O ATOM 751 CB LEU A 45 -12.189 18.723 -4.521 1.00 0.00 C ATOM 752 CG LEU A 45 -11.906 19.998 -3.725 1.00 0.00 C ATOM 753 CD1 LEU A 45 -12.632 21.186 -4.338 1.00 0.00 C ATOM 754 CD2 LEU A 45 -12.307 19.814 -2.268 1.00 0.00 C ATOM 0 H LEU A 45 -11.986 16.605 -5.752 1.00 0.00 H new ATOM 0 HA LEU A 45 -12.026 19.251 -6.600 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -13.265 18.643 -4.679 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -11.891 17.864 -3.920 1.00 0.00 H new ATOM 0 HG LEU A 45 -10.835 20.199 -3.764 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -12.417 22.083 -3.757 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -12.294 21.329 -5.364 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -13.706 20.998 -4.333 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -12.099 20.730 -1.715 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -13.372 19.588 -2.209 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -11.737 18.992 -1.835 1.00 0.00 H new ATOM 840 N GLU B 2 6.656 -13.656 12.848 1.00 0.00 N ATOM 841 CA GLU B 2 6.774 -12.352 12.203 1.00 0.00 C ATOM 842 C GLU B 2 7.591 -12.452 10.920 1.00 0.00 C ATOM 843 O GLU B 2 7.988 -11.439 10.348 1.00 0.00 O ATOM 844 CB GLU B 2 7.416 -11.342 13.158 1.00 0.00 C ATOM 845 CG GLU B 2 8.816 -11.729 13.604 1.00 0.00 C ATOM 846 CD GLU B 2 9.412 -10.735 14.581 1.00 0.00 C ATOM 847 OE1 GLU B 2 10.018 -9.743 14.124 1.00 0.00 O ATOM 848 OE2 GLU B 2 9.272 -10.947 15.804 1.00 0.00 O ATOM 0 HA GLU B 2 5.772 -12.009 11.946 1.00 0.00 H new ATOM 0 HB2 GLU B 2 7.456 -10.368 12.670 1.00 0.00 H new ATOM 0 HB3 GLU B 2 6.781 -11.232 14.037 1.00 0.00 H new ATOM 0 HG2 GLU B 2 8.786 -12.715 14.067 1.00 0.00 H new ATOM 0 HG3 GLU B 2 9.463 -11.807 12.730 1.00 0.00 H new ATOM 855 N ASP B 3 7.844 -13.679 10.475 1.00 0.00 N ATOM 856 CA ASP B 3 8.608 -13.902 9.254 1.00 0.00 C ATOM 857 C ASP B 3 7.729 -13.669 8.029 1.00 0.00 C ATOM 858 O ASP B 3 6.877 -12.781 8.039 1.00 0.00 O ATOM 859 CB ASP B 3 9.185 -15.318 9.239 1.00 0.00 C ATOM 860 CG ASP B 3 8.112 -16.382 9.357 1.00 0.00 C ATOM 861 OD1 ASP B 3 7.750 -16.736 10.499 1.00 0.00 O ATOM 862 OD2 ASP B 3 7.633 -16.863 8.308 1.00 0.00 O ATOM 0 H ASP B 3 7.532 -14.531 10.941 1.00 0.00 H new ATOM 0 HA ASP B 3 9.435 -13.193 9.225 1.00 0.00 H new ATOM 0 HB2 ASP B 3 9.743 -15.470 8.315 1.00 0.00 H new ATOM 0 HB3 ASP B 3 9.893 -15.427 10.061 1.00 0.00 H new ATOM 867 N THR B 4 7.931 -14.454 6.971 1.00 0.00 N ATOM 868 CA THR B 4 7.132 -14.299 5.769 1.00 0.00 C ATOM 869 C THR B 4 5.715 -14.796 6.001 1.00 0.00 C ATOM 870 O THR B 4 5.483 -15.781 6.702 1.00 0.00 O ATOM 871 CB THR B 4 7.750 -15.012 4.557 1.00 0.00 C ATOM 872 OG1 THR B 4 9.130 -15.304 4.807 1.00 0.00 O ATOM 873 CG2 THR B 4 7.627 -14.155 3.300 1.00 0.00 C ATOM 0 H THR B 4 8.633 -15.193 6.927 1.00 0.00 H new ATOM 0 HA THR B 4 7.108 -13.233 5.542 1.00 0.00 H new ATOM 0 HB THR B 4 7.206 -15.943 4.398 1.00 0.00 H new ATOM 0 HG1 THR B 4 9.514 -15.760 4.029 1.00 0.00 H new ATOM 0 HG21 THR B 4 8.072 -14.682 2.456 1.00 0.00 H new ATOM 0 HG22 THR B 4 6.574 -13.961 3.093 1.00 0.00 H new ATOM 0 HG23 THR B 4 8.147 -13.209 3.452 1.00 0.00 H new ATOM 881 N TYR B 5 4.784 -14.088 5.399 1.00 0.00 N ATOM 882 CA TYR B 5 3.371 -14.370 5.531 1.00 0.00 C ATOM 883 C TYR B 5 2.732 -14.525 4.168 1.00 0.00 C ATOM 884 O TYR B 5 3.349 -14.184 3.171 1.00 0.00 O ATOM 885 CB TYR B 5 2.710 -13.196 6.237 1.00 0.00 C ATOM 886 CG TYR B 5 3.020 -13.135 7.713 1.00 0.00 C ATOM 887 CD1 TYR B 5 2.377 -13.977 8.609 1.00 0.00 C ATOM 888 CD2 TYR B 5 3.948 -12.232 8.210 1.00 0.00 C ATOM 889 CE1 TYR B 5 2.650 -13.921 9.961 1.00 0.00 C ATOM 890 CE2 TYR B 5 4.229 -12.170 9.560 1.00 0.00 C ATOM 891 CZ TYR B 5 3.576 -13.017 10.431 1.00 0.00 C ATOM 892 OH TYR B 5 3.850 -12.962 11.777 1.00 0.00 O ATOM 0 H TYR B 5 4.990 -13.291 4.797 1.00 0.00 H new ATOM 0 HA TYR B 5 3.243 -15.294 6.095 1.00 0.00 H new ATOM 0 HB2 TYR B 5 3.035 -12.268 5.766 1.00 0.00 H new ATOM 0 HB3 TYR B 5 1.630 -13.261 6.102 1.00 0.00 H new ATOM 0 HD1 TYR B 5 1.651 -14.688 8.243 1.00 0.00 H new ATOM 0 HD2 TYR B 5 4.459 -11.567 7.530 1.00 0.00 H new ATOM 0 HE1 TYR B 5 2.140 -14.582 10.646 1.00 0.00 H new ATOM 0 HE2 TYR B 5 4.956 -11.463 9.932 1.00 0.00 H new ATOM 0 HH TYR B 5 4.334 -13.771 12.046 1.00 0.00 H new ATOM 902 N TYR B 6 1.517 -15.042 4.102 1.00 0.00 N ATOM 903 CA TYR B 6 0.843 -15.140 2.815 1.00 0.00 C ATOM 904 C TYR B 6 -0.386 -14.242 2.803 1.00 0.00 C ATOM 905 O TYR B 6 -1.243 -14.317 3.683 1.00 0.00 O ATOM 906 CB TYR B 6 0.473 -16.585 2.478 1.00 0.00 C ATOM 907 CG TYR B 6 1.571 -17.581 2.788 1.00 0.00 C ATOM 908 CD1 TYR B 6 2.900 -17.276 2.530 1.00 0.00 C ATOM 909 CD2 TYR B 6 1.280 -18.824 3.337 1.00 0.00 C ATOM 910 CE1 TYR B 6 3.910 -18.174 2.806 1.00 0.00 C ATOM 911 CE2 TYR B 6 2.286 -19.732 3.618 1.00 0.00 C ATOM 912 CZ TYR B 6 3.598 -19.402 3.350 1.00 0.00 C ATOM 913 OH TYR B 6 4.601 -20.303 3.629 1.00 0.00 O ATOM 0 H TYR B 6 0.987 -15.392 4.900 1.00 0.00 H new ATOM 0 HA TYR B 6 1.534 -14.801 2.043 1.00 0.00 H new ATOM 0 HB2 TYR B 6 -0.423 -16.861 3.034 1.00 0.00 H new ATOM 0 HB3 TYR B 6 0.224 -16.650 1.419 1.00 0.00 H new ATOM 0 HD1 TYR B 6 3.149 -16.315 2.104 1.00 0.00 H new ATOM 0 HD2 TYR B 6 0.253 -19.085 3.548 1.00 0.00 H new ATOM 0 HE1 TYR B 6 4.938 -17.917 2.597 1.00 0.00 H new ATOM 0 HE2 TYR B 6 2.045 -20.694 4.045 1.00 0.00 H new ATOM 0 HH TYR B 6 4.212 -21.118 4.009 1.00 0.00 H new ATOM 923 N LEU B 7 -0.451 -13.394 1.786 1.00 0.00 N ATOM 924 CA LEU B 7 -1.530 -12.430 1.635 1.00 0.00 C ATOM 925 C LEU B 7 -2.368 -12.761 0.413 1.00 0.00 C ATOM 926 O LEU B 7 -1.921 -12.572 -0.715 1.00 0.00 O ATOM 927 CB LEU B 7 -0.881 -11.059 1.446 1.00 0.00 C ATOM 928 CG LEU B 7 -1.473 -9.850 2.175 1.00 0.00 C ATOM 929 CD1 LEU B 7 -2.124 -10.209 3.494 1.00 0.00 C ATOM 930 CD2 LEU B 7 -0.367 -8.831 2.386 1.00 0.00 C ATOM 0 H LEU B 7 0.245 -13.356 1.041 1.00 0.00 H new ATOM 0 HA LEU B 7 -2.181 -12.447 2.509 1.00 0.00 H new ATOM 0 HB2 LEU B 7 0.163 -11.145 1.746 1.00 0.00 H new ATOM 0 HB3 LEU B 7 -0.888 -10.836 0.379 1.00 0.00 H new ATOM 0 HG LEU B 7 -2.269 -9.437 1.555 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -2.523 -9.308 3.960 1.00 0.00 H new ATOM 0 HD12 LEU B 7 -2.934 -10.917 3.319 1.00 0.00 H new ATOM 0 HD13 LEU B 7 -1.384 -10.661 4.154 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -0.768 -7.960 2.905 1.00 0.00 H new ATOM 0 HD22 LEU B 7 0.428 -9.276 2.985 1.00 0.00 H new ATOM 0 HD23 LEU B 7 0.035 -8.525 1.420 1.00 0.00 H new ATOM 942 N GLN B 8 -3.592 -13.220 0.619 1.00 0.00 N ATOM 943 CA GLN B 8 -4.436 -13.533 -0.513 1.00 0.00 C ATOM 944 C GLN B 8 -5.100 -12.276 -1.040 1.00 0.00 C ATOM 945 O GLN B 8 -5.922 -11.663 -0.367 1.00 0.00 O ATOM 946 CB GLN B 8 -5.476 -14.584 -0.144 1.00 0.00 C ATOM 947 CG GLN B 8 -5.667 -15.643 -1.215 1.00 0.00 C ATOM 948 CD GLN B 8 -7.014 -16.347 -1.141 1.00 0.00 C ATOM 949 OE1 GLN B 8 -7.507 -16.862 -2.144 1.00 0.00 O ATOM 950 NE2 GLN B 8 -7.624 -16.367 0.038 1.00 0.00 N ATOM 0 H GLN B 8 -4.011 -13.380 1.535 1.00 0.00 H new ATOM 0 HA GLN B 8 -3.810 -13.948 -1.303 1.00 0.00 H new ATOM 0 HB2 GLN B 8 -5.179 -15.068 0.786 1.00 0.00 H new ATOM 0 HB3 GLN B 8 -6.430 -14.091 0.044 1.00 0.00 H new ATOM 0 HG2 GLN B 8 -5.562 -15.179 -2.196 1.00 0.00 H new ATOM 0 HG3 GLN B 8 -4.873 -16.385 -1.127 1.00 0.00 H new ATOM 0 HE21 GLN B 8 -7.184 -15.929 0.847 1.00 0.00 H new ATOM 0 HE22 GLN B 8 -8.533 -16.820 0.134 1.00 0.00 H new ATOM 959 N VAL B 9 -4.744 -11.906 -2.260 1.00 0.00 N ATOM 960 CA VAL B 9 -5.283 -10.700 -2.855 1.00 0.00 C ATOM 961 C VAL B 9 -6.056 -11.006 -4.129 1.00 0.00 C ATOM 962 O VAL B 9 -5.518 -11.581 -5.068 1.00 0.00 O ATOM 963 CB VAL B 9 -4.163 -9.688 -3.135 1.00 0.00 C ATOM 964 CG1 VAL B 9 -4.648 -8.573 -4.039 1.00 0.00 C ATOM 965 CG2 VAL B 9 -3.614 -9.141 -1.829 1.00 0.00 C ATOM 0 H VAL B 9 -4.090 -12.420 -2.851 1.00 0.00 H new ATOM 0 HA VAL B 9 -5.979 -10.261 -2.140 1.00 0.00 H new ATOM 0 HB VAL B 9 -3.356 -10.201 -3.658 1.00 0.00 H new ATOM 0 HG11 VAL B 9 -3.834 -7.871 -4.220 1.00 0.00 H new ATOM 0 HG12 VAL B 9 -4.983 -8.993 -4.987 1.00 0.00 H new ATOM 0 HG13 VAL B 9 -5.477 -8.051 -3.561 1.00 0.00 H new ATOM 0 HG21 VAL B 9 -2.820 -8.424 -2.040 1.00 0.00 H new ATOM 0 HG22 VAL B 9 -4.413 -8.646 -1.277 1.00 0.00 H new ATOM 0 HG23 VAL B 9 -3.214 -9.960 -1.231 1.00 0.00 H new ATOM 975 N ARG B 10 -7.300 -10.553 -4.184 1.00 0.00 N ATOM 976 CA ARG B 10 -8.148 -10.829 -5.336 1.00 0.00 C ATOM 977 C ARG B 10 -8.119 -9.669 -6.321 1.00 0.00 C ATOM 978 O ARG B 10 -8.116 -8.503 -5.928 1.00 0.00 O ATOM 979 CB ARG B 10 -9.585 -11.121 -4.895 1.00 0.00 C ATOM 980 CG ARG B 10 -10.385 -11.937 -5.900 1.00 0.00 C ATOM 981 CD ARG B 10 -11.006 -11.060 -6.977 1.00 0.00 C ATOM 982 NE ARG B 10 -11.785 -11.840 -7.936 1.00 0.00 N ATOM 983 CZ ARG B 10 -12.398 -11.314 -8.992 1.00 0.00 C ATOM 984 NH1 ARG B 10 -12.325 -10.010 -9.226 1.00 0.00 N ATOM 985 NH2 ARG B 10 -13.086 -12.092 -9.817 1.00 0.00 N ATOM 0 H ARG B 10 -7.742 -9.997 -3.452 1.00 0.00 H new ATOM 0 HA ARG B 10 -7.756 -11.714 -5.838 1.00 0.00 H new ATOM 0 HB2 ARG B 10 -9.562 -11.655 -3.945 1.00 0.00 H new ATOM 0 HB3 ARG B 10 -10.099 -10.176 -4.717 1.00 0.00 H new ATOM 0 HG2 ARG B 10 -9.735 -12.678 -6.365 1.00 0.00 H new ATOM 0 HG3 ARG B 10 -11.171 -12.484 -5.380 1.00 0.00 H new ATOM 0 HD2 ARG B 10 -11.648 -10.313 -6.511 1.00 0.00 H new ATOM 0 HD3 ARG B 10 -10.219 -10.520 -7.503 1.00 0.00 H new ATOM 0 HE ARG B 10 -11.863 -12.846 -7.787 1.00 0.00 H new ATOM 0 HH11 ARG B 10 -11.797 -9.407 -8.595 1.00 0.00 H new ATOM 0 HH12 ARG B 10 -12.797 -9.610 -10.037 1.00 0.00 H new ATOM 0 HH21 ARG B 10 -13.145 -13.095 -9.642 1.00 0.00 H new ATOM 0 HH22 ARG B 10 -13.556 -11.687 -10.627 1.00 0.00 H new ATOM 999 N GLY B 11 -8.096 -10.004 -7.599 1.00 0.00 N ATOM 1000 CA GLY B 11 -8.051 -8.978 -8.622 1.00 0.00 C ATOM 1001 C GLY B 11 -6.626 -8.605 -8.979 1.00 0.00 C ATOM 1002 O GLY B 11 -5.842 -8.223 -8.110 1.00 0.00 O ATOM 0 H GLY B 11 -8.108 -10.962 -7.948 1.00 0.00 H new ATOM 0 HA2 GLY B 11 -8.569 -9.330 -9.514 1.00 0.00 H new ATOM 0 HA3 GLY B 11 -8.583 -8.093 -8.273 1.00 0.00 H new ATOM 1006 N ARG B 12 -6.292 -8.720 -10.257 1.00 0.00 N ATOM 1007 CA ARG B 12 -4.950 -8.406 -10.736 1.00 0.00 C ATOM 1008 C ARG B 12 -4.493 -7.005 -10.327 1.00 0.00 C ATOM 1009 O ARG B 12 -3.380 -6.841 -9.832 1.00 0.00 O ATOM 1010 CB ARG B 12 -4.875 -8.563 -12.255 1.00 0.00 C ATOM 1011 CG ARG B 12 -3.465 -8.787 -12.771 1.00 0.00 C ATOM 1012 CD ARG B 12 -2.964 -10.180 -12.426 1.00 0.00 C ATOM 1013 NE ARG B 12 -1.571 -10.373 -12.820 1.00 0.00 N ATOM 1014 CZ ARG B 12 -1.109 -11.485 -13.386 1.00 0.00 C ATOM 1015 NH1 ARG B 12 -1.931 -12.494 -13.642 1.00 0.00 N ATOM 1016 NH2 ARG B 12 0.174 -11.585 -13.702 1.00 0.00 N ATOM 0 H ARG B 12 -6.935 -9.030 -10.986 1.00 0.00 H new ATOM 0 HA ARG B 12 -4.271 -9.116 -10.264 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -5.502 -9.402 -12.557 1.00 0.00 H new ATOM 0 HB3 ARG B 12 -5.288 -7.671 -12.726 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -3.445 -8.649 -13.852 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -2.796 -8.041 -12.342 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -3.064 -10.346 -11.353 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -3.588 -10.923 -12.923 1.00 0.00 H new ATOM 0 HE ARG B 12 -0.914 -9.611 -12.651 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -2.920 -12.419 -13.405 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -1.574 -13.345 -14.076 1.00 0.00 H new ATOM 0 HH21 ARG B 12 0.808 -10.809 -13.511 1.00 0.00 H new ATOM 0 HH22 ARG B 12 0.527 -12.438 -14.136 1.00 0.00 H new ATOM 1030 N GLU B 13 -5.337 -5.996 -10.535 1.00 0.00 N ATOM 1031 CA GLU B 13 -4.975 -4.619 -10.191 1.00 0.00 C ATOM 1032 C GLU B 13 -4.511 -4.495 -8.739 1.00 0.00 C ATOM 1033 O GLU B 13 -3.490 -3.868 -8.458 1.00 0.00 O ATOM 1034 CB GLU B 13 -6.158 -3.681 -10.449 1.00 0.00 C ATOM 1035 CG GLU B 13 -5.871 -2.223 -10.124 1.00 0.00 C ATOM 1036 CD GLU B 13 -6.933 -1.289 -10.673 1.00 0.00 C ATOM 1037 OE1 GLU B 13 -8.093 -1.376 -10.219 1.00 0.00 O ATOM 1038 OE2 GLU B 13 -6.605 -0.474 -11.560 1.00 0.00 O ATOM 0 H GLU B 13 -6.269 -6.102 -10.936 1.00 0.00 H new ATOM 0 HA GLU B 13 -4.139 -4.331 -10.828 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -6.449 -3.759 -11.497 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -7.009 -4.014 -9.856 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -5.807 -2.100 -9.043 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -4.900 -1.946 -10.535 1.00 0.00 H new ATOM 1045 N ASN B 14 -5.265 -5.094 -7.822 1.00 0.00 N ATOM 1046 CA ASN B 14 -4.934 -5.048 -6.400 1.00 0.00 C ATOM 1047 C ASN B 14 -3.654 -5.836 -6.109 1.00 0.00 C ATOM 1048 O ASN B 14 -2.791 -5.377 -5.362 1.00 0.00 O ATOM 1049 CB ASN B 14 -6.094 -5.606 -5.577 1.00 0.00 C ATOM 1050 CG ASN B 14 -7.422 -4.977 -5.952 1.00 0.00 C ATOM 1051 OD1 ASN B 14 -7.474 -3.839 -6.418 1.00 0.00 O ATOM 1052 ND2 ASN B 14 -8.507 -5.715 -5.745 1.00 0.00 N ATOM 0 H ASN B 14 -6.112 -5.619 -8.039 1.00 0.00 H new ATOM 0 HA ASN B 14 -4.763 -4.008 -6.121 1.00 0.00 H new ATOM 0 HB2 ASN B 14 -6.152 -6.685 -5.721 1.00 0.00 H new ATOM 0 HB3 ASN B 14 -5.900 -5.435 -4.518 1.00 0.00 H new ATOM 0 HD21 ASN B 14 -9.428 -5.343 -5.974 1.00 0.00 H new ATOM 0 HD22 ASN B 14 -8.419 -6.654 -5.357 1.00 0.00 H new ATOM 1059 N PHE B 15 -3.543 -7.022 -6.701 1.00 0.00 N ATOM 1060 CA PHE B 15 -2.371 -7.875 -6.517 1.00 0.00 C ATOM 1061 C PHE B 15 -1.089 -7.166 -6.941 1.00 0.00 C ATOM 1062 O PHE B 15 -0.089 -7.239 -6.248 1.00 0.00 O ATOM 1063 CB PHE B 15 -2.539 -9.170 -7.312 1.00 0.00 C ATOM 1064 CG PHE B 15 -1.430 -10.160 -7.097 1.00 0.00 C ATOM 1065 CD1 PHE B 15 -0.968 -10.443 -5.818 1.00 0.00 C ATOM 1066 CD2 PHE B 15 -0.850 -10.812 -8.174 1.00 0.00 C ATOM 1067 CE1 PHE B 15 0.044 -11.354 -5.622 1.00 0.00 C ATOM 1068 CE2 PHE B 15 0.170 -11.727 -7.978 1.00 0.00 C ATOM 1069 CZ PHE B 15 0.614 -11.997 -6.697 1.00 0.00 C ATOM 0 H PHE B 15 -4.255 -7.417 -7.316 1.00 0.00 H new ATOM 0 HA PHE B 15 -2.289 -8.107 -5.455 1.00 0.00 H new ATOM 0 HB2 PHE B 15 -3.486 -9.634 -7.037 1.00 0.00 H new ATOM 0 HB3 PHE B 15 -2.598 -8.929 -8.373 1.00 0.00 H new ATOM 0 HD1 PHE B 15 -1.408 -9.942 -4.968 1.00 0.00 H new ATOM 0 HD2 PHE B 15 -1.197 -10.604 -9.175 1.00 0.00 H new ATOM 0 HE1 PHE B 15 0.392 -11.565 -4.622 1.00 0.00 H new ATOM 0 HE2 PHE B 15 0.618 -12.228 -8.823 1.00 0.00 H new ATOM 0 HZ PHE B 15 1.408 -12.712 -6.540 1.00 0.00 H new ATOM 1079 N GLU B 16 -1.121 -6.508 -8.096 1.00 0.00 N ATOM 1080 CA GLU B 16 0.041 -5.775 -8.612 1.00 0.00 C ATOM 1081 C GLU B 16 0.415 -4.606 -7.711 1.00 0.00 C ATOM 1082 O GLU B 16 1.591 -4.415 -7.404 1.00 0.00 O ATOM 1083 CB GLU B 16 -0.240 -5.269 -10.028 1.00 0.00 C ATOM 1084 CG GLU B 16 -0.463 -6.382 -11.038 1.00 0.00 C ATOM 1085 CD GLU B 16 -0.718 -5.856 -12.437 1.00 0.00 C ATOM 1086 OE1 GLU B 16 -1.875 -5.488 -12.731 1.00 0.00 O ATOM 1087 OE2 GLU B 16 0.239 -5.812 -13.238 1.00 0.00 O ATOM 0 H GLU B 16 -1.942 -6.465 -8.699 1.00 0.00 H new ATOM 0 HA GLU B 16 0.883 -6.466 -8.632 1.00 0.00 H new ATOM 0 HB2 GLU B 16 -1.120 -4.627 -10.007 1.00 0.00 H new ATOM 0 HB3 GLU B 16 0.597 -4.653 -10.357 1.00 0.00 H new ATOM 0 HG2 GLU B 16 0.410 -7.035 -11.053 1.00 0.00 H new ATOM 0 HG3 GLU B 16 -1.311 -6.990 -10.722 1.00 0.00 H new ATOM 1094 N ILE B 17 -0.567 -3.823 -7.288 1.00 0.00 N ATOM 1095 CA ILE B 17 -0.284 -2.693 -6.420 1.00 0.00 C ATOM 1096 C ILE B 17 0.330 -3.173 -5.110 1.00 0.00 C ATOM 1097 O ILE B 17 1.307 -2.600 -4.621 1.00 0.00 O ATOM 1098 CB ILE B 17 -1.558 -1.857 -6.157 1.00 0.00 C ATOM 1099 CG1 ILE B 17 -1.601 -0.672 -7.125 1.00 0.00 C ATOM 1100 CG2 ILE B 17 -1.618 -1.366 -4.715 1.00 0.00 C ATOM 1101 CD1 ILE B 17 -2.975 -0.081 -7.307 1.00 0.00 C ATOM 0 H ILE B 17 -1.551 -3.947 -7.528 1.00 0.00 H new ATOM 0 HA ILE B 17 0.435 -2.048 -6.925 1.00 0.00 H new ATOM 0 HB ILE B 17 -2.426 -2.495 -6.322 1.00 0.00 H new ATOM 0 HG12 ILE B 17 -0.927 0.105 -6.763 1.00 0.00 H new ATOM 0 HG13 ILE B 17 -1.224 -0.994 -8.095 1.00 0.00 H new ATOM 0 HG21 ILE B 17 -2.527 -0.782 -4.567 1.00 0.00 H new ATOM 0 HG22 ILE B 17 -1.622 -2.221 -4.039 1.00 0.00 H new ATOM 0 HG23 ILE B 17 -0.748 -0.743 -4.506 1.00 0.00 H new ATOM 0 HD11 ILE B 17 -2.923 0.753 -8.007 1.00 0.00 H new ATOM 0 HD12 ILE B 17 -3.649 -0.842 -7.700 1.00 0.00 H new ATOM 0 HD13 ILE B 17 -3.348 0.274 -6.347 1.00 0.00 H new ATOM 1113 N LEU B 18 -0.231 -4.240 -4.556 1.00 0.00 N ATOM 1114 CA LEU B 18 0.256 -4.793 -3.306 1.00 0.00 C ATOM 1115 C LEU B 18 1.577 -5.532 -3.507 1.00 0.00 C ATOM 1116 O LEU B 18 2.429 -5.508 -2.633 1.00 0.00 O ATOM 1117 CB LEU B 18 -0.786 -5.750 -2.725 1.00 0.00 C ATOM 1118 CG LEU B 18 -1.952 -5.080 -1.997 1.00 0.00 C ATOM 1119 CD1 LEU B 18 -3.239 -5.851 -2.228 1.00 0.00 C ATOM 1120 CD2 LEU B 18 -1.660 -4.986 -0.508 1.00 0.00 C ATOM 0 H LEU B 18 -1.026 -4.739 -4.956 1.00 0.00 H new ATOM 0 HA LEU B 18 0.428 -3.969 -2.613 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -1.187 -6.360 -3.534 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -0.287 -6.427 -2.032 1.00 0.00 H new ATOM 0 HG LEU B 18 -2.073 -4.073 -2.397 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -4.057 -5.359 -1.702 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -3.459 -5.880 -3.295 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.126 -6.868 -1.853 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -2.498 -4.507 -0.002 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -1.515 -5.987 -0.102 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -0.757 -4.396 -0.351 1.00 0.00 H new ATOM 1132 N MET B 19 1.729 -6.215 -4.647 1.00 0.00 N ATOM 1133 CA MET B 19 2.959 -6.969 -4.930 1.00 0.00 C ATOM 1134 C MET B 19 4.153 -6.023 -4.974 1.00 0.00 C ATOM 1135 O MET B 19 5.172 -6.286 -4.335 1.00 0.00 O ATOM 1136 CB MET B 19 2.839 -7.776 -6.230 1.00 0.00 C ATOM 1137 CG MET B 19 3.625 -9.080 -6.239 1.00 0.00 C ATOM 1138 SD MET B 19 5.382 -8.853 -5.936 1.00 0.00 S ATOM 1139 CE MET B 19 5.849 -10.543 -5.583 1.00 0.00 C ATOM 0 H MET B 19 1.024 -6.262 -5.383 1.00 0.00 H new ATOM 0 HA MET B 19 3.114 -7.686 -4.124 1.00 0.00 H new ATOM 0 HB2 MET B 19 1.787 -7.999 -6.408 1.00 0.00 H new ATOM 0 HB3 MET B 19 3.178 -7.156 -7.060 1.00 0.00 H new ATOM 0 HG2 MET B 19 3.216 -9.748 -5.481 1.00 0.00 H new ATOM 0 HG3 MET B 19 3.490 -9.571 -7.203 1.00 0.00 H new ATOM 0 HE1 MET B 19 6.875 -10.568 -5.216 1.00 0.00 H new ATOM 0 HE2 MET B 19 5.182 -10.954 -4.825 1.00 0.00 H new ATOM 0 HE3 MET B 19 5.775 -11.139 -6.493 1.00 0.00 H new ATOM 1149 N LYS B 20 4.043 -4.927 -5.722 1.00 0.00 N ATOM 1150 CA LYS B 20 5.113 -3.941 -5.766 1.00 0.00 C ATOM 1151 C LYS B 20 5.399 -3.463 -4.366 1.00 0.00 C ATOM 1152 O LYS B 20 6.549 -3.284 -3.966 1.00 0.00 O ATOM 1153 CB LYS B 20 4.720 -2.722 -6.594 1.00 0.00 C ATOM 1154 CG LYS B 20 5.617 -1.516 -6.320 1.00 0.00 C ATOM 1155 CD LYS B 20 6.329 -1.063 -7.569 1.00 0.00 C ATOM 1156 CE LYS B 20 7.106 0.221 -7.337 1.00 0.00 C ATOM 1157 NZ LYS B 20 8.280 0.007 -6.446 1.00 0.00 N ATOM 0 H LYS B 20 3.232 -4.703 -6.299 1.00 0.00 H new ATOM 0 HA LYS B 20 5.983 -4.417 -6.217 1.00 0.00 H new ATOM 0 HB2 LYS B 20 4.770 -2.975 -7.653 1.00 0.00 H new ATOM 0 HB3 LYS B 20 3.685 -2.458 -6.377 1.00 0.00 H new ATOM 0 HG2 LYS B 20 5.016 -0.697 -5.925 1.00 0.00 H new ATOM 0 HG3 LYS B 20 6.350 -1.772 -5.555 1.00 0.00 H new ATOM 0 HD2 LYS B 20 7.010 -1.845 -7.904 1.00 0.00 H new ATOM 0 HD3 LYS B 20 5.603 -0.910 -8.367 1.00 0.00 H new ATOM 0 HE2 LYS B 20 7.444 0.618 -8.294 1.00 0.00 H new ATOM 0 HE3 LYS B 20 6.447 0.969 -6.896 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 8.744 0.919 -6.258 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 7.963 -0.412 -5.548 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 8.954 -0.636 -6.909 1.00 0.00 H new ATOM 1171 N LEU B 21 4.323 -3.262 -3.629 1.00 0.00 N ATOM 1172 CA LEU B 21 4.418 -2.777 -2.273 1.00 0.00 C ATOM 1173 C LEU B 21 5.146 -3.785 -1.393 1.00 0.00 C ATOM 1174 O LEU B 21 6.013 -3.422 -0.603 1.00 0.00 O ATOM 1175 CB LEU B 21 3.021 -2.478 -1.728 1.00 0.00 C ATOM 1176 CG LEU B 21 2.931 -1.494 -0.565 1.00 0.00 C ATOM 1177 CD1 LEU B 21 1.613 -1.662 0.163 1.00 0.00 C ATOM 1178 CD2 LEU B 21 4.085 -1.653 0.410 1.00 0.00 C ATOM 0 H LEU B 21 3.370 -3.429 -3.952 1.00 0.00 H new ATOM 0 HA LEU B 21 4.996 -1.853 -2.267 1.00 0.00 H new ATOM 0 HB2 LEU B 21 2.413 -2.093 -2.546 1.00 0.00 H new ATOM 0 HB3 LEU B 21 2.571 -3.419 -1.412 1.00 0.00 H new ATOM 0 HG LEU B 21 2.991 -0.490 -0.985 1.00 0.00 H new ATOM 0 HD11 LEU B 21 1.562 -0.954 0.990 1.00 0.00 H new ATOM 0 HD12 LEU B 21 0.790 -1.475 -0.527 1.00 0.00 H new ATOM 0 HD13 LEU B 21 1.538 -2.678 0.550 1.00 0.00 H new ATOM 0 HD21 LEU B 21 3.978 -0.932 1.221 1.00 0.00 H new ATOM 0 HD22 LEU B 21 4.079 -2.663 0.820 1.00 0.00 H new ATOM 0 HD23 LEU B 21 5.027 -1.478 -0.110 1.00 0.00 H new ATOM 1190 N LYS B 22 4.802 -5.054 -1.547 1.00 0.00 N ATOM 1191 CA LYS B 22 5.436 -6.113 -0.790 1.00 0.00 C ATOM 1192 C LYS B 22 6.939 -6.030 -0.990 1.00 0.00 C ATOM 1193 O LYS B 22 7.717 -6.231 -0.059 1.00 0.00 O ATOM 1194 CB LYS B 22 4.874 -7.462 -1.255 1.00 0.00 C ATOM 1195 CG LYS B 22 5.843 -8.626 -1.171 1.00 0.00 C ATOM 1196 CD LYS B 22 5.326 -9.813 -1.966 1.00 0.00 C ATOM 1197 CE LYS B 22 6.440 -10.780 -2.320 1.00 0.00 C ATOM 1198 NZ LYS B 22 7.614 -10.084 -2.915 1.00 0.00 N ATOM 0 H LYS B 22 4.082 -5.373 -2.195 1.00 0.00 H new ATOM 0 HA LYS B 22 5.230 -6.009 0.275 1.00 0.00 H new ATOM 0 HB2 LYS B 22 3.994 -7.698 -0.656 1.00 0.00 H new ATOM 0 HB3 LYS B 22 4.539 -7.362 -2.287 1.00 0.00 H new ATOM 0 HG2 LYS B 22 6.818 -8.323 -1.553 1.00 0.00 H new ATOM 0 HG3 LYS B 22 5.985 -8.913 -0.129 1.00 0.00 H new ATOM 0 HD2 LYS B 22 4.563 -10.333 -1.388 1.00 0.00 H new ATOM 0 HD3 LYS B 22 4.848 -9.459 -2.879 1.00 0.00 H new ATOM 0 HE2 LYS B 22 6.752 -11.317 -1.424 1.00 0.00 H new ATOM 0 HE3 LYS B 22 6.065 -11.524 -3.023 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 8.245 -10.783 -3.356 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 7.289 -9.408 -3.635 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 8.130 -9.574 -2.170 1.00 0.00 H new ATOM 1212 N GLU B 23 7.335 -5.726 -2.221 1.00 0.00 N ATOM 1213 CA GLU B 23 8.740 -5.577 -2.554 1.00 0.00 C ATOM 1214 C GLU B 23 9.321 -4.337 -1.880 1.00 0.00 C ATOM 1215 O GLU B 23 10.411 -4.395 -1.325 1.00 0.00 O ATOM 1216 CB GLU B 23 8.937 -5.504 -4.070 1.00 0.00 C ATOM 1217 CG GLU B 23 8.559 -6.785 -4.796 1.00 0.00 C ATOM 1218 CD GLU B 23 8.610 -6.638 -6.304 1.00 0.00 C ATOM 1219 OE1 GLU B 23 7.588 -6.231 -6.895 1.00 0.00 O ATOM 1220 OE2 GLU B 23 9.672 -6.931 -6.893 1.00 0.00 O ATOM 0 H GLU B 23 6.698 -5.578 -3.004 1.00 0.00 H new ATOM 0 HA GLU B 23 9.271 -6.454 -2.184 1.00 0.00 H new ATOM 0 HB2 GLU B 23 8.340 -4.682 -4.466 1.00 0.00 H new ATOM 0 HB3 GLU B 23 9.981 -5.271 -4.281 1.00 0.00 H new ATOM 0 HG2 GLU B 23 9.234 -7.584 -4.490 1.00 0.00 H new ATOM 0 HG3 GLU B 23 7.554 -7.084 -4.498 1.00 0.00 H new ATOM 1227 N SER B 24 8.606 -3.209 -1.936 1.00 0.00 N ATOM 1228 CA SER B 24 9.093 -1.980 -1.307 1.00 0.00 C ATOM 1229 C SER B 24 9.274 -2.154 0.206 1.00 0.00 C ATOM 1230 O SER B 24 10.304 -1.770 0.760 1.00 0.00 O ATOM 1231 CB SER B 24 8.157 -0.807 -1.602 1.00 0.00 C ATOM 1232 OG SER B 24 6.881 -1.011 -1.024 1.00 0.00 O ATOM 0 H SER B 24 7.703 -3.122 -2.402 1.00 0.00 H new ATOM 0 HA SER B 24 10.070 -1.760 -1.737 1.00 0.00 H new ATOM 0 HB2 SER B 24 8.591 0.114 -1.214 1.00 0.00 H new ATOM 0 HB3 SER B 24 8.055 -0.682 -2.680 1.00 0.00 H new ATOM 0 HG SER B 24 6.684 -1.971 -0.996 1.00 0.00 H new ATOM 1238 N LEU B 25 8.270 -2.730 0.870 1.00 0.00 N ATOM 1239 CA LEU B 25 8.324 -2.957 2.315 1.00 0.00 C ATOM 1240 C LEU B 25 9.434 -3.937 2.679 1.00 0.00 C ATOM 1241 O LEU B 25 10.201 -3.699 3.613 1.00 0.00 O ATOM 1242 CB LEU B 25 6.981 -3.491 2.823 1.00 0.00 C ATOM 1243 CG LEU B 25 5.925 -2.425 3.137 1.00 0.00 C ATOM 1244 CD1 LEU B 25 4.566 -3.069 3.346 1.00 0.00 C ATOM 1245 CD2 LEU B 25 6.313 -1.624 4.368 1.00 0.00 C ATOM 0 H LEU B 25 7.408 -3.048 0.428 1.00 0.00 H new ATOM 0 HA LEU B 25 8.536 -2.000 2.792 1.00 0.00 H new ATOM 0 HB2 LEU B 25 6.574 -4.172 2.075 1.00 0.00 H new ATOM 0 HB3 LEU B 25 7.160 -4.077 3.724 1.00 0.00 H new ATOM 0 HG LEU B 25 5.869 -1.747 2.286 1.00 0.00 H new ATOM 0 HD11 LEU B 25 3.828 -2.298 3.568 1.00 0.00 H new ATOM 0 HD12 LEU B 25 4.273 -3.602 2.441 1.00 0.00 H new ATOM 0 HD13 LEU B 25 4.620 -3.770 4.179 1.00 0.00 H new ATOM 0 HD21 LEU B 25 5.548 -0.874 4.570 1.00 0.00 H new ATOM 0 HD22 LEU B 25 6.401 -2.293 5.224 1.00 0.00 H new ATOM 0 HD23 LEU B 25 7.269 -1.130 4.194 1.00 0.00 H new ATOM 1257 N GLU B 26 9.516 -5.038 1.940 1.00 0.00 N ATOM 1258 CA GLU B 26 10.532 -6.054 2.195 1.00 0.00 C ATOM 1259 C GLU B 26 11.930 -5.515 1.904 1.00 0.00 C ATOM 1260 O GLU B 26 12.864 -5.743 2.668 1.00 0.00 O ATOM 1261 CB GLU B 26 10.269 -7.303 1.350 1.00 0.00 C ATOM 1262 CG GLU B 26 9.117 -8.153 1.860 1.00 0.00 C ATOM 1263 CD GLU B 26 9.072 -9.523 1.213 1.00 0.00 C ATOM 1264 OE1 GLU B 26 9.831 -10.412 1.652 1.00 0.00 O ATOM 1265 OE2 GLU B 26 8.277 -9.708 0.268 1.00 0.00 O ATOM 0 H GLU B 26 8.893 -5.250 1.161 1.00 0.00 H new ATOM 0 HA GLU B 26 10.477 -6.322 3.250 1.00 0.00 H new ATOM 0 HB2 GLU B 26 10.059 -7.000 0.324 1.00 0.00 H new ATOM 0 HB3 GLU B 26 11.174 -7.911 1.324 1.00 0.00 H new ATOM 0 HG2 GLU B 26 9.206 -8.268 2.940 1.00 0.00 H new ATOM 0 HG3 GLU B 26 8.177 -7.635 1.671 1.00 0.00 H new ATOM 1272 N LEU B 27 12.060 -4.798 0.792 1.00 0.00 N ATOM 1273 CA LEU B 27 13.331 -4.208 0.393 1.00 0.00 C ATOM 1274 C LEU B 27 13.783 -3.128 1.370 1.00 0.00 C ATOM 1275 O LEU B 27 14.977 -2.944 1.576 1.00 0.00 O ATOM 1276 CB LEU B 27 13.227 -3.621 -1.017 1.00 0.00 C ATOM 1277 CG LEU B 27 13.338 -4.643 -2.153 1.00 0.00 C ATOM 1278 CD1 LEU B 27 12.922 -4.025 -3.476 1.00 0.00 C ATOM 1279 CD2 LEU B 27 14.756 -5.179 -2.250 1.00 0.00 C ATOM 0 H LEU B 27 11.292 -4.611 0.147 1.00 0.00 H new ATOM 0 HA LEU B 27 14.077 -5.003 0.401 1.00 0.00 H new ATOM 0 HB2 LEU B 27 12.274 -3.101 -1.108 1.00 0.00 H new ATOM 0 HB3 LEU B 27 14.011 -2.874 -1.142 1.00 0.00 H new ATOM 0 HG LEU B 27 12.664 -5.471 -1.931 1.00 0.00 H new ATOM 0 HD11 LEU B 27 13.009 -4.769 -4.268 1.00 0.00 H new ATOM 0 HD12 LEU B 27 11.889 -3.684 -3.410 1.00 0.00 H new ATOM 0 HD13 LEU B 27 13.570 -3.178 -3.701 1.00 0.00 H new ATOM 0 HD21 LEU B 27 14.816 -5.904 -3.062 1.00 0.00 H new ATOM 0 HD22 LEU B 27 15.443 -4.356 -2.446 1.00 0.00 H new ATOM 0 HD23 LEU B 27 15.027 -5.663 -1.312 1.00 0.00 H new ATOM 1291 N MET B 28 12.856 -2.405 1.977 1.00 0.00 N ATOM 1292 CA MET B 28 13.261 -1.357 2.907 1.00 0.00 C ATOM 1293 C MET B 28 14.180 -1.911 4.004 1.00 0.00 C ATOM 1294 O MET B 28 14.810 -1.145 4.732 1.00 0.00 O ATOM 1295 CB MET B 28 12.050 -0.638 3.510 1.00 0.00 C ATOM 1296 CG MET B 28 12.414 0.649 4.229 1.00 0.00 C ATOM 1297 SD MET B 28 11.209 1.135 5.479 1.00 0.00 S ATOM 1298 CE MET B 28 10.023 2.029 4.481 1.00 0.00 C ATOM 0 H MET B 28 11.850 -2.516 1.851 1.00 0.00 H new ATOM 0 HA MET B 28 13.828 -0.620 2.338 1.00 0.00 H new ATOM 0 HB2 MET B 28 11.337 -0.414 2.717 1.00 0.00 H new ATOM 0 HB3 MET B 28 11.549 -1.308 4.209 1.00 0.00 H new ATOM 0 HG2 MET B 28 13.389 0.529 4.702 1.00 0.00 H new ATOM 0 HG3 MET B 28 12.511 1.451 3.497 1.00 0.00 H new ATOM 0 HE1 MET B 28 9.629 2.870 5.051 1.00 0.00 H new ATOM 0 HE2 MET B 28 10.511 2.398 3.579 1.00 0.00 H new ATOM 0 HE3 MET B 28 9.205 1.363 4.204 1.00 0.00 H new ATOM 1308 N GLU B 29 14.252 -3.235 4.134 1.00 0.00 N ATOM 1309 CA GLU B 29 15.101 -3.858 5.146 1.00 0.00 C ATOM 1310 C GLU B 29 16.510 -4.145 4.615 1.00 0.00 C ATOM 1311 O GLU B 29 17.460 -4.249 5.392 1.00 0.00 O ATOM 1312 CB GLU B 29 14.463 -5.163 5.637 1.00 0.00 C ATOM 1313 CG GLU B 29 14.838 -6.386 4.812 1.00 0.00 C ATOM 1314 CD GLU B 29 14.093 -7.632 5.247 1.00 0.00 C ATOM 1315 OE1 GLU B 29 14.549 -8.292 6.205 1.00 0.00 O ATOM 1316 OE2 GLU B 29 13.054 -7.949 4.630 1.00 0.00 O ATOM 0 H GLU B 29 13.734 -3.894 3.553 1.00 0.00 H new ATOM 0 HA GLU B 29 15.191 -3.154 5.973 1.00 0.00 H new ATOM 0 HB2 GLU B 29 14.758 -5.332 6.673 1.00 0.00 H new ATOM 0 HB3 GLU B 29 13.379 -5.051 5.629 1.00 0.00 H new ATOM 0 HG2 GLU B 29 14.627 -6.189 3.761 1.00 0.00 H new ATOM 0 HG3 GLU B 29 15.911 -6.561 4.895 1.00 0.00 H new ATOM 1323 N LEU B 30 16.644 -4.272 3.293 1.00 0.00 N ATOM 1324 CA LEU B 30 17.934 -4.584 2.686 1.00 0.00 C ATOM 1325 C LEU B 30 18.715 -3.317 2.366 1.00 0.00 C ATOM 1326 O LEU B 30 19.809 -3.372 1.802 1.00 0.00 O ATOM 1327 CB LEU B 30 17.733 -5.467 1.441 1.00 0.00 C ATOM 1328 CG LEU B 30 17.908 -4.792 0.077 1.00 0.00 C ATOM 1329 CD1 LEU B 30 17.874 -5.834 -1.030 1.00 0.00 C ATOM 1330 CD2 LEU B 30 16.836 -3.745 -0.159 1.00 0.00 C ATOM 0 H LEU B 30 15.878 -4.164 2.628 1.00 0.00 H new ATOM 0 HA LEU B 30 18.531 -5.146 3.404 1.00 0.00 H new ATOM 0 HB2 LEU B 30 18.433 -6.300 1.499 1.00 0.00 H new ATOM 0 HB3 LEU B 30 16.729 -5.890 1.484 1.00 0.00 H new ATOM 0 HG LEU B 30 18.876 -4.292 0.069 1.00 0.00 H new ATOM 0 HD11 LEU B 30 17.999 -5.344 -1.995 1.00 0.00 H new ATOM 0 HD12 LEU B 30 18.681 -6.551 -0.880 1.00 0.00 H new ATOM 0 HD13 LEU B 30 16.917 -6.356 -1.009 1.00 0.00 H new ATOM 0 HD21 LEU B 30 16.987 -3.284 -1.135 1.00 0.00 H new ATOM 0 HD22 LEU B 30 15.854 -4.217 -0.128 1.00 0.00 H new ATOM 0 HD23 LEU B 30 16.896 -2.981 0.617 1.00 0.00 H new ATOM 1342 N VAL B 31 18.155 -2.178 2.745 1.00 0.00 N ATOM 1343 CA VAL B 31 18.827 -0.912 2.519 1.00 0.00 C ATOM 1344 C VAL B 31 19.528 -0.473 3.801 1.00 0.00 C ATOM 1345 O VAL B 31 18.890 -0.363 4.849 1.00 0.00 O ATOM 1346 CB VAL B 31 17.861 0.194 2.051 1.00 0.00 C ATOM 1347 CG1 VAL B 31 16.646 0.279 2.958 1.00 0.00 C ATOM 1348 CG2 VAL B 31 18.583 1.532 1.986 1.00 0.00 C ATOM 0 H VAL B 31 17.247 -2.106 3.205 1.00 0.00 H new ATOM 0 HA VAL B 31 19.554 -1.065 1.721 1.00 0.00 H new ATOM 0 HB VAL B 31 17.510 -0.060 1.051 1.00 0.00 H new ATOM 0 HG11 VAL B 31 15.982 1.068 2.604 1.00 0.00 H new ATOM 0 HG12 VAL B 31 16.116 -0.674 2.947 1.00 0.00 H new ATOM 0 HG13 VAL B 31 16.966 0.504 3.975 1.00 0.00 H new ATOM 0 HG21 VAL B 31 17.889 2.304 1.654 1.00 0.00 H new ATOM 0 HG22 VAL B 31 18.965 1.788 2.974 1.00 0.00 H new ATOM 0 HG23 VAL B 31 19.413 1.464 1.283 1.00 0.00 H new ATOM 1358 N PRO B 32 20.851 -0.232 3.743 1.00 0.00 N ATOM 1359 CA PRO B 32 21.624 0.188 4.909 1.00 0.00 C ATOM 1360 C PRO B 32 20.871 1.199 5.767 1.00 0.00 C ATOM 1361 O PRO B 32 20.355 2.196 5.262 1.00 0.00 O ATOM 1362 CB PRO B 32 22.865 0.814 4.282 1.00 0.00 C ATOM 1363 CG PRO B 32 23.073 0.041 3.024 1.00 0.00 C ATOM 1364 CD PRO B 32 21.703 -0.377 2.546 1.00 0.00 C ATOM 0 HA PRO B 32 21.843 -0.636 5.587 1.00 0.00 H new ATOM 0 HB2 PRO B 32 22.715 1.874 4.077 1.00 0.00 H new ATOM 0 HB3 PRO B 32 23.727 0.736 4.944 1.00 0.00 H new ATOM 0 HG2 PRO B 32 23.577 0.650 2.273 1.00 0.00 H new ATOM 0 HG3 PRO B 32 23.704 -0.830 3.204 1.00 0.00 H new ATOM 0 HD2 PRO B 32 21.355 0.255 1.729 1.00 0.00 H new ATOM 0 HD3 PRO B 32 21.704 -1.403 2.178 1.00 0.00 H new ATOM 1372 N GLN B 33 20.811 0.924 7.067 1.00 0.00 N ATOM 1373 CA GLN B 33 20.117 1.791 8.016 1.00 0.00 C ATOM 1374 C GLN B 33 20.488 3.270 7.837 1.00 0.00 C ATOM 1375 O GLN B 33 19.606 4.129 7.860 1.00 0.00 O ATOM 1376 CB GLN B 33 20.415 1.348 9.451 1.00 0.00 C ATOM 1377 CG GLN B 33 19.692 2.170 10.506 1.00 0.00 C ATOM 1378 CD GLN B 33 20.002 1.709 11.917 1.00 0.00 C ATOM 1379 OE1 GLN B 33 19.312 0.852 12.468 1.00 0.00 O ATOM 1380 NE2 GLN B 33 21.047 2.277 12.509 1.00 0.00 N ATOM 0 H GLN B 33 21.238 0.100 7.491 1.00 0.00 H new ATOM 0 HA GLN B 33 19.050 1.697 7.816 1.00 0.00 H new ATOM 0 HB2 GLN B 33 20.135 0.301 9.564 1.00 0.00 H new ATOM 0 HB3 GLN B 33 21.489 1.412 9.626 1.00 0.00 H new ATOM 0 HG2 GLN B 33 19.972 3.218 10.400 1.00 0.00 H new ATOM 0 HG3 GLN B 33 18.617 2.109 10.336 1.00 0.00 H new ATOM 0 HE21 GLN B 33 21.591 2.984 12.014 1.00 0.00 H new ATOM 0 HE22 GLN B 33 21.305 2.006 13.458 1.00 0.00 H new ATOM 1389 N PRO B 34 21.788 3.601 7.669 1.00 0.00 N ATOM 1390 CA PRO B 34 22.225 4.995 7.500 1.00 0.00 C ATOM 1391 C PRO B 34 21.527 5.715 6.346 1.00 0.00 C ATOM 1392 O PRO B 34 21.328 6.931 6.396 1.00 0.00 O ATOM 1393 CB PRO B 34 23.725 4.872 7.216 1.00 0.00 C ATOM 1394 CG PRO B 34 24.119 3.571 7.821 1.00 0.00 C ATOM 1395 CD PRO B 34 22.933 2.667 7.648 1.00 0.00 C ATOM 0 HA PRO B 34 21.984 5.590 8.381 1.00 0.00 H new ATOM 0 HB2 PRO B 34 23.928 4.888 6.145 1.00 0.00 H new ATOM 0 HB3 PRO B 34 24.281 5.699 7.658 1.00 0.00 H new ATOM 0 HG2 PRO B 34 25.000 3.160 7.327 1.00 0.00 H new ATOM 0 HG3 PRO B 34 24.371 3.689 8.875 1.00 0.00 H new ATOM 0 HD2 PRO B 34 22.983 2.113 6.711 1.00 0.00 H new ATOM 0 HD3 PRO B 34 22.867 1.932 8.450 1.00 0.00 H new ATOM 1403 N LEU B 35 21.143 4.965 5.311 1.00 0.00 N ATOM 1404 CA LEU B 35 20.483 5.541 4.142 1.00 0.00 C ATOM 1405 C LEU B 35 19.016 5.837 4.426 1.00 0.00 C ATOM 1406 O LEU B 35 18.463 6.815 3.922 1.00 0.00 O ATOM 1407 CB LEU B 35 20.603 4.594 2.946 1.00 0.00 C ATOM 1408 CG LEU B 35 21.760 4.894 1.997 1.00 0.00 C ATOM 1409 CD1 LEU B 35 22.295 3.610 1.383 1.00 0.00 C ATOM 1410 CD2 LEU B 35 21.317 5.858 0.906 1.00 0.00 C ATOM 0 H LEU B 35 21.279 3.955 5.261 1.00 0.00 H new ATOM 0 HA LEU B 35 20.980 6.482 3.906 1.00 0.00 H new ATOM 0 HB2 LEU B 35 20.713 3.576 3.318 1.00 0.00 H new ATOM 0 HB3 LEU B 35 19.672 4.628 2.381 1.00 0.00 H new ATOM 0 HG LEU B 35 22.561 5.362 2.570 1.00 0.00 H new ATOM 0 HD11 LEU B 35 23.119 3.845 0.709 1.00 0.00 H new ATOM 0 HD12 LEU B 35 22.649 2.949 2.174 1.00 0.00 H new ATOM 0 HD13 LEU B 35 21.500 3.115 0.825 1.00 0.00 H new ATOM 0 HD21 LEU B 35 22.154 6.061 0.238 1.00 0.00 H new ATOM 0 HD22 LEU B 35 20.499 5.414 0.338 1.00 0.00 H new ATOM 0 HD23 LEU B 35 20.980 6.790 1.359 1.00 0.00 H new ATOM 1422 N VAL B 36 18.390 4.992 5.233 1.00 0.00 N ATOM 1423 CA VAL B 36 16.990 5.184 5.581 1.00 0.00 C ATOM 1424 C VAL B 36 16.844 6.402 6.483 1.00 0.00 C ATOM 1425 O VAL B 36 15.903 7.182 6.338 1.00 0.00 O ATOM 1426 CB VAL B 36 16.374 3.942 6.255 1.00 0.00 C ATOM 1427 CG1 VAL B 36 15.011 4.267 6.849 1.00 0.00 C ATOM 1428 CG2 VAL B 36 16.263 2.800 5.257 1.00 0.00 C ATOM 0 H VAL B 36 18.826 4.173 5.656 1.00 0.00 H new ATOM 0 HA VAL B 36 16.442 5.346 4.653 1.00 0.00 H new ATOM 0 HB VAL B 36 17.031 3.632 7.067 1.00 0.00 H new ATOM 0 HG11 VAL B 36 14.597 3.375 7.319 1.00 0.00 H new ATOM 0 HG12 VAL B 36 15.118 5.054 7.596 1.00 0.00 H new ATOM 0 HG13 VAL B 36 14.341 4.605 6.059 1.00 0.00 H new ATOM 0 HG21 VAL B 36 15.826 1.930 5.747 1.00 0.00 H new ATOM 0 HG22 VAL B 36 15.628 3.104 4.425 1.00 0.00 H new ATOM 0 HG23 VAL B 36 17.255 2.546 4.883 1.00 0.00 H new ATOM 1438 N ASP B 37 17.775 6.561 7.416 1.00 0.00 N ATOM 1439 CA ASP B 37 17.755 7.705 8.314 1.00 0.00 C ATOM 1440 C ASP B 37 17.846 8.988 7.500 1.00 0.00 C ATOM 1441 O ASP B 37 17.078 9.925 7.716 1.00 0.00 O ATOM 1442 CB ASP B 37 18.925 7.632 9.296 1.00 0.00 C ATOM 1443 CG ASP B 37 18.905 8.763 10.304 1.00 0.00 C ATOM 1444 OD1 ASP B 37 19.466 9.837 10.002 1.00 0.00 O ATOM 1445 OD2 ASP B 37 18.328 8.576 11.396 1.00 0.00 O ATOM 0 H ASP B 37 18.549 5.915 7.569 1.00 0.00 H new ATOM 0 HA ASP B 37 16.824 7.695 8.880 1.00 0.00 H new ATOM 0 HB2 ASP B 37 18.894 6.679 9.823 1.00 0.00 H new ATOM 0 HB3 ASP B 37 19.863 7.660 8.742 1.00 0.00 H new ATOM 1450 N SER B 38 18.788 9.026 6.562 1.00 0.00 N ATOM 1451 CA SER B 38 18.981 10.206 5.727 1.00 0.00 C ATOM 1452 C SER B 38 17.729 10.537 4.918 1.00 0.00 C ATOM 1453 O SER B 38 17.329 11.699 4.835 1.00 0.00 O ATOM 1454 CB SER B 38 20.169 9.991 4.790 1.00 0.00 C ATOM 1455 OG SER B 38 21.389 9.967 5.510 1.00 0.00 O ATOM 0 H SER B 38 19.427 8.256 6.362 1.00 0.00 H new ATOM 0 HA SER B 38 19.183 11.051 6.385 1.00 0.00 H new ATOM 0 HB2 SER B 38 20.044 9.053 4.249 1.00 0.00 H new ATOM 0 HB3 SER B 38 20.198 10.787 4.046 1.00 0.00 H new ATOM 0 HG SER B 38 21.546 9.064 5.858 1.00 0.00 H new ATOM 1461 N TYR B 39 17.111 9.520 4.321 1.00 0.00 N ATOM 1462 CA TYR B 39 15.901 9.723 3.532 1.00 0.00 C ATOM 1463 C TYR B 39 14.780 10.281 4.400 1.00 0.00 C ATOM 1464 O TYR B 39 14.098 11.233 4.018 1.00 0.00 O ATOM 1465 CB TYR B 39 15.447 8.410 2.893 1.00 0.00 C ATOM 1466 CG TYR B 39 13.982 8.407 2.516 1.00 0.00 C ATOM 1467 CD1 TYR B 39 13.549 8.985 1.331 1.00 0.00 C ATOM 1468 CD2 TYR B 39 13.031 7.839 3.355 1.00 0.00 C ATOM 1469 CE1 TYR B 39 12.211 8.994 0.991 1.00 0.00 C ATOM 1470 CE2 TYR B 39 11.695 7.845 3.024 1.00 0.00 C ATOM 1471 CZ TYR B 39 11.287 8.423 1.841 1.00 0.00 C ATOM 1472 OH TYR B 39 9.952 8.431 1.507 1.00 0.00 O ATOM 0 H TYR B 39 17.428 8.552 4.369 1.00 0.00 H new ATOM 0 HA TYR B 39 16.132 10.441 2.745 1.00 0.00 H new ATOM 0 HB2 TYR B 39 16.045 8.221 2.002 1.00 0.00 H new ATOM 0 HB3 TYR B 39 15.639 7.591 3.586 1.00 0.00 H new ATOM 0 HD1 TYR B 39 14.270 9.435 0.664 1.00 0.00 H new ATOM 0 HD2 TYR B 39 13.346 7.385 4.283 1.00 0.00 H new ATOM 0 HE1 TYR B 39 11.889 9.446 0.064 1.00 0.00 H new ATOM 0 HE2 TYR B 39 10.970 7.399 3.688 1.00 0.00 H new ATOM 0 HH TYR B 39 9.728 9.281 1.073 1.00 0.00 H new ATOM 1482 N ARG B 40 14.596 9.674 5.566 1.00 0.00 N ATOM 1483 CA ARG B 40 13.555 10.097 6.489 1.00 0.00 C ATOM 1484 C ARG B 40 13.704 11.576 6.821 1.00 0.00 C ATOM 1485 O ARG B 40 12.715 12.273 7.033 1.00 0.00 O ATOM 1486 CB ARG B 40 13.592 9.251 7.757 1.00 0.00 C ATOM 1487 CG ARG B 40 12.986 7.874 7.564 1.00 0.00 C ATOM 1488 CD ARG B 40 12.907 7.115 8.873 1.00 0.00 C ATOM 1489 NE ARG B 40 12.007 7.757 9.828 1.00 0.00 N ATOM 1490 CZ ARG B 40 11.934 7.421 11.113 1.00 0.00 C ATOM 1491 NH1 ARG B 40 12.704 6.454 11.595 1.00 0.00 N ATOM 1492 NH2 ARG B 40 11.089 8.052 11.917 1.00 0.00 N ATOM 0 H ARG B 40 15.156 8.887 5.893 1.00 0.00 H new ATOM 0 HA ARG B 40 12.587 9.952 6.010 1.00 0.00 H new ATOM 0 HB2 ARG B 40 14.625 9.145 8.087 1.00 0.00 H new ATOM 0 HB3 ARG B 40 13.055 9.771 8.551 1.00 0.00 H new ATOM 0 HG2 ARG B 40 11.988 7.971 7.137 1.00 0.00 H new ATOM 0 HG3 ARG B 40 13.584 7.309 6.850 1.00 0.00 H new ATOM 0 HD2 ARG B 40 12.566 6.098 8.681 1.00 0.00 H new ATOM 0 HD3 ARG B 40 13.903 7.040 9.309 1.00 0.00 H new ATOM 0 HE ARG B 40 11.401 8.505 9.491 1.00 0.00 H new ATOM 0 HH11 ARG B 40 13.355 5.966 10.980 1.00 0.00 H new ATOM 0 HH12 ARG B 40 12.645 6.199 12.581 1.00 0.00 H new ATOM 0 HH21 ARG B 40 10.495 8.795 11.550 1.00 0.00 H new ATOM 0 HH22 ARG B 40 11.033 7.794 12.902 1.00 0.00 H new ATOM 1506 N GLN B 41 14.946 12.047 6.864 1.00 0.00 N ATOM 1507 CA GLN B 41 15.221 13.454 7.122 1.00 0.00 C ATOM 1508 C GLN B 41 14.701 14.298 5.963 1.00 0.00 C ATOM 1509 O GLN B 41 14.090 15.349 6.172 1.00 0.00 O ATOM 1510 CB GLN B 41 16.718 13.683 7.306 1.00 0.00 C ATOM 1511 CG GLN B 41 17.054 15.098 7.736 1.00 0.00 C ATOM 1512 CD GLN B 41 16.655 15.380 9.172 1.00 0.00 C ATOM 1513 OE1 GLN B 41 17.440 15.178 10.098 1.00 0.00 O ATOM 1514 NE2 GLN B 41 15.427 15.849 9.364 1.00 0.00 N ATOM 0 H GLN B 41 15.778 11.474 6.723 1.00 0.00 H new ATOM 0 HA GLN B 41 14.713 13.749 8.040 1.00 0.00 H new ATOM 0 HB2 GLN B 41 17.098 12.983 8.050 1.00 0.00 H new ATOM 0 HB3 GLN B 41 17.231 13.462 6.370 1.00 0.00 H new ATOM 0 HG2 GLN B 41 18.125 15.264 7.621 1.00 0.00 H new ATOM 0 HG3 GLN B 41 16.549 15.804 7.077 1.00 0.00 H new ATOM 0 HE21 GLN B 41 14.809 16.002 8.567 1.00 0.00 H new ATOM 0 HE22 GLN B 41 15.102 16.056 10.308 1.00 0.00 H new ATOM 1523 N GLN B 42 14.937 13.830 4.738 1.00 0.00 N ATOM 1524 CA GLN B 42 14.472 14.539 3.552 1.00 0.00 C ATOM 1525 C GLN B 42 12.955 14.663 3.597 1.00 0.00 C ATOM 1526 O GLN B 42 12.374 15.592 3.036 1.00 0.00 O ATOM 1527 CB GLN B 42 14.906 13.805 2.282 1.00 0.00 C ATOM 1528 CG GLN B 42 14.553 14.543 1.000 1.00 0.00 C ATOM 1529 CD GLN B 42 14.988 13.793 -0.245 1.00 0.00 C ATOM 1530 OE1 GLN B 42 15.044 12.563 -0.256 1.00 0.00 O ATOM 1531 NE2 GLN B 42 15.298 14.533 -1.304 1.00 0.00 N ATOM 0 H GLN B 42 15.445 12.967 4.544 1.00 0.00 H new ATOM 0 HA GLN B 42 14.915 15.535 3.538 1.00 0.00 H new ATOM 0 HB2 GLN B 42 15.984 13.646 2.315 1.00 0.00 H new ATOM 0 HB3 GLN B 42 14.439 12.820 2.264 1.00 0.00 H new ATOM 0 HG2 GLN B 42 13.476 14.705 0.964 1.00 0.00 H new ATOM 0 HG3 GLN B 42 15.023 15.526 1.010 1.00 0.00 H new ATOM 0 HE21 GLN B 42 15.238 15.550 -1.251 1.00 0.00 H new ATOM 0 HE22 GLN B 42 15.596 14.084 -2.170 1.00 0.00 H new ATOM 1540 N GLN B 43 12.326 13.709 4.275 1.00 0.00 N ATOM 1541 CA GLN B 43 10.880 13.694 4.431 1.00 0.00 C ATOM 1542 C GLN B 43 10.475 14.580 5.604 1.00 0.00 C ATOM 1543 O GLN B 43 9.446 15.255 5.563 1.00 0.00 O ATOM 1544 CB GLN B 43 10.393 12.259 4.652 1.00 0.00 C ATOM 1545 CG GLN B 43 8.907 12.145 4.952 1.00 0.00 C ATOM 1546 CD GLN B 43 8.595 12.249 6.433 1.00 0.00 C ATOM 1547 OE1 GLN B 43 8.636 11.116 7.126 1.00 0.00 O flip ATOM 1548 NE2 GLN B 43 8.323 13.332 6.950 1.00 0.00 N flip ATOM 0 H GLN B 43 12.803 12.930 4.729 1.00 0.00 H new ATOM 0 HA GLN B 43 10.418 14.083 3.524 1.00 0.00 H new ATOM 0 HB2 GLN B 43 10.619 11.669 3.764 1.00 0.00 H new ATOM 0 HB3 GLN B 43 10.954 11.820 5.477 1.00 0.00 H new ATOM 0 HG2 GLN B 43 8.372 12.930 4.417 1.00 0.00 H new ATOM 0 HG3 GLN B 43 8.537 11.192 4.574 1.00 0.00 H new ATOM 0 HE21 GLN B 43 8.303 14.178 6.381 1.00 0.00 H new ATOM 0 HE22 GLN B 43 8.118 13.384 7.948 1.00 0.00 H new ATOM 1667 N GLU C 2 -6.655 13.656 12.849 1.00 0.00 N ATOM 1668 CA GLU C 2 -6.773 12.352 12.205 1.00 0.00 C ATOM 1669 C GLU C 2 -7.592 12.451 10.922 1.00 0.00 C ATOM 1670 O GLU C 2 -7.990 11.437 10.352 1.00 0.00 O ATOM 1671 CB GLU C 2 -7.415 11.342 13.159 1.00 0.00 C ATOM 1672 CG GLU C 2 -8.815 11.728 13.604 1.00 0.00 C ATOM 1673 CD GLU C 2 -9.412 10.733 14.581 1.00 0.00 C ATOM 1674 OE1 GLU C 2 -10.018 9.743 14.122 1.00 0.00 O ATOM 1675 OE2 GLU C 2 -9.272 10.945 15.804 1.00 0.00 O ATOM 0 HA GLU C 2 -5.770 12.010 11.949 1.00 0.00 H new ATOM 0 HB2 GLU C 2 -7.454 10.368 12.671 1.00 0.00 H new ATOM 0 HB3 GLU C 2 -6.781 11.232 14.039 1.00 0.00 H new ATOM 0 HG2 GLU C 2 -8.786 12.714 14.068 1.00 0.00 H new ATOM 0 HG3 GLU C 2 -9.462 11.806 12.730 1.00 0.00 H new ATOM 1682 N ASP C 3 -7.843 13.678 10.476 1.00 0.00 N ATOM 1683 CA ASP C 3 -8.609 13.902 9.255 1.00 0.00 C ATOM 1684 C ASP C 3 -7.729 13.669 8.030 1.00 0.00 C ATOM 1685 O ASP C 3 -6.877 12.782 8.040 1.00 0.00 O ATOM 1686 CB ASP C 3 -9.185 15.318 9.240 1.00 0.00 C ATOM 1687 CG ASP C 3 -8.111 16.382 9.358 1.00 0.00 C ATOM 1688 OD1 ASP C 3 -7.749 16.735 10.500 1.00 0.00 O ATOM 1689 OD2 ASP C 3 -7.633 16.863 8.309 1.00 0.00 O ATOM 0 H ASP C 3 -7.528 14.530 10.940 1.00 0.00 H new ATOM 0 HA ASP C 3 -9.437 13.194 9.227 1.00 0.00 H new ATOM 0 HB2 ASP C 3 -9.743 15.470 8.316 1.00 0.00 H new ATOM 0 HB3 ASP C 3 -9.893 15.428 10.062 1.00 0.00 H new ATOM 1694 N THR C 4 -7.932 14.454 6.972 1.00 0.00 N ATOM 1695 CA THR C 4 -7.133 14.299 5.770 1.00 0.00 C ATOM 1696 C THR C 4 -5.715 14.796 6.002 1.00 0.00 C ATOM 1697 O THR C 4 -5.482 15.781 6.703 1.00 0.00 O ATOM 1698 CB THR C 4 -7.749 15.014 4.558 1.00 0.00 C ATOM 1699 OG1 THR C 4 -9.129 15.306 4.807 1.00 0.00 O ATOM 1700 CG2 THR C 4 -7.626 14.155 3.301 1.00 0.00 C ATOM 0 H THR C 4 -8.634 15.192 6.928 1.00 0.00 H new ATOM 0 HA THR C 4 -7.111 13.233 5.543 1.00 0.00 H new ATOM 0 HB THR C 4 -7.205 15.945 4.400 1.00 0.00 H new ATOM 0 HG1 THR C 4 -9.512 15.763 4.029 1.00 0.00 H new ATOM 0 HG21 THR C 4 -8.069 14.682 2.456 1.00 0.00 H new ATOM 0 HG22 THR C 4 -6.574 13.959 3.096 1.00 0.00 H new ATOM 0 HG23 THR C 4 -8.148 13.210 3.454 1.00 0.00 H new ATOM 1708 N TYR C 5 -4.784 14.088 5.400 1.00 0.00 N ATOM 1709 CA TYR C 5 -3.372 14.371 5.532 1.00 0.00 C ATOM 1710 C TYR C 5 -2.733 14.525 4.169 1.00 0.00 C ATOM 1711 O TYR C 5 -3.351 14.184 3.172 1.00 0.00 O ATOM 1712 CB TYR C 5 -2.710 13.196 6.238 1.00 0.00 C ATOM 1713 CG TYR C 5 -3.020 13.135 7.713 1.00 0.00 C ATOM 1714 CD1 TYR C 5 -2.377 13.977 8.610 1.00 0.00 C ATOM 1715 CD2 TYR C 5 -3.949 12.232 8.210 1.00 0.00 C ATOM 1716 CE1 TYR C 5 -2.650 13.921 9.962 1.00 0.00 C ATOM 1717 CE2 TYR C 5 -4.229 12.169 9.560 1.00 0.00 C ATOM 1718 CZ TYR C 5 -3.576 13.016 10.432 1.00 0.00 C ATOM 1719 OH TYR C 5 -3.850 12.961 11.778 1.00 0.00 O ATOM 0 H TYR C 5 -4.989 13.290 4.798 1.00 0.00 H new ATOM 0 HA TYR C 5 -3.245 15.295 6.096 1.00 0.00 H new ATOM 0 HB2 TYR C 5 -3.035 12.268 5.767 1.00 0.00 H new ATOM 0 HB3 TYR C 5 -1.630 13.261 6.103 1.00 0.00 H new ATOM 0 HD1 TYR C 5 -1.651 14.688 8.244 1.00 0.00 H new ATOM 0 HD2 TYR C 5 -4.461 11.568 7.530 1.00 0.00 H new ATOM 0 HE1 TYR C 5 -2.141 14.583 10.647 1.00 0.00 H new ATOM 0 HE2 TYR C 5 -4.955 11.461 9.932 1.00 0.00 H new ATOM 0 HH TYR C 5 -4.335 13.769 12.046 1.00 0.00 H new ATOM 1729 N TYR C 6 -1.518 15.042 4.103 1.00 0.00 N ATOM 1730 CA TYR C 6 -0.844 15.140 2.815 1.00 0.00 C ATOM 1731 C TYR C 6 0.385 14.242 2.803 1.00 0.00 C ATOM 1732 O TYR C 6 1.242 14.317 3.684 1.00 0.00 O ATOM 1733 CB TYR C 6 -0.474 16.585 2.479 1.00 0.00 C ATOM 1734 CG TYR C 6 -1.572 17.581 2.789 1.00 0.00 C ATOM 1735 CD1 TYR C 6 -2.900 17.276 2.531 1.00 0.00 C ATOM 1736 CD2 TYR C 6 -1.281 18.823 3.339 1.00 0.00 C ATOM 1737 CE1 TYR C 6 -3.910 18.174 2.807 1.00 0.00 C ATOM 1738 CE2 TYR C 6 -2.286 19.731 3.620 1.00 0.00 C ATOM 1739 CZ TYR C 6 -3.599 19.402 3.352 1.00 0.00 C ATOM 1740 OH TYR C 6 -4.601 20.303 3.629 1.00 0.00 O ATOM 0 H TYR C 6 -0.988 15.392 4.901 1.00 0.00 H new ATOM 0 HA TYR C 6 -1.535 14.801 2.043 1.00 0.00 H new ATOM 0 HB2 TYR C 6 0.422 16.860 3.035 1.00 0.00 H new ATOM 0 HB3 TYR C 6 -0.224 16.650 1.420 1.00 0.00 H new ATOM 0 HD1 TYR C 6 -3.149 16.315 2.105 1.00 0.00 H new ATOM 0 HD2 TYR C 6 -0.254 19.084 3.550 1.00 0.00 H new ATOM 0 HE1 TYR C 6 -4.938 17.917 2.598 1.00 0.00 H new ATOM 0 HE2 TYR C 6 -2.044 20.693 4.047 1.00 0.00 H new ATOM 0 HH TYR C 6 -4.212 21.118 4.010 1.00 0.00 H new ATOM 1750 N LEU C 7 0.450 13.394 1.786 1.00 0.00 N ATOM 1751 CA LEU C 7 1.529 12.431 1.635 1.00 0.00 C ATOM 1752 C LEU C 7 2.366 12.761 0.414 1.00 0.00 C ATOM 1753 O LEU C 7 1.919 12.573 -0.715 1.00 0.00 O ATOM 1754 CB LEU C 7 0.880 11.059 1.448 1.00 0.00 C ATOM 1755 CG LEU C 7 1.473 9.851 2.177 1.00 0.00 C ATOM 1756 CD1 LEU C 7 2.124 10.210 3.495 1.00 0.00 C ATOM 1757 CD2 LEU C 7 0.367 8.832 2.388 1.00 0.00 C ATOM 0 H LEU C 7 -0.246 13.355 1.041 1.00 0.00 H new ATOM 0 HA LEU C 7 2.181 12.449 2.508 1.00 0.00 H new ATOM 0 HB2 LEU C 7 -0.164 11.145 1.750 1.00 0.00 H new ATOM 0 HB3 LEU C 7 0.886 10.835 0.381 1.00 0.00 H new ATOM 0 HG LEU C 7 2.269 9.438 1.557 1.00 0.00 H new ATOM 0 HD11 LEU C 7 2.524 9.309 3.960 1.00 0.00 H new ATOM 0 HD12 LEU C 7 2.934 10.918 3.320 1.00 0.00 H new ATOM 0 HD13 LEU C 7 1.384 10.661 4.155 1.00 0.00 H new ATOM 0 HD21 LEU C 7 0.768 7.961 2.907 1.00 0.00 H new ATOM 0 HD22 LEU C 7 -0.428 9.277 2.987 1.00 0.00 H new ATOM 0 HD23 LEU C 7 -0.034 8.525 1.422 1.00 0.00 H new ATOM 1769 N GLN C 8 3.591 13.221 0.620 1.00 0.00 N ATOM 1770 CA GLN C 8 4.435 13.533 -0.513 1.00 0.00 C ATOM 1771 C GLN C 8 5.099 12.276 -1.040 1.00 0.00 C ATOM 1772 O GLN C 8 5.920 11.662 -0.366 1.00 0.00 O ATOM 1773 CB GLN C 8 5.475 14.584 -0.144 1.00 0.00 C ATOM 1774 CG GLN C 8 5.668 15.643 -1.215 1.00 0.00 C ATOM 1775 CD GLN C 8 7.014 16.348 -1.141 1.00 0.00 C ATOM 1776 OE1 GLN C 8 7.507 16.864 -2.143 1.00 0.00 O ATOM 1777 NE2 GLN C 8 7.623 16.368 0.039 1.00 0.00 N ATOM 0 H GLN C 8 4.010 13.382 1.536 1.00 0.00 H new ATOM 0 HA GLN C 8 3.809 13.947 -1.303 1.00 0.00 H new ATOM 0 HB2 GLN C 8 5.177 15.068 0.786 1.00 0.00 H new ATOM 0 HB3 GLN C 8 6.428 14.091 0.045 1.00 0.00 H new ATOM 0 HG2 GLN C 8 5.564 15.179 -2.196 1.00 0.00 H new ATOM 0 HG3 GLN C 8 4.874 16.385 -1.128 1.00 0.00 H new ATOM 0 HE21 GLN C 8 7.183 15.929 0.848 1.00 0.00 H new ATOM 0 HE22 GLN C 8 8.531 16.822 0.137 1.00 0.00 H new ATOM 1786 N VAL C 9 4.744 11.907 -2.260 1.00 0.00 N ATOM 1787 CA VAL C 9 5.283 10.701 -2.854 1.00 0.00 C ATOM 1788 C VAL C 9 6.056 11.007 -4.128 1.00 0.00 C ATOM 1789 O VAL C 9 5.518 11.582 -5.066 1.00 0.00 O ATOM 1790 CB VAL C 9 4.163 9.689 -3.134 1.00 0.00 C ATOM 1791 CG1 VAL C 9 4.648 8.573 -4.038 1.00 0.00 C ATOM 1792 CG2 VAL C 9 3.614 9.142 -1.829 1.00 0.00 C ATOM 0 H VAL C 9 4.091 12.421 -2.851 1.00 0.00 H new ATOM 0 HA VAL C 9 5.979 10.262 -2.139 1.00 0.00 H new ATOM 0 HB VAL C 9 3.356 10.202 -3.657 1.00 0.00 H new ATOM 0 HG11 VAL C 9 3.834 7.871 -4.219 1.00 0.00 H new ATOM 0 HG12 VAL C 9 4.983 8.993 -4.987 1.00 0.00 H new ATOM 0 HG13 VAL C 9 5.477 8.051 -3.559 1.00 0.00 H new ATOM 0 HG21 VAL C 9 2.820 8.425 -2.040 1.00 0.00 H new ATOM 0 HG22 VAL C 9 4.413 8.647 -1.277 1.00 0.00 H new ATOM 0 HG23 VAL C 9 3.214 9.961 -1.231 1.00 0.00 H new ATOM 1802 N ARG C 10 7.300 10.553 -4.183 1.00 0.00 N ATOM 1803 CA ARG C 10 8.148 10.829 -5.335 1.00 0.00 C ATOM 1804 C ARG C 10 8.119 9.669 -6.320 1.00 0.00 C ATOM 1805 O ARG C 10 8.118 8.503 -5.927 1.00 0.00 O ATOM 1806 CB ARG C 10 9.585 11.121 -4.894 1.00 0.00 C ATOM 1807 CG ARG C 10 10.385 11.938 -5.899 1.00 0.00 C ATOM 1808 CD ARG C 10 11.005 11.061 -6.976 1.00 0.00 C ATOM 1809 NE ARG C 10 11.784 11.841 -7.935 1.00 0.00 N ATOM 1810 CZ ARG C 10 12.398 11.315 -8.992 1.00 0.00 C ATOM 1811 NH1 ARG C 10 12.325 10.011 -9.226 1.00 0.00 N ATOM 1812 NH2 ARG C 10 13.085 12.095 -9.816 1.00 0.00 N ATOM 0 H ARG C 10 7.742 9.997 -3.451 1.00 0.00 H new ATOM 0 HA ARG C 10 7.756 11.714 -5.837 1.00 0.00 H new ATOM 0 HB2 ARG C 10 9.562 11.654 -3.944 1.00 0.00 H new ATOM 0 HB3 ARG C 10 10.099 10.176 -4.717 1.00 0.00 H new ATOM 0 HG2 ARG C 10 9.735 12.679 -6.364 1.00 0.00 H new ATOM 0 HG3 ARG C 10 11.171 12.485 -5.379 1.00 0.00 H new ATOM 0 HD2 ARG C 10 11.647 10.314 -6.510 1.00 0.00 H new ATOM 0 HD3 ARG C 10 10.218 10.521 -7.502 1.00 0.00 H new ATOM 0 HE ARG C 10 11.862 12.847 -7.786 1.00 0.00 H new ATOM 0 HH11 ARG C 10 11.797 9.408 -8.595 1.00 0.00 H new ATOM 0 HH12 ARG C 10 12.797 9.611 -10.037 1.00 0.00 H new ATOM 0 HH21 ARG C 10 13.143 13.098 -9.639 1.00 0.00 H new ATOM 0 HH22 ARG C 10 13.556 11.692 -10.626 1.00 0.00 H new ATOM 1826 N GLY C 11 8.095 10.004 -7.598 1.00 0.00 N ATOM 1827 CA GLY C 11 8.050 8.979 -8.621 1.00 0.00 C ATOM 1828 C GLY C 11 6.627 8.605 -8.979 1.00 0.00 C ATOM 1829 O GLY C 11 5.843 8.221 -8.111 1.00 0.00 O ATOM 0 H GLY C 11 8.106 10.962 -7.947 1.00 0.00 H new ATOM 0 HA2 GLY C 11 8.568 9.332 -9.512 1.00 0.00 H new ATOM 0 HA3 GLY C 11 8.582 8.094 -8.272 1.00 0.00 H new ATOM 1833 N ARG C 12 6.293 8.720 -10.258 1.00 0.00 N ATOM 1834 CA ARG C 12 4.950 8.406 -10.736 1.00 0.00 C ATOM 1835 C ARG C 12 4.493 7.005 -10.327 1.00 0.00 C ATOM 1836 O ARG C 12 3.380 6.842 -9.832 1.00 0.00 O ATOM 1837 CB ARG C 12 4.875 8.563 -12.254 1.00 0.00 C ATOM 1838 CG ARG C 12 3.464 8.788 -12.770 1.00 0.00 C ATOM 1839 CD ARG C 12 2.963 10.181 -12.425 1.00 0.00 C ATOM 1840 NE ARG C 12 1.570 10.374 -12.818 1.00 0.00 N ATOM 1841 CZ ARG C 12 1.109 11.486 -13.384 1.00 0.00 C ATOM 1842 NH1 ARG C 12 1.930 12.495 -13.641 1.00 0.00 N ATOM 1843 NH2 ARG C 12 -0.175 11.587 -13.701 1.00 0.00 N ATOM 0 H ARG C 12 6.936 9.030 -10.987 1.00 0.00 H new ATOM 0 HA ARG C 12 4.271 9.116 -10.263 1.00 0.00 H new ATOM 0 HB2 ARG C 12 5.502 9.402 -12.556 1.00 0.00 H new ATOM 0 HB3 ARG C 12 5.288 7.671 -12.725 1.00 0.00 H new ATOM 0 HG2 ARG C 12 3.444 8.650 -13.851 1.00 0.00 H new ATOM 0 HG3 ARG C 12 2.795 8.042 -12.341 1.00 0.00 H new ATOM 0 HD2 ARG C 12 3.063 10.347 -11.352 1.00 0.00 H new ATOM 0 HD3 ARG C 12 3.586 10.924 -12.922 1.00 0.00 H new ATOM 0 HE ARG C 12 0.913 9.613 -12.649 1.00 0.00 H new ATOM 0 HH11 ARG C 12 2.919 12.420 -13.405 1.00 0.00 H new ATOM 0 HH12 ARG C 12 1.572 13.346 -14.075 1.00 0.00 H new ATOM 0 HH21 ARG C 12 -0.810 10.812 -13.511 1.00 0.00 H new ATOM 0 HH22 ARG C 12 -0.528 12.440 -14.135 1.00 0.00 H new ATOM 1857 N GLU C 13 5.337 5.996 -10.535 1.00 0.00 N ATOM 1858 CA GLU C 13 4.975 4.619 -10.191 1.00 0.00 C ATOM 1859 C GLU C 13 4.511 4.496 -8.738 1.00 0.00 C ATOM 1860 O GLU C 13 3.489 3.869 -8.458 1.00 0.00 O ATOM 1861 CB GLU C 13 6.158 3.682 -10.450 1.00 0.00 C ATOM 1862 CG GLU C 13 5.872 2.223 -10.125 1.00 0.00 C ATOM 1863 CD GLU C 13 6.934 1.289 -10.673 1.00 0.00 C ATOM 1864 OE1 GLU C 13 8.094 1.377 -10.220 1.00 0.00 O ATOM 1865 OE2 GLU C 13 6.606 0.473 -11.560 1.00 0.00 O ATOM 0 H GLU C 13 6.269 6.102 -10.936 1.00 0.00 H new ATOM 0 HA GLU C 13 4.139 4.330 -10.828 1.00 0.00 H new ATOM 0 HB2 GLU C 13 6.448 3.760 -11.498 1.00 0.00 H new ATOM 0 HB3 GLU C 13 7.010 4.016 -9.857 1.00 0.00 H new ATOM 0 HG2 GLU C 13 5.807 2.100 -9.044 1.00 0.00 H new ATOM 0 HG3 GLU C 13 4.901 1.946 -10.536 1.00 0.00 H new ATOM 1872 N ASN C 14 5.265 5.094 -7.821 1.00 0.00 N ATOM 1873 CA ASN C 14 4.933 5.049 -6.400 1.00 0.00 C ATOM 1874 C ASN C 14 3.654 5.836 -6.109 1.00 0.00 C ATOM 1875 O ASN C 14 2.791 5.377 -5.362 1.00 0.00 O ATOM 1876 CB ASN C 14 6.093 5.606 -5.576 1.00 0.00 C ATOM 1877 CG ASN C 14 7.422 4.978 -5.952 1.00 0.00 C ATOM 1878 OD1 ASN C 14 7.474 3.840 -6.418 1.00 0.00 O ATOM 1879 ND2 ASN C 14 8.506 5.716 -5.745 1.00 0.00 N ATOM 0 H ASN C 14 6.113 5.618 -8.037 1.00 0.00 H new ATOM 0 HA ASN C 14 4.761 4.009 -6.121 1.00 0.00 H new ATOM 0 HB2 ASN C 14 6.151 6.685 -5.718 1.00 0.00 H new ATOM 0 HB3 ASN C 14 5.899 5.434 -4.517 1.00 0.00 H new ATOM 0 HD21 ASN C 14 9.428 5.344 -5.974 1.00 0.00 H new ATOM 0 HD22 ASN C 14 8.417 6.655 -5.357 1.00 0.00 H new ATOM 1886 N PHE C 15 3.543 7.023 -6.701 1.00 0.00 N ATOM 1887 CA PHE C 15 2.371 7.876 -6.516 1.00 0.00 C ATOM 1888 C PHE C 15 1.089 7.166 -6.941 1.00 0.00 C ATOM 1889 O PHE C 15 0.089 7.240 -6.247 1.00 0.00 O ATOM 1890 CB PHE C 15 2.539 9.170 -7.311 1.00 0.00 C ATOM 1891 CG PHE C 15 1.431 10.161 -7.096 1.00 0.00 C ATOM 1892 CD1 PHE C 15 0.968 10.444 -5.817 1.00 0.00 C ATOM 1893 CD2 PHE C 15 0.850 10.812 -8.173 1.00 0.00 C ATOM 1894 CE1 PHE C 15 -0.044 11.355 -5.621 1.00 0.00 C ATOM 1895 CE2 PHE C 15 -0.169 11.727 -7.976 1.00 0.00 C ATOM 1896 CZ PHE C 15 -0.614 11.998 -6.696 1.00 0.00 C ATOM 0 H PHE C 15 4.254 7.418 -7.316 1.00 0.00 H new ATOM 0 HA PHE C 15 2.289 8.108 -5.454 1.00 0.00 H new ATOM 0 HB2 PHE C 15 3.487 9.633 -7.037 1.00 0.00 H new ATOM 0 HB3 PHE C 15 2.597 8.929 -8.372 1.00 0.00 H new ATOM 0 HD1 PHE C 15 1.408 9.943 -4.967 1.00 0.00 H new ATOM 0 HD2 PHE C 15 1.196 10.603 -9.175 1.00 0.00 H new ATOM 0 HE1 PHE C 15 -0.392 11.566 -4.621 1.00 0.00 H new ATOM 0 HE2 PHE C 15 -0.616 12.229 -8.821 1.00 0.00 H new ATOM 0 HZ PHE C 15 -1.408 12.713 -6.540 1.00 0.00 H new ATOM 1906 N GLU C 16 1.121 6.508 -8.096 1.00 0.00 N ATOM 1907 CA GLU C 16 -0.040 5.774 -8.611 1.00 0.00 C ATOM 1908 C GLU C 16 -0.415 4.605 -7.710 1.00 0.00 C ATOM 1909 O GLU C 16 -1.592 4.414 -7.404 1.00 0.00 O ATOM 1910 CB GLU C 16 0.241 5.268 -10.027 1.00 0.00 C ATOM 1911 CG GLU C 16 0.464 6.381 -11.037 1.00 0.00 C ATOM 1912 CD GLU C 16 0.719 5.857 -12.437 1.00 0.00 C ATOM 1913 OE1 GLU C 16 1.877 5.491 -12.731 1.00 0.00 O ATOM 1914 OE2 GLU C 16 -0.238 5.813 -13.238 1.00 0.00 O ATOM 0 H GLU C 16 1.942 6.466 -8.700 1.00 0.00 H new ATOM 0 HA GLU C 16 -0.883 6.465 -8.631 1.00 0.00 H new ATOM 0 HB2 GLU C 16 1.121 4.626 -10.006 1.00 0.00 H new ATOM 0 HB3 GLU C 16 -0.596 4.652 -10.356 1.00 0.00 H new ATOM 0 HG2 GLU C 16 -0.409 7.034 -11.051 1.00 0.00 H new ATOM 0 HG3 GLU C 16 1.312 6.989 -10.721 1.00 0.00 H new ATOM 1921 N ILE C 17 0.567 3.823 -7.288 1.00 0.00 N ATOM 1922 CA ILE C 17 0.284 2.693 -6.420 1.00 0.00 C ATOM 1923 C ILE C 17 -0.330 3.173 -5.109 1.00 0.00 C ATOM 1924 O ILE C 17 -1.307 2.600 -4.620 1.00 0.00 O ATOM 1925 CB ILE C 17 1.558 1.857 -6.157 1.00 0.00 C ATOM 1926 CG1 ILE C 17 1.601 0.672 -7.124 1.00 0.00 C ATOM 1927 CG2 ILE C 17 1.619 1.366 -4.716 1.00 0.00 C ATOM 1928 CD1 ILE C 17 2.975 0.082 -7.307 1.00 0.00 C ATOM 0 H ILE C 17 1.551 3.947 -7.528 1.00 0.00 H new ATOM 0 HA ILE C 17 -0.436 2.048 -6.925 1.00 0.00 H new ATOM 0 HB ILE C 17 2.426 2.496 -6.322 1.00 0.00 H new ATOM 0 HG12 ILE C 17 0.928 -0.105 -6.761 1.00 0.00 H new ATOM 0 HG13 ILE C 17 1.222 0.994 -8.094 1.00 0.00 H new ATOM 0 HG21 ILE C 17 2.528 0.782 -4.569 1.00 0.00 H new ATOM 0 HG22 ILE C 17 1.623 2.221 -4.040 1.00 0.00 H new ATOM 0 HG23 ILE C 17 0.750 0.743 -4.507 1.00 0.00 H new ATOM 0 HD11 ILE C 17 2.922 -0.753 -8.006 1.00 0.00 H new ATOM 0 HD12 ILE C 17 3.648 0.843 -7.701 1.00 0.00 H new ATOM 0 HD13 ILE C 17 3.350 -0.272 -6.347 1.00 0.00 H new ATOM 1940 N LEU C 18 0.231 4.240 -4.555 1.00 0.00 N ATOM 1941 CA LEU C 18 -0.255 4.793 -3.305 1.00 0.00 C ATOM 1942 C LEU C 18 -1.577 5.532 -3.506 1.00 0.00 C ATOM 1943 O LEU C 18 -2.430 5.508 -2.633 1.00 0.00 O ATOM 1944 CB LEU C 18 0.787 5.750 -2.723 1.00 0.00 C ATOM 1945 CG LEU C 18 1.953 5.080 -1.995 1.00 0.00 C ATOM 1946 CD1 LEU C 18 3.241 5.851 -2.227 1.00 0.00 C ATOM 1947 CD2 LEU C 18 1.661 4.986 -0.507 1.00 0.00 C ATOM 0 H LEU C 18 1.025 4.739 -4.956 1.00 0.00 H new ATOM 0 HA LEU C 18 -0.426 3.969 -2.612 1.00 0.00 H new ATOM 0 HB2 LEU C 18 1.188 6.361 -3.532 1.00 0.00 H new ATOM 0 HB3 LEU C 18 0.288 6.427 -2.030 1.00 0.00 H new ATOM 0 HG LEU C 18 2.075 4.073 -2.394 1.00 0.00 H new ATOM 0 HD11 LEU C 18 4.059 5.359 -1.701 1.00 0.00 H new ATOM 0 HD12 LEU C 18 3.461 5.880 -3.294 1.00 0.00 H new ATOM 0 HD13 LEU C 18 3.129 6.868 -1.852 1.00 0.00 H new ATOM 0 HD21 LEU C 18 2.499 4.507 -0.001 1.00 0.00 H new ATOM 0 HD22 LEU C 18 1.516 5.987 -0.101 1.00 0.00 H new ATOM 0 HD23 LEU C 18 0.758 4.396 -0.350 1.00 0.00 H new ATOM 1959 N MET C 19 -1.728 6.215 -4.646 1.00 0.00 N ATOM 1960 CA MET C 19 -2.958 6.970 -4.930 1.00 0.00 C ATOM 1961 C MET C 19 -4.153 6.024 -4.974 1.00 0.00 C ATOM 1962 O MET C 19 -5.171 6.287 -4.334 1.00 0.00 O ATOM 1963 CB MET C 19 -2.841 7.776 -6.230 1.00 0.00 C ATOM 1964 CG MET C 19 -3.626 9.080 -6.238 1.00 0.00 C ATOM 1965 SD MET C 19 -5.383 8.853 -5.934 1.00 0.00 S ATOM 1966 CE MET C 19 -5.851 10.542 -5.582 1.00 0.00 C ATOM 0 H MET C 19 -1.023 6.262 -5.382 1.00 0.00 H new ATOM 0 HA MET C 19 -3.110 7.688 -4.124 1.00 0.00 H new ATOM 0 HB2 MET C 19 -1.789 7.999 -6.411 1.00 0.00 H new ATOM 0 HB3 MET C 19 -3.183 7.156 -7.059 1.00 0.00 H new ATOM 0 HG2 MET C 19 -3.216 9.747 -5.480 1.00 0.00 H new ATOM 0 HG3 MET C 19 -3.491 9.571 -7.202 1.00 0.00 H new ATOM 0 HE1 MET C 19 -6.903 10.577 -5.300 1.00 0.00 H new ATOM 0 HE2 MET C 19 -5.243 10.925 -4.763 1.00 0.00 H new ATOM 0 HE3 MET C 19 -5.693 11.156 -6.469 1.00 0.00 H new ATOM 1976 N LYS C 20 -4.042 4.927 -5.722 1.00 0.00 N ATOM 1977 CA LYS C 20 -5.113 3.941 -5.766 1.00 0.00 C ATOM 1978 C LYS C 20 -5.399 3.463 -4.365 1.00 0.00 C ATOM 1979 O LYS C 20 -6.549 3.284 -3.966 1.00 0.00 O ATOM 1980 CB LYS C 20 -4.719 2.722 -6.593 1.00 0.00 C ATOM 1981 CG LYS C 20 -5.617 1.517 -6.320 1.00 0.00 C ATOM 1982 CD LYS C 20 -6.329 1.064 -7.568 1.00 0.00 C ATOM 1983 CE LYS C 20 -7.106 -0.219 -7.337 1.00 0.00 C ATOM 1984 NZ LYS C 20 -8.280 -0.006 -6.446 1.00 0.00 N ATOM 0 H LYS C 20 -3.231 4.703 -6.298 1.00 0.00 H new ATOM 0 HA LYS C 20 -5.984 4.417 -6.218 1.00 0.00 H new ATOM 0 HB2 LYS C 20 -4.767 2.974 -7.652 1.00 0.00 H new ATOM 0 HB3 LYS C 20 -3.684 2.457 -6.375 1.00 0.00 H new ATOM 0 HG2 LYS C 20 -5.017 0.697 -5.924 1.00 0.00 H new ATOM 0 HG3 LYS C 20 -6.350 1.774 -5.555 1.00 0.00 H new ATOM 0 HD2 LYS C 20 -7.010 1.847 -7.903 1.00 0.00 H new ATOM 0 HD3 LYS C 20 -5.603 0.911 -8.366 1.00 0.00 H new ATOM 0 HE2 LYS C 20 -7.444 -0.616 -8.294 1.00 0.00 H new ATOM 0 HE3 LYS C 20 -6.447 -0.968 -6.897 1.00 0.00 H new ATOM 0 HZ1 LYS C 20 -8.774 -0.910 -6.300 1.00 0.00 H new ATOM 0 HZ2 LYS C 20 -7.957 0.364 -5.529 1.00 0.00 H new ATOM 0 HZ3 LYS C 20 -8.930 0.676 -6.886 1.00 0.00 H new ATOM 1998 N LEU C 21 -4.323 3.262 -3.628 1.00 0.00 N ATOM 1999 CA LEU C 21 -4.418 2.776 -2.272 1.00 0.00 C ATOM 2000 C LEU C 21 -5.146 3.784 -1.392 1.00 0.00 C ATOM 2001 O LEU C 21 -6.014 3.422 -0.603 1.00 0.00 O ATOM 2002 CB LEU C 21 -3.022 2.478 -1.727 1.00 0.00 C ATOM 2003 CG LEU C 21 -2.932 1.493 -0.564 1.00 0.00 C ATOM 2004 CD1 LEU C 21 -1.614 1.662 0.163 1.00 0.00 C ATOM 2005 CD2 LEU C 21 -4.085 1.653 0.410 1.00 0.00 C ATOM 0 H LEU C 21 -3.370 3.430 -3.951 1.00 0.00 H new ATOM 0 HA LEU C 21 -4.995 1.851 -2.266 1.00 0.00 H new ATOM 0 HB2 LEU C 21 -2.413 2.094 -2.545 1.00 0.00 H new ATOM 0 HB3 LEU C 21 -2.573 3.419 -1.410 1.00 0.00 H new ATOM 0 HG LEU C 21 -2.992 0.489 -0.983 1.00 0.00 H new ATOM 0 HD11 LEU C 21 -1.561 0.954 0.990 1.00 0.00 H new ATOM 0 HD12 LEU C 21 -0.791 1.475 -0.527 1.00 0.00 H new ATOM 0 HD13 LEU C 21 -1.540 2.678 0.550 1.00 0.00 H new ATOM 0 HD21 LEU C 21 -3.979 0.932 1.221 1.00 0.00 H new ATOM 0 HD22 LEU C 21 -4.078 2.663 0.820 1.00 0.00 H new ATOM 0 HD23 LEU C 21 -5.027 1.479 -0.110 1.00 0.00 H new ATOM 2017 N LYS C 22 -4.802 5.053 -1.547 1.00 0.00 N ATOM 2018 CA LYS C 22 -5.435 6.112 -0.789 1.00 0.00 C ATOM 2019 C LYS C 22 -6.938 6.029 -0.989 1.00 0.00 C ATOM 2020 O LYS C 22 -7.716 6.231 -0.057 1.00 0.00 O ATOM 2021 CB LYS C 22 -4.873 7.461 -1.255 1.00 0.00 C ATOM 2022 CG LYS C 22 -5.842 8.626 -1.170 1.00 0.00 C ATOM 2023 CD LYS C 22 -5.325 9.812 -1.966 1.00 0.00 C ATOM 2024 CE LYS C 22 -6.440 10.779 -2.319 1.00 0.00 C ATOM 2025 NZ LYS C 22 -7.613 10.083 -2.915 1.00 0.00 N ATOM 0 H LYS C 22 -4.083 5.372 -2.196 1.00 0.00 H new ATOM 0 HA LYS C 22 -5.228 6.008 0.276 1.00 0.00 H new ATOM 0 HB2 LYS C 22 -3.993 7.696 -0.657 1.00 0.00 H new ATOM 0 HB3 LYS C 22 -4.539 7.361 -2.288 1.00 0.00 H new ATOM 0 HG2 LYS C 22 -6.817 8.323 -1.551 1.00 0.00 H new ATOM 0 HG3 LYS C 22 -5.982 8.914 -0.128 1.00 0.00 H new ATOM 0 HD2 LYS C 22 -4.561 10.333 -1.389 1.00 0.00 H new ATOM 0 HD3 LYS C 22 -4.848 9.457 -2.880 1.00 0.00 H new ATOM 0 HE2 LYS C 22 -6.753 11.314 -1.423 1.00 0.00 H new ATOM 0 HE3 LYS C 22 -6.065 11.524 -3.021 1.00 0.00 H new ATOM 0 HZ1 LYS C 22 -8.316 10.786 -3.219 1.00 0.00 H new ATOM 0 HZ2 LYS C 22 -7.305 9.524 -3.736 1.00 0.00 H new ATOM 0 HZ3 LYS C 22 -8.039 9.452 -2.207 1.00 0.00 H new ATOM 2039 N GLU C 23 -7.335 5.726 -2.220 1.00 0.00 N ATOM 2040 CA GLU C 23 -8.739 5.577 -2.552 1.00 0.00 C ATOM 2041 C GLU C 23 -9.320 4.337 -1.878 1.00 0.00 C ATOM 2042 O GLU C 23 -10.409 4.396 -1.321 1.00 0.00 O ATOM 2043 CB GLU C 23 -8.936 5.503 -4.069 1.00 0.00 C ATOM 2044 CG GLU C 23 -8.559 6.785 -4.795 1.00 0.00 C ATOM 2045 CD GLU C 23 -8.611 6.638 -6.303 1.00 0.00 C ATOM 2046 OE1 GLU C 23 -7.590 6.231 -6.896 1.00 0.00 O ATOM 2047 OE2 GLU C 23 -9.673 6.930 -6.892 1.00 0.00 O ATOM 0 H GLU C 23 -6.699 5.579 -3.004 1.00 0.00 H new ATOM 0 HA GLU C 23 -9.270 6.454 -2.182 1.00 0.00 H new ATOM 0 HB2 GLU C 23 -8.338 4.682 -4.465 1.00 0.00 H new ATOM 0 HB3 GLU C 23 -9.979 5.269 -4.281 1.00 0.00 H new ATOM 0 HG2 GLU C 23 -9.234 7.584 -4.488 1.00 0.00 H new ATOM 0 HG3 GLU C 23 -7.554 7.085 -4.497 1.00 0.00 H new ATOM 2054 N SER C 24 -8.606 3.209 -1.936 1.00 0.00 N ATOM 2055 CA SER C 24 -9.093 1.981 -1.306 1.00 0.00 C ATOM 2056 C SER C 24 -9.274 2.154 0.207 1.00 0.00 C ATOM 2057 O SER C 24 -10.303 1.769 0.760 1.00 0.00 O ATOM 2058 CB SER C 24 -8.156 0.807 -1.602 1.00 0.00 C ATOM 2059 OG SER C 24 -6.880 1.011 -1.025 1.00 0.00 O ATOM 0 H SER C 24 -7.704 3.121 -2.404 1.00 0.00 H new ATOM 0 HA SER C 24 -10.071 1.762 -1.735 1.00 0.00 H new ATOM 0 HB2 SER C 24 -8.590 -0.115 -1.214 1.00 0.00 H new ATOM 0 HB3 SER C 24 -8.055 0.682 -2.680 1.00 0.00 H new ATOM 0 HG SER C 24 -6.744 0.369 -0.297 1.00 0.00 H new ATOM 2065 N LEU C 25 -8.270 2.729 0.871 1.00 0.00 N ATOM 2066 CA LEU C 25 -8.325 2.956 2.315 1.00 0.00 C ATOM 2067 C LEU C 25 -9.435 3.936 2.680 1.00 0.00 C ATOM 2068 O LEU C 25 -10.201 3.698 3.614 1.00 0.00 O ATOM 2069 CB LEU C 25 -6.982 3.490 2.824 1.00 0.00 C ATOM 2070 CG LEU C 25 -5.925 2.425 3.137 1.00 0.00 C ATOM 2071 CD1 LEU C 25 -4.566 3.069 3.347 1.00 0.00 C ATOM 2072 CD2 LEU C 25 -6.311 1.624 4.368 1.00 0.00 C ATOM 0 H LEU C 25 -7.407 3.047 0.430 1.00 0.00 H new ATOM 0 HA LEU C 25 -8.538 1.999 2.791 1.00 0.00 H new ATOM 0 HB2 LEU C 25 -6.575 4.172 2.077 1.00 0.00 H new ATOM 0 HB3 LEU C 25 -7.162 4.075 3.726 1.00 0.00 H new ATOM 0 HG LEU C 25 -5.869 1.748 2.285 1.00 0.00 H new ATOM 0 HD11 LEU C 25 -3.828 2.298 3.568 1.00 0.00 H new ATOM 0 HD12 LEU C 25 -4.273 3.603 2.443 1.00 0.00 H new ATOM 0 HD13 LEU C 25 -4.620 3.769 4.181 1.00 0.00 H new ATOM 0 HD21 LEU C 25 -5.545 0.875 4.569 1.00 0.00 H new ATOM 0 HD22 LEU C 25 -6.399 2.293 5.224 1.00 0.00 H new ATOM 0 HD23 LEU C 25 -7.266 1.129 4.195 1.00 0.00 H new ATOM 2084 N GLU C 26 -9.516 5.038 1.940 1.00 0.00 N ATOM 2085 CA GLU C 26 -10.532 6.054 2.195 1.00 0.00 C ATOM 2086 C GLU C 26 -11.929 5.515 1.905 1.00 0.00 C ATOM 2087 O GLU C 26 -12.863 5.741 2.670 1.00 0.00 O ATOM 2088 CB GLU C 26 -10.269 7.303 1.350 1.00 0.00 C ATOM 2089 CG GLU C 26 -9.117 8.153 1.861 1.00 0.00 C ATOM 2090 CD GLU C 26 -9.072 9.524 1.214 1.00 0.00 C ATOM 2091 OE1 GLU C 26 -9.832 10.413 1.651 1.00 0.00 O ATOM 2092 OE2 GLU C 26 -8.276 9.709 0.269 1.00 0.00 O ATOM 0 H GLU C 26 -8.892 5.250 1.161 1.00 0.00 H new ATOM 0 HA GLU C 26 -10.477 6.323 3.250 1.00 0.00 H new ATOM 0 HB2 GLU C 26 -10.058 7.000 0.324 1.00 0.00 H new ATOM 0 HB3 GLU C 26 -11.174 7.910 1.323 1.00 0.00 H new ATOM 0 HG2 GLU C 26 -9.206 8.268 2.941 1.00 0.00 H new ATOM 0 HG3 GLU C 26 -8.177 7.635 1.672 1.00 0.00 H new ATOM 2099 N LEU C 27 -12.060 4.798 0.793 1.00 0.00 N ATOM 2100 CA LEU C 27 -13.330 4.208 0.394 1.00 0.00 C ATOM 2101 C LEU C 27 -13.782 3.129 1.371 1.00 0.00 C ATOM 2102 O LEU C 27 -14.976 2.945 1.577 1.00 0.00 O ATOM 2103 CB LEU C 27 -13.226 3.621 -1.016 1.00 0.00 C ATOM 2104 CG LEU C 27 -13.337 4.643 -2.152 1.00 0.00 C ATOM 2105 CD1 LEU C 27 -12.921 4.024 -3.475 1.00 0.00 C ATOM 2106 CD2 LEU C 27 -14.755 5.179 -2.248 1.00 0.00 C ATOM 0 H LEU C 27 -11.293 4.611 0.148 1.00 0.00 H new ATOM 0 HA LEU C 27 -14.076 5.003 0.401 1.00 0.00 H new ATOM 0 HB2 LEU C 27 -12.273 3.101 -1.107 1.00 0.00 H new ATOM 0 HB3 LEU C 27 -14.010 2.874 -1.141 1.00 0.00 H new ATOM 0 HG LEU C 27 -12.663 5.471 -1.931 1.00 0.00 H new ATOM 0 HD11 LEU C 27 -13.008 4.767 -4.268 1.00 0.00 H new ATOM 0 HD12 LEU C 27 -11.888 3.683 -3.408 1.00 0.00 H new ATOM 0 HD13 LEU C 27 -13.569 3.177 -3.700 1.00 0.00 H new ATOM 0 HD21 LEU C 27 -14.816 5.904 -3.060 1.00 0.00 H new ATOM 0 HD22 LEU C 27 -15.443 4.356 -2.444 1.00 0.00 H new ATOM 0 HD23 LEU C 27 -15.026 5.662 -1.309 1.00 0.00 H new ATOM 2118 N MET C 28 -12.855 2.405 1.978 1.00 0.00 N ATOM 2119 CA MET C 28 -13.261 1.357 2.907 1.00 0.00 C ATOM 2120 C MET C 28 -14.179 1.911 4.004 1.00 0.00 C ATOM 2121 O MET C 28 -14.810 1.144 4.732 1.00 0.00 O ATOM 2122 CB MET C 28 -12.050 0.637 3.510 1.00 0.00 C ATOM 2123 CG MET C 28 -12.414 -0.649 4.229 1.00 0.00 C ATOM 2124 SD MET C 28 -11.209 -1.137 5.479 1.00 0.00 S ATOM 2125 CE MET C 28 -10.023 -2.031 4.481 1.00 0.00 C ATOM 0 H MET C 28 -11.849 2.515 1.853 1.00 0.00 H new ATOM 0 HA MET C 28 -13.829 0.621 2.338 1.00 0.00 H new ATOM 0 HB2 MET C 28 -11.337 0.412 2.717 1.00 0.00 H new ATOM 0 HB3 MET C 28 -11.549 1.307 4.209 1.00 0.00 H new ATOM 0 HG2 MET C 28 -13.389 -0.529 4.702 1.00 0.00 H new ATOM 0 HG3 MET C 28 -12.512 -1.451 3.497 1.00 0.00 H new ATOM 0 HE1 MET C 28 -9.669 -2.903 5.031 1.00 0.00 H new ATOM 0 HE2 MET C 28 -10.497 -2.354 3.554 1.00 0.00 H new ATOM 0 HE3 MET C 28 -9.179 -1.381 4.249 1.00 0.00 H new ATOM 2135 N GLU C 29 -14.251 3.235 4.135 1.00 0.00 N ATOM 2136 CA GLU C 29 -15.101 3.858 5.147 1.00 0.00 C ATOM 2137 C GLU C 29 -16.509 4.144 4.616 1.00 0.00 C ATOM 2138 O GLU C 29 -17.459 4.249 5.392 1.00 0.00 O ATOM 2139 CB GLU C 29 -14.463 5.163 5.638 1.00 0.00 C ATOM 2140 CG GLU C 29 -14.837 6.386 4.812 1.00 0.00 C ATOM 2141 CD GLU C 29 -14.092 7.632 5.248 1.00 0.00 C ATOM 2142 OE1 GLU C 29 -14.548 8.291 6.206 1.00 0.00 O ATOM 2143 OE2 GLU C 29 -13.054 7.950 4.631 1.00 0.00 O ATOM 0 H GLU C 29 -13.733 3.895 3.555 1.00 0.00 H new ATOM 0 HA GLU C 29 -15.191 3.154 5.975 1.00 0.00 H new ATOM 0 HB2 GLU C 29 -14.759 5.333 6.673 1.00 0.00 H new ATOM 0 HB3 GLU C 29 -13.379 5.050 5.631 1.00 0.00 H new ATOM 0 HG2 GLU C 29 -14.625 6.189 3.761 1.00 0.00 H new ATOM 0 HG3 GLU C 29 -15.910 6.561 4.893 1.00 0.00 H new ATOM 2150 N LEU C 30 -16.643 4.272 3.293 1.00 0.00 N ATOM 2151 CA LEU C 30 -17.933 4.583 2.686 1.00 0.00 C ATOM 2152 C LEU C 30 -18.714 3.315 2.365 1.00 0.00 C ATOM 2153 O LEU C 30 -19.807 3.370 1.800 1.00 0.00 O ATOM 2154 CB LEU C 30 -17.733 5.466 1.442 1.00 0.00 C ATOM 2155 CG LEU C 30 -17.907 4.792 0.078 1.00 0.00 C ATOM 2156 CD1 LEU C 30 -17.873 5.834 -1.029 1.00 0.00 C ATOM 2157 CD2 LEU C 30 -16.836 3.745 -0.158 1.00 0.00 C ATOM 0 H LEU C 30 -15.877 4.165 2.628 1.00 0.00 H new ATOM 0 HA LEU C 30 -18.530 5.145 3.404 1.00 0.00 H new ATOM 0 HB2 LEU C 30 -18.434 6.298 1.501 1.00 0.00 H new ATOM 0 HB3 LEU C 30 -16.730 5.890 1.485 1.00 0.00 H new ATOM 0 HG LEU C 30 -18.876 4.292 0.070 1.00 0.00 H new ATOM 0 HD11 LEU C 30 -17.998 5.343 -1.994 1.00 0.00 H new ATOM 0 HD12 LEU C 30 -18.681 6.551 -0.879 1.00 0.00 H new ATOM 0 HD13 LEU C 30 -16.916 6.356 -1.008 1.00 0.00 H new ATOM 0 HD21 LEU C 30 -16.986 3.284 -1.134 1.00 0.00 H new ATOM 0 HD22 LEU C 30 -15.854 4.216 -0.126 1.00 0.00 H new ATOM 0 HD23 LEU C 30 -16.897 2.981 0.617 1.00 0.00 H new ATOM 2169 N VAL C 31 -18.154 2.177 2.745 1.00 0.00 N ATOM 2170 CA VAL C 31 -18.826 0.911 2.519 1.00 0.00 C ATOM 2171 C VAL C 31 -19.527 0.472 3.802 1.00 0.00 C ATOM 2172 O VAL C 31 -18.889 0.361 4.849 1.00 0.00 O ATOM 2173 CB VAL C 31 -17.861 -0.195 2.051 1.00 0.00 C ATOM 2174 CG1 VAL C 31 -16.645 -0.280 2.957 1.00 0.00 C ATOM 2175 CG2 VAL C 31 -18.582 -1.533 1.987 1.00 0.00 C ATOM 0 H VAL C 31 -17.247 2.105 3.206 1.00 0.00 H new ATOM 0 HA VAL C 31 -19.552 1.064 1.721 1.00 0.00 H new ATOM 0 HB VAL C 31 -17.512 0.059 1.050 1.00 0.00 H new ATOM 0 HG11 VAL C 31 -15.982 -1.069 2.603 1.00 0.00 H new ATOM 0 HG12 VAL C 31 -16.115 0.672 2.945 1.00 0.00 H new ATOM 0 HG13 VAL C 31 -16.964 -0.505 3.975 1.00 0.00 H new ATOM 0 HG21 VAL C 31 -17.888 -2.305 1.655 1.00 0.00 H new ATOM 0 HG22 VAL C 31 -18.963 -1.789 2.976 1.00 0.00 H new ATOM 0 HG23 VAL C 31 -19.413 -1.465 1.284 1.00 0.00 H new ATOM 2185 N PRO C 32 -20.850 0.231 3.744 1.00 0.00 N ATOM 2186 CA PRO C 32 -21.623 -0.188 4.910 1.00 0.00 C ATOM 2187 C PRO C 32 -20.870 -1.200 5.767 1.00 0.00 C ATOM 2188 O PRO C 32 -20.354 -2.197 5.261 1.00 0.00 O ATOM 2189 CB PRO C 32 -22.864 -0.815 4.283 1.00 0.00 C ATOM 2190 CG PRO C 32 -23.072 -0.042 3.024 1.00 0.00 C ATOM 2191 CD PRO C 32 -21.702 0.376 2.547 1.00 0.00 C ATOM 0 HA PRO C 32 -21.842 0.637 5.588 1.00 0.00 H new ATOM 0 HB2 PRO C 32 -22.714 -1.875 4.079 1.00 0.00 H new ATOM 0 HB3 PRO C 32 -23.727 -0.737 4.945 1.00 0.00 H new ATOM 0 HG2 PRO C 32 -23.575 -0.651 2.273 1.00 0.00 H new ATOM 0 HG3 PRO C 32 -23.703 0.829 3.203 1.00 0.00 H new ATOM 0 HD2 PRO C 32 -21.354 -0.255 1.730 1.00 0.00 H new ATOM 0 HD3 PRO C 32 -21.703 1.402 2.179 1.00 0.00 H new ATOM 2199 N GLN C 33 -20.810 -0.925 7.067 1.00 0.00 N ATOM 2200 CA GLN C 33 -20.116 -1.792 8.017 1.00 0.00 C ATOM 2201 C GLN C 33 -20.487 -3.272 7.838 1.00 0.00 C ATOM 2202 O GLN C 33 -19.605 -4.130 7.858 1.00 0.00 O ATOM 2203 CB GLN C 33 -20.414 -1.348 9.452 1.00 0.00 C ATOM 2204 CG GLN C 33 -19.690 -2.170 10.508 1.00 0.00 C ATOM 2205 CD GLN C 33 -20.001 -1.710 11.918 1.00 0.00 C ATOM 2206 OE1 GLN C 33 -19.311 -0.852 12.470 1.00 0.00 O ATOM 2207 NE2 GLN C 33 -21.045 -2.278 12.510 1.00 0.00 N ATOM 0 H GLN C 33 -21.237 -0.101 7.490 1.00 0.00 H new ATOM 0 HA GLN C 33 -19.049 -1.698 7.817 1.00 0.00 H new ATOM 0 HB2 GLN C 33 -20.134 -0.301 9.565 1.00 0.00 H new ATOM 0 HB3 GLN C 33 -21.488 -1.412 9.627 1.00 0.00 H new ATOM 0 HG2 GLN C 33 -19.969 -3.218 10.402 1.00 0.00 H new ATOM 0 HG3 GLN C 33 -18.615 -2.108 10.338 1.00 0.00 H new ATOM 0 HE21 GLN C 33 -21.589 -2.985 12.016 1.00 0.00 H new ATOM 0 HE22 GLN C 33 -21.303 -2.007 13.459 1.00 0.00 H new ATOM 2216 N PRO C 34 -21.787 -3.603 7.669 1.00 0.00 N ATOM 2217 CA PRO C 34 -22.224 -4.996 7.501 1.00 0.00 C ATOM 2218 C PRO C 34 -21.526 -5.717 6.347 1.00 0.00 C ATOM 2219 O PRO C 34 -21.327 -6.933 6.396 1.00 0.00 O ATOM 2220 CB PRO C 34 -23.723 -4.874 7.216 1.00 0.00 C ATOM 2221 CG PRO C 34 -24.118 -3.573 7.820 1.00 0.00 C ATOM 2222 CD PRO C 34 -22.932 -2.669 7.648 1.00 0.00 C ATOM 0 HA PRO C 34 -21.983 -5.590 8.383 1.00 0.00 H new ATOM 0 HB2 PRO C 34 -23.925 -4.891 6.145 1.00 0.00 H new ATOM 0 HB3 PRO C 34 -24.279 -5.701 7.658 1.00 0.00 H new ATOM 0 HG2 PRO C 34 -24.998 -3.163 7.325 1.00 0.00 H new ATOM 0 HG3 PRO C 34 -24.371 -3.691 8.874 1.00 0.00 H new ATOM 0 HD2 PRO C 34 -22.982 -2.114 6.711 1.00 0.00 H new ATOM 0 HD3 PRO C 34 -22.867 -1.934 8.450 1.00 0.00 H new ATOM 2230 N LEU C 35 -21.142 -4.966 5.312 1.00 0.00 N ATOM 2231 CA LEU C 35 -20.482 -5.543 4.142 1.00 0.00 C ATOM 2232 C LEU C 35 -19.015 -5.838 4.426 1.00 0.00 C ATOM 2233 O LEU C 35 -18.462 -6.815 3.922 1.00 0.00 O ATOM 2234 CB LEU C 35 -20.602 -4.595 2.947 1.00 0.00 C ATOM 2235 CG LEU C 35 -21.760 -4.895 1.998 1.00 0.00 C ATOM 2236 CD1 LEU C 35 -22.294 -3.610 1.384 1.00 0.00 C ATOM 2237 CD2 LEU C 35 -21.316 -5.860 0.907 1.00 0.00 C ATOM 0 H LEU C 35 -21.278 -3.956 5.262 1.00 0.00 H new ATOM 0 HA LEU C 35 -20.979 -6.484 3.906 1.00 0.00 H new ATOM 0 HB2 LEU C 35 -20.712 -3.577 3.320 1.00 0.00 H new ATOM 0 HB3 LEU C 35 -19.671 -4.628 2.381 1.00 0.00 H new ATOM 0 HG LEU C 35 -22.562 -5.362 2.570 1.00 0.00 H new ATOM 0 HD11 LEU C 35 -23.119 -3.844 0.711 1.00 0.00 H new ATOM 0 HD12 LEU C 35 -22.648 -2.948 2.175 1.00 0.00 H new ATOM 0 HD13 LEU C 35 -21.499 -3.116 0.826 1.00 0.00 H new ATOM 0 HD21 LEU C 35 -22.153 -6.064 0.239 1.00 0.00 H new ATOM 0 HD22 LEU C 35 -20.498 -5.416 0.339 1.00 0.00 H new ATOM 0 HD23 LEU C 35 -20.979 -6.792 1.361 1.00 0.00 H new ATOM 2249 N VAL C 36 -18.389 -4.992 5.234 1.00 0.00 N ATOM 2250 CA VAL C 36 -16.989 -5.185 5.581 1.00 0.00 C ATOM 2251 C VAL C 36 -16.843 -6.403 6.483 1.00 0.00 C ATOM 2252 O VAL C 36 -15.902 -7.182 6.337 1.00 0.00 O ATOM 2253 CB VAL C 36 -16.373 -3.943 6.255 1.00 0.00 C ATOM 2254 CG1 VAL C 36 -15.010 -4.267 6.850 1.00 0.00 C ATOM 2255 CG2 VAL C 36 -16.262 -2.801 5.257 1.00 0.00 C ATOM 0 H VAL C 36 -18.825 -4.173 5.658 1.00 0.00 H new ATOM 0 HA VAL C 36 -16.441 -5.347 4.653 1.00 0.00 H new ATOM 0 HB VAL C 36 -17.031 -3.634 7.067 1.00 0.00 H new ATOM 0 HG11 VAL C 36 -14.597 -3.374 7.320 1.00 0.00 H new ATOM 0 HG12 VAL C 36 -15.117 -5.054 7.597 1.00 0.00 H new ATOM 0 HG13 VAL C 36 -14.339 -4.605 6.060 1.00 0.00 H new ATOM 0 HG21 VAL C 36 -15.825 -1.931 5.747 1.00 0.00 H new ATOM 0 HG22 VAL C 36 -15.627 -3.105 4.425 1.00 0.00 H new ATOM 0 HG23 VAL C 36 -17.254 -2.547 4.883 1.00 0.00 H new ATOM 2265 N ASP C 37 -17.773 -6.562 7.417 1.00 0.00 N ATOM 2266 CA ASP C 37 -17.753 -7.706 8.315 1.00 0.00 C ATOM 2267 C ASP C 37 -17.843 -8.988 7.500 1.00 0.00 C ATOM 2268 O ASP C 37 -17.074 -9.926 7.715 1.00 0.00 O ATOM 2269 CB ASP C 37 -18.923 -7.633 9.296 1.00 0.00 C ATOM 2270 CG ASP C 37 -18.905 -8.765 10.305 1.00 0.00 C ATOM 2271 OD1 ASP C 37 -19.467 -9.838 10.004 1.00 0.00 O ATOM 2272 OD2 ASP C 37 -18.327 -8.578 11.397 1.00 0.00 O ATOM 0 H ASP C 37 -18.547 -5.915 7.571 1.00 0.00 H new ATOM 0 HA ASP C 37 -16.822 -7.697 8.882 1.00 0.00 H new ATOM 0 HB2 ASP C 37 -18.892 -6.680 9.823 1.00 0.00 H new ATOM 0 HB3 ASP C 37 -19.861 -7.660 8.741 1.00 0.00 H new ATOM 2277 N SER C 38 -18.786 -9.027 6.562 1.00 0.00 N ATOM 2278 CA SER C 38 -18.979 -10.207 5.727 1.00 0.00 C ATOM 2279 C SER C 38 -17.728 -10.538 4.918 1.00 0.00 C ATOM 2280 O SER C 38 -17.328 -11.700 4.834 1.00 0.00 O ATOM 2281 CB SER C 38 -20.167 -9.992 4.790 1.00 0.00 C ATOM 2282 OG SER C 38 -21.387 -9.969 5.510 1.00 0.00 O ATOM 0 H SER C 38 -19.426 -8.258 6.362 1.00 0.00 H new ATOM 0 HA SER C 38 -19.180 -11.052 6.385 1.00 0.00 H new ATOM 0 HB2 SER C 38 -20.043 -9.054 4.249 1.00 0.00 H new ATOM 0 HB3 SER C 38 -20.196 -10.788 4.045 1.00 0.00 H new ATOM 0 HG SER C 38 -21.536 -9.071 5.872 1.00 0.00 H new ATOM 2288 N TYR C 39 -17.109 -9.520 4.321 1.00 0.00 N ATOM 2289 CA TYR C 39 -15.899 -9.724 3.532 1.00 0.00 C ATOM 2290 C TYR C 39 -14.778 -10.281 4.399 1.00 0.00 C ATOM 2291 O TYR C 39 -14.097 -11.233 4.018 1.00 0.00 O ATOM 2292 CB TYR C 39 -15.446 -8.410 2.893 1.00 0.00 C ATOM 2293 CG TYR C 39 -13.981 -8.406 2.516 1.00 0.00 C ATOM 2294 CD1 TYR C 39 -13.548 -8.985 1.332 1.00 0.00 C ATOM 2295 CD2 TYR C 39 -13.030 -7.838 3.355 1.00 0.00 C ATOM 2296 CE1 TYR C 39 -12.210 -8.994 0.992 1.00 0.00 C ATOM 2297 CE2 TYR C 39 -11.693 -7.845 3.025 1.00 0.00 C ATOM 2298 CZ TYR C 39 -11.286 -8.423 1.841 1.00 0.00 C ATOM 2299 OH TYR C 39 -9.951 -8.432 1.509 1.00 0.00 O ATOM 0 H TYR C 39 -17.425 -8.551 4.369 1.00 0.00 H new ATOM 0 HA TYR C 39 -16.129 -10.443 2.746 1.00 0.00 H new ATOM 0 HB2 TYR C 39 -16.045 -8.221 2.002 1.00 0.00 H new ATOM 0 HB3 TYR C 39 -15.639 -7.591 3.586 1.00 0.00 H new ATOM 0 HD1 TYR C 39 -14.269 -9.436 0.666 1.00 0.00 H new ATOM 0 HD2 TYR C 39 -13.345 -7.383 4.282 1.00 0.00 H new ATOM 0 HE1 TYR C 39 -11.889 -9.446 0.065 1.00 0.00 H new ATOM 0 HE2 TYR C 39 -10.967 -7.400 3.690 1.00 0.00 H new ATOM 0 HH TYR C 39 -9.682 -9.341 1.258 1.00 0.00 H new ATOM 2309 N ARG C 40 -14.594 -9.674 5.566 1.00 0.00 N ATOM 2310 CA ARG C 40 -13.553 -10.098 6.489 1.00 0.00 C ATOM 2311 C ARG C 40 -13.703 -11.576 6.821 1.00 0.00 C ATOM 2312 O ARG C 40 -12.714 -12.273 7.034 1.00 0.00 O ATOM 2313 CB ARG C 40 -13.590 -9.252 7.757 1.00 0.00 C ATOM 2314 CG ARG C 40 -12.984 -7.875 7.564 1.00 0.00 C ATOM 2315 CD ARG C 40 -12.905 -7.116 8.873 1.00 0.00 C ATOM 2316 NE ARG C 40 -12.006 -7.758 9.829 1.00 0.00 N ATOM 2317 CZ ARG C 40 -11.932 -7.422 11.114 1.00 0.00 C ATOM 2318 NH1 ARG C 40 -12.703 -6.456 11.595 1.00 0.00 N ATOM 2319 NH2 ARG C 40 -11.087 -8.052 11.919 1.00 0.00 N ATOM 0 H ARG C 40 -15.153 -8.887 5.894 1.00 0.00 H new ATOM 0 HA ARG C 40 -12.585 -9.954 6.010 1.00 0.00 H new ATOM 0 HB2 ARG C 40 -14.623 -9.146 8.087 1.00 0.00 H new ATOM 0 HB3 ARG C 40 -13.053 -9.772 8.551 1.00 0.00 H new ATOM 0 HG2 ARG C 40 -11.986 -7.972 7.137 1.00 0.00 H new ATOM 0 HG3 ARG C 40 -13.582 -7.310 6.850 1.00 0.00 H new ATOM 0 HD2 ARG C 40 -12.563 -6.099 8.681 1.00 0.00 H new ATOM 0 HD3 ARG C 40 -13.902 -7.040 9.308 1.00 0.00 H new ATOM 0 HE ARG C 40 -11.401 -8.507 9.492 1.00 0.00 H new ATOM 0 HH11 ARG C 40 -13.354 -5.969 10.979 1.00 0.00 H new ATOM 0 HH12 ARG C 40 -12.645 -6.200 12.581 1.00 0.00 H new ATOM 0 HH21 ARG C 40 -10.492 -8.796 11.553 1.00 0.00 H new ATOM 0 HH22 ARG C 40 -11.032 -7.793 12.904 1.00 0.00 H new ATOM 2333 N GLN C 41 -14.945 -12.047 6.865 1.00 0.00 N ATOM 2334 CA GLN C 41 -15.219 -13.454 7.123 1.00 0.00 C ATOM 2335 C GLN C 41 -14.698 -14.298 5.963 1.00 0.00 C ATOM 2336 O GLN C 41 -14.086 -15.348 6.173 1.00 0.00 O ATOM 2337 CB GLN C 41 -16.716 -13.684 7.306 1.00 0.00 C ATOM 2338 CG GLN C 41 -17.052 -15.099 7.736 1.00 0.00 C ATOM 2339 CD GLN C 41 -16.652 -15.381 9.172 1.00 0.00 C ATOM 2340 OE1 GLN C 41 -15.424 -15.850 9.364 1.00 0.00 O flip ATOM 2341 NE2 GLN C 41 -17.438 -15.178 10.098 1.00 0.00 N flip ATOM 0 H GLN C 41 -15.777 -11.474 6.725 1.00 0.00 H new ATOM 0 HA GLN C 41 -14.711 -13.749 8.041 1.00 0.00 H new ATOM 0 HB2 GLN C 41 -17.097 -12.984 8.050 1.00 0.00 H new ATOM 0 HB3 GLN C 41 -17.229 -13.464 6.370 1.00 0.00 H new ATOM 0 HG2 GLN C 41 -18.123 -15.265 7.621 1.00 0.00 H new ATOM 0 HG3 GLN C 41 -16.547 -15.805 7.076 1.00 0.00 H new ATOM 0 HE21 GLN C 41 -18.372 -14.817 9.904 1.00 0.00 H new ATOM 0 HE22 GLN C 41 -17.155 -15.371 11.059 1.00 0.00 H new ATOM 2350 N GLN C 42 -14.936 -13.830 4.739 1.00 0.00 N ATOM 2351 CA GLN C 42 -14.471 -14.539 3.553 1.00 0.00 C ATOM 2352 C GLN C 42 -12.954 -14.664 3.596 1.00 0.00 C ATOM 2353 O GLN C 42 -12.374 -15.592 3.033 1.00 0.00 O ATOM 2354 CB GLN C 42 -14.906 -13.804 2.283 1.00 0.00 C ATOM 2355 CG GLN C 42 -14.553 -14.543 1.002 1.00 0.00 C ATOM 2356 CD GLN C 42 -14.986 -13.794 -0.243 1.00 0.00 C ATOM 2357 OE1 GLN C 42 -15.041 -12.564 -0.255 1.00 0.00 O ATOM 2358 NE2 GLN C 42 -15.295 -14.535 -1.301 1.00 0.00 N ATOM 0 H GLN C 42 -15.445 -12.968 4.545 1.00 0.00 H new ATOM 0 HA GLN C 42 -14.914 -15.535 3.540 1.00 0.00 H new ATOM 0 HB2 GLN C 42 -15.984 -13.645 2.316 1.00 0.00 H new ATOM 0 HB3 GLN C 42 -14.439 -12.819 2.265 1.00 0.00 H new ATOM 0 HG2 GLN C 42 -13.476 -14.707 0.967 1.00 0.00 H new ATOM 0 HG3 GLN C 42 -15.024 -15.526 1.012 1.00 0.00 H new ATOM 0 HE21 GLN C 42 -15.235 -15.552 -1.247 1.00 0.00 H new ATOM 0 HE22 GLN C 42 -15.592 -14.087 -2.168 1.00 0.00 H new ATOM 2367 N GLN C 43 -12.325 -13.709 4.274 1.00 0.00 N ATOM 2368 CA GLN C 43 -10.878 -13.695 4.431 1.00 0.00 C ATOM 2369 C GLN C 43 -10.474 -14.581 5.603 1.00 0.00 C ATOM 2370 O GLN C 43 -9.444 -15.254 5.564 1.00 0.00 O ATOM 2371 CB GLN C 43 -10.392 -12.260 4.651 1.00 0.00 C ATOM 2372 CG GLN C 43 -8.907 -12.145 4.951 1.00 0.00 C ATOM 2373 CD GLN C 43 -8.595 -12.249 6.433 1.00 0.00 C ATOM 2374 OE1 GLN C 43 -8.635 -11.117 7.126 1.00 0.00 O flip ATOM 2375 NE2 GLN C 43 -8.322 -13.332 6.950 1.00 0.00 N flip ATOM 0 H GLN C 43 -12.802 -12.929 4.726 1.00 0.00 H new ATOM 0 HA GLN C 43 -10.415 -14.085 3.525 1.00 0.00 H new ATOM 0 HB2 GLN C 43 -10.618 -11.671 3.762 1.00 0.00 H new ATOM 0 HB3 GLN C 43 -10.953 -11.821 5.476 1.00 0.00 H new ATOM 0 HG2 GLN C 43 -8.371 -12.929 4.416 1.00 0.00 H new ATOM 0 HG3 GLN C 43 -8.538 -11.192 4.573 1.00 0.00 H new ATOM 0 HE21 GLN C 43 -8.302 -14.178 6.381 1.00 0.00 H new ATOM 0 HE22 GLN C 43 -8.116 -13.383 7.948 1.00 0.00 H new ATOM 2384 N GLN C 44 -11.303 -14.574 6.645 1.00 0.00 N ATOM 2385 CA GLN C 44 -11.053 -15.380 7.835 1.00 0.00 C ATOM 2386 C GLN C 44 -10.987 -16.854 7.468 1.00 0.00 C ATOM 2387 O GLN C 44 -10.403 -17.661 8.192 1.00 0.00 O ATOM 2388 CB GLN C 44 -12.142 -15.147 8.883 1.00 0.00 C ATOM 2389 CG GLN C 44 -11.995 -13.830 9.626 1.00 0.00 C ATOM 2390 CD GLN C 44 -10.756 -13.788 10.500 1.00 0.00 C ATOM 2391 OE1 GLN C 44 -9.646 -13.329 9.933 1.00 0.00 O flip ATOM 2392 NE2 GLN C 44 -10.796 -14.163 11.672 1.00 0.00 N flip ATOM 0 H GLN C 44 -12.156 -14.017 6.688 1.00 0.00 H new ATOM 0 HA GLN C 44 -10.095 -15.078 8.259 1.00 0.00 H new ATOM 0 HB2 GLN C 44 -13.116 -15.173 8.395 1.00 0.00 H new ATOM 0 HB3 GLN C 44 -12.124 -15.965 9.603 1.00 0.00 H new ATOM 0 HG2 GLN C 44 -11.955 -13.013 8.905 1.00 0.00 H new ATOM 0 HG3 GLN C 44 -12.877 -13.666 10.245 1.00 0.00 H new ATOM 0 HE21 GLN C 44 -11.670 -14.509 12.067 1.00 0.00 H new ATOM 0 HE22 GLN C 44 -9.955 -14.128 12.248 1.00 0.00 H new ATOM 2401 N LEU C 45 -11.597 -17.196 6.338 1.00 0.00 N ATOM 2402 CA LEU C 45 -11.604 -18.571 5.861 1.00 0.00 C ATOM 2403 C LEU C 45 -10.179 -19.100 5.737 1.00 0.00 C ATOM 2404 O LEU C 45 -9.865 -20.184 6.227 1.00 0.00 O ATOM 2405 CB LEU C 45 -12.305 -18.651 4.503 1.00 0.00 C ATOM 2406 CG LEU C 45 -12.031 -19.927 3.704 1.00 0.00 C ATOM 2407 CD1 LEU C 45 -12.765 -21.111 4.317 1.00 0.00 C ATOM 2408 CD2 LEU C 45 -12.430 -19.740 2.248 1.00 0.00 C ATOM 0 H LEU C 45 -12.093 -16.538 5.736 1.00 0.00 H new ATOM 0 HA LEU C 45 -12.145 -19.184 6.582 1.00 0.00 H new ATOM 0 HB2 LEU C 45 -13.380 -18.564 4.661 1.00 0.00 H new ATOM 0 HB3 LEU C 45 -12.000 -17.793 3.903 1.00 0.00 H new ATOM 0 HG LEU C 45 -10.962 -20.134 3.741 1.00 0.00 H new ATOM 0 HD11 LEU C 45 -12.558 -22.009 3.735 1.00 0.00 H new ATOM 0 HD12 LEU C 45 -12.427 -21.257 5.343 1.00 0.00 H new ATOM 0 HD13 LEU C 45 -13.837 -20.916 4.313 1.00 0.00 H new ATOM 0 HD21 LEU C 45 -12.228 -20.657 1.695 1.00 0.00 H new ATOM 0 HD22 LEU C 45 -13.493 -19.507 2.189 1.00 0.00 H new ATOM 0 HD23 LEU C 45 -11.855 -18.921 1.815 1.00 0.00 H new ATOM 2494 N GLU D 2 6.739 13.628 -12.836 1.00 0.00 N ATOM 2495 CA GLU D 2 6.849 12.323 -12.193 1.00 0.00 C ATOM 2496 C GLU D 2 7.668 12.416 -10.911 1.00 0.00 C ATOM 2497 O GLU D 2 8.060 11.399 -10.341 1.00 0.00 O ATOM 2498 CB GLU D 2 7.484 11.310 -13.147 1.00 0.00 C ATOM 2499 CG GLU D 2 8.887 11.688 -13.594 1.00 0.00 C ATOM 2500 CD GLU D 2 9.477 10.691 -14.572 1.00 0.00 C ATOM 2501 OE1 GLU D 2 10.077 9.695 -14.115 1.00 0.00 O ATOM 2502 OE2 GLU D 2 9.339 10.905 -15.795 1.00 0.00 O ATOM 0 HA GLU D 2 5.844 11.987 -11.937 1.00 0.00 H new ATOM 0 HB2 GLU D 2 7.518 10.336 -12.659 1.00 0.00 H new ATOM 0 HB3 GLU D 2 6.848 11.204 -14.026 1.00 0.00 H new ATOM 0 HG2 GLU D 2 8.863 12.675 -14.057 1.00 0.00 H new ATOM 0 HG3 GLU D 2 9.535 11.761 -12.721 1.00 0.00 H new ATOM 2509 N ASP D 3 7.928 13.640 -10.464 1.00 0.00 N ATOM 2510 CA ASP D 3 8.695 13.858 -9.242 1.00 0.00 C ATOM 2511 C ASP D 3 7.814 13.629 -8.017 1.00 0.00 C ATOM 2512 O ASP D 3 6.957 12.747 -8.028 1.00 0.00 O ATOM 2513 CB ASP D 3 9.280 15.270 -9.226 1.00 0.00 C ATOM 2514 CG ASP D 3 8.213 16.341 -9.344 1.00 0.00 C ATOM 2515 OD1 ASP D 3 7.854 16.699 -10.485 1.00 0.00 O ATOM 2516 OD2 ASP D 3 7.736 16.823 -8.294 1.00 0.00 O ATOM 0 H ASP D 3 7.620 14.495 -10.928 1.00 0.00 H new ATOM 0 HA ASP D 3 9.518 13.144 -9.214 1.00 0.00 H new ATOM 0 HB2 ASP D 3 9.838 15.418 -8.302 1.00 0.00 H new ATOM 0 HB3 ASP D 3 9.989 15.376 -10.047 1.00 0.00 H new ATOM 2521 N THR D 4 8.022 14.412 -6.959 1.00 0.00 N ATOM 2522 CA THR D 4 7.222 14.260 -5.757 1.00 0.00 C ATOM 2523 C THR D 4 5.807 14.765 -5.989 1.00 0.00 C ATOM 2524 O THR D 4 5.580 15.752 -6.690 1.00 0.00 O ATOM 2525 CB THR D 4 7.842 14.969 -4.545 1.00 0.00 C ATOM 2526 OG1 THR D 4 9.224 15.253 -4.794 1.00 0.00 O ATOM 2527 CG2 THR D 4 7.715 14.111 -3.290 1.00 0.00 C ATOM 0 H THR D 4 8.729 15.146 -6.914 1.00 0.00 H new ATOM 0 HA THR D 4 7.193 13.194 -5.531 1.00 0.00 H new ATOM 0 HB THR D 4 7.302 15.903 -4.386 1.00 0.00 H new ATOM 0 HG1 THR D 4 9.610 15.707 -4.016 1.00 0.00 H new ATOM 0 HG21 THR D 4 8.161 14.635 -2.445 1.00 0.00 H new ATOM 0 HG22 THR D 4 6.662 13.921 -3.084 1.00 0.00 H new ATOM 0 HG23 THR D 4 8.231 13.163 -3.443 1.00 0.00 H new ATOM 2535 N TYR D 5 4.871 14.063 -5.386 1.00 0.00 N ATOM 2536 CA TYR D 5 3.461 14.355 -5.518 1.00 0.00 C ATOM 2537 C TYR D 5 2.823 14.513 -4.155 1.00 0.00 C ATOM 2538 O TYR D 5 3.438 14.167 -3.158 1.00 0.00 O ATOM 2539 CB TYR D 5 2.792 13.185 -6.225 1.00 0.00 C ATOM 2540 CG TYR D 5 3.101 13.124 -7.700 1.00 0.00 C ATOM 2541 CD1 TYR D 5 2.462 13.972 -8.596 1.00 0.00 C ATOM 2542 CD2 TYR D 5 4.024 12.216 -8.198 1.00 0.00 C ATOM 2543 CE1 TYR D 5 2.736 13.915 -9.947 1.00 0.00 C ATOM 2544 CE2 TYR D 5 4.304 12.153 -9.548 1.00 0.00 C ATOM 2545 CZ TYR D 5 3.656 13.005 -10.419 1.00 0.00 C ATOM 2546 OH TYR D 5 3.929 12.949 -11.765 1.00 0.00 O ATOM 0 H TYR D 5 5.071 13.265 -4.784 1.00 0.00 H new ATOM 0 HA TYR D 5 3.339 15.280 -6.081 1.00 0.00 H new ATOM 0 HB2 TYR D 5 3.111 12.255 -5.755 1.00 0.00 H new ATOM 0 HB3 TYR D 5 1.713 13.256 -6.090 1.00 0.00 H new ATOM 0 HD1 TYR D 5 1.740 14.687 -8.229 1.00 0.00 H new ATOM 0 HD2 TYR D 5 4.532 11.548 -7.518 1.00 0.00 H new ATOM 0 HE1 TYR D 5 2.231 14.581 -10.631 1.00 0.00 H new ATOM 0 HE2 TYR D 5 5.026 11.441 -9.920 1.00 0.00 H new ATOM 0 HH TYR D 5 4.418 13.755 -12.033 1.00 0.00 H new ATOM 2556 N TYR D 6 1.611 15.037 -4.089 1.00 0.00 N ATOM 2557 CA TYR D 6 0.937 15.138 -2.801 1.00 0.00 C ATOM 2558 C TYR D 6 -0.297 14.247 -2.790 1.00 0.00 C ATOM 2559 O TYR D 6 -1.153 14.328 -3.671 1.00 0.00 O ATOM 2560 CB TYR D 6 0.577 16.585 -2.463 1.00 0.00 C ATOM 2561 CG TYR D 6 1.681 17.575 -2.772 1.00 0.00 C ATOM 2562 CD1 TYR D 6 3.007 17.260 -2.515 1.00 0.00 C ATOM 2563 CD2 TYR D 6 1.398 18.819 -3.320 1.00 0.00 C ATOM 2564 CE1 TYR D 6 4.023 18.152 -2.790 1.00 0.00 C ATOM 2565 CE2 TYR D 6 2.409 19.721 -3.599 1.00 0.00 C ATOM 2566 CZ TYR D 6 3.720 19.383 -3.332 1.00 0.00 C ATOM 2567 OH TYR D 6 4.728 20.278 -3.608 1.00 0.00 O ATOM 0 H TYR D 6 1.083 15.391 -4.887 1.00 0.00 H new ATOM 0 HA TYR D 6 1.625 14.794 -2.028 1.00 0.00 H new ATOM 0 HB2 TYR D 6 -0.318 16.867 -3.018 1.00 0.00 H new ATOM 0 HB3 TYR D 6 0.328 16.650 -1.404 1.00 0.00 H new ATOM 0 HD1 TYR D 6 3.249 16.297 -2.091 1.00 0.00 H new ATOM 0 HD2 TYR D 6 0.373 19.086 -3.532 1.00 0.00 H new ATOM 0 HE1 TYR D 6 5.049 17.888 -2.582 1.00 0.00 H new ATOM 0 HE2 TYR D 6 2.173 20.686 -4.024 1.00 0.00 H new ATOM 0 HH TYR D 6 4.344 21.096 -3.987 1.00 0.00 H new ATOM 2577 N LEU D 7 -0.367 13.399 -1.774 1.00 0.00 N ATOM 2578 CA LEU D 7 -1.452 12.442 -1.624 1.00 0.00 C ATOM 2579 C LEU D 7 -2.288 12.776 -0.401 1.00 0.00 C ATOM 2580 O LEU D 7 -1.842 12.583 0.727 1.00 0.00 O ATOM 2581 CB LEU D 7 -0.811 11.067 -1.437 1.00 0.00 C ATOM 2582 CG LEU D 7 -1.412 9.862 -2.166 1.00 0.00 C ATOM 2583 CD1 LEU D 7 -2.061 10.226 -3.484 1.00 0.00 C ATOM 2584 CD2 LEU D 7 -0.313 8.837 -2.378 1.00 0.00 C ATOM 0 H LEU D 7 0.329 13.356 -1.029 1.00 0.00 H new ATOM 0 HA LEU D 7 -2.103 12.465 -2.498 1.00 0.00 H new ATOM 0 HB2 LEU D 7 0.233 11.147 -1.739 1.00 0.00 H new ATOM 0 HB3 LEU D 7 -0.818 10.843 -0.370 1.00 0.00 H new ATOM 0 HG LEU D 7 -2.210 9.454 -1.546 1.00 0.00 H new ATOM 0 HD11 LEU D 7 -2.467 9.328 -3.950 1.00 0.00 H new ATOM 0 HD12 LEU D 7 -2.866 10.939 -3.308 1.00 0.00 H new ATOM 0 HD13 LEU D 7 -1.318 10.673 -4.144 1.00 0.00 H new ATOM 0 HD21 LEU D 7 -0.720 7.969 -2.897 1.00 0.00 H new ATOM 0 HD22 LEU D 7 0.484 9.277 -2.977 1.00 0.00 H new ATOM 0 HD23 LEU D 7 0.087 8.528 -1.412 1.00 0.00 H new ATOM 2596 N GLN D 8 -3.509 13.244 -0.607 1.00 0.00 N ATOM 2597 CA GLN D 8 -4.351 13.560 0.526 1.00 0.00 C ATOM 2598 C GLN D 8 -5.023 12.307 1.052 1.00 0.00 C ATOM 2599 O GLN D 8 -5.848 11.700 0.378 1.00 0.00 O ATOM 2600 CB GLN D 8 -5.385 14.618 0.158 1.00 0.00 C ATOM 2601 CG GLN D 8 -5.571 15.677 1.231 1.00 0.00 C ATOM 2602 CD GLN D 8 -6.912 16.391 1.156 1.00 0.00 C ATOM 2603 OE1 GLN D 8 -7.402 16.909 2.159 1.00 0.00 O ATOM 2604 NE2 GLN D 8 -7.521 16.417 -0.024 1.00 0.00 N ATOM 0 H GLN D 8 -3.927 13.409 -1.523 1.00 0.00 H new ATOM 0 HA GLN D 8 -3.722 13.969 1.316 1.00 0.00 H new ATOM 0 HB2 GLN D 8 -5.084 15.102 -0.771 1.00 0.00 H new ATOM 0 HB3 GLN D 8 -6.341 14.131 -0.031 1.00 0.00 H new ATOM 0 HG2 GLN D 8 -5.472 15.211 2.211 1.00 0.00 H new ATOM 0 HG3 GLN D 8 -4.772 16.413 1.146 1.00 0.00 H new ATOM 0 HE21 GLN D 8 -7.084 15.977 -0.833 1.00 0.00 H new ATOM 0 HE22 GLN D 8 -8.426 16.877 -0.121 1.00 0.00 H new ATOM 2613 N VAL D 9 -4.670 11.935 2.271 1.00 0.00 N ATOM 2614 CA VAL D 9 -5.216 10.732 2.865 1.00 0.00 C ATOM 2615 C VAL D 9 -5.987 11.041 4.140 1.00 0.00 C ATOM 2616 O VAL D 9 -5.446 11.610 5.079 1.00 0.00 O ATOM 2617 CB VAL D 9 -4.102 9.713 3.144 1.00 0.00 C ATOM 2618 CG1 VAL D 9 -4.594 8.599 4.048 1.00 0.00 C ATOM 2619 CG2 VAL D 9 -3.556 9.164 1.838 1.00 0.00 C ATOM 0 H VAL D 9 -4.014 12.445 2.862 1.00 0.00 H new ATOM 0 HA VAL D 9 -5.915 10.298 2.150 1.00 0.00 H new ATOM 0 HB VAL D 9 -3.292 10.221 3.667 1.00 0.00 H new ATOM 0 HG11 VAL D 9 -3.784 7.892 4.228 1.00 0.00 H new ATOM 0 HG12 VAL D 9 -4.926 9.020 4.997 1.00 0.00 H new ATOM 0 HG13 VAL D 9 -5.426 8.083 3.569 1.00 0.00 H new ATOM 0 HG21 VAL D 9 -2.767 8.442 2.048 1.00 0.00 H new ATOM 0 HG22 VAL D 9 -4.358 8.674 1.286 1.00 0.00 H new ATOM 0 HG23 VAL D 9 -3.151 9.981 1.241 1.00 0.00 H new ATOM 2629 N ARG D 10 -7.234 10.595 4.194 1.00 0.00 N ATOM 2630 CA ARG D 10 -8.080 10.875 5.347 1.00 0.00 C ATOM 2631 C ARG D 10 -8.058 9.714 6.330 1.00 0.00 C ATOM 2632 O ARG D 10 -8.064 8.549 5.936 1.00 0.00 O ATOM 2633 CB ARG D 10 -9.515 11.176 4.906 1.00 0.00 C ATOM 2634 CG ARG D 10 -10.310 11.997 5.911 1.00 0.00 C ATOM 2635 CD ARG D 10 -10.937 11.123 6.987 1.00 0.00 C ATOM 2636 NE ARG D 10 -11.709 11.907 7.949 1.00 0.00 N ATOM 2637 CZ ARG D 10 -12.326 11.383 9.004 1.00 0.00 C ATOM 2638 NH1 ARG D 10 -12.262 10.079 9.236 1.00 0.00 N ATOM 2639 NH2 ARG D 10 -13.008 12.165 9.830 1.00 0.00 N ATOM 0 H ARG D 10 -7.680 10.043 3.461 1.00 0.00 H new ATOM 0 HA ARG D 10 -7.682 11.756 5.850 1.00 0.00 H new ATOM 0 HB2 ARG D 10 -9.488 11.710 3.956 1.00 0.00 H new ATOM 0 HB3 ARG D 10 -10.035 10.235 4.728 1.00 0.00 H new ATOM 0 HG2 ARG D 10 -9.655 12.733 6.377 1.00 0.00 H new ATOM 0 HG3 ARG D 10 -11.092 12.550 5.391 1.00 0.00 H new ATOM 0 HD2 ARG D 10 -11.586 10.382 6.520 1.00 0.00 H new ATOM 0 HD3 ARG D 10 -10.154 10.575 7.511 1.00 0.00 H new ATOM 0 HE ARG D 10 -11.779 12.914 7.803 1.00 0.00 H new ATOM 0 HH11 ARG D 10 -11.738 9.474 8.604 1.00 0.00 H new ATOM 0 HH12 ARG D 10 -12.737 9.681 10.046 1.00 0.00 H new ATOM 0 HH21 ARG D 10 -13.059 13.169 9.656 1.00 0.00 H new ATOM 0 HH22 ARG D 10 -13.481 11.763 10.639 1.00 0.00 H new ATOM 2653 N GLY D 11 -8.033 10.047 7.609 1.00 0.00 N ATOM 2654 CA GLY D 11 -7.994 9.020 8.630 1.00 0.00 C ATOM 2655 C GLY D 11 -6.573 8.637 8.988 1.00 0.00 C ATOM 2656 O GLY D 11 -5.792 8.249 8.119 1.00 0.00 O ATOM 0 H GLY D 11 -8.039 11.005 7.959 1.00 0.00 H new ATOM 0 HA2 GLY D 11 -8.511 9.374 9.522 1.00 0.00 H new ATOM 0 HA3 GLY D 11 -8.531 8.138 8.280 1.00 0.00 H new ATOM 2660 N ARG D 12 -6.237 8.750 10.266 1.00 0.00 N ATOM 2661 CA ARG D 12 -4.897 8.427 10.745 1.00 0.00 C ATOM 2662 C ARG D 12 -4.450 7.023 10.335 1.00 0.00 C ATOM 2663 O ARG D 12 -3.337 6.853 9.840 1.00 0.00 O ATOM 2664 CB ARG D 12 -4.821 8.583 12.264 1.00 0.00 C ATOM 2665 CG ARG D 12 -3.409 8.798 12.779 1.00 0.00 C ATOM 2666 CD ARG D 12 -2.898 10.188 12.435 1.00 0.00 C ATOM 2667 NE ARG D 12 -1.504 10.372 12.829 1.00 0.00 N ATOM 2668 CZ ARG D 12 -1.035 11.480 13.396 1.00 0.00 C ATOM 2669 NH1 ARG D 12 -1.850 12.494 13.653 1.00 0.00 N ATOM 2670 NH2 ARG D 12 0.249 11.573 13.712 1.00 0.00 N ATOM 0 H ARG D 12 -6.878 9.065 10.995 1.00 0.00 H new ATOM 0 HA ARG D 12 -4.213 9.133 10.274 1.00 0.00 H new ATOM 0 HB2 ARG D 12 -5.442 9.426 12.567 1.00 0.00 H new ATOM 0 HB3 ARG D 12 -5.240 7.693 12.734 1.00 0.00 H new ATOM 0 HG2 ARG D 12 -3.389 8.659 13.860 1.00 0.00 H new ATOM 0 HG3 ARG D 12 -2.745 8.048 12.349 1.00 0.00 H new ATOM 0 HD2 ARG D 12 -2.997 10.355 11.362 1.00 0.00 H new ATOM 0 HD3 ARG D 12 -3.517 10.935 12.932 1.00 0.00 H new ATOM 0 HE ARG D 12 -0.852 9.606 12.660 1.00 0.00 H new ATOM 0 HH11 ARG D 12 -2.840 12.426 13.416 1.00 0.00 H new ATOM 0 HH12 ARG D 12 -1.487 13.342 14.088 1.00 0.00 H new ATOM 0 HH21 ARG D 12 0.879 10.794 13.520 1.00 0.00 H new ATOM 0 HH22 ARG D 12 0.607 12.423 14.147 1.00 0.00 H new ATOM 2684 N GLU D 13 -5.300 6.020 10.541 1.00 0.00 N ATOM 2685 CA GLU D 13 -4.947 4.641 10.196 1.00 0.00 C ATOM 2686 C GLU D 13 -4.483 4.516 8.743 1.00 0.00 C ATOM 2687 O GLU D 13 -3.466 3.882 8.462 1.00 0.00 O ATOM 2688 CB GLU D 13 -6.135 3.711 10.453 1.00 0.00 C ATOM 2689 CG GLU D 13 -5.858 2.251 10.127 1.00 0.00 C ATOM 2690 CD GLU D 13 -6.925 1.323 10.674 1.00 0.00 C ATOM 2691 OE1 GLU D 13 -8.085 1.419 10.222 1.00 0.00 O ATOM 2692 OE2 GLU D 13 -6.602 0.504 11.560 1.00 0.00 O ATOM 0 H GLU D 13 -6.231 6.132 10.942 1.00 0.00 H new ATOM 0 HA GLU D 13 -4.113 4.347 10.833 1.00 0.00 H new ATOM 0 HB2 GLU D 13 -6.426 3.790 11.501 1.00 0.00 H new ATOM 0 HB3 GLU D 13 -6.984 4.051 9.860 1.00 0.00 H new ATOM 0 HG2 GLU D 13 -5.794 2.129 9.046 1.00 0.00 H new ATOM 0 HG3 GLU D 13 -4.889 1.968 10.538 1.00 0.00 H new ATOM 2699 N ASN D 14 -5.233 5.120 7.826 1.00 0.00 N ATOM 2700 CA ASN D 14 -4.902 5.074 6.405 1.00 0.00 C ATOM 2701 C ASN D 14 -3.618 5.854 6.114 1.00 0.00 C ATOM 2702 O ASN D 14 -2.758 5.391 5.366 1.00 0.00 O ATOM 2703 CB ASN D 14 -6.058 5.640 5.581 1.00 0.00 C ATOM 2704 CG ASN D 14 -7.391 5.020 5.956 1.00 0.00 C ATOM 2705 OD1 ASN D 14 -7.450 3.882 6.421 1.00 0.00 O ATOM 2706 ND2 ASN D 14 -8.470 5.766 5.750 1.00 0.00 N ATOM 0 H ASN D 14 -6.078 5.649 8.043 1.00 0.00 H new ATOM 0 HA ASN D 14 -4.737 4.033 6.126 1.00 0.00 H new ATOM 0 HB2 ASN D 14 -6.109 6.719 5.724 1.00 0.00 H new ATOM 0 HB3 ASN D 14 -5.865 5.468 4.522 1.00 0.00 H new ATOM 0 HD21 ASN D 14 -9.394 5.400 5.979 1.00 0.00 H new ATOM 0 HD22 ASN D 14 -8.375 6.705 5.362 1.00 0.00 H new ATOM 2713 N PHE D 15 -3.499 7.039 6.707 1.00 0.00 N ATOM 2714 CA PHE D 15 -2.322 7.885 6.523 1.00 0.00 C ATOM 2715 C PHE D 15 -1.044 7.167 6.948 1.00 0.00 C ATOM 2716 O PHE D 15 -0.045 7.234 6.254 1.00 0.00 O ATOM 2717 CB PHE D 15 -2.482 9.180 7.320 1.00 0.00 C ATOM 2718 CG PHE D 15 -1.367 10.164 7.105 1.00 0.00 C ATOM 2719 CD1 PHE D 15 -0.903 10.444 5.827 1.00 0.00 C ATOM 2720 CD2 PHE D 15 -0.782 10.811 8.183 1.00 0.00 C ATOM 2721 CE1 PHE D 15 0.115 11.349 5.632 1.00 0.00 C ATOM 2722 CE2 PHE D 15 0.243 11.719 7.988 1.00 0.00 C ATOM 2723 CZ PHE D 15 0.690 11.987 6.708 1.00 0.00 C ATOM 0 H PHE D 15 -4.208 7.437 7.323 1.00 0.00 H new ATOM 0 HA PHE D 15 -2.238 8.117 5.461 1.00 0.00 H new ATOM 0 HB2 PHE D 15 -3.427 9.650 7.047 1.00 0.00 H new ATOM 0 HB3 PHE D 15 -2.541 8.938 8.381 1.00 0.00 H new ATOM 0 HD1 PHE D 15 -1.346 9.946 4.977 1.00 0.00 H new ATOM 0 HD2 PHE D 15 -1.130 10.604 9.184 1.00 0.00 H new ATOM 0 HE1 PHE D 15 0.464 11.559 4.632 1.00 0.00 H new ATOM 0 HE2 PHE D 15 0.693 12.217 8.834 1.00 0.00 H new ATOM 0 HZ PHE D 15 1.489 12.696 6.552 1.00 0.00 H new ATOM 2733 N GLU D 16 -1.080 6.509 8.103 1.00 0.00 N ATOM 2734 CA GLU D 16 0.077 5.768 8.617 1.00 0.00 C ATOM 2735 C GLU D 16 0.444 4.597 7.715 1.00 0.00 C ATOM 2736 O GLU D 16 1.619 4.398 7.408 1.00 0.00 O ATOM 2737 CB GLU D 16 -0.207 5.262 10.033 1.00 0.00 C ATOM 2738 CG GLU D 16 -0.423 6.375 11.044 1.00 0.00 C ATOM 2739 CD GLU D 16 -0.682 5.849 12.442 1.00 0.00 C ATOM 2740 OE1 GLU D 16 -1.841 5.491 12.736 1.00 0.00 O ATOM 2741 OE2 GLU D 16 0.276 5.795 13.243 1.00 0.00 O ATOM 0 H GLU D 16 -1.901 6.472 8.707 1.00 0.00 H new ATOM 0 HA GLU D 16 0.924 6.454 8.637 1.00 0.00 H new ATOM 0 HB2 GLU D 16 -1.091 4.625 10.012 1.00 0.00 H new ATOM 0 HB3 GLU D 16 0.626 4.640 10.362 1.00 0.00 H new ATOM 0 HG2 GLU D 16 0.454 7.022 11.060 1.00 0.00 H new ATOM 0 HG3 GLU D 16 -1.267 6.989 10.729 1.00 0.00 H new ATOM 2748 N ILE D 17 -0.543 3.822 7.292 1.00 0.00 N ATOM 2749 CA ILE D 17 -0.268 2.690 6.423 1.00 0.00 C ATOM 2750 C ILE D 17 0.349 3.168 5.113 1.00 0.00 C ATOM 2751 O ILE D 17 1.323 2.590 4.623 1.00 0.00 O ATOM 2752 CB ILE D 17 -1.547 1.863 6.159 1.00 0.00 C ATOM 2753 CG1 ILE D 17 -1.598 0.676 7.126 1.00 0.00 C ATOM 2754 CG2 ILE D 17 -1.610 1.373 4.717 1.00 0.00 C ATOM 2755 CD1 ILE D 17 -2.975 0.095 7.307 1.00 0.00 C ATOM 0 H ILE D 17 -1.526 3.953 7.532 1.00 0.00 H new ATOM 0 HA ILE D 17 0.446 2.039 6.927 1.00 0.00 H new ATOM 0 HB ILE D 17 -2.411 2.507 6.324 1.00 0.00 H new ATOM 0 HG12 ILE D 17 -0.930 -0.105 6.763 1.00 0.00 H new ATOM 0 HG13 ILE D 17 -1.218 0.994 8.097 1.00 0.00 H new ATOM 0 HG21 ILE D 17 -2.522 0.796 4.568 1.00 0.00 H new ATOM 0 HG22 ILE D 17 -1.608 2.229 4.042 1.00 0.00 H new ATOM 0 HG23 ILE D 17 -0.745 0.744 4.508 1.00 0.00 H new ATOM 0 HD11 ILE D 17 -2.928 -0.741 8.005 1.00 0.00 H new ATOM 0 HD12 ILE D 17 -3.644 0.860 7.701 1.00 0.00 H new ATOM 0 HD13 ILE D 17 -3.351 -0.256 6.346 1.00 0.00 H new ATOM 2767 N LEU D 18 -0.205 4.240 4.560 1.00 0.00 N ATOM 2768 CA LEU D 18 0.285 4.790 3.311 1.00 0.00 C ATOM 2769 C LEU D 18 1.611 5.520 3.512 1.00 0.00 C ATOM 2770 O LEU D 18 2.464 5.492 2.637 1.00 0.00 O ATOM 2771 CB LEU D 18 -0.751 5.754 2.729 1.00 0.00 C ATOM 2772 CG LEU D 18 -1.921 5.091 2.001 1.00 0.00 C ATOM 2773 CD1 LEU D 18 -3.204 5.869 2.233 1.00 0.00 C ATOM 2774 CD2 LEU D 18 -1.629 4.996 0.512 1.00 0.00 C ATOM 0 H LEU D 18 -0.996 4.744 4.961 1.00 0.00 H new ATOM 0 HA LEU D 18 0.451 3.965 2.618 1.00 0.00 H new ATOM 0 HB2 LEU D 18 -1.148 6.367 3.538 1.00 0.00 H new ATOM 0 HB3 LEU D 18 -0.248 6.428 2.036 1.00 0.00 H new ATOM 0 HG LEU D 18 -2.049 4.085 2.400 1.00 0.00 H new ATOM 0 HD11 LEU D 18 -4.025 5.382 1.707 1.00 0.00 H new ATOM 0 HD12 LEU D 18 -3.424 5.899 3.300 1.00 0.00 H new ATOM 0 HD13 LEU D 18 -3.086 6.886 1.858 1.00 0.00 H new ATOM 0 HD21 LEU D 18 -2.470 4.522 0.006 1.00 0.00 H new ATOM 0 HD22 LEU D 18 -1.478 5.996 0.106 1.00 0.00 H new ATOM 0 HD23 LEU D 18 -0.729 4.401 0.355 1.00 0.00 H new ATOM 2786 N MET D 19 1.768 6.201 4.652 1.00 0.00 N ATOM 2787 CA MET D 19 3.002 6.947 4.936 1.00 0.00 C ATOM 2788 C MET D 19 4.190 5.993 4.980 1.00 0.00 C ATOM 2789 O MET D 19 5.210 6.249 4.340 1.00 0.00 O ATOM 2790 CB MET D 19 2.889 7.754 6.237 1.00 0.00 C ATOM 2791 CG MET D 19 3.682 9.053 6.248 1.00 0.00 C ATOM 2792 SD MET D 19 5.438 8.816 5.944 1.00 0.00 S ATOM 2793 CE MET D 19 5.916 10.503 5.592 1.00 0.00 C ATOM 0 H MET D 19 1.064 6.252 5.388 1.00 0.00 H new ATOM 0 HA MET D 19 3.160 7.664 4.130 1.00 0.00 H new ATOM 0 HB2 MET D 19 1.839 7.983 6.417 1.00 0.00 H new ATOM 0 HB3 MET D 19 3.226 7.131 7.066 1.00 0.00 H new ATOM 0 HG2 MET D 19 3.277 9.725 5.491 1.00 0.00 H new ATOM 0 HG3 MET D 19 3.550 9.543 7.213 1.00 0.00 H new ATOM 0 HE1 MET D 19 6.959 10.527 5.275 1.00 0.00 H new ATOM 0 HE2 MET D 19 5.286 10.901 4.797 1.00 0.00 H new ATOM 0 HE3 MET D 19 5.795 11.110 6.489 1.00 0.00 H new ATOM 2803 N LYS D 20 4.073 4.897 5.728 1.00 0.00 N ATOM 2804 CA LYS D 20 5.138 3.904 5.770 1.00 0.00 C ATOM 2805 C LYS D 20 5.420 3.426 4.369 1.00 0.00 C ATOM 2806 O LYS D 20 6.569 3.241 3.969 1.00 0.00 O ATOM 2807 CB LYS D 20 4.736 2.687 6.596 1.00 0.00 C ATOM 2808 CG LYS D 20 5.627 1.477 6.322 1.00 0.00 C ATOM 2809 CD LYS D 20 6.336 1.018 7.570 1.00 0.00 C ATOM 2810 CE LYS D 20 7.106 -0.270 7.337 1.00 0.00 C ATOM 2811 NZ LYS D 20 8.281 -0.063 6.446 1.00 0.00 N ATOM 0 H LYS D 20 3.261 4.678 6.305 1.00 0.00 H new ATOM 0 HA LYS D 20 6.012 4.373 6.221 1.00 0.00 H new ATOM 0 HB2 LYS D 20 4.785 2.938 7.656 1.00 0.00 H new ATOM 0 HB3 LYS D 20 3.700 2.429 6.377 1.00 0.00 H new ATOM 0 HG2 LYS D 20 5.023 0.661 5.925 1.00 0.00 H new ATOM 0 HG3 LYS D 20 6.362 1.731 5.558 1.00 0.00 H new ATOM 0 HD2 LYS D 20 7.021 1.796 7.906 1.00 0.00 H new ATOM 0 HD3 LYS D 20 5.608 0.868 8.368 1.00 0.00 H new ATOM 0 HE2 LYS D 20 7.442 -0.670 8.294 1.00 0.00 H new ATOM 0 HE3 LYS D 20 6.443 -1.014 6.896 1.00 0.00 H new ATOM 0 HZ1 LYS D 20 8.739 -0.977 6.258 1.00 0.00 H new ATOM 0 HZ2 LYS D 20 7.966 0.358 5.548 1.00 0.00 H new ATOM 0 HZ3 LYS D 20 8.959 0.575 6.909 1.00 0.00 H new ATOM 2825 N LEU D 21 4.343 3.233 3.631 1.00 0.00 N ATOM 2826 CA LEU D 21 4.435 2.748 2.275 1.00 0.00 C ATOM 2827 C LEU D 21 5.170 3.752 1.395 1.00 0.00 C ATOM 2828 O LEU D 21 6.035 3.384 0.606 1.00 0.00 O ATOM 2829 CB LEU D 21 3.037 2.459 1.728 1.00 0.00 C ATOM 2830 CG LEU D 21 2.941 1.477 0.565 1.00 0.00 C ATOM 2831 CD1 LEU D 21 1.624 1.653 -0.162 1.00 0.00 C ATOM 2832 CD2 LEU D 21 4.096 1.629 -0.410 1.00 0.00 C ATOM 0 H LEU D 21 3.391 3.407 3.954 1.00 0.00 H new ATOM 0 HA LEU D 21 5.006 1.820 2.270 1.00 0.00 H new ATOM 0 HB2 LEU D 21 2.425 2.078 2.545 1.00 0.00 H new ATOM 0 HB3 LEU D 21 2.594 3.404 1.412 1.00 0.00 H new ATOM 0 HG LEU D 21 2.995 0.472 0.985 1.00 0.00 H new ATOM 0 HD11 LEU D 21 1.568 0.946 -0.990 1.00 0.00 H new ATOM 0 HD12 LEU D 21 0.800 1.470 0.528 1.00 0.00 H new ATOM 0 HD13 LEU D 21 1.555 2.670 -0.548 1.00 0.00 H new ATOM 0 HD21 LEU D 21 3.985 0.909 -1.221 1.00 0.00 H new ATOM 0 HD22 LEU D 21 4.096 2.639 -0.819 1.00 0.00 H new ATOM 0 HD23 LEU D 21 5.037 1.448 0.109 1.00 0.00 H new ATOM 2844 N LYS D 22 4.834 5.023 1.551 1.00 0.00 N ATOM 2845 CA LYS D 22 5.473 6.078 0.795 1.00 0.00 C ATOM 2846 C LYS D 22 6.977 5.985 0.994 1.00 0.00 C ATOM 2847 O LYS D 22 7.756 6.182 0.062 1.00 0.00 O ATOM 2848 CB LYS D 22 4.920 7.430 1.261 1.00 0.00 C ATOM 2849 CG LYS D 22 5.896 8.588 1.178 1.00 0.00 C ATOM 2850 CD LYS D 22 5.387 9.777 1.975 1.00 0.00 C ATOM 2851 CE LYS D 22 6.507 10.738 2.329 1.00 0.00 C ATOM 2852 NZ LYS D 22 7.677 10.034 2.923 1.00 0.00 N ATOM 0 H LYS D 22 4.117 5.346 2.200 1.00 0.00 H new ATOM 0 HA LYS D 22 5.265 5.976 -0.270 1.00 0.00 H new ATOM 0 HB2 LYS D 22 4.042 7.672 0.662 1.00 0.00 H new ATOM 0 HB3 LYS D 22 4.584 7.331 2.293 1.00 0.00 H new ATOM 0 HG2 LYS D 22 6.869 8.278 1.559 1.00 0.00 H new ATOM 0 HG3 LYS D 22 6.039 8.876 0.136 1.00 0.00 H new ATOM 0 HD2 LYS D 22 4.626 10.302 1.398 1.00 0.00 H new ATOM 0 HD3 LYS D 22 4.908 9.424 2.888 1.00 0.00 H new ATOM 0 HE2 LYS D 22 6.822 11.274 1.434 1.00 0.00 H new ATOM 0 HE3 LYS D 22 6.137 11.484 3.033 1.00 0.00 H new ATOM 0 HZ1 LYS D 22 8.362 10.734 3.274 1.00 0.00 H new ATOM 0 HZ2 LYS D 22 7.358 9.435 3.711 1.00 0.00 H new ATOM 0 HZ3 LYS D 22 8.129 9.440 2.199 1.00 0.00 H new ATOM 2866 N GLU D 23 7.371 5.679 2.225 1.00 0.00 N ATOM 2867 CA GLU D 23 8.775 5.521 2.557 1.00 0.00 C ATOM 2868 C GLU D 23 9.347 4.278 1.882 1.00 0.00 C ATOM 2869 O GLU D 23 10.437 4.330 1.325 1.00 0.00 O ATOM 2870 CB GLU D 23 8.971 5.445 4.073 1.00 0.00 C ATOM 2871 CG GLU D 23 8.603 6.728 4.801 1.00 0.00 C ATOM 2872 CD GLU D 23 8.653 6.579 6.309 1.00 0.00 C ATOM 2873 OE1 GLU D 23 7.629 6.176 6.900 1.00 0.00 O ATOM 2874 OE2 GLU D 23 9.716 6.865 6.899 1.00 0.00 O ATOM 0 H GLU D 23 6.734 5.536 3.008 1.00 0.00 H new ATOM 0 HA GLU D 23 9.312 6.395 2.188 1.00 0.00 H new ATOM 0 HB2 GLU D 23 8.368 4.628 4.468 1.00 0.00 H new ATOM 0 HB3 GLU D 23 10.013 5.204 4.284 1.00 0.00 H new ATOM 0 HG2 GLU D 23 9.284 7.522 4.496 1.00 0.00 H new ATOM 0 HG3 GLU D 23 7.601 7.035 4.503 1.00 0.00 H new ATOM 2881 N SER D 24 8.625 3.154 1.939 1.00 0.00 N ATOM 2882 CA SER D 24 9.104 1.923 1.308 1.00 0.00 C ATOM 2883 C SER D 24 9.286 2.096 -0.204 1.00 0.00 C ATOM 2884 O SER D 24 10.312 1.703 -0.759 1.00 0.00 O ATOM 2885 CB SER D 24 8.160 0.755 1.602 1.00 0.00 C ATOM 2886 OG SER D 24 6.886 0.968 1.025 1.00 0.00 O ATOM 0 H SER D 24 7.723 3.072 2.407 1.00 0.00 H new ATOM 0 HA SER D 24 10.080 1.698 1.738 1.00 0.00 H new ATOM 0 HB2 SER D 24 8.588 -0.169 1.213 1.00 0.00 H new ATOM 0 HB3 SER D 24 8.057 0.630 2.680 1.00 0.00 H new ATOM 0 HG SER D 24 6.739 0.317 0.308 1.00 0.00 H new ATOM 2892 N LEU D 25 8.287 2.680 -0.868 1.00 0.00 N ATOM 2893 CA LEU D 25 8.343 2.906 -2.312 1.00 0.00 C ATOM 2894 C LEU D 25 9.460 3.879 -2.676 1.00 0.00 C ATOM 2895 O LEU D 25 10.227 3.635 -3.608 1.00 0.00 O ATOM 2896 CB LEU D 25 7.003 3.449 -2.821 1.00 0.00 C ATOM 2897 CG LEU D 25 5.940 2.391 -3.135 1.00 0.00 C ATOM 2898 CD1 LEU D 25 4.585 3.043 -3.343 1.00 0.00 C ATOM 2899 CD2 LEU D 25 6.322 1.589 -4.367 1.00 0.00 C ATOM 0 H LEU D 25 7.427 3.006 -0.426 1.00 0.00 H new ATOM 0 HA LEU D 25 8.549 1.948 -2.789 1.00 0.00 H new ATOM 0 HB2 LEU D 25 6.600 4.133 -2.074 1.00 0.00 H new ATOM 0 HB3 LEU D 25 7.186 4.034 -3.722 1.00 0.00 H new ATOM 0 HG LEU D 25 5.880 1.713 -2.284 1.00 0.00 H new ATOM 0 HD11 LEU D 25 3.843 2.276 -3.565 1.00 0.00 H new ATOM 0 HD12 LEU D 25 4.296 3.577 -2.438 1.00 0.00 H new ATOM 0 HD13 LEU D 25 4.643 3.744 -4.176 1.00 0.00 H new ATOM 0 HD21 LEU D 25 5.552 0.844 -4.570 1.00 0.00 H new ATOM 0 HD22 LEU D 25 6.414 2.258 -5.223 1.00 0.00 H new ATOM 0 HD23 LEU D 25 7.275 1.088 -4.194 1.00 0.00 H new ATOM 2911 N GLU D 26 9.548 4.980 -1.937 1.00 0.00 N ATOM 2912 CA GLU D 26 10.569 5.990 -2.191 1.00 0.00 C ATOM 2913 C GLU D 26 11.963 5.442 -1.902 1.00 0.00 C ATOM 2914 O GLU D 26 12.899 5.663 -2.666 1.00 0.00 O ATOM 2915 CB GLU D 26 10.315 7.240 -1.345 1.00 0.00 C ATOM 2916 CG GLU D 26 9.168 8.099 -1.855 1.00 0.00 C ATOM 2917 CD GLU D 26 9.131 9.469 -1.205 1.00 0.00 C ATOM 2918 OE1 GLU D 26 9.896 10.354 -1.642 1.00 0.00 O ATOM 2919 OE2 GLU D 26 8.336 9.657 -0.261 1.00 0.00 O ATOM 0 H GLU D 26 8.925 5.195 -1.158 1.00 0.00 H new ATOM 0 HA GLU D 26 10.514 6.261 -3.245 1.00 0.00 H new ATOM 0 HB2 GLU D 26 10.103 6.937 -0.320 1.00 0.00 H new ATOM 0 HB3 GLU D 26 11.224 7.841 -1.318 1.00 0.00 H new ATOM 0 HG2 GLU D 26 9.259 8.216 -2.935 1.00 0.00 H new ATOM 0 HG3 GLU D 26 8.224 7.587 -1.668 1.00 0.00 H new ATOM 2926 N LEU D 27 12.089 4.725 -0.791 1.00 0.00 N ATOM 2927 CA LEU D 27 13.356 4.126 -0.392 1.00 0.00 C ATOM 2928 C LEU D 27 13.801 3.044 -1.369 1.00 0.00 C ATOM 2929 O LEU D 27 14.993 2.853 -1.574 1.00 0.00 O ATOM 2930 CB LEU D 27 13.248 3.539 1.018 1.00 0.00 C ATOM 2931 CG LEU D 27 13.366 4.559 2.155 1.00 0.00 C ATOM 2932 CD1 LEU D 27 12.947 3.943 3.478 1.00 0.00 C ATOM 2933 CD2 LEU D 27 14.788 5.086 2.252 1.00 0.00 C ATOM 0 H LEU D 27 11.320 4.544 -0.145 1.00 0.00 H new ATOM 0 HA LEU D 27 14.107 4.916 -0.399 1.00 0.00 H new ATOM 0 HB2 LEU D 27 12.291 3.025 1.109 1.00 0.00 H new ATOM 0 HB3 LEU D 27 14.027 2.787 1.143 1.00 0.00 H new ATOM 0 HG LEU D 27 12.697 5.391 1.933 1.00 0.00 H new ATOM 0 HD11 LEU D 27 13.039 4.686 4.271 1.00 0.00 H new ATOM 0 HD12 LEU D 27 11.912 3.609 3.412 1.00 0.00 H new ATOM 0 HD13 LEU D 27 13.589 3.091 3.702 1.00 0.00 H new ATOM 0 HD21 LEU D 27 14.853 5.809 3.065 1.00 0.00 H new ATOM 0 HD22 LEU D 27 15.470 4.259 2.447 1.00 0.00 H new ATOM 0 HD23 LEU D 27 15.062 5.569 1.314 1.00 0.00 H new ATOM 2945 N MET D 28 12.870 2.328 -1.977 1.00 0.00 N ATOM 2946 CA MET D 28 13.269 1.278 -2.907 1.00 0.00 C ATOM 2947 C MET D 28 14.190 1.827 -4.004 1.00 0.00 C ATOM 2948 O MET D 28 14.815 1.057 -4.733 1.00 0.00 O ATOM 2949 CB MET D 28 12.054 0.566 -3.509 1.00 0.00 C ATOM 2950 CG MET D 28 12.409 -0.722 -4.230 1.00 0.00 C ATOM 2951 SD MET D 28 11.201 -1.200 -5.480 1.00 0.00 S ATOM 2952 CE MET D 28 10.010 -2.089 -4.484 1.00 0.00 C ATOM 0 H MET D 28 11.864 2.445 -1.852 1.00 0.00 H new ATOM 0 HA MET D 28 13.832 0.538 -2.339 1.00 0.00 H new ATOM 0 HB2 MET D 28 11.341 0.345 -2.715 1.00 0.00 H new ATOM 0 HB3 MET D 28 11.556 1.239 -4.207 1.00 0.00 H new ATOM 0 HG2 MET D 28 13.384 -0.608 -4.703 1.00 0.00 H new ATOM 0 HG3 MET D 28 12.501 -1.525 -3.499 1.00 0.00 H new ATOM 0 HE1 MET D 28 9.611 -2.927 -5.055 1.00 0.00 H new ATOM 0 HE2 MET D 28 10.496 -2.463 -3.583 1.00 0.00 H new ATOM 0 HE3 MET D 28 9.196 -1.419 -4.206 1.00 0.00 H new ATOM 2962 N GLU D 29 14.271 3.151 -4.134 1.00 0.00 N ATOM 2963 CA GLU D 29 15.124 3.768 -5.145 1.00 0.00 C ATOM 2964 C GLU D 29 16.535 4.045 -4.614 1.00 0.00 C ATOM 2965 O GLU D 29 17.485 4.144 -5.390 1.00 0.00 O ATOM 2966 CB GLU D 29 14.494 5.078 -5.635 1.00 0.00 C ATOM 2967 CG GLU D 29 14.877 6.298 -4.809 1.00 0.00 C ATOM 2968 CD GLU D 29 14.140 7.550 -5.243 1.00 0.00 C ATOM 2969 OE1 GLU D 29 14.601 8.208 -6.199 1.00 0.00 O ATOM 2970 OE2 GLU D 29 13.102 7.872 -4.627 1.00 0.00 O ATOM 0 H GLU D 29 13.757 3.814 -3.553 1.00 0.00 H new ATOM 0 HA GLU D 29 15.210 3.064 -5.973 1.00 0.00 H new ATOM 0 HB2 GLU D 29 14.790 5.246 -6.671 1.00 0.00 H new ATOM 0 HB3 GLU D 29 13.409 4.973 -5.627 1.00 0.00 H new ATOM 0 HG2 GLU D 29 14.665 6.102 -3.758 1.00 0.00 H new ATOM 0 HG3 GLU D 29 15.951 6.466 -4.892 1.00 0.00 H new ATOM 2977 N LEU D 30 16.669 4.171 -3.291 1.00 0.00 N ATOM 2978 CA LEU D 30 17.962 4.475 -2.684 1.00 0.00 C ATOM 2979 C LEU D 30 18.735 3.202 -2.365 1.00 0.00 C ATOM 2980 O LEU D 30 19.829 3.249 -1.802 1.00 0.00 O ATOM 2981 CB LEU D 30 17.767 5.358 -1.438 1.00 0.00 C ATOM 2982 CG LEU D 30 17.937 4.681 -0.075 1.00 0.00 C ATOM 2983 CD1 LEU D 30 17.910 5.722 1.033 1.00 0.00 C ATOM 2984 CD2 LEU D 30 16.858 3.640 0.160 1.00 0.00 C ATOM 0 H LEU D 30 15.902 4.068 -2.626 1.00 0.00 H new ATOM 0 HA LEU D 30 18.562 5.035 -3.401 1.00 0.00 H new ATOM 0 HB2 LEU D 30 18.473 6.186 -1.496 1.00 0.00 H new ATOM 0 HB3 LEU D 30 16.766 5.788 -1.480 1.00 0.00 H new ATOM 0 HG LEU D 30 18.902 4.174 -0.067 1.00 0.00 H new ATOM 0 HD11 LEU D 30 18.032 5.230 1.998 1.00 0.00 H new ATOM 0 HD12 LEU D 30 18.722 6.433 0.884 1.00 0.00 H new ATOM 0 HD13 LEU D 30 16.957 6.250 1.013 1.00 0.00 H new ATOM 0 HD21 LEU D 30 17.006 3.177 1.136 1.00 0.00 H new ATOM 0 HD22 LEU D 30 15.879 4.118 0.129 1.00 0.00 H new ATOM 0 HD23 LEU D 30 16.914 2.877 -0.616 1.00 0.00 H new ATOM 2996 N VAL D 31 18.167 2.067 -2.745 1.00 0.00 N ATOM 2997 CA VAL D 31 18.832 0.797 -2.520 1.00 0.00 C ATOM 2998 C VAL D 31 19.529 0.355 -3.803 1.00 0.00 C ATOM 2999 O VAL D 31 18.890 0.249 -4.851 1.00 0.00 O ATOM 3000 CB VAL D 31 17.859 -0.303 -2.053 1.00 0.00 C ATOM 3001 CG1 VAL D 31 16.643 -0.380 -2.960 1.00 0.00 C ATOM 3002 CG2 VAL D 31 18.571 -1.646 -1.992 1.00 0.00 C ATOM 0 H VAL D 31 17.259 2.001 -3.205 1.00 0.00 H new ATOM 0 HA VAL D 31 19.560 0.945 -1.722 1.00 0.00 H new ATOM 0 HB VAL D 31 17.511 -0.047 -1.052 1.00 0.00 H new ATOM 0 HG11 VAL D 31 15.974 -1.165 -2.606 1.00 0.00 H new ATOM 0 HG12 VAL D 31 16.119 0.576 -2.948 1.00 0.00 H new ATOM 0 HG13 VAL D 31 16.962 -0.606 -3.977 1.00 0.00 H new ATOM 0 HG21 VAL D 31 17.872 -2.414 -1.661 1.00 0.00 H new ATOM 0 HG22 VAL D 31 18.949 -1.902 -2.982 1.00 0.00 H new ATOM 0 HG23 VAL D 31 19.403 -1.585 -1.290 1.00 0.00 H new ATOM 3012 N PRO D 32 20.851 0.106 -3.746 1.00 0.00 N ATOM 3013 CA PRO D 32 21.621 -0.318 -4.913 1.00 0.00 C ATOM 3014 C PRO D 32 20.861 -1.324 -5.771 1.00 0.00 C ATOM 3015 O PRO D 32 20.340 -2.318 -5.266 1.00 0.00 O ATOM 3016 CB PRO D 32 22.857 -0.953 -4.287 1.00 0.00 C ATOM 3017 CG PRO D 32 23.072 -0.182 -3.028 1.00 0.00 C ATOM 3018 CD PRO D 32 21.705 0.245 -2.549 1.00 0.00 C ATOM 0 HA PRO D 32 21.846 0.506 -5.591 1.00 0.00 H new ATOM 0 HB2 PRO D 32 22.700 -2.012 -4.083 1.00 0.00 H new ATOM 0 HB3 PRO D 32 23.720 -0.881 -4.949 1.00 0.00 H new ATOM 0 HG2 PRO D 32 23.572 -0.795 -2.278 1.00 0.00 H new ATOM 0 HG3 PRO D 32 23.709 0.684 -3.207 1.00 0.00 H new ATOM 0 HD2 PRO D 32 21.353 -0.385 -1.732 1.00 0.00 H new ATOM 0 HD3 PRO D 32 21.713 1.271 -2.181 1.00 0.00 H new ATOM 3026 N GLN D 33 20.802 -1.047 -7.070 1.00 0.00 N ATOM 3027 CA GLN D 33 20.104 -1.910 -8.020 1.00 0.00 C ATOM 3028 C GLN D 33 20.465 -3.391 -7.842 1.00 0.00 C ATOM 3029 O GLN D 33 19.578 -4.244 -7.864 1.00 0.00 O ATOM 3030 CB GLN D 33 20.404 -1.466 -9.455 1.00 0.00 C ATOM 3031 CG GLN D 33 19.675 -2.282 -10.511 1.00 0.00 C ATOM 3032 CD GLN D 33 19.988 -1.822 -11.922 1.00 0.00 C ATOM 3033 OE1 GLN D 33 19.304 -0.960 -12.473 1.00 0.00 O ATOM 3034 NE2 GLN D 33 21.029 -2.397 -12.514 1.00 0.00 N ATOM 0 H GLN D 33 21.233 -0.225 -7.492 1.00 0.00 H new ATOM 0 HA GLN D 33 19.037 -1.811 -7.820 1.00 0.00 H new ATOM 0 HB2 GLN D 33 20.131 -0.417 -9.566 1.00 0.00 H new ATOM 0 HB3 GLN D 33 21.477 -1.536 -9.631 1.00 0.00 H new ATOM 0 HG2 GLN D 33 19.948 -3.332 -10.406 1.00 0.00 H new ATOM 0 HG3 GLN D 33 18.601 -2.213 -10.340 1.00 0.00 H new ATOM 0 HE21 GLN D 33 21.568 -3.108 -12.020 1.00 0.00 H new ATOM 0 HE22 GLN D 33 21.289 -2.128 -13.463 1.00 0.00 H new ATOM 3043 N PRO D 34 21.764 -3.730 -7.675 1.00 0.00 N ATOM 3044 CA PRO D 34 22.192 -5.127 -7.507 1.00 0.00 C ATOM 3045 C PRO D 34 21.490 -5.844 -6.355 1.00 0.00 C ATOM 3046 O PRO D 34 21.283 -7.058 -6.405 1.00 0.00 O ATOM 3047 CB PRO D 34 23.692 -5.013 -7.223 1.00 0.00 C ATOM 3048 CG PRO D 34 24.094 -3.715 -7.827 1.00 0.00 C ATOM 3049 CD PRO D 34 22.914 -2.803 -7.652 1.00 0.00 C ATOM 0 HA PRO D 34 21.947 -5.720 -8.388 1.00 0.00 H new ATOM 0 HB2 PRO D 34 23.895 -5.031 -6.152 1.00 0.00 H new ATOM 0 HB3 PRO D 34 24.243 -5.843 -7.666 1.00 0.00 H new ATOM 0 HG2 PRO D 34 24.978 -3.311 -7.334 1.00 0.00 H new ATOM 0 HG3 PRO D 34 24.344 -3.834 -8.881 1.00 0.00 H new ATOM 0 HD2 PRO D 34 22.967 -2.251 -6.714 1.00 0.00 H new ATOM 0 HD3 PRO D 34 22.853 -2.066 -8.452 1.00 0.00 H new ATOM 3057 N LEU D 35 21.111 -5.092 -5.319 1.00 0.00 N ATOM 3058 CA LEU D 35 20.447 -5.665 -4.150 1.00 0.00 C ATOM 3059 C LEU D 35 18.978 -5.951 -4.434 1.00 0.00 C ATOM 3060 O LEU D 35 18.418 -6.924 -3.929 1.00 0.00 O ATOM 3061 CB LEU D 35 20.572 -4.720 -2.953 1.00 0.00 C ATOM 3062 CG LEU D 35 21.728 -5.028 -2.005 1.00 0.00 C ATOM 3063 CD1 LEU D 35 22.270 -3.748 -1.389 1.00 0.00 C ATOM 3064 CD2 LEU D 35 21.278 -5.992 -0.915 1.00 0.00 C ATOM 0 H LEU D 35 21.254 -4.083 -5.268 1.00 0.00 H new ATOM 0 HA LEU D 35 20.939 -6.609 -3.916 1.00 0.00 H new ATOM 0 HB2 LEU D 35 20.688 -3.702 -3.324 1.00 0.00 H new ATOM 0 HB3 LEU D 35 19.641 -4.749 -2.387 1.00 0.00 H new ATOM 0 HG LEU D 35 22.527 -5.499 -2.578 1.00 0.00 H new ATOM 0 HD11 LEU D 35 23.093 -3.988 -0.716 1.00 0.00 H new ATOM 0 HD12 LEU D 35 22.628 -3.087 -2.179 1.00 0.00 H new ATOM 0 HD13 LEU D 35 21.478 -3.250 -0.830 1.00 0.00 H new ATOM 0 HD21 LEU D 35 22.114 -6.202 -0.247 1.00 0.00 H new ATOM 0 HD22 LEU D 35 20.463 -5.544 -0.347 1.00 0.00 H new ATOM 0 HD23 LEU D 35 20.935 -6.921 -1.370 1.00 0.00 H new ATOM 3076 N VAL D 36 18.357 -5.101 -5.241 1.00 0.00 N ATOM 3077 CA VAL D 36 16.955 -5.284 -5.588 1.00 0.00 C ATOM 3078 C VAL D 36 16.801 -6.501 -6.491 1.00 0.00 C ATOM 3079 O VAL D 36 15.855 -7.274 -6.346 1.00 0.00 O ATOM 3080 CB VAL D 36 16.347 -4.038 -6.261 1.00 0.00 C ATOM 3081 CG1 VAL D 36 14.982 -4.353 -6.856 1.00 0.00 C ATOM 3082 CG2 VAL D 36 16.243 -2.897 -5.261 1.00 0.00 C ATOM 0 H VAL D 36 18.798 -4.284 -5.664 1.00 0.00 H new ATOM 0 HA VAL D 36 16.406 -5.443 -4.660 1.00 0.00 H new ATOM 0 HB VAL D 36 17.006 -3.732 -7.073 1.00 0.00 H new ATOM 0 HG11 VAL D 36 14.574 -3.458 -7.325 1.00 0.00 H new ATOM 0 HG12 VAL D 36 15.084 -5.140 -7.603 1.00 0.00 H new ATOM 0 HG13 VAL D 36 14.309 -4.687 -6.066 1.00 0.00 H new ATOM 0 HG21 VAL D 36 15.812 -2.023 -5.750 1.00 0.00 H new ATOM 0 HG22 VAL D 36 15.606 -3.199 -4.429 1.00 0.00 H new ATOM 0 HG23 VAL D 36 17.236 -2.650 -4.886 1.00 0.00 H new ATOM 3092 N ASP D 37 17.731 -6.664 -7.425 1.00 0.00 N ATOM 3093 CA ASP D 37 17.704 -7.807 -8.325 1.00 0.00 C ATOM 3094 C ASP D 37 17.786 -9.091 -7.511 1.00 0.00 C ATOM 3095 O ASP D 37 17.012 -10.023 -7.727 1.00 0.00 O ATOM 3096 CB ASP D 37 18.874 -7.741 -9.306 1.00 0.00 C ATOM 3097 CG ASP D 37 18.848 -8.871 -10.316 1.00 0.00 C ATOM 3098 OD1 ASP D 37 19.404 -9.948 -10.016 1.00 0.00 O ATOM 3099 OD2 ASP D 37 18.271 -8.679 -11.407 1.00 0.00 O ATOM 0 H ASP D 37 18.509 -6.022 -7.577 1.00 0.00 H new ATOM 0 HA ASP D 37 16.774 -7.791 -8.893 1.00 0.00 H new ATOM 0 HB2 ASP D 37 18.849 -6.787 -9.832 1.00 0.00 H new ATOM 0 HB3 ASP D 37 19.812 -7.775 -8.751 1.00 0.00 H new ATOM 3104 N SER D 38 18.729 -9.136 -6.574 1.00 0.00 N ATOM 3105 CA SER D 38 18.915 -10.318 -5.740 1.00 0.00 C ATOM 3106 C SER D 38 17.661 -10.643 -4.931 1.00 0.00 C ATOM 3107 O SER D 38 17.253 -11.802 -4.850 1.00 0.00 O ATOM 3108 CB SER D 38 20.104 -10.111 -4.802 1.00 0.00 C ATOM 3109 OG SER D 38 21.325 -10.095 -5.521 1.00 0.00 O ATOM 0 H SER D 38 19.373 -8.371 -6.374 1.00 0.00 H new ATOM 0 HA SER D 38 19.112 -11.163 -6.399 1.00 0.00 H new ATOM 0 HB2 SER D 38 19.985 -9.172 -4.261 1.00 0.00 H new ATOM 0 HB3 SER D 38 20.127 -10.907 -4.058 1.00 0.00 H new ATOM 0 HG SER D 38 21.488 -9.193 -5.869 1.00 0.00 H new ATOM 3115 N TYR D 39 17.049 -9.622 -4.333 1.00 0.00 N ATOM 3116 CA TYR D 39 15.838 -9.818 -3.544 1.00 0.00 C ATOM 3117 C TYR D 39 14.713 -10.367 -4.411 1.00 0.00 C ATOM 3118 O TYR D 39 14.025 -11.315 -4.030 1.00 0.00 O ATOM 3119 CB TYR D 39 15.393 -8.502 -2.904 1.00 0.00 C ATOM 3120 CG TYR D 39 13.929 -8.490 -2.526 1.00 0.00 C ATOM 3121 CD1 TYR D 39 13.492 -9.067 -1.342 1.00 0.00 C ATOM 3122 CD2 TYR D 39 12.981 -7.916 -3.364 1.00 0.00 C ATOM 3123 CE1 TYR D 39 12.154 -9.068 -1.001 1.00 0.00 C ATOM 3124 CE2 TYR D 39 11.645 -7.915 -3.033 1.00 0.00 C ATOM 3125 CZ TYR D 39 11.234 -8.491 -1.850 1.00 0.00 C ATOM 3126 OH TYR D 39 9.899 -8.492 -1.516 1.00 0.00 O ATOM 0 H TYR D 39 17.371 -8.655 -4.380 1.00 0.00 H new ATOM 0 HA TYR D 39 16.065 -10.538 -2.758 1.00 0.00 H new ATOM 0 HB2 TYR D 39 15.993 -8.317 -2.013 1.00 0.00 H new ATOM 0 HB3 TYR D 39 15.590 -7.684 -3.597 1.00 0.00 H new ATOM 0 HD1 TYR D 39 14.210 -9.523 -0.676 1.00 0.00 H new ATOM 0 HD2 TYR D 39 13.298 -7.463 -4.292 1.00 0.00 H new ATOM 0 HE1 TYR D 39 11.830 -9.518 -0.074 1.00 0.00 H new ATOM 0 HE2 TYR D 39 10.922 -7.465 -3.697 1.00 0.00 H new ATOM 0 HH TYR D 39 9.670 -9.342 -1.086 1.00 0.00 H new ATOM 3136 N ARG D 40 14.533 -9.759 -5.577 1.00 0.00 N ATOM 3137 CA ARG D 40 13.489 -10.175 -6.501 1.00 0.00 C ATOM 3138 C ARG D 40 13.630 -11.655 -6.834 1.00 0.00 C ATOM 3139 O ARG D 40 12.636 -12.345 -7.048 1.00 0.00 O ATOM 3140 CB ARG D 40 13.531 -9.328 -7.767 1.00 0.00 C ATOM 3141 CG ARG D 40 12.934 -7.947 -7.573 1.00 0.00 C ATOM 3142 CD ARG D 40 12.859 -7.187 -8.881 1.00 0.00 C ATOM 3143 NE ARG D 40 11.957 -7.823 -9.838 1.00 0.00 N ATOM 3144 CZ ARG D 40 11.885 -7.484 -11.122 1.00 0.00 C ATOM 3145 NH1 ARG D 40 12.661 -6.522 -11.603 1.00 0.00 N ATOM 3146 NH2 ARG D 40 11.036 -8.108 -11.928 1.00 0.00 N ATOM 0 H ARG D 40 15.098 -8.975 -5.904 1.00 0.00 H new ATOM 0 HA ARG D 40 12.521 -10.025 -6.022 1.00 0.00 H new ATOM 0 HB2 ARG D 40 14.565 -9.228 -8.097 1.00 0.00 H new ATOM 0 HB3 ARG D 40 12.991 -9.844 -8.561 1.00 0.00 H new ATOM 0 HG2 ARG D 40 11.935 -8.038 -7.146 1.00 0.00 H new ATOM 0 HG3 ARG D 40 13.537 -7.386 -6.859 1.00 0.00 H new ATOM 0 HD2 ARG D 40 12.522 -6.168 -8.689 1.00 0.00 H new ATOM 0 HD3 ARG D 40 13.856 -7.116 -9.316 1.00 0.00 H new ATOM 0 HE ARG D 40 11.348 -8.569 -9.502 1.00 0.00 H new ATOM 0 HH11 ARG D 40 13.316 -6.039 -10.988 1.00 0.00 H new ATOM 0 HH12 ARG D 40 12.603 -6.265 -12.588 1.00 0.00 H new ATOM 0 HH21 ARG D 40 10.437 -8.849 -11.563 1.00 0.00 H new ATOM 0 HH22 ARG D 40 10.982 -7.847 -12.913 1.00 0.00 H new ATOM 3160 N GLN D 41 14.869 -12.133 -6.878 1.00 0.00 N ATOM 3161 CA GLN D 41 15.134 -13.541 -7.137 1.00 0.00 C ATOM 3162 C GLN D 41 14.609 -14.383 -5.979 1.00 0.00 C ATOM 3163 O GLN D 41 13.990 -15.429 -6.189 1.00 0.00 O ATOM 3164 CB GLN D 41 16.630 -13.780 -7.321 1.00 0.00 C ATOM 3165 CG GLN D 41 16.957 -15.196 -7.753 1.00 0.00 C ATOM 3166 CD GLN D 41 16.556 -15.475 -9.189 1.00 0.00 C ATOM 3167 OE1 GLN D 41 17.343 -15.277 -10.115 1.00 0.00 O ATOM 3168 NE2 GLN D 41 15.325 -15.936 -9.382 1.00 0.00 N ATOM 0 H GLN D 41 15.705 -11.565 -6.738 1.00 0.00 H new ATOM 0 HA GLN D 41 14.624 -13.831 -8.055 1.00 0.00 H new ATOM 0 HB2 GLN D 41 17.015 -13.082 -8.064 1.00 0.00 H new ATOM 0 HB3 GLN D 41 17.144 -13.564 -6.385 1.00 0.00 H new ATOM 0 HG2 GLN D 41 18.027 -15.369 -7.638 1.00 0.00 H new ATOM 0 HG3 GLN D 41 16.448 -15.900 -7.094 1.00 0.00 H new ATOM 0 HE21 GLN D 41 14.706 -16.086 -8.585 1.00 0.00 H new ATOM 0 HE22 GLN D 41 14.999 -16.140 -10.327 1.00 0.00 H new ATOM 3177 N GLN D 42 14.849 -13.918 -4.754 1.00 0.00 N ATOM 3178 CA GLN D 42 14.380 -14.625 -3.569 1.00 0.00 C ATOM 3179 C GLN D 42 12.862 -14.740 -3.612 1.00 0.00 C ATOM 3180 O GLN D 42 12.276 -15.667 -3.053 1.00 0.00 O ATOM 3181 CB GLN D 42 14.819 -13.894 -2.298 1.00 0.00 C ATOM 3182 CG GLN D 42 14.463 -14.632 -1.017 1.00 0.00 C ATOM 3183 CD GLN D 42 14.900 -13.886 0.229 1.00 0.00 C ATOM 3184 OE1 GLN D 42 14.963 -12.656 0.242 1.00 0.00 O ATOM 3185 NE2 GLN D 42 15.205 -14.629 1.286 1.00 0.00 N ATOM 0 H GLN D 42 15.363 -13.059 -4.559 1.00 0.00 H new ATOM 0 HA GLN D 42 14.817 -15.624 -3.557 1.00 0.00 H new ATOM 0 HB2 GLN D 42 15.898 -13.741 -2.331 1.00 0.00 H new ATOM 0 HB3 GLN D 42 14.357 -12.907 -2.279 1.00 0.00 H new ATOM 0 HG2 GLN D 42 13.385 -14.790 -0.981 1.00 0.00 H new ATOM 0 HG3 GLN D 42 14.930 -15.617 -1.028 1.00 0.00 H new ATOM 0 HE21 GLN D 42 15.139 -15.645 1.231 1.00 0.00 H new ATOM 0 HE22 GLN D 42 15.506 -14.184 2.153 1.00 0.00 H new ATOM 3194 N GLN D 43 12.238 -13.781 -4.289 1.00 0.00 N ATOM 3195 CA GLN D 43 10.792 -13.758 -4.445 1.00 0.00 C ATOM 3196 C GLN D 43 10.382 -14.640 -5.619 1.00 0.00 C ATOM 3197 O GLN D 43 9.349 -15.309 -5.579 1.00 0.00 O ATOM 3198 CB GLN D 43 10.314 -12.320 -4.664 1.00 0.00 C ATOM 3199 CG GLN D 43 8.829 -12.195 -4.964 1.00 0.00 C ATOM 3200 CD GLN D 43 8.516 -12.295 -6.446 1.00 0.00 C ATOM 3201 OE1 GLN D 43 8.564 -11.162 -7.137 1.00 0.00 O flip ATOM 3202 NE2 GLN D 43 8.234 -13.375 -6.963 1.00 0.00 N flip ATOM 0 H GLN D 43 12.719 -13.004 -4.741 1.00 0.00 H new ATOM 0 HA GLN D 43 10.327 -14.146 -3.538 1.00 0.00 H new ATOM 0 HB2 GLN D 43 10.544 -11.733 -3.775 1.00 0.00 H new ATOM 0 HB3 GLN D 43 10.878 -11.883 -5.488 1.00 0.00 H new ATOM 0 HG2 GLN D 43 8.288 -12.976 -4.430 1.00 0.00 H new ATOM 0 HG3 GLN D 43 8.466 -11.240 -4.585 1.00 0.00 H new ATOM 0 HE21 GLN D 43 8.209 -14.221 -6.394 1.00 0.00 H new ATOM 0 HE22 GLN D 43 8.026 -13.424 -7.960 1.00 0.00 H new