USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=55 USER MOD reduce.3.24.130724 removed 1036 hydrogens (94 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 NoAdj-H: A 78 ASNHD21 : A 78 ASN ND2 : A 136 NAG C1 :(H bumps) USER MOD NoAdj-H: A 111 ASNHD21 : A 111 ASN ND2 : A 132 NAG C1 :(H bumps) USER MOD Set 1.1: A 137 NAG O6 : rot 180:sc= 1.02 USER MOD Set 1.2: A 139 BMA O2 : rot -78:sc= 1.28 USER MOD Set 2.1: A 132 NAG O3 : rot -174:sc= 1.09 USER MOD Set 2.2: A 133 NAG O6 : rot 180:sc= 0 USER MOD Set 3.1: A 30 THR OG1 : rot -179:sc= -2.34 USER MOD Set 3.2: A 53 MET CE :methyl 176:sc= -8.51! (180deg=-7.43!) USER MOD Set 4.1: A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 75 ASN : amide:sc= 0 K(o=0,f=-5.1!) USER MOD Set 5.1: A 18 SER OG : rot 88:sc= 1.05 USER MOD Set 5.2: A 80 THR OG1 : rot 180:sc= 0.0741 USER MOD Single : A 1 MET CE :methyl -151:sc= -0.169 (180deg=-1.12) USER MOD Single : A 1AALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 HIS :FLIP no HD1:sc= -0.604 F(o=-1.3,f=-0.6) USER MOD Single : A 5 GLN : amide:sc= -22.6! C(o=-23!,f=-29!) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 150:sc= 0 USER MOD Single : A 35 THR OG1 : rot -170:sc= 0 USER MOD Single : A 39 GLN :FLIP amide:sc= -0.937 F(o=-4.3!,f=-0.94) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -0.0623 X(o=-0.062,f=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot -158:sc= 0.709 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl -108:sc= -4.51! (180deg=-11.1!) USER MOD Single : A 56 ASN : amide:sc= -0.729 X(o=-0.73,f=-0.35) USER MOD Single : A 59 THR OG1 : rot 32:sc= 0.309 USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 150:sc= 0 USER MOD Single : A 72 SER OG : rot 89:sc= 0.452 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= -0.411 X(o=-0.41,f=0) USER MOD Single : A 82 GLN : amide:sc= -1.71 K(o=-1.7,f=-4.1!) USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 101:sc= -0.935 USER MOD Single : A 92 TYR OH : rot -61:sc= 1.17 USER MOD Single : A 95 LYS NZ :NH3+ -159:sc=-0.000622 (180deg=-0.48) USER MOD Single : A 99 MET CE :methyl -142:sc= -0.374 (180deg=-1.65!) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 TYR OH : rot 180:sc= -4.51 USER MOD Single : A 105 TYR OH : rot 64:sc= 0.671 USER MOD Single : A 113 THR OG1 : rot -41:sc= 1.08 USER MOD Single : A 114 GLN : amide:sc= -3.46! C(o=-3.5!,f=-3.7!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 CYS SG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= -0.549 X(o=-0.55,f=-0.24) USER MOD Single : A 131 LYS NZ :NH3+ -159:sc= -0.029 (180deg=-0.485) USER MOD Single : A 133 NAG O3 : rot 180:sc= -0.666 USER MOD Single : A 134 FUL O2 : rot 180:sc= -2.05! USER MOD Single : A 134 FUL O3 : rot -87:sc= 0.114 USER MOD Single : A 134 FUL O4 : rot 150:sc= 0.0696 USER MOD Single : A 135 BMA O2 : rot 155:sc= -0.662 USER MOD Single : A 135 BMA O3 : rot 180:sc= 0.0606 USER MOD Single : A 135 BMA O4 : rot 160:sc= 0 USER MOD Single : A 135 BMA O6 : rot 180:sc= -0.0162 USER MOD Single : A 136 NAG O3 : rot -31:sc= -1.28! USER MOD Single : A 137 NAG O3 : rot -5:sc= 0.44 USER MOD Single : A 138 FUC O2 : rot 180:sc= 0 USER MOD Single : A 138 FUC O3 : rot -100:sc= 0.113 USER MOD Single : A 138 FUC O4 : rot 150:sc= 0.0851 USER MOD Single : A 139 BMA O3 : rot 180:sc= 0 USER MOD Single : A 139 BMA O4 : rot 160:sc= 0 USER MOD Single : A 139 BMA O6 : rot 180:sc= -0.0283 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1A -10.671 7.621 7.043 1.00 0.00 N ATOM 2 CA ALA A 1A -10.082 8.883 6.510 1.00 0.00 C ATOM 3 C ALA A 1A -9.192 8.582 5.300 1.00 0.00 C ATOM 4 O ALA A 1A -9.495 8.968 4.187 1.00 0.00 O ATOM 5 CB ALA A 1A -9.250 9.449 7.661 1.00 0.00 C ATOM 0 H1 ALA A 1A -11.272 7.838 7.863 1.00 0.00 H new ATOM 0 H2 ALA A 1A -11.244 7.166 6.304 1.00 0.00 H new ATOM 0 H3 ALA A 1A -9.908 6.977 7.334 1.00 0.00 H new ATOM 0 HA ALA A 1A -10.845 9.586 6.175 1.00 0.00 H new ATOM 0 HB1 ALA A 1A -8.782 10.382 7.347 1.00 0.00 H new ATOM 0 HB2 ALA A 1A -9.896 9.638 8.518 1.00 0.00 H new ATOM 0 HB3 ALA A 1A -8.478 8.731 7.939 1.00 0.00 H new ATOM 13 N MET A 1 -8.099 7.895 5.513 1.00 0.00 N ATOM 14 CA MET A 1 -7.183 7.562 4.378 1.00 0.00 C ATOM 15 C MET A 1 -7.893 6.641 3.384 1.00 0.00 C ATOM 16 O MET A 1 -8.599 5.727 3.770 1.00 0.00 O ATOM 17 CB MET A 1 -5.991 6.846 5.015 1.00 0.00 C ATOM 18 CG MET A 1 -5.258 7.807 5.953 1.00 0.00 C ATOM 19 SD MET A 1 -4.568 9.177 4.992 1.00 0.00 S ATOM 20 CE MET A 1 -3.283 8.231 4.139 1.00 0.00 C ATOM 0 H MET A 1 -7.800 7.549 6.425 1.00 0.00 H new ATOM 0 HA MET A 1 -6.872 8.450 3.828 1.00 0.00 H new ATOM 0 HB2 MET A 1 -6.332 5.971 5.568 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.312 6.489 4.241 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.944 8.188 6.709 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.462 7.281 6.481 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.441 8.885 3.910 1.00 0.00 H new ATOM 0 HE2 MET A 1 -2.946 7.416 4.779 1.00 0.00 H new ATOM 0 HE3 MET A 1 -3.687 7.822 3.213 1.00 0.00 H new ATOM 30 N HIS A 2 -7.717 6.877 2.108 1.00 0.00 N ATOM 31 CA HIS A 2 -8.386 6.019 1.085 1.00 0.00 C ATOM 32 C HIS A 2 -7.361 5.154 0.345 1.00 0.00 C ATOM 33 O HIS A 2 -6.360 5.640 -0.146 1.00 0.00 O ATOM 34 CB HIS A 2 -9.053 7.001 0.121 1.00 0.00 C ATOM 35 CG HIS A 2 -10.118 7.781 0.846 1.00 0.00 C ATOM 36 ND1 HIS A 2 -10.717 7.603 2.070 1.00 0.00 N flip ATOM 37 CD2 HIS A 2 -10.703 8.913 0.301 1.00 0.00 C flip ATOM 38 CE1 HIS A 2 -11.657 8.607 2.282 1.00 0.00 C flip ATOM 39 NE2 HIS A 2 -11.608 9.369 1.186 1.00 0.00 N flip ATOM 0 H HIS A 2 -7.138 7.628 1.731 1.00 0.00 H new ATOM 0 HA HIS A 2 -9.103 5.333 1.536 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -8.309 7.681 -0.293 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -9.492 6.461 -0.718 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -10.474 9.350 -0.660 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -12.290 8.741 3.147 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -12.186 10.196 1.038 1.00 0.00 H new ATOM 47 N VAL A 3 -7.618 3.875 0.258 1.00 0.00 N ATOM 48 CA VAL A 3 -6.685 2.955 -0.457 1.00 0.00 C ATOM 49 C VAL A 3 -7.496 1.823 -1.095 1.00 0.00 C ATOM 50 O VAL A 3 -8.490 1.386 -0.544 1.00 0.00 O ATOM 51 CB VAL A 3 -5.748 2.417 0.630 1.00 0.00 C ATOM 52 CG1 VAL A 3 -4.770 1.407 0.022 1.00 0.00 C ATOM 53 CG2 VAL A 3 -4.961 3.579 1.241 1.00 0.00 C ATOM 0 H VAL A 3 -8.442 3.425 0.656 1.00 0.00 H new ATOM 0 HA VAL A 3 -6.124 3.444 -1.254 1.00 0.00 H new ATOM 0 HB VAL A 3 -6.339 1.925 1.402 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -4.107 1.029 0.800 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -5.327 0.578 -0.414 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -4.179 1.894 -0.753 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -4.294 3.199 2.015 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.374 4.069 0.464 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -5.654 4.297 1.680 1.00 0.00 H new ATOM 63 N ALA A 4 -7.095 1.352 -2.251 1.00 0.00 N ATOM 64 CA ALA A 4 -7.872 0.254 -2.911 1.00 0.00 C ATOM 65 C ALA A 4 -7.036 -1.018 -3.054 1.00 0.00 C ATOM 66 O ALA A 4 -6.035 -1.049 -3.744 1.00 0.00 O ATOM 67 CB ALA A 4 -8.260 0.795 -4.284 1.00 0.00 C ATOM 0 H ALA A 4 -6.273 1.675 -2.762 1.00 0.00 H new ATOM 0 HA ALA A 4 -8.744 -0.020 -2.317 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -8.833 0.041 -4.824 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -8.866 1.693 -4.163 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -7.359 1.038 -4.847 1.00 0.00 H new ATOM 73 N GLN A 5 -7.473 -2.069 -2.419 1.00 0.00 N ATOM 74 CA GLN A 5 -6.752 -3.377 -2.500 1.00 0.00 C ATOM 75 C GLN A 5 -7.753 -4.546 -2.544 1.00 0.00 C ATOM 76 O GLN A 5 -8.746 -4.521 -1.845 1.00 0.00 O ATOM 77 CB GLN A 5 -5.923 -3.467 -1.215 1.00 0.00 C ATOM 78 CG GLN A 5 -4.702 -2.551 -1.305 1.00 0.00 C ATOM 79 CD GLN A 5 -3.473 -3.372 -1.714 1.00 0.00 C ATOM 80 OE1 GLN A 5 -2.516 -3.460 -0.974 1.00 0.00 O ATOM 81 NE2 GLN A 5 -3.457 -3.980 -2.869 1.00 0.00 N ATOM 0 H GLN A 5 -8.311 -2.081 -1.838 1.00 0.00 H new ATOM 0 HA GLN A 5 -6.138 -3.436 -3.398 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -6.535 -3.185 -0.359 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -5.603 -4.496 -1.052 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -4.882 -1.759 -2.032 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -4.526 -2.067 -0.344 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -4.260 -3.908 -3.494 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -2.642 -4.527 -3.146 1.00 0.00 H new ATOM 90 N PRO A 6 -7.454 -5.555 -3.338 1.00 0.00 N ATOM 91 CA PRO A 6 -8.349 -6.740 -3.412 1.00 0.00 C ATOM 92 C PRO A 6 -8.243 -7.542 -2.117 1.00 0.00 C ATOM 93 O PRO A 6 -7.166 -7.734 -1.589 1.00 0.00 O ATOM 94 CB PRO A 6 -7.802 -7.533 -4.597 1.00 0.00 C ATOM 95 CG PRO A 6 -6.371 -7.119 -4.712 1.00 0.00 C ATOM 96 CD PRO A 6 -6.286 -5.697 -4.225 1.00 0.00 C ATOM 0 HA PRO A 6 -9.402 -6.487 -3.537 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -7.890 -8.606 -4.428 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -8.353 -7.308 -5.510 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -5.732 -7.770 -4.116 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -6.029 -7.195 -5.744 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -5.354 -5.513 -3.691 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -6.324 -4.988 -5.052 1.00 0.00 H new ATOM 104 N ALA A 7 -9.346 -8.013 -1.602 1.00 0.00 N ATOM 105 CA ALA A 7 -9.298 -8.806 -0.338 1.00 0.00 C ATOM 106 C ALA A 7 -8.656 -10.157 -0.598 1.00 0.00 C ATOM 107 O ALA A 7 -8.020 -10.718 0.277 1.00 0.00 O ATOM 108 CB ALA A 7 -10.753 -8.967 0.105 1.00 0.00 C ATOM 0 H ALA A 7 -10.276 -7.884 -2.000 1.00 0.00 H new ATOM 0 HA ALA A 7 -8.704 -8.315 0.433 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -10.790 -9.542 1.030 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -11.194 -7.984 0.271 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -11.313 -9.490 -0.670 1.00 0.00 H new ATOM 114 N VAL A 8 -8.800 -10.687 -1.788 1.00 0.00 N ATOM 115 CA VAL A 8 -8.178 -11.990 -2.069 1.00 0.00 C ATOM 116 C VAL A 8 -7.791 -12.103 -3.536 1.00 0.00 C ATOM 117 O VAL A 8 -8.351 -11.450 -4.397 1.00 0.00 O ATOM 118 CB VAL A 8 -9.228 -13.041 -1.664 1.00 0.00 C ATOM 119 CG1 VAL A 8 -10.327 -13.272 -2.725 1.00 0.00 C ATOM 120 CG2 VAL A 8 -8.529 -14.358 -1.399 1.00 0.00 C ATOM 0 H VAL A 8 -9.318 -10.269 -2.561 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.251 -12.131 -1.513 1.00 0.00 H new ATOM 0 HB VAL A 8 -9.724 -12.654 -0.774 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -11.027 -14.026 -2.365 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -10.860 -12.338 -2.906 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.870 -13.615 -3.653 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.265 -15.109 -1.111 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.012 -14.684 -2.302 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -7.806 -14.231 -0.593 1.00 0.00 H new ATOM 130 N VAL A 9 -6.857 -12.951 -3.810 1.00 0.00 N ATOM 131 CA VAL A 9 -6.422 -13.166 -5.209 1.00 0.00 C ATOM 132 C VAL A 9 -6.166 -14.658 -5.440 1.00 0.00 C ATOM 133 O VAL A 9 -5.813 -15.387 -4.532 1.00 0.00 O ATOM 134 CB VAL A 9 -5.154 -12.318 -5.364 1.00 0.00 C ATOM 135 CG1 VAL A 9 -4.318 -12.762 -6.575 1.00 0.00 C ATOM 136 CG2 VAL A 9 -5.558 -10.861 -5.564 1.00 0.00 C ATOM 0 H VAL A 9 -6.367 -13.515 -3.116 1.00 0.00 H new ATOM 0 HA VAL A 9 -7.168 -12.872 -5.947 1.00 0.00 H new ATOM 0 HB VAL A 9 -4.551 -12.443 -4.464 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -3.428 -12.137 -6.651 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -4.021 -13.803 -6.450 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.911 -12.661 -7.484 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -4.664 -10.248 -5.676 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -6.172 -10.773 -6.460 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -6.127 -10.519 -4.699 1.00 0.00 H new ATOM 146 N LEU A 10 -6.343 -15.104 -6.651 1.00 0.00 N ATOM 147 CA LEU A 10 -6.114 -16.545 -6.962 1.00 0.00 C ATOM 148 C LEU A 10 -4.860 -16.687 -7.830 1.00 0.00 C ATOM 149 O LEU A 10 -4.704 -16.002 -8.823 1.00 0.00 O ATOM 150 CB LEU A 10 -7.365 -16.990 -7.727 1.00 0.00 C ATOM 151 CG LEU A 10 -8.606 -16.806 -6.843 1.00 0.00 C ATOM 152 CD1 LEU A 10 -9.865 -17.044 -7.680 1.00 0.00 C ATOM 153 CD2 LEU A 10 -8.573 -17.801 -5.672 1.00 0.00 C ATOM 0 H LEU A 10 -6.637 -14.532 -7.443 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.957 -17.151 -6.070 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -7.469 -16.408 -8.642 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -7.269 -18.035 -8.023 1.00 0.00 H new ATOM 0 HG LEU A 10 -8.614 -15.791 -6.446 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -10.748 -16.914 -7.054 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -9.895 -16.330 -8.503 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -9.850 -18.058 -8.080 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -9.458 -17.662 -5.051 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -8.559 -18.819 -6.060 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -7.679 -17.628 -5.073 1.00 0.00 H new ATOM 165 N ALA A 11 -3.962 -17.563 -7.455 1.00 0.00 N ATOM 166 CA ALA A 11 -2.709 -17.744 -8.247 1.00 0.00 C ATOM 167 C ALA A 11 -2.907 -18.806 -9.334 1.00 0.00 C ATOM 168 O ALA A 11 -3.470 -19.857 -9.094 1.00 0.00 O ATOM 169 CB ALA A 11 -1.660 -18.195 -7.230 1.00 0.00 C ATOM 0 H ALA A 11 -4.044 -18.161 -6.633 1.00 0.00 H new ATOM 0 HA ALA A 11 -2.411 -16.830 -8.760 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -0.707 -18.350 -7.735 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -1.544 -17.429 -6.463 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.981 -19.128 -6.766 1.00 0.00 H new ATOM 175 N SER A 12 -2.447 -18.529 -10.527 1.00 0.00 N ATOM 176 CA SER A 12 -2.600 -19.508 -11.649 1.00 0.00 C ATOM 177 C SER A 12 -1.702 -20.728 -11.423 1.00 0.00 C ATOM 178 O SER A 12 -0.904 -20.761 -10.505 1.00 0.00 O ATOM 179 CB SER A 12 -2.167 -18.751 -12.905 1.00 0.00 C ATOM 180 OG SER A 12 -0.763 -18.532 -12.860 1.00 0.00 O ATOM 0 H SER A 12 -1.969 -17.663 -10.775 1.00 0.00 H new ATOM 0 HA SER A 12 -3.622 -19.879 -11.729 1.00 0.00 H new ATOM 0 HB2 SER A 12 -2.429 -19.321 -13.796 1.00 0.00 H new ATOM 0 HB3 SER A 12 -2.693 -17.799 -12.969 1.00 0.00 H new ATOM 0 HG SER A 12 -0.481 -18.048 -13.665 1.00 0.00 H new ATOM 186 N SER A 13 -1.831 -21.730 -12.258 1.00 0.00 N ATOM 187 CA SER A 13 -0.991 -22.960 -12.101 1.00 0.00 C ATOM 188 C SER A 13 0.495 -22.603 -12.209 1.00 0.00 C ATOM 189 O SER A 13 1.340 -23.244 -11.614 1.00 0.00 O ATOM 190 CB SER A 13 -1.402 -23.878 -13.254 1.00 0.00 C ATOM 191 OG SER A 13 -1.062 -23.262 -14.490 1.00 0.00 O ATOM 0 H SER A 13 -2.482 -21.750 -13.043 1.00 0.00 H new ATOM 0 HA SER A 13 -1.138 -23.435 -11.131 1.00 0.00 H new ATOM 0 HB2 SER A 13 -0.899 -24.841 -13.164 1.00 0.00 H new ATOM 0 HB3 SER A 13 -2.474 -24.073 -13.214 1.00 0.00 H new ATOM 0 HG SER A 13 -1.323 -23.849 -15.230 1.00 0.00 H new ATOM 197 N ARG A 14 0.814 -21.575 -12.955 1.00 0.00 N ATOM 198 CA ARG A 14 2.246 -21.161 -13.102 1.00 0.00 C ATOM 199 C ARG A 14 2.826 -20.795 -11.733 1.00 0.00 C ATOM 200 O ARG A 14 4.009 -20.944 -11.491 1.00 0.00 O ATOM 201 CB ARG A 14 2.222 -19.934 -14.017 1.00 0.00 C ATOM 202 CG ARG A 14 3.657 -19.490 -14.310 1.00 0.00 C ATOM 203 CD ARG A 14 4.275 -20.413 -15.365 1.00 0.00 C ATOM 204 NE ARG A 14 3.463 -20.198 -16.604 1.00 0.00 N ATOM 205 CZ ARG A 14 3.608 -20.972 -17.663 1.00 0.00 C ATOM 206 NH1 ARG A 14 4.469 -21.964 -17.677 1.00 0.00 N ATOM 207 NH2 ARG A 14 2.880 -20.745 -18.722 1.00 0.00 N ATOM 0 H ARG A 14 0.145 -21.003 -13.470 1.00 0.00 H new ATOM 0 HA ARG A 14 2.865 -21.958 -13.514 1.00 0.00 H new ATOM 0 HB2 ARG A 14 1.706 -20.171 -14.947 1.00 0.00 H new ATOM 0 HB3 ARG A 14 1.669 -19.124 -13.543 1.00 0.00 H new ATOM 0 HG2 ARG A 14 3.664 -18.459 -14.665 1.00 0.00 H new ATOM 0 HG3 ARG A 14 4.251 -19.517 -13.396 1.00 0.00 H new ATOM 0 HD2 ARG A 14 5.324 -20.169 -15.535 1.00 0.00 H new ATOM 0 HD3 ARG A 14 4.238 -21.455 -15.046 1.00 0.00 H new ATOM 0 HE ARG A 14 2.784 -19.438 -16.630 1.00 0.00 H new ATOM 0 HH11 ARG A 14 5.045 -22.151 -16.856 1.00 0.00 H new ATOM 0 HH12 ARG A 14 4.561 -22.547 -18.509 1.00 0.00 H new ATOM 0 HH21 ARG A 14 2.209 -19.977 -18.724 1.00 0.00 H new ATOM 0 HH22 ARG A 14 2.982 -21.336 -19.547 1.00 0.00 H new ATOM 221 N GLY A 15 1.998 -20.315 -10.844 1.00 0.00 N ATOM 222 CA GLY A 15 2.485 -19.927 -9.489 1.00 0.00 C ATOM 223 C GLY A 15 2.731 -18.418 -9.449 1.00 0.00 C ATOM 224 O GLY A 15 3.521 -17.931 -8.663 1.00 0.00 O ATOM 0 H GLY A 15 1.000 -20.174 -10.999 1.00 0.00 H new ATOM 0 HA2 GLY A 15 1.751 -20.207 -8.733 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.405 -20.463 -9.254 1.00 0.00 H new ATOM 228 N ILE A 16 2.054 -17.675 -10.290 1.00 0.00 N ATOM 229 CA ILE A 16 2.230 -16.205 -10.310 1.00 0.00 C ATOM 230 C ILE A 16 0.941 -15.511 -9.868 1.00 0.00 C ATOM 231 O ILE A 16 -0.080 -15.572 -10.527 1.00 0.00 O ATOM 232 CB ILE A 16 2.625 -15.855 -11.764 1.00 0.00 C ATOM 233 CG1 ILE A 16 4.115 -16.138 -11.960 1.00 0.00 C ATOM 234 CG2 ILE A 16 2.374 -14.369 -12.071 1.00 0.00 C ATOM 235 CD1 ILE A 16 4.424 -17.627 -11.827 1.00 0.00 C ATOM 0 H ILE A 16 1.382 -18.036 -10.967 1.00 0.00 H new ATOM 0 HA ILE A 16 2.999 -15.865 -9.616 1.00 0.00 H new ATOM 0 HB ILE A 16 2.017 -16.462 -12.434 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.427 -15.787 -12.944 1.00 0.00 H new ATOM 0 HG13 ILE A 16 4.693 -15.578 -11.224 1.00 0.00 H new ATOM 0 HG21 ILE A 16 2.662 -14.156 -13.101 1.00 0.00 H new ATOM 0 HG22 ILE A 16 1.316 -14.143 -11.936 1.00 0.00 H new ATOM 0 HG23 ILE A 16 2.966 -13.753 -11.394 1.00 0.00 H new ATOM 0 HD11 ILE A 16 5.492 -17.791 -11.972 1.00 0.00 H new ATOM 0 HD12 ILE A 16 4.136 -17.971 -10.834 1.00 0.00 H new ATOM 0 HD13 ILE A 16 3.866 -18.183 -12.580 1.00 0.00 H new ATOM 247 N ALA A 17 1.014 -14.830 -8.765 1.00 0.00 N ATOM 248 CA ALA A 17 -0.169 -14.083 -8.249 1.00 0.00 C ATOM 249 C ALA A 17 0.073 -12.587 -8.440 1.00 0.00 C ATOM 250 O ALA A 17 1.100 -12.066 -8.044 1.00 0.00 O ATOM 251 CB ALA A 17 -0.254 -14.430 -6.765 1.00 0.00 C ATOM 0 H ALA A 17 1.852 -14.756 -8.188 1.00 0.00 H new ATOM 0 HA ALA A 17 -1.093 -14.342 -8.766 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -1.104 -13.914 -6.319 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -0.382 -15.506 -6.650 1.00 0.00 H new ATOM 0 HB3 ALA A 17 0.663 -14.118 -6.265 1.00 0.00 H new ATOM 257 N SER A 18 -0.847 -11.895 -9.061 1.00 0.00 N ATOM 258 CA SER A 18 -0.646 -10.434 -9.295 1.00 0.00 C ATOM 259 C SER A 18 -1.831 -9.614 -8.786 1.00 0.00 C ATOM 260 O SER A 18 -2.979 -9.920 -9.048 1.00 0.00 O ATOM 261 CB SER A 18 -0.515 -10.294 -10.809 1.00 0.00 C ATOM 262 OG SER A 18 -0.227 -8.940 -11.132 1.00 0.00 O ATOM 0 H SER A 18 -1.725 -12.276 -9.415 1.00 0.00 H new ATOM 0 HA SER A 18 0.229 -10.062 -8.762 1.00 0.00 H new ATOM 0 HB2 SER A 18 0.277 -10.945 -11.179 1.00 0.00 H new ATOM 0 HB3 SER A 18 -1.438 -10.608 -11.296 1.00 0.00 H new ATOM 0 HG SER A 18 0.742 -8.797 -11.106 1.00 0.00 H new ATOM 268 N PHE A 19 -1.544 -8.557 -8.079 1.00 0.00 N ATOM 269 CA PHE A 19 -2.619 -7.667 -7.554 1.00 0.00 C ATOM 270 C PHE A 19 -2.138 -6.219 -7.604 1.00 0.00 C ATOM 271 O PHE A 19 -0.968 -5.959 -7.820 1.00 0.00 O ATOM 272 CB PHE A 19 -2.881 -8.119 -6.115 1.00 0.00 C ATOM 273 CG PHE A 19 -1.616 -8.033 -5.294 1.00 0.00 C ATOM 274 CD1 PHE A 19 -1.277 -6.825 -4.627 1.00 0.00 C ATOM 275 CD2 PHE A 19 -0.769 -9.168 -5.184 1.00 0.00 C ATOM 276 CE1 PHE A 19 -0.089 -6.752 -3.850 1.00 0.00 C ATOM 277 CE2 PHE A 19 0.419 -9.095 -4.409 1.00 0.00 C ATOM 278 CZ PHE A 19 0.759 -7.887 -3.742 1.00 0.00 C ATOM 0 H PHE A 19 -0.596 -8.267 -7.839 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.535 -7.727 -8.142 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -3.655 -7.496 -5.667 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -3.255 -9.143 -6.112 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -1.922 -5.963 -4.710 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.028 -10.086 -5.690 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.169 -5.834 -3.342 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.064 -9.957 -4.327 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.662 -7.832 -3.153 1.00 0.00 H new ATOM 288 N VAL A 20 -3.026 -5.276 -7.431 1.00 0.00 N ATOM 289 CA VAL A 20 -2.604 -3.845 -7.498 1.00 0.00 C ATOM 290 C VAL A 20 -3.086 -3.059 -6.271 1.00 0.00 C ATOM 291 O VAL A 20 -4.267 -3.006 -5.981 1.00 0.00 O ATOM 292 CB VAL A 20 -3.250 -3.312 -8.780 1.00 0.00 C ATOM 293 CG1 VAL A 20 -2.942 -1.820 -8.950 1.00 0.00 C ATOM 294 CG2 VAL A 20 -2.699 -4.078 -9.985 1.00 0.00 C ATOM 0 H VAL A 20 -4.017 -5.432 -7.248 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.519 -3.741 -7.506 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.329 -3.449 -8.713 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -3.407 -1.454 -9.865 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -3.336 -1.268 -8.097 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -1.863 -1.676 -9.009 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -3.158 -3.699 -10.898 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.619 -3.943 -10.039 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.927 -5.138 -9.877 1.00 0.00 H new ATOM 304 N CYS A 21 -2.176 -2.425 -5.569 1.00 0.00 N ATOM 305 CA CYS A 21 -2.571 -1.610 -4.382 1.00 0.00 C ATOM 306 C CYS A 21 -2.615 -0.135 -4.780 1.00 0.00 C ATOM 307 O CYS A 21 -1.597 0.483 -5.023 1.00 0.00 O ATOM 308 CB CYS A 21 -1.481 -1.849 -3.335 1.00 0.00 C ATOM 309 SG CYS A 21 -1.924 -0.993 -1.799 1.00 0.00 S ATOM 0 H CYS A 21 -1.176 -2.439 -5.770 1.00 0.00 H new ATOM 0 HA CYS A 21 -3.554 -1.883 -3.997 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -1.367 -2.917 -3.149 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -0.522 -1.486 -3.703 1.00 0.00 H new ATOM 314 N GLU A 22 -3.786 0.426 -4.861 1.00 0.00 N ATOM 315 CA GLU A 22 -3.908 1.857 -5.262 1.00 0.00 C ATOM 316 C GLU A 22 -3.773 2.777 -4.050 1.00 0.00 C ATOM 317 O GLU A 22 -4.267 2.486 -2.977 1.00 0.00 O ATOM 318 CB GLU A 22 -5.291 1.952 -5.898 1.00 0.00 C ATOM 319 CG GLU A 22 -5.563 3.384 -6.365 1.00 0.00 C ATOM 320 CD GLU A 22 -6.910 3.441 -7.089 1.00 0.00 C ATOM 321 OE1 GLU A 22 -7.796 2.690 -6.715 1.00 0.00 O ATOM 322 OE2 GLU A 22 -7.034 4.239 -8.004 1.00 0.00 O ATOM 0 H GLU A 22 -4.670 -0.045 -4.666 1.00 0.00 H new ATOM 0 HA GLU A 22 -3.123 2.172 -5.950 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.358 1.267 -6.744 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.051 1.646 -5.179 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -5.569 4.061 -5.511 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -4.767 3.718 -7.030 1.00 0.00 H new ATOM 329 N TYR A 23 -3.096 3.886 -4.221 1.00 0.00 N ATOM 330 CA TYR A 23 -2.910 4.832 -3.102 1.00 0.00 C ATOM 331 C TYR A 23 -3.301 6.242 -3.567 1.00 0.00 C ATOM 332 O TYR A 23 -3.375 6.514 -4.750 1.00 0.00 O ATOM 333 CB TYR A 23 -1.407 4.714 -2.733 1.00 0.00 C ATOM 334 CG TYR A 23 -0.519 5.542 -3.654 1.00 0.00 C ATOM 335 CD1 TYR A 23 -0.408 6.945 -3.450 1.00 0.00 C ATOM 336 CD2 TYR A 23 0.203 4.922 -4.713 1.00 0.00 C ATOM 337 CE1 TYR A 23 0.417 7.726 -4.300 1.00 0.00 C ATOM 338 CE2 TYR A 23 1.030 5.705 -5.563 1.00 0.00 C ATOM 339 CZ TYR A 23 1.137 7.107 -5.357 1.00 0.00 C ATOM 340 OH TYR A 23 1.939 7.867 -6.183 1.00 0.00 O ATOM 0 H TYR A 23 -2.664 4.170 -5.100 1.00 0.00 H new ATOM 0 HA TYR A 23 -3.531 4.619 -2.232 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -1.261 5.039 -1.703 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -1.104 3.668 -2.783 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -0.953 7.417 -2.646 1.00 0.00 H new ATOM 0 HD2 TYR A 23 0.122 3.857 -4.870 1.00 0.00 H new ATOM 0 HE1 TYR A 23 0.498 8.792 -4.143 1.00 0.00 H new ATOM 0 HE2 TYR A 23 1.578 5.234 -6.366 1.00 0.00 H new ATOM 0 HH TYR A 23 2.360 7.288 -6.852 1.00 0.00 H new ATOM 350 N ALA A 24 -3.547 7.127 -2.649 1.00 0.00 N ATOM 351 CA ALA A 24 -3.934 8.521 -3.027 1.00 0.00 C ATOM 352 C ALA A 24 -3.366 9.532 -2.027 1.00 0.00 C ATOM 353 O ALA A 24 -3.513 9.382 -0.829 1.00 0.00 O ATOM 354 CB ALA A 24 -5.461 8.530 -2.986 1.00 0.00 C ATOM 0 H ALA A 24 -3.498 6.950 -1.646 1.00 0.00 H new ATOM 0 HA ALA A 24 -3.546 8.800 -4.006 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -5.826 9.522 -3.252 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -5.848 7.798 -3.695 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -5.800 8.276 -1.981 1.00 0.00 H new ATOM 360 N SER A 25 -2.725 10.565 -2.516 1.00 0.00 N ATOM 361 CA SER A 25 -2.152 11.598 -1.602 1.00 0.00 C ATOM 362 C SER A 25 -1.906 12.910 -2.364 1.00 0.00 C ATOM 363 O SER A 25 -1.818 12.906 -3.576 1.00 0.00 O ATOM 364 CB SER A 25 -0.832 11.005 -1.117 1.00 0.00 C ATOM 365 OG SER A 25 0.046 10.848 -2.224 1.00 0.00 O ATOM 0 H SER A 25 -2.574 10.736 -3.510 1.00 0.00 H new ATOM 0 HA SER A 25 -2.823 11.835 -0.776 1.00 0.00 H new ATOM 0 HB2 SER A 25 -0.380 11.657 -0.369 1.00 0.00 H new ATOM 0 HB3 SER A 25 -1.007 10.042 -0.637 1.00 0.00 H new ATOM 0 HG SER A 25 0.974 10.941 -1.922 1.00 0.00 H new ATOM 371 N PRO A 26 -1.797 14.000 -1.633 1.00 0.00 N ATOM 372 CA PRO A 26 -1.554 15.315 -2.279 1.00 0.00 C ATOM 373 C PRO A 26 -0.119 15.397 -2.810 1.00 0.00 C ATOM 374 O PRO A 26 0.793 14.822 -2.246 1.00 0.00 O ATOM 375 CB PRO A 26 -1.773 16.319 -1.150 1.00 0.00 C ATOM 376 CG PRO A 26 -1.513 15.553 0.107 1.00 0.00 C ATOM 377 CD PRO A 26 -1.885 14.119 -0.167 1.00 0.00 C ATOM 0 HA PRO A 26 -2.205 15.495 -3.135 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -1.096 17.169 -1.241 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -2.788 16.716 -1.167 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -0.465 15.631 0.397 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -2.102 15.954 0.932 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -1.204 13.428 0.331 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -2.889 13.892 0.192 1.00 0.00 H new ATOM 385 N GLY A 27 0.085 16.115 -3.886 1.00 0.00 N ATOM 386 CA GLY A 27 1.459 16.248 -4.456 1.00 0.00 C ATOM 387 C GLY A 27 1.883 14.927 -5.099 1.00 0.00 C ATOM 388 O GLY A 27 1.254 13.903 -4.905 1.00 0.00 O ATOM 0 H GLY A 27 -0.643 16.616 -4.395 1.00 0.00 H new ATOM 0 HA2 GLY A 27 1.479 17.047 -5.197 1.00 0.00 H new ATOM 0 HA3 GLY A 27 2.163 16.524 -3.671 1.00 0.00 H new ATOM 392 N LYS A 28 2.948 14.944 -5.860 1.00 0.00 N ATOM 393 CA LYS A 28 3.426 13.691 -6.519 1.00 0.00 C ATOM 394 C LYS A 28 4.923 13.492 -6.261 1.00 0.00 C ATOM 395 O LYS A 28 5.670 14.442 -6.121 1.00 0.00 O ATOM 396 CB LYS A 28 3.164 13.904 -8.011 1.00 0.00 C ATOM 397 CG LYS A 28 1.659 14.030 -8.258 1.00 0.00 C ATOM 398 CD LYS A 28 0.979 12.684 -7.990 1.00 0.00 C ATOM 399 CE LYS A 28 -0.508 12.786 -8.334 1.00 0.00 C ATOM 400 NZ LYS A 28 -1.044 11.411 -8.133 1.00 0.00 N ATOM 0 H LYS A 28 3.508 15.774 -6.054 1.00 0.00 H new ATOM 0 HA LYS A 28 2.918 12.805 -6.137 1.00 0.00 H new ATOM 0 HB2 LYS A 28 3.675 14.803 -8.355 1.00 0.00 H new ATOM 0 HB3 LYS A 28 3.568 13.069 -8.584 1.00 0.00 H new ATOM 0 HG2 LYS A 28 1.237 14.797 -7.609 1.00 0.00 H new ATOM 0 HG3 LYS A 28 1.474 14.344 -9.285 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.448 11.902 -8.587 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.103 12.404 -6.944 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -1.014 13.505 -7.690 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -0.654 13.120 -9.361 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -2.061 11.400 -8.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -0.548 10.749 -8.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -0.897 11.122 -7.145 1.00 0.00 H new ATOM 414 N ALA A 29 5.362 12.260 -6.206 1.00 0.00 N ATOM 415 CA ALA A 29 6.810 11.978 -5.967 1.00 0.00 C ATOM 416 C ALA A 29 7.211 10.692 -6.694 1.00 0.00 C ATOM 417 O ALA A 29 6.401 9.802 -6.876 1.00 0.00 O ATOM 418 CB ALA A 29 6.937 11.803 -4.454 1.00 0.00 C ATOM 0 H ALA A 29 4.776 11.433 -6.317 1.00 0.00 H new ATOM 0 HA ALA A 29 7.458 12.773 -6.336 1.00 0.00 H new ATOM 0 HB1 ALA A 29 7.975 11.592 -4.198 1.00 0.00 H new ATOM 0 HB2 ALA A 29 6.618 12.718 -3.954 1.00 0.00 H new ATOM 0 HB3 ALA A 29 6.308 10.974 -4.130 1.00 0.00 H new ATOM 424 N THR A 30 8.449 10.586 -7.116 1.00 0.00 N ATOM 425 CA THR A 30 8.884 9.349 -7.839 1.00 0.00 C ATOM 426 C THR A 30 9.177 8.232 -6.862 1.00 0.00 C ATOM 427 O THR A 30 9.029 7.072 -7.169 1.00 0.00 O ATOM 428 CB THR A 30 10.211 9.683 -8.532 1.00 0.00 C ATOM 429 OG1 THR A 30 11.214 9.896 -7.547 1.00 0.00 O ATOM 430 CG2 THR A 30 10.094 10.932 -9.379 1.00 0.00 C ATOM 0 H THR A 30 9.171 11.296 -6.992 1.00 0.00 H new ATOM 0 HA THR A 30 8.100 9.037 -8.530 1.00 0.00 H new ATOM 0 HB THR A 30 10.473 8.846 -9.179 1.00 0.00 H new ATOM 0 HG1 THR A 30 12.060 10.124 -7.986 1.00 0.00 H new ATOM 0 HG21 THR A 30 11.052 11.140 -9.855 1.00 0.00 H new ATOM 0 HG22 THR A 30 9.333 10.782 -10.145 1.00 0.00 H new ATOM 0 HG23 THR A 30 9.813 11.775 -8.748 1.00 0.00 H new ATOM 438 N GLU A 31 9.667 8.583 -5.715 1.00 0.00 N ATOM 439 CA GLU A 31 10.073 7.545 -4.735 1.00 0.00 C ATOM 440 C GLU A 31 8.878 6.978 -3.961 1.00 0.00 C ATOM 441 O GLU A 31 8.719 7.249 -2.781 1.00 0.00 O ATOM 442 CB GLU A 31 11.017 8.272 -3.767 1.00 0.00 C ATOM 443 CG GLU A 31 12.196 8.907 -4.521 1.00 0.00 C ATOM 444 CD GLU A 31 13.386 7.935 -4.572 1.00 0.00 C ATOM 445 OE1 GLU A 31 13.274 6.843 -4.038 1.00 0.00 O ATOM 446 OE2 GLU A 31 14.396 8.305 -5.148 1.00 0.00 O ATOM 0 H GLU A 31 9.805 9.547 -5.410 1.00 0.00 H new ATOM 0 HA GLU A 31 10.537 6.696 -5.238 1.00 0.00 H new ATOM 0 HB2 GLU A 31 10.467 9.044 -3.228 1.00 0.00 H new ATOM 0 HB3 GLU A 31 11.392 7.569 -3.023 1.00 0.00 H new ATOM 0 HG2 GLU A 31 11.889 9.170 -5.533 1.00 0.00 H new ATOM 0 HG3 GLU A 31 12.495 9.832 -4.028 1.00 0.00 H new ATOM 453 N VAL A 32 8.065 6.150 -4.579 1.00 0.00 N ATOM 454 CA VAL A 32 6.939 5.544 -3.799 1.00 0.00 C ATOM 455 C VAL A 32 7.432 4.223 -3.234 1.00 0.00 C ATOM 456 O VAL A 32 7.304 3.176 -3.836 1.00 0.00 O ATOM 457 CB VAL A 32 5.753 5.338 -4.743 1.00 0.00 C ATOM 458 CG1 VAL A 32 5.157 6.696 -5.106 1.00 0.00 C ATOM 459 CG2 VAL A 32 6.198 4.602 -6.006 1.00 0.00 C ATOM 0 H VAL A 32 8.129 5.875 -5.559 1.00 0.00 H new ATOM 0 HA VAL A 32 6.617 6.186 -2.979 1.00 0.00 H new ATOM 0 HB VAL A 32 4.997 4.732 -4.243 1.00 0.00 H new ATOM 0 HG11 VAL A 32 4.311 6.554 -5.779 1.00 0.00 H new ATOM 0 HG12 VAL A 32 4.819 7.199 -4.200 1.00 0.00 H new ATOM 0 HG13 VAL A 32 5.914 7.306 -5.599 1.00 0.00 H new ATOM 0 HG21 VAL A 32 5.342 4.463 -6.667 1.00 0.00 H new ATOM 0 HG22 VAL A 32 6.961 5.188 -6.518 1.00 0.00 H new ATOM 0 HG23 VAL A 32 6.608 3.629 -5.735 1.00 0.00 H new ATOM 469 N ARG A 33 8.030 4.290 -2.081 1.00 0.00 N ATOM 470 CA ARG A 33 8.594 3.066 -1.431 1.00 0.00 C ATOM 471 C ARG A 33 7.532 1.968 -1.332 1.00 0.00 C ATOM 472 O ARG A 33 6.640 2.032 -0.509 1.00 0.00 O ATOM 473 CB ARG A 33 9.030 3.525 -0.036 1.00 0.00 C ATOM 474 CG ARG A 33 9.887 2.435 0.613 1.00 0.00 C ATOM 475 CD ARG A 33 10.409 2.926 1.964 1.00 0.00 C ATOM 476 NE ARG A 33 11.326 1.845 2.438 1.00 0.00 N ATOM 477 CZ ARG A 33 10.866 0.746 3.003 1.00 0.00 C ATOM 478 NH1 ARG A 33 9.578 0.534 3.150 1.00 0.00 N ATOM 479 NH2 ARG A 33 11.711 -0.158 3.416 1.00 0.00 N ATOM 0 H ARG A 33 8.156 5.151 -1.549 1.00 0.00 H new ATOM 0 HA ARG A 33 9.422 2.644 -2.001 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.596 4.454 -0.107 1.00 0.00 H new ATOM 0 HB3 ARG A 33 8.155 3.731 0.581 1.00 0.00 H new ATOM 0 HG2 ARG A 33 9.298 1.528 0.748 1.00 0.00 H new ATOM 0 HG3 ARG A 33 10.722 2.179 -0.039 1.00 0.00 H new ATOM 0 HD2 ARG A 33 10.936 3.875 1.863 1.00 0.00 H new ATOM 0 HD3 ARG A 33 9.593 3.088 2.668 1.00 0.00 H new ATOM 0 HE ARG A 33 12.333 1.960 2.321 1.00 0.00 H new ATOM 0 HH11 ARG A 33 8.906 1.229 2.823 1.00 0.00 H new ATOM 0 HH12 ARG A 33 9.250 -0.325 3.591 1.00 0.00 H new ATOM 0 HH21 ARG A 33 12.714 -0.010 3.300 1.00 0.00 H new ATOM 0 HH22 ARG A 33 11.369 -1.013 3.855 1.00 0.00 H new ATOM 493 N VAL A 34 7.629 0.961 -2.169 1.00 0.00 N ATOM 494 CA VAL A 34 6.629 -0.140 -2.129 1.00 0.00 C ATOM 495 C VAL A 34 7.243 -1.414 -1.540 1.00 0.00 C ATOM 496 O VAL A 34 8.308 -1.851 -1.930 1.00 0.00 O ATOM 497 CB VAL A 34 6.174 -0.366 -3.578 1.00 0.00 C ATOM 498 CG1 VAL A 34 5.460 0.888 -4.096 1.00 0.00 C ATOM 499 CG2 VAL A 34 7.373 -0.673 -4.484 1.00 0.00 C ATOM 0 H VAL A 34 8.358 0.859 -2.875 1.00 0.00 H new ATOM 0 HA VAL A 34 5.784 0.120 -1.491 1.00 0.00 H new ATOM 0 HB VAL A 34 5.493 -1.217 -3.595 1.00 0.00 H new ATOM 0 HG11 VAL A 34 5.138 0.725 -5.125 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.590 1.095 -3.472 1.00 0.00 H new ATOM 0 HG13 VAL A 34 6.143 1.737 -4.060 1.00 0.00 H new ATOM 0 HG21 VAL A 34 7.026 -0.829 -5.506 1.00 0.00 H new ATOM 0 HG22 VAL A 34 8.070 0.165 -4.462 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.876 -1.573 -4.130 1.00 0.00 H new ATOM 509 N THR A 35 6.559 -2.010 -0.603 1.00 0.00 N ATOM 510 CA THR A 35 7.060 -3.270 0.025 1.00 0.00 C ATOM 511 C THR A 35 5.908 -4.268 0.151 1.00 0.00 C ATOM 512 O THR A 35 4.756 -3.891 0.294 1.00 0.00 O ATOM 513 CB THR A 35 7.607 -2.884 1.415 1.00 0.00 C ATOM 514 OG1 THR A 35 8.659 -1.942 1.262 1.00 0.00 O ATOM 515 CG2 THR A 35 8.142 -4.135 2.131 1.00 0.00 C ATOM 0 H THR A 35 5.666 -1.677 -0.241 1.00 0.00 H new ATOM 0 HA THR A 35 7.841 -3.739 -0.574 1.00 0.00 H new ATOM 0 HB THR A 35 6.805 -2.446 2.009 1.00 0.00 H new ATOM 0 HG1 THR A 35 9.112 -1.814 2.122 1.00 0.00 H new ATOM 0 HG21 THR A 35 8.527 -3.856 3.112 1.00 0.00 H new ATOM 0 HG22 THR A 35 7.336 -4.859 2.250 1.00 0.00 H new ATOM 0 HG23 THR A 35 8.943 -4.578 1.539 1.00 0.00 H new ATOM 523 N VAL A 36 6.215 -5.533 0.097 1.00 0.00 N ATOM 524 CA VAL A 36 5.158 -6.573 0.221 1.00 0.00 C ATOM 525 C VAL A 36 5.445 -7.405 1.475 1.00 0.00 C ATOM 526 O VAL A 36 6.591 -7.688 1.768 1.00 0.00 O ATOM 527 CB VAL A 36 5.277 -7.413 -1.057 1.00 0.00 C ATOM 528 CG1 VAL A 36 4.282 -8.575 -1.009 1.00 0.00 C ATOM 529 CG2 VAL A 36 4.972 -6.529 -2.276 1.00 0.00 C ATOM 0 H VAL A 36 7.161 -5.894 -0.029 1.00 0.00 H new ATOM 0 HA VAL A 36 4.151 -6.168 0.322 1.00 0.00 H new ATOM 0 HB VAL A 36 6.289 -7.810 -1.135 1.00 0.00 H new ATOM 0 HG11 VAL A 36 4.371 -9.168 -1.919 1.00 0.00 H new ATOM 0 HG12 VAL A 36 4.497 -9.203 -0.144 1.00 0.00 H new ATOM 0 HG13 VAL A 36 3.268 -8.183 -0.929 1.00 0.00 H new ATOM 0 HG21 VAL A 36 5.056 -7.123 -3.186 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.960 -6.132 -2.194 1.00 0.00 H new ATOM 0 HG23 VAL A 36 5.683 -5.704 -2.314 1.00 0.00 H new ATOM 539 N LEU A 37 4.438 -7.779 2.241 1.00 0.00 N ATOM 540 CA LEU A 37 4.722 -8.572 3.473 1.00 0.00 C ATOM 541 C LEU A 37 3.878 -9.834 3.512 1.00 0.00 C ATOM 542 O LEU A 37 2.903 -9.961 2.807 1.00 0.00 O ATOM 543 CB LEU A 37 4.333 -7.668 4.641 1.00 0.00 C ATOM 544 CG LEU A 37 5.181 -6.405 4.625 1.00 0.00 C ATOM 545 CD1 LEU A 37 4.457 -5.299 5.395 1.00 0.00 C ATOM 546 CD2 LEU A 37 6.525 -6.703 5.288 1.00 0.00 C ATOM 0 H LEU A 37 3.455 -7.571 2.066 1.00 0.00 H new ATOM 0 HA LEU A 37 5.768 -8.877 3.510 1.00 0.00 H new ATOM 0 HB2 LEU A 37 3.277 -7.408 4.574 1.00 0.00 H new ATOM 0 HB3 LEU A 37 4.472 -8.197 5.584 1.00 0.00 H new ATOM 0 HG LEU A 37 5.345 -6.078 3.598 1.00 0.00 H new ATOM 0 HD11 LEU A 37 5.062 -4.393 5.385 1.00 0.00 H new ATOM 0 HD12 LEU A 37 3.495 -5.098 4.924 1.00 0.00 H new ATOM 0 HD13 LEU A 37 4.297 -5.617 6.425 1.00 0.00 H new ATOM 0 HD21 LEU A 37 7.141 -5.804 5.282 1.00 0.00 H new ATOM 0 HD22 LEU A 37 6.360 -7.023 6.317 1.00 0.00 H new ATOM 0 HD23 LEU A 37 7.034 -7.495 4.739 1.00 0.00 H new ATOM 558 N ARG A 38 4.243 -10.756 4.356 1.00 0.00 N ATOM 559 CA ARG A 38 3.454 -12.013 4.480 1.00 0.00 C ATOM 560 C ARG A 38 3.098 -12.233 5.949 1.00 0.00 C ATOM 561 O ARG A 38 3.971 -12.395 6.783 1.00 0.00 O ATOM 562 CB ARG A 38 4.379 -13.121 3.973 1.00 0.00 C ATOM 563 CG ARG A 38 3.594 -14.430 3.862 1.00 0.00 C ATOM 564 CD ARG A 38 4.494 -15.518 3.271 1.00 0.00 C ATOM 565 NE ARG A 38 5.581 -15.709 4.279 1.00 0.00 N ATOM 566 CZ ARG A 38 5.396 -16.437 5.364 1.00 0.00 C ATOM 567 NH1 ARG A 38 4.240 -17.004 5.624 1.00 0.00 N ATOM 568 NH2 ARG A 38 6.383 -16.589 6.204 1.00 0.00 N ATOM 0 H ARG A 38 5.057 -10.694 4.968 1.00 0.00 H new ATOM 0 HA ARG A 38 2.522 -11.988 3.915 1.00 0.00 H new ATOM 0 HB2 ARG A 38 4.792 -12.849 3.002 1.00 0.00 H new ATOM 0 HB3 ARG A 38 5.221 -13.246 4.654 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.235 -14.735 4.845 1.00 0.00 H new ATOM 0 HG3 ARG A 38 2.716 -14.287 3.232 1.00 0.00 H new ATOM 0 HD2 ARG A 38 3.940 -16.443 3.107 1.00 0.00 H new ATOM 0 HD3 ARG A 38 4.899 -15.214 2.306 1.00 0.00 H new ATOM 0 HE ARG A 38 6.487 -15.266 4.125 1.00 0.00 H new ATOM 0 HH11 ARG A 38 3.458 -16.887 4.980 1.00 0.00 H new ATOM 0 HH12 ARG A 38 4.124 -17.562 6.470 1.00 0.00 H new ATOM 0 HH21 ARG A 38 7.284 -16.148 6.018 1.00 0.00 H new ATOM 0 HH22 ARG A 38 6.254 -17.149 7.047 1.00 0.00 H new ATOM 582 N GLN A 39 1.829 -12.235 6.277 1.00 0.00 N ATOM 583 CA GLN A 39 1.438 -12.441 7.703 1.00 0.00 C ATOM 584 C GLN A 39 0.883 -13.847 7.910 1.00 0.00 C ATOM 585 O GLN A 39 -0.058 -14.263 7.261 1.00 0.00 O ATOM 586 CB GLN A 39 0.373 -11.384 8.000 1.00 0.00 C ATOM 587 CG GLN A 39 1.022 -9.998 8.028 1.00 0.00 C ATOM 588 CD GLN A 39 -0.047 -8.934 8.285 1.00 0.00 C ATOM 589 OE1 GLN A 39 -0.946 -8.693 7.372 1.00 0.00 O flip ATOM 590 NE2 GLN A 39 -0.061 -8.312 9.329 1.00 0.00 N flip ATOM 0 H GLN A 39 1.055 -12.104 5.625 1.00 0.00 H new ATOM 0 HA GLN A 39 2.292 -12.342 8.372 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -0.408 -11.416 7.240 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -0.105 -11.593 8.957 1.00 0.00 H new ATOM 0 HG2 GLN A 39 1.784 -9.958 8.807 1.00 0.00 H new ATOM 0 HG3 GLN A 39 1.524 -9.802 7.081 1.00 0.00 H new ATOM 0 HE21 GLN A 39 0.642 -8.500 10.044 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -0.776 -7.602 9.490 1.00 0.00 H new ATOM 599 N ALA A 40 1.471 -14.575 8.820 1.00 0.00 N ATOM 600 CA ALA A 40 1.007 -15.960 9.104 1.00 0.00 C ATOM 601 C ALA A 40 0.654 -16.080 10.586 1.00 0.00 C ATOM 602 O ALA A 40 1.166 -15.346 11.411 1.00 0.00 O ATOM 603 CB ALA A 40 2.200 -16.854 8.755 1.00 0.00 C ATOM 0 H ALA A 40 2.262 -14.264 9.384 1.00 0.00 H new ATOM 0 HA ALA A 40 0.119 -16.237 8.535 1.00 0.00 H new ATOM 0 HB1 ALA A 40 1.939 -17.896 8.937 1.00 0.00 H new ATOM 0 HB2 ALA A 40 2.458 -16.723 7.704 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.054 -16.580 9.375 1.00 0.00 H new ATOM 609 N ASP A 41 -0.220 -16.991 10.931 1.00 0.00 N ATOM 610 CA ASP A 41 -0.605 -17.151 12.368 1.00 0.00 C ATOM 611 C ASP A 41 0.623 -17.492 13.215 1.00 0.00 C ATOM 612 O ASP A 41 0.815 -16.952 14.288 1.00 0.00 O ATOM 613 CB ASP A 41 -1.609 -18.298 12.392 1.00 0.00 C ATOM 614 CG ASP A 41 -2.938 -17.843 11.779 1.00 0.00 C ATOM 615 OD1 ASP A 41 -3.234 -16.661 11.856 1.00 0.00 O ATOM 616 OD2 ASP A 41 -3.641 -18.688 11.249 1.00 0.00 O ATOM 0 H ASP A 41 -0.683 -17.629 10.284 1.00 0.00 H new ATOM 0 HA ASP A 41 -1.028 -16.235 12.781 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -1.215 -19.149 11.836 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -1.767 -18.632 13.417 1.00 0.00 H new ATOM 621 N SER A 42 1.454 -18.384 12.738 1.00 0.00 N ATOM 622 CA SER A 42 2.675 -18.763 13.513 1.00 0.00 C ATOM 623 C SER A 42 3.667 -17.596 13.577 1.00 0.00 C ATOM 624 O SER A 42 4.153 -17.248 14.637 1.00 0.00 O ATOM 625 CB SER A 42 3.286 -19.940 12.751 1.00 0.00 C ATOM 626 OG SER A 42 2.446 -21.078 12.892 1.00 0.00 O ATOM 0 H SER A 42 1.340 -18.866 11.846 1.00 0.00 H new ATOM 0 HA SER A 42 2.432 -19.022 14.543 1.00 0.00 H new ATOM 0 HB2 SER A 42 3.400 -19.686 11.697 1.00 0.00 H new ATOM 0 HB3 SER A 42 4.282 -20.159 13.135 1.00 0.00 H new ATOM 0 HG SER A 42 2.834 -21.834 12.403 1.00 0.00 H new ATOM 632 N GLN A 43 3.978 -16.994 12.452 1.00 0.00 N ATOM 633 CA GLN A 43 4.950 -15.853 12.450 1.00 0.00 C ATOM 634 C GLN A 43 4.709 -14.924 11.252 1.00 0.00 C ATOM 635 O GLN A 43 4.103 -15.303 10.269 1.00 0.00 O ATOM 636 CB GLN A 43 6.333 -16.503 12.332 1.00 0.00 C ATOM 637 CG GLN A 43 6.703 -17.196 13.645 1.00 0.00 C ATOM 638 CD GLN A 43 8.173 -17.617 13.602 1.00 0.00 C ATOM 639 OE1 GLN A 43 8.486 -18.786 13.711 1.00 0.00 O ATOM 640 NE2 GLN A 43 9.095 -16.706 13.446 1.00 0.00 N ATOM 0 H GLN A 43 3.602 -17.243 11.537 1.00 0.00 H new ATOM 0 HA GLN A 43 4.848 -15.244 13.348 1.00 0.00 H new ATOM 0 HB2 GLN A 43 6.335 -17.227 11.517 1.00 0.00 H new ATOM 0 HB3 GLN A 43 7.079 -15.747 12.088 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.531 -16.523 14.485 1.00 0.00 H new ATOM 0 HG3 GLN A 43 6.068 -18.068 13.800 1.00 0.00 H new ATOM 0 HE21 GLN A 43 8.832 -15.725 13.354 1.00 0.00 H new ATOM 0 HE22 GLN A 43 10.078 -16.976 13.416 1.00 0.00 H new ATOM 649 N VAL A 44 5.204 -13.712 11.329 1.00 0.00 N ATOM 650 CA VAL A 44 5.040 -12.744 10.201 1.00 0.00 C ATOM 651 C VAL A 44 6.417 -12.209 9.788 1.00 0.00 C ATOM 652 O VAL A 44 7.225 -11.847 10.623 1.00 0.00 O ATOM 653 CB VAL A 44 4.168 -11.616 10.762 1.00 0.00 C ATOM 654 CG1 VAL A 44 4.008 -10.503 9.719 1.00 0.00 C ATOM 655 CG2 VAL A 44 2.787 -12.169 11.131 1.00 0.00 C ATOM 0 H VAL A 44 5.719 -13.350 12.132 1.00 0.00 H new ATOM 0 HA VAL A 44 4.586 -13.197 9.320 1.00 0.00 H new ATOM 0 HB VAL A 44 4.649 -11.207 11.650 1.00 0.00 H new ATOM 0 HG11 VAL A 44 3.386 -9.707 10.129 1.00 0.00 H new ATOM 0 HG12 VAL A 44 4.988 -10.102 9.462 1.00 0.00 H new ATOM 0 HG13 VAL A 44 3.535 -10.908 8.824 1.00 0.00 H new ATOM 0 HG21 VAL A 44 2.168 -11.365 11.530 1.00 0.00 H new ATOM 0 HG22 VAL A 44 2.313 -12.586 10.242 1.00 0.00 H new ATOM 0 HG23 VAL A 44 2.897 -12.950 11.883 1.00 0.00 H new ATOM 665 N THR A 45 6.688 -12.165 8.510 1.00 0.00 N ATOM 666 CA THR A 45 8.018 -11.660 8.039 1.00 0.00 C ATOM 667 C THR A 45 7.869 -10.807 6.772 1.00 0.00 C ATOM 668 O THR A 45 6.856 -10.847 6.099 1.00 0.00 O ATOM 669 CB THR A 45 8.835 -12.919 7.737 1.00 0.00 C ATOM 670 OG1 THR A 45 8.177 -13.678 6.732 1.00 0.00 O ATOM 671 CG2 THR A 45 8.977 -13.762 9.006 1.00 0.00 C ATOM 0 H THR A 45 6.049 -12.456 7.770 1.00 0.00 H new ATOM 0 HA THR A 45 8.493 -11.024 8.786 1.00 0.00 H new ATOM 0 HB THR A 45 9.826 -12.631 7.387 1.00 0.00 H new ATOM 0 HG1 THR A 45 8.699 -14.484 6.536 1.00 0.00 H new ATOM 0 HG21 THR A 45 9.559 -14.657 8.785 1.00 0.00 H new ATOM 0 HG22 THR A 45 9.484 -13.179 9.775 1.00 0.00 H new ATOM 0 HG23 THR A 45 7.989 -14.051 9.363 1.00 0.00 H new ATOM 679 N GLU A 46 8.885 -10.047 6.439 1.00 0.00 N ATOM 680 CA GLU A 46 8.831 -9.197 5.212 1.00 0.00 C ATOM 681 C GLU A 46 9.125 -10.047 3.980 1.00 0.00 C ATOM 682 O GLU A 46 9.741 -11.093 4.064 1.00 0.00 O ATOM 683 CB GLU A 46 9.920 -8.133 5.401 1.00 0.00 C ATOM 684 CG GLU A 46 9.931 -7.151 4.225 1.00 0.00 C ATOM 685 CD GLU A 46 11.207 -6.309 4.283 1.00 0.00 C ATOM 686 OE1 GLU A 46 11.387 -5.610 5.267 1.00 0.00 O ATOM 687 OE2 GLU A 46 11.981 -6.377 3.343 1.00 0.00 O ATOM 0 H GLU A 46 9.754 -9.980 6.969 1.00 0.00 H new ATOM 0 HA GLU A 46 7.850 -8.745 5.069 1.00 0.00 H new ATOM 0 HB2 GLU A 46 9.748 -7.591 6.331 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.894 -8.614 5.488 1.00 0.00 H new ATOM 0 HG2 GLU A 46 9.883 -7.695 3.282 1.00 0.00 H new ATOM 0 HG3 GLU A 46 9.053 -6.506 4.266 1.00 0.00 H new ATOM 694 N VAL A 47 8.677 -9.601 2.843 1.00 0.00 N ATOM 695 CA VAL A 47 8.908 -10.368 1.588 1.00 0.00 C ATOM 696 C VAL A 47 9.843 -9.575 0.653 1.00 0.00 C ATOM 697 O VAL A 47 11.047 -9.724 0.721 1.00 0.00 O ATOM 698 CB VAL A 47 7.504 -10.557 0.997 1.00 0.00 C ATOM 699 CG1 VAL A 47 7.588 -11.257 -0.353 1.00 0.00 C ATOM 700 CG2 VAL A 47 6.662 -11.407 1.951 1.00 0.00 C ATOM 0 H VAL A 47 8.157 -8.731 2.727 1.00 0.00 H new ATOM 0 HA VAL A 47 9.399 -11.328 1.745 1.00 0.00 H new ATOM 0 HB VAL A 47 7.044 -9.578 0.863 1.00 0.00 H new ATOM 0 HG11 VAL A 47 6.585 -11.384 -0.760 1.00 0.00 H new ATOM 0 HG12 VAL A 47 8.184 -10.655 -1.039 1.00 0.00 H new ATOM 0 HG13 VAL A 47 8.055 -12.234 -0.228 1.00 0.00 H new ATOM 0 HG21 VAL A 47 5.664 -11.543 1.533 1.00 0.00 H new ATOM 0 HG22 VAL A 47 7.135 -12.380 2.085 1.00 0.00 H new ATOM 0 HG23 VAL A 47 6.586 -10.905 2.915 1.00 0.00 H new ATOM 710 N CYS A 48 9.317 -8.733 -0.207 1.00 0.00 N ATOM 711 CA CYS A 48 10.203 -7.946 -1.125 1.00 0.00 C ATOM 712 C CYS A 48 9.961 -6.446 -0.939 1.00 0.00 C ATOM 713 O CYS A 48 8.874 -6.030 -0.582 1.00 0.00 O ATOM 714 CB CYS A 48 9.809 -8.403 -2.529 1.00 0.00 C ATOM 715 SG CYS A 48 10.365 -10.109 -2.776 1.00 0.00 S ATOM 0 H CYS A 48 8.318 -8.558 -0.313 1.00 0.00 H new ATOM 0 HA CYS A 48 11.263 -8.110 -0.930 1.00 0.00 H new ATOM 0 HB2 CYS A 48 8.728 -8.338 -2.656 1.00 0.00 H new ATOM 0 HB3 CYS A 48 10.258 -7.749 -3.277 1.00 0.00 H new ATOM 720 N ALA A 49 10.971 -5.630 -1.156 1.00 0.00 N ATOM 721 CA ALA A 49 10.788 -4.159 -0.962 1.00 0.00 C ATOM 722 C ALA A 49 11.699 -3.343 -1.891 1.00 0.00 C ATOM 723 O ALA A 49 12.850 -3.670 -2.101 1.00 0.00 O ATOM 724 CB ALA A 49 11.165 -3.920 0.501 1.00 0.00 C ATOM 0 H ALA A 49 11.902 -5.919 -1.456 1.00 0.00 H new ATOM 0 HA ALA A 49 9.771 -3.846 -1.197 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.060 -2.861 0.735 1.00 0.00 H new ATOM 0 HB2 ALA A 49 10.506 -4.501 1.146 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.198 -4.227 0.666 1.00 0.00 H new ATOM 730 N ALA A 50 11.178 -2.268 -2.430 1.00 0.00 N ATOM 731 CA ALA A 50 11.981 -1.387 -3.334 1.00 0.00 C ATOM 732 C ALA A 50 11.175 -0.119 -3.642 1.00 0.00 C ATOM 733 O ALA A 50 9.958 -0.140 -3.607 1.00 0.00 O ATOM 734 CB ALA A 50 12.204 -2.206 -4.609 1.00 0.00 C ATOM 0 H ALA A 50 10.217 -1.960 -2.280 1.00 0.00 H new ATOM 0 HA ALA A 50 12.928 -1.080 -2.891 1.00 0.00 H new ATOM 0 HB1 ALA A 50 12.788 -1.621 -5.320 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.742 -3.122 -4.364 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.241 -2.459 -5.052 1.00 0.00 H new ATOM 740 N THR A 51 11.829 0.979 -3.947 1.00 0.00 N ATOM 741 CA THR A 51 11.064 2.229 -4.257 1.00 0.00 C ATOM 742 C THR A 51 10.812 2.310 -5.754 1.00 0.00 C ATOM 743 O THR A 51 11.741 2.338 -6.541 1.00 0.00 O ATOM 744 CB THR A 51 11.947 3.403 -3.814 1.00 0.00 C ATOM 745 OG1 THR A 51 12.585 3.082 -2.587 1.00 0.00 O ATOM 746 CG2 THR A 51 11.070 4.642 -3.617 1.00 0.00 C ATOM 0 H THR A 51 12.844 1.063 -3.994 1.00 0.00 H new ATOM 0 HA THR A 51 10.102 2.246 -3.746 1.00 0.00 H new ATOM 0 HB THR A 51 12.702 3.599 -4.575 1.00 0.00 H new ATOM 0 HG1 THR A 51 12.858 3.907 -2.134 1.00 0.00 H new ATOM 0 HG21 THR A 51 11.691 5.481 -3.302 1.00 0.00 H new ATOM 0 HG22 THR A 51 10.574 4.890 -4.556 1.00 0.00 H new ATOM 0 HG23 THR A 51 10.320 4.439 -2.853 1.00 0.00 H new ATOM 754 N TYR A 52 9.569 2.358 -6.157 1.00 0.00 N ATOM 755 CA TYR A 52 9.277 2.447 -7.605 1.00 0.00 C ATOM 756 C TYR A 52 9.472 3.879 -8.060 1.00 0.00 C ATOM 757 O TYR A 52 8.678 4.748 -7.738 1.00 0.00 O ATOM 758 CB TYR A 52 7.810 2.058 -7.764 1.00 0.00 C ATOM 759 CG TYR A 52 7.508 1.834 -9.225 1.00 0.00 C ATOM 760 CD1 TYR A 52 7.395 2.939 -10.121 1.00 0.00 C ATOM 761 CD2 TYR A 52 7.339 0.511 -9.706 1.00 0.00 C ATOM 762 CE1 TYR A 52 7.113 2.708 -11.495 1.00 0.00 C ATOM 763 CE2 TYR A 52 7.057 0.283 -11.079 1.00 0.00 C ATOM 764 CZ TYR A 52 6.943 1.381 -11.974 1.00 0.00 C ATOM 765 OH TYR A 52 6.669 1.159 -13.308 1.00 0.00 O ATOM 0 H TYR A 52 8.753 2.339 -5.545 1.00 0.00 H new ATOM 0 HA TYR A 52 9.928 1.801 -8.194 1.00 0.00 H new ATOM 0 HB2 TYR A 52 7.598 1.153 -7.194 1.00 0.00 H new ATOM 0 HB3 TYR A 52 7.168 2.844 -7.365 1.00 0.00 H new ATOM 0 HD1 TYR A 52 7.523 3.947 -9.756 1.00 0.00 H new ATOM 0 HD2 TYR A 52 7.425 -0.325 -9.027 1.00 0.00 H new ATOM 0 HE1 TYR A 52 7.028 3.542 -12.176 1.00 0.00 H new ATOM 0 HE2 TYR A 52 6.929 -0.726 -11.443 1.00 0.00 H new ATOM 0 HH TYR A 52 6.583 0.196 -13.468 1.00 0.00 H new ATOM 775 N MET A 53 10.505 4.125 -8.819 1.00 0.00 N ATOM 776 CA MET A 53 10.735 5.498 -9.332 1.00 0.00 C ATOM 777 C MET A 53 9.816 5.663 -10.533 1.00 0.00 C ATOM 778 O MET A 53 9.238 4.698 -10.995 1.00 0.00 O ATOM 779 CB MET A 53 12.184 5.549 -9.802 1.00 0.00 C ATOM 780 CG MET A 53 13.136 5.152 -8.671 1.00 0.00 C ATOM 781 SD MET A 53 14.038 6.615 -8.119 1.00 0.00 S ATOM 782 CE MET A 53 12.618 7.468 -7.401 1.00 0.00 C ATOM 0 H MET A 53 11.197 3.432 -9.104 1.00 0.00 H new ATOM 0 HA MET A 53 10.546 6.272 -8.589 1.00 0.00 H new ATOM 0 HB2 MET A 53 12.320 4.878 -10.650 1.00 0.00 H new ATOM 0 HB3 MET A 53 12.423 6.554 -10.149 1.00 0.00 H new ATOM 0 HG2 MET A 53 12.576 4.720 -7.842 1.00 0.00 H new ATOM 0 HG3 MET A 53 13.833 4.388 -9.016 1.00 0.00 H new ATOM 0 HE1 MET A 53 12.950 8.390 -6.924 1.00 0.00 H new ATOM 0 HE2 MET A 53 11.900 7.705 -8.187 1.00 0.00 H new ATOM 0 HE3 MET A 53 12.145 6.825 -6.659 1.00 0.00 H new ATOM 792 N MET A 54 9.669 6.841 -11.058 1.00 0.00 N ATOM 793 CA MET A 54 8.768 6.993 -12.233 1.00 0.00 C ATOM 794 C MET A 54 9.345 6.280 -13.465 1.00 0.00 C ATOM 795 O MET A 54 8.603 5.854 -14.331 1.00 0.00 O ATOM 796 CB MET A 54 8.657 8.496 -12.481 1.00 0.00 C ATOM 797 CG MET A 54 7.983 9.156 -11.282 1.00 0.00 C ATOM 798 SD MET A 54 6.378 8.370 -10.981 1.00 0.00 S ATOM 799 CE MET A 54 6.918 7.200 -9.707 1.00 0.00 C ATOM 0 H MET A 54 10.124 7.694 -10.734 1.00 0.00 H new ATOM 0 HA MET A 54 7.793 6.544 -12.045 1.00 0.00 H new ATOM 0 HB2 MET A 54 9.647 8.924 -12.638 1.00 0.00 H new ATOM 0 HB3 MET A 54 8.081 8.685 -13.387 1.00 0.00 H new ATOM 0 HG2 MET A 54 8.616 9.064 -10.399 1.00 0.00 H new ATOM 0 HG3 MET A 54 7.849 10.222 -11.468 1.00 0.00 H new ATOM 0 HE1 MET A 54 6.925 6.191 -10.119 1.00 0.00 H new ATOM 0 HE2 MET A 54 7.922 7.463 -9.374 1.00 0.00 H new ATOM 0 HE3 MET A 54 6.232 7.241 -8.861 1.00 0.00 H new ATOM 809 N GLY A 55 10.654 6.161 -13.572 1.00 0.00 N ATOM 810 CA GLY A 55 11.233 5.489 -14.780 1.00 0.00 C ATOM 811 C GLY A 55 12.499 4.676 -14.454 1.00 0.00 C ATOM 812 O GLY A 55 13.401 4.600 -15.268 1.00 0.00 O ATOM 0 H GLY A 55 11.332 6.494 -12.887 1.00 0.00 H new ATOM 0 HA2 GLY A 55 10.484 4.829 -15.218 1.00 0.00 H new ATOM 0 HA3 GLY A 55 11.472 6.242 -15.531 1.00 0.00 H new ATOM 816 N ASN A 56 12.577 4.047 -13.303 1.00 0.00 N ATOM 817 CA ASN A 56 13.793 3.222 -12.989 1.00 0.00 C ATOM 818 C ASN A 56 13.378 1.829 -12.498 1.00 0.00 C ATOM 819 O ASN A 56 12.257 1.620 -12.074 1.00 0.00 O ATOM 820 CB ASN A 56 14.562 3.976 -11.902 1.00 0.00 C ATOM 821 CG ASN A 56 14.961 5.359 -12.423 1.00 0.00 C ATOM 822 OD1 ASN A 56 15.480 5.482 -13.515 1.00 0.00 O ATOM 823 ND2 ASN A 56 14.747 6.411 -11.681 1.00 0.00 N ATOM 0 H ASN A 56 11.862 4.067 -12.575 1.00 0.00 H new ATOM 0 HA ASN A 56 14.414 3.078 -13.873 1.00 0.00 H new ATOM 0 HB2 ASN A 56 13.945 4.076 -11.009 1.00 0.00 H new ATOM 0 HB3 ASN A 56 15.451 3.414 -11.614 1.00 0.00 H new ATOM 0 HD21 ASN A 56 15.015 7.336 -12.018 1.00 0.00 H new ATOM 0 HD22 ASN A 56 14.311 6.309 -10.764 1.00 0.00 H new ATOM 830 N GLU A 57 14.274 0.875 -12.567 1.00 0.00 N ATOM 831 CA GLU A 57 13.943 -0.515 -12.122 1.00 0.00 C ATOM 832 C GLU A 57 14.107 -0.663 -10.604 1.00 0.00 C ATOM 833 O GLU A 57 15.035 -0.142 -10.014 1.00 0.00 O ATOM 834 CB GLU A 57 14.941 -1.411 -12.856 1.00 0.00 C ATOM 835 CG GLU A 57 14.630 -2.879 -12.553 1.00 0.00 C ATOM 836 CD GLU A 57 15.563 -3.781 -13.364 1.00 0.00 C ATOM 837 OE1 GLU A 57 15.924 -3.395 -14.464 1.00 0.00 O ATOM 838 OE2 GLU A 57 15.902 -4.844 -12.870 1.00 0.00 O ATOM 0 H GLU A 57 15.225 1.000 -12.914 1.00 0.00 H new ATOM 0 HA GLU A 57 12.908 -0.775 -12.346 1.00 0.00 H new ATOM 0 HB2 GLU A 57 14.886 -1.231 -13.930 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.958 -1.172 -12.544 1.00 0.00 H new ATOM 0 HG2 GLU A 57 14.754 -3.075 -11.488 1.00 0.00 H new ATOM 0 HG3 GLU A 57 13.591 -3.099 -12.799 1.00 0.00 H new ATOM 845 N LEU A 58 13.206 -1.375 -9.974 1.00 0.00 N ATOM 846 CA LEU A 58 13.284 -1.578 -8.499 1.00 0.00 C ATOM 847 C LEU A 58 14.119 -2.819 -8.179 1.00 0.00 C ATOM 848 O LEU A 58 13.904 -3.880 -8.736 1.00 0.00 O ATOM 849 CB LEU A 58 11.836 -1.792 -8.062 1.00 0.00 C ATOM 850 CG LEU A 58 11.064 -0.475 -8.158 1.00 0.00 C ATOM 851 CD1 LEU A 58 10.644 -0.234 -9.611 1.00 0.00 C ATOM 852 CD2 LEU A 58 9.819 -0.548 -7.264 1.00 0.00 C ATOM 0 H LEU A 58 12.412 -1.828 -10.426 1.00 0.00 H new ATOM 0 HA LEU A 58 13.753 -0.736 -7.989 1.00 0.00 H new ATOM 0 HB2 LEU A 58 11.365 -2.547 -8.691 1.00 0.00 H new ATOM 0 HB3 LEU A 58 11.807 -2.167 -7.039 1.00 0.00 H new ATOM 0 HG LEU A 58 11.699 0.346 -7.826 1.00 0.00 H new ATOM 0 HD11 LEU A 58 10.094 0.704 -9.680 1.00 0.00 H new ATOM 0 HD12 LEU A 58 11.531 -0.182 -10.242 1.00 0.00 H new ATOM 0 HD13 LEU A 58 10.008 -1.053 -9.946 1.00 0.00 H new ATOM 0 HD21 LEU A 58 9.267 0.390 -7.331 1.00 0.00 H new ATOM 0 HD22 LEU A 58 9.182 -1.368 -7.594 1.00 0.00 H new ATOM 0 HD23 LEU A 58 10.122 -0.717 -6.231 1.00 0.00 H new ATOM 864 N THR A 59 15.074 -2.693 -7.294 1.00 0.00 N ATOM 865 CA THR A 59 15.928 -3.846 -6.937 1.00 0.00 C ATOM 866 C THR A 59 15.468 -4.483 -5.621 1.00 0.00 C ATOM 867 O THR A 59 15.198 -3.801 -4.650 1.00 0.00 O ATOM 868 CB THR A 59 17.309 -3.225 -6.776 1.00 0.00 C ATOM 869 OG1 THR A 59 17.246 -2.179 -5.817 1.00 0.00 O ATOM 870 CG2 THR A 59 17.790 -2.669 -8.118 1.00 0.00 C ATOM 0 H THR A 59 15.295 -1.827 -6.802 1.00 0.00 H new ATOM 0 HA THR A 59 15.898 -4.641 -7.682 1.00 0.00 H new ATOM 0 HB THR A 59 18.011 -3.987 -6.437 1.00 0.00 H new ATOM 0 HG1 THR A 59 16.572 -2.396 -5.140 1.00 0.00 H new ATOM 0 HG21 THR A 59 18.778 -2.226 -7.995 1.00 0.00 H new ATOM 0 HG22 THR A 59 17.842 -3.476 -8.849 1.00 0.00 H new ATOM 0 HG23 THR A 59 17.092 -1.908 -8.468 1.00 0.00 H new ATOM 878 N PHE A 60 15.402 -5.789 -5.581 1.00 0.00 N ATOM 879 CA PHE A 60 14.989 -6.495 -4.330 1.00 0.00 C ATOM 880 C PHE A 60 16.224 -7.176 -3.723 1.00 0.00 C ATOM 881 O PHE A 60 16.819 -8.052 -4.320 1.00 0.00 O ATOM 882 CB PHE A 60 13.942 -7.515 -4.785 1.00 0.00 C ATOM 883 CG PHE A 60 12.738 -6.779 -5.339 1.00 0.00 C ATOM 884 CD1 PHE A 60 11.787 -6.210 -4.450 1.00 0.00 C ATOM 885 CD2 PHE A 60 12.555 -6.655 -6.745 1.00 0.00 C ATOM 886 CE1 PHE A 60 10.654 -5.519 -4.962 1.00 0.00 C ATOM 887 CE2 PHE A 60 11.423 -5.962 -7.256 1.00 0.00 C ATOM 888 CZ PHE A 60 10.473 -5.395 -6.364 1.00 0.00 C ATOM 0 H PHE A 60 15.618 -6.402 -6.367 1.00 0.00 H new ATOM 0 HA PHE A 60 14.578 -5.835 -3.565 1.00 0.00 H new ATOM 0 HB2 PHE A 60 14.363 -8.172 -5.546 1.00 0.00 H new ATOM 0 HB3 PHE A 60 13.644 -8.146 -3.948 1.00 0.00 H new ATOM 0 HD1 PHE A 60 11.925 -6.302 -3.383 1.00 0.00 H new ATOM 0 HD2 PHE A 60 13.276 -7.087 -7.424 1.00 0.00 H new ATOM 0 HE1 PHE A 60 9.932 -5.089 -4.284 1.00 0.00 H new ATOM 0 HE2 PHE A 60 11.285 -5.867 -8.323 1.00 0.00 H new ATOM 0 HZ PHE A 60 9.613 -4.870 -6.753 1.00 0.00 H new ATOM 898 N LEU A 61 16.634 -6.740 -2.559 1.00 0.00 N ATOM 899 CA LEU A 61 17.866 -7.307 -1.917 1.00 0.00 C ATOM 900 C LEU A 61 17.758 -8.817 -1.649 1.00 0.00 C ATOM 901 O LEU A 61 18.703 -9.550 -1.879 1.00 0.00 O ATOM 902 CB LEU A 61 18.007 -6.546 -0.593 1.00 0.00 C ATOM 903 CG LEU A 61 19.295 -6.972 0.118 1.00 0.00 C ATOM 904 CD1 LEU A 61 20.507 -6.571 -0.727 1.00 0.00 C ATOM 905 CD2 LEU A 61 19.377 -6.282 1.481 1.00 0.00 C ATOM 0 H LEU A 61 16.167 -6.011 -2.020 1.00 0.00 H new ATOM 0 HA LEU A 61 18.728 -7.190 -2.574 1.00 0.00 H new ATOM 0 HB2 LEU A 61 18.023 -5.472 -0.780 1.00 0.00 H new ATOM 0 HB3 LEU A 61 17.146 -6.746 0.045 1.00 0.00 H new ATOM 0 HG LEU A 61 19.290 -8.053 0.255 1.00 0.00 H new ATOM 0 HD11 LEU A 61 21.422 -6.875 -0.219 1.00 0.00 H new ATOM 0 HD12 LEU A 61 20.451 -7.062 -1.699 1.00 0.00 H new ATOM 0 HD13 LEU A 61 20.512 -5.490 -0.866 1.00 0.00 H new ATOM 0 HD21 LEU A 61 20.293 -6.585 1.988 1.00 0.00 H new ATOM 0 HD22 LEU A 61 19.379 -5.201 1.342 1.00 0.00 H new ATOM 0 HD23 LEU A 61 18.517 -6.568 2.086 1.00 0.00 H new ATOM 917 N ASP A 62 16.644 -9.289 -1.146 1.00 0.00 N ATOM 918 CA ASP A 62 16.527 -10.752 -0.844 1.00 0.00 C ATOM 919 C ASP A 62 15.086 -11.247 -0.999 1.00 0.00 C ATOM 920 O ASP A 62 14.267 -10.618 -1.639 1.00 0.00 O ATOM 921 CB ASP A 62 17.004 -10.888 0.610 1.00 0.00 C ATOM 922 CG ASP A 62 16.073 -10.120 1.564 1.00 0.00 C ATOM 923 OD1 ASP A 62 15.159 -9.464 1.086 1.00 0.00 O ATOM 924 OD2 ASP A 62 16.293 -10.203 2.761 1.00 0.00 O ATOM 0 H ASP A 62 15.817 -8.732 -0.933 1.00 0.00 H new ATOM 0 HA ASP A 62 17.118 -11.356 -1.533 1.00 0.00 H new ATOM 0 HB2 ASP A 62 17.032 -11.941 0.891 1.00 0.00 H new ATOM 0 HB3 ASP A 62 18.021 -10.506 0.701 1.00 0.00 H new ATOM 929 N ASP A 63 14.784 -12.389 -0.421 1.00 0.00 N ATOM 930 CA ASP A 63 13.405 -12.969 -0.520 1.00 0.00 C ATOM 931 C ASP A 63 13.014 -13.146 -1.987 1.00 0.00 C ATOM 932 O ASP A 63 12.028 -12.608 -2.450 1.00 0.00 O ATOM 933 CB ASP A 63 12.476 -11.978 0.181 1.00 0.00 C ATOM 934 CG ASP A 63 12.839 -11.895 1.667 1.00 0.00 C ATOM 935 OD1 ASP A 63 13.276 -12.898 2.209 1.00 0.00 O ATOM 936 OD2 ASP A 63 12.676 -10.829 2.238 1.00 0.00 O ATOM 0 H ASP A 63 15.443 -12.949 0.121 1.00 0.00 H new ATOM 0 HA ASP A 63 13.345 -13.953 -0.054 1.00 0.00 H new ATOM 0 HB2 ASP A 63 12.563 -10.994 -0.280 1.00 0.00 H new ATOM 0 HB3 ASP A 63 11.439 -12.293 0.067 1.00 0.00 H new ATOM 941 N SER A 64 13.798 -13.901 -2.713 1.00 0.00 N ATOM 942 CA SER A 64 13.524 -14.148 -4.164 1.00 0.00 C ATOM 943 C SER A 64 13.467 -12.827 -4.932 1.00 0.00 C ATOM 944 O SER A 64 13.367 -11.762 -4.353 1.00 0.00 O ATOM 945 CB SER A 64 12.179 -14.880 -4.223 1.00 0.00 C ATOM 946 OG SER A 64 12.304 -16.143 -3.584 1.00 0.00 O ATOM 0 H SER A 64 14.633 -14.366 -2.356 1.00 0.00 H new ATOM 0 HA SER A 64 14.313 -14.742 -4.626 1.00 0.00 H new ATOM 0 HB2 SER A 64 11.407 -14.286 -3.733 1.00 0.00 H new ATOM 0 HB3 SER A 64 11.869 -15.013 -5.260 1.00 0.00 H new ATOM 0 HG SER A 64 11.445 -16.613 -3.618 1.00 0.00 H new ATOM 952 N ILE A 67 13.546 -12.893 -6.236 1.00 0.00 N ATOM 953 CA ILE A 67 13.515 -11.650 -7.059 1.00 0.00 C ATOM 954 C ILE A 67 12.072 -11.288 -7.429 1.00 0.00 C ATOM 955 O ILE A 67 11.590 -11.640 -8.490 1.00 0.00 O ATOM 956 CB ILE A 67 14.340 -11.984 -8.298 1.00 0.00 C ATOM 957 CG1 ILE A 67 15.779 -12.247 -7.861 1.00 0.00 C ATOM 958 CG2 ILE A 67 14.316 -10.806 -9.283 1.00 0.00 C ATOM 959 CD1 ILE A 67 16.557 -12.839 -9.025 1.00 0.00 C ATOM 0 H ILE A 67 13.631 -13.759 -6.767 1.00 0.00 H new ATOM 0 HA ILE A 67 13.917 -10.787 -6.529 1.00 0.00 H new ATOM 0 HB ILE A 67 13.923 -12.862 -8.791 1.00 0.00 H new ATOM 0 HG12 ILE A 67 16.246 -11.319 -7.531 1.00 0.00 H new ATOM 0 HG13 ILE A 67 15.794 -12.931 -7.013 1.00 0.00 H new ATOM 0 HG21 ILE A 67 14.908 -11.056 -10.163 1.00 0.00 H new ATOM 0 HG22 ILE A 67 13.288 -10.603 -9.583 1.00 0.00 H new ATOM 0 HG23 ILE A 67 14.735 -9.922 -8.803 1.00 0.00 H new ATOM 0 HD11 ILE A 67 17.585 -13.028 -8.717 1.00 0.00 H new ATOM 0 HD12 ILE A 67 16.093 -13.775 -9.334 1.00 0.00 H new ATOM 0 HD13 ILE A 67 16.552 -12.138 -9.860 1.00 0.00 H new ATOM 971 N CYS A 68 11.388 -10.578 -6.567 1.00 0.00 N ATOM 972 CA CYS A 68 9.981 -10.180 -6.873 1.00 0.00 C ATOM 973 C CYS A 68 9.975 -9.176 -8.024 1.00 0.00 C ATOM 974 O CYS A 68 10.934 -8.458 -8.232 1.00 0.00 O ATOM 975 CB CYS A 68 9.447 -9.526 -5.596 1.00 0.00 C ATOM 976 SG CYS A 68 9.243 -10.785 -4.312 1.00 0.00 S ATOM 0 H CYS A 68 11.743 -10.257 -5.666 1.00 0.00 H new ATOM 0 HA CYS A 68 9.368 -11.031 -7.170 1.00 0.00 H new ATOM 0 HB2 CYS A 68 10.136 -8.753 -5.256 1.00 0.00 H new ATOM 0 HB3 CYS A 68 8.493 -9.038 -5.796 1.00 0.00 H new ATOM 981 N THR A 69 8.905 -9.120 -8.769 1.00 0.00 N ATOM 982 CA THR A 69 8.831 -8.159 -9.906 1.00 0.00 C ATOM 983 C THR A 69 7.429 -7.553 -9.965 1.00 0.00 C ATOM 984 O THR A 69 6.464 -8.187 -9.580 1.00 0.00 O ATOM 985 CB THR A 69 9.133 -8.990 -11.159 1.00 0.00 C ATOM 986 OG1 THR A 69 9.096 -8.148 -12.302 1.00 0.00 O ATOM 987 CG2 THR A 69 8.100 -10.111 -11.311 1.00 0.00 C ATOM 0 H THR A 69 8.076 -9.700 -8.639 1.00 0.00 H new ATOM 0 HA THR A 69 9.534 -7.331 -9.809 1.00 0.00 H new ATOM 0 HB THR A 69 10.123 -9.435 -11.063 1.00 0.00 H new ATOM 0 HG1 THR A 69 9.290 -8.676 -13.104 1.00 0.00 H new ATOM 0 HG21 THR A 69 8.325 -10.694 -12.204 1.00 0.00 H new ATOM 0 HG22 THR A 69 8.135 -10.760 -10.436 1.00 0.00 H new ATOM 0 HG23 THR A 69 7.104 -9.678 -11.402 1.00 0.00 H new ATOM 995 N GLY A 70 7.306 -6.339 -10.434 1.00 0.00 N ATOM 996 CA GLY A 70 5.956 -5.712 -10.503 1.00 0.00 C ATOM 997 C GLY A 70 6.016 -4.386 -11.260 1.00 0.00 C ATOM 998 O GLY A 70 7.056 -3.957 -11.721 1.00 0.00 O ATOM 0 H GLY A 70 8.076 -5.760 -10.769 1.00 0.00 H new ATOM 0 HA2 GLY A 70 5.260 -6.389 -10.999 1.00 0.00 H new ATOM 0 HA3 GLY A 70 5.575 -5.545 -9.496 1.00 0.00 H new ATOM 1002 N THR A 71 4.889 -3.747 -11.383 1.00 0.00 N ATOM 1003 CA THR A 71 4.810 -2.446 -12.100 1.00 0.00 C ATOM 1004 C THR A 71 4.067 -1.429 -11.230 1.00 0.00 C ATOM 1005 O THR A 71 3.474 -1.776 -10.236 1.00 0.00 O ATOM 1006 CB THR A 71 4.013 -2.761 -13.360 1.00 0.00 C ATOM 1007 OG1 THR A 71 4.719 -3.711 -14.145 1.00 0.00 O ATOM 1008 CG2 THR A 71 3.775 -1.493 -14.177 1.00 0.00 C ATOM 0 H THR A 71 4.000 -4.079 -11.009 1.00 0.00 H new ATOM 0 HA THR A 71 5.787 -2.020 -12.328 1.00 0.00 H new ATOM 0 HB THR A 71 3.047 -3.173 -13.068 1.00 0.00 H new ATOM 0 HG1 THR A 71 4.081 -4.259 -14.647 1.00 0.00 H new ATOM 0 HG21 THR A 71 3.204 -1.739 -15.073 1.00 0.00 H new ATOM 0 HG22 THR A 71 3.217 -0.773 -13.578 1.00 0.00 H new ATOM 0 HG23 THR A 71 4.733 -1.060 -14.465 1.00 0.00 H new ATOM 1016 N SER A 72 4.093 -0.183 -11.608 1.00 0.00 N ATOM 1017 CA SER A 72 3.375 0.871 -10.827 1.00 0.00 C ATOM 1018 C SER A 72 3.045 2.037 -11.763 1.00 0.00 C ATOM 1019 O SER A 72 3.926 2.583 -12.403 1.00 0.00 O ATOM 1020 CB SER A 72 4.352 1.307 -9.739 1.00 0.00 C ATOM 1021 OG SER A 72 4.724 0.176 -8.963 1.00 0.00 O ATOM 0 H SER A 72 4.586 0.158 -12.434 1.00 0.00 H new ATOM 0 HA SER A 72 2.440 0.517 -10.393 1.00 0.00 H new ATOM 0 HB2 SER A 72 5.235 1.761 -10.188 1.00 0.00 H new ATOM 0 HB3 SER A 72 3.893 2.064 -9.103 1.00 0.00 H new ATOM 0 HG SER A 72 5.503 -0.258 -9.370 1.00 0.00 H new ATOM 1027 N SER A 73 1.795 2.423 -11.862 1.00 0.00 N ATOM 1028 CA SER A 73 1.439 3.551 -12.774 1.00 0.00 C ATOM 1029 C SER A 73 0.370 4.434 -12.138 1.00 0.00 C ATOM 1030 O SER A 73 -0.501 3.959 -11.434 1.00 0.00 O ATOM 1031 CB SER A 73 0.897 2.881 -14.036 1.00 0.00 C ATOM 1032 OG SER A 73 -0.240 2.097 -13.699 1.00 0.00 O ATOM 0 H SER A 73 1.013 2.008 -11.354 1.00 0.00 H new ATOM 0 HA SER A 73 2.294 4.194 -12.985 1.00 0.00 H new ATOM 0 HB2 SER A 73 0.627 3.635 -14.775 1.00 0.00 H new ATOM 0 HB3 SER A 73 1.665 2.253 -14.487 1.00 0.00 H new ATOM 0 HG SER A 73 -0.592 1.667 -14.506 1.00 0.00 H new ATOM 1038 N GLY A 74 0.425 5.721 -12.387 1.00 0.00 N ATOM 1039 CA GLY A 74 -0.590 6.654 -11.805 1.00 0.00 C ATOM 1040 C GLY A 74 -0.689 6.442 -10.291 1.00 0.00 C ATOM 1041 O GLY A 74 0.287 6.552 -9.573 1.00 0.00 O ATOM 0 H GLY A 74 1.133 6.166 -12.971 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -0.312 7.686 -12.019 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.561 6.483 -12.269 1.00 0.00 H new ATOM 1045 N ASN A 75 -1.863 6.130 -9.813 1.00 0.00 N ATOM 1046 CA ASN A 75 -2.046 5.896 -8.353 1.00 0.00 C ATOM 1047 C ASN A 75 -2.208 4.398 -8.051 1.00 0.00 C ATOM 1048 O ASN A 75 -2.586 4.028 -6.956 1.00 0.00 O ATOM 1049 CB ASN A 75 -3.327 6.652 -7.999 1.00 0.00 C ATOM 1050 CG ASN A 75 -3.116 8.150 -8.225 1.00 0.00 C ATOM 1051 OD1 ASN A 75 -2.206 8.737 -7.673 1.00 0.00 O ATOM 1052 ND2 ASN A 75 -3.924 8.798 -9.018 1.00 0.00 N ATOM 0 H ASN A 75 -2.708 6.027 -10.375 1.00 0.00 H new ATOM 0 HA ASN A 75 -1.186 6.235 -7.775 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -4.154 6.294 -8.612 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -3.597 6.465 -6.960 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -3.792 9.797 -9.175 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -4.688 8.305 -9.481 1.00 0.00 H new ATOM 1059 N GLN A 76 -1.933 3.531 -9.005 1.00 0.00 N ATOM 1060 CA GLN A 76 -2.089 2.065 -8.751 1.00 0.00 C ATOM 1061 C GLN A 76 -0.745 1.349 -8.855 1.00 0.00 C ATOM 1062 O GLN A 76 -0.050 1.470 -9.847 1.00 0.00 O ATOM 1063 CB GLN A 76 -3.034 1.574 -9.847 1.00 0.00 C ATOM 1064 CG GLN A 76 -4.444 2.107 -9.584 1.00 0.00 C ATOM 1065 CD GLN A 76 -5.416 1.524 -10.614 1.00 0.00 C ATOM 1066 OE1 GLN A 76 -6.537 1.189 -10.284 1.00 0.00 O ATOM 1067 NE2 GLN A 76 -5.037 1.389 -11.856 1.00 0.00 N ATOM 0 H GLN A 76 -1.610 3.778 -9.940 1.00 0.00 H new ATOM 0 HA GLN A 76 -2.473 1.866 -7.750 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -2.683 1.911 -10.822 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.045 0.484 -9.871 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -4.763 1.839 -8.577 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -4.448 3.196 -9.641 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -4.097 1.669 -12.136 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -5.681 1.003 -12.547 1.00 0.00 H new ATOM 1076 N VAL A 77 -0.373 0.601 -7.842 1.00 0.00 N ATOM 1077 CA VAL A 77 0.924 -0.119 -7.896 1.00 0.00 C ATOM 1078 C VAL A 77 0.679 -1.625 -8.082 1.00 0.00 C ATOM 1079 O VAL A 77 -0.016 -2.249 -7.308 1.00 0.00 O ATOM 1080 CB VAL A 77 1.650 0.191 -6.569 1.00 0.00 C ATOM 1081 CG1 VAL A 77 1.563 1.688 -6.231 1.00 0.00 C ATOM 1082 CG2 VAL A 77 1.079 -0.629 -5.400 1.00 0.00 C ATOM 0 H VAL A 77 -0.913 0.463 -6.988 1.00 0.00 H new ATOM 0 HA VAL A 77 1.536 0.201 -8.739 1.00 0.00 H new ATOM 0 HB VAL A 77 2.694 -0.088 -6.709 1.00 0.00 H new ATOM 0 HG11 VAL A 77 2.082 1.880 -5.292 1.00 0.00 H new ATOM 0 HG12 VAL A 77 2.028 2.269 -7.028 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.517 1.979 -6.133 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.617 -0.381 -4.485 1.00 0.00 H new ATOM 0 HG22 VAL A 77 0.022 -0.395 -5.274 1.00 0.00 H new ATOM 0 HG23 VAL A 77 1.193 -1.692 -5.612 1.00 0.00 H new ATOM 1092 N ASN A 78 1.238 -2.199 -9.110 1.00 0.00 N ATOM 1093 CA ASN A 78 1.040 -3.654 -9.375 1.00 0.00 C ATOM 1094 C ASN A 78 2.250 -4.480 -8.908 1.00 0.00 C ATOM 1095 O ASN A 78 3.346 -4.323 -9.404 1.00 0.00 O ATOM 1096 CB ASN A 78 0.892 -3.740 -10.898 1.00 0.00 C ATOM 1097 CG ASN A 78 0.540 -5.173 -11.301 1.00 0.00 C ATOM 1098 OD1 ASN A 78 0.894 -6.123 -10.631 1.00 0.00 O ATOM 1099 ND2 ASN A 78 -0.156 -5.337 -12.395 1.00 0.00 N ATOM 0 H ASN A 78 1.831 -1.718 -9.786 1.00 0.00 H new ATOM 0 HA ASN A 78 0.179 -4.053 -8.839 1.00 0.00 H new ATOM 0 HB2 ASN A 78 0.115 -3.055 -11.237 1.00 0.00 H new ATOM 0 HB3 ASN A 78 1.820 -3.433 -11.381 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -0.443 -4.526 -12.943 1.00 0.00 H new ATOM 1105 N LEU A 79 2.047 -5.382 -7.976 1.00 0.00 N ATOM 1106 CA LEU A 79 3.170 -6.251 -7.497 1.00 0.00 C ATOM 1107 C LEU A 79 2.912 -7.699 -7.938 1.00 0.00 C ATOM 1108 O LEU A 79 1.797 -8.182 -7.860 1.00 0.00 O ATOM 1109 CB LEU A 79 3.160 -6.142 -5.966 1.00 0.00 C ATOM 1110 CG LEU A 79 3.665 -4.758 -5.532 1.00 0.00 C ATOM 1111 CD1 LEU A 79 3.528 -4.600 -4.014 1.00 0.00 C ATOM 1112 CD2 LEU A 79 5.139 -4.610 -5.940 1.00 0.00 C ATOM 0 H LEU A 79 1.148 -5.554 -7.525 1.00 0.00 H new ATOM 0 HA LEU A 79 4.134 -5.946 -7.905 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.150 -6.304 -5.589 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.790 -6.920 -5.534 1.00 0.00 H new ATOM 0 HG LEU A 79 3.070 -3.986 -6.019 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.889 -3.615 -3.717 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.481 -4.704 -3.730 1.00 0.00 H new ATOM 0 HD13 LEU A 79 4.117 -5.369 -3.514 1.00 0.00 H new ATOM 0 HD21 LEU A 79 5.504 -3.629 -5.635 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.731 -5.385 -5.453 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.229 -4.710 -7.022 1.00 0.00 H new ATOM 1124 N THR A 80 3.923 -8.391 -8.413 1.00 0.00 N ATOM 1125 CA THR A 80 3.716 -9.801 -8.870 1.00 0.00 C ATOM 1126 C THR A 80 4.734 -10.744 -8.216 1.00 0.00 C ATOM 1127 O THR A 80 5.895 -10.415 -8.064 1.00 0.00 O ATOM 1128 CB THR A 80 3.919 -9.754 -10.387 1.00 0.00 C ATOM 1129 OG1 THR A 80 2.992 -8.840 -10.957 1.00 0.00 O ATOM 1130 CG2 THR A 80 3.692 -11.145 -10.981 1.00 0.00 C ATOM 0 H THR A 80 4.877 -8.041 -8.503 1.00 0.00 H new ATOM 0 HA THR A 80 2.731 -10.179 -8.597 1.00 0.00 H new ATOM 0 HB THR A 80 4.936 -9.430 -10.606 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.120 -8.807 -11.928 1.00 0.00 H new ATOM 0 HG21 THR A 80 3.837 -11.108 -12.061 1.00 0.00 H new ATOM 0 HG22 THR A 80 4.401 -11.848 -10.543 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.675 -11.472 -10.763 1.00 0.00 H new ATOM 1138 N ILE A 81 4.297 -11.918 -7.834 1.00 0.00 N ATOM 1139 CA ILE A 81 5.220 -12.904 -7.192 1.00 0.00 C ATOM 1140 C ILE A 81 5.342 -14.155 -8.064 1.00 0.00 C ATOM 1141 O ILE A 81 4.347 -14.714 -8.478 1.00 0.00 O ATOM 1142 CB ILE A 81 4.544 -13.281 -5.867 1.00 0.00 C ATOM 1143 CG1 ILE A 81 4.456 -12.055 -4.958 1.00 0.00 C ATOM 1144 CG2 ILE A 81 5.355 -14.381 -5.162 1.00 0.00 C ATOM 1145 CD1 ILE A 81 3.487 -12.350 -3.810 1.00 0.00 C ATOM 0 H ILE A 81 3.334 -12.238 -7.940 1.00 0.00 H new ATOM 0 HA ILE A 81 6.219 -12.491 -7.053 1.00 0.00 H new ATOM 0 HB ILE A 81 3.539 -13.648 -6.076 1.00 0.00 H new ATOM 0 HG12 ILE A 81 5.442 -11.808 -4.564 1.00 0.00 H new ATOM 0 HG13 ILE A 81 4.114 -11.190 -5.526 1.00 0.00 H new ATOM 0 HG21 ILE A 81 4.870 -14.645 -4.222 1.00 0.00 H new ATOM 0 HG22 ILE A 81 5.408 -15.261 -5.802 1.00 0.00 H new ATOM 0 HG23 ILE A 81 6.363 -14.018 -4.961 1.00 0.00 H new ATOM 0 HD11 ILE A 81 3.420 -11.479 -3.158 1.00 0.00 H new ATOM 0 HD12 ILE A 81 2.501 -12.577 -4.215 1.00 0.00 H new ATOM 0 HD13 ILE A 81 3.850 -13.204 -3.238 1.00 0.00 H new ATOM 1157 N GLN A 82 6.543 -14.624 -8.299 1.00 0.00 N ATOM 1158 CA GLN A 82 6.708 -15.874 -9.096 1.00 0.00 C ATOM 1159 C GLN A 82 7.396 -16.937 -8.244 1.00 0.00 C ATOM 1160 O GLN A 82 8.497 -16.748 -7.762 1.00 0.00 O ATOM 1161 CB GLN A 82 7.595 -15.529 -10.287 1.00 0.00 C ATOM 1162 CG GLN A 82 6.891 -14.528 -11.202 1.00 0.00 C ATOM 1163 CD GLN A 82 7.927 -13.598 -11.836 1.00 0.00 C ATOM 1164 OE1 GLN A 82 8.588 -12.847 -11.147 1.00 0.00 O ATOM 1165 NE2 GLN A 82 8.097 -13.617 -13.130 1.00 0.00 N ATOM 0 H GLN A 82 7.410 -14.196 -7.974 1.00 0.00 H new ATOM 0 HA GLN A 82 5.742 -16.259 -9.422 1.00 0.00 H new ATOM 0 HB2 GLN A 82 8.539 -15.110 -9.937 1.00 0.00 H new ATOM 0 HB3 GLN A 82 7.835 -16.434 -10.844 1.00 0.00 H new ATOM 0 HG2 GLN A 82 6.338 -15.056 -11.979 1.00 0.00 H new ATOM 0 HG3 GLN A 82 6.165 -13.947 -10.633 1.00 0.00 H new ATOM 0 HE21 GLN A 82 7.542 -14.248 -13.708 1.00 0.00 H new ATOM 0 HE22 GLN A 82 8.785 -13.001 -13.563 1.00 0.00 H new ATOM 1174 N GLY A 83 6.750 -18.049 -8.065 1.00 0.00 N ATOM 1175 CA GLY A 83 7.343 -19.151 -7.251 1.00 0.00 C ATOM 1176 C GLY A 83 6.572 -19.286 -5.940 1.00 0.00 C ATOM 1177 O GLY A 83 7.144 -19.243 -4.867 1.00 0.00 O ATOM 0 H GLY A 83 5.827 -18.249 -8.450 1.00 0.00 H new ATOM 0 HA2 GLY A 83 7.305 -20.088 -7.806 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.394 -18.943 -7.048 1.00 0.00 H new ATOM 1181 N LEU A 84 5.276 -19.444 -6.020 1.00 0.00 N ATOM 1182 CA LEU A 84 4.457 -19.576 -4.780 1.00 0.00 C ATOM 1183 C LEU A 84 4.314 -21.045 -4.372 1.00 0.00 C ATOM 1184 O LEU A 84 3.777 -21.855 -5.103 1.00 0.00 O ATOM 1185 CB LEU A 84 3.091 -18.999 -5.150 1.00 0.00 C ATOM 1186 CG LEU A 84 3.234 -17.513 -5.473 1.00 0.00 C ATOM 1187 CD1 LEU A 84 1.947 -17.006 -6.125 1.00 0.00 C ATOM 1188 CD2 LEU A 84 3.488 -16.738 -4.179 1.00 0.00 C ATOM 0 H LEU A 84 4.749 -19.487 -6.893 1.00 0.00 H new ATOM 0 HA LEU A 84 4.915 -19.060 -3.936 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.681 -19.530 -6.009 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.391 -19.137 -4.326 1.00 0.00 H new ATOM 0 HG LEU A 84 4.069 -17.367 -6.158 1.00 0.00 H new ATOM 0 HD11 LEU A 84 2.049 -15.946 -6.355 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.762 -17.561 -7.045 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.111 -17.150 -5.440 1.00 0.00 H new ATOM 0 HD21 LEU A 84 3.591 -15.677 -4.405 1.00 0.00 H new ATOM 0 HD22 LEU A 84 2.651 -16.884 -3.497 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.404 -17.100 -3.712 1.00 0.00 H new ATOM 1200 N ARG A 85 4.773 -21.380 -3.195 1.00 0.00 N ATOM 1201 CA ARG A 85 4.654 -22.784 -2.703 1.00 0.00 C ATOM 1202 C ARG A 85 3.437 -22.884 -1.783 1.00 0.00 C ATOM 1203 O ARG A 85 2.763 -21.901 -1.533 1.00 0.00 O ATOM 1204 CB ARG A 85 5.936 -23.053 -1.915 1.00 0.00 C ATOM 1205 CG ARG A 85 7.149 -22.888 -2.832 1.00 0.00 C ATOM 1206 CD ARG A 85 8.381 -23.482 -2.149 1.00 0.00 C ATOM 1207 NE ARG A 85 9.522 -23.184 -3.070 1.00 0.00 N ATOM 1208 CZ ARG A 85 10.772 -23.212 -2.647 1.00 0.00 C ATOM 1209 NH1 ARG A 85 11.071 -23.504 -1.401 1.00 0.00 N ATOM 1210 NH2 ARG A 85 11.734 -22.944 -3.487 1.00 0.00 N ATOM 0 H ARG A 85 5.229 -20.736 -2.549 1.00 0.00 H new ATOM 0 HA ARG A 85 4.528 -23.503 -3.513 1.00 0.00 H new ATOM 0 HB2 ARG A 85 6.008 -22.364 -1.073 1.00 0.00 H new ATOM 0 HB3 ARG A 85 5.915 -24.061 -1.501 1.00 0.00 H new ATOM 0 HG2 ARG A 85 6.970 -23.387 -3.784 1.00 0.00 H new ATOM 0 HG3 ARG A 85 7.313 -21.833 -3.051 1.00 0.00 H new ATOM 0 HD2 ARG A 85 8.540 -23.036 -1.167 1.00 0.00 H new ATOM 0 HD3 ARG A 85 8.268 -24.555 -1.997 1.00 0.00 H new ATOM 0 HE ARG A 85 9.330 -22.954 -4.045 1.00 0.00 H new ATOM 0 HH11 ARG A 85 10.328 -23.716 -0.735 1.00 0.00 H new ATOM 0 HH12 ARG A 85 12.046 -23.519 -1.100 1.00 0.00 H new ATOM 0 HH21 ARG A 85 11.515 -22.716 -4.457 1.00 0.00 H new ATOM 0 HH22 ARG A 85 12.704 -22.962 -3.174 1.00 0.00 H new ATOM 1224 N ALA A 86 3.153 -24.053 -1.265 1.00 0.00 N ATOM 1225 CA ALA A 86 1.979 -24.199 -0.348 1.00 0.00 C ATOM 1226 C ALA A 86 2.163 -23.291 0.873 1.00 0.00 C ATOM 1227 O ALA A 86 1.234 -22.659 1.338 1.00 0.00 O ATOM 1228 CB ALA A 86 1.975 -25.671 0.073 1.00 0.00 C ATOM 0 H ALA A 86 3.680 -24.909 -1.436 1.00 0.00 H new ATOM 0 HA ALA A 86 1.041 -23.917 -0.826 1.00 0.00 H new ATOM 0 HB1 ALA A 86 1.139 -25.854 0.748 1.00 0.00 H new ATOM 0 HB2 ALA A 86 1.873 -26.302 -0.810 1.00 0.00 H new ATOM 0 HB3 ALA A 86 2.910 -25.907 0.581 1.00 0.00 H new ATOM 1234 N MET A 87 3.364 -23.225 1.386 1.00 0.00 N ATOM 1235 CA MET A 87 3.640 -22.361 2.573 1.00 0.00 C ATOM 1236 C MET A 87 3.484 -20.880 2.209 1.00 0.00 C ATOM 1237 O MET A 87 3.015 -20.083 2.999 1.00 0.00 O ATOM 1238 CB MET A 87 5.089 -22.666 2.961 1.00 0.00 C ATOM 1239 CG MET A 87 5.443 -21.918 4.247 1.00 0.00 C ATOM 1240 SD MET A 87 7.190 -22.185 4.638 1.00 0.00 S ATOM 1241 CE MET A 87 7.152 -21.518 6.320 1.00 0.00 C ATOM 0 H MET A 87 4.172 -23.737 1.031 1.00 0.00 H new ATOM 0 HA MET A 87 2.947 -22.559 3.391 1.00 0.00 H new ATOM 0 HB2 MET A 87 5.220 -23.739 3.104 1.00 0.00 H new ATOM 0 HB3 MET A 87 5.762 -22.367 2.157 1.00 0.00 H new ATOM 0 HG2 MET A 87 5.245 -20.853 4.127 1.00 0.00 H new ATOM 0 HG3 MET A 87 4.818 -22.268 5.068 1.00 0.00 H new ATOM 0 HE1 MET A 87 8.147 -21.585 6.760 1.00 0.00 H new ATOM 0 HE2 MET A 87 6.837 -20.475 6.291 1.00 0.00 H new ATOM 0 HE3 MET A 87 6.449 -22.092 6.923 1.00 0.00 H new ATOM 1251 N ASP A 88 3.889 -20.510 1.022 1.00 0.00 N ATOM 1252 CA ASP A 88 3.784 -19.079 0.593 1.00 0.00 C ATOM 1253 C ASP A 88 2.331 -18.601 0.616 1.00 0.00 C ATOM 1254 O ASP A 88 2.063 -17.447 0.893 1.00 0.00 O ATOM 1255 CB ASP A 88 4.336 -19.035 -0.829 1.00 0.00 C ATOM 1256 CG ASP A 88 5.860 -19.159 -0.788 1.00 0.00 C ATOM 1257 OD1 ASP A 88 6.340 -20.241 -0.497 1.00 0.00 O ATOM 1258 OD2 ASP A 88 6.522 -18.166 -1.042 1.00 0.00 O ATOM 0 H ASP A 88 4.290 -21.139 0.326 1.00 0.00 H new ATOM 0 HA ASP A 88 4.337 -18.423 1.266 1.00 0.00 H new ATOM 0 HB2 ASP A 88 3.910 -19.845 -1.421 1.00 0.00 H new ATOM 0 HB3 ASP A 88 4.049 -18.102 -1.313 1.00 0.00 H new ATOM 1263 N THR A 89 1.387 -19.469 0.320 1.00 0.00 N ATOM 1264 CA THR A 89 -0.047 -19.056 0.321 1.00 0.00 C ATOM 1265 C THR A 89 -0.400 -18.376 1.639 1.00 0.00 C ATOM 1266 O THR A 89 -0.095 -18.870 2.709 1.00 0.00 O ATOM 1267 CB THR A 89 -0.839 -20.335 0.164 1.00 0.00 C ATOM 1268 OG1 THR A 89 -0.328 -21.084 -0.929 1.00 0.00 O ATOM 1269 CG2 THR A 89 -2.310 -20.001 -0.082 1.00 0.00 C ATOM 0 H THR A 89 1.554 -20.446 0.078 1.00 0.00 H new ATOM 0 HA THR A 89 -0.263 -18.346 -0.477 1.00 0.00 H new ATOM 0 HB THR A 89 -0.752 -20.927 1.075 1.00 0.00 H new ATOM 0 HG1 THR A 89 0.248 -21.802 -0.593 1.00 0.00 H new ATOM 0 HG21 THR A 89 -2.879 -20.924 -0.195 1.00 0.00 H new ATOM 0 HG22 THR A 89 -2.701 -19.435 0.764 1.00 0.00 H new ATOM 0 HG23 THR A 89 -2.401 -19.405 -0.990 1.00 0.00 H new ATOM 1277 N GLY A 90 -1.025 -17.241 1.560 1.00 0.00 N ATOM 1278 CA GLY A 90 -1.392 -16.500 2.801 1.00 0.00 C ATOM 1279 C GLY A 90 -1.823 -15.076 2.450 1.00 0.00 C ATOM 1280 O GLY A 90 -2.489 -14.845 1.458 1.00 0.00 O ATOM 0 H GLY A 90 -1.301 -16.789 0.688 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -2.201 -17.017 3.318 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -0.543 -16.474 3.484 1.00 0.00 H new ATOM 1284 N LEU A 91 -1.459 -14.123 3.271 1.00 0.00 N ATOM 1285 CA LEU A 91 -1.854 -12.711 3.015 1.00 0.00 C ATOM 1286 C LEU A 91 -0.652 -11.859 2.589 1.00 0.00 C ATOM 1287 O LEU A 91 0.367 -11.824 3.257 1.00 0.00 O ATOM 1288 CB LEU A 91 -2.389 -12.226 4.360 1.00 0.00 C ATOM 1289 CG LEU A 91 -2.898 -10.794 4.228 1.00 0.00 C ATOM 1290 CD1 LEU A 91 -4.260 -10.800 3.540 1.00 0.00 C ATOM 1291 CD2 LEU A 91 -3.026 -10.178 5.618 1.00 0.00 C ATOM 0 H LEU A 91 -0.901 -14.267 4.113 1.00 0.00 H new ATOM 0 HA LEU A 91 -2.582 -12.632 2.207 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -3.194 -12.878 4.698 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -1.603 -12.274 5.113 1.00 0.00 H new ATOM 0 HG LEU A 91 -2.198 -10.207 3.633 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -4.624 -9.777 3.445 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -4.165 -11.245 2.549 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -4.965 -11.383 4.133 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -3.389 -9.154 5.530 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -3.728 -10.763 6.212 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -2.052 -10.176 6.106 1.00 0.00 H new ATOM 1303 N TYR A 92 -0.792 -11.143 1.502 1.00 0.00 N ATOM 1304 CA TYR A 92 0.305 -10.247 1.033 1.00 0.00 C ATOM 1305 C TYR A 92 -0.119 -8.791 1.227 1.00 0.00 C ATOM 1306 O TYR A 92 -1.228 -8.416 0.907 1.00 0.00 O ATOM 1307 CB TYR A 92 0.518 -10.595 -0.438 1.00 0.00 C ATOM 1308 CG TYR A 92 1.184 -11.947 -0.514 1.00 0.00 C ATOM 1309 CD1 TYR A 92 0.409 -13.135 -0.434 1.00 0.00 C ATOM 1310 CD2 TYR A 92 2.596 -12.028 -0.651 1.00 0.00 C ATOM 1311 CE1 TYR A 92 1.046 -14.404 -0.493 1.00 0.00 C ATOM 1312 CE2 TYR A 92 3.234 -13.294 -0.712 1.00 0.00 C ATOM 1313 CZ TYR A 92 2.459 -14.484 -0.632 1.00 0.00 C ATOM 1314 OH TYR A 92 3.079 -15.716 -0.690 1.00 0.00 O ATOM 0 H TYR A 92 -1.627 -11.142 0.916 1.00 0.00 H new ATOM 0 HA TYR A 92 1.233 -10.379 1.589 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -0.435 -10.611 -0.966 1.00 0.00 H new ATOM 0 HB3 TYR A 92 1.137 -9.839 -0.921 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -0.664 -13.074 -0.328 1.00 0.00 H new ATOM 0 HD2 TYR A 92 3.185 -11.124 -0.709 1.00 0.00 H new ATOM 0 HE1 TYR A 92 0.457 -15.307 -0.432 1.00 0.00 H new ATOM 0 HE2 TYR A 92 4.307 -13.354 -0.819 1.00 0.00 H new ATOM 0 HH TYR A 92 2.907 -16.208 0.140 1.00 0.00 H new ATOM 1324 N ILE A 93 0.740 -7.988 1.802 1.00 0.00 N ATOM 1325 CA ILE A 93 0.379 -6.564 2.093 1.00 0.00 C ATOM 1326 C ILE A 93 1.145 -5.594 1.201 1.00 0.00 C ATOM 1327 O ILE A 93 2.353 -5.631 1.162 1.00 0.00 O ATOM 1328 CB ILE A 93 0.842 -6.331 3.541 1.00 0.00 C ATOM 1329 CG1 ILE A 93 0.136 -7.290 4.497 1.00 0.00 C ATOM 1330 CG2 ILE A 93 0.520 -4.886 3.978 1.00 0.00 C ATOM 1331 CD1 ILE A 93 0.767 -8.683 4.442 1.00 0.00 C ATOM 0 H ILE A 93 1.682 -8.258 2.085 1.00 0.00 H new ATOM 0 HA ILE A 93 -0.686 -6.398 1.928 1.00 0.00 H new ATOM 0 HB ILE A 93 1.918 -6.504 3.577 1.00 0.00 H new ATOM 0 HG12 ILE A 93 0.191 -6.902 5.514 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -0.921 -7.355 4.238 1.00 0.00 H new ATOM 0 HG21 ILE A 93 0.853 -4.734 5.005 1.00 0.00 H new ATOM 0 HG22 ILE A 93 1.035 -4.184 3.322 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -0.555 -4.718 3.916 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.245 -9.346 5.132 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.688 -9.078 3.429 1.00 0.00 H new ATOM 0 HD13 ILE A 93 1.818 -8.618 4.725 1.00 0.00 H new ATOM 1343 N CYS A 94 0.470 -4.670 0.567 1.00 0.00 N ATOM 1344 CA CYS A 94 1.215 -3.655 -0.224 1.00 0.00 C ATOM 1345 C CYS A 94 1.726 -2.620 0.782 1.00 0.00 C ATOM 1346 O CYS A 94 1.181 -2.493 1.864 1.00 0.00 O ATOM 1347 CB CYS A 94 0.213 -3.054 -1.211 1.00 0.00 C ATOM 1348 SG CYS A 94 -0.995 -2.035 -0.334 1.00 0.00 S ATOM 0 H CYS A 94 -0.546 -4.577 0.564 1.00 0.00 H new ATOM 0 HA CYS A 94 2.062 -4.053 -0.784 1.00 0.00 H new ATOM 0 HB2 CYS A 94 0.738 -2.451 -1.952 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -0.297 -3.851 -1.752 1.00 0.00 H new ATOM 1353 N LYS A 95 2.772 -1.910 0.468 1.00 0.00 N ATOM 1354 CA LYS A 95 3.324 -0.920 1.439 1.00 0.00 C ATOM 1355 C LYS A 95 3.902 0.250 0.667 1.00 0.00 C ATOM 1356 O LYS A 95 5.097 0.344 0.473 1.00 0.00 O ATOM 1357 CB LYS A 95 4.423 -1.690 2.166 1.00 0.00 C ATOM 1358 CG LYS A 95 5.156 -0.775 3.158 1.00 0.00 C ATOM 1359 CD LYS A 95 4.999 -1.332 4.570 1.00 0.00 C ATOM 1360 CE LYS A 95 5.620 -0.362 5.577 1.00 0.00 C ATOM 1361 NZ LYS A 95 7.090 -0.487 5.372 1.00 0.00 N ATOM 0 H LYS A 95 3.271 -1.971 -0.420 1.00 0.00 H new ATOM 0 HA LYS A 95 2.583 -0.519 2.131 1.00 0.00 H new ATOM 0 HB2 LYS A 95 3.991 -2.539 2.696 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.132 -2.094 1.443 1.00 0.00 H new ATOM 0 HG2 LYS A 95 6.212 -0.708 2.897 1.00 0.00 H new ATOM 0 HG3 LYS A 95 4.750 0.235 3.106 1.00 0.00 H new ATOM 0 HD2 LYS A 95 3.944 -1.482 4.797 1.00 0.00 H new ATOM 0 HD3 LYS A 95 5.482 -2.306 4.643 1.00 0.00 H new ATOM 0 HE2 LYS A 95 5.282 0.659 5.402 1.00 0.00 H new ATOM 0 HE3 LYS A 95 5.340 -0.620 6.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 7.589 -0.152 6.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 7.333 -1.483 5.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 7.376 0.087 4.553 1.00 0.00 H new ATOM 1375 N VAL A 96 3.061 1.130 0.219 1.00 0.00 N ATOM 1376 CA VAL A 96 3.548 2.289 -0.575 1.00 0.00 C ATOM 1377 C VAL A 96 3.742 3.513 0.322 1.00 0.00 C ATOM 1378 O VAL A 96 2.813 4.042 0.907 1.00 0.00 O ATOM 1379 CB VAL A 96 2.487 2.490 -1.673 1.00 0.00 C ATOM 1380 CG1 VAL A 96 1.078 2.592 -1.076 1.00 0.00 C ATOM 1381 CG2 VAL A 96 2.804 3.747 -2.496 1.00 0.00 C ATOM 0 H VAL A 96 2.052 1.099 0.368 1.00 0.00 H new ATOM 0 HA VAL A 96 4.527 2.123 -1.023 1.00 0.00 H new ATOM 0 HB VAL A 96 2.514 1.618 -2.327 1.00 0.00 H new ATOM 0 HG11 VAL A 96 0.353 2.733 -1.877 1.00 0.00 H new ATOM 0 HG12 VAL A 96 0.845 1.676 -0.534 1.00 0.00 H new ATOM 0 HG13 VAL A 96 1.033 3.440 -0.392 1.00 0.00 H new ATOM 0 HG21 VAL A 96 2.046 3.877 -3.268 1.00 0.00 H new ATOM 0 HG22 VAL A 96 2.808 4.619 -1.842 1.00 0.00 H new ATOM 0 HG23 VAL A 96 3.783 3.639 -2.963 1.00 0.00 H new ATOM 1391 N GLU A 97 4.973 3.945 0.448 1.00 0.00 N ATOM 1392 CA GLU A 97 5.279 5.114 1.315 1.00 0.00 C ATOM 1393 C GLU A 97 6.233 6.087 0.633 1.00 0.00 C ATOM 1394 O GLU A 97 7.228 5.691 0.057 1.00 0.00 O ATOM 1395 CB GLU A 97 5.981 4.521 2.536 1.00 0.00 C ATOM 1396 CG GLU A 97 5.008 3.626 3.328 1.00 0.00 C ATOM 1397 CD GLU A 97 3.717 4.386 3.694 1.00 0.00 C ATOM 1398 OE1 GLU A 97 3.744 5.606 3.699 1.00 0.00 O ATOM 1399 OE2 GLU A 97 2.727 3.729 3.970 1.00 0.00 O ATOM 0 H GLU A 97 5.781 3.532 -0.018 1.00 0.00 H new ATOM 0 HA GLU A 97 4.371 5.667 1.554 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.846 3.939 2.220 1.00 0.00 H new ATOM 0 HB3 GLU A 97 6.352 5.322 3.176 1.00 0.00 H new ATOM 0 HG2 GLU A 97 4.758 2.745 2.737 1.00 0.00 H new ATOM 0 HG3 GLU A 97 5.494 3.272 4.237 1.00 0.00 H new ATOM 1406 N LEU A 98 5.968 7.360 0.747 1.00 0.00 N ATOM 1407 CA LEU A 98 6.895 8.371 0.164 1.00 0.00 C ATOM 1408 C LEU A 98 7.979 8.574 1.209 1.00 0.00 C ATOM 1409 O LEU A 98 7.966 9.532 1.957 1.00 0.00 O ATOM 1410 CB LEU A 98 6.061 9.653 -0.006 1.00 0.00 C ATOM 1411 CG LEU A 98 4.703 9.345 -0.656 1.00 0.00 C ATOM 1412 CD1 LEU A 98 4.024 10.653 -1.038 1.00 0.00 C ATOM 1413 CD2 LEU A 98 4.891 8.473 -1.904 1.00 0.00 C ATOM 0 H LEU A 98 5.149 7.744 1.219 1.00 0.00 H new ATOM 0 HA LEU A 98 7.339 8.087 -0.790 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.905 10.121 0.966 1.00 0.00 H new ATOM 0 HB3 LEU A 98 6.608 10.368 -0.620 1.00 0.00 H new ATOM 0 HG LEU A 98 4.082 8.800 0.055 1.00 0.00 H new ATOM 0 HD11 LEU A 98 3.060 10.441 -1.500 1.00 0.00 H new ATOM 0 HD12 LEU A 98 3.873 11.259 -0.145 1.00 0.00 H new ATOM 0 HD13 LEU A 98 4.652 11.197 -1.743 1.00 0.00 H new ATOM 0 HD21 LEU A 98 3.919 8.264 -2.352 1.00 0.00 H new ATOM 0 HD22 LEU A 98 5.517 8.999 -2.625 1.00 0.00 H new ATOM 0 HD23 LEU A 98 5.370 7.535 -1.624 1.00 0.00 H new ATOM 1425 N MET A 99 8.868 7.633 1.315 1.00 0.00 N ATOM 1426 CA MET A 99 9.912 7.702 2.379 1.00 0.00 C ATOM 1427 C MET A 99 11.070 8.640 2.011 1.00 0.00 C ATOM 1428 O MET A 99 11.697 9.238 2.880 1.00 0.00 O ATOM 1429 CB MET A 99 10.432 6.274 2.515 1.00 0.00 C ATOM 1430 CG MET A 99 11.327 6.154 3.751 1.00 0.00 C ATOM 1431 SD MET A 99 10.997 4.577 4.574 1.00 0.00 S ATOM 1432 CE MET A 99 9.283 4.926 5.041 1.00 0.00 C ATOM 0 H MET A 99 8.921 6.813 0.710 1.00 0.00 H new ATOM 0 HA MET A 99 9.489 8.099 3.302 1.00 0.00 H new ATOM 0 HB2 MET A 99 9.595 5.580 2.594 1.00 0.00 H new ATOM 0 HB3 MET A 99 10.993 5.997 1.622 1.00 0.00 H new ATOM 0 HG2 MET A 99 12.376 6.214 3.462 1.00 0.00 H new ATOM 0 HG3 MET A 99 11.136 6.981 4.434 1.00 0.00 H new ATOM 0 HE1 MET A 99 9.083 4.510 6.029 1.00 0.00 H new ATOM 0 HE2 MET A 99 9.124 6.004 5.062 1.00 0.00 H new ATOM 0 HE3 MET A 99 8.609 4.474 4.314 1.00 0.00 H new ATOM 1442 N TYR A 100 11.395 8.737 0.753 1.00 0.00 N ATOM 1443 CA TYR A 100 12.542 9.604 0.339 1.00 0.00 C ATOM 1444 C TYR A 100 12.120 11.060 0.104 1.00 0.00 C ATOM 1445 O TYR A 100 12.886 11.986 0.413 1.00 0.00 O ATOM 1446 CB TYR A 100 13.081 8.990 -0.947 1.00 0.00 C ATOM 1447 CG TYR A 100 13.695 7.648 -0.643 1.00 0.00 C ATOM 1448 CD1 TYR A 100 15.067 7.560 -0.280 1.00 0.00 C ATOM 1449 CD2 TYR A 100 12.907 6.468 -0.727 1.00 0.00 C ATOM 1450 CE1 TYR A 100 15.652 6.290 -0.004 1.00 0.00 C ATOM 1451 CE2 TYR A 100 13.488 5.206 -0.454 1.00 0.00 C ATOM 1452 CZ TYR A 100 14.863 5.116 -0.091 1.00 0.00 C ATOM 1453 OH TYR A 100 15.425 3.883 0.174 1.00 0.00 O ATOM 0 H TYR A 100 10.919 8.255 -0.009 1.00 0.00 H new ATOM 0 HA TYR A 100 13.294 9.640 1.127 1.00 0.00 H new ATOM 0 HB2 TYR A 100 12.277 8.878 -1.674 1.00 0.00 H new ATOM 0 HB3 TYR A 100 13.825 9.650 -1.394 1.00 0.00 H new ATOM 0 HD1 TYR A 100 15.666 8.456 -0.213 1.00 0.00 H new ATOM 0 HD2 TYR A 100 11.864 6.534 -0.999 1.00 0.00 H new ATOM 0 HE1 TYR A 100 16.694 6.222 0.271 1.00 0.00 H new ATOM 0 HE2 TYR A 100 12.888 4.310 -0.521 1.00 0.00 H new ATOM 0 HH TYR A 100 14.746 3.185 0.070 1.00 0.00 H new ATOM 1463 N PRO A 101 10.955 11.291 -0.495 1.00 0.00 N ATOM 1464 CA PRO A 101 10.526 12.691 -0.771 1.00 0.00 C ATOM 1465 C PRO A 101 9.664 13.235 0.386 1.00 0.00 C ATOM 1466 O PRO A 101 8.612 12.704 0.703 1.00 0.00 O ATOM 1467 CB PRO A 101 9.711 12.535 -2.044 1.00 0.00 C ATOM 1468 CG PRO A 101 9.178 11.121 -2.028 1.00 0.00 C ATOM 1469 CD PRO A 101 9.949 10.343 -0.989 1.00 0.00 C ATOM 0 HA PRO A 101 11.351 13.396 -0.871 1.00 0.00 H new ATOM 0 HB2 PRO A 101 8.896 13.258 -2.077 1.00 0.00 H new ATOM 0 HB3 PRO A 101 10.328 12.709 -2.926 1.00 0.00 H new ATOM 0 HG2 PRO A 101 8.113 11.118 -1.794 1.00 0.00 H new ATOM 0 HG3 PRO A 101 9.290 10.660 -3.010 1.00 0.00 H new ATOM 0 HD2 PRO A 101 9.298 10.000 -0.185 1.00 0.00 H new ATOM 0 HD3 PRO A 101 10.416 9.458 -1.421 1.00 0.00 H new ATOM 1477 N PRO A 102 10.133 14.293 1.026 1.00 0.00 N ATOM 1478 CA PRO A 102 9.329 14.929 2.141 1.00 0.00 C ATOM 1479 C PRO A 102 8.345 16.126 1.559 1.00 0.00 C ATOM 1480 O PRO A 102 8.793 16.682 0.556 1.00 0.00 O ATOM 1481 CB PRO A 102 10.389 15.634 2.936 1.00 0.00 C ATOM 1482 CG PRO A 102 11.536 15.962 1.926 1.00 0.00 C ATOM 1483 CD PRO A 102 11.443 14.958 0.845 1.00 0.00 C ATOM 0 HA PRO A 102 8.720 14.196 2.670 1.00 0.00 H new ATOM 0 HB2 PRO A 102 9.996 16.544 3.390 1.00 0.00 H new ATOM 0 HB3 PRO A 102 10.752 15.004 3.748 1.00 0.00 H new ATOM 0 HG2 PRO A 102 11.426 16.971 1.529 1.00 0.00 H new ATOM 0 HG3 PRO A 102 12.509 15.916 2.415 1.00 0.00 H new ATOM 0 HD2 PRO A 102 11.510 15.431 -0.135 1.00 0.00 H new ATOM 0 HD3 PRO A 102 12.259 14.238 0.908 1.00 0.00 H new ATOM 1491 N PRO A 103 7.079 16.601 2.239 1.00 0.00 N ATOM 1492 CA PRO A 103 7.305 15.546 3.479 1.00 0.00 C ATOM 1493 C PRO A 103 6.647 14.090 3.303 1.00 0.00 C ATOM 1494 O PRO A 103 6.089 13.720 2.239 1.00 0.00 O ATOM 1495 CB PRO A 103 6.813 16.223 4.818 1.00 0.00 C ATOM 1496 CG PRO A 103 5.926 17.116 4.271 1.00 0.00 C ATOM 1497 CD PRO A 103 5.761 16.661 2.913 1.00 0.00 C ATOM 0 HA PRO A 103 8.375 15.341 3.499 1.00 0.00 H new ATOM 0 HB2 PRO A 103 6.339 15.518 5.501 1.00 0.00 H new ATOM 0 HB3 PRO A 103 7.618 16.708 5.369 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.978 17.117 4.809 1.00 0.00 H new ATOM 0 HG3 PRO A 103 6.313 18.134 4.306 1.00 0.00 H new ATOM 0 HD2 PRO A 103 5.293 15.677 2.904 1.00 0.00 H new ATOM 0 HD3 PRO A 103 5.096 17.335 2.372 1.00 0.00 H new ATOM 1505 N TYR A 104 6.889 13.241 4.211 1.00 0.00 N ATOM 1506 CA TYR A 104 6.416 11.818 4.033 1.00 0.00 C ATOM 1507 C TYR A 104 4.941 11.721 4.450 1.00 0.00 C ATOM 1508 O TYR A 104 4.557 12.148 5.521 1.00 0.00 O ATOM 1509 CB TYR A 104 7.368 10.982 4.926 1.00 0.00 C ATOM 1510 CG TYR A 104 6.908 9.523 5.013 1.00 0.00 C ATOM 1511 CD1 TYR A 104 6.233 8.946 3.933 1.00 0.00 C ATOM 1512 CD2 TYR A 104 7.185 8.746 6.177 1.00 0.00 C ATOM 1513 CE1 TYR A 104 5.815 7.590 3.984 1.00 0.00 C ATOM 1514 CE2 TYR A 104 6.780 7.382 6.251 1.00 0.00 C ATOM 1515 CZ TYR A 104 6.092 6.791 5.152 1.00 0.00 C ATOM 1516 OH TYR A 104 5.675 5.467 5.234 1.00 0.00 O ATOM 0 H TYR A 104 7.389 13.434 5.079 1.00 0.00 H new ATOM 0 HA TYR A 104 6.451 11.456 3.005 1.00 0.00 H new ATOM 0 HB2 TYR A 104 8.380 11.024 4.522 1.00 0.00 H new ATOM 0 HB3 TYR A 104 7.406 11.414 5.926 1.00 0.00 H new ATOM 0 HD1 TYR A 104 6.028 9.537 3.052 1.00 0.00 H new ATOM 0 HD2 TYR A 104 7.706 9.196 7.009 1.00 0.00 H new ATOM 0 HE1 TYR A 104 5.289 7.156 3.147 1.00 0.00 H new ATOM 0 HE2 TYR A 104 6.993 6.799 7.135 1.00 0.00 H new ATOM 0 HH TYR A 104 5.953 5.089 6.095 1.00 0.00 H new ATOM 1526 N TYR A 105 4.094 11.147 3.617 1.00 0.00 N ATOM 1527 CA TYR A 105 2.654 11.012 3.957 1.00 0.00 C ATOM 1528 C TYR A 105 2.016 10.032 2.972 1.00 0.00 C ATOM 1529 O TYR A 105 1.762 10.397 1.842 1.00 0.00 O ATOM 1530 CB TYR A 105 2.063 12.411 3.748 1.00 0.00 C ATOM 1531 CG TYR A 105 0.622 12.403 4.139 1.00 0.00 C ATOM 1532 CD1 TYR A 105 -0.353 12.027 3.181 1.00 0.00 C ATOM 1533 CD2 TYR A 105 0.247 12.753 5.449 1.00 0.00 C ATOM 1534 CE1 TYR A 105 -1.729 12.002 3.550 1.00 0.00 C ATOM 1535 CE2 TYR A 105 -1.115 12.727 5.823 1.00 0.00 C ATOM 1536 CZ TYR A 105 -2.110 12.353 4.874 1.00 0.00 C ATOM 1537 OH TYR A 105 -3.445 12.334 5.231 1.00 0.00 O ATOM 0 H TYR A 105 4.354 10.765 2.708 1.00 0.00 H new ATOM 0 HA TYR A 105 2.487 10.648 4.971 1.00 0.00 H new ATOM 0 HB2 TYR A 105 2.609 13.142 4.345 1.00 0.00 H new ATOM 0 HB3 TYR A 105 2.167 12.710 2.705 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -0.055 11.761 2.178 1.00 0.00 H new ATOM 0 HD2 TYR A 105 1.000 13.041 6.168 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -2.479 11.718 2.827 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -1.403 12.991 6.830 1.00 0.00 H new ATOM 0 HH TYR A 105 -3.788 11.418 5.165 1.00 0.00 H new ATOM 1547 N LEU A 106 1.735 8.832 3.379 1.00 0.00 N ATOM 1548 CA LEU A 106 1.076 7.856 2.434 1.00 0.00 C ATOM 1549 C LEU A 106 0.349 6.752 3.221 1.00 0.00 C ATOM 1550 O LEU A 106 -0.148 7.006 4.303 1.00 0.00 O ATOM 1551 CB LEU A 106 2.209 7.266 1.579 1.00 0.00 C ATOM 1552 CG LEU A 106 1.772 7.196 0.101 1.00 0.00 C ATOM 1553 CD1 LEU A 106 1.458 8.603 -0.427 1.00 0.00 C ATOM 1554 CD2 LEU A 106 2.897 6.575 -0.739 1.00 0.00 C ATOM 0 H LEU A 106 1.925 8.473 4.314 1.00 0.00 H new ATOM 0 HA LEU A 106 0.325 8.343 1.812 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.105 7.880 1.673 1.00 0.00 H new ATOM 0 HB3 LEU A 106 2.466 6.270 1.938 1.00 0.00 H new ATOM 0 HG LEU A 106 0.876 6.580 0.027 1.00 0.00 H new ATOM 0 HD11 LEU A 106 1.151 8.540 -1.471 1.00 0.00 H new ATOM 0 HD12 LEU A 106 0.653 9.041 0.162 1.00 0.00 H new ATOM 0 HD13 LEU A 106 2.347 9.228 -0.348 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.587 6.526 -1.783 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.794 7.188 -0.655 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.109 5.569 -0.376 1.00 0.00 H new ATOM 1566 N GLY A 108 0.272 5.539 2.704 1.00 0.00 N ATOM 1567 CA GLY A 108 -0.447 4.480 3.473 1.00 0.00 C ATOM 1568 C GLY A 108 -0.003 3.059 3.066 1.00 0.00 C ATOM 1569 O GLY A 108 0.722 2.850 2.101 1.00 0.00 O ATOM 0 H GLY A 108 0.666 5.250 1.809 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -0.268 4.623 4.539 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -1.520 4.583 3.313 1.00 0.00 H new ATOM 1573 N ILE A 109 -0.445 2.075 3.814 1.00 0.00 N ATOM 1574 CA ILE A 109 -0.088 0.659 3.521 1.00 0.00 C ATOM 1575 C ILE A 109 -1.360 -0.114 3.140 1.00 0.00 C ATOM 1576 O ILE A 109 -2.426 0.157 3.660 1.00 0.00 O ATOM 1577 CB ILE A 109 0.460 0.130 4.848 1.00 0.00 C ATOM 1578 CG1 ILE A 109 1.629 0.986 5.340 1.00 0.00 C ATOM 1579 CG2 ILE A 109 0.910 -1.313 4.683 1.00 0.00 C ATOM 1580 CD1 ILE A 109 2.713 1.013 4.279 1.00 0.00 C ATOM 0 H ILE A 109 -1.048 2.201 4.627 1.00 0.00 H new ATOM 0 HA ILE A 109 0.624 0.557 2.702 1.00 0.00 H new ATOM 0 HB ILE A 109 -0.336 0.180 5.591 1.00 0.00 H new ATOM 0 HG12 ILE A 109 1.288 1.999 5.554 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.025 0.580 6.271 1.00 0.00 H new ATOM 0 HG21 ILE A 109 1.299 -1.683 5.631 1.00 0.00 H new ATOM 0 HG22 ILE A 109 0.063 -1.925 4.374 1.00 0.00 H new ATOM 0 HG23 ILE A 109 1.691 -1.366 3.925 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.547 1.622 4.627 1.00 0.00 H new ATOM 0 HD12 ILE A 109 3.060 -0.002 4.088 1.00 0.00 H new ATOM 0 HD13 ILE A 109 2.311 1.439 3.359 1.00 0.00 H new ATOM 1592 N GLY A 110 -1.261 -1.082 2.257 1.00 0.00 N ATOM 1593 CA GLY A 110 -2.470 -1.878 1.869 1.00 0.00 C ATOM 1594 C GLY A 110 -2.829 -2.821 3.015 1.00 0.00 C ATOM 1595 O GLY A 110 -1.955 -3.372 3.660 1.00 0.00 O ATOM 0 H GLY A 110 -0.396 -1.354 1.789 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -3.306 -1.213 1.652 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -2.271 -2.447 0.961 1.00 0.00 H new ATOM 1599 N ASN A 111 -4.100 -3.013 3.281 1.00 0.00 N ATOM 1600 CA ASN A 111 -4.498 -3.924 4.397 1.00 0.00 C ATOM 1601 C ASN A 111 -3.963 -5.333 4.129 1.00 0.00 C ATOM 1602 O ASN A 111 -3.634 -6.069 5.040 1.00 0.00 O ATOM 1603 CB ASN A 111 -6.027 -3.913 4.434 1.00 0.00 C ATOM 1604 CG ASN A 111 -6.492 -4.561 5.741 1.00 0.00 C ATOM 1605 OD1 ASN A 111 -7.139 -5.591 5.742 1.00 0.00 O ATOM 1606 ND2 ASN A 111 -6.164 -3.961 6.860 1.00 0.00 N ATOM 0 H ASN A 111 -4.873 -2.580 2.776 1.00 0.00 H new ATOM 0 HA ASN A 111 -4.089 -3.600 5.354 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -6.399 -2.891 4.366 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -6.429 -4.456 3.579 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -5.621 -3.098 6.836 1.00 0.00 H new ATOM 1612 N GLY A 112 -3.847 -5.694 2.876 1.00 0.00 N ATOM 1613 CA GLY A 112 -3.302 -7.033 2.521 1.00 0.00 C ATOM 1614 C GLY A 112 -4.326 -7.869 1.755 1.00 0.00 C ATOM 1615 O GLY A 112 -5.497 -7.907 2.080 1.00 0.00 O ATOM 0 H GLY A 112 -4.109 -5.112 2.080 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -2.403 -6.913 1.916 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -3.007 -7.559 3.429 1.00 0.00 H new ATOM 1619 N THR A 113 -3.862 -8.560 0.748 1.00 0.00 N ATOM 1620 CA THR A 113 -4.752 -9.440 -0.063 1.00 0.00 C ATOM 1621 C THR A 113 -4.371 -10.895 0.188 1.00 0.00 C ATOM 1622 O THR A 113 -3.199 -11.223 0.252 1.00 0.00 O ATOM 1623 CB THR A 113 -4.443 -9.087 -1.523 1.00 0.00 C ATOM 1624 OG1 THR A 113 -4.721 -7.714 -1.755 1.00 0.00 O ATOM 1625 CG2 THR A 113 -5.284 -9.965 -2.464 1.00 0.00 C ATOM 0 H THR A 113 -2.887 -8.551 0.449 1.00 0.00 H new ATOM 0 HA THR A 113 -5.806 -9.305 0.182 1.00 0.00 H new ATOM 0 HB THR A 113 -3.387 -9.272 -1.720 1.00 0.00 H new ATOM 0 HG1 THR A 113 -5.555 -7.468 -1.303 1.00 0.00 H new ATOM 0 HG21 THR A 113 -5.059 -9.708 -3.499 1.00 0.00 H new ATOM 0 HG22 THR A 113 -5.047 -11.015 -2.291 1.00 0.00 H new ATOM 0 HG23 THR A 113 -6.343 -9.795 -2.270 1.00 0.00 H new ATOM 1633 N GLN A 114 -5.330 -11.774 0.298 1.00 0.00 N ATOM 1634 CA GLN A 114 -4.972 -13.208 0.507 1.00 0.00 C ATOM 1635 C GLN A 114 -4.674 -13.832 -0.859 1.00 0.00 C ATOM 1636 O GLN A 114 -5.514 -13.839 -1.730 1.00 0.00 O ATOM 1637 CB GLN A 114 -6.201 -13.870 1.155 1.00 0.00 C ATOM 1638 CG GLN A 114 -5.809 -15.244 1.701 1.00 0.00 C ATOM 1639 CD GLN A 114 -5.115 -15.081 3.054 1.00 0.00 C ATOM 1640 OE1 GLN A 114 -5.315 -14.098 3.740 1.00 0.00 O ATOM 1641 NE2 GLN A 114 -4.305 -16.013 3.472 1.00 0.00 N ATOM 0 H GLN A 114 -6.328 -11.568 0.253 1.00 0.00 H new ATOM 0 HA GLN A 114 -4.095 -13.336 1.142 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -6.584 -13.242 1.960 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -7.001 -13.972 0.422 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -6.695 -15.870 1.809 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -5.145 -15.749 0.999 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -4.137 -16.838 2.897 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -3.839 -15.917 4.374 1.00 0.00 H new ATOM 1650 N ILE A 115 -3.492 -14.352 -1.069 1.00 0.00 N ATOM 1651 CA ILE A 115 -3.206 -14.975 -2.392 1.00 0.00 C ATOM 1652 C ILE A 115 -3.424 -16.489 -2.277 1.00 0.00 C ATOM 1653 O ILE A 115 -2.719 -17.171 -1.552 1.00 0.00 O ATOM 1654 CB ILE A 115 -1.750 -14.627 -2.741 1.00 0.00 C ATOM 1655 CG1 ILE A 115 -1.628 -13.105 -2.918 1.00 0.00 C ATOM 1656 CG2 ILE A 115 -1.356 -15.335 -4.044 1.00 0.00 C ATOM 1657 CD1 ILE A 115 -0.196 -12.731 -3.322 1.00 0.00 C ATOM 0 H ILE A 115 -2.727 -14.372 -0.395 1.00 0.00 H new ATOM 0 HA ILE A 115 -3.863 -14.608 -3.180 1.00 0.00 H new ATOM 0 HB ILE A 115 -1.087 -14.955 -1.941 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -2.329 -12.763 -3.679 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -1.895 -12.601 -1.989 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -0.324 -15.090 -4.294 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -1.452 -16.413 -3.916 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -2.012 -15.006 -4.850 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -0.123 -11.650 -3.444 1.00 0.00 H new ATOM 0 HD12 ILE A 115 0.498 -13.056 -2.547 1.00 0.00 H new ATOM 0 HD13 ILE A 115 0.056 -13.220 -4.263 1.00 0.00 H new ATOM 1669 N TYR A 116 -4.407 -17.008 -2.971 1.00 0.00 N ATOM 1670 CA TYR A 116 -4.697 -18.472 -2.896 1.00 0.00 C ATOM 1671 C TYR A 116 -3.879 -19.258 -3.915 1.00 0.00 C ATOM 1672 O TYR A 116 -3.743 -18.864 -5.058 1.00 0.00 O ATOM 1673 CB TYR A 116 -6.186 -18.618 -3.226 1.00 0.00 C ATOM 1674 CG TYR A 116 -7.014 -18.363 -1.987 1.00 0.00 C ATOM 1675 CD1 TYR A 116 -6.737 -19.084 -0.794 1.00 0.00 C ATOM 1676 CD2 TYR A 116 -8.074 -17.411 -2.010 1.00 0.00 C ATOM 1677 CE1 TYR A 116 -7.514 -18.855 0.373 1.00 0.00 C ATOM 1678 CE2 TYR A 116 -8.846 -17.185 -0.843 1.00 0.00 C ATOM 1679 CZ TYR A 116 -8.568 -17.904 0.349 1.00 0.00 C ATOM 1680 OH TYR A 116 -9.324 -17.681 1.483 1.00 0.00 O ATOM 0 H TYR A 116 -5.023 -16.478 -3.588 1.00 0.00 H new ATOM 0 HA TYR A 116 -4.442 -18.861 -1.910 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -6.464 -17.915 -4.011 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -6.386 -19.619 -3.609 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -5.935 -19.807 -0.775 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -8.289 -16.863 -2.915 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -7.303 -19.404 1.279 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -9.649 -16.463 -0.861 1.00 0.00 H new ATOM 0 HH TYR A 116 -10.002 -16.999 1.295 1.00 0.00 H new ATOM 1690 N VAL A 117 -3.377 -20.393 -3.513 1.00 0.00 N ATOM 1691 CA VAL A 117 -2.611 -21.252 -4.452 1.00 0.00 C ATOM 1692 C VAL A 117 -3.238 -22.640 -4.453 1.00 0.00 C ATOM 1693 O VAL A 117 -4.032 -22.976 -3.593 1.00 0.00 O ATOM 1694 CB VAL A 117 -1.173 -21.311 -3.930 1.00 0.00 C ATOM 1695 CG1 VAL A 117 -0.344 -22.248 -4.825 1.00 0.00 C ATOM 1696 CG2 VAL A 117 -0.563 -19.908 -3.961 1.00 0.00 C ATOM 0 H VAL A 117 -3.467 -20.763 -2.567 1.00 0.00 H new ATOM 0 HA VAL A 117 -2.623 -20.863 -5.470 1.00 0.00 H new ATOM 0 HB VAL A 117 -1.171 -21.687 -2.907 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.681 -22.292 -4.455 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -0.779 -23.247 -4.807 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -0.345 -21.870 -5.847 1.00 0.00 H new ATOM 0 HG21 VAL A 117 0.461 -19.948 -3.590 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -0.563 -19.534 -4.985 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -1.152 -19.241 -3.331 1.00 0.00 H new ATOM 1706 N ILE A 118 -2.896 -23.433 -5.417 1.00 0.00 N ATOM 1707 CA ILE A 118 -3.467 -24.798 -5.510 1.00 0.00 C ATOM 1708 C ILE A 118 -2.475 -25.828 -4.962 1.00 0.00 C ATOM 1709 O ILE A 118 -1.370 -25.959 -5.454 1.00 0.00 O ATOM 1710 CB ILE A 118 -3.684 -24.988 -7.010 1.00 0.00 C ATOM 1711 CG1 ILE A 118 -4.573 -23.867 -7.592 1.00 0.00 C ATOM 1712 CG2 ILE A 118 -4.331 -26.347 -7.276 1.00 0.00 C ATOM 1713 CD1 ILE A 118 -5.834 -23.690 -6.748 1.00 0.00 C ATOM 0 H ILE A 118 -2.236 -23.192 -6.156 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.383 -24.925 -4.933 1.00 0.00 H new ATOM 0 HB ILE A 118 -2.711 -24.944 -7.500 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -4.015 -22.931 -7.623 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -4.847 -24.109 -8.619 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -4.482 -26.474 -8.348 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.680 -27.139 -6.905 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -5.293 -26.398 -6.765 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -6.448 -22.896 -7.173 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -6.400 -24.621 -6.740 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -5.555 -23.426 -5.728 1.00 0.00 H new ATOM 1725 N ASP A 119 -2.862 -26.552 -3.943 1.00 0.00 N ATOM 1726 CA ASP A 119 -1.948 -27.574 -3.350 1.00 0.00 C ATOM 1727 C ASP A 119 -2.727 -28.865 -3.034 1.00 0.00 C ATOM 1728 O ASP A 119 -3.729 -28.814 -2.349 1.00 0.00 O ATOM 1729 CB ASP A 119 -1.437 -26.931 -2.059 1.00 0.00 C ATOM 1730 CG ASP A 119 -0.298 -27.772 -1.476 1.00 0.00 C ATOM 1731 OD1 ASP A 119 0.430 -28.370 -2.251 1.00 0.00 O ATOM 1732 OD2 ASP A 119 -0.169 -27.797 -0.263 1.00 0.00 O ATOM 0 H ASP A 119 -3.775 -26.479 -3.495 1.00 0.00 H new ATOM 0 HA ASP A 119 -1.137 -27.850 -4.024 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -1.087 -25.918 -2.260 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -2.249 -26.850 -1.336 1.00 0.00 H new ATOM 1737 N PRO A 120 -2.251 -29.991 -3.532 1.00 0.00 N ATOM 1738 CA PRO A 120 -2.946 -31.278 -3.266 1.00 0.00 C ATOM 1739 C PRO A 120 -2.784 -31.676 -1.795 1.00 0.00 C ATOM 1740 O PRO A 120 -1.896 -31.204 -1.111 1.00 0.00 O ATOM 1741 CB PRO A 120 -2.236 -32.271 -4.183 1.00 0.00 C ATOM 1742 CG PRO A 120 -0.885 -31.680 -4.415 1.00 0.00 C ATOM 1743 CD PRO A 120 -1.054 -30.185 -4.369 1.00 0.00 C ATOM 0 HA PRO A 120 -4.019 -31.232 -3.452 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -2.163 -33.255 -3.719 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -2.777 -32.400 -5.120 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -0.180 -32.014 -3.653 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -0.485 -31.995 -5.379 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -0.180 -29.697 -3.937 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -1.192 -29.767 -5.366 1.00 0.00 H new ATOM 1751 N GLU A 121 -3.641 -32.538 -1.306 1.00 0.00 N ATOM 1752 CA GLU A 121 -3.547 -32.968 0.121 1.00 0.00 C ATOM 1753 C GLU A 121 -3.206 -34.465 0.205 1.00 0.00 C ATOM 1754 O GLU A 121 -3.566 -35.225 -0.671 1.00 0.00 O ATOM 1755 CB GLU A 121 -4.935 -32.703 0.705 1.00 0.00 C ATOM 1756 CG GLU A 121 -5.222 -31.200 0.678 1.00 0.00 C ATOM 1757 CD GLU A 121 -6.648 -30.939 1.170 1.00 0.00 C ATOM 1758 OE1 GLU A 121 -7.501 -31.781 0.935 1.00 0.00 O ATOM 1759 OE2 GLU A 121 -6.864 -29.901 1.774 1.00 0.00 O ATOM 0 H GLU A 121 -4.402 -32.962 -1.836 1.00 0.00 H new ATOM 0 HA GLU A 121 -2.766 -32.434 0.662 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -5.691 -33.239 0.131 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -4.988 -33.076 1.728 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -4.507 -30.672 1.309 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -5.100 -30.815 -0.334 1.00 0.00 H new ATOM 1766 N PRO A 122 -2.519 -34.850 1.262 1.00 0.00 N ATOM 1767 CA PRO A 122 -2.136 -36.276 1.432 1.00 0.00 C ATOM 1768 C PRO A 122 -3.373 -37.147 1.693 1.00 0.00 C ATOM 1769 O PRO A 122 -3.339 -38.349 1.504 1.00 0.00 O ATOM 1770 CB PRO A 122 -1.212 -36.259 2.649 1.00 0.00 C ATOM 1771 CG PRO A 122 -1.599 -35.031 3.406 1.00 0.00 C ATOM 1772 CD PRO A 122 -2.040 -34.021 2.382 1.00 0.00 C ATOM 0 HA PRO A 122 -1.659 -36.695 0.546 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -1.341 -37.155 3.256 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -0.164 -36.225 2.350 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -2.403 -35.246 4.110 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -0.758 -34.653 3.988 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -2.829 -33.376 2.769 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -1.218 -33.373 2.078 1.00 0.00 H new ATOM 1780 N CYS A 123 -4.462 -36.554 2.121 1.00 0.00 N ATOM 1781 CA CYS A 123 -5.696 -37.351 2.388 1.00 0.00 C ATOM 1782 C CYS A 123 -6.702 -37.166 1.236 1.00 0.00 C ATOM 1783 O CYS A 123 -7.071 -36.050 0.928 1.00 0.00 O ATOM 1784 CB CYS A 123 -6.259 -36.775 3.688 1.00 0.00 C ATOM 1785 SG CYS A 123 -5.088 -37.071 5.036 1.00 0.00 S ATOM 0 H CYS A 123 -4.547 -35.553 2.296 1.00 0.00 H new ATOM 0 HA CYS A 123 -5.494 -38.419 2.467 1.00 0.00 H new ATOM 0 HB2 CYS A 123 -6.439 -35.706 3.577 1.00 0.00 H new ATOM 0 HB3 CYS A 123 -7.219 -37.238 3.918 1.00 0.00 H new ATOM 0 HG CYS A 123 -5.565 -36.580 6.141 1.00 0.00 H new ATOM 1791 N PRO A 124 -7.117 -38.258 0.622 1.00 0.00 N ATOM 1792 CA PRO A 124 -8.083 -38.162 -0.505 1.00 0.00 C ATOM 1793 C PRO A 124 -9.471 -37.725 -0.017 1.00 0.00 C ATOM 1794 O PRO A 124 -10.296 -37.291 -0.799 1.00 0.00 O ATOM 1795 CB PRO A 124 -8.126 -39.582 -1.066 1.00 0.00 C ATOM 1796 CG PRO A 124 -7.716 -40.457 0.072 1.00 0.00 C ATOM 1797 CD PRO A 124 -6.750 -39.657 0.904 1.00 0.00 C ATOM 0 HA PRO A 124 -7.787 -37.420 -1.246 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -9.125 -39.837 -1.420 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -7.449 -39.693 -1.913 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -8.582 -40.755 0.663 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -7.248 -41.372 -0.292 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -6.847 -39.890 1.964 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -5.716 -39.863 0.626 1.00 0.00 H new ATOM 1805 N ASP A 125 -9.740 -37.839 1.263 1.00 0.00 N ATOM 1806 CA ASP A 125 -11.082 -37.433 1.785 1.00 0.00 C ATOM 1807 C ASP A 125 -11.083 -35.957 2.196 1.00 0.00 C ATOM 1808 O ASP A 125 -10.078 -35.277 2.109 1.00 0.00 O ATOM 1809 CB ASP A 125 -11.333 -38.341 2.998 1.00 0.00 C ATOM 1810 CG ASP A 125 -10.245 -38.144 4.068 1.00 0.00 C ATOM 1811 OD1 ASP A 125 -9.436 -37.241 3.924 1.00 0.00 O ATOM 1812 OD2 ASP A 125 -10.241 -38.909 5.018 1.00 0.00 O ATOM 0 H ASP A 125 -9.091 -38.194 1.965 1.00 0.00 H new ATOM 0 HA ASP A 125 -11.862 -37.540 1.031 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -12.312 -38.122 3.425 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -11.350 -39.383 2.679 1.00 0.00 H new ATOM 1817 N SER A 126 -12.208 -35.464 2.647 1.00 0.00 N ATOM 1818 CA SER A 126 -12.294 -34.034 3.072 1.00 0.00 C ATOM 1819 C SER A 126 -11.796 -33.881 4.512 1.00 0.00 C ATOM 1820 O SER A 126 -11.577 -34.856 5.206 1.00 0.00 O ATOM 1821 CB SER A 126 -13.778 -33.681 2.978 1.00 0.00 C ATOM 1822 OG SER A 126 -14.508 -34.468 3.909 1.00 0.00 O ATOM 0 H SER A 126 -13.075 -35.993 2.740 1.00 0.00 H new ATOM 0 HA SER A 126 -11.680 -33.381 2.452 1.00 0.00 H new ATOM 0 HB2 SER A 126 -13.925 -32.621 3.186 1.00 0.00 H new ATOM 0 HB3 SER A 126 -14.143 -33.861 1.967 1.00 0.00 H new ATOM 0 HG SER A 126 -15.460 -34.243 3.852 1.00 0.00 H new ATOM 1828 N ASP A 127 -11.618 -32.665 4.962 1.00 0.00 N ATOM 1829 CA ASP A 127 -11.137 -32.442 6.358 1.00 0.00 C ATOM 1830 C ASP A 127 -12.327 -32.344 7.315 1.00 0.00 C ATOM 1831 O ASP A 127 -13.037 -31.355 7.337 1.00 0.00 O ATOM 1832 CB ASP A 127 -10.377 -31.113 6.307 1.00 0.00 C ATOM 1833 CG ASP A 127 -9.738 -30.810 7.671 1.00 0.00 C ATOM 1834 OD1 ASP A 127 -10.073 -31.482 8.636 1.00 0.00 O ATOM 1835 OD2 ASP A 127 -8.920 -29.907 7.727 1.00 0.00 O ATOM 0 H ASP A 127 -11.785 -31.816 4.422 1.00 0.00 H new ATOM 0 HA ASP A 127 -10.508 -33.257 6.715 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -9.605 -31.157 5.538 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -11.057 -30.308 6.030 1.00 0.00 H new ATOM 1840 N GLN A 128 -12.549 -33.364 8.104 1.00 0.00 N ATOM 1841 CA GLN A 128 -13.692 -33.345 9.064 1.00 0.00 C ATOM 1842 C GLN A 128 -13.213 -33.731 10.466 1.00 0.00 C ATOM 1843 O GLN A 128 -12.172 -34.338 10.630 1.00 0.00 O ATOM 1844 CB GLN A 128 -14.678 -34.385 8.528 1.00 0.00 C ATOM 1845 CG GLN A 128 -15.199 -33.944 7.157 1.00 0.00 C ATOM 1846 CD GLN A 128 -15.997 -32.645 7.300 1.00 0.00 C ATOM 1847 OE1 GLN A 128 -15.578 -31.606 6.830 1.00 0.00 O ATOM 1848 NE2 GLN A 128 -17.137 -32.661 7.935 1.00 0.00 N ATOM 0 H GLN A 128 -11.984 -34.213 8.124 1.00 0.00 H new ATOM 0 HA GLN A 128 -14.146 -32.357 9.145 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -14.189 -35.356 8.447 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -15.509 -34.504 9.223 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -14.365 -33.796 6.471 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -15.829 -34.724 6.729 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -17.489 -33.533 8.330 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -17.676 -31.801 8.037 1.00 0.00 H new ATOM 1857 N GLU A 129 -13.970 -33.384 11.481 1.00 0.00 N ATOM 1858 CA GLU A 129 -13.574 -33.727 12.888 1.00 0.00 C ATOM 1859 C GLU A 129 -12.142 -33.241 13.193 1.00 0.00 C ATOM 1860 O GLU A 129 -11.331 -34.003 13.682 1.00 0.00 O ATOM 1861 CB GLU A 129 -13.654 -35.256 12.971 1.00 0.00 C ATOM 1862 CG GLU A 129 -15.103 -35.709 12.762 1.00 0.00 C ATOM 1863 CD GLU A 129 -15.980 -35.181 13.902 1.00 0.00 C ATOM 1864 OE1 GLU A 129 -15.474 -35.052 15.004 1.00 0.00 O ATOM 1865 OE2 GLU A 129 -17.144 -34.915 13.651 1.00 0.00 O ATOM 0 H GLU A 129 -14.850 -32.875 11.396 1.00 0.00 H new ATOM 0 HA GLU A 129 -14.225 -33.245 13.617 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -13.010 -35.705 12.215 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -13.293 -35.597 13.941 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -15.474 -35.342 11.805 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -15.152 -36.797 12.727 1.00 0.00 H new ATOM 1872 N PRO A 130 -11.866 -31.988 12.894 1.00 0.00 N ATOM 1873 CA PRO A 130 -10.510 -31.439 13.151 1.00 0.00 C ATOM 1874 C PRO A 130 -10.267 -31.297 14.657 1.00 0.00 C ATOM 1875 O PRO A 130 -11.187 -31.083 15.424 1.00 0.00 O ATOM 1876 CB PRO A 130 -10.536 -30.072 12.470 1.00 0.00 C ATOM 1877 CG PRO A 130 -11.981 -29.692 12.429 1.00 0.00 C ATOM 1878 CD PRO A 130 -12.761 -30.974 12.310 1.00 0.00 C ATOM 0 HA PRO A 130 -9.712 -32.079 12.774 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -9.951 -29.341 13.028 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -10.112 -30.122 11.467 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -12.264 -29.149 13.331 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -12.185 -29.035 11.584 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -13.707 -30.918 12.849 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -12.999 -31.202 11.271 1.00 0.00 H new ATOM 1886 N LYS A 131 -9.035 -31.420 15.081 1.00 0.00 N ATOM 1887 CA LYS A 131 -8.722 -31.297 16.536 1.00 0.00 C ATOM 1888 C LYS A 131 -8.440 -29.835 16.895 1.00 0.00 C ATOM 1889 O LYS A 131 -8.492 -29.447 18.045 1.00 0.00 O ATOM 1890 CB LYS A 131 -7.472 -32.152 16.744 1.00 0.00 C ATOM 1891 CG LYS A 131 -7.800 -33.616 16.447 1.00 0.00 C ATOM 1892 CD LYS A 131 -6.527 -34.458 16.559 1.00 0.00 C ATOM 1893 CE LYS A 131 -6.835 -35.905 16.166 1.00 0.00 C ATOM 1894 NZ LYS A 131 -7.644 -36.446 17.293 1.00 0.00 N ATOM 0 H LYS A 131 -8.231 -31.601 14.480 1.00 0.00 H new ATOM 0 HA LYS A 131 -9.549 -31.624 17.166 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -6.670 -31.808 16.090 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -7.114 -32.049 17.768 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -8.552 -33.980 17.147 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -8.223 -33.709 15.447 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -5.751 -34.051 15.910 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -6.142 -34.421 17.578 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -7.386 -35.950 15.227 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -5.919 -36.479 16.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -7.596 -37.485 17.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -7.268 -36.087 18.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -8.634 -36.145 17.186 1.00 0.00 H new TER 1908 LYS A 131 HETATM 1909 C1 NAG A 132 -5.539 -4.703 7.942 1.00 0.00 C HETATM 1910 C2 NAG A 132 -4.368 -3.898 8.506 1.00 0.00 C HETATM 1911 C3 NAG A 132 -3.741 -4.611 9.699 1.00 0.00 C HETATM 1912 C4 NAG A 132 -4.807 -4.989 10.719 1.00 0.00 C HETATM 1913 C5 NAG A 132 -5.942 -5.750 10.047 1.00 0.00 C HETATM 1914 C6 NAG A 132 -7.068 -6.042 11.017 1.00 0.00 C HETATM 1915 C7 NAG A 132 -2.709 -2.572 7.408 1.00 0.00 C HETATM 1916 C8 NAG A 132 -1.342 -2.592 6.743 1.00 0.00 C HETATM 1917 N2 NAG A 132 -3.359 -3.704 7.483 1.00 0.00 N HETATM 1918 O3 NAG A 132 -2.779 -3.762 10.306 1.00 0.00 O HETATM 1919 O4 NAG A 132 -4.223 -5.813 11.746 1.00 0.00 O HETATM 1920 O5 NAG A 132 -6.497 -4.976 8.969 1.00 0.00 O HETATM 1921 O6 NAG A 132 -7.718 -7.277 10.646 1.00 0.00 O HETATM 1922 O7 NAG A 132 -3.182 -1.546 7.854 1.00 0.00 O HETATM 0 HO3 NAG A 132 -2.313 -4.251 11.016 1.00 0.00 H new HETATM 0 HN2 NAG A 132 -3.156 -4.452 6.820 1.00 0.00 H new HETATM 0 H83 NAG A 132 -0.682 -3.268 7.287 1.00 0.00 H new HETATM 0 H82 NAG A 132 -1.443 -2.935 5.713 1.00 0.00 H new HETATM 0 H81 NAG A 132 -0.919 -1.587 6.751 1.00 0.00 H new HETATM 0 H62 NAG A 132 -6.677 -6.115 12.032 1.00 0.00 H new HETATM 0 H61 NAG A 132 -7.788 -5.224 11.011 1.00 0.00 H new HETATM 0 H5 NAG A 132 -5.518 -6.684 9.680 1.00 0.00 H new HETATM 0 H4 NAG A 132 -5.206 -4.076 11.160 1.00 0.00 H new HETATM 0 H3 NAG A 132 -3.258 -5.523 9.348 1.00 0.00 H new HETATM 0 H2 NAG A 132 -4.751 -2.932 8.834 1.00 0.00 H new HETATM 1935 C1 NAG A 133 -3.735 -5.147 12.857 1.00 0.00 C HETATM 1936 C2 NAG A 133 -3.821 -6.057 14.077 1.00 0.00 C HETATM 1937 C3 NAG A 133 -3.163 -5.397 15.286 1.00 0.00 C HETATM 1938 C4 NAG A 133 -1.755 -4.921 14.938 1.00 0.00 C HETATM 1939 C5 NAG A 133 -1.778 -4.066 13.675 1.00 0.00 C HETATM 1940 C6 NAG A 133 -0.386 -3.669 13.226 1.00 0.00 C HETATM 1941 C7 NAG A 133 -5.511 -7.258 15.260 1.00 0.00 C HETATM 1942 C8 NAG A 133 -5.233 -8.705 14.891 1.00 0.00 C HETATM 1943 N2 NAG A 133 -5.210 -6.347 14.376 1.00 0.00 N HETATM 1944 O3 NAG A 133 -3.099 -6.325 16.359 1.00 0.00 O HETATM 1945 O4 NAG A 133 -1.221 -4.150 16.032 1.00 0.00 O HETATM 1946 O5 NAG A 133 -2.376 -4.797 12.592 1.00 0.00 O HETATM 1947 O6 NAG A 133 -0.413 -3.074 11.937 1.00 0.00 O HETATM 1948 O7 NAG A 133 -5.994 -6.958 16.334 1.00 0.00 O HETATM 0 HO6 NAG A 133 0.497 -2.826 11.672 1.00 0.00 H new HETATM 0 HO3 NAG A 133 -2.675 -5.900 17.134 1.00 0.00 H new HETATM 0 HN2 NAG A 133 -5.952 -5.839 13.895 1.00 0.00 H new HETATM 0 H83 NAG A 133 -5.801 -8.968 13.999 1.00 0.00 H new HETATM 0 H82 NAG A 133 -4.168 -8.832 14.695 1.00 0.00 H new HETATM 0 H81 NAG A 133 -5.530 -9.354 15.715 1.00 0.00 H new HETATM 0 H62 NAG A 133 0.045 -2.970 13.943 1.00 0.00 H new HETATM 0 H61 NAG A 133 0.259 -4.548 13.210 1.00 0.00 H new HETATM 0 H5 NAG A 133 -2.351 -3.172 13.921 1.00 0.00 H new HETATM 0 H4 NAG A 133 -1.125 -5.792 14.761 1.00 0.00 H new HETATM 0 H3 NAG A 133 -3.761 -4.534 15.581 1.00 0.00 H new HETATM 0 H2 NAG A 133 -3.294 -6.985 13.855 1.00 0.00 H new HETATM 1962 C1 FUL A 134 -7.676 -8.262 11.647 1.00 0.00 C HETATM 1963 C2 FUL A 134 -8.639 -7.871 12.755 1.00 0.00 C HETATM 1964 O2 FUL A 134 -8.186 -6.703 13.426 1.00 0.00 O HETATM 1965 C3 FUL A 134 -9.993 -7.620 12.093 1.00 0.00 C HETATM 1966 O3 FUL A 134 -10.960 -7.326 13.090 1.00 0.00 O HETATM 1967 C4 FUL A 134 -10.438 -8.863 11.298 1.00 0.00 C HETATM 1968 O4 FUL A 134 -10.831 -9.877 12.210 1.00 0.00 O HETATM 1969 C5 FUL A 134 -9.322 -9.416 10.393 1.00 0.00 C HETATM 1970 C6 FUL A 134 -9.635 -10.802 9.866 1.00 0.00 C HETATM 1971 O5 FUL A 134 -8.097 -9.511 11.141 1.00 0.00 O HETATM 0 HO4 FUL A 134 -11.524 -10.435 11.800 1.00 0.00 H new HETATM 0 HO3 FUL A 134 -11.346 -8.161 13.428 1.00 0.00 H new HETATM 0 HO2 FUL A 134 -8.820 -6.466 14.135 1.00 0.00 H new HETATM 0 H63 FUL A 134 -9.760 -11.490 10.702 1.00 0.00 H new HETATM 0 H62 FUL A 134 -10.555 -10.770 9.282 1.00 0.00 H new HETATM 0 H61 FUL A 134 -8.816 -11.144 9.234 1.00 0.00 H new HETATM 0 H5 FUL A 134 -9.234 -8.728 9.552 1.00 0.00 H new HETATM 0 H4 FUL A 134 -11.266 -8.563 10.656 1.00 0.00 H new HETATM 0 H3 FUL A 134 -9.901 -6.777 11.409 1.00 0.00 H new HETATM 0 H2 FUL A 134 -8.711 -8.661 13.503 1.00 0.00 H new HETATM 1983 C1 BMA A 135 -0.124 -4.693 16.683 1.00 0.00 C HETATM 1984 C2 BMA A 135 1.157 -4.262 15.975 1.00 0.00 C HETATM 1985 C3 BMA A 135 2.375 -4.777 16.733 1.00 0.00 C HETATM 1986 C4 BMA A 135 2.300 -4.357 18.198 1.00 0.00 C HETATM 1987 C5 BMA A 135 0.957 -4.757 18.806 1.00 0.00 C HETATM 1988 C6 BMA A 135 0.791 -4.240 20.221 1.00 0.00 C HETATM 1989 O2 BMA A 135 1.207 -2.845 15.897 1.00 0.00 O HETATM 1990 O3 BMA A 135 3.558 -4.255 16.147 1.00 0.00 O HETATM 1991 O4 BMA A 135 3.351 -4.977 18.924 1.00 0.00 O HETATM 1992 O5 BMA A 135 -0.128 -4.215 18.029 1.00 0.00 O HETATM 1993 O6 BMA A 135 1.121 -2.861 20.306 1.00 0.00 O HETATM 0 HO6 BMA A 135 1.004 -2.553 21.229 1.00 0.00 H new HETATM 0 HO4 BMA A 135 3.509 -4.484 19.756 1.00 0.00 H new HETATM 0 HO3 BMA A 135 4.339 -4.586 16.637 1.00 0.00 H new HETATM 0 HO2 BMA A 135 2.140 -2.554 15.820 1.00 0.00 H new HETATM 0 H62 BMA A 135 -0.238 -4.391 20.548 1.00 0.00 H new HETATM 0 H61 BMA A 135 1.427 -4.811 20.897 1.00 0.00 H new HETATM 0 H5 BMA A 135 0.939 -5.847 18.810 1.00 0.00 H new HETATM 0 H4 BMA A 135 2.400 -3.273 18.255 1.00 0.00 H new HETATM 0 H3 BMA A 135 2.392 -5.865 16.677 1.00 0.00 H new HETATM 0 H2 BMA A 135 1.163 -4.681 14.969 1.00 0.00 H new HETATM 2005 C1 NAG A 136 0.174 -6.406 -13.319 1.00 0.00 C HETATM 2006 C2 NAG A 136 -1.115 -7.025 -13.857 1.00 0.00 C HETATM 2007 C3 NAG A 136 -0.811 -8.098 -14.898 1.00 0.00 C HETATM 2008 C4 NAG A 136 0.118 -7.538 -15.964 1.00 0.00 C HETATM 2009 C5 NAG A 136 1.364 -6.929 -15.314 1.00 0.00 C HETATM 2010 C6 NAG A 136 2.296 -6.293 -16.327 1.00 0.00 C HETATM 2011 C7 NAG A 136 -3.177 -7.639 -12.823 1.00 0.00 C HETATM 2012 C8 NAG A 136 -3.940 -6.656 -11.949 1.00 0.00 C HETATM 2013 N2 NAG A 136 -1.874 -7.606 -12.766 1.00 0.00 N HETATM 2014 O3 NAG A 136 -2.021 -8.533 -15.502 1.00 0.00 O HETATM 2015 O4 NAG A 136 0.441 -8.558 -16.943 1.00 0.00 O HETATM 2016 O5 NAG A 136 0.977 -5.900 -14.389 1.00 0.00 O HETATM 2017 O6 NAG A 136 1.667 -5.129 -16.902 1.00 0.00 O HETATM 2018 O7 NAG A 136 -3.756 -8.426 -13.546 1.00 0.00 O HETATM 0 HO3 NAG A 136 -2.753 -8.467 -14.853 1.00 0.00 H new HETATM 0 HN2 NAG A 136 -1.389 -7.989 -11.954 1.00 0.00 H new HETATM 0 H83 NAG A 136 -3.692 -6.831 -10.902 1.00 0.00 H new HETATM 0 H82 NAG A 136 -3.665 -5.637 -12.221 1.00 0.00 H new HETATM 0 H81 NAG A 136 -5.011 -6.794 -12.096 1.00 0.00 H new HETATM 0 H62 NAG A 136 3.233 -6.012 -15.847 1.00 0.00 H new HETATM 0 H61 NAG A 136 2.541 -7.010 -17.110 1.00 0.00 H new HETATM 0 H5 NAG A 136 1.883 -7.748 -14.816 1.00 0.00 H new HETATM 0 H4 NAG A 136 -0.389 -6.735 -16.500 1.00 0.00 H new HETATM 0 H3 NAG A 136 -0.325 -8.942 -14.409 1.00 0.00 H new HETATM 0 H2 NAG A 136 -1.700 -6.238 -14.332 1.00 0.00 H new HETATM 2031 C1 NAG A 137 1.608 -9.297 -16.830 1.00 0.00 C HETATM 2032 C2 NAG A 137 1.266 -10.765 -16.588 1.00 0.00 C HETATM 2033 C3 NAG A 137 2.530 -11.619 -16.602 1.00 0.00 C HETATM 2034 C4 NAG A 137 3.358 -11.347 -17.854 1.00 0.00 C HETATM 2035 C5 NAG A 137 3.590 -9.849 -18.031 1.00 0.00 C HETATM 2036 C6 NAG A 137 4.298 -9.530 -19.332 1.00 0.00 C HETATM 2037 C7 NAG A 137 -0.485 -11.628 -15.208 1.00 0.00 C HETATM 2038 C8 NAG A 137 -1.487 -11.236 -14.134 1.00 0.00 C HETATM 2039 N2 NAG A 137 0.601 -10.908 -15.307 1.00 0.00 N HETATM 2040 O3 NAG A 137 2.177 -12.994 -16.557 1.00 0.00 O HETATM 2041 O4 NAG A 137 4.628 -12.018 -17.747 1.00 0.00 O HETATM 2042 O5 NAG A 137 2.334 -9.149 -18.052 1.00 0.00 O HETATM 2043 O6 NAG A 137 5.708 -9.618 -19.186 1.00 0.00 O HETATM 2044 O7 NAG A 137 -0.683 -12.573 -15.945 1.00 0.00 O HETATM 0 HO6 NAG A 137 6.139 -9.409 -20.041 1.00 0.00 H new HETATM 0 HO3 NAG A 137 1.206 -13.079 -16.451 1.00 0.00 H new HETATM 0 HN2 NAG A 137 0.982 -10.446 -14.482 1.00 0.00 H new HETATM 0 H83 NAG A 137 -1.012 -11.293 -13.155 1.00 0.00 H new HETATM 0 H82 NAG A 137 -1.831 -10.217 -14.312 1.00 0.00 H new HETATM 0 H81 NAG A 137 -2.338 -11.916 -14.165 1.00 0.00 H new HETATM 0 H62 NAG A 137 3.967 -10.220 -20.108 1.00 0.00 H new HETATM 0 H61 NAG A 137 4.026 -8.527 -19.660 1.00 0.00 H new HETATM 0 H5 NAG A 137 4.209 -9.534 -17.191 1.00 0.00 H new HETATM 0 H4 NAG A 137 2.812 -11.722 -18.720 1.00 0.00 H new HETATM 0 H3 NAG A 137 3.129 -11.361 -15.728 1.00 0.00 H new HETATM 0 H2 NAG A 137 0.604 -11.103 -17.385 1.00 0.00 H new HETATM 2058 C1 FUC A 138 1.832 -5.071 -18.291 1.00 0.00 C HETATM 2059 C2 FUC A 138 1.231 -3.772 -18.798 1.00 0.00 C HETATM 2060 C3 FUC A 138 1.894 -2.637 -18.021 1.00 0.00 C HETATM 2061 C4 FUC A 138 3.423 -2.709 -18.170 1.00 0.00 C HETATM 2062 C5 FUC A 138 3.971 -4.122 -17.906 1.00 0.00 C HETATM 2063 C6 FUC A 138 5.414 -4.274 -18.343 1.00 0.00 C HETATM 2064 O2 FUC A 138 -0.173 -3.764 -18.585 1.00 0.00 O HETATM 2065 O3 FUC A 138 1.430 -1.390 -18.517 1.00 0.00 O HETATM 2066 O4 FUC A 138 3.779 -2.317 -19.487 1.00 0.00 O HETATM 2067 O5 FUC A 138 3.200 -5.085 -18.645 1.00 0.00 O HETATM 0 HO4 FUC A 138 4.667 -1.902 -19.476 1.00 0.00 H new HETATM 0 HO3 FUC A 138 2.100 -1.008 -19.121 1.00 0.00 H new HETATM 0 HO2 FUC A 138 -0.549 -2.921 -18.914 1.00 0.00 H new HETATM 0 H63 FUC A 138 5.493 -4.077 -19.412 1.00 0.00 H new HETATM 0 H62 FUC A 138 6.036 -3.565 -17.797 1.00 0.00 H new HETATM 0 H61 FUC A 138 5.752 -5.289 -18.135 1.00 0.00 H new HETATM 0 H5 FUC A 138 3.905 -4.286 -16.830 1.00 0.00 H new HETATM 0 H4 FUC A 138 3.858 -2.039 -17.428 1.00 0.00 H new HETATM 0 H3 FUC A 138 1.636 -2.734 -16.966 1.00 0.00 H new HETATM 0 H2 FUC A 138 1.402 -3.657 -19.868 1.00 0.00 H new HETATM 2079 C1 BMA A 139 4.781 -13.164 -18.510 1.00 0.00 C HETATM 2080 C2 BMA A 139 5.438 -12.808 -19.839 1.00 0.00 C HETATM 2081 C3 BMA A 139 5.713 -14.070 -20.648 1.00 0.00 C HETATM 2082 C4 BMA A 139 6.496 -15.076 -19.811 1.00 0.00 C HETATM 2083 C5 BMA A 139 5.801 -15.317 -18.472 1.00 0.00 C HETATM 2084 C6 BMA A 139 6.612 -16.214 -17.558 1.00 0.00 C HETATM 2085 O2 BMA A 139 6.657 -12.120 -19.600 1.00 0.00 O HETATM 2086 O3 BMA A 139 6.455 -13.738 -21.813 1.00 0.00 O HETATM 2087 O4 BMA A 139 6.602 -16.302 -20.518 1.00 0.00 O HETATM 2088 O5 BMA A 139 5.605 -14.072 -17.777 1.00 0.00 O HETATM 2089 O6 BMA A 139 7.950 -15.752 -17.440 1.00 0.00 O HETATM 0 HO6 BMA A 139 8.450 -16.347 -16.844 1.00 0.00 H new HETATM 0 HO4 BMA A 139 7.347 -16.826 -20.155 1.00 0.00 H new HETATM 0 HO3 BMA A 139 6.632 -14.551 -22.331 1.00 0.00 H new HETATM 0 HO2 BMA A 139 6.466 -11.187 -19.367 1.00 0.00 H new HETATM 0 H62 BMA A 139 6.148 -16.248 -16.572 1.00 0.00 H new HETATM 0 H61 BMA A 139 6.609 -17.232 -17.947 1.00 0.00 H new HETATM 0 H5 BMA A 139 4.850 -15.797 -18.705 1.00 0.00 H new HETATM 0 H4 BMA A 139 7.491 -14.673 -19.621 1.00 0.00 H new HETATM 0 H3 BMA A 139 4.762 -14.517 -20.937 1.00 0.00 H new HETATM 0 H2 BMA A 139 4.762 -12.167 -20.405 1.00 0.00 H new