USER MOD reduce.3.24.130724 H: found=0, std=0, add=1428, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1426 hydrogens (16 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 201 HCS HXT : A 201 HCS OXT : A 201 HCS C :(short bond) USER MOD NoAdj-H: B 201 HCS HXT : B 201 HCS OXT : B 201 HCS C :(short bond) USER MOD Set 1.1: B 34 LYS NZ :NH3+ 141:sc= 0.616! (180deg=0) USER MOD Set 1.2: B 38 GLN :FLIP amide:sc= -0.299! C(o=-16!,f=0.32!) USER MOD Set 2.1: A 82 THR OG1 : rot 89:sc= 0.371 USER MOD Set 2.2: B 8 MET CE :methyl -179:sc= -1.01 (180deg=-0.73) USER MOD Set 3.1: A 34 LYS NZ :NH3+ 146:sc= 0.633! (180deg=0) USER MOD Set 3.2: A 38 GLN :FLIP amide:sc= -0.434 F(o=-16!,f=0.2) USER MOD Set 4.1: A 8 MET CE :methyl -176:sc= -1.08 (180deg=-0.744) USER MOD Set 4.2: B 82 THR OG1 : rot 81:sc= 0.397 USER MOD Single : A 1 GLY N :NH3+ -105:sc= -7.29! (180deg=-11!) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 76:sc= 1 USER MOD Single : A 10 THR OG1 : rot 73:sc= 1.21 USER MOD Single : A 13 ASN : amide:sc= -0.141 K(o=-0.14,f=-1.8!) USER MOD Single : A 16 HIS : no HD1:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 18 HIS :FLIP no HE2:sc= -26! C(o=-27!,f=-26!) USER MOD Single : A 19 SER OG : rot -3:sc= -3.41! USER MOD Single : A 21 LYS NZ :NH3+ 150:sc= -1.04 (180deg=-2.64!) USER MOD Single : A 25 LYS NZ :NH3+ -132:sc= 0.0335 (180deg=0) USER MOD Single : A 26 TYR OH : rot -115:sc= -1.83! USER MOD Single : A 27 LYS NZ :NH3+ -158:sc= -0.508 (180deg=-0.762!) USER MOD Single : A 29 SER OG : rot -111:sc= -2.38 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot -24:sc= 0.7 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.16) USER MOD Single : A 49 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00594) USER MOD Single : A 56 LYS NZ :NH3+ 135:sc= 0.0163 (180deg=0) USER MOD Single : A 58 MET CE :methyl -142:sc= -0.611 (180deg=-3.06!) USER MOD Single : A 59 LYS NZ :NH3+ -170:sc= 0.279 (180deg=0.123) USER MOD Single : A 64 ASN : amide:sc= -5.68! C(o=-5.7!,f=-13!) USER MOD Single : A 72 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 74 TYR OH : rot -165:sc= -0.159 USER MOD Single : A 86 ASN : amide:sc= -0.572 X(o=-0.57,f=-0.99) USER MOD Single : A 87 ASN : amide:sc= -3.83! C(o=-3.8!,f=-9.3!) USER MOD Single : A 92 ASN : amide:sc= -0.929! C(o=-0.93!,f=-4.8!) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : B 1 GLY N :NH3+ -107:sc= -7.39! (180deg=-10.5!) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 6 THR OG1 : rot 75:sc= 1.03 USER MOD Single : B 10 THR OG1 : rot 72:sc= 1.22 USER MOD Single : B 13 ASN : amide:sc= -0.102 K(o=-0.1,f=-1.8!) USER MOD Single : B 16 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD Single : B 18 HIS : no HD1:sc= -26.5! C(o=-27!,f=-26!) USER MOD Single : B 19 SER OG : rot -0:sc= -3.37! USER MOD Single : B 21 LYS NZ :NH3+ 155:sc= -1.08 (180deg=-2.68!) USER MOD Single : B 25 LYS NZ :NH3+ -129:sc= 0.031 (180deg=0) USER MOD Single : B 26 TYR OH : rot -114:sc= -2.01! USER MOD Single : B 27 LYS NZ :NH3+ -166:sc= -0.337 (180deg=-0.507!) USER MOD Single : B 29 SER OG : rot -103:sc= -2.35 USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 THR OG1 : rot -27:sc= 0.645 USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -0.216 X(o=-0.22,f=-0.22) USER MOD Single : B 49 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00466) USER MOD Single : B 56 LYS NZ :NH3+ 135:sc= 0.0178 (180deg=0) USER MOD Single : B 58 MET CE :methyl -143:sc= -0.605 (180deg=-3.05!) USER MOD Single : B 59 LYS NZ :NH3+ -166:sc= 0.283 (180deg=0.126) USER MOD Single : B 64 ASN : amide:sc= -5.69! C(o=-5.7!,f=-12!) USER MOD Single : B 72 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : B 74 TYR OH : rot -165:sc= -0.185 USER MOD Single : B 86 ASN : amide:sc= -0.582 X(o=-0.58,f=-1) USER MOD Single : B 87 ASN : amide:sc= -3.75! C(o=-3.7!,f=-9.7!) USER MOD Single : B 92 ASN : amide:sc= -0.967! C(o=-0.97!,f=-5.2!) USER MOD Single : B 93 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -12.653 3.401 9.881 1.00 0.00 N ATOM 2 CA GLY A 1 -12.471 4.749 10.403 1.00 0.00 C ATOM 3 C GLY A 1 -11.038 5.232 10.208 1.00 0.00 C ATOM 4 O GLY A 1 -10.489 5.178 9.109 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.176 3.444 8.983 1.00 0.00 H new ATOM 0 H2 GLY A 1 -11.724 2.963 9.720 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.190 2.833 10.567 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -13.158 5.431 9.902 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -12.722 4.767 11.464 1.00 0.00 H new ATOM 8 N SER A 2 -10.454 5.721 11.288 1.00 0.00 N ATOM 9 CA SER A 2 -9.090 6.233 11.261 1.00 0.00 C ATOM 10 C SER A 2 -8.055 5.125 11.042 1.00 0.00 C ATOM 11 O SER A 2 -6.899 5.413 10.732 1.00 0.00 O ATOM 12 CB SER A 2 -8.787 6.951 12.576 1.00 0.00 C ATOM 13 OG SER A 2 -8.732 5.998 13.629 1.00 0.00 O ATOM 0 H SER A 2 -10.905 5.775 12.201 1.00 0.00 H new ATOM 0 HA SER A 2 -9.019 6.924 10.421 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.839 7.484 12.503 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.556 7.695 12.783 1.00 0.00 H new ATOM 0 HG SER A 2 -8.536 6.455 14.474 1.00 0.00 H new ATOM 19 N GLU A 3 -8.442 3.868 11.260 1.00 0.00 N ATOM 20 CA GLU A 3 -7.480 2.770 11.136 1.00 0.00 C ATOM 21 C GLU A 3 -6.851 2.668 9.753 1.00 0.00 C ATOM 22 O GLU A 3 -5.642 2.429 9.645 1.00 0.00 O ATOM 23 CB GLU A 3 -8.169 1.442 11.454 1.00 0.00 C ATOM 24 CG GLU A 3 -8.589 1.420 12.920 1.00 0.00 C ATOM 25 CD GLU A 3 -9.224 0.076 13.260 1.00 0.00 C ATOM 26 OE1 GLU A 3 -9.463 -0.693 12.344 1.00 0.00 O ATOM 27 OE2 GLU A 3 -9.463 -0.164 14.432 1.00 0.00 O ATOM 0 H GLU A 3 -9.389 3.588 11.517 1.00 0.00 H new ATOM 0 HA GLU A 3 -6.680 2.984 11.845 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -9.041 1.311 10.814 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -7.494 0.612 11.246 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -7.722 1.594 13.558 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -9.296 2.226 13.116 1.00 0.00 H new ATOM 34 N LEU A 4 -7.623 2.853 8.689 1.00 0.00 N ATOM 35 CA LEU A 4 -7.012 2.757 7.378 1.00 0.00 C ATOM 36 C LEU A 4 -5.983 3.884 7.255 1.00 0.00 C ATOM 37 O LEU A 4 -4.849 3.679 6.803 1.00 0.00 O ATOM 38 CB LEU A 4 -8.086 2.892 6.300 1.00 0.00 C ATOM 39 CG LEU A 4 -7.602 2.276 4.976 1.00 0.00 C ATOM 40 CD1 LEU A 4 -8.657 2.473 3.888 1.00 0.00 C ATOM 41 CD2 LEU A 4 -6.281 2.888 4.526 1.00 0.00 C ATOM 0 H LEU A 4 -8.622 3.060 8.705 1.00 0.00 H new ATOM 0 HA LEU A 4 -6.522 1.792 7.250 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -9.000 2.396 6.626 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -8.329 3.944 6.151 1.00 0.00 H new ATOM 0 HG LEU A 4 -7.444 1.211 5.144 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -8.304 2.033 2.955 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -9.585 1.988 4.189 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -8.835 3.538 3.742 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -5.969 2.430 3.588 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.408 3.961 4.381 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -5.521 2.712 5.287 1.00 0.00 H new ATOM 53 N GLU A 5 -6.371 5.075 7.729 1.00 0.00 N ATOM 54 CA GLU A 5 -5.459 6.210 7.716 1.00 0.00 C ATOM 55 C GLU A 5 -4.292 5.969 8.651 1.00 0.00 C ATOM 56 O GLU A 5 -3.172 6.349 8.347 1.00 0.00 O ATOM 57 CB GLU A 5 -6.173 7.515 8.101 1.00 0.00 C ATOM 58 CG GLU A 5 -7.124 7.951 6.981 1.00 0.00 C ATOM 59 CD GLU A 5 -6.319 8.243 5.714 1.00 0.00 C ATOM 60 OE1 GLU A 5 -5.117 8.418 5.830 1.00 0.00 O ATOM 61 OE2 GLU A 5 -6.910 8.288 4.651 1.00 0.00 O ATOM 0 H GLU A 5 -7.294 5.269 8.118 1.00 0.00 H new ATOM 0 HA GLU A 5 -5.086 6.314 6.697 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -6.731 7.373 9.026 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -5.438 8.298 8.289 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -7.857 7.168 6.787 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -7.679 8.839 7.285 1.00 0.00 H new ATOM 68 N THR A 6 -4.542 5.323 9.782 1.00 0.00 N ATOM 69 CA THR A 6 -3.455 5.052 10.705 1.00 0.00 C ATOM 70 C THR A 6 -2.402 4.219 9.995 1.00 0.00 C ATOM 71 O THR A 6 -1.193 4.463 10.113 1.00 0.00 O ATOM 72 CB THR A 6 -3.977 4.296 11.930 1.00 0.00 C ATOM 73 OG1 THR A 6 -5.045 5.028 12.515 1.00 0.00 O ATOM 74 CG2 THR A 6 -2.849 4.134 12.951 1.00 0.00 C ATOM 0 H THR A 6 -5.459 4.987 10.074 1.00 0.00 H new ATOM 0 HA THR A 6 -3.019 5.993 11.039 1.00 0.00 H new ATOM 0 HB THR A 6 -4.333 3.312 11.626 1.00 0.00 H new ATOM 0 HG1 THR A 6 -5.853 4.920 11.970 1.00 0.00 H new ATOM 0 HG21 THR A 6 -3.222 3.596 13.823 1.00 0.00 H new ATOM 0 HG22 THR A 6 -2.029 3.574 12.502 1.00 0.00 H new ATOM 0 HG23 THR A 6 -2.491 5.117 13.257 1.00 0.00 H new ATOM 82 N ALA A 7 -2.875 3.242 9.226 1.00 0.00 N ATOM 83 CA ALA A 7 -1.961 2.390 8.480 1.00 0.00 C ATOM 84 C ALA A 7 -1.205 3.207 7.442 1.00 0.00 C ATOM 85 O ALA A 7 0.014 3.092 7.317 1.00 0.00 O ATOM 86 CB ALA A 7 -2.740 1.282 7.772 1.00 0.00 C ATOM 0 H ALA A 7 -3.864 3.025 9.106 1.00 0.00 H new ATOM 0 HA ALA A 7 -1.251 1.950 9.181 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -2.048 0.649 7.216 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -3.269 0.680 8.511 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -3.459 1.726 7.083 1.00 0.00 H new ATOM 92 N MET A 8 -1.936 4.050 6.716 1.00 0.00 N ATOM 93 CA MET A 8 -1.314 4.892 5.692 1.00 0.00 C ATOM 94 C MET A 8 -0.256 5.799 6.327 1.00 0.00 C ATOM 95 O MET A 8 0.857 5.968 5.797 1.00 0.00 O ATOM 96 CB MET A 8 -2.422 5.730 5.034 1.00 0.00 C ATOM 97 CG MET A 8 -3.351 4.806 4.226 1.00 0.00 C ATOM 98 SD MET A 8 -4.744 5.747 3.539 1.00 0.00 S ATOM 99 CE MET A 8 -3.856 6.650 2.260 1.00 0.00 C ATOM 0 H MET A 8 -2.944 4.169 6.813 1.00 0.00 H new ATOM 0 HA MET A 8 -0.817 4.277 4.942 1.00 0.00 H new ATOM 0 HB2 MET A 8 -2.992 6.261 5.796 1.00 0.00 H new ATOM 0 HB3 MET A 8 -1.983 6.484 4.381 1.00 0.00 H new ATOM 0 HG2 MET A 8 -2.791 4.333 3.419 1.00 0.00 H new ATOM 0 HG3 MET A 8 -3.725 4.007 4.866 1.00 0.00 H new ATOM 0 HE1 MET A 8 -4.536 7.345 1.767 1.00 0.00 H new ATOM 0 HE2 MET A 8 -3.034 7.206 2.711 1.00 0.00 H new ATOM 0 HE3 MET A 8 -3.460 5.947 1.527 1.00 0.00 H new ATOM 109 N GLU A 9 -0.584 6.335 7.498 1.00 0.00 N ATOM 110 CA GLU A 9 0.357 7.173 8.210 1.00 0.00 C ATOM 111 C GLU A 9 1.560 6.354 8.622 1.00 0.00 C ATOM 112 O GLU A 9 2.682 6.845 8.589 1.00 0.00 O ATOM 113 CB GLU A 9 -0.296 7.806 9.445 1.00 0.00 C ATOM 114 CG GLU A 9 -1.369 8.812 9.014 1.00 0.00 C ATOM 115 CD GLU A 9 -0.738 9.949 8.217 1.00 0.00 C ATOM 116 OE1 GLU A 9 0.469 10.110 8.304 1.00 0.00 O ATOM 117 OE2 GLU A 9 -1.471 10.646 7.535 1.00 0.00 O ATOM 0 H GLU A 9 -1.482 6.203 7.964 1.00 0.00 H new ATOM 0 HA GLU A 9 0.675 7.976 7.545 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -0.742 7.031 10.068 1.00 0.00 H new ATOM 0 HB3 GLU A 9 0.460 8.306 10.050 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -2.125 8.311 8.410 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -1.876 9.212 9.892 1.00 0.00 H new ATOM 124 N THR A 10 1.337 5.092 8.994 1.00 0.00 N ATOM 125 CA THR A 10 2.455 4.252 9.373 1.00 0.00 C ATOM 126 C THR A 10 3.379 4.053 8.182 1.00 0.00 C ATOM 127 O THR A 10 4.605 4.113 8.322 1.00 0.00 O ATOM 128 CB THR A 10 1.964 2.901 9.878 1.00 0.00 C ATOM 129 OG1 THR A 10 1.046 3.100 10.945 1.00 0.00 O ATOM 130 CG2 THR A 10 3.156 2.067 10.366 1.00 0.00 C ATOM 0 H THR A 10 0.420 4.647 9.038 1.00 0.00 H new ATOM 0 HA THR A 10 3.002 4.745 10.176 1.00 0.00 H new ATOM 0 HB THR A 10 1.465 2.370 9.067 1.00 0.00 H new ATOM 0 HG1 THR A 10 0.200 3.443 10.589 1.00 0.00 H new ATOM 0 HG21 THR A 10 2.801 1.101 10.726 1.00 0.00 H new ATOM 0 HG22 THR A 10 3.854 1.913 9.543 1.00 0.00 H new ATOM 0 HG23 THR A 10 3.661 2.593 11.176 1.00 0.00 H new ATOM 138 N LEU A 11 2.795 3.826 6.998 1.00 0.00 N ATOM 139 CA LEU A 11 3.628 3.634 5.822 1.00 0.00 C ATOM 140 C LEU A 11 4.468 4.886 5.632 1.00 0.00 C ATOM 141 O LEU A 11 5.678 4.821 5.370 1.00 0.00 O ATOM 142 CB LEU A 11 2.777 3.431 4.557 1.00 0.00 C ATOM 143 CG LEU A 11 1.774 2.279 4.724 1.00 0.00 C ATOM 144 CD1 LEU A 11 1.088 2.009 3.384 1.00 0.00 C ATOM 145 CD2 LEU A 11 2.469 1.002 5.200 1.00 0.00 C ATOM 0 H LEU A 11 1.789 3.773 6.839 1.00 0.00 H new ATOM 0 HA LEU A 11 4.245 2.748 5.971 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.239 4.351 4.329 1.00 0.00 H new ATOM 0 HB3 LEU A 11 3.430 3.225 3.709 1.00 0.00 H new ATOM 0 HG LEU A 11 1.040 2.571 5.475 1.00 0.00 H new ATOM 0 HD11 LEU A 11 0.375 1.192 3.498 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.562 2.906 3.057 1.00 0.00 H new ATOM 0 HD13 LEU A 11 1.837 1.736 2.640 1.00 0.00 H new ATOM 0 HD21 LEU A 11 1.733 0.206 5.309 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.221 0.703 4.470 1.00 0.00 H new ATOM 0 HD23 LEU A 11 2.949 1.186 6.161 1.00 0.00 H new ATOM 157 N ILE A 12 3.814 6.035 5.804 1.00 0.00 N ATOM 158 CA ILE A 12 4.513 7.309 5.676 1.00 0.00 C ATOM 159 C ILE A 12 5.626 7.452 6.711 1.00 0.00 C ATOM 160 O ILE A 12 6.732 7.885 6.389 1.00 0.00 O ATOM 161 CB ILE A 12 3.525 8.476 5.810 1.00 0.00 C ATOM 162 CG1 ILE A 12 2.504 8.434 4.664 1.00 0.00 C ATOM 163 CG2 ILE A 12 4.293 9.797 5.765 1.00 0.00 C ATOM 164 CD1 ILE A 12 1.398 9.463 4.909 1.00 0.00 C ATOM 0 H ILE A 12 2.822 6.108 6.028 1.00 0.00 H new ATOM 0 HA ILE A 12 4.970 7.331 4.687 1.00 0.00 H new ATOM 0 HB ILE A 12 2.996 8.392 6.759 1.00 0.00 H new ATOM 0 HG12 ILE A 12 3.001 8.641 3.716 1.00 0.00 H new ATOM 0 HG13 ILE A 12 2.073 7.436 4.587 1.00 0.00 H new ATOM 0 HG21 ILE A 12 3.594 10.628 5.860 1.00 0.00 H new ATOM 0 HG22 ILE A 12 5.009 9.830 6.586 1.00 0.00 H new ATOM 0 HG23 ILE A 12 4.825 9.877 4.817 1.00 0.00 H new ATOM 0 HD11 ILE A 12 0.679 9.426 4.091 1.00 0.00 H new ATOM 0 HD12 ILE A 12 0.892 9.237 5.848 1.00 0.00 H new ATOM 0 HD13 ILE A 12 1.834 10.460 4.963 1.00 0.00 H new ATOM 176 N ASN A 13 5.320 7.109 7.958 1.00 0.00 N ATOM 177 CA ASN A 13 6.298 7.230 9.032 1.00 0.00 C ATOM 178 C ASN A 13 7.531 6.362 8.801 1.00 0.00 C ATOM 179 O ASN A 13 8.655 6.806 9.047 1.00 0.00 O ATOM 180 CB ASN A 13 5.647 6.842 10.359 1.00 0.00 C ATOM 181 CG ASN A 13 4.543 7.835 10.706 1.00 0.00 C ATOM 182 OD1 ASN A 13 4.498 8.935 10.154 1.00 0.00 O ATOM 183 ND2 ASN A 13 3.643 7.512 11.594 1.00 0.00 N ATOM 0 H ASN A 13 4.411 6.748 8.248 1.00 0.00 H new ATOM 0 HA ASN A 13 6.629 8.268 9.055 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.234 5.835 10.291 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.396 6.827 11.151 1.00 0.00 H new ATOM 0 HD21 ASN A 13 2.901 8.171 11.831 1.00 0.00 H new ATOM 0 HD22 ASN A 13 3.681 6.601 12.051 1.00 0.00 H new ATOM 190 N VAL A 14 7.343 5.131 8.323 1.00 0.00 N ATOM 191 CA VAL A 14 8.508 4.284 8.091 1.00 0.00 C ATOM 192 C VAL A 14 9.282 4.776 6.856 1.00 0.00 C ATOM 193 O VAL A 14 10.537 4.828 6.863 1.00 0.00 O ATOM 194 CB VAL A 14 8.125 2.785 7.999 1.00 0.00 C ATOM 195 CG1 VAL A 14 7.339 2.373 9.254 1.00 0.00 C ATOM 196 CG2 VAL A 14 7.263 2.503 6.774 1.00 0.00 C ATOM 0 H VAL A 14 6.439 4.715 8.098 1.00 0.00 H new ATOM 0 HA VAL A 14 9.172 4.366 8.952 1.00 0.00 H new ATOM 0 HB VAL A 14 9.049 2.212 7.919 1.00 0.00 H new ATOM 0 HG11 VAL A 14 7.071 1.319 9.186 1.00 0.00 H new ATOM 0 HG12 VAL A 14 7.955 2.535 10.139 1.00 0.00 H new ATOM 0 HG13 VAL A 14 6.432 2.973 9.329 1.00 0.00 H new ATOM 0 HG21 VAL A 14 7.013 1.443 6.741 1.00 0.00 H new ATOM 0 HG22 VAL A 14 6.346 3.090 6.831 1.00 0.00 H new ATOM 0 HG23 VAL A 14 7.812 2.774 5.872 1.00 0.00 H new ATOM 206 N PHE A 15 8.548 5.213 5.812 1.00 0.00 N ATOM 207 CA PHE A 15 9.226 5.750 4.638 1.00 0.00 C ATOM 208 C PHE A 15 10.046 6.967 5.020 1.00 0.00 C ATOM 209 O PHE A 15 11.193 7.149 4.591 1.00 0.00 O ATOM 210 CB PHE A 15 8.262 6.108 3.506 1.00 0.00 C ATOM 211 CG PHE A 15 9.098 6.629 2.359 1.00 0.00 C ATOM 212 CD1 PHE A 15 9.823 5.745 1.547 1.00 0.00 C ATOM 213 CD2 PHE A 15 9.175 8.008 2.133 1.00 0.00 C ATOM 214 CE1 PHE A 15 10.627 6.246 0.513 1.00 0.00 C ATOM 215 CE2 PHE A 15 9.968 8.505 1.093 1.00 0.00 C ATOM 216 CZ PHE A 15 10.696 7.625 0.284 1.00 0.00 C ATOM 0 H PHE A 15 7.529 5.203 5.765 1.00 0.00 H new ATOM 0 HA PHE A 15 9.880 4.962 4.264 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.688 5.234 3.198 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.546 6.861 3.834 1.00 0.00 H new ATOM 0 HD1 PHE A 15 9.762 4.680 1.718 1.00 0.00 H new ATOM 0 HD2 PHE A 15 8.622 8.689 2.762 1.00 0.00 H new ATOM 0 HE1 PHE A 15 11.193 5.567 -0.107 1.00 0.00 H new ATOM 0 HE2 PHE A 15 10.018 9.569 0.914 1.00 0.00 H new ATOM 0 HZ PHE A 15 11.311 8.010 -0.516 1.00 0.00 H new ATOM 226 N HIS A 16 9.461 7.806 5.839 1.00 0.00 N ATOM 227 CA HIS A 16 10.172 8.966 6.294 1.00 0.00 C ATOM 228 C HIS A 16 11.303 8.535 7.182 1.00 0.00 C ATOM 229 O HIS A 16 12.352 9.171 7.216 1.00 0.00 O ATOM 230 CB HIS A 16 9.245 9.944 7.017 1.00 0.00 C ATOM 231 CG HIS A 16 10.016 11.176 7.404 1.00 0.00 C ATOM 232 ND1 HIS A 16 10.593 11.324 8.655 1.00 0.00 N ATOM 233 CD2 HIS A 16 10.314 12.325 6.716 1.00 0.00 C ATOM 234 CE1 HIS A 16 11.204 12.523 8.682 1.00 0.00 C ATOM 235 NE2 HIS A 16 11.063 13.175 7.524 1.00 0.00 N ATOM 0 H HIS A 16 8.511 7.708 6.197 1.00 0.00 H new ATOM 0 HA HIS A 16 10.575 9.494 5.430 1.00 0.00 H new ATOM 0 HB2 HIS A 16 8.409 10.213 6.371 1.00 0.00 H new ATOM 0 HB3 HIS A 16 8.823 9.473 7.905 1.00 0.00 H new ATOM 0 HD2 HIS A 16 10.013 12.538 5.701 1.00 0.00 H new ATOM 0 HE1 HIS A 16 11.742 12.910 9.535 1.00 0.00 H new ATOM 0 HE2 HIS A 16 11.426 14.097 7.284 1.00 0.00 H new ATOM 244 N ALA A 17 11.085 7.464 7.924 1.00 0.00 N ATOM 245 CA ALA A 17 12.119 7.018 8.816 1.00 0.00 C ATOM 246 C ALA A 17 13.386 6.683 8.057 1.00 0.00 C ATOM 247 O ALA A 17 14.445 7.184 8.399 1.00 0.00 O ATOM 248 CB ALA A 17 11.668 5.764 9.571 1.00 0.00 C ATOM 0 H ALA A 17 10.229 6.909 7.924 1.00 0.00 H new ATOM 0 HA ALA A 17 12.317 7.830 9.516 1.00 0.00 H new ATOM 0 HB1 ALA A 17 12.462 5.438 10.243 1.00 0.00 H new ATOM 0 HB2 ALA A 17 10.773 5.990 10.150 1.00 0.00 H new ATOM 0 HB3 ALA A 17 11.447 4.970 8.858 1.00 0.00 H new ATOM 254 N HIS A 18 13.314 5.865 7.007 1.00 0.00 N ATOM 255 CA HIS A 18 14.576 5.569 6.295 1.00 0.00 C ATOM 256 C HIS A 18 15.001 6.665 5.309 1.00 0.00 C ATOM 257 O HIS A 18 16.166 7.098 5.341 1.00 0.00 O ATOM 258 CB HIS A 18 14.609 4.166 5.651 1.00 0.00 C ATOM 259 CG HIS A 18 13.517 3.992 4.656 1.00 0.00 C ATOM 260 ND1 HIS A 18 12.460 4.768 4.362 1.00 0.00 N flip ATOM 261 CD2 HIS A 18 13.412 2.880 3.836 1.00 0.00 C flip ATOM 262 CE1 HIS A 18 11.699 4.180 3.363 1.00 0.00 C flip ATOM 263 NE2 HIS A 18 12.306 3.040 3.087 1.00 0.00 N flip ATOM 0 H HIS A 18 12.470 5.421 6.644 1.00 0.00 H new ATOM 0 HA HIS A 18 15.331 5.561 7.081 1.00 0.00 H new ATOM 0 HB2 HIS A 18 15.572 4.011 5.165 1.00 0.00 H new ATOM 0 HB3 HIS A 18 14.518 3.407 6.428 1.00 0.00 H new ATOM 0 HD1 HIS A 18 12.248 5.660 4.809 1.00 0.00 H new ATOM 0 HD2 HIS A 18 14.091 2.041 3.804 1.00 0.00 H new ATOM 0 HE1 HIS A 18 10.801 4.571 2.908 1.00 0.00 H new ATOM 272 N SER A 19 14.093 7.138 4.429 1.00 0.00 N ATOM 273 CA SER A 19 14.513 8.173 3.490 1.00 0.00 C ATOM 274 C SER A 19 14.965 9.408 4.261 1.00 0.00 C ATOM 275 O SER A 19 15.975 10.024 3.918 1.00 0.00 O ATOM 276 CB SER A 19 13.399 8.542 2.500 1.00 0.00 C ATOM 277 OG SER A 19 13.919 9.454 1.508 1.00 0.00 O ATOM 0 H SER A 19 13.122 6.835 4.356 1.00 0.00 H new ATOM 0 HA SER A 19 15.344 7.778 2.905 1.00 0.00 H new ATOM 0 HB2 SER A 19 13.014 7.644 2.017 1.00 0.00 H new ATOM 0 HB3 SER A 19 12.564 9.001 3.030 1.00 0.00 H new ATOM 0 HG SER A 19 14.850 9.673 1.721 1.00 0.00 H new ATOM 283 N GLY A 20 14.211 9.735 5.323 1.00 0.00 N ATOM 284 CA GLY A 20 14.522 10.875 6.187 1.00 0.00 C ATOM 285 C GLY A 20 15.781 10.644 7.007 1.00 0.00 C ATOM 286 O GLY A 20 16.630 11.529 7.117 1.00 0.00 O ATOM 0 H GLY A 20 13.377 9.219 5.602 1.00 0.00 H new ATOM 0 HA2 GLY A 20 14.647 11.769 5.576 1.00 0.00 H new ATOM 0 HA3 GLY A 20 13.683 11.061 6.857 1.00 0.00 H new ATOM 290 N LYS A 21 15.898 9.455 7.594 1.00 0.00 N ATOM 291 CA LYS A 21 17.069 9.151 8.412 1.00 0.00 C ATOM 292 C LYS A 21 18.370 9.259 7.617 1.00 0.00 C ATOM 293 O LYS A 21 19.358 9.791 8.122 1.00 0.00 O ATOM 294 CB LYS A 21 16.933 7.748 8.993 1.00 0.00 C ATOM 295 CG LYS A 21 18.112 7.415 9.893 1.00 0.00 C ATOM 296 CD LYS A 21 17.911 5.995 10.423 1.00 0.00 C ATOM 297 CE LYS A 21 18.009 4.989 9.266 1.00 0.00 C ATOM 298 NZ LYS A 21 16.639 4.551 8.876 1.00 0.00 N ATOM 0 H LYS A 21 15.214 8.702 7.522 1.00 0.00 H new ATOM 0 HA LYS A 21 17.115 9.887 9.214 1.00 0.00 H new ATOM 0 HB2 LYS A 21 16.005 7.674 9.560 1.00 0.00 H new ATOM 0 HB3 LYS A 21 16.871 7.020 8.184 1.00 0.00 H new ATOM 0 HG2 LYS A 21 19.048 7.487 9.338 1.00 0.00 H new ATOM 0 HG3 LYS A 21 18.175 8.125 10.718 1.00 0.00 H new ATOM 0 HD2 LYS A 21 18.664 5.769 11.178 1.00 0.00 H new ATOM 0 HD3 LYS A 21 16.938 5.912 10.908 1.00 0.00 H new ATOM 0 HE2 LYS A 21 18.514 5.445 8.414 1.00 0.00 H new ATOM 0 HE3 LYS A 21 18.606 4.128 9.567 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 16.625 4.316 7.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 16.372 3.712 9.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 15.963 5.319 9.062 1.00 0.00 H new ATOM 312 N GLU A 22 18.383 8.763 6.372 1.00 0.00 N ATOM 313 CA GLU A 22 19.607 8.841 5.555 1.00 0.00 C ATOM 314 C GLU A 22 19.364 9.431 4.167 1.00 0.00 C ATOM 315 O GLU A 22 18.281 9.309 3.610 1.00 0.00 O ATOM 316 CB GLU A 22 20.233 7.461 5.396 1.00 0.00 C ATOM 317 CG GLU A 22 20.701 6.945 6.749 1.00 0.00 C ATOM 318 CD GLU A 22 21.389 5.593 6.588 1.00 0.00 C ATOM 319 OE1 GLU A 22 21.328 5.047 5.499 1.00 0.00 O ATOM 320 OE2 GLU A 22 21.965 5.125 7.555 1.00 0.00 O ATOM 0 H GLU A 22 17.587 8.316 5.917 1.00 0.00 H new ATOM 0 HA GLU A 22 20.282 9.509 6.090 1.00 0.00 H new ATOM 0 HB2 GLU A 22 19.508 6.771 4.965 1.00 0.00 H new ATOM 0 HB3 GLU A 22 21.075 7.511 4.705 1.00 0.00 H new ATOM 0 HG2 GLU A 22 21.389 7.660 7.201 1.00 0.00 H new ATOM 0 HG3 GLU A 22 19.851 6.850 7.424 1.00 0.00 H new ATOM 327 N GLY A 23 20.414 10.034 3.606 1.00 0.00 N ATOM 328 CA GLY A 23 20.359 10.604 2.258 1.00 0.00 C ATOM 329 C GLY A 23 19.218 11.598 2.093 1.00 0.00 C ATOM 330 O GLY A 23 18.854 12.310 3.028 1.00 0.00 O ATOM 0 H GLY A 23 21.317 10.141 4.067 1.00 0.00 H new ATOM 0 HA2 GLY A 23 21.304 11.100 2.038 1.00 0.00 H new ATOM 0 HA3 GLY A 23 20.244 9.800 1.531 1.00 0.00 H new ATOM 334 N ASP A 24 18.648 11.626 0.885 1.00 0.00 N ATOM 335 CA ASP A 24 17.535 12.520 0.598 1.00 0.00 C ATOM 336 C ASP A 24 16.291 12.032 1.323 1.00 0.00 C ATOM 337 O ASP A 24 16.028 10.830 1.391 1.00 0.00 O ATOM 338 CB ASP A 24 17.274 12.575 -0.907 1.00 0.00 C ATOM 339 CG ASP A 24 18.453 13.231 -1.617 1.00 0.00 C ATOM 340 OD1 ASP A 24 19.279 13.816 -0.935 1.00 0.00 O ATOM 341 OD2 ASP A 24 18.514 13.139 -2.832 1.00 0.00 O ATOM 0 H ASP A 24 18.939 11.044 0.100 1.00 0.00 H new ATOM 0 HA ASP A 24 17.786 13.523 0.945 1.00 0.00 H new ATOM 0 HB2 ASP A 24 17.120 11.568 -1.295 1.00 0.00 H new ATOM 0 HB3 ASP A 24 16.361 13.136 -1.106 1.00 0.00 H new ATOM 346 N LYS A 25 15.551 12.967 1.895 1.00 0.00 N ATOM 347 CA LYS A 25 14.358 12.622 2.649 1.00 0.00 C ATOM 348 C LYS A 25 13.304 11.919 1.795 1.00 0.00 C ATOM 349 O LYS A 25 12.531 11.114 2.304 1.00 0.00 O ATOM 350 CB LYS A 25 13.747 13.871 3.287 1.00 0.00 C ATOM 351 CG LYS A 25 14.783 14.539 4.223 1.00 0.00 C ATOM 352 CD LYS A 25 14.106 15.642 5.047 1.00 0.00 C ATOM 353 CE LYS A 25 13.630 16.772 4.128 1.00 0.00 C ATOM 354 NZ LYS A 25 13.654 18.060 4.877 1.00 0.00 N ATOM 0 H LYS A 25 15.754 13.966 1.852 1.00 0.00 H new ATOM 0 HA LYS A 25 14.673 11.925 3.425 1.00 0.00 H new ATOM 0 HB2 LYS A 25 13.437 14.572 2.512 1.00 0.00 H new ATOM 0 HB3 LYS A 25 12.853 13.603 3.850 1.00 0.00 H new ATOM 0 HG2 LYS A 25 15.220 13.793 4.887 1.00 0.00 H new ATOM 0 HG3 LYS A 25 15.599 14.960 3.635 1.00 0.00 H new ATOM 0 HD2 LYS A 25 13.260 15.229 5.596 1.00 0.00 H new ATOM 0 HD3 LYS A 25 14.804 16.034 5.786 1.00 0.00 H new ATOM 0 HE2 LYS A 25 14.272 16.837 3.250 1.00 0.00 H new ATOM 0 HE3 LYS A 25 12.621 16.565 3.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.754 18.561 4.735 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 13.789 17.870 5.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 14.436 18.650 4.528 1.00 0.00 H new ATOM 368 N TYR A 26 13.233 12.264 0.515 1.00 0.00 N ATOM 369 CA TYR A 26 12.217 11.684 -0.366 1.00 0.00 C ATOM 370 C TYR A 26 12.781 10.673 -1.362 1.00 0.00 C ATOM 371 O TYR A 26 12.114 10.347 -2.343 1.00 0.00 O ATOM 372 CB TYR A 26 11.501 12.802 -1.121 1.00 0.00 C ATOM 373 CG TYR A 26 10.809 13.694 -0.123 1.00 0.00 C ATOM 374 CD1 TYR A 26 9.570 13.313 0.406 1.00 0.00 C ATOM 375 CD2 TYR A 26 11.408 14.891 0.285 1.00 0.00 C ATOM 376 CE1 TYR A 26 8.929 14.130 1.342 1.00 0.00 C ATOM 377 CE2 TYR A 26 10.767 15.707 1.224 1.00 0.00 C ATOM 378 CZ TYR A 26 9.527 15.326 1.751 1.00 0.00 C ATOM 379 OH TYR A 26 8.896 16.127 2.679 1.00 0.00 O ATOM 0 H TYR A 26 13.857 12.934 0.065 1.00 0.00 H new ATOM 0 HA TYR A 26 11.521 11.139 0.272 1.00 0.00 H new ATOM 0 HB2 TYR A 26 12.215 13.377 -1.710 1.00 0.00 H new ATOM 0 HB3 TYR A 26 10.776 12.383 -1.819 1.00 0.00 H new ATOM 0 HD1 TYR A 26 9.110 12.388 0.091 1.00 0.00 H new ATOM 0 HD2 TYR A 26 12.363 15.185 -0.124 1.00 0.00 H new ATOM 0 HE1 TYR A 26 7.972 13.838 1.749 1.00 0.00 H new ATOM 0 HE2 TYR A 26 11.229 16.630 1.542 1.00 0.00 H new ATOM 0 HH TYR A 26 8.648 16.978 2.262 1.00 0.00 H new ATOM 389 N LYS A 27 13.975 10.136 -1.111 1.00 0.00 N ATOM 390 CA LYS A 27 14.516 9.126 -2.032 1.00 0.00 C ATOM 391 C LYS A 27 15.213 8.048 -1.222 1.00 0.00 C ATOM 392 O LYS A 27 15.855 8.337 -0.212 1.00 0.00 O ATOM 393 CB LYS A 27 15.460 9.731 -3.081 1.00 0.00 C ATOM 394 CG LYS A 27 15.656 8.747 -4.247 1.00 0.00 C ATOM 395 CD LYS A 27 14.383 8.721 -5.138 1.00 0.00 C ATOM 396 CE LYS A 27 14.688 8.077 -6.485 1.00 0.00 C ATOM 397 NZ LYS A 27 13.655 8.492 -7.475 1.00 0.00 N ATOM 0 H LYS A 27 14.568 10.367 -0.314 1.00 0.00 H new ATOM 0 HA LYS A 27 13.688 8.691 -2.591 1.00 0.00 H new ATOM 0 HB2 LYS A 27 15.049 10.670 -3.453 1.00 0.00 H new ATOM 0 HB3 LYS A 27 16.422 9.963 -2.625 1.00 0.00 H new ATOM 0 HG2 LYS A 27 16.521 9.042 -4.842 1.00 0.00 H new ATOM 0 HG3 LYS A 27 15.861 7.748 -3.861 1.00 0.00 H new ATOM 0 HD2 LYS A 27 13.591 8.167 -4.634 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.016 9.736 -5.288 1.00 0.00 H new ATOM 0 HE2 LYS A 27 15.678 8.377 -6.828 1.00 0.00 H new ATOM 0 HE3 LYS A 27 14.699 6.991 -6.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 13.623 7.803 -8.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 12.726 8.533 -7.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 13.894 9.430 -7.854 1.00 0.00 H new ATOM 411 N LEU A 28 15.036 6.802 -1.624 1.00 0.00 N ATOM 412 CA LEU A 28 15.602 5.687 -0.881 1.00 0.00 C ATOM 413 C LEU A 28 16.707 4.978 -1.666 1.00 0.00 C ATOM 414 O LEU A 28 16.533 4.649 -2.832 1.00 0.00 O ATOM 415 CB LEU A 28 14.442 4.751 -0.587 1.00 0.00 C ATOM 416 CG LEU A 28 14.790 3.668 0.441 1.00 0.00 C ATOM 417 CD1 LEU A 28 14.937 4.220 1.878 1.00 0.00 C ATOM 418 CD2 LEU A 28 13.642 2.669 0.446 1.00 0.00 C ATOM 0 H LEU A 28 14.508 6.536 -2.455 1.00 0.00 H new ATOM 0 HA LEU A 28 16.078 6.033 0.037 1.00 0.00 H new ATOM 0 HB2 LEU A 28 13.597 5.333 -0.221 1.00 0.00 H new ATOM 0 HB3 LEU A 28 14.123 4.275 -1.514 1.00 0.00 H new ATOM 0 HG LEU A 28 15.747 3.229 0.158 1.00 0.00 H new ATOM 0 HD11 LEU A 28 15.183 3.404 2.558 1.00 0.00 H new ATOM 0 HD12 LEU A 28 15.732 4.965 1.902 1.00 0.00 H new ATOM 0 HD13 LEU A 28 13.999 4.680 2.189 1.00 0.00 H new ATOM 0 HD21 LEU A 28 13.851 1.879 1.167 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.718 3.178 0.722 1.00 0.00 H new ATOM 0 HD23 LEU A 28 13.534 2.234 -0.548 1.00 0.00 H new ATOM 430 N SER A 29 17.840 4.735 -1.011 1.00 0.00 N ATOM 431 CA SER A 29 18.961 4.050 -1.642 1.00 0.00 C ATOM 432 C SER A 29 19.012 2.598 -1.167 1.00 0.00 C ATOM 433 O SER A 29 18.329 2.225 -0.203 1.00 0.00 O ATOM 434 CB SER A 29 20.266 4.786 -1.344 1.00 0.00 C ATOM 435 OG SER A 29 20.509 4.768 0.048 1.00 0.00 O ATOM 0 H SER A 29 18.004 5.004 -0.041 1.00 0.00 H new ATOM 0 HA SER A 29 18.825 4.048 -2.723 1.00 0.00 H new ATOM 0 HB2 SER A 29 21.092 4.313 -1.874 1.00 0.00 H new ATOM 0 HB3 SER A 29 20.206 5.814 -1.700 1.00 0.00 H new ATOM 0 HG SER A 29 20.410 5.674 0.409 1.00 0.00 H new ATOM 441 N LYS A 30 19.770 1.761 -1.874 1.00 0.00 N ATOM 442 CA LYS A 30 19.825 0.343 -1.530 1.00 0.00 C ATOM 443 C LYS A 30 20.183 0.127 -0.072 1.00 0.00 C ATOM 444 O LYS A 30 19.563 -0.688 0.632 1.00 0.00 O ATOM 445 CB LYS A 30 20.928 -0.336 -2.332 1.00 0.00 C ATOM 446 CG LYS A 30 20.899 -1.846 -2.066 1.00 0.00 C ATOM 447 CD LYS A 30 22.098 -2.491 -2.755 1.00 0.00 C ATOM 448 CE LYS A 30 23.386 -2.068 -2.022 1.00 0.00 C ATOM 449 NZ LYS A 30 24.333 -3.218 -1.985 1.00 0.00 N ATOM 0 H LYS A 30 20.343 2.033 -2.672 1.00 0.00 H new ATOM 0 HA LYS A 30 18.838 -0.067 -1.743 1.00 0.00 H new ATOM 0 HB2 LYS A 30 20.792 -0.141 -3.396 1.00 0.00 H new ATOM 0 HB3 LYS A 30 21.899 0.074 -2.055 1.00 0.00 H new ATOM 0 HG2 LYS A 30 20.930 -2.041 -0.994 1.00 0.00 H new ATOM 0 HG3 LYS A 30 19.971 -2.277 -2.441 1.00 0.00 H new ATOM 0 HD2 LYS A 30 21.999 -3.576 -2.745 1.00 0.00 H new ATOM 0 HD3 LYS A 30 22.142 -2.184 -3.800 1.00 0.00 H new ATOM 0 HE2 LYS A 30 23.845 -1.220 -2.530 1.00 0.00 H new ATOM 0 HE3 LYS A 30 23.151 -1.743 -1.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 25.203 -2.935 -1.491 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 23.892 -4.015 -1.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 24.565 -3.508 -2.956 1.00 0.00 H new ATOM 463 N LYS A 31 21.190 0.844 0.380 1.00 0.00 N ATOM 464 CA LYS A 31 21.623 0.688 1.742 1.00 0.00 C ATOM 465 C LYS A 31 20.478 1.008 2.689 1.00 0.00 C ATOM 466 O LYS A 31 20.235 0.286 3.655 1.00 0.00 O ATOM 467 CB LYS A 31 22.784 1.637 2.003 1.00 0.00 C ATOM 468 CG LYS A 31 22.263 3.070 1.939 1.00 0.00 C ATOM 469 CD LYS A 31 23.418 4.029 2.039 1.00 0.00 C ATOM 470 CE LYS A 31 22.896 5.453 2.232 1.00 0.00 C ATOM 471 NZ LYS A 31 24.039 6.369 2.509 1.00 0.00 N ATOM 0 H LYS A 31 21.713 1.527 -0.168 1.00 0.00 H new ATOM 0 HA LYS A 31 21.941 -0.341 1.909 1.00 0.00 H new ATOM 0 HB2 LYS A 31 23.224 1.437 2.980 1.00 0.00 H new ATOM 0 HB3 LYS A 31 23.570 1.486 1.263 1.00 0.00 H new ATOM 0 HG2 LYS A 31 21.723 3.231 1.006 1.00 0.00 H new ATOM 0 HG3 LYS A 31 21.557 3.248 2.750 1.00 0.00 H new ATOM 0 HD2 LYS A 31 24.061 3.752 2.874 1.00 0.00 H new ATOM 0 HD3 LYS A 31 24.027 3.975 1.136 1.00 0.00 H new ATOM 0 HE2 LYS A 31 22.362 5.780 1.340 1.00 0.00 H new ATOM 0 HE3 LYS A 31 22.185 5.482 3.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 23.684 7.338 2.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 24.530 6.060 3.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 24.702 6.349 1.708 1.00 0.00 H new ATOM 485 N GLU A 32 19.800 2.122 2.430 1.00 0.00 N ATOM 486 CA GLU A 32 18.714 2.527 3.315 1.00 0.00 C ATOM 487 C GLU A 32 17.585 1.490 3.343 1.00 0.00 C ATOM 488 O GLU A 32 17.176 1.073 4.434 1.00 0.00 O ATOM 489 CB GLU A 32 18.137 3.876 2.882 1.00 0.00 C ATOM 490 CG GLU A 32 19.227 4.940 2.945 1.00 0.00 C ATOM 491 CD GLU A 32 18.648 6.325 2.634 1.00 0.00 C ATOM 492 OE1 GLU A 32 17.486 6.402 2.264 1.00 0.00 O ATOM 493 OE2 GLU A 32 19.377 7.292 2.773 1.00 0.00 O ATOM 0 H GLU A 32 19.975 2.743 1.640 1.00 0.00 H new ATOM 0 HA GLU A 32 19.138 2.610 4.316 1.00 0.00 H new ATOM 0 HB2 GLU A 32 17.741 3.806 1.869 1.00 0.00 H new ATOM 0 HB3 GLU A 32 17.306 4.153 3.531 1.00 0.00 H new ATOM 0 HG2 GLU A 32 19.682 4.944 3.936 1.00 0.00 H new ATOM 0 HG3 GLU A 32 20.017 4.702 2.233 1.00 0.00 H new ATOM 500 N LEU A 33 17.084 1.016 2.184 1.00 0.00 N ATOM 501 CA LEU A 33 16.025 -0.001 2.296 1.00 0.00 C ATOM 502 C LEU A 33 16.564 -1.178 3.073 1.00 0.00 C ATOM 503 O LEU A 33 15.850 -1.790 3.861 1.00 0.00 O ATOM 504 CB LEU A 33 15.437 -0.553 0.975 1.00 0.00 C ATOM 505 CG LEU A 33 16.462 -0.550 -0.189 1.00 0.00 C ATOM 506 CD1 LEU A 33 16.716 -1.992 -0.686 1.00 0.00 C ATOM 507 CD2 LEU A 33 15.907 0.288 -1.366 1.00 0.00 C ATOM 0 H LEU A 33 17.364 1.290 1.242 1.00 0.00 H new ATOM 0 HA LEU A 33 15.204 0.524 2.785 1.00 0.00 H new ATOM 0 HB2 LEU A 33 15.083 -1.571 1.138 1.00 0.00 H new ATOM 0 HB3 LEU A 33 14.571 0.044 0.691 1.00 0.00 H new ATOM 0 HG LEU A 33 17.396 -0.121 0.173 1.00 0.00 H new ATOM 0 HD11 LEU A 33 17.437 -1.974 -1.503 1.00 0.00 H new ATOM 0 HD12 LEU A 33 17.110 -2.595 0.132 1.00 0.00 H new ATOM 0 HD13 LEU A 33 15.780 -2.426 -1.038 1.00 0.00 H new ATOM 0 HD21 LEU A 33 16.628 0.289 -2.183 1.00 0.00 H new ATOM 0 HD22 LEU A 33 14.968 -0.146 -1.711 1.00 0.00 H new ATOM 0 HD23 LEU A 33 15.733 1.311 -1.034 1.00 0.00 H new ATOM 519 N LYS A 34 17.823 -1.515 2.860 1.00 0.00 N ATOM 520 CA LYS A 34 18.348 -2.650 3.575 1.00 0.00 C ATOM 521 C LYS A 34 18.098 -2.435 5.056 1.00 0.00 C ATOM 522 O LYS A 34 17.786 -3.377 5.782 1.00 0.00 O ATOM 523 CB LYS A 34 19.851 -2.812 3.322 1.00 0.00 C ATOM 524 CG LYS A 34 20.363 -4.109 3.965 1.00 0.00 C ATOM 525 CD LYS A 34 19.982 -5.306 3.084 1.00 0.00 C ATOM 526 CE LYS A 34 20.611 -6.595 3.628 1.00 0.00 C ATOM 527 NZ LYS A 34 19.600 -7.332 4.436 1.00 0.00 N ATOM 0 H LYS A 34 18.470 -1.042 2.229 1.00 0.00 H new ATOM 0 HA LYS A 34 17.851 -3.556 3.229 1.00 0.00 H new ATOM 0 HB2 LYS A 34 20.047 -2.828 2.250 1.00 0.00 H new ATOM 0 HB3 LYS A 34 20.390 -1.958 3.732 1.00 0.00 H new ATOM 0 HG2 LYS A 34 21.445 -4.064 4.086 1.00 0.00 H new ATOM 0 HG3 LYS A 34 19.935 -4.227 4.961 1.00 0.00 H new ATOM 0 HD2 LYS A 34 18.897 -5.410 3.050 1.00 0.00 H new ATOM 0 HD3 LYS A 34 20.318 -5.134 2.061 1.00 0.00 H new ATOM 0 HE2 LYS A 34 20.960 -7.218 2.805 1.00 0.00 H new ATOM 0 HE3 LYS A 34 21.481 -6.359 4.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 19.747 -8.356 4.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 19.701 -7.073 5.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 18.645 -7.083 4.108 1.00 0.00 H new ATOM 541 N GLU A 35 18.208 -1.189 5.503 1.00 0.00 N ATOM 542 CA GLU A 35 17.957 -0.893 6.900 1.00 0.00 C ATOM 543 C GLU A 35 16.467 -0.958 7.249 1.00 0.00 C ATOM 544 O GLU A 35 16.099 -1.482 8.305 1.00 0.00 O ATOM 545 CB GLU A 35 18.494 0.499 7.235 1.00 0.00 C ATOM 546 CG GLU A 35 20.016 0.510 7.084 1.00 0.00 C ATOM 547 CD GLU A 35 20.568 1.875 7.482 1.00 0.00 C ATOM 548 OE1 GLU A 35 19.774 2.778 7.685 1.00 0.00 O ATOM 549 OE2 GLU A 35 21.779 1.997 7.576 1.00 0.00 O ATOM 0 H GLU A 35 18.464 -0.386 4.929 1.00 0.00 H new ATOM 0 HA GLU A 35 18.470 -1.652 7.491 1.00 0.00 H new ATOM 0 HB2 GLU A 35 18.047 1.241 6.574 1.00 0.00 H new ATOM 0 HB3 GLU A 35 18.217 0.772 8.253 1.00 0.00 H new ATOM 0 HG2 GLU A 35 20.458 -0.267 7.709 1.00 0.00 H new ATOM 0 HG3 GLU A 35 20.289 0.284 6.053 1.00 0.00 H new ATOM 556 N LEU A 36 15.597 -0.397 6.392 1.00 0.00 N ATOM 557 CA LEU A 36 14.169 -0.400 6.732 1.00 0.00 C ATOM 558 C LEU A 36 13.575 -1.806 6.707 1.00 0.00 C ATOM 559 O LEU A 36 12.880 -2.200 7.641 1.00 0.00 O ATOM 560 CB LEU A 36 13.344 0.477 5.771 1.00 0.00 C ATOM 561 CG LEU A 36 11.954 0.770 6.408 1.00 0.00 C ATOM 562 CD1 LEU A 36 11.214 1.846 5.624 1.00 0.00 C ATOM 563 CD2 LEU A 36 11.085 -0.487 6.441 1.00 0.00 C ATOM 0 H LEU A 36 15.841 0.042 5.504 1.00 0.00 H new ATOM 0 HA LEU A 36 14.113 0.005 7.742 1.00 0.00 H new ATOM 0 HB2 LEU A 36 13.869 1.411 5.571 1.00 0.00 H new ATOM 0 HB3 LEU A 36 13.219 -0.030 4.814 1.00 0.00 H new ATOM 0 HG LEU A 36 12.136 1.113 7.426 1.00 0.00 H new ATOM 0 HD11 LEU A 36 10.246 2.033 6.088 1.00 0.00 H new ATOM 0 HD12 LEU A 36 11.800 2.765 5.624 1.00 0.00 H new ATOM 0 HD13 LEU A 36 11.065 1.511 4.597 1.00 0.00 H new ATOM 0 HD21 LEU A 36 10.121 -0.251 6.891 1.00 0.00 H new ATOM 0 HD22 LEU A 36 10.932 -0.850 5.425 1.00 0.00 H new ATOM 0 HD23 LEU A 36 11.582 -1.257 7.031 1.00 0.00 H new ATOM 575 N LEU A 37 13.835 -2.583 5.650 1.00 0.00 N ATOM 576 CA LEU A 37 13.245 -3.914 5.610 1.00 0.00 C ATOM 577 C LEU A 37 13.695 -4.718 6.817 1.00 0.00 C ATOM 578 O LEU A 37 12.887 -5.391 7.448 1.00 0.00 O ATOM 579 CB LEU A 37 13.597 -4.678 4.315 1.00 0.00 C ATOM 580 CG LEU A 37 12.830 -4.125 3.088 1.00 0.00 C ATOM 581 CD1 LEU A 37 11.366 -4.583 3.120 1.00 0.00 C ATOM 582 CD2 LEU A 37 12.870 -2.604 3.053 1.00 0.00 C ATOM 0 H LEU A 37 14.418 -2.328 4.853 1.00 0.00 H new ATOM 0 HA LEU A 37 12.163 -3.785 5.629 1.00 0.00 H new ATOM 0 HB2 LEU A 37 14.670 -4.609 4.133 1.00 0.00 H new ATOM 0 HB3 LEU A 37 13.363 -5.735 4.443 1.00 0.00 H new ATOM 0 HG LEU A 37 13.319 -4.514 2.195 1.00 0.00 H new ATOM 0 HD11 LEU A 37 10.841 -4.186 2.251 1.00 0.00 H new ATOM 0 HD12 LEU A 37 11.325 -5.672 3.102 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.890 -4.217 4.030 1.00 0.00 H new ATOM 0 HD21 LEU A 37 12.323 -2.246 2.181 1.00 0.00 H new ATOM 0 HD22 LEU A 37 12.410 -2.207 3.958 1.00 0.00 H new ATOM 0 HD23 LEU A 37 13.905 -2.268 2.995 1.00 0.00 H new ATOM 594 N GLN A 38 14.977 -4.622 7.161 1.00 0.00 N ATOM 595 CA GLN A 38 15.479 -5.336 8.326 1.00 0.00 C ATOM 596 C GLN A 38 14.846 -4.832 9.621 1.00 0.00 C ATOM 597 O GLN A 38 14.542 -5.624 10.513 1.00 0.00 O ATOM 598 CB GLN A 38 16.999 -5.205 8.417 1.00 0.00 C ATOM 599 CG GLN A 38 17.656 -5.928 7.241 1.00 0.00 C ATOM 600 CD GLN A 38 19.167 -5.739 7.299 1.00 0.00 C ATOM 601 OE1 GLN A 38 19.948 -6.600 6.710 1.00 0.00 O flip ATOM 602 NE2 GLN A 38 19.650 -4.788 7.916 1.00 0.00 N flip ATOM 0 H GLN A 38 15.672 -4.069 6.660 1.00 0.00 H new ATOM 0 HA GLN A 38 15.207 -6.384 8.202 1.00 0.00 H new ATOM 0 HB2 GLN A 38 17.283 -4.153 8.412 1.00 0.00 H new ATOM 0 HB3 GLN A 38 17.353 -5.626 9.358 1.00 0.00 H new ATOM 0 HG2 GLN A 38 17.411 -6.990 7.272 1.00 0.00 H new ATOM 0 HG3 GLN A 38 17.267 -5.539 6.300 1.00 0.00 H new ATOM 0 HE21 GLN A 38 19.037 -4.115 8.377 1.00 0.00 H new ATOM 0 HE22 GLN A 38 20.662 -4.674 7.966 1.00 0.00 H new ATOM 611 N THR A 39 14.662 -3.515 9.737 1.00 0.00 N ATOM 612 CA THR A 39 14.082 -2.962 10.960 1.00 0.00 C ATOM 613 C THR A 39 12.601 -3.301 11.113 1.00 0.00 C ATOM 614 O THR A 39 12.150 -3.614 12.212 1.00 0.00 O ATOM 615 CB THR A 39 14.260 -1.440 10.985 1.00 0.00 C ATOM 616 OG1 THR A 39 13.560 -0.867 9.889 1.00 0.00 O ATOM 617 CG2 THR A 39 15.749 -1.076 10.897 1.00 0.00 C ATOM 0 H THR A 39 14.899 -2.829 9.020 1.00 0.00 H new ATOM 0 HA THR A 39 14.613 -3.418 11.796 1.00 0.00 H new ATOM 0 HB THR A 39 13.860 -1.049 11.921 1.00 0.00 H new ATOM 0 HG1 THR A 39 13.459 -1.536 9.180 1.00 0.00 H new ATOM 0 HG21 THR A 39 15.860 0.008 10.916 1.00 0.00 H new ATOM 0 HG22 THR A 39 16.280 -1.510 11.744 1.00 0.00 H new ATOM 0 HG23 THR A 39 16.165 -1.467 9.969 1.00 0.00 H new ATOM 625 N GLU A 40 11.844 -3.240 10.019 1.00 0.00 N ATOM 626 CA GLU A 40 10.415 -3.549 10.084 1.00 0.00 C ATOM 627 C GLU A 40 10.125 -5.016 9.789 1.00 0.00 C ATOM 628 O GLU A 40 9.398 -5.674 10.534 1.00 0.00 O ATOM 629 CB GLU A 40 9.641 -2.692 9.084 1.00 0.00 C ATOM 630 CG GLU A 40 9.685 -1.211 9.490 1.00 0.00 C ATOM 631 CD GLU A 40 8.932 -0.990 10.798 1.00 0.00 C ATOM 632 OE1 GLU A 40 8.095 -1.814 11.126 1.00 0.00 O ATOM 633 OE2 GLU A 40 9.206 0.002 11.453 1.00 0.00 O ATOM 0 H GLU A 40 12.187 -2.985 9.093 1.00 0.00 H new ATOM 0 HA GLU A 40 10.096 -3.332 11.103 1.00 0.00 H new ATOM 0 HB2 GLU A 40 10.066 -2.814 8.088 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.606 -3.030 9.033 1.00 0.00 H new ATOM 0 HG2 GLU A 40 10.721 -0.890 9.602 1.00 0.00 H new ATOM 0 HG3 GLU A 40 9.244 -0.599 8.703 1.00 0.00 H new ATOM 640 N LEU A 41 10.664 -5.518 8.677 1.00 0.00 N ATOM 641 CA LEU A 41 10.409 -6.902 8.283 1.00 0.00 C ATOM 642 C LEU A 41 11.597 -7.808 8.579 1.00 0.00 C ATOM 643 O LEU A 41 12.751 -7.430 8.389 1.00 0.00 O ATOM 644 CB LEU A 41 10.100 -6.990 6.780 1.00 0.00 C ATOM 645 CG LEU A 41 8.978 -6.019 6.366 1.00 0.00 C ATOM 646 CD1 LEU A 41 8.568 -6.309 4.914 1.00 0.00 C ATOM 647 CD2 LEU A 41 7.750 -6.174 7.267 1.00 0.00 C ATOM 0 H LEU A 41 11.270 -4.996 8.043 1.00 0.00 H new ATOM 0 HA LEU A 41 9.552 -7.237 8.867 1.00 0.00 H new ATOM 0 HB2 LEU A 41 11.002 -6.766 6.210 1.00 0.00 H new ATOM 0 HB3 LEU A 41 9.809 -8.010 6.528 1.00 0.00 H new ATOM 0 HG LEU A 41 9.355 -5.001 6.463 1.00 0.00 H new ATOM 0 HD11 LEU A 41 7.774 -5.624 4.616 1.00 0.00 H new ATOM 0 HD12 LEU A 41 9.429 -6.173 4.259 1.00 0.00 H new ATOM 0 HD13 LEU A 41 8.210 -7.336 4.835 1.00 0.00 H new ATOM 0 HD21 LEU A 41 6.976 -5.476 6.950 1.00 0.00 H new ATOM 0 HD22 LEU A 41 7.371 -7.193 7.194 1.00 0.00 H new ATOM 0 HD23 LEU A 41 8.028 -5.963 8.300 1.00 0.00 H new ATOM 659 N SER A 42 11.302 -9.027 9.017 1.00 0.00 N ATOM 660 CA SER A 42 12.348 -9.998 9.301 1.00 0.00 C ATOM 661 C SER A 42 12.271 -11.163 8.313 1.00 0.00 C ATOM 662 O SER A 42 13.182 -11.384 7.518 1.00 0.00 O ATOM 663 CB SER A 42 12.196 -10.518 10.734 1.00 0.00 C ATOM 664 OG SER A 42 13.009 -9.739 11.603 1.00 0.00 O ATOM 0 H SER A 42 10.353 -9.363 9.182 1.00 0.00 H new ATOM 0 HA SER A 42 13.319 -9.513 9.196 1.00 0.00 H new ATOM 0 HB2 SER A 42 11.153 -10.462 11.045 1.00 0.00 H new ATOM 0 HB3 SER A 42 12.488 -11.567 10.786 1.00 0.00 H new ATOM 0 HG SER A 42 12.914 -10.067 12.522 1.00 0.00 H new ATOM 670 N GLY A 43 11.176 -11.912 8.397 1.00 0.00 N ATOM 671 CA GLY A 43 10.968 -13.077 7.542 1.00 0.00 C ATOM 672 C GLY A 43 10.973 -12.762 6.042 1.00 0.00 C ATOM 673 O GLY A 43 11.461 -13.569 5.249 1.00 0.00 O ATOM 0 H GLY A 43 10.415 -11.732 9.052 1.00 0.00 H new ATOM 0 HA2 GLY A 43 11.746 -13.811 7.751 1.00 0.00 H new ATOM 0 HA3 GLY A 43 10.016 -13.540 7.802 1.00 0.00 H new ATOM 677 N PHE A 44 10.406 -11.626 5.636 1.00 0.00 N ATOM 678 CA PHE A 44 10.351 -11.312 4.205 1.00 0.00 C ATOM 679 C PHE A 44 11.744 -11.227 3.572 1.00 0.00 C ATOM 680 O PHE A 44 12.018 -11.912 2.588 1.00 0.00 O ATOM 681 CB PHE A 44 9.604 -9.989 3.995 1.00 0.00 C ATOM 682 CG PHE A 44 8.129 -10.175 4.292 1.00 0.00 C ATOM 683 CD1 PHE A 44 7.262 -10.576 3.266 1.00 0.00 C ATOM 684 CD2 PHE A 44 7.623 -9.956 5.586 1.00 0.00 C ATOM 685 CE1 PHE A 44 5.899 -10.756 3.527 1.00 0.00 C ATOM 686 CE2 PHE A 44 6.259 -10.137 5.843 1.00 0.00 C ATOM 687 CZ PHE A 44 5.397 -10.537 4.815 1.00 0.00 C ATOM 0 H PHE A 44 9.991 -10.927 6.252 1.00 0.00 H new ATOM 0 HA PHE A 44 9.820 -12.126 3.712 1.00 0.00 H new ATOM 0 HB2 PHE A 44 10.020 -9.219 4.645 1.00 0.00 H new ATOM 0 HB3 PHE A 44 9.737 -9.646 2.969 1.00 0.00 H new ATOM 0 HD1 PHE A 44 7.647 -10.746 2.271 1.00 0.00 H new ATOM 0 HD2 PHE A 44 8.286 -9.648 6.381 1.00 0.00 H new ATOM 0 HE1 PHE A 44 5.234 -11.064 2.734 1.00 0.00 H new ATOM 0 HE2 PHE A 44 5.871 -9.968 6.836 1.00 0.00 H new ATOM 0 HZ PHE A 44 4.345 -10.677 5.016 1.00 0.00 H new ATOM 697 N LEU A 45 12.630 -10.420 4.149 1.00 0.00 N ATOM 698 CA LEU A 45 13.995 -10.314 3.622 1.00 0.00 C ATOM 699 C LEU A 45 14.823 -11.546 3.961 1.00 0.00 C ATOM 700 O LEU A 45 15.643 -11.997 3.162 1.00 0.00 O ATOM 701 CB LEU A 45 14.687 -9.031 4.136 1.00 0.00 C ATOM 702 CG LEU A 45 14.654 -7.946 3.047 1.00 0.00 C ATOM 703 CD1 LEU A 45 15.649 -8.335 1.936 1.00 0.00 C ATOM 704 CD2 LEU A 45 13.228 -7.799 2.473 1.00 0.00 C ATOM 0 H LEU A 45 12.438 -9.839 4.965 1.00 0.00 H new ATOM 0 HA LEU A 45 13.922 -10.253 2.536 1.00 0.00 H new ATOM 0 HB2 LEU A 45 14.185 -8.672 5.035 1.00 0.00 H new ATOM 0 HB3 LEU A 45 15.718 -9.250 4.413 1.00 0.00 H new ATOM 0 HG LEU A 45 14.940 -6.985 3.475 1.00 0.00 H new ATOM 0 HD11 LEU A 45 15.638 -7.575 1.155 1.00 0.00 H new ATOM 0 HD12 LEU A 45 16.652 -8.409 2.356 1.00 0.00 H new ATOM 0 HD13 LEU A 45 15.362 -9.297 1.511 1.00 0.00 H new ATOM 0 HD21 LEU A 45 13.223 -7.027 1.704 1.00 0.00 H new ATOM 0 HD22 LEU A 45 12.911 -8.747 2.038 1.00 0.00 H new ATOM 0 HD23 LEU A 45 12.541 -7.519 3.272 1.00 0.00 H new ATOM 716 N ASP A 46 14.605 -12.075 5.148 1.00 0.00 N ATOM 717 CA ASP A 46 15.334 -13.247 5.598 1.00 0.00 C ATOM 718 C ASP A 46 15.120 -14.433 4.661 1.00 0.00 C ATOM 719 O ASP A 46 15.976 -15.312 4.553 1.00 0.00 O ATOM 720 CB ASP A 46 14.920 -13.627 7.021 1.00 0.00 C ATOM 721 CG ASP A 46 15.834 -14.726 7.552 1.00 0.00 C ATOM 722 OD1 ASP A 46 16.784 -15.062 6.864 1.00 0.00 O ATOM 723 OD2 ASP A 46 15.569 -15.216 8.637 1.00 0.00 O ATOM 0 H ASP A 46 13.929 -11.713 5.820 1.00 0.00 H new ATOM 0 HA ASP A 46 16.394 -12.994 5.591 1.00 0.00 H new ATOM 0 HB2 ASP A 46 14.973 -12.753 7.670 1.00 0.00 H new ATOM 0 HB3 ASP A 46 13.885 -13.968 7.029 1.00 0.00 H new ATOM 728 N ALA A 47 13.957 -14.475 4.024 1.00 0.00 N ATOM 729 CA ALA A 47 13.619 -15.586 3.144 1.00 0.00 C ATOM 730 C ALA A 47 14.675 -15.791 2.062 1.00 0.00 C ATOM 731 O ALA A 47 14.881 -16.917 1.610 1.00 0.00 O ATOM 732 CB ALA A 47 12.263 -15.330 2.486 1.00 0.00 C ATOM 0 H ALA A 47 13.236 -13.758 4.099 1.00 0.00 H new ATOM 0 HA ALA A 47 13.577 -16.490 3.752 1.00 0.00 H new ATOM 0 HB1 ALA A 47 12.014 -16.163 1.829 1.00 0.00 H new ATOM 0 HB2 ALA A 47 11.497 -15.234 3.256 1.00 0.00 H new ATOM 0 HB3 ALA A 47 12.309 -14.410 1.903 1.00 0.00 H new ATOM 738 N GLN A 48 15.353 -14.724 1.643 1.00 0.00 N ATOM 739 CA GLN A 48 16.378 -14.882 0.616 1.00 0.00 C ATOM 740 C GLN A 48 17.740 -15.104 1.272 1.00 0.00 C ATOM 741 O GLN A 48 18.229 -14.254 2.018 1.00 0.00 O ATOM 742 CB GLN A 48 16.436 -13.633 -0.256 1.00 0.00 C ATOM 743 CG GLN A 48 15.040 -13.308 -0.784 1.00 0.00 C ATOM 744 CD GLN A 48 14.457 -14.518 -1.502 1.00 0.00 C ATOM 745 OE1 GLN A 48 15.082 -15.064 -2.411 1.00 0.00 O ATOM 746 NE2 GLN A 48 13.295 -14.982 -1.131 1.00 0.00 N ATOM 0 H GLN A 48 15.218 -13.773 1.985 1.00 0.00 H new ATOM 0 HA GLN A 48 16.128 -15.744 -0.002 1.00 0.00 H new ATOM 0 HB2 GLN A 48 16.822 -12.793 0.321 1.00 0.00 H new ATOM 0 HB3 GLN A 48 17.122 -13.790 -1.088 1.00 0.00 H new ATOM 0 HG2 GLN A 48 14.390 -13.017 0.041 1.00 0.00 H new ATOM 0 HG3 GLN A 48 15.089 -12.459 -1.466 1.00 0.00 H new ATOM 0 HE21 GLN A 48 12.781 -14.526 -0.377 1.00 0.00 H new ATOM 0 HE22 GLN A 48 12.901 -15.801 -1.595 1.00 0.00 H new ATOM 755 N LYS A 49 18.334 -16.260 1.003 1.00 0.00 N ATOM 756 CA LYS A 49 19.630 -16.614 1.579 1.00 0.00 C ATOM 757 C LYS A 49 20.770 -15.688 1.148 1.00 0.00 C ATOM 758 O LYS A 49 21.685 -15.428 1.929 1.00 0.00 O ATOM 759 CB LYS A 49 19.982 -18.055 1.209 1.00 0.00 C ATOM 760 CG LYS A 49 18.970 -19.008 1.847 1.00 0.00 C ATOM 761 CD LYS A 49 19.390 -20.454 1.576 1.00 0.00 C ATOM 762 CE LYS A 49 18.315 -21.406 2.106 1.00 0.00 C ATOM 763 NZ LYS A 49 18.435 -21.515 3.587 1.00 0.00 N ATOM 0 H LYS A 49 17.939 -16.972 0.388 1.00 0.00 H new ATOM 0 HA LYS A 49 19.526 -16.502 2.658 1.00 0.00 H new ATOM 0 HB2 LYS A 49 19.977 -18.175 0.126 1.00 0.00 H new ATOM 0 HB3 LYS A 49 20.989 -18.294 1.552 1.00 0.00 H new ATOM 0 HG2 LYS A 49 18.913 -18.830 2.921 1.00 0.00 H new ATOM 0 HG3 LYS A 49 17.975 -18.825 1.441 1.00 0.00 H new ATOM 0 HD2 LYS A 49 19.532 -20.608 0.506 1.00 0.00 H new ATOM 0 HD3 LYS A 49 20.345 -20.663 2.058 1.00 0.00 H new ATOM 0 HE2 LYS A 49 17.324 -21.039 1.837 1.00 0.00 H new ATOM 0 HE3 LYS A 49 18.427 -22.389 1.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 17.738 -22.200 3.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 19.393 -21.835 3.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 18.258 -20.586 4.019 1.00 0.00 H new ATOM 777 N ASP A 50 20.746 -15.233 -0.100 1.00 0.00 N ATOM 778 CA ASP A 50 21.830 -14.389 -0.602 1.00 0.00 C ATOM 779 C ASP A 50 21.830 -12.997 0.021 1.00 0.00 C ATOM 780 O ASP A 50 20.779 -12.395 0.237 1.00 0.00 O ATOM 781 CB ASP A 50 21.744 -14.248 -2.116 1.00 0.00 C ATOM 782 CG ASP A 50 21.995 -15.596 -2.783 1.00 0.00 C ATOM 783 OD1 ASP A 50 22.461 -16.494 -2.101 1.00 0.00 O ATOM 784 OD2 ASP A 50 21.719 -15.711 -3.966 1.00 0.00 O ATOM 0 H ASP A 50 20.005 -15.428 -0.773 1.00 0.00 H new ATOM 0 HA ASP A 50 22.758 -14.887 -0.320 1.00 0.00 H new ATOM 0 HB2 ASP A 50 20.761 -13.871 -2.399 1.00 0.00 H new ATOM 0 HB3 ASP A 50 22.477 -13.520 -2.463 1.00 0.00 H new ATOM 789 N VAL A 51 23.034 -12.483 0.277 1.00 0.00 N ATOM 790 CA VAL A 51 23.187 -11.147 0.843 1.00 0.00 C ATOM 791 C VAL A 51 22.889 -10.107 -0.231 1.00 0.00 C ATOM 792 O VAL A 51 22.457 -8.992 0.061 1.00 0.00 O ATOM 793 CB VAL A 51 24.612 -10.945 1.374 1.00 0.00 C ATOM 794 CG1 VAL A 51 25.020 -12.143 2.240 1.00 0.00 C ATOM 795 CG2 VAL A 51 25.593 -10.786 0.204 1.00 0.00 C ATOM 0 H VAL A 51 23.912 -12.971 0.101 1.00 0.00 H new ATOM 0 HA VAL A 51 22.489 -11.034 1.672 1.00 0.00 H new ATOM 0 HB VAL A 51 24.639 -10.040 1.982 1.00 0.00 H new ATOM 0 HG11 VAL A 51 26.033 -11.993 2.614 1.00 0.00 H new ATOM 0 HG12 VAL A 51 24.333 -12.235 3.081 1.00 0.00 H new ATOM 0 HG13 VAL A 51 24.985 -13.053 1.641 1.00 0.00 H new ATOM 0 HG21 VAL A 51 26.602 -10.643 0.592 1.00 0.00 H new ATOM 0 HG22 VAL A 51 25.566 -11.681 -0.417 1.00 0.00 H new ATOM 0 HG23 VAL A 51 25.308 -9.921 -0.394 1.00 0.00 H new ATOM 805 N ASP A 52 23.119 -10.501 -1.480 1.00 0.00 N ATOM 806 CA ASP A 52 22.872 -9.627 -2.619 1.00 0.00 C ATOM 807 C ASP A 52 21.386 -9.608 -2.930 1.00 0.00 C ATOM 808 O ASP A 52 20.931 -8.942 -3.866 1.00 0.00 O ATOM 809 CB ASP A 52 23.648 -10.122 -3.841 1.00 0.00 C ATOM 810 CG ASP A 52 25.147 -9.978 -3.601 1.00 0.00 C ATOM 811 OD1 ASP A 52 25.513 -9.307 -2.651 1.00 0.00 O ATOM 812 OD2 ASP A 52 25.907 -10.542 -4.371 1.00 0.00 O ATOM 0 H ASP A 52 23.477 -11.423 -1.728 1.00 0.00 H new ATOM 0 HA ASP A 52 23.206 -8.619 -2.374 1.00 0.00 H new ATOM 0 HB2 ASP A 52 23.402 -11.165 -4.040 1.00 0.00 H new ATOM 0 HB3 ASP A 52 23.356 -9.552 -4.723 1.00 0.00 H new ATOM 817 N ALA A 53 20.632 -10.358 -2.137 1.00 0.00 N ATOM 818 CA ALA A 53 19.200 -10.439 -2.334 1.00 0.00 C ATOM 819 C ALA A 53 18.588 -9.049 -2.276 1.00 0.00 C ATOM 820 O ALA A 53 17.671 -8.740 -3.036 1.00 0.00 O ATOM 821 CB ALA A 53 18.585 -11.307 -1.245 1.00 0.00 C ATOM 0 H ALA A 53 20.989 -10.913 -1.359 1.00 0.00 H new ATOM 0 HA ALA A 53 19.000 -10.879 -3.311 1.00 0.00 H new ATOM 0 HB1 ALA A 53 17.507 -11.368 -1.394 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.015 -12.308 -1.291 1.00 0.00 H new ATOM 0 HB3 ALA A 53 18.793 -10.868 -0.269 1.00 0.00 H new ATOM 827 N VAL A 54 19.108 -8.200 -1.395 1.00 0.00 N ATOM 828 CA VAL A 54 18.590 -6.845 -1.305 1.00 0.00 C ATOM 829 C VAL A 54 18.768 -6.138 -2.636 1.00 0.00 C ATOM 830 O VAL A 54 17.860 -5.455 -3.120 1.00 0.00 O ATOM 831 CB VAL A 54 19.345 -6.066 -0.230 1.00 0.00 C ATOM 832 CG1 VAL A 54 20.774 -5.800 -0.716 1.00 0.00 C ATOM 833 CG2 VAL A 54 18.638 -4.727 0.014 1.00 0.00 C ATOM 0 H VAL A 54 19.867 -8.420 -0.750 1.00 0.00 H new ATOM 0 HA VAL A 54 17.532 -6.893 -1.048 1.00 0.00 H new ATOM 0 HB VAL A 54 19.370 -6.642 0.695 1.00 0.00 H new ATOM 0 HG11 VAL A 54 21.320 -5.244 0.046 1.00 0.00 H new ATOM 0 HG12 VAL A 54 21.277 -6.749 -0.903 1.00 0.00 H new ATOM 0 HG13 VAL A 54 20.743 -5.218 -1.637 1.00 0.00 H new ATOM 0 HG21 VAL A 54 19.173 -4.167 0.781 1.00 0.00 H new ATOM 0 HG22 VAL A 54 18.621 -4.151 -0.911 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.616 -4.910 0.346 1.00 0.00 H new ATOM 843 N ASP A 55 19.939 -6.323 -3.239 1.00 0.00 N ATOM 844 CA ASP A 55 20.200 -5.708 -4.523 1.00 0.00 C ATOM 845 C ASP A 55 19.208 -6.234 -5.539 1.00 0.00 C ATOM 846 O ASP A 55 18.659 -5.480 -6.336 1.00 0.00 O ATOM 847 CB ASP A 55 21.627 -6.024 -4.979 1.00 0.00 C ATOM 848 CG ASP A 55 21.962 -5.225 -6.234 1.00 0.00 C ATOM 849 OD1 ASP A 55 22.355 -4.078 -6.094 1.00 0.00 O ATOM 850 OD2 ASP A 55 21.820 -5.771 -7.315 1.00 0.00 O ATOM 0 H ASP A 55 20.704 -6.883 -2.863 1.00 0.00 H new ATOM 0 HA ASP A 55 20.093 -4.627 -4.433 1.00 0.00 H new ATOM 0 HB2 ASP A 55 22.333 -5.782 -4.185 1.00 0.00 H new ATOM 0 HB3 ASP A 55 21.726 -7.091 -5.180 1.00 0.00 H new ATOM 855 N LYS A 56 18.967 -7.539 -5.486 1.00 0.00 N ATOM 856 CA LYS A 56 18.020 -8.154 -6.400 1.00 0.00 C ATOM 857 C LYS A 56 16.622 -7.575 -6.201 1.00 0.00 C ATOM 858 O LYS A 56 15.888 -7.354 -7.163 1.00 0.00 O ATOM 859 CB LYS A 56 17.989 -9.666 -6.175 1.00 0.00 C ATOM 860 CG LYS A 56 19.354 -10.259 -6.530 1.00 0.00 C ATOM 861 CD LYS A 56 19.299 -11.782 -6.416 1.00 0.00 C ATOM 862 CE LYS A 56 20.694 -12.364 -6.657 1.00 0.00 C ATOM 863 NZ LYS A 56 20.715 -13.793 -6.237 1.00 0.00 N ATOM 0 H LYS A 56 19.409 -8.182 -4.829 1.00 0.00 H new ATOM 0 HA LYS A 56 18.340 -7.944 -7.421 1.00 0.00 H new ATOM 0 HB2 LYS A 56 17.744 -9.885 -5.136 1.00 0.00 H new ATOM 0 HB3 LYS A 56 17.212 -10.121 -6.789 1.00 0.00 H new ATOM 0 HG2 LYS A 56 19.634 -9.970 -7.543 1.00 0.00 H new ATOM 0 HG3 LYS A 56 20.119 -9.862 -5.862 1.00 0.00 H new ATOM 0 HD2 LYS A 56 18.939 -12.070 -5.428 1.00 0.00 H new ATOM 0 HD3 LYS A 56 18.594 -12.186 -7.143 1.00 0.00 H new ATOM 0 HE2 LYS A 56 20.958 -12.280 -7.711 1.00 0.00 H new ATOM 0 HE3 LYS A 56 21.438 -11.798 -6.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 21.197 -14.361 -6.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 21.223 -13.882 -5.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 19.740 -14.135 -6.121 1.00 0.00 H new ATOM 877 N VAL A 57 16.259 -7.340 -4.940 1.00 0.00 N ATOM 878 CA VAL A 57 14.941 -6.798 -4.629 1.00 0.00 C ATOM 879 C VAL A 57 14.764 -5.378 -5.162 1.00 0.00 C ATOM 880 O VAL A 57 13.723 -5.046 -5.721 1.00 0.00 O ATOM 881 CB VAL A 57 14.731 -6.779 -3.108 1.00 0.00 C ATOM 882 CG1 VAL A 57 13.428 -6.046 -2.785 1.00 0.00 C ATOM 883 CG2 VAL A 57 14.648 -8.209 -2.565 1.00 0.00 C ATOM 0 H VAL A 57 16.852 -7.514 -4.128 1.00 0.00 H new ATOM 0 HA VAL A 57 14.206 -7.442 -5.112 1.00 0.00 H new ATOM 0 HB VAL A 57 15.574 -6.268 -2.643 1.00 0.00 H new ATOM 0 HG11 VAL A 57 13.277 -6.031 -1.706 1.00 0.00 H new ATOM 0 HG12 VAL A 57 13.484 -5.023 -3.158 1.00 0.00 H new ATOM 0 HG13 VAL A 57 12.593 -6.560 -3.261 1.00 0.00 H new ATOM 0 HG21 VAL A 57 14.499 -8.180 -1.486 1.00 0.00 H new ATOM 0 HG22 VAL A 57 13.811 -8.728 -3.033 1.00 0.00 H new ATOM 0 HG23 VAL A 57 15.574 -8.738 -2.789 1.00 0.00 H new ATOM 893 N MET A 58 15.776 -4.536 -4.952 1.00 0.00 N ATOM 894 CA MET A 58 15.702 -3.136 -5.377 1.00 0.00 C ATOM 895 C MET A 58 15.661 -2.931 -6.899 1.00 0.00 C ATOM 896 O MET A 58 15.013 -1.989 -7.371 1.00 0.00 O ATOM 897 CB MET A 58 16.824 -2.313 -4.722 1.00 0.00 C ATOM 898 CG MET A 58 18.117 -2.370 -5.536 1.00 0.00 C ATOM 899 SD MET A 58 18.210 -0.924 -6.621 1.00 0.00 S ATOM 900 CE MET A 58 19.062 0.177 -5.465 1.00 0.00 C ATOM 0 H MET A 58 16.650 -4.795 -4.494 1.00 0.00 H new ATOM 0 HA MET A 58 14.738 -2.769 -5.025 1.00 0.00 H new ATOM 0 HB2 MET A 58 16.503 -1.276 -4.621 1.00 0.00 H new ATOM 0 HB3 MET A 58 17.011 -2.688 -3.716 1.00 0.00 H new ATOM 0 HG2 MET A 58 18.979 -2.394 -4.869 1.00 0.00 H new ATOM 0 HG3 MET A 58 18.147 -3.285 -6.128 1.00 0.00 H new ATOM 0 HE1 MET A 58 18.668 1.188 -5.568 1.00 0.00 H new ATOM 0 HE2 MET A 58 18.902 -0.172 -4.445 1.00 0.00 H new ATOM 0 HE3 MET A 58 20.130 0.179 -5.685 1.00 0.00 H new ATOM 910 N LYS A 59 16.328 -3.781 -7.682 1.00 0.00 N ATOM 911 CA LYS A 59 16.291 -3.584 -9.131 1.00 0.00 C ATOM 912 C LYS A 59 14.859 -3.643 -9.638 1.00 0.00 C ATOM 913 O LYS A 59 14.464 -2.855 -10.497 1.00 0.00 O ATOM 914 CB LYS A 59 17.145 -4.623 -9.872 1.00 0.00 C ATOM 915 CG LYS A 59 18.606 -4.507 -9.464 1.00 0.00 C ATOM 916 CD LYS A 59 19.127 -3.130 -9.893 1.00 0.00 C ATOM 917 CE LYS A 59 20.575 -3.266 -10.329 1.00 0.00 C ATOM 918 NZ LYS A 59 21.407 -3.726 -9.182 1.00 0.00 N ATOM 0 H LYS A 59 16.876 -4.577 -7.357 1.00 0.00 H new ATOM 0 HA LYS A 59 16.709 -2.598 -9.333 1.00 0.00 H new ATOM 0 HB2 LYS A 59 16.779 -5.626 -9.652 1.00 0.00 H new ATOM 0 HB3 LYS A 59 17.050 -4.478 -10.948 1.00 0.00 H new ATOM 0 HG2 LYS A 59 18.708 -4.631 -8.386 1.00 0.00 H new ATOM 0 HG3 LYS A 59 19.193 -5.296 -9.933 1.00 0.00 H new ATOM 0 HD2 LYS A 59 18.523 -2.736 -10.710 1.00 0.00 H new ATOM 0 HD3 LYS A 59 19.047 -2.423 -9.068 1.00 0.00 H new ATOM 0 HE2 LYS A 59 20.651 -3.976 -11.153 1.00 0.00 H new ATOM 0 HE3 LYS A 59 20.945 -2.309 -10.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 22.414 -3.656 -9.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 21.215 -3.129 -8.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 21.174 -4.715 -8.959 1.00 0.00 H new ATOM 932 N GLU A 60 14.077 -4.562 -9.087 1.00 0.00 N ATOM 933 CA GLU A 60 12.683 -4.680 -9.485 1.00 0.00 C ATOM 934 C GLU A 60 11.916 -3.421 -9.115 1.00 0.00 C ATOM 935 O GLU A 60 11.043 -2.968 -9.855 1.00 0.00 O ATOM 936 CB GLU A 60 12.043 -5.877 -8.781 1.00 0.00 C ATOM 937 CG GLU A 60 10.614 -6.069 -9.292 1.00 0.00 C ATOM 938 CD GLU A 60 9.936 -7.201 -8.527 1.00 0.00 C ATOM 939 OE1 GLU A 60 10.568 -7.754 -7.642 1.00 0.00 O ATOM 940 OE2 GLU A 60 8.794 -7.497 -8.838 1.00 0.00 O ATOM 0 H GLU A 60 14.379 -5.226 -8.374 1.00 0.00 H new ATOM 0 HA GLU A 60 12.644 -4.820 -10.565 1.00 0.00 H new ATOM 0 HB2 GLU A 60 12.630 -6.777 -8.966 1.00 0.00 H new ATOM 0 HB3 GLU A 60 12.036 -5.717 -7.703 1.00 0.00 H new ATOM 0 HG2 GLU A 60 10.048 -5.146 -9.170 1.00 0.00 H new ATOM 0 HG3 GLU A 60 10.627 -6.296 -10.358 1.00 0.00 H new ATOM 947 N LEU A 61 12.240 -2.877 -7.948 1.00 0.00 N ATOM 948 CA LEU A 61 11.565 -1.681 -7.464 1.00 0.00 C ATOM 949 C LEU A 61 11.888 -0.463 -8.298 1.00 0.00 C ATOM 950 O LEU A 61 11.037 0.407 -8.477 1.00 0.00 O ATOM 951 CB LEU A 61 11.938 -1.385 -6.005 1.00 0.00 C ATOM 952 CG LEU A 61 11.607 -2.569 -5.084 1.00 0.00 C ATOM 953 CD1 LEU A 61 11.899 -2.164 -3.635 1.00 0.00 C ATOM 954 CD2 LEU A 61 10.129 -2.965 -5.209 1.00 0.00 C ATOM 0 H LEU A 61 12.960 -3.242 -7.324 1.00 0.00 H new ATOM 0 HA LEU A 61 10.497 -1.887 -7.541 1.00 0.00 H new ATOM 0 HB2 LEU A 61 13.002 -1.159 -5.940 1.00 0.00 H new ATOM 0 HB3 LEU A 61 11.403 -0.498 -5.665 1.00 0.00 H new ATOM 0 HG LEU A 61 12.219 -3.423 -5.375 1.00 0.00 H new ATOM 0 HD11 LEU A 61 11.668 -2.997 -2.971 1.00 0.00 H new ATOM 0 HD12 LEU A 61 12.952 -1.902 -3.536 1.00 0.00 H new ATOM 0 HD13 LEU A 61 11.285 -1.305 -3.367 1.00 0.00 H new ATOM 0 HD21 LEU A 61 9.920 -3.805 -4.547 1.00 0.00 H new ATOM 0 HD22 LEU A 61 9.501 -2.119 -4.930 1.00 0.00 H new ATOM 0 HD23 LEU A 61 9.915 -3.252 -6.238 1.00 0.00 H new ATOM 966 N ASP A 62 13.114 -0.364 -8.784 1.00 0.00 N ATOM 967 CA ASP A 62 13.457 0.812 -9.550 1.00 0.00 C ATOM 968 C ASP A 62 12.780 0.780 -10.909 1.00 0.00 C ATOM 969 O ASP A 62 13.438 0.613 -11.936 1.00 0.00 O ATOM 970 CB ASP A 62 14.969 0.912 -9.734 1.00 0.00 C ATOM 971 CG ASP A 62 15.332 2.301 -10.258 1.00 0.00 C ATOM 972 OD1 ASP A 62 14.511 3.200 -10.124 1.00 0.00 O ATOM 973 OD2 ASP A 62 16.420 2.445 -10.786 1.00 0.00 O ATOM 0 H ASP A 62 13.857 -1.053 -8.667 1.00 0.00 H new ATOM 0 HA ASP A 62 13.108 1.686 -8.999 1.00 0.00 H new ATOM 0 HB2 ASP A 62 15.474 0.727 -8.786 1.00 0.00 H new ATOM 0 HB3 ASP A 62 15.312 0.148 -10.432 1.00 0.00 H new ATOM 978 N GLU A 63 11.471 1.026 -10.919 1.00 0.00 N ATOM 979 CA GLU A 63 10.757 1.104 -12.186 1.00 0.00 C ATOM 980 C GLU A 63 11.328 2.265 -12.939 1.00 0.00 C ATOM 981 O GLU A 63 11.524 2.247 -14.154 1.00 0.00 O ATOM 982 CB GLU A 63 9.265 1.332 -11.946 1.00 0.00 C ATOM 983 CG GLU A 63 8.553 1.419 -13.293 1.00 0.00 C ATOM 984 CD GLU A 63 7.068 1.695 -13.087 1.00 0.00 C ATOM 985 OE1 GLU A 63 6.666 1.842 -11.946 1.00 0.00 O ATOM 986 OE2 GLU A 63 6.355 1.757 -14.075 1.00 0.00 O ATOM 0 H GLU A 63 10.899 1.171 -10.087 1.00 0.00 H new ATOM 0 HA GLU A 63 10.869 0.175 -12.745 1.00 0.00 H new ATOM 0 HB2 GLU A 63 8.850 0.517 -11.353 1.00 0.00 H new ATOM 0 HB3 GLU A 63 9.111 2.250 -11.379 1.00 0.00 H new ATOM 0 HG2 GLU A 63 8.997 2.210 -13.897 1.00 0.00 H new ATOM 0 HG3 GLU A 63 8.684 0.487 -13.843 1.00 0.00 H new ATOM 993 N ASN A 64 11.610 3.261 -12.144 1.00 0.00 N ATOM 994 CA ASN A 64 12.196 4.488 -12.586 1.00 0.00 C ATOM 995 C ASN A 64 13.540 4.244 -13.282 1.00 0.00 C ATOM 996 O ASN A 64 13.837 4.857 -14.307 1.00 0.00 O ATOM 997 CB ASN A 64 12.327 5.330 -11.329 1.00 0.00 C ATOM 998 CG ASN A 64 12.944 6.682 -11.587 1.00 0.00 C ATOM 999 OD1 ASN A 64 14.016 6.953 -11.055 1.00 0.00 O ATOM 1000 ND2 ASN A 64 12.344 7.543 -12.364 1.00 0.00 N ATOM 0 H ASN A 64 11.431 3.236 -11.140 1.00 0.00 H new ATOM 0 HA ASN A 64 11.589 4.996 -13.335 1.00 0.00 H new ATOM 0 HB2 ASN A 64 11.341 5.466 -10.885 1.00 0.00 H new ATOM 0 HB3 ASN A 64 12.934 4.793 -10.600 1.00 0.00 H new ATOM 0 HD21 ASN A 64 12.766 8.456 -12.536 1.00 0.00 H new ATOM 0 HD22 ASN A 64 11.453 7.303 -12.799 1.00 0.00 H new ATOM 1007 N GLY A 65 14.327 3.317 -12.736 1.00 0.00 N ATOM 1008 CA GLY A 65 15.616 2.964 -13.332 1.00 0.00 C ATOM 1009 C GLY A 65 16.723 3.963 -12.990 1.00 0.00 C ATOM 1010 O GLY A 65 17.743 4.016 -13.676 1.00 0.00 O ATOM 0 H GLY A 65 14.097 2.800 -11.888 1.00 0.00 H new ATOM 0 HA2 GLY A 65 15.910 1.972 -12.989 1.00 0.00 H new ATOM 0 HA3 GLY A 65 15.507 2.907 -14.415 1.00 0.00 H new ATOM 1014 N ASP A 66 16.529 4.759 -11.944 1.00 0.00 N ATOM 1015 CA ASP A 66 17.542 5.746 -11.565 1.00 0.00 C ATOM 1016 C ASP A 66 18.572 5.186 -10.579 1.00 0.00 C ATOM 1017 O ASP A 66 19.474 5.902 -10.148 1.00 0.00 O ATOM 1018 CB ASP A 66 16.851 6.969 -10.953 1.00 0.00 C ATOM 1019 CG ASP A 66 16.097 6.567 -9.684 1.00 0.00 C ATOM 1020 OD1 ASP A 66 16.290 5.457 -9.223 1.00 0.00 O ATOM 1021 OD2 ASP A 66 15.324 7.376 -9.198 1.00 0.00 O ATOM 0 H ASP A 66 15.699 4.745 -11.352 1.00 0.00 H new ATOM 0 HA ASP A 66 18.084 6.024 -12.469 1.00 0.00 H new ATOM 0 HB2 ASP A 66 17.590 7.735 -10.719 1.00 0.00 H new ATOM 0 HB3 ASP A 66 16.159 7.404 -11.674 1.00 0.00 H new ATOM 1026 N GLY A 67 18.451 3.910 -10.241 1.00 0.00 N ATOM 1027 CA GLY A 67 19.397 3.280 -9.318 1.00 0.00 C ATOM 1028 C GLY A 67 18.937 3.474 -7.879 1.00 0.00 C ATOM 1029 O GLY A 67 19.551 2.977 -6.936 1.00 0.00 O ATOM 0 H GLY A 67 17.716 3.292 -10.586 1.00 0.00 H new ATOM 0 HA2 GLY A 67 19.480 2.216 -9.541 1.00 0.00 H new ATOM 0 HA3 GLY A 67 20.389 3.712 -9.452 1.00 0.00 H new ATOM 1033 N GLU A 68 17.839 4.202 -7.739 1.00 0.00 N ATOM 1034 CA GLU A 68 17.242 4.487 -6.439 1.00 0.00 C ATOM 1035 C GLU A 68 15.820 3.967 -6.359 1.00 0.00 C ATOM 1036 O GLU A 68 15.140 3.808 -7.376 1.00 0.00 O ATOM 1037 CB GLU A 68 17.181 5.993 -6.172 1.00 0.00 C ATOM 1038 CG GLU A 68 18.565 6.609 -5.989 1.00 0.00 C ATOM 1039 CD GLU A 68 19.225 6.856 -7.342 1.00 0.00 C ATOM 1040 OE1 GLU A 68 18.512 6.889 -8.330 1.00 0.00 O ATOM 1041 OE2 GLU A 68 20.433 7.022 -7.367 1.00 0.00 O ATOM 0 H GLU A 68 17.335 4.613 -8.524 1.00 0.00 H new ATOM 0 HA GLU A 68 17.874 3.992 -5.701 1.00 0.00 H new ATOM 0 HB2 GLU A 68 16.674 6.486 -7.002 1.00 0.00 H new ATOM 0 HB3 GLU A 68 16.584 6.177 -5.279 1.00 0.00 H new ATOM 0 HG2 GLU A 68 18.482 7.548 -5.442 1.00 0.00 H new ATOM 0 HG3 GLU A 68 19.188 5.945 -5.390 1.00 0.00 H new ATOM 1048 N VAL A 69 15.357 3.782 -5.133 1.00 0.00 N ATOM 1049 CA VAL A 69 13.993 3.365 -4.898 1.00 0.00 C ATOM 1050 C VAL A 69 13.238 4.592 -4.411 1.00 0.00 C ATOM 1051 O VAL A 69 13.706 5.299 -3.519 1.00 0.00 O ATOM 1052 CB VAL A 69 13.952 2.254 -3.840 1.00 0.00 C ATOM 1053 CG1 VAL A 69 12.522 1.759 -3.630 1.00 0.00 C ATOM 1054 CG2 VAL A 69 14.829 1.097 -4.288 1.00 0.00 C ATOM 0 H VAL A 69 15.911 3.916 -4.287 1.00 0.00 H new ATOM 0 HA VAL A 69 13.542 2.967 -5.807 1.00 0.00 H new ATOM 0 HB VAL A 69 14.322 2.657 -2.897 1.00 0.00 H new ATOM 0 HG11 VAL A 69 12.516 0.972 -2.876 1.00 0.00 H new ATOM 0 HG12 VAL A 69 11.896 2.586 -3.295 1.00 0.00 H new ATOM 0 HG13 VAL A 69 12.132 1.365 -4.568 1.00 0.00 H new ATOM 0 HG21 VAL A 69 14.801 0.307 -3.537 1.00 0.00 H new ATOM 0 HG22 VAL A 69 14.461 0.708 -5.238 1.00 0.00 H new ATOM 0 HG23 VAL A 69 15.855 1.444 -4.411 1.00 0.00 H new ATOM 1064 N ASP A 70 12.091 4.871 -5.017 1.00 0.00 N ATOM 1065 CA ASP A 70 11.320 6.056 -4.644 1.00 0.00 C ATOM 1066 C ASP A 70 10.143 5.699 -3.751 1.00 0.00 C ATOM 1067 O ASP A 70 9.736 4.544 -3.666 1.00 0.00 O ATOM 1068 CB ASP A 70 10.851 6.813 -5.888 1.00 0.00 C ATOM 1069 CG ASP A 70 10.207 8.135 -5.485 1.00 0.00 C ATOM 1070 OD1 ASP A 70 10.937 9.093 -5.297 1.00 0.00 O ATOM 1071 OD2 ASP A 70 8.993 8.170 -5.369 1.00 0.00 O ATOM 0 H ASP A 70 11.677 4.305 -5.758 1.00 0.00 H new ATOM 0 HA ASP A 70 11.978 6.710 -4.073 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.696 6.998 -6.551 1.00 0.00 H new ATOM 0 HB3 ASP A 70 10.137 6.206 -6.445 1.00 0.00 H new ATOM 1076 N PHE A 71 9.623 6.707 -3.066 1.00 0.00 N ATOM 1077 CA PHE A 71 8.513 6.513 -2.147 1.00 0.00 C ATOM 1078 C PHE A 71 7.409 5.738 -2.859 1.00 0.00 C ATOM 1079 O PHE A 71 6.852 4.801 -2.312 1.00 0.00 O ATOM 1080 CB PHE A 71 8.002 7.907 -1.749 1.00 0.00 C ATOM 1081 CG PHE A 71 7.090 7.904 -0.530 1.00 0.00 C ATOM 1082 CD1 PHE A 71 6.541 6.723 0.005 1.00 0.00 C ATOM 1083 CD2 PHE A 71 6.784 9.132 0.064 1.00 0.00 C ATOM 1084 CE1 PHE A 71 5.699 6.786 1.122 1.00 0.00 C ATOM 1085 CE2 PHE A 71 5.945 9.187 1.178 1.00 0.00 C ATOM 1086 CZ PHE A 71 5.405 8.016 1.704 1.00 0.00 C ATOM 0 H PHE A 71 9.954 7.670 -3.130 1.00 0.00 H new ATOM 0 HA PHE A 71 8.821 5.953 -1.264 1.00 0.00 H new ATOM 0 HB2 PHE A 71 8.857 8.553 -1.550 1.00 0.00 H new ATOM 0 HB3 PHE A 71 7.464 8.341 -2.592 1.00 0.00 H new ATOM 0 HD1 PHE A 71 6.769 5.769 -0.446 1.00 0.00 H new ATOM 0 HD2 PHE A 71 7.199 10.043 -0.341 1.00 0.00 H new ATOM 0 HE1 PHE A 71 5.278 5.880 1.532 1.00 0.00 H new ATOM 0 HE2 PHE A 71 5.714 10.139 1.633 1.00 0.00 H new ATOM 0 HZ PHE A 71 4.756 8.062 2.566 1.00 0.00 H new ATOM 1096 N GLN A 72 7.112 6.098 -4.093 1.00 0.00 N ATOM 1097 CA GLN A 72 6.083 5.375 -4.832 1.00 0.00 C ATOM 1098 C GLN A 72 6.480 3.902 -5.015 1.00 0.00 C ATOM 1099 O GLN A 72 5.642 2.990 -4.890 1.00 0.00 O ATOM 1100 CB GLN A 72 5.872 6.035 -6.199 1.00 0.00 C ATOM 1101 CG GLN A 72 5.321 7.452 -5.996 1.00 0.00 C ATOM 1102 CD GLN A 72 5.131 8.155 -7.330 1.00 0.00 C ATOM 1103 OE1 GLN A 72 5.662 7.718 -8.351 1.00 0.00 O ATOM 1104 NE2 GLN A 72 4.397 9.232 -7.375 1.00 0.00 N ATOM 0 H GLN A 72 7.553 6.866 -4.599 1.00 0.00 H new ATOM 0 HA GLN A 72 5.153 5.411 -4.264 1.00 0.00 H new ATOM 0 HB2 GLN A 72 6.814 6.073 -6.747 1.00 0.00 H new ATOM 0 HB3 GLN A 72 5.178 5.445 -6.798 1.00 0.00 H new ATOM 0 HG2 GLN A 72 4.369 7.404 -5.466 1.00 0.00 H new ATOM 0 HG3 GLN A 72 6.005 8.027 -5.371 1.00 0.00 H new ATOM 0 HE21 GLN A 72 3.960 9.588 -6.524 1.00 0.00 H new ATOM 0 HE22 GLN A 72 4.259 9.719 -8.261 1.00 0.00 H new ATOM 1113 N GLU A 73 7.768 3.669 -5.295 1.00 0.00 N ATOM 1114 CA GLU A 73 8.250 2.306 -5.487 1.00 0.00 C ATOM 1115 C GLU A 73 8.114 1.513 -4.173 1.00 0.00 C ATOM 1116 O GLU A 73 7.660 0.357 -4.140 1.00 0.00 O ATOM 1117 CB GLU A 73 9.731 2.354 -5.894 1.00 0.00 C ATOM 1118 CG GLU A 73 9.917 3.099 -7.230 1.00 0.00 C ATOM 1119 CD GLU A 73 11.391 3.028 -7.645 1.00 0.00 C ATOM 1120 OE1 GLU A 73 12.065 2.162 -7.123 1.00 0.00 O ATOM 1121 OE2 GLU A 73 11.840 3.863 -8.441 1.00 0.00 O ATOM 0 H GLU A 73 8.479 4.394 -5.391 1.00 0.00 H new ATOM 0 HA GLU A 73 7.661 1.819 -6.264 1.00 0.00 H new ATOM 0 HB2 GLU A 73 10.309 2.850 -5.114 1.00 0.00 H new ATOM 0 HB3 GLU A 73 10.120 1.340 -5.983 1.00 0.00 H new ATOM 0 HG2 GLU A 73 9.288 2.652 -8.000 1.00 0.00 H new ATOM 0 HG3 GLU A 73 9.605 4.138 -7.127 1.00 0.00 H new ATOM 1128 N TYR A 74 8.473 2.182 -3.082 1.00 0.00 N ATOM 1129 CA TYR A 74 8.376 1.606 -1.745 1.00 0.00 C ATOM 1130 C TYR A 74 6.921 1.306 -1.402 1.00 0.00 C ATOM 1131 O TYR A 74 6.581 0.271 -0.808 1.00 0.00 O ATOM 1132 CB TYR A 74 8.942 2.611 -0.739 1.00 0.00 C ATOM 1133 CG TYR A 74 8.906 2.034 0.651 1.00 0.00 C ATOM 1134 CD1 TYR A 74 9.957 1.232 1.109 1.00 0.00 C ATOM 1135 CD2 TYR A 74 7.821 2.314 1.489 1.00 0.00 C ATOM 1136 CE1 TYR A 74 9.921 0.710 2.406 1.00 0.00 C ATOM 1137 CE2 TYR A 74 7.784 1.791 2.784 1.00 0.00 C ATOM 1138 CZ TYR A 74 8.834 0.989 3.243 1.00 0.00 C ATOM 1139 OH TYR A 74 8.798 0.478 4.520 1.00 0.00 O ATOM 0 H TYR A 74 8.838 3.134 -3.099 1.00 0.00 H new ATOM 0 HA TYR A 74 8.941 0.674 -1.708 1.00 0.00 H new ATOM 0 HB2 TYR A 74 9.967 2.867 -1.008 1.00 0.00 H new ATOM 0 HB3 TYR A 74 8.364 3.534 -0.772 1.00 0.00 H new ATOM 0 HD1 TYR A 74 10.795 1.016 0.462 1.00 0.00 H new ATOM 0 HD2 TYR A 74 7.012 2.935 1.134 1.00 0.00 H new ATOM 0 HE1 TYR A 74 10.732 0.092 2.762 1.00 0.00 H new ATOM 0 HE2 TYR A 74 6.946 2.006 3.430 1.00 0.00 H new ATOM 0 HH TYR A 74 7.890 0.560 4.880 1.00 0.00 H new ATOM 1149 N VAL A 75 6.080 2.252 -1.786 1.00 0.00 N ATOM 1150 CA VAL A 75 4.647 2.159 -1.533 1.00 0.00 C ATOM 1151 C VAL A 75 4.080 0.916 -2.205 1.00 0.00 C ATOM 1152 O VAL A 75 3.367 0.116 -1.565 1.00 0.00 O ATOM 1153 CB VAL A 75 3.925 3.482 -2.001 1.00 0.00 C ATOM 1154 CG1 VAL A 75 2.935 3.236 -3.144 1.00 0.00 C ATOM 1155 CG2 VAL A 75 3.154 4.115 -0.832 1.00 0.00 C ATOM 0 H VAL A 75 6.365 3.099 -2.277 1.00 0.00 H new ATOM 0 HA VAL A 75 4.467 2.058 -0.463 1.00 0.00 H new ATOM 0 HB VAL A 75 4.710 4.150 -2.355 1.00 0.00 H new ATOM 0 HG11 VAL A 75 2.466 4.178 -3.428 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.465 2.821 -4.002 1.00 0.00 H new ATOM 0 HG13 VAL A 75 2.169 2.533 -2.817 1.00 0.00 H new ATOM 0 HG21 VAL A 75 2.662 5.026 -1.172 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.405 3.412 -0.467 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.848 4.356 -0.027 1.00 0.00 H new ATOM 1165 N VAL A 76 4.417 0.706 -3.474 1.00 0.00 N ATOM 1166 CA VAL A 76 3.912 -0.488 -4.118 1.00 0.00 C ATOM 1167 C VAL A 76 4.549 -1.716 -3.478 1.00 0.00 C ATOM 1168 O VAL A 76 3.894 -2.739 -3.339 1.00 0.00 O ATOM 1169 CB VAL A 76 4.120 -0.467 -5.638 1.00 0.00 C ATOM 1170 CG1 VAL A 76 3.511 0.815 -6.215 1.00 0.00 C ATOM 1171 CG2 VAL A 76 5.607 -0.520 -5.975 1.00 0.00 C ATOM 0 H VAL A 76 5.005 1.313 -4.046 1.00 0.00 H new ATOM 0 HA VAL A 76 2.833 -0.527 -3.967 1.00 0.00 H new ATOM 0 HB VAL A 76 3.632 -1.339 -6.073 1.00 0.00 H new ATOM 0 HG11 VAL A 76 3.657 0.833 -7.295 1.00 0.00 H new ATOM 0 HG12 VAL A 76 2.444 0.843 -5.993 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.998 1.682 -5.768 1.00 0.00 H new ATOM 0 HG21 VAL A 76 5.736 -0.504 -7.057 1.00 0.00 H new ATOM 0 HG22 VAL A 76 6.110 0.342 -5.537 1.00 0.00 H new ATOM 0 HG23 VAL A 76 6.039 -1.436 -5.572 1.00 0.00 H new ATOM 1181 N LEU A 77 5.820 -1.629 -3.058 1.00 0.00 N ATOM 1182 CA LEU A 77 6.431 -2.795 -2.405 1.00 0.00 C ATOM 1183 C LEU A 77 5.629 -3.255 -1.188 1.00 0.00 C ATOM 1184 O LEU A 77 5.280 -4.433 -1.075 1.00 0.00 O ATOM 1185 CB LEU A 77 7.871 -2.461 -1.957 1.00 0.00 C ATOM 1186 CG LEU A 77 8.504 -3.596 -1.097 1.00 0.00 C ATOM 1187 CD1 LEU A 77 8.832 -4.865 -1.910 1.00 0.00 C ATOM 1188 CD2 LEU A 77 9.795 -3.061 -0.470 1.00 0.00 C ATOM 0 H LEU A 77 6.419 -0.808 -3.151 1.00 0.00 H new ATOM 0 HA LEU A 77 6.440 -3.603 -3.137 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.491 -2.287 -2.836 1.00 0.00 H new ATOM 0 HB3 LEU A 77 7.864 -1.535 -1.383 1.00 0.00 H new ATOM 0 HG LEU A 77 7.772 -3.883 -0.342 1.00 0.00 H new ATOM 0 HD11 LEU A 77 9.270 -5.616 -1.252 1.00 0.00 H new ATOM 0 HD12 LEU A 77 7.918 -5.260 -2.353 1.00 0.00 H new ATOM 0 HD13 LEU A 77 9.541 -4.618 -2.700 1.00 0.00 H new ATOM 0 HD21 LEU A 77 10.255 -3.841 0.137 1.00 0.00 H new ATOM 0 HD22 LEU A 77 10.485 -2.761 -1.258 1.00 0.00 H new ATOM 0 HD23 LEU A 77 9.565 -2.200 0.158 1.00 0.00 H new ATOM 1200 N VAL A 78 5.322 -2.344 -0.272 1.00 0.00 N ATOM 1201 CA VAL A 78 4.574 -2.773 0.910 1.00 0.00 C ATOM 1202 C VAL A 78 3.147 -3.168 0.561 1.00 0.00 C ATOM 1203 O VAL A 78 2.596 -4.104 1.150 1.00 0.00 O ATOM 1204 CB VAL A 78 4.550 -1.717 2.035 1.00 0.00 C ATOM 1205 CG1 VAL A 78 5.970 -1.451 2.520 1.00 0.00 C ATOM 1206 CG2 VAL A 78 3.912 -0.399 1.570 1.00 0.00 C ATOM 0 H VAL A 78 5.562 -1.354 -0.314 1.00 0.00 H new ATOM 0 HA VAL A 78 5.111 -3.645 1.284 1.00 0.00 H new ATOM 0 HB VAL A 78 3.943 -2.114 2.849 1.00 0.00 H new ATOM 0 HG11 VAL A 78 5.949 -0.705 3.314 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.403 -2.375 2.902 1.00 0.00 H new ATOM 0 HG13 VAL A 78 6.574 -1.082 1.691 1.00 0.00 H new ATOM 0 HG21 VAL A 78 3.915 0.317 2.392 1.00 0.00 H new ATOM 0 HG22 VAL A 78 4.482 0.006 0.734 1.00 0.00 H new ATOM 0 HG23 VAL A 78 2.885 -0.583 1.253 1.00 0.00 H new ATOM 1216 N ALA A 79 2.535 -2.467 -0.386 1.00 0.00 N ATOM 1217 CA ALA A 79 1.154 -2.806 -0.743 1.00 0.00 C ATOM 1218 C ALA A 79 1.059 -4.169 -1.440 1.00 0.00 C ATOM 1219 O ALA A 79 0.228 -5.027 -1.078 1.00 0.00 O ATOM 1220 CB ALA A 79 0.570 -1.715 -1.638 1.00 0.00 C ATOM 0 H ALA A 79 2.947 -1.691 -0.904 1.00 0.00 H new ATOM 0 HA ALA A 79 0.578 -2.872 0.180 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.456 -1.971 -1.901 1.00 0.00 H new ATOM 0 HB2 ALA A 79 0.582 -0.763 -1.107 1.00 0.00 H new ATOM 0 HB3 ALA A 79 1.167 -1.631 -2.546 1.00 0.00 H new ATOM 1226 N ALA A 80 1.927 -4.375 -2.426 1.00 0.00 N ATOM 1227 CA ALA A 80 1.942 -5.630 -3.152 1.00 0.00 C ATOM 1228 C ALA A 80 2.303 -6.752 -2.190 1.00 0.00 C ATOM 1229 O ALA A 80 1.705 -7.831 -2.208 1.00 0.00 O ATOM 1230 CB ALA A 80 2.947 -5.557 -4.302 1.00 0.00 C ATOM 0 H ALA A 80 2.621 -3.694 -2.735 1.00 0.00 H new ATOM 0 HA ALA A 80 0.957 -5.826 -3.576 1.00 0.00 H new ATOM 0 HB1 ALA A 80 2.952 -6.504 -4.842 1.00 0.00 H new ATOM 0 HB2 ALA A 80 2.664 -4.753 -4.982 1.00 0.00 H new ATOM 0 HB3 ALA A 80 3.943 -5.362 -3.903 1.00 0.00 H new ATOM 1236 N LEU A 81 3.248 -6.481 -1.300 1.00 0.00 N ATOM 1237 CA LEU A 81 3.590 -7.476 -0.308 1.00 0.00 C ATOM 1238 C LEU A 81 2.396 -7.724 0.602 1.00 0.00 C ATOM 1239 O LEU A 81 2.189 -8.843 1.039 1.00 0.00 O ATOM 1240 CB LEU A 81 4.838 -7.077 0.492 1.00 0.00 C ATOM 1241 CG LEU A 81 6.115 -7.611 -0.198 1.00 0.00 C ATOM 1242 CD1 LEU A 81 6.218 -7.148 -1.655 1.00 0.00 C ATOM 1243 CD2 LEU A 81 7.346 -7.121 0.568 1.00 0.00 C ATOM 0 H LEU A 81 3.773 -5.608 -1.248 1.00 0.00 H new ATOM 0 HA LEU A 81 3.837 -8.406 -0.821 1.00 0.00 H new ATOM 0 HB2 LEU A 81 4.891 -5.992 0.578 1.00 0.00 H new ATOM 0 HB3 LEU A 81 4.771 -7.475 1.505 1.00 0.00 H new ATOM 0 HG LEU A 81 6.063 -8.700 -0.193 1.00 0.00 H new ATOM 0 HD11 LEU A 81 7.130 -7.547 -2.100 1.00 0.00 H new ATOM 0 HD12 LEU A 81 5.354 -7.509 -2.213 1.00 0.00 H new ATOM 0 HD13 LEU A 81 6.243 -6.059 -1.690 1.00 0.00 H new ATOM 0 HD21 LEU A 81 8.248 -7.496 0.085 1.00 0.00 H new ATOM 0 HD22 LEU A 81 7.362 -6.031 0.572 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.306 -7.487 1.594 1.00 0.00 H new ATOM 1255 N THR A 82 1.606 -6.683 0.892 1.00 0.00 N ATOM 1256 CA THR A 82 0.438 -6.872 1.759 1.00 0.00 C ATOM 1257 C THR A 82 -0.582 -7.826 1.132 1.00 0.00 C ATOM 1258 O THR A 82 -1.019 -8.800 1.774 1.00 0.00 O ATOM 1259 CB THR A 82 -0.232 -5.517 2.012 1.00 0.00 C ATOM 1260 OG1 THR A 82 0.731 -4.600 2.513 1.00 0.00 O ATOM 1261 CG2 THR A 82 -1.362 -5.672 3.035 1.00 0.00 C ATOM 0 H THR A 82 1.747 -5.732 0.552 1.00 0.00 H new ATOM 0 HA THR A 82 0.783 -7.309 2.696 1.00 0.00 H new ATOM 0 HB THR A 82 -0.645 -5.144 1.075 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.171 -4.146 1.764 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.832 -4.704 3.208 1.00 0.00 H new ATOM 0 HG22 THR A 82 -2.105 -6.373 2.653 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.955 -6.050 3.973 1.00 0.00 H new ATOM 1269 N VAL A 83 -0.943 -7.581 -0.133 1.00 0.00 N ATOM 1270 CA VAL A 83 -1.900 -8.488 -0.790 1.00 0.00 C ATOM 1271 C VAL A 83 -1.308 -9.892 -0.902 1.00 0.00 C ATOM 1272 O VAL A 83 -2.003 -10.895 -0.686 1.00 0.00 O ATOM 1273 CB VAL A 83 -2.359 -7.970 -2.174 1.00 0.00 C ATOM 1274 CG1 VAL A 83 -1.199 -7.908 -3.165 1.00 0.00 C ATOM 1275 CG2 VAL A 83 -3.416 -8.927 -2.737 1.00 0.00 C ATOM 0 H VAL A 83 -0.609 -6.803 -0.702 1.00 0.00 H new ATOM 0 HA VAL A 83 -2.791 -8.526 -0.163 1.00 0.00 H new ATOM 0 HB VAL A 83 -2.760 -6.965 -2.041 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.560 -7.540 -4.125 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -0.431 -7.235 -2.784 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -0.777 -8.905 -3.294 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.746 -8.571 -3.713 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -2.986 -9.923 -2.841 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -4.268 -8.968 -2.058 1.00 0.00 H new ATOM 1285 N ALA A 84 -0.012 -9.964 -1.203 1.00 0.00 N ATOM 1286 CA ALA A 84 0.655 -11.251 -1.304 1.00 0.00 C ATOM 1287 C ALA A 84 0.681 -11.933 0.056 1.00 0.00 C ATOM 1288 O ALA A 84 0.661 -13.159 0.151 1.00 0.00 O ATOM 1289 CB ALA A 84 2.077 -11.070 -1.827 1.00 0.00 C ATOM 0 H ALA A 84 0.586 -9.156 -1.378 1.00 0.00 H new ATOM 0 HA ALA A 84 0.103 -11.878 -2.004 1.00 0.00 H new ATOM 0 HB1 ALA A 84 2.565 -12.042 -1.898 1.00 0.00 H new ATOM 0 HB2 ALA A 84 2.046 -10.607 -2.813 1.00 0.00 H new ATOM 0 HB3 ALA A 84 2.637 -10.431 -1.144 1.00 0.00 H new ATOM 1295 N CYS A 85 0.730 -11.120 1.107 1.00 0.00 N ATOM 1296 CA CYS A 85 0.761 -11.638 2.460 1.00 0.00 C ATOM 1297 C CYS A 85 -0.557 -12.307 2.770 1.00 0.00 C ATOM 1298 O CYS A 85 -0.590 -13.474 3.160 1.00 0.00 O ATOM 1299 CB CYS A 85 1.013 -10.507 3.460 1.00 0.00 C ATOM 1300 SG CYS A 85 1.662 -11.200 5.001 1.00 0.00 S ATOM 0 H CYS A 85 0.749 -10.102 1.042 1.00 0.00 H new ATOM 0 HA CYS A 85 1.571 -12.363 2.543 1.00 0.00 H new ATOM 0 HB2 CYS A 85 1.721 -9.790 3.044 1.00 0.00 H new ATOM 0 HB3 CYS A 85 0.087 -9.965 3.654 1.00 0.00 H new ATOM 1305 N ASN A 86 -1.654 -11.577 2.583 1.00 0.00 N ATOM 1306 CA ASN A 86 -2.948 -12.182 2.847 1.00 0.00 C ATOM 1307 C ASN A 86 -3.077 -13.447 2.011 1.00 0.00 C ATOM 1308 O ASN A 86 -3.548 -14.485 2.496 1.00 0.00 O ATOM 1309 CB ASN A 86 -4.078 -11.220 2.490 1.00 0.00 C ATOM 1310 CG ASN A 86 -5.396 -11.745 3.051 1.00 0.00 C ATOM 1311 OD1 ASN A 86 -5.566 -11.825 4.266 1.00 0.00 O ATOM 1312 ND2 ASN A 86 -6.341 -12.119 2.232 1.00 0.00 N ATOM 0 H ASN A 86 -1.673 -10.608 2.264 1.00 0.00 H new ATOM 0 HA ASN A 86 -3.020 -12.419 3.908 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -3.868 -10.230 2.895 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -4.149 -11.113 1.408 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -7.222 -12.478 2.600 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -6.199 -12.052 1.224 1.00 0.00 H new ATOM 1319 N ASN A 87 -2.620 -13.365 0.757 1.00 0.00 N ATOM 1320 CA ASN A 87 -2.661 -14.526 -0.121 1.00 0.00 C ATOM 1321 C ASN A 87 -1.850 -15.659 0.472 1.00 0.00 C ATOM 1322 O ASN A 87 -2.260 -16.790 0.463 1.00 0.00 O ATOM 1323 CB ASN A 87 -2.087 -14.150 -1.490 1.00 0.00 C ATOM 1324 CG ASN A 87 -2.940 -13.061 -2.132 1.00 0.00 C ATOM 1325 OD1 ASN A 87 -2.408 -12.093 -2.674 1.00 0.00 O ATOM 1326 ND2 ASN A 87 -4.241 -13.163 -2.102 1.00 0.00 N ATOM 0 H ASN A 87 -2.226 -12.522 0.339 1.00 0.00 H new ATOM 0 HA ASN A 87 -3.696 -14.851 -0.232 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -1.060 -13.801 -1.380 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -2.058 -15.028 -2.135 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -4.819 -12.439 -2.529 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -4.679 -13.967 -1.652 1.00 0.00 H new ATOM 1333 N PHE A 88 -0.705 -15.376 1.023 1.00 0.00 N ATOM 1334 CA PHE A 88 0.061 -16.457 1.601 1.00 0.00 C ATOM 1335 C PHE A 88 -0.677 -17.083 2.784 1.00 0.00 C ATOM 1336 O PHE A 88 -0.660 -18.300 2.956 1.00 0.00 O ATOM 1337 CB PHE A 88 1.447 -15.974 2.031 1.00 0.00 C ATOM 1338 CG PHE A 88 2.264 -17.149 2.512 1.00 0.00 C ATOM 1339 CD1 PHE A 88 2.972 -17.934 1.594 1.00 0.00 C ATOM 1340 CD2 PHE A 88 2.312 -17.455 3.878 1.00 0.00 C ATOM 1341 CE1 PHE A 88 3.728 -19.023 2.041 1.00 0.00 C ATOM 1342 CE2 PHE A 88 3.068 -18.545 4.325 1.00 0.00 C ATOM 1343 CZ PHE A 88 3.777 -19.329 3.407 1.00 0.00 C ATOM 0 H PHE A 88 -0.288 -14.447 1.087 1.00 0.00 H new ATOM 0 HA PHE A 88 0.186 -17.222 0.835 1.00 0.00 H new ATOM 0 HB2 PHE A 88 1.949 -15.486 1.195 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.355 -15.232 2.824 1.00 0.00 H new ATOM 0 HD1 PHE A 88 2.935 -17.699 0.541 1.00 0.00 H new ATOM 0 HD2 PHE A 88 1.766 -16.850 4.586 1.00 0.00 H new ATOM 0 HE1 PHE A 88 4.274 -19.628 1.332 1.00 0.00 H new ATOM 0 HE2 PHE A 88 3.104 -18.781 5.378 1.00 0.00 H new ATOM 0 HZ PHE A 88 4.361 -20.169 3.752 1.00 0.00 H new ATOM 1353 N PHE A 89 -1.289 -16.252 3.627 1.00 0.00 N ATOM 1354 CA PHE A 89 -1.981 -16.782 4.797 1.00 0.00 C ATOM 1355 C PHE A 89 -3.183 -17.652 4.416 1.00 0.00 C ATOM 1356 O PHE A 89 -3.221 -18.835 4.753 1.00 0.00 O ATOM 1357 CB PHE A 89 -2.451 -15.628 5.684 1.00 0.00 C ATOM 1358 CG PHE A 89 -3.045 -16.179 6.958 1.00 0.00 C ATOM 1359 CD1 PHE A 89 -2.210 -16.494 8.037 1.00 0.00 C ATOM 1360 CD2 PHE A 89 -4.427 -16.375 7.062 1.00 0.00 C ATOM 1361 CE1 PHE A 89 -2.759 -17.005 9.220 1.00 0.00 C ATOM 1362 CE2 PHE A 89 -4.976 -16.885 8.244 1.00 0.00 C ATOM 1363 CZ PHE A 89 -4.141 -17.201 9.323 1.00 0.00 C ATOM 0 H PHE A 89 -1.320 -15.237 3.526 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.273 -17.412 5.336 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -1.614 -14.970 5.916 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -3.191 -15.028 5.155 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.144 -16.343 7.957 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -5.070 -16.132 6.229 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.116 -17.248 10.053 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -6.043 -17.035 8.324 1.00 0.00 H new ATOM 0 HZ PHE A 89 -4.564 -17.596 10.235 1.00 0.00 H new ATOM 1373 N TRP A 90 -4.160 -17.081 3.702 1.00 0.00 N ATOM 1374 CA TRP A 90 -5.327 -17.873 3.294 1.00 0.00 C ATOM 1375 C TRP A 90 -4.958 -18.935 2.269 1.00 0.00 C ATOM 1376 O TRP A 90 -5.420 -20.074 2.328 1.00 0.00 O ATOM 1377 CB TRP A 90 -6.429 -17.004 2.709 1.00 0.00 C ATOM 1378 CG TRP A 90 -7.579 -17.908 2.427 1.00 0.00 C ATOM 1379 CD1 TRP A 90 -7.642 -18.738 1.369 1.00 0.00 C ATOM 1380 CD2 TRP A 90 -8.811 -18.104 3.177 1.00 0.00 C ATOM 1381 NE1 TRP A 90 -8.823 -19.443 1.417 1.00 0.00 N ATOM 1382 CE2 TRP A 90 -9.588 -19.082 2.512 1.00 0.00 C ATOM 1383 CE3 TRP A 90 -9.327 -17.535 4.355 1.00 0.00 C ATOM 1384 CZ2 TRP A 90 -10.833 -19.483 2.998 1.00 0.00 C ATOM 1385 CZ3 TRP A 90 -10.580 -17.936 4.848 1.00 0.00 C ATOM 1386 CH2 TRP A 90 -11.331 -18.908 4.170 1.00 0.00 C ATOM 0 H TRP A 90 -4.170 -16.106 3.402 1.00 0.00 H new ATOM 0 HA TRP A 90 -5.691 -18.353 4.202 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -6.716 -16.219 3.409 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -6.091 -16.511 1.798 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -6.886 -18.835 0.604 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -9.100 -20.145 0.730 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -8.757 -16.785 4.884 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -11.407 -20.232 2.472 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -10.967 -17.494 5.754 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -12.294 -19.212 4.554 1.00 0.00 H new ATOM 1397 N GLU A 91 -4.130 -18.527 1.323 1.00 0.00 N ATOM 1398 CA GLU A 91 -3.679 -19.394 0.244 1.00 0.00 C ATOM 1399 C GLU A 91 -2.297 -19.973 0.526 1.00 0.00 C ATOM 1400 O GLU A 91 -1.453 -19.325 1.133 1.00 0.00 O ATOM 1401 CB GLU A 91 -3.636 -18.596 -1.076 1.00 0.00 C ATOM 1402 CG GLU A 91 -5.041 -18.393 -1.653 1.00 0.00 C ATOM 1403 CD GLU A 91 -5.699 -19.739 -1.948 1.00 0.00 C ATOM 1404 OE1 GLU A 91 -4.982 -20.723 -2.019 1.00 0.00 O ATOM 1405 OE2 GLU A 91 -6.909 -19.763 -2.098 1.00 0.00 O ATOM 0 H GLU A 91 -3.749 -17.582 1.280 1.00 0.00 H new ATOM 0 HA GLU A 91 -4.384 -20.221 0.164 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -3.169 -17.627 -0.902 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.016 -19.123 -1.801 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -5.652 -17.830 -0.948 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.983 -17.802 -2.567 1.00 0.00 H new ATOM 1412 N ASN A 92 -2.077 -21.202 0.066 1.00 0.00 N ATOM 1413 CA ASN A 92 -0.794 -21.869 0.264 1.00 0.00 C ATOM 1414 C ASN A 92 -0.382 -22.618 -0.999 1.00 0.00 C ATOM 1415 O ASN A 92 -1.081 -22.578 -2.011 1.00 0.00 O ATOM 1416 CB ASN A 92 -0.892 -22.851 1.434 1.00 0.00 C ATOM 1417 CG ASN A 92 -1.723 -24.064 1.029 1.00 0.00 C ATOM 1418 OD1 ASN A 92 -2.416 -24.031 0.012 1.00 0.00 O ATOM 1419 ND2 ASN A 92 -1.694 -25.138 1.769 1.00 0.00 N ATOM 0 H ASN A 92 -2.767 -21.754 -0.444 1.00 0.00 H new ATOM 0 HA ASN A 92 -0.041 -21.113 0.487 1.00 0.00 H new ATOM 0 HB2 ASN A 92 0.106 -23.168 1.738 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -1.346 -22.360 2.295 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -2.247 -25.954 1.506 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -1.119 -25.162 2.611 1.00 0.00 H new ATOM 1426 N SER A 93 0.755 -23.302 -0.932 1.00 0.00 N ATOM 1427 CA SER A 93 1.249 -24.057 -2.077 1.00 0.00 C ATOM 1428 C SER A 93 0.336 -25.244 -2.370 1.00 0.00 C ATOM 1429 O SER A 93 0.234 -25.616 -3.527 1.00 0.00 O ATOM 1430 CB SER A 93 2.667 -24.558 -1.800 1.00 0.00 C ATOM 1431 OG SER A 93 3.572 -23.463 -1.865 1.00 0.00 O ATOM 0 H SER A 93 1.348 -23.349 -0.103 1.00 0.00 H new ATOM 0 HA SER A 93 1.260 -23.398 -2.945 1.00 0.00 H new ATOM 0 HB2 SER A 93 2.714 -25.026 -0.817 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.945 -25.319 -2.529 1.00 0.00 H new ATOM 0 HG SER A 93 4.482 -23.780 -1.686 1.00 0.00 H new TER 1437 SER A 93 ATOM 1438 N GLY B 1 9.806 -2.009 13.005 1.00 0.00 N ATOM 1439 CA GLY B 1 9.484 -3.287 13.624 1.00 0.00 C ATOM 1440 C GLY B 1 8.134 -3.811 13.145 1.00 0.00 C ATOM 1441 O GLY B 1 7.869 -3.897 11.947 1.00 0.00 O ATOM 0 H1 GLY B 1 10.555 -2.145 12.296 1.00 0.00 H new ATOM 0 H2 GLY B 1 8.958 -1.624 12.543 1.00 0.00 H new ATOM 0 H3 GLY B 1 10.136 -1.344 13.733 1.00 0.00 H new ATOM 0 HA2 GLY B 1 10.262 -4.013 13.390 1.00 0.00 H new ATOM 0 HA3 GLY B 1 9.469 -3.175 14.708 1.00 0.00 H new ATOM 1445 N SER B 2 7.296 -4.177 14.099 1.00 0.00 N ATOM 1446 CA SER B 2 5.972 -4.708 13.802 1.00 0.00 C ATOM 1447 C SER B 2 5.040 -3.649 13.205 1.00 0.00 C ATOM 1448 O SER B 2 3.990 -3.989 12.660 1.00 0.00 O ATOM 1449 CB SER B 2 5.347 -5.268 15.079 1.00 0.00 C ATOM 1450 OG SER B 2 5.051 -4.197 15.965 1.00 0.00 O ATOM 0 H SER B 2 7.509 -4.116 15.095 1.00 0.00 H new ATOM 0 HA SER B 2 6.096 -5.496 13.059 1.00 0.00 H new ATOM 0 HB2 SER B 2 4.438 -5.820 14.841 1.00 0.00 H new ATOM 0 HB3 SER B 2 6.031 -5.970 15.555 1.00 0.00 H new ATOM 0 HG SER B 2 4.648 -4.552 16.785 1.00 0.00 H new ATOM 1456 N GLU B 3 5.382 -2.369 13.360 1.00 0.00 N ATOM 1457 CA GLU B 3 4.495 -1.309 12.873 1.00 0.00 C ATOM 1458 C GLU B 3 4.225 -1.383 11.377 1.00 0.00 C ATOM 1459 O GLU B 3 3.082 -1.177 10.949 1.00 0.00 O ATOM 1460 CB GLU B 3 5.105 0.058 13.189 1.00 0.00 C ATOM 1461 CG GLU B 3 5.154 0.261 14.700 1.00 0.00 C ATOM 1462 CD GLU B 3 5.707 1.645 15.022 1.00 0.00 C ATOM 1463 OE1 GLU B 3 6.174 2.302 14.106 1.00 0.00 O ATOM 1464 OE2 GLU B 3 5.656 2.027 16.179 1.00 0.00 O ATOM 0 H GLU B 3 6.241 -2.046 13.805 1.00 0.00 H new ATOM 0 HA GLU B 3 3.543 -1.449 13.385 1.00 0.00 H new ATOM 0 HB2 GLU B 3 6.109 0.125 12.770 1.00 0.00 H new ATOM 0 HB3 GLU B 3 4.513 0.847 12.725 1.00 0.00 H new ATOM 0 HG2 GLU B 3 4.155 0.152 15.123 1.00 0.00 H new ATOM 0 HG3 GLU B 3 5.779 -0.505 15.158 1.00 0.00 H new ATOM 1471 N LEU B 4 5.230 -1.682 10.564 1.00 0.00 N ATOM 1472 CA LEU B 4 4.958 -1.752 9.142 1.00 0.00 C ATOM 1473 C LEU B 4 3.973 -2.901 8.907 1.00 0.00 C ATOM 1474 O LEU B 4 2.987 -2.768 8.171 1.00 0.00 O ATOM 1475 CB LEU B 4 6.261 -2.000 8.382 1.00 0.00 C ATOM 1476 CG LEU B 4 6.123 -1.555 6.917 1.00 0.00 C ATOM 1477 CD1 LEU B 4 7.408 -1.864 6.150 1.00 0.00 C ATOM 1478 CD2 LEU B 4 4.943 -2.234 6.234 1.00 0.00 C ATOM 0 H LEU B 4 6.192 -1.871 10.848 1.00 0.00 H new ATOM 0 HA LEU B 4 4.528 -0.816 8.784 1.00 0.00 H new ATOM 0 HB2 LEU B 4 7.076 -1.455 8.858 1.00 0.00 H new ATOM 0 HB3 LEU B 4 6.518 -3.059 8.424 1.00 0.00 H new ATOM 0 HG LEU B 4 5.944 -0.480 6.914 1.00 0.00 H new ATOM 0 HD11 LEU B 4 7.299 -1.545 5.114 1.00 0.00 H new ATOM 0 HD12 LEU B 4 8.242 -1.332 6.608 1.00 0.00 H new ATOM 0 HD13 LEU B 4 7.601 -2.936 6.181 1.00 0.00 H new ATOM 0 HD21 LEU B 4 4.877 -1.895 5.200 1.00 0.00 H new ATOM 0 HD22 LEU B 4 5.084 -3.315 6.253 1.00 0.00 H new ATOM 0 HD23 LEU B 4 4.023 -1.979 6.759 1.00 0.00 H new ATOM 1490 N GLU B 5 4.217 -4.021 9.599 1.00 0.00 N ATOM 1491 CA GLU B 5 3.317 -5.163 9.501 1.00 0.00 C ATOM 1492 C GLU B 5 1.962 -4.829 10.087 1.00 0.00 C ATOM 1493 O GLU B 5 0.945 -5.259 9.568 1.00 0.00 O ATOM 1494 CB GLU B 5 3.896 -6.403 10.202 1.00 0.00 C ATOM 1495 CG GLU B 5 5.085 -6.955 9.407 1.00 0.00 C ATOM 1496 CD GLU B 5 4.610 -7.408 8.026 1.00 0.00 C ATOM 1497 OE1 GLU B 5 3.414 -7.585 7.865 1.00 0.00 O ATOM 1498 OE2 GLU B 5 5.442 -7.571 7.154 1.00 0.00 O ATOM 0 H GLU B 5 5.015 -4.155 10.220 1.00 0.00 H new ATOM 0 HA GLU B 5 3.202 -5.393 8.442 1.00 0.00 H new ATOM 0 HB2 GLU B 5 4.214 -6.143 11.212 1.00 0.00 H new ATOM 0 HB3 GLU B 5 3.126 -7.169 10.297 1.00 0.00 H new ATOM 0 HG2 GLU B 5 5.855 -6.190 9.305 1.00 0.00 H new ATOM 0 HG3 GLU B 5 5.536 -7.792 9.941 1.00 0.00 H new ATOM 1505 N THR B 6 1.939 -4.048 11.160 1.00 0.00 N ATOM 1506 CA THR B 6 0.664 -3.685 11.752 1.00 0.00 C ATOM 1507 C THR B 6 -0.171 -2.957 10.713 1.00 0.00 C ATOM 1508 O THR B 6 -1.375 -3.201 10.566 1.00 0.00 O ATOM 1509 CB THR B 6 0.881 -2.781 12.968 1.00 0.00 C ATOM 1510 OG1 THR B 6 1.764 -3.421 13.879 1.00 0.00 O ATOM 1511 CG2 THR B 6 -0.459 -2.514 13.654 1.00 0.00 C ATOM 0 H THR B 6 2.763 -3.665 11.624 1.00 0.00 H new ATOM 0 HA THR B 6 0.147 -4.587 12.079 1.00 0.00 H new ATOM 0 HB THR B 6 1.315 -1.834 12.645 1.00 0.00 H new ATOM 0 HG1 THR B 6 2.679 -3.381 13.531 1.00 0.00 H new ATOM 0 HG21 THR B 6 -0.303 -1.870 14.520 1.00 0.00 H new ATOM 0 HG22 THR B 6 -1.135 -2.023 12.954 1.00 0.00 H new ATOM 0 HG23 THR B 6 -0.896 -3.458 13.978 1.00 0.00 H new ATOM 1519 N ALA B 7 0.489 -2.075 9.968 1.00 0.00 N ATOM 1520 CA ALA B 7 -0.204 -1.333 8.926 1.00 0.00 C ATOM 1521 C ALA B 7 -0.696 -2.277 7.841 1.00 0.00 C ATOM 1522 O ALA B 7 -1.846 -2.196 7.409 1.00 0.00 O ATOM 1523 CB ALA B 7 0.741 -0.305 8.302 1.00 0.00 C ATOM 0 H ALA B 7 1.482 -1.861 10.064 1.00 0.00 H new ATOM 0 HA ALA B 7 -1.057 -0.825 9.375 1.00 0.00 H new ATOM 0 HB1 ALA B 7 0.215 0.247 7.523 1.00 0.00 H new ATOM 0 HB2 ALA B 7 1.082 0.389 9.070 1.00 0.00 H new ATOM 0 HB3 ALA B 7 1.600 -0.817 7.868 1.00 0.00 H new ATOM 1529 N MET B 8 0.178 -3.190 7.421 1.00 0.00 N ATOM 1530 CA MET B 8 -0.189 -4.159 6.386 1.00 0.00 C ATOM 1531 C MET B 8 -1.382 -5.000 6.848 1.00 0.00 C ATOM 1532 O MET B 8 -2.336 -5.248 6.086 1.00 0.00 O ATOM 1533 CB MET B 8 1.035 -5.052 6.121 1.00 0.00 C ATOM 1534 CG MET B 8 2.146 -4.218 5.459 1.00 0.00 C ATOM 1535 SD MET B 8 3.651 -5.213 5.250 1.00 0.00 S ATOM 1536 CE MET B 8 3.088 -6.277 3.911 1.00 0.00 C ATOM 0 H MET B 8 1.131 -3.280 7.774 1.00 0.00 H new ATOM 0 HA MET B 8 -0.482 -3.646 5.470 1.00 0.00 H new ATOM 0 HB2 MET B 8 1.395 -5.480 7.056 1.00 0.00 H new ATOM 0 HB3 MET B 8 0.757 -5.885 5.475 1.00 0.00 H new ATOM 0 HG2 MET B 8 1.806 -3.854 4.489 1.00 0.00 H new ATOM 0 HG3 MET B 8 2.364 -3.342 6.070 1.00 0.00 H new ATOM 0 HE1 MET B 8 3.878 -6.981 3.649 1.00 0.00 H new ATOM 0 HE2 MET B 8 2.203 -6.827 4.231 1.00 0.00 H new ATOM 0 HE3 MET B 8 2.842 -5.668 3.041 1.00 0.00 H new ATOM 1546 N GLU B 9 -1.360 -5.389 8.120 1.00 0.00 N ATOM 1547 CA GLU B 9 -2.459 -6.152 8.673 1.00 0.00 C ATOM 1548 C GLU B 9 -3.713 -5.308 8.674 1.00 0.00 C ATOM 1549 O GLU B 9 -4.796 -5.810 8.412 1.00 0.00 O ATOM 1550 CB GLU B 9 -2.138 -6.620 10.097 1.00 0.00 C ATOM 1551 CG GLU B 9 -1.005 -7.653 10.065 1.00 0.00 C ATOM 1552 CD GLU B 9 -1.440 -8.887 9.279 1.00 0.00 C ATOM 1553 OE1 GLU B 9 -2.632 -9.055 9.088 1.00 0.00 O ATOM 1554 OE2 GLU B 9 -0.572 -9.649 8.886 1.00 0.00 O ATOM 0 H GLU B 9 -0.603 -5.189 8.773 1.00 0.00 H new ATOM 0 HA GLU B 9 -2.616 -7.035 8.053 1.00 0.00 H new ATOM 0 HB2 GLU B 9 -1.848 -5.768 10.712 1.00 0.00 H new ATOM 0 HB3 GLU B 9 -3.026 -7.056 10.555 1.00 0.00 H new ATOM 0 HG2 GLU B 9 -0.117 -7.216 9.608 1.00 0.00 H new ATOM 0 HG3 GLU B 9 -0.733 -7.937 11.082 1.00 0.00 H new ATOM 1561 N THR B 10 -3.567 -4.013 8.950 1.00 0.00 N ATOM 1562 CA THR B 10 -4.730 -3.145 8.937 1.00 0.00 C ATOM 1563 C THR B 10 -5.332 -3.100 7.539 1.00 0.00 C ATOM 1564 O THR B 10 -6.557 -3.160 7.380 1.00 0.00 O ATOM 1565 CB THR B 10 -4.355 -1.732 9.379 1.00 0.00 C ATOM 1566 OG1 THR B 10 -3.730 -1.786 10.653 1.00 0.00 O ATOM 1567 CG2 THR B 10 -5.618 -0.864 9.455 1.00 0.00 C ATOM 0 H THR B 10 -2.683 -3.558 9.178 1.00 0.00 H new ATOM 0 HA THR B 10 -5.464 -3.547 9.635 1.00 0.00 H new ATOM 0 HB THR B 10 -3.665 -1.295 8.657 1.00 0.00 H new ATOM 0 HG1 THR B 10 -2.833 -2.170 10.561 1.00 0.00 H new ATOM 0 HG21 THR B 10 -5.348 0.144 9.771 1.00 0.00 H new ATOM 0 HG22 THR B 10 -6.091 -0.823 8.474 1.00 0.00 H new ATOM 0 HG23 THR B 10 -6.313 -1.296 10.175 1.00 0.00 H new ATOM 1575 N LEU B 11 -4.473 -3.005 6.513 1.00 0.00 N ATOM 1576 CA LEU B 11 -4.993 -2.966 5.154 1.00 0.00 C ATOM 1577 C LEU B 11 -5.780 -4.243 4.915 1.00 0.00 C ATOM 1578 O LEU B 11 -6.888 -4.228 4.360 1.00 0.00 O ATOM 1579 CB LEU B 11 -3.857 -2.899 4.119 1.00 0.00 C ATOM 1580 CG LEU B 11 -2.914 -1.713 4.381 1.00 0.00 C ATOM 1581 CD1 LEU B 11 -1.910 -1.608 3.232 1.00 0.00 C ATOM 1582 CD2 LEU B 11 -3.688 -0.395 4.488 1.00 0.00 C ATOM 0 H LEU B 11 -3.458 -2.956 6.598 1.00 0.00 H new ATOM 0 HA LEU B 11 -5.615 -2.078 5.043 1.00 0.00 H new ATOM 0 HB2 LEU B 11 -3.288 -3.828 4.144 1.00 0.00 H new ATOM 0 HB3 LEU B 11 -4.281 -2.812 3.119 1.00 0.00 H new ATOM 0 HG LEU B 11 -2.401 -1.888 5.327 1.00 0.00 H new ATOM 0 HD11 LEU B 11 -1.238 -0.769 3.412 1.00 0.00 H new ATOM 0 HD12 LEU B 11 -1.331 -2.529 3.169 1.00 0.00 H new ATOM 0 HD13 LEU B 11 -2.444 -1.451 2.295 1.00 0.00 H new ATOM 0 HD21 LEU B 11 -2.991 0.422 4.673 1.00 0.00 H new ATOM 0 HD22 LEU B 11 -4.224 -0.211 3.557 1.00 0.00 H new ATOM 0 HD23 LEU B 11 -4.401 -0.457 5.310 1.00 0.00 H new ATOM 1594 N ILE B 12 -5.205 -5.354 5.376 1.00 0.00 N ATOM 1595 CA ILE B 12 -5.870 -6.645 5.235 1.00 0.00 C ATOM 1596 C ILE B 12 -7.206 -6.679 5.976 1.00 0.00 C ATOM 1597 O ILE B 12 -8.206 -7.163 5.446 1.00 0.00 O ATOM 1598 CB ILE B 12 -4.964 -7.773 5.745 1.00 0.00 C ATOM 1599 CG1 ILE B 12 -3.692 -7.853 4.885 1.00 0.00 C ATOM 1600 CG2 ILE B 12 -5.717 -9.100 5.673 1.00 0.00 C ATOM 1601 CD1 ILE B 12 -2.696 -8.828 5.514 1.00 0.00 C ATOM 0 H ILE B 12 -4.298 -5.386 5.841 1.00 0.00 H new ATOM 0 HA ILE B 12 -6.070 -6.793 4.174 1.00 0.00 H new ATOM 0 HB ILE B 12 -4.682 -7.569 6.778 1.00 0.00 H new ATOM 0 HG12 ILE B 12 -3.945 -8.179 3.876 1.00 0.00 H new ATOM 0 HG13 ILE B 12 -3.240 -6.865 4.797 1.00 0.00 H new ATOM 0 HG21 ILE B 12 -5.075 -9.903 6.035 1.00 0.00 H new ATOM 0 HG22 ILE B 12 -6.612 -9.044 6.292 1.00 0.00 H new ATOM 0 HG23 ILE B 12 -6.002 -9.301 4.640 1.00 0.00 H new ATOM 0 HD11 ILE B 12 -1.798 -8.879 4.898 1.00 0.00 H new ATOM 0 HD12 ILE B 12 -2.432 -8.484 6.514 1.00 0.00 H new ATOM 0 HD13 ILE B 12 -3.148 -9.818 5.579 1.00 0.00 H new ATOM 1613 N ASN B 13 -7.210 -6.185 7.209 1.00 0.00 N ATOM 1614 CA ASN B 13 -8.420 -6.190 8.019 1.00 0.00 C ATOM 1615 C ASN B 13 -9.546 -5.375 7.392 1.00 0.00 C ATOM 1616 O ASN B 13 -10.703 -5.803 7.409 1.00 0.00 O ATOM 1617 CB ASN B 13 -8.107 -5.638 9.409 1.00 0.00 C ATOM 1618 CG ASN B 13 -7.136 -6.566 10.131 1.00 0.00 C ATOM 1619 OD1 ASN B 13 -6.974 -7.722 9.741 1.00 0.00 O ATOM 1620 ND2 ASN B 13 -6.475 -6.125 11.166 1.00 0.00 N ATOM 0 H ASN B 13 -6.394 -5.779 7.666 1.00 0.00 H new ATOM 0 HA ASN B 13 -8.762 -7.223 8.085 1.00 0.00 H new ATOM 0 HB2 ASN B 13 -7.675 -4.641 9.325 1.00 0.00 H new ATOM 0 HB3 ASN B 13 -9.026 -5.540 9.986 1.00 0.00 H new ATOM 0 HD21 ASN B 13 -5.822 -6.739 11.654 1.00 0.00 H new ATOM 0 HD22 ASN B 13 -6.611 -5.167 11.487 1.00 0.00 H new ATOM 1627 N VAL B 14 -9.229 -4.208 6.831 1.00 0.00 N ATOM 1628 CA VAL B 14 -10.289 -3.412 6.222 1.00 0.00 C ATOM 1629 C VAL B 14 -10.745 -4.059 4.903 1.00 0.00 C ATOM 1630 O VAL B 14 -11.964 -4.127 4.610 1.00 0.00 O ATOM 1631 CB VAL B 14 -9.872 -1.929 6.049 1.00 0.00 C ATOM 1632 CG1 VAL B 14 -9.411 -1.359 7.399 1.00 0.00 C ATOM 1633 CG2 VAL B 14 -8.734 -1.783 5.046 1.00 0.00 C ATOM 0 H VAL B 14 -8.292 -3.808 6.786 1.00 0.00 H new ATOM 0 HA VAL B 14 -11.145 -3.400 6.897 1.00 0.00 H new ATOM 0 HB VAL B 14 -10.739 -1.383 5.679 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -9.119 -0.316 7.273 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -10.227 -1.423 8.119 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -8.559 -1.933 7.765 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -8.467 -0.731 4.949 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -7.868 -2.347 5.394 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -9.052 -2.167 4.077 1.00 0.00 H new ATOM 1643 N PHE B 15 -9.786 -4.606 4.130 1.00 0.00 N ATOM 1644 CA PHE B 15 -10.164 -5.291 2.900 1.00 0.00 C ATOM 1645 C PHE B 15 -11.071 -6.465 3.212 1.00 0.00 C ATOM 1646 O PHE B 15 -12.081 -6.714 2.542 1.00 0.00 O ATOM 1647 CB PHE B 15 -8.960 -5.767 2.088 1.00 0.00 C ATOM 1648 CG PHE B 15 -9.497 -6.434 0.843 1.00 0.00 C ATOM 1649 CD1 PHE B 15 -9.991 -5.664 -0.220 1.00 0.00 C ATOM 1650 CD2 PHE B 15 -9.537 -7.831 0.771 1.00 0.00 C ATOM 1651 CE1 PHE B 15 -10.525 -6.297 -1.353 1.00 0.00 C ATOM 1652 CE2 PHE B 15 -10.061 -8.461 -0.363 1.00 0.00 C ATOM 1653 CZ PHE B 15 -10.557 -7.694 -1.424 1.00 0.00 C ATOM 0 H PHE B 15 -8.786 -4.585 4.332 1.00 0.00 H new ATOM 0 HA PHE B 15 -10.695 -4.563 2.287 1.00 0.00 H new ATOM 0 HB2 PHE B 15 -8.315 -4.928 1.827 1.00 0.00 H new ATOM 0 HB3 PHE B 15 -8.356 -6.465 2.668 1.00 0.00 H new ATOM 0 HD1 PHE B 15 -9.961 -4.586 -0.167 1.00 0.00 H new ATOM 0 HD2 PHE B 15 -9.163 -8.424 1.592 1.00 0.00 H new ATOM 0 HE1 PHE B 15 -10.911 -5.706 -2.170 1.00 0.00 H new ATOM 0 HE2 PHE B 15 -10.083 -9.539 -0.420 1.00 0.00 H new ATOM 0 HZ PHE B 15 -10.965 -8.181 -2.298 1.00 0.00 H new ATOM 1663 N HIS B 16 -10.716 -7.191 4.243 1.00 0.00 N ATOM 1664 CA HIS B 16 -11.534 -8.299 4.647 1.00 0.00 C ATOM 1665 C HIS B 16 -12.840 -7.782 5.174 1.00 0.00 C ATOM 1666 O HIS B 16 -13.877 -8.424 5.027 1.00 0.00 O ATOM 1667 CB HIS B 16 -10.826 -9.169 5.687 1.00 0.00 C ATOM 1668 CG HIS B 16 -11.687 -10.357 6.019 1.00 0.00 C ATOM 1669 ND1 HIS B 16 -12.555 -10.362 7.099 1.00 0.00 N ATOM 1670 CD2 HIS B 16 -11.826 -11.585 5.421 1.00 0.00 C ATOM 1671 CE1 HIS B 16 -13.171 -11.558 7.120 1.00 0.00 C ATOM 1672 NE2 HIS B 16 -12.763 -12.342 6.118 1.00 0.00 N ATOM 0 H HIS B 16 -9.880 -7.036 4.807 1.00 0.00 H new ATOM 0 HA HIS B 16 -11.722 -8.932 3.780 1.00 0.00 H new ATOM 0 HB2 HIS B 16 -9.862 -9.502 5.302 1.00 0.00 H new ATOM 0 HB3 HIS B 16 -10.627 -8.588 6.588 1.00 0.00 H new ATOM 0 HD2 HIS B 16 -11.290 -11.914 4.543 1.00 0.00 H new ATOM 0 HE1 HIS B 16 -13.905 -11.849 7.857 1.00 0.00 H new ATOM 0 HE2 HIS B 16 -13.072 -13.291 5.909 1.00 0.00 H new ATOM 1681 N ALA B 17 -12.795 -6.625 5.814 1.00 0.00 N ATOM 1682 CA ALA B 17 -14.008 -6.092 6.366 1.00 0.00 C ATOM 1683 C ALA B 17 -15.046 -5.868 5.287 1.00 0.00 C ATOM 1684 O ALA B 17 -16.164 -6.340 5.417 1.00 0.00 O ATOM 1685 CB ALA B 17 -13.736 -4.750 7.053 1.00 0.00 C ATOM 0 H ALA B 17 -11.958 -6.060 5.956 1.00 0.00 H new ATOM 0 HA ALA B 17 -14.383 -6.818 7.088 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -14.665 -4.358 7.467 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -13.013 -4.892 7.856 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -13.336 -4.043 6.326 1.00 0.00 H new ATOM 1691 N HIS B 18 -14.708 -5.181 4.196 1.00 0.00 N ATOM 1692 CA HIS B 18 -15.753 -4.990 3.168 1.00 0.00 C ATOM 1693 C HIS B 18 -15.942 -6.203 2.246 1.00 0.00 C ATOM 1694 O HIS B 18 -17.086 -6.645 2.044 1.00 0.00 O ATOM 1695 CB HIS B 18 -15.608 -3.675 2.372 1.00 0.00 C ATOM 1696 CG HIS B 18 -14.303 -3.606 1.660 1.00 0.00 C ATOM 1697 ND1 HIS B 18 -13.984 -2.598 0.763 1.00 0.00 N ATOM 1698 CD2 HIS B 18 -13.219 -4.396 1.728 1.00 0.00 C ATOM 1699 CE1 HIS B 18 -12.733 -2.830 0.332 1.00 0.00 C ATOM 1700 NE2 HIS B 18 -12.227 -3.921 0.882 1.00 0.00 N ATOM 0 H HIS B 18 -13.795 -4.772 3.999 1.00 0.00 H new ATOM 0 HA HIS B 18 -16.676 -4.898 3.741 1.00 0.00 H new ATOM 0 HB2 HIS B 18 -16.421 -3.594 1.651 1.00 0.00 H new ATOM 0 HB3 HIS B 18 -15.698 -2.827 3.050 1.00 0.00 H new ATOM 0 HD2 HIS B 18 -13.132 -5.274 2.351 1.00 0.00 H new ATOM 0 HE1 HIS B 18 -12.207 -2.205 -0.374 1.00 0.00 H new ATOM 0 HE2 HIS B 18 -11.305 -4.326 0.719 1.00 0.00 H new ATOM 1709 N SER B 19 -14.854 -6.764 1.678 1.00 0.00 N ATOM 1710 CA SER B 19 -15.048 -7.910 0.796 1.00 0.00 C ATOM 1711 C SER B 19 -15.692 -9.050 1.574 1.00 0.00 C ATOM 1712 O SER B 19 -16.597 -9.718 1.072 1.00 0.00 O ATOM 1713 CB SER B 19 -13.733 -8.379 0.159 1.00 0.00 C ATOM 1714 OG SER B 19 -14.007 -9.412 -0.812 1.00 0.00 O ATOM 0 H SER B 19 -13.890 -6.458 1.809 1.00 0.00 H new ATOM 0 HA SER B 19 -15.705 -7.599 -0.016 1.00 0.00 H new ATOM 0 HB2 SER B 19 -13.230 -7.539 -0.320 1.00 0.00 H new ATOM 0 HB3 SER B 19 -13.059 -8.758 0.928 1.00 0.00 H new ATOM 0 HG SER B 19 -14.971 -9.583 -0.845 1.00 0.00 H new ATOM 1720 N GLY B 20 -15.225 -9.237 2.820 1.00 0.00 N ATOM 1721 CA GLY B 20 -15.755 -10.271 3.711 1.00 0.00 C ATOM 1722 C GLY B 20 -17.173 -9.961 4.165 1.00 0.00 C ATOM 1723 O GLY B 20 -18.035 -10.840 4.171 1.00 0.00 O ATOM 0 H GLY B 20 -14.476 -8.679 3.231 1.00 0.00 H new ATOM 0 HA2 GLY B 20 -15.741 -11.233 3.199 1.00 0.00 H new ATOM 0 HA3 GLY B 20 -15.108 -10.365 4.583 1.00 0.00 H new ATOM 1727 N LYS B 21 -17.411 -8.713 4.559 1.00 0.00 N ATOM 1728 CA LYS B 21 -18.742 -8.330 5.024 1.00 0.00 C ATOM 1729 C LYS B 21 -19.810 -8.552 3.954 1.00 0.00 C ATOM 1730 O LYS B 21 -20.901 -9.034 4.264 1.00 0.00 O ATOM 1731 CB LYS B 21 -18.731 -6.866 5.448 1.00 0.00 C ATOM 1732 CG LYS B 21 -20.089 -6.445 5.987 1.00 0.00 C ATOM 1733 CD LYS B 21 -20.002 -4.969 6.377 1.00 0.00 C ATOM 1734 CE LYS B 21 -19.800 -4.111 5.119 1.00 0.00 C ATOM 1735 NZ LYS B 21 -18.369 -3.702 5.025 1.00 0.00 N ATOM 0 H LYS B 21 -16.718 -7.965 4.567 1.00 0.00 H new ATOM 0 HA LYS B 21 -18.994 -8.965 5.874 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -17.969 -6.710 6.211 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -18.463 -6.239 4.597 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -20.862 -6.596 5.234 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -20.362 -7.052 6.850 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -20.913 -4.665 6.893 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -19.176 -4.814 7.071 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -20.088 -4.674 4.231 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -20.440 -3.230 5.160 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 -18.128 -3.508 4.032 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 -18.215 -2.844 5.593 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 -17.765 -4.468 5.384 1.00 0.00 H new ATOM 1749 N GLU B 22 -19.512 -8.208 2.694 1.00 0.00 N ATOM 1750 CA GLU B 22 -20.501 -8.402 1.619 1.00 0.00 C ATOM 1751 C GLU B 22 -19.937 -9.151 0.413 1.00 0.00 C ATOM 1752 O GLU B 22 -18.747 -9.082 0.127 1.00 0.00 O ATOM 1753 CB GLU B 22 -21.048 -7.061 1.148 1.00 0.00 C ATOM 1754 CG GLU B 22 -21.825 -6.393 2.274 1.00 0.00 C ATOM 1755 CD GLU B 22 -22.431 -5.080 1.790 1.00 0.00 C ATOM 1756 OE1 GLU B 22 -22.100 -4.667 0.691 1.00 0.00 O ATOM 1757 OE2 GLU B 22 -23.220 -4.508 2.523 1.00 0.00 O ATOM 0 H GLU B 22 -18.623 -7.806 2.397 1.00 0.00 H new ATOM 0 HA GLU B 22 -21.296 -9.011 2.050 1.00 0.00 H new ATOM 0 HB2 GLU B 22 -20.229 -6.417 0.828 1.00 0.00 H new ATOM 0 HB3 GLU B 22 -21.696 -7.206 0.284 1.00 0.00 H new ATOM 0 HG2 GLU B 22 -22.614 -7.058 2.626 1.00 0.00 H new ATOM 0 HG3 GLU B 22 -21.164 -6.207 3.121 1.00 0.00 H new ATOM 1764 N GLY B 23 -20.827 -9.831 -0.311 1.00 0.00 N ATOM 1765 CA GLY B 23 -20.454 -10.558 -1.527 1.00 0.00 C ATOM 1766 C GLY B 23 -19.320 -11.547 -1.289 1.00 0.00 C ATOM 1767 O GLY B 23 -19.206 -12.137 -0.214 1.00 0.00 O ATOM 0 H GLY B 23 -21.817 -9.894 -0.075 1.00 0.00 H new ATOM 0 HA2 GLY B 23 -21.324 -11.092 -1.909 1.00 0.00 H new ATOM 0 HA3 GLY B 23 -20.155 -9.845 -2.296 1.00 0.00 H new ATOM 1771 N ASP B 24 -18.472 -11.709 -2.307 1.00 0.00 N ATOM 1772 CA ASP B 24 -17.336 -12.615 -2.206 1.00 0.00 C ATOM 1773 C ASP B 24 -16.301 -12.027 -1.262 1.00 0.00 C ATOM 1774 O ASP B 24 -16.043 -10.821 -1.277 1.00 0.00 O ATOM 1775 CB ASP B 24 -16.718 -12.847 -3.584 1.00 0.00 C ATOM 1776 CG ASP B 24 -17.699 -13.601 -4.476 1.00 0.00 C ATOM 1777 OD1 ASP B 24 -18.674 -14.111 -3.951 1.00 0.00 O ATOM 1778 OD2 ASP B 24 -17.460 -13.656 -5.672 1.00 0.00 O ATOM 0 H ASP B 24 -18.553 -11.227 -3.202 1.00 0.00 H new ATOM 0 HA ASP B 24 -17.678 -13.573 -1.815 1.00 0.00 H new ATOM 0 HB2 ASP B 24 -16.459 -11.892 -4.041 1.00 0.00 H new ATOM 0 HB3 ASP B 24 -15.793 -13.415 -3.486 1.00 0.00 H new ATOM 1783 N LYS B 25 -15.737 -12.875 -0.421 1.00 0.00 N ATOM 1784 CA LYS B 25 -14.759 -12.426 0.556 1.00 0.00 C ATOM 1785 C LYS B 25 -13.518 -11.816 -0.092 1.00 0.00 C ATOM 1786 O LYS B 25 -12.880 -10.944 0.490 1.00 0.00 O ATOM 1787 CB LYS B 25 -14.341 -13.580 1.468 1.00 0.00 C ATOM 1788 CG LYS B 25 -15.585 -14.146 2.195 1.00 0.00 C ATOM 1789 CD LYS B 25 -15.147 -15.132 3.286 1.00 0.00 C ATOM 1790 CE LYS B 25 -14.478 -16.357 2.653 1.00 0.00 C ATOM 1791 NZ LYS B 25 -14.702 -17.548 3.522 1.00 0.00 N ATOM 0 H LYS B 25 -15.938 -13.875 -0.394 1.00 0.00 H new ATOM 0 HA LYS B 25 -15.244 -11.646 1.143 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -13.862 -14.364 0.882 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -13.608 -13.234 2.197 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -16.160 -13.333 2.637 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -16.238 -14.647 1.481 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -14.454 -14.644 3.971 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -16.011 -15.443 3.874 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -14.888 -16.536 1.659 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -13.410 -16.179 2.530 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -13.793 -18.019 3.706 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -15.124 -17.246 4.423 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -15.345 -18.211 3.044 1.00 0.00 H new ATOM 1805 N TYR B 26 -13.142 -12.310 -1.265 1.00 0.00 N ATOM 1806 CA TYR B 26 -11.933 -11.824 -1.935 1.00 0.00 C ATOM 1807 C TYR B 26 -12.224 -10.947 -3.150 1.00 0.00 C ATOM 1808 O TYR B 26 -11.334 -10.729 -3.972 1.00 0.00 O ATOM 1809 CB TYR B 26 -11.072 -13.014 -2.355 1.00 0.00 C ATOM 1810 CG TYR B 26 -10.658 -13.770 -1.118 1.00 0.00 C ATOM 1811 CD1 TYR B 26 -9.580 -13.311 -0.353 1.00 0.00 C ATOM 1812 CD2 TYR B 26 -11.357 -14.917 -0.728 1.00 0.00 C ATOM 1813 CE1 TYR B 26 -9.198 -14.001 0.802 1.00 0.00 C ATOM 1814 CE2 TYR B 26 -10.977 -15.607 0.429 1.00 0.00 C ATOM 1815 CZ TYR B 26 -9.897 -15.147 1.194 1.00 0.00 C ATOM 1816 OH TYR B 26 -9.523 -15.822 2.335 1.00 0.00 O ATOM 0 H TYR B 26 -13.647 -13.038 -1.771 1.00 0.00 H new ATOM 0 HA TYR B 26 -11.404 -11.197 -1.217 1.00 0.00 H new ATOM 0 HB2 TYR B 26 -11.630 -13.666 -3.027 1.00 0.00 H new ATOM 0 HB3 TYR B 26 -10.193 -12.671 -2.900 1.00 0.00 H new ATOM 0 HD1 TYR B 26 -9.043 -12.424 -0.654 1.00 0.00 H new ATOM 0 HD2 TYR B 26 -12.189 -15.270 -1.319 1.00 0.00 H new ATOM 0 HE1 TYR B 26 -8.364 -13.649 1.391 1.00 0.00 H new ATOM 0 HE2 TYR B 26 -11.516 -16.493 0.732 1.00 0.00 H new ATOM 0 HH TYR B 26 -9.183 -16.709 2.094 1.00 0.00 H new ATOM 1826 N LYS B 27 -13.436 -10.402 -3.263 1.00 0.00 N ATOM 1827 CA LYS B 27 -13.721 -9.516 -4.399 1.00 0.00 C ATOM 1828 C LYS B 27 -14.577 -8.359 -3.920 1.00 0.00 C ATOM 1829 O LYS B 27 -15.449 -8.535 -3.069 1.00 0.00 O ATOM 1830 CB LYS B 27 -14.393 -10.253 -5.568 1.00 0.00 C ATOM 1831 CG LYS B 27 -14.282 -9.422 -6.860 1.00 0.00 C ATOM 1832 CD LYS B 27 -12.841 -9.522 -7.423 1.00 0.00 C ATOM 1833 CE LYS B 27 -12.792 -9.027 -8.863 1.00 0.00 C ATOM 1834 NZ LYS B 27 -11.551 -9.532 -9.515 1.00 0.00 N ATOM 0 H LYS B 27 -14.209 -10.547 -2.613 1.00 0.00 H new ATOM 0 HA LYS B 27 -12.773 -9.140 -4.785 1.00 0.00 H new ATOM 0 HB2 LYS B 27 -13.923 -11.226 -5.712 1.00 0.00 H new ATOM 0 HB3 LYS B 27 -15.442 -10.437 -5.335 1.00 0.00 H new ATOM 0 HG2 LYS B 27 -14.997 -9.783 -7.599 1.00 0.00 H new ATOM 0 HG3 LYS B 27 -14.532 -8.381 -6.657 1.00 0.00 H new ATOM 0 HD2 LYS B 27 -12.162 -8.932 -6.807 1.00 0.00 H new ATOM 0 HD3 LYS B 27 -12.497 -10.555 -7.376 1.00 0.00 H new ATOM 0 HE2 LYS B 27 -13.670 -9.373 -9.409 1.00 0.00 H new ATOM 0 HE3 LYS B 27 -12.811 -7.937 -8.886 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 -11.390 -9.015 -10.403 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 -10.741 -9.387 -8.879 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 -11.654 -10.547 -9.719 1.00 0.00 H new ATOM 1848 N LEU B 28 -14.288 -7.169 -4.416 1.00 0.00 N ATOM 1849 CA LEU B 28 -15.001 -5.981 -3.974 1.00 0.00 C ATOM 1850 C LEU B 28 -15.869 -5.388 -5.085 1.00 0.00 C ATOM 1851 O LEU B 28 -15.411 -5.198 -6.204 1.00 0.00 O ATOM 1852 CB LEU B 28 -13.933 -5.000 -3.519 1.00 0.00 C ATOM 1853 CG LEU B 28 -14.504 -3.807 -2.745 1.00 0.00 C ATOM 1854 CD1 LEU B 28 -15.005 -4.185 -1.333 1.00 0.00 C ATOM 1855 CD2 LEU B 28 -13.376 -2.798 -2.581 1.00 0.00 C ATOM 0 H LEU B 28 -13.570 -6.999 -5.120 1.00 0.00 H new ATOM 0 HA LEU B 28 -15.692 -6.220 -3.166 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -13.212 -5.522 -2.890 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -13.389 -4.634 -4.390 1.00 0.00 H new ATOM 0 HG LEU B 28 -15.356 -3.418 -3.302 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -15.397 -3.297 -0.836 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -15.793 -4.933 -1.415 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -14.178 -4.591 -0.750 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -13.741 -1.930 -2.033 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -12.555 -3.256 -2.029 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -13.022 -2.485 -3.563 1.00 0.00 H new ATOM 1867 N SER B 29 -17.124 -5.085 -4.760 1.00 0.00 N ATOM 1868 CA SER B 29 -18.046 -4.497 -5.723 1.00 0.00 C ATOM 1869 C SER B 29 -18.190 -2.998 -5.452 1.00 0.00 C ATOM 1870 O SER B 29 -17.758 -2.504 -4.402 1.00 0.00 O ATOM 1871 CB SER B 29 -19.396 -5.211 -5.666 1.00 0.00 C ATOM 1872 OG SER B 29 -19.971 -5.030 -4.389 1.00 0.00 O ATOM 0 H SER B 29 -17.524 -5.238 -3.834 1.00 0.00 H new ATOM 0 HA SER B 29 -17.649 -4.622 -6.730 1.00 0.00 H new ATOM 0 HB2 SER B 29 -20.061 -4.817 -6.435 1.00 0.00 H new ATOM 0 HB3 SER B 29 -19.266 -6.274 -5.871 1.00 0.00 H new ATOM 0 HG SER B 29 -19.863 -5.849 -3.862 1.00 0.00 H new ATOM 1878 N LYS B 30 -18.741 -2.264 -6.417 1.00 0.00 N ATOM 1879 CA LYS B 30 -18.856 -0.816 -6.268 1.00 0.00 C ATOM 1880 C LYS B 30 -19.557 -0.433 -4.980 1.00 0.00 C ATOM 1881 O LYS B 30 -19.114 0.469 -4.248 1.00 0.00 O ATOM 1882 CB LYS B 30 -19.720 -0.254 -7.391 1.00 0.00 C ATOM 1883 CG LYS B 30 -19.734 1.277 -7.309 1.00 0.00 C ATOM 1884 CD LYS B 30 -20.718 1.818 -8.341 1.00 0.00 C ATOM 1885 CE LYS B 30 -22.152 1.467 -7.901 1.00 0.00 C ATOM 1886 NZ LYS B 30 -23.062 2.598 -8.234 1.00 0.00 N ATOM 0 H LYS B 30 -19.107 -2.638 -7.292 1.00 0.00 H new ATOM 0 HA LYS B 30 -17.840 -0.420 -6.280 1.00 0.00 H new ATOM 0 HB2 LYS B 30 -19.331 -0.573 -8.358 1.00 0.00 H new ATOM 0 HB3 LYS B 30 -20.735 -0.642 -7.312 1.00 0.00 H new ATOM 0 HG2 LYS B 30 -20.023 1.598 -6.308 1.00 0.00 H new ATOM 0 HG3 LYS B 30 -18.736 1.674 -7.496 1.00 0.00 H new ATOM 0 HD2 LYS B 30 -20.607 2.898 -8.436 1.00 0.00 H new ATOM 0 HD3 LYS B 30 -20.509 1.389 -9.321 1.00 0.00 H new ATOM 0 HE2 LYS B 30 -22.486 0.558 -8.401 1.00 0.00 H new ATOM 0 HE3 LYS B 30 -22.177 1.269 -6.829 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 -24.031 2.363 -7.938 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 -22.746 3.455 -7.737 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 -23.045 2.767 -9.260 1.00 0.00 H new ATOM 1900 N LYS B 31 -20.653 -1.105 -4.705 1.00 0.00 N ATOM 1901 CA LYS B 31 -21.403 -0.792 -3.518 1.00 0.00 C ATOM 1902 C LYS B 31 -20.528 -0.981 -2.290 1.00 0.00 C ATOM 1903 O LYS B 31 -20.518 -0.146 -1.388 1.00 0.00 O ATOM 1904 CB LYS B 31 -22.609 -1.719 -3.438 1.00 0.00 C ATOM 1905 CG LYS B 31 -22.110 -3.140 -3.198 1.00 0.00 C ATOM 1906 CD LYS B 31 -23.268 -4.099 -3.271 1.00 0.00 C ATOM 1907 CE LYS B 31 -22.829 -5.483 -2.788 1.00 0.00 C ATOM 1908 NZ LYS B 31 -24.018 -6.376 -2.691 1.00 0.00 N ATOM 0 H LYS B 31 -21.036 -1.857 -5.277 1.00 0.00 H new ATOM 0 HA LYS B 31 -21.736 0.245 -3.557 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -23.273 -1.409 -2.631 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -23.186 -1.671 -4.361 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -21.359 -3.403 -3.943 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -21.629 -3.208 -2.222 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -24.092 -3.735 -2.658 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -23.636 -4.161 -4.295 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -22.099 -5.906 -3.478 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -22.341 -5.403 -1.817 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -23.720 -7.317 -2.363 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -24.700 -5.974 -2.017 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -24.465 -6.461 -3.626 1.00 0.00 H new ATOM 1922 N GLU B 32 -19.825 -2.108 -2.240 1.00 0.00 N ATOM 1923 CA GLU B 32 -18.994 -2.389 -1.075 1.00 0.00 C ATOM 1924 C GLU B 32 -17.890 -1.339 -0.896 1.00 0.00 C ATOM 1925 O GLU B 32 -17.754 -0.789 0.204 1.00 0.00 O ATOM 1926 CB GLU B 32 -18.347 -3.771 -1.188 1.00 0.00 C ATOM 1927 CG GLU B 32 -19.433 -4.839 -1.266 1.00 0.00 C ATOM 1928 CD GLU B 32 -18.815 -6.241 -1.257 1.00 0.00 C ATOM 1929 OE1 GLU B 32 -17.598 -6.343 -1.320 1.00 0.00 O ATOM 1930 OE2 GLU B 32 -19.570 -7.195 -1.185 1.00 0.00 O ATOM 0 H GLU B 32 -19.812 -2.822 -2.968 1.00 0.00 H new ATOM 0 HA GLU B 32 -19.652 -2.359 -0.206 1.00 0.00 H new ATOM 0 HB2 GLU B 32 -17.714 -3.816 -2.074 1.00 0.00 H new ATOM 0 HB3 GLU B 32 -17.704 -3.954 -0.327 1.00 0.00 H new ATOM 0 HG2 GLU B 32 -20.116 -4.732 -0.424 1.00 0.00 H new ATOM 0 HG3 GLU B 32 -20.021 -4.701 -2.173 1.00 0.00 H new ATOM 1937 N LEU B 33 -17.114 -0.999 -1.945 1.00 0.00 N ATOM 1938 CA LEU B 33 -16.099 0.039 -1.701 1.00 0.00 C ATOM 1939 C LEU B 33 -16.794 1.292 -1.226 1.00 0.00 C ATOM 1940 O LEU B 33 -16.283 2.004 -0.367 1.00 0.00 O ATOM 1941 CB LEU B 33 -15.199 0.437 -2.895 1.00 0.00 C ATOM 1942 CG LEU B 33 -15.909 0.280 -4.265 1.00 0.00 C ATOM 1943 CD1 LEU B 33 -16.012 1.648 -4.977 1.00 0.00 C ATOM 1944 CD2 LEU B 33 -15.095 -0.685 -5.161 1.00 0.00 C ATOM 0 H LEU B 33 -17.160 -1.387 -2.887 1.00 0.00 H new ATOM 0 HA LEU B 33 -15.430 -0.411 -0.968 1.00 0.00 H new ATOM 0 HB2 LEU B 33 -14.880 1.472 -2.774 1.00 0.00 H new ATOM 0 HB3 LEU B 33 -14.299 -0.177 -2.886 1.00 0.00 H new ATOM 0 HG LEU B 33 -16.910 -0.116 -4.095 1.00 0.00 H new ATOM 0 HD11 LEU B 33 -16.512 1.522 -5.937 1.00 0.00 H new ATOM 0 HD12 LEU B 33 -16.584 2.338 -4.357 1.00 0.00 H new ATOM 0 HD13 LEU B 33 -15.012 2.050 -5.139 1.00 0.00 H new ATOM 0 HD21 LEU B 33 -15.594 -0.795 -6.124 1.00 0.00 H new ATOM 0 HD22 LEU B 33 -14.094 -0.282 -5.315 1.00 0.00 H new ATOM 0 HD23 LEU B 33 -15.023 -1.658 -4.676 1.00 0.00 H new ATOM 1956 N LYS B 34 -17.957 1.582 -1.778 1.00 0.00 N ATOM 1957 CA LYS B 34 -18.624 2.787 -1.354 1.00 0.00 C ATOM 1958 C LYS B 34 -18.746 2.755 0.158 1.00 0.00 C ATOM 1959 O LYS B 34 -18.607 3.782 0.820 1.00 0.00 O ATOM 1960 CB LYS B 34 -20.017 2.895 -1.983 1.00 0.00 C ATOM 1961 CG LYS B 34 -20.651 4.253 -1.645 1.00 0.00 C ATOM 1962 CD LYS B 34 -20.048 5.341 -2.543 1.00 0.00 C ATOM 1963 CE LYS B 34 -20.771 6.676 -2.327 1.00 0.00 C ATOM 1964 NZ LYS B 34 -19.978 7.520 -1.391 1.00 0.00 N ATOM 0 H LYS B 34 -18.437 1.027 -2.487 1.00 0.00 H new ATOM 0 HA LYS B 34 -18.045 3.653 -1.675 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -19.945 2.779 -3.064 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -20.652 2.088 -1.617 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -21.731 4.207 -1.787 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -20.478 4.496 -0.597 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -18.987 5.456 -2.323 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -20.127 5.043 -3.589 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -20.900 7.191 -3.279 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -21.768 6.501 -1.922 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -20.010 8.511 -1.705 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -20.378 7.447 -0.434 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -18.991 7.193 -1.380 1.00 0.00 H new ATOM 1978 N GLU B 35 -18.981 1.569 0.711 1.00 0.00 N ATOM 1979 CA GLU B 35 -19.083 1.447 2.152 1.00 0.00 C ATOM 1980 C GLU B 35 -17.721 1.575 2.844 1.00 0.00 C ATOM 1981 O GLU B 35 -17.615 2.227 3.886 1.00 0.00 O ATOM 1982 CB GLU B 35 -19.706 0.097 2.510 1.00 0.00 C ATOM 1983 CG GLU B 35 -21.146 0.045 1.994 1.00 0.00 C ATOM 1984 CD GLU B 35 -21.799 -1.270 2.405 1.00 0.00 C ATOM 1985 OE1 GLU B 35 -21.092 -2.130 2.902 1.00 0.00 O ATOM 1986 OE2 GLU B 35 -22.997 -1.397 2.215 1.00 0.00 O ATOM 0 H GLU B 35 -19.101 0.699 0.192 1.00 0.00 H new ATOM 0 HA GLU B 35 -19.713 2.264 2.504 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -19.122 -0.712 2.072 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -19.690 -0.047 3.590 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -21.715 0.884 2.394 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -21.156 0.142 0.908 1.00 0.00 H new ATOM 1993 N LEU B 36 -16.677 0.928 2.298 1.00 0.00 N ATOM 1994 CA LEU B 36 -15.377 0.993 2.974 1.00 0.00 C ATOM 1995 C LEU B 36 -14.772 2.395 2.926 1.00 0.00 C ATOM 1996 O LEU B 36 -14.321 2.907 3.947 1.00 0.00 O ATOM 1997 CB LEU B 36 -14.355 0.019 2.354 1.00 0.00 C ATOM 1998 CG LEU B 36 -13.167 -0.176 3.341 1.00 0.00 C ATOM 1999 CD1 LEU B 36 -12.275 -1.326 2.897 1.00 0.00 C ATOM 2000 CD2 LEU B 36 -12.314 1.089 3.435 1.00 0.00 C ATOM 0 H LEU B 36 -16.703 0.382 1.437 1.00 0.00 H new ATOM 0 HA LEU B 36 -15.576 0.713 4.008 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -14.830 -0.940 2.144 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -13.993 0.410 1.403 1.00 0.00 H new ATOM 0 HG LEU B 36 -13.598 -0.399 4.317 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -11.453 -1.442 3.603 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -12.858 -2.247 2.864 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -11.875 -1.114 1.905 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -11.492 0.923 4.132 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -11.912 1.331 2.451 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -12.928 1.917 3.790 1.00 0.00 H new ATOM 2012 N LEU B 37 -14.754 3.035 1.753 1.00 0.00 N ATOM 2013 CA LEU B 37 -14.154 4.360 1.699 1.00 0.00 C ATOM 2014 C LEU B 37 -14.872 5.296 2.655 1.00 0.00 C ATOM 2015 O LEU B 37 -14.231 6.052 3.378 1.00 0.00 O ATOM 2016 CB LEU B 37 -14.167 4.959 0.276 1.00 0.00 C ATOM 2017 CG LEU B 37 -13.131 4.274 -0.653 1.00 0.00 C ATOM 2018 CD1 LEU B 37 -11.713 4.753 -0.319 1.00 0.00 C ATOM 2019 CD2 LEU B 37 -13.184 2.759 -0.514 1.00 0.00 C ATOM 0 H LEU B 37 -15.128 2.677 0.874 1.00 0.00 H new ATOM 0 HA LEU B 37 -13.111 4.250 1.997 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -15.164 4.853 -0.153 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -13.955 6.027 0.330 1.00 0.00 H new ATOM 0 HG LEU B 37 -13.382 4.546 -1.678 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -10.998 4.263 -0.980 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -11.652 5.833 -0.456 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -11.479 4.504 0.716 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -12.447 2.307 -1.177 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -12.964 2.480 0.517 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -14.179 2.404 -0.782 1.00 0.00 H new ATOM 2031 N GLN B 38 -16.199 5.223 2.685 1.00 0.00 N ATOM 2032 CA GLN B 38 -16.960 6.065 3.597 1.00 0.00 C ATOM 2033 C GLN B 38 -16.670 5.729 5.059 1.00 0.00 C ATOM 2034 O GLN B 38 -16.582 6.627 5.897 1.00 0.00 O ATOM 2035 CB GLN B 38 -18.459 5.922 3.330 1.00 0.00 C ATOM 2036 CG GLN B 38 -18.798 6.490 1.951 1.00 0.00 C ATOM 2037 CD GLN B 38 -20.280 6.286 1.661 1.00 0.00 C ATOM 2038 OE1 GLN B 38 -20.881 7.060 0.801 1.00 0.00 O flip ATOM 2039 NE2 GLN B 38 -20.913 5.409 2.249 1.00 0.00 N flip ATOM 0 H GLN B 38 -16.759 4.602 2.101 1.00 0.00 H new ATOM 0 HA GLN B 38 -16.651 7.095 3.417 1.00 0.00 H new ATOM 0 HB2 GLN B 38 -18.748 4.872 3.382 1.00 0.00 H new ATOM 0 HB3 GLN B 38 -19.026 6.447 4.099 1.00 0.00 H new ATOM 0 HG2 GLN B 38 -18.553 7.552 1.914 1.00 0.00 H new ATOM 0 HG3 GLN B 38 -18.197 5.998 1.187 1.00 0.00 H new ATOM 0 HE21 GLN B 38 -20.442 4.804 2.922 1.00 0.00 H new ATOM 0 HE22 GLN B 38 -21.909 5.287 2.064 1.00 0.00 H new ATOM 2048 N THR B 39 -16.541 4.436 5.373 1.00 0.00 N ATOM 2049 CA THR B 39 -16.285 4.043 6.758 1.00 0.00 C ATOM 2050 C THR B 39 -14.881 4.420 7.226 1.00 0.00 C ATOM 2051 O THR B 39 -14.707 4.868 8.356 1.00 0.00 O ATOM 2052 CB THR B 39 -16.486 2.532 6.920 1.00 0.00 C ATOM 2053 OG1 THR B 39 -15.548 1.842 6.105 1.00 0.00 O ATOM 2054 CG2 THR B 39 -17.914 2.139 6.515 1.00 0.00 C ATOM 0 H THR B 39 -16.607 3.666 4.708 1.00 0.00 H new ATOM 0 HA THR B 39 -16.996 4.588 7.379 1.00 0.00 H new ATOM 0 HB THR B 39 -16.332 2.261 7.965 1.00 0.00 H new ATOM 0 HG1 THR B 39 -15.303 2.404 5.340 1.00 0.00 H new ATOM 0 HG21 THR B 39 -18.043 1.063 6.635 1.00 0.00 H new ATOM 0 HG22 THR B 39 -18.629 2.663 7.149 1.00 0.00 H new ATOM 0 HG23 THR B 39 -18.085 2.411 5.473 1.00 0.00 H new ATOM 2062 N GLU B 40 -13.881 4.240 6.364 1.00 0.00 N ATOM 2063 CA GLU B 40 -12.506 4.575 6.739 1.00 0.00 C ATOM 2064 C GLU B 40 -12.130 6.000 6.351 1.00 0.00 C ATOM 2065 O GLU B 40 -11.598 6.753 7.166 1.00 0.00 O ATOM 2066 CB GLU B 40 -11.524 3.616 6.068 1.00 0.00 C ATOM 2067 CG GLU B 40 -11.688 2.194 6.625 1.00 0.00 C ATOM 2068 CD GLU B 40 -11.281 2.141 8.094 1.00 0.00 C ATOM 2069 OE1 GLU B 40 -10.535 3.010 8.515 1.00 0.00 O ATOM 2070 OE2 GLU B 40 -11.723 1.232 8.776 1.00 0.00 O ATOM 0 H GLU B 40 -13.991 3.872 5.419 1.00 0.00 H new ATOM 0 HA GLU B 40 -12.449 4.485 7.824 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -11.691 3.612 4.991 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -10.503 3.960 6.231 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -12.724 1.873 6.518 1.00 0.00 H new ATOM 0 HG3 GLU B 40 -11.078 1.499 6.048 1.00 0.00 H new ATOM 2077 N LEU B 41 -12.374 6.358 5.088 1.00 0.00 N ATOM 2078 CA LEU B 41 -12.011 7.688 4.605 1.00 0.00 C ATOM 2079 C LEU B 41 -13.221 8.606 4.492 1.00 0.00 C ATOM 2080 O LEU B 41 -14.300 8.190 4.074 1.00 0.00 O ATOM 2081 CB LEU B 41 -11.344 7.601 3.224 1.00 0.00 C ATOM 2082 CG LEU B 41 -10.168 6.603 3.216 1.00 0.00 C ATOM 2083 CD1 LEU B 41 -9.412 6.723 1.884 1.00 0.00 C ATOM 2084 CD2 LEU B 41 -9.196 6.883 4.364 1.00 0.00 C ATOM 0 H LEU B 41 -12.814 5.755 4.393 1.00 0.00 H new ATOM 0 HA LEU B 41 -11.318 8.103 5.337 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -12.083 7.298 2.482 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -10.985 8.588 2.931 1.00 0.00 H new ATOM 0 HG LEU B 41 -10.572 5.598 3.339 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -8.580 6.019 1.873 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -10.089 6.497 1.060 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -9.031 7.738 1.772 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -8.378 6.163 4.332 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -8.796 7.892 4.264 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -9.721 6.793 5.315 1.00 0.00 H new ATOM 2096 N SER B 42 -13.023 9.873 4.841 1.00 0.00 N ATOM 2097 CA SER B 42 -14.093 10.855 4.742 1.00 0.00 C ATOM 2098 C SER B 42 -13.759 11.894 3.672 1.00 0.00 C ATOM 2099 O SER B 42 -14.446 12.005 2.657 1.00 0.00 O ATOM 2100 CB SER B 42 -14.287 11.545 6.097 1.00 0.00 C ATOM 2101 OG SER B 42 -15.298 10.864 6.828 1.00 0.00 O ATOM 0 H SER B 42 -12.139 10.240 5.192 1.00 0.00 H new ATOM 0 HA SER B 42 -15.016 10.347 4.461 1.00 0.00 H new ATOM 0 HB2 SER B 42 -13.352 11.542 6.657 1.00 0.00 H new ATOM 0 HB3 SER B 42 -14.568 12.588 5.951 1.00 0.00 H new ATOM 0 HG SER B 42 -15.424 11.301 7.696 1.00 0.00 H new ATOM 2107 N GLY B 43 -12.707 12.664 3.929 1.00 0.00 N ATOM 2108 CA GLY B 43 -12.279 13.721 3.018 1.00 0.00 C ATOM 2109 C GLY B 43 -11.923 13.230 1.610 1.00 0.00 C ATOM 2110 O GLY B 43 -12.189 13.928 0.632 1.00 0.00 O ATOM 0 H GLY B 43 -12.131 12.575 4.766 1.00 0.00 H new ATOM 0 HA2 GLY B 43 -13.073 14.463 2.942 1.00 0.00 H new ATOM 0 HA3 GLY B 43 -11.412 14.225 3.445 1.00 0.00 H new ATOM 2114 N PHE B 44 -11.290 12.061 1.494 1.00 0.00 N ATOM 2115 CA PHE B 44 -10.892 11.579 0.168 1.00 0.00 C ATOM 2116 C PHE B 44 -12.090 11.398 -0.771 1.00 0.00 C ATOM 2117 O PHE B 44 -12.105 11.957 -1.867 1.00 0.00 O ATOM 2118 CB PHE B 44 -10.136 10.252 0.307 1.00 0.00 C ATOM 2119 CG PHE B 44 -8.777 10.493 0.931 1.00 0.00 C ATOM 2120 CD1 PHE B 44 -7.680 10.782 0.106 1.00 0.00 C ATOM 2121 CD2 PHE B 44 -8.605 10.437 2.325 1.00 0.00 C ATOM 2122 CE1 PHE B 44 -6.419 11.012 0.669 1.00 0.00 C ATOM 2123 CE2 PHE B 44 -7.342 10.667 2.884 1.00 0.00 C ATOM 2124 CZ PHE B 44 -6.250 10.954 2.057 1.00 0.00 C ATOM 0 H PHE B 44 -11.048 11.448 2.272 1.00 0.00 H new ATOM 0 HA PHE B 44 -10.244 12.336 -0.274 1.00 0.00 H new ATOM 0 HB2 PHE B 44 -10.710 9.560 0.922 1.00 0.00 H new ATOM 0 HB3 PHE B 44 -10.019 9.787 -0.672 1.00 0.00 H new ATOM 0 HD1 PHE B 44 -7.808 10.827 -0.965 1.00 0.00 H new ATOM 0 HD2 PHE B 44 -9.447 10.217 2.965 1.00 0.00 H new ATOM 0 HE1 PHE B 44 -5.576 11.234 0.032 1.00 0.00 H new ATOM 0 HE2 PHE B 44 -7.210 10.623 3.955 1.00 0.00 H new ATOM 0 HZ PHE B 44 -5.277 11.131 2.490 1.00 0.00 H new ATOM 2134 N LEU B 45 -13.101 10.654 -0.336 1.00 0.00 N ATOM 2135 CA LEU B 45 -14.299 10.465 -1.163 1.00 0.00 C ATOM 2136 C LEU B 45 -15.165 11.716 -1.186 1.00 0.00 C ATOM 2137 O LEU B 45 -15.760 12.055 -2.210 1.00 0.00 O ATOM 2138 CB LEU B 45 -15.115 9.243 -0.683 1.00 0.00 C ATOM 2139 CG LEU B 45 -14.834 8.036 -1.593 1.00 0.00 C ATOM 2140 CD1 LEU B 45 -15.521 8.275 -2.953 1.00 0.00 C ATOM 2141 CD2 LEU B 45 -13.312 7.843 -1.780 1.00 0.00 C ATOM 0 H LEU B 45 -13.122 10.178 0.566 1.00 0.00 H new ATOM 0 HA LEU B 45 -13.965 10.275 -2.183 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -14.853 9.002 0.347 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -16.179 9.478 -0.694 1.00 0.00 H new ATOM 0 HG LEU B 45 -15.231 7.129 -1.136 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -15.331 7.427 -3.611 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -16.595 8.385 -2.804 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -15.123 9.182 -3.407 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -13.131 6.984 -2.427 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -12.885 8.737 -2.235 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -12.845 7.672 -0.810 1.00 0.00 H new ATOM 2153 N ASP B 46 -15.236 12.387 -0.054 1.00 0.00 N ATOM 2154 CA ASP B 46 -16.035 13.593 0.061 1.00 0.00 C ATOM 2155 C ASP B 46 -15.581 14.661 -0.930 1.00 0.00 C ATOM 2156 O ASP B 46 -16.371 15.508 -1.347 1.00 0.00 O ATOM 2157 CB ASP B 46 -15.975 14.147 1.485 1.00 0.00 C ATOM 2158 CG ASP B 46 -16.974 15.288 1.642 1.00 0.00 C ATOM 2159 OD1 ASP B 46 -17.723 15.526 0.708 1.00 0.00 O ATOM 2160 OD2 ASP B 46 -16.975 15.909 2.692 1.00 0.00 O ATOM 0 H ASP B 46 -14.750 12.118 0.801 1.00 0.00 H new ATOM 0 HA ASP B 46 -17.065 13.325 -0.174 1.00 0.00 H new ATOM 0 HB2 ASP B 46 -16.198 13.356 2.202 1.00 0.00 H new ATOM 0 HB3 ASP B 46 -14.968 14.501 1.704 1.00 0.00 H new ATOM 2165 N ALA B 47 -14.297 14.644 -1.265 1.00 0.00 N ATOM 2166 CA ALA B 47 -13.738 15.647 -2.163 1.00 0.00 C ATOM 2167 C ALA B 47 -14.495 15.705 -3.485 1.00 0.00 C ATOM 2168 O ALA B 47 -14.567 16.765 -4.106 1.00 0.00 O ATOM 2169 CB ALA B 47 -12.266 15.333 -2.434 1.00 0.00 C ATOM 0 H ALA B 47 -13.627 13.952 -0.931 1.00 0.00 H new ATOM 0 HA ALA B 47 -13.832 16.618 -1.677 1.00 0.00 H new ATOM 0 HB1 ALA B 47 -11.851 16.085 -3.106 1.00 0.00 H new ATOM 0 HB2 ALA B 47 -11.713 15.341 -1.495 1.00 0.00 H new ATOM 0 HB3 ALA B 47 -12.183 14.349 -2.895 1.00 0.00 H new ATOM 2175 N GLN B 48 -15.067 14.587 -3.926 1.00 0.00 N ATOM 2176 CA GLN B 48 -15.808 14.604 -5.184 1.00 0.00 C ATOM 2177 C GLN B 48 -17.285 14.883 -4.910 1.00 0.00 C ATOM 2178 O GLN B 48 -17.953 14.122 -4.211 1.00 0.00 O ATOM 2179 CB GLN B 48 -15.670 13.260 -5.887 1.00 0.00 C ATOM 2180 CG GLN B 48 -14.192 12.895 -6.016 1.00 0.00 C ATOM 2181 CD GLN B 48 -13.432 14.018 -6.710 1.00 0.00 C ATOM 2182 OE1 GLN B 48 -13.807 14.443 -7.802 1.00 0.00 O ATOM 2183 NE2 GLN B 48 -12.390 14.541 -6.125 1.00 0.00 N ATOM 0 H GLN B 48 -15.035 13.686 -3.449 1.00 0.00 H new ATOM 0 HA GLN B 48 -15.402 15.388 -5.823 1.00 0.00 H new ATOM 0 HB2 GLN B 48 -16.197 12.489 -5.325 1.00 0.00 H new ATOM 0 HB3 GLN B 48 -16.131 13.306 -6.874 1.00 0.00 H new ATOM 0 HG2 GLN B 48 -13.767 12.714 -5.029 1.00 0.00 H new ATOM 0 HG3 GLN B 48 -14.086 11.970 -6.583 1.00 0.00 H new ATOM 0 HE21 GLN B 48 -12.082 14.186 -5.220 1.00 0.00 H new ATOM 0 HE22 GLN B 48 -11.883 15.305 -6.573 1.00 0.00 H new ATOM 2192 N LYS B 49 -17.776 15.990 -5.454 1.00 0.00 N ATOM 2193 CA LYS B 49 -19.168 16.391 -5.257 1.00 0.00 C ATOM 2194 C LYS B 49 -20.183 15.404 -5.839 1.00 0.00 C ATOM 2195 O LYS B 49 -21.265 15.226 -5.281 1.00 0.00 O ATOM 2196 CB LYS B 49 -19.399 17.773 -5.871 1.00 0.00 C ATOM 2197 CG LYS B 49 -18.558 18.810 -5.125 1.00 0.00 C ATOM 2198 CD LYS B 49 -18.877 20.208 -5.661 1.00 0.00 C ATOM 2199 CE LYS B 49 -17.950 21.230 -5.003 1.00 0.00 C ATOM 2200 NZ LYS B 49 -18.426 21.514 -3.619 1.00 0.00 N ATOM 0 H LYS B 49 -17.232 16.628 -6.036 1.00 0.00 H new ATOM 0 HA LYS B 49 -19.330 16.409 -4.179 1.00 0.00 H new ATOM 0 HB2 LYS B 49 -19.130 17.763 -6.927 1.00 0.00 H new ATOM 0 HB3 LYS B 49 -20.455 18.036 -5.813 1.00 0.00 H new ATOM 0 HG2 LYS B 49 -18.767 18.762 -4.056 1.00 0.00 H new ATOM 0 HG3 LYS B 49 -17.497 18.593 -5.252 1.00 0.00 H new ATOM 0 HD2 LYS B 49 -18.752 20.231 -6.744 1.00 0.00 H new ATOM 0 HD3 LYS B 49 -19.917 20.459 -5.455 1.00 0.00 H new ATOM 0 HE2 LYS B 49 -16.930 20.847 -4.977 1.00 0.00 H new ATOM 0 HE3 LYS B 49 -17.931 22.149 -5.588 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 -17.816 22.234 -3.183 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 -19.405 21.864 -3.653 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 -18.390 20.642 -3.054 1.00 0.00 H new ATOM 2214 N ASP B 50 -19.863 14.803 -6.980 1.00 0.00 N ATOM 2215 CA ASP B 50 -20.805 13.889 -7.627 1.00 0.00 C ATOM 2216 C ASP B 50 -20.977 12.582 -6.862 1.00 0.00 C ATOM 2217 O ASP B 50 -20.019 12.025 -6.326 1.00 0.00 O ATOM 2218 CB ASP B 50 -20.353 13.570 -9.047 1.00 0.00 C ATOM 2219 CG ASP B 50 -20.414 14.825 -9.911 1.00 0.00 C ATOM 2220 OD1 ASP B 50 -21.017 15.792 -9.475 1.00 0.00 O ATOM 2221 OD2 ASP B 50 -19.855 14.800 -10.996 1.00 0.00 O ATOM 0 H ASP B 50 -18.977 14.927 -7.470 1.00 0.00 H new ATOM 0 HA ASP B 50 -21.766 14.403 -7.641 1.00 0.00 H new ATOM 0 HB2 ASP B 50 -19.336 13.177 -9.034 1.00 0.00 H new ATOM 0 HB3 ASP B 50 -20.989 12.794 -9.474 1.00 0.00 H new ATOM 2226 N VAL B 51 -22.214 12.086 -6.847 1.00 0.00 N ATOM 2227 CA VAL B 51 -22.521 10.824 -6.180 1.00 0.00 C ATOM 2228 C VAL B 51 -21.986 9.668 -7.015 1.00 0.00 C ATOM 2229 O VAL B 51 -21.656 8.603 -6.495 1.00 0.00 O ATOM 2230 CB VAL B 51 -24.036 10.666 -5.993 1.00 0.00 C ATOM 2231 CG1 VAL B 51 -24.624 11.953 -5.402 1.00 0.00 C ATOM 2232 CG2 VAL B 51 -24.704 10.353 -7.339 1.00 0.00 C ATOM 0 H VAL B 51 -23.016 12.538 -7.287 1.00 0.00 H new ATOM 0 HA VAL B 51 -22.048 10.821 -5.198 1.00 0.00 H new ATOM 0 HB VAL B 51 -24.224 9.840 -5.307 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -25.700 11.835 -5.271 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -24.161 12.154 -4.436 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -24.430 12.786 -6.078 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -25.779 10.243 -7.195 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -24.513 11.167 -8.038 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -24.295 9.426 -7.741 1.00 0.00 H new ATOM 2242 N ASP B 52 -21.898 9.905 -8.321 1.00 0.00 N ATOM 2243 CA ASP B 52 -21.394 8.905 -9.254 1.00 0.00 C ATOM 2244 C ASP B 52 -19.877 8.871 -9.187 1.00 0.00 C ATOM 2245 O ASP B 52 -19.218 8.105 -9.898 1.00 0.00 O ATOM 2246 CB ASP B 52 -21.840 9.240 -10.678 1.00 0.00 C ATOM 2247 CG ASP B 52 -23.355 9.104 -10.796 1.00 0.00 C ATOM 2248 OD1 ASP B 52 -23.953 8.546 -9.890 1.00 0.00 O ATOM 2249 OD2 ASP B 52 -23.896 9.559 -11.790 1.00 0.00 O ATOM 0 H ASP B 52 -22.171 10.786 -8.757 1.00 0.00 H new ATOM 0 HA ASP B 52 -21.794 7.928 -8.981 1.00 0.00 H new ATOM 0 HB2 ASP B 52 -21.537 10.255 -10.933 1.00 0.00 H new ATOM 0 HB3 ASP B 52 -21.350 8.573 -11.388 1.00 0.00 H new ATOM 2254 N ALA B 53 -19.328 9.722 -8.331 1.00 0.00 N ATOM 2255 CA ALA B 53 -17.891 9.799 -8.180 1.00 0.00 C ATOM 2256 C ALA B 53 -17.332 8.436 -7.809 1.00 0.00 C ATOM 2257 O ALA B 53 -16.263 8.051 -8.279 1.00 0.00 O ATOM 2258 CB ALA B 53 -17.547 10.801 -7.087 1.00 0.00 C ATOM 0 H ALA B 53 -19.855 10.362 -7.737 1.00 0.00 H new ATOM 0 HA ALA B 53 -17.452 10.121 -9.124 1.00 0.00 H new ATOM 0 HB1 ALA B 53 -16.464 10.859 -6.974 1.00 0.00 H new ATOM 0 HB2 ALA B 53 -17.936 11.783 -7.358 1.00 0.00 H new ATOM 0 HB3 ALA B 53 -17.994 10.480 -6.146 1.00 0.00 H new ATOM 2264 N VAL B 54 -18.064 7.691 -6.986 1.00 0.00 N ATOM 2265 CA VAL B 54 -17.605 6.364 -6.611 1.00 0.00 C ATOM 2266 C VAL B 54 -17.462 5.500 -7.850 1.00 0.00 C ATOM 2267 O VAL B 54 -16.475 4.778 -8.012 1.00 0.00 O ATOM 2268 CB VAL B 54 -18.610 5.708 -5.667 1.00 0.00 C ATOM 2269 CG1 VAL B 54 -19.883 5.366 -6.452 1.00 0.00 C ATOM 2270 CG2 VAL B 54 -18.005 4.419 -5.099 1.00 0.00 C ATOM 0 H VAL B 54 -18.954 7.976 -6.577 1.00 0.00 H new ATOM 0 HA VAL B 54 -16.641 6.458 -6.111 1.00 0.00 H new ATOM 0 HB VAL B 54 -18.850 6.390 -4.851 1.00 0.00 H new ATOM 0 HG11 VAL B 54 -20.607 4.897 -5.785 1.00 0.00 H new ATOM 0 HG12 VAL B 54 -20.311 6.279 -6.867 1.00 0.00 H new ATOM 0 HG13 VAL B 54 -19.637 4.679 -7.262 1.00 0.00 H new ATOM 0 HG21 VAL B 54 -18.720 3.948 -4.424 1.00 0.00 H new ATOM 0 HG22 VAL B 54 -17.772 3.736 -5.916 1.00 0.00 H new ATOM 0 HG23 VAL B 54 -17.092 4.656 -4.552 1.00 0.00 H new ATOM 2280 N ASP B 55 -18.448 5.594 -8.739 1.00 0.00 N ATOM 2281 CA ASP B 55 -18.398 4.826 -9.964 1.00 0.00 C ATOM 2282 C ASP B 55 -17.181 5.242 -10.763 1.00 0.00 C ATOM 2283 O ASP B 55 -16.465 4.407 -11.306 1.00 0.00 O ATOM 2284 CB ASP B 55 -19.665 5.065 -10.789 1.00 0.00 C ATOM 2285 CG ASP B 55 -19.696 4.117 -11.983 1.00 0.00 C ATOM 2286 OD1 ASP B 55 -20.128 2.990 -11.807 1.00 0.00 O ATOM 2287 OD2 ASP B 55 -19.287 4.532 -13.055 1.00 0.00 O ATOM 0 H ASP B 55 -19.273 6.184 -8.631 1.00 0.00 H new ATOM 0 HA ASP B 55 -18.333 3.765 -9.721 1.00 0.00 H new ATOM 0 HB2 ASP B 55 -20.548 4.910 -10.168 1.00 0.00 H new ATOM 0 HB3 ASP B 55 -19.695 6.099 -11.134 1.00 0.00 H new ATOM 2292 N LYS B 56 -16.939 6.547 -10.810 1.00 0.00 N ATOM 2293 CA LYS B 56 -15.788 7.061 -11.531 1.00 0.00 C ATOM 2294 C LYS B 56 -14.491 6.532 -10.930 1.00 0.00 C ATOM 2295 O LYS B 56 -13.548 6.209 -11.650 1.00 0.00 O ATOM 2296 CB LYS B 56 -15.791 8.591 -11.489 1.00 0.00 C ATOM 2297 CG LYS B 56 -17.020 9.116 -12.234 1.00 0.00 C ATOM 2298 CD LYS B 56 -16.971 10.644 -12.293 1.00 0.00 C ATOM 2299 CE LYS B 56 -18.256 11.172 -12.935 1.00 0.00 C ATOM 2300 NZ LYS B 56 -18.357 12.641 -12.708 1.00 0.00 N ATOM 0 H LYS B 56 -17.518 7.258 -10.363 1.00 0.00 H new ATOM 0 HA LYS B 56 -15.852 6.724 -12.566 1.00 0.00 H new ATOM 0 HB2 LYS B 56 -15.803 8.938 -10.456 1.00 0.00 H new ATOM 0 HB3 LYS B 56 -14.881 8.980 -11.946 1.00 0.00 H new ATOM 0 HG2 LYS B 56 -17.050 8.704 -13.243 1.00 0.00 H new ATOM 0 HG3 LYS B 56 -17.930 8.791 -11.730 1.00 0.00 H new ATOM 0 HD2 LYS B 56 -16.859 11.054 -11.289 1.00 0.00 H new ATOM 0 HD3 LYS B 56 -16.104 10.969 -12.869 1.00 0.00 H new ATOM 0 HE2 LYS B 56 -18.256 10.957 -14.004 1.00 0.00 H new ATOM 0 HE3 LYS B 56 -19.123 10.667 -12.508 1.00 0.00 H new ATOM 0 HZ1 LYS B 56 -18.639 13.110 -13.592 1.00 0.00 H new ATOM 0 HZ2 LYS B 56 -19.069 12.831 -11.974 1.00 0.00 H new ATOM 0 HZ3 LYS B 56 -17.434 13.009 -12.399 1.00 0.00 H new ATOM 2314 N VAL B 57 -14.450 6.456 -9.600 1.00 0.00 N ATOM 2315 CA VAL B 57 -13.256 5.973 -8.914 1.00 0.00 C ATOM 2316 C VAL B 57 -12.976 4.501 -9.213 1.00 0.00 C ATOM 2317 O VAL B 57 -11.835 4.120 -9.457 1.00 0.00 O ATOM 2318 CB VAL B 57 -13.423 6.139 -7.397 1.00 0.00 C ATOM 2319 CG1 VAL B 57 -12.250 5.469 -6.681 1.00 0.00 C ATOM 2320 CG2 VAL B 57 -13.455 7.626 -7.025 1.00 0.00 C ATOM 0 H VAL B 57 -15.220 6.719 -8.985 1.00 0.00 H new ATOM 0 HA VAL B 57 -12.416 6.565 -9.278 1.00 0.00 H new ATOM 0 HB VAL B 57 -14.361 5.674 -7.093 1.00 0.00 H new ATOM 0 HG11 VAL B 57 -12.367 5.586 -5.604 1.00 0.00 H new ATOM 0 HG12 VAL B 57 -12.229 4.408 -6.931 1.00 0.00 H new ATOM 0 HG13 VAL B 57 -11.317 5.935 -6.997 1.00 0.00 H new ATOM 0 HG21 VAL B 57 -13.574 7.729 -5.946 1.00 0.00 H new ATOM 0 HG22 VAL B 57 -12.523 8.098 -7.334 1.00 0.00 H new ATOM 0 HG23 VAL B 57 -14.291 8.109 -7.530 1.00 0.00 H new ATOM 2330 N MET B 58 -14.021 3.677 -9.157 1.00 0.00 N ATOM 2331 CA MET B 58 -13.866 2.237 -9.382 1.00 0.00 C ATOM 2332 C MET B 58 -13.458 1.852 -10.812 1.00 0.00 C ATOM 2333 O MET B 58 -12.730 0.871 -10.994 1.00 0.00 O ATOM 2334 CB MET B 58 -15.127 1.481 -8.927 1.00 0.00 C ATOM 2335 CG MET B 58 -16.182 1.421 -10.032 1.00 0.00 C ATOM 2336 SD MET B 58 -16.028 -0.145 -10.926 1.00 0.00 S ATOM 2337 CE MET B 58 -17.152 -1.111 -9.890 1.00 0.00 C ATOM 0 H MET B 58 -14.976 3.976 -8.960 1.00 0.00 H new ATOM 0 HA MET B 58 -13.022 1.929 -8.765 1.00 0.00 H new ATOM 0 HB2 MET B 58 -14.856 0.469 -8.628 1.00 0.00 H new ATOM 0 HB3 MET B 58 -15.548 1.971 -8.049 1.00 0.00 H new ATOM 0 HG2 MET B 58 -17.180 1.511 -9.603 1.00 0.00 H new ATOM 0 HG3 MET B 58 -16.054 2.258 -10.718 1.00 0.00 H new ATOM 0 HE1 MET B 58 -16.769 -2.126 -9.786 1.00 0.00 H new ATOM 0 HE2 MET B 58 -17.227 -0.649 -8.906 1.00 0.00 H new ATOM 0 HE3 MET B 58 -18.138 -1.141 -10.353 1.00 0.00 H new ATOM 2347 N LYS B 59 -13.901 2.593 -11.829 1.00 0.00 N ATOM 2348 CA LYS B 59 -13.516 2.224 -13.192 1.00 0.00 C ATOM 2349 C LYS B 59 -12.003 2.244 -13.337 1.00 0.00 C ATOM 2350 O LYS B 59 -11.420 1.365 -13.974 1.00 0.00 O ATOM 2351 CB LYS B 59 -14.147 3.154 -14.237 1.00 0.00 C ATOM 2352 CG LYS B 59 -15.664 3.066 -14.187 1.00 0.00 C ATOM 2353 CD LYS B 59 -16.086 1.640 -14.563 1.00 0.00 C ATOM 2354 CE LYS B 59 -17.381 1.701 -15.352 1.00 0.00 C ATOM 2355 NZ LYS B 59 -18.461 2.284 -14.505 1.00 0.00 N ATOM 0 H LYS B 59 -14.499 3.415 -11.745 1.00 0.00 H new ATOM 0 HA LYS B 59 -13.888 1.215 -13.371 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -13.831 4.181 -14.055 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -13.794 2.883 -15.232 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -16.024 3.316 -13.189 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -16.107 3.785 -14.876 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -15.307 1.160 -15.155 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -16.220 1.038 -13.665 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -17.243 2.305 -16.249 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -17.664 0.701 -15.682 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -19.384 2.109 -14.951 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -18.442 1.841 -13.564 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -18.311 3.309 -14.408 1.00 0.00 H new ATOM 2369 N GLU B 60 -11.364 3.233 -12.726 1.00 0.00 N ATOM 2370 CA GLU B 60 -9.914 3.322 -12.783 1.00 0.00 C ATOM 2371 C GLU B 60 -9.279 2.129 -12.089 1.00 0.00 C ATOM 2372 O GLU B 60 -8.259 1.603 -12.534 1.00 0.00 O ATOM 2373 CB GLU B 60 -9.447 4.604 -12.093 1.00 0.00 C ATOM 2374 CG GLU B 60 -7.934 4.756 -12.258 1.00 0.00 C ATOM 2375 CD GLU B 60 -7.446 5.980 -11.493 1.00 0.00 C ATOM 2376 OE1 GLU B 60 -8.267 6.625 -10.862 1.00 0.00 O ATOM 2377 OE2 GLU B 60 -6.258 6.255 -11.549 1.00 0.00 O ATOM 0 H GLU B 60 -11.820 3.974 -12.193 1.00 0.00 H new ATOM 0 HA GLU B 60 -9.611 3.331 -13.830 1.00 0.00 H new ATOM 0 HB2 GLU B 60 -9.958 5.466 -12.522 1.00 0.00 H new ATOM 0 HB3 GLU B 60 -9.706 4.574 -11.035 1.00 0.00 H new ATOM 0 HG2 GLU B 60 -7.428 3.863 -11.891 1.00 0.00 H new ATOM 0 HG3 GLU B 60 -7.683 4.853 -13.314 1.00 0.00 H new ATOM 2384 N LEU B 61 -9.886 1.723 -10.980 1.00 0.00 N ATOM 2385 CA LEU B 61 -9.368 0.604 -10.206 1.00 0.00 C ATOM 2386 C LEU B 61 -9.496 -0.709 -10.942 1.00 0.00 C ATOM 2387 O LEU B 61 -8.639 -1.582 -10.803 1.00 0.00 O ATOM 2388 CB LEU B 61 -10.090 0.480 -8.859 1.00 0.00 C ATOM 2389 CG LEU B 61 -9.975 1.770 -8.033 1.00 0.00 C ATOM 2390 CD1 LEU B 61 -10.618 1.537 -6.661 1.00 0.00 C ATOM 2391 CD2 LEU B 61 -8.506 2.169 -7.839 1.00 0.00 C ATOM 0 H LEU B 61 -10.731 2.149 -10.600 1.00 0.00 H new ATOM 0 HA LEU B 61 -8.311 0.814 -10.043 1.00 0.00 H new ATOM 0 HB2 LEU B 61 -11.142 0.249 -9.029 1.00 0.00 H new ATOM 0 HB3 LEU B 61 -9.668 -0.352 -8.295 1.00 0.00 H new ATOM 0 HG LEU B 61 -10.484 2.574 -8.565 1.00 0.00 H new ATOM 0 HD11 LEU B 61 -10.543 2.446 -6.065 1.00 0.00 H new ATOM 0 HD12 LEU B 61 -11.668 1.274 -6.791 1.00 0.00 H new ATOM 0 HD13 LEU B 61 -10.101 0.724 -6.150 1.00 0.00 H new ATOM 0 HD21 LEU B 61 -8.452 3.085 -7.251 1.00 0.00 H new ATOM 0 HD22 LEU B 61 -7.978 1.371 -7.316 1.00 0.00 H new ATOM 0 HD23 LEU B 61 -8.042 2.334 -8.812 1.00 0.00 H new ATOM 2403 N ASP B 62 -10.568 -0.884 -11.697 1.00 0.00 N ATOM 2404 CA ASP B 62 -10.730 -2.149 -12.378 1.00 0.00 C ATOM 2405 C ASP B 62 -9.743 -2.269 -13.524 1.00 0.00 C ATOM 2406 O ASP B 62 -10.128 -2.236 -14.692 1.00 0.00 O ATOM 2407 CB ASP B 62 -12.154 -2.292 -12.911 1.00 0.00 C ATOM 2408 CG ASP B 62 -12.399 -3.738 -13.337 1.00 0.00 C ATOM 2409 OD1 ASP B 62 -11.650 -4.603 -12.901 1.00 0.00 O ATOM 2410 OD2 ASP B 62 -13.328 -3.960 -14.094 1.00 0.00 O ATOM 0 H ASP B 62 -11.307 -0.197 -11.848 1.00 0.00 H new ATOM 0 HA ASP B 62 -10.537 -2.946 -11.659 1.00 0.00 H new ATOM 0 HB2 ASP B 62 -12.871 -2.002 -12.143 1.00 0.00 H new ATOM 0 HB3 ASP B 62 -12.305 -1.622 -13.758 1.00 0.00 H new ATOM 2415 N GLU B 63 -8.474 -2.494 -13.185 1.00 0.00 N ATOM 2416 CA GLU B 63 -7.474 -2.713 -14.220 1.00 0.00 C ATOM 2417 C GLU B 63 -7.861 -3.965 -14.946 1.00 0.00 C ATOM 2418 O GLU B 63 -7.755 -4.096 -16.165 1.00 0.00 O ATOM 2419 CB GLU B 63 -6.089 -2.889 -13.598 1.00 0.00 C ATOM 2420 CG GLU B 63 -5.072 -3.127 -14.711 1.00 0.00 C ATOM 2421 CD GLU B 63 -3.687 -3.355 -14.117 1.00 0.00 C ATOM 2422 OE1 GLU B 63 -3.577 -3.357 -12.902 1.00 0.00 O ATOM 2423 OE2 GLU B 63 -2.754 -3.523 -14.886 1.00 0.00 O ATOM 0 H GLU B 63 -8.124 -2.528 -12.228 1.00 0.00 H new ATOM 0 HA GLU B 63 -7.432 -1.859 -14.896 1.00 0.00 H new ATOM 0 HB2 GLU B 63 -5.819 -2.003 -13.024 1.00 0.00 H new ATOM 0 HB3 GLU B 63 -6.092 -3.730 -12.904 1.00 0.00 H new ATOM 0 HG2 GLU B 63 -5.368 -3.991 -15.305 1.00 0.00 H new ATOM 0 HG3 GLU B 63 -5.051 -2.270 -15.384 1.00 0.00 H new ATOM 2430 N ASN B 64 -8.344 -4.863 -14.130 1.00 0.00 N ATOM 2431 CA ASN B 64 -8.822 -6.143 -14.552 1.00 0.00 C ATOM 2432 C ASN B 64 -9.951 -6.003 -15.578 1.00 0.00 C ATOM 2433 O ASN B 64 -10.000 -6.738 -16.564 1.00 0.00 O ATOM 2434 CB ASN B 64 -9.269 -6.830 -13.274 1.00 0.00 C ATOM 2435 CG ASN B 64 -9.825 -8.212 -13.511 1.00 0.00 C ATOM 2436 OD1 ASN B 64 -10.999 -8.431 -13.228 1.00 0.00 O ATOM 2437 ND2 ASN B 64 -9.066 -9.151 -14.008 1.00 0.00 N ATOM 0 H ASN B 64 -8.416 -4.715 -13.123 1.00 0.00 H new ATOM 0 HA ASN B 64 -8.058 -6.728 -15.064 1.00 0.00 H new ATOM 0 HB2 ASN B 64 -8.424 -6.897 -12.589 1.00 0.00 H new ATOM 0 HB3 ASN B 64 -10.027 -6.218 -12.785 1.00 0.00 H new ATOM 0 HD21 ASN B 64 -9.447 -10.084 -14.167 1.00 0.00 H new ATOM 0 HD22 ASN B 64 -8.092 -8.952 -14.238 1.00 0.00 H new ATOM 2444 N GLY B 65 -10.835 -5.028 -15.356 1.00 0.00 N ATOM 2445 CA GLY B 65 -11.934 -4.769 -16.287 1.00 0.00 C ATOM 2446 C GLY B 65 -13.106 -5.736 -16.108 1.00 0.00 C ATOM 2447 O GLY B 65 -13.928 -5.885 -17.011 1.00 0.00 O ATOM 0 H GLY B 65 -10.812 -4.409 -14.546 1.00 0.00 H new ATOM 0 HA2 GLY B 65 -12.288 -3.747 -16.148 1.00 0.00 H new ATOM 0 HA3 GLY B 65 -11.562 -4.842 -17.309 1.00 0.00 H new ATOM 2451 N ASP B 66 -13.185 -6.398 -14.959 1.00 0.00 N ATOM 2452 CA ASP B 66 -14.275 -7.347 -14.723 1.00 0.00 C ATOM 2453 C ASP B 66 -15.506 -6.689 -14.092 1.00 0.00 C ATOM 2454 O ASP B 66 -16.496 -7.362 -13.812 1.00 0.00 O ATOM 2455 CB ASP B 66 -13.774 -8.478 -13.819 1.00 0.00 C ATOM 2456 CG ASP B 66 -13.345 -7.917 -12.462 1.00 0.00 C ATOM 2457 OD1 ASP B 66 -13.629 -6.761 -12.199 1.00 0.00 O ATOM 2458 OD2 ASP B 66 -12.725 -8.649 -11.709 1.00 0.00 O ATOM 0 H ASP B 66 -12.524 -6.301 -14.188 1.00 0.00 H new ATOM 0 HA ASP B 66 -14.584 -7.738 -15.692 1.00 0.00 H new ATOM 0 HB2 ASP B 66 -14.561 -9.220 -13.682 1.00 0.00 H new ATOM 0 HB3 ASP B 66 -12.935 -8.987 -14.292 1.00 0.00 H new ATOM 2463 N GLY B 67 -15.454 -5.380 -13.891 1.00 0.00 N ATOM 2464 CA GLY B 67 -16.587 -4.658 -13.310 1.00 0.00 C ATOM 2465 C GLY B 67 -16.494 -4.672 -11.789 1.00 0.00 C ATOM 2466 O GLY B 67 -17.311 -4.075 -11.089 1.00 0.00 O ATOM 0 H GLY B 67 -14.649 -4.796 -14.118 1.00 0.00 H new ATOM 0 HA2 GLY B 67 -16.597 -3.630 -13.672 1.00 0.00 H new ATOM 0 HA3 GLY B 67 -17.523 -5.117 -13.629 1.00 0.00 H new ATOM 2470 N GLU B 68 -15.474 -5.362 -11.298 1.00 0.00 N ATOM 2471 CA GLU B 68 -15.217 -5.480 -9.867 1.00 0.00 C ATOM 2472 C GLU B 68 -13.849 -4.933 -9.507 1.00 0.00 C ATOM 2473 O GLU B 68 -12.940 -4.885 -10.339 1.00 0.00 O ATOM 2474 CB GLU B 68 -15.244 -6.942 -9.416 1.00 0.00 C ATOM 2475 CG GLU B 68 -16.640 -7.551 -9.503 1.00 0.00 C ATOM 2476 CD GLU B 68 -16.954 -7.969 -10.935 1.00 0.00 C ATOM 2477 OE1 GLU B 68 -16.023 -8.110 -11.710 1.00 0.00 O ATOM 2478 OE2 GLU B 68 -18.122 -8.154 -11.234 1.00 0.00 O ATOM 0 H GLU B 68 -14.799 -5.857 -11.881 1.00 0.00 H new ATOM 0 HA GLU B 68 -16.002 -4.910 -9.369 1.00 0.00 H new ATOM 0 HB2 GLU B 68 -14.558 -7.523 -10.033 1.00 0.00 H new ATOM 0 HB3 GLU B 68 -14.884 -7.010 -8.389 1.00 0.00 H new ATOM 0 HG2 GLU B 68 -16.707 -8.416 -8.843 1.00 0.00 H new ATOM 0 HG3 GLU B 68 -17.380 -6.829 -9.159 1.00 0.00 H new ATOM 2485 N VAL B 69 -13.696 -4.596 -8.235 1.00 0.00 N ATOM 2486 CA VAL B 69 -12.424 -4.134 -7.726 1.00 0.00 C ATOM 2487 C VAL B 69 -11.827 -5.283 -6.926 1.00 0.00 C ATOM 2488 O VAL B 69 -12.509 -5.887 -6.099 1.00 0.00 O ATOM 2489 CB VAL B 69 -12.627 -2.905 -6.831 1.00 0.00 C ATOM 2490 CG1 VAL B 69 -11.283 -2.367 -6.339 1.00 0.00 C ATOM 2491 CG2 VAL B 69 -13.350 -1.823 -7.614 1.00 0.00 C ATOM 0 H VAL B 69 -14.441 -4.636 -7.540 1.00 0.00 H new ATOM 0 HA VAL B 69 -11.759 -3.841 -8.538 1.00 0.00 H new ATOM 0 HB VAL B 69 -13.223 -3.198 -5.966 1.00 0.00 H new ATOM 0 HG11 VAL B 69 -11.450 -1.495 -5.706 1.00 0.00 H new ATOM 0 HG12 VAL B 69 -10.770 -3.139 -5.766 1.00 0.00 H new ATOM 0 HG13 VAL B 69 -10.670 -2.082 -7.194 1.00 0.00 H new ATOM 0 HG21 VAL B 69 -13.495 -0.949 -6.979 1.00 0.00 H new ATOM 0 HG22 VAL B 69 -12.755 -1.545 -8.484 1.00 0.00 H new ATOM 0 HG23 VAL B 69 -14.320 -2.198 -7.942 1.00 0.00 H new ATOM 2501 N ASP B 70 -10.571 -5.613 -7.198 1.00 0.00 N ATOM 2502 CA ASP B 70 -9.928 -6.734 -6.512 1.00 0.00 C ATOM 2503 C ASP B 70 -9.008 -6.256 -5.402 1.00 0.00 C ATOM 2504 O ASP B 70 -8.619 -5.092 -5.357 1.00 0.00 O ATOM 2505 CB ASP B 70 -9.159 -7.610 -7.503 1.00 0.00 C ATOM 2506 CG ASP B 70 -8.666 -8.872 -6.803 1.00 0.00 C ATOM 2507 OD1 ASP B 70 -9.440 -9.810 -6.700 1.00 0.00 O ATOM 2508 OD2 ASP B 70 -7.521 -8.884 -6.382 1.00 0.00 O ATOM 0 H ASP B 70 -9.982 -5.131 -7.877 1.00 0.00 H new ATOM 0 HA ASP B 70 -10.717 -7.333 -6.057 1.00 0.00 H new ATOM 0 HB2 ASP B 70 -9.802 -7.876 -8.342 1.00 0.00 H new ATOM 0 HB3 ASP B 70 -8.314 -7.056 -7.912 1.00 0.00 H new ATOM 2513 N PHE B 71 -8.685 -7.168 -4.497 1.00 0.00 N ATOM 2514 CA PHE B 71 -7.830 -6.849 -3.363 1.00 0.00 C ATOM 2515 C PHE B 71 -6.573 -6.148 -3.872 1.00 0.00 C ATOM 2516 O PHE B 71 -6.153 -5.144 -3.322 1.00 0.00 O ATOM 2517 CB PHE B 71 -7.451 -8.178 -2.690 1.00 0.00 C ATOM 2518 CG PHE B 71 -6.865 -8.016 -1.295 1.00 0.00 C ATOM 2519 CD1 PHE B 71 -6.445 -6.772 -0.787 1.00 0.00 C ATOM 2520 CD2 PHE B 71 -6.731 -9.161 -0.501 1.00 0.00 C ATOM 2521 CE1 PHE B 71 -5.902 -6.689 0.501 1.00 0.00 C ATOM 2522 CE2 PHE B 71 -6.190 -9.069 0.781 1.00 0.00 C ATOM 2523 CZ PHE B 71 -5.777 -7.836 1.279 1.00 0.00 C ATOM 0 H PHE B 71 -9.003 -8.137 -4.526 1.00 0.00 H new ATOM 0 HA PHE B 71 -8.337 -6.193 -2.655 1.00 0.00 H new ATOM 0 HB2 PHE B 71 -8.337 -8.810 -2.630 1.00 0.00 H new ATOM 0 HB3 PHE B 71 -6.729 -8.700 -3.319 1.00 0.00 H new ATOM 0 HD1 PHE B 71 -6.542 -5.882 -1.391 1.00 0.00 H new ATOM 0 HD2 PHE B 71 -7.048 -10.120 -0.883 1.00 0.00 H new ATOM 0 HE1 PHE B 71 -5.580 -5.735 0.891 1.00 0.00 H new ATOM 0 HE2 PHE B 71 -6.091 -9.956 1.389 1.00 0.00 H new ATOM 0 HZ PHE B 71 -5.358 -7.770 2.272 1.00 0.00 H new ATOM 2533 N GLN B 72 -5.990 -6.650 -4.945 1.00 0.00 N ATOM 2534 CA GLN B 72 -4.800 -6.005 -5.490 1.00 0.00 C ATOM 2535 C GLN B 72 -5.118 -4.571 -5.940 1.00 0.00 C ATOM 2536 O GLN B 72 -4.323 -3.638 -5.725 1.00 0.00 O ATOM 2537 CB GLN B 72 -4.273 -6.821 -6.676 1.00 0.00 C ATOM 2538 CG GLN B 72 -3.809 -8.194 -6.178 1.00 0.00 C ATOM 2539 CD GLN B 72 -3.311 -9.050 -7.331 1.00 0.00 C ATOM 2540 OE1 GLN B 72 -3.571 -8.747 -8.496 1.00 0.00 O ATOM 2541 NE2 GLN B 72 -2.603 -10.113 -7.066 1.00 0.00 N ATOM 0 H GLN B 72 -6.306 -7.479 -5.448 1.00 0.00 H new ATOM 0 HA GLN B 72 -4.038 -5.959 -4.712 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -5.054 -6.938 -7.427 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -3.446 -6.296 -7.155 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -3.014 -8.069 -5.443 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -4.633 -8.700 -5.674 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -2.392 -10.357 -6.098 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -2.260 -10.700 -7.826 1.00 0.00 H new ATOM 2550 N GLU B 73 -6.296 -4.392 -6.553 1.00 0.00 N ATOM 2551 CA GLU B 73 -6.696 -3.068 -7.018 1.00 0.00 C ATOM 2552 C GLU B 73 -6.873 -2.122 -5.814 1.00 0.00 C ATOM 2553 O GLU B 73 -6.424 -0.964 -5.811 1.00 0.00 O ATOM 2554 CB GLU B 73 -8.033 -3.186 -7.765 1.00 0.00 C ATOM 2555 CG GLU B 73 -7.896 -4.084 -9.010 1.00 0.00 C ATOM 2556 CD GLU B 73 -9.225 -4.088 -9.777 1.00 0.00 C ATOM 2557 OE1 GLU B 73 -9.995 -3.177 -9.541 1.00 0.00 O ATOM 2558 OE2 GLU B 73 -9.478 -5.020 -10.550 1.00 0.00 O ATOM 0 H GLU B 73 -6.972 -5.134 -6.733 1.00 0.00 H new ATOM 0 HA GLU B 73 -5.928 -2.668 -7.680 1.00 0.00 H new ATOM 0 HB2 GLU B 73 -8.791 -3.597 -7.098 1.00 0.00 H new ATOM 0 HB3 GLU B 73 -8.375 -2.195 -8.063 1.00 0.00 H new ATOM 0 HG2 GLU B 73 -7.094 -3.718 -9.651 1.00 0.00 H new ATOM 0 HG3 GLU B 73 -7.630 -5.099 -8.714 1.00 0.00 H new ATOM 2565 N TYR B 74 -7.497 -2.661 -4.772 1.00 0.00 N ATOM 2566 CA TYR B 74 -7.721 -1.928 -3.531 1.00 0.00 C ATOM 2567 C TYR B 74 -6.390 -1.567 -2.883 1.00 0.00 C ATOM 2568 O TYR B 74 -6.189 -0.464 -2.351 1.00 0.00 O ATOM 2569 CB TYR B 74 -8.530 -2.814 -2.581 1.00 0.00 C ATOM 2570 CG TYR B 74 -8.827 -2.074 -1.303 1.00 0.00 C ATOM 2571 CD1 TYR B 74 -9.945 -1.238 -1.216 1.00 0.00 C ATOM 2572 CD2 TYR B 74 -7.983 -2.236 -0.200 1.00 0.00 C ATOM 2573 CE1 TYR B 74 -10.219 -0.564 -0.021 1.00 0.00 C ATOM 2574 CE2 TYR B 74 -8.255 -1.561 0.994 1.00 0.00 C ATOM 2575 CZ TYR B 74 -9.373 -0.726 1.083 1.00 0.00 C ATOM 2576 OH TYR B 74 -9.642 -0.065 2.260 1.00 0.00 O ATOM 0 H TYR B 74 -7.860 -3.614 -4.763 1.00 0.00 H new ATOM 0 HA TYR B 74 -8.264 -1.007 -3.744 1.00 0.00 H new ATOM 0 HB2 TYR B 74 -9.462 -3.116 -3.059 1.00 0.00 H new ATOM 0 HB3 TYR B 74 -7.974 -3.726 -2.361 1.00 0.00 H new ATOM 0 HD1 TYR B 74 -10.595 -1.113 -2.069 1.00 0.00 H new ATOM 0 HD2 TYR B 74 -7.121 -2.883 -0.270 1.00 0.00 H new ATOM 0 HE1 TYR B 74 -11.082 0.081 0.050 1.00 0.00 H new ATOM 0 HE2 TYR B 74 -7.603 -1.684 1.846 1.00 0.00 H new ATOM 0 HH TYR B 74 -8.851 -0.091 2.838 1.00 0.00 H new ATOM 2586 N VAL B 75 -5.494 -2.540 -2.933 1.00 0.00 N ATOM 2587 CA VAL B 75 -4.165 -2.397 -2.350 1.00 0.00 C ATOM 2588 C VAL B 75 -3.433 -1.235 -3.008 1.00 0.00 C ATOM 2589 O VAL B 75 -2.885 -0.354 -2.314 1.00 0.00 O ATOM 2590 CB VAL B 75 -3.371 -3.756 -2.467 1.00 0.00 C ATOM 2591 CG1 VAL B 75 -2.128 -3.633 -3.355 1.00 0.00 C ATOM 2592 CG2 VAL B 75 -2.917 -4.232 -1.078 1.00 0.00 C ATOM 0 H VAL B 75 -5.663 -3.444 -3.374 1.00 0.00 H new ATOM 0 HA VAL B 75 -4.250 -2.167 -1.288 1.00 0.00 H new ATOM 0 HB VAL B 75 -4.056 -4.473 -2.919 1.00 0.00 H new ATOM 0 HG11 VAL B 75 -1.618 -4.595 -3.402 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -2.426 -3.331 -4.359 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -1.454 -2.885 -2.936 1.00 0.00 H new ATOM 0 HG21 VAL B 75 -2.371 -5.170 -1.175 1.00 0.00 H new ATOM 0 HG22 VAL B 75 -2.268 -3.479 -0.630 1.00 0.00 H new ATOM 0 HG23 VAL B 75 -3.789 -4.384 -0.442 1.00 0.00 H new ATOM 2602 N VAL B 76 -3.447 -1.183 -4.336 1.00 0.00 N ATOM 2603 CA VAL B 76 -2.781 -0.068 -4.976 1.00 0.00 C ATOM 2604 C VAL B 76 -3.537 1.220 -4.663 1.00 0.00 C ATOM 2605 O VAL B 76 -2.920 2.260 -4.491 1.00 0.00 O ATOM 2606 CB VAL B 76 -2.614 -0.273 -6.487 1.00 0.00 C ATOM 2607 CG1 VAL B 76 -1.900 -1.607 -6.741 1.00 0.00 C ATOM 2608 CG2 VAL B 76 -3.972 -0.283 -7.181 1.00 0.00 C ATOM 0 H VAL B 76 -3.888 -1.862 -4.957 1.00 0.00 H new ATOM 0 HA VAL B 76 -1.771 0.003 -4.573 1.00 0.00 H new ATOM 0 HB VAL B 76 -2.023 0.549 -6.891 1.00 0.00 H new ATOM 0 HG11 VAL B 76 -1.779 -1.757 -7.814 1.00 0.00 H new ATOM 0 HG12 VAL B 76 -0.920 -1.592 -6.264 1.00 0.00 H new ATOM 0 HG13 VAL B 76 -2.493 -2.422 -6.326 1.00 0.00 H new ATOM 0 HG21 VAL B 76 -3.832 -0.430 -8.252 1.00 0.00 H new ATOM 0 HG22 VAL B 76 -4.580 -1.094 -6.780 1.00 0.00 H new ATOM 0 HG23 VAL B 76 -4.476 0.668 -7.008 1.00 0.00 H new ATOM 2618 N LEU B 77 -4.873 1.164 -4.558 1.00 0.00 N ATOM 2619 CA LEU B 77 -5.607 2.391 -4.218 1.00 0.00 C ATOM 2620 C LEU B 77 -5.119 3.004 -2.907 1.00 0.00 C ATOM 2621 O LEU B 77 -4.792 4.194 -2.853 1.00 0.00 O ATOM 2622 CB LEU B 77 -7.118 2.091 -4.099 1.00 0.00 C ATOM 2623 CG LEU B 77 -7.924 3.312 -3.562 1.00 0.00 C ATOM 2624 CD1 LEU B 77 -8.026 4.469 -4.577 1.00 0.00 C ATOM 2625 CD2 LEU B 77 -9.338 2.838 -3.210 1.00 0.00 C ATOM 0 H LEU B 77 -5.443 0.329 -4.695 1.00 0.00 H new ATOM 0 HA LEU B 77 -5.426 3.106 -5.020 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -7.507 1.803 -5.076 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -7.266 1.240 -3.434 1.00 0.00 H new ATOM 0 HG LEU B 77 -7.393 3.698 -2.692 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -8.599 5.287 -4.140 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -7.026 4.821 -4.829 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -8.525 4.118 -5.480 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -9.920 3.678 -2.832 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -9.819 2.436 -4.101 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -9.282 2.062 -2.446 1.00 0.00 H new ATOM 2637 N VAL B 78 -5.060 2.214 -1.841 1.00 0.00 N ATOM 2638 CA VAL B 78 -4.616 2.792 -0.572 1.00 0.00 C ATOM 2639 C VAL B 78 -3.141 3.165 -0.607 1.00 0.00 C ATOM 2640 O VAL B 78 -2.738 4.171 -0.018 1.00 0.00 O ATOM 2641 CB VAL B 78 -4.884 1.879 0.643 1.00 0.00 C ATOM 2642 CG1 VAL B 78 -6.382 1.652 0.795 1.00 0.00 C ATOM 2643 CG2 VAL B 78 -4.171 0.524 0.508 1.00 0.00 C ATOM 0 H VAL B 78 -5.299 1.223 -1.821 1.00 0.00 H new ATOM 0 HA VAL B 78 -5.215 3.694 -0.447 1.00 0.00 H new ATOM 0 HB VAL B 78 -4.489 2.380 1.527 1.00 0.00 H new ATOM 0 HG11 VAL B 78 -6.567 1.007 1.654 1.00 0.00 H new ATOM 0 HG12 VAL B 78 -6.882 2.609 0.946 1.00 0.00 H new ATOM 0 HG13 VAL B 78 -6.771 1.177 -0.106 1.00 0.00 H new ATOM 0 HG21 VAL B 78 -4.385 -0.089 1.384 1.00 0.00 H new ATOM 0 HG22 VAL B 78 -4.526 0.014 -0.388 1.00 0.00 H new ATOM 0 HG23 VAL B 78 -3.096 0.685 0.432 1.00 0.00 H new ATOM 2653 N ALA B 79 -2.326 2.364 -1.285 1.00 0.00 N ATOM 2654 CA ALA B 79 -0.896 2.676 -1.332 1.00 0.00 C ATOM 2655 C ALA B 79 -0.613 3.949 -2.143 1.00 0.00 C ATOM 2656 O ALA B 79 0.119 4.856 -1.695 1.00 0.00 O ATOM 2657 CB ALA B 79 -0.128 1.495 -1.920 1.00 0.00 C ATOM 0 H ALA B 79 -2.611 1.526 -1.792 1.00 0.00 H new ATOM 0 HA ALA B 79 -0.561 2.859 -0.311 1.00 0.00 H new ATOM 0 HB1 ALA B 79 0.935 1.732 -1.953 1.00 0.00 H new ATOM 0 HB2 ALA B 79 -0.284 0.614 -1.298 1.00 0.00 H new ATOM 0 HB3 ALA B 79 -0.486 1.295 -2.930 1.00 0.00 H new ATOM 2663 N ALA B 80 -1.210 4.022 -3.329 1.00 0.00 N ATOM 2664 CA ALA B 80 -1.029 5.181 -4.182 1.00 0.00 C ATOM 2665 C ALA B 80 -1.596 6.405 -3.479 1.00 0.00 C ATOM 2666 O ALA B 80 -0.995 7.483 -3.478 1.00 0.00 O ATOM 2667 CB ALA B 80 -1.724 4.956 -5.525 1.00 0.00 C ATOM 0 H ALA B 80 -1.816 3.298 -3.714 1.00 0.00 H new ATOM 0 HA ALA B 80 0.032 5.339 -4.374 1.00 0.00 H new ATOM 0 HB1 ALA B 80 -1.583 5.831 -6.159 1.00 0.00 H new ATOM 0 HB2 ALA B 80 -1.296 4.081 -6.014 1.00 0.00 H new ATOM 0 HB3 ALA B 80 -2.789 4.795 -5.361 1.00 0.00 H new ATOM 2673 N LEU B 81 -2.735 6.228 -2.820 1.00 0.00 N ATOM 2674 CA LEU B 81 -3.291 7.330 -2.069 1.00 0.00 C ATOM 2675 C LEU B 81 -2.350 7.703 -0.932 1.00 0.00 C ATOM 2676 O LEU B 81 -2.240 8.869 -0.595 1.00 0.00 O ATOM 2677 CB LEU B 81 -4.698 7.008 -1.548 1.00 0.00 C ATOM 2678 CG LEU B 81 -5.769 7.436 -2.587 1.00 0.00 C ATOM 2679 CD1 LEU B 81 -5.520 6.801 -3.962 1.00 0.00 C ATOM 2680 CD2 LEU B 81 -7.170 7.028 -2.102 1.00 0.00 C ATOM 0 H LEU B 81 -3.271 5.361 -2.793 1.00 0.00 H new ATOM 0 HA LEU B 81 -3.392 8.186 -2.736 1.00 0.00 H new ATOM 0 HB2 LEU B 81 -4.783 5.940 -1.347 1.00 0.00 H new ATOM 0 HB3 LEU B 81 -4.871 7.525 -0.604 1.00 0.00 H new ATOM 0 HG LEU B 81 -5.702 8.519 -2.688 1.00 0.00 H new ATOM 0 HD11 LEU B 81 -6.292 7.127 -4.659 1.00 0.00 H new ATOM 0 HD12 LEU B 81 -4.543 7.109 -4.333 1.00 0.00 H new ATOM 0 HD13 LEU B 81 -5.548 5.715 -3.872 1.00 0.00 H new ATOM 0 HD21 LEU B 81 -7.913 7.333 -2.839 1.00 0.00 H new ATOM 0 HD22 LEU B 81 -7.210 5.946 -1.973 1.00 0.00 H new ATOM 0 HD23 LEU B 81 -7.382 7.515 -1.150 1.00 0.00 H new ATOM 2692 N THR B 82 -1.674 6.716 -0.334 1.00 0.00 N ATOM 2693 CA THR B 82 -0.750 7.024 0.762 1.00 0.00 C ATOM 2694 C THR B 82 0.406 7.912 0.295 1.00 0.00 C ATOM 2695 O THR B 82 0.688 8.962 0.903 1.00 0.00 O ATOM 2696 CB THR B 82 -0.184 5.719 1.332 1.00 0.00 C ATOM 2697 OG1 THR B 82 -1.253 4.855 1.689 1.00 0.00 O ATOM 2698 CG2 THR B 82 0.663 6.012 2.574 1.00 0.00 C ATOM 0 H THR B 82 -1.744 5.729 -0.580 1.00 0.00 H new ATOM 0 HA THR B 82 -1.306 7.565 1.527 1.00 0.00 H new ATOM 0 HB THR B 82 0.440 5.243 0.575 1.00 0.00 H new ATOM 0 HG1 THR B 82 -1.589 4.402 0.888 1.00 0.00 H new ATOM 0 HG21 THR B 82 1.061 5.078 2.972 1.00 0.00 H new ATOM 0 HG22 THR B 82 1.487 6.672 2.305 1.00 0.00 H new ATOM 0 HG23 THR B 82 0.044 6.494 3.331 1.00 0.00 H new ATOM 2706 N VAL B 83 1.061 7.523 -0.805 1.00 0.00 N ATOM 2707 CA VAL B 83 2.162 8.357 -1.313 1.00 0.00 C ATOM 2708 C VAL B 83 1.638 9.729 -1.733 1.00 0.00 C ATOM 2709 O VAL B 83 2.274 10.760 -1.476 1.00 0.00 O ATOM 2710 CB VAL B 83 2.938 7.685 -2.470 1.00 0.00 C ATOM 2711 CG1 VAL B 83 2.053 7.486 -3.700 1.00 0.00 C ATOM 2712 CG2 VAL B 83 4.115 8.582 -2.868 1.00 0.00 C ATOM 0 H VAL B 83 0.864 6.678 -1.341 1.00 0.00 H new ATOM 0 HA VAL B 83 2.873 8.481 -0.496 1.00 0.00 H new ATOM 0 HB VAL B 83 3.281 6.710 -2.123 1.00 0.00 H new ATOM 0 HG11 VAL B 83 2.632 7.012 -4.492 1.00 0.00 H new ATOM 0 HG12 VAL B 83 1.206 6.851 -3.440 1.00 0.00 H new ATOM 0 HG13 VAL B 83 1.689 8.453 -4.046 1.00 0.00 H new ATOM 0 HG21 VAL B 83 4.668 8.116 -3.683 1.00 0.00 H new ATOM 0 HG22 VAL B 83 3.739 9.552 -3.192 1.00 0.00 H new ATOM 0 HG23 VAL B 83 4.776 8.716 -2.012 1.00 0.00 H new ATOM 2722 N ALA B 84 0.455 9.746 -2.348 1.00 0.00 N ATOM 2723 CA ALA B 84 -0.147 11.003 -2.761 1.00 0.00 C ATOM 2724 C ALA B 84 -0.494 11.841 -1.540 1.00 0.00 C ATOM 2725 O ALA B 84 -0.481 13.070 -1.590 1.00 0.00 O ATOM 2726 CB ALA B 84 -1.400 10.739 -3.590 1.00 0.00 C ATOM 0 H ALA B 84 -0.094 8.915 -2.566 1.00 0.00 H new ATOM 0 HA ALA B 84 0.569 11.551 -3.373 1.00 0.00 H new ATOM 0 HB1 ALA B 84 -1.842 11.688 -3.894 1.00 0.00 H new ATOM 0 HB2 ALA B 84 -1.135 10.162 -4.476 1.00 0.00 H new ATOM 0 HB3 ALA B 84 -2.119 10.178 -2.994 1.00 0.00 H new ATOM 2732 N CYS B 85 -0.809 11.159 -0.442 1.00 0.00 N ATOM 2733 CA CYS B 85 -1.162 11.834 0.790 1.00 0.00 C ATOM 2734 C CYS B 85 0.049 12.554 1.330 1.00 0.00 C ATOM 2735 O CYS B 85 0.005 13.761 1.573 1.00 0.00 O ATOM 2736 CB CYS B 85 -1.668 10.828 1.826 1.00 0.00 C ATOM 2737 SG CYS B 85 -2.663 11.690 3.067 1.00 0.00 S ATOM 0 H CYS B 85 -0.825 10.141 -0.387 1.00 0.00 H new ATOM 0 HA CYS B 85 -1.957 12.552 0.585 1.00 0.00 H new ATOM 0 HB2 CYS B 85 -2.264 10.056 1.339 1.00 0.00 H new ATOM 0 HB3 CYS B 85 -0.826 10.327 2.303 1.00 0.00 H new ATOM 2742 N ASN B 86 1.148 11.824 1.505 1.00 0.00 N ATOM 2743 CA ASN B 86 2.347 12.475 2.002 1.00 0.00 C ATOM 2744 C ASN B 86 2.696 13.633 1.078 1.00 0.00 C ATOM 2745 O ASN B 86 3.049 14.728 1.534 1.00 0.00 O ATOM 2746 CB ASN B 86 3.515 11.494 2.048 1.00 0.00 C ATOM 2747 CG ASN B 86 4.664 12.102 2.847 1.00 0.00 C ATOM 2748 OD1 ASN B 86 4.533 12.330 4.050 1.00 0.00 O ATOM 2749 ND2 ASN B 86 5.786 12.390 2.245 1.00 0.00 N ATOM 0 H ASN B 86 1.230 10.825 1.318 1.00 0.00 H new ATOM 0 HA ASN B 86 2.161 12.838 3.013 1.00 0.00 H new ATOM 0 HB2 ASN B 86 3.198 10.556 2.504 1.00 0.00 H new ATOM 0 HB3 ASN B 86 3.846 11.260 1.036 1.00 0.00 H new ATOM 0 HD21 ASN B 86 6.555 12.804 2.771 1.00 0.00 H new ATOM 0 HD22 ASN B 86 5.893 12.201 1.248 1.00 0.00 H new ATOM 2756 N ASN B 87 2.558 13.395 -0.231 1.00 0.00 N ATOM 2757 CA ASN B 87 2.829 14.442 -1.205 1.00 0.00 C ATOM 2758 C ASN B 87 1.915 15.627 -0.967 1.00 0.00 C ATOM 2759 O ASN B 87 2.332 16.753 -1.012 1.00 0.00 O ATOM 2760 CB ASN B 87 2.600 13.897 -2.617 1.00 0.00 C ATOM 2761 CG ASN B 87 3.568 12.752 -2.896 1.00 0.00 C ATOM 2762 OD1 ASN B 87 3.169 11.718 -3.433 1.00 0.00 O ATOM 2763 ND2 ASN B 87 4.823 12.875 -2.563 1.00 0.00 N ATOM 0 H ASN B 87 2.266 12.502 -0.629 1.00 0.00 H new ATOM 0 HA ASN B 87 3.864 14.766 -1.099 1.00 0.00 H new ATOM 0 HB2 ASN B 87 1.572 13.549 -2.719 1.00 0.00 H new ATOM 0 HB3 ASN B 87 2.742 14.691 -3.350 1.00 0.00 H new ATOM 0 HD21 ASN B 87 5.476 12.114 -2.747 1.00 0.00 H new ATOM 0 HD22 ASN B 87 5.151 13.732 -2.118 1.00 0.00 H new ATOM 2770 N PHE B 88 0.666 15.394 -0.683 1.00 0.00 N ATOM 2771 CA PHE B 88 -0.202 16.525 -0.442 1.00 0.00 C ATOM 2772 C PHE B 88 0.234 17.299 0.801 1.00 0.00 C ATOM 2773 O PHE B 88 0.195 18.528 0.818 1.00 0.00 O ATOM 2774 CB PHE B 88 -1.658 16.077 -0.310 1.00 0.00 C ATOM 2775 CG PHE B 88 -2.549 17.289 -0.186 1.00 0.00 C ATOM 2776 CD1 PHE B 88 -3.000 17.948 -1.336 1.00 0.00 C ATOM 2777 CD2 PHE B 88 -2.925 17.756 1.079 1.00 0.00 C ATOM 2778 CE1 PHE B 88 -3.826 19.073 -1.221 1.00 0.00 C ATOM 2779 CE2 PHE B 88 -3.751 18.880 1.195 1.00 0.00 C ATOM 2780 CZ PHE B 88 -4.202 19.538 0.045 1.00 0.00 C ATOM 0 H PHE B 88 0.233 14.473 -0.613 1.00 0.00 H new ATOM 0 HA PHE B 88 -0.124 17.191 -1.301 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -1.948 15.487 -1.179 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -1.774 15.436 0.564 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -2.711 17.588 -2.312 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -2.577 17.248 1.967 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -4.173 19.582 -2.108 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -4.040 19.239 2.172 1.00 0.00 H new ATOM 0 HZ PHE B 88 -4.840 20.405 0.134 1.00 0.00 H new ATOM 2790 N PHE B 89 0.609 16.584 1.860 1.00 0.00 N ATOM 2791 CA PHE B 89 1.002 17.260 3.093 1.00 0.00 C ATOM 2792 C PHE B 89 2.275 18.096 2.915 1.00 0.00 C ATOM 2793 O PHE B 89 2.246 19.312 3.108 1.00 0.00 O ATOM 2794 CB PHE B 89 1.226 16.228 4.199 1.00 0.00 C ATOM 2795 CG PHE B 89 1.498 16.936 5.503 1.00 0.00 C ATOM 2796 CD1 PHE B 89 0.431 17.366 6.301 1.00 0.00 C ATOM 2797 CD2 PHE B 89 2.816 17.163 5.917 1.00 0.00 C ATOM 2798 CE1 PHE B 89 0.682 18.023 7.512 1.00 0.00 C ATOM 2799 CE2 PHE B 89 3.067 17.820 7.128 1.00 0.00 C ATOM 2800 CZ PHE B 89 2.000 18.250 7.925 1.00 0.00 C ATOM 0 H PHE B 89 0.649 15.565 1.891 1.00 0.00 H new ATOM 0 HA PHE B 89 0.193 17.938 3.364 1.00 0.00 H new ATOM 0 HB2 PHE B 89 0.349 15.588 4.297 1.00 0.00 H new ATOM 0 HB3 PHE B 89 2.065 15.581 3.943 1.00 0.00 H new ATOM 0 HD1 PHE B 89 -0.586 17.191 5.983 1.00 0.00 H new ATOM 0 HD2 PHE B 89 3.640 16.831 5.302 1.00 0.00 H new ATOM 0 HE1 PHE B 89 -0.141 18.355 8.127 1.00 0.00 H new ATOM 0 HE2 PHE B 89 4.084 17.995 7.447 1.00 0.00 H new ATOM 0 HZ PHE B 89 2.194 18.757 8.859 1.00 0.00 H new ATOM 2810 N TRP B 90 3.388 17.459 2.535 1.00 0.00 N ATOM 2811 CA TRP B 90 4.630 18.213 2.332 1.00 0.00 C ATOM 2812 C TRP B 90 4.539 19.139 1.128 1.00 0.00 C ATOM 2813 O TRP B 90 4.990 20.283 1.162 1.00 0.00 O ATOM 2814 CB TRP B 90 5.829 17.296 2.143 1.00 0.00 C ATOM 2815 CG TRP B 90 7.026 18.177 2.043 1.00 0.00 C ATOM 2816 CD1 TRP B 90 7.358 18.875 0.942 1.00 0.00 C ATOM 2817 CD2 TRP B 90 8.041 18.479 3.042 1.00 0.00 C ATOM 2818 NE1 TRP B 90 8.502 19.598 1.192 1.00 0.00 N ATOM 2819 CE2 TRP B 90 8.972 19.382 2.474 1.00 0.00 C ATOM 2820 CE3 TRP B 90 8.246 18.063 4.371 1.00 0.00 C ATOM 2821 CZ2 TRP B 90 10.066 19.857 3.198 1.00 0.00 C ATOM 2822 CZ3 TRP B 90 9.347 18.538 5.102 1.00 0.00 C ATOM 2823 CH2 TRP B 90 10.254 19.433 4.517 1.00 0.00 C ATOM 0 H TRP B 90 3.456 16.455 2.366 1.00 0.00 H new ATOM 0 HA TRP B 90 4.768 18.805 3.237 1.00 0.00 H new ATOM 0 HB2 TRP B 90 5.925 16.606 2.981 1.00 0.00 H new ATOM 0 HB3 TRP B 90 5.716 16.691 1.243 1.00 0.00 H new ATOM 0 HD1 TRP B 90 6.813 18.869 0.010 1.00 0.00 H new ATOM 0 HE1 TRP B 90 8.948 20.217 0.515 1.00 0.00 H new ATOM 0 HE3 TRP B 90 7.553 17.375 4.831 1.00 0.00 H new ATOM 0 HZ2 TRP B 90 10.762 20.547 2.743 1.00 0.00 H new ATOM 0 HZ3 TRP B 90 9.496 18.212 6.121 1.00 0.00 H new ATOM 0 HH2 TRP B 90 11.098 19.795 5.085 1.00 0.00 H new ATOM 2834 N GLU B 91 3.961 18.608 0.066 1.00 0.00 N ATOM 2835 CA GLU B 91 3.799 19.332 -1.186 1.00 0.00 C ATOM 2836 C GLU B 91 2.401 19.922 -1.322 1.00 0.00 C ATOM 2837 O GLU B 91 1.424 19.339 -0.866 1.00 0.00 O ATOM 2838 CB GLU B 91 4.070 18.382 -2.372 1.00 0.00 C ATOM 2839 CG GLU B 91 5.568 18.132 -2.561 1.00 0.00 C ATOM 2840 CD GLU B 91 6.299 19.442 -2.845 1.00 0.00 C ATOM 2841 OE1 GLU B 91 5.636 20.401 -3.206 1.00 0.00 O ATOM 2842 OE2 GLU B 91 7.509 19.467 -2.698 1.00 0.00 O ATOM 0 H GLU B 91 3.589 17.659 0.045 1.00 0.00 H new ATOM 0 HA GLU B 91 4.514 20.155 -1.189 1.00 0.00 H new ATOM 0 HB2 GLU B 91 3.560 17.433 -2.203 1.00 0.00 H new ATOM 0 HB3 GLU B 91 3.654 18.809 -3.284 1.00 0.00 H new ATOM 0 HG2 GLU B 91 5.980 17.666 -1.666 1.00 0.00 H new ATOM 0 HG3 GLU B 91 5.725 17.436 -3.385 1.00 0.00 H new ATOM 2849 N ASN B 92 2.318 21.083 -1.964 1.00 0.00 N ATOM 2850 CA ASN B 92 1.035 21.750 -2.167 1.00 0.00 C ATOM 2851 C ASN B 92 0.954 22.336 -3.572 1.00 0.00 C ATOM 2852 O ASN B 92 1.879 22.186 -4.371 1.00 0.00 O ATOM 2853 CB ASN B 92 0.859 22.866 -1.135 1.00 0.00 C ATOM 2854 CG ASN B 92 1.782 24.034 -1.468 1.00 0.00 C ATOM 2855 OD1 ASN B 92 2.701 23.890 -2.273 1.00 0.00 O ATOM 2856 ND2 ASN B 92 1.591 25.190 -0.891 1.00 0.00 N ATOM 0 H ASN B 92 3.120 21.580 -2.351 1.00 0.00 H new ATOM 0 HA ASN B 92 0.240 21.015 -2.046 1.00 0.00 H new ATOM 0 HB2 ASN B 92 -0.178 23.203 -1.124 1.00 0.00 H new ATOM 0 HB3 ASN B 92 1.082 22.488 -0.137 1.00 0.00 H new ATOM 0 HD21 ASN B 92 2.204 25.976 -1.108 1.00 0.00 H new ATOM 0 HD22 ASN B 92 0.828 25.307 -0.224 1.00 0.00 H new ATOM 2863 N SER B 93 -0.155 23.006 -3.868 1.00 0.00 N ATOM 2864 CA SER B 93 -0.342 23.612 -5.181 1.00 0.00 C ATOM 2865 C SER B 93 0.632 24.768 -5.382 1.00 0.00 C ATOM 2866 O SER B 93 1.019 25.001 -6.515 1.00 0.00 O ATOM 2867 CB SER B 93 -1.776 24.122 -5.321 1.00 0.00 C ATOM 2868 OG SER B 93 -2.655 23.016 -5.474 1.00 0.00 O ATOM 0 H SER B 93 -0.932 23.142 -3.222 1.00 0.00 H new ATOM 0 HA SER B 93 -0.150 22.854 -5.940 1.00 0.00 H new ATOM 0 HB2 SER B 93 -2.055 24.704 -4.442 1.00 0.00 H new ATOM 0 HB3 SER B 93 -1.856 24.786 -6.182 1.00 0.00 H new ATOM 0 HG SER B 93 -3.576 23.340 -5.562 1.00 0.00 H new TER 2874 SER B 93 HETATM 2875 N HCS A 201 3.482 -12.985 7.878 1.00 0.00 N HETATM 2876 CA HCS A 201 2.503 -11.924 8.250 1.00 0.00 C HETATM 2877 CB HCS A 201 1.107 -12.540 8.365 1.00 0.00 C HETATM 2878 CG HCS A 201 0.738 -13.226 7.048 1.00 0.00 C HETATM 2879 SD HCS A 201 0.045 -12.006 5.905 1.00 0.00 S HETATM 2880 C HCS A 201 2.910 -11.307 9.583 1.00 0.00 C HETATM 2881 OXT HCS A 201 2.156 -10.493 10.092 1.00 0.00 O HETATM 2882 O HCS A 201 3.970 -11.656 10.077 1.00 0.00 O HETATM 0 HG3 HCS A 201 1.620 -13.692 6.609 1.00 0.00 H new HETATM 0 HG2 HCS A 201 0.015 -14.021 7.230 1.00 0.00 H new HETATM 0 HCA HCS A 201 2.491 -11.148 7.484 1.00 0.00 H new HETATM 0 HB3 HCS A 201 1.083 -13.262 9.182 1.00 0.00 H new HETATM 0 HB2 HCS A 201 0.376 -11.767 8.601 1.00 0.00 H new HETATM 0 H2 HCS A 201 4.467 -12.750 7.758 1.00 0.00 H new HETATM 0 H HCS A 201 3.166 -13.946 7.744 1.00 0.00 H new HETATM 2891 CA CA A 202 16.818 8.613 1.976 1.00 0.00 CA HETATM 2892 CA CA A 203 13.885 5.077 -9.079 1.00 0.00 CA HETATM 2893 N HCS B 201 -5.104 13.779 5.178 1.00 0.00 N HETATM 2894 CA HCS B 201 -4.261 12.786 5.902 1.00 0.00 C HETATM 2895 CB HCS B 201 -2.926 13.432 6.280 1.00 0.00 C HETATM 2896 CG HCS B 201 -2.236 13.960 5.020 1.00 0.00 C HETATM 2897 SD HCS B 201 -1.303 12.622 4.235 1.00 0.00 S HETATM 2898 C HCS B 201 -4.991 12.325 7.159 1.00 0.00 C HETATM 2899 OXT HCS B 201 -4.396 11.590 7.930 1.00 0.00 O HETATM 2900 O HCS B 201 -6.133 12.716 7.333 1.00 0.00 O HETATM 0 HG3 HCS B 201 -2.977 14.356 4.326 1.00 0.00 H new HETATM 0 HG2 HCS B 201 -1.567 14.782 5.276 1.00 0.00 H new HETATM 0 HCA HCS B 201 -4.072 11.925 5.261 1.00 0.00 H new HETATM 0 HB3 HCS B 201 -3.091 14.247 6.985 1.00 0.00 H new HETATM 0 HB2 HCS B 201 -2.287 12.704 6.779 1.00 0.00 H new HETATM 0 H2 HCS B 201 -6.033 13.516 4.850 1.00 0.00 H new HETATM 0 H HCS B 201 -4.752 14.721 5.010 1.00 0.00 H new HETATM 2909 CA CA B 202 -16.921 -8.563 -1.171 1.00 0.00 CA HETATM 2910 CA CA B 203 -11.326 -6.331 -11.518 1.00 0.00 CA