USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=56 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 ASNHD22 : A 111 ASN ND2 : A 132 NAG C1 :(H bumps) USER MOD Set 1.1: A 114 GLN : amide:sc= 0.0523 K(o=-0.15,f=-1.9) USER MOD Set 1.2: A 116 TYR OH : rot 19:sc= -0.203 USER MOD Set 2.1: A 54 MET CE :methyl 149:sc= -0.757 (180deg=-1.77) USER MOD Set 2.2: A 72 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 30 THR OG1 : rot 180:sc= -1.57 USER MOD Set 3.2: A 53 MET CE :methyl 177:sc= -7.63! (180deg=-7.6!) USER MOD Single : A 1 MET CE :methyl 156:sc= -0.0776 (180deg=-0.757) USER MOD Single : A 1AALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 HIS :FLIP no HD1:sc= -1.32 F(o=-2,f=-1.3) USER MOD Single : A 5 GLN : amide:sc= -23.5! C(o=-24!,f=-31!) USER MOD Single : A 12 SER OG : rot 180:sc= -0.0551 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot -159:sc= -1.99 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= -0.903 USER MOD Single : A 28 LYS NZ :NH3+ -144:sc= -0.0429 (180deg=-0.567) USER MOD Single : A 35 THR OG1 : rot 170:sc= 0 USER MOD Single : A 39 GLN :FLIP amide:sc= -1.98 F(o=-5.6!,f=-2) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -0.131 X(o=-0.13,f=-0.2) USER MOD Single : A 45 THR OG1 : rot 160:sc= 0 USER MOD Single : A 51 THR OG1 : rot -146:sc= 0.363 USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 ASN : amide:sc=-0.00792 X(o=-0.0079,f=-0.011) USER MOD Single : A 59 THR OG1 : rot 37:sc= 0.124 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 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -0.25 X(o=-0.25,f=0) USER MOD Single : A 76 GLN : amide:sc= -0.0414 X(o=-0.041,f=0) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 MET CE :methyl -117:sc= -1.11 (180deg=-2.51!) USER MOD Single : A 89 THR OG1 : rot 120:sc= 1.28 USER MOD Single : A 92 TYR OH : rot -19:sc= 0.835 USER MOD Single : A 95 LYS NZ :NH3+ -165:sc= -0.75 (180deg=-1.25) USER MOD Single : A 99 MET CE :methyl -115:sc= -2.44! (180deg=-3.83!) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 TYR OH : rot 180:sc= -1.95 USER MOD Single : A 105 TYR OH : rot 165:sc= -0.0332 USER MOD Single : A 113 THR OG1 : rot -74:sc= 0.0416 USER MOD Single : A 123 CYS SG : rot -100:sc= -0.815! USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc= -0.213 K(o=-0.21,f=-1.8) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 NAG O3 : rot 172:sc= 1.26 USER MOD Single : A 133 NAG O3 : rot 14:sc= 0.902 USER MOD Single : A 133 NAG O6 : rot 180:sc= 0 USER MOD Single : A 134 FUL O2 : rot 147:sc= -3.72! USER MOD Single : A 134 FUL O3 : rot -100:sc= 0.0567 USER MOD Single : A 134 FUL O4 : rot 150:sc= 0.05 USER MOD Single : A 135 BMA O2 : rot 153:sc= 0.0641 USER MOD Single : A 135 BMA O3 : rot 180:sc= 0.0746 USER MOD Single : A 135 BMA O4 : rot 150:sc= -0.0111 USER MOD Single : A 135 BMA O6 : rot 180:sc= 0 USER MOD Single : A 136 NAG O3 : rot -75:sc= 0.111 USER MOD Single : A 137 NAG O3 : rot 138:sc= 0.349 USER MOD Single : A 137 NAG O6 : rot 180:sc= -0.0227 USER MOD Single : A 138 FUC O2 : rot -57:sc= -1.98 USER MOD Single : A 138 FUC O3 : rot -88:sc= 0.12 USER MOD Single : A 138 FUC O4 : rot 150:sc= 0.0934 USER MOD Single : A 139 BMA O2 : rot 149:sc= 0.0619 USER MOD Single : A 139 BMA O3 : rot 180:sc= 0.0638 USER MOD Single : A 139 BMA O4 : rot 160:sc= 0 USER MOD Single : A 139 BMA O6 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1A -9.140 11.890 0.011 1.00 0.00 N ATOM 2 CA ALA A 1A -9.849 10.588 -0.148 1.00 0.00 C ATOM 3 C ALA A 1A -9.388 9.602 0.928 1.00 0.00 C ATOM 4 O ALA A 1A -10.188 9.030 1.643 1.00 0.00 O ATOM 5 CB ALA A 1A -9.454 10.090 -1.538 1.00 0.00 C ATOM 0 H1 ALA A 1A -9.460 12.552 -0.724 1.00 0.00 H new ATOM 0 H2 ALA A 1A -9.349 12.287 0.949 1.00 0.00 H new ATOM 0 H3 ALA A 1A -8.115 11.741 -0.081 1.00 0.00 H new ATOM 0 HA ALA A 1A -10.929 10.689 -0.044 1.00 0.00 H new ATOM 0 HB1 ALA A 1A -9.937 9.132 -1.732 1.00 0.00 H new ATOM 0 HB2 ALA A 1A -9.771 10.815 -2.288 1.00 0.00 H new ATOM 0 HB3 ALA A 1A -8.372 9.967 -1.587 1.00 0.00 H new ATOM 13 N MET A 1 -8.097 9.399 1.048 1.00 0.00 N ATOM 14 CA MET A 1 -7.556 8.450 2.078 1.00 0.00 C ATOM 15 C MET A 1 -8.231 7.077 1.956 1.00 0.00 C ATOM 16 O MET A 1 -8.515 6.426 2.944 1.00 0.00 O ATOM 17 CB MET A 1 -7.883 9.091 3.431 1.00 0.00 C ATOM 18 CG MET A 1 -7.124 10.412 3.567 1.00 0.00 C ATOM 19 SD MET A 1 -7.581 11.213 5.125 1.00 0.00 S ATOM 20 CE MET A 1 -6.702 10.079 6.229 1.00 0.00 C ATOM 0 H MET A 1 -7.388 9.853 0.472 1.00 0.00 H new ATOM 0 HA MET A 1 -6.486 8.285 1.954 1.00 0.00 H new ATOM 0 HB2 MET A 1 -8.956 9.266 3.513 1.00 0.00 H new ATOM 0 HB3 MET A 1 -7.607 8.416 4.241 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.050 10.231 3.540 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.358 11.066 2.727 1.00 0.00 H new ATOM 0 HE1 MET A 1 -6.481 10.585 7.169 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.324 9.206 6.424 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.771 9.763 5.759 1.00 0.00 H new ATOM 30 N HIS A 2 -8.481 6.636 0.749 1.00 0.00 N ATOM 31 CA HIS A 2 -9.132 5.307 0.551 1.00 0.00 C ATOM 32 C HIS A 2 -8.128 4.318 -0.044 1.00 0.00 C ATOM 33 O HIS A 2 -7.464 4.607 -1.022 1.00 0.00 O ATOM 34 CB HIS A 2 -10.276 5.570 -0.429 1.00 0.00 C ATOM 35 CG HIS A 2 -11.274 6.499 0.206 1.00 0.00 C ATOM 36 ND1 HIS A 2 -11.779 7.713 -0.190 1.00 0.00 N flip ATOM 37 CD2 HIS A 2 -11.882 6.214 1.419 1.00 0.00 C flip ATOM 38 CE1 HIS A 2 -12.686 8.175 0.759 1.00 0.00 C flip ATOM 39 NE2 HIS A 2 -12.710 7.234 1.707 1.00 0.00 N flip ATOM 0 H HIS A 2 -8.261 7.141 -0.110 1.00 0.00 H new ATOM 0 HA HIS A 2 -9.490 4.874 1.485 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -9.888 6.008 -1.349 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -10.759 4.632 -0.702 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -11.720 5.333 2.023 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -13.249 9.096 0.734 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -13.286 7.283 2.547 1.00 0.00 H new ATOM 47 N VAL A 3 -8.014 3.153 0.542 1.00 0.00 N ATOM 48 CA VAL A 3 -7.051 2.139 0.021 1.00 0.00 C ATOM 49 C VAL A 3 -7.776 0.813 -0.241 1.00 0.00 C ATOM 50 O VAL A 3 -8.515 0.324 0.593 1.00 0.00 O ATOM 51 CB VAL A 3 -6.006 1.984 1.132 1.00 0.00 C ATOM 52 CG1 VAL A 3 -4.973 0.925 0.736 1.00 0.00 C ATOM 53 CG2 VAL A 3 -5.295 3.322 1.353 1.00 0.00 C ATOM 0 H VAL A 3 -8.548 2.861 1.360 1.00 0.00 H new ATOM 0 HA VAL A 3 -6.595 2.438 -0.923 1.00 0.00 H new ATOM 0 HB VAL A 3 -6.506 1.674 2.050 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -4.235 0.822 1.531 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -5.473 -0.031 0.579 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -4.475 1.229 -0.184 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -4.552 3.213 2.143 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.802 3.629 0.431 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -6.025 4.078 1.643 1.00 0.00 H new ATOM 63 N ALA A 4 -7.561 0.231 -1.393 1.00 0.00 N ATOM 64 CA ALA A 4 -8.224 -1.066 -1.723 1.00 0.00 C ATOM 65 C ALA A 4 -7.177 -2.178 -1.791 1.00 0.00 C ATOM 66 O ALA A 4 -6.141 -2.022 -2.411 1.00 0.00 O ATOM 67 CB ALA A 4 -8.860 -0.850 -3.094 1.00 0.00 C ATOM 0 H ALA A 4 -6.952 0.601 -2.123 1.00 0.00 H new ATOM 0 HA ALA A 4 -8.962 -1.359 -0.976 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -9.368 -1.762 -3.407 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -9.581 -0.034 -3.036 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -8.086 -0.599 -3.819 1.00 0.00 H new ATOM 73 N GLN A 5 -7.431 -3.294 -1.155 1.00 0.00 N ATOM 74 CA GLN A 5 -6.434 -4.408 -1.181 1.00 0.00 C ATOM 75 C GLN A 5 -7.123 -5.766 -1.388 1.00 0.00 C ATOM 76 O GLN A 5 -8.228 -5.968 -0.924 1.00 0.00 O ATOM 77 CB GLN A 5 -5.762 -4.375 0.193 1.00 0.00 C ATOM 78 CG GLN A 5 -5.080 -3.022 0.408 1.00 0.00 C ATOM 79 CD GLN A 5 -4.011 -2.793 -0.662 1.00 0.00 C ATOM 80 OE1 GLN A 5 -3.289 -3.702 -1.021 1.00 0.00 O ATOM 81 NE2 GLN A 5 -3.890 -1.607 -1.194 1.00 0.00 N ATOM 0 H GLN A 5 -8.280 -3.482 -0.622 1.00 0.00 H new ATOM 0 HA GLN A 5 -5.725 -4.285 -2.000 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -6.503 -4.547 0.974 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -5.028 -5.178 0.268 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -5.821 -2.223 0.369 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -4.626 -2.989 1.399 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -4.498 -0.847 -0.889 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -3.187 -1.440 -1.914 1.00 0.00 H new ATOM 90 N PRO A 6 -6.437 -6.675 -2.053 1.00 0.00 N ATOM 91 CA PRO A 6 -7.000 -8.030 -2.270 1.00 0.00 C ATOM 92 C PRO A 6 -7.032 -8.777 -0.941 1.00 0.00 C ATOM 93 O PRO A 6 -6.249 -8.503 -0.053 1.00 0.00 O ATOM 94 CB PRO A 6 -6.026 -8.679 -3.252 1.00 0.00 C ATOM 95 CG PRO A 6 -4.739 -7.947 -3.057 1.00 0.00 C ATOM 96 CD PRO A 6 -5.096 -6.541 -2.651 1.00 0.00 C ATOM 0 HA PRO A 6 -8.020 -8.029 -2.654 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -5.910 -9.743 -3.048 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -6.381 -8.588 -4.279 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -4.132 -8.429 -2.290 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -4.151 -7.947 -3.975 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -4.379 -6.137 -1.937 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -5.106 -5.868 -3.508 1.00 0.00 H new ATOM 104 N ALA A 7 -7.934 -9.705 -0.791 1.00 0.00 N ATOM 105 CA ALA A 7 -8.015 -10.461 0.490 1.00 0.00 C ATOM 106 C ALA A 7 -7.705 -11.936 0.268 1.00 0.00 C ATOM 107 O ALA A 7 -7.486 -12.665 1.220 1.00 0.00 O ATOM 108 CB ALA A 7 -9.454 -10.282 0.967 1.00 0.00 C ATOM 0 H ALA A 7 -8.618 -9.973 -1.499 1.00 0.00 H new ATOM 0 HA ALA A 7 -7.293 -10.099 1.221 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -9.594 -10.812 1.909 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.660 -9.222 1.113 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -10.138 -10.684 0.220 1.00 0.00 H new ATOM 114 N VAL A 8 -7.660 -12.392 -0.965 1.00 0.00 N ATOM 115 CA VAL A 8 -7.335 -13.823 -1.179 1.00 0.00 C ATOM 116 C VAL A 8 -6.400 -13.818 -2.423 1.00 0.00 C ATOM 117 O VAL A 8 -6.678 -13.103 -3.373 1.00 0.00 O ATOM 118 CB VAL A 8 -8.709 -14.520 -1.501 1.00 0.00 C ATOM 119 CG1 VAL A 8 -9.041 -14.324 -2.951 1.00 0.00 C ATOM 120 CG2 VAL A 8 -8.766 -16.022 -1.216 1.00 0.00 C ATOM 0 H VAL A 8 -7.831 -11.843 -1.807 1.00 0.00 H new ATOM 0 HA VAL A 8 -6.857 -14.334 -0.343 1.00 0.00 H new ATOM 0 HB VAL A 8 -9.425 -14.044 -0.831 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -9.992 -14.806 -3.175 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.115 -13.258 -3.166 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -8.257 -14.765 -3.567 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.754 -16.404 -1.472 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -8.013 -16.535 -1.814 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -8.571 -16.199 -0.158 1.00 0.00 H new ATOM 130 N VAL A 9 -5.340 -14.569 -2.460 1.00 0.00 N ATOM 131 CA VAL A 9 -4.477 -14.548 -3.692 1.00 0.00 C ATOM 132 C VAL A 9 -4.032 -15.962 -4.069 1.00 0.00 C ATOM 133 O VAL A 9 -3.811 -16.791 -3.226 1.00 0.00 O ATOM 134 CB VAL A 9 -3.304 -13.618 -3.362 1.00 0.00 C ATOM 135 CG1 VAL A 9 -2.102 -13.864 -4.292 1.00 0.00 C ATOM 136 CG2 VAL A 9 -3.768 -12.178 -3.558 1.00 0.00 C ATOM 0 H VAL A 9 -5.029 -15.189 -1.712 1.00 0.00 H new ATOM 0 HA VAL A 9 -5.013 -14.180 -4.567 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.991 -13.810 -2.336 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -1.291 -13.186 -4.026 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -1.763 -14.894 -4.184 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -2.399 -13.687 -5.326 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -2.948 -11.497 -3.328 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.081 -12.034 -4.592 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -4.607 -11.972 -2.893 1.00 0.00 H new ATOM 146 N LEU A 10 -3.908 -16.233 -5.341 1.00 0.00 N ATOM 147 CA LEU A 10 -3.491 -17.603 -5.774 1.00 0.00 C ATOM 148 C LEU A 10 -2.122 -17.556 -6.463 1.00 0.00 C ATOM 149 O LEU A 10 -1.771 -16.581 -7.101 1.00 0.00 O ATOM 150 CB LEU A 10 -4.582 -18.059 -6.754 1.00 0.00 C ATOM 151 CG LEU A 10 -5.967 -17.993 -6.084 1.00 0.00 C ATOM 152 CD1 LEU A 10 -7.028 -18.490 -7.068 1.00 0.00 C ATOM 153 CD2 LEU A 10 -5.996 -18.860 -4.811 1.00 0.00 C ATOM 0 H LEU A 10 -4.076 -15.570 -6.098 1.00 0.00 H new ATOM 0 HA LEU A 10 -3.389 -18.288 -4.932 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -4.570 -17.427 -7.642 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.379 -19.077 -7.085 1.00 0.00 H new ATOM 0 HG LEU A 10 -6.175 -16.960 -5.804 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -8.010 -18.445 -6.597 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -7.023 -17.860 -7.958 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -6.808 -19.519 -7.351 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -6.983 -18.800 -4.352 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -5.779 -19.896 -5.071 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.246 -18.498 -4.107 1.00 0.00 H new ATOM 165 N ALA A 11 -1.347 -18.605 -6.333 1.00 0.00 N ATOM 166 CA ALA A 11 0.006 -18.637 -6.970 1.00 0.00 C ATOM 167 C ALA A 11 0.032 -19.650 -8.118 1.00 0.00 C ATOM 168 O ALA A 11 -0.987 -20.183 -8.510 1.00 0.00 O ATOM 169 CB ALA A 11 0.962 -19.067 -5.856 1.00 0.00 C ATOM 0 H ALA A 11 -1.595 -19.445 -5.810 1.00 0.00 H new ATOM 0 HA ALA A 11 0.281 -17.671 -7.394 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.978 -19.114 -6.247 1.00 0.00 H new ATOM 0 HB2 ALA A 11 0.920 -18.344 -5.041 1.00 0.00 H new ATOM 0 HB3 ALA A 11 0.670 -20.050 -5.485 1.00 0.00 H new ATOM 175 N SER A 12 1.194 -19.913 -8.660 1.00 0.00 N ATOM 176 CA SER A 12 1.306 -20.888 -9.787 1.00 0.00 C ATOM 177 C SER A 12 2.302 -21.996 -9.427 1.00 0.00 C ATOM 178 O SER A 12 2.978 -21.927 -8.418 1.00 0.00 O ATOM 179 CB SER A 12 1.815 -20.069 -10.971 1.00 0.00 C ATOM 180 OG SER A 12 1.859 -20.893 -12.128 1.00 0.00 O ATOM 0 H SER A 12 2.076 -19.491 -8.368 1.00 0.00 H new ATOM 0 HA SER A 12 0.357 -21.375 -10.010 1.00 0.00 H new ATOM 0 HB2 SER A 12 1.162 -19.214 -11.144 1.00 0.00 H new ATOM 0 HB3 SER A 12 2.807 -19.673 -10.754 1.00 0.00 H new ATOM 0 HG SER A 12 2.184 -20.370 -12.890 1.00 0.00 H new ATOM 186 N SER A 13 2.407 -23.011 -10.255 1.00 0.00 N ATOM 187 CA SER A 13 3.361 -24.126 -9.954 1.00 0.00 C ATOM 188 C SER A 13 4.792 -23.579 -9.885 1.00 0.00 C ATOM 189 O SER A 13 5.570 -23.962 -9.030 1.00 0.00 O ATOM 190 CB SER A 13 3.225 -25.099 -11.131 1.00 0.00 C ATOM 191 OG SER A 13 4.036 -26.242 -10.890 1.00 0.00 O ATOM 0 H SER A 13 1.877 -23.114 -11.120 1.00 0.00 H new ATOM 0 HA SER A 13 3.147 -24.608 -9.000 1.00 0.00 H new ATOM 0 HB2 SER A 13 2.184 -25.397 -11.254 1.00 0.00 H new ATOM 0 HB3 SER A 13 3.528 -24.612 -12.058 1.00 0.00 H new ATOM 0 HG SER A 13 3.951 -26.868 -11.640 1.00 0.00 H new ATOM 197 N ARG A 14 5.125 -22.661 -10.754 1.00 0.00 N ATOM 198 CA ARG A 14 6.495 -22.058 -10.735 1.00 0.00 C ATOM 199 C ARG A 14 6.741 -21.368 -9.390 1.00 0.00 C ATOM 200 O ARG A 14 7.865 -21.240 -8.943 1.00 0.00 O ATOM 201 CB ARG A 14 6.495 -21.021 -11.861 1.00 0.00 C ATOM 202 CG ARG A 14 6.511 -21.729 -13.216 1.00 0.00 C ATOM 203 CD ARG A 14 7.941 -22.159 -13.544 1.00 0.00 C ATOM 204 NE ARG A 14 7.877 -22.676 -14.946 1.00 0.00 N ATOM 205 CZ ARG A 14 7.873 -21.860 -15.982 1.00 0.00 C ATOM 206 NH1 ARG A 14 7.896 -20.555 -15.833 1.00 0.00 N ATOM 207 NH2 ARG A 14 7.836 -22.362 -17.187 1.00 0.00 N ATOM 0 H ARG A 14 4.506 -22.300 -11.480 1.00 0.00 H new ATOM 0 HA ARG A 14 7.275 -22.808 -10.869 1.00 0.00 H new ATOM 0 HB2 ARG A 14 5.613 -20.385 -11.783 1.00 0.00 H new ATOM 0 HB3 ARG A 14 7.365 -20.371 -11.769 1.00 0.00 H new ATOM 0 HG2 ARG A 14 5.854 -22.598 -13.193 1.00 0.00 H new ATOM 0 HG3 ARG A 14 6.132 -21.063 -13.992 1.00 0.00 H new ATOM 0 HD2 ARG A 14 8.634 -21.321 -13.463 1.00 0.00 H new ATOM 0 HD3 ARG A 14 8.290 -22.928 -12.855 1.00 0.00 H new ATOM 0 HE ARG A 14 7.835 -23.683 -15.104 1.00 0.00 H new ATOM 0 HH11 ARG A 14 7.918 -20.149 -14.898 1.00 0.00 H new ATOM 0 HH12 ARG A 14 7.892 -19.948 -16.653 1.00 0.00 H new ATOM 0 HH21 ARG A 14 7.811 -23.373 -17.318 1.00 0.00 H new ATOM 0 HH22 ARG A 14 7.832 -21.743 -17.998 1.00 0.00 H new ATOM 221 N GLY A 15 5.693 -20.907 -8.759 1.00 0.00 N ATOM 222 CA GLY A 15 5.842 -20.199 -7.456 1.00 0.00 C ATOM 223 C GLY A 15 5.788 -18.690 -7.703 1.00 0.00 C ATOM 224 O GLY A 15 6.342 -17.907 -6.954 1.00 0.00 O ATOM 0 H GLY A 15 4.733 -20.992 -9.094 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.048 -20.498 -6.772 1.00 0.00 H new ATOM 0 HA3 GLY A 15 6.787 -20.470 -6.985 1.00 0.00 H new ATOM 228 N ILE A 16 5.116 -18.281 -8.752 1.00 0.00 N ATOM 229 CA ILE A 16 5.006 -16.834 -9.065 1.00 0.00 C ATOM 230 C ILE A 16 3.663 -16.322 -8.525 1.00 0.00 C ATOM 231 O ILE A 16 2.629 -16.493 -9.144 1.00 0.00 O ATOM 232 CB ILE A 16 5.080 -16.749 -10.616 1.00 0.00 C ATOM 233 CG1 ILE A 16 6.540 -16.841 -11.122 1.00 0.00 C ATOM 234 CG2 ILE A 16 4.502 -15.409 -11.103 1.00 0.00 C ATOM 235 CD1 ILE A 16 7.309 -18.001 -10.475 1.00 0.00 C ATOM 0 H ILE A 16 4.637 -18.899 -9.407 1.00 0.00 H new ATOM 0 HA ILE A 16 5.789 -16.224 -8.613 1.00 0.00 H new ATOM 0 HB ILE A 16 4.504 -17.587 -11.008 1.00 0.00 H new ATOM 0 HG12 ILE A 16 6.540 -16.967 -12.205 1.00 0.00 H new ATOM 0 HG13 ILE A 16 7.055 -15.904 -10.911 1.00 0.00 H new ATOM 0 HG21 ILE A 16 4.560 -15.362 -12.190 1.00 0.00 H new ATOM 0 HG22 ILE A 16 3.461 -15.327 -10.791 1.00 0.00 H new ATOM 0 HG23 ILE A 16 5.076 -14.588 -10.673 1.00 0.00 H new ATOM 0 HD11 ILE A 16 8.328 -18.023 -10.862 1.00 0.00 H new ATOM 0 HD12 ILE A 16 7.335 -17.862 -9.394 1.00 0.00 H new ATOM 0 HD13 ILE A 16 6.811 -18.942 -10.708 1.00 0.00 H new ATOM 247 N ALA A 17 3.685 -15.689 -7.388 1.00 0.00 N ATOM 248 CA ALA A 17 2.425 -15.146 -6.802 1.00 0.00 C ATOM 249 C ALA A 17 2.400 -13.633 -6.978 1.00 0.00 C ATOM 250 O ALA A 17 3.328 -12.944 -6.596 1.00 0.00 O ATOM 251 CB ALA A 17 2.470 -15.507 -5.319 1.00 0.00 C ATOM 0 H ALA A 17 4.525 -15.522 -6.834 1.00 0.00 H new ATOM 0 HA ALA A 17 1.535 -15.553 -7.282 1.00 0.00 H new ATOM 0 HB1 ALA A 17 1.571 -15.136 -4.827 1.00 0.00 H new ATOM 0 HB2 ALA A 17 2.523 -16.590 -5.210 1.00 0.00 H new ATOM 0 HB3 ALA A 17 3.348 -15.053 -4.860 1.00 0.00 H new ATOM 257 N SER A 18 1.354 -13.111 -7.562 1.00 0.00 N ATOM 258 CA SER A 18 1.283 -11.639 -7.770 1.00 0.00 C ATOM 259 C SER A 18 -0.084 -11.091 -7.361 1.00 0.00 C ATOM 260 O SER A 18 -1.098 -11.754 -7.470 1.00 0.00 O ATOM 261 CB SER A 18 1.509 -11.446 -9.270 1.00 0.00 C ATOM 262 OG SER A 18 0.442 -12.053 -9.986 1.00 0.00 O ATOM 0 H SER A 18 0.550 -13.639 -7.902 1.00 0.00 H new ATOM 0 HA SER A 18 2.019 -11.108 -7.166 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.564 -10.384 -9.508 1.00 0.00 H new ATOM 0 HB3 SER A 18 2.460 -11.889 -9.566 1.00 0.00 H new ATOM 0 HG SER A 18 0.726 -12.232 -10.907 1.00 0.00 H new ATOM 268 N PHE A 19 -0.105 -9.869 -6.911 1.00 0.00 N ATOM 269 CA PHE A 19 -1.382 -9.216 -6.504 1.00 0.00 C ATOM 270 C PHE A 19 -1.223 -7.705 -6.623 1.00 0.00 C ATOM 271 O PHE A 19 -0.119 -7.205 -6.746 1.00 0.00 O ATOM 272 CB PHE A 19 -1.647 -9.650 -5.057 1.00 0.00 C ATOM 273 CG PHE A 19 -0.467 -9.321 -4.169 1.00 0.00 C ATOM 274 CD1 PHE A 19 0.639 -10.211 -4.115 1.00 0.00 C ATOM 275 CD2 PHE A 19 -0.468 -8.138 -3.380 1.00 0.00 C ATOM 276 CE1 PHE A 19 1.746 -9.919 -3.275 1.00 0.00 C ATOM 277 CE2 PHE A 19 0.640 -7.848 -2.535 1.00 0.00 C ATOM 278 CZ PHE A 19 1.747 -8.740 -2.484 1.00 0.00 C ATOM 0 H PHE A 19 0.724 -9.283 -6.806 1.00 0.00 H new ATOM 0 HA PHE A 19 -2.222 -9.504 -7.136 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.540 -9.151 -4.681 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.844 -10.722 -5.025 1.00 0.00 H new ATOM 0 HD1 PHE A 19 0.638 -11.110 -4.713 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.308 -7.461 -3.422 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.588 -10.594 -3.238 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.640 -6.951 -1.933 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.588 -8.520 -1.843 1.00 0.00 H new ATOM 288 N VAL A 20 -2.307 -6.976 -6.623 1.00 0.00 N ATOM 289 CA VAL A 20 -2.194 -5.496 -6.776 1.00 0.00 C ATOM 290 C VAL A 20 -2.774 -4.748 -5.572 1.00 0.00 C ATOM 291 O VAL A 20 -3.928 -4.900 -5.221 1.00 0.00 O ATOM 292 CB VAL A 20 -2.970 -5.168 -8.053 1.00 0.00 C ATOM 293 CG1 VAL A 20 -2.937 -3.659 -8.312 1.00 0.00 C ATOM 294 CG2 VAL A 20 -2.328 -5.892 -9.240 1.00 0.00 C ATOM 0 H VAL A 20 -3.256 -7.336 -6.525 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.152 -5.183 -6.835 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.004 -5.493 -7.934 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -3.492 -3.434 -9.223 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -3.392 -3.135 -7.471 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -1.904 -3.332 -8.426 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -2.880 -5.659 -10.150 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.294 -5.565 -9.349 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.352 -6.968 -9.066 1.00 0.00 H new ATOM 304 N CYS A 21 -1.970 -3.915 -4.966 1.00 0.00 N ATOM 305 CA CYS A 21 -2.437 -3.107 -3.805 1.00 0.00 C ATOM 306 C CYS A 21 -2.701 -1.678 -4.294 1.00 0.00 C ATOM 307 O CYS A 21 -1.790 -0.943 -4.618 1.00 0.00 O ATOM 308 CB CYS A 21 -1.271 -3.158 -2.820 1.00 0.00 C ATOM 309 SG CYS A 21 -1.704 -2.317 -1.279 1.00 0.00 S ATOM 0 H CYS A 21 -0.997 -3.759 -5.231 1.00 0.00 H new ATOM 0 HA CYS A 21 -3.356 -3.469 -3.344 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -1.008 -4.195 -2.613 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -0.393 -2.688 -3.263 1.00 0.00 H new ATOM 314 N GLU A 22 -3.943 -1.295 -4.387 1.00 0.00 N ATOM 315 CA GLU A 22 -4.269 0.068 -4.901 1.00 0.00 C ATOM 316 C GLU A 22 -4.264 1.124 -3.794 1.00 0.00 C ATOM 317 O GLU A 22 -4.707 0.895 -2.685 1.00 0.00 O ATOM 318 CB GLU A 22 -5.652 -0.094 -5.531 1.00 0.00 C ATOM 319 CG GLU A 22 -6.147 1.243 -6.091 1.00 0.00 C ATOM 320 CD GLU A 22 -7.486 1.037 -6.805 1.00 0.00 C ATOM 321 OE1 GLU A 22 -7.681 -0.030 -7.364 1.00 0.00 O ATOM 322 OE2 GLU A 22 -8.293 1.951 -6.780 1.00 0.00 O ATOM 0 H GLU A 22 -4.748 -1.866 -4.130 1.00 0.00 H new ATOM 0 HA GLU A 22 -3.526 0.426 -5.614 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.610 -0.836 -6.329 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.356 -0.466 -4.786 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -6.261 1.967 -5.284 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -5.413 1.652 -6.785 1.00 0.00 H new ATOM 329 N TYR A 23 -3.770 2.292 -4.119 1.00 0.00 N ATOM 330 CA TYR A 23 -3.722 3.404 -3.147 1.00 0.00 C ATOM 331 C TYR A 23 -4.385 4.627 -3.799 1.00 0.00 C ATOM 332 O TYR A 23 -4.755 4.587 -4.958 1.00 0.00 O ATOM 333 CB TYR A 23 -2.220 3.632 -2.865 1.00 0.00 C ATOM 334 CG TYR A 23 -1.520 4.217 -4.074 1.00 0.00 C ATOM 335 CD1 TYR A 23 -1.482 5.626 -4.250 1.00 0.00 C ATOM 336 CD2 TYR A 23 -0.907 3.365 -5.030 1.00 0.00 C ATOM 337 CE1 TYR A 23 -0.830 6.184 -5.380 1.00 0.00 C ATOM 338 CE2 TYR A 23 -0.254 3.922 -6.162 1.00 0.00 C ATOM 339 CZ TYR A 23 -0.215 5.333 -6.337 1.00 0.00 C ATOM 340 OH TYR A 23 0.418 5.874 -7.437 1.00 0.00 O ATOM 0 H TYR A 23 -3.392 2.517 -5.039 1.00 0.00 H new ATOM 0 HA TYR A 23 -4.249 3.206 -2.214 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -2.105 4.303 -2.014 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -1.751 2.687 -2.591 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -1.950 6.273 -3.523 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -0.937 2.294 -4.897 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -0.801 7.255 -5.513 1.00 0.00 H new ATOM 0 HE2 TYR A 23 0.213 3.274 -6.889 1.00 0.00 H new ATOM 0 HH TYR A 23 0.786 5.153 -7.990 1.00 0.00 H new ATOM 350 N ALA A 24 -4.545 5.695 -3.074 1.00 0.00 N ATOM 351 CA ALA A 24 -5.196 6.908 -3.666 1.00 0.00 C ATOM 352 C ALA A 24 -4.572 8.199 -3.127 1.00 0.00 C ATOM 353 O ALA A 24 -4.411 8.373 -1.934 1.00 0.00 O ATOM 354 CB ALA A 24 -6.662 6.810 -3.241 1.00 0.00 C ATOM 0 H ALA A 24 -4.257 5.787 -2.100 1.00 0.00 H new ATOM 0 HA ALA A 24 -5.073 6.940 -4.749 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -7.213 7.664 -3.635 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -7.093 5.888 -3.632 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -6.726 6.807 -2.153 1.00 0.00 H new ATOM 360 N SER A 25 -4.241 9.113 -4.007 1.00 0.00 N ATOM 361 CA SER A 25 -3.649 10.412 -3.566 1.00 0.00 C ATOM 362 C SER A 25 -3.702 11.443 -4.704 1.00 0.00 C ATOM 363 O SER A 25 -3.703 11.080 -5.864 1.00 0.00 O ATOM 364 CB SER A 25 -2.205 10.102 -3.188 1.00 0.00 C ATOM 365 OG SER A 25 -1.452 11.308 -3.163 1.00 0.00 O ATOM 0 H SER A 25 -4.357 9.013 -5.016 1.00 0.00 H new ATOM 0 HA SER A 25 -4.199 10.840 -2.727 1.00 0.00 H new ATOM 0 HB2 SER A 25 -2.169 9.618 -2.212 1.00 0.00 H new ATOM 0 HB3 SER A 25 -1.772 9.405 -3.905 1.00 0.00 H new ATOM 0 HG SER A 25 -0.524 11.109 -2.919 1.00 0.00 H new ATOM 371 N PRO A 26 -3.744 12.705 -4.335 1.00 0.00 N ATOM 372 CA PRO A 26 -3.798 13.790 -5.348 1.00 0.00 C ATOM 373 C PRO A 26 -2.443 13.951 -6.047 1.00 0.00 C ATOM 374 O PRO A 26 -1.402 13.710 -5.465 1.00 0.00 O ATOM 375 CB PRO A 26 -4.129 15.033 -4.526 1.00 0.00 C ATOM 376 CG PRO A 26 -3.644 14.728 -3.145 1.00 0.00 C ATOM 377 CD PRO A 26 -3.744 13.237 -2.961 1.00 0.00 C ATOM 0 HA PRO A 26 -4.524 13.595 -6.137 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -3.635 15.916 -4.931 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -5.200 15.236 -4.532 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -2.615 15.064 -3.015 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -4.246 15.249 -2.401 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -2.905 12.849 -2.383 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -4.653 12.961 -2.427 1.00 0.00 H new ATOM 385 N GLY A 27 -2.453 14.373 -7.286 1.00 0.00 N ATOM 386 CA GLY A 27 -1.173 14.573 -8.031 1.00 0.00 C ATOM 387 C GLY A 27 -0.434 13.241 -8.178 1.00 0.00 C ATOM 388 O GLY A 27 -0.899 12.209 -7.733 1.00 0.00 O ATOM 0 H GLY A 27 -3.297 14.589 -7.816 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -1.378 14.994 -9.015 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -0.544 15.290 -7.503 1.00 0.00 H new ATOM 392 N LYS A 28 0.718 13.265 -8.799 1.00 0.00 N ATOM 393 CA LYS A 28 1.507 12.010 -8.984 1.00 0.00 C ATOM 394 C LYS A 28 2.973 12.241 -8.600 1.00 0.00 C ATOM 395 O LYS A 28 3.489 13.337 -8.719 1.00 0.00 O ATOM 396 CB LYS A 28 1.394 11.684 -10.473 1.00 0.00 C ATOM 397 CG LYS A 28 -0.064 11.384 -10.826 1.00 0.00 C ATOM 398 CD LYS A 28 -0.183 11.140 -12.332 1.00 0.00 C ATOM 399 CE LYS A 28 -1.638 10.823 -12.687 1.00 0.00 C ATOM 400 NZ LYS A 28 -1.875 9.453 -12.151 1.00 0.00 N ATOM 0 H LYS A 28 1.148 14.104 -9.188 1.00 0.00 H new ATOM 0 HA LYS A 28 1.137 11.198 -8.358 1.00 0.00 H new ATOM 0 HB2 LYS A 28 1.757 12.523 -11.067 1.00 0.00 H new ATOM 0 HB3 LYS A 28 2.021 10.826 -10.716 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.410 10.509 -10.276 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.700 12.218 -10.530 1.00 0.00 H new ATOM 0 HD2 LYS A 28 0.152 12.020 -12.881 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.463 10.314 -12.629 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -2.320 11.546 -12.239 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -1.798 10.859 -13.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -2.505 8.933 -12.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -0.968 8.949 -12.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -2.317 9.519 -11.212 1.00 0.00 H new ATOM 414 N ALA A 29 3.644 11.213 -8.149 1.00 0.00 N ATOM 415 CA ALA A 29 5.080 11.354 -7.762 1.00 0.00 C ATOM 416 C ALA A 29 5.867 10.138 -8.256 1.00 0.00 C ATOM 417 O ALA A 29 5.312 9.069 -8.434 1.00 0.00 O ATOM 418 CB ALA A 29 5.077 11.407 -6.234 1.00 0.00 C ATOM 0 H ALA A 29 3.257 10.277 -8.031 1.00 0.00 H new ATOM 0 HA ALA A 29 5.545 12.240 -8.195 1.00 0.00 H new ATOM 0 HB1 ALA A 29 6.100 11.510 -5.872 1.00 0.00 H new ATOM 0 HB2 ALA A 29 4.486 12.260 -5.901 1.00 0.00 H new ATOM 0 HB3 ALA A 29 4.643 10.488 -5.839 1.00 0.00 H new ATOM 424 N THR A 30 7.150 10.287 -8.485 1.00 0.00 N ATOM 425 CA THR A 30 7.957 9.126 -8.974 1.00 0.00 C ATOM 426 C THR A 30 8.317 8.206 -7.828 1.00 0.00 C ATOM 427 O THR A 30 8.367 7.007 -7.973 1.00 0.00 O ATOM 428 CB THR A 30 9.271 9.700 -9.506 1.00 0.00 C ATOM 429 OG1 THR A 30 10.000 10.276 -8.433 1.00 0.00 O ATOM 430 CG2 THR A 30 9.025 10.765 -10.551 1.00 0.00 C ATOM 0 H THR A 30 7.669 11.155 -8.356 1.00 0.00 H new ATOM 0 HA THR A 30 7.390 8.573 -9.723 1.00 0.00 H new ATOM 0 HB THR A 30 9.834 8.886 -9.963 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.844 10.643 -8.771 1.00 0.00 H new ATOM 0 HG21 THR A 30 9.979 11.152 -10.908 1.00 0.00 H new ATOM 0 HG22 THR A 30 8.473 10.334 -11.386 1.00 0.00 H new ATOM 0 HG23 THR A 30 8.445 11.577 -10.113 1.00 0.00 H new ATOM 438 N GLU A 31 8.630 8.777 -6.708 1.00 0.00 N ATOM 439 CA GLU A 31 9.084 7.955 -5.559 1.00 0.00 C ATOM 440 C GLU A 31 7.920 7.299 -4.814 1.00 0.00 C ATOM 441 O GLU A 31 7.563 7.709 -3.722 1.00 0.00 O ATOM 442 CB GLU A 31 9.797 8.950 -4.637 1.00 0.00 C ATOM 443 CG GLU A 31 10.983 9.603 -5.367 1.00 0.00 C ATOM 444 CD GLU A 31 12.252 8.750 -5.199 1.00 0.00 C ATOM 445 OE1 GLU A 31 12.210 7.780 -4.458 1.00 0.00 O ATOM 446 OE2 GLU A 31 13.250 9.089 -5.814 1.00 0.00 O ATOM 0 H GLU A 31 8.592 9.782 -6.536 1.00 0.00 H new ATOM 0 HA GLU A 31 9.721 7.135 -5.892 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.096 9.718 -4.309 1.00 0.00 H new ATOM 0 HB3 GLU A 31 10.150 8.438 -3.742 1.00 0.00 H new ATOM 0 HG2 GLU A 31 10.750 9.714 -6.426 1.00 0.00 H new ATOM 0 HG3 GLU A 31 11.155 10.604 -4.971 1.00 0.00 H new ATOM 453 N VAL A 32 7.361 6.249 -5.362 1.00 0.00 N ATOM 454 CA VAL A 32 6.269 5.540 -4.637 1.00 0.00 C ATOM 455 C VAL A 32 6.916 4.398 -3.859 1.00 0.00 C ATOM 456 O VAL A 32 6.954 3.267 -4.307 1.00 0.00 O ATOM 457 CB VAL A 32 5.315 5.012 -5.710 1.00 0.00 C ATOM 458 CG1 VAL A 32 4.181 4.220 -5.044 1.00 0.00 C ATOM 459 CG2 VAL A 32 4.727 6.192 -6.486 1.00 0.00 C ATOM 0 H VAL A 32 7.612 5.857 -6.270 1.00 0.00 H new ATOM 0 HA VAL A 32 5.721 6.175 -3.940 1.00 0.00 H new ATOM 0 HB VAL A 32 5.858 4.359 -6.393 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.502 3.844 -5.809 1.00 0.00 H new ATOM 0 HG12 VAL A 32 4.601 3.382 -4.488 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.634 4.871 -4.362 1.00 0.00 H new ATOM 0 HG21 VAL A 32 4.046 5.821 -7.252 1.00 0.00 H new ATOM 0 HG22 VAL A 32 4.183 6.843 -5.801 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.532 6.755 -6.958 1.00 0.00 H new ATOM 469 N ARG A 33 7.457 4.702 -2.710 1.00 0.00 N ATOM 470 CA ARG A 33 8.150 3.656 -1.901 1.00 0.00 C ATOM 471 C ARG A 33 7.198 2.522 -1.547 1.00 0.00 C ATOM 472 O ARG A 33 6.184 2.729 -0.905 1.00 0.00 O ATOM 473 CB ARG A 33 8.620 4.368 -0.630 1.00 0.00 C ATOM 474 CG ARG A 33 9.557 3.446 0.154 1.00 0.00 C ATOM 475 CD ARG A 33 10.098 4.183 1.382 1.00 0.00 C ATOM 476 NE ARG A 33 9.255 3.703 2.520 1.00 0.00 N ATOM 477 CZ ARG A 33 9.478 2.538 3.099 1.00 0.00 C ATOM 478 NH1 ARG A 33 10.432 1.734 2.687 1.00 0.00 N ATOM 479 NH2 ARG A 33 8.727 2.172 4.102 1.00 0.00 N ATOM 0 H ARG A 33 7.449 5.634 -2.295 1.00 0.00 H new ATOM 0 HA ARG A 33 8.978 3.211 -2.452 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.135 5.293 -0.888 1.00 0.00 H new ATOM 0 HB3 ARG A 33 7.763 4.641 -0.015 1.00 0.00 H new ATOM 0 HG2 ARG A 33 9.024 2.547 0.463 1.00 0.00 H new ATOM 0 HG3 ARG A 33 10.382 3.124 -0.482 1.00 0.00 H new ATOM 0 HD2 ARG A 33 11.151 3.956 1.547 1.00 0.00 H new ATOM 0 HD3 ARG A 33 10.020 5.263 1.261 1.00 0.00 H new ATOM 0 HE ARG A 33 8.491 4.289 2.856 1.00 0.00 H new ATOM 0 HH11 ARG A 33 11.023 2.005 1.901 1.00 0.00 H new ATOM 0 HH12 ARG A 33 10.582 0.839 3.153 1.00 0.00 H new ATOM 0 HH21 ARG A 33 7.979 2.784 4.429 1.00 0.00 H new ATOM 0 HH22 ARG A 33 8.888 1.274 4.559 1.00 0.00 H new ATOM 493 N VAL A 34 7.531 1.321 -1.943 1.00 0.00 N ATOM 494 CA VAL A 34 6.665 0.167 -1.613 1.00 0.00 C ATOM 495 C VAL A 34 7.483 -0.906 -0.900 1.00 0.00 C ATOM 496 O VAL A 34 8.617 -1.177 -1.246 1.00 0.00 O ATOM 497 CB VAL A 34 6.122 -0.362 -2.940 1.00 0.00 C ATOM 498 CG1 VAL A 34 5.239 0.705 -3.596 1.00 0.00 C ATOM 499 CG2 VAL A 34 7.282 -0.731 -3.883 1.00 0.00 C ATOM 0 H VAL A 34 8.368 1.096 -2.481 1.00 0.00 H new ATOM 0 HA VAL A 34 5.850 0.454 -0.949 1.00 0.00 H new ATOM 0 HB VAL A 34 5.529 -1.256 -2.748 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.853 0.326 -4.542 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.407 0.946 -2.934 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.829 1.603 -3.779 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.880 -1.106 -4.824 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.890 0.153 -4.075 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.898 -1.501 -3.418 1.00 0.00 H new ATOM 509 N THR A 35 6.903 -1.510 0.091 1.00 0.00 N ATOM 510 CA THR A 35 7.615 -2.577 0.857 1.00 0.00 C ATOM 511 C THR A 35 6.684 -3.767 1.083 1.00 0.00 C ATOM 512 O THR A 35 5.549 -3.605 1.491 1.00 0.00 O ATOM 513 CB THR A 35 7.987 -1.935 2.200 1.00 0.00 C ATOM 514 OG1 THR A 35 8.764 -0.769 1.966 1.00 0.00 O ATOM 515 CG2 THR A 35 8.795 -2.932 3.041 1.00 0.00 C ATOM 0 H THR A 35 5.955 -1.312 0.412 1.00 0.00 H new ATOM 0 HA THR A 35 8.493 -2.945 0.326 1.00 0.00 H new ATOM 0 HB THR A 35 7.078 -1.664 2.738 1.00 0.00 H new ATOM 0 HG1 THR A 35 8.866 -0.271 2.804 1.00 0.00 H new ATOM 0 HG21 THR A 35 9.058 -2.474 3.995 1.00 0.00 H new ATOM 0 HG22 THR A 35 8.197 -3.825 3.220 1.00 0.00 H new ATOM 0 HG23 THR A 35 9.705 -3.206 2.506 1.00 0.00 H new ATOM 523 N VAL A 36 7.157 -4.958 0.835 1.00 0.00 N ATOM 524 CA VAL A 36 6.302 -6.158 1.051 1.00 0.00 C ATOM 525 C VAL A 36 6.758 -6.877 2.328 1.00 0.00 C ATOM 526 O VAL A 36 7.940 -7.089 2.530 1.00 0.00 O ATOM 527 CB VAL A 36 6.513 -7.028 -0.198 1.00 0.00 C ATOM 528 CG1 VAL A 36 5.754 -8.352 -0.045 1.00 0.00 C ATOM 529 CG2 VAL A 36 5.998 -6.283 -1.443 1.00 0.00 C ATOM 0 H VAL A 36 8.098 -5.151 0.492 1.00 0.00 H new ATOM 0 HA VAL A 36 5.247 -5.919 1.183 1.00 0.00 H new ATOM 0 HB VAL A 36 7.577 -7.234 -0.312 1.00 0.00 H new ATOM 0 HG11 VAL A 36 5.908 -8.964 -0.934 1.00 0.00 H new ATOM 0 HG12 VAL A 36 6.124 -8.885 0.831 1.00 0.00 H new ATOM 0 HG13 VAL A 36 4.690 -8.149 0.077 1.00 0.00 H new ATOM 0 HG21 VAL A 36 6.149 -6.903 -2.327 1.00 0.00 H new ATOM 0 HG22 VAL A 36 4.935 -6.071 -1.326 1.00 0.00 H new ATOM 0 HG23 VAL A 36 6.544 -5.347 -1.559 1.00 0.00 H new ATOM 539 N LEU A 37 5.842 -7.237 3.204 1.00 0.00 N ATOM 540 CA LEU A 37 6.264 -7.927 4.461 1.00 0.00 C ATOM 541 C LEU A 37 5.514 -9.237 4.647 1.00 0.00 C ATOM 542 O LEU A 37 4.528 -9.505 3.991 1.00 0.00 O ATOM 543 CB LEU A 37 5.888 -6.986 5.607 1.00 0.00 C ATOM 544 CG LEU A 37 6.607 -5.653 5.464 1.00 0.00 C ATOM 545 CD1 LEU A 37 6.071 -4.688 6.519 1.00 0.00 C ATOM 546 CD2 LEU A 37 8.098 -5.867 5.684 1.00 0.00 C ATOM 0 H LEU A 37 4.839 -7.084 3.102 1.00 0.00 H new ATOM 0 HA LEU A 37 7.330 -8.152 4.429 1.00 0.00 H new ATOM 0 HB2 LEU A 37 4.810 -6.825 5.613 1.00 0.00 H new ATOM 0 HB3 LEU A 37 6.147 -7.445 6.561 1.00 0.00 H new ATOM 0 HG LEU A 37 6.440 -5.241 4.469 1.00 0.00 H new ATOM 0 HD11 LEU A 37 6.579 -3.728 6.426 1.00 0.00 H new ATOM 0 HD12 LEU A 37 5.000 -4.547 6.373 1.00 0.00 H new ATOM 0 HD13 LEU A 37 6.250 -5.099 7.513 1.00 0.00 H new ATOM 0 HD21 LEU A 37 8.621 -4.916 5.583 1.00 0.00 H new ATOM 0 HD22 LEU A 37 8.264 -6.268 6.684 1.00 0.00 H new ATOM 0 HD23 LEU A 37 8.478 -6.570 4.943 1.00 0.00 H new ATOM 558 N ARG A 38 5.969 -10.034 5.572 1.00 0.00 N ATOM 559 CA ARG A 38 5.285 -11.326 5.865 1.00 0.00 C ATOM 560 C ARG A 38 5.042 -11.426 7.372 1.00 0.00 C ATOM 561 O ARG A 38 5.949 -11.241 8.162 1.00 0.00 O ATOM 562 CB ARG A 38 6.254 -12.413 5.400 1.00 0.00 C ATOM 563 CG ARG A 38 5.587 -13.783 5.542 1.00 0.00 C ATOM 564 CD ARG A 38 6.587 -14.883 5.172 1.00 0.00 C ATOM 565 NE ARG A 38 7.676 -14.791 6.198 1.00 0.00 N ATOM 566 CZ ARG A 38 8.710 -15.610 6.176 1.00 0.00 C ATOM 567 NH1 ARG A 38 8.832 -16.539 5.256 1.00 0.00 N ATOM 568 NH2 ARG A 38 9.633 -15.494 7.091 1.00 0.00 N ATOM 0 H ARG A 38 6.793 -9.845 6.143 1.00 0.00 H new ATOM 0 HA ARG A 38 4.321 -11.419 5.365 1.00 0.00 H new ATOM 0 HB2 ARG A 38 6.540 -12.241 4.362 1.00 0.00 H new ATOM 0 HB3 ARG A 38 7.168 -12.378 5.992 1.00 0.00 H new ATOM 0 HG2 ARG A 38 5.238 -13.924 6.565 1.00 0.00 H new ATOM 0 HG3 ARG A 38 4.711 -13.841 4.895 1.00 0.00 H new ATOM 0 HD2 ARG A 38 6.114 -15.865 5.187 1.00 0.00 H new ATOM 0 HD3 ARG A 38 6.981 -14.734 4.167 1.00 0.00 H new ATOM 0 HE ARG A 38 7.616 -14.081 6.928 1.00 0.00 H new ATOM 0 HH11 ARG A 38 8.117 -16.640 4.536 1.00 0.00 H new ATOM 0 HH12 ARG A 38 9.642 -17.159 5.262 1.00 0.00 H new ATOM 0 HH21 ARG A 38 9.550 -14.777 7.811 1.00 0.00 H new ATOM 0 HH22 ARG A 38 10.438 -16.121 7.086 1.00 0.00 H new ATOM 582 N GLN A 39 3.829 -11.708 7.781 1.00 0.00 N ATOM 583 CA GLN A 39 3.543 -11.807 9.247 1.00 0.00 C ATOM 584 C GLN A 39 3.267 -13.251 9.665 1.00 0.00 C ATOM 585 O GLN A 39 2.491 -13.956 9.049 1.00 0.00 O ATOM 586 CB GLN A 39 2.317 -10.924 9.483 1.00 0.00 C ATOM 587 CG GLN A 39 2.727 -9.454 9.393 1.00 0.00 C ATOM 588 CD GLN A 39 1.480 -8.569 9.430 1.00 0.00 C ATOM 589 OE1 GLN A 39 0.580 -8.689 8.493 1.00 0.00 O flip ATOM 590 NE2 GLN A 39 1.320 -7.762 10.324 1.00 0.00 N flip ATOM 0 H GLN A 39 3.030 -11.873 7.169 1.00 0.00 H new ATOM 0 HA GLN A 39 4.397 -11.482 9.842 1.00 0.00 H new ATOM 0 HB2 GLN A 39 1.548 -11.145 8.743 1.00 0.00 H new ATOM 0 HB3 GLN A 39 1.887 -11.134 10.462 1.00 0.00 H new ATOM 0 HG2 GLN A 39 3.390 -9.200 10.220 1.00 0.00 H new ATOM 0 HG3 GLN A 39 3.283 -9.277 8.473 1.00 0.00 H new ATOM 0 HE21 GLN A 39 2.023 -7.667 11.057 1.00 0.00 H new ATOM 0 HE22 GLN A 39 0.483 -7.179 10.341 1.00 0.00 H new ATOM 599 N ALA A 40 3.904 -13.683 10.723 1.00 0.00 N ATOM 600 CA ALA A 40 3.702 -15.072 11.221 1.00 0.00 C ATOM 601 C ALA A 40 2.681 -15.073 12.361 1.00 0.00 C ATOM 602 O ALA A 40 2.169 -14.038 12.746 1.00 0.00 O ATOM 603 CB ALA A 40 5.075 -15.513 11.729 1.00 0.00 C ATOM 0 H ALA A 40 4.562 -13.125 11.267 1.00 0.00 H new ATOM 0 HA ALA A 40 3.321 -15.741 10.449 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.011 -16.531 12.114 1.00 0.00 H new ATOM 0 HB2 ALA A 40 5.794 -15.480 10.910 1.00 0.00 H new ATOM 0 HB3 ALA A 40 5.401 -14.844 12.525 1.00 0.00 H new ATOM 609 N ASP A 41 2.375 -16.227 12.891 1.00 0.00 N ATOM 610 CA ASP A 41 1.374 -16.307 13.999 1.00 0.00 C ATOM 611 C ASP A 41 1.822 -15.495 15.222 1.00 0.00 C ATOM 612 O ASP A 41 1.015 -14.853 15.869 1.00 0.00 O ATOM 613 CB ASP A 41 1.286 -17.788 14.352 1.00 0.00 C ATOM 614 CG ASP A 41 0.553 -18.547 13.241 1.00 0.00 C ATOM 615 OD1 ASP A 41 -0.269 -17.940 12.571 1.00 0.00 O ATOM 616 OD2 ASP A 41 0.827 -19.724 13.078 1.00 0.00 O ATOM 0 H ASP A 41 2.775 -17.121 12.605 1.00 0.00 H new ATOM 0 HA ASP A 41 0.413 -15.894 13.693 1.00 0.00 H new ATOM 0 HB2 ASP A 41 2.287 -18.199 14.486 1.00 0.00 H new ATOM 0 HB3 ASP A 41 0.760 -17.914 15.298 1.00 0.00 H new ATOM 621 N SER A 42 3.090 -15.533 15.560 1.00 0.00 N ATOM 622 CA SER A 42 3.564 -14.775 16.762 1.00 0.00 C ATOM 623 C SER A 42 4.598 -13.701 16.397 1.00 0.00 C ATOM 624 O SER A 42 4.823 -12.778 17.159 1.00 0.00 O ATOM 625 CB SER A 42 4.198 -15.833 17.664 1.00 0.00 C ATOM 626 OG SER A 42 3.221 -16.808 18.004 1.00 0.00 O ATOM 0 H SER A 42 3.812 -16.052 15.060 1.00 0.00 H new ATOM 0 HA SER A 42 2.742 -14.244 17.241 1.00 0.00 H new ATOM 0 HB2 SER A 42 5.038 -16.306 17.155 1.00 0.00 H new ATOM 0 HB3 SER A 42 4.594 -15.368 18.567 1.00 0.00 H new ATOM 0 HG SER A 42 3.625 -17.489 18.581 1.00 0.00 H new ATOM 632 N GLN A 43 5.235 -13.809 15.256 1.00 0.00 N ATOM 633 CA GLN A 43 6.260 -12.785 14.877 1.00 0.00 C ATOM 634 C GLN A 43 6.065 -12.277 13.456 1.00 0.00 C ATOM 635 O GLN A 43 5.175 -12.692 12.742 1.00 0.00 O ATOM 636 CB GLN A 43 7.612 -13.481 14.995 1.00 0.00 C ATOM 637 CG GLN A 43 7.946 -13.695 16.466 1.00 0.00 C ATOM 638 CD GLN A 43 8.147 -12.340 17.151 1.00 0.00 C ATOM 639 OE1 GLN A 43 9.057 -11.607 16.819 1.00 0.00 O ATOM 640 NE2 GLN A 43 7.329 -11.976 18.100 1.00 0.00 N ATOM 0 H GLN A 43 5.092 -14.555 14.576 1.00 0.00 H new ATOM 0 HA GLN A 43 6.180 -11.915 15.528 1.00 0.00 H new ATOM 0 HB2 GLN A 43 7.587 -14.438 14.474 1.00 0.00 H new ATOM 0 HB3 GLN A 43 8.386 -12.879 14.519 1.00 0.00 H new ATOM 0 HG2 GLN A 43 7.142 -14.245 16.955 1.00 0.00 H new ATOM 0 HG3 GLN A 43 8.849 -14.299 16.560 1.00 0.00 H new ATOM 0 HE21 GLN A 43 6.565 -12.592 18.379 1.00 0.00 H new ATOM 0 HE22 GLN A 43 7.454 -11.076 18.563 1.00 0.00 H new ATOM 649 N VAL A 44 6.912 -11.370 13.056 1.00 0.00 N ATOM 650 CA VAL A 44 6.825 -10.793 11.680 1.00 0.00 C ATOM 651 C VAL A 44 8.225 -10.388 11.196 1.00 0.00 C ATOM 652 O VAL A 44 9.040 -9.914 11.965 1.00 0.00 O ATOM 653 CB VAL A 44 5.927 -9.558 11.827 1.00 0.00 C ATOM 654 CG1 VAL A 44 5.808 -8.832 10.482 1.00 0.00 C ATOM 655 CG2 VAL A 44 4.534 -9.990 12.293 1.00 0.00 C ATOM 0 H VAL A 44 7.670 -10.998 13.628 1.00 0.00 H new ATOM 0 HA VAL A 44 6.426 -11.501 10.953 1.00 0.00 H new ATOM 0 HB VAL A 44 6.368 -8.884 12.561 1.00 0.00 H new ATOM 0 HG11 VAL A 44 5.169 -7.957 10.596 1.00 0.00 H new ATOM 0 HG12 VAL A 44 6.797 -8.518 10.149 1.00 0.00 H new ATOM 0 HG13 VAL A 44 5.373 -9.505 9.743 1.00 0.00 H new ATOM 0 HG21 VAL A 44 3.897 -9.112 12.397 1.00 0.00 H new ATOM 0 HG22 VAL A 44 4.099 -10.669 11.559 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.613 -10.497 13.255 1.00 0.00 H new ATOM 665 N THR A 45 8.503 -10.563 9.927 1.00 0.00 N ATOM 666 CA THR A 45 9.847 -10.180 9.390 1.00 0.00 C ATOM 667 C THR A 45 9.704 -9.501 8.023 1.00 0.00 C ATOM 668 O THR A 45 8.730 -9.700 7.321 1.00 0.00 O ATOM 669 CB THR A 45 10.620 -11.495 9.256 1.00 0.00 C ATOM 670 OG1 THR A 45 9.955 -12.342 8.329 1.00 0.00 O ATOM 671 CG2 THR A 45 10.709 -12.188 10.618 1.00 0.00 C ATOM 0 H THR A 45 7.858 -10.954 9.240 1.00 0.00 H new ATOM 0 HA THR A 45 10.359 -9.473 10.043 1.00 0.00 H new ATOM 0 HB THR A 45 11.628 -11.286 8.898 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.581 -13.020 7.998 1.00 0.00 H new ATOM 0 HG21 THR A 45 11.260 -13.123 10.515 1.00 0.00 H new ATOM 0 HG22 THR A 45 11.226 -11.538 11.324 1.00 0.00 H new ATOM 0 HG23 THR A 45 9.705 -12.398 10.986 1.00 0.00 H new ATOM 679 N GLU A 46 10.670 -8.700 7.644 1.00 0.00 N ATOM 680 CA GLU A 46 10.602 -8.003 6.326 1.00 0.00 C ATOM 681 C GLU A 46 11.019 -8.924 5.183 1.00 0.00 C ATOM 682 O GLU A 46 11.863 -9.786 5.336 1.00 0.00 O ATOM 683 CB GLU A 46 11.564 -6.816 6.434 1.00 0.00 C ATOM 684 CG GLU A 46 10.971 -5.746 7.354 1.00 0.00 C ATOM 685 CD GLU A 46 12.070 -4.770 7.784 1.00 0.00 C ATOM 686 OE1 GLU A 46 13.204 -5.203 7.915 1.00 0.00 O ATOM 687 OE2 GLU A 46 11.759 -3.607 7.977 1.00 0.00 O ATOM 0 H GLU A 46 11.505 -8.500 8.195 1.00 0.00 H new ATOM 0 HA GLU A 46 9.583 -7.685 6.106 1.00 0.00 H new ATOM 0 HB2 GLU A 46 12.526 -7.150 6.823 1.00 0.00 H new ATOM 0 HB3 GLU A 46 11.749 -6.396 5.445 1.00 0.00 H new ATOM 0 HG2 GLU A 46 10.175 -5.209 6.838 1.00 0.00 H new ATOM 0 HG3 GLU A 46 10.523 -6.214 8.231 1.00 0.00 H new ATOM 694 N VAL A 47 10.428 -8.731 4.032 1.00 0.00 N ATOM 695 CA VAL A 47 10.772 -9.571 2.852 1.00 0.00 C ATOM 696 C VAL A 47 11.684 -8.770 1.907 1.00 0.00 C ATOM 697 O VAL A 47 12.875 -9.009 1.839 1.00 0.00 O ATOM 698 CB VAL A 47 9.415 -9.885 2.213 1.00 0.00 C ATOM 699 CG1 VAL A 47 9.605 -10.668 0.920 1.00 0.00 C ATOM 700 CG2 VAL A 47 8.575 -10.718 3.186 1.00 0.00 C ATOM 0 H VAL A 47 9.716 -8.021 3.860 1.00 0.00 H new ATOM 0 HA VAL A 47 11.315 -10.483 3.099 1.00 0.00 H new ATOM 0 HB VAL A 47 8.907 -8.947 1.989 1.00 0.00 H new ATOM 0 HG11 VAL A 47 8.632 -10.883 0.479 1.00 0.00 H new ATOM 0 HG12 VAL A 47 10.198 -10.078 0.221 1.00 0.00 H new ATOM 0 HG13 VAL A 47 10.121 -11.604 1.134 1.00 0.00 H new ATOM 0 HG21 VAL A 47 7.609 -10.942 2.733 1.00 0.00 H new ATOM 0 HG22 VAL A 47 9.095 -11.649 3.411 1.00 0.00 H new ATOM 0 HG23 VAL A 47 8.422 -10.156 4.107 1.00 0.00 H new ATOM 710 N CYS A 48 11.139 -7.814 1.195 1.00 0.00 N ATOM 711 CA CYS A 48 11.978 -6.984 0.272 1.00 0.00 C ATOM 712 C CYS A 48 11.263 -5.667 -0.050 1.00 0.00 C ATOM 713 O CYS A 48 10.083 -5.523 0.212 1.00 0.00 O ATOM 714 CB CYS A 48 12.192 -7.837 -0.977 1.00 0.00 C ATOM 715 SG CYS A 48 10.610 -8.414 -1.640 1.00 0.00 S ATOM 0 H CYS A 48 10.148 -7.572 1.213 1.00 0.00 H new ATOM 0 HA CYS A 48 12.935 -6.711 0.716 1.00 0.00 H new ATOM 0 HB2 CYS A 48 12.718 -7.256 -1.734 1.00 0.00 H new ATOM 0 HB3 CYS A 48 12.824 -8.692 -0.735 1.00 0.00 H new ATOM 720 N ALA A 49 11.968 -4.690 -0.588 1.00 0.00 N ATOM 721 CA ALA A 49 11.310 -3.376 -0.885 1.00 0.00 C ATOM 722 C ALA A 49 12.213 -2.471 -1.738 1.00 0.00 C ATOM 723 O ALA A 49 13.413 -2.650 -1.802 1.00 0.00 O ATOM 724 CB ALA A 49 11.089 -2.743 0.489 1.00 0.00 C ATOM 0 H ALA A 49 12.957 -4.748 -0.830 1.00 0.00 H new ATOM 0 HA ALA A 49 10.388 -3.508 -1.451 1.00 0.00 H new ATOM 0 HB1 ALA A 49 10.609 -1.772 0.369 1.00 0.00 H new ATOM 0 HB2 ALA A 49 10.451 -3.391 1.090 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.049 -2.614 0.989 1.00 0.00 H new ATOM 730 N ALA A 50 11.629 -1.487 -2.374 1.00 0.00 N ATOM 731 CA ALA A 50 12.414 -0.528 -3.215 1.00 0.00 C ATOM 732 C ALA A 50 11.490 0.611 -3.657 1.00 0.00 C ATOM 733 O ALA A 50 10.283 0.452 -3.676 1.00 0.00 O ATOM 734 CB ALA A 50 12.899 -1.335 -4.423 1.00 0.00 C ATOM 0 H ALA A 50 10.626 -1.304 -2.346 1.00 0.00 H new ATOM 0 HA ALA A 50 13.255 -0.088 -2.680 1.00 0.00 H new ATOM 0 HB1 ALA A 50 13.482 -0.690 -5.081 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.521 -2.163 -4.082 1.00 0.00 H new ATOM 0 HB3 ALA A 50 12.040 -1.727 -4.967 1.00 0.00 H new ATOM 740 N THR A 51 12.030 1.756 -4.007 1.00 0.00 N ATOM 741 CA THR A 51 11.146 2.884 -4.439 1.00 0.00 C ATOM 742 C THR A 51 10.817 2.740 -5.920 1.00 0.00 C ATOM 743 O THR A 51 11.697 2.744 -6.758 1.00 0.00 O ATOM 744 CB THR A 51 11.947 4.169 -4.198 1.00 0.00 C ATOM 745 OG1 THR A 51 12.660 4.061 -2.974 1.00 0.00 O ATOM 746 CG2 THR A 51 10.986 5.357 -4.114 1.00 0.00 C ATOM 0 H THR A 51 13.030 1.956 -4.012 1.00 0.00 H new ATOM 0 HA THR A 51 10.206 2.894 -3.888 1.00 0.00 H new ATOM 0 HB THR A 51 12.648 4.318 -5.019 1.00 0.00 H new ATOM 0 HG1 THR A 51 12.710 4.941 -2.546 1.00 0.00 H new ATOM 0 HG21 THR A 51 11.553 6.272 -3.943 1.00 0.00 H new ATOM 0 HG22 THR A 51 10.432 5.443 -5.048 1.00 0.00 H new ATOM 0 HG23 THR A 51 10.288 5.203 -3.291 1.00 0.00 H new ATOM 754 N TYR A 52 9.560 2.617 -6.254 1.00 0.00 N ATOM 755 CA TYR A 52 9.195 2.474 -7.684 1.00 0.00 C ATOM 756 C TYR A 52 9.203 3.838 -8.353 1.00 0.00 C ATOM 757 O TYR A 52 8.244 4.583 -8.249 1.00 0.00 O ATOM 758 CB TYR A 52 7.779 1.909 -7.697 1.00 0.00 C ATOM 759 CG TYR A 52 7.445 1.489 -9.102 1.00 0.00 C ATOM 760 CD1 TYR A 52 6.851 2.415 -10.000 1.00 0.00 C ATOM 761 CD2 TYR A 52 7.738 0.170 -9.527 1.00 0.00 C ATOM 762 CE1 TYR A 52 6.546 2.016 -11.330 1.00 0.00 C ATOM 763 CE2 TYR A 52 7.436 -0.231 -10.856 1.00 0.00 C ATOM 764 CZ TYR A 52 6.839 0.692 -11.758 1.00 0.00 C ATOM 765 OH TYR A 52 6.545 0.304 -13.049 1.00 0.00 O ATOM 0 H TYR A 52 8.778 2.610 -5.599 1.00 0.00 H new ATOM 0 HA TYR A 52 9.895 1.830 -8.217 1.00 0.00 H new ATOM 0 HB2 TYR A 52 7.705 1.058 -7.020 1.00 0.00 H new ATOM 0 HB3 TYR A 52 7.069 2.658 -7.347 1.00 0.00 H new ATOM 0 HD1 TYR A 52 6.631 3.421 -9.673 1.00 0.00 H new ATOM 0 HD2 TYR A 52 8.191 -0.531 -8.841 1.00 0.00 H new ATOM 0 HE1 TYR A 52 6.092 2.718 -12.014 1.00 0.00 H new ATOM 0 HE2 TYR A 52 7.660 -1.236 -11.181 1.00 0.00 H new ATOM 0 HH TYR A 52 6.810 -0.631 -13.178 1.00 0.00 H new ATOM 775 N MET A 53 10.259 4.165 -9.055 1.00 0.00 N ATOM 776 CA MET A 53 10.295 5.476 -9.753 1.00 0.00 C ATOM 777 C MET A 53 9.322 5.381 -10.926 1.00 0.00 C ATOM 778 O MET A 53 9.275 4.367 -11.600 1.00 0.00 O ATOM 779 CB MET A 53 11.728 5.648 -10.268 1.00 0.00 C ATOM 780 CG MET A 53 12.723 5.581 -9.106 1.00 0.00 C ATOM 781 SD MET A 53 13.364 7.238 -8.768 1.00 0.00 S ATOM 782 CE MET A 53 11.856 7.905 -8.031 1.00 0.00 C ATOM 0 H MET A 53 11.089 3.583 -9.172 1.00 0.00 H new ATOM 0 HA MET A 53 10.019 6.315 -9.114 1.00 0.00 H new ATOM 0 HB2 MET A 53 11.956 4.869 -10.996 1.00 0.00 H new ATOM 0 HB3 MET A 53 11.824 6.604 -10.783 1.00 0.00 H new ATOM 0 HG2 MET A 53 12.235 5.180 -8.218 1.00 0.00 H new ATOM 0 HG3 MET A 53 13.542 4.905 -9.353 1.00 0.00 H new ATOM 0 HE1 MET A 53 12.037 8.925 -7.691 1.00 0.00 H new ATOM 0 HE2 MET A 53 11.058 7.907 -8.774 1.00 0.00 H new ATOM 0 HE3 MET A 53 11.561 7.287 -7.183 1.00 0.00 H new ATOM 792 N MET A 54 8.542 6.396 -11.183 1.00 0.00 N ATOM 793 CA MET A 54 7.578 6.301 -12.320 1.00 0.00 C ATOM 794 C MET A 54 8.339 6.270 -13.653 1.00 0.00 C ATOM 795 O MET A 54 7.814 5.835 -14.661 1.00 0.00 O ATOM 796 CB MET A 54 6.691 7.541 -12.220 1.00 0.00 C ATOM 797 CG MET A 54 5.396 7.291 -12.990 1.00 0.00 C ATOM 798 SD MET A 54 4.888 5.566 -12.759 1.00 0.00 S ATOM 799 CE MET A 54 4.830 5.568 -10.947 1.00 0.00 C ATOM 0 H MET A 54 8.528 7.275 -10.665 1.00 0.00 H new ATOM 0 HA MET A 54 6.981 5.390 -12.276 1.00 0.00 H new ATOM 0 HB2 MET A 54 6.471 7.763 -11.176 1.00 0.00 H new ATOM 0 HB3 MET A 54 7.210 8.409 -12.628 1.00 0.00 H new ATOM 0 HG2 MET A 54 4.614 7.963 -12.637 1.00 0.00 H new ATOM 0 HG3 MET A 54 5.543 7.501 -14.050 1.00 0.00 H new ATOM 0 HE1 MET A 54 4.065 4.870 -10.607 1.00 0.00 H new ATOM 0 HE2 MET A 54 5.800 5.265 -10.552 1.00 0.00 H new ATOM 0 HE3 MET A 54 4.590 6.570 -10.592 1.00 0.00 H new ATOM 809 N GLY A 55 9.572 6.720 -13.663 1.00 0.00 N ATOM 810 CA GLY A 55 10.370 6.708 -14.925 1.00 0.00 C ATOM 811 C GLY A 55 11.422 5.589 -14.873 1.00 0.00 C ATOM 812 O GLY A 55 11.917 5.153 -15.896 1.00 0.00 O ATOM 0 H GLY A 55 10.058 7.095 -12.849 1.00 0.00 H new ATOM 0 HA2 GLY A 55 9.711 6.559 -15.780 1.00 0.00 H new ATOM 0 HA3 GLY A 55 10.859 7.672 -15.064 1.00 0.00 H new ATOM 816 N ASN A 56 11.774 5.126 -13.694 1.00 0.00 N ATOM 817 CA ASN A 56 12.801 4.042 -13.585 1.00 0.00 C ATOM 818 C ASN A 56 12.267 2.871 -12.750 1.00 0.00 C ATOM 819 O ASN A 56 11.312 3.009 -12.010 1.00 0.00 O ATOM 820 CB ASN A 56 13.993 4.698 -12.886 1.00 0.00 C ATOM 821 CG ASN A 56 14.559 5.807 -13.775 1.00 0.00 C ATOM 822 OD1 ASN A 56 14.914 5.569 -14.912 1.00 0.00 O ATOM 823 ND2 ASN A 56 14.659 7.019 -13.301 1.00 0.00 N ATOM 0 H ASN A 56 11.394 5.453 -12.805 1.00 0.00 H new ATOM 0 HA ASN A 56 13.068 3.633 -14.559 1.00 0.00 H new ATOM 0 HB2 ASN A 56 13.683 5.110 -11.925 1.00 0.00 H new ATOM 0 HB3 ASN A 56 14.762 3.954 -12.681 1.00 0.00 H new ATOM 0 HD21 ASN A 56 15.035 7.766 -13.885 1.00 0.00 H new ATOM 0 HD22 ASN A 56 14.361 7.219 -12.346 1.00 0.00 H new ATOM 830 N GLU A 57 12.875 1.717 -12.872 1.00 0.00 N ATOM 831 CA GLU A 57 12.408 0.528 -12.093 1.00 0.00 C ATOM 832 C GLU A 57 13.539 -0.019 -11.213 1.00 0.00 C ATOM 833 O GLU A 57 14.607 -0.345 -11.696 1.00 0.00 O ATOM 834 CB GLU A 57 12.010 -0.500 -13.153 1.00 0.00 C ATOM 835 CG GLU A 57 11.417 -1.736 -12.473 1.00 0.00 C ATOM 836 CD GLU A 57 10.930 -2.725 -13.536 1.00 0.00 C ATOM 837 OE1 GLU A 57 10.498 -2.274 -14.585 1.00 0.00 O ATOM 838 OE2 GLU A 57 10.996 -3.916 -13.282 1.00 0.00 O ATOM 0 H GLU A 57 13.677 1.547 -13.479 1.00 0.00 H new ATOM 0 HA GLU A 57 11.583 0.773 -11.424 1.00 0.00 H new ATOM 0 HB2 GLU A 57 11.283 -0.066 -13.840 1.00 0.00 H new ATOM 0 HB3 GLU A 57 12.880 -0.781 -13.746 1.00 0.00 H new ATOM 0 HG2 GLU A 57 12.167 -2.209 -11.838 1.00 0.00 H new ATOM 0 HG3 GLU A 57 10.589 -1.445 -11.826 1.00 0.00 H new ATOM 845 N LEU A 58 13.308 -0.128 -9.925 1.00 0.00 N ATOM 846 CA LEU A 58 14.365 -0.662 -9.011 1.00 0.00 C ATOM 847 C LEU A 58 14.206 -2.170 -8.818 1.00 0.00 C ATOM 848 O LEU A 58 13.191 -2.749 -9.155 1.00 0.00 O ATOM 849 CB LEU A 58 14.167 0.050 -7.671 1.00 0.00 C ATOM 850 CG LEU A 58 14.556 1.526 -7.786 1.00 0.00 C ATOM 851 CD1 LEU A 58 14.326 2.205 -6.434 1.00 0.00 C ATOM 852 CD2 LEU A 58 16.035 1.646 -8.165 1.00 0.00 C ATOM 0 H LEU A 58 12.433 0.130 -9.469 1.00 0.00 H new ATOM 0 HA LEU A 58 15.359 -0.488 -9.424 1.00 0.00 H new ATOM 0 HB2 LEU A 58 13.126 -0.035 -7.358 1.00 0.00 H new ATOM 0 HB3 LEU A 58 14.771 -0.433 -6.903 1.00 0.00 H new ATOM 0 HG LEU A 58 13.949 2.004 -8.555 1.00 0.00 H new ATOM 0 HD11 LEU A 58 14.600 3.258 -6.504 1.00 0.00 H new ATOM 0 HD12 LEU A 58 13.275 2.121 -6.159 1.00 0.00 H new ATOM 0 HD13 LEU A 58 14.939 1.720 -5.674 1.00 0.00 H new ATOM 0 HD21 LEU A 58 16.306 2.699 -8.245 1.00 0.00 H new ATOM 0 HD22 LEU A 58 16.647 1.171 -7.398 1.00 0.00 H new ATOM 0 HD23 LEU A 58 16.206 1.153 -9.122 1.00 0.00 H new ATOM 864 N THR A 59 15.213 -2.804 -8.277 1.00 0.00 N ATOM 865 CA THR A 59 15.166 -4.261 -8.048 1.00 0.00 C ATOM 866 C THR A 59 15.319 -4.568 -6.555 1.00 0.00 C ATOM 867 O THR A 59 16.169 -4.013 -5.883 1.00 0.00 O ATOM 868 CB THR A 59 16.366 -4.775 -8.824 1.00 0.00 C ATOM 869 OG1 THR A 59 17.518 -4.026 -8.462 1.00 0.00 O ATOM 870 CG2 THR A 59 16.109 -4.648 -10.326 1.00 0.00 C ATOM 0 H THR A 59 16.080 -2.355 -7.981 1.00 0.00 H new ATOM 0 HA THR A 59 14.227 -4.718 -8.362 1.00 0.00 H new ATOM 0 HB THR A 59 16.529 -5.826 -8.584 1.00 0.00 H new ATOM 0 HG1 THR A 59 17.484 -3.816 -7.505 1.00 0.00 H new ATOM 0 HG21 THR A 59 16.974 -5.019 -10.876 1.00 0.00 H new ATOM 0 HG22 THR A 59 15.230 -5.233 -10.595 1.00 0.00 H new ATOM 0 HG23 THR A 59 15.940 -3.601 -10.579 1.00 0.00 H new ATOM 878 N PHE A 60 14.507 -5.451 -6.038 1.00 0.00 N ATOM 879 CA PHE A 60 14.601 -5.808 -4.586 1.00 0.00 C ATOM 880 C PHE A 60 15.925 -6.538 -4.328 1.00 0.00 C ATOM 881 O PHE A 60 16.350 -7.362 -5.111 1.00 0.00 O ATOM 882 CB PHE A 60 13.384 -6.706 -4.336 1.00 0.00 C ATOM 883 CG PHE A 60 12.113 -5.863 -4.181 1.00 0.00 C ATOM 884 CD1 PHE A 60 12.035 -4.524 -4.686 1.00 0.00 C ATOM 885 CD2 PHE A 60 10.988 -6.422 -3.522 1.00 0.00 C ATOM 886 CE1 PHE A 60 10.846 -3.766 -4.527 1.00 0.00 C ATOM 887 CE2 PHE A 60 9.797 -5.662 -3.364 1.00 0.00 C ATOM 888 CZ PHE A 60 9.726 -4.335 -3.866 1.00 0.00 C ATOM 0 H PHE A 60 13.780 -5.943 -6.557 1.00 0.00 H new ATOM 0 HA PHE A 60 14.594 -4.946 -3.919 1.00 0.00 H new ATOM 0 HB2 PHE A 60 13.265 -7.404 -5.164 1.00 0.00 H new ATOM 0 HB3 PHE A 60 13.543 -7.302 -3.437 1.00 0.00 H new ATOM 0 HD1 PHE A 60 12.886 -4.090 -5.190 1.00 0.00 H new ATOM 0 HD2 PHE A 60 11.037 -7.430 -3.138 1.00 0.00 H new ATOM 0 HE1 PHE A 60 10.793 -2.757 -4.909 1.00 0.00 H new ATOM 0 HE2 PHE A 60 8.944 -6.094 -2.861 1.00 0.00 H new ATOM 0 HZ PHE A 60 8.820 -3.759 -3.745 1.00 0.00 H new ATOM 898 N LEU A 61 16.598 -6.198 -3.260 1.00 0.00 N ATOM 899 CA LEU A 61 17.930 -6.822 -2.963 1.00 0.00 C ATOM 900 C LEU A 61 17.838 -8.309 -2.582 1.00 0.00 C ATOM 901 O LEU A 61 18.669 -9.099 -2.994 1.00 0.00 O ATOM 902 CB LEU A 61 18.491 -6.012 -1.791 1.00 0.00 C ATOM 903 CG LEU A 61 19.928 -6.453 -1.507 1.00 0.00 C ATOM 904 CD1 LEU A 61 20.708 -5.288 -0.896 1.00 0.00 C ATOM 905 CD2 LEU A 61 19.917 -7.628 -0.527 1.00 0.00 C ATOM 0 H LEU A 61 16.284 -5.511 -2.574 1.00 0.00 H new ATOM 0 HA LEU A 61 18.562 -6.798 -3.850 1.00 0.00 H new ATOM 0 HB2 LEU A 61 18.466 -4.948 -2.025 1.00 0.00 H new ATOM 0 HB3 LEU A 61 17.873 -6.158 -0.905 1.00 0.00 H new ATOM 0 HG LEU A 61 20.404 -6.760 -2.438 1.00 0.00 H new ATOM 0 HD11 LEU A 61 21.732 -5.602 -0.694 1.00 0.00 H new ATOM 0 HD12 LEU A 61 20.717 -4.450 -1.593 1.00 0.00 H new ATOM 0 HD13 LEU A 61 20.232 -4.980 0.035 1.00 0.00 H new ATOM 0 HD21 LEU A 61 20.941 -7.942 -0.324 1.00 0.00 H new ATOM 0 HD22 LEU A 61 19.441 -7.321 0.404 1.00 0.00 H new ATOM 0 HD23 LEU A 61 19.361 -8.459 -0.962 1.00 0.00 H new ATOM 917 N ASP A 62 16.878 -8.699 -1.776 1.00 0.00 N ATOM 918 CA ASP A 62 16.802 -10.138 -1.353 1.00 0.00 C ATOM 919 C ASP A 62 15.503 -10.818 -1.805 1.00 0.00 C ATOM 920 O ASP A 62 14.723 -10.269 -2.557 1.00 0.00 O ATOM 921 CB ASP A 62 16.891 -10.098 0.178 1.00 0.00 C ATOM 922 CG ASP A 62 15.699 -9.330 0.772 1.00 0.00 C ATOM 923 OD1 ASP A 62 14.907 -8.801 0.007 1.00 0.00 O ATOM 924 OD2 ASP A 62 15.601 -9.284 1.987 1.00 0.00 O ATOM 0 H ASP A 62 16.151 -8.093 -1.396 1.00 0.00 H new ATOM 0 HA ASP A 62 17.600 -10.723 -1.809 1.00 0.00 H new ATOM 0 HB2 ASP A 62 16.909 -11.114 0.573 1.00 0.00 H new ATOM 0 HB3 ASP A 62 17.824 -9.622 0.481 1.00 0.00 H new ATOM 929 N ASP A 63 15.285 -12.030 -1.339 1.00 0.00 N ATOM 930 CA ASP A 63 14.054 -12.802 -1.710 1.00 0.00 C ATOM 931 C ASP A 63 13.932 -12.936 -3.226 1.00 0.00 C ATOM 932 O ASP A 63 12.942 -12.553 -3.819 1.00 0.00 O ATOM 933 CB ASP A 63 12.875 -12.021 -1.129 1.00 0.00 C ATOM 934 CG ASP A 63 12.883 -12.127 0.402 1.00 0.00 C ATOM 935 OD1 ASP A 63 13.490 -13.054 0.917 1.00 0.00 O ATOM 936 OD2 ASP A 63 12.274 -11.284 1.034 1.00 0.00 O ATOM 0 H ASP A 63 15.918 -12.522 -0.709 1.00 0.00 H new ATOM 0 HA ASP A 63 14.087 -13.817 -1.314 1.00 0.00 H new ATOM 0 HB2 ASP A 63 12.936 -10.975 -1.430 1.00 0.00 H new ATOM 0 HB3 ASP A 63 11.938 -12.412 -1.525 1.00 0.00 H new ATOM 941 N SER A 64 14.938 -13.488 -3.857 1.00 0.00 N ATOM 942 CA SER A 64 14.913 -13.671 -5.345 1.00 0.00 C ATOM 943 C SER A 64 14.580 -12.352 -6.047 1.00 0.00 C ATOM 944 O SER A 64 14.051 -12.335 -7.142 1.00 0.00 O ATOM 945 CB SER A 64 13.822 -14.710 -5.605 1.00 0.00 C ATOM 946 OG SER A 64 14.200 -15.947 -5.014 1.00 0.00 O ATOM 0 H SER A 64 15.786 -13.824 -3.401 1.00 0.00 H new ATOM 0 HA SER A 64 15.881 -13.993 -5.730 1.00 0.00 H new ATOM 0 HB2 SER A 64 12.874 -14.370 -5.189 1.00 0.00 H new ATOM 0 HB3 SER A 64 13.673 -14.837 -6.677 1.00 0.00 H new ATOM 0 HG SER A 64 13.502 -16.615 -5.178 1.00 0.00 H new ATOM 952 N ILE A 67 14.892 -11.243 -5.419 1.00 0.00 N ATOM 953 CA ILE A 67 14.607 -9.906 -6.030 1.00 0.00 C ATOM 954 C ILE A 67 13.126 -9.792 -6.425 1.00 0.00 C ATOM 955 O ILE A 67 12.786 -9.884 -7.591 1.00 0.00 O ATOM 956 CB ILE A 67 15.508 -9.821 -7.265 1.00 0.00 C ATOM 957 CG1 ILE A 67 16.968 -9.931 -6.819 1.00 0.00 C ATOM 958 CG2 ILE A 67 15.289 -8.478 -7.974 1.00 0.00 C ATOM 959 CD1 ILE A 67 17.871 -9.948 -8.042 1.00 0.00 C ATOM 0 H ILE A 67 15.336 -11.207 -4.501 1.00 0.00 H new ATOM 0 HA ILE A 67 14.804 -9.093 -5.331 1.00 0.00 H new ATOM 0 HB ILE A 67 15.267 -10.631 -7.954 1.00 0.00 H new ATOM 0 HG12 ILE A 67 17.227 -9.091 -6.174 1.00 0.00 H new ATOM 0 HG13 ILE A 67 17.113 -10.839 -6.234 1.00 0.00 H new ATOM 0 HG21 ILE A 67 15.932 -8.421 -8.852 1.00 0.00 H new ATOM 0 HG22 ILE A 67 14.247 -8.395 -8.281 1.00 0.00 H new ATOM 0 HG23 ILE A 67 15.533 -7.663 -7.293 1.00 0.00 H new ATOM 0 HD11 ILE A 67 18.911 -10.026 -7.725 1.00 0.00 H new ATOM 0 HD12 ILE A 67 17.617 -10.802 -8.670 1.00 0.00 H new ATOM 0 HD13 ILE A 67 17.733 -9.027 -8.609 1.00 0.00 H new ATOM 971 N CYS A 68 12.245 -9.583 -5.471 1.00 0.00 N ATOM 972 CA CYS A 68 10.796 -9.454 -5.817 1.00 0.00 C ATOM 973 C CYS A 68 10.605 -8.201 -6.673 1.00 0.00 C ATOM 974 O CYS A 68 11.347 -7.244 -6.547 1.00 0.00 O ATOM 975 CB CYS A 68 10.043 -9.323 -4.484 1.00 0.00 C ATOM 976 SG CYS A 68 11.156 -9.699 -3.106 1.00 0.00 S ATOM 0 H CYS A 68 12.467 -9.497 -4.479 1.00 0.00 H new ATOM 0 HA CYS A 68 10.426 -10.310 -6.381 1.00 0.00 H new ATOM 0 HB2 CYS A 68 9.647 -8.313 -4.378 1.00 0.00 H new ATOM 0 HB3 CYS A 68 9.191 -10.002 -4.470 1.00 0.00 H new ATOM 981 N THR A 69 9.633 -8.201 -7.548 1.00 0.00 N ATOM 982 CA THR A 69 9.420 -7.006 -8.417 1.00 0.00 C ATOM 983 C THR A 69 8.032 -6.408 -8.178 1.00 0.00 C ATOM 984 O THR A 69 7.070 -7.117 -7.951 1.00 0.00 O ATOM 985 CB THR A 69 9.558 -7.527 -9.853 1.00 0.00 C ATOM 986 OG1 THR A 69 9.403 -6.447 -10.763 1.00 0.00 O ATOM 987 CG2 THR A 69 8.494 -8.593 -10.132 1.00 0.00 C ATOM 0 H THR A 69 8.982 -8.971 -7.698 1.00 0.00 H new ATOM 0 HA THR A 69 10.136 -6.211 -8.207 1.00 0.00 H new ATOM 0 HB THR A 69 10.545 -7.973 -9.978 1.00 0.00 H new ATOM 0 HG1 THR A 69 9.493 -6.778 -11.681 1.00 0.00 H new ATOM 0 HG21 THR A 69 8.602 -8.956 -11.154 1.00 0.00 H new ATOM 0 HG22 THR A 69 8.620 -9.423 -9.437 1.00 0.00 H new ATOM 0 HG23 THR A 69 7.502 -8.160 -10.003 1.00 0.00 H new ATOM 995 N GLY A 70 7.932 -5.105 -8.228 1.00 0.00 N ATOM 996 CA GLY A 70 6.618 -4.443 -8.004 1.00 0.00 C ATOM 997 C GLY A 70 6.349 -3.442 -9.127 1.00 0.00 C ATOM 998 O GLY A 70 7.239 -2.747 -9.579 1.00 0.00 O ATOM 0 H GLY A 70 8.709 -4.471 -8.415 1.00 0.00 H new ATOM 0 HA2 GLY A 70 5.824 -5.190 -7.971 1.00 0.00 H new ATOM 0 HA3 GLY A 70 6.616 -3.933 -7.041 1.00 0.00 H new ATOM 1002 N THR A 71 5.124 -3.364 -9.571 1.00 0.00 N ATOM 1003 CA THR A 71 4.768 -2.409 -10.659 1.00 0.00 C ATOM 1004 C THR A 71 3.785 -1.377 -10.119 1.00 0.00 C ATOM 1005 O THR A 71 3.155 -1.592 -9.105 1.00 0.00 O ATOM 1006 CB THR A 71 4.106 -3.252 -11.732 1.00 0.00 C ATOM 1007 OG1 THR A 71 4.980 -4.299 -12.129 1.00 0.00 O ATOM 1008 CG2 THR A 71 3.758 -2.386 -12.939 1.00 0.00 C ATOM 0 H THR A 71 4.347 -3.926 -9.223 1.00 0.00 H new ATOM 0 HA THR A 71 5.635 -1.875 -11.047 1.00 0.00 H new ATOM 0 HB THR A 71 3.189 -3.682 -11.328 1.00 0.00 H new ATOM 0 HG1 THR A 71 4.453 -5.075 -12.414 1.00 0.00 H new ATOM 0 HG21 THR A 71 3.283 -3.001 -13.703 1.00 0.00 H new ATOM 0 HG22 THR A 71 3.074 -1.594 -12.634 1.00 0.00 H new ATOM 0 HG23 THR A 71 4.668 -1.943 -13.343 1.00 0.00 H new ATOM 1016 N SER A 72 3.655 -0.264 -10.784 1.00 0.00 N ATOM 1017 CA SER A 72 2.707 0.792 -10.312 1.00 0.00 C ATOM 1018 C SER A 72 2.043 1.489 -11.505 1.00 0.00 C ATOM 1019 O SER A 72 2.679 2.229 -12.232 1.00 0.00 O ATOM 1020 CB SER A 72 3.573 1.779 -9.528 1.00 0.00 C ATOM 1021 OG SER A 72 2.754 2.824 -9.023 1.00 0.00 O ATOM 0 H SER A 72 4.165 -0.036 -11.638 1.00 0.00 H new ATOM 0 HA SER A 72 1.903 0.379 -9.703 1.00 0.00 H new ATOM 0 HB2 SER A 72 4.076 1.267 -8.708 1.00 0.00 H new ATOM 0 HB3 SER A 72 4.350 2.190 -10.172 1.00 0.00 H new ATOM 0 HG SER A 72 3.306 3.458 -8.519 1.00 0.00 H new ATOM 1027 N SER A 73 0.768 1.258 -11.708 1.00 0.00 N ATOM 1028 CA SER A 73 0.057 1.913 -12.850 1.00 0.00 C ATOM 1029 C SER A 73 -1.429 2.091 -12.520 1.00 0.00 C ATOM 1030 O SER A 73 -2.051 1.224 -11.936 1.00 0.00 O ATOM 1031 CB SER A 73 0.235 0.951 -14.025 1.00 0.00 C ATOM 1032 OG SER A 73 -0.415 1.487 -15.171 1.00 0.00 O ATOM 0 H SER A 73 0.190 0.645 -11.133 1.00 0.00 H new ATOM 0 HA SER A 73 0.451 2.905 -13.069 1.00 0.00 H new ATOM 0 HB2 SER A 73 1.295 0.801 -14.230 1.00 0.00 H new ATOM 0 HB3 SER A 73 -0.183 -0.025 -13.778 1.00 0.00 H new ATOM 0 HG SER A 73 -0.302 0.874 -15.928 1.00 0.00 H new ATOM 1038 N GLY A 74 -2.005 3.206 -12.903 1.00 0.00 N ATOM 1039 CA GLY A 74 -3.453 3.442 -12.619 1.00 0.00 C ATOM 1040 C GLY A 74 -3.680 3.478 -11.107 1.00 0.00 C ATOM 1041 O GLY A 74 -4.641 2.932 -10.604 1.00 0.00 O ATOM 0 H GLY A 74 -1.533 3.962 -13.400 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -3.773 4.382 -13.067 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -4.056 2.653 -13.069 1.00 0.00 H new ATOM 1045 N ASN A 75 -2.785 4.104 -10.379 1.00 0.00 N ATOM 1046 CA ASN A 75 -2.914 4.178 -8.885 1.00 0.00 C ATOM 1047 C ASN A 75 -2.989 2.767 -8.285 1.00 0.00 C ATOM 1048 O ASN A 75 -3.454 2.581 -7.178 1.00 0.00 O ATOM 1049 CB ASN A 75 -4.206 4.961 -8.604 1.00 0.00 C ATOM 1050 CG ASN A 75 -4.064 6.393 -9.126 1.00 0.00 C ATOM 1051 OD1 ASN A 75 -4.949 6.900 -9.786 1.00 0.00 O ATOM 1052 ND2 ASN A 75 -2.985 7.074 -8.853 1.00 0.00 N ATOM 0 H ASN A 75 -1.962 4.572 -10.759 1.00 0.00 H new ATOM 0 HA ASN A 75 -2.053 4.670 -8.433 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -5.052 4.470 -9.085 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -4.411 4.972 -7.533 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -2.886 8.030 -9.194 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -2.241 6.650 -8.299 1.00 0.00 H new ATOM 1059 N GLN A 76 -2.520 1.777 -9.004 1.00 0.00 N ATOM 1060 CA GLN A 76 -2.542 0.377 -8.489 1.00 0.00 C ATOM 1061 C GLN A 76 -1.131 -0.204 -8.526 1.00 0.00 C ATOM 1062 O GLN A 76 -0.485 -0.188 -9.559 1.00 0.00 O ATOM 1063 CB GLN A 76 -3.462 -0.379 -9.448 1.00 0.00 C ATOM 1064 CG GLN A 76 -4.910 0.053 -9.218 1.00 0.00 C ATOM 1065 CD GLN A 76 -5.816 -0.628 -10.245 1.00 0.00 C ATOM 1066 OE1 GLN A 76 -6.481 0.034 -11.018 1.00 0.00 O ATOM 1067 NE2 GLN A 76 -5.872 -1.931 -10.288 1.00 0.00 N ATOM 0 H GLN A 76 -2.119 1.883 -9.936 1.00 0.00 H new ATOM 0 HA GLN A 76 -2.891 0.312 -7.458 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -3.172 -0.179 -10.479 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.363 -1.453 -9.292 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.224 -0.212 -8.208 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -4.995 1.136 -9.304 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -5.314 -2.487 -9.640 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -6.473 -2.393 -10.970 1.00 0.00 H new ATOM 1076 N VAL A 77 -0.633 -0.704 -7.418 1.00 0.00 N ATOM 1077 CA VAL A 77 0.746 -1.259 -7.423 1.00 0.00 C ATOM 1078 C VAL A 77 0.699 -2.799 -7.459 1.00 0.00 C ATOM 1079 O VAL A 77 0.079 -3.427 -6.626 1.00 0.00 O ATOM 1080 CB VAL A 77 1.438 -0.719 -6.143 1.00 0.00 C ATOM 1081 CG1 VAL A 77 1.129 0.775 -5.937 1.00 0.00 C ATOM 1082 CG2 VAL A 77 1.019 -1.504 -4.890 1.00 0.00 C ATOM 0 H VAL A 77 -1.121 -0.749 -6.523 1.00 0.00 H new ATOM 0 HA VAL A 77 1.308 -0.954 -8.306 1.00 0.00 H new ATOM 0 HB VAL A 77 2.510 -0.849 -6.288 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.626 1.128 -5.033 1.00 0.00 H new ATOM 0 HG12 VAL A 77 1.489 1.343 -6.795 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.052 0.913 -5.837 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.526 -1.093 -4.017 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -0.060 -1.424 -4.754 1.00 0.00 H new ATOM 0 HG23 VAL A 77 1.293 -2.552 -5.009 1.00 0.00 H new ATOM 1092 N ASN A 78 1.336 -3.403 -8.430 1.00 0.00 N ATOM 1093 CA ASN A 78 1.313 -4.894 -8.528 1.00 0.00 C ATOM 1094 C ASN A 78 2.628 -5.503 -8.020 1.00 0.00 C ATOM 1095 O ASN A 78 3.680 -5.301 -8.596 1.00 0.00 O ATOM 1096 CB ASN A 78 1.127 -5.180 -10.020 1.00 0.00 C ATOM 1097 CG ASN A 78 0.823 -6.664 -10.225 1.00 0.00 C ATOM 1098 OD1 ASN A 78 1.263 -7.508 -9.470 1.00 0.00 O ATOM 1099 ND2 ASN A 78 0.073 -6.989 -11.245 1.00 0.00 N ATOM 0 H ASN A 78 1.870 -2.929 -9.158 1.00 0.00 H new ATOM 0 HA ASN A 78 0.522 -5.331 -7.918 1.00 0.00 H new ATOM 0 HB2 ASN A 78 0.313 -4.574 -10.418 1.00 0.00 H new ATOM 0 HB3 ASN A 78 2.028 -4.904 -10.568 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -0.286 -6.264 -11.866 1.00 0.00 H new ATOM 1105 N LEU A 79 2.565 -6.267 -6.954 1.00 0.00 N ATOM 1106 CA LEU A 79 3.797 -6.919 -6.408 1.00 0.00 C ATOM 1107 C LEU A 79 3.842 -8.386 -6.852 1.00 0.00 C ATOM 1108 O LEU A 79 2.836 -9.071 -6.841 1.00 0.00 O ATOM 1109 CB LEU A 79 3.668 -6.832 -4.882 1.00 0.00 C ATOM 1110 CG LEU A 79 3.830 -5.380 -4.416 1.00 0.00 C ATOM 1111 CD1 LEU A 79 3.455 -5.263 -2.931 1.00 0.00 C ATOM 1112 CD2 LEU A 79 5.286 -4.948 -4.618 1.00 0.00 C ATOM 0 H LEU A 79 1.709 -6.467 -6.437 1.00 0.00 H new ATOM 0 HA LEU A 79 4.708 -6.437 -6.762 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.696 -7.215 -4.570 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.424 -7.459 -4.410 1.00 0.00 H new ATOM 0 HG LEU A 79 3.172 -4.735 -4.998 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.572 -4.229 -2.606 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.419 -5.572 -2.792 1.00 0.00 H new ATOM 0 HD13 LEU A 79 4.107 -5.905 -2.339 1.00 0.00 H new ATOM 0 HD21 LEU A 79 5.408 -3.916 -4.289 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.942 -5.595 -4.035 1.00 0.00 H new ATOM 0 HD23 LEU A 79 5.545 -5.025 -5.674 1.00 0.00 H new ATOM 1124 N THR A 80 4.995 -8.872 -7.246 1.00 0.00 N ATOM 1125 CA THR A 80 5.096 -10.294 -7.694 1.00 0.00 C ATOM 1126 C THR A 80 6.219 -11.022 -6.945 1.00 0.00 C ATOM 1127 O THR A 80 7.330 -10.534 -6.843 1.00 0.00 O ATOM 1128 CB THR A 80 5.412 -10.213 -9.187 1.00 0.00 C ATOM 1129 OG1 THR A 80 4.411 -9.446 -9.840 1.00 0.00 O ATOM 1130 CG2 THR A 80 5.443 -11.622 -9.779 1.00 0.00 C ATOM 0 H THR A 80 5.868 -8.345 -7.276 1.00 0.00 H new ATOM 0 HA THR A 80 4.180 -10.851 -7.496 1.00 0.00 H new ATOM 0 HB THR A 80 6.383 -9.739 -9.329 1.00 0.00 H new ATOM 0 HG1 THR A 80 4.613 -9.392 -10.797 1.00 0.00 H new ATOM 0 HG21 THR A 80 5.668 -11.564 -10.844 1.00 0.00 H new ATOM 0 HG22 THR A 80 6.211 -12.211 -9.277 1.00 0.00 H new ATOM 0 HG23 THR A 80 4.472 -12.097 -9.639 1.00 0.00 H new ATOM 1138 N ILE A 81 5.933 -12.194 -6.431 1.00 0.00 N ATOM 1139 CA ILE A 81 6.971 -12.978 -5.693 1.00 0.00 C ATOM 1140 C ILE A 81 7.362 -14.214 -6.503 1.00 0.00 C ATOM 1141 O ILE A 81 6.513 -14.897 -7.043 1.00 0.00 O ATOM 1142 CB ILE A 81 6.296 -13.421 -4.389 1.00 0.00 C ATOM 1143 CG1 ILE A 81 5.944 -12.196 -3.544 1.00 0.00 C ATOM 1144 CG2 ILE A 81 7.247 -14.333 -3.593 1.00 0.00 C ATOM 1145 CD1 ILE A 81 4.898 -12.592 -2.499 1.00 0.00 C ATOM 0 H ILE A 81 5.019 -12.643 -6.492 1.00 0.00 H new ATOM 0 HA ILE A 81 7.872 -12.390 -5.515 1.00 0.00 H new ATOM 0 HB ILE A 81 5.385 -13.969 -4.631 1.00 0.00 H new ATOM 0 HG12 ILE A 81 6.837 -11.808 -3.054 1.00 0.00 H new ATOM 0 HG13 ILE A 81 5.558 -11.399 -4.180 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.763 -14.645 -2.668 1.00 0.00 H new ATOM 0 HG22 ILE A 81 7.491 -15.212 -4.189 1.00 0.00 H new ATOM 0 HG23 ILE A 81 8.162 -13.788 -3.358 1.00 0.00 H new ATOM 0 HD11 ILE A 81 4.642 -11.723 -1.893 1.00 0.00 H new ATOM 0 HD12 ILE A 81 4.003 -12.960 -3.001 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.303 -13.375 -1.858 1.00 0.00 H new ATOM 1157 N GLN A 82 8.630 -14.529 -6.555 1.00 0.00 N ATOM 1158 CA GLN A 82 9.054 -15.750 -7.292 1.00 0.00 C ATOM 1159 C GLN A 82 9.850 -16.670 -6.369 1.00 0.00 C ATOM 1160 O GLN A 82 10.868 -16.293 -5.820 1.00 0.00 O ATOM 1161 CB GLN A 82 9.932 -15.270 -8.437 1.00 0.00 C ATOM 1162 CG GLN A 82 9.113 -14.379 -9.370 1.00 0.00 C ATOM 1163 CD GLN A 82 10.020 -13.819 -10.468 1.00 0.00 C ATOM 1164 OE1 GLN A 82 10.432 -14.537 -11.356 1.00 0.00 O ATOM 1165 NE2 GLN A 82 10.349 -12.556 -10.444 1.00 0.00 N ATOM 0 H GLN A 82 9.384 -13.996 -6.121 1.00 0.00 H new ATOM 0 HA GLN A 82 8.196 -16.313 -7.658 1.00 0.00 H new ATOM 0 HB2 GLN A 82 10.787 -14.717 -8.047 1.00 0.00 H new ATOM 0 HB3 GLN A 82 10.329 -16.123 -8.987 1.00 0.00 H new ATOM 0 HG2 GLN A 82 8.298 -14.951 -9.813 1.00 0.00 H new ATOM 0 HG3 GLN A 82 8.660 -13.563 -8.806 1.00 0.00 H new ATOM 0 HE21 GLN A 82 10.003 -11.953 -9.698 1.00 0.00 H new ATOM 0 HE22 GLN A 82 10.952 -12.172 -11.171 1.00 0.00 H new ATOM 1174 N GLY A 83 9.391 -17.875 -6.212 1.00 0.00 N ATOM 1175 CA GLY A 83 10.105 -18.856 -5.341 1.00 0.00 C ATOM 1176 C GLY A 83 9.236 -19.224 -4.136 1.00 0.00 C ATOM 1177 O GLY A 83 9.742 -19.558 -3.081 1.00 0.00 O ATOM 0 H GLY A 83 8.543 -18.231 -6.653 1.00 0.00 H new ATOM 0 HA2 GLY A 83 10.346 -19.753 -5.912 1.00 0.00 H new ATOM 0 HA3 GLY A 83 11.050 -18.431 -5.001 1.00 0.00 H new ATOM 1181 N LEU A 84 7.936 -19.165 -4.283 1.00 0.00 N ATOM 1182 CA LEU A 84 7.036 -19.510 -3.144 1.00 0.00 C ATOM 1183 C LEU A 84 6.741 -21.010 -3.098 1.00 0.00 C ATOM 1184 O LEU A 84 6.343 -21.610 -4.078 1.00 0.00 O ATOM 1185 CB LEU A 84 5.751 -18.733 -3.408 1.00 0.00 C ATOM 1186 CG LEU A 84 5.998 -17.249 -3.163 1.00 0.00 C ATOM 1187 CD1 LEU A 84 4.821 -16.445 -3.709 1.00 0.00 C ATOM 1188 CD2 LEU A 84 6.134 -17.001 -1.658 1.00 0.00 C ATOM 0 H LEU A 84 7.461 -18.893 -5.143 1.00 0.00 H new ATOM 0 HA LEU A 84 7.493 -19.257 -2.187 1.00 0.00 H new ATOM 0 HB2 LEU A 84 5.420 -18.893 -4.434 1.00 0.00 H new ATOM 0 HB3 LEU A 84 4.955 -19.093 -2.756 1.00 0.00 H new ATOM 0 HG LEU A 84 6.914 -16.940 -3.667 1.00 0.00 H new ATOM 0 HD11 LEU A 84 4.994 -15.383 -3.535 1.00 0.00 H new ATOM 0 HD12 LEU A 84 4.722 -16.626 -4.779 1.00 0.00 H new ATOM 0 HD13 LEU A 84 3.905 -16.751 -3.203 1.00 0.00 H new ATOM 0 HD21 LEU A 84 6.311 -15.941 -1.479 1.00 0.00 H new ATOM 0 HD22 LEU A 84 5.217 -17.306 -1.155 1.00 0.00 H new ATOM 0 HD23 LEU A 84 6.972 -17.580 -1.268 1.00 0.00 H new ATOM 1200 N ARG A 85 6.913 -21.604 -1.949 1.00 0.00 N ATOM 1201 CA ARG A 85 6.626 -23.056 -1.787 1.00 0.00 C ATOM 1202 C ARG A 85 5.284 -23.224 -1.074 1.00 0.00 C ATOM 1203 O ARG A 85 4.661 -22.255 -0.680 1.00 0.00 O ATOM 1204 CB ARG A 85 7.758 -23.595 -0.909 1.00 0.00 C ATOM 1205 CG ARG A 85 9.091 -23.449 -1.645 1.00 0.00 C ATOM 1206 CD ARG A 85 10.146 -24.319 -0.959 1.00 0.00 C ATOM 1207 NE ARG A 85 11.425 -24.034 -1.682 1.00 0.00 N ATOM 1208 CZ ARG A 85 12.590 -24.412 -1.191 1.00 0.00 C ATOM 1209 NH1 ARG A 85 12.679 -25.049 -0.046 1.00 0.00 N ATOM 1210 NH2 ARG A 85 13.679 -24.145 -1.858 1.00 0.00 N ATOM 0 H ARG A 85 7.245 -21.138 -1.105 1.00 0.00 H new ATOM 0 HA ARG A 85 6.570 -23.581 -2.740 1.00 0.00 H new ATOM 0 HB2 ARG A 85 7.791 -23.051 0.035 1.00 0.00 H new ATOM 0 HB3 ARG A 85 7.577 -24.642 -0.667 1.00 0.00 H new ATOM 0 HG2 ARG A 85 8.979 -23.748 -2.687 1.00 0.00 H new ATOM 0 HG3 ARG A 85 9.407 -22.406 -1.645 1.00 0.00 H new ATOM 0 HD2 ARG A 85 10.230 -24.074 0.100 1.00 0.00 H new ATOM 0 HD3 ARG A 85 9.886 -25.376 -1.022 1.00 0.00 H new ATOM 0 HE ARG A 85 11.396 -23.537 -2.572 1.00 0.00 H new ATOM 0 HH11 ARG A 85 11.835 -25.263 0.486 1.00 0.00 H new ATOM 0 HH12 ARG A 85 13.592 -25.330 0.312 1.00 0.00 H new ATOM 0 HH21 ARG A 85 13.623 -23.650 -2.748 1.00 0.00 H new ATOM 0 HH22 ARG A 85 14.586 -24.432 -1.490 1.00 0.00 H new ATOM 1224 N ALA A 86 4.839 -24.440 -0.894 1.00 0.00 N ATOM 1225 CA ALA A 86 3.537 -24.670 -0.188 1.00 0.00 C ATOM 1226 C ALA A 86 3.608 -24.095 1.227 1.00 0.00 C ATOM 1227 O ALA A 86 2.694 -23.453 1.705 1.00 0.00 O ATOM 1228 CB ALA A 86 3.390 -26.189 -0.118 1.00 0.00 C ATOM 0 H ALA A 86 5.318 -25.285 -1.204 1.00 0.00 H new ATOM 0 HA ALA A 86 2.700 -24.195 -0.699 1.00 0.00 H new ATOM 0 HB1 ALA A 86 2.458 -26.441 0.387 1.00 0.00 H new ATOM 0 HB2 ALA A 86 3.379 -26.600 -1.127 1.00 0.00 H new ATOM 0 HB3 ALA A 86 4.229 -26.611 0.436 1.00 0.00 H new ATOM 1234 N MET A 87 4.700 -24.341 1.891 1.00 0.00 N ATOM 1235 CA MET A 87 4.886 -23.843 3.284 1.00 0.00 C ATOM 1236 C MET A 87 4.999 -22.313 3.320 1.00 0.00 C ATOM 1237 O MET A 87 4.638 -21.681 4.295 1.00 0.00 O ATOM 1238 CB MET A 87 6.192 -24.487 3.746 1.00 0.00 C ATOM 1239 CG MET A 87 5.983 -25.992 3.929 1.00 0.00 C ATOM 1240 SD MET A 87 4.784 -26.279 5.255 1.00 0.00 S ATOM 1241 CE MET A 87 3.340 -26.554 4.199 1.00 0.00 C ATOM 0 H MET A 87 5.487 -24.876 1.522 1.00 0.00 H new ATOM 0 HA MET A 87 4.041 -24.097 3.924 1.00 0.00 H new ATOM 0 HB2 MET A 87 6.979 -24.305 3.014 1.00 0.00 H new ATOM 0 HB3 MET A 87 6.519 -24.038 4.684 1.00 0.00 H new ATOM 0 HG2 MET A 87 5.626 -26.436 3.000 1.00 0.00 H new ATOM 0 HG3 MET A 87 6.930 -26.475 4.170 1.00 0.00 H new ATOM 0 HE1 MET A 87 2.597 -25.779 4.389 1.00 0.00 H new ATOM 0 HE2 MET A 87 3.642 -26.518 3.152 1.00 0.00 H new ATOM 0 HE3 MET A 87 2.909 -27.531 4.419 1.00 0.00 H new ATOM 1251 N ASP A 88 5.512 -21.719 2.274 1.00 0.00 N ATOM 1252 CA ASP A 88 5.670 -20.228 2.249 1.00 0.00 C ATOM 1253 C ASP A 88 4.310 -19.520 2.245 1.00 0.00 C ATOM 1254 O ASP A 88 4.228 -18.339 2.522 1.00 0.00 O ATOM 1255 CB ASP A 88 6.437 -19.921 0.965 1.00 0.00 C ATOM 1256 CG ASP A 88 7.883 -20.413 1.097 1.00 0.00 C ATOM 1257 OD1 ASP A 88 8.378 -20.462 2.213 1.00 0.00 O ATOM 1258 OD2 ASP A 88 8.472 -20.734 0.078 1.00 0.00 O ATOM 0 H ASP A 88 5.830 -22.200 1.433 1.00 0.00 H new ATOM 0 HA ASP A 88 6.195 -19.873 3.135 1.00 0.00 H new ATOM 0 HB2 ASP A 88 5.954 -20.406 0.117 1.00 0.00 H new ATOM 0 HB3 ASP A 88 6.424 -18.849 0.770 1.00 0.00 H new ATOM 1263 N THR A 89 3.242 -20.224 1.933 1.00 0.00 N ATOM 1264 CA THR A 89 1.888 -19.596 1.913 1.00 0.00 C ATOM 1265 C THR A 89 1.640 -18.823 3.207 1.00 0.00 C ATOM 1266 O THR A 89 2.170 -19.156 4.251 1.00 0.00 O ATOM 1267 CB THR A 89 0.915 -20.749 1.790 1.00 0.00 C ATOM 1268 OG1 THR A 89 1.307 -21.593 0.717 1.00 0.00 O ATOM 1269 CG2 THR A 89 -0.491 -20.212 1.534 1.00 0.00 C ATOM 0 H THR A 89 3.257 -21.215 1.690 1.00 0.00 H new ATOM 0 HA THR A 89 1.781 -18.885 1.094 1.00 0.00 H new ATOM 0 HB THR A 89 0.917 -21.321 2.718 1.00 0.00 H new ATOM 0 HG1 THR A 89 1.487 -22.494 1.058 1.00 0.00 H new ATOM 0 HG21 THR A 89 -1.188 -21.045 1.446 1.00 0.00 H new ATOM 0 HG22 THR A 89 -0.793 -19.572 2.363 1.00 0.00 H new ATOM 0 HG23 THR A 89 -0.497 -19.635 0.610 1.00 0.00 H new ATOM 1277 N GLY A 90 0.858 -17.787 3.136 1.00 0.00 N ATOM 1278 CA GLY A 90 0.591 -16.971 4.359 1.00 0.00 C ATOM 1279 C GLY A 90 0.227 -15.538 3.967 1.00 0.00 C ATOM 1280 O GLY A 90 -0.037 -15.250 2.817 1.00 0.00 O ATOM 0 H GLY A 90 0.391 -17.466 2.288 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -0.222 -17.417 4.933 1.00 0.00 H new ATOM 0 HA3 GLY A 90 1.471 -16.968 5.002 1.00 0.00 H new ATOM 1284 N LEU A 91 0.189 -14.646 4.927 1.00 0.00 N ATOM 1285 CA LEU A 91 -0.193 -13.229 4.640 1.00 0.00 C ATOM 1286 C LEU A 91 1.012 -12.356 4.259 1.00 0.00 C ATOM 1287 O LEU A 91 2.007 -12.295 4.960 1.00 0.00 O ATOM 1288 CB LEU A 91 -0.804 -12.728 5.949 1.00 0.00 C ATOM 1289 CG LEU A 91 -1.332 -11.304 5.763 1.00 0.00 C ATOM 1290 CD1 LEU A 91 -2.748 -11.352 5.192 1.00 0.00 C ATOM 1291 CD2 LEU A 91 -1.345 -10.591 7.113 1.00 0.00 C ATOM 0 H LEU A 91 0.408 -14.841 5.904 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.873 -13.174 3.790 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -1.614 -13.388 6.259 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.056 -12.748 6.741 1.00 0.00 H new ATOM 0 HG LEU A 91 -0.686 -10.762 5.072 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -3.122 -10.337 5.060 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -2.735 -11.861 4.228 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -3.399 -11.892 5.879 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -1.721 -9.576 6.985 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.991 -11.132 7.804 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.333 -10.555 7.515 1.00 0.00 H new ATOM 1303 N TYR A 92 0.885 -11.638 3.171 1.00 0.00 N ATOM 1304 CA TYR A 92 1.962 -10.705 2.730 1.00 0.00 C ATOM 1305 C TYR A 92 1.401 -9.278 2.717 1.00 0.00 C ATOM 1306 O TYR A 92 0.257 -9.066 2.366 1.00 0.00 O ATOM 1307 CB TYR A 92 2.355 -11.155 1.322 1.00 0.00 C ATOM 1308 CG TYR A 92 3.179 -12.416 1.414 1.00 0.00 C ATOM 1309 CD1 TYR A 92 2.547 -13.688 1.420 1.00 0.00 C ATOM 1310 CD2 TYR A 92 4.594 -12.325 1.497 1.00 0.00 C ATOM 1311 CE1 TYR A 92 3.332 -14.870 1.508 1.00 0.00 C ATOM 1312 CE2 TYR A 92 5.380 -13.504 1.586 1.00 0.00 C ATOM 1313 CZ TYR A 92 4.749 -14.778 1.592 1.00 0.00 C ATOM 1314 OH TYR A 92 5.511 -15.925 1.679 1.00 0.00 O ATOM 0 H TYR A 92 0.067 -11.661 2.562 1.00 0.00 H new ATOM 0 HA TYR A 92 2.829 -10.716 3.391 1.00 0.00 H new ATOM 0 HB2 TYR A 92 1.462 -11.333 0.722 1.00 0.00 H new ATOM 0 HB3 TYR A 92 2.924 -10.371 0.822 1.00 0.00 H new ATOM 0 HD1 TYR A 92 1.471 -13.757 1.358 1.00 0.00 H new ATOM 0 HD2 TYR A 92 5.073 -11.357 1.492 1.00 0.00 H new ATOM 0 HE1 TYR A 92 2.853 -15.838 1.511 1.00 0.00 H new ATOM 0 HE2 TYR A 92 6.456 -13.433 1.649 1.00 0.00 H new ATOM 0 HH TYR A 92 4.947 -16.671 1.973 1.00 0.00 H new ATOM 1324 N ILE A 93 2.179 -8.309 3.129 1.00 0.00 N ATOM 1325 CA ILE A 93 1.673 -6.900 3.179 1.00 0.00 C ATOM 1326 C ILE A 93 2.099 -6.099 1.954 1.00 0.00 C ATOM 1327 O ILE A 93 3.207 -6.209 1.482 1.00 0.00 O ATOM 1328 CB ILE A 93 2.309 -6.275 4.437 1.00 0.00 C ATOM 1329 CG1 ILE A 93 1.758 -6.940 5.696 1.00 0.00 C ATOM 1330 CG2 ILE A 93 2.000 -4.761 4.508 1.00 0.00 C ATOM 1331 CD1 ILE A 93 2.408 -8.307 5.913 1.00 0.00 C ATOM 0 H ILE A 93 3.145 -8.431 3.434 1.00 0.00 H new ATOM 0 HA ILE A 93 0.583 -6.890 3.201 1.00 0.00 H new ATOM 0 HB ILE A 93 3.387 -6.428 4.376 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.943 -6.303 6.561 1.00 0.00 H new ATOM 0 HG13 ILE A 93 0.678 -7.055 5.610 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.457 -4.338 5.402 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.404 -4.265 3.625 1.00 0.00 H new ATOM 0 HG23 ILE A 93 0.921 -4.611 4.547 1.00 0.00 H new ATOM 0 HD11 ILE A 93 2.002 -8.764 6.815 1.00 0.00 H new ATOM 0 HD12 ILE A 93 2.201 -8.948 5.056 1.00 0.00 H new ATOM 0 HD13 ILE A 93 3.486 -8.184 6.022 1.00 0.00 H new ATOM 1343 N CYS A 94 1.234 -5.240 1.501 1.00 0.00 N ATOM 1344 CA CYS A 94 1.574 -4.341 0.373 1.00 0.00 C ATOM 1345 C CYS A 94 1.707 -2.941 0.967 1.00 0.00 C ATOM 1346 O CYS A 94 0.753 -2.411 1.496 1.00 0.00 O ATOM 1347 CB CYS A 94 0.385 -4.411 -0.578 1.00 0.00 C ATOM 1348 SG CYS A 94 -1.033 -3.560 0.167 1.00 0.00 S ATOM 0 H CYS A 94 0.291 -5.123 1.872 1.00 0.00 H new ATOM 0 HA CYS A 94 2.493 -4.604 -0.151 1.00 0.00 H new ATOM 0 HB2 CYS A 94 0.640 -3.949 -1.532 1.00 0.00 H new ATOM 0 HB3 CYS A 94 0.132 -5.451 -0.785 1.00 0.00 H new ATOM 1353 N LYS A 95 2.869 -2.346 0.918 1.00 0.00 N ATOM 1354 CA LYS A 95 3.029 -0.991 1.525 1.00 0.00 C ATOM 1355 C LYS A 95 3.256 0.043 0.436 1.00 0.00 C ATOM 1356 O LYS A 95 3.905 -0.230 -0.551 1.00 0.00 O ATOM 1357 CB LYS A 95 4.249 -1.105 2.432 1.00 0.00 C ATOM 1358 CG LYS A 95 3.966 -2.098 3.563 1.00 0.00 C ATOM 1359 CD LYS A 95 4.218 -1.411 4.898 1.00 0.00 C ATOM 1360 CE LYS A 95 3.926 -2.383 6.043 1.00 0.00 C ATOM 1361 NZ LYS A 95 4.849 -1.981 7.144 1.00 0.00 N ATOM 0 H LYS A 95 3.708 -2.735 0.488 1.00 0.00 H new ATOM 0 HA LYS A 95 2.145 -0.675 2.079 1.00 0.00 H new ATOM 0 HB2 LYS A 95 5.113 -1.434 1.855 1.00 0.00 H new ATOM 0 HB3 LYS A 95 4.497 -0.128 2.847 1.00 0.00 H new ATOM 0 HG2 LYS A 95 2.935 -2.448 3.508 1.00 0.00 H new ATOM 0 HG3 LYS A 95 4.606 -2.975 3.464 1.00 0.00 H new ATOM 0 HD2 LYS A 95 5.252 -1.070 4.953 1.00 0.00 H new ATOM 0 HD3 LYS A 95 3.586 -0.528 4.988 1.00 0.00 H new ATOM 0 HE2 LYS A 95 2.885 -2.318 6.359 1.00 0.00 H new ATOM 0 HE3 LYS A 95 4.103 -3.415 5.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 4.893 -2.739 7.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 5.800 -1.814 6.757 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 4.499 -1.109 7.590 1.00 0.00 H new ATOM 1375 N VAL A 96 2.707 1.218 0.598 1.00 0.00 N ATOM 1376 CA VAL A 96 2.876 2.272 -0.442 1.00 0.00 C ATOM 1377 C VAL A 96 3.036 3.629 0.242 1.00 0.00 C ATOM 1378 O VAL A 96 2.076 4.188 0.755 1.00 0.00 O ATOM 1379 CB VAL A 96 1.579 2.247 -1.257 1.00 0.00 C ATOM 1380 CG1 VAL A 96 1.775 3.055 -2.540 1.00 0.00 C ATOM 1381 CG2 VAL A 96 1.187 0.805 -1.620 1.00 0.00 C ATOM 0 H VAL A 96 2.149 1.492 1.406 1.00 0.00 H new ATOM 0 HA VAL A 96 3.751 2.104 -1.070 1.00 0.00 H new ATOM 0 HB VAL A 96 0.781 2.682 -0.655 1.00 0.00 H new ATOM 0 HG11 VAL A 96 0.854 3.040 -3.124 1.00 0.00 H new ATOM 0 HG12 VAL A 96 2.027 4.085 -2.287 1.00 0.00 H new ATOM 0 HG13 VAL A 96 2.583 2.617 -3.126 1.00 0.00 H new ATOM 0 HG21 VAL A 96 0.263 0.814 -2.198 1.00 0.00 H new ATOM 0 HG22 VAL A 96 1.981 0.350 -2.212 1.00 0.00 H new ATOM 0 HG23 VAL A 96 1.038 0.228 -0.707 1.00 0.00 H new ATOM 1391 N GLU A 97 4.233 4.165 0.269 1.00 0.00 N ATOM 1392 CA GLU A 97 4.433 5.481 0.941 1.00 0.00 C ATOM 1393 C GLU A 97 5.157 6.471 0.046 1.00 0.00 C ATOM 1394 O GLU A 97 6.264 6.227 -0.394 1.00 0.00 O ATOM 1395 CB GLU A 97 5.327 5.201 2.150 1.00 0.00 C ATOM 1396 CG GLU A 97 4.637 4.220 3.103 1.00 0.00 C ATOM 1397 CD GLU A 97 5.153 2.801 2.846 1.00 0.00 C ATOM 1398 OE1 GLU A 97 4.741 2.209 1.863 1.00 0.00 O ATOM 1399 OE2 GLU A 97 5.954 2.332 3.637 1.00 0.00 O ATOM 0 H GLU A 97 5.070 3.751 -0.141 1.00 0.00 H new ATOM 0 HA GLU A 97 3.466 5.912 1.201 1.00 0.00 H new ATOM 0 HB2 GLU A 97 6.280 4.788 1.819 1.00 0.00 H new ATOM 0 HB3 GLU A 97 5.547 6.132 2.672 1.00 0.00 H new ATOM 0 HG2 GLU A 97 4.830 4.506 4.137 1.00 0.00 H new ATOM 0 HG3 GLU A 97 3.557 4.256 2.959 1.00 0.00 H new ATOM 1406 N LEU A 98 4.575 7.616 -0.157 1.00 0.00 N ATOM 1407 CA LEU A 98 5.267 8.661 -0.944 1.00 0.00 C ATOM 1408 C LEU A 98 6.206 9.308 0.063 1.00 0.00 C ATOM 1409 O LEU A 98 5.925 10.351 0.628 1.00 0.00 O ATOM 1410 CB LEU A 98 4.176 9.639 -1.398 1.00 0.00 C ATOM 1411 CG LEU A 98 3.037 8.875 -2.086 1.00 0.00 C ATOM 1412 CD1 LEU A 98 1.924 9.858 -2.444 1.00 0.00 C ATOM 1413 CD2 LEU A 98 3.557 8.171 -3.348 1.00 0.00 C ATOM 0 H LEU A 98 3.650 7.871 0.189 1.00 0.00 H new ATOM 0 HA LEU A 98 5.815 8.313 -1.820 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.789 10.189 -0.540 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.598 10.374 -2.084 1.00 0.00 H new ATOM 0 HG LEU A 98 2.645 8.115 -1.410 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.110 9.323 -2.934 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.552 10.333 -1.536 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.315 10.620 -3.118 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.739 7.632 -3.827 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.958 8.912 -4.039 1.00 0.00 H new ATOM 0 HD23 LEU A 98 4.344 7.468 -3.074 1.00 0.00 H new ATOM 1425 N MET A 99 7.278 8.631 0.358 1.00 0.00 N ATOM 1426 CA MET A 99 8.218 9.117 1.411 1.00 0.00 C ATOM 1427 C MET A 99 9.178 10.199 0.905 1.00 0.00 C ATOM 1428 O MET A 99 9.317 11.238 1.513 1.00 0.00 O ATOM 1429 CB MET A 99 9.003 7.875 1.831 1.00 0.00 C ATOM 1430 CG MET A 99 9.570 8.089 3.236 1.00 0.00 C ATOM 1431 SD MET A 99 9.567 6.519 4.140 1.00 0.00 S ATOM 1432 CE MET A 99 7.771 6.300 4.229 1.00 0.00 C ATOM 0 H MET A 99 7.548 7.754 -0.087 1.00 0.00 H new ATOM 0 HA MET A 99 7.669 9.582 2.230 1.00 0.00 H new ATOM 0 HB2 MET A 99 8.355 6.999 1.817 1.00 0.00 H new ATOM 0 HB3 MET A 99 9.811 7.685 1.125 1.00 0.00 H new ATOM 0 HG2 MET A 99 10.585 8.482 3.173 1.00 0.00 H new ATOM 0 HG3 MET A 99 8.974 8.829 3.770 1.00 0.00 H new ATOM 0 HE1 MET A 99 7.450 6.348 5.269 1.00 0.00 H new ATOM 0 HE2 MET A 99 7.280 7.090 3.661 1.00 0.00 H new ATOM 0 HE3 MET A 99 7.502 5.330 3.811 1.00 0.00 H new ATOM 1442 N TYR A 100 9.870 9.941 -0.178 1.00 0.00 N ATOM 1443 CA TYR A 100 10.850 10.944 -0.686 1.00 0.00 C ATOM 1444 C TYR A 100 10.190 12.283 -1.099 1.00 0.00 C ATOM 1445 O TYR A 100 10.748 13.334 -0.814 1.00 0.00 O ATOM 1446 CB TYR A 100 11.551 10.284 -1.876 1.00 0.00 C ATOM 1447 CG TYR A 100 12.411 9.135 -1.384 1.00 0.00 C ATOM 1448 CD1 TYR A 100 13.734 9.375 -0.918 1.00 0.00 C ATOM 1449 CD2 TYR A 100 11.892 7.811 -1.386 1.00 0.00 C ATOM 1450 CE1 TYR A 100 14.530 8.291 -0.456 1.00 0.00 C ATOM 1451 CE2 TYR A 100 12.687 6.731 -0.922 1.00 0.00 C ATOM 1452 CZ TYR A 100 14.005 6.972 -0.458 1.00 0.00 C ATOM 1453 OH TYR A 100 14.780 5.922 -0.007 1.00 0.00 O ATOM 0 H TYR A 100 9.798 9.085 -0.727 1.00 0.00 H new ATOM 0 HA TYR A 100 11.552 11.212 0.104 1.00 0.00 H new ATOM 0 HB2 TYR A 100 10.813 9.919 -2.590 1.00 0.00 H new ATOM 0 HB3 TYR A 100 12.167 11.015 -2.400 1.00 0.00 H new ATOM 0 HD1 TYR A 100 14.133 10.379 -0.915 1.00 0.00 H new ATOM 0 HD2 TYR A 100 10.889 7.627 -1.742 1.00 0.00 H new ATOM 0 HE1 TYR A 100 15.535 8.471 -0.103 1.00 0.00 H new ATOM 0 HE2 TYR A 100 12.289 5.727 -0.922 1.00 0.00 H new ATOM 0 HH TYR A 100 14.271 5.087 -0.074 1.00 0.00 H new ATOM 1463 N PRO A 101 9.050 12.237 -1.764 1.00 0.00 N ATOM 1464 CA PRO A 101 8.371 13.474 -2.184 1.00 0.00 C ATOM 1465 C PRO A 101 7.477 14.020 -1.071 1.00 0.00 C ATOM 1466 O PRO A 101 6.484 13.389 -0.737 1.00 0.00 O ATOM 1467 CB PRO A 101 7.547 13.039 -3.403 1.00 0.00 C ATOM 1468 CG PRO A 101 7.297 11.576 -3.214 1.00 0.00 C ATOM 1469 CD PRO A 101 8.254 11.074 -2.145 1.00 0.00 C ATOM 0 HA PRO A 101 9.067 14.281 -2.415 1.00 0.00 H new ATOM 0 HB2 PRO A 101 6.610 13.593 -3.462 1.00 0.00 H new ATOM 0 HB3 PRO A 101 8.088 13.228 -4.330 1.00 0.00 H new ATOM 0 HG2 PRO A 101 6.264 11.401 -2.914 1.00 0.00 H new ATOM 0 HG3 PRO A 101 7.453 11.038 -4.149 1.00 0.00 H new ATOM 0 HD2 PRO A 101 7.712 10.671 -1.290 1.00 0.00 H new ATOM 0 HD3 PRO A 101 8.886 10.273 -2.528 1.00 0.00 H new ATOM 1477 N PRO A 102 7.829 15.202 -0.523 1.00 0.00 N ATOM 1478 CA PRO A 102 7.070 15.840 0.576 1.00 0.00 C ATOM 1479 C PRO A 102 5.899 16.855 -0.094 1.00 0.00 C ATOM 1480 O PRO A 102 6.279 17.498 -1.014 1.00 0.00 O ATOM 1481 CB PRO A 102 8.105 16.602 1.332 1.00 0.00 C ATOM 1482 CG PRO A 102 9.129 16.962 0.300 1.00 0.00 C ATOM 1483 CD PRO A 102 8.981 16.025 -0.874 1.00 0.00 C ATOM 0 HA PRO A 102 6.543 15.141 1.225 1.00 0.00 H new ATOM 0 HB2 PRO A 102 7.682 17.491 1.799 1.00 0.00 H new ATOM 0 HB3 PRO A 102 8.539 15.999 2.129 1.00 0.00 H new ATOM 0 HG2 PRO A 102 8.995 17.995 -0.021 1.00 0.00 H new ATOM 0 HG3 PRO A 102 10.132 16.886 0.720 1.00 0.00 H new ATOM 0 HD2 PRO A 102 8.814 16.571 -1.802 1.00 0.00 H new ATOM 0 HD3 PRO A 102 9.876 15.419 -1.017 1.00 0.00 H new ATOM 1491 N PRO A 103 4.626 17.150 0.577 1.00 0.00 N ATOM 1492 CA PRO A 103 4.807 16.111 1.705 1.00 0.00 C ATOM 1493 C PRO A 103 4.408 14.640 1.416 1.00 0.00 C ATOM 1494 O PRO A 103 3.887 14.280 0.344 1.00 0.00 O ATOM 1495 CB PRO A 103 4.199 16.724 2.937 1.00 0.00 C ATOM 1496 CG PRO A 103 3.208 17.586 2.485 1.00 0.00 C ATOM 1497 CD PRO A 103 3.101 17.102 1.051 1.00 0.00 C ATOM 0 HA PRO A 103 5.873 15.930 1.839 1.00 0.00 H new ATOM 0 HB2 PRO A 103 3.782 15.957 3.589 1.00 0.00 H new ATOM 0 HB3 PRO A 103 4.949 17.262 3.517 1.00 0.00 H new ATOM 0 HG2 PRO A 103 2.274 17.478 3.036 1.00 0.00 H new ATOM 0 HG3 PRO A 103 3.499 18.634 2.554 1.00 0.00 H new ATOM 0 HD2 PRO A 103 2.685 16.097 0.989 1.00 0.00 H new ATOM 0 HD3 PRO A 103 2.464 17.749 0.447 1.00 0.00 H new ATOM 1505 N TYR A 104 4.651 13.738 2.388 1.00 0.00 N ATOM 1506 CA TYR A 104 4.249 12.308 2.186 1.00 0.00 C ATOM 1507 C TYR A 104 2.734 12.135 2.522 1.00 0.00 C ATOM 1508 O TYR A 104 2.306 12.538 3.579 1.00 0.00 O ATOM 1509 CB TYR A 104 5.171 11.459 3.126 1.00 0.00 C ATOM 1510 CG TYR A 104 4.590 10.059 3.376 1.00 0.00 C ATOM 1511 CD1 TYR A 104 3.789 9.377 2.397 1.00 0.00 C ATOM 1512 CD2 TYR A 104 4.889 9.423 4.598 1.00 0.00 C ATOM 1513 CE1 TYR A 104 3.303 8.070 2.672 1.00 0.00 C ATOM 1514 CE2 TYR A 104 4.407 8.117 4.868 1.00 0.00 C ATOM 1515 CZ TYR A 104 3.611 7.443 3.902 1.00 0.00 C ATOM 1516 OH TYR A 104 3.121 6.195 4.180 1.00 0.00 O ATOM 0 H TYR A 104 5.099 13.945 3.281 1.00 0.00 H new ATOM 0 HA TYR A 104 4.372 11.981 1.154 1.00 0.00 H new ATOM 0 HB2 TYR A 104 6.161 11.368 2.680 1.00 0.00 H new ATOM 0 HB3 TYR A 104 5.297 11.976 4.077 1.00 0.00 H new ATOM 0 HD1 TYR A 104 3.557 9.855 1.457 1.00 0.00 H new ATOM 0 HD2 TYR A 104 5.490 9.935 5.335 1.00 0.00 H new ATOM 0 HE1 TYR A 104 2.698 7.555 1.941 1.00 0.00 H new ATOM 0 HE2 TYR A 104 4.644 7.636 5.805 1.00 0.00 H new ATOM 0 HH TYR A 104 3.430 5.912 5.066 1.00 0.00 H new ATOM 1526 N TYR A 105 1.929 11.565 1.632 1.00 0.00 N ATOM 1527 CA TYR A 105 0.463 11.414 1.941 1.00 0.00 C ATOM 1528 C TYR A 105 -0.110 10.160 1.279 1.00 0.00 C ATOM 1529 O TYR A 105 -0.621 10.192 0.174 1.00 0.00 O ATOM 1530 CB TYR A 105 -0.175 12.647 1.324 1.00 0.00 C ATOM 1531 CG TYR A 105 -1.637 12.734 1.700 1.00 0.00 C ATOM 1532 CD1 TYR A 105 -2.022 13.391 2.900 1.00 0.00 C ATOM 1533 CD2 TYR A 105 -2.616 12.169 0.853 1.00 0.00 C ATOM 1534 CE1 TYR A 105 -3.394 13.478 3.251 1.00 0.00 C ATOM 1535 CE2 TYR A 105 -3.994 12.253 1.199 1.00 0.00 C ATOM 1536 CZ TYR A 105 -4.383 12.906 2.400 1.00 0.00 C ATOM 1537 OH TYR A 105 -5.720 12.997 2.737 1.00 0.00 O ATOM 0 H TYR A 105 2.223 11.206 0.724 1.00 0.00 H new ATOM 0 HA TYR A 105 0.280 11.320 3.011 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.347 13.542 1.663 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -0.074 12.611 0.239 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -1.271 13.824 3.544 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -2.318 11.672 -0.059 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -3.688 13.977 4.162 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -4.742 11.822 0.551 1.00 0.00 H new ATOM 0 HH TYR A 105 -6.270 12.778 1.956 1.00 0.00 H new ATOM 1547 N LEU A 106 -0.024 9.054 1.948 1.00 0.00 N ATOM 1548 CA LEU A 106 -0.546 7.771 1.377 1.00 0.00 C ATOM 1549 C LEU A 106 -0.906 6.788 2.492 1.00 0.00 C ATOM 1550 O LEU A 106 -1.375 7.196 3.542 1.00 0.00 O ATOM 1551 CB LEU A 106 0.602 7.240 0.497 1.00 0.00 C ATOM 1552 CG LEU A 106 0.022 6.696 -0.820 1.00 0.00 C ATOM 1553 CD1 LEU A 106 -0.621 7.833 -1.625 1.00 0.00 C ATOM 1554 CD2 LEU A 106 1.124 6.040 -1.648 1.00 0.00 C ATOM 0 H LEU A 106 0.389 8.973 2.877 1.00 0.00 H new ATOM 0 HA LEU A 106 -1.461 7.911 0.802 1.00 0.00 H new ATOM 0 HB2 LEU A 106 1.317 8.037 0.291 1.00 0.00 H new ATOM 0 HB3 LEU A 106 1.144 6.453 1.022 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.739 5.952 -0.584 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -1.028 7.436 -2.555 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -1.424 8.284 -1.041 1.00 0.00 H new ATOM 0 HD13 LEU A 106 0.131 8.589 -1.852 1.00 0.00 H new ATOM 0 HD21 LEU A 106 0.702 5.658 -2.578 1.00 0.00 H new ATOM 0 HD22 LEU A 106 1.896 6.776 -1.874 1.00 0.00 H new ATOM 0 HD23 LEU A 106 1.562 5.217 -1.084 1.00 0.00 H new ATOM 1566 N GLY A 108 -0.723 5.507 2.277 1.00 0.00 N ATOM 1567 CA GLY A 108 -1.098 4.531 3.339 1.00 0.00 C ATOM 1568 C GLY A 108 -0.463 3.164 3.063 1.00 0.00 C ATOM 1569 O GLY A 108 0.361 3.016 2.180 1.00 0.00 O ATOM 0 H GLY A 108 -0.336 5.103 1.424 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -0.772 4.900 4.311 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -2.183 4.432 3.383 1.00 0.00 H new ATOM 1573 N ILE A 109 -0.832 2.173 3.834 1.00 0.00 N ATOM 1574 CA ILE A 109 -0.256 0.813 3.667 1.00 0.00 C ATOM 1575 C ILE A 109 -1.373 -0.229 3.518 1.00 0.00 C ATOM 1576 O ILE A 109 -2.498 -0.004 3.923 1.00 0.00 O ATOM 1577 CB ILE A 109 0.525 0.601 4.949 1.00 0.00 C ATOM 1578 CG1 ILE A 109 1.684 1.582 4.930 1.00 0.00 C ATOM 1579 CG2 ILE A 109 1.055 -0.833 5.027 1.00 0.00 C ATOM 1580 CD1 ILE A 109 2.419 1.503 6.239 1.00 0.00 C ATOM 0 H ILE A 109 -1.520 2.255 4.583 1.00 0.00 H new ATOM 0 HA ILE A 109 0.365 0.713 2.777 1.00 0.00 H new ATOM 0 HB ILE A 109 -0.114 0.763 5.817 1.00 0.00 H new ATOM 0 HG12 ILE A 109 2.359 1.351 4.106 1.00 0.00 H new ATOM 0 HG13 ILE A 109 1.316 2.595 4.766 1.00 0.00 H new ATOM 0 HG21 ILE A 109 1.613 -0.965 5.954 1.00 0.00 H new ATOM 0 HG22 ILE A 109 0.219 -1.532 5.004 1.00 0.00 H new ATOM 0 HG23 ILE A 109 1.712 -1.025 4.178 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.253 2.205 6.231 1.00 0.00 H new ATOM 0 HD12 ILE A 109 1.740 1.755 7.053 1.00 0.00 H new ATOM 0 HD13 ILE A 109 2.798 0.491 6.383 1.00 0.00 H new ATOM 1592 N GLY A 110 -1.059 -1.380 2.980 1.00 0.00 N ATOM 1593 CA GLY A 110 -2.086 -2.448 2.851 1.00 0.00 C ATOM 1594 C GLY A 110 -1.879 -3.412 4.013 1.00 0.00 C ATOM 1595 O GLY A 110 -0.767 -3.830 4.282 1.00 0.00 O ATOM 0 H GLY A 110 -0.134 -1.623 2.625 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -3.089 -2.023 2.877 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -1.985 -2.967 1.898 1.00 0.00 H new ATOM 1599 N ASN A 111 -2.922 -3.739 4.734 1.00 0.00 N ATOM 1600 CA ASN A 111 -2.755 -4.651 5.904 1.00 0.00 C ATOM 1601 C ASN A 111 -2.186 -6.000 5.471 1.00 0.00 C ATOM 1602 O ASN A 111 -1.422 -6.608 6.197 1.00 0.00 O ATOM 1603 CB ASN A 111 -4.134 -4.771 6.546 1.00 0.00 C ATOM 1604 CG ASN A 111 -4.396 -3.497 7.357 1.00 0.00 C ATOM 1605 OD1 ASN A 111 -4.255 -2.398 6.857 1.00 0.00 O ATOM 1606 ND2 ASN A 111 -4.774 -3.622 8.602 1.00 0.00 N ATOM 0 H ASN A 111 -3.875 -3.416 4.564 1.00 0.00 H new ATOM 0 HA ASN A 111 -2.038 -4.259 6.625 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -4.900 -4.899 5.781 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -4.178 -5.648 7.191 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -4.954 -2.792 9.166 1.00 0.00 H new ATOM 1612 N GLY A 112 -2.507 -6.455 4.283 1.00 0.00 N ATOM 1613 CA GLY A 112 -1.919 -7.742 3.815 1.00 0.00 C ATOM 1614 C GLY A 112 -2.947 -8.664 3.165 1.00 0.00 C ATOM 1615 O GLY A 112 -4.118 -8.669 3.490 1.00 0.00 O ATOM 0 H GLY A 112 -3.141 -5.996 3.629 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -1.123 -7.533 3.100 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -1.462 -8.255 4.661 1.00 0.00 H new ATOM 1619 N THR A 113 -2.467 -9.475 2.260 1.00 0.00 N ATOM 1620 CA THR A 113 -3.321 -10.469 1.558 1.00 0.00 C ATOM 1621 C THR A 113 -2.687 -11.840 1.758 1.00 0.00 C ATOM 1622 O THR A 113 -1.476 -11.944 1.862 1.00 0.00 O ATOM 1623 CB THR A 113 -3.249 -10.088 0.076 1.00 0.00 C ATOM 1624 OG1 THR A 113 -3.814 -8.800 -0.108 1.00 0.00 O ATOM 1625 CG2 THR A 113 -4.011 -11.122 -0.767 1.00 0.00 C ATOM 0 H THR A 113 -1.488 -9.487 1.972 1.00 0.00 H new ATOM 0 HA THR A 113 -4.349 -10.486 1.919 1.00 0.00 H new ATOM 0 HB THR A 113 -2.207 -10.073 -0.244 1.00 0.00 H new ATOM 0 HG1 THR A 113 -4.790 -8.858 -0.042 1.00 0.00 H new ATOM 0 HG21 THR A 113 -3.956 -10.845 -1.820 1.00 0.00 H new ATOM 0 HG22 THR A 113 -3.564 -12.106 -0.627 1.00 0.00 H new ATOM 0 HG23 THR A 113 -5.055 -11.149 -0.453 1.00 0.00 H new ATOM 1633 N GLN A 114 -3.463 -12.888 1.789 1.00 0.00 N ATOM 1634 CA GLN A 114 -2.838 -14.228 1.955 1.00 0.00 C ATOM 1635 C GLN A 114 -2.669 -14.898 0.593 1.00 0.00 C ATOM 1636 O GLN A 114 -3.632 -15.145 -0.110 1.00 0.00 O ATOM 1637 CB GLN A 114 -3.767 -15.045 2.852 1.00 0.00 C ATOM 1638 CG GLN A 114 -3.106 -16.403 3.110 1.00 0.00 C ATOM 1639 CD GLN A 114 -3.827 -17.147 4.229 1.00 0.00 C ATOM 1640 OE1 GLN A 114 -4.988 -16.905 4.496 1.00 0.00 O ATOM 1641 NE2 GLN A 114 -3.174 -18.058 4.896 1.00 0.00 N ATOM 0 H GLN A 114 -4.480 -12.877 1.709 1.00 0.00 H new ATOM 0 HA GLN A 114 -1.848 -14.150 2.404 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -3.944 -14.523 3.792 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -4.737 -15.179 2.374 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -3.123 -17.001 2.199 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -2.059 -16.259 3.377 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -2.200 -18.257 4.668 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -3.637 -18.571 5.646 1.00 0.00 H new ATOM 1650 N ILE A 115 -1.450 -15.207 0.226 1.00 0.00 N ATOM 1651 CA ILE A 115 -1.217 -15.879 -1.080 1.00 0.00 C ATOM 1652 C ILE A 115 -1.492 -17.385 -0.912 1.00 0.00 C ATOM 1653 O ILE A 115 -1.173 -17.968 0.113 1.00 0.00 O ATOM 1654 CB ILE A 115 0.252 -15.602 -1.430 1.00 0.00 C ATOM 1655 CG1 ILE A 115 0.444 -14.097 -1.643 1.00 0.00 C ATOM 1656 CG2 ILE A 115 0.628 -16.343 -2.716 1.00 0.00 C ATOM 1657 CD1 ILE A 115 1.937 -13.767 -1.696 1.00 0.00 C ATOM 0 H ILE A 115 -0.611 -15.022 0.776 1.00 0.00 H new ATOM 0 HA ILE A 115 -1.868 -15.517 -1.876 1.00 0.00 H new ATOM 0 HB ILE A 115 0.888 -15.947 -0.615 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -0.039 -13.787 -2.570 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.032 -13.542 -0.834 1.00 0.00 H new ATOM 0 HG21 ILE A 115 1.671 -16.143 -2.959 1.00 0.00 H new ATOM 0 HG22 ILE A 115 0.488 -17.414 -2.573 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -0.007 -16.000 -3.533 1.00 0.00 H new ATOM 0 HD11 ILE A 115 2.068 -12.696 -1.848 1.00 0.00 H new ATOM 0 HD12 ILE A 115 2.408 -14.061 -0.758 1.00 0.00 H new ATOM 0 HD13 ILE A 115 2.400 -14.309 -2.520 1.00 0.00 H new ATOM 1669 N TYR A 116 -2.114 -17.997 -1.891 1.00 0.00 N ATOM 1670 CA TYR A 116 -2.471 -19.450 -1.791 1.00 0.00 C ATOM 1671 C TYR A 116 -1.841 -20.276 -2.904 1.00 0.00 C ATOM 1672 O TYR A 116 -1.642 -19.803 -4.008 1.00 0.00 O ATOM 1673 CB TYR A 116 -3.992 -19.502 -1.994 1.00 0.00 C ATOM 1674 CG TYR A 116 -4.676 -18.701 -0.923 1.00 0.00 C ATOM 1675 CD1 TYR A 116 -4.490 -19.055 0.442 1.00 0.00 C ATOM 1676 CD2 TYR A 116 -5.497 -17.583 -1.263 1.00 0.00 C ATOM 1677 CE1 TYR A 116 -5.116 -18.294 1.463 1.00 0.00 C ATOM 1678 CE2 TYR A 116 -6.103 -16.841 -0.252 1.00 0.00 C ATOM 1679 CZ TYR A 116 -5.921 -17.180 1.116 1.00 0.00 C ATOM 1680 OH TYR A 116 -6.539 -16.437 2.104 1.00 0.00 O ATOM 0 H TYR A 116 -2.393 -17.549 -2.764 1.00 0.00 H new ATOM 0 HA TYR A 116 -2.124 -19.852 -0.839 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -4.251 -19.108 -2.977 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -4.337 -20.536 -1.964 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -3.873 -19.902 0.701 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -5.647 -17.314 -2.298 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -4.980 -18.562 2.500 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -6.721 -15.994 -0.512 1.00 0.00 H new ATOM 0 HH TYR A 116 -6.097 -16.603 2.963 1.00 0.00 H new ATOM 1690 N VAL A 117 -1.608 -21.535 -2.639 1.00 0.00 N ATOM 1691 CA VAL A 117 -1.084 -22.430 -3.701 1.00 0.00 C ATOM 1692 C VAL A 117 -2.295 -22.954 -4.469 1.00 0.00 C ATOM 1693 O VAL A 117 -3.422 -22.772 -4.043 1.00 0.00 O ATOM 1694 CB VAL A 117 -0.342 -23.573 -2.993 1.00 0.00 C ATOM 1695 CG1 VAL A 117 -1.289 -24.316 -2.035 1.00 0.00 C ATOM 1696 CG2 VAL A 117 0.198 -24.548 -4.053 1.00 0.00 C ATOM 0 H VAL A 117 -1.759 -21.978 -1.733 1.00 0.00 H new ATOM 0 HA VAL A 117 -0.404 -21.933 -4.392 1.00 0.00 H new ATOM 0 HB VAL A 117 0.483 -23.162 -2.411 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -0.748 -25.123 -1.541 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -1.667 -23.621 -1.285 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -2.124 -24.731 -2.599 1.00 0.00 H new ATOM 0 HG21 VAL A 117 0.727 -25.364 -3.561 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -0.632 -24.951 -4.633 1.00 0.00 H new ATOM 0 HG23 VAL A 117 0.882 -24.021 -4.717 1.00 0.00 H new ATOM 1706 N ILE A 118 -2.089 -23.580 -5.586 1.00 0.00 N ATOM 1707 CA ILE A 118 -3.243 -24.089 -6.372 1.00 0.00 C ATOM 1708 C ILE A 118 -3.497 -25.570 -6.073 1.00 0.00 C ATOM 1709 O ILE A 118 -2.691 -26.427 -6.382 1.00 0.00 O ATOM 1710 CB ILE A 118 -2.816 -23.872 -7.820 1.00 0.00 C ATOM 1711 CG1 ILE A 118 -2.556 -22.379 -8.080 1.00 0.00 C ATOM 1712 CG2 ILE A 118 -3.904 -24.375 -8.773 1.00 0.00 C ATOM 1713 CD1 ILE A 118 -3.782 -21.560 -7.682 1.00 0.00 C ATOM 0 H ILE A 118 -1.171 -23.763 -5.992 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.179 -23.583 -6.135 1.00 0.00 H new ATOM 0 HB ILE A 118 -1.897 -24.431 -7.997 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -1.687 -22.048 -7.512 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -2.328 -22.219 -9.134 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -3.588 -24.215 -9.804 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.070 -25.439 -8.606 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -4.830 -23.830 -8.589 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -3.590 -20.503 -7.869 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -4.641 -21.882 -8.270 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -3.991 -21.709 -6.623 1.00 0.00 H new ATOM 1725 N ASP A 119 -4.623 -25.865 -5.475 1.00 0.00 N ATOM 1726 CA ASP A 119 -4.964 -27.280 -5.147 1.00 0.00 C ATOM 1727 C ASP A 119 -6.461 -27.531 -5.415 1.00 0.00 C ATOM 1728 O ASP A 119 -7.296 -26.830 -4.878 1.00 0.00 O ATOM 1729 CB ASP A 119 -4.658 -27.422 -3.652 1.00 0.00 C ATOM 1730 CG ASP A 119 -4.868 -28.874 -3.199 1.00 0.00 C ATOM 1731 OD1 ASP A 119 -5.439 -29.646 -3.956 1.00 0.00 O ATOM 1732 OD2 ASP A 119 -4.453 -29.190 -2.096 1.00 0.00 O ATOM 0 H ASP A 119 -5.326 -25.179 -5.198 1.00 0.00 H new ATOM 0 HA ASP A 119 -4.403 -27.996 -5.748 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -3.630 -27.117 -3.454 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -5.304 -26.758 -3.077 1.00 0.00 H new ATOM 1737 N PRO A 120 -6.768 -28.514 -6.239 1.00 0.00 N ATOM 1738 CA PRO A 120 -8.192 -28.813 -6.548 1.00 0.00 C ATOM 1739 C PRO A 120 -8.895 -29.412 -5.327 1.00 0.00 C ATOM 1740 O PRO A 120 -8.261 -29.951 -4.439 1.00 0.00 O ATOM 1741 CB PRO A 120 -8.111 -29.829 -7.685 1.00 0.00 C ATOM 1742 CG PRO A 120 -6.771 -30.472 -7.529 1.00 0.00 C ATOM 1743 CD PRO A 120 -5.856 -29.430 -6.945 1.00 0.00 C ATOM 0 HA PRO A 120 -8.764 -27.925 -6.818 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -8.913 -30.564 -7.616 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -8.206 -29.344 -8.656 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -6.833 -31.342 -6.876 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -6.395 -30.822 -8.491 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -5.129 -29.873 -6.265 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -5.292 -28.913 -7.721 1.00 0.00 H new ATOM 1751 N GLU A 121 -10.201 -29.324 -5.280 1.00 0.00 N ATOM 1752 CA GLU A 121 -10.955 -29.890 -4.121 1.00 0.00 C ATOM 1753 C GLU A 121 -11.534 -31.269 -4.491 1.00 0.00 C ATOM 1754 O GLU A 121 -12.309 -31.370 -5.421 1.00 0.00 O ATOM 1755 CB GLU A 121 -12.083 -28.891 -3.863 1.00 0.00 C ATOM 1756 CG GLU A 121 -11.488 -27.547 -3.439 1.00 0.00 C ATOM 1757 CD GLU A 121 -12.609 -26.519 -3.278 1.00 0.00 C ATOM 1758 OE1 GLU A 121 -13.299 -26.266 -4.252 1.00 0.00 O ATOM 1759 OE2 GLU A 121 -12.758 -26.002 -2.183 1.00 0.00 O ATOM 0 H GLU A 121 -10.778 -28.883 -5.996 1.00 0.00 H new ATOM 0 HA GLU A 121 -10.324 -30.032 -3.244 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -12.685 -28.766 -4.763 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -12.747 -29.269 -3.085 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -10.945 -27.658 -2.501 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -10.770 -27.204 -4.184 1.00 0.00 H new ATOM 1766 N PRO A 122 -11.144 -32.298 -3.762 1.00 0.00 N ATOM 1767 CA PRO A 122 -11.656 -33.662 -4.060 1.00 0.00 C ATOM 1768 C PRO A 122 -13.144 -33.786 -3.704 1.00 0.00 C ATOM 1769 O PRO A 122 -13.827 -34.672 -4.183 1.00 0.00 O ATOM 1770 CB PRO A 122 -10.808 -34.570 -3.172 1.00 0.00 C ATOM 1771 CG PRO A 122 -10.351 -33.694 -2.052 1.00 0.00 C ATOM 1772 CD PRO A 122 -10.218 -32.304 -2.616 1.00 0.00 C ATOM 0 HA PRO A 122 -11.583 -33.914 -5.118 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -11.389 -35.414 -2.801 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -9.962 -34.982 -3.722 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -11.067 -33.711 -1.230 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -9.399 -34.042 -1.652 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -10.488 -31.546 -1.880 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -9.195 -32.095 -2.928 1.00 0.00 H new ATOM 1780 N CYS A 123 -13.650 -32.913 -2.865 1.00 0.00 N ATOM 1781 CA CYS A 123 -15.091 -32.994 -2.478 1.00 0.00 C ATOM 1782 C CYS A 123 -15.876 -31.802 -3.059 1.00 0.00 C ATOM 1783 O CYS A 123 -15.570 -30.667 -2.751 1.00 0.00 O ATOM 1784 CB CYS A 123 -15.089 -32.930 -0.950 1.00 0.00 C ATOM 1785 SG CYS A 123 -16.779 -33.137 -0.335 1.00 0.00 S ATOM 0 H CYS A 123 -13.127 -32.151 -2.434 1.00 0.00 H new ATOM 0 HA CYS A 123 -15.566 -33.899 -2.856 1.00 0.00 H new ATOM 0 HB2 CYS A 123 -14.445 -33.710 -0.544 1.00 0.00 H new ATOM 0 HB3 CYS A 123 -14.683 -31.975 -0.616 1.00 0.00 H new ATOM 0 HG CYS A 123 -17.279 -31.974 -0.040 1.00 0.00 H new ATOM 1791 N PRO A 124 -16.869 -32.083 -3.881 1.00 0.00 N ATOM 1792 CA PRO A 124 -17.683 -30.989 -4.475 1.00 0.00 C ATOM 1793 C PRO A 124 -18.556 -30.308 -3.409 1.00 0.00 C ATOM 1794 O PRO A 124 -19.128 -29.262 -3.649 1.00 0.00 O ATOM 1795 CB PRO A 124 -18.544 -31.700 -5.515 1.00 0.00 C ATOM 1796 CG PRO A 124 -18.628 -33.114 -5.043 1.00 0.00 C ATOM 1797 CD PRO A 124 -17.338 -33.408 -4.325 1.00 0.00 C ATOM 0 HA PRO A 124 -17.071 -30.196 -4.905 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -19.533 -31.248 -5.585 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -18.095 -31.641 -6.507 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -19.481 -33.250 -4.378 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -18.767 -33.795 -5.883 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -17.495 -34.080 -3.481 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -16.614 -33.888 -4.984 1.00 0.00 H new ATOM 1805 N ASP A 125 -18.671 -30.896 -2.240 1.00 0.00 N ATOM 1806 CA ASP A 125 -19.512 -30.285 -1.168 1.00 0.00 C ATOM 1807 C ASP A 125 -18.894 -30.547 0.212 1.00 0.00 C ATOM 1808 O ASP A 125 -17.783 -31.031 0.320 1.00 0.00 O ATOM 1809 CB ASP A 125 -20.883 -30.967 -1.301 1.00 0.00 C ATOM 1810 CG ASP A 125 -20.774 -32.478 -1.029 1.00 0.00 C ATOM 1811 OD1 ASP A 125 -19.667 -32.958 -0.832 1.00 0.00 O ATOM 1812 OD2 ASP A 125 -21.805 -33.130 -1.029 1.00 0.00 O ATOM 0 H ASP A 125 -18.217 -31.773 -1.985 1.00 0.00 H new ATOM 0 HA ASP A 125 -19.590 -29.202 -1.268 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -21.587 -30.517 -0.601 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -21.280 -30.802 -2.302 1.00 0.00 H new ATOM 1817 N SER A 126 -19.608 -30.229 1.262 1.00 0.00 N ATOM 1818 CA SER A 126 -19.066 -30.455 2.638 1.00 0.00 C ATOM 1819 C SER A 126 -19.003 -31.955 2.940 1.00 0.00 C ATOM 1820 O SER A 126 -19.575 -32.763 2.233 1.00 0.00 O ATOM 1821 CB SER A 126 -20.054 -29.762 3.578 1.00 0.00 C ATOM 1822 OG SER A 126 -21.319 -30.404 3.488 1.00 0.00 O ATOM 0 H SER A 126 -20.543 -29.823 1.227 1.00 0.00 H new ATOM 0 HA SER A 126 -18.055 -30.063 2.751 1.00 0.00 H new ATOM 0 HB2 SER A 126 -19.686 -29.801 4.603 1.00 0.00 H new ATOM 0 HB3 SER A 126 -20.148 -28.709 3.313 1.00 0.00 H new ATOM 0 HG SER A 126 -21.953 -29.963 4.091 1.00 0.00 H new ATOM 1828 N ASP A 127 -18.305 -32.329 3.982 1.00 0.00 N ATOM 1829 CA ASP A 127 -18.193 -33.776 4.335 1.00 0.00 C ATOM 1830 C ASP A 127 -18.274 -33.961 5.853 1.00 0.00 C ATOM 1831 O ASP A 127 -18.052 -33.037 6.613 1.00 0.00 O ATOM 1832 CB ASP A 127 -16.818 -34.204 3.816 1.00 0.00 C ATOM 1833 CG ASP A 127 -16.697 -35.733 3.849 1.00 0.00 C ATOM 1834 OD1 ASP A 127 -17.722 -36.396 3.818 1.00 0.00 O ATOM 1835 OD2 ASP A 127 -15.578 -36.215 3.906 1.00 0.00 O ATOM 0 H ASP A 127 -17.807 -31.693 4.605 1.00 0.00 H new ATOM 0 HA ASP A 127 -18.997 -34.370 3.901 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -16.676 -33.842 2.798 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -16.034 -33.756 4.426 1.00 0.00 H new ATOM 1840 N GLN A 128 -18.593 -35.151 6.295 1.00 0.00 N ATOM 1841 CA GLN A 128 -18.695 -35.410 7.765 1.00 0.00 C ATOM 1842 C GLN A 128 -17.327 -35.242 8.432 1.00 0.00 C ATOM 1843 O GLN A 128 -17.230 -34.803 9.562 1.00 0.00 O ATOM 1844 CB GLN A 128 -19.175 -36.859 7.887 1.00 0.00 C ATOM 1845 CG GLN A 128 -20.577 -36.991 7.283 1.00 0.00 C ATOM 1846 CD GLN A 128 -21.570 -36.151 8.091 1.00 0.00 C ATOM 1847 OE1 GLN A 128 -21.338 -35.859 9.248 1.00 0.00 O ATOM 1848 NE2 GLN A 128 -22.675 -35.748 7.526 1.00 0.00 N ATOM 0 H GLN A 128 -18.788 -35.957 5.701 1.00 0.00 H new ATOM 0 HA GLN A 128 -19.375 -34.714 8.255 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -18.483 -37.526 7.373 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -19.190 -37.160 8.934 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -20.568 -36.661 6.244 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -20.886 -38.036 7.283 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -22.870 -35.993 6.555 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -23.344 -35.188 8.055 1.00 0.00 H new ATOM 1857 N GLU A 129 -16.271 -35.593 7.741 1.00 0.00 N ATOM 1858 CA GLU A 129 -14.905 -35.460 8.334 1.00 0.00 C ATOM 1859 C GLU A 129 -14.444 -33.991 8.284 1.00 0.00 C ATOM 1860 O GLU A 129 -14.524 -33.365 7.246 1.00 0.00 O ATOM 1861 CB GLU A 129 -14.004 -36.330 7.456 1.00 0.00 C ATOM 1862 CG GLU A 129 -12.587 -36.347 8.036 1.00 0.00 C ATOM 1863 CD GLU A 129 -11.707 -37.296 7.218 1.00 0.00 C ATOM 1864 OE1 GLU A 129 -12.231 -38.278 6.717 1.00 0.00 O ATOM 1865 OE2 GLU A 129 -10.523 -37.025 7.108 1.00 0.00 O ATOM 0 H GLU A 129 -16.296 -35.966 6.792 1.00 0.00 H new ATOM 0 HA GLU A 129 -14.879 -35.768 9.379 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -14.399 -37.345 7.404 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -13.987 -35.942 6.438 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -12.166 -35.342 8.022 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -12.614 -36.667 9.078 1.00 0.00 H new ATOM 1872 N PRO A 130 -13.972 -33.475 9.404 1.00 0.00 N ATOM 1873 CA PRO A 130 -13.506 -32.064 9.440 1.00 0.00 C ATOM 1874 C PRO A 130 -12.208 -31.908 8.641 1.00 0.00 C ATOM 1875 O PRO A 130 -11.504 -32.869 8.394 1.00 0.00 O ATOM 1876 CB PRO A 130 -13.271 -31.796 10.924 1.00 0.00 C ATOM 1877 CG PRO A 130 -13.021 -33.141 11.522 1.00 0.00 C ATOM 1878 CD PRO A 130 -13.821 -34.129 10.716 1.00 0.00 C ATOM 0 HA PRO A 130 -14.219 -31.368 8.998 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -12.420 -31.132 11.076 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -14.136 -31.315 11.381 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -11.959 -33.387 11.492 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -13.323 -33.161 12.569 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -13.305 -35.085 10.629 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -14.788 -34.330 11.176 1.00 0.00 H new ATOM 1886 N LYS A 131 -11.890 -30.703 8.240 1.00 0.00 N ATOM 1887 CA LYS A 131 -10.637 -30.475 7.458 1.00 0.00 C ATOM 1888 C LYS A 131 -9.927 -29.213 7.957 1.00 0.00 C ATOM 1889 O LYS A 131 -8.792 -29.258 8.388 1.00 0.00 O ATOM 1890 CB LYS A 131 -11.100 -30.292 6.013 1.00 0.00 C ATOM 1891 CG LYS A 131 -11.742 -31.589 5.514 1.00 0.00 C ATOM 1892 CD LYS A 131 -12.114 -31.440 4.038 1.00 0.00 C ATOM 1893 CE LYS A 131 -13.245 -30.419 3.895 1.00 0.00 C ATOM 1894 NZ LYS A 131 -13.455 -30.282 2.427 1.00 0.00 N ATOM 0 H LYS A 131 -12.445 -29.866 8.421 1.00 0.00 H new ATOM 0 HA LYS A 131 -9.931 -31.299 7.558 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -11.816 -29.472 5.950 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -10.254 -30.026 5.380 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -11.051 -32.422 5.643 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -12.631 -31.817 6.103 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -11.245 -31.118 3.464 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -12.426 -32.402 3.632 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -14.152 -30.762 4.393 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -12.975 -29.464 4.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -14.217 -29.597 2.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -12.577 -29.948 1.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -13.718 -31.205 2.026 1.00 0.00 H new TER 1908 LYS A 131 HETATM 1909 C1 NAG A 132 -3.952 -4.339 9.561 1.00 0.00 C HETATM 1910 C2 NAG A 132 -2.709 -3.518 9.918 1.00 0.00 C HETATM 1911 C3 NAG A 132 -1.887 -4.232 10.987 1.00 0.00 C HETATM 1912 C4 NAG A 132 -2.751 -4.647 12.172 1.00 0.00 C HETATM 1913 C5 NAG A 132 -3.994 -5.396 11.703 1.00 0.00 C HETATM 1914 C6 NAG A 132 -4.951 -5.670 12.847 1.00 0.00 C HETATM 1915 C7 NAG A 132 -1.831 -2.157 8.149 1.00 0.00 C HETATM 1916 C8 NAG A 132 -0.796 -1.977 7.045 1.00 0.00 C HETATM 1917 N2 NAG A 132 -1.881 -3.322 8.743 1.00 0.00 N HETATM 1918 O3 NAG A 132 -0.845 -3.378 11.436 1.00 0.00 O HETATM 1919 O4 NAG A 132 -1.986 -5.501 13.043 1.00 0.00 O HETATM 1920 O5 NAG A 132 -4.718 -4.617 10.735 1.00 0.00 O HETATM 1921 O6 NAG A 132 -4.890 -7.071 13.225 1.00 0.00 O HETATM 1922 O7 NAG A 132 -2.583 -1.257 8.466 1.00 0.00 O HETATM 0 HO3 NAG A 132 -0.396 -3.787 12.205 1.00 0.00 H new HETATM 0 HN2 NAG A 132 -1.332 -4.100 8.376 1.00 0.00 H new HETATM 0 H83 NAG A 132 0.202 -2.137 7.453 1.00 0.00 H new HETATM 0 H82 NAG A 132 -0.983 -2.699 6.250 1.00 0.00 H new HETATM 0 H81 NAG A 132 -0.866 -0.967 6.642 1.00 0.00 H new HETATM 0 H62 NAG A 132 -4.697 -5.043 13.702 1.00 0.00 H new HETATM 0 H61 NAG A 132 -5.967 -5.409 12.552 1.00 0.00 H new HETATM 0 H5 NAG A 132 -3.642 -6.335 11.275 1.00 0.00 H new HETATM 0 H4 NAG A 132 -3.064 -3.748 12.703 1.00 0.00 H new HETATM 0 H3 NAG A 132 -1.466 -5.134 10.542 1.00 0.00 H new HETATM 0 H2 NAG A 132 -3.040 -2.552 10.299 1.00 0.00 H new HETATM 1935 C1 NAG A 133 -1.478 -4.922 14.194 1.00 0.00 C HETATM 1936 C2 NAG A 133 -1.234 -6.008 15.239 1.00 0.00 C HETATM 1937 C3 NAG A 133 -0.546 -5.426 16.469 1.00 0.00 C HETATM 1938 C4 NAG A 133 0.698 -4.644 16.063 1.00 0.00 C HETATM 1939 C5 NAG A 133 0.355 -3.621 14.983 1.00 0.00 C HETATM 1940 C6 NAG A 133 1.584 -2.895 14.471 1.00 0.00 C HETATM 1941 C7 NAG A 133 -2.525 -7.827 16.095 1.00 0.00 C HETATM 1942 C8 NAG A 133 -3.883 -8.389 16.482 1.00 0.00 C HETATM 1943 N2 NAG A 133 -2.496 -6.609 15.624 1.00 0.00 N HETATM 1944 O3 NAG A 133 -0.181 -6.476 17.352 1.00 0.00 O HETATM 1945 O4 NAG A 133 1.243 -3.970 17.213 1.00 0.00 O HETATM 1946 O5 NAG A 133 -0.251 -4.274 13.854 1.00 0.00 O HETATM 1947 O6 NAG A 133 1.333 -1.506 14.316 1.00 0.00 O HETATM 1948 O7 NAG A 133 -1.509 -8.482 16.217 1.00 0.00 O HETATM 0 HO6 NAG A 133 2.142 -1.062 13.986 1.00 0.00 H new HETATM 0 HO3 NAG A 133 -0.247 -7.335 16.884 1.00 0.00 H new HETATM 0 HN2 NAG A 133 -3.363 -6.080 15.527 1.00 0.00 H new HETATM 0 H83 NAG A 133 -4.327 -7.766 17.259 1.00 0.00 H new HETATM 0 H82 NAG A 133 -4.535 -8.399 15.608 1.00 0.00 H new HETATM 0 H81 NAG A 133 -3.763 -9.405 16.857 1.00 0.00 H new HETATM 0 H62 NAG A 133 2.412 -3.042 15.165 1.00 0.00 H new HETATM 0 H61 NAG A 133 1.889 -3.321 13.515 1.00 0.00 H new HETATM 0 H5 NAG A 133 -0.326 -2.905 15.444 1.00 0.00 H new HETATM 0 H4 NAG A 133 1.436 -5.340 15.665 1.00 0.00 H new HETATM 0 H3 NAG A 133 -1.238 -4.749 16.971 1.00 0.00 H new HETATM 0 H2 NAG A 133 -0.585 -6.768 14.804 1.00 0.00 H new HETATM 1962 C1 FUL A 134 -6.101 -7.747 13.052 1.00 0.00 C HETATM 1963 C2 FUL A 134 -5.867 -9.255 13.151 1.00 0.00 C HETATM 1964 O2 FUL A 134 -5.382 -9.606 14.440 1.00 0.00 O HETATM 1965 C3 FUL A 134 -7.168 -10.007 12.876 1.00 0.00 C HETATM 1966 O3 FUL A 134 -6.913 -11.404 12.859 1.00 0.00 O HETATM 1967 C4 FUL A 134 -7.749 -9.577 11.535 1.00 0.00 C HETATM 1968 O4 FUL A 134 -6.900 -10.025 10.489 1.00 0.00 O HETATM 1969 C5 FUL A 134 -7.880 -8.054 11.464 1.00 0.00 C HETATM 1970 C6 FUL A 134 -8.296 -7.583 10.087 1.00 0.00 C HETATM 1971 O5 FUL A 134 -6.617 -7.443 11.763 1.00 0.00 O HETATM 0 HO4 FUL A 134 -7.434 -10.197 9.685 1.00 0.00 H new HETATM 0 HO3 FUL A 134 -6.838 -11.712 11.932 1.00 0.00 H new HETATM 0 HO2 FUL A 134 -5.714 -10.495 14.684 1.00 0.00 H new HETATM 0 H63 FUL A 134 -7.550 -7.894 9.355 1.00 0.00 H new HETATM 0 H62 FUL A 134 -9.261 -8.019 9.829 1.00 0.00 H new HETATM 0 H61 FUL A 134 -8.377 -6.496 10.083 1.00 0.00 H new HETATM 0 H5 FUL A 134 -8.644 -7.769 12.188 1.00 0.00 H new HETATM 0 H4 FUL A 134 -8.740 -10.018 11.427 1.00 0.00 H new HETATM 0 H3 FUL A 134 -7.886 -9.776 13.663 1.00 0.00 H new HETATM 0 H2 FUL A 134 -5.121 -9.533 12.406 1.00 0.00 H new HETATM 1983 C1 BMA A 135 2.294 -4.606 17.857 1.00 0.00 C HETATM 1984 C2 BMA A 135 3.587 -3.837 17.601 1.00 0.00 C HETATM 1985 C3 BMA A 135 4.735 -4.453 18.392 1.00 0.00 C HETATM 1986 C4 BMA A 135 4.358 -4.574 19.864 1.00 0.00 C HETATM 1987 C5 BMA A 135 3.024 -5.299 20.017 1.00 0.00 C HETATM 1988 C6 BMA A 135 2.552 -5.336 21.458 1.00 0.00 C HETATM 1989 O2 BMA A 135 3.420 -2.480 17.981 1.00 0.00 O HETATM 1990 O3 BMA A 135 5.894 -3.642 18.261 1.00 0.00 O HETATM 1991 O4 BMA A 135 5.370 -5.292 20.556 1.00 0.00 O HETATM 1992 O5 BMA A 135 2.000 -4.633 19.255 1.00 0.00 O HETATM 1993 O6 BMA A 135 1.520 -6.296 21.635 1.00 0.00 O HETATM 0 HO6 BMA A 135 1.235 -6.301 22.573 1.00 0.00 H new HETATM 0 HO4 BMA A 135 5.412 -4.984 21.485 1.00 0.00 H new HETATM 0 HO3 BMA A 135 6.630 -4.039 18.772 1.00 0.00 H new HETATM 0 HO2 BMA A 135 4.287 -2.103 18.239 1.00 0.00 H new HETATM 0 H62 BMA A 135 3.391 -5.575 22.112 1.00 0.00 H new HETATM 0 H61 BMA A 135 2.190 -4.350 21.750 1.00 0.00 H new HETATM 0 H5 BMA A 135 3.189 -6.316 19.660 1.00 0.00 H new HETATM 0 H4 BMA A 135 4.263 -3.573 20.284 1.00 0.00 H new HETATM 0 H3 BMA A 135 4.940 -5.448 17.998 1.00 0.00 H new HETATM 0 H2 BMA A 135 3.823 -3.891 16.538 1.00 0.00 H new HETATM 2005 C1 NAG A 136 0.585 -7.865 -12.282 1.00 0.00 C HETATM 2006 C2 NAG A 136 -0.417 -8.994 -12.529 1.00 0.00 C HETATM 2007 C3 NAG A 136 0.054 -9.896 -13.666 1.00 0.00 C HETATM 2008 C4 NAG A 136 0.366 -9.053 -14.892 1.00 0.00 C HETATM 2009 C5 NAG A 136 1.359 -7.944 -14.535 1.00 0.00 C HETATM 2010 C6 NAG A 136 1.669 -7.034 -15.706 1.00 0.00 C HETATM 2011 C7 NAG A 136 -1.565 -10.635 -11.233 1.00 0.00 C HETATM 2012 C8 NAG A 136 -2.877 -10.139 -10.648 1.00 0.00 C HETATM 2013 N2 NAG A 136 -0.585 -9.777 -11.321 1.00 0.00 N HETATM 2014 O3 NAG A 136 -0.961 -10.839 -13.978 1.00 0.00 O HETATM 2015 O4 NAG A 136 0.851 -9.885 -15.970 1.00 0.00 O HETATM 2016 O5 NAG A 136 0.815 -7.125 -13.486 1.00 0.00 O HETATM 2017 O6 NAG A 136 2.940 -6.383 -15.489 1.00 0.00 O HETATM 2018 O7 NAG A 136 -1.431 -11.784 -11.605 1.00 0.00 O HETATM 0 HO3 NAG A 136 -0.983 -11.536 -13.289 1.00 0.00 H new HETATM 0 HN2 NAG A 136 0.061 -9.658 -10.541 1.00 0.00 H new HETATM 0 H83 NAG A 136 -2.711 -9.785 -9.631 1.00 0.00 H new HETATM 0 H82 NAG A 136 -3.262 -9.322 -11.259 1.00 0.00 H new HETATM 0 H81 NAG A 136 -3.601 -10.954 -10.635 1.00 0.00 H new HETATM 0 H62 NAG A 136 1.697 -7.611 -16.630 1.00 0.00 H new HETATM 0 H61 NAG A 136 0.882 -6.289 -15.819 1.00 0.00 H new HETATM 0 H5 NAG A 136 2.278 -8.442 -14.226 1.00 0.00 H new HETATM 0 H4 NAG A 136 -0.551 -8.576 -15.238 1.00 0.00 H new HETATM 0 H3 NAG A 136 0.955 -10.426 -13.357 1.00 0.00 H new HETATM 0 H2 NAG A 136 -1.372 -8.551 -12.810 1.00 0.00 H new HETATM 2031 C1 NAG A 137 2.186 -10.247 -15.982 1.00 0.00 C HETATM 2032 C2 NAG A 137 2.306 -11.769 -16.012 1.00 0.00 C HETATM 2033 C3 NAG A 137 3.765 -12.188 -16.178 1.00 0.00 C HETATM 2034 C4 NAG A 137 4.404 -11.466 -17.360 1.00 0.00 C HETATM 2035 C5 NAG A 137 4.183 -9.962 -17.251 1.00 0.00 C HETATM 2036 C6 NAG A 137 4.702 -9.222 -18.469 1.00 0.00 C HETATM 2037 C7 NAG A 137 0.950 -13.334 -14.823 1.00 0.00 C HETATM 2038 C8 NAG A 137 1.145 -14.439 -13.797 1.00 0.00 C HETATM 2039 N2 NAG A 137 1.781 -12.330 -14.782 1.00 0.00 N HETATM 2040 O3 NAG A 137 3.836 -13.591 -16.386 1.00 0.00 O HETATM 2041 O4 NAG A 137 5.818 -11.744 -17.389 1.00 0.00 O HETATM 2042 O5 NAG A 137 2.777 -9.675 -17.151 1.00 0.00 O HETATM 2043 O6 NAG A 137 4.203 -9.795 -19.669 1.00 0.00 O HETATM 2044 O7 NAG A 137 0.060 -13.383 -15.648 1.00 0.00 O HETATM 0 HO6 NAG A 137 4.552 -9.298 -20.438 1.00 0.00 H new HETATM 0 HO3 NAG A 137 4.490 -13.785 -17.090 1.00 0.00 H new HETATM 0 HN2 NAG A 137 2.062 -11.938 -13.883 1.00 0.00 H new HETATM 0 H83 NAG A 137 2.136 -14.877 -13.917 1.00 0.00 H new HETATM 0 H82 NAG A 137 1.051 -14.024 -12.793 1.00 0.00 H new HETATM 0 H81 NAG A 137 0.388 -15.209 -13.944 1.00 0.00 H new HETATM 0 H62 NAG A 137 4.408 -8.174 -18.414 1.00 0.00 H new HETATM 0 H61 NAG A 137 5.792 -9.247 -18.476 1.00 0.00 H new HETATM 0 H5 NAG A 137 4.723 -9.632 -16.364 1.00 0.00 H new HETATM 0 H4 NAG A 137 3.940 -11.823 -18.279 1.00 0.00 H new HETATM 0 H3 NAG A 137 4.308 -11.920 -15.272 1.00 0.00 H new HETATM 0 H2 NAG A 137 1.731 -12.143 -16.859 1.00 0.00 H new HETATM 2058 C1 FUC A 138 3.840 -6.535 -16.558 1.00 0.00 C HETATM 2059 C2 FUC A 138 3.352 -5.697 -17.728 1.00 0.00 C HETATM 2060 C3 FUC A 138 3.147 -4.280 -17.197 1.00 0.00 C HETATM 2061 C4 FUC A 138 4.449 -3.753 -16.565 1.00 0.00 C HETATM 2062 C5 FUC A 138 5.085 -4.765 -15.593 1.00 0.00 C HETATM 2063 C6 FUC A 138 6.510 -4.399 -15.226 1.00 0.00 C HETATM 2064 O2 FUC A 138 2.136 -6.216 -18.246 1.00 0.00 O HETATM 2065 O3 FUC A 138 2.762 -3.426 -18.265 1.00 0.00 O HETATM 2066 O4 FUC A 138 5.380 -3.463 -17.597 1.00 0.00 O HETATM 2067 O5 FUC A 138 5.124 -6.065 -16.206 1.00 0.00 O HETATM 0 HO4 FUC A 138 5.966 -2.730 -17.313 1.00 0.00 H new HETATM 0 HO3 FUC A 138 3.563 -3.068 -18.703 1.00 0.00 H new HETATM 0 HO2 FUC A 138 2.266 -7.151 -18.511 1.00 0.00 H new HETATM 0 H63 FUC A 138 7.122 -4.369 -16.128 1.00 0.00 H new HETATM 0 H62 FUC A 138 6.522 -3.420 -14.747 1.00 0.00 H new HETATM 0 H61 FUC A 138 6.912 -5.144 -14.539 1.00 0.00 H new HETATM 0 H5 FUC A 138 4.472 -4.758 -14.692 1.00 0.00 H new HETATM 0 H4 FUC A 138 4.198 -2.858 -15.995 1.00 0.00 H new HETATM 0 H3 FUC A 138 2.366 -4.297 -16.437 1.00 0.00 H new HETATM 0 H2 FUC A 138 4.076 -5.709 -18.542 1.00 0.00 H new HETATM 2079 C1 BMA A 139 6.304 -12.310 -18.556 1.00 0.00 C HETATM 2080 C2 BMA A 139 7.820 -12.137 -18.618 1.00 0.00 C HETATM 2081 C3 BMA A 139 8.392 -12.861 -19.834 1.00 0.00 C HETATM 2082 C4 BMA A 139 7.916 -14.311 -19.863 1.00 0.00 C HETATM 2083 C5 BMA A 139 6.396 -14.368 -19.744 1.00 0.00 C HETATM 2084 C6 BMA A 139 5.861 -15.778 -19.687 1.00 0.00 C HETATM 2085 O2 BMA A 139 8.408 -12.657 -17.434 1.00 0.00 O HETATM 2086 O3 BMA A 139 9.811 -12.827 -19.786 1.00 0.00 O HETATM 2087 O4 BMA A 139 8.321 -14.921 -21.079 1.00 0.00 O HETATM 2088 O5 BMA A 139 5.967 -13.698 -18.546 1.00 0.00 O HETATM 2089 O6 BMA A 139 5.516 -16.250 -20.981 1.00 0.00 O HETATM 0 HO6 BMA A 139 5.174 -17.166 -20.915 1.00 0.00 H new HETATM 0 HO4 BMA A 139 8.310 -15.895 -20.976 1.00 0.00 H new HETATM 0 HO3 BMA A 139 10.176 -13.294 -20.567 1.00 0.00 H new HETATM 0 HO2 BMA A 139 9.303 -13.000 -17.637 1.00 0.00 H new HETATM 0 H62 BMA A 139 6.609 -16.436 -19.245 1.00 0.00 H new HETATM 0 H61 BMA A 139 4.985 -15.811 -19.040 1.00 0.00 H new HETATM 0 H5 BMA A 139 6.008 -13.881 -20.639 1.00 0.00 H new HETATM 0 H4 BMA A 139 8.358 -14.845 -19.022 1.00 0.00 H new HETATM 0 H3 BMA A 139 8.044 -12.359 -20.737 1.00 0.00 H new HETATM 0 H2 BMA A 139 8.047 -11.074 -18.704 1.00 0.00 H new