USER MOD reduce.3.24.130724 H: found=0, std=0, add=1140, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1144 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 53 SER OG : rot -154:sc= 0.955 USER MOD Set 1.2: B 56 GLN :FLIP amide:sc= 0.85 F(o=-2.7,f=1.8) USER MOD Set 2.1: B 20 LYS NZ :NH3+ -133:sc= 0.0487 (180deg=0) USER MOD Set 2.2: B 82 THR OG1 : rot 171:sc= -1.59! USER MOD Set 3.1: B 14 ASN : amide:sc= -2.17 K(o=-2.2,f=-5.2!) USER MOD Set 3.2: B 34 LYS NZ :NH3+ -127:sc=0.000842 (180deg=0) USER MOD Set 4.1: A 46 GLN : amide:sc= -2.98 X(o=-2.6,f=-3.1) USER MOD Set 4.2: A 77 GLN : amide:sc= 0.379 X(o=-2.6,f=-3.1) USER MOD Set 5.1: A 4 ASN : amide:sc= -2.67! C(o=-4.6!,f=-9.6!) USER MOD Set 5.2: A 26 HIS :FLIP no HD1:sc= -1.9! C(o=-5.9!,f=-4.6!) USER MOD Single : A 6 HIS : no HD1:sc= -0.111 X(o=-0.11,f=-0.37) USER MOD Single : A 8 ASN :FLIP amide:sc= -2.42! F(o=-3.2,f=-2.4!) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 20 GLN :FLIP amide:sc= -6.73! C(o=-8.8!,f=-6.7!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot -160:sc= -1.39 USER MOD Single : A 30 SER OG : rot 180:sc= -0.372 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 MET CE :methyl 164:sc= -5.38! (180deg=-6.03!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 39:sc= -1.09 USER MOD Single : A 37 CYS SG : rot -74:sc= -4.51! USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 MET CE :methyl -137:sc= -9.39! (180deg=-11.9!) USER MOD Single : A 54 GLN : amide:sc=-0.00761 X(o=-0.0076,f=-0.11) USER MOD Single : A 57 ASN : amide:sc= -0.316 X(o=-0.32,f=-0.0029) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.00455 USER MOD Single : A 61 THR OG1 : rot 123:sc= -0.0491 USER MOD Single : A 64 GLN : amide:sc=-0.00782 X(o=-0.0078,f=-0.012) USER MOD Single : A 67 MET CE :methyl 158:sc= -10.6! (180deg=-13.8!) USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.0664 USER MOD Single : A 78 GLN :FLIP amide:sc= -0.642 F(o=-1.3,f=-0.64) USER MOD Single : B 16 HIS : no HD1:sc= -5.49! C(o=-5.5!,f=-5.1!) USER MOD Single : B 18 ASN :FLIP amide:sc= -2.55 F(o=-4.4!,f=-2.5) USER MOD Single : B 24 GLN : amide:sc= -2.04 X(o=-2,f=-2.2!) USER MOD Single : B 27 SER OG : rot 180:sc= 0.0572 USER MOD Single : B 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 36 HIS : no HD1:sc= -1.11 X(o=-1.1,f=-0.74) USER MOD Single : B 37 THR OG1 : rot -170:sc= -2.33! USER MOD Single : B 40 SER OG : rot 95:sc= 0.834 USER MOD Single : B 41 LYS NZ :NH3+ 174:sc= -0.657 (180deg=-0.806) USER MOD Single : B 43 MET CE :methyl 145:sc= -10! (180deg=-12.1!) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 46 TYR OH : rot 90:sc= -1.01 USER MOD Single : B 47 CYS SG : rot 47:sc= -20.4! USER MOD Single : B 50 GLN :FLIP amide:sc= -8.72! C(o=-14!,f=-8.7!) USER MOD Single : B 54 MET CE :methyl 157:sc= 0 (180deg=-0.295) USER MOD Single : B 64 GLN :FLIP amide:sc= -1.01 F(o=-3.1!,f=-1) USER MOD Single : B 67 ASN : amide:sc= -2.09 K(o=-2.1,f=-3.1!) USER MOD Single : B 69 THR OG1 : rot -62:sc= 0.117 USER MOD Single : B 71 THR OG1 : rot 85:sc= -0.457 USER MOD Single : B 74 GLN : amide:sc= -0.768 X(o=-0.77,f=-0.5) USER MOD Single : B 77 MET CE :methyl -112:sc= -8.5! (180deg=-11.3!) USER MOD Single : B 87 GLN :FLIP amide:sc= -1.64 F(o=-6.4!,f=-1.6) USER MOD Single : B 88 GLN : amide:sc= -0.356 K(o=-0.36,f=-2.9!) USER MOD ----------------------------------------------------------------- ATOM 39 N ASN A 4 293.630 -11.866 -10.667 1.00 0.00 N ATOM 40 CA ASN A 4 293.247 -10.502 -10.312 1.00 0.00 C ATOM 41 C ASN A 4 291.838 -10.439 -9.725 1.00 0.00 C ATOM 42 O ASN A 4 291.330 -9.354 -9.450 1.00 0.00 O ATOM 43 CB ASN A 4 293.340 -9.585 -11.525 1.00 0.00 C ATOM 44 CG ASN A 4 293.703 -8.149 -11.169 1.00 0.00 C ATOM 45 OD1 ASN A 4 294.590 -7.557 -11.783 1.00 0.00 O ATOM 46 ND2 ASN A 4 293.014 -7.574 -10.184 1.00 0.00 N ATOM 0 HA ASN A 4 293.946 -10.163 -9.548 1.00 0.00 H new ATOM 0 HB2 ASN A 4 294.086 -9.981 -12.214 1.00 0.00 H new ATOM 0 HB3 ASN A 4 292.385 -9.591 -12.051 1.00 0.00 H new ATOM 0 HD21 ASN A 4 293.215 -6.611 -9.916 1.00 0.00 H new ATOM 0 HD22 ASN A 4 292.286 -8.097 -9.698 1.00 0.00 H new ATOM 53 N ASP A 5 291.227 -11.593 -9.469 1.00 0.00 N ATOM 54 CA ASP A 5 289.917 -11.611 -8.845 1.00 0.00 C ATOM 55 C ASP A 5 290.147 -11.480 -7.352 1.00 0.00 C ATOM 56 O ASP A 5 291.237 -11.077 -6.949 1.00 0.00 O ATOM 57 CB ASP A 5 289.162 -12.901 -9.177 1.00 0.00 C ATOM 58 CG ASP A 5 289.811 -14.133 -8.577 1.00 0.00 C ATOM 59 OD1 ASP A 5 290.746 -14.675 -9.201 1.00 0.00 O ATOM 60 OD2 ASP A 5 289.381 -14.555 -7.483 1.00 0.00 O ATOM 0 H ASP A 5 291.615 -12.512 -9.682 1.00 0.00 H new ATOM 0 HA ASP A 5 289.300 -10.793 -9.217 1.00 0.00 H new ATOM 0 HB2 ASP A 5 288.138 -12.821 -8.812 1.00 0.00 H new ATOM 0 HB3 ASP A 5 289.107 -13.016 -10.260 1.00 0.00 H new ATOM 65 N HIS A 6 289.182 -11.830 -6.517 1.00 0.00 N ATOM 66 CA HIS A 6 289.417 -11.729 -5.102 1.00 0.00 C ATOM 67 C HIS A 6 290.031 -12.990 -4.549 1.00 0.00 C ATOM 68 O HIS A 6 289.960 -14.070 -5.136 1.00 0.00 O ATOM 69 CB HIS A 6 288.158 -11.488 -4.295 1.00 0.00 C ATOM 70 CG HIS A 6 287.405 -10.252 -4.590 1.00 0.00 C ATOM 71 ND1 HIS A 6 286.929 -9.902 -5.833 1.00 0.00 N ATOM 72 CD2 HIS A 6 287.010 -9.294 -3.741 1.00 0.00 C ATOM 73 CE1 HIS A 6 286.261 -8.766 -5.734 1.00 0.00 C ATOM 74 NE2 HIS A 6 286.294 -8.374 -4.470 1.00 0.00 N ATOM 0 H HIS A 6 288.261 -12.174 -6.789 1.00 0.00 H new ATOM 0 HA HIS A 6 290.088 -10.875 -5.006 1.00 0.00 H new ATOM 0 HB2 HIS A 6 287.491 -12.337 -4.445 1.00 0.00 H new ATOM 0 HB3 HIS A 6 288.428 -11.478 -3.239 1.00 0.00 H new ATOM 0 HD2 HIS A 6 287.216 -9.252 -2.682 1.00 0.00 H new ATOM 0 HE1 HIS A 6 285.772 -8.247 -6.545 1.00 0.00 H new ATOM 0 HE2 HIS A 6 285.860 -7.529 -4.098 1.00 0.00 H new ATOM 83 N ILE A 7 290.563 -12.825 -3.366 1.00 0.00 N ATOM 84 CA ILE A 7 291.139 -13.896 -2.600 1.00 0.00 C ATOM 85 C ILE A 7 291.079 -13.469 -1.160 1.00 0.00 C ATOM 86 O ILE A 7 291.361 -12.314 -0.841 1.00 0.00 O ATOM 87 CB ILE A 7 292.581 -14.263 -3.018 1.00 0.00 C ATOM 88 CG1 ILE A 7 293.630 -13.439 -2.281 1.00 0.00 C ATOM 89 CG2 ILE A 7 292.760 -14.106 -4.511 1.00 0.00 C ATOM 90 CD1 ILE A 7 295.029 -13.900 -2.595 1.00 0.00 C ATOM 0 H ILE A 7 290.608 -11.920 -2.898 1.00 0.00 H new ATOM 0 HA ILE A 7 290.571 -14.809 -2.778 1.00 0.00 H new ATOM 0 HB ILE A 7 292.730 -15.307 -2.742 1.00 0.00 H new ATOM 0 HG12 ILE A 7 293.524 -12.389 -2.554 1.00 0.00 H new ATOM 0 HG13 ILE A 7 293.457 -13.508 -1.207 1.00 0.00 H new ATOM 0 HG21 ILE A 7 293.782 -14.369 -4.785 1.00 0.00 H new ATOM 0 HG22 ILE A 7 292.064 -14.763 -5.032 1.00 0.00 H new ATOM 0 HG23 ILE A 7 292.563 -13.072 -4.794 1.00 0.00 H new ATOM 0 HD11 ILE A 7 295.745 -13.286 -2.049 1.00 0.00 H new ATOM 0 HD12 ILE A 7 295.144 -14.942 -2.298 1.00 0.00 H new ATOM 0 HD13 ILE A 7 295.212 -13.806 -3.665 1.00 0.00 H new ATOM 102 N ASN A 8 290.681 -14.366 -0.298 1.00 0.00 N ATOM 103 CA ASN A 8 290.550 -14.021 1.099 1.00 0.00 C ATOM 104 C ASN A 8 291.894 -14.142 1.790 1.00 0.00 C ATOM 105 O ASN A 8 292.653 -15.074 1.529 1.00 0.00 O ATOM 106 CB ASN A 8 289.522 -14.931 1.774 1.00 0.00 C ATOM 107 CG ASN A 8 288.242 -14.200 2.127 1.00 0.00 C ATOM 108 OD1 ASN A 8 288.354 -13.204 2.996 1.00 0.00 O flip ATOM 109 ND2 ASN A 8 287.167 -14.526 1.624 1.00 0.00 N flip ATOM 0 H ASN A 8 290.444 -15.330 -0.530 1.00 0.00 H new ATOM 0 HA ASN A 8 290.205 -12.990 1.178 1.00 0.00 H new ATOM 0 HB2 ASN A 8 289.289 -15.765 1.112 1.00 0.00 H new ATOM 0 HB3 ASN A 8 289.956 -15.355 2.680 1.00 0.00 H new ATOM 0 HD21 ASN A 8 287.128 -15.299 0.960 1.00 0.00 H new ATOM 0 HD22 ASN A 8 286.315 -14.023 1.871 1.00 0.00 H new ATOM 116 N LEU A 9 292.190 -13.206 2.675 1.00 0.00 N ATOM 117 CA LEU A 9 293.438 -13.233 3.393 1.00 0.00 C ATOM 118 C LEU A 9 293.190 -13.257 4.872 1.00 0.00 C ATOM 119 O LEU A 9 292.391 -12.482 5.399 1.00 0.00 O ATOM 120 CB LEU A 9 294.297 -12.021 3.060 1.00 0.00 C ATOM 121 CG LEU A 9 295.438 -12.255 2.057 1.00 0.00 C ATOM 122 CD1 LEU A 9 295.342 -13.627 1.393 1.00 0.00 C ATOM 123 CD2 LEU A 9 295.421 -11.170 1.003 1.00 0.00 C ATOM 0 H LEU A 9 291.580 -12.422 2.908 1.00 0.00 H new ATOM 0 HA LEU A 9 293.967 -14.136 3.089 1.00 0.00 H new ATOM 0 HB2 LEU A 9 293.648 -11.239 2.665 1.00 0.00 H new ATOM 0 HB3 LEU A 9 294.727 -11.641 3.986 1.00 0.00 H new ATOM 0 HG LEU A 9 296.378 -12.222 2.608 1.00 0.00 H new ATOM 0 HD11 LEU A 9 296.167 -13.750 0.692 1.00 0.00 H new ATOM 0 HD12 LEU A 9 295.394 -14.405 2.155 1.00 0.00 H new ATOM 0 HD13 LEU A 9 294.396 -13.707 0.857 1.00 0.00 H new ATOM 0 HD21 LEU A 9 296.231 -11.339 0.294 1.00 0.00 H new ATOM 0 HD22 LEU A 9 294.467 -11.190 0.476 1.00 0.00 H new ATOM 0 HD23 LEU A 9 295.552 -10.198 1.479 1.00 0.00 H new ATOM 135 N LYS A 10 293.899 -14.127 5.541 1.00 0.00 N ATOM 136 CA LYS A 10 293.779 -14.225 6.970 1.00 0.00 C ATOM 137 C LYS A 10 294.860 -13.386 7.603 1.00 0.00 C ATOM 138 O LYS A 10 296.021 -13.770 7.574 1.00 0.00 O ATOM 139 CB LYS A 10 293.997 -15.670 7.379 1.00 0.00 C ATOM 140 CG LYS A 10 292.739 -16.502 7.438 1.00 0.00 C ATOM 141 CD LYS A 10 293.068 -17.971 7.307 1.00 0.00 C ATOM 142 CE LYS A 10 293.884 -18.464 8.496 1.00 0.00 C ATOM 143 NZ LYS A 10 293.019 -19.039 9.563 1.00 0.00 N ATOM 0 H LYS A 10 294.564 -14.776 5.120 1.00 0.00 H new ATOM 0 HA LYS A 10 292.794 -13.883 7.288 1.00 0.00 H new ATOM 0 HB2 LYS A 10 294.690 -16.132 6.676 1.00 0.00 H new ATOM 0 HB3 LYS A 10 294.476 -15.689 8.358 1.00 0.00 H new ATOM 0 HG2 LYS A 10 292.221 -16.322 8.380 1.00 0.00 H new ATOM 0 HG3 LYS A 10 292.061 -16.203 6.639 1.00 0.00 H new ATOM 0 HD2 LYS A 10 292.146 -18.547 7.232 1.00 0.00 H new ATOM 0 HD3 LYS A 10 293.625 -18.140 6.386 1.00 0.00 H new ATOM 0 HE2 LYS A 10 294.596 -19.218 8.160 1.00 0.00 H new ATOM 0 HE3 LYS A 10 294.465 -17.637 8.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 293.612 -19.363 10.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 292.356 -18.313 9.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 292.484 -19.844 9.180 1.00 0.00 H new ATOM 157 N VAL A 11 294.507 -12.275 8.211 1.00 0.00 N ATOM 158 CA VAL A 11 295.517 -11.466 8.849 1.00 0.00 C ATOM 159 C VAL A 11 295.607 -11.877 10.310 1.00 0.00 C ATOM 160 O VAL A 11 294.659 -11.715 11.060 1.00 0.00 O ATOM 161 CB VAL A 11 295.258 -9.953 8.678 1.00 0.00 C ATOM 162 CG1 VAL A 11 293.799 -9.605 8.882 1.00 0.00 C ATOM 163 CG2 VAL A 11 296.146 -9.154 9.601 1.00 0.00 C ATOM 0 H VAL A 11 293.553 -11.919 8.276 1.00 0.00 H new ATOM 0 HA VAL A 11 296.477 -11.642 8.364 1.00 0.00 H new ATOM 0 HB VAL A 11 295.507 -9.689 7.650 1.00 0.00 H new ATOM 0 HG11 VAL A 11 293.659 -8.532 8.753 1.00 0.00 H new ATOM 0 HG12 VAL A 11 293.192 -10.140 8.152 1.00 0.00 H new ATOM 0 HG13 VAL A 11 293.494 -9.892 9.888 1.00 0.00 H new ATOM 0 HG21 VAL A 11 295.949 -8.091 9.466 1.00 0.00 H new ATOM 0 HG22 VAL A 11 295.941 -9.432 10.635 1.00 0.00 H new ATOM 0 HG23 VAL A 11 297.191 -9.361 9.370 1.00 0.00 H new ATOM 173 N ALA A 12 296.773 -12.390 10.687 1.00 0.00 N ATOM 174 CA ALA A 12 297.028 -12.838 12.055 1.00 0.00 C ATOM 175 C ALA A 12 297.720 -11.735 12.839 1.00 0.00 C ATOM 176 O ALA A 12 298.599 -11.075 12.310 1.00 0.00 O ATOM 177 CB ALA A 12 297.833 -14.128 12.038 1.00 0.00 C ATOM 0 H ALA A 12 297.567 -12.508 10.057 1.00 0.00 H new ATOM 0 HA ALA A 12 296.084 -13.052 12.557 1.00 0.00 H new ATOM 0 HB1 ALA A 12 298.018 -14.455 13.061 1.00 0.00 H new ATOM 0 HB2 ALA A 12 297.274 -14.899 11.507 1.00 0.00 H new ATOM 0 HB3 ALA A 12 298.784 -13.957 11.534 1.00 0.00 H new ATOM 183 N GLY A 13 297.302 -11.510 14.086 1.00 0.00 N ATOM 184 CA GLY A 13 297.886 -10.430 14.867 1.00 0.00 C ATOM 185 C GLY A 13 298.829 -10.848 15.970 1.00 0.00 C ATOM 186 O GLY A 13 298.651 -10.431 17.113 1.00 0.00 O ATOM 0 H GLY A 13 296.579 -12.049 14.563 1.00 0.00 H new ATOM 0 HA2 GLY A 13 298.423 -9.766 14.189 1.00 0.00 H new ATOM 0 HA3 GLY A 13 297.077 -9.848 15.308 1.00 0.00 H new ATOM 226 N SER A 17 295.321 -13.826 16.773 1.00 0.00 N ATOM 227 CA SER A 17 294.058 -13.289 16.297 1.00 0.00 C ATOM 228 C SER A 17 294.192 -12.861 14.844 1.00 0.00 C ATOM 229 O SER A 17 294.771 -11.819 14.540 1.00 0.00 O ATOM 230 CB SER A 17 293.620 -12.103 17.159 1.00 0.00 C ATOM 231 OG SER A 17 292.328 -11.652 16.789 1.00 0.00 O ATOM 0 HA SER A 17 293.298 -14.067 16.370 1.00 0.00 H new ATOM 0 HB2 SER A 17 293.620 -12.394 18.210 1.00 0.00 H new ATOM 0 HB3 SER A 17 294.337 -11.289 17.054 1.00 0.00 H new ATOM 0 HG SER A 17 292.071 -10.895 17.356 1.00 0.00 H new ATOM 237 N VAL A 18 293.651 -13.676 13.954 1.00 0.00 N ATOM 238 CA VAL A 18 293.697 -13.401 12.524 1.00 0.00 C ATOM 239 C VAL A 18 292.322 -12.934 12.037 1.00 0.00 C ATOM 240 O VAL A 18 291.324 -13.096 12.740 1.00 0.00 O ATOM 241 CB VAL A 18 294.171 -14.647 11.723 1.00 0.00 C ATOM 242 CG1 VAL A 18 293.930 -15.936 12.493 1.00 0.00 C ATOM 243 CG2 VAL A 18 293.522 -14.710 10.353 1.00 0.00 C ATOM 0 H VAL A 18 293.170 -14.542 14.198 1.00 0.00 H new ATOM 0 HA VAL A 18 294.422 -12.606 12.352 1.00 0.00 H new ATOM 0 HB VAL A 18 295.246 -14.541 11.580 1.00 0.00 H new ATOM 0 HG11 VAL A 18 294.274 -16.784 11.900 1.00 0.00 H new ATOM 0 HG12 VAL A 18 294.478 -15.905 13.435 1.00 0.00 H new ATOM 0 HG13 VAL A 18 292.865 -16.044 12.697 1.00 0.00 H new ATOM 0 HG21 VAL A 18 293.877 -15.593 9.822 1.00 0.00 H new ATOM 0 HG22 VAL A 18 292.439 -14.765 10.466 1.00 0.00 H new ATOM 0 HG23 VAL A 18 293.783 -13.817 9.785 1.00 0.00 H new ATOM 253 N VAL A 19 292.268 -12.359 10.836 1.00 0.00 N ATOM 254 CA VAL A 19 291.011 -11.881 10.272 1.00 0.00 C ATOM 255 C VAL A 19 290.962 -12.187 8.789 1.00 0.00 C ATOM 256 O VAL A 19 291.981 -12.126 8.106 1.00 0.00 O ATOM 257 CB VAL A 19 290.823 -10.365 10.461 1.00 0.00 C ATOM 258 CG1 VAL A 19 289.475 -9.911 9.917 1.00 0.00 C ATOM 259 CG2 VAL A 19 290.969 -9.974 11.918 1.00 0.00 C ATOM 0 H VAL A 19 293.081 -12.214 10.237 1.00 0.00 H new ATOM 0 HA VAL A 19 290.210 -12.396 10.803 1.00 0.00 H new ATOM 0 HB VAL A 19 291.607 -9.861 9.895 1.00 0.00 H new ATOM 0 HG11 VAL A 19 289.367 -8.836 10.063 1.00 0.00 H new ATOM 0 HG12 VAL A 19 289.416 -10.141 8.853 1.00 0.00 H new ATOM 0 HG13 VAL A 19 288.676 -10.431 10.445 1.00 0.00 H new ATOM 0 HG21 VAL A 19 290.831 -8.898 12.021 1.00 0.00 H new ATOM 0 HG22 VAL A 19 290.218 -10.495 12.512 1.00 0.00 H new ATOM 0 HG23 VAL A 19 291.963 -10.248 12.270 1.00 0.00 H new ATOM 269 N GLN A 20 289.785 -12.508 8.286 1.00 0.00 N ATOM 270 CA GLN A 20 289.646 -12.812 6.876 1.00 0.00 C ATOM 271 C GLN A 20 289.326 -11.563 6.082 1.00 0.00 C ATOM 272 O GLN A 20 288.569 -10.700 6.529 1.00 0.00 O ATOM 273 CB GLN A 20 288.583 -13.886 6.657 1.00 0.00 C ATOM 274 CG GLN A 20 289.116 -15.297 6.833 1.00 0.00 C ATOM 275 CD GLN A 20 289.847 -15.798 5.603 1.00 0.00 C ATOM 276 OE1 GLN A 20 291.018 -15.231 5.340 1.00 0.00 O flip ATOM 277 NE2 GLN A 20 289.364 -16.684 4.897 1.00 0.00 N flip ATOM 0 H GLN A 20 288.921 -12.565 8.826 1.00 0.00 H new ATOM 0 HA GLN A 20 290.599 -13.201 6.518 1.00 0.00 H new ATOM 0 HB2 GLN A 20 287.762 -13.724 7.356 1.00 0.00 H new ATOM 0 HB3 GLN A 20 288.172 -13.782 5.653 1.00 0.00 H new ATOM 0 HG2 GLN A 20 289.791 -15.323 7.689 1.00 0.00 H new ATOM 0 HG3 GLN A 20 288.288 -15.969 7.059 1.00 0.00 H new ATOM 0 HE21 GLN A 20 288.460 -17.092 5.137 1.00 0.00 H new ATOM 0 HE22 GLN A 20 289.868 -17.010 4.072 1.00 0.00 H new ATOM 286 N PHE A 21 289.914 -11.470 4.899 1.00 0.00 N ATOM 287 CA PHE A 21 289.702 -10.321 4.036 1.00 0.00 C ATOM 288 C PHE A 21 289.886 -10.675 2.583 1.00 0.00 C ATOM 289 O PHE A 21 290.987 -11.041 2.172 1.00 0.00 O ATOM 290 CB PHE A 21 290.706 -9.228 4.360 1.00 0.00 C ATOM 291 CG PHE A 21 290.462 -8.556 5.668 1.00 0.00 C ATOM 292 CD1 PHE A 21 289.398 -7.687 5.826 1.00 0.00 C ATOM 293 CD2 PHE A 21 291.307 -8.783 6.736 1.00 0.00 C ATOM 294 CE1 PHE A 21 289.179 -7.059 7.032 1.00 0.00 C ATOM 295 CE2 PHE A 21 291.097 -8.152 7.944 1.00 0.00 C ATOM 296 CZ PHE A 21 290.031 -7.290 8.091 1.00 0.00 C ATOM 0 H PHE A 21 290.541 -12.177 4.516 1.00 0.00 H new ATOM 0 HA PHE A 21 288.680 -9.984 4.209 1.00 0.00 H new ATOM 0 HB2 PHE A 21 291.708 -9.657 4.364 1.00 0.00 H new ATOM 0 HB3 PHE A 21 290.683 -8.480 3.568 1.00 0.00 H new ATOM 0 HD1 PHE A 21 288.733 -7.499 4.996 1.00 0.00 H new ATOM 0 HD2 PHE A 21 292.140 -9.461 6.624 1.00 0.00 H new ATOM 0 HE1 PHE A 21 288.342 -6.387 7.148 1.00 0.00 H new ATOM 0 HE2 PHE A 21 291.766 -8.333 8.773 1.00 0.00 H new ATOM 0 HZ PHE A 21 289.863 -6.795 9.036 1.00 0.00 H new ATOM 306 N LYS A 22 288.851 -10.506 1.777 1.00 0.00 N ATOM 307 CA LYS A 22 289.026 -10.763 0.368 1.00 0.00 C ATOM 308 C LYS A 22 289.537 -9.516 -0.285 1.00 0.00 C ATOM 309 O LYS A 22 289.038 -8.414 -0.050 1.00 0.00 O ATOM 310 CB LYS A 22 287.786 -11.264 -0.358 1.00 0.00 C ATOM 311 CG LYS A 22 288.083 -12.515 -1.144 1.00 0.00 C ATOM 312 CD LYS A 22 286.926 -12.899 -2.017 1.00 0.00 C ATOM 313 CE LYS A 22 285.853 -13.626 -1.232 1.00 0.00 C ATOM 314 NZ LYS A 22 285.068 -14.556 -2.090 1.00 0.00 N ATOM 0 H LYS A 22 287.919 -10.204 2.063 1.00 0.00 H new ATOM 0 HA LYS A 22 289.741 -11.582 0.292 1.00 0.00 H new ATOM 0 HB2 LYS A 22 286.995 -11.464 0.364 1.00 0.00 H new ATOM 0 HB3 LYS A 22 287.416 -10.489 -1.029 1.00 0.00 H new ATOM 0 HG2 LYS A 22 288.969 -12.358 -1.759 1.00 0.00 H new ATOM 0 HG3 LYS A 22 288.311 -13.332 -0.459 1.00 0.00 H new ATOM 0 HD2 LYS A 22 286.501 -12.005 -2.473 1.00 0.00 H new ATOM 0 HD3 LYS A 22 287.278 -13.535 -2.829 1.00 0.00 H new ATOM 0 HE2 LYS A 22 286.315 -14.186 -0.419 1.00 0.00 H new ATOM 0 HE3 LYS A 22 285.181 -12.898 -0.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 284.345 -15.033 -1.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 284.606 -14.019 -2.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 285.704 -15.266 -2.505 1.00 0.00 H new ATOM 328 N ILE A 23 290.551 -9.696 -1.085 1.00 0.00 N ATOM 329 CA ILE A 23 291.169 -8.595 -1.763 1.00 0.00 C ATOM 330 C ILE A 23 291.664 -9.048 -3.122 1.00 0.00 C ATOM 331 O ILE A 23 292.304 -10.092 -3.254 1.00 0.00 O ATOM 332 CB ILE A 23 292.315 -8.018 -0.902 1.00 0.00 C ATOM 333 CG1 ILE A 23 293.116 -6.963 -1.671 1.00 0.00 C ATOM 334 CG2 ILE A 23 293.208 -9.143 -0.400 1.00 0.00 C ATOM 335 CD1 ILE A 23 294.376 -6.515 -0.959 1.00 0.00 C ATOM 0 H ILE A 23 290.969 -10.605 -1.283 1.00 0.00 H new ATOM 0 HA ILE A 23 290.439 -7.800 -1.916 1.00 0.00 H new ATOM 0 HB ILE A 23 291.879 -7.516 -0.038 1.00 0.00 H new ATOM 0 HG12 ILE A 23 293.385 -7.365 -2.648 1.00 0.00 H new ATOM 0 HG13 ILE A 23 292.481 -6.095 -1.847 1.00 0.00 H new ATOM 0 HG21 ILE A 23 294.013 -8.726 0.206 1.00 0.00 H new ATOM 0 HG22 ILE A 23 292.619 -9.833 0.204 1.00 0.00 H new ATOM 0 HG23 ILE A 23 293.633 -9.677 -1.250 1.00 0.00 H new ATOM 0 HD11 ILE A 23 294.890 -5.768 -1.564 1.00 0.00 H new ATOM 0 HD12 ILE A 23 294.114 -6.082 0.007 1.00 0.00 H new ATOM 0 HD13 ILE A 23 295.032 -7.372 -0.807 1.00 0.00 H new ATOM 347 N LYS A 24 291.365 -8.246 -4.125 1.00 0.00 N ATOM 348 CA LYS A 24 291.790 -8.566 -5.472 1.00 0.00 C ATOM 349 C LYS A 24 293.305 -8.690 -5.467 1.00 0.00 C ATOM 350 O LYS A 24 293.988 -7.902 -4.812 1.00 0.00 O ATOM 351 CB LYS A 24 291.323 -7.525 -6.472 1.00 0.00 C ATOM 352 CG LYS A 24 289.890 -7.714 -6.876 1.00 0.00 C ATOM 353 CD LYS A 24 289.648 -7.210 -8.278 1.00 0.00 C ATOM 354 CE LYS A 24 288.495 -7.954 -8.894 1.00 0.00 C ATOM 355 NZ LYS A 24 287.386 -7.045 -9.294 1.00 0.00 N ATOM 0 H LYS A 24 290.836 -7.379 -4.035 1.00 0.00 H new ATOM 0 HA LYS A 24 291.339 -9.508 -5.785 1.00 0.00 H new ATOM 0 HB2 LYS A 24 291.447 -6.531 -6.041 1.00 0.00 H new ATOM 0 HB3 LYS A 24 291.955 -7.569 -7.359 1.00 0.00 H new ATOM 0 HG2 LYS A 24 289.629 -8.771 -6.816 1.00 0.00 H new ATOM 0 HG3 LYS A 24 289.240 -7.185 -6.179 1.00 0.00 H new ATOM 0 HD2 LYS A 24 289.434 -6.141 -8.258 1.00 0.00 H new ATOM 0 HD3 LYS A 24 290.545 -7.345 -8.883 1.00 0.00 H new ATOM 0 HE2 LYS A 24 288.845 -8.503 -9.768 1.00 0.00 H new ATOM 0 HE3 LYS A 24 288.120 -8.691 -8.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 286.614 -7.602 -9.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 287.033 -6.539 -8.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 287.735 -6.357 -9.992 1.00 0.00 H new ATOM 369 N ARG A 25 293.836 -9.696 -6.140 1.00 0.00 N ATOM 370 CA ARG A 25 295.273 -9.924 -6.137 1.00 0.00 C ATOM 371 C ARG A 25 296.072 -8.686 -6.515 1.00 0.00 C ATOM 372 O ARG A 25 297.095 -8.399 -5.896 1.00 0.00 O ATOM 373 CB ARG A 25 295.625 -11.081 -7.060 1.00 0.00 C ATOM 374 CG ARG A 25 295.316 -12.440 -6.455 1.00 0.00 C ATOM 375 CD ARG A 25 295.950 -13.566 -7.255 1.00 0.00 C ATOM 376 NE ARG A 25 297.139 -14.100 -6.597 1.00 0.00 N ATOM 377 CZ ARG A 25 297.905 -15.059 -7.112 1.00 0.00 C ATOM 378 NH1 ARG A 25 297.610 -15.589 -8.292 1.00 0.00 N ATOM 379 NH2 ARG A 25 298.968 -15.488 -6.446 1.00 0.00 N ATOM 0 H ARG A 25 293.299 -10.365 -6.692 1.00 0.00 H new ATOM 0 HA ARG A 25 295.549 -10.175 -5.113 1.00 0.00 H new ATOM 0 HB2 ARG A 25 295.075 -10.973 -7.995 1.00 0.00 H new ATOM 0 HB3 ARG A 25 296.686 -11.032 -7.306 1.00 0.00 H new ATOM 0 HG2 ARG A 25 295.680 -12.473 -5.428 1.00 0.00 H new ATOM 0 HG3 ARG A 25 294.236 -12.584 -6.415 1.00 0.00 H new ATOM 0 HD2 ARG A 25 295.223 -14.366 -7.395 1.00 0.00 H new ATOM 0 HD3 ARG A 25 296.217 -13.201 -8.247 1.00 0.00 H new ATOM 0 HE ARG A 25 297.398 -13.715 -5.689 1.00 0.00 H new ATOM 0 HH11 ARG A 25 296.793 -15.262 -8.808 1.00 0.00 H new ATOM 0 HH12 ARG A 25 298.200 -16.324 -8.683 1.00 0.00 H new ATOM 0 HH21 ARG A 25 299.199 -15.083 -5.539 1.00 0.00 H new ATOM 0 HH22 ARG A 25 299.555 -16.223 -6.841 1.00 0.00 H new ATOM 393 N HIS A 26 295.625 -7.954 -7.524 1.00 0.00 N ATOM 394 CA HIS A 26 296.346 -6.761 -7.941 1.00 0.00 C ATOM 395 C HIS A 26 295.918 -5.539 -7.140 1.00 0.00 C ATOM 396 O HIS A 26 295.979 -4.412 -7.632 1.00 0.00 O ATOM 397 CB HIS A 26 296.165 -6.498 -9.430 1.00 0.00 C ATOM 398 CG HIS A 26 296.829 -7.521 -10.300 1.00 0.00 C ATOM 399 ND1 HIS A 26 296.704 -8.869 -10.337 1.00 0.00 N flip ATOM 400 CD2 HIS A 26 297.749 -7.197 -11.276 1.00 0.00 C flip ATOM 401 CE1 HIS A 26 297.541 -9.328 -11.324 1.00 0.00 C flip ATOM 402 NE2 HIS A 26 298.159 -8.300 -11.876 1.00 0.00 N flip ATOM 0 H HIS A 26 294.782 -8.159 -8.061 1.00 0.00 H new ATOM 0 HA HIS A 26 297.403 -6.944 -7.746 1.00 0.00 H new ATOM 0 HB2 HIS A 26 295.100 -6.473 -9.660 1.00 0.00 H new ATOM 0 HB3 HIS A 26 296.566 -5.513 -9.669 1.00 0.00 H new ATOM 0 HD2 HIS A 26 298.082 -6.197 -11.513 1.00 0.00 H new ATOM 0 HE1 HIS A 26 297.673 -10.363 -11.604 1.00 0.00 H new ATOM 0 HE2 HIS A 26 298.837 -8.349 -12.636 1.00 0.00 H new ATOM 411 N THR A 27 295.517 -5.759 -5.893 1.00 0.00 N ATOM 412 CA THR A 27 295.125 -4.666 -5.022 1.00 0.00 C ATOM 413 C THR A 27 296.153 -4.506 -3.924 1.00 0.00 C ATOM 414 O THR A 27 296.687 -5.490 -3.418 1.00 0.00 O ATOM 415 CB THR A 27 293.755 -4.902 -4.392 1.00 0.00 C ATOM 416 OG1 THR A 27 292.749 -4.926 -5.383 1.00 0.00 O ATOM 417 CG2 THR A 27 293.388 -3.839 -3.368 1.00 0.00 C ATOM 0 H THR A 27 295.456 -6.684 -5.467 1.00 0.00 H new ATOM 0 HA THR A 27 295.066 -3.762 -5.629 1.00 0.00 H new ATOM 0 HB THR A 27 293.819 -5.864 -3.884 1.00 0.00 H new ATOM 0 HG1 THR A 27 291.877 -4.759 -4.968 1.00 0.00 H new ATOM 0 HG21 THR A 27 292.404 -4.058 -2.953 1.00 0.00 H new ATOM 0 HG22 THR A 27 294.127 -3.835 -2.567 1.00 0.00 H new ATOM 0 HG23 THR A 27 293.369 -2.861 -3.849 1.00 0.00 H new ATOM 425 N PRO A 28 296.435 -3.272 -3.517 1.00 0.00 N ATOM 426 CA PRO A 28 297.395 -3.023 -2.463 1.00 0.00 C ATOM 427 C PRO A 28 296.855 -3.457 -1.116 1.00 0.00 C ATOM 428 O PRO A 28 295.809 -2.989 -0.665 1.00 0.00 O ATOM 429 CB PRO A 28 297.621 -1.508 -2.503 1.00 0.00 C ATOM 430 CG PRO A 28 296.879 -1.007 -3.701 1.00 0.00 C ATOM 431 CD PRO A 28 295.839 -2.034 -4.026 1.00 0.00 C ATOM 0 HA PRO A 28 298.318 -3.584 -2.606 1.00 0.00 H new ATOM 0 HB2 PRO A 28 297.254 -1.035 -1.592 1.00 0.00 H new ATOM 0 HB3 PRO A 28 298.683 -1.275 -2.577 1.00 0.00 H new ATOM 0 HG2 PRO A 28 296.417 -0.041 -3.494 1.00 0.00 H new ATOM 0 HG3 PRO A 28 297.556 -0.863 -4.543 1.00 0.00 H new ATOM 0 HD2 PRO A 28 294.888 -1.814 -3.541 1.00 0.00 H new ATOM 0 HD3 PRO A 28 295.646 -2.089 -5.097 1.00 0.00 H new ATOM 439 N LEU A 29 297.583 -4.359 -0.482 1.00 0.00 N ATOM 440 CA LEU A 29 297.207 -4.883 0.818 1.00 0.00 C ATOM 441 C LEU A 29 296.935 -3.762 1.815 1.00 0.00 C ATOM 442 O LEU A 29 296.297 -3.987 2.843 1.00 0.00 O ATOM 443 CB LEU A 29 298.302 -5.810 1.326 1.00 0.00 C ATOM 444 CG LEU A 29 298.409 -7.104 0.530 1.00 0.00 C ATOM 445 CD1 LEU A 29 299.748 -7.776 0.753 1.00 0.00 C ATOM 446 CD2 LEU A 29 297.263 -8.036 0.876 1.00 0.00 C ATOM 0 H LEU A 29 298.450 -4.748 -0.853 1.00 0.00 H new ATOM 0 HA LEU A 29 296.280 -5.447 0.712 1.00 0.00 H new ATOM 0 HB2 LEU A 29 299.258 -5.288 1.288 1.00 0.00 H new ATOM 0 HB3 LEU A 29 298.110 -6.049 2.372 1.00 0.00 H new ATOM 0 HG LEU A 29 298.340 -6.858 -0.530 1.00 0.00 H new ATOM 0 HD11 LEU A 29 299.794 -8.697 0.172 1.00 0.00 H new ATOM 0 HD12 LEU A 29 300.548 -7.107 0.437 1.00 0.00 H new ATOM 0 HD13 LEU A 29 299.867 -8.009 1.811 1.00 0.00 H new ATOM 0 HD21 LEU A 29 297.355 -8.956 0.298 1.00 0.00 H new ATOM 0 HD22 LEU A 29 297.294 -8.271 1.940 1.00 0.00 H new ATOM 0 HD23 LEU A 29 296.316 -7.552 0.639 1.00 0.00 H new ATOM 458 N SER A 30 297.392 -2.544 1.503 1.00 0.00 N ATOM 459 CA SER A 30 297.161 -1.399 2.373 1.00 0.00 C ATOM 460 C SER A 30 295.688 -1.308 2.762 1.00 0.00 C ATOM 461 O SER A 30 295.346 -0.717 3.782 1.00 0.00 O ATOM 462 CB SER A 30 297.590 -0.101 1.677 1.00 0.00 C ATOM 463 OG SER A 30 296.888 0.081 0.460 1.00 0.00 O ATOM 0 H SER A 30 297.921 -2.332 0.657 1.00 0.00 H new ATOM 0 HA SER A 30 297.758 -1.534 3.275 1.00 0.00 H new ATOM 0 HB2 SER A 30 297.406 0.747 2.337 1.00 0.00 H new ATOM 0 HB3 SER A 30 298.662 -0.127 1.482 1.00 0.00 H new ATOM 0 HG SER A 30 297.178 0.916 0.037 1.00 0.00 H new ATOM 469 N LYS A 31 294.815 -1.904 1.947 1.00 0.00 N ATOM 470 CA LYS A 31 293.389 -1.887 2.225 1.00 0.00 C ATOM 471 C LYS A 31 293.023 -2.988 3.212 1.00 0.00 C ATOM 472 O LYS A 31 292.415 -2.729 4.250 1.00 0.00 O ATOM 473 CB LYS A 31 292.605 -2.051 0.934 1.00 0.00 C ATOM 474 CG LYS A 31 291.297 -1.285 0.922 1.00 0.00 C ATOM 475 CD LYS A 31 290.950 -0.814 -0.480 1.00 0.00 C ATOM 476 CE LYS A 31 291.727 0.435 -0.859 1.00 0.00 C ATOM 477 NZ LYS A 31 290.934 1.338 -1.739 1.00 0.00 N ATOM 0 H LYS A 31 295.075 -2.400 1.095 1.00 0.00 H new ATOM 0 HA LYS A 31 293.132 -0.927 2.673 1.00 0.00 H new ATOM 0 HB2 LYS A 31 293.221 -1.717 0.099 1.00 0.00 H new ATOM 0 HB3 LYS A 31 292.399 -3.109 0.775 1.00 0.00 H new ATOM 0 HG2 LYS A 31 290.497 -1.920 1.304 1.00 0.00 H new ATOM 0 HG3 LYS A 31 291.369 -0.426 1.590 1.00 0.00 H new ATOM 0 HD2 LYS A 31 291.166 -1.608 -1.195 1.00 0.00 H new ATOM 0 HD3 LYS A 31 289.881 -0.611 -0.542 1.00 0.00 H new ATOM 0 HE2 LYS A 31 292.016 0.971 0.045 1.00 0.00 H new ATOM 0 HE3 LYS A 31 292.648 0.149 -1.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 291.500 2.178 -1.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 290.680 0.835 -2.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 290.068 1.632 -1.244 1.00 0.00 H new ATOM 491 N LEU A 32 293.414 -4.218 2.888 1.00 0.00 N ATOM 492 CA LEU A 32 293.153 -5.372 3.743 1.00 0.00 C ATOM 493 C LEU A 32 293.557 -5.071 5.180 1.00 0.00 C ATOM 494 O LEU A 32 292.834 -5.396 6.122 1.00 0.00 O ATOM 495 CB LEU A 32 293.940 -6.571 3.198 1.00 0.00 C ATOM 496 CG LEU A 32 294.054 -7.808 4.101 1.00 0.00 C ATOM 497 CD1 LEU A 32 294.118 -9.062 3.257 1.00 0.00 C ATOM 498 CD2 LEU A 32 295.282 -7.715 4.991 1.00 0.00 C ATOM 0 H LEU A 32 293.918 -4.442 2.030 1.00 0.00 H new ATOM 0 HA LEU A 32 292.088 -5.602 3.740 1.00 0.00 H new ATOM 0 HB2 LEU A 32 293.478 -6.879 2.260 1.00 0.00 H new ATOM 0 HB3 LEU A 32 294.949 -6.233 2.960 1.00 0.00 H new ATOM 0 HG LEU A 32 293.171 -7.851 4.738 1.00 0.00 H new ATOM 0 HD11 LEU A 32 294.199 -9.934 3.906 1.00 0.00 H new ATOM 0 HD12 LEU A 32 293.214 -9.141 2.654 1.00 0.00 H new ATOM 0 HD13 LEU A 32 294.988 -9.016 2.602 1.00 0.00 H new ATOM 0 HD21 LEU A 32 295.342 -8.602 5.622 1.00 0.00 H new ATOM 0 HD22 LEU A 32 296.176 -7.649 4.371 1.00 0.00 H new ATOM 0 HD23 LEU A 32 295.210 -6.827 5.619 1.00 0.00 H new ATOM 510 N MET A 33 294.718 -4.445 5.339 1.00 0.00 N ATOM 511 CA MET A 33 295.221 -4.096 6.643 1.00 0.00 C ATOM 512 C MET A 33 294.420 -2.948 7.235 1.00 0.00 C ATOM 513 O MET A 33 294.183 -2.903 8.442 1.00 0.00 O ATOM 514 CB MET A 33 296.698 -3.730 6.561 1.00 0.00 C ATOM 515 CG MET A 33 297.487 -4.486 5.494 1.00 0.00 C ATOM 516 SD MET A 33 298.568 -3.416 4.536 1.00 0.00 S ATOM 517 CE MET A 33 300.141 -3.779 5.296 1.00 0.00 C ATOM 0 H MET A 33 295.326 -4.171 4.567 1.00 0.00 H new ATOM 0 HA MET A 33 295.114 -4.961 7.297 1.00 0.00 H new ATOM 0 HB2 MET A 33 296.783 -2.661 6.366 1.00 0.00 H new ATOM 0 HB3 MET A 33 297.158 -3.914 7.532 1.00 0.00 H new ATOM 0 HG2 MET A 33 298.084 -5.263 5.972 1.00 0.00 H new ATOM 0 HG3 MET A 33 296.791 -4.987 4.821 1.00 0.00 H new ATOM 0 HE1 MET A 33 300.946 -3.427 4.651 1.00 0.00 H new ATOM 0 HE2 MET A 33 300.203 -3.277 6.261 1.00 0.00 H new ATOM 0 HE3 MET A 33 300.236 -4.855 5.440 1.00 0.00 H new ATOM 527 N LYS A 34 293.980 -2.030 6.379 1.00 0.00 N ATOM 528 CA LYS A 34 293.180 -0.905 6.839 1.00 0.00 C ATOM 529 C LYS A 34 291.911 -1.428 7.494 1.00 0.00 C ATOM 530 O LYS A 34 291.389 -0.834 8.437 1.00 0.00 O ATOM 531 CB LYS A 34 292.837 0.034 5.682 1.00 0.00 C ATOM 532 CG LYS A 34 293.941 1.024 5.363 1.00 0.00 C ATOM 533 CD LYS A 34 294.005 2.138 6.392 1.00 0.00 C ATOM 534 CE LYS A 34 294.554 3.422 5.792 1.00 0.00 C ATOM 535 NZ LYS A 34 295.396 4.174 6.763 1.00 0.00 N ATOM 0 H LYS A 34 294.162 -2.044 5.376 1.00 0.00 H new ATOM 0 HA LYS A 34 293.757 -0.335 7.567 1.00 0.00 H new ATOM 0 HB2 LYS A 34 292.623 -0.560 4.793 1.00 0.00 H new ATOM 0 HB3 LYS A 34 291.927 0.582 5.926 1.00 0.00 H new ATOM 0 HG2 LYS A 34 294.898 0.504 5.328 1.00 0.00 H new ATOM 0 HG3 LYS A 34 293.774 1.450 4.374 1.00 0.00 H new ATOM 0 HD2 LYS A 34 293.008 2.320 6.794 1.00 0.00 H new ATOM 0 HD3 LYS A 34 294.634 1.828 7.227 1.00 0.00 H new ATOM 0 HE2 LYS A 34 295.144 3.185 4.907 1.00 0.00 H new ATOM 0 HE3 LYS A 34 293.727 4.052 5.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 295.751 5.043 6.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 294.826 4.422 7.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 296.200 3.583 7.056 1.00 0.00 H new ATOM 549 N ALA A 35 291.449 -2.574 7.005 1.00 0.00 N ATOM 550 CA ALA A 35 290.275 -3.226 7.552 1.00 0.00 C ATOM 551 C ALA A 35 290.657 -3.898 8.857 1.00 0.00 C ATOM 552 O ALA A 35 289.917 -3.844 9.832 1.00 0.00 O ATOM 553 CB ALA A 35 289.723 -4.220 6.540 1.00 0.00 C ATOM 0 H ALA A 35 291.878 -3.070 6.224 1.00 0.00 H new ATOM 0 HA ALA A 35 289.489 -2.499 7.756 1.00 0.00 H new ATOM 0 HB1 ALA A 35 288.841 -4.709 6.954 1.00 0.00 H new ATOM 0 HB2 ALA A 35 289.451 -3.694 5.625 1.00 0.00 H new ATOM 0 HB3 ALA A 35 290.481 -4.970 6.316 1.00 0.00 H new ATOM 559 N TYR A 36 291.850 -4.483 8.881 1.00 0.00 N ATOM 560 CA TYR A 36 292.364 -5.111 10.089 1.00 0.00 C ATOM 561 C TYR A 36 292.494 -4.061 11.174 1.00 0.00 C ATOM 562 O TYR A 36 292.139 -4.293 12.328 1.00 0.00 O ATOM 563 CB TYR A 36 293.724 -5.728 9.829 1.00 0.00 C ATOM 564 CG TYR A 36 294.195 -6.581 10.972 1.00 0.00 C ATOM 565 CD1 TYR A 36 293.337 -7.499 11.565 1.00 0.00 C ATOM 566 CD2 TYR A 36 295.491 -6.467 11.466 1.00 0.00 C ATOM 567 CE1 TYR A 36 293.766 -8.282 12.619 1.00 0.00 C ATOM 568 CE2 TYR A 36 295.924 -7.240 12.510 1.00 0.00 C ATOM 569 CZ TYR A 36 295.062 -8.150 13.089 1.00 0.00 C ATOM 570 OH TYR A 36 295.491 -8.929 14.138 1.00 0.00 O ATOM 0 H TYR A 36 292.477 -4.534 8.078 1.00 0.00 H new ATOM 0 HA TYR A 36 291.675 -5.896 10.401 1.00 0.00 H new ATOM 0 HB2 TYR A 36 293.678 -6.333 8.923 1.00 0.00 H new ATOM 0 HB3 TYR A 36 294.450 -4.936 9.647 1.00 0.00 H new ATOM 0 HD1 TYR A 36 292.326 -7.601 11.199 1.00 0.00 H new ATOM 0 HD2 TYR A 36 296.168 -5.755 11.017 1.00 0.00 H new ATOM 0 HE1 TYR A 36 293.094 -8.994 13.075 1.00 0.00 H new ATOM 0 HE2 TYR A 36 296.934 -7.138 12.878 1.00 0.00 H new ATOM 0 HH TYR A 36 295.121 -9.832 14.047 1.00 0.00 H new ATOM 580 N CYS A 37 292.968 -2.880 10.784 1.00 0.00 N ATOM 581 CA CYS A 37 293.095 -1.777 11.719 1.00 0.00 C ATOM 582 C CYS A 37 291.728 -1.497 12.312 1.00 0.00 C ATOM 583 O CYS A 37 291.594 -1.121 13.477 1.00 0.00 O ATOM 584 CB CYS A 37 293.633 -0.538 11.009 1.00 0.00 C ATOM 585 SG CYS A 37 295.332 -0.131 11.451 1.00 0.00 S ATOM 0 H CYS A 37 293.267 -2.668 9.832 1.00 0.00 H new ATOM 0 HA CYS A 37 293.797 -2.038 12.511 1.00 0.00 H new ATOM 0 HB2 CYS A 37 293.574 -0.693 9.932 1.00 0.00 H new ATOM 0 HB3 CYS A 37 292.992 0.312 11.244 1.00 0.00 H new ATOM 0 HG CYS A 37 295.360 0.369 12.651 1.00 0.00 H new ATOM 673 N SER A 43 296.886 1.216 14.223 1.00 0.00 N ATOM 674 CA SER A 43 297.141 2.471 13.528 1.00 0.00 C ATOM 675 C SER A 43 297.543 2.217 12.077 1.00 0.00 C ATOM 676 O SER A 43 297.454 3.105 11.229 1.00 0.00 O ATOM 677 CB SER A 43 298.256 3.236 14.242 1.00 0.00 C ATOM 678 OG SER A 43 298.149 4.631 14.014 1.00 0.00 O ATOM 0 HA SER A 43 296.225 3.062 13.535 1.00 0.00 H new ATOM 0 HB2 SER A 43 298.210 3.035 15.312 1.00 0.00 H new ATOM 0 HB3 SER A 43 299.225 2.881 13.892 1.00 0.00 H new ATOM 0 HG SER A 43 298.873 5.096 14.483 1.00 0.00 H new ATOM 684 N MET A 44 298.007 0.999 11.813 1.00 0.00 N ATOM 685 CA MET A 44 298.457 0.596 10.480 1.00 0.00 C ATOM 686 C MET A 44 299.879 1.109 10.209 1.00 0.00 C ATOM 687 O MET A 44 300.522 0.703 9.242 1.00 0.00 O ATOM 688 CB MET A 44 297.505 1.084 9.400 1.00 0.00 C ATOM 689 CG MET A 44 297.173 0.003 8.394 1.00 0.00 C ATOM 690 SD MET A 44 296.986 0.652 6.728 1.00 0.00 S ATOM 691 CE MET A 44 297.825 -0.616 5.787 1.00 0.00 C ATOM 0 H MET A 44 298.082 0.263 12.515 1.00 0.00 H new ATOM 0 HA MET A 44 298.466 -0.494 10.452 1.00 0.00 H new ATOM 0 HB2 MET A 44 296.585 1.440 9.864 1.00 0.00 H new ATOM 0 HB3 MET A 44 297.951 1.934 8.883 1.00 0.00 H new ATOM 0 HG2 MET A 44 297.960 -0.751 8.401 1.00 0.00 H new ATOM 0 HG3 MET A 44 296.251 -0.496 8.692 1.00 0.00 H new ATOM 0 HE1 MET A 44 298.455 -0.150 5.029 1.00 0.00 H new ATOM 0 HE2 MET A 44 298.444 -1.215 6.455 1.00 0.00 H new ATOM 0 HE3 MET A 44 297.088 -1.257 5.303 1.00 0.00 H new ATOM 701 N ARG A 45 300.369 1.981 11.095 1.00 0.00 N ATOM 702 CA ARG A 45 301.718 2.530 10.992 1.00 0.00 C ATOM 703 C ARG A 45 302.583 1.896 12.072 1.00 0.00 C ATOM 704 O ARG A 45 303.720 1.490 11.831 1.00 0.00 O ATOM 705 CB ARG A 45 301.693 4.048 11.149 1.00 0.00 C ATOM 706 CG ARG A 45 302.641 4.773 10.211 1.00 0.00 C ATOM 707 CD ARG A 45 303.931 5.150 10.915 1.00 0.00 C ATOM 708 NE ARG A 45 304.609 6.265 10.257 1.00 0.00 N ATOM 709 CZ ARG A 45 304.238 7.537 10.383 1.00 0.00 C ATOM 710 NH1 ARG A 45 303.196 7.860 11.139 1.00 0.00 N ATOM 711 NH2 ARG A 45 304.910 8.488 9.750 1.00 0.00 N ATOM 0 H ARG A 45 299.842 2.323 11.899 1.00 0.00 H new ATOM 0 HA ARG A 45 302.132 2.305 10.009 1.00 0.00 H new ATOM 0 HB2 ARG A 45 300.678 4.406 10.974 1.00 0.00 H new ATOM 0 HB3 ARG A 45 301.948 4.303 12.178 1.00 0.00 H new ATOM 0 HG2 ARG A 45 302.864 4.138 9.354 1.00 0.00 H new ATOM 0 HG3 ARG A 45 302.159 5.671 9.825 1.00 0.00 H new ATOM 0 HD2 ARG A 45 303.715 5.417 11.949 1.00 0.00 H new ATOM 0 HD3 ARG A 45 304.595 4.286 10.941 1.00 0.00 H new ATOM 0 HE ARG A 45 305.414 6.056 9.666 1.00 0.00 H new ATOM 0 HH11 ARG A 45 302.675 7.132 11.627 1.00 0.00 H new ATOM 0 HH12 ARG A 45 302.916 8.837 11.232 1.00 0.00 H new ATOM 0 HH21 ARG A 45 305.711 8.245 9.167 1.00 0.00 H new ATOM 0 HH22 ARG A 45 304.626 9.463 9.846 1.00 0.00 H new ATOM 725 N GLN A 46 301.990 1.773 13.256 1.00 0.00 N ATOM 726 CA GLN A 46 302.632 1.137 14.400 1.00 0.00 C ATOM 727 C GLN A 46 302.532 -0.377 14.254 1.00 0.00 C ATOM 728 O GLN A 46 303.051 -1.146 15.062 1.00 0.00 O ATOM 729 CB GLN A 46 301.920 1.573 15.672 1.00 0.00 C ATOM 730 CG GLN A 46 302.685 1.244 16.942 1.00 0.00 C ATOM 731 CD GLN A 46 302.345 -0.128 17.488 1.00 0.00 C ATOM 732 OE1 GLN A 46 303.230 -0.940 17.754 1.00 0.00 O ATOM 733 NE2 GLN A 46 301.056 -0.393 17.659 1.00 0.00 N ATOM 0 H GLN A 46 301.048 2.113 13.449 1.00 0.00 H new ATOM 0 HA GLN A 46 303.681 1.428 14.448 1.00 0.00 H new ATOM 0 HB2 GLN A 46 301.747 2.648 15.631 1.00 0.00 H new ATOM 0 HB3 GLN A 46 300.942 1.094 15.713 1.00 0.00 H new ATOM 0 HG2 GLN A 46 303.755 1.296 16.741 1.00 0.00 H new ATOM 0 HG3 GLN A 46 302.466 1.997 17.699 1.00 0.00 H new ATOM 0 HE21 GLN A 46 300.355 0.310 17.425 1.00 0.00 H new ATOM 0 HE22 GLN A 46 300.766 -1.300 18.024 1.00 0.00 H new ATOM 742 N ILE A 47 301.829 -0.767 13.206 1.00 0.00 N ATOM 743 CA ILE A 47 301.574 -2.154 12.866 1.00 0.00 C ATOM 744 C ILE A 47 302.095 -2.450 11.471 1.00 0.00 C ATOM 745 O ILE A 47 301.833 -1.709 10.524 1.00 0.00 O ATOM 746 CB ILE A 47 300.062 -2.388 12.916 1.00 0.00 C ATOM 747 CG1 ILE A 47 299.625 -3.824 12.701 1.00 0.00 C ATOM 748 CG2 ILE A 47 299.388 -1.517 11.911 1.00 0.00 C ATOM 749 CD1 ILE A 47 300.128 -4.518 11.502 1.00 0.00 C ATOM 0 H ILE A 47 301.408 -0.109 12.550 1.00 0.00 H new ATOM 0 HA ILE A 47 302.081 -2.812 13.571 1.00 0.00 H new ATOM 0 HB ILE A 47 299.765 -2.136 13.934 1.00 0.00 H new ATOM 0 HG12 ILE A 47 299.927 -4.401 13.575 1.00 0.00 H new ATOM 0 HG13 ILE A 47 298.536 -3.842 12.668 1.00 0.00 H new ATOM 0 HG21 ILE A 47 298.312 -1.685 11.948 1.00 0.00 H new ATOM 0 HG22 ILE A 47 299.600 -0.472 12.135 1.00 0.00 H new ATOM 0 HG23 ILE A 47 299.759 -1.757 10.915 1.00 0.00 H new ATOM 0 HD11 ILE A 47 299.735 -5.534 11.478 1.00 0.00 H new ATOM 0 HD12 ILE A 47 299.804 -3.983 10.609 1.00 0.00 H new ATOM 0 HD13 ILE A 47 301.217 -4.551 11.531 1.00 0.00 H new ATOM 761 N ARG A 48 302.802 -3.548 11.350 1.00 0.00 N ATOM 762 CA ARG A 48 303.339 -3.985 10.079 1.00 0.00 C ATOM 763 C ARG A 48 302.823 -5.379 9.811 1.00 0.00 C ATOM 764 O ARG A 48 303.021 -6.288 10.615 1.00 0.00 O ATOM 765 CB ARG A 48 304.860 -3.967 10.108 1.00 0.00 C ATOM 766 CG ARG A 48 305.444 -2.600 9.831 1.00 0.00 C ATOM 767 CD ARG A 48 305.249 -2.231 8.374 1.00 0.00 C ATOM 768 NE ARG A 48 305.109 -0.788 8.180 1.00 0.00 N ATOM 769 CZ ARG A 48 303.944 -0.159 8.027 1.00 0.00 C ATOM 770 NH1 ARG A 48 302.802 -0.835 8.035 1.00 0.00 N ATOM 771 NH2 ARG A 48 303.922 1.157 7.862 1.00 0.00 N ATOM 0 H ARG A 48 303.023 -4.166 12.130 1.00 0.00 H new ATOM 0 HA ARG A 48 303.022 -3.311 9.283 1.00 0.00 H new ATOM 0 HB2 ARG A 48 305.203 -4.311 11.084 1.00 0.00 H new ATOM 0 HB3 ARG A 48 305.240 -4.674 9.370 1.00 0.00 H new ATOM 0 HG2 ARG A 48 304.966 -1.857 10.469 1.00 0.00 H new ATOM 0 HG3 ARG A 48 306.506 -2.594 10.076 1.00 0.00 H new ATOM 0 HD2 ARG A 48 306.098 -2.593 7.793 1.00 0.00 H new ATOM 0 HD3 ARG A 48 304.362 -2.735 7.990 1.00 0.00 H new ATOM 0 HE ARG A 48 305.960 -0.226 8.161 1.00 0.00 H new ATOM 0 HH11 ARG A 48 302.809 -1.847 8.159 1.00 0.00 H new ATOM 0 HH12 ARG A 48 301.917 -0.342 7.917 1.00 0.00 H new ATOM 0 HH21 ARG A 48 304.795 1.684 7.852 1.00 0.00 H new ATOM 0 HH22 ARG A 48 303.032 1.641 7.745 1.00 0.00 H new ATOM 785 N PHE A 49 302.137 -5.550 8.701 1.00 0.00 N ATOM 786 CA PHE A 49 301.574 -6.841 8.388 1.00 0.00 C ATOM 787 C PHE A 49 302.564 -7.707 7.664 1.00 0.00 C ATOM 788 O PHE A 49 303.252 -7.255 6.766 1.00 0.00 O ATOM 789 CB PHE A 49 300.348 -6.711 7.469 1.00 0.00 C ATOM 790 CG PHE A 49 299.164 -6.092 8.107 1.00 0.00 C ATOM 791 CD1 PHE A 49 299.280 -4.970 8.911 1.00 0.00 C ATOM 792 CD2 PHE A 49 297.920 -6.632 7.893 1.00 0.00 C ATOM 793 CE1 PHE A 49 298.186 -4.408 9.480 1.00 0.00 C ATOM 794 CE2 PHE A 49 296.812 -6.063 8.476 1.00 0.00 C ATOM 795 CZ PHE A 49 296.959 -4.942 9.270 1.00 0.00 C ATOM 0 H PHE A 49 301.959 -4.821 8.010 1.00 0.00 H new ATOM 0 HA PHE A 49 301.295 -7.286 9.343 1.00 0.00 H new ATOM 0 HB2 PHE A 49 300.625 -6.120 6.596 1.00 0.00 H new ATOM 0 HB3 PHE A 49 300.074 -7.702 7.108 1.00 0.00 H new ATOM 0 HD1 PHE A 49 300.254 -4.538 9.087 1.00 0.00 H new ATOM 0 HD2 PHE A 49 297.811 -7.505 7.266 1.00 0.00 H new ATOM 0 HE1 PHE A 49 298.293 -3.532 10.103 1.00 0.00 H new ATOM 0 HE2 PHE A 49 295.833 -6.490 8.314 1.00 0.00 H new ATOM 0 HZ PHE A 49 296.091 -4.489 9.726 1.00 0.00 H new ATOM 805 N ARG A 50 302.614 -8.958 8.028 1.00 0.00 N ATOM 806 CA ARG A 50 303.456 -9.911 7.372 1.00 0.00 C ATOM 807 C ARG A 50 302.532 -10.727 6.491 1.00 0.00 C ATOM 808 O ARG A 50 301.325 -10.490 6.456 1.00 0.00 O ATOM 809 CB ARG A 50 304.236 -10.804 8.340 1.00 0.00 C ATOM 810 CG ARG A 50 305.633 -11.129 7.853 1.00 0.00 C ATOM 811 CD ARG A 50 305.929 -12.618 7.873 1.00 0.00 C ATOM 812 NE ARG A 50 306.367 -13.097 9.181 1.00 0.00 N ATOM 813 CZ ARG A 50 307.600 -12.932 9.658 1.00 0.00 C ATOM 814 NH1 ARG A 50 308.519 -12.301 8.937 1.00 0.00 N ATOM 815 NH2 ARG A 50 307.914 -13.401 10.857 1.00 0.00 N ATOM 0 H ARG A 50 302.065 -9.345 8.796 1.00 0.00 H new ATOM 0 HA ARG A 50 304.230 -9.399 6.800 1.00 0.00 H new ATOM 0 HB2 ARG A 50 304.301 -10.309 9.309 1.00 0.00 H new ATOM 0 HB3 ARG A 50 303.686 -11.732 8.492 1.00 0.00 H new ATOM 0 HG2 ARG A 50 305.756 -10.752 6.838 1.00 0.00 H new ATOM 0 HG3 ARG A 50 306.361 -10.610 8.477 1.00 0.00 H new ATOM 0 HD2 ARG A 50 305.035 -13.164 7.573 1.00 0.00 H new ATOM 0 HD3 ARG A 50 306.700 -12.839 7.135 1.00 0.00 H new ATOM 0 HE ARG A 50 305.689 -13.587 9.764 1.00 0.00 H new ATOM 0 HH11 ARG A 50 308.283 -11.940 8.013 1.00 0.00 H new ATOM 0 HH12 ARG A 50 309.461 -12.178 9.307 1.00 0.00 H new ATOM 0 HH21 ARG A 50 307.212 -13.888 11.414 1.00 0.00 H new ATOM 0 HH22 ARG A 50 308.858 -13.275 11.223 1.00 0.00 H new ATOM 829 N PHE A 51 303.072 -11.693 5.830 1.00 0.00 N ATOM 830 CA PHE A 51 302.309 -12.587 4.992 1.00 0.00 C ATOM 831 C PHE A 51 302.818 -13.960 5.343 1.00 0.00 C ATOM 832 O PHE A 51 303.923 -14.057 5.868 1.00 0.00 O ATOM 833 CB PHE A 51 302.446 -12.264 3.496 1.00 0.00 C ATOM 834 CG PHE A 51 302.223 -13.439 2.573 1.00 0.00 C ATOM 835 CD1 PHE A 51 301.048 -14.168 2.629 1.00 0.00 C ATOM 836 CD2 PHE A 51 303.191 -13.816 1.655 1.00 0.00 C ATOM 837 CE1 PHE A 51 300.841 -15.249 1.795 1.00 0.00 C ATOM 838 CE2 PHE A 51 302.992 -14.897 0.818 1.00 0.00 C ATOM 839 CZ PHE A 51 301.816 -15.615 0.888 1.00 0.00 C ATOM 0 H PHE A 51 304.071 -11.897 5.849 1.00 0.00 H new ATOM 0 HA PHE A 51 301.238 -12.495 5.171 1.00 0.00 H new ATOM 0 HB2 PHE A 51 301.734 -11.479 3.241 1.00 0.00 H new ATOM 0 HB3 PHE A 51 303.443 -11.861 3.315 1.00 0.00 H new ATOM 0 HD1 PHE A 51 300.281 -13.887 3.336 1.00 0.00 H new ATOM 0 HD2 PHE A 51 304.113 -13.257 1.593 1.00 0.00 H new ATOM 0 HE1 PHE A 51 299.918 -15.807 1.852 1.00 0.00 H new ATOM 0 HE2 PHE A 51 303.756 -15.180 0.109 1.00 0.00 H new ATOM 0 HZ PHE A 51 301.658 -16.461 0.235 1.00 0.00 H new ATOM 849 N ASP A 52 302.045 -15.005 5.110 1.00 0.00 N ATOM 850 CA ASP A 52 302.524 -16.329 5.477 1.00 0.00 C ATOM 851 C ASP A 52 304.008 -16.351 5.127 1.00 0.00 C ATOM 852 O ASP A 52 304.408 -16.616 3.994 1.00 0.00 O ATOM 853 CB ASP A 52 301.770 -17.419 4.717 1.00 0.00 C ATOM 854 CG ASP A 52 301.908 -18.781 5.369 1.00 0.00 C ATOM 855 OD1 ASP A 52 301.294 -18.994 6.435 1.00 0.00 O ATOM 856 OD2 ASP A 52 302.632 -19.634 4.813 1.00 0.00 O ATOM 0 H ASP A 52 301.118 -14.971 4.685 1.00 0.00 H new ATOM 0 HA ASP A 52 302.361 -16.526 6.537 1.00 0.00 H new ATOM 0 HB2 ASP A 52 300.715 -17.153 4.658 1.00 0.00 H new ATOM 0 HB3 ASP A 52 302.144 -17.470 3.694 1.00 0.00 H new ATOM 861 N GLY A 53 304.806 -16.016 6.150 1.00 0.00 N ATOM 862 CA GLY A 53 306.240 -15.934 6.015 1.00 0.00 C ATOM 863 C GLY A 53 306.698 -14.923 4.971 1.00 0.00 C ATOM 864 O GLY A 53 307.437 -15.288 4.057 1.00 0.00 O ATOM 0 H GLY A 53 304.463 -15.798 7.085 1.00 0.00 H new ATOM 0 HA2 GLY A 53 306.673 -15.669 6.980 1.00 0.00 H new ATOM 0 HA3 GLY A 53 306.628 -16.918 5.751 1.00 0.00 H new ATOM 868 N GLN A 54 306.296 -13.642 5.091 1.00 0.00 N ATOM 869 CA GLN A 54 306.728 -12.633 4.132 1.00 0.00 C ATOM 870 C GLN A 54 306.257 -11.254 4.576 1.00 0.00 C ATOM 871 O GLN A 54 305.081 -10.921 4.439 1.00 0.00 O ATOM 872 CB GLN A 54 306.182 -12.946 2.741 1.00 0.00 C ATOM 873 CG GLN A 54 307.200 -12.762 1.627 1.00 0.00 C ATOM 874 CD GLN A 54 307.930 -14.047 1.288 1.00 0.00 C ATOM 875 OE1 GLN A 54 307.311 -15.057 0.955 1.00 0.00 O ATOM 876 NE2 GLN A 54 309.256 -14.014 1.371 1.00 0.00 N ATOM 0 H GLN A 54 305.685 -13.296 5.831 1.00 0.00 H new ATOM 0 HA GLN A 54 307.817 -12.642 4.089 1.00 0.00 H new ATOM 0 HB2 GLN A 54 305.822 -13.975 2.725 1.00 0.00 H new ATOM 0 HB3 GLN A 54 305.323 -12.304 2.545 1.00 0.00 H new ATOM 0 HG2 GLN A 54 306.695 -12.389 0.736 1.00 0.00 H new ATOM 0 HG3 GLN A 54 307.925 -12.004 1.923 1.00 0.00 H new ATOM 0 HE21 GLN A 54 309.728 -13.154 1.651 1.00 0.00 H new ATOM 0 HE22 GLN A 54 309.801 -14.848 1.154 1.00 0.00 H new ATOM 885 N PRO A 55 307.171 -10.423 5.110 1.00 0.00 N ATOM 886 CA PRO A 55 306.838 -9.071 5.568 1.00 0.00 C ATOM 887 C PRO A 55 305.970 -8.342 4.547 1.00 0.00 C ATOM 888 O PRO A 55 306.021 -8.643 3.355 1.00 0.00 O ATOM 889 CB PRO A 55 308.206 -8.402 5.745 1.00 0.00 C ATOM 890 CG PRO A 55 309.198 -9.355 5.154 1.00 0.00 C ATOM 891 CD PRO A 55 308.593 -10.714 5.300 1.00 0.00 C ATOM 0 HA PRO A 55 306.253 -9.062 6.488 1.00 0.00 H new ATOM 0 HB2 PRO A 55 308.239 -7.437 5.239 1.00 0.00 H new ATOM 0 HB3 PRO A 55 308.419 -8.217 6.798 1.00 0.00 H new ATOM 0 HG2 PRO A 55 309.388 -9.122 4.106 1.00 0.00 H new ATOM 0 HG3 PRO A 55 310.155 -9.295 5.673 1.00 0.00 H new ATOM 0 HD2 PRO A 55 308.972 -11.414 4.555 1.00 0.00 H new ATOM 0 HD3 PRO A 55 308.795 -11.150 6.278 1.00 0.00 H new ATOM 899 N ILE A 56 305.123 -7.436 5.023 1.00 0.00 N ATOM 900 CA ILE A 56 304.192 -6.739 4.132 1.00 0.00 C ATOM 901 C ILE A 56 304.399 -5.242 3.998 1.00 0.00 C ATOM 902 O ILE A 56 304.873 -4.551 4.900 1.00 0.00 O ATOM 903 CB ILE A 56 302.749 -6.966 4.591 1.00 0.00 C ATOM 904 CG1 ILE A 56 302.422 -8.446 4.511 1.00 0.00 C ATOM 905 CG2 ILE A 56 301.754 -6.104 3.832 1.00 0.00 C ATOM 906 CD1 ILE A 56 301.134 -8.745 3.819 1.00 0.00 C ATOM 0 H ILE A 56 305.059 -7.167 6.005 1.00 0.00 H new ATOM 0 HA ILE A 56 304.396 -7.172 3.153 1.00 0.00 H new ATOM 0 HB ILE A 56 302.661 -6.649 5.630 1.00 0.00 H new ATOM 0 HG12 ILE A 56 303.230 -8.959 3.990 1.00 0.00 H new ATOM 0 HG13 ILE A 56 302.384 -8.855 5.521 1.00 0.00 H new ATOM 0 HG21 ILE A 56 300.747 -6.304 4.197 1.00 0.00 H new ATOM 0 HG22 ILE A 56 301.993 -5.052 3.986 1.00 0.00 H new ATOM 0 HG23 ILE A 56 301.808 -6.337 2.769 1.00 0.00 H new ATOM 0 HD11 ILE A 56 300.971 -9.823 3.803 1.00 0.00 H new ATOM 0 HD12 ILE A 56 300.314 -8.262 4.351 1.00 0.00 H new ATOM 0 HD13 ILE A 56 301.174 -8.368 2.797 1.00 0.00 H new ATOM 918 N ASN A 57 303.979 -4.782 2.830 1.00 0.00 N ATOM 919 CA ASN A 57 304.021 -3.388 2.454 1.00 0.00 C ATOM 920 C ASN A 57 302.615 -2.919 2.113 1.00 0.00 C ATOM 921 O ASN A 57 301.797 -3.698 1.624 1.00 0.00 O ATOM 922 CB ASN A 57 304.925 -3.215 1.249 1.00 0.00 C ATOM 923 CG ASN A 57 306.387 -3.399 1.570 1.00 0.00 C ATOM 924 OD1 ASN A 57 307.091 -4.150 0.895 1.00 0.00 O ATOM 925 ND2 ASN A 57 306.858 -2.719 2.598 1.00 0.00 N ATOM 0 H ASN A 57 303.592 -5.386 2.105 1.00 0.00 H new ATOM 0 HA ASN A 57 304.411 -2.796 3.282 1.00 0.00 H new ATOM 0 HB2 ASN A 57 304.636 -3.932 0.480 1.00 0.00 H new ATOM 0 HB3 ASN A 57 304.774 -2.220 0.830 1.00 0.00 H new ATOM 0 HD21 ASN A 57 307.840 -2.805 2.860 1.00 0.00 H new ATOM 0 HD22 ASN A 57 306.240 -2.107 3.131 1.00 0.00 H new ATOM 932 N GLU A 58 302.333 -1.653 2.367 1.00 0.00 N ATOM 933 CA GLU A 58 301.019 -1.102 2.080 1.00 0.00 C ATOM 934 C GLU A 58 300.634 -1.341 0.622 1.00 0.00 C ATOM 935 O GLU A 58 299.470 -1.584 0.304 1.00 0.00 O ATOM 936 CB GLU A 58 301.004 0.395 2.385 1.00 0.00 C ATOM 937 CG GLU A 58 300.303 0.739 3.686 1.00 0.00 C ATOM 938 CD GLU A 58 300.317 2.226 3.983 1.00 0.00 C ATOM 939 OE1 GLU A 58 301.369 2.733 4.427 1.00 0.00 O ATOM 940 OE2 GLU A 58 299.276 2.884 3.772 1.00 0.00 O ATOM 0 H GLU A 58 302.994 -0.989 2.770 1.00 0.00 H new ATOM 0 HA GLU A 58 300.290 -1.607 2.714 1.00 0.00 H new ATOM 0 HB2 GLU A 58 302.030 0.760 2.427 1.00 0.00 H new ATOM 0 HB3 GLU A 58 300.512 0.920 1.566 1.00 0.00 H new ATOM 0 HG2 GLU A 58 299.271 0.391 3.641 1.00 0.00 H new ATOM 0 HG3 GLU A 58 300.784 0.204 4.505 1.00 0.00 H new ATOM 947 N THR A 59 301.617 -1.253 -0.260 1.00 0.00 N ATOM 948 CA THR A 59 301.379 -1.433 -1.684 1.00 0.00 C ATOM 949 C THR A 59 301.455 -2.899 -2.111 1.00 0.00 C ATOM 950 O THR A 59 300.898 -3.277 -3.141 1.00 0.00 O ATOM 951 CB THR A 59 302.375 -0.592 -2.473 1.00 0.00 C ATOM 952 OG1 THR A 59 303.702 -0.859 -2.054 1.00 0.00 O ATOM 953 CG2 THR A 59 302.128 0.892 -2.316 1.00 0.00 C ATOM 0 H THR A 59 302.588 -1.058 -0.015 1.00 0.00 H new ATOM 0 HA THR A 59 300.363 -1.101 -1.897 1.00 0.00 H new ATOM 0 HB THR A 59 302.239 -0.867 -3.519 1.00 0.00 H new ATOM 0 HG1 THR A 59 304.326 -0.310 -2.574 1.00 0.00 H new ATOM 0 HG21 THR A 59 302.864 1.447 -2.898 1.00 0.00 H new ATOM 0 HG22 THR A 59 301.127 1.134 -2.672 1.00 0.00 H new ATOM 0 HG23 THR A 59 302.215 1.166 -1.265 1.00 0.00 H new ATOM 961 N ASP A 60 302.137 -3.725 -1.323 1.00 0.00 N ATOM 962 CA ASP A 60 302.260 -5.144 -1.651 1.00 0.00 C ATOM 963 C ASP A 60 300.884 -5.771 -1.837 1.00 0.00 C ATOM 964 O ASP A 60 299.985 -5.561 -1.025 1.00 0.00 O ATOM 965 CB ASP A 60 303.021 -5.900 -0.561 1.00 0.00 C ATOM 966 CG ASP A 60 304.512 -5.966 -0.833 1.00 0.00 C ATOM 967 OD1 ASP A 60 304.991 -5.210 -1.704 1.00 0.00 O ATOM 968 OD2 ASP A 60 305.200 -6.774 -0.175 1.00 0.00 O ATOM 0 H ASP A 60 302.608 -3.443 -0.463 1.00 0.00 H new ATOM 0 HA ASP A 60 302.820 -5.218 -2.583 1.00 0.00 H new ATOM 0 HB2 ASP A 60 302.851 -5.414 0.400 1.00 0.00 H new ATOM 0 HB3 ASP A 60 302.624 -6.912 -0.481 1.00 0.00 H new ATOM 973 N THR A 61 300.725 -6.542 -2.908 1.00 0.00 N ATOM 974 CA THR A 61 299.455 -7.202 -3.190 1.00 0.00 C ATOM 975 C THR A 61 299.612 -8.711 -3.226 1.00 0.00 C ATOM 976 O THR A 61 300.691 -9.229 -3.506 1.00 0.00 O ATOM 977 CB THR A 61 298.857 -6.725 -4.513 1.00 0.00 C ATOM 978 OG1 THR A 61 299.368 -7.476 -5.600 1.00 0.00 O ATOM 979 CG2 THR A 61 299.108 -5.263 -4.809 1.00 0.00 C ATOM 0 H THR A 61 301.458 -6.725 -3.593 1.00 0.00 H new ATOM 0 HA THR A 61 298.777 -6.935 -2.380 1.00 0.00 H new ATOM 0 HB THR A 61 297.783 -6.870 -4.399 1.00 0.00 H new ATOM 0 HG1 THR A 61 298.626 -7.891 -6.088 1.00 0.00 H new ATOM 0 HG21 THR A 61 298.653 -5.002 -5.764 1.00 0.00 H new ATOM 0 HG22 THR A 61 298.671 -4.652 -4.019 1.00 0.00 H new ATOM 0 HG23 THR A 61 300.182 -5.081 -4.857 1.00 0.00 H new ATOM 987 N PRO A 62 298.516 -9.436 -2.957 1.00 0.00 N ATOM 988 CA PRO A 62 298.509 -10.898 -2.976 1.00 0.00 C ATOM 989 C PRO A 62 299.260 -11.446 -4.187 1.00 0.00 C ATOM 990 O PRO A 62 300.089 -12.337 -4.055 1.00 0.00 O ATOM 991 CB PRO A 62 297.022 -11.220 -3.089 1.00 0.00 C ATOM 992 CG PRO A 62 296.320 -10.086 -2.434 1.00 0.00 C ATOM 993 CD PRO A 62 297.190 -8.875 -2.632 1.00 0.00 C ATOM 0 HA PRO A 62 298.996 -11.336 -2.105 1.00 0.00 H new ATOM 0 HB2 PRO A 62 296.720 -11.319 -4.132 1.00 0.00 H new ATOM 0 HB3 PRO A 62 296.786 -12.164 -2.598 1.00 0.00 H new ATOM 0 HG2 PRO A 62 295.335 -9.933 -2.875 1.00 0.00 H new ATOM 0 HG3 PRO A 62 296.167 -10.285 -1.373 1.00 0.00 H new ATOM 0 HD2 PRO A 62 296.816 -8.243 -3.437 1.00 0.00 H new ATOM 0 HD3 PRO A 62 297.227 -8.259 -1.734 1.00 0.00 H new ATOM 1001 N ALA A 63 298.986 -10.880 -5.364 1.00 0.00 N ATOM 1002 CA ALA A 63 299.663 -11.287 -6.593 1.00 0.00 C ATOM 1003 C ALA A 63 301.138 -11.015 -6.478 1.00 0.00 C ATOM 1004 O ALA A 63 301.992 -11.799 -6.891 1.00 0.00 O ATOM 1005 CB ALA A 63 299.159 -10.456 -7.741 1.00 0.00 C ATOM 0 H ALA A 63 298.298 -10.137 -5.490 1.00 0.00 H new ATOM 0 HA ALA A 63 299.472 -12.348 -6.755 1.00 0.00 H new ATOM 0 HB1 ALA A 63 299.664 -10.759 -8.658 1.00 0.00 H new ATOM 0 HB2 ALA A 63 298.085 -10.603 -7.852 1.00 0.00 H new ATOM 0 HB3 ALA A 63 299.363 -9.403 -7.545 1.00 0.00 H new ATOM 1011 N GLN A 64 301.394 -9.872 -5.889 1.00 0.00 N ATOM 1012 CA GLN A 64 302.719 -9.374 -5.646 1.00 0.00 C ATOM 1013 C GLN A 64 303.369 -10.160 -4.518 1.00 0.00 C ATOM 1014 O GLN A 64 304.570 -10.060 -4.267 1.00 0.00 O ATOM 1015 CB GLN A 64 302.559 -7.914 -5.261 1.00 0.00 C ATOM 1016 CG GLN A 64 303.205 -6.951 -6.229 1.00 0.00 C ATOM 1017 CD GLN A 64 304.719 -7.017 -6.205 1.00 0.00 C ATOM 1018 OE1 GLN A 64 305.336 -7.705 -7.019 1.00 0.00 O ATOM 1019 NE2 GLN A 64 305.328 -6.300 -5.268 1.00 0.00 N ATOM 0 H GLN A 64 300.660 -9.246 -5.557 1.00 0.00 H new ATOM 0 HA GLN A 64 303.357 -9.478 -6.524 1.00 0.00 H new ATOM 0 HB2 GLN A 64 301.496 -7.682 -5.188 1.00 0.00 H new ATOM 0 HB3 GLN A 64 302.988 -7.761 -4.271 1.00 0.00 H new ATOM 0 HG2 GLN A 64 302.853 -7.167 -7.238 1.00 0.00 H new ATOM 0 HG3 GLN A 64 302.887 -5.936 -5.991 1.00 0.00 H new ATOM 0 HE21 GLN A 64 304.778 -5.744 -4.613 1.00 0.00 H new ATOM 0 HE22 GLN A 64 306.346 -6.305 -5.203 1.00 0.00 H new ATOM 1028 N LEU A 65 302.534 -10.921 -3.836 1.00 0.00 N ATOM 1029 CA LEU A 65 302.933 -11.729 -2.711 1.00 0.00 C ATOM 1030 C LEU A 65 302.588 -13.192 -2.952 1.00 0.00 C ATOM 1031 O LEU A 65 302.701 -14.030 -2.057 1.00 0.00 O ATOM 1032 CB LEU A 65 302.193 -11.188 -1.499 1.00 0.00 C ATOM 1033 CG LEU A 65 302.693 -9.828 -1.020 1.00 0.00 C ATOM 1034 CD1 LEU A 65 302.111 -9.474 0.331 1.00 0.00 C ATOM 1035 CD2 LEU A 65 304.205 -9.814 -0.965 1.00 0.00 C ATOM 0 H LEU A 65 301.541 -10.993 -4.057 1.00 0.00 H new ATOM 0 HA LEU A 65 304.011 -11.681 -2.557 1.00 0.00 H new ATOM 0 HB2 LEU A 65 301.133 -11.109 -1.739 1.00 0.00 H new ATOM 0 HB3 LEU A 65 302.283 -11.904 -0.682 1.00 0.00 H new ATOM 0 HG LEU A 65 302.360 -9.076 -1.735 1.00 0.00 H new ATOM 0 HD11 LEU A 65 302.486 -8.500 0.645 1.00 0.00 H new ATOM 0 HD12 LEU A 65 301.024 -9.439 0.261 1.00 0.00 H new ATOM 0 HD13 LEU A 65 302.403 -10.228 1.062 1.00 0.00 H new ATOM 0 HD21 LEU A 65 304.548 -8.838 -0.622 1.00 0.00 H new ATOM 0 HD22 LEU A 65 304.551 -10.583 -0.275 1.00 0.00 H new ATOM 0 HD23 LEU A 65 304.607 -10.011 -1.959 1.00 0.00 H new ATOM 1047 N GLU A 66 302.145 -13.478 -4.172 1.00 0.00 N ATOM 1048 CA GLU A 66 301.750 -14.822 -4.565 1.00 0.00 C ATOM 1049 C GLU A 66 300.865 -15.440 -3.488 1.00 0.00 C ATOM 1050 O GLU A 66 301.109 -16.552 -3.020 1.00 0.00 O ATOM 1051 CB GLU A 66 302.982 -15.696 -4.811 1.00 0.00 C ATOM 1052 CG GLU A 66 303.874 -15.186 -5.931 1.00 0.00 C ATOM 1053 CD GLU A 66 305.348 -15.391 -5.641 1.00 0.00 C ATOM 1054 OE1 GLU A 66 305.956 -14.509 -4.998 1.00 0.00 O ATOM 1055 OE2 GLU A 66 305.896 -16.433 -6.059 1.00 0.00 O ATOM 0 H GLU A 66 302.051 -12.784 -4.914 1.00 0.00 H new ATOM 0 HA GLU A 66 301.184 -14.762 -5.495 1.00 0.00 H new ATOM 0 HB2 GLU A 66 303.565 -15.755 -3.892 1.00 0.00 H new ATOM 0 HB3 GLU A 66 302.657 -16.709 -5.049 1.00 0.00 H new ATOM 0 HG2 GLU A 66 303.615 -15.697 -6.858 1.00 0.00 H new ATOM 0 HG3 GLU A 66 303.683 -14.125 -6.088 1.00 0.00 H new ATOM 1062 N MET A 67 299.842 -14.691 -3.099 1.00 0.00 N ATOM 1063 CA MET A 67 298.908 -15.127 -2.074 1.00 0.00 C ATOM 1064 C MET A 67 297.750 -15.897 -2.693 1.00 0.00 C ATOM 1065 O MET A 67 297.598 -15.931 -3.913 1.00 0.00 O ATOM 1066 CB MET A 67 298.386 -13.914 -1.304 1.00 0.00 C ATOM 1067 CG MET A 67 299.383 -13.350 -0.308 1.00 0.00 C ATOM 1068 SD MET A 67 298.602 -12.836 1.231 1.00 0.00 S ATOM 1069 CE MET A 67 298.587 -11.061 1.010 1.00 0.00 C ATOM 0 H MET A 67 299.638 -13.769 -3.484 1.00 0.00 H new ATOM 0 HA MET A 67 299.429 -15.792 -1.385 1.00 0.00 H new ATOM 0 HB2 MET A 67 298.114 -13.133 -2.014 1.00 0.00 H new ATOM 0 HB3 MET A 67 297.476 -14.195 -0.774 1.00 0.00 H new ATOM 0 HG2 MET A 67 300.142 -14.102 -0.093 1.00 0.00 H new ATOM 0 HG3 MET A 67 299.895 -12.498 -0.754 1.00 0.00 H new ATOM 0 HE1 MET A 67 297.820 -10.621 1.647 1.00 0.00 H new ATOM 0 HE2 MET A 67 299.561 -10.652 1.280 1.00 0.00 H new ATOM 0 HE3 MET A 67 298.372 -10.826 -0.032 1.00 0.00 H new ATOM 1079 N GLU A 68 296.938 -16.518 -1.847 1.00 0.00 N ATOM 1080 CA GLU A 68 295.798 -17.289 -2.323 1.00 0.00 C ATOM 1081 C GLU A 68 294.504 -16.828 -1.707 1.00 0.00 C ATOM 1082 O GLU A 68 294.448 -15.872 -0.934 1.00 0.00 O ATOM 1083 CB GLU A 68 295.930 -18.761 -1.964 1.00 0.00 C ATOM 1084 CG GLU A 68 296.039 -19.683 -3.167 1.00 0.00 C ATOM 1085 CD GLU A 68 296.750 -20.982 -2.844 1.00 0.00 C ATOM 1086 OE1 GLU A 68 296.074 -21.936 -2.405 1.00 0.00 O ATOM 1087 OE2 GLU A 68 297.983 -21.046 -3.031 1.00 0.00 O ATOM 0 H GLU A 68 297.047 -16.503 -0.833 1.00 0.00 H new ATOM 0 HA GLU A 68 295.787 -17.142 -3.403 1.00 0.00 H new ATOM 0 HB2 GLU A 68 296.811 -18.894 -1.336 1.00 0.00 H new ATOM 0 HB3 GLU A 68 295.067 -19.058 -1.368 1.00 0.00 H new ATOM 0 HG2 GLU A 68 295.040 -19.904 -3.542 1.00 0.00 H new ATOM 0 HG3 GLU A 68 296.574 -19.170 -3.966 1.00 0.00 H new ATOM 1094 N ASP A 69 293.474 -17.581 -2.030 1.00 0.00 N ATOM 1095 CA ASP A 69 292.164 -17.344 -1.503 1.00 0.00 C ATOM 1096 C ASP A 69 292.025 -18.082 -0.177 1.00 0.00 C ATOM 1097 O ASP A 69 292.168 -19.301 -0.096 1.00 0.00 O ATOM 1098 CB ASP A 69 291.116 -17.763 -2.524 1.00 0.00 C ATOM 1099 CG ASP A 69 290.771 -19.240 -2.462 1.00 0.00 C ATOM 1100 OD1 ASP A 69 291.603 -20.063 -2.899 1.00 0.00 O ATOM 1101 OD2 ASP A 69 289.669 -19.573 -1.977 1.00 0.00 O ATOM 0 H ASP A 69 293.531 -18.375 -2.668 1.00 0.00 H new ATOM 0 HA ASP A 69 292.009 -16.283 -1.309 1.00 0.00 H new ATOM 0 HB2 ASP A 69 290.210 -17.179 -2.364 1.00 0.00 H new ATOM 0 HB3 ASP A 69 291.478 -17.524 -3.524 1.00 0.00 H new ATOM 1106 N GLU A 70 291.800 -17.284 0.845 1.00 0.00 N ATOM 1107 CA GLU A 70 291.679 -17.739 2.234 1.00 0.00 C ATOM 1108 C GLU A 70 293.057 -17.798 2.870 1.00 0.00 C ATOM 1109 O GLU A 70 293.195 -18.164 4.037 1.00 0.00 O ATOM 1110 CB GLU A 70 290.981 -19.102 2.342 1.00 0.00 C ATOM 1111 CG GLU A 70 289.466 -19.004 2.439 1.00 0.00 C ATOM 1112 CD GLU A 70 288.858 -18.186 1.318 1.00 0.00 C ATOM 1113 OE1 GLU A 70 289.333 -18.304 0.169 1.00 0.00 O ATOM 1114 OE2 GLU A 70 287.902 -17.428 1.588 1.00 0.00 O ATOM 0 H GLU A 70 291.692 -16.275 0.742 1.00 0.00 H new ATOM 0 HA GLU A 70 291.056 -17.021 2.767 1.00 0.00 H new ATOM 0 HB2 GLU A 70 291.243 -19.705 1.472 1.00 0.00 H new ATOM 0 HB3 GLU A 70 291.360 -19.626 3.219 1.00 0.00 H new ATOM 0 HG2 GLU A 70 289.040 -20.007 2.423 1.00 0.00 H new ATOM 0 HG3 GLU A 70 289.196 -18.558 3.396 1.00 0.00 H new ATOM 1121 N ASP A 71 294.080 -17.439 2.084 1.00 0.00 N ATOM 1122 CA ASP A 71 295.454 -17.441 2.550 1.00 0.00 C ATOM 1123 C ASP A 71 295.554 -16.736 3.886 1.00 0.00 C ATOM 1124 O ASP A 71 294.549 -16.490 4.549 1.00 0.00 O ATOM 1125 CB ASP A 71 296.364 -16.763 1.517 1.00 0.00 C ATOM 1126 CG ASP A 71 297.659 -17.523 1.305 1.00 0.00 C ATOM 1127 OD1 ASP A 71 298.305 -17.887 2.310 1.00 0.00 O ATOM 1128 OD2 ASP A 71 298.027 -17.753 0.134 1.00 0.00 O ATOM 0 H ASP A 71 293.970 -17.142 1.114 1.00 0.00 H new ATOM 0 HA ASP A 71 295.781 -18.473 2.677 1.00 0.00 H new ATOM 0 HB2 ASP A 71 295.834 -16.680 0.568 1.00 0.00 H new ATOM 0 HB3 ASP A 71 296.590 -15.749 1.845 1.00 0.00 H new ATOM 1133 N THR A 72 296.757 -16.394 4.282 1.00 0.00 N ATOM 1134 CA THR A 72 296.932 -15.713 5.542 1.00 0.00 C ATOM 1135 C THR A 72 297.894 -14.557 5.444 1.00 0.00 C ATOM 1136 O THR A 72 299.042 -14.697 5.022 1.00 0.00 O ATOM 1137 CB THR A 72 297.413 -16.667 6.631 1.00 0.00 C ATOM 1138 OG1 THR A 72 296.545 -17.781 6.751 1.00 0.00 O ATOM 1139 CG2 THR A 72 297.513 -15.998 7.990 1.00 0.00 C ATOM 0 H THR A 72 297.615 -16.572 3.760 1.00 0.00 H new ATOM 0 HA THR A 72 295.949 -15.323 5.807 1.00 0.00 H new ATOM 0 HB THR A 72 298.408 -16.990 6.324 1.00 0.00 H new ATOM 0 HG1 THR A 72 296.875 -18.379 7.454 1.00 0.00 H new ATOM 0 HG21 THR A 72 297.860 -16.722 8.727 1.00 0.00 H new ATOM 0 HG22 THR A 72 298.218 -15.169 7.936 1.00 0.00 H new ATOM 0 HG23 THR A 72 296.533 -15.622 8.284 1.00 0.00 H new ATOM 1147 N ILE A 73 297.431 -13.447 5.964 1.00 0.00 N ATOM 1148 CA ILE A 73 298.232 -12.277 6.088 1.00 0.00 C ATOM 1149 C ILE A 73 298.686 -12.303 7.519 1.00 0.00 C ATOM 1150 O ILE A 73 297.897 -12.524 8.428 1.00 0.00 O ATOM 1151 CB ILE A 73 297.479 -10.955 5.783 1.00 0.00 C ATOM 1152 CG1 ILE A 73 297.626 -10.649 4.328 1.00 0.00 C ATOM 1153 CG2 ILE A 73 298.072 -9.791 6.596 1.00 0.00 C ATOM 1154 CD1 ILE A 73 299.046 -10.673 3.913 1.00 0.00 C ATOM 0 H ILE A 73 296.479 -13.340 6.313 1.00 0.00 H new ATOM 0 HA ILE A 73 299.043 -12.291 5.360 1.00 0.00 H new ATOM 0 HB ILE A 73 296.430 -11.073 6.053 1.00 0.00 H new ATOM 0 HG12 ILE A 73 297.062 -11.375 3.743 1.00 0.00 H new ATOM 0 HG13 ILE A 73 297.200 -9.669 4.116 1.00 0.00 H new ATOM 0 HG21 ILE A 73 297.529 -8.874 6.367 1.00 0.00 H new ATOM 0 HG22 ILE A 73 297.984 -10.009 7.660 1.00 0.00 H new ATOM 0 HG23 ILE A 73 299.123 -9.665 6.337 1.00 0.00 H new ATOM 0 HD11 ILE A 73 299.118 -10.446 2.849 1.00 0.00 H new ATOM 0 HD12 ILE A 73 299.604 -9.929 4.481 1.00 0.00 H new ATOM 0 HD13 ILE A 73 299.464 -11.662 4.102 1.00 0.00 H new ATOM 1166 N ASP A 74 299.944 -12.120 7.723 1.00 0.00 N ATOM 1167 CA ASP A 74 300.466 -12.157 9.062 1.00 0.00 C ATOM 1168 C ASP A 74 300.578 -10.748 9.560 1.00 0.00 C ATOM 1169 O ASP A 74 300.727 -9.824 8.768 1.00 0.00 O ATOM 1170 CB ASP A 74 301.815 -12.874 9.108 1.00 0.00 C ATOM 1171 CG ASP A 74 301.689 -14.308 9.584 1.00 0.00 C ATOM 1172 OD1 ASP A 74 301.679 -14.527 10.813 1.00 0.00 O ATOM 1173 OD2 ASP A 74 301.602 -15.212 8.726 1.00 0.00 O ATOM 0 H ASP A 74 300.633 -11.944 6.992 1.00 0.00 H new ATOM 0 HA ASP A 74 299.792 -12.720 9.707 1.00 0.00 H new ATOM 0 HB2 ASP A 74 302.265 -12.861 8.115 1.00 0.00 H new ATOM 0 HB3 ASP A 74 302.490 -12.332 9.770 1.00 0.00 H new ATOM 1178 N VAL A 75 300.488 -10.564 10.854 1.00 0.00 N ATOM 1179 CA VAL A 75 300.587 -9.227 11.391 1.00 0.00 C ATOM 1180 C VAL A 75 301.572 -9.139 12.526 1.00 0.00 C ATOM 1181 O VAL A 75 301.638 -9.990 13.411 1.00 0.00 O ATOM 1182 CB VAL A 75 299.233 -8.619 11.833 1.00 0.00 C ATOM 1183 CG1 VAL A 75 299.428 -7.673 13.022 1.00 0.00 C ATOM 1184 CG2 VAL A 75 298.612 -7.874 10.664 1.00 0.00 C ATOM 0 H VAL A 75 300.350 -11.304 11.543 1.00 0.00 H new ATOM 0 HA VAL A 75 300.949 -8.631 10.553 1.00 0.00 H new ATOM 0 HB VAL A 75 298.567 -9.423 12.146 1.00 0.00 H new ATOM 0 HG11 VAL A 75 298.465 -7.256 13.317 1.00 0.00 H new ATOM 0 HG12 VAL A 75 299.857 -8.224 13.859 1.00 0.00 H new ATOM 0 HG13 VAL A 75 300.101 -6.864 12.737 1.00 0.00 H new ATOM 0 HG21 VAL A 75 297.658 -7.445 10.971 1.00 0.00 H new ATOM 0 HG22 VAL A 75 299.282 -7.077 10.343 1.00 0.00 H new ATOM 0 HG23 VAL A 75 298.449 -8.565 9.837 1.00 0.00 H new ATOM 1194 N PHE A 76 302.296 -8.051 12.480 1.00 0.00 N ATOM 1195 CA PHE A 76 303.278 -7.699 13.474 1.00 0.00 C ATOM 1196 C PHE A 76 303.183 -6.210 13.672 1.00 0.00 C ATOM 1197 O PHE A 76 302.816 -5.489 12.756 1.00 0.00 O ATOM 1198 CB PHE A 76 304.686 -8.054 13.025 1.00 0.00 C ATOM 1199 CG PHE A 76 304.891 -9.518 12.751 1.00 0.00 C ATOM 1200 CD1 PHE A 76 304.837 -10.431 13.791 1.00 0.00 C ATOM 1201 CD2 PHE A 76 305.138 -9.987 11.467 1.00 0.00 C ATOM 1202 CE1 PHE A 76 305.023 -11.779 13.563 1.00 0.00 C ATOM 1203 CE2 PHE A 76 305.324 -11.333 11.238 1.00 0.00 C ATOM 1204 CZ PHE A 76 305.266 -12.231 12.285 1.00 0.00 C ATOM 0 H PHE A 76 302.217 -7.366 11.729 1.00 0.00 H new ATOM 0 HA PHE A 76 303.082 -8.250 14.394 1.00 0.00 H new ATOM 0 HB2 PHE A 76 304.921 -7.490 12.123 1.00 0.00 H new ATOM 0 HB3 PHE A 76 305.392 -7.736 13.793 1.00 0.00 H new ATOM 0 HD1 PHE A 76 304.646 -10.083 14.795 1.00 0.00 H new ATOM 0 HD2 PHE A 76 305.185 -9.292 10.642 1.00 0.00 H new ATOM 0 HE1 PHE A 76 304.978 -12.478 14.385 1.00 0.00 H new ATOM 0 HE2 PHE A 76 305.516 -11.687 10.236 1.00 0.00 H new ATOM 0 HZ PHE A 76 305.411 -13.286 12.102 1.00 0.00 H new ATOM 1214 N GLN A 77 303.485 -5.744 14.849 1.00 0.00 N ATOM 1215 CA GLN A 77 303.396 -4.322 15.109 1.00 0.00 C ATOM 1216 C GLN A 77 304.783 -3.689 15.108 1.00 0.00 C ATOM 1217 O GLN A 77 305.585 -3.923 16.012 1.00 0.00 O ATOM 1218 CB GLN A 77 302.666 -4.068 16.421 1.00 0.00 C ATOM 1219 CG GLN A 77 301.329 -3.378 16.232 1.00 0.00 C ATOM 1220 CD GLN A 77 300.299 -3.832 17.248 1.00 0.00 C ATOM 1221 OE1 GLN A 77 300.156 -3.234 18.314 1.00 0.00 O ATOM 1222 NE2 GLN A 77 299.575 -4.895 16.919 1.00 0.00 N ATOM 0 H GLN A 77 303.792 -6.312 15.639 1.00 0.00 H new ATOM 0 HA GLN A 77 302.820 -3.854 14.311 1.00 0.00 H new ATOM 0 HB2 GLN A 77 302.509 -5.018 16.933 1.00 0.00 H new ATOM 0 HB3 GLN A 77 303.295 -3.457 17.068 1.00 0.00 H new ATOM 0 HG2 GLN A 77 301.465 -2.299 16.312 1.00 0.00 H new ATOM 0 HG3 GLN A 77 300.958 -3.579 15.227 1.00 0.00 H new ATOM 0 HE21 GLN A 77 299.728 -5.359 16.024 1.00 0.00 H new ATOM 0 HE22 GLN A 77 298.865 -5.247 17.561 1.00 0.00 H new ATOM 1231 N GLN A 78 305.059 -2.889 14.081 1.00 0.00 N ATOM 1232 CA GLN A 78 306.348 -2.218 13.945 1.00 0.00 C ATOM 1233 C GLN A 78 307.508 -3.213 13.995 1.00 0.00 C ATOM 1234 O GLN A 78 308.242 -3.281 14.980 1.00 0.00 O ATOM 1235 CB GLN A 78 306.513 -1.161 15.035 1.00 0.00 C ATOM 1236 CG GLN A 78 306.736 0.242 14.493 1.00 0.00 C ATOM 1237 CD GLN A 78 306.312 1.319 15.472 1.00 0.00 C ATOM 1238 OE1 GLN A 78 305.743 2.401 14.952 1.00 0.00 O flip ATOM 1239 NE2 GLN A 78 306.493 1.181 16.681 1.00 0.00 N flip ATOM 0 H GLN A 78 304.402 -2.689 13.327 1.00 0.00 H new ATOM 0 HA GLN A 78 306.367 -1.732 12.970 1.00 0.00 H new ATOM 0 HB2 GLN A 78 305.625 -1.161 15.667 1.00 0.00 H new ATOM 0 HB3 GLN A 78 307.356 -1.434 15.670 1.00 0.00 H new ATOM 0 HG2 GLN A 78 307.791 0.371 14.251 1.00 0.00 H new ATOM 0 HG3 GLN A 78 306.179 0.361 13.564 1.00 0.00 H new ATOM 0 HE21 GLN A 78 306.934 0.333 17.037 1.00 0.00 H new ATOM 0 HE22 GLN A 78 306.202 1.915 17.327 1.00 0.00 H new ATOM 1489 N ASN B 14 311.675 -2.619 -6.990 1.00 0.00 N ATOM 1490 CA ASN B 14 310.594 -1.787 -6.475 1.00 0.00 C ATOM 1491 C ASN B 14 310.235 -2.151 -5.035 1.00 0.00 C ATOM 1492 O ASN B 14 309.108 -2.553 -4.742 1.00 0.00 O ATOM 1493 CB ASN B 14 309.376 -1.909 -7.378 1.00 0.00 C ATOM 1494 CG ASN B 14 308.690 -0.577 -7.611 1.00 0.00 C ATOM 1495 OD1 ASN B 14 308.310 0.113 -6.665 1.00 0.00 O ATOM 1496 ND2 ASN B 14 308.527 -0.208 -8.877 1.00 0.00 N ATOM 0 HA ASN B 14 310.937 -0.752 -6.470 1.00 0.00 H new ATOM 0 HB2 ASN B 14 309.679 -2.330 -8.336 1.00 0.00 H new ATOM 0 HB3 ASN B 14 308.666 -2.607 -6.933 1.00 0.00 H new ATOM 0 HD21 ASN B 14 308.072 0.678 -9.095 1.00 0.00 H new ATOM 0 HD22 ASN B 14 308.857 -0.811 -9.631 1.00 0.00 H new ATOM 1503 N ASP B 15 311.204 -1.994 -4.142 1.00 0.00 N ATOM 1504 CA ASP B 15 311.013 -2.287 -2.725 1.00 0.00 C ATOM 1505 C ASP B 15 312.102 -1.614 -1.903 1.00 0.00 C ATOM 1506 O ASP B 15 312.885 -2.284 -1.233 1.00 0.00 O ATOM 1507 CB ASP B 15 311.036 -3.792 -2.479 1.00 0.00 C ATOM 1508 CG ASP B 15 309.715 -4.456 -2.815 1.00 0.00 C ATOM 1509 OD1 ASP B 15 308.736 -4.241 -2.071 1.00 0.00 O ATOM 1510 OD2 ASP B 15 309.660 -5.191 -3.823 1.00 0.00 O ATOM 0 H ASP B 15 312.140 -1.662 -4.376 1.00 0.00 H new ATOM 0 HA ASP B 15 310.041 -1.899 -2.421 1.00 0.00 H new ATOM 0 HB2 ASP B 15 311.828 -4.243 -3.077 1.00 0.00 H new ATOM 0 HB3 ASP B 15 311.279 -3.982 -1.434 1.00 0.00 H new ATOM 1515 N HIS B 16 312.142 -0.286 -1.994 1.00 0.00 N ATOM 1516 CA HIS B 16 313.114 0.559 -1.313 1.00 0.00 C ATOM 1517 C HIS B 16 314.295 -0.179 -0.700 1.00 0.00 C ATOM 1518 O HIS B 16 314.144 -1.137 0.052 1.00 0.00 O ATOM 1519 CB HIS B 16 312.450 1.379 -0.227 1.00 0.00 C ATOM 1520 CG HIS B 16 311.244 2.137 -0.674 1.00 0.00 C ATOM 1521 ND1 HIS B 16 309.959 1.826 -0.281 1.00 0.00 N ATOM 1522 CD2 HIS B 16 311.141 3.226 -1.470 1.00 0.00 C ATOM 1523 CE1 HIS B 16 309.116 2.692 -0.817 1.00 0.00 C ATOM 1524 NE2 HIS B 16 309.808 3.552 -1.541 1.00 0.00 N ATOM 0 H HIS B 16 311.479 0.244 -2.560 1.00 0.00 H new ATOM 0 HA HIS B 16 313.513 1.194 -2.104 1.00 0.00 H new ATOM 0 HB2 HIS B 16 312.164 0.715 0.589 1.00 0.00 H new ATOM 0 HB3 HIS B 16 313.178 2.084 0.175 1.00 0.00 H new ATOM 0 HD2 HIS B 16 311.954 3.742 -1.958 1.00 0.00 H new ATOM 0 HE1 HIS B 16 308.044 2.695 -0.685 1.00 0.00 H new ATOM 0 HE2 HIS B 16 309.416 4.333 -2.068 1.00 0.00 H new ATOM 1533 N ILE B 17 315.467 0.357 -0.971 1.00 0.00 N ATOM 1534 CA ILE B 17 316.708 -0.144 -0.407 1.00 0.00 C ATOM 1535 C ILE B 17 317.492 1.030 0.104 1.00 0.00 C ATOM 1536 O ILE B 17 317.321 2.146 -0.374 1.00 0.00 O ATOM 1537 CB ILE B 17 317.614 -0.915 -1.396 1.00 0.00 C ATOM 1538 CG1 ILE B 17 318.172 0.013 -2.484 1.00 0.00 C ATOM 1539 CG2 ILE B 17 316.868 -2.089 -2.014 1.00 0.00 C ATOM 1540 CD1 ILE B 17 319.036 -0.690 -3.515 1.00 0.00 C ATOM 0 H ILE B 17 315.588 1.157 -1.592 1.00 0.00 H new ATOM 0 HA ILE B 17 316.422 -0.854 0.369 1.00 0.00 H new ATOM 0 HB ILE B 17 318.459 -1.309 -0.832 1.00 0.00 H new ATOM 0 HG12 ILE B 17 317.340 0.499 -2.994 1.00 0.00 H new ATOM 0 HG13 ILE B 17 318.759 0.800 -2.010 1.00 0.00 H new ATOM 0 HG21 ILE B 17 317.526 -2.615 -2.706 1.00 0.00 H new ATOM 0 HG22 ILE B 17 316.548 -2.772 -1.227 1.00 0.00 H new ATOM 0 HG23 ILE B 17 315.994 -1.722 -2.553 1.00 0.00 H new ATOM 0 HD11 ILE B 17 319.391 0.035 -4.248 1.00 0.00 H new ATOM 0 HD12 ILE B 17 319.890 -1.153 -3.020 1.00 0.00 H new ATOM 0 HD13 ILE B 17 318.449 -1.458 -4.019 1.00 0.00 H new ATOM 1552 N ASN B 18 318.365 0.789 1.044 1.00 0.00 N ATOM 1553 CA ASN B 18 319.177 1.864 1.565 1.00 0.00 C ATOM 1554 C ASN B 18 320.429 1.964 0.708 1.00 0.00 C ATOM 1555 O ASN B 18 321.086 0.956 0.446 1.00 0.00 O ATOM 1556 CB ASN B 18 319.548 1.678 3.050 1.00 0.00 C ATOM 1557 CG ASN B 18 319.151 0.326 3.622 1.00 0.00 C ATOM 1558 OD1 ASN B 18 317.877 -0.024 3.501 1.00 0.00 O flip ATOM 1559 ND2 ASN B 18 319.986 -0.395 4.168 1.00 0.00 N flip ATOM 0 H ASN B 18 318.534 -0.126 1.462 1.00 0.00 H new ATOM 0 HA ASN B 18 318.598 2.786 1.520 1.00 0.00 H new ATOM 0 HB2 ASN B 18 320.624 1.807 3.164 1.00 0.00 H new ATOM 0 HB3 ASN B 18 319.069 2.463 3.635 1.00 0.00 H new ATOM 0 HD21 ASN B 18 320.956 -0.088 4.240 1.00 0.00 H new ATOM 0 HD22 ASN B 18 319.708 -1.300 4.548 1.00 0.00 H new ATOM 1566 N LEU B 19 320.759 3.166 0.262 1.00 0.00 N ATOM 1567 CA LEU B 19 321.930 3.350 -0.570 1.00 0.00 C ATOM 1568 C LEU B 19 322.985 4.192 0.115 1.00 0.00 C ATOM 1569 O LEU B 19 322.749 5.322 0.513 1.00 0.00 O ATOM 1570 CB LEU B 19 321.549 3.958 -1.917 1.00 0.00 C ATOM 1571 CG LEU B 19 321.758 2.998 -3.107 1.00 0.00 C ATOM 1572 CD1 LEU B 19 321.717 3.726 -4.437 1.00 0.00 C ATOM 1573 CD2 LEU B 19 323.065 2.214 -2.969 1.00 0.00 C ATOM 0 H LEU B 19 320.236 4.019 0.461 1.00 0.00 H new ATOM 0 HA LEU B 19 322.361 2.364 -0.742 1.00 0.00 H new ATOM 0 HB2 LEU B 19 320.503 4.263 -1.886 1.00 0.00 H new ATOM 0 HB3 LEU B 19 322.139 4.860 -2.080 1.00 0.00 H new ATOM 0 HG LEU B 19 320.929 2.291 -3.088 1.00 0.00 H new ATOM 0 HD11 LEU B 19 321.868 3.013 -5.247 1.00 0.00 H new ATOM 0 HD12 LEU B 19 320.748 4.211 -4.557 1.00 0.00 H new ATOM 0 HD13 LEU B 19 322.505 4.479 -4.464 1.00 0.00 H new ATOM 0 HD21 LEU B 19 323.181 1.547 -3.823 1.00 0.00 H new ATOM 0 HD22 LEU B 19 323.904 2.909 -2.934 1.00 0.00 H new ATOM 0 HD23 LEU B 19 323.042 1.627 -2.051 1.00 0.00 H new ATOM 1585 N LYS B 20 324.157 3.623 0.247 1.00 0.00 N ATOM 1586 CA LYS B 20 325.260 4.298 0.889 1.00 0.00 C ATOM 1587 C LYS B 20 326.040 5.160 -0.099 1.00 0.00 C ATOM 1588 O LYS B 20 326.282 4.746 -1.225 1.00 0.00 O ATOM 1589 CB LYS B 20 326.199 3.259 1.473 1.00 0.00 C ATOM 1590 CG LYS B 20 326.319 3.384 2.958 1.00 0.00 C ATOM 1591 CD LYS B 20 327.116 2.273 3.628 1.00 0.00 C ATOM 1592 CE LYS B 20 327.447 1.105 2.716 1.00 0.00 C ATOM 1593 NZ LYS B 20 328.772 0.508 3.042 1.00 0.00 N ATOM 0 H LYS B 20 324.374 2.683 -0.085 1.00 0.00 H new ATOM 0 HA LYS B 20 324.857 4.945 1.668 1.00 0.00 H new ATOM 0 HB2 LYS B 20 325.838 2.262 1.221 1.00 0.00 H new ATOM 0 HB3 LYS B 20 327.184 3.365 1.019 1.00 0.00 H new ATOM 0 HG2 LYS B 20 326.787 4.340 3.192 1.00 0.00 H new ATOM 0 HG3 LYS B 20 325.318 3.405 3.389 1.00 0.00 H new ATOM 0 HD2 LYS B 20 328.045 2.691 4.016 1.00 0.00 H new ATOM 0 HD3 LYS B 20 326.552 1.902 4.484 1.00 0.00 H new ATOM 0 HE2 LYS B 20 326.673 0.343 2.806 1.00 0.00 H new ATOM 0 HE3 LYS B 20 327.445 1.441 1.679 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 329.316 0.372 2.166 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 329.293 1.145 3.678 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 328.633 -0.410 3.510 1.00 0.00 H new ATOM 1607 N VAL B 21 326.439 6.352 0.319 1.00 0.00 N ATOM 1608 CA VAL B 21 327.212 7.252 -0.534 1.00 0.00 C ATOM 1609 C VAL B 21 328.458 7.708 0.233 1.00 0.00 C ATOM 1610 O VAL B 21 328.375 8.051 1.405 1.00 0.00 O ATOM 1611 CB VAL B 21 326.395 8.497 -0.947 1.00 0.00 C ATOM 1612 CG1 VAL B 21 326.875 9.020 -2.288 1.00 0.00 C ATOM 1613 CG2 VAL B 21 324.905 8.179 -0.998 1.00 0.00 C ATOM 0 H VAL B 21 326.241 6.723 1.248 1.00 0.00 H new ATOM 0 HA VAL B 21 327.484 6.711 -1.441 1.00 0.00 H new ATOM 0 HB VAL B 21 326.548 9.271 -0.195 1.00 0.00 H new ATOM 0 HG11 VAL B 21 326.291 9.897 -2.567 1.00 0.00 H new ATOM 0 HG12 VAL B 21 327.928 9.293 -2.216 1.00 0.00 H new ATOM 0 HG13 VAL B 21 326.752 8.246 -3.046 1.00 0.00 H new ATOM 0 HG21 VAL B 21 324.352 9.072 -1.291 1.00 0.00 H new ATOM 0 HG22 VAL B 21 324.727 7.387 -1.725 1.00 0.00 H new ATOM 0 HG23 VAL B 21 324.569 7.851 -0.014 1.00 0.00 H new ATOM 1623 N ALA B 22 329.612 7.703 -0.407 1.00 0.00 N ATOM 1624 CA ALA B 22 330.840 8.125 0.263 1.00 0.00 C ATOM 1625 C ALA B 22 331.311 9.447 -0.338 1.00 0.00 C ATOM 1626 O ALA B 22 331.415 9.558 -1.549 1.00 0.00 O ATOM 1627 CB ALA B 22 331.891 7.030 0.148 1.00 0.00 C ATOM 0 H ALA B 22 329.731 7.416 -1.379 1.00 0.00 H new ATOM 0 HA ALA B 22 330.658 8.288 1.325 1.00 0.00 H new ATOM 0 HB1 ALA B 22 332.805 7.349 0.649 1.00 0.00 H new ATOM 0 HB2 ALA B 22 331.520 6.119 0.616 1.00 0.00 H new ATOM 0 HB3 ALA B 22 332.102 6.837 -0.904 1.00 0.00 H new ATOM 1633 N GLY B 23 331.542 10.473 0.491 1.00 0.00 N ATOM 1634 CA GLY B 23 331.927 11.768 -0.067 1.00 0.00 C ATOM 1635 C GLY B 23 333.119 12.446 0.579 1.00 0.00 C ATOM 1636 O GLY B 23 332.957 13.422 1.311 1.00 0.00 O ATOM 0 H GLY B 23 331.472 10.435 1.508 1.00 0.00 H new ATOM 0 HA2 GLY B 23 332.142 11.634 -1.127 1.00 0.00 H new ATOM 0 HA3 GLY B 23 331.071 12.439 0.003 1.00 0.00 H new ATOM 1640 N GLN B 24 334.320 11.964 0.271 1.00 0.00 N ATOM 1641 CA GLN B 24 335.556 12.562 0.790 1.00 0.00 C ATOM 1642 C GLN B 24 335.632 12.567 2.317 1.00 0.00 C ATOM 1643 O GLN B 24 336.715 12.717 2.884 1.00 0.00 O ATOM 1644 CB GLN B 24 335.703 13.996 0.284 1.00 0.00 C ATOM 1645 CG GLN B 24 335.149 14.224 -1.109 1.00 0.00 C ATOM 1646 CD GLN B 24 335.917 15.290 -1.866 1.00 0.00 C ATOM 1647 OE1 GLN B 24 335.859 16.471 -1.526 1.00 0.00 O ATOM 1648 NE2 GLN B 24 336.645 14.876 -2.897 1.00 0.00 N ATOM 0 H GLN B 24 334.468 11.159 -0.337 1.00 0.00 H new ATOM 0 HA GLN B 24 336.370 11.937 0.423 1.00 0.00 H new ATOM 0 HB2 GLN B 24 335.198 14.668 0.978 1.00 0.00 H new ATOM 0 HB3 GLN B 24 336.759 14.265 0.291 1.00 0.00 H new ATOM 0 HG2 GLN B 24 335.182 13.289 -1.668 1.00 0.00 H new ATOM 0 HG3 GLN B 24 334.101 14.516 -1.038 1.00 0.00 H new ATOM 0 HE21 GLN B 24 336.664 13.886 -3.143 1.00 0.00 H new ATOM 0 HE22 GLN B 24 337.185 15.548 -3.442 1.00 0.00 H new ATOM 1657 N ASP B 25 334.495 12.420 2.984 1.00 0.00 N ATOM 1658 CA ASP B 25 334.464 12.428 4.441 1.00 0.00 C ATOM 1659 C ASP B 25 335.339 11.324 5.025 1.00 0.00 C ATOM 1660 O ASP B 25 335.620 11.317 6.224 1.00 0.00 O ATOM 1661 CB ASP B 25 333.028 12.269 4.939 1.00 0.00 C ATOM 1662 CG ASP B 25 332.880 12.633 6.403 1.00 0.00 C ATOM 1663 OD1 ASP B 25 333.174 13.794 6.759 1.00 0.00 O ATOM 1664 OD2 ASP B 25 332.470 11.758 7.194 1.00 0.00 O ATOM 0 H ASP B 25 333.585 12.294 2.541 1.00 0.00 H new ATOM 0 HA ASP B 25 334.860 13.387 4.776 1.00 0.00 H new ATOM 0 HB2 ASP B 25 332.368 12.899 4.342 1.00 0.00 H new ATOM 0 HB3 ASP B 25 332.707 11.238 4.789 1.00 0.00 H new ATOM 1669 N GLY B 26 335.749 10.377 4.185 1.00 0.00 N ATOM 1670 CA GLY B 26 336.561 9.277 4.661 1.00 0.00 C ATOM 1671 C GLY B 26 335.700 8.145 5.181 1.00 0.00 C ATOM 1672 O GLY B 26 336.205 7.093 5.570 1.00 0.00 O ATOM 0 H GLY B 26 335.533 10.354 3.188 1.00 0.00 H new ATOM 0 HA2 GLY B 26 337.195 8.913 3.852 1.00 0.00 H new ATOM 0 HA3 GLY B 26 337.223 9.627 5.453 1.00 0.00 H new ATOM 1676 N SER B 27 334.389 8.373 5.186 1.00 0.00 N ATOM 1677 CA SER B 27 333.435 7.387 5.656 1.00 0.00 C ATOM 1678 C SER B 27 332.340 7.187 4.625 1.00 0.00 C ATOM 1679 O SER B 27 332.619 7.110 3.428 1.00 0.00 O ATOM 1680 CB SER B 27 332.856 7.818 7.008 1.00 0.00 C ATOM 1681 OG SER B 27 332.296 6.714 7.698 1.00 0.00 O ATOM 0 H SER B 27 333.965 9.244 4.865 1.00 0.00 H new ATOM 0 HA SER B 27 333.943 6.433 5.796 1.00 0.00 H new ATOM 0 HB2 SER B 27 333.640 8.271 7.615 1.00 0.00 H new ATOM 0 HB3 SER B 27 332.092 8.580 6.854 1.00 0.00 H new ATOM 0 HG SER B 27 331.935 7.015 8.558 1.00 0.00 H new ATOM 1687 N VAL B 28 331.103 7.081 5.075 1.00 0.00 N ATOM 1688 CA VAL B 28 330.007 6.866 4.163 1.00 0.00 C ATOM 1689 C VAL B 28 328.690 7.403 4.714 1.00 0.00 C ATOM 1690 O VAL B 28 328.527 7.574 5.922 1.00 0.00 O ATOM 1691 CB VAL B 28 329.895 5.360 3.857 1.00 0.00 C ATOM 1692 CG1 VAL B 28 329.927 4.553 5.146 1.00 0.00 C ATOM 1693 CG2 VAL B 28 328.645 5.047 3.045 1.00 0.00 C ATOM 0 H VAL B 28 330.839 7.140 6.058 1.00 0.00 H new ATOM 0 HA VAL B 28 330.210 7.416 3.244 1.00 0.00 H new ATOM 0 HB VAL B 28 330.755 5.075 3.251 1.00 0.00 H new ATOM 0 HG11 VAL B 28 329.847 3.491 4.913 1.00 0.00 H new ATOM 0 HG12 VAL B 28 330.865 4.740 5.669 1.00 0.00 H new ATOM 0 HG13 VAL B 28 329.092 4.849 5.781 1.00 0.00 H new ATOM 0 HG21 VAL B 28 328.598 3.976 2.847 1.00 0.00 H new ATOM 0 HG22 VAL B 28 327.761 5.352 3.606 1.00 0.00 H new ATOM 0 HG23 VAL B 28 328.680 5.589 2.100 1.00 0.00 H new ATOM 1703 N VAL B 29 327.733 7.587 3.817 1.00 0.00 N ATOM 1704 CA VAL B 29 326.396 8.012 4.188 1.00 0.00 C ATOM 1705 C VAL B 29 325.448 6.936 3.742 1.00 0.00 C ATOM 1706 O VAL B 29 325.734 6.210 2.796 1.00 0.00 O ATOM 1707 CB VAL B 29 325.941 9.343 3.567 1.00 0.00 C ATOM 1708 CG1 VAL B 29 326.292 10.510 4.466 1.00 0.00 C ATOM 1709 CG2 VAL B 29 326.513 9.509 2.181 1.00 0.00 C ATOM 0 H VAL B 29 327.863 7.446 2.815 1.00 0.00 H new ATOM 0 HA VAL B 29 326.403 8.174 5.266 1.00 0.00 H new ATOM 0 HB VAL B 29 324.855 9.325 3.473 1.00 0.00 H new ATOM 0 HG11 VAL B 29 325.959 11.439 4.003 1.00 0.00 H new ATOM 0 HG12 VAL B 29 325.798 10.388 5.430 1.00 0.00 H new ATOM 0 HG13 VAL B 29 327.372 10.544 4.613 1.00 0.00 H new ATOM 0 HG21 VAL B 29 326.178 10.457 1.760 1.00 0.00 H new ATOM 0 HG22 VAL B 29 327.602 9.499 2.233 1.00 0.00 H new ATOM 0 HG23 VAL B 29 326.173 8.691 1.547 1.00 0.00 H new ATOM 1719 N GLN B 30 324.344 6.813 4.426 1.00 0.00 N ATOM 1720 CA GLN B 30 323.376 5.785 4.091 1.00 0.00 C ATOM 1721 C GLN B 30 322.051 6.392 3.662 1.00 0.00 C ATOM 1722 O GLN B 30 321.424 7.151 4.399 1.00 0.00 O ATOM 1723 CB GLN B 30 323.206 4.860 5.276 1.00 0.00 C ATOM 1724 CG GLN B 30 323.919 3.533 5.122 1.00 0.00 C ATOM 1725 CD GLN B 30 323.614 2.569 6.252 1.00 0.00 C ATOM 1726 OE1 GLN B 30 322.676 1.776 6.171 1.00 0.00 O ATOM 1727 NE2 GLN B 30 324.407 2.634 7.315 1.00 0.00 N ATOM 0 H GLN B 30 324.086 7.404 5.216 1.00 0.00 H new ATOM 0 HA GLN B 30 323.744 5.209 3.242 1.00 0.00 H new ATOM 0 HB2 GLN B 30 323.577 5.359 6.171 1.00 0.00 H new ATOM 0 HB3 GLN B 30 322.143 4.675 5.431 1.00 0.00 H new ATOM 0 HG2 GLN B 30 323.630 3.078 4.174 1.00 0.00 H new ATOM 0 HG3 GLN B 30 324.994 3.706 5.078 1.00 0.00 H new ATOM 0 HE21 GLN B 30 325.173 3.307 7.339 1.00 0.00 H new ATOM 0 HE22 GLN B 30 324.250 2.011 8.107 1.00 0.00 H new ATOM 1736 N PHE B 31 321.660 6.059 2.445 1.00 0.00 N ATOM 1737 CA PHE B 31 320.440 6.549 1.838 1.00 0.00 C ATOM 1738 C PHE B 31 319.390 5.468 1.812 1.00 0.00 C ATOM 1739 O PHE B 31 319.686 4.306 2.046 1.00 0.00 O ATOM 1740 CB PHE B 31 320.733 7.002 0.397 1.00 0.00 C ATOM 1741 CG PHE B 31 321.491 8.293 0.348 1.00 0.00 C ATOM 1742 CD1 PHE B 31 322.613 8.474 1.140 1.00 0.00 C ATOM 1743 CD2 PHE B 31 321.078 9.332 -0.465 1.00 0.00 C ATOM 1744 CE1 PHE B 31 323.306 9.661 1.119 1.00 0.00 C ATOM 1745 CE2 PHE B 31 321.776 10.522 -0.491 1.00 0.00 C ATOM 1746 CZ PHE B 31 322.889 10.685 0.303 1.00 0.00 C ATOM 0 H PHE B 31 322.191 5.430 1.843 1.00 0.00 H new ATOM 0 HA PHE B 31 320.069 7.388 2.427 1.00 0.00 H new ATOM 0 HB2 PHE B 31 321.305 6.228 -0.115 1.00 0.00 H new ATOM 0 HB3 PHE B 31 319.793 7.115 -0.144 1.00 0.00 H new ATOM 0 HD1 PHE B 31 322.947 7.673 1.782 1.00 0.00 H new ATOM 0 HD2 PHE B 31 320.202 9.211 -1.085 1.00 0.00 H new ATOM 0 HE1 PHE B 31 324.178 9.789 1.744 1.00 0.00 H new ATOM 0 HE2 PHE B 31 321.449 11.326 -1.134 1.00 0.00 H new ATOM 0 HZ PHE B 31 323.434 11.617 0.284 1.00 0.00 H new ATOM 1756 N LYS B 32 318.181 5.855 1.469 1.00 0.00 N ATOM 1757 CA LYS B 32 317.088 4.922 1.320 1.00 0.00 C ATOM 1758 C LYS B 32 316.433 5.268 0.007 1.00 0.00 C ATOM 1759 O LYS B 32 315.833 6.329 -0.159 1.00 0.00 O ATOM 1760 CB LYS B 32 316.107 4.962 2.485 1.00 0.00 C ATOM 1761 CG LYS B 32 314.841 4.143 2.254 1.00 0.00 C ATOM 1762 CD LYS B 32 313.605 4.846 2.802 1.00 0.00 C ATOM 1763 CE LYS B 32 313.681 5.047 4.310 1.00 0.00 C ATOM 1764 NZ LYS B 32 312.584 5.921 4.810 1.00 0.00 N ATOM 0 H LYS B 32 317.929 6.826 1.286 1.00 0.00 H new ATOM 0 HA LYS B 32 317.454 3.895 1.324 1.00 0.00 H new ATOM 0 HB2 LYS B 32 316.607 4.595 3.381 1.00 0.00 H new ATOM 0 HB3 LYS B 32 315.828 5.998 2.677 1.00 0.00 H new ATOM 0 HG2 LYS B 32 314.714 3.964 1.186 1.00 0.00 H new ATOM 0 HG3 LYS B 32 314.946 3.168 2.731 1.00 0.00 H new ATOM 0 HD2 LYS B 32 313.492 5.814 2.313 1.00 0.00 H new ATOM 0 HD3 LYS B 32 312.718 4.261 2.559 1.00 0.00 H new ATOM 0 HE2 LYS B 32 313.629 4.079 4.808 1.00 0.00 H new ATOM 0 HE3 LYS B 32 314.643 5.488 4.569 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 312.671 6.033 5.840 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 312.648 6.853 4.354 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 311.665 5.488 4.586 1.00 0.00 H new ATOM 1778 N ILE B 33 316.624 4.381 -0.935 1.00 0.00 N ATOM 1779 CA ILE B 33 316.135 4.579 -2.273 1.00 0.00 C ATOM 1780 C ILE B 33 315.670 3.277 -2.884 1.00 0.00 C ATOM 1781 O ILE B 33 316.356 2.262 -2.803 1.00 0.00 O ATOM 1782 CB ILE B 33 317.253 5.182 -3.153 1.00 0.00 C ATOM 1783 CG1 ILE B 33 316.711 5.496 -4.548 1.00 0.00 C ATOM 1784 CG2 ILE B 33 318.426 4.217 -3.239 1.00 0.00 C ATOM 1785 CD1 ILE B 33 317.286 6.750 -5.163 1.00 0.00 C ATOM 0 H ILE B 33 317.123 3.502 -0.796 1.00 0.00 H new ATOM 0 HA ILE B 33 315.287 5.262 -2.224 1.00 0.00 H new ATOM 0 HB ILE B 33 317.601 6.111 -2.700 1.00 0.00 H new ATOM 0 HG12 ILE B 33 316.920 4.652 -5.206 1.00 0.00 H new ATOM 0 HG13 ILE B 33 315.627 5.596 -4.491 1.00 0.00 H new ATOM 0 HG21 ILE B 33 319.209 4.651 -3.861 1.00 0.00 H new ATOM 0 HG22 ILE B 33 318.818 4.031 -2.239 1.00 0.00 H new ATOM 0 HG23 ILE B 33 318.092 3.277 -3.678 1.00 0.00 H new ATOM 0 HD11 ILE B 33 316.852 6.903 -6.151 1.00 0.00 H new ATOM 0 HD12 ILE B 33 317.055 7.606 -4.528 1.00 0.00 H new ATOM 0 HD13 ILE B 33 318.367 6.648 -5.254 1.00 0.00 H new ATOM 1797 N LYS B 34 314.508 3.314 -3.508 1.00 0.00 N ATOM 1798 CA LYS B 34 313.974 2.133 -4.145 1.00 0.00 C ATOM 1799 C LYS B 34 314.830 1.761 -5.334 1.00 0.00 C ATOM 1800 O LYS B 34 315.664 2.545 -5.788 1.00 0.00 O ATOM 1801 CB LYS B 34 312.525 2.354 -4.554 1.00 0.00 C ATOM 1802 CG LYS B 34 311.828 1.103 -5.078 1.00 0.00 C ATOM 1803 CD LYS B 34 310.318 1.291 -5.224 1.00 0.00 C ATOM 1804 CE LYS B 34 309.795 2.435 -4.367 1.00 0.00 C ATOM 1805 NZ LYS B 34 308.306 2.501 -4.362 1.00 0.00 N ATOM 0 H LYS B 34 313.922 4.145 -3.585 1.00 0.00 H new ATOM 0 HA LYS B 34 313.993 1.305 -3.436 1.00 0.00 H new ATOM 0 HB2 LYS B 34 311.970 2.733 -3.696 1.00 0.00 H new ATOM 0 HB3 LYS B 34 312.489 3.126 -5.323 1.00 0.00 H new ATOM 0 HG2 LYS B 34 312.252 0.833 -6.045 1.00 0.00 H new ATOM 0 HG3 LYS B 34 312.023 0.272 -4.401 1.00 0.00 H new ATOM 0 HD2 LYS B 34 310.077 1.483 -6.270 1.00 0.00 H new ATOM 0 HD3 LYS B 34 309.810 0.368 -4.944 1.00 0.00 H new ATOM 0 HE2 LYS B 34 310.155 2.315 -3.345 1.00 0.00 H new ATOM 0 HE3 LYS B 34 310.197 3.378 -4.738 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 308.000 3.460 -4.625 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 307.926 1.816 -5.046 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 307.952 2.273 -3.411 1.00 0.00 H new ATOM 1819 N ARG B 35 314.643 0.552 -5.813 1.00 0.00 N ATOM 1820 CA ARG B 35 315.417 0.051 -6.925 1.00 0.00 C ATOM 1821 C ARG B 35 315.244 0.910 -8.173 1.00 0.00 C ATOM 1822 O ARG B 35 316.150 1.643 -8.563 1.00 0.00 O ATOM 1823 CB ARG B 35 315.010 -1.385 -7.216 1.00 0.00 C ATOM 1824 CG ARG B 35 315.545 -2.378 -6.203 1.00 0.00 C ATOM 1825 CD ARG B 35 316.802 -3.078 -6.693 1.00 0.00 C ATOM 1826 NE ARG B 35 316.633 -3.667 -8.019 1.00 0.00 N ATOM 1827 CZ ARG B 35 317.542 -4.446 -8.603 1.00 0.00 C ATOM 1828 NH1 ARG B 35 318.678 -4.734 -7.980 1.00 0.00 N ATOM 1829 NH2 ARG B 35 317.316 -4.937 -9.814 1.00 0.00 N ATOM 0 H ARG B 35 313.956 -0.107 -5.446 1.00 0.00 H new ATOM 0 HA ARG B 35 316.471 0.090 -6.649 1.00 0.00 H new ATOM 0 HB2 ARG B 35 313.922 -1.449 -7.238 1.00 0.00 H new ATOM 0 HB3 ARG B 35 315.366 -1.662 -8.208 1.00 0.00 H new ATOM 0 HG2 ARG B 35 315.761 -1.860 -5.268 1.00 0.00 H new ATOM 0 HG3 ARG B 35 314.778 -3.122 -5.986 1.00 0.00 H new ATOM 0 HD2 ARG B 35 317.625 -2.364 -6.718 1.00 0.00 H new ATOM 0 HD3 ARG B 35 317.079 -3.859 -5.985 1.00 0.00 H new ATOM 0 HE ARG B 35 315.770 -3.471 -8.526 1.00 0.00 H new ATOM 0 HH11 ARG B 35 318.859 -4.358 -7.049 1.00 0.00 H new ATOM 0 HH12 ARG B 35 319.370 -5.331 -8.432 1.00 0.00 H new ATOM 0 HH21 ARG B 35 316.446 -4.718 -10.299 1.00 0.00 H new ATOM 0 HH22 ARG B 35 318.013 -5.533 -10.261 1.00 0.00 H new ATOM 1843 N HIS B 36 314.091 0.788 -8.815 1.00 0.00 N ATOM 1844 CA HIS B 36 313.814 1.525 -10.044 1.00 0.00 C ATOM 1845 C HIS B 36 313.765 3.045 -9.833 1.00 0.00 C ATOM 1846 O HIS B 36 313.491 3.789 -10.775 1.00 0.00 O ATOM 1847 CB HIS B 36 312.503 1.027 -10.662 1.00 0.00 C ATOM 1848 CG HIS B 36 312.127 1.731 -11.929 1.00 0.00 C ATOM 1849 ND1 HIS B 36 310.835 2.108 -12.227 1.00 0.00 N ATOM 1850 CD2 HIS B 36 312.884 2.126 -12.980 1.00 0.00 C ATOM 1851 CE1 HIS B 36 310.813 2.703 -13.407 1.00 0.00 C ATOM 1852 NE2 HIS B 36 312.044 2.727 -13.884 1.00 0.00 N ATOM 0 H HIS B 36 313.329 0.184 -8.506 1.00 0.00 H new ATOM 0 HA HIS B 36 314.642 1.335 -10.728 1.00 0.00 H new ATOM 0 HB2 HIS B 36 312.589 -0.041 -10.862 1.00 0.00 H new ATOM 0 HB3 HIS B 36 311.700 1.151 -9.936 1.00 0.00 H new ATOM 0 HD2 HIS B 36 313.950 1.993 -13.087 1.00 0.00 H new ATOM 0 HE1 HIS B 36 309.937 3.102 -13.898 1.00 0.00 H new ATOM 0 HE2 HIS B 36 312.325 3.127 -14.779 1.00 0.00 H new ATOM 1861 N THR B 37 314.022 3.513 -8.611 1.00 0.00 N ATOM 1862 CA THR B 37 313.987 4.949 -8.339 1.00 0.00 C ATOM 1863 C THR B 37 315.265 5.645 -8.759 1.00 0.00 C ATOM 1864 O THR B 37 316.325 5.435 -8.168 1.00 0.00 O ATOM 1865 CB THR B 37 313.757 5.245 -6.862 1.00 0.00 C ATOM 1866 OG1 THR B 37 312.475 4.817 -6.458 1.00 0.00 O ATOM 1867 CG2 THR B 37 313.867 6.724 -6.541 1.00 0.00 C ATOM 0 H THR B 37 314.253 2.930 -7.807 1.00 0.00 H new ATOM 0 HA THR B 37 313.153 5.331 -8.928 1.00 0.00 H new ATOM 0 HB THR B 37 314.536 4.703 -6.326 1.00 0.00 H new ATOM 0 HG1 THR B 37 312.286 5.154 -5.557 1.00 0.00 H new ATOM 0 HG21 THR B 37 313.695 6.879 -5.476 1.00 0.00 H new ATOM 0 HG22 THR B 37 314.863 7.080 -6.803 1.00 0.00 H new ATOM 0 HG23 THR B 37 313.122 7.277 -7.113 1.00 0.00 H new ATOM 1875 N PRO B 38 315.162 6.524 -9.761 1.00 0.00 N ATOM 1876 CA PRO B 38 316.278 7.313 -10.245 1.00 0.00 C ATOM 1877 C PRO B 38 317.223 7.694 -9.118 1.00 0.00 C ATOM 1878 O PRO B 38 316.791 7.913 -7.987 1.00 0.00 O ATOM 1879 CB PRO B 38 315.601 8.564 -10.792 1.00 0.00 C ATOM 1880 CG PRO B 38 314.160 8.211 -11.015 1.00 0.00 C ATOM 1881 CD PRO B 38 313.928 6.838 -10.480 1.00 0.00 C ATOM 0 HA PRO B 38 316.882 6.775 -10.976 1.00 0.00 H new ATOM 0 HB2 PRO B 38 315.692 9.392 -10.089 1.00 0.00 H new ATOM 0 HB3 PRO B 38 316.070 8.882 -11.723 1.00 0.00 H new ATOM 0 HG2 PRO B 38 313.511 8.929 -10.514 1.00 0.00 H new ATOM 0 HG3 PRO B 38 313.919 8.251 -12.077 1.00 0.00 H new ATOM 0 HD2 PRO B 38 313.062 6.809 -9.818 1.00 0.00 H new ATOM 0 HD3 PRO B 38 313.741 6.124 -11.282 1.00 0.00 H new ATOM 1889 N LEU B 39 318.507 7.754 -9.415 1.00 0.00 N ATOM 1890 CA LEU B 39 319.485 8.087 -8.399 1.00 0.00 C ATOM 1891 C LEU B 39 319.521 9.578 -8.097 1.00 0.00 C ATOM 1892 O LEU B 39 320.034 9.974 -7.054 1.00 0.00 O ATOM 1893 CB LEU B 39 320.860 7.561 -8.784 1.00 0.00 C ATOM 1894 CG LEU B 39 321.064 6.091 -8.424 1.00 0.00 C ATOM 1895 CD1 LEU B 39 322.300 5.529 -9.123 1.00 0.00 C ATOM 1896 CD2 LEU B 39 321.178 5.936 -6.911 1.00 0.00 C ATOM 0 H LEU B 39 318.894 7.578 -10.342 1.00 0.00 H new ATOM 0 HA LEU B 39 319.177 7.594 -7.477 1.00 0.00 H new ATOM 0 HB2 LEU B 39 321.004 7.689 -9.857 1.00 0.00 H new ATOM 0 HB3 LEU B 39 321.623 8.160 -8.287 1.00 0.00 H new ATOM 0 HG LEU B 39 320.199 5.523 -8.768 1.00 0.00 H new ATOM 0 HD11 LEU B 39 322.426 4.481 -8.852 1.00 0.00 H new ATOM 0 HD12 LEU B 39 322.177 5.613 -10.203 1.00 0.00 H new ATOM 0 HD13 LEU B 39 323.181 6.092 -8.814 1.00 0.00 H new ATOM 0 HD21 LEU B 39 321.323 4.885 -6.663 1.00 0.00 H new ATOM 0 HD22 LEU B 39 322.028 6.515 -6.549 1.00 0.00 H new ATOM 0 HD23 LEU B 39 320.265 6.297 -6.438 1.00 0.00 H new ATOM 1908 N SER B 40 318.990 10.421 -8.986 1.00 0.00 N ATOM 1909 CA SER B 40 318.986 11.866 -8.754 1.00 0.00 C ATOM 1910 C SER B 40 318.365 12.224 -7.407 1.00 0.00 C ATOM 1911 O SER B 40 318.629 13.298 -6.867 1.00 0.00 O ATOM 1912 CB SER B 40 318.210 12.574 -9.869 1.00 0.00 C ATOM 1913 OG SER B 40 319.084 13.293 -10.724 1.00 0.00 O ATOM 0 H SER B 40 318.561 10.131 -9.865 1.00 0.00 H new ATOM 0 HA SER B 40 320.024 12.197 -8.750 1.00 0.00 H new ATOM 0 HB2 SER B 40 317.651 11.840 -10.450 1.00 0.00 H new ATOM 0 HB3 SER B 40 317.481 13.257 -9.432 1.00 0.00 H new ATOM 0 HG SER B 40 319.309 12.741 -11.502 1.00 0.00 H new ATOM 1919 N LYS B 41 317.575 11.316 -6.845 1.00 0.00 N ATOM 1920 CA LYS B 41 316.969 11.529 -5.557 1.00 0.00 C ATOM 1921 C LYS B 41 318.004 11.242 -4.475 1.00 0.00 C ATOM 1922 O LYS B 41 317.904 11.701 -3.337 1.00 0.00 O ATOM 1923 CB LYS B 41 315.808 10.570 -5.429 1.00 0.00 C ATOM 1924 CG LYS B 41 314.503 11.078 -6.011 1.00 0.00 C ATOM 1925 CD LYS B 41 313.807 9.975 -6.787 1.00 0.00 C ATOM 1926 CE LYS B 41 313.818 10.237 -8.280 1.00 0.00 C ATOM 1927 NZ LYS B 41 312.442 10.339 -8.840 1.00 0.00 N ATOM 0 H LYS B 41 317.344 10.420 -7.275 1.00 0.00 H new ATOM 0 HA LYS B 41 316.618 12.556 -5.451 1.00 0.00 H new ATOM 0 HB2 LYS B 41 316.071 9.634 -5.922 1.00 0.00 H new ATOM 0 HB3 LYS B 41 315.656 10.343 -4.374 1.00 0.00 H new ATOM 0 HG2 LYS B 41 313.854 11.434 -5.211 1.00 0.00 H new ATOM 0 HG3 LYS B 41 314.696 11.927 -6.667 1.00 0.00 H new ATOM 0 HD2 LYS B 41 314.297 9.023 -6.582 1.00 0.00 H new ATOM 0 HD3 LYS B 41 312.777 9.884 -6.443 1.00 0.00 H new ATOM 0 HE2 LYS B 41 314.361 11.161 -8.482 1.00 0.00 H new ATOM 0 HE3 LYS B 41 314.356 9.435 -8.785 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 312.494 10.618 -9.840 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 311.966 9.417 -8.762 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 311.903 11.053 -8.309 1.00 0.00 H new ATOM 1941 N LEU B 42 319.001 10.463 -4.881 1.00 0.00 N ATOM 1942 CA LEU B 42 320.100 10.054 -4.035 1.00 0.00 C ATOM 1943 C LEU B 42 321.266 11.042 -4.105 1.00 0.00 C ATOM 1944 O LEU B 42 321.930 11.311 -3.107 1.00 0.00 O ATOM 1945 CB LEU B 42 320.567 8.677 -4.491 1.00 0.00 C ATOM 1946 CG LEU B 42 321.383 7.908 -3.469 1.00 0.00 C ATOM 1947 CD1 LEU B 42 321.096 6.429 -3.563 1.00 0.00 C ATOM 1948 CD2 LEU B 42 322.861 8.185 -3.675 1.00 0.00 C ATOM 0 H LEU B 42 319.062 10.094 -5.830 1.00 0.00 H new ATOM 0 HA LEU B 42 319.757 10.026 -3.001 1.00 0.00 H new ATOM 0 HB2 LEU B 42 319.693 8.083 -4.758 1.00 0.00 H new ATOM 0 HB3 LEU B 42 321.162 8.793 -5.397 1.00 0.00 H new ATOM 0 HG LEU B 42 321.101 8.241 -2.470 1.00 0.00 H new ATOM 0 HD11 LEU B 42 321.691 5.895 -2.822 1.00 0.00 H new ATOM 0 HD12 LEU B 42 320.037 6.251 -3.375 1.00 0.00 H new ATOM 0 HD13 LEU B 42 321.352 6.071 -4.560 1.00 0.00 H new ATOM 0 HD21 LEU B 42 323.441 7.630 -2.938 1.00 0.00 H new ATOM 0 HD22 LEU B 42 323.153 7.872 -4.677 1.00 0.00 H new ATOM 0 HD23 LEU B 42 323.051 9.252 -3.558 1.00 0.00 H new ATOM 1960 N MET B 43 321.538 11.536 -5.307 1.00 0.00 N ATOM 1961 CA MET B 43 322.658 12.447 -5.534 1.00 0.00 C ATOM 1962 C MET B 43 322.544 13.766 -4.766 1.00 0.00 C ATOM 1963 O MET B 43 323.538 14.241 -4.234 1.00 0.00 O ATOM 1964 CB MET B 43 322.822 12.719 -7.030 1.00 0.00 C ATOM 1965 CG MET B 43 323.047 11.457 -7.850 1.00 0.00 C ATOM 1966 SD MET B 43 324.719 11.328 -8.523 1.00 0.00 S ATOM 1967 CE MET B 43 324.679 9.656 -9.166 1.00 0.00 C ATOM 0 H MET B 43 320.997 11.321 -6.144 1.00 0.00 H new ATOM 0 HA MET B 43 323.544 11.944 -5.146 1.00 0.00 H new ATOM 0 HB2 MET B 43 321.933 13.230 -7.399 1.00 0.00 H new ATOM 0 HB3 MET B 43 323.663 13.396 -7.179 1.00 0.00 H new ATOM 0 HG2 MET B 43 322.846 10.586 -7.226 1.00 0.00 H new ATOM 0 HG3 MET B 43 322.330 11.433 -8.671 1.00 0.00 H new ATOM 0 HE1 MET B 43 325.273 9.603 -10.078 1.00 0.00 H new ATOM 0 HE2 MET B 43 325.090 8.971 -8.425 1.00 0.00 H new ATOM 0 HE3 MET B 43 323.649 9.376 -9.387 1.00 0.00 H new ATOM 1977 N LYS B 44 321.347 14.346 -4.704 1.00 0.00 N ATOM 1978 CA LYS B 44 321.160 15.617 -3.985 1.00 0.00 C ATOM 1979 C LYS B 44 321.224 15.424 -2.477 1.00 0.00 C ATOM 1980 O LYS B 44 321.915 16.173 -1.794 1.00 0.00 O ATOM 1981 CB LYS B 44 319.859 16.309 -4.361 1.00 0.00 C ATOM 1982 CG LYS B 44 319.677 17.684 -3.706 1.00 0.00 C ATOM 1983 CD LYS B 44 320.985 18.355 -3.318 1.00 0.00 C ATOM 1984 CE LYS B 44 321.196 19.640 -4.091 1.00 0.00 C ATOM 1985 NZ LYS B 44 320.320 20.741 -3.603 1.00 0.00 N ATOM 0 H LYS B 44 320.502 13.969 -5.133 1.00 0.00 H new ATOM 0 HA LYS B 44 321.985 16.260 -4.292 1.00 0.00 H new ATOM 0 HB2 LYS B 44 319.820 16.425 -5.444 1.00 0.00 H new ATOM 0 HB3 LYS B 44 319.023 15.669 -4.079 1.00 0.00 H new ATOM 0 HG2 LYS B 44 319.135 18.335 -4.392 1.00 0.00 H new ATOM 0 HG3 LYS B 44 319.058 17.573 -2.816 1.00 0.00 H new ATOM 0 HD2 LYS B 44 320.984 18.568 -2.249 1.00 0.00 H new ATOM 0 HD3 LYS B 44 321.815 17.674 -3.507 1.00 0.00 H new ATOM 0 HE2 LYS B 44 322.239 19.944 -4.008 1.00 0.00 H new ATOM 0 HE3 LYS B 44 320.999 19.463 -5.148 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 320.499 21.600 -4.161 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 319.323 20.463 -3.706 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 320.525 20.930 -2.601 1.00 0.00 H new ATOM 1999 N ALA B 45 320.478 14.451 -1.948 1.00 0.00 N ATOM 2000 CA ALA B 45 320.458 14.219 -0.499 1.00 0.00 C ATOM 2001 C ALA B 45 321.851 14.374 0.094 1.00 0.00 C ATOM 2002 O ALA B 45 322.036 15.086 1.078 1.00 0.00 O ATOM 2003 CB ALA B 45 319.908 12.838 -0.155 1.00 0.00 C ATOM 0 H ALA B 45 319.888 13.819 -2.490 1.00 0.00 H new ATOM 0 HA ALA B 45 319.797 14.970 -0.066 1.00 0.00 H new ATOM 0 HB1 ALA B 45 319.910 12.705 0.927 1.00 0.00 H new ATOM 0 HB2 ALA B 45 318.888 12.749 -0.530 1.00 0.00 H new ATOM 0 HB3 ALA B 45 320.533 12.073 -0.616 1.00 0.00 H new ATOM 2009 N TYR B 46 322.829 13.704 -0.505 1.00 0.00 N ATOM 2010 CA TYR B 46 324.195 13.783 -0.013 1.00 0.00 C ATOM 2011 C TYR B 46 324.702 15.208 -0.015 1.00 0.00 C ATOM 2012 O TYR B 46 325.613 15.561 0.730 1.00 0.00 O ATOM 2013 CB TYR B 46 325.146 12.934 -0.848 1.00 0.00 C ATOM 2014 CG TYR B 46 326.375 12.521 -0.077 1.00 0.00 C ATOM 2015 CD1 TYR B 46 326.375 12.543 1.311 1.00 0.00 C ATOM 2016 CD2 TYR B 46 327.527 12.102 -0.726 1.00 0.00 C ATOM 2017 CE1 TYR B 46 327.474 12.161 2.031 1.00 0.00 C ATOM 2018 CE2 TYR B 46 328.641 11.713 -0.010 1.00 0.00 C ATOM 2019 CZ TYR B 46 328.611 11.741 1.371 1.00 0.00 C ATOM 2020 OH TYR B 46 329.719 11.355 2.091 1.00 0.00 O ATOM 0 H TYR B 46 322.702 13.107 -1.322 1.00 0.00 H new ATOM 0 HA TYR B 46 324.172 13.403 1.008 1.00 0.00 H new ATOM 0 HB2 TYR B 46 324.623 12.044 -1.197 1.00 0.00 H new ATOM 0 HB3 TYR B 46 325.447 13.494 -1.733 1.00 0.00 H new ATOM 0 HD1 TYR B 46 325.488 12.869 1.834 1.00 0.00 H new ATOM 0 HD2 TYR B 46 327.553 12.080 -1.805 1.00 0.00 H new ATOM 0 HE1 TYR B 46 327.452 12.188 3.110 1.00 0.00 H new ATOM 0 HE2 TYR B 46 329.532 11.388 -0.527 1.00 0.00 H new ATOM 0 HH TYR B 46 329.670 10.394 2.278 1.00 0.00 H new ATOM 2030 N CYS B 47 324.100 16.018 -0.853 1.00 0.00 N ATOM 2031 CA CYS B 47 324.451 17.414 -0.986 1.00 0.00 C ATOM 2032 C CYS B 47 323.719 18.222 0.066 1.00 0.00 C ATOM 2033 O CYS B 47 324.205 19.247 0.536 1.00 0.00 O ATOM 2034 CB CYS B 47 324.042 17.873 -2.374 1.00 0.00 C ATOM 2035 SG CYS B 47 324.159 16.580 -3.612 1.00 0.00 S ATOM 0 H CYS B 47 323.343 15.723 -1.470 1.00 0.00 H new ATOM 0 HA CYS B 47 325.523 17.554 -0.848 1.00 0.00 H new ATOM 0 HB2 CYS B 47 323.017 18.242 -2.340 1.00 0.00 H new ATOM 0 HB3 CYS B 47 324.672 18.711 -2.673 1.00 0.00 H new ATOM 0 HG CYS B 47 323.616 15.491 -3.155 1.00 0.00 H new ATOM 2041 N GLU B 48 322.563 17.713 0.465 1.00 0.00 N ATOM 2042 CA GLU B 48 321.775 18.333 1.505 1.00 0.00 C ATOM 2043 C GLU B 48 322.285 17.809 2.851 1.00 0.00 C ATOM 2044 O GLU B 48 322.022 18.381 3.909 1.00 0.00 O ATOM 2045 CB GLU B 48 320.286 18.015 1.309 1.00 0.00 C ATOM 2046 CG GLU B 48 319.820 18.071 -0.149 1.00 0.00 C ATOM 2047 CD GLU B 48 318.391 17.593 -0.319 1.00 0.00 C ATOM 2048 OE1 GLU B 48 317.464 18.401 -0.097 1.00 0.00 O ATOM 2049 OE2 GLU B 48 318.199 16.411 -0.675 1.00 0.00 O ATOM 0 H GLU B 48 322.152 16.864 0.076 1.00 0.00 H new ATOM 0 HA GLU B 48 321.876 19.418 1.470 1.00 0.00 H new ATOM 0 HB2 GLU B 48 320.083 17.020 1.706 1.00 0.00 H new ATOM 0 HB3 GLU B 48 319.695 18.719 1.895 1.00 0.00 H new ATOM 0 HG2 GLU B 48 319.904 19.094 -0.515 1.00 0.00 H new ATOM 0 HG3 GLU B 48 320.480 17.458 -0.762 1.00 0.00 H new ATOM 2056 N ARG B 49 323.038 16.704 2.767 1.00 0.00 N ATOM 2057 CA ARG B 49 323.639 16.039 3.902 1.00 0.00 C ATOM 2058 C ARG B 49 324.952 16.712 4.286 1.00 0.00 C ATOM 2059 O ARG B 49 325.199 17.024 5.450 1.00 0.00 O ATOM 2060 CB ARG B 49 323.933 14.604 3.488 1.00 0.00 C ATOM 2061 CG ARG B 49 323.034 13.558 4.111 1.00 0.00 C ATOM 2062 CD ARG B 49 322.704 12.469 3.108 1.00 0.00 C ATOM 2063 NE ARG B 49 321.318 12.577 2.666 1.00 0.00 N ATOM 2064 CZ ARG B 49 320.359 11.724 3.025 1.00 0.00 C ATOM 2065 NH1 ARG B 49 320.644 10.664 3.775 1.00 0.00 N ATOM 2066 NH2 ARG B 49 319.108 11.934 2.639 1.00 0.00 N ATOM 0 H ARG B 49 323.244 16.246 1.879 1.00 0.00 H new ATOM 0 HA ARG B 49 322.962 16.083 4.755 1.00 0.00 H new ATOM 0 HB2 ARG B 49 323.851 14.531 2.404 1.00 0.00 H new ATOM 0 HB3 ARG B 49 324.966 14.372 3.746 1.00 0.00 H new ATOM 0 HG2 ARG B 49 323.524 13.121 4.981 1.00 0.00 H new ATOM 0 HG3 ARG B 49 322.115 14.025 4.464 1.00 0.00 H new ATOM 0 HD2 ARG B 49 323.371 12.544 2.250 1.00 0.00 H new ATOM 0 HD3 ARG B 49 322.872 11.490 3.558 1.00 0.00 H new ATOM 0 HE ARG B 49 321.069 13.349 2.047 1.00 0.00 H new ATOM 0 HH11 ARG B 49 321.603 10.498 4.080 1.00 0.00 H new ATOM 0 HH12 ARG B 49 319.904 10.016 4.045 1.00 0.00 H new ATOM 0 HH21 ARG B 49 318.880 12.748 2.068 1.00 0.00 H new ATOM 0 HH22 ARG B 49 318.373 11.282 2.913 1.00 0.00 H new ATOM 2080 N GLN B 50 325.793 16.912 3.274 1.00 0.00 N ATOM 2081 CA GLN B 50 327.101 17.526 3.451 1.00 0.00 C ATOM 2082 C GLN B 50 327.080 19.001 3.080 1.00 0.00 C ATOM 2083 O GLN B 50 327.882 19.791 3.577 1.00 0.00 O ATOM 2084 CB GLN B 50 328.125 16.829 2.566 1.00 0.00 C ATOM 2085 CG GLN B 50 328.075 15.316 2.604 1.00 0.00 C ATOM 2086 CD GLN B 50 329.233 14.700 1.848 1.00 0.00 C ATOM 2087 OE1 GLN B 50 328.990 14.339 0.596 1.00 0.00 O flip ATOM 2088 NE2 GLN B 50 330.332 14.552 2.382 1.00 0.00 N flip ATOM 0 H GLN B 50 325.585 16.652 2.310 1.00 0.00 H new ATOM 0 HA GLN B 50 327.367 17.426 4.503 1.00 0.00 H new ATOM 0 HB2 GLN B 50 327.978 17.157 1.537 1.00 0.00 H new ATOM 0 HB3 GLN B 50 329.122 17.153 2.864 1.00 0.00 H new ATOM 0 HG2 GLN B 50 328.095 14.977 3.640 1.00 0.00 H new ATOM 0 HG3 GLN B 50 327.135 14.972 2.174 1.00 0.00 H new ATOM 0 HE21 GLN B 50 330.473 14.845 3.349 1.00 0.00 H new ATOM 0 HE22 GLN B 50 331.102 14.136 1.858 1.00 0.00 H new ATOM 2097 N GLY B 51 326.201 19.348 2.152 1.00 0.00 N ATOM 2098 CA GLY B 51 326.139 20.708 1.666 1.00 0.00 C ATOM 2099 C GLY B 51 326.933 20.803 0.386 1.00 0.00 C ATOM 2100 O GLY B 51 327.982 21.444 0.337 1.00 0.00 O ATOM 0 H GLY B 51 325.529 18.710 1.727 1.00 0.00 H new ATOM 0 HA2 GLY B 51 325.103 20.999 1.490 1.00 0.00 H new ATOM 0 HA3 GLY B 51 326.541 21.394 2.412 1.00 0.00 H new ATOM 2104 N LEU B 52 326.445 20.119 -0.645 1.00 0.00 N ATOM 2105 CA LEU B 52 327.115 20.070 -1.933 1.00 0.00 C ATOM 2106 C LEU B 52 326.191 20.540 -3.046 1.00 0.00 C ATOM 2107 O LEU B 52 324.983 20.327 -2.995 1.00 0.00 O ATOM 2108 CB LEU B 52 327.555 18.633 -2.208 1.00 0.00 C ATOM 2109 CG LEU B 52 328.236 17.957 -1.024 1.00 0.00 C ATOM 2110 CD1 LEU B 52 327.819 16.505 -0.894 1.00 0.00 C ATOM 2111 CD2 LEU B 52 329.731 18.081 -1.170 1.00 0.00 C ATOM 0 H LEU B 52 325.576 19.586 -0.608 1.00 0.00 H new ATOM 0 HA LEU B 52 327.980 20.732 -1.905 1.00 0.00 H new ATOM 0 HB2 LEU B 52 326.683 18.046 -2.497 1.00 0.00 H new ATOM 0 HB3 LEU B 52 328.238 18.629 -3.058 1.00 0.00 H new ATOM 0 HG LEU B 52 327.922 18.459 -0.109 1.00 0.00 H new ATOM 0 HD11 LEU B 52 328.325 16.056 -0.039 1.00 0.00 H new ATOM 0 HD12 LEU B 52 326.740 16.448 -0.748 1.00 0.00 H new ATOM 0 HD13 LEU B 52 328.092 15.966 -1.801 1.00 0.00 H new ATOM 0 HD21 LEU B 52 330.220 17.598 -0.324 1.00 0.00 H new ATOM 0 HD22 LEU B 52 330.047 17.600 -2.095 1.00 0.00 H new ATOM 0 HD23 LEU B 52 330.008 19.135 -1.196 1.00 0.00 H new ATOM 2123 N SER B 53 326.750 21.206 -4.038 1.00 0.00 N ATOM 2124 CA SER B 53 325.942 21.714 -5.144 1.00 0.00 C ATOM 2125 C SER B 53 325.194 20.585 -5.873 1.00 0.00 C ATOM 2126 O SER B 53 324.401 20.850 -6.776 1.00 0.00 O ATOM 2127 CB SER B 53 326.808 22.499 -6.132 1.00 0.00 C ATOM 2128 OG SER B 53 328.078 22.800 -5.577 1.00 0.00 O ATOM 0 H SER B 53 327.747 21.409 -4.107 1.00 0.00 H new ATOM 0 HA SER B 53 325.196 22.385 -4.717 1.00 0.00 H new ATOM 0 HB2 SER B 53 326.936 21.920 -7.046 1.00 0.00 H new ATOM 0 HB3 SER B 53 326.301 23.423 -6.409 1.00 0.00 H new ATOM 0 HG SER B 53 328.437 23.607 -6.001 1.00 0.00 H new ATOM 2134 N MET B 54 325.449 19.330 -5.481 1.00 0.00 N ATOM 2135 CA MET B 54 324.799 18.172 -6.103 1.00 0.00 C ATOM 2136 C MET B 54 325.312 17.968 -7.506 1.00 0.00 C ATOM 2137 O MET B 54 326.019 17.006 -7.800 1.00 0.00 O ATOM 2138 CB MET B 54 323.268 18.325 -6.107 1.00 0.00 C ATOM 2139 CG MET B 54 322.562 17.201 -6.834 1.00 0.00 C ATOM 2140 SD MET B 54 320.935 17.679 -7.447 1.00 0.00 S ATOM 2141 CE MET B 54 321.386 18.618 -8.904 1.00 0.00 C ATOM 0 H MET B 54 326.102 19.092 -4.735 1.00 0.00 H new ATOM 0 HA MET B 54 325.046 17.292 -5.509 1.00 0.00 H new ATOM 0 HB2 MET B 54 322.910 18.366 -5.078 1.00 0.00 H new ATOM 0 HB3 MET B 54 323.005 19.274 -6.574 1.00 0.00 H new ATOM 0 HG2 MET B 54 323.178 16.872 -7.671 1.00 0.00 H new ATOM 0 HG3 MET B 54 322.456 16.349 -6.162 1.00 0.00 H new ATOM 0 HE1 MET B 54 320.548 18.634 -9.600 1.00 0.00 H new ATOM 0 HE2 MET B 54 321.638 19.639 -8.616 1.00 0.00 H new ATOM 0 HE3 MET B 54 322.248 18.154 -9.384 1.00 0.00 H new ATOM 2151 N ARG B 55 324.967 18.891 -8.359 1.00 0.00 N ATOM 2152 CA ARG B 55 325.407 18.848 -9.737 1.00 0.00 C ATOM 2153 C ARG B 55 326.931 18.861 -9.781 1.00 0.00 C ATOM 2154 O ARG B 55 327.547 18.351 -10.717 1.00 0.00 O ATOM 2155 CB ARG B 55 324.842 20.051 -10.499 1.00 0.00 C ATOM 2156 CG ARG B 55 324.436 21.205 -9.590 1.00 0.00 C ATOM 2157 CD ARG B 55 324.211 22.488 -10.373 1.00 0.00 C ATOM 2158 NE ARG B 55 325.288 22.743 -11.330 1.00 0.00 N ATOM 2159 CZ ARG B 55 325.167 22.603 -12.650 1.00 0.00 C ATOM 2160 NH1 ARG B 55 324.022 22.199 -13.188 1.00 0.00 N ATOM 2161 NH2 ARG B 55 326.201 22.866 -13.438 1.00 0.00 N ATOM 0 H ARG B 55 324.378 19.691 -8.128 1.00 0.00 H new ATOM 0 HA ARG B 55 325.045 17.935 -10.209 1.00 0.00 H new ATOM 0 HB2 ARG B 55 325.588 20.404 -11.211 1.00 0.00 H new ATOM 0 HB3 ARG B 55 323.975 19.731 -11.077 1.00 0.00 H new ATOM 0 HG2 ARG B 55 323.524 20.942 -9.054 1.00 0.00 H new ATOM 0 HG3 ARG B 55 325.211 21.368 -8.841 1.00 0.00 H new ATOM 0 HD2 ARG B 55 323.261 22.426 -10.904 1.00 0.00 H new ATOM 0 HD3 ARG B 55 324.135 23.327 -9.681 1.00 0.00 H new ATOM 0 HE ARG B 55 326.190 23.048 -10.963 1.00 0.00 H new ATOM 0 HH11 ARG B 55 323.222 21.992 -12.590 1.00 0.00 H new ATOM 0 HH12 ARG B 55 323.942 22.096 -14.200 1.00 0.00 H new ATOM 0 HH21 ARG B 55 327.085 23.174 -13.033 1.00 0.00 H new ATOM 0 HH22 ARG B 55 326.112 22.760 -14.449 1.00 0.00 H new ATOM 2175 N GLN B 56 327.527 19.502 -8.775 1.00 0.00 N ATOM 2176 CA GLN B 56 328.971 19.660 -8.685 1.00 0.00 C ATOM 2177 C GLN B 56 329.727 18.402 -8.253 1.00 0.00 C ATOM 2178 O GLN B 56 330.866 18.224 -8.672 1.00 0.00 O ATOM 2179 CB GLN B 56 329.278 20.786 -7.704 1.00 0.00 C ATOM 2180 CG GLN B 56 329.423 22.148 -8.363 1.00 0.00 C ATOM 2181 CD GLN B 56 330.289 23.096 -7.556 1.00 0.00 C ATOM 2182 OE1 GLN B 56 329.689 24.178 -7.073 1.00 0.00 O flip ATOM 2183 NE2 GLN B 56 331.482 22.859 -7.369 1.00 0.00 N flip ATOM 0 H GLN B 56 327.017 19.926 -8.000 1.00 0.00 H new ATOM 0 HA GLN B 56 329.317 19.885 -9.694 1.00 0.00 H new ATOM 0 HB2 GLN B 56 328.483 20.835 -6.960 1.00 0.00 H new ATOM 0 HB3 GLN B 56 330.199 20.550 -7.171 1.00 0.00 H new ATOM 0 HG2 GLN B 56 329.855 22.023 -9.356 1.00 0.00 H new ATOM 0 HG3 GLN B 56 328.436 22.589 -8.498 1.00 0.00 H new ATOM 0 HE21 GLN B 56 331.902 22.015 -7.759 1.00 0.00 H new ATOM 0 HE22 GLN B 56 332.051 23.506 -6.824 1.00 0.00 H new ATOM 2192 N ILE B 57 329.132 17.528 -7.432 1.00 0.00 N ATOM 2193 CA ILE B 57 329.850 16.333 -7.007 1.00 0.00 C ATOM 2194 C ILE B 57 329.921 15.323 -8.118 1.00 0.00 C ATOM 2195 O ILE B 57 329.286 15.469 -9.162 1.00 0.00 O ATOM 2196 CB ILE B 57 329.254 15.630 -5.772 1.00 0.00 C ATOM 2197 CG1 ILE B 57 327.740 15.589 -5.840 1.00 0.00 C ATOM 2198 CG2 ILE B 57 329.711 16.284 -4.482 1.00 0.00 C ATOM 2199 CD1 ILE B 57 327.102 15.754 -4.491 1.00 0.00 C ATOM 0 H ILE B 57 328.186 17.624 -7.062 1.00 0.00 H new ATOM 0 HA ILE B 57 330.840 16.700 -6.734 1.00 0.00 H new ATOM 0 HB ILE B 57 329.624 14.605 -5.777 1.00 0.00 H new ATOM 0 HG12 ILE B 57 327.387 16.378 -6.505 1.00 0.00 H new ATOM 0 HG13 ILE B 57 327.424 14.641 -6.275 1.00 0.00 H new ATOM 0 HG21 ILE B 57 329.270 15.761 -3.633 1.00 0.00 H new ATOM 0 HG22 ILE B 57 330.798 16.235 -4.414 1.00 0.00 H new ATOM 0 HG23 ILE B 57 329.394 17.327 -4.470 1.00 0.00 H new ATOM 0 HD11 ILE B 57 326.018 15.717 -4.594 1.00 0.00 H new ATOM 0 HD12 ILE B 57 327.431 14.950 -3.832 1.00 0.00 H new ATOM 0 HD13 ILE B 57 327.394 16.714 -4.066 1.00 0.00 H new ATOM 2211 N ARG B 58 330.694 14.291 -7.872 1.00 0.00 N ATOM 2212 CA ARG B 58 330.868 13.222 -8.824 1.00 0.00 C ATOM 2213 C ARG B 58 330.604 11.911 -8.120 1.00 0.00 C ATOM 2214 O ARG B 58 331.309 11.559 -7.175 1.00 0.00 O ATOM 2215 CB ARG B 58 332.283 13.244 -9.391 1.00 0.00 C ATOM 2216 CG ARG B 58 333.039 14.525 -9.076 1.00 0.00 C ATOM 2217 CD ARG B 58 332.543 15.698 -9.897 1.00 0.00 C ATOM 2218 NE ARG B 58 333.194 16.945 -9.513 1.00 0.00 N ATOM 2219 CZ ARG B 58 333.064 18.088 -10.183 1.00 0.00 C ATOM 2220 NH1 ARG B 58 332.288 18.151 -11.257 1.00 0.00 N ATOM 2221 NH2 ARG B 58 333.712 19.171 -9.777 1.00 0.00 N ATOM 0 H ARG B 58 331.219 14.170 -7.006 1.00 0.00 H new ATOM 0 HA ARG B 58 330.172 13.345 -9.654 1.00 0.00 H new ATOM 0 HB2 ARG B 58 332.839 12.395 -8.993 1.00 0.00 H new ATOM 0 HB3 ARG B 58 332.235 13.115 -10.472 1.00 0.00 H new ATOM 0 HG2 ARG B 58 332.934 14.755 -8.016 1.00 0.00 H new ATOM 0 HG3 ARG B 58 334.102 14.374 -9.266 1.00 0.00 H new ATOM 0 HD2 ARG B 58 332.725 15.504 -10.954 1.00 0.00 H new ATOM 0 HD3 ARG B 58 331.465 15.798 -9.772 1.00 0.00 H new ATOM 0 HE ARG B 58 333.784 16.941 -8.681 1.00 0.00 H new ATOM 0 HH11 ARG B 58 331.787 17.321 -11.574 1.00 0.00 H new ATOM 0 HH12 ARG B 58 332.192 19.030 -11.766 1.00 0.00 H new ATOM 0 HH21 ARG B 58 334.310 19.128 -8.952 1.00 0.00 H new ATOM 0 HH22 ARG B 58 333.613 20.047 -10.290 1.00 0.00 H new ATOM 2235 N PHE B 59 329.592 11.191 -8.562 1.00 0.00 N ATOM 2236 CA PHE B 59 329.258 9.925 -7.933 1.00 0.00 C ATOM 2237 C PHE B 59 329.742 8.751 -8.752 1.00 0.00 C ATOM 2238 O PHE B 59 329.897 8.833 -9.971 1.00 0.00 O ATOM 2239 CB PHE B 59 327.750 9.751 -7.745 1.00 0.00 C ATOM 2240 CG PHE B 59 327.136 10.526 -6.618 1.00 0.00 C ATOM 2241 CD1 PHE B 59 327.628 11.760 -6.222 1.00 0.00 C ATOM 2242 CD2 PHE B 59 326.040 10.002 -5.954 1.00 0.00 C ATOM 2243 CE1 PHE B 59 327.033 12.448 -5.183 1.00 0.00 C ATOM 2244 CE2 PHE B 59 325.446 10.686 -4.919 1.00 0.00 C ATOM 2245 CZ PHE B 59 325.945 11.912 -4.530 1.00 0.00 C ATOM 0 H PHE B 59 328.992 11.455 -9.344 1.00 0.00 H new ATOM 0 HA PHE B 59 329.754 9.947 -6.963 1.00 0.00 H new ATOM 0 HB2 PHE B 59 327.253 10.039 -8.671 1.00 0.00 H new ATOM 0 HB3 PHE B 59 327.543 8.693 -7.587 1.00 0.00 H new ATOM 0 HD1 PHE B 59 328.481 12.186 -6.729 1.00 0.00 H new ATOM 0 HD2 PHE B 59 325.646 9.042 -6.253 1.00 0.00 H new ATOM 0 HE1 PHE B 59 327.422 13.409 -4.881 1.00 0.00 H new ATOM 0 HE2 PHE B 59 324.591 10.264 -4.412 1.00 0.00 H new ATOM 0 HZ PHE B 59 325.484 12.450 -3.715 1.00 0.00 H new ATOM 2255 N ARG B 60 329.915 7.641 -8.066 1.00 0.00 N ATOM 2256 CA ARG B 60 330.307 6.399 -8.683 1.00 0.00 C ATOM 2257 C ARG B 60 329.817 5.267 -7.814 1.00 0.00 C ATOM 2258 O ARG B 60 330.067 5.250 -6.610 1.00 0.00 O ATOM 2259 CB ARG B 60 331.825 6.280 -8.867 1.00 0.00 C ATOM 2260 CG ARG B 60 332.216 5.639 -10.184 1.00 0.00 C ATOM 2261 CD ARG B 60 333.510 4.862 -10.060 1.00 0.00 C ATOM 2262 NE ARG B 60 334.034 4.457 -11.362 1.00 0.00 N ATOM 2263 CZ ARG B 60 335.092 3.665 -11.523 1.00 0.00 C ATOM 2264 NH1 ARG B 60 335.739 3.187 -10.468 1.00 0.00 N ATOM 2265 NH2 ARG B 60 335.504 3.351 -12.744 1.00 0.00 N ATOM 0 H ARG B 60 329.786 7.579 -7.056 1.00 0.00 H new ATOM 0 HA ARG B 60 329.865 6.361 -9.678 1.00 0.00 H new ATOM 0 HB2 ARG B 60 332.271 7.273 -8.806 1.00 0.00 H new ATOM 0 HB3 ARG B 60 332.239 5.693 -8.047 1.00 0.00 H new ATOM 0 HG2 ARG B 60 331.420 4.972 -10.516 1.00 0.00 H new ATOM 0 HG3 ARG B 60 332.325 6.410 -10.947 1.00 0.00 H new ATOM 0 HD2 ARG B 60 334.251 5.473 -9.545 1.00 0.00 H new ATOM 0 HD3 ARG B 60 333.344 3.977 -9.445 1.00 0.00 H new ATOM 0 HE ARG B 60 333.561 4.801 -12.198 1.00 0.00 H new ATOM 0 HH11 ARG B 60 335.427 3.426 -9.527 1.00 0.00 H new ATOM 0 HH12 ARG B 60 336.549 2.581 -10.598 1.00 0.00 H new ATOM 0 HH21 ARG B 60 335.010 3.716 -13.558 1.00 0.00 H new ATOM 0 HH22 ARG B 60 336.314 2.744 -12.869 1.00 0.00 H new ATOM 2279 N PHE B 61 329.169 4.301 -8.419 1.00 0.00 N ATOM 2280 CA PHE B 61 328.710 3.151 -7.685 1.00 0.00 C ATOM 2281 C PHE B 61 329.785 2.095 -7.840 1.00 0.00 C ATOM 2282 O PHE B 61 330.554 2.156 -8.794 1.00 0.00 O ATOM 2283 CB PHE B 61 327.347 2.663 -8.198 1.00 0.00 C ATOM 2284 CG PHE B 61 327.065 1.235 -7.846 1.00 0.00 C ATOM 2285 CD1 PHE B 61 326.915 0.865 -6.524 1.00 0.00 C ATOM 2286 CD2 PHE B 61 326.958 0.268 -8.830 1.00 0.00 C ATOM 2287 CE1 PHE B 61 326.662 -0.451 -6.184 1.00 0.00 C ATOM 2288 CE2 PHE B 61 326.703 -1.049 -8.499 1.00 0.00 C ATOM 2289 CZ PHE B 61 326.555 -1.409 -7.174 1.00 0.00 C ATOM 0 H PHE B 61 328.949 4.290 -9.415 1.00 0.00 H new ATOM 0 HA PHE B 61 328.553 3.391 -6.633 1.00 0.00 H new ATOM 0 HB2 PHE B 61 326.562 3.295 -7.784 1.00 0.00 H new ATOM 0 HB3 PHE B 61 327.311 2.778 -9.281 1.00 0.00 H new ATOM 0 HD1 PHE B 61 326.996 1.611 -5.748 1.00 0.00 H new ATOM 0 HD2 PHE B 61 327.075 0.546 -9.867 1.00 0.00 H new ATOM 0 HE1 PHE B 61 326.548 -0.730 -5.147 1.00 0.00 H new ATOM 0 HE2 PHE B 61 326.620 -1.795 -9.275 1.00 0.00 H new ATOM 0 HZ PHE B 61 326.356 -2.438 -6.912 1.00 0.00 H new ATOM 2299 N ASP B 62 329.892 1.173 -6.896 1.00 0.00 N ATOM 2300 CA ASP B 62 330.940 0.161 -6.948 1.00 0.00 C ATOM 2301 C ASP B 62 331.145 -0.401 -8.354 1.00 0.00 C ATOM 2302 O ASP B 62 330.676 -1.493 -8.676 1.00 0.00 O ATOM 2303 CB ASP B 62 330.613 -0.960 -5.989 1.00 0.00 C ATOM 2304 CG ASP B 62 331.791 -1.882 -5.743 1.00 0.00 C ATOM 2305 OD1 ASP B 62 332.103 -2.698 -6.637 1.00 0.00 O ATOM 2306 OD2 ASP B 62 332.402 -1.789 -4.658 1.00 0.00 O ATOM 0 H ASP B 62 329.272 1.103 -6.089 1.00 0.00 H new ATOM 0 HA ASP B 62 331.873 0.645 -6.657 1.00 0.00 H new ATOM 0 HB2 ASP B 62 330.284 -0.536 -5.040 1.00 0.00 H new ATOM 0 HB3 ASP B 62 329.779 -1.540 -6.385 1.00 0.00 H new ATOM 2311 N GLY B 63 331.868 0.356 -9.183 1.00 0.00 N ATOM 2312 CA GLY B 63 332.153 -0.067 -10.540 1.00 0.00 C ATOM 2313 C GLY B 63 331.410 0.727 -11.606 1.00 0.00 C ATOM 2314 O GLY B 63 331.759 0.653 -12.785 1.00 0.00 O ATOM 0 H GLY B 63 332.262 1.262 -8.931 1.00 0.00 H new ATOM 0 HA2 GLY B 63 333.225 0.019 -10.719 1.00 0.00 H new ATOM 0 HA3 GLY B 63 331.896 -1.121 -10.642 1.00 0.00 H new ATOM 2318 N GLN B 64 330.393 1.488 -11.210 1.00 0.00 N ATOM 2319 CA GLN B 64 329.628 2.287 -12.168 1.00 0.00 C ATOM 2320 C GLN B 64 329.700 3.779 -11.838 1.00 0.00 C ATOM 2321 O GLN B 64 329.641 4.163 -10.679 1.00 0.00 O ATOM 2322 CB GLN B 64 328.176 1.837 -12.204 1.00 0.00 C ATOM 2323 CG GLN B 64 327.388 2.452 -13.348 1.00 0.00 C ATOM 2324 CD GLN B 64 326.298 1.540 -13.872 1.00 0.00 C ATOM 2325 OE1 GLN B 64 325.659 0.804 -12.973 1.00 0.00 O flip ATOM 2326 NE2 GLN B 64 326.032 1.499 -15.073 1.00 0.00 N flip ATOM 0 H GLN B 64 330.080 1.569 -10.243 1.00 0.00 H new ATOM 0 HA GLN B 64 330.075 2.132 -13.150 1.00 0.00 H new ATOM 0 HB2 GLN B 64 328.141 0.751 -12.289 1.00 0.00 H new ATOM 0 HB3 GLN B 64 327.698 2.098 -11.260 1.00 0.00 H new ATOM 0 HG2 GLN B 64 326.941 3.388 -13.013 1.00 0.00 H new ATOM 0 HG3 GLN B 64 328.071 2.698 -14.161 1.00 0.00 H new ATOM 0 HE21 GLN B 64 326.549 2.083 -15.730 1.00 0.00 H new ATOM 0 HE22 GLN B 64 325.294 0.881 -15.411 1.00 0.00 H new ATOM 2335 N PRO B 65 329.834 4.643 -12.862 1.00 0.00 N ATOM 2336 CA PRO B 65 329.926 6.102 -12.702 1.00 0.00 C ATOM 2337 C PRO B 65 328.565 6.752 -12.499 1.00 0.00 C ATOM 2338 O PRO B 65 328.454 7.855 -11.966 1.00 0.00 O ATOM 2339 CB PRO B 65 330.501 6.549 -14.056 1.00 0.00 C ATOM 2340 CG PRO B 65 330.907 5.299 -14.748 1.00 0.00 C ATOM 2341 CD PRO B 65 329.917 4.294 -14.276 1.00 0.00 C ATOM 0 HA PRO B 65 330.519 6.381 -11.831 1.00 0.00 H new ATOM 0 HB2 PRO B 65 329.758 7.095 -14.637 1.00 0.00 H new ATOM 0 HB3 PRO B 65 331.352 7.216 -13.920 1.00 0.00 H new ATOM 0 HG2 PRO B 65 330.875 5.413 -15.832 1.00 0.00 H new ATOM 0 HG3 PRO B 65 331.925 5.010 -14.488 1.00 0.00 H new ATOM 0 HD2 PRO B 65 328.957 4.389 -14.783 1.00 0.00 H new ATOM 0 HD3 PRO B 65 330.260 3.271 -14.431 1.00 0.00 H new ATOM 2349 N ILE B 66 327.545 6.036 -12.939 1.00 0.00 N ATOM 2350 CA ILE B 66 326.166 6.458 -12.853 1.00 0.00 C ATOM 2351 C ILE B 66 326.001 7.904 -13.338 1.00 0.00 C ATOM 2352 O ILE B 66 326.986 8.587 -13.615 1.00 0.00 O ATOM 2353 CB ILE B 66 325.641 6.223 -11.434 1.00 0.00 C ATOM 2354 CG1 ILE B 66 326.373 7.081 -10.428 1.00 0.00 C ATOM 2355 CG2 ILE B 66 325.830 4.759 -11.080 1.00 0.00 C ATOM 2356 CD1 ILE B 66 325.782 7.000 -9.040 1.00 0.00 C ATOM 0 H ILE B 66 327.661 5.122 -13.377 1.00 0.00 H new ATOM 0 HA ILE B 66 325.554 5.854 -13.523 1.00 0.00 H new ATOM 0 HB ILE B 66 324.585 6.493 -11.403 1.00 0.00 H new ATOM 0 HG12 ILE B 66 327.418 6.774 -10.390 1.00 0.00 H new ATOM 0 HG13 ILE B 66 326.357 8.118 -10.764 1.00 0.00 H new ATOM 0 HG21 ILE B 66 325.460 4.578 -10.071 1.00 0.00 H new ATOM 0 HG22 ILE B 66 325.277 4.140 -11.786 1.00 0.00 H new ATOM 0 HG23 ILE B 66 326.889 4.507 -11.129 1.00 0.00 H new ATOM 0 HD11 ILE B 66 326.352 7.638 -8.364 1.00 0.00 H new ATOM 0 HD12 ILE B 66 324.745 7.334 -9.066 1.00 0.00 H new ATOM 0 HD13 ILE B 66 325.823 5.970 -8.687 1.00 0.00 H new ATOM 2368 N ASN B 67 324.765 8.361 -13.479 1.00 0.00 N ATOM 2369 CA ASN B 67 324.521 9.718 -13.971 1.00 0.00 C ATOM 2370 C ASN B 67 323.236 10.280 -13.401 1.00 0.00 C ATOM 2371 O ASN B 67 322.307 10.624 -14.130 1.00 0.00 O ATOM 2372 CB ASN B 67 324.448 9.736 -15.492 1.00 0.00 C ATOM 2373 CG ASN B 67 325.369 8.720 -16.144 1.00 0.00 C ATOM 2374 OD1 ASN B 67 326.592 8.830 -16.060 1.00 0.00 O ATOM 2375 ND2 ASN B 67 324.783 7.725 -16.799 1.00 0.00 N ATOM 0 H ASN B 67 323.924 7.825 -13.265 1.00 0.00 H new ATOM 0 HA ASN B 67 325.355 10.339 -13.644 1.00 0.00 H new ATOM 0 HB2 ASN B 67 323.422 9.540 -15.803 1.00 0.00 H new ATOM 0 HB3 ASN B 67 324.705 10.733 -15.850 1.00 0.00 H new ATOM 0 HD21 ASN B 67 325.350 7.013 -17.258 1.00 0.00 H new ATOM 0 HD22 ASN B 67 323.765 7.673 -16.843 1.00 0.00 H new ATOM 2382 N GLU B 68 323.228 10.393 -12.091 1.00 0.00 N ATOM 2383 CA GLU B 68 322.107 10.932 -11.317 1.00 0.00 C ATOM 2384 C GLU B 68 320.718 10.570 -11.867 1.00 0.00 C ATOM 2385 O GLU B 68 319.713 11.012 -11.321 1.00 0.00 O ATOM 2386 CB GLU B 68 322.223 12.449 -11.170 1.00 0.00 C ATOM 2387 CG GLU B 68 323.487 13.020 -11.769 1.00 0.00 C ATOM 2388 CD GLU B 68 323.395 14.510 -12.030 1.00 0.00 C ATOM 2389 OE1 GLU B 68 323.725 15.295 -11.117 1.00 0.00 O ATOM 2390 OE2 GLU B 68 322.991 14.893 -13.149 1.00 0.00 O ATOM 0 H GLU B 68 324.016 10.108 -11.510 1.00 0.00 H new ATOM 0 HA GLU B 68 322.184 10.452 -10.342 1.00 0.00 H new ATOM 0 HB2 GLU B 68 321.362 12.919 -11.645 1.00 0.00 H new ATOM 0 HB3 GLU B 68 322.184 12.707 -10.112 1.00 0.00 H new ATOM 0 HG2 GLU B 68 324.322 12.825 -11.096 1.00 0.00 H new ATOM 0 HG3 GLU B 68 323.704 12.505 -12.705 1.00 0.00 H new ATOM 2397 N THR B 69 320.642 9.772 -12.925 1.00 0.00 N ATOM 2398 CA THR B 69 319.359 9.381 -13.490 1.00 0.00 C ATOM 2399 C THR B 69 319.276 7.863 -13.595 1.00 0.00 C ATOM 2400 O THR B 69 318.240 7.307 -13.956 1.00 0.00 O ATOM 2401 CB THR B 69 319.154 10.024 -14.854 1.00 0.00 C ATOM 2402 OG1 THR B 69 320.021 9.456 -15.820 1.00 0.00 O ATOM 2403 CG2 THR B 69 319.393 11.515 -14.831 1.00 0.00 C ATOM 0 H THR B 69 321.453 9.384 -13.407 1.00 0.00 H new ATOM 0 HA THR B 69 318.566 9.730 -12.829 1.00 0.00 H new ATOM 0 HB THR B 69 318.113 9.836 -15.118 1.00 0.00 H new ATOM 0 HG1 THR B 69 320.952 9.624 -15.563 1.00 0.00 H new ATOM 0 HG21 THR B 69 319.234 11.924 -15.829 1.00 0.00 H new ATOM 0 HG22 THR B 69 318.701 11.984 -14.131 1.00 0.00 H new ATOM 0 HG23 THR B 69 320.417 11.714 -14.516 1.00 0.00 H new ATOM 2411 N ASP B 70 320.367 7.202 -13.216 1.00 0.00 N ATOM 2412 CA ASP B 70 320.420 5.765 -13.198 1.00 0.00 C ATOM 2413 C ASP B 70 319.809 5.317 -11.902 1.00 0.00 C ATOM 2414 O ASP B 70 320.198 5.790 -10.842 1.00 0.00 O ATOM 2415 CB ASP B 70 321.857 5.280 -13.277 1.00 0.00 C ATOM 2416 CG ASP B 70 322.437 5.390 -14.673 1.00 0.00 C ATOM 2417 OD1 ASP B 70 322.211 4.468 -15.485 1.00 0.00 O ATOM 2418 OD2 ASP B 70 323.118 6.399 -14.955 1.00 0.00 O ATOM 0 H ASP B 70 321.229 7.657 -12.916 1.00 0.00 H new ATOM 0 HA ASP B 70 319.882 5.356 -14.053 1.00 0.00 H new ATOM 0 HB2 ASP B 70 322.470 5.860 -12.587 1.00 0.00 H new ATOM 0 HB3 ASP B 70 321.904 4.241 -12.950 1.00 0.00 H new ATOM 2423 N THR B 71 318.858 4.421 -11.970 1.00 0.00 N ATOM 2424 CA THR B 71 318.227 3.948 -10.760 1.00 0.00 C ATOM 2425 C THR B 71 318.984 2.756 -10.229 1.00 0.00 C ATOM 2426 O THR B 71 319.563 1.991 -10.999 1.00 0.00 O ATOM 2427 CB THR B 71 316.763 3.604 -10.977 1.00 0.00 C ATOM 2428 OG1 THR B 71 316.600 2.231 -11.292 1.00 0.00 O ATOM 2429 CG2 THR B 71 316.106 4.414 -12.078 1.00 0.00 C ATOM 0 H THR B 71 318.506 4.008 -12.834 1.00 0.00 H new ATOM 0 HA THR B 71 318.256 4.753 -10.026 1.00 0.00 H new ATOM 0 HB THR B 71 316.276 3.848 -10.033 1.00 0.00 H new ATOM 0 HG1 THR B 71 316.561 1.708 -10.464 1.00 0.00 H new ATOM 0 HG21 THR B 71 315.062 4.115 -12.177 1.00 0.00 H new ATOM 0 HG22 THR B 71 316.158 5.474 -11.830 1.00 0.00 H new ATOM 0 HG23 THR B 71 316.625 4.236 -13.020 1.00 0.00 H new ATOM 2437 N PRO B 72 319.020 2.583 -8.907 1.00 0.00 N ATOM 2438 CA PRO B 72 319.751 1.482 -8.317 1.00 0.00 C ATOM 2439 C PRO B 72 319.434 0.151 -9.005 1.00 0.00 C ATOM 2440 O PRO B 72 320.332 -0.648 -9.260 1.00 0.00 O ATOM 2441 CB PRO B 72 319.353 1.500 -6.837 1.00 0.00 C ATOM 2442 CG PRO B 72 318.786 2.861 -6.580 1.00 0.00 C ATOM 2443 CD PRO B 72 318.380 3.452 -7.905 1.00 0.00 C ATOM 0 HA PRO B 72 320.829 1.589 -8.438 1.00 0.00 H new ATOM 0 HB2 PRO B 72 318.619 0.724 -6.621 1.00 0.00 H new ATOM 0 HB3 PRO B 72 320.216 1.309 -6.198 1.00 0.00 H new ATOM 0 HG2 PRO B 72 317.927 2.796 -5.912 1.00 0.00 H new ATOM 0 HG3 PRO B 72 319.524 3.495 -6.090 1.00 0.00 H new ATOM 0 HD2 PRO B 72 317.296 3.460 -8.021 1.00 0.00 H new ATOM 0 HD3 PRO B 72 318.718 4.484 -8.000 1.00 0.00 H new ATOM 2451 N ALA B 73 318.162 -0.080 -9.322 1.00 0.00 N ATOM 2452 CA ALA B 73 317.768 -1.316 -10.001 1.00 0.00 C ATOM 2453 C ALA B 73 318.530 -1.484 -11.304 1.00 0.00 C ATOM 2454 O ALA B 73 319.244 -2.468 -11.493 1.00 0.00 O ATOM 2455 CB ALA B 73 316.276 -1.324 -10.288 1.00 0.00 C ATOM 0 H ALA B 73 317.394 0.562 -9.124 1.00 0.00 H new ATOM 0 HA ALA B 73 318.009 -2.146 -9.337 1.00 0.00 H new ATOM 0 HB1 ALA B 73 316.008 -2.252 -10.793 1.00 0.00 H new ATOM 0 HB2 ALA B 73 315.725 -1.248 -9.351 1.00 0.00 H new ATOM 0 HB3 ALA B 73 316.024 -0.478 -10.927 1.00 0.00 H new ATOM 2461 N GLN B 74 318.367 -0.525 -12.209 1.00 0.00 N ATOM 2462 CA GLN B 74 319.028 -0.563 -13.501 1.00 0.00 C ATOM 2463 C GLN B 74 320.514 -0.858 -13.364 1.00 0.00 C ATOM 2464 O GLN B 74 321.115 -1.506 -14.222 1.00 0.00 O ATOM 2465 CB GLN B 74 318.817 0.766 -14.197 1.00 0.00 C ATOM 2466 CG GLN B 74 317.889 0.688 -15.393 1.00 0.00 C ATOM 2467 CD GLN B 74 318.314 -0.366 -16.396 1.00 0.00 C ATOM 2468 OE1 GLN B 74 319.183 -0.126 -17.235 1.00 0.00 O ATOM 2469 NE2 GLN B 74 317.701 -1.541 -16.316 1.00 0.00 N ATOM 0 H GLN B 74 317.776 0.294 -12.066 1.00 0.00 H new ATOM 0 HA GLN B 74 318.594 -1.369 -14.092 1.00 0.00 H new ATOM 0 HB2 GLN B 74 318.412 1.481 -13.481 1.00 0.00 H new ATOM 0 HB3 GLN B 74 319.783 1.153 -14.522 1.00 0.00 H new ATOM 0 HG2 GLN B 74 316.878 0.470 -15.049 1.00 0.00 H new ATOM 0 HG3 GLN B 74 317.855 1.660 -15.886 1.00 0.00 H new ATOM 0 HE21 GLN B 74 316.987 -1.696 -15.605 1.00 0.00 H new ATOM 0 HE22 GLN B 74 317.945 -2.289 -16.966 1.00 0.00 H new ATOM 2478 N LEU B 75 321.102 -0.365 -12.284 1.00 0.00 N ATOM 2479 CA LEU B 75 322.517 -0.550 -12.018 1.00 0.00 C ATOM 2480 C LEU B 75 322.735 -1.817 -11.198 1.00 0.00 C ATOM 2481 O LEU B 75 323.845 -2.343 -11.116 1.00 0.00 O ATOM 2482 CB LEU B 75 323.040 0.697 -11.301 1.00 0.00 C ATOM 2483 CG LEU B 75 322.585 2.027 -11.932 1.00 0.00 C ATOM 2484 CD1 LEU B 75 323.491 3.158 -11.493 1.00 0.00 C ATOM 2485 CD2 LEU B 75 322.552 1.923 -13.453 1.00 0.00 C ATOM 0 H LEU B 75 320.611 0.173 -11.570 1.00 0.00 H new ATOM 0 HA LEU B 75 323.071 -0.676 -12.948 1.00 0.00 H new ATOM 0 HB2 LEU B 75 322.711 0.670 -10.262 1.00 0.00 H new ATOM 0 HB3 LEU B 75 324.130 0.667 -11.291 1.00 0.00 H new ATOM 0 HG LEU B 75 321.574 2.241 -11.586 1.00 0.00 H new ATOM 0 HD11 LEU B 75 323.156 4.090 -11.948 1.00 0.00 H new ATOM 0 HD12 LEU B 75 323.457 3.251 -10.407 1.00 0.00 H new ATOM 0 HD13 LEU B 75 324.513 2.948 -11.807 1.00 0.00 H new ATOM 0 HD21 LEU B 75 322.228 2.874 -13.876 1.00 0.00 H new ATOM 0 HD22 LEU B 75 323.549 1.682 -13.823 1.00 0.00 H new ATOM 0 HD23 LEU B 75 321.856 1.138 -13.749 1.00 0.00 H new ATOM 2497 N GLU B 76 321.639 -2.310 -10.632 1.00 0.00 N ATOM 2498 CA GLU B 76 321.619 -3.535 -9.849 1.00 0.00 C ATOM 2499 C GLU B 76 322.190 -3.368 -8.447 1.00 0.00 C ATOM 2500 O GLU B 76 322.701 -4.324 -7.862 1.00 0.00 O ATOM 2501 CB GLU B 76 322.328 -4.663 -10.594 1.00 0.00 C ATOM 2502 CG GLU B 76 321.669 -4.990 -11.921 1.00 0.00 C ATOM 2503 CD GLU B 76 321.770 -6.461 -12.278 1.00 0.00 C ATOM 2504 OE1 GLU B 76 322.900 -6.939 -12.510 1.00 0.00 O ATOM 2505 OE2 GLU B 76 320.719 -7.133 -12.325 1.00 0.00 O ATOM 0 H GLU B 76 320.726 -1.861 -10.707 1.00 0.00 H new ATOM 0 HA GLU B 76 320.569 -3.797 -9.719 1.00 0.00 H new ATOM 0 HB2 GLU B 76 323.367 -4.382 -10.768 1.00 0.00 H new ATOM 0 HB3 GLU B 76 322.340 -5.556 -9.969 1.00 0.00 H new ATOM 0 HG2 GLU B 76 320.619 -4.701 -11.881 1.00 0.00 H new ATOM 0 HG3 GLU B 76 322.133 -4.396 -12.709 1.00 0.00 H new ATOM 2512 N MET B 77 322.080 -2.163 -7.899 1.00 0.00 N ATOM 2513 CA MET B 77 322.562 -1.894 -6.543 1.00 0.00 C ATOM 2514 C MET B 77 321.969 -2.907 -5.580 1.00 0.00 C ATOM 2515 O MET B 77 321.299 -3.850 -5.997 1.00 0.00 O ATOM 2516 CB MET B 77 322.154 -0.496 -6.086 1.00 0.00 C ATOM 2517 CG MET B 77 322.310 0.564 -7.150 1.00 0.00 C ATOM 2518 SD MET B 77 324.009 1.022 -7.471 1.00 0.00 S ATOM 2519 CE MET B 77 323.789 2.785 -7.639 1.00 0.00 C ATOM 0 H MET B 77 321.664 -1.358 -8.368 1.00 0.00 H new ATOM 0 HA MET B 77 323.650 -1.966 -6.551 1.00 0.00 H new ATOM 0 HB2 MET B 77 321.114 -0.520 -5.760 1.00 0.00 H new ATOM 0 HB3 MET B 77 322.754 -0.218 -5.219 1.00 0.00 H new ATOM 0 HG2 MET B 77 321.859 0.205 -8.075 1.00 0.00 H new ATOM 0 HG3 MET B 77 321.755 1.452 -6.849 1.00 0.00 H new ATOM 0 HE1 MET B 77 323.974 3.078 -8.673 1.00 0.00 H new ATOM 0 HE2 MET B 77 322.769 3.052 -7.363 1.00 0.00 H new ATOM 0 HE3 MET B 77 324.490 3.303 -6.984 1.00 0.00 H new ATOM 2529 N GLU B 78 322.173 -2.700 -4.289 1.00 0.00 N ATOM 2530 CA GLU B 78 321.624 -3.582 -3.283 1.00 0.00 C ATOM 2531 C GLU B 78 321.535 -2.825 -1.971 1.00 0.00 C ATOM 2532 O GLU B 78 322.059 -1.718 -1.844 1.00 0.00 O ATOM 2533 CB GLU B 78 322.488 -4.827 -3.098 1.00 0.00 C ATOM 2534 CG GLU B 78 322.128 -5.972 -4.030 1.00 0.00 C ATOM 2535 CD GLU B 78 323.343 -6.590 -4.693 1.00 0.00 C ATOM 2536 OE1 GLU B 78 323.952 -5.924 -5.557 1.00 0.00 O ATOM 2537 OE2 GLU B 78 323.686 -7.741 -4.348 1.00 0.00 O ATOM 0 H GLU B 78 322.719 -1.923 -3.916 1.00 0.00 H new ATOM 0 HA GLU B 78 320.636 -3.909 -3.606 1.00 0.00 H new ATOM 0 HB2 GLU B 78 323.533 -4.559 -3.255 1.00 0.00 H new ATOM 0 HB3 GLU B 78 322.398 -5.169 -2.067 1.00 0.00 H new ATOM 0 HG2 GLU B 78 321.596 -6.739 -3.468 1.00 0.00 H new ATOM 0 HG3 GLU B 78 321.445 -5.609 -4.798 1.00 0.00 H new ATOM 2544 N ASP B 79 320.867 -3.414 -1.008 1.00 0.00 N ATOM 2545 CA ASP B 79 320.705 -2.780 0.290 1.00 0.00 C ATOM 2546 C ASP B 79 322.063 -2.541 0.957 1.00 0.00 C ATOM 2547 O ASP B 79 322.836 -3.476 1.166 1.00 0.00 O ATOM 2548 CB ASP B 79 319.797 -3.628 1.178 1.00 0.00 C ATOM 2549 CG ASP B 79 318.511 -2.908 1.529 1.00 0.00 C ATOM 2550 OD1 ASP B 79 318.567 -1.688 1.779 1.00 0.00 O ATOM 2551 OD2 ASP B 79 317.448 -3.562 1.548 1.00 0.00 O ATOM 0 H ASP B 79 320.426 -4.330 -1.093 1.00 0.00 H new ATOM 0 HA ASP B 79 320.235 -1.807 0.146 1.00 0.00 H new ATOM 0 HB2 ASP B 79 319.562 -4.562 0.668 1.00 0.00 H new ATOM 0 HB3 ASP B 79 320.327 -3.889 2.094 1.00 0.00 H new ATOM 2556 N GLU B 80 322.337 -1.273 1.289 1.00 0.00 N ATOM 2557 CA GLU B 80 323.592 -0.868 1.941 1.00 0.00 C ATOM 2558 C GLU B 80 324.717 -0.616 0.941 1.00 0.00 C ATOM 2559 O GLU B 80 325.784 -0.168 1.330 1.00 0.00 O ATOM 2560 CB GLU B 80 324.036 -1.892 2.984 1.00 0.00 C ATOM 2561 CG GLU B 80 322.922 -2.300 3.931 1.00 0.00 C ATOM 2562 CD GLU B 80 323.419 -3.130 5.098 1.00 0.00 C ATOM 2563 OE1 GLU B 80 323.811 -2.537 6.125 1.00 0.00 O ATOM 2564 OE2 GLU B 80 323.416 -4.374 4.985 1.00 0.00 O ATOM 0 H GLU B 80 321.697 -0.499 1.114 1.00 0.00 H new ATOM 0 HA GLU B 80 323.381 0.076 2.444 1.00 0.00 H new ATOM 0 HB2 GLU B 80 324.415 -2.778 2.475 1.00 0.00 H new ATOM 0 HB3 GLU B 80 324.862 -1.478 3.562 1.00 0.00 H new ATOM 0 HG2 GLU B 80 322.428 -1.406 4.311 1.00 0.00 H new ATOM 0 HG3 GLU B 80 322.172 -2.868 3.380 1.00 0.00 H new ATOM 2571 N ASP B 81 324.499 -0.873 -0.346 1.00 0.00 N ATOM 2572 CA ASP B 81 325.542 -0.615 -1.324 1.00 0.00 C ATOM 2573 C ASP B 81 325.998 0.824 -1.186 1.00 0.00 C ATOM 2574 O ASP B 81 325.261 1.667 -0.691 1.00 0.00 O ATOM 2575 CB ASP B 81 325.052 -0.873 -2.745 1.00 0.00 C ATOM 2576 CG ASP B 81 324.855 -2.349 -3.030 1.00 0.00 C ATOM 2577 OD1 ASP B 81 324.771 -3.135 -2.063 1.00 0.00 O ATOM 2578 OD2 ASP B 81 324.785 -2.719 -4.221 1.00 0.00 O ATOM 0 H ASP B 81 323.631 -1.250 -0.726 1.00 0.00 H new ATOM 0 HA ASP B 81 326.374 -1.294 -1.135 1.00 0.00 H new ATOM 0 HB2 ASP B 81 324.111 -0.347 -2.903 1.00 0.00 H new ATOM 0 HB3 ASP B 81 325.770 -0.462 -3.454 1.00 0.00 H new ATOM 2583 N THR B 82 327.206 1.094 -1.614 1.00 0.00 N ATOM 2584 CA THR B 82 327.756 2.446 -1.517 1.00 0.00 C ATOM 2585 C THR B 82 327.962 3.079 -2.890 1.00 0.00 C ATOM 2586 O THR B 82 328.228 2.389 -3.875 1.00 0.00 O ATOM 2587 CB THR B 82 329.096 2.453 -0.780 1.00 0.00 C ATOM 2588 OG1 THR B 82 329.078 1.559 0.317 1.00 0.00 O ATOM 2589 CG2 THR B 82 329.465 3.831 -0.258 1.00 0.00 C ATOM 0 H THR B 82 327.834 0.408 -2.033 1.00 0.00 H new ATOM 0 HA THR B 82 327.023 3.028 -0.958 1.00 0.00 H new ATOM 0 HB THR B 82 329.840 2.141 -1.513 1.00 0.00 H new ATOM 0 HG1 THR B 82 329.983 1.471 0.683 1.00 0.00 H new ATOM 0 HG21 THR B 82 330.424 3.780 0.257 1.00 0.00 H new ATOM 0 HG22 THR B 82 329.537 4.529 -1.092 1.00 0.00 H new ATOM 0 HG23 THR B 82 328.698 4.174 0.437 1.00 0.00 H new ATOM 2597 N ILE B 83 327.882 4.404 -2.930 1.00 0.00 N ATOM 2598 CA ILE B 83 328.104 5.162 -4.151 1.00 0.00 C ATOM 2599 C ILE B 83 329.082 6.286 -3.855 1.00 0.00 C ATOM 2600 O ILE B 83 328.727 7.272 -3.214 1.00 0.00 O ATOM 2601 CB ILE B 83 326.791 5.762 -4.674 1.00 0.00 C ATOM 2602 CG1 ILE B 83 325.890 4.650 -5.186 1.00 0.00 C ATOM 2603 CG2 ILE B 83 327.060 6.791 -5.777 1.00 0.00 C ATOM 2604 CD1 ILE B 83 324.466 5.091 -5.347 1.00 0.00 C ATOM 0 H ILE B 83 327.662 4.980 -2.118 1.00 0.00 H new ATOM 0 HA ILE B 83 328.504 4.493 -4.913 1.00 0.00 H new ATOM 0 HB ILE B 83 326.290 6.278 -3.855 1.00 0.00 H new ATOM 0 HG12 ILE B 83 326.267 4.294 -6.145 1.00 0.00 H new ATOM 0 HG13 ILE B 83 325.930 3.808 -4.495 1.00 0.00 H new ATOM 0 HG21 ILE B 83 326.114 7.201 -6.131 1.00 0.00 H new ATOM 0 HG22 ILE B 83 327.679 7.596 -5.381 1.00 0.00 H new ATOM 0 HG23 ILE B 83 327.579 6.309 -6.606 1.00 0.00 H new ATOM 0 HD11 ILE B 83 323.867 4.258 -5.715 1.00 0.00 H new ATOM 0 HD12 ILE B 83 324.076 5.421 -4.384 1.00 0.00 H new ATOM 0 HD13 ILE B 83 324.419 5.915 -6.059 1.00 0.00 H new ATOM 2616 N ASP B 84 330.334 6.096 -4.233 1.00 0.00 N ATOM 2617 CA ASP B 84 331.370 7.058 -3.906 1.00 0.00 C ATOM 2618 C ASP B 84 331.216 8.417 -4.594 1.00 0.00 C ATOM 2619 O ASP B 84 330.938 8.525 -5.787 1.00 0.00 O ATOM 2620 CB ASP B 84 332.737 6.466 -4.221 1.00 0.00 C ATOM 2621 CG ASP B 84 333.629 6.380 -2.997 1.00 0.00 C ATOM 2622 OD1 ASP B 84 333.866 7.428 -2.360 1.00 0.00 O ATOM 2623 OD2 ASP B 84 334.089 5.265 -2.675 1.00 0.00 O ATOM 0 H ASP B 84 330.656 5.287 -4.765 1.00 0.00 H new ATOM 0 HA ASP B 84 331.269 7.257 -2.839 1.00 0.00 H new ATOM 0 HB2 ASP B 84 332.609 5.470 -4.644 1.00 0.00 H new ATOM 0 HB3 ASP B 84 333.227 7.075 -4.981 1.00 0.00 H new ATOM 2628 N VAL B 85 331.442 9.440 -3.773 1.00 0.00 N ATOM 2629 CA VAL B 85 331.393 10.847 -4.158 1.00 0.00 C ATOM 2630 C VAL B 85 332.792 11.433 -4.029 1.00 0.00 C ATOM 2631 O VAL B 85 333.408 11.343 -2.967 1.00 0.00 O ATOM 2632 CB VAL B 85 330.417 11.639 -3.247 1.00 0.00 C ATOM 2633 CG1 VAL B 85 330.546 13.152 -3.440 1.00 0.00 C ATOM 2634 CG2 VAL B 85 328.994 11.195 -3.501 1.00 0.00 C ATOM 0 H VAL B 85 331.672 9.307 -2.788 1.00 0.00 H new ATOM 0 HA VAL B 85 331.037 10.923 -5.186 1.00 0.00 H new ATOM 0 HB VAL B 85 330.685 11.422 -2.213 1.00 0.00 H new ATOM 0 HG11 VAL B 85 329.844 13.664 -2.782 1.00 0.00 H new ATOM 0 HG12 VAL B 85 331.562 13.464 -3.199 1.00 0.00 H new ATOM 0 HG13 VAL B 85 330.324 13.407 -4.476 1.00 0.00 H new ATOM 0 HG21 VAL B 85 328.317 11.757 -2.857 1.00 0.00 H new ATOM 0 HG22 VAL B 85 328.737 11.377 -4.544 1.00 0.00 H new ATOM 0 HG23 VAL B 85 328.901 10.131 -3.285 1.00 0.00 H new ATOM 2644 N PHE B 86 333.284 12.055 -5.087 1.00 0.00 N ATOM 2645 CA PHE B 86 334.598 12.674 -5.049 1.00 0.00 C ATOM 2646 C PHE B 86 334.529 13.999 -5.774 1.00 0.00 C ATOM 2647 O PHE B 86 334.437 14.044 -6.994 1.00 0.00 O ATOM 2648 CB PHE B 86 335.641 11.777 -5.707 1.00 0.00 C ATOM 2649 CG PHE B 86 336.254 10.775 -4.770 1.00 0.00 C ATOM 2650 CD1 PHE B 86 337.169 11.174 -3.808 1.00 0.00 C ATOM 2651 CD2 PHE B 86 335.916 9.434 -4.853 1.00 0.00 C ATOM 2652 CE1 PHE B 86 337.734 10.253 -2.946 1.00 0.00 C ATOM 2653 CE2 PHE B 86 336.478 8.509 -3.993 1.00 0.00 C ATOM 2654 CZ PHE B 86 337.388 8.919 -3.039 1.00 0.00 C ATOM 0 H PHE B 86 332.796 12.145 -5.978 1.00 0.00 H new ATOM 0 HA PHE B 86 334.893 12.827 -4.011 1.00 0.00 H new ATOM 0 HB2 PHE B 86 335.178 11.247 -6.539 1.00 0.00 H new ATOM 0 HB3 PHE B 86 336.431 12.400 -6.126 1.00 0.00 H new ATOM 0 HD1 PHE B 86 337.443 12.216 -3.731 1.00 0.00 H new ATOM 0 HD2 PHE B 86 335.205 9.108 -5.598 1.00 0.00 H new ATOM 0 HE1 PHE B 86 338.445 10.576 -2.200 1.00 0.00 H new ATOM 0 HE2 PHE B 86 336.205 7.467 -4.067 1.00 0.00 H new ATOM 0 HZ PHE B 86 337.829 8.198 -2.367 1.00 0.00 H new ATOM 2664 N GLN B 87 334.554 15.068 -5.009 1.00 0.00 N ATOM 2665 CA GLN B 87 334.458 16.396 -5.587 1.00 0.00 C ATOM 2666 C GLN B 87 335.279 17.434 -4.829 1.00 0.00 C ATOM 2667 O GLN B 87 335.165 17.574 -3.612 1.00 0.00 O ATOM 2668 CB GLN B 87 332.983 16.794 -5.662 1.00 0.00 C ATOM 2669 CG GLN B 87 332.675 17.820 -6.738 1.00 0.00 C ATOM 2670 CD GLN B 87 332.116 19.115 -6.168 1.00 0.00 C ATOM 2671 OE1 GLN B 87 330.926 19.049 -5.555 1.00 0.00 O flip ATOM 2672 NE2 GLN B 87 332.744 20.168 -6.274 1.00 0.00 N flip ATOM 0 H GLN B 87 334.639 15.048 -3.993 1.00 0.00 H new ATOM 0 HA GLN B 87 334.884 16.365 -6.590 1.00 0.00 H new ATOM 0 HB2 GLN B 87 332.385 15.901 -5.844 1.00 0.00 H new ATOM 0 HB3 GLN B 87 332.675 17.193 -4.695 1.00 0.00 H new ATOM 0 HG2 GLN B 87 333.584 18.037 -7.299 1.00 0.00 H new ATOM 0 HG3 GLN B 87 331.958 17.398 -7.443 1.00 0.00 H new ATOM 0 HE21 GLN B 87 333.647 20.178 -6.748 1.00 0.00 H new ATOM 0 HE22 GLN B 87 332.361 21.031 -5.888 1.00 0.00 H new ATOM 2681 N GLN B 88 336.118 18.149 -5.572 1.00 0.00 N ATOM 2682 CA GLN B 88 336.985 19.173 -4.998 1.00 0.00 C ATOM 2683 C GLN B 88 336.196 20.140 -4.120 1.00 0.00 C ATOM 2684 O GLN B 88 335.310 20.849 -4.597 1.00 0.00 O ATOM 2685 CB GLN B 88 337.683 19.953 -6.110 1.00 0.00 C ATOM 2686 CG GLN B 88 338.582 19.096 -6.986 1.00 0.00 C ATOM 2687 CD GLN B 88 340.003 19.623 -7.061 1.00 0.00 C ATOM 2688 OE1 GLN B 88 340.298 20.719 -6.584 1.00 0.00 O ATOM 2689 NE2 GLN B 88 340.892 18.843 -7.665 1.00 0.00 N ATOM 0 H GLN B 88 336.216 18.037 -6.581 1.00 0.00 H new ATOM 0 HA GLN B 88 337.727 18.670 -4.378 1.00 0.00 H new ATOM 0 HB2 GLN B 88 336.929 20.430 -6.736 1.00 0.00 H new ATOM 0 HB3 GLN B 88 338.278 20.750 -5.664 1.00 0.00 H new ATOM 0 HG2 GLN B 88 338.597 18.078 -6.598 1.00 0.00 H new ATOM 0 HG3 GLN B 88 338.163 19.048 -7.991 1.00 0.00 H new ATOM 0 HE21 GLN B 88 340.604 17.942 -8.046 1.00 0.00 H new ATOM 0 HE22 GLN B 88 341.863 19.145 -7.748 1.00 0.00 H new