USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 972 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 74 TYR OH : rot 171:sc= 0.297 USER MOD Set 1.2: A 101 GLN : amide:sc= 0.24 K(o=0.54,f=-0.79) USER MOD Set 2.1: A 12 SER OG : rot 31:sc= 1.83 USER MOD Set 2.2: A 17 THR OG1 : rot -89:sc= 0.771 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl -167:sc= -0.0141 (180deg=-0.242) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ -177:sc= 1.26 (180deg=1.23) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 81:sc= 0.129 USER MOD Single : A 18 LYS NZ :NH3+ -162:sc= -0.0796 (180deg=-0.448) USER MOD Single : A 19 LYS NZ :NH3+ 160:sc= 0.658 (180deg=0.265) USER MOD Single : A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 142:sc= 0.0473 (180deg=0) USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ -161:sc= -0.059 (180deg=-0.35) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 162:sc= 1.26 (180deg=1.19) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 140:sc= 0 USER MOD Single : A 47 MET CE :methyl -175:sc= 0 (180deg=-0.0241) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot -87:sc= 0.386 USER MOD Single : A 57 GLN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 ASN : amide:sc= 0.794 K(o=0.79,f=-2.2!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0.774 K(o=0.77,f=-0.0047) USER MOD Single : A 71 ASN :FLIP amide:sc= -0.0502 F(o=-1.5,f=-0.05) USER MOD Single : A 75 ASN : amide:sc= 0.00268! X(o=0.0027!,f=0) USER MOD Single : A 76 ASN : amide:sc= -0.239 K(o=-0.24,f=-1.5) USER MOD Single : A 77 TYR OH : rot 8:sc= 0.494 USER MOD Single : A 84 SER OG : rot 180:sc= -0.158 USER MOD Single : A 88 SER OG : rot -140:sc= -0.0425 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 62:sc= -0.132 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot -48:sc= 0.426 USER MOD Single : A 102 MET CE :methyl 162:sc= -0.315 (180deg=-0.376) USER MOD Single : A 103 LYS NZ :NH3+ 165:sc= -0.185 (180deg=-0.384) USER MOD Single : A 104 ASN : amide:sc=-0.00276 X(o=-0.0028,f=0) USER MOD Single : A 105 TYR OH : rot 165:sc= 1.14 USER MOD Single : A 111 SER OG : rot 180:sc= -0.004 USER MOD Single : A 114 THR OG1 : rot 180:sc=-0.00315 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot -118:sc= 1.05 USER MOD Single : A 119 ASN : amide:sc= -1.02 K(o=-1,f=-2.5!) USER MOD Single : A 120 HIS : no HD1:sc= -0.0622 X(o=-0.062,f=0.0039) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HE2:sc= -0.91 K(o=-0.91,f=-4.8!) USER MOD Single : A 128 ASN : amide:sc= -0.101 K(o=-0.1,f=-1.3!) USER MOD Single : A 135 ASN :FLIP amide:sc= -0.0078 F(o=-1,f=-0.0078) USER MOD Single : A 144 SER OG : rot -34:sc= 0.104 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ -168:sc= 0.18 (180deg=-0.106) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -3.443 -26.353 -12.950 1.00 45.14 N ATOM 2 CA GLY A 1 -3.574 -24.899 -13.080 1.00 63.50 C ATOM 3 C GLY A 1 -3.433 -24.244 -11.719 1.00 31.41 C ATOM 4 O GLY A 1 -4.371 -24.282 -10.923 1.00 72.22 O ATOM 0 H1 GLY A 1 -3.541 -26.795 -13.886 1.00 45.14 H new ATOM 0 H2 GLY A 1 -2.509 -26.583 -12.554 1.00 45.14 H new ATOM 0 H3 GLY A 1 -4.186 -26.713 -12.318 1.00 45.14 H new ATOM 0 HA2 GLY A 1 -2.812 -24.516 -13.758 1.00 63.50 H new ATOM 0 HA3 GLY A 1 -4.542 -24.650 -13.515 1.00 63.50 H new ATOM 8 N MET A 2 -2.275 -23.637 -11.446 1.00 1.34 N ATOM 9 CA MET A 2 -1.989 -22.815 -10.275 1.00 11.34 C ATOM 10 C MET A 2 -0.882 -21.852 -10.692 1.00 5.35 C ATOM 11 O MET A 2 0.166 -22.310 -11.161 1.00 45.23 O ATOM 12 CB MET A 2 -1.560 -23.689 -9.082 1.00 23.54 C ATOM 13 CG MET A 2 -1.211 -22.894 -7.808 1.00 10.43 C ATOM 14 SD MET A 2 0.361 -21.969 -7.763 1.00 25.53 S ATOM 15 CE MET A 2 1.552 -23.326 -7.934 1.00 5.42 C ATOM 0 H MET A 2 -1.472 -23.712 -12.071 1.00 1.34 H new ATOM 0 HA MET A 2 -2.873 -22.269 -9.946 1.00 11.34 H new ATOM 0 HB2 MET A 2 -2.363 -24.389 -8.851 1.00 23.54 H new ATOM 0 HB3 MET A 2 -0.694 -24.283 -9.374 1.00 23.54 H new ATOM 0 HG2 MET A 2 -2.019 -22.184 -7.628 1.00 10.43 H new ATOM 0 HG3 MET A 2 -1.209 -23.593 -6.971 1.00 10.43 H new ATOM 0 HE1 MET A 2 2.552 -22.964 -7.696 1.00 5.42 H new ATOM 0 HE2 MET A 2 1.285 -24.132 -7.251 1.00 5.42 H new ATOM 0 HE3 MET A 2 1.535 -23.698 -8.958 1.00 5.42 H new ATOM 23 N ALA A 3 -1.105 -20.547 -10.559 1.00 14.11 N ATOM 24 CA ALA A 3 -0.081 -19.528 -10.708 1.00 70.10 C ATOM 25 C ALA A 3 -0.453 -18.390 -9.771 1.00 74.40 C ATOM 26 O ALA A 3 -1.405 -17.653 -10.022 1.00 64.33 O ATOM 27 CB ALA A 3 0.027 -19.030 -12.152 1.00 71.41 C ATOM 0 H ALA A 3 -2.025 -20.165 -10.340 1.00 14.11 H new ATOM 0 HA ALA A 3 0.896 -19.942 -10.459 1.00 70.10 H new ATOM 0 HB1 ALA A 3 0.805 -18.269 -12.217 1.00 71.41 H new ATOM 0 HB2 ALA A 3 0.280 -19.864 -12.807 1.00 71.41 H new ATOM 0 HB3 ALA A 3 -0.926 -18.602 -12.461 1.00 71.41 H new ATOM 33 N LYS A 4 0.272 -18.261 -8.665 1.00 13.41 N ATOM 34 CA LYS A 4 0.243 -17.082 -7.824 1.00 65.34 C ATOM 35 C LYS A 4 1.196 -16.083 -8.446 1.00 3.23 C ATOM 36 O LYS A 4 2.350 -16.439 -8.706 1.00 5.22 O ATOM 37 CB LYS A 4 0.750 -17.436 -6.428 1.00 21.43 C ATOM 38 CG LYS A 4 -0.126 -18.472 -5.710 1.00 25.53 C ATOM 39 CD LYS A 4 0.309 -18.553 -4.248 1.00 73.33 C ATOM 40 CE LYS A 4 1.659 -19.256 -4.028 1.00 72.41 C ATOM 41 NZ LYS A 4 2.109 -19.132 -2.625 1.00 50.32 N ATOM 0 H LYS A 4 0.904 -18.987 -8.327 1.00 13.41 H new ATOM 0 HA LYS A 4 -0.769 -16.684 -7.745 1.00 65.34 H new ATOM 0 HB2 LYS A 4 1.767 -17.821 -6.505 1.00 21.43 H new ATOM 0 HB3 LYS A 4 0.797 -16.529 -5.825 1.00 21.43 H new ATOM 0 HG2 LYS A 4 -1.177 -18.189 -5.776 1.00 25.53 H new ATOM 0 HG3 LYS A 4 -0.027 -19.447 -6.188 1.00 25.53 H new ATOM 0 HD2 LYS A 4 0.368 -17.543 -3.842 1.00 73.33 H new ATOM 0 HD3 LYS A 4 -0.459 -19.080 -3.681 1.00 73.33 H new ATOM 0 HE2 LYS A 4 1.569 -20.310 -4.291 1.00 72.41 H new ATOM 0 HE3 LYS A 4 2.408 -18.824 -4.692 1.00 72.41 H new ATOM 0 HZ1 LYS A 4 3.022 -19.616 -2.509 1.00 50.32 H new ATOM 0 HZ2 LYS A 4 2.217 -18.126 -2.383 1.00 50.32 H new ATOM 0 HZ3 LYS A 4 1.405 -19.566 -1.995 1.00 50.32 H new ATOM 51 N LYS A 5 0.781 -14.842 -8.657 1.00 53.42 N ATOM 52 CA LYS A 5 1.685 -13.790 -9.114 1.00 65.54 C ATOM 53 C LYS A 5 1.820 -12.718 -8.070 1.00 22.31 C ATOM 54 O LYS A 5 1.040 -12.666 -7.125 1.00 23.43 O ATOM 55 CB LYS A 5 1.205 -13.214 -10.437 1.00 32.21 C ATOM 56 CG LYS A 5 1.148 -14.338 -11.439 1.00 3.03 C ATOM 57 CD LYS A 5 0.830 -13.809 -12.825 1.00 12.04 C ATOM 58 CE LYS A 5 0.940 -14.980 -13.805 1.00 50.02 C ATOM 59 NZ LYS A 5 1.704 -14.612 -15.015 1.00 34.35 N ATOM 0 H LYS A 5 -0.182 -14.535 -8.519 1.00 53.42 H new ATOM 0 HA LYS A 5 2.672 -14.224 -9.275 1.00 65.54 H new ATOM 0 HB2 LYS A 5 0.222 -12.757 -10.320 1.00 32.21 H new ATOM 0 HB3 LYS A 5 1.882 -12.431 -10.780 1.00 32.21 H new ATOM 0 HG2 LYS A 5 2.102 -14.865 -11.456 1.00 3.03 H new ATOM 0 HG3 LYS A 5 0.390 -15.061 -11.138 1.00 3.03 H new ATOM 0 HD2 LYS A 5 -0.172 -13.381 -12.851 1.00 12.04 H new ATOM 0 HD3 LYS A 5 1.523 -13.014 -13.099 1.00 12.04 H new ATOM 0 HE2 LYS A 5 1.424 -15.823 -13.312 1.00 50.02 H new ATOM 0 HE3 LYS A 5 -0.059 -15.309 -14.092 1.00 50.02 H new ATOM 0 HZ1 LYS A 5 1.714 -15.414 -15.677 1.00 34.35 H new ATOM 0 HZ2 LYS A 5 1.257 -13.792 -15.472 1.00 34.35 H new ATOM 0 HZ3 LYS A 5 2.680 -14.371 -14.749 1.00 34.35 H new ATOM 69 N THR A 6 2.803 -11.867 -8.286 1.00 14.03 N ATOM 70 CA THR A 6 3.135 -10.779 -7.375 1.00 64.10 C ATOM 71 C THR A 6 3.071 -9.444 -8.129 1.00 24.24 C ATOM 72 O THR A 6 3.172 -9.409 -9.357 1.00 22.34 O ATOM 73 CB THR A 6 4.488 -11.081 -6.701 1.00 72.14 C ATOM 74 OG1 THR A 6 4.421 -12.292 -5.962 1.00 12.21 O ATOM 75 CG2 THR A 6 4.928 -10.001 -5.702 1.00 5.34 C ATOM 0 H THR A 6 3.404 -11.908 -9.109 1.00 14.03 H new ATOM 0 HA THR A 6 2.410 -10.693 -6.566 1.00 64.10 H new ATOM 0 HB THR A 6 5.203 -11.133 -7.522 1.00 72.14 H new ATOM 0 HG1 THR A 6 5.289 -12.468 -5.543 1.00 12.21 H new ATOM 0 HG21 THR A 6 5.888 -10.278 -5.266 1.00 5.34 H new ATOM 0 HG22 THR A 6 5.026 -9.046 -6.218 1.00 5.34 H new ATOM 0 HG23 THR A 6 4.183 -9.911 -4.912 1.00 5.34 H new ATOM 83 N LEU A 7 2.915 -8.336 -7.403 1.00 53.40 N ATOM 84 CA LEU A 7 2.887 -6.980 -7.938 1.00 5.03 C ATOM 85 C LEU A 7 3.640 -6.058 -6.975 1.00 44.43 C ATOM 86 O LEU A 7 3.650 -6.330 -5.775 1.00 10.35 O ATOM 87 CB LEU A 7 1.421 -6.524 -8.063 1.00 41.40 C ATOM 88 CG LEU A 7 1.084 -5.747 -9.346 1.00 24.54 C ATOM 89 CD1 LEU A 7 -0.250 -5.016 -9.148 1.00 11.11 C ATOM 90 CD2 LEU A 7 2.126 -4.713 -9.773 1.00 50.32 C ATOM 0 H LEU A 7 2.801 -8.363 -6.390 1.00 53.40 H new ATOM 0 HA LEU A 7 3.360 -6.946 -8.919 1.00 5.03 H new ATOM 0 HB2 LEU A 7 0.778 -7.403 -8.010 1.00 41.40 H new ATOM 0 HB3 LEU A 7 1.177 -5.899 -7.204 1.00 41.40 H new ATOM 0 HG LEU A 7 1.048 -6.496 -10.137 1.00 24.54 H new ATOM 0 HD11 LEU A 7 -0.499 -4.461 -10.053 1.00 11.11 H new ATOM 0 HD12 LEU A 7 -1.036 -5.742 -8.940 1.00 11.11 H new ATOM 0 HD13 LEU A 7 -0.165 -4.324 -8.310 1.00 11.11 H new ATOM 0 HD21 LEU A 7 1.796 -4.220 -10.687 1.00 50.32 H new ATOM 0 HD22 LEU A 7 2.247 -3.971 -8.984 1.00 50.32 H new ATOM 0 HD23 LEU A 7 3.079 -5.210 -9.953 1.00 50.32 H new ATOM 101 N ILE A 8 4.224 -4.963 -7.468 1.00 24.32 N ATOM 102 CA ILE A 8 5.029 -3.996 -6.723 1.00 70.32 C ATOM 103 C ILE A 8 4.550 -2.591 -7.112 1.00 52.12 C ATOM 104 O ILE A 8 4.818 -2.110 -8.215 1.00 41.31 O ATOM 105 CB ILE A 8 6.534 -4.203 -7.029 1.00 65.52 C ATOM 106 CG1 ILE A 8 7.041 -5.627 -6.696 1.00 62.24 C ATOM 107 CG2 ILE A 8 7.404 -3.180 -6.274 1.00 50.34 C ATOM 108 CD1 ILE A 8 8.243 -5.991 -7.564 1.00 21.52 C ATOM 0 H ILE A 8 4.142 -4.715 -8.454 1.00 24.32 H new ATOM 0 HA ILE A 8 4.908 -4.131 -5.648 1.00 70.32 H new ATOM 0 HB ILE A 8 6.628 -4.057 -8.105 1.00 65.52 H new ATOM 0 HG12 ILE A 8 7.317 -5.683 -5.643 1.00 62.24 H new ATOM 0 HG13 ILE A 8 6.240 -6.349 -6.854 1.00 62.24 H new ATOM 0 HG21 ILE A 8 8.454 -3.351 -6.510 1.00 50.34 H new ATOM 0 HG22 ILE A 8 7.124 -2.171 -6.577 1.00 50.34 H new ATOM 0 HG23 ILE A 8 7.250 -3.293 -5.201 1.00 50.34 H new ATOM 0 HD11 ILE A 8 8.582 -6.996 -7.313 1.00 21.52 H new ATOM 0 HD12 ILE A 8 7.956 -5.957 -8.615 1.00 21.52 H new ATOM 0 HD13 ILE A 8 9.050 -5.280 -7.385 1.00 21.52 H new ATOM 119 N LEU A 9 3.818 -1.916 -6.229 1.00 32.33 N ATOM 120 CA LEU A 9 3.280 -0.579 -6.432 1.00 13.22 C ATOM 121 C LEU A 9 4.064 0.426 -5.607 1.00 24.14 C ATOM 122 O LEU A 9 4.148 0.288 -4.382 1.00 53.31 O ATOM 123 CB LEU A 9 1.811 -0.599 -6.016 1.00 64.10 C ATOM 124 CG LEU A 9 0.960 -1.040 -7.216 1.00 12.03 C ATOM 125 CD1 LEU A 9 -0.241 -1.865 -6.783 1.00 61.41 C ATOM 126 CD2 LEU A 9 0.529 0.213 -7.976 1.00 70.41 C ATOM 0 H LEU A 9 3.575 -2.304 -5.317 1.00 32.33 H new ATOM 0 HA LEU A 9 3.363 -0.284 -7.478 1.00 13.22 H new ATOM 0 HB2 LEU A 9 1.665 -1.282 -5.179 1.00 64.10 H new ATOM 0 HB3 LEU A 9 1.502 0.390 -5.678 1.00 64.10 H new ATOM 0 HG LEU A 9 1.552 -1.685 -7.866 1.00 12.03 H new ATOM 0 HD11 LEU A 9 -0.817 -2.157 -7.661 1.00 61.41 H new ATOM 0 HD12 LEU A 9 0.101 -2.758 -6.259 1.00 61.41 H new ATOM 0 HD13 LEU A 9 -0.869 -1.272 -6.118 1.00 61.41 H new ATOM 0 HD21 LEU A 9 -0.078 -0.073 -8.835 1.00 70.41 H new ATOM 0 HD22 LEU A 9 -0.055 0.855 -7.317 1.00 70.41 H new ATOM 0 HD23 LEU A 9 1.412 0.752 -8.319 1.00 70.41 H new ATOM 137 N TYR A 10 4.638 1.444 -6.249 1.00 14.11 N ATOM 138 CA TYR A 10 5.630 2.302 -5.617 1.00 25.25 C ATOM 139 C TYR A 10 5.363 3.777 -5.899 1.00 61.41 C ATOM 140 O TYR A 10 5.889 4.380 -6.838 1.00 13.44 O ATOM 141 CB TYR A 10 7.038 1.804 -5.988 1.00 11.23 C ATOM 142 CG TYR A 10 7.432 1.849 -7.460 1.00 4.04 C ATOM 143 CD1 TYR A 10 6.911 0.920 -8.388 1.00 72.41 C ATOM 144 CD2 TYR A 10 8.373 2.800 -7.896 1.00 74.53 C ATOM 145 CE1 TYR A 10 7.308 0.957 -9.738 1.00 23.11 C ATOM 146 CE2 TYR A 10 8.787 2.828 -9.236 1.00 32.24 C ATOM 147 CZ TYR A 10 8.261 1.909 -10.165 1.00 51.12 C ATOM 148 OH TYR A 10 8.665 1.996 -11.460 1.00 14.45 O ATOM 0 H TYR A 10 4.427 1.693 -7.216 1.00 14.11 H new ATOM 0 HA TYR A 10 5.556 2.234 -4.532 1.00 25.25 H new ATOM 0 HB2 TYR A 10 7.763 2.394 -5.427 1.00 11.23 H new ATOM 0 HB3 TYR A 10 7.132 0.774 -5.645 1.00 11.23 H new ATOM 0 HD1 TYR A 10 6.202 0.175 -8.059 1.00 72.41 H new ATOM 0 HD2 TYR A 10 8.779 3.513 -7.194 1.00 74.53 H new ATOM 0 HE1 TYR A 10 6.885 0.259 -10.446 1.00 23.11 H new ATOM 0 HE2 TYR A 10 9.514 3.559 -9.558 1.00 32.24 H new ATOM 0 HH TYR A 10 9.325 2.715 -11.549 1.00 14.45 H new ATOM 157 N TYR A 11 4.518 4.375 -5.059 1.00 11.22 N ATOM 158 CA TYR A 11 4.200 5.792 -5.157 1.00 51.32 C ATOM 159 C TYR A 11 5.486 6.565 -4.831 1.00 65.34 C ATOM 160 O TYR A 11 6.303 6.106 -4.023 1.00 34.01 O ATOM 161 CB TYR A 11 3.021 6.184 -4.263 1.00 62.22 C ATOM 162 CG TYR A 11 3.025 7.655 -3.850 1.00 43.10 C ATOM 163 CD1 TYR A 11 2.380 8.596 -4.678 1.00 64.02 C ATOM 164 CD2 TYR A 11 3.834 8.114 -2.789 1.00 10.54 C ATOM 165 CE1 TYR A 11 2.628 9.971 -4.529 1.00 1.31 C ATOM 166 CE2 TYR A 11 4.058 9.495 -2.610 1.00 13.23 C ATOM 167 CZ TYR A 11 3.495 10.427 -3.514 1.00 10.12 C ATOM 168 OH TYR A 11 3.842 11.743 -3.453 1.00 65.41 O ATOM 0 H TYR A 11 4.040 3.892 -4.298 1.00 11.22 H new ATOM 0 HA TYR A 11 3.867 6.042 -6.164 1.00 51.32 H new ATOM 0 HB2 TYR A 11 2.091 5.966 -4.787 1.00 62.22 H new ATOM 0 HB3 TYR A 11 3.035 5.564 -3.366 1.00 62.22 H new ATOM 0 HD1 TYR A 11 1.688 8.257 -5.435 1.00 64.02 H new ATOM 0 HD2 TYR A 11 4.284 7.404 -2.111 1.00 10.54 H new ATOM 0 HE1 TYR A 11 2.154 10.680 -5.192 1.00 1.31 H new ATOM 0 HE2 TYR A 11 4.660 9.841 -1.783 1.00 13.23 H new ATOM 0 HH TYR A 11 4.444 11.888 -2.694 1.00 65.41 H new ATOM 177 N SER A 12 5.672 7.735 -5.426 1.00 5.42 N ATOM 178 CA SER A 12 6.573 8.790 -4.987 1.00 65.10 C ATOM 179 C SER A 12 6.220 10.036 -5.786 1.00 70.21 C ATOM 180 O SER A 12 5.415 9.976 -6.724 1.00 74.41 O ATOM 181 CB SER A 12 8.042 8.400 -5.204 1.00 45.44 C ATOM 182 OG SER A 12 8.493 7.677 -4.080 1.00 2.42 O ATOM 0 H SER A 12 5.169 7.987 -6.277 1.00 5.42 H new ATOM 0 HA SER A 12 6.456 8.967 -3.918 1.00 65.10 H new ATOM 0 HB2 SER A 12 8.143 7.796 -6.106 1.00 45.44 H new ATOM 0 HB3 SER A 12 8.652 9.292 -5.348 1.00 45.44 H new ATOM 0 HG SER A 12 7.743 7.185 -3.685 1.00 2.42 H new ATOM 187 N TRP A 13 6.849 11.150 -5.428 1.00 73.14 N ATOM 188 CA TRP A 13 6.813 12.377 -6.190 1.00 11.24 C ATOM 189 C TRP A 13 7.541 12.112 -7.513 1.00 73.14 C ATOM 190 O TRP A 13 6.905 11.676 -8.476 1.00 32.23 O ATOM 191 CB TRP A 13 7.364 13.528 -5.326 1.00 30.43 C ATOM 192 CG TRP A 13 6.628 14.807 -5.507 1.00 32.41 C ATOM 193 CD1 TRP A 13 5.637 15.251 -4.707 1.00 41.32 C ATOM 194 CD2 TRP A 13 6.768 15.797 -6.563 1.00 31.43 C ATOM 195 NE1 TRP A 13 5.122 16.420 -5.221 1.00 22.03 N ATOM 196 CE2 TRP A 13 5.759 16.788 -6.388 1.00 12.11 C ATOM 197 CE3 TRP A 13 7.640 15.945 -7.658 1.00 3.45 C ATOM 198 CZ2 TRP A 13 5.589 17.843 -7.297 1.00 61.12 C ATOM 199 CZ3 TRP A 13 7.489 17.007 -8.565 1.00 54.34 C ATOM 200 CH2 TRP A 13 6.456 17.942 -8.398 1.00 43.12 C ATOM 0 H TRP A 13 7.409 11.219 -4.578 1.00 73.14 H new ATOM 0 HA TRP A 13 5.806 12.700 -6.454 1.00 11.24 H new ATOM 0 HB2 TRP A 13 7.320 13.238 -4.276 1.00 30.43 H new ATOM 0 HB3 TRP A 13 8.415 13.684 -5.570 1.00 30.43 H new ATOM 0 HD1 TRP A 13 5.300 14.765 -3.803 1.00 41.32 H new ATOM 0 HE1 TRP A 13 4.363 16.949 -4.792 1.00 22.03 H new ATOM 0 HE3 TRP A 13 8.437 15.231 -7.803 1.00 3.45 H new ATOM 0 HZ2 TRP A 13 4.803 18.569 -7.152 1.00 61.12 H new ATOM 0 HZ3 TRP A 13 8.172 17.104 -9.396 1.00 54.34 H new ATOM 0 HH2 TRP A 13 6.327 18.738 -9.116 1.00 43.12 H new ATOM 210 N SER A 14 8.869 12.236 -7.551 1.00 44.44 N ATOM 211 CA SER A 14 9.667 11.950 -8.736 1.00 13.24 C ATOM 212 C SER A 14 10.915 11.166 -8.326 1.00 33.41 C ATOM 213 O SER A 14 11.876 11.727 -7.801 1.00 65.34 O ATOM 214 CB SER A 14 9.979 13.246 -9.502 1.00 63.42 C ATOM 215 OG SER A 14 8.772 13.845 -9.963 1.00 30.11 O ATOM 0 H SER A 14 9.422 12.541 -6.750 1.00 44.44 H new ATOM 0 HA SER A 14 9.107 11.323 -9.430 1.00 13.24 H new ATOM 0 HB2 SER A 14 10.514 13.940 -8.854 1.00 63.42 H new ATOM 0 HB3 SER A 14 10.633 13.030 -10.347 1.00 63.42 H new ATOM 0 HG SER A 14 8.359 14.352 -9.233 1.00 30.11 H new ATOM 220 N GLY A 15 10.893 9.853 -8.560 1.00 42.20 N ATOM 221 CA GLY A 15 12.085 9.020 -8.616 1.00 53.44 C ATOM 222 C GLY A 15 12.685 8.711 -7.252 1.00 21.44 C ATOM 223 O GLY A 15 13.910 8.672 -7.141 1.00 51.31 O ATOM 0 H GLY A 15 10.029 9.334 -8.718 1.00 42.20 H new ATOM 0 HA2 GLY A 15 11.838 8.083 -9.114 1.00 53.44 H new ATOM 0 HA3 GLY A 15 12.836 9.518 -9.228 1.00 53.44 H new ATOM 227 N GLU A 16 11.867 8.486 -6.221 1.00 21.22 N ATOM 228 CA GLU A 16 12.331 8.166 -4.866 1.00 2.45 C ATOM 229 C GLU A 16 12.289 6.649 -4.632 1.00 22.11 C ATOM 230 O GLU A 16 13.339 5.995 -4.652 1.00 33.05 O ATOM 231 CB GLU A 16 11.519 8.970 -3.835 1.00 52.33 C ATOM 232 CG GLU A 16 12.262 10.209 -3.323 1.00 13.43 C ATOM 233 CD GLU A 16 13.331 9.884 -2.278 1.00 63.24 C ATOM 234 OE1 GLU A 16 14.030 8.854 -2.385 1.00 44.51 O ATOM 235 OE2 GLU A 16 13.509 10.667 -1.317 1.00 34.03 O ATOM 0 H GLU A 16 10.851 8.521 -6.303 1.00 21.22 H new ATOM 0 HA GLU A 16 13.373 8.462 -4.745 1.00 2.45 H new ATOM 0 HB2 GLU A 16 10.575 9.279 -4.285 1.00 52.33 H new ATOM 0 HB3 GLU A 16 11.274 8.325 -2.991 1.00 52.33 H new ATOM 0 HG2 GLU A 16 12.730 10.718 -4.166 1.00 13.43 H new ATOM 0 HG3 GLU A 16 11.541 10.904 -2.892 1.00 13.43 H new ATOM 240 N THR A 17 11.093 6.062 -4.492 1.00 11.45 N ATOM 241 CA THR A 17 10.894 4.619 -4.294 1.00 65.12 C ATOM 242 C THR A 17 11.395 3.783 -5.480 1.00 30.24 C ATOM 243 O THR A 17 11.536 2.571 -5.356 1.00 44.14 O ATOM 244 CB THR A 17 9.402 4.314 -4.061 1.00 65.43 C ATOM 245 OG1 THR A 17 8.624 4.968 -5.048 1.00 11.02 O ATOM 246 CG2 THR A 17 8.900 4.754 -2.686 1.00 62.50 C ATOM 0 H THR A 17 10.219 6.587 -4.514 1.00 11.45 H new ATOM 0 HA THR A 17 11.481 4.342 -3.418 1.00 65.12 H new ATOM 0 HB THR A 17 9.298 3.231 -4.120 1.00 65.43 H new ATOM 0 HG1 THR A 17 8.396 5.870 -4.740 1.00 11.02 H new ATOM 0 HG21 THR A 17 7.842 4.509 -2.589 1.00 62.50 H new ATOM 0 HG22 THR A 17 9.465 4.237 -1.910 1.00 62.50 H new ATOM 0 HG23 THR A 17 9.035 5.830 -2.577 1.00 62.50 H new ATOM 254 N LYS A 18 11.706 4.417 -6.617 1.00 22.45 N ATOM 255 CA LYS A 18 12.090 3.791 -7.877 1.00 74.20 C ATOM 256 C LYS A 18 13.091 2.668 -7.651 1.00 64.33 C ATOM 257 O LYS A 18 12.798 1.513 -7.957 1.00 32.55 O ATOM 258 CB LYS A 18 12.638 4.893 -8.801 1.00 72.14 C ATOM 259 CG LYS A 18 13.113 4.433 -10.186 1.00 3.22 C ATOM 260 CD LYS A 18 11.955 4.116 -11.143 1.00 45.10 C ATOM 261 CE LYS A 18 12.395 3.975 -12.609 1.00 32.13 C ATOM 262 NZ LYS A 18 13.081 5.186 -13.107 1.00 4.45 N ATOM 0 H LYS A 18 11.694 5.435 -6.681 1.00 22.45 H new ATOM 0 HA LYS A 18 11.227 3.323 -8.351 1.00 74.20 H new ATOM 0 HB2 LYS A 18 11.861 5.646 -8.936 1.00 72.14 H new ATOM 0 HB3 LYS A 18 13.471 5.382 -8.296 1.00 72.14 H new ATOM 0 HG2 LYS A 18 13.738 5.210 -10.626 1.00 3.22 H new ATOM 0 HG3 LYS A 18 13.737 3.547 -10.074 1.00 3.22 H new ATOM 0 HD2 LYS A 18 11.474 3.191 -10.825 1.00 45.10 H new ATOM 0 HD3 LYS A 18 11.207 4.906 -11.070 1.00 45.10 H new ATOM 0 HE2 LYS A 18 13.061 3.117 -12.705 1.00 32.13 H new ATOM 0 HE3 LYS A 18 11.522 3.773 -13.230 1.00 32.13 H new ATOM 0 HZ1 LYS A 18 13.087 5.179 -14.147 1.00 4.45 H new ATOM 0 HZ2 LYS A 18 12.580 6.032 -12.770 1.00 4.45 H new ATOM 0 HZ3 LYS A 18 14.060 5.200 -12.755 1.00 4.45 H new ATOM 272 N LYS A 19 14.249 2.990 -7.076 1.00 3.12 N ATOM 273 CA LYS A 19 15.317 2.025 -6.853 1.00 73.32 C ATOM 274 C LYS A 19 14.842 0.810 -6.055 1.00 72.13 C ATOM 275 O LYS A 19 15.277 -0.299 -6.347 1.00 44.22 O ATOM 276 CB LYS A 19 16.494 2.739 -6.158 1.00 45.32 C ATOM 277 CG LYS A 19 16.211 3.119 -4.691 1.00 31.12 C ATOM 278 CD LYS A 19 17.341 3.923 -4.035 1.00 5.35 C ATOM 279 CE LYS A 19 17.252 5.429 -4.288 1.00 41.24 C ATOM 280 NZ LYS A 19 16.080 6.041 -3.618 1.00 71.20 N ATOM 0 H LYS A 19 14.470 3.931 -6.752 1.00 3.12 H new ATOM 0 HA LYS A 19 15.647 1.636 -7.816 1.00 73.32 H new ATOM 0 HB2 LYS A 19 17.371 2.093 -6.194 1.00 45.32 H new ATOM 0 HB3 LYS A 19 16.740 3.642 -6.717 1.00 45.32 H new ATOM 0 HG2 LYS A 19 15.290 3.700 -4.646 1.00 31.12 H new ATOM 0 HG3 LYS A 19 16.042 2.209 -4.115 1.00 31.12 H new ATOM 0 HD2 LYS A 19 17.326 3.743 -2.960 1.00 5.35 H new ATOM 0 HD3 LYS A 19 18.298 3.557 -4.407 1.00 5.35 H new ATOM 0 HE2 LYS A 19 18.163 5.910 -3.933 1.00 41.24 H new ATOM 0 HE3 LYS A 19 17.192 5.613 -5.361 1.00 41.24 H new ATOM 0 HZ1 LYS A 19 16.231 7.066 -3.522 1.00 71.20 H new ATOM 0 HZ2 LYS A 19 15.226 5.868 -4.186 1.00 71.20 H new ATOM 0 HZ3 LYS A 19 15.960 5.619 -2.675 1.00 71.20 H new ATOM 290 N MET A 20 13.956 1.030 -5.081 1.00 53.22 N ATOM 291 CA MET A 20 13.420 0.027 -4.175 1.00 34.23 C ATOM 292 C MET A 20 12.252 -0.743 -4.804 1.00 3.45 C ATOM 293 O MET A 20 11.677 -1.591 -4.124 1.00 50.41 O ATOM 294 CB MET A 20 12.906 0.713 -2.888 1.00 5.31 C ATOM 295 CG MET A 20 14.002 1.291 -1.991 1.00 74.14 C ATOM 296 SD MET A 20 14.214 0.385 -0.442 1.00 44.22 S ATOM 297 CE MET A 20 14.911 -1.150 -1.098 1.00 61.23 C ATOM 0 H MET A 20 13.578 1.960 -4.899 1.00 53.22 H new ATOM 0 HA MET A 20 14.225 -0.674 -3.952 1.00 34.23 H new ATOM 0 HB2 MET A 20 12.224 1.516 -3.168 1.00 5.31 H new ATOM 0 HB3 MET A 20 12.328 -0.010 -2.313 1.00 5.31 H new ATOM 0 HG2 MET A 20 14.946 1.289 -2.536 1.00 74.14 H new ATOM 0 HG3 MET A 20 13.766 2.331 -1.766 1.00 74.14 H new ATOM 0 HE1 MET A 20 15.109 -1.839 -0.277 1.00 61.23 H new ATOM 0 HE2 MET A 20 14.203 -1.604 -1.791 1.00 61.23 H new ATOM 0 HE3 MET A 20 15.842 -0.932 -1.622 1.00 61.23 H new ATOM 305 N ALA A 21 11.898 -0.513 -6.072 1.00 43.03 N ATOM 306 CA ALA A 21 10.987 -1.379 -6.815 1.00 4.15 C ATOM 307 C ALA A 21 11.745 -2.236 -7.833 1.00 30.43 C ATOM 308 O ALA A 21 11.389 -3.393 -8.066 1.00 54.21 O ATOM 309 CB ALA A 21 9.930 -0.518 -7.508 1.00 63.14 C ATOM 0 H ALA A 21 12.238 0.283 -6.611 1.00 43.03 H new ATOM 0 HA ALA A 21 10.498 -2.061 -6.119 1.00 4.15 H new ATOM 0 HB1 ALA A 21 9.246 -1.159 -8.065 1.00 63.14 H new ATOM 0 HB2 ALA A 21 9.372 0.045 -6.760 1.00 63.14 H new ATOM 0 HB3 ALA A 21 10.418 0.175 -8.194 1.00 63.14 H new ATOM 315 N GLU A 22 12.773 -1.668 -8.472 1.00 2.43 N ATOM 316 CA GLU A 22 13.429 -2.314 -9.604 1.00 70.44 C ATOM 317 C GLU A 22 14.278 -3.510 -9.170 1.00 61.11 C ATOM 318 O GLU A 22 14.430 -4.431 -9.975 1.00 4.13 O ATOM 319 CB GLU A 22 14.268 -1.300 -10.408 1.00 33.54 C ATOM 320 CG GLU A 22 13.445 -0.077 -10.857 1.00 33.12 C ATOM 321 CD GLU A 22 13.860 0.484 -12.222 1.00 34.23 C ATOM 322 OE1 GLU A 22 13.504 -0.098 -13.270 1.00 42.41 O ATOM 323 OE2 GLU A 22 14.519 1.547 -12.256 1.00 71.34 O ATOM 0 H GLU A 22 13.166 -0.761 -8.221 1.00 2.43 H new ATOM 0 HA GLU A 22 12.644 -2.699 -10.255 1.00 70.44 H new ATOM 0 HB2 GLU A 22 15.108 -0.965 -9.800 1.00 33.54 H new ATOM 0 HB3 GLU A 22 14.687 -1.794 -11.285 1.00 33.54 H new ATOM 0 HG2 GLU A 22 12.391 -0.354 -10.894 1.00 33.12 H new ATOM 0 HG3 GLU A 22 13.542 0.709 -10.108 1.00 33.12 H new ATOM 328 N LYS A 23 14.790 -3.536 -7.928 1.00 5.14 N ATOM 329 CA LYS A 23 15.537 -4.684 -7.410 1.00 34.21 C ATOM 330 C LYS A 23 14.584 -5.871 -7.266 1.00 73.11 C ATOM 331 O LYS A 23 14.694 -6.822 -8.044 1.00 74.42 O ATOM 332 CB LYS A 23 16.210 -4.335 -6.073 1.00 44.43 C ATOM 333 CG LYS A 23 17.713 -4.144 -6.096 1.00 34.15 C ATOM 334 CD LYS A 23 18.108 -2.680 -6.069 1.00 72.52 C ATOM 335 CE LYS A 23 17.777 -1.927 -7.346 1.00 41.23 C ATOM 336 NZ LYS A 23 18.236 -0.535 -7.237 1.00 62.13 N ATOM 0 H LYS A 23 14.697 -2.767 -7.264 1.00 5.14 H new ATOM 0 HA LYS A 23 16.331 -4.952 -8.107 1.00 34.21 H new ATOM 0 HB2 LYS A 23 15.757 -3.420 -5.693 1.00 44.43 H new ATOM 0 HB3 LYS A 23 15.979 -5.126 -5.359 1.00 44.43 H new ATOM 0 HG2 LYS A 23 18.155 -4.653 -5.239 1.00 34.15 H new ATOM 0 HG3 LYS A 23 18.123 -4.612 -6.991 1.00 34.15 H new ATOM 0 HD2 LYS A 23 17.606 -2.194 -5.232 1.00 72.52 H new ATOM 0 HD3 LYS A 23 19.180 -2.607 -5.884 1.00 72.52 H new ATOM 0 HE2 LYS A 23 18.254 -2.411 -8.198 1.00 41.23 H new ATOM 0 HE3 LYS A 23 16.702 -1.952 -7.526 1.00 41.23 H new ATOM 0 HZ1 LYS A 23 18.613 -0.221 -8.154 1.00 62.13 H new ATOM 0 HZ2 LYS A 23 17.438 0.073 -6.964 1.00 62.13 H new ATOM 0 HZ3 LYS A 23 18.982 -0.471 -6.516 1.00 62.13 H new ATOM 346 N ILE A 24 13.613 -5.760 -6.352 1.00 64.43 N ATOM 347 CA ILE A 24 12.635 -6.769 -5.934 1.00 24.15 C ATOM 348 C ILE A 24 11.964 -7.383 -7.170 1.00 71.23 C ATOM 349 O ILE A 24 11.762 -8.592 -7.237 1.00 70.42 O ATOM 350 CB ILE A 24 11.610 -6.124 -4.973 1.00 33.43 C ATOM 351 CG1 ILE A 24 12.271 -5.721 -3.633 1.00 61.13 C ATOM 352 CG2 ILE A 24 10.438 -7.065 -4.651 1.00 73.14 C ATOM 353 CD1 ILE A 24 11.422 -4.693 -2.874 1.00 63.14 C ATOM 0 H ILE A 24 13.481 -4.886 -5.843 1.00 64.43 H new ATOM 0 HA ILE A 24 13.131 -7.577 -5.397 1.00 24.15 H new ATOM 0 HB ILE A 24 11.234 -5.243 -5.493 1.00 33.43 H new ATOM 0 HG12 ILE A 24 12.411 -6.607 -3.014 1.00 61.13 H new ATOM 0 HG13 ILE A 24 13.261 -5.307 -3.824 1.00 61.13 H new ATOM 0 HG21 ILE A 24 9.746 -6.566 -3.973 1.00 73.14 H new ATOM 0 HG22 ILE A 24 9.918 -7.326 -5.572 1.00 73.14 H new ATOM 0 HG23 ILE A 24 10.818 -7.971 -4.179 1.00 73.14 H new ATOM 0 HD11 ILE A 24 11.916 -4.433 -1.938 1.00 63.14 H new ATOM 0 HD12 ILE A 24 11.304 -3.797 -3.484 1.00 63.14 H new ATOM 0 HD13 ILE A 24 10.441 -5.118 -2.660 1.00 63.14 H new ATOM 364 N ASN A 25 11.622 -6.563 -8.169 1.00 31.12 N ATOM 365 CA ASN A 25 10.960 -7.019 -9.388 1.00 45.23 C ATOM 366 C ASN A 25 11.754 -8.108 -10.131 1.00 31.41 C ATOM 367 O ASN A 25 11.150 -8.965 -10.775 1.00 25.12 O ATOM 368 CB ASN A 25 10.672 -5.796 -10.272 1.00 1.23 C ATOM 369 CG ASN A 25 10.141 -6.168 -11.645 1.00 30.42 C ATOM 370 OD1 ASN A 25 10.680 -5.712 -12.650 1.00 13.44 O ATOM 371 ND2 ASN A 25 9.080 -6.952 -11.719 1.00 3.42 N ATOM 0 H ASN A 25 11.799 -5.559 -8.151 1.00 31.12 H new ATOM 0 HA ASN A 25 10.020 -7.501 -9.119 1.00 45.23 H new ATOM 0 HB2 ASN A 25 9.948 -5.154 -9.770 1.00 1.23 H new ATOM 0 HB3 ASN A 25 11.587 -5.215 -10.388 1.00 1.23 H new ATOM 0 HD21 ASN A 25 8.687 -7.194 -12.629 1.00 3.42 H new ATOM 0 HD22 ASN A 25 8.654 -7.316 -10.866 1.00 3.42 H new ATOM 377 N SER A 26 13.083 -8.098 -10.028 1.00 51.00 N ATOM 378 CA SER A 26 13.958 -9.128 -10.580 1.00 71.32 C ATOM 379 C SER A 26 14.090 -10.349 -9.652 1.00 42.14 C ATOM 380 O SER A 26 14.382 -11.445 -10.134 1.00 73.32 O ATOM 381 CB SER A 26 15.338 -8.494 -10.813 1.00 22.44 C ATOM 382 OG SER A 26 16.160 -9.252 -11.682 1.00 4.43 O ATOM 0 H SER A 26 13.591 -7.356 -9.547 1.00 51.00 H new ATOM 0 HA SER A 26 13.526 -9.493 -11.512 1.00 71.32 H new ATOM 0 HB2 SER A 26 15.206 -7.495 -11.228 1.00 22.44 H new ATOM 0 HB3 SER A 26 15.844 -8.377 -9.855 1.00 22.44 H new ATOM 0 HG SER A 26 17.022 -8.800 -11.794 1.00 4.43 H new ATOM 387 N GLU A 27 13.923 -10.200 -8.334 1.00 23.14 N ATOM 388 CA GLU A 27 14.161 -11.268 -7.360 1.00 23.32 C ATOM 389 C GLU A 27 12.895 -12.081 -7.074 1.00 33.52 C ATOM 390 O GLU A 27 12.996 -13.170 -6.503 1.00 13.34 O ATOM 391 CB GLU A 27 14.869 -10.781 -6.079 1.00 42.44 C ATOM 392 CG GLU A 27 14.469 -9.434 -5.579 1.00 12.41 C ATOM 393 CD GLU A 27 15.374 -8.883 -4.476 1.00 3.44 C ATOM 394 OE1 GLU A 27 15.650 -9.608 -3.491 1.00 70.53 O ATOM 395 OE2 GLU A 27 15.810 -7.718 -4.608 1.00 1.33 O ATOM 0 H GLU A 27 13.615 -9.325 -7.910 1.00 23.14 H new ATOM 0 HA GLU A 27 14.867 -11.953 -7.829 1.00 23.32 H new ATOM 0 HB2 GLU A 27 14.686 -11.509 -5.288 1.00 42.44 H new ATOM 0 HB3 GLU A 27 15.943 -10.773 -6.263 1.00 42.44 H new ATOM 0 HG2 GLU A 27 14.466 -8.734 -6.415 1.00 12.41 H new ATOM 0 HG3 GLU A 27 13.447 -9.486 -5.203 1.00 12.41 H new ATOM 400 N ILE A 28 11.727 -11.604 -7.516 1.00 74.30 N ATOM 401 CA ILE A 28 10.463 -12.320 -7.423 1.00 4.21 C ATOM 402 C ILE A 28 10.085 -12.830 -8.802 1.00 65.44 C ATOM 403 O ILE A 28 9.868 -12.060 -9.742 1.00 45.33 O ATOM 404 CB ILE A 28 9.348 -11.462 -6.809 1.00 73.20 C ATOM 405 CG1 ILE A 28 9.775 -10.904 -5.437 1.00 13.31 C ATOM 406 CG2 ILE A 28 8.087 -12.338 -6.657 1.00 62.23 C ATOM 407 CD1 ILE A 28 8.672 -10.108 -4.736 1.00 43.14 C ATOM 0 H ILE A 28 11.638 -10.689 -7.957 1.00 74.30 H new ATOM 0 HA ILE A 28 10.590 -13.165 -6.746 1.00 4.21 H new ATOM 0 HB ILE A 28 9.142 -10.614 -7.462 1.00 73.20 H new ATOM 0 HG12 ILE A 28 10.080 -11.731 -4.796 1.00 13.31 H new ATOM 0 HG13 ILE A 28 10.647 -10.264 -5.569 1.00 13.31 H new ATOM 0 HG21 ILE A 28 7.282 -11.745 -6.222 1.00 62.23 H new ATOM 0 HG22 ILE A 28 7.779 -12.705 -7.636 1.00 62.23 H new ATOM 0 HG23 ILE A 28 8.308 -13.184 -6.006 1.00 62.23 H new ATOM 0 HD11 ILE A 28 9.039 -9.744 -3.776 1.00 43.14 H new ATOM 0 HD12 ILE A 28 8.383 -9.261 -5.358 1.00 43.14 H new ATOM 0 HD13 ILE A 28 7.807 -10.751 -4.573 1.00 43.14 H new ATOM 418 N LYS A 29 9.959 -14.151 -8.902 1.00 51.24 N ATOM 419 CA LYS A 29 9.499 -14.790 -10.120 1.00 65.10 C ATOM 420 C LYS A 29 8.022 -14.500 -10.329 1.00 73.32 C ATOM 421 O LYS A 29 7.227 -14.616 -9.392 1.00 24.31 O ATOM 422 CB LYS A 29 9.759 -16.303 -10.053 1.00 23.31 C ATOM 423 CG LYS A 29 10.008 -16.924 -11.433 1.00 62.51 C ATOM 424 CD LYS A 29 11.269 -16.322 -12.075 1.00 54.00 C ATOM 425 CE LYS A 29 11.997 -17.257 -13.038 1.00 22.54 C ATOM 426 NZ LYS A 29 12.500 -18.464 -12.357 1.00 25.33 N ATOM 0 H LYS A 29 10.172 -14.799 -8.144 1.00 51.24 H new ATOM 0 HA LYS A 29 10.052 -14.388 -10.969 1.00 65.10 H new ATOM 0 HB2 LYS A 29 10.622 -16.491 -9.414 1.00 23.31 H new ATOM 0 HB3 LYS A 29 8.904 -16.794 -9.587 1.00 23.31 H new ATOM 0 HG2 LYS A 29 10.122 -18.004 -11.337 1.00 62.51 H new ATOM 0 HG3 LYS A 29 9.146 -16.750 -12.077 1.00 62.51 H new ATOM 0 HD2 LYS A 29 10.991 -15.414 -12.610 1.00 54.00 H new ATOM 0 HD3 LYS A 29 11.959 -16.027 -11.284 1.00 54.00 H new ATOM 0 HE2 LYS A 29 11.321 -17.549 -13.842 1.00 22.54 H new ATOM 0 HE3 LYS A 29 12.830 -16.726 -13.499 1.00 22.54 H new ATOM 0 HZ1 LYS A 29 13.243 -18.905 -12.936 1.00 25.33 H new ATOM 0 HZ2 LYS A 29 12.893 -18.201 -11.431 1.00 25.33 H new ATOM 0 HZ3 LYS A 29 11.719 -19.138 -12.223 1.00 25.33 H new ATOM 436 N ASP A 30 7.655 -14.213 -11.575 1.00 54.21 N ATOM 437 CA ASP A 30 6.291 -13.911 -12.010 1.00 53.24 C ATOM 438 C ASP A 30 5.693 -12.725 -11.234 1.00 31.43 C ATOM 439 O ASP A 30 4.504 -12.703 -10.907 1.00 64.32 O ATOM 440 CB ASP A 30 5.429 -15.191 -11.988 1.00 23.13 C ATOM 441 CG ASP A 30 4.350 -15.247 -13.074 1.00 54.03 C ATOM 442 OD1 ASP A 30 4.214 -14.323 -13.906 1.00 14.14 O ATOM 443 OD2 ASP A 30 3.719 -16.319 -13.218 1.00 70.33 O ATOM 0 H ASP A 30 8.326 -14.183 -12.342 1.00 54.21 H new ATOM 0 HA ASP A 30 6.310 -13.575 -13.047 1.00 53.24 H new ATOM 0 HB2 ASP A 30 6.083 -16.056 -12.098 1.00 23.13 H new ATOM 0 HB3 ASP A 30 4.950 -15.275 -11.013 1.00 23.13 H new ATOM 447 N SER A 31 6.543 -11.749 -10.888 1.00 51.31 N ATOM 448 CA SER A 31 6.137 -10.471 -10.333 1.00 34.44 C ATOM 449 C SER A 31 5.912 -9.440 -11.446 1.00 44.32 C ATOM 450 O SER A 31 6.229 -9.681 -12.615 1.00 13.01 O ATOM 451 CB SER A 31 7.242 -10.032 -9.374 1.00 74.23 C ATOM 452 OG SER A 31 6.792 -9.069 -8.442 1.00 71.43 O ATOM 0 H SER A 31 7.554 -11.838 -10.993 1.00 51.31 H new ATOM 0 HA SER A 31 5.189 -10.558 -9.802 1.00 34.44 H new ATOM 0 HB2 SER A 31 7.623 -10.902 -8.839 1.00 74.23 H new ATOM 0 HB3 SER A 31 8.074 -9.620 -9.946 1.00 74.23 H new ATOM 0 HG SER A 31 7.530 -8.819 -7.848 1.00 71.43 H new ATOM 457 N GLU A 32 5.436 -8.257 -11.071 1.00 4.45 N ATOM 458 CA GLU A 32 5.319 -7.057 -11.890 1.00 65.21 C ATOM 459 C GLU A 32 5.592 -5.844 -11.012 1.00 54.43 C ATOM 460 O GLU A 32 5.581 -5.948 -9.785 1.00 63.22 O ATOM 461 CB GLU A 32 3.902 -6.953 -12.488 1.00 34.42 C ATOM 462 CG GLU A 32 3.922 -7.499 -13.910 1.00 64.51 C ATOM 463 CD GLU A 32 2.595 -7.286 -14.626 1.00 73.32 C ATOM 464 OE1 GLU A 32 2.168 -6.119 -14.765 1.00 10.34 O ATOM 465 OE2 GLU A 32 1.945 -8.280 -15.030 1.00 44.04 O ATOM 0 H GLU A 32 5.099 -8.102 -10.121 1.00 4.45 H new ATOM 0 HA GLU A 32 6.038 -7.102 -12.708 1.00 65.21 H new ATOM 0 HB2 GLU A 32 3.194 -7.515 -11.879 1.00 34.42 H new ATOM 0 HB3 GLU A 32 3.569 -5.915 -12.488 1.00 34.42 H new ATOM 0 HG2 GLU A 32 4.719 -7.013 -14.473 1.00 64.51 H new ATOM 0 HG3 GLU A 32 4.153 -8.564 -13.885 1.00 64.51 H new ATOM 470 N LEU A 33 5.766 -4.675 -11.629 1.00 4.43 N ATOM 471 CA LEU A 33 5.782 -3.388 -10.987 1.00 63.43 C ATOM 472 C LEU A 33 4.834 -2.428 -11.719 1.00 21.32 C ATOM 473 O LEU A 33 4.680 -2.529 -12.942 1.00 53.02 O ATOM 474 CB LEU A 33 7.223 -2.889 -10.903 1.00 30.51 C ATOM 475 CG LEU A 33 7.850 -2.228 -12.145 1.00 32.23 C ATOM 476 CD1 LEU A 33 9.253 -1.725 -11.773 1.00 72.44 C ATOM 477 CD2 LEU A 33 7.966 -3.176 -13.343 1.00 43.21 C ATOM 0 H LEU A 33 5.905 -4.612 -12.638 1.00 4.43 H new ATOM 0 HA LEU A 33 5.411 -3.456 -9.964 1.00 63.43 H new ATOM 0 HB2 LEU A 33 7.277 -2.172 -10.084 1.00 30.51 H new ATOM 0 HB3 LEU A 33 7.851 -3.736 -10.627 1.00 30.51 H new ATOM 0 HG LEU A 33 7.192 -1.413 -12.446 1.00 32.23 H new ATOM 0 HD11 LEU A 33 9.713 -1.253 -12.642 1.00 72.44 H new ATOM 0 HD12 LEU A 33 9.176 -0.999 -10.964 1.00 72.44 H new ATOM 0 HD13 LEU A 33 9.867 -2.565 -11.449 1.00 72.44 H new ATOM 0 HD21 LEU A 33 8.415 -2.647 -14.183 1.00 43.21 H new ATOM 0 HD22 LEU A 33 8.591 -4.027 -13.074 1.00 43.21 H new ATOM 0 HD23 LEU A 33 6.974 -3.529 -13.625 1.00 43.21 H new ATOM 488 N LYS A 34 4.188 -1.519 -10.983 1.00 32.32 N ATOM 489 CA LYS A 34 3.112 -0.641 -11.449 1.00 44.33 C ATOM 490 C LYS A 34 3.301 0.771 -10.898 1.00 52.04 C ATOM 491 O LYS A 34 3.921 0.961 -9.846 1.00 5.33 O ATOM 492 CB LYS A 34 1.752 -1.184 -10.966 1.00 54.20 C ATOM 493 CG LYS A 34 0.809 -1.721 -12.045 1.00 51.24 C ATOM 494 CD LYS A 34 1.337 -2.893 -12.873 1.00 34.31 C ATOM 495 CE LYS A 34 1.387 -2.540 -14.355 1.00 54.31 C ATOM 496 NZ LYS A 34 2.347 -3.410 -15.062 1.00 52.12 N ATOM 0 H LYS A 34 4.412 -1.369 -9.999 1.00 32.32 H new ATOM 0 HA LYS A 34 3.138 -0.611 -12.538 1.00 44.33 H new ATOM 0 HB2 LYS A 34 1.939 -1.983 -10.248 1.00 54.20 H new ATOM 0 HB3 LYS A 34 1.238 -0.387 -10.429 1.00 54.20 H new ATOM 0 HG2 LYS A 34 -0.121 -2.029 -11.567 1.00 51.24 H new ATOM 0 HG3 LYS A 34 0.563 -0.904 -12.723 1.00 51.24 H new ATOM 0 HD2 LYS A 34 2.334 -3.166 -12.527 1.00 34.31 H new ATOM 0 HD3 LYS A 34 0.698 -3.764 -12.725 1.00 34.31 H new ATOM 0 HE2 LYS A 34 0.396 -2.650 -14.795 1.00 54.31 H new ATOM 0 HE3 LYS A 34 1.676 -1.496 -14.477 1.00 54.31 H new ATOM 0 HZ1 LYS A 34 2.157 -3.378 -16.084 1.00 52.12 H new ATOM 0 HZ2 LYS A 34 3.316 -3.079 -14.879 1.00 52.12 H new ATOM 0 HZ3 LYS A 34 2.246 -4.387 -14.722 1.00 52.12 H new ATOM 506 N GLU A 35 2.675 1.742 -11.560 1.00 52.20 N ATOM 507 CA GLU A 35 2.768 3.157 -11.234 1.00 30.14 C ATOM 508 C GLU A 35 1.466 3.687 -10.634 1.00 1.14 C ATOM 509 O GLU A 35 0.475 3.900 -11.332 1.00 34.25 O ATOM 510 CB GLU A 35 3.146 3.992 -12.465 1.00 30.23 C ATOM 511 CG GLU A 35 4.602 3.769 -12.884 1.00 50.44 C ATOM 512 CD GLU A 35 5.066 4.763 -13.957 1.00 30.31 C ATOM 513 OE1 GLU A 35 4.370 4.909 -14.988 1.00 10.35 O ATOM 514 OE2 GLU A 35 6.167 5.350 -13.804 1.00 44.41 O ATOM 0 H GLU A 35 2.072 1.557 -12.361 1.00 52.20 H new ATOM 0 HA GLU A 35 3.557 3.253 -10.488 1.00 30.14 H new ATOM 0 HB2 GLU A 35 2.487 3.735 -13.294 1.00 30.23 H new ATOM 0 HB3 GLU A 35 2.989 5.049 -12.249 1.00 30.23 H new ATOM 0 HG2 GLU A 35 5.246 3.858 -12.009 1.00 50.44 H new ATOM 0 HG3 GLU A 35 4.716 2.753 -13.262 1.00 50.44 H new ATOM 519 N VAL A 36 1.505 3.954 -9.334 1.00 51.40 N ATOM 520 CA VAL A 36 0.701 4.944 -8.631 1.00 50.22 C ATOM 521 C VAL A 36 1.243 6.355 -8.874 1.00 51.23 C ATOM 522 O VAL A 36 2.450 6.581 -8.758 1.00 5.35 O ATOM 523 CB VAL A 36 0.699 4.566 -7.131 1.00 23.23 C ATOM 524 CG1 VAL A 36 2.073 4.103 -6.684 1.00 45.23 C ATOM 525 CG2 VAL A 36 0.050 5.676 -6.291 1.00 52.11 C ATOM 0 H VAL A 36 2.136 3.456 -8.706 1.00 51.40 H new ATOM 0 HA VAL A 36 -0.324 4.947 -9.003 1.00 50.22 H new ATOM 0 HB VAL A 36 0.063 3.697 -6.963 1.00 23.23 H new ATOM 0 HG11 VAL A 36 2.043 3.844 -5.626 1.00 45.23 H new ATOM 0 HG12 VAL A 36 2.369 3.229 -7.264 1.00 45.23 H new ATOM 0 HG13 VAL A 36 2.796 4.904 -6.841 1.00 45.23 H new ATOM 0 HG21 VAL A 36 0.059 5.389 -5.239 1.00 52.11 H new ATOM 0 HG22 VAL A 36 0.609 6.603 -6.419 1.00 52.11 H new ATOM 0 HG23 VAL A 36 -0.979 5.825 -6.617 1.00 52.11 H new ATOM 535 N LYS A 37 0.365 7.323 -9.127 1.00 1.02 N ATOM 536 CA LYS A 37 0.653 8.751 -9.124 1.00 50.12 C ATOM 537 C LYS A 37 -0.537 9.479 -8.484 1.00 23.14 C ATOM 538 O LYS A 37 -1.495 8.820 -8.072 1.00 13.43 O ATOM 539 CB LYS A 37 1.024 9.191 -10.551 1.00 10.13 C ATOM 540 CG LYS A 37 0.132 8.685 -11.703 1.00 23.03 C ATOM 541 CD LYS A 37 0.898 8.737 -13.028 1.00 72.30 C ATOM 542 CE LYS A 37 0.016 8.196 -14.153 1.00 25.43 C ATOM 543 NZ LYS A 37 0.785 8.002 -15.391 1.00 64.20 N ATOM 0 H LYS A 37 -0.610 7.122 -9.349 1.00 1.02 H new ATOM 0 HA LYS A 37 1.520 9.012 -8.517 1.00 50.12 H new ATOM 0 HB2 LYS A 37 1.024 10.281 -10.578 1.00 10.13 H new ATOM 0 HB3 LYS A 37 2.046 8.867 -10.749 1.00 10.13 H new ATOM 0 HG2 LYS A 37 -0.191 7.664 -11.501 1.00 23.03 H new ATOM 0 HG3 LYS A 37 -0.768 9.296 -11.771 1.00 23.03 H new ATOM 0 HD2 LYS A 37 1.196 9.762 -13.247 1.00 72.30 H new ATOM 0 HD3 LYS A 37 1.812 8.148 -12.954 1.00 72.30 H new ATOM 0 HE2 LYS A 37 -0.428 7.249 -13.846 1.00 25.43 H new ATOM 0 HE3 LYS A 37 -0.806 8.888 -14.338 1.00 25.43 H new ATOM 0 HZ1 LYS A 37 0.158 7.634 -16.135 1.00 64.20 H new ATOM 0 HZ2 LYS A 37 1.188 8.911 -15.696 1.00 64.20 H new ATOM 0 HZ3 LYS A 37 1.554 7.323 -15.219 1.00 64.20 H new ATOM 553 N VAL A 38 -0.499 10.803 -8.342 1.00 11.13 N ATOM 554 CA VAL A 38 -1.603 11.586 -7.764 1.00 65.00 C ATOM 555 C VAL A 38 -2.219 12.503 -8.822 1.00 5.53 C ATOM 556 O VAL A 38 -1.681 12.621 -9.926 1.00 30.14 O ATOM 557 CB VAL A 38 -1.164 12.322 -6.479 1.00 54.14 C ATOM 558 CG1 VAL A 38 -0.919 11.317 -5.343 1.00 51.13 C ATOM 559 CG2 VAL A 38 0.080 13.200 -6.669 1.00 33.05 C ATOM 0 H VAL A 38 0.300 11.370 -8.624 1.00 11.13 H new ATOM 0 HA VAL A 38 -2.393 10.905 -7.448 1.00 65.00 H new ATOM 0 HB VAL A 38 -1.985 12.990 -6.220 1.00 54.14 H new ATOM 0 HG11 VAL A 38 -0.610 11.852 -4.445 1.00 51.13 H new ATOM 0 HG12 VAL A 38 -1.837 10.766 -5.140 1.00 51.13 H new ATOM 0 HG13 VAL A 38 -0.135 10.619 -5.637 1.00 51.13 H new ATOM 0 HG21 VAL A 38 0.330 13.686 -5.726 1.00 33.05 H new ATOM 0 HG22 VAL A 38 0.917 12.580 -6.991 1.00 33.05 H new ATOM 0 HG23 VAL A 38 -0.122 13.958 -7.425 1.00 33.05 H new ATOM 569 N SER A 39 -3.364 13.118 -8.517 1.00 4.45 N ATOM 570 CA SER A 39 -4.008 14.121 -9.357 1.00 3.24 C ATOM 571 C SER A 39 -3.440 15.510 -9.034 1.00 2.34 C ATOM 572 O SER A 39 -2.643 15.706 -8.110 1.00 63.12 O ATOM 573 CB SER A 39 -5.538 14.062 -9.163 1.00 54.31 C ATOM 574 OG SER A 39 -6.216 14.003 -10.407 1.00 63.40 O ATOM 0 H SER A 39 -3.879 12.925 -7.658 1.00 4.45 H new ATOM 0 HA SER A 39 -3.801 13.915 -10.407 1.00 3.24 H new ATOM 0 HB2 SER A 39 -5.797 13.189 -8.564 1.00 54.31 H new ATOM 0 HB3 SER A 39 -5.870 14.939 -8.607 1.00 54.31 H new ATOM 0 HG SER A 39 -7.183 13.965 -10.251 1.00 63.40 H new ATOM 579 N GLU A 40 -3.827 16.487 -9.842 1.00 41.20 N ATOM 580 CA GLU A 40 -3.609 17.908 -9.596 1.00 44.52 C ATOM 581 C GLU A 40 -4.538 18.399 -8.472 1.00 13.11 C ATOM 582 O GLU A 40 -5.290 17.616 -7.881 1.00 71.30 O ATOM 583 CB GLU A 40 -3.829 18.655 -10.919 1.00 32.01 C ATOM 584 CG GLU A 40 -5.270 18.536 -11.440 1.00 51.11 C ATOM 585 CD GLU A 40 -5.305 18.511 -12.961 1.00 3.34 C ATOM 586 OE1 GLU A 40 -4.875 17.481 -13.540 1.00 3.22 O ATOM 587 OE2 GLU A 40 -5.814 19.483 -13.562 1.00 14.43 O ATOM 0 H GLU A 40 -4.319 16.307 -10.717 1.00 41.20 H new ATOM 0 HA GLU A 40 -2.591 18.099 -9.256 1.00 44.52 H new ATOM 0 HB2 GLU A 40 -3.584 19.708 -10.781 1.00 32.01 H new ATOM 0 HB3 GLU A 40 -3.143 18.263 -11.670 1.00 32.01 H new ATOM 0 HG2 GLU A 40 -5.727 17.627 -11.048 1.00 51.11 H new ATOM 0 HG3 GLU A 40 -5.862 19.375 -11.074 1.00 51.11 H new ATOM 592 N GLY A 41 -4.506 19.702 -8.176 1.00 10.42 N ATOM 593 CA GLY A 41 -5.439 20.331 -7.251 1.00 44.42 C ATOM 594 C GLY A 41 -4.778 21.381 -6.370 1.00 44.33 C ATOM 595 O GLY A 41 -4.943 21.342 -5.147 1.00 11.43 O ATOM 0 H GLY A 41 -3.827 20.349 -8.576 1.00 10.42 H new ATOM 0 HA2 GLY A 41 -6.247 20.794 -7.817 1.00 44.42 H new ATOM 0 HA3 GLY A 41 -5.890 19.565 -6.620 1.00 44.42 H new ATOM 599 N THR A 42 -4.032 22.312 -6.961 1.00 74.30 N ATOM 600 CA THR A 42 -3.343 23.391 -6.260 1.00 43.33 C ATOM 601 C THR A 42 -3.327 24.631 -7.165 1.00 1.31 C ATOM 602 O THR A 42 -3.410 24.501 -8.391 1.00 24.41 O ATOM 603 CB THR A 42 -1.938 22.891 -5.871 1.00 24.12 C ATOM 604 OG1 THR A 42 -1.271 23.847 -5.077 1.00 70.33 O ATOM 605 CG2 THR A 42 -1.058 22.543 -7.085 1.00 62.00 C ATOM 0 H THR A 42 -3.887 22.336 -7.970 1.00 74.30 H new ATOM 0 HA THR A 42 -3.850 23.679 -5.339 1.00 43.33 H new ATOM 0 HB THR A 42 -2.095 21.973 -5.305 1.00 24.12 H new ATOM 0 HG1 THR A 42 -0.779 23.392 -4.362 1.00 70.33 H new ATOM 0 HG21 THR A 42 -0.083 22.198 -6.741 1.00 62.00 H new ATOM 0 HG22 THR A 42 -1.537 21.756 -7.668 1.00 62.00 H new ATOM 0 HG23 THR A 42 -0.930 23.429 -7.708 1.00 62.00 H new ATOM 613 N PHE A 43 -3.199 25.835 -6.599 1.00 74.34 N ATOM 614 CA PHE A 43 -2.978 27.048 -7.381 1.00 65.14 C ATOM 615 C PHE A 43 -1.464 27.186 -7.560 1.00 14.53 C ATOM 616 O PHE A 43 -0.835 28.089 -7.013 1.00 10.55 O ATOM 617 CB PHE A 43 -3.650 28.260 -6.708 1.00 41.52 C ATOM 618 CG PHE A 43 -3.945 29.427 -7.637 1.00 32.03 C ATOM 619 CD1 PHE A 43 -2.970 30.407 -7.906 1.00 41.41 C ATOM 620 CD2 PHE A 43 -5.226 29.559 -8.204 1.00 13.31 C ATOM 621 CE1 PHE A 43 -3.282 31.513 -8.720 1.00 30.43 C ATOM 622 CE2 PHE A 43 -5.547 30.672 -9.002 1.00 2.35 C ATOM 623 CZ PHE A 43 -4.575 31.655 -9.256 1.00 24.22 C ATOM 0 H PHE A 43 -3.246 25.992 -5.592 1.00 74.34 H new ATOM 0 HA PHE A 43 -3.441 26.995 -8.367 1.00 65.14 H new ATOM 0 HB2 PHE A 43 -4.584 27.932 -6.252 1.00 41.52 H new ATOM 0 HB3 PHE A 43 -3.008 28.611 -5.900 1.00 41.52 H new ATOM 0 HD1 PHE A 43 -1.980 30.310 -7.487 1.00 41.41 H new ATOM 0 HD2 PHE A 43 -5.971 28.798 -8.025 1.00 13.31 H new ATOM 0 HE1 PHE A 43 -2.526 32.254 -8.933 1.00 30.43 H new ATOM 0 HE2 PHE A 43 -6.538 30.771 -9.419 1.00 2.35 H new ATOM 0 HZ PHE A 43 -4.820 32.516 -9.860 1.00 24.22 H new ATOM 632 N ASP A 44 -0.857 26.252 -8.282 1.00 64.21 N ATOM 633 CA ASP A 44 0.516 26.342 -8.767 1.00 12.22 C ATOM 634 C ASP A 44 0.509 25.829 -10.209 1.00 21.24 C ATOM 635 O ASP A 44 -0.489 25.222 -10.613 1.00 61.12 O ATOM 636 CB ASP A 44 1.478 25.566 -7.849 1.00 74.12 C ATOM 637 CG ASP A 44 2.946 25.964 -8.033 1.00 73.11 C ATOM 638 OD1 ASP A 44 3.243 26.871 -8.847 1.00 54.12 O ATOM 639 OD2 ASP A 44 3.805 25.376 -7.336 1.00 42.42 O ATOM 0 H ASP A 44 -1.320 25.385 -8.555 1.00 64.21 H new ATOM 0 HA ASP A 44 0.882 27.369 -8.752 1.00 12.22 H new ATOM 0 HB2 ASP A 44 1.191 25.732 -6.811 1.00 74.12 H new ATOM 0 HB3 ASP A 44 1.371 24.499 -8.042 1.00 74.12 H new ATOM 643 N ALA A 45 1.571 26.101 -10.979 1.00 51.43 N ATOM 644 CA ALA A 45 1.633 26.112 -12.447 1.00 62.40 C ATOM 645 C ALA A 45 1.568 24.717 -13.092 1.00 53.41 C ATOM 646 O ALA A 45 2.466 24.314 -13.834 1.00 21.14 O ATOM 647 CB ALA A 45 2.885 26.883 -12.885 1.00 53.24 C ATOM 0 H ALA A 45 2.473 26.336 -10.564 1.00 51.43 H new ATOM 0 HA ALA A 45 0.737 26.617 -12.808 1.00 62.40 H new ATOM 0 HB1 ALA A 45 2.941 26.897 -13.973 1.00 53.24 H new ATOM 0 HB2 ALA A 45 2.832 27.905 -12.511 1.00 53.24 H new ATOM 0 HB3 ALA A 45 3.772 26.395 -12.482 1.00 53.24 H new ATOM 653 N ASP A 46 0.505 23.983 -12.794 1.00 50.32 N ATOM 654 CA ASP A 46 0.186 22.613 -13.178 1.00 33.12 C ATOM 655 C ASP A 46 1.372 21.661 -13.056 1.00 53.32 C ATOM 656 O ASP A 46 1.739 20.923 -13.971 1.00 45.44 O ATOM 657 CB ASP A 46 -0.618 22.481 -14.466 1.00 62.42 C ATOM 658 CG ASP A 46 -1.236 21.080 -14.537 1.00 61.43 C ATOM 659 OD1 ASP A 46 -1.468 20.450 -13.474 1.00 23.44 O ATOM 660 OD2 ASP A 46 -1.518 20.622 -15.673 1.00 53.31 O ATOM 0 H ASP A 46 -0.236 24.375 -12.214 1.00 50.32 H new ATOM 0 HA ASP A 46 -0.520 22.268 -12.422 1.00 33.12 H new ATOM 0 HB2 ASP A 46 -1.401 23.238 -14.498 1.00 62.42 H new ATOM 0 HB3 ASP A 46 0.026 22.651 -15.329 1.00 62.42 H new ATOM 664 N MET A 47 2.007 21.744 -11.895 1.00 1.24 N ATOM 665 CA MET A 47 3.294 21.147 -11.584 1.00 3.53 C ATOM 666 C MET A 47 3.222 20.323 -10.300 1.00 24.05 C ATOM 667 O MET A 47 4.266 19.886 -9.816 1.00 74.02 O ATOM 668 CB MET A 47 4.353 22.260 -11.540 1.00 64.01 C ATOM 669 CG MET A 47 4.086 23.325 -10.466 1.00 30.21 C ATOM 670 SD MET A 47 5.102 24.817 -10.619 1.00 63.32 S ATOM 671 CE MET A 47 6.766 24.141 -10.444 1.00 24.02 C ATOM 0 H MET A 47 1.616 22.257 -11.105 1.00 1.24 H new ATOM 0 HA MET A 47 3.584 20.440 -12.361 1.00 3.53 H new ATOM 0 HB2 MET A 47 5.330 21.812 -11.360 1.00 64.01 H new ATOM 0 HB3 MET A 47 4.399 22.744 -12.515 1.00 64.01 H new ATOM 0 HG2 MET A 47 3.035 23.610 -10.509 1.00 30.21 H new ATOM 0 HG3 MET A 47 4.257 22.884 -9.484 1.00 30.21 H new ATOM 0 HE1 MET A 47 7.490 24.956 -10.429 1.00 24.02 H new ATOM 0 HE2 MET A 47 6.834 23.578 -9.513 1.00 24.02 H new ATOM 0 HE3 MET A 47 6.981 23.481 -11.284 1.00 24.02 H new ATOM 679 N TYR A 48 2.015 20.102 -9.759 1.00 34.43 N ATOM 680 CA TYR A 48 1.728 19.438 -8.488 1.00 71.30 C ATOM 681 C TYR A 48 2.412 20.142 -7.294 1.00 43.34 C ATOM 682 O TYR A 48 3.356 20.920 -7.443 1.00 50.41 O ATOM 683 CB TYR A 48 2.051 17.928 -8.585 1.00 43.23 C ATOM 684 CG TYR A 48 1.380 17.185 -9.739 1.00 74.31 C ATOM 685 CD1 TYR A 48 1.937 17.231 -11.033 1.00 54.34 C ATOM 686 CD2 TYR A 48 0.206 16.435 -9.527 1.00 74.13 C ATOM 687 CE1 TYR A 48 1.296 16.596 -12.115 1.00 33.44 C ATOM 688 CE2 TYR A 48 -0.427 15.782 -10.603 1.00 31.25 C ATOM 689 CZ TYR A 48 0.093 15.886 -11.910 1.00 32.05 C ATOM 690 OH TYR A 48 -0.535 15.276 -12.957 1.00 22.01 O ATOM 0 H TYR A 48 1.162 20.403 -10.231 1.00 34.43 H new ATOM 0 HA TYR A 48 0.660 19.522 -8.287 1.00 71.30 H new ATOM 0 HB2 TYR A 48 3.131 17.810 -8.679 1.00 43.23 H new ATOM 0 HB3 TYR A 48 1.759 17.451 -7.650 1.00 43.23 H new ATOM 0 HD1 TYR A 48 2.865 17.759 -11.197 1.00 54.34 H new ATOM 0 HD2 TYR A 48 -0.211 16.360 -8.534 1.00 74.13 H new ATOM 0 HE1 TYR A 48 1.726 16.652 -13.104 1.00 33.44 H new ATOM 0 HE2 TYR A 48 -1.317 15.197 -10.426 1.00 31.25 H new ATOM 0 HH TYR A 48 -1.348 14.832 -12.637 1.00 22.01 H new ATOM 699 N LYS A 49 1.943 19.873 -6.072 1.00 51.30 N ATOM 700 CA LYS A 49 2.493 20.464 -4.844 1.00 31.22 C ATOM 701 C LYS A 49 2.591 19.448 -3.714 1.00 74.44 C ATOM 702 O LYS A 49 3.589 19.492 -2.996 1.00 63.44 O ATOM 703 CB LYS A 49 1.651 21.680 -4.404 1.00 10.24 C ATOM 704 CG LYS A 49 2.125 23.009 -5.032 1.00 41.32 C ATOM 705 CD LYS A 49 2.897 23.890 -4.044 1.00 14.15 C ATOM 706 CE LYS A 49 4.191 23.243 -3.529 1.00 53.20 C ATOM 707 NZ LYS A 49 5.283 23.290 -4.522 1.00 13.31 N ATOM 0 H LYS A 49 1.165 19.235 -5.904 1.00 51.30 H new ATOM 0 HA LYS A 49 3.506 20.797 -5.071 1.00 31.22 H new ATOM 0 HB2 LYS A 49 0.609 21.509 -4.675 1.00 10.24 H new ATOM 0 HB3 LYS A 49 1.688 21.765 -3.318 1.00 10.24 H new ATOM 0 HG2 LYS A 49 2.759 22.794 -5.892 1.00 41.32 H new ATOM 0 HG3 LYS A 49 1.260 23.559 -5.403 1.00 41.32 H new ATOM 0 HD2 LYS A 49 3.140 24.836 -4.527 1.00 14.15 H new ATOM 0 HD3 LYS A 49 2.253 24.121 -3.196 1.00 14.15 H new ATOM 0 HE2 LYS A 49 4.510 23.751 -2.619 1.00 53.20 H new ATOM 0 HE3 LYS A 49 3.993 22.205 -3.261 1.00 53.20 H new ATOM 0 HZ1 LYS A 49 6.133 22.841 -4.125 1.00 13.31 H new ATOM 0 HZ2 LYS A 49 4.992 22.782 -5.382 1.00 13.31 H new ATOM 0 HZ3 LYS A 49 5.494 24.280 -4.759 1.00 13.31 H new ATOM 717 N THR A 50 1.618 18.539 -3.622 1.00 21.44 N ATOM 718 CA THR A 50 1.383 17.575 -2.551 1.00 11.22 C ATOM 719 C THR A 50 2.685 16.899 -2.113 1.00 13.53 C ATOM 720 O THR A 50 3.422 16.393 -2.964 1.00 62.43 O ATOM 721 CB THR A 50 0.365 16.573 -3.130 1.00 31.03 C ATOM 722 OG1 THR A 50 -0.875 17.239 -3.328 1.00 23.33 O ATOM 723 CG2 THR A 50 0.120 15.292 -2.341 1.00 32.21 C ATOM 0 H THR A 50 0.917 18.453 -4.358 1.00 21.44 H new ATOM 0 HA THR A 50 0.998 18.048 -1.648 1.00 11.22 H new ATOM 0 HB THR A 50 0.823 16.231 -4.058 1.00 31.03 H new ATOM 0 HG1 THR A 50 -1.529 16.610 -3.698 1.00 23.33 H new ATOM 0 HG21 THR A 50 -0.617 14.680 -2.861 1.00 32.21 H new ATOM 0 HG22 THR A 50 1.054 14.737 -2.250 1.00 32.21 H new ATOM 0 HG23 THR A 50 -0.252 15.542 -1.348 1.00 32.21 H new ATOM 731 N SER A 51 2.983 16.911 -0.812 1.00 62.01 N ATOM 732 CA SER A 51 4.255 16.442 -0.272 1.00 45.24 C ATOM 733 C SER A 51 4.159 16.173 1.239 1.00 41.21 C ATOM 734 O SER A 51 3.075 16.193 1.831 1.00 64.12 O ATOM 735 CB SER A 51 5.361 17.445 -0.645 1.00 13.51 C ATOM 736 OG SER A 51 4.968 18.781 -0.400 1.00 65.42 O ATOM 0 H SER A 51 2.339 17.251 -0.098 1.00 62.01 H new ATOM 0 HA SER A 51 4.514 15.482 -0.717 1.00 45.24 H new ATOM 0 HB2 SER A 51 6.262 17.221 -0.073 1.00 13.51 H new ATOM 0 HB3 SER A 51 5.615 17.329 -1.699 1.00 13.51 H new ATOM 0 HG SER A 51 4.501 19.134 -1.186 1.00 65.42 H new ATOM 741 N ASP A 52 5.304 15.848 1.847 1.00 45.12 N ATOM 742 CA ASP A 52 5.457 15.219 3.158 1.00 4.41 C ATOM 743 C ASP A 52 5.334 16.257 4.288 1.00 70.14 C ATOM 744 O ASP A 52 6.272 16.486 5.054 1.00 4.51 O ATOM 745 CB ASP A 52 6.805 14.463 3.164 1.00 43.33 C ATOM 746 CG ASP A 52 6.802 13.250 4.103 1.00 50.40 C ATOM 747 OD1 ASP A 52 6.301 12.181 3.667 1.00 72.11 O ATOM 748 OD2 ASP A 52 7.330 13.377 5.233 1.00 74.40 O ATOM 0 H ASP A 52 6.206 16.030 1.406 1.00 45.12 H new ATOM 0 HA ASP A 52 4.657 14.503 3.343 1.00 4.41 H new ATOM 0 HB2 ASP A 52 7.035 14.132 2.151 1.00 43.33 H new ATOM 0 HB3 ASP A 52 7.599 15.147 3.464 1.00 43.33 H new ATOM 752 N ILE A 53 4.188 16.935 4.372 1.00 53.21 N ATOM 753 CA ILE A 53 3.933 18.096 5.238 1.00 1.15 C ATOM 754 C ILE A 53 4.193 17.783 6.726 1.00 51.21 C ATOM 755 O ILE A 53 4.789 18.609 7.420 1.00 31.33 O ATOM 756 CB ILE A 53 2.495 18.600 4.951 1.00 54.21 C ATOM 757 CG1 ILE A 53 2.424 19.235 3.544 1.00 73.12 C ATOM 758 CG2 ILE A 53 1.957 19.623 5.967 1.00 64.10 C ATOM 759 CD1 ILE A 53 1.103 18.935 2.844 1.00 54.42 C ATOM 0 H ILE A 53 3.373 16.681 3.814 1.00 53.21 H new ATOM 0 HA ILE A 53 4.636 18.897 5.009 1.00 1.15 H new ATOM 0 HB ILE A 53 1.866 17.713 5.028 1.00 54.21 H new ATOM 0 HG12 ILE A 53 2.553 20.314 3.627 1.00 73.12 H new ATOM 0 HG13 ILE A 53 3.248 18.862 2.936 1.00 73.12 H new ATOM 0 HG21 ILE A 53 0.946 19.918 5.686 1.00 64.10 H new ATOM 0 HG22 ILE A 53 1.941 19.175 6.961 1.00 64.10 H new ATOM 0 HG23 ILE A 53 2.602 20.501 5.975 1.00 64.10 H new ATOM 0 HD11 ILE A 53 1.099 19.402 1.859 1.00 54.42 H new ATOM 0 HD12 ILE A 53 0.985 17.857 2.735 1.00 54.42 H new ATOM 0 HD13 ILE A 53 0.279 19.332 3.437 1.00 54.42 H new ATOM 770 N ALA A 54 3.801 16.585 7.178 1.00 51.34 N ATOM 771 CA ALA A 54 3.612 16.149 8.562 1.00 4.54 C ATOM 772 C ALA A 54 2.423 16.865 9.199 1.00 51.10 C ATOM 773 O ALA A 54 2.345 18.093 9.182 1.00 61.41 O ATOM 774 CB ALA A 54 4.879 16.276 9.407 1.00 30.15 C ATOM 0 H ALA A 54 3.590 15.831 6.524 1.00 51.34 H new ATOM 0 HA ALA A 54 3.387 15.083 8.532 1.00 4.54 H new ATOM 0 HB1 ALA A 54 4.674 15.937 10.423 1.00 30.15 H new ATOM 0 HB2 ALA A 54 5.669 15.664 8.972 1.00 30.15 H new ATOM 0 HB3 ALA A 54 5.198 17.318 9.429 1.00 30.15 H new ATOM 780 N LEU A 55 1.525 16.089 9.812 1.00 65.02 N ATOM 781 CA LEU A 55 0.239 16.489 10.330 1.00 52.22 C ATOM 782 C LEU A 55 -0.596 17.307 9.327 1.00 4.23 C ATOM 783 O LEU A 55 -0.325 17.288 8.125 1.00 70.43 O ATOM 784 CB LEU A 55 0.433 17.044 11.731 1.00 4.23 C ATOM 785 CG LEU A 55 0.223 15.909 12.750 1.00 13.12 C ATOM 786 CD1 LEU A 55 0.883 16.302 14.045 1.00 62.14 C ATOM 787 CD2 LEU A 55 -1.247 15.535 13.003 1.00 50.51 C ATOM 0 H LEU A 55 1.702 15.096 9.964 1.00 65.02 H new ATOM 0 HA LEU A 55 -0.422 15.631 10.452 1.00 52.22 H new ATOM 0 HB2 LEU A 55 1.434 17.464 11.835 1.00 4.23 H new ATOM 0 HB3 LEU A 55 -0.273 17.853 11.917 1.00 4.23 H new ATOM 0 HG LEU A 55 0.674 15.015 12.320 1.00 13.12 H new ATOM 0 HD11 LEU A 55 0.744 15.509 14.780 1.00 62.14 H new ATOM 0 HD12 LEU A 55 1.949 16.459 13.877 1.00 62.14 H new ATOM 0 HD13 LEU A 55 0.435 17.223 14.417 1.00 62.14 H new ATOM 0 HD21 LEU A 55 -1.296 14.728 13.734 1.00 50.51 H new ATOM 0 HD22 LEU A 55 -1.783 16.404 13.385 1.00 50.51 H new ATOM 0 HD23 LEU A 55 -1.705 15.208 12.070 1.00 50.51 H new ATOM 798 N ASP A 56 -1.706 17.872 9.802 1.00 1.51 N ATOM 799 CA ASP A 56 -2.630 18.829 9.178 1.00 64.20 C ATOM 800 C ASP A 56 -3.245 18.433 7.833 1.00 12.23 C ATOM 801 O ASP A 56 -4.014 19.200 7.261 1.00 64.44 O ATOM 802 CB ASP A 56 -2.095 20.271 9.271 1.00 25.35 C ATOM 803 CG ASP A 56 -2.581 20.900 10.579 1.00 64.40 C ATOM 804 OD1 ASP A 56 -1.908 20.737 11.630 1.00 61.02 O ATOM 805 OD2 ASP A 56 -3.714 21.415 10.634 1.00 52.34 O ATOM 0 H ASP A 56 -2.019 17.645 10.746 1.00 1.51 H new ATOM 0 HA ASP A 56 -3.529 18.788 9.794 1.00 64.20 H new ATOM 0 HB2 ASP A 56 -1.006 20.271 9.235 1.00 25.35 H new ATOM 0 HB3 ASP A 56 -2.442 20.857 8.420 1.00 25.35 H new ATOM 809 N GLN A 57 -3.041 17.198 7.387 1.00 63.31 N ATOM 810 CA GLN A 57 -3.870 16.493 6.406 1.00 63.33 C ATOM 811 C GLN A 57 -4.275 15.119 6.965 1.00 72.42 C ATOM 812 O GLN A 57 -4.605 14.211 6.204 1.00 12.14 O ATOM 813 CB GLN A 57 -3.177 16.450 5.026 1.00 73.03 C ATOM 814 CG GLN A 57 -1.769 15.830 5.034 1.00 72.01 C ATOM 815 CD GLN A 57 -1.013 15.970 3.707 1.00 23.11 C ATOM 816 OE1 GLN A 57 -1.411 16.699 2.799 1.00 11.34 O ATOM 817 NE2 GLN A 57 0.142 15.325 3.582 1.00 52.34 N ATOM 0 H GLN A 57 -2.258 16.632 7.713 1.00 63.31 H new ATOM 0 HA GLN A 57 -4.798 17.037 6.233 1.00 63.33 H new ATOM 0 HB2 GLN A 57 -3.804 15.885 4.337 1.00 73.03 H new ATOM 0 HB3 GLN A 57 -3.110 17.466 4.636 1.00 73.03 H new ATOM 0 HG2 GLN A 57 -1.183 16.298 5.825 1.00 72.01 H new ATOM 0 HG3 GLN A 57 -1.852 14.772 5.282 1.00 72.01 H new ATOM 0 HE21 GLN A 57 0.473 14.721 4.334 1.00 52.34 H new ATOM 0 HE22 GLN A 57 0.698 15.434 2.734 1.00 52.34 H new ATOM 824 N ILE A 58 -4.205 14.936 8.298 1.00 61.02 N ATOM 825 CA ILE A 58 -4.567 13.681 8.953 1.00 74.10 C ATOM 826 C ILE A 58 -5.613 13.927 10.051 1.00 10.44 C ATOM 827 O ILE A 58 -6.809 13.746 9.822 1.00 30.45 O ATOM 828 CB ILE A 58 -3.325 12.893 9.466 1.00 64.42 C ATOM 829 CG1 ILE A 58 -2.147 12.777 8.469 1.00 52.20 C ATOM 830 CG2 ILE A 58 -3.817 11.480 9.817 1.00 44.54 C ATOM 831 CD1 ILE A 58 -1.023 13.771 8.731 1.00 72.11 C ATOM 0 H ILE A 58 -3.894 15.661 8.945 1.00 61.02 H new ATOM 0 HA ILE A 58 -5.025 13.036 8.204 1.00 74.10 H new ATOM 0 HB ILE A 58 -2.920 13.448 10.312 1.00 64.42 H new ATOM 0 HG12 ILE A 58 -1.743 11.766 8.513 1.00 52.20 H new ATOM 0 HG13 ILE A 58 -2.523 12.926 7.457 1.00 52.20 H new ATOM 0 HG21 ILE A 58 -2.981 10.884 10.183 1.00 44.54 H new ATOM 0 HG22 ILE A 58 -4.584 11.543 10.589 1.00 44.54 H new ATOM 0 HG23 ILE A 58 -4.236 11.009 8.928 1.00 44.54 H new ATOM 0 HD11 ILE A 58 -0.233 13.630 7.993 1.00 72.11 H new ATOM 0 HD12 ILE A 58 -1.411 14.787 8.657 1.00 72.11 H new ATOM 0 HD13 ILE A 58 -0.619 13.608 9.730 1.00 72.11 H new ATOM 842 N GLN A 59 -5.182 14.279 11.266 1.00 34.11 N ATOM 843 CA GLN A 59 -5.995 14.079 12.460 1.00 1.53 C ATOM 844 C GLN A 59 -7.005 15.210 12.608 1.00 25.21 C ATOM 845 O GLN A 59 -6.657 16.285 13.094 1.00 65.02 O ATOM 846 CB GLN A 59 -5.118 13.939 13.711 1.00 73.24 C ATOM 847 CG GLN A 59 -4.253 12.670 13.676 1.00 14.53 C ATOM 848 CD GLN A 59 -3.946 12.179 15.086 1.00 62.24 C ATOM 849 OE1 GLN A 59 -4.498 11.174 15.540 1.00 32.21 O ATOM 850 NE2 GLN A 59 -3.135 12.888 15.851 1.00 72.24 N ATOM 0 H GLN A 59 -4.272 14.704 11.444 1.00 34.11 H new ATOM 0 HA GLN A 59 -6.547 13.146 12.349 1.00 1.53 H new ATOM 0 HB2 GLN A 59 -4.473 14.813 13.800 1.00 73.24 H new ATOM 0 HB3 GLN A 59 -5.753 13.919 14.597 1.00 73.24 H new ATOM 0 HG2 GLN A 59 -4.770 11.888 13.119 1.00 14.53 H new ATOM 0 HG3 GLN A 59 -3.322 12.875 13.148 1.00 14.53 H new ATOM 0 HE21 GLN A 59 -2.678 13.719 15.477 1.00 72.24 H new ATOM 0 HE22 GLN A 59 -2.966 12.604 16.816 1.00 72.24 H new ATOM 857 N GLY A 60 -8.247 14.973 12.195 1.00 72.22 N ATOM 858 CA GLY A 60 -9.287 15.992 12.180 1.00 14.15 C ATOM 859 C GLY A 60 -9.258 16.837 10.907 1.00 14.35 C ATOM 860 O GLY A 60 -10.125 17.695 10.749 1.00 24.31 O ATOM 0 H GLY A 60 -8.560 14.062 11.860 1.00 72.22 H new ATOM 0 HA2 GLY A 60 -10.262 15.513 12.273 1.00 14.15 H new ATOM 0 HA3 GLY A 60 -9.167 16.642 13.047 1.00 14.15 H new ATOM 864 N ASN A 61 -8.334 16.580 9.973 1.00 64.43 N ATOM 865 CA ASN A 61 -8.395 17.072 8.599 1.00 31.32 C ATOM 866 C ASN A 61 -8.600 15.837 7.741 1.00 13.25 C ATOM 867 O ASN A 61 -7.650 15.225 7.259 1.00 42.10 O ATOM 868 CB ASN A 61 -7.173 17.937 8.229 1.00 50.43 C ATOM 869 CG ASN A 61 -7.342 19.392 8.670 1.00 52.40 C ATOM 870 OD1 ASN A 61 -8.403 19.788 9.153 1.00 42.23 O ATOM 871 ND2 ASN A 61 -6.336 20.229 8.531 1.00 30.24 N ATOM 0 H ASN A 61 -7.508 16.012 10.159 1.00 64.43 H new ATOM 0 HA ASN A 61 -9.219 17.767 8.439 1.00 31.32 H new ATOM 0 HB2 ASN A 61 -6.280 17.519 8.694 1.00 50.43 H new ATOM 0 HB3 ASN A 61 -7.017 17.901 7.151 1.00 50.43 H new ATOM 0 HD21 ASN A 61 -6.437 21.201 8.823 1.00 30.24 H new ATOM 0 HD22 ASN A 61 -5.455 19.906 8.131 1.00 30.24 H new ATOM 877 N LYS A 62 -9.858 15.394 7.672 1.00 3.32 N ATOM 878 CA LYS A 62 -10.225 14.060 7.205 1.00 2.32 C ATOM 879 C LYS A 62 -10.641 14.114 5.736 1.00 73.40 C ATOM 880 O LYS A 62 -11.707 13.619 5.362 1.00 5.13 O ATOM 881 CB LYS A 62 -11.319 13.469 8.104 1.00 43.54 C ATOM 882 CG LYS A 62 -10.856 13.179 9.539 1.00 13.15 C ATOM 883 CD LYS A 62 -12.058 12.651 10.325 1.00 33.24 C ATOM 884 CE LYS A 62 -11.720 12.344 11.788 1.00 45.50 C ATOM 885 NZ LYS A 62 -12.949 12.251 12.601 1.00 74.11 N ATOM 0 H LYS A 62 -10.660 15.963 7.944 1.00 3.32 H new ATOM 0 HA LYS A 62 -9.362 13.397 7.271 1.00 2.32 H new ATOM 0 HB2 LYS A 62 -12.161 14.160 8.137 1.00 43.54 H new ATOM 0 HB3 LYS A 62 -11.683 12.544 7.656 1.00 43.54 H new ATOM 0 HG2 LYS A 62 -10.049 12.446 9.538 1.00 13.15 H new ATOM 0 HG3 LYS A 62 -10.464 14.084 10.004 1.00 13.15 H new ATOM 0 HD2 LYS A 62 -12.862 13.386 10.289 1.00 33.24 H new ATOM 0 HD3 LYS A 62 -12.432 11.746 9.845 1.00 33.24 H new ATOM 0 HE2 LYS A 62 -11.166 11.407 11.849 1.00 45.50 H new ATOM 0 HE3 LYS A 62 -11.072 13.124 12.188 1.00 45.50 H new ATOM 0 HZ1 LYS A 62 -12.697 12.043 13.588 1.00 74.11 H new ATOM 0 HZ2 LYS A 62 -13.463 13.154 12.558 1.00 74.11 H new ATOM 0 HZ3 LYS A 62 -13.554 11.491 12.230 1.00 74.11 H new ATOM 895 N ASP A 63 -9.804 14.708 4.896 1.00 21.05 N ATOM 896 CA ASP A 63 -9.964 14.702 3.444 1.00 13.55 C ATOM 897 C ASP A 63 -8.559 14.590 2.858 1.00 22.43 C ATOM 898 O ASP A 63 -7.606 15.033 3.509 1.00 31.02 O ATOM 899 CB ASP A 63 -10.689 15.976 2.969 1.00 61.24 C ATOM 900 CG ASP A 63 -11.858 15.672 2.024 1.00 32.02 C ATOM 901 OD1 ASP A 63 -11.783 14.727 1.204 1.00 73.13 O ATOM 902 OD2 ASP A 63 -12.904 16.349 2.160 1.00 61.42 O ATOM 0 H ASP A 63 -8.978 15.218 5.209 1.00 21.05 H new ATOM 0 HA ASP A 63 -10.581 13.867 3.111 1.00 13.55 H new ATOM 0 HB2 ASP A 63 -11.060 16.523 3.836 1.00 61.24 H new ATOM 0 HB3 ASP A 63 -9.977 16.627 2.462 1.00 61.24 H new ATOM 906 N PHE A 64 -8.387 13.999 1.675 1.00 41.32 N ATOM 907 CA PHE A 64 -7.063 13.818 1.081 1.00 11.13 C ATOM 908 C PHE A 64 -7.118 13.877 -0.453 1.00 62.12 C ATOM 909 O PHE A 64 -8.207 13.770 -1.022 1.00 2.25 O ATOM 910 CB PHE A 64 -6.431 12.504 1.589 1.00 52.54 C ATOM 911 CG PHE A 64 -7.291 11.259 1.600 1.00 73.14 C ATOM 912 CD1 PHE A 64 -7.827 10.760 0.401 1.00 23.41 C ATOM 913 CD2 PHE A 64 -7.504 10.559 2.804 1.00 4.23 C ATOM 914 CE1 PHE A 64 -8.620 9.605 0.416 1.00 5.31 C ATOM 915 CE2 PHE A 64 -8.293 9.396 2.815 1.00 25.24 C ATOM 916 CZ PHE A 64 -8.863 8.928 1.618 1.00 62.53 C ATOM 0 H PHE A 64 -9.153 13.636 1.107 1.00 41.32 H new ATOM 0 HA PHE A 64 -6.425 14.644 1.397 1.00 11.13 H new ATOM 0 HB2 PHE A 64 -5.553 12.298 0.977 1.00 52.54 H new ATOM 0 HB3 PHE A 64 -6.078 12.675 2.606 1.00 52.54 H new ATOM 0 HD1 PHE A 64 -7.628 11.266 -0.532 1.00 23.41 H new ATOM 0 HD2 PHE A 64 -7.060 10.917 3.721 1.00 4.23 H new ATOM 0 HE1 PHE A 64 -9.046 9.235 -0.505 1.00 5.31 H new ATOM 0 HE2 PHE A 64 -8.461 8.864 3.740 1.00 25.24 H new ATOM 0 HZ PHE A 64 -9.488 8.047 1.625 1.00 62.53 H new ATOM 925 N PRO A 65 -5.971 14.045 -1.138 1.00 42.33 N ATOM 926 CA PRO A 65 -5.915 14.111 -2.597 1.00 62.43 C ATOM 927 C PRO A 65 -6.380 12.818 -3.277 1.00 54.22 C ATOM 928 O PRO A 65 -6.224 11.721 -2.743 1.00 5.35 O ATOM 929 CB PRO A 65 -4.447 14.407 -2.938 1.00 62.34 C ATOM 930 CG PRO A 65 -3.677 14.022 -1.682 1.00 5.11 C ATOM 931 CD PRO A 65 -4.664 14.360 -0.580 1.00 70.02 C ATOM 0 HA PRO A 65 -6.594 14.880 -2.965 1.00 62.43 H new ATOM 0 HB2 PRO A 65 -4.115 13.828 -3.800 1.00 62.34 H new ATOM 0 HB3 PRO A 65 -4.302 15.458 -3.186 1.00 62.34 H new ATOM 0 HG2 PRO A 65 -3.409 12.966 -1.677 1.00 5.11 H new ATOM 0 HG3 PRO A 65 -2.750 14.587 -1.585 1.00 5.11 H new ATOM 0 HD2 PRO A 65 -4.467 13.776 0.319 1.00 70.02 H new ATOM 0 HD3 PRO A 65 -4.597 15.411 -0.299 1.00 70.02 H new ATOM 936 N GLU A 66 -6.876 12.962 -4.510 1.00 30.34 N ATOM 937 CA GLU A 66 -7.142 11.840 -5.409 1.00 1.23 C ATOM 938 C GLU A 66 -5.844 11.147 -5.817 1.00 14.53 C ATOM 939 O GLU A 66 -4.748 11.721 -5.730 1.00 62.13 O ATOM 940 CB GLU A 66 -7.866 12.336 -6.677 1.00 71.13 C ATOM 941 CG GLU A 66 -9.386 12.175 -6.577 1.00 53.20 C ATOM 942 CD GLU A 66 -9.840 10.727 -6.789 1.00 45.42 C ATOM 943 OE1 GLU A 66 -9.044 9.785 -6.566 1.00 70.03 O ATOM 944 OE2 GLU A 66 -11.014 10.553 -7.190 1.00 61.12 O ATOM 0 H GLU A 66 -7.105 13.870 -4.914 1.00 30.34 H new ATOM 0 HA GLU A 66 -7.773 11.128 -4.877 1.00 1.23 H new ATOM 0 HB2 GLU A 66 -7.624 13.386 -6.844 1.00 71.13 H new ATOM 0 HB3 GLU A 66 -7.500 11.783 -7.542 1.00 71.13 H new ATOM 0 HG2 GLU A 66 -9.720 12.517 -5.598 1.00 53.20 H new ATOM 0 HG3 GLU A 66 -9.865 12.814 -7.318 1.00 53.20 H new ATOM 949 N ILE A 67 -5.997 9.954 -6.381 1.00 64.21 N ATOM 950 CA ILE A 67 -4.906 9.154 -6.925 1.00 2.51 C ATOM 951 C ILE A 67 -5.144 8.932 -8.418 1.00 41.30 C ATOM 952 O ILE A 67 -6.260 9.083 -8.914 1.00 44.20 O ATOM 953 CB ILE A 67 -4.741 7.832 -6.146 1.00 45.44 C ATOM 954 CG1 ILE A 67 -6.031 6.986 -6.192 1.00 73.22 C ATOM 955 CG2 ILE A 67 -4.301 8.120 -4.697 1.00 53.30 C ATOM 956 CD1 ILE A 67 -5.821 5.523 -5.803 1.00 4.32 C ATOM 0 H ILE A 67 -6.908 9.505 -6.475 1.00 64.21 H new ATOM 0 HA ILE A 67 -3.964 9.690 -6.808 1.00 2.51 H new ATOM 0 HB ILE A 67 -3.960 7.244 -6.628 1.00 45.44 H new ATOM 0 HG12 ILE A 67 -6.769 7.428 -5.523 1.00 73.22 H new ATOM 0 HG13 ILE A 67 -6.447 7.029 -7.198 1.00 73.22 H new ATOM 0 HG21 ILE A 67 -4.188 7.180 -4.157 1.00 53.30 H new ATOM 0 HG22 ILE A 67 -3.349 8.651 -4.705 1.00 53.30 H new ATOM 0 HG23 ILE A 67 -5.055 8.733 -4.203 1.00 53.30 H new ATOM 0 HD11 ILE A 67 -6.771 4.992 -5.859 1.00 4.32 H new ATOM 0 HD12 ILE A 67 -5.108 5.063 -6.487 1.00 4.32 H new ATOM 0 HD13 ILE A 67 -5.434 5.469 -4.785 1.00 4.32 H new ATOM 967 N GLN A 68 -4.095 8.545 -9.139 1.00 63.11 N ATOM 968 CA GLN A 68 -4.118 8.277 -10.567 1.00 31.54 C ATOM 969 C GLN A 68 -3.270 7.036 -10.834 1.00 30.34 C ATOM 970 O GLN A 68 -2.306 6.770 -10.111 1.00 44.22 O ATOM 971 CB GLN A 68 -3.576 9.499 -11.324 1.00 12.44 C ATOM 972 CG GLN A 68 -4.584 10.662 -11.356 1.00 62.42 C ATOM 973 CD GLN A 68 -4.234 11.723 -12.393 1.00 1.14 C ATOM 974 OE1 GLN A 68 -4.982 11.953 -13.329 1.00 4.32 O ATOM 975 NE2 GLN A 68 -3.083 12.376 -12.322 1.00 32.22 N ATOM 0 H GLN A 68 -3.173 8.405 -8.726 1.00 63.11 H new ATOM 0 HA GLN A 68 -5.135 8.093 -10.914 1.00 31.54 H new ATOM 0 HB2 GLN A 68 -2.652 9.835 -10.853 1.00 12.44 H new ATOM 0 HB3 GLN A 68 -3.326 9.210 -12.345 1.00 12.44 H new ATOM 0 HG2 GLN A 68 -5.578 10.269 -11.568 1.00 62.42 H new ATOM 0 HG3 GLN A 68 -4.628 11.125 -10.370 1.00 62.42 H new ATOM 0 HE21 GLN A 68 -2.443 12.199 -11.548 1.00 32.22 H new ATOM 0 HE22 GLN A 68 -2.837 13.056 -13.042 1.00 32.22 H new ATOM 982 N LEU A 69 -3.635 6.269 -11.858 1.00 12.35 N ATOM 983 CA LEU A 69 -2.952 5.090 -12.387 1.00 11.05 C ATOM 984 C LEU A 69 -3.572 4.778 -13.748 1.00 43.11 C ATOM 985 O LEU A 69 -4.098 5.674 -14.412 1.00 2.12 O ATOM 986 CB LEU A 69 -2.875 3.910 -11.390 1.00 33.34 C ATOM 987 CG LEU A 69 -4.058 2.943 -11.272 1.00 5.05 C ATOM 988 CD1 LEU A 69 -3.840 2.015 -10.078 1.00 3.32 C ATOM 989 CD2 LEU A 69 -5.432 3.613 -11.153 1.00 65.42 C ATOM 0 H LEU A 69 -4.486 6.472 -12.383 1.00 12.35 H new ATOM 0 HA LEU A 69 -1.892 5.297 -12.536 1.00 11.05 H new ATOM 0 HB2 LEU A 69 -1.996 3.320 -11.649 1.00 33.34 H new ATOM 0 HB3 LEU A 69 -2.697 4.330 -10.400 1.00 33.34 H new ATOM 0 HG LEU A 69 -4.080 2.390 -12.211 1.00 5.05 H new ATOM 0 HD11 LEU A 69 -4.681 1.327 -9.994 1.00 3.32 H new ATOM 0 HD12 LEU A 69 -2.920 1.448 -10.221 1.00 3.32 H new ATOM 0 HD13 LEU A 69 -3.763 2.607 -9.166 1.00 3.32 H new ATOM 0 HD21 LEU A 69 -6.204 2.848 -11.075 1.00 65.42 H new ATOM 0 HD22 LEU A 69 -5.454 4.243 -10.264 1.00 65.42 H new ATOM 0 HD23 LEU A 69 -5.616 4.225 -12.036 1.00 65.42 H new ATOM 1000 N ASP A 70 -3.343 3.573 -14.242 1.00 34.51 N ATOM 1001 CA ASP A 70 -3.895 2.998 -15.469 1.00 41.12 C ATOM 1002 C ASP A 70 -4.914 1.888 -15.154 1.00 3.41 C ATOM 1003 O ASP A 70 -5.114 1.565 -13.989 1.00 64.53 O ATOM 1004 CB ASP A 70 -2.719 2.463 -16.283 1.00 62.41 C ATOM 1005 CG ASP A 70 -2.430 3.406 -17.447 1.00 70.42 C ATOM 1006 OD1 ASP A 70 -3.143 3.352 -18.471 1.00 42.33 O ATOM 1007 OD2 ASP A 70 -1.534 4.270 -17.288 1.00 74.20 O ATOM 0 H ASP A 70 -2.722 2.919 -13.765 1.00 34.51 H new ATOM 0 HA ASP A 70 -4.436 3.754 -16.038 1.00 41.12 H new ATOM 0 HB2 ASP A 70 -1.837 2.371 -15.649 1.00 62.41 H new ATOM 0 HB3 ASP A 70 -2.947 1.465 -16.658 1.00 62.41 H new ATOM 1011 N ASN A 71 -5.565 1.256 -16.143 1.00 23.33 N ATOM 1012 CA ASN A 71 -6.457 0.132 -15.819 1.00 3.45 C ATOM 1013 C ASN A 71 -5.615 -1.117 -15.589 1.00 5.23 C ATOM 1014 O ASN A 71 -5.344 -1.909 -16.498 1.00 21.41 O ATOM 1015 CB ASN A 71 -7.561 -0.152 -16.840 1.00 70.44 C ATOM 1016 CG ASN A 71 -8.714 -0.982 -16.259 1.00 62.21 C ATOM 1017 OD1 ASN A 71 -8.538 -1.845 -15.266 1.00 63.24 O flip ATOM 1018 ND2 ASN A 71 -9.838 -0.850 -16.732 1.00 74.24 N flip ATOM 0 H ASN A 71 -5.497 1.490 -17.133 1.00 23.33 H new ATOM 0 HA ASN A 71 -6.993 0.427 -14.917 1.00 3.45 H new ATOM 0 HB2 ASN A 71 -7.954 0.793 -17.215 1.00 70.44 H new ATOM 0 HB3 ASN A 71 -7.133 -0.680 -17.692 1.00 70.44 H new ATOM 0 HD21 ASN A 71 -9.996 -0.192 -17.496 1.00 74.24 H new ATOM 0 HD22 ASN A 71 -10.615 -1.398 -16.362 1.00 74.24 H new ATOM 1024 N ILE A 72 -5.207 -1.289 -14.346 1.00 42.43 N ATOM 1025 CA ILE A 72 -4.768 -2.558 -13.789 1.00 65.13 C ATOM 1026 C ILE A 72 -6.020 -3.215 -13.214 1.00 14.15 C ATOM 1027 O ILE A 72 -6.946 -2.516 -12.791 1.00 54.11 O ATOM 1028 CB ILE A 72 -3.660 -2.300 -12.751 1.00 25.45 C ATOM 1029 CG1 ILE A 72 -2.503 -1.484 -13.387 1.00 54.30 C ATOM 1030 CG2 ILE A 72 -3.083 -3.578 -12.122 1.00 2.11 C ATOM 1031 CD1 ILE A 72 -2.205 -0.221 -12.578 1.00 30.13 C ATOM 0 H ILE A 72 -5.170 -0.524 -13.672 1.00 42.43 H new ATOM 0 HA ILE A 72 -4.325 -3.230 -14.524 1.00 65.13 H new ATOM 0 HB ILE A 72 -4.137 -1.737 -11.949 1.00 25.45 H new ATOM 0 HG12 ILE A 72 -1.607 -2.102 -13.444 1.00 54.30 H new ATOM 0 HG13 ILE A 72 -2.767 -1.211 -14.409 1.00 54.30 H new ATOM 0 HG21 ILE A 72 -2.309 -3.312 -11.402 1.00 2.11 H new ATOM 0 HG22 ILE A 72 -3.878 -4.125 -11.615 1.00 2.11 H new ATOM 0 HG23 ILE A 72 -2.652 -4.205 -12.903 1.00 2.11 H new ATOM 0 HD11 ILE A 72 -1.390 0.329 -13.049 1.00 30.13 H new ATOM 0 HD12 ILE A 72 -3.095 0.408 -12.544 1.00 30.13 H new ATOM 0 HD13 ILE A 72 -1.917 -0.498 -11.564 1.00 30.13 H new ATOM 1042 N ASP A 73 -6.065 -4.540 -13.214 1.00 63.53 N ATOM 1043 CA ASP A 73 -7.187 -5.312 -12.695 1.00 71.31 C ATOM 1044 C ASP A 73 -6.657 -6.198 -11.585 1.00 64.11 C ATOM 1045 O ASP A 73 -5.844 -7.076 -11.852 1.00 5.31 O ATOM 1046 CB ASP A 73 -7.835 -6.152 -13.798 1.00 51.02 C ATOM 1047 CG ASP A 73 -9.054 -6.924 -13.289 1.00 24.12 C ATOM 1048 OD1 ASP A 73 -9.451 -6.768 -12.114 1.00 64.12 O ATOM 1049 OD2 ASP A 73 -9.672 -7.634 -14.119 1.00 54.31 O ATOM 0 H ASP A 73 -5.310 -5.119 -13.581 1.00 63.53 H new ATOM 0 HA ASP A 73 -7.958 -4.643 -12.313 1.00 71.31 H new ATOM 0 HB2 ASP A 73 -8.135 -5.502 -14.620 1.00 51.02 H new ATOM 0 HB3 ASP A 73 -7.102 -6.853 -14.197 1.00 51.02 H new ATOM 1053 N TYR A 74 -7.048 -5.944 -10.339 1.00 30.34 N ATOM 1054 CA TYR A 74 -6.551 -6.581 -9.118 1.00 62.41 C ATOM 1055 C TYR A 74 -7.090 -8.005 -8.914 1.00 63.53 C ATOM 1056 O TYR A 74 -7.482 -8.370 -7.806 1.00 62.41 O ATOM 1057 CB TYR A 74 -6.950 -5.700 -7.933 1.00 30.15 C ATOM 1058 CG TYR A 74 -6.577 -4.232 -8.032 1.00 51.43 C ATOM 1059 CD1 TYR A 74 -5.357 -3.834 -8.614 1.00 31.43 C ATOM 1060 CD2 TYR A 74 -7.463 -3.261 -7.531 1.00 33.13 C ATOM 1061 CE1 TYR A 74 -5.055 -2.465 -8.741 1.00 21.42 C ATOM 1062 CE2 TYR A 74 -7.145 -1.896 -7.617 1.00 74.11 C ATOM 1063 CZ TYR A 74 -5.946 -1.487 -8.235 1.00 23.14 C ATOM 1064 OH TYR A 74 -5.611 -0.168 -8.303 1.00 44.13 O ATOM 0 H TYR A 74 -7.764 -5.245 -10.140 1.00 30.34 H new ATOM 0 HA TYR A 74 -5.468 -6.677 -9.202 1.00 62.41 H new ATOM 0 HB2 TYR A 74 -8.030 -5.771 -7.802 1.00 30.15 H new ATOM 0 HB3 TYR A 74 -6.492 -6.110 -7.033 1.00 30.15 H new ATOM 0 HD1 TYR A 74 -4.655 -4.578 -8.962 1.00 31.43 H new ATOM 0 HD2 TYR A 74 -8.394 -3.567 -7.077 1.00 33.13 H new ATOM 0 HE1 TYR A 74 -4.140 -2.159 -9.226 1.00 21.42 H new ATOM 0 HE2 TYR A 74 -7.820 -1.158 -7.209 1.00 74.11 H new ATOM 0 HH TYR A 74 -6.382 0.379 -8.046 1.00 44.13 H new ATOM 1073 N ASN A 75 -7.215 -8.798 -9.971 1.00 43.00 N ATOM 1074 CA ASN A 75 -7.697 -10.184 -9.914 1.00 34.45 C ATOM 1075 C ASN A 75 -6.746 -11.217 -10.514 1.00 41.01 C ATOM 1076 O ASN A 75 -6.921 -12.407 -10.258 1.00 70.23 O ATOM 1077 CB ASN A 75 -9.098 -10.271 -10.551 1.00 13.12 C ATOM 1078 CG ASN A 75 -10.224 -10.141 -9.528 1.00 22.44 C ATOM 1079 OD1 ASN A 75 -11.230 -10.846 -9.587 1.00 63.24 O ATOM 1080 ND2 ASN A 75 -10.080 -9.256 -8.558 1.00 32.43 N ATOM 0 H ASN A 75 -6.980 -8.494 -10.916 1.00 43.00 H new ATOM 0 HA ASN A 75 -7.750 -10.448 -8.858 1.00 34.45 H new ATOM 0 HB2 ASN A 75 -9.201 -9.485 -11.299 1.00 13.12 H new ATOM 0 HB3 ASN A 75 -9.196 -11.223 -11.073 1.00 13.12 H new ATOM 0 HD21 ASN A 75 -10.807 -9.153 -7.850 1.00 32.43 H new ATOM 0 HD22 ASN A 75 -9.242 -8.676 -8.517 1.00 32.43 H new ATOM 1086 N ASN A 76 -5.722 -10.791 -11.245 1.00 31.13 N ATOM 1087 CA ASN A 76 -4.754 -11.651 -11.912 1.00 33.32 C ATOM 1088 C ASN A 76 -3.395 -11.721 -11.196 1.00 10.21 C ATOM 1089 O ASN A 76 -2.481 -12.354 -11.729 1.00 64.53 O ATOM 1090 CB ASN A 76 -4.611 -11.198 -13.368 1.00 13.15 C ATOM 1091 CG ASN A 76 -4.134 -9.759 -13.471 1.00 52.33 C ATOM 1092 OD1 ASN A 76 -3.035 -9.418 -13.053 1.00 73.14 O ATOM 1093 ND2 ASN A 76 -4.952 -8.871 -13.998 1.00 5.24 N ATOM 0 H ASN A 76 -5.537 -9.799 -11.394 1.00 31.13 H new ATOM 0 HA ASN A 76 -5.134 -12.672 -11.879 1.00 33.32 H new ATOM 0 HB2 ASN A 76 -3.907 -11.851 -13.884 1.00 13.15 H new ATOM 0 HB3 ASN A 76 -5.570 -11.299 -13.875 1.00 13.15 H new ATOM 0 HD21 ASN A 76 -4.671 -7.892 -14.060 1.00 5.24 H new ATOM 0 HD22 ASN A 76 -5.866 -9.162 -14.344 1.00 5.24 H new ATOM 1099 N TYR A 77 -3.252 -11.135 -10.002 1.00 25.23 N ATOM 1100 CA TYR A 77 -2.116 -11.353 -9.104 1.00 23.22 C ATOM 1101 C TYR A 77 -2.658 -11.944 -7.805 1.00 31.32 C ATOM 1102 O TYR A 77 -3.816 -11.705 -7.464 1.00 73.20 O ATOM 1103 CB TYR A 77 -1.332 -10.055 -8.804 1.00 32.21 C ATOM 1104 CG TYR A 77 -0.902 -9.249 -10.017 1.00 25.15 C ATOM 1105 CD1 TYR A 77 0.027 -9.768 -10.936 1.00 72.14 C ATOM 1106 CD2 TYR A 77 -1.479 -7.993 -10.259 1.00 12.22 C ATOM 1107 CE1 TYR A 77 0.282 -9.105 -12.147 1.00 71.41 C ATOM 1108 CE2 TYR A 77 -1.264 -7.335 -11.481 1.00 51.00 C ATOM 1109 CZ TYR A 77 -0.406 -7.909 -12.442 1.00 45.13 C ATOM 1110 OH TYR A 77 -0.260 -7.316 -13.651 1.00 33.45 O ATOM 0 H TYR A 77 -3.939 -10.482 -9.626 1.00 25.23 H new ATOM 0 HA TYR A 77 -1.414 -12.030 -9.590 1.00 23.22 H new ATOM 0 HB2 TYR A 77 -1.948 -9.419 -8.168 1.00 32.21 H new ATOM 0 HB3 TYR A 77 -0.443 -10.314 -8.229 1.00 32.21 H new ATOM 0 HD1 TYR A 77 0.549 -10.685 -10.708 1.00 72.14 H new ATOM 0 HD2 TYR A 77 -2.092 -7.529 -9.501 1.00 12.22 H new ATOM 0 HE1 TYR A 77 0.999 -9.507 -12.847 1.00 71.41 H new ATOM 0 HE2 TYR A 77 -1.753 -6.394 -11.684 1.00 51.00 H new ATOM 0 HH TYR A 77 0.252 -7.905 -14.244 1.00 33.45 H new ATOM 1119 N ASP A 78 -1.819 -12.670 -7.062 1.00 21.52 N ATOM 1120 CA ASP A 78 -2.201 -13.251 -5.762 1.00 41.00 C ATOM 1121 C ASP A 78 -1.468 -12.584 -4.591 1.00 52.21 C ATOM 1122 O ASP A 78 -1.757 -12.873 -3.432 1.00 72.53 O ATOM 1123 CB ASP A 78 -1.946 -14.766 -5.780 1.00 3.15 C ATOM 1124 CG ASP A 78 -2.833 -15.536 -4.795 1.00 10.21 C ATOM 1125 OD1 ASP A 78 -4.079 -15.561 -4.993 1.00 44.21 O ATOM 1126 OD2 ASP A 78 -2.298 -16.245 -3.918 1.00 33.15 O ATOM 0 H ASP A 78 -0.859 -12.874 -7.339 1.00 21.52 H new ATOM 0 HA ASP A 78 -3.264 -13.066 -5.609 1.00 41.00 H new ATOM 0 HB2 ASP A 78 -2.117 -15.145 -6.787 1.00 3.15 H new ATOM 0 HB3 ASP A 78 -0.899 -14.955 -5.542 1.00 3.15 H new ATOM 1130 N LEU A 79 -0.524 -11.680 -4.873 1.00 42.11 N ATOM 1131 CA LEU A 79 0.319 -10.988 -3.904 1.00 32.33 C ATOM 1132 C LEU A 79 0.520 -9.554 -4.393 1.00 73.23 C ATOM 1133 O LEU A 79 0.841 -9.355 -5.565 1.00 45.24 O ATOM 1134 CB LEU A 79 1.677 -11.712 -3.805 1.00 54.20 C ATOM 1135 CG LEU A 79 1.955 -12.317 -2.423 1.00 73.44 C ATOM 1136 CD1 LEU A 79 3.213 -13.176 -2.540 1.00 23.35 C ATOM 1137 CD2 LEU A 79 2.180 -11.225 -1.365 1.00 42.00 C ATOM 0 H LEU A 79 -0.320 -11.400 -5.833 1.00 42.11 H new ATOM 0 HA LEU A 79 -0.146 -10.982 -2.918 1.00 32.33 H new ATOM 0 HB2 LEU A 79 1.711 -12.505 -4.552 1.00 54.20 H new ATOM 0 HB3 LEU A 79 2.472 -11.008 -4.050 1.00 54.20 H new ATOM 0 HG LEU A 79 1.095 -12.908 -2.108 1.00 73.44 H new ATOM 0 HD11 LEU A 79 3.440 -13.623 -1.572 1.00 23.35 H new ATOM 0 HD12 LEU A 79 3.048 -13.965 -3.274 1.00 23.35 H new ATOM 0 HD13 LEU A 79 4.050 -12.554 -2.858 1.00 23.35 H new ATOM 0 HD21 LEU A 79 2.374 -11.690 -0.398 1.00 42.00 H new ATOM 0 HD22 LEU A 79 3.035 -10.612 -1.651 1.00 42.00 H new ATOM 0 HD23 LEU A 79 1.291 -10.598 -1.294 1.00 42.00 H new ATOM 1148 N ILE A 80 0.353 -8.545 -3.533 1.00 25.33 N ATOM 1149 CA ILE A 80 0.485 -7.138 -3.909 1.00 31.12 C ATOM 1150 C ILE A 80 1.315 -6.433 -2.828 1.00 11.24 C ATOM 1151 O ILE A 80 0.941 -6.392 -1.655 1.00 24.42 O ATOM 1152 CB ILE A 80 -0.903 -6.513 -4.220 1.00 31.12 C ATOM 1153 CG1 ILE A 80 -1.517 -7.232 -5.454 1.00 52.30 C ATOM 1154 CG2 ILE A 80 -0.765 -5.003 -4.487 1.00 32.31 C ATOM 1155 CD1 ILE A 80 -2.771 -6.610 -6.094 1.00 64.43 C ATOM 0 H ILE A 80 0.121 -8.685 -2.550 1.00 25.33 H new ATOM 0 HA ILE A 80 1.029 -7.015 -4.845 1.00 31.12 H new ATOM 0 HB ILE A 80 -1.561 -6.643 -3.361 1.00 31.12 H new ATOM 0 HG12 ILE A 80 -0.746 -7.298 -6.222 1.00 52.30 H new ATOM 0 HG13 ILE A 80 -1.762 -8.253 -5.160 1.00 52.30 H new ATOM 0 HG21 ILE A 80 -1.746 -4.581 -4.703 1.00 32.31 H new ATOM 0 HG22 ILE A 80 -0.346 -4.515 -3.607 1.00 32.31 H new ATOM 0 HG23 ILE A 80 -0.105 -4.843 -5.340 1.00 32.31 H new ATOM 0 HD11 ILE A 80 -3.086 -7.218 -6.942 1.00 64.43 H new ATOM 0 HD12 ILE A 80 -3.574 -6.570 -5.358 1.00 64.43 H new ATOM 0 HD13 ILE A 80 -2.542 -5.601 -6.436 1.00 64.43 H new ATOM 1166 N LEU A 81 2.482 -5.920 -3.224 1.00 3.33 N ATOM 1167 CA LEU A 81 3.460 -5.228 -2.389 1.00 41.30 C ATOM 1168 C LEU A 81 3.325 -3.727 -2.630 1.00 73.40 C ATOM 1169 O LEU A 81 3.177 -3.300 -3.778 1.00 71.12 O ATOM 1170 CB LEU A 81 4.882 -5.683 -2.774 1.00 11.02 C ATOM 1171 CG LEU A 81 5.143 -7.184 -2.548 1.00 23.25 C ATOM 1172 CD1 LEU A 81 6.446 -7.624 -3.220 1.00 12.01 C ATOM 1173 CD2 LEU A 81 5.195 -7.487 -1.053 1.00 61.22 C ATOM 0 H LEU A 81 2.786 -5.982 -4.196 1.00 3.33 H new ATOM 0 HA LEU A 81 3.284 -5.458 -1.338 1.00 41.30 H new ATOM 0 HB2 LEU A 81 5.055 -5.449 -3.824 1.00 11.02 H new ATOM 0 HB3 LEU A 81 5.605 -5.108 -2.196 1.00 11.02 H new ATOM 0 HG LEU A 81 4.323 -7.743 -2.999 1.00 23.25 H new ATOM 0 HD11 LEU A 81 6.605 -8.688 -3.044 1.00 12.01 H new ATOM 0 HD12 LEU A 81 6.383 -7.439 -4.292 1.00 12.01 H new ATOM 0 HD13 LEU A 81 7.279 -7.059 -2.803 1.00 12.01 H new ATOM 0 HD21 LEU A 81 5.380 -8.551 -0.904 1.00 61.22 H new ATOM 0 HD22 LEU A 81 5.998 -6.911 -0.593 1.00 61.22 H new ATOM 0 HD23 LEU A 81 4.244 -7.216 -0.594 1.00 61.22 H new ATOM 1184 N ILE A 82 3.389 -2.913 -1.570 1.00 12.14 N ATOM 1185 CA ILE A 82 3.046 -1.491 -1.641 1.00 2.35 C ATOM 1186 C ILE A 82 4.086 -0.641 -0.894 1.00 50.24 C ATOM 1187 O ILE A 82 4.206 -0.756 0.327 1.00 45.14 O ATOM 1188 CB ILE A 82 1.620 -1.257 -1.081 1.00 21.45 C ATOM 1189 CG1 ILE A 82 0.569 -2.304 -1.526 1.00 62.50 C ATOM 1190 CG2 ILE A 82 1.184 0.145 -1.528 1.00 14.23 C ATOM 1191 CD1 ILE A 82 -0.789 -2.124 -0.840 1.00 62.51 C ATOM 0 H ILE A 82 3.679 -3.222 -0.642 1.00 12.14 H new ATOM 0 HA ILE A 82 3.057 -1.180 -2.686 1.00 2.35 H new ATOM 0 HB ILE A 82 1.669 -1.357 0.003 1.00 21.45 H new ATOM 0 HG12 ILE A 82 0.435 -2.239 -2.606 1.00 62.50 H new ATOM 0 HG13 ILE A 82 0.948 -3.303 -1.312 1.00 62.50 H new ATOM 0 HG21 ILE A 82 0.181 0.351 -1.153 1.00 14.23 H new ATOM 0 HG22 ILE A 82 1.879 0.886 -1.132 1.00 14.23 H new ATOM 0 HG23 ILE A 82 1.182 0.196 -2.617 1.00 14.23 H new ATOM 0 HD11 ILE A 82 -1.480 -2.888 -1.195 1.00 62.51 H new ATOM 0 HD12 ILE A 82 -0.667 -2.218 0.239 1.00 62.51 H new ATOM 0 HD13 ILE A 82 -1.187 -1.137 -1.075 1.00 62.51 H new ATOM 1202 N GLY A 83 4.805 0.253 -1.580 1.00 11.21 N ATOM 1203 CA GLY A 83 5.808 1.141 -0.983 1.00 10.15 C ATOM 1204 C GLY A 83 5.374 2.608 -0.999 1.00 41.24 C ATOM 1205 O GLY A 83 4.672 3.034 -1.920 1.00 70.12 O ATOM 0 H GLY A 83 4.704 0.382 -2.587 1.00 11.21 H new ATOM 0 HA2 GLY A 83 5.996 0.832 0.045 1.00 10.15 H new ATOM 0 HA3 GLY A 83 6.749 1.038 -1.524 1.00 10.15 H new ATOM 1209 N SER A 84 5.792 3.382 0.007 1.00 63.54 N ATOM 1210 CA SER A 84 5.473 4.792 0.245 1.00 14.31 C ATOM 1211 C SER A 84 6.363 5.272 1.418 1.00 21.11 C ATOM 1212 O SER A 84 6.680 4.451 2.288 1.00 14.34 O ATOM 1213 CB SER A 84 3.968 4.898 0.576 1.00 3.25 C ATOM 1214 OG SER A 84 3.536 6.230 0.746 1.00 34.04 O ATOM 0 H SER A 84 6.408 3.011 0.730 1.00 63.54 H new ATOM 0 HA SER A 84 5.669 5.419 -0.625 1.00 14.31 H new ATOM 0 HB2 SER A 84 3.392 4.434 -0.224 1.00 3.25 H new ATOM 0 HB3 SER A 84 3.761 4.335 1.486 1.00 3.25 H new ATOM 0 HG SER A 84 2.578 6.239 0.952 1.00 34.04 H new ATOM 1219 N PRO A 85 6.759 6.557 1.507 1.00 65.34 N ATOM 1220 CA PRO A 85 7.566 7.077 2.615 1.00 34.45 C ATOM 1221 C PRO A 85 6.766 7.240 3.914 1.00 74.21 C ATOM 1222 O PRO A 85 5.537 7.141 3.921 1.00 71.41 O ATOM 1223 CB PRO A 85 8.093 8.427 2.119 1.00 12.43 C ATOM 1224 CG PRO A 85 7.001 8.896 1.161 1.00 65.32 C ATOM 1225 CD PRO A 85 6.510 7.600 0.525 1.00 52.23 C ATOM 0 HA PRO A 85 8.366 6.382 2.871 1.00 34.45 H new ATOM 0 HB2 PRO A 85 8.237 9.129 2.940 1.00 12.43 H new ATOM 0 HB3 PRO A 85 9.054 8.324 1.615 1.00 12.43 H new ATOM 0 HG2 PRO A 85 6.200 9.414 1.688 1.00 65.32 H new ATOM 0 HG3 PRO A 85 7.391 9.588 0.414 1.00 65.32 H new ATOM 0 HD2 PRO A 85 5.450 7.662 0.281 1.00 52.23 H new ATOM 0 HD3 PRO A 85 7.040 7.396 -0.405 1.00 52.23 H new ATOM 1230 N VAL A 86 7.457 7.563 5.008 1.00 63.12 N ATOM 1231 CA VAL A 86 6.912 7.952 6.308 1.00 2.12 C ATOM 1232 C VAL A 86 7.889 8.972 6.861 1.00 73.23 C ATOM 1233 O VAL A 86 9.090 8.859 6.615 1.00 64.00 O ATOM 1234 CB VAL A 86 6.882 6.795 7.335 1.00 44.53 C ATOM 1235 CG1 VAL A 86 5.819 7.044 8.418 1.00 50.52 C ATOM 1236 CG2 VAL A 86 6.680 5.443 6.675 1.00 65.34 C ATOM 0 H VAL A 86 8.477 7.559 5.009 1.00 63.12 H new ATOM 0 HA VAL A 86 5.890 8.302 6.165 1.00 2.12 H new ATOM 0 HB VAL A 86 7.861 6.772 7.814 1.00 44.53 H new ATOM 0 HG11 VAL A 86 5.820 6.215 9.126 1.00 50.52 H new ATOM 0 HG12 VAL A 86 6.046 7.971 8.944 1.00 50.52 H new ATOM 0 HG13 VAL A 86 4.837 7.122 7.952 1.00 50.52 H new ATOM 0 HG21 VAL A 86 6.666 4.664 7.438 1.00 65.34 H new ATOM 0 HG22 VAL A 86 5.733 5.439 6.135 1.00 65.34 H new ATOM 0 HG23 VAL A 86 7.496 5.253 5.977 1.00 65.34 H new ATOM 1246 N TRP A 87 7.419 9.866 7.723 1.00 23.41 N ATOM 1247 CA TRP A 87 8.341 10.589 8.588 1.00 1.42 C ATOM 1248 C TRP A 87 7.746 10.885 9.930 1.00 64.03 C ATOM 1249 O TRP A 87 8.402 10.682 10.950 1.00 11.42 O ATOM 1250 CB TRP A 87 8.810 11.818 7.815 1.00 63.00 C ATOM 1251 CG TRP A 87 10.133 12.405 8.202 1.00 1.23 C ATOM 1252 CD1 TRP A 87 11.225 12.382 7.408 1.00 25.34 C ATOM 1253 CD2 TRP A 87 10.515 13.186 9.381 1.00 43.50 C ATOM 1254 NE1 TRP A 87 12.245 13.085 8.008 1.00 43.32 N ATOM 1255 CE2 TRP A 87 11.865 13.617 9.216 1.00 70.33 C ATOM 1256 CE3 TRP A 87 9.859 13.622 10.552 1.00 64.41 C ATOM 1257 CZ2 TRP A 87 12.517 14.450 10.139 1.00 73.44 C ATOM 1258 CZ3 TRP A 87 10.499 14.455 11.490 1.00 34.12 C ATOM 1259 CH2 TRP A 87 11.822 14.880 11.282 1.00 11.32 C ATOM 0 H TRP A 87 6.434 10.103 7.840 1.00 23.41 H new ATOM 0 HA TRP A 87 9.211 9.980 8.834 1.00 1.42 H new ATOM 0 HB2 TRP A 87 8.852 11.556 6.758 1.00 63.00 H new ATOM 0 HB3 TRP A 87 8.052 12.594 7.921 1.00 63.00 H new ATOM 0 HD1 TRP A 87 11.288 11.888 6.450 1.00 25.34 H new ATOM 0 HE1 TRP A 87 13.174 13.198 7.603 1.00 43.32 H new ATOM 0 HE3 TRP A 87 8.841 13.309 10.733 1.00 64.41 H new ATOM 0 HZ2 TRP A 87 13.539 14.756 9.973 1.00 73.44 H new ATOM 0 HZ3 TRP A 87 9.969 14.770 12.377 1.00 34.12 H new ATOM 0 HH2 TRP A 87 12.302 15.533 11.996 1.00 11.32 H new ATOM 1269 N SER A 88 6.453 11.163 9.913 1.00 34.14 N ATOM 1270 CA SER A 88 5.720 11.607 11.080 1.00 13.22 C ATOM 1271 C SER A 88 4.519 10.699 11.349 1.00 10.25 C ATOM 1272 O SER A 88 3.455 11.138 11.788 1.00 1.44 O ATOM 1273 CB SER A 88 5.330 13.076 10.886 1.00 62.32 C ATOM 1274 OG SER A 88 6.454 13.802 10.446 1.00 62.32 O ATOM 0 H SER A 88 5.878 11.084 9.074 1.00 34.14 H new ATOM 0 HA SER A 88 6.347 11.538 11.969 1.00 13.22 H new ATOM 0 HB2 SER A 88 4.523 13.157 10.158 1.00 62.32 H new ATOM 0 HB3 SER A 88 4.958 13.492 11.822 1.00 62.32 H new ATOM 0 HG SER A 88 6.473 14.676 10.889 1.00 62.32 H new ATOM 1279 N GLY A 89 4.655 9.420 11.004 1.00 53.31 N ATOM 1280 CA GLY A 89 3.640 8.412 11.241 1.00 33.45 C ATOM 1281 C GLY A 89 2.726 8.234 10.039 1.00 70.33 C ATOM 1282 O GLY A 89 2.465 7.088 9.694 1.00 4.53 O ATOM 0 H GLY A 89 5.490 9.056 10.545 1.00 53.31 H new ATOM 0 HA2 GLY A 89 4.120 7.462 11.476 1.00 33.45 H new ATOM 0 HA3 GLY A 89 3.046 8.693 12.111 1.00 33.45 H new ATOM 1286 N TYR A 90 2.239 9.309 9.411 1.00 14.15 N ATOM 1287 CA TYR A 90 1.408 9.232 8.206 1.00 10.25 C ATOM 1288 C TYR A 90 1.398 10.526 7.350 1.00 12.33 C ATOM 1289 O TYR A 90 0.326 11.051 7.057 1.00 30.11 O ATOM 1290 CB TYR A 90 -0.010 8.744 8.588 1.00 43.52 C ATOM 1291 CG TYR A 90 -0.628 9.162 9.922 1.00 10.32 C ATOM 1292 CD1 TYR A 90 -0.320 10.377 10.576 1.00 42.14 C ATOM 1293 CD2 TYR A 90 -1.513 8.261 10.540 1.00 5.14 C ATOM 1294 CE1 TYR A 90 -0.835 10.646 11.860 1.00 23.23 C ATOM 1295 CE2 TYR A 90 -2.022 8.514 11.819 1.00 61.20 C ATOM 1296 CZ TYR A 90 -1.681 9.706 12.493 1.00 30.12 C ATOM 1297 OH TYR A 90 -2.188 9.955 13.732 1.00 10.54 O ATOM 0 H TYR A 90 2.412 10.263 9.727 1.00 14.15 H new ATOM 0 HA TYR A 90 1.865 8.498 7.542 1.00 10.25 H new ATOM 0 HB2 TYR A 90 -0.689 9.070 7.800 1.00 43.52 H new ATOM 0 HB3 TYR A 90 0.005 7.654 8.565 1.00 43.52 H new ATOM 0 HD1 TYR A 90 0.314 11.103 10.089 1.00 42.14 H new ATOM 0 HD2 TYR A 90 -1.804 7.360 10.020 1.00 5.14 H new ATOM 0 HE1 TYR A 90 -0.584 11.570 12.360 1.00 23.23 H new ATOM 0 HE2 TYR A 90 -2.677 7.796 12.291 1.00 61.20 H new ATOM 0 HH TYR A 90 -2.749 9.203 14.013 1.00 10.54 H new ATOM 1306 N PRO A 91 2.553 11.073 6.915 1.00 5.32 N ATOM 1307 CA PRO A 91 2.578 12.277 6.082 1.00 5.15 C ATOM 1308 C PRO A 91 2.125 12.120 4.607 1.00 43.53 C ATOM 1309 O PRO A 91 2.254 13.094 3.859 1.00 31.35 O ATOM 1310 CB PRO A 91 3.989 12.860 6.218 1.00 12.42 C ATOM 1311 CG PRO A 91 4.865 11.709 6.689 1.00 25.25 C ATOM 1312 CD PRO A 91 3.903 10.712 7.332 1.00 63.23 C ATOM 0 HA PRO A 91 1.811 12.958 6.450 1.00 5.15 H new ATOM 0 HB2 PRO A 91 4.342 13.257 5.266 1.00 12.42 H new ATOM 0 HB3 PRO A 91 4.006 13.683 6.933 1.00 12.42 H new ATOM 0 HG2 PRO A 91 5.402 11.256 5.856 1.00 25.25 H new ATOM 0 HG3 PRO A 91 5.614 12.051 7.403 1.00 25.25 H new ATOM 0 HD2 PRO A 91 4.141 9.695 7.021 1.00 63.23 H new ATOM 0 HD3 PRO A 91 3.990 10.742 8.418 1.00 63.23 H new ATOM 1317 N ALA A 92 1.623 10.963 4.137 1.00 44.44 N ATOM 1318 CA ALA A 92 1.083 10.796 2.787 1.00 65.01 C ATOM 1319 C ALA A 92 -0.191 9.942 2.859 1.00 4.55 C ATOM 1320 O ALA A 92 -0.331 9.135 3.783 1.00 3.14 O ATOM 1321 CB ALA A 92 2.146 10.133 1.887 1.00 62.30 C ATOM 0 H ALA A 92 1.583 10.111 4.696 1.00 44.44 H new ATOM 0 HA ALA A 92 0.829 11.765 2.358 1.00 65.01 H new ATOM 0 HB1 ALA A 92 1.745 10.008 0.881 1.00 62.30 H new ATOM 0 HB2 ALA A 92 3.034 10.764 1.848 1.00 62.30 H new ATOM 0 HB3 ALA A 92 2.411 9.158 2.295 1.00 62.30 H new ATOM 1327 N THR A 93 -1.055 10.033 1.843 1.00 53.11 N ATOM 1328 CA THR A 93 -2.211 9.153 1.630 1.00 12.33 C ATOM 1329 C THR A 93 -2.325 8.710 0.155 1.00 11.51 C ATOM 1330 O THR A 93 -3.410 8.764 -0.424 1.00 54.22 O ATOM 1331 CB THR A 93 -3.494 9.908 2.047 1.00 43.40 C ATOM 1332 OG1 THR A 93 -3.423 11.250 1.604 1.00 22.05 O ATOM 1333 CG2 THR A 93 -3.736 9.898 3.544 1.00 5.53 C ATOM 0 H THR A 93 -0.966 10.747 1.120 1.00 53.11 H new ATOM 0 HA THR A 93 -2.081 8.256 2.235 1.00 12.33 H new ATOM 0 HB THR A 93 -4.327 9.384 1.579 1.00 43.40 H new ATOM 0 HG1 THR A 93 -3.371 11.269 0.626 1.00 22.05 H new ATOM 0 HG21 THR A 93 -4.652 10.445 3.768 1.00 5.53 H new ATOM 0 HG22 THR A 93 -3.834 8.869 3.890 1.00 5.53 H new ATOM 0 HG23 THR A 93 -2.896 10.373 4.051 1.00 5.53 H new ATOM 1341 N PRO A 94 -1.278 8.149 -0.470 1.00 4.53 N ATOM 1342 CA PRO A 94 -1.458 7.355 -1.680 1.00 31.15 C ATOM 1343 C PRO A 94 -2.136 6.042 -1.278 1.00 21.53 C ATOM 1344 O PRO A 94 -3.130 5.622 -1.878 1.00 45.24 O ATOM 1345 CB PRO A 94 -0.045 7.177 -2.260 1.00 30.03 C ATOM 1346 CG PRO A 94 0.859 7.287 -1.025 1.00 51.53 C ATOM 1347 CD PRO A 94 0.127 8.260 -0.123 1.00 23.24 C ATOM 0 HA PRO A 94 -2.094 7.810 -2.439 1.00 31.15 H new ATOM 0 HB2 PRO A 94 0.068 6.213 -2.757 1.00 30.03 H new ATOM 0 HB3 PRO A 94 0.187 7.945 -2.998 1.00 30.03 H new ATOM 0 HG2 PRO A 94 0.995 6.319 -0.542 1.00 51.53 H new ATOM 0 HG3 PRO A 94 1.851 7.654 -1.287 1.00 51.53 H new ATOM 0 HD2 PRO A 94 0.290 8.017 0.927 1.00 23.24 H new ATOM 0 HD3 PRO A 94 0.487 9.278 -0.274 1.00 23.24 H new ATOM 1352 N ILE A 95 -1.666 5.421 -0.189 1.00 21.32 N ATOM 1353 CA ILE A 95 -2.205 4.165 0.294 1.00 1.34 C ATOM 1354 C ILE A 95 -3.349 4.551 1.238 1.00 63.34 C ATOM 1355 O ILE A 95 -3.255 4.481 2.467 1.00 2.24 O ATOM 1356 CB ILE A 95 -1.134 3.274 0.963 1.00 34.22 C ATOM 1357 CG1 ILE A 95 0.339 3.516 0.553 1.00 54.00 C ATOM 1358 CG2 ILE A 95 -1.527 1.807 0.708 1.00 23.14 C ATOM 1359 CD1 ILE A 95 0.670 3.490 -0.940 1.00 63.50 C ATOM 0 H ILE A 95 -0.899 5.785 0.376 1.00 21.32 H new ATOM 0 HA ILE A 95 -2.569 3.545 -0.525 1.00 1.34 H new ATOM 0 HB ILE A 95 -1.138 3.543 2.019 1.00 34.22 H new ATOM 0 HG12 ILE A 95 0.643 4.485 0.948 1.00 54.00 H new ATOM 0 HG13 ILE A 95 0.954 2.763 1.047 1.00 54.00 H new ATOM 0 HG21 ILE A 95 -0.791 1.148 1.168 1.00 23.14 H new ATOM 0 HG22 ILE A 95 -2.508 1.613 1.141 1.00 23.14 H new ATOM 0 HG23 ILE A 95 -1.561 1.621 -0.365 1.00 23.14 H new ATOM 0 HD11 ILE A 95 1.735 3.674 -1.080 1.00 63.50 H new ATOM 0 HD12 ILE A 95 0.413 2.514 -1.353 1.00 63.50 H new ATOM 0 HD13 ILE A 95 0.098 4.263 -1.453 1.00 63.50 H new ATOM 1370 N LYS A 96 -4.423 5.043 0.645 1.00 53.12 N ATOM 1371 CA LYS A 96 -5.714 5.215 1.294 1.00 62.13 C ATOM 1372 C LYS A 96 -6.794 4.999 0.253 1.00 73.10 C ATOM 1373 O LYS A 96 -7.515 4.012 0.338 1.00 24.15 O ATOM 1374 CB LYS A 96 -5.809 6.569 2.030 1.00 22.45 C ATOM 1375 CG LYS A 96 -6.406 6.402 3.438 1.00 13.05 C ATOM 1376 CD LYS A 96 -7.822 5.806 3.423 1.00 34.23 C ATOM 1377 CE LYS A 96 -8.386 5.700 4.839 1.00 74.44 C ATOM 1378 NZ LYS A 96 -9.775 5.213 4.813 1.00 43.02 N ATOM 0 H LYS A 96 -4.422 5.343 -0.330 1.00 53.12 H new ATOM 0 HA LYS A 96 -5.850 4.475 2.082 1.00 62.13 H new ATOM 0 HB2 LYS A 96 -4.817 7.015 2.104 1.00 22.45 H new ATOM 0 HB3 LYS A 96 -6.425 7.257 1.451 1.00 22.45 H new ATOM 0 HG2 LYS A 96 -5.754 5.759 4.029 1.00 13.05 H new ATOM 0 HG3 LYS A 96 -6.432 7.373 3.933 1.00 13.05 H new ATOM 0 HD2 LYS A 96 -8.476 6.429 2.813 1.00 34.23 H new ATOM 0 HD3 LYS A 96 -7.800 4.819 2.961 1.00 34.23 H new ATOM 0 HE2 LYS A 96 -7.770 5.024 5.431 1.00 74.44 H new ATOM 0 HE3 LYS A 96 -8.347 6.675 5.325 1.00 74.44 H new ATOM 0 HZ1 LYS A 96 -10.139 5.149 5.785 1.00 43.02 H new ATOM 0 HZ2 LYS A 96 -10.364 5.873 4.266 1.00 43.02 H new ATOM 0 HZ3 LYS A 96 -9.805 4.273 4.369 1.00 43.02 H new ATOM 1388 N THR A 97 -6.839 5.835 -0.778 1.00 74.34 N ATOM 1389 CA THR A 97 -7.816 5.705 -1.849 1.00 10.22 C ATOM 1390 C THR A 97 -7.669 4.338 -2.536 1.00 62.54 C ATOM 1391 O THR A 97 -8.664 3.697 -2.864 1.00 1.31 O ATOM 1392 CB THR A 97 -7.632 6.885 -2.822 1.00 74.31 C ATOM 1393 OG1 THR A 97 -7.239 8.043 -2.103 1.00 23.33 O ATOM 1394 CG2 THR A 97 -8.907 7.184 -3.609 1.00 72.33 C ATOM 0 H THR A 97 -6.199 6.621 -0.894 1.00 74.34 H new ATOM 0 HA THR A 97 -8.832 5.744 -1.456 1.00 10.22 H new ATOM 0 HB THR A 97 -6.857 6.604 -3.535 1.00 74.31 H new ATOM 0 HG1 THR A 97 -7.824 8.159 -1.325 1.00 23.33 H new ATOM 0 HG21 THR A 97 -8.731 8.023 -4.282 1.00 72.33 H new ATOM 0 HG22 THR A 97 -9.190 6.306 -4.190 1.00 72.33 H new ATOM 0 HG23 THR A 97 -9.711 7.436 -2.917 1.00 72.33 H new ATOM 1402 N LEU A 98 -6.430 3.842 -2.683 1.00 44.41 N ATOM 1403 CA LEU A 98 -6.146 2.571 -3.348 1.00 73.40 C ATOM 1404 C LEU A 98 -6.832 1.397 -2.649 1.00 13.34 C ATOM 1405 O LEU A 98 -7.449 0.566 -3.306 1.00 5.45 O ATOM 1406 CB LEU A 98 -4.628 2.336 -3.410 1.00 24.15 C ATOM 1407 CG LEU A 98 -4.169 1.558 -4.656 1.00 12.31 C ATOM 1408 CD1 LEU A 98 -4.912 0.248 -4.926 1.00 2.34 C ATOM 1409 CD2 LEU A 98 -4.237 2.448 -5.892 1.00 54.11 C ATOM 0 H LEU A 98 -5.596 4.318 -2.340 1.00 44.41 H new ATOM 0 HA LEU A 98 -6.546 2.631 -4.360 1.00 73.40 H new ATOM 0 HB2 LEU A 98 -4.120 3.300 -3.388 1.00 24.15 H new ATOM 0 HB3 LEU A 98 -4.318 1.791 -2.518 1.00 24.15 H new ATOM 0 HG LEU A 98 -3.141 1.269 -4.436 1.00 12.31 H new ATOM 0 HD11 LEU A 98 -4.511 -0.219 -5.825 1.00 2.34 H new ATOM 0 HD12 LEU A 98 -4.782 -0.425 -4.079 1.00 2.34 H new ATOM 0 HD13 LEU A 98 -5.973 0.454 -5.066 1.00 2.34 H new ATOM 0 HD21 LEU A 98 -3.909 1.884 -6.765 1.00 54.11 H new ATOM 0 HD22 LEU A 98 -5.263 2.785 -6.042 1.00 54.11 H new ATOM 0 HD23 LEU A 98 -3.588 3.312 -5.754 1.00 54.11 H new ATOM 1420 N LEU A 99 -6.759 1.338 -1.316 1.00 73.10 N ATOM 1421 CA LEU A 99 -7.427 0.318 -0.514 1.00 52.31 C ATOM 1422 C LEU A 99 -8.905 0.225 -0.891 1.00 31.11 C ATOM 1423 O LEU A 99 -9.452 -0.869 -1.012 1.00 22.43 O ATOM 1424 CB LEU A 99 -7.293 0.656 0.976 1.00 42.02 C ATOM 1425 CG LEU A 99 -5.897 0.472 1.600 1.00 52.02 C ATOM 1426 CD1 LEU A 99 -4.890 -0.371 0.821 1.00 65.43 C ATOM 1427 CD2 LEU A 99 -5.256 1.806 1.964 1.00 51.42 C ATOM 0 H LEU A 99 -6.227 2.007 -0.760 1.00 73.10 H new ATOM 0 HA LEU A 99 -6.954 -0.644 -0.710 1.00 52.31 H new ATOM 0 HB2 LEU A 99 -7.597 1.693 1.119 1.00 42.02 H new ATOM 0 HB3 LEU A 99 -7.999 0.038 1.531 1.00 42.02 H new ATOM 0 HG LEU A 99 -6.126 -0.111 2.492 1.00 52.02 H new ATOM 0 HD11 LEU A 99 -3.951 -0.418 1.373 1.00 65.43 H new ATOM 0 HD12 LEU A 99 -5.284 -1.379 0.688 1.00 65.43 H new ATOM 0 HD13 LEU A 99 -4.715 0.081 -0.155 1.00 65.43 H new ATOM 0 HD21 LEU A 99 -4.273 1.630 2.401 1.00 51.42 H new ATOM 0 HD22 LEU A 99 -5.150 2.416 1.067 1.00 51.42 H new ATOM 0 HD23 LEU A 99 -5.885 2.327 2.685 1.00 51.42 H new ATOM 1438 N ASP A 100 -9.548 1.367 -1.134 1.00 72.40 N ATOM 1439 CA ASP A 100 -10.961 1.368 -1.493 1.00 31.24 C ATOM 1440 C ASP A 100 -11.202 0.859 -2.917 1.00 65.41 C ATOM 1441 O ASP A 100 -12.263 0.315 -3.196 1.00 44.22 O ATOM 1442 CB ASP A 100 -11.586 2.750 -1.281 1.00 21.25 C ATOM 1443 CG ASP A 100 -12.927 2.555 -0.586 1.00 23.43 C ATOM 1444 OD1 ASP A 100 -12.905 2.464 0.665 1.00 45.34 O ATOM 1445 OD2 ASP A 100 -13.966 2.385 -1.261 1.00 10.23 O ATOM 0 H ASP A 100 -9.118 2.291 -1.089 1.00 72.40 H new ATOM 0 HA ASP A 100 -11.458 0.667 -0.822 1.00 31.24 H new ATOM 0 HB2 ASP A 100 -10.930 3.377 -0.676 1.00 21.25 H new ATOM 0 HB3 ASP A 100 -11.721 3.258 -2.236 1.00 21.25 H new ATOM 1449 N GLN A 101 -10.218 0.945 -3.818 1.00 2.34 N ATOM 1450 CA GLN A 101 -10.286 0.329 -5.145 1.00 71.50 C ATOM 1451 C GLN A 101 -10.075 -1.195 -5.076 1.00 70.33 C ATOM 1452 O GLN A 101 -10.300 -1.892 -6.065 1.00 64.34 O ATOM 1453 CB GLN A 101 -9.226 0.918 -6.097 1.00 53.30 C ATOM 1454 CG GLN A 101 -9.197 2.448 -6.245 1.00 14.05 C ATOM 1455 CD GLN A 101 -8.210 2.912 -7.331 1.00 45.44 C ATOM 1456 OE1 GLN A 101 -7.353 2.145 -7.776 1.00 21.23 O ATOM 1457 NE2 GLN A 101 -8.306 4.164 -7.764 1.00 41.31 N ATOM 0 H GLN A 101 -9.347 1.447 -3.645 1.00 2.34 H new ATOM 0 HA GLN A 101 -11.284 0.543 -5.527 1.00 71.50 H new ATOM 0 HB2 GLN A 101 -8.244 0.592 -5.755 1.00 53.30 H new ATOM 0 HB3 GLN A 101 -9.379 0.484 -7.085 1.00 53.30 H new ATOM 0 HG2 GLN A 101 -10.197 2.806 -6.489 1.00 14.05 H new ATOM 0 HG3 GLN A 101 -8.922 2.898 -5.291 1.00 14.05 H new ATOM 0 HE21 GLN A 101 -9.022 4.782 -7.383 1.00 41.31 H new ATOM 0 HE22 GLN A 101 -7.664 4.507 -8.478 1.00 41.31 H new ATOM 1464 N MET A 102 -9.606 -1.746 -3.952 1.00 64.20 N ATOM 1465 CA MET A 102 -9.171 -3.142 -3.841 1.00 52.42 C ATOM 1466 C MET A 102 -10.295 -4.079 -3.382 1.00 54.22 C ATOM 1467 O MET A 102 -10.020 -5.217 -3.010 1.00 34.31 O ATOM 1468 CB MET A 102 -7.943 -3.220 -2.919 1.00 50.31 C ATOM 1469 CG MET A 102 -6.696 -2.641 -3.591 1.00 33.24 C ATOM 1470 SD MET A 102 -5.737 -3.826 -4.575 1.00 42.23 S ATOM 1471 CE MET A 102 -4.938 -4.729 -3.224 1.00 14.35 C ATOM 0 H MET A 102 -9.516 -1.226 -3.079 1.00 64.20 H new ATOM 0 HA MET A 102 -8.892 -3.492 -4.835 1.00 52.42 H new ATOM 0 HB2 MET A 102 -8.145 -2.676 -1.996 1.00 50.31 H new ATOM 0 HB3 MET A 102 -7.760 -4.259 -2.644 1.00 50.31 H new ATOM 0 HG2 MET A 102 -6.999 -1.816 -4.236 1.00 33.24 H new ATOM 0 HG3 MET A 102 -6.048 -2.222 -2.821 1.00 33.24 H new ATOM 0 HE1 MET A 102 -4.566 -5.684 -3.595 1.00 14.35 H new ATOM 0 HE2 MET A 102 -4.106 -4.141 -2.835 1.00 14.35 H new ATOM 0 HE3 MET A 102 -5.661 -4.906 -2.427 1.00 14.35 H new ATOM 1479 N LYS A 103 -11.569 -3.661 -3.403 1.00 21.54 N ATOM 1480 CA LYS A 103 -12.648 -4.457 -2.795 1.00 50.12 C ATOM 1481 C LYS A 103 -12.856 -5.852 -3.402 1.00 45.34 C ATOM 1482 O LYS A 103 -13.576 -6.646 -2.802 1.00 21.52 O ATOM 1483 CB LYS A 103 -14.003 -3.734 -2.851 1.00 62.20 C ATOM 1484 CG LYS A 103 -14.044 -2.276 -2.396 1.00 10.43 C ATOM 1485 CD LYS A 103 -13.341 -1.952 -1.069 1.00 44.33 C ATOM 1486 CE LYS A 103 -13.978 -2.580 0.180 1.00 50.42 C ATOM 1487 NZ LYS A 103 -13.607 -3.990 0.411 1.00 13.01 N ATOM 0 H LYS A 103 -11.876 -2.787 -3.829 1.00 21.54 H new ATOM 0 HA LYS A 103 -12.303 -4.582 -1.769 1.00 50.12 H new ATOM 0 HB2 LYS A 103 -14.364 -3.776 -3.878 1.00 62.20 H new ATOM 0 HB3 LYS A 103 -14.710 -4.297 -2.241 1.00 62.20 H new ATOM 0 HG2 LYS A 103 -13.597 -1.662 -3.178 1.00 10.43 H new ATOM 0 HG3 LYS A 103 -15.088 -1.974 -2.312 1.00 10.43 H new ATOM 0 HD2 LYS A 103 -12.305 -2.284 -1.135 1.00 44.33 H new ATOM 0 HD3 LYS A 103 -13.321 -0.870 -0.942 1.00 44.33 H new ATOM 0 HE2 LYS A 103 -13.691 -1.994 1.053 1.00 50.42 H new ATOM 0 HE3 LYS A 103 -15.062 -2.512 0.093 1.00 50.42 H new ATOM 0 HZ1 LYS A 103 -13.860 -4.261 1.383 1.00 13.01 H new ATOM 0 HZ2 LYS A 103 -14.116 -4.598 -0.262 1.00 13.01 H new ATOM 0 HZ3 LYS A 103 -12.582 -4.106 0.275 1.00 13.01 H new ATOM 1497 N ASN A 104 -12.291 -6.151 -4.575 1.00 22.52 N ATOM 1498 CA ASN A 104 -12.419 -7.450 -5.245 1.00 54.22 C ATOM 1499 C ASN A 104 -11.098 -8.220 -5.214 1.00 13.32 C ATOM 1500 O ASN A 104 -10.983 -9.248 -5.879 1.00 42.32 O ATOM 1501 CB ASN A 104 -12.937 -7.263 -6.689 1.00 30.12 C ATOM 1502 CG ASN A 104 -14.420 -6.938 -6.697 1.00 50.41 C ATOM 1503 OD1 ASN A 104 -15.263 -7.778 -6.988 1.00 63.43 O ATOM 1504 ND2 ASN A 104 -14.800 -5.732 -6.322 1.00 44.13 N ATOM 0 H ASN A 104 -11.721 -5.485 -5.096 1.00 22.52 H new ATOM 0 HA ASN A 104 -13.151 -8.048 -4.701 1.00 54.22 H new ATOM 0 HB2 ASN A 104 -12.383 -6.461 -7.177 1.00 30.12 H new ATOM 0 HB3 ASN A 104 -12.757 -8.171 -7.264 1.00 30.12 H new ATOM 0 HD21 ASN A 104 -15.793 -5.502 -6.275 1.00 44.13 H new ATOM 0 HD22 ASN A 104 -14.101 -5.030 -6.079 1.00 44.13 H new ATOM 1510 N TYR A 105 -10.077 -7.707 -4.520 1.00 52.02 N ATOM 1511 CA TYR A 105 -8.763 -8.316 -4.477 1.00 52.04 C ATOM 1512 C TYR A 105 -8.810 -9.622 -3.695 1.00 1.25 C ATOM 1513 O TYR A 105 -9.183 -9.649 -2.521 1.00 44.33 O ATOM 1514 CB TYR A 105 -7.749 -7.357 -3.845 1.00 30.33 C ATOM 1515 CG TYR A 105 -6.365 -7.963 -3.718 1.00 13.45 C ATOM 1516 CD1 TYR A 105 -5.734 -8.499 -4.856 1.00 42.22 C ATOM 1517 CD2 TYR A 105 -5.737 -8.058 -2.463 1.00 31.55 C ATOM 1518 CE1 TYR A 105 -4.493 -9.138 -4.749 1.00 11.02 C ATOM 1519 CE2 TYR A 105 -4.470 -8.653 -2.354 1.00 24.45 C ATOM 1520 CZ TYR A 105 -3.846 -9.190 -3.502 1.00 30.54 C ATOM 1521 OH TYR A 105 -2.623 -9.764 -3.420 1.00 22.33 O ATOM 0 H TYR A 105 -10.150 -6.850 -3.971 1.00 52.02 H new ATOM 0 HA TYR A 105 -8.449 -8.531 -5.498 1.00 52.04 H new ATOM 0 HB2 TYR A 105 -7.689 -6.450 -4.447 1.00 30.33 H new ATOM 0 HB3 TYR A 105 -8.103 -7.061 -2.857 1.00 30.33 H new ATOM 0 HD1 TYR A 105 -6.212 -8.417 -5.821 1.00 42.22 H new ATOM 0 HD2 TYR A 105 -6.230 -7.673 -1.583 1.00 31.55 H new ATOM 0 HE1 TYR A 105 -4.036 -9.588 -5.618 1.00 11.02 H new ATOM 0 HE2 TYR A 105 -3.974 -8.700 -1.396 1.00 24.45 H new ATOM 0 HH TYR A 105 -2.205 -9.523 -2.567 1.00 22.33 H new ATOM 1530 N ARG A 106 -8.362 -10.700 -4.335 1.00 33.42 N ATOM 1531 CA ARG A 106 -8.169 -12.007 -3.728 1.00 52.44 C ATOM 1532 C ARG A 106 -6.683 -12.276 -3.768 1.00 73.11 C ATOM 1533 O ARG A 106 -6.127 -12.393 -4.860 1.00 32.41 O ATOM 1534 CB ARG A 106 -8.954 -13.061 -4.512 1.00 43.30 C ATOM 1535 CG ARG A 106 -10.462 -12.921 -4.259 1.00 4.03 C ATOM 1536 CD ARG A 106 -11.043 -14.182 -3.621 1.00 22.52 C ATOM 1537 NE ARG A 106 -11.206 -15.279 -4.590 1.00 64.43 N ATOM 1538 CZ ARG A 106 -12.291 -16.055 -4.724 1.00 24.44 C ATOM 1539 NH1 ARG A 106 -13.352 -15.909 -3.932 1.00 34.21 N ATOM 1540 NH2 ARG A 106 -12.308 -17.017 -5.640 1.00 52.23 N ATOM 0 H ARG A 106 -8.116 -10.683 -5.325 1.00 33.42 H new ATOM 0 HA ARG A 106 -8.532 -12.041 -2.701 1.00 52.44 H new ATOM 0 HB2 ARG A 106 -8.749 -12.956 -5.577 1.00 43.30 H new ATOM 0 HB3 ARG A 106 -8.623 -14.058 -4.221 1.00 43.30 H new ATOM 0 HG2 ARG A 106 -10.645 -12.066 -3.609 1.00 4.03 H new ATOM 0 HG3 ARG A 106 -10.973 -12.720 -5.201 1.00 4.03 H new ATOM 0 HD2 ARG A 106 -10.390 -14.510 -2.812 1.00 22.52 H new ATOM 0 HD3 ARG A 106 -12.010 -13.948 -3.176 1.00 22.52 H new ATOM 0 HE ARG A 106 -10.422 -15.465 -5.216 1.00 64.43 H new ATOM 0 HH11 ARG A 106 -13.351 -15.195 -3.204 1.00 34.21 H new ATOM 0 HH12 ARG A 106 -14.166 -16.512 -4.054 1.00 34.21 H new ATOM 0 HH21 ARG A 106 -11.496 -17.164 -6.240 1.00 52.23 H new ATOM 0 HH22 ARG A 106 -13.133 -17.608 -5.743 1.00 52.23 H new ATOM 1551 N GLY A 107 -6.047 -12.330 -2.607 1.00 13.13 N ATOM 1552 CA GLY A 107 -4.611 -12.445 -2.501 1.00 31.51 C ATOM 1553 C GLY A 107 -4.150 -11.822 -1.193 1.00 25.14 C ATOM 1554 O GLY A 107 -4.942 -11.628 -0.260 1.00 5.24 O ATOM 0 H GLY A 107 -6.524 -12.294 -1.706 1.00 13.13 H new ATOM 0 HA2 GLY A 107 -4.315 -13.493 -2.542 1.00 31.51 H new ATOM 0 HA3 GLY A 107 -4.132 -11.946 -3.343 1.00 31.51 H new ATOM 1558 N GLU A 108 -2.863 -11.504 -1.127 1.00 10.35 N ATOM 1559 CA GLU A 108 -2.147 -11.136 0.082 1.00 21.42 C ATOM 1560 C GLU A 108 -1.544 -9.751 -0.092 1.00 22.25 C ATOM 1561 O GLU A 108 -1.239 -9.349 -1.220 1.00 2.35 O ATOM 1562 CB GLU A 108 -1.042 -12.171 0.319 1.00 32.52 C ATOM 1563 CG GLU A 108 -1.609 -13.479 0.884 1.00 13.32 C ATOM 1564 CD GLU A 108 -0.590 -14.619 0.938 1.00 72.41 C ATOM 1565 OE1 GLU A 108 0.640 -14.384 0.857 1.00 44.04 O ATOM 1566 OE2 GLU A 108 -1.017 -15.776 1.126 1.00 30.52 O ATOM 0 H GLU A 108 -2.266 -11.496 -1.954 1.00 10.35 H new ATOM 0 HA GLU A 108 -2.822 -11.117 0.938 1.00 21.42 H new ATOM 0 HB2 GLU A 108 -0.524 -12.373 -0.619 1.00 32.52 H new ATOM 0 HB3 GLU A 108 -0.304 -11.765 1.010 1.00 32.52 H new ATOM 0 HG2 GLU A 108 -1.989 -13.296 1.889 1.00 13.32 H new ATOM 0 HG3 GLU A 108 -2.457 -13.790 0.274 1.00 13.32 H new ATOM 1571 N VAL A 109 -1.362 -9.021 1.007 1.00 12.23 N ATOM 1572 CA VAL A 109 -0.756 -7.695 0.964 1.00 50.30 C ATOM 1573 C VAL A 109 0.438 -7.645 1.910 1.00 52.24 C ATOM 1574 O VAL A 109 0.372 -8.151 3.034 1.00 65.11 O ATOM 1575 CB VAL A 109 -1.778 -6.582 1.292 1.00 12.04 C ATOM 1576 CG1 VAL A 109 -1.196 -5.227 0.847 1.00 25.41 C ATOM 1577 CG2 VAL A 109 -3.149 -6.761 0.614 1.00 5.02 C ATOM 0 H VAL A 109 -1.628 -9.329 1.942 1.00 12.23 H new ATOM 0 HA VAL A 109 -0.410 -7.510 -0.053 1.00 50.30 H new ATOM 0 HB VAL A 109 -1.948 -6.632 2.368 1.00 12.04 H new ATOM 0 HG11 VAL A 109 -1.908 -4.433 1.073 1.00 25.41 H new ATOM 0 HG12 VAL A 109 -0.263 -5.040 1.378 1.00 25.41 H new ATOM 0 HG13 VAL A 109 -1.005 -5.248 -0.226 1.00 25.41 H new ATOM 0 HG21 VAL A 109 -3.805 -5.938 0.897 1.00 5.02 H new ATOM 0 HG22 VAL A 109 -3.021 -6.768 -0.468 1.00 5.02 H new ATOM 0 HG23 VAL A 109 -3.592 -7.704 0.933 1.00 5.02 H new ATOM 1587 N ALA A 110 1.494 -6.946 1.496 1.00 72.34 N ATOM 1588 CA ALA A 110 2.491 -6.418 2.407 1.00 32.35 C ATOM 1589 C ALA A 110 2.892 -5.004 1.998 1.00 42.41 C ATOM 1590 O ALA A 110 2.539 -4.538 0.907 1.00 14.23 O ATOM 1591 CB ALA A 110 3.697 -7.355 2.486 1.00 32.24 C ATOM 0 H ALA A 110 1.677 -6.733 0.515 1.00 72.34 H new ATOM 0 HA ALA A 110 2.060 -6.359 3.407 1.00 32.35 H new ATOM 0 HB1 ALA A 110 4.434 -6.942 3.174 1.00 32.24 H new ATOM 0 HB2 ALA A 110 3.375 -8.333 2.843 1.00 32.24 H new ATOM 0 HB3 ALA A 110 4.143 -7.459 1.497 1.00 32.24 H new ATOM 1597 N SER A 111 3.619 -4.305 2.871 1.00 30.15 N ATOM 1598 CA SER A 111 4.041 -2.941 2.609 1.00 70.20 C ATOM 1599 C SER A 111 5.512 -2.747 2.980 1.00 5.21 C ATOM 1600 O SER A 111 5.993 -3.317 3.963 1.00 5.41 O ATOM 1601 CB SER A 111 3.043 -1.961 3.255 1.00 34.25 C ATOM 1602 OG SER A 111 3.454 -1.426 4.495 1.00 64.13 O ATOM 0 H SER A 111 3.927 -4.671 3.772 1.00 30.15 H new ATOM 0 HA SER A 111 4.011 -2.717 1.543 1.00 70.20 H new ATOM 0 HB2 SER A 111 2.864 -1.139 2.562 1.00 34.25 H new ATOM 0 HB3 SER A 111 2.091 -2.474 3.394 1.00 34.25 H new ATOM 0 HG SER A 111 2.766 -0.815 4.832 1.00 64.13 H new ATOM 1607 N PHE A 112 6.209 -1.945 2.170 1.00 21.45 N ATOM 1608 CA PHE A 112 7.656 -1.782 2.193 1.00 63.52 C ATOM 1609 C PHE A 112 7.990 -0.287 2.181 1.00 45.00 C ATOM 1610 O PHE A 112 8.171 0.314 1.121 1.00 30.53 O ATOM 1611 CB PHE A 112 8.294 -2.608 1.058 1.00 64.33 C ATOM 1612 CG PHE A 112 8.063 -2.189 -0.385 1.00 54.23 C ATOM 1613 CD1 PHE A 112 6.852 -2.480 -1.044 1.00 41.20 C ATOM 1614 CD2 PHE A 112 9.113 -1.585 -1.105 1.00 41.44 C ATOM 1615 CE1 PHE A 112 6.686 -2.129 -2.398 1.00 43.42 C ATOM 1616 CE2 PHE A 112 8.928 -1.204 -2.442 1.00 43.42 C ATOM 1617 CZ PHE A 112 7.712 -1.466 -3.090 1.00 11.33 C ATOM 0 H PHE A 112 5.759 -1.372 1.456 1.00 21.45 H new ATOM 0 HA PHE A 112 8.093 -2.178 3.110 1.00 63.52 H new ATOM 0 HB2 PHE A 112 9.371 -2.621 1.227 1.00 64.33 H new ATOM 0 HB3 PHE A 112 7.942 -3.634 1.162 1.00 64.33 H new ATOM 0 HD1 PHE A 112 6.052 -2.972 -0.511 1.00 41.20 H new ATOM 0 HD2 PHE A 112 10.065 -1.415 -0.625 1.00 41.44 H new ATOM 0 HE1 PHE A 112 5.765 -2.371 -2.907 1.00 43.42 H new ATOM 0 HE2 PHE A 112 9.725 -0.707 -2.975 1.00 43.42 H new ATOM 0 HZ PHE A 112 7.566 -1.160 -4.115 1.00 11.33 H new ATOM 1626 N PHE A 113 7.985 0.387 3.336 1.00 70.14 N ATOM 1627 CA PHE A 113 8.205 1.842 3.376 1.00 4.44 C ATOM 1628 C PHE A 113 9.693 2.208 3.234 1.00 14.44 C ATOM 1629 O PHE A 113 10.570 1.353 3.390 1.00 12.34 O ATOM 1630 CB PHE A 113 7.527 2.499 4.592 1.00 70.10 C ATOM 1631 CG PHE A 113 7.722 1.844 5.945 1.00 22.42 C ATOM 1632 CD1 PHE A 113 6.828 0.846 6.378 1.00 2.31 C ATOM 1633 CD2 PHE A 113 8.756 2.270 6.798 1.00 30.31 C ATOM 1634 CE1 PHE A 113 6.989 0.247 7.634 1.00 74.54 C ATOM 1635 CE2 PHE A 113 8.909 1.677 8.068 1.00 62.13 C ATOM 1636 CZ PHE A 113 8.036 0.649 8.474 1.00 70.11 C ATOM 0 H PHE A 113 7.833 -0.043 4.248 1.00 70.14 H new ATOM 0 HA PHE A 113 7.713 2.265 2.500 1.00 4.44 H new ATOM 0 HB2 PHE A 113 7.885 3.526 4.662 1.00 70.10 H new ATOM 0 HB3 PHE A 113 6.456 2.547 4.394 1.00 70.10 H new ATOM 0 HD1 PHE A 113 6.013 0.541 5.738 1.00 2.31 H new ATOM 0 HD2 PHE A 113 9.432 3.050 6.481 1.00 30.31 H new ATOM 0 HE1 PHE A 113 6.306 -0.525 7.955 1.00 74.54 H new ATOM 0 HE2 PHE A 113 9.695 2.011 8.729 1.00 62.13 H new ATOM 0 HZ PHE A 113 8.174 0.171 9.432 1.00 70.11 H new ATOM 1645 N THR A 114 9.986 3.475 2.919 1.00 73.13 N ATOM 1646 CA THR A 114 11.326 3.955 2.563 1.00 24.13 C ATOM 1647 C THR A 114 12.002 4.801 3.652 1.00 52.52 C ATOM 1648 O THR A 114 13.197 5.081 3.548 1.00 50.50 O ATOM 1649 CB THR A 114 11.258 4.751 1.242 1.00 71.20 C ATOM 1650 OG1 THR A 114 10.073 5.540 1.183 1.00 3.33 O ATOM 1651 CG2 THR A 114 11.266 3.830 0.021 1.00 64.24 C ATOM 0 H THR A 114 9.281 4.212 2.904 1.00 73.13 H new ATOM 0 HA THR A 114 11.947 3.067 2.448 1.00 24.13 H new ATOM 0 HB THR A 114 12.142 5.388 1.224 1.00 71.20 H new ATOM 0 HG1 THR A 114 10.052 6.037 0.338 1.00 3.33 H new ATOM 0 HG21 THR A 114 11.217 4.430 -0.888 1.00 64.24 H new ATOM 0 HG22 THR A 114 12.182 3.239 0.017 1.00 64.24 H new ATOM 0 HG23 THR A 114 10.405 3.163 0.062 1.00 64.24 H new ATOM 1659 N SER A 115 11.282 5.205 4.700 1.00 50.22 N ATOM 1660 CA SER A 115 11.756 6.136 5.717 1.00 2.34 C ATOM 1661 C SER A 115 11.026 5.866 7.026 1.00 32.25 C ATOM 1662 O SER A 115 9.930 5.315 7.007 1.00 24.02 O ATOM 1663 CB SER A 115 11.416 7.552 5.263 1.00 3.55 C ATOM 1664 OG SER A 115 12.315 8.028 4.274 1.00 71.20 O ATOM 0 H SER A 115 10.328 4.883 4.866 1.00 50.22 H new ATOM 0 HA SER A 115 12.830 6.018 5.859 1.00 2.34 H new ATOM 0 HB2 SER A 115 10.400 7.571 4.868 1.00 3.55 H new ATOM 0 HB3 SER A 115 11.436 8.222 6.123 1.00 3.55 H new ATOM 0 HG SER A 115 12.060 8.937 4.010 1.00 71.20 H new ATOM 1669 N ALA A 116 11.609 6.261 8.161 1.00 53.33 N ATOM 1670 CA ALA A 116 11.023 6.052 9.485 1.00 73.20 C ATOM 1671 C ALA A 116 11.546 7.059 10.528 1.00 41.51 C ATOM 1672 O ALA A 116 11.504 6.780 11.727 1.00 53.24 O ATOM 1673 CB ALA A 116 11.300 4.609 9.926 1.00 71.41 C ATOM 0 H ALA A 116 12.510 6.739 8.185 1.00 53.33 H new ATOM 0 HA ALA A 116 9.948 6.221 9.416 1.00 73.20 H new ATOM 0 HB1 ALA A 116 10.868 4.441 10.912 1.00 71.41 H new ATOM 0 HB2 ALA A 116 10.853 3.918 9.211 1.00 71.41 H new ATOM 0 HB3 ALA A 116 12.376 4.442 9.968 1.00 71.41 H new ATOM 1679 N GLY A 117 12.092 8.194 10.068 1.00 54.22 N ATOM 1680 CA GLY A 117 13.045 9.031 10.795 1.00 65.23 C ATOM 1681 C GLY A 117 12.691 9.292 12.257 1.00 5.45 C ATOM 1682 O GLY A 117 13.537 9.098 13.130 1.00 32.31 O ATOM 0 H GLY A 117 11.871 8.564 9.144 1.00 54.22 H new ATOM 0 HA2 GLY A 117 14.026 8.558 10.753 1.00 65.23 H new ATOM 0 HA3 GLY A 117 13.130 9.988 10.281 1.00 65.23 H new ATOM 1686 N THR A 118 11.445 9.684 12.546 1.00 2.44 N ATOM 1687 CA THR A 118 10.993 9.911 13.918 1.00 5.54 C ATOM 1688 C THR A 118 9.783 9.035 14.282 1.00 62.34 C ATOM 1689 O THR A 118 9.199 9.187 15.363 1.00 72.13 O ATOM 1690 CB THR A 118 10.772 11.416 14.140 1.00 74.10 C ATOM 1691 OG1 THR A 118 9.717 11.928 13.349 1.00 71.40 O ATOM 1692 CG2 THR A 118 12.031 12.245 13.871 1.00 74.30 C ATOM 0 H THR A 118 10.729 9.851 11.839 1.00 2.44 H new ATOM 0 HA THR A 118 11.770 9.594 14.614 1.00 5.54 H new ATOM 0 HB THR A 118 10.508 11.507 15.194 1.00 74.10 H new ATOM 0 HG1 THR A 118 10.066 12.613 12.741 1.00 71.40 H new ATOM 0 HG21 THR A 118 11.816 13.300 14.044 1.00 74.30 H new ATOM 0 HG22 THR A 118 12.829 11.923 14.540 1.00 74.30 H new ATOM 0 HG23 THR A 118 12.346 12.103 12.837 1.00 74.30 H new ATOM 1700 N ASN A 119 9.399 8.113 13.392 1.00 51.34 N ATOM 1701 CA ASN A 119 8.218 7.271 13.493 1.00 51.21 C ATOM 1702 C ASN A 119 8.452 5.982 12.726 1.00 62.24 C ATOM 1703 O ASN A 119 8.540 6.000 11.500 1.00 34.15 O ATOM 1704 CB ASN A 119 7.007 7.964 12.858 1.00 64.04 C ATOM 1705 CG ASN A 119 6.203 8.756 13.859 1.00 45.11 C ATOM 1706 OD1 ASN A 119 6.183 9.976 13.825 1.00 32.04 O ATOM 1707 ND2 ASN A 119 5.495 8.088 14.746 1.00 42.40 N ATOM 0 H ASN A 119 9.934 7.931 12.543 1.00 51.34 H new ATOM 0 HA ASN A 119 8.030 7.077 14.549 1.00 51.21 H new ATOM 0 HB2 ASN A 119 7.348 8.628 12.064 1.00 64.04 H new ATOM 0 HB3 ASN A 119 6.366 7.215 12.394 1.00 64.04 H new ATOM 0 HD21 ASN A 119 4.917 8.590 15.420 1.00 42.40 H new ATOM 0 HD22 ASN A 119 5.524 7.069 14.759 1.00 42.40 H new ATOM 1713 N HIS A 120 8.463 4.858 13.435 1.00 73.01 N ATOM 1714 CA HIS A 120 8.521 3.526 12.867 1.00 5.01 C ATOM 1715 C HIS A 120 7.301 2.748 13.345 1.00 23.51 C ATOM 1716 O HIS A 120 6.359 2.554 12.578 1.00 4.44 O ATOM 1717 CB HIS A 120 9.861 2.876 13.239 1.00 44.40 C ATOM 1718 CG HIS A 120 10.058 1.483 12.719 1.00 33.42 C ATOM 1719 ND1 HIS A 120 10.822 0.504 13.307 1.00 13.21 N ATOM 1720 CD2 HIS A 120 9.678 1.037 11.489 1.00 53.12 C ATOM 1721 CE1 HIS A 120 10.905 -0.520 12.441 1.00 30.51 C ATOM 1722 NE2 HIS A 120 10.267 -0.214 11.298 1.00 71.23 N ATOM 0 H HIS A 120 8.431 4.855 14.454 1.00 73.01 H new ATOM 0 HA HIS A 120 8.484 3.543 11.778 1.00 5.01 H new ATOM 0 HB2 HIS A 120 10.669 3.505 12.864 1.00 44.40 H new ATOM 0 HB3 HIS A 120 9.949 2.858 14.325 1.00 44.40 H new ATOM 0 HD2 HIS A 120 9.039 1.556 10.790 1.00 53.12 H new ATOM 0 HE1 HIS A 120 11.411 -1.454 12.635 1.00 30.51 H new ATOM 0 HE2 HIS A 120 10.222 -0.785 10.454 1.00 71.23 H new ATOM 1729 N LYS A 121 7.277 2.355 14.622 1.00 31.54 N ATOM 1730 CA LYS A 121 6.234 1.494 15.179 1.00 42.44 C ATOM 1731 C LYS A 121 4.828 2.084 15.027 1.00 73.24 C ATOM 1732 O LYS A 121 3.876 1.314 14.900 1.00 14.32 O ATOM 1733 CB LYS A 121 6.558 1.169 16.653 1.00 62.54 C ATOM 1734 CG LYS A 121 6.795 -0.329 16.933 1.00 45.12 C ATOM 1735 CD LYS A 121 5.795 -0.962 17.913 1.00 41.14 C ATOM 1736 CE LYS A 121 4.362 -0.891 17.372 1.00 34.33 C ATOM 1737 NZ LYS A 121 3.388 -1.571 18.252 1.00 2.11 N ATOM 0 H LYS A 121 7.987 2.628 15.302 1.00 31.54 H new ATOM 0 HA LYS A 121 6.227 0.569 14.603 1.00 42.44 H new ATOM 0 HB2 LYS A 121 7.446 1.727 16.950 1.00 62.54 H new ATOM 0 HB3 LYS A 121 5.737 1.519 17.279 1.00 62.54 H new ATOM 0 HG2 LYS A 121 6.753 -0.873 15.989 1.00 45.12 H new ATOM 0 HG3 LYS A 121 7.802 -0.456 17.329 1.00 45.12 H new ATOM 0 HD2 LYS A 121 6.067 -2.002 18.092 1.00 41.14 H new ATOM 0 HD3 LYS A 121 5.849 -0.449 18.873 1.00 41.14 H new ATOM 0 HE2 LYS A 121 4.073 0.153 17.255 1.00 34.33 H new ATOM 0 HE3 LYS A 121 4.329 -1.344 16.381 1.00 34.33 H new ATOM 0 HZ1 LYS A 121 2.436 -1.494 17.841 1.00 2.11 H new ATOM 0 HZ2 LYS A 121 3.645 -2.575 18.344 1.00 2.11 H new ATOM 0 HZ3 LYS A 121 3.397 -1.124 19.191 1.00 2.11 H new ATOM 1747 N ALA A 122 4.679 3.415 14.993 1.00 54.23 N ATOM 1748 CA ALA A 122 3.390 4.049 14.754 1.00 65.53 C ATOM 1749 C ALA A 122 2.803 3.629 13.409 1.00 32.21 C ATOM 1750 O ALA A 122 1.628 3.291 13.347 1.00 51.41 O ATOM 1751 CB ALA A 122 3.537 5.567 14.804 1.00 23.12 C ATOM 0 H ALA A 122 5.447 4.072 15.130 1.00 54.23 H new ATOM 0 HA ALA A 122 2.706 3.723 15.538 1.00 65.53 H new ATOM 0 HB1 ALA A 122 2.568 6.033 14.624 1.00 23.12 H new ATOM 0 HB2 ALA A 122 3.906 5.865 15.785 1.00 23.12 H new ATOM 0 HB3 ALA A 122 4.242 5.890 14.038 1.00 23.12 H new ATOM 1757 N TYR A 123 3.608 3.623 12.341 1.00 31.55 N ATOM 1758 CA TYR A 123 3.137 3.351 10.986 1.00 1.42 C ATOM 1759 C TYR A 123 2.441 1.989 10.915 1.00 43.21 C ATOM 1760 O TYR A 123 1.381 1.848 10.310 1.00 44.23 O ATOM 1761 CB TYR A 123 4.308 3.415 10.000 1.00 10.01 C ATOM 1762 CG TYR A 123 3.866 3.237 8.562 1.00 25.35 C ATOM 1763 CD1 TYR A 123 3.441 4.352 7.816 1.00 23.52 C ATOM 1764 CD2 TYR A 123 3.825 1.949 7.988 1.00 1.01 C ATOM 1765 CE1 TYR A 123 2.986 4.184 6.500 1.00 34.45 C ATOM 1766 CE2 TYR A 123 3.371 1.775 6.669 1.00 54.10 C ATOM 1767 CZ TYR A 123 2.966 2.899 5.919 1.00 44.11 C ATOM 1768 OH TYR A 123 2.610 2.760 4.617 1.00 1.14 O ATOM 0 H TYR A 123 4.610 3.808 12.397 1.00 31.55 H new ATOM 0 HA TYR A 123 2.408 4.114 10.711 1.00 1.42 H new ATOM 0 HB2 TYR A 123 4.815 4.374 10.105 1.00 10.01 H new ATOM 0 HB3 TYR A 123 5.034 2.642 10.252 1.00 10.01 H new ATOM 0 HD1 TYR A 123 3.465 5.338 8.257 1.00 23.52 H new ATOM 0 HD2 TYR A 123 4.144 1.093 8.564 1.00 1.01 H new ATOM 0 HE1 TYR A 123 2.651 5.039 5.931 1.00 34.45 H new ATOM 0 HE2 TYR A 123 3.333 0.788 6.233 1.00 54.10 H new ATOM 0 HH TYR A 123 2.647 1.813 4.367 1.00 1.14 H new ATOM 1777 N VAL A 124 3.011 0.993 11.591 1.00 32.34 N ATOM 1778 CA VAL A 124 2.508 -0.372 11.618 1.00 3.04 C ATOM 1779 C VAL A 124 1.108 -0.445 12.264 1.00 73.31 C ATOM 1780 O VAL A 124 0.294 -1.307 11.937 1.00 53.11 O ATOM 1781 CB VAL A 124 3.555 -1.243 12.347 1.00 61.23 C ATOM 1782 CG1 VAL A 124 3.185 -2.716 12.209 1.00 63.53 C ATOM 1783 CG2 VAL A 124 4.995 -1.039 11.833 1.00 30.13 C ATOM 0 H VAL A 124 3.856 1.120 12.148 1.00 32.34 H new ATOM 0 HA VAL A 124 2.373 -0.752 10.605 1.00 3.04 H new ATOM 0 HB VAL A 124 3.540 -0.929 13.391 1.00 61.23 H new ATOM 0 HG11 VAL A 124 3.926 -3.327 12.724 1.00 63.53 H new ATOM 0 HG12 VAL A 124 2.203 -2.887 12.650 1.00 63.53 H new ATOM 0 HG13 VAL A 124 3.161 -2.988 11.154 1.00 63.53 H new ATOM 0 HG21 VAL A 124 5.675 -1.683 12.391 1.00 30.13 H new ATOM 0 HG22 VAL A 124 5.043 -1.292 10.774 1.00 30.13 H new ATOM 0 HG23 VAL A 124 5.286 0.002 11.971 1.00 30.13 H new ATOM 1793 N SER A 125 0.795 0.445 13.198 1.00 42.14 N ATOM 1794 CA SER A 125 -0.553 0.616 13.719 1.00 50.04 C ATOM 1795 C SER A 125 -1.401 1.392 12.708 1.00 34.43 C ATOM 1796 O SER A 125 -2.489 0.940 12.360 1.00 44.31 O ATOM 1797 CB SER A 125 -0.422 1.305 15.077 1.00 14.31 C ATOM 1798 OG SER A 125 -1.653 1.644 15.687 1.00 65.51 O ATOM 0 H SER A 125 1.479 1.074 13.619 1.00 42.14 H new ATOM 0 HA SER A 125 -1.070 -0.332 13.866 1.00 50.04 H new ATOM 0 HB2 SER A 125 0.134 0.651 15.749 1.00 14.31 H new ATOM 0 HB3 SER A 125 0.169 2.212 14.954 1.00 14.31 H new ATOM 0 HG SER A 125 -1.482 2.077 16.549 1.00 65.51 H new ATOM 1803 N HIS A 126 -0.908 2.537 12.239 1.00 10.02 N ATOM 1804 CA HIS A 126 -1.612 3.451 11.343 1.00 5.02 C ATOM 1805 C HIS A 126 -2.161 2.738 10.106 1.00 33.51 C ATOM 1806 O HIS A 126 -3.368 2.763 9.869 1.00 53.21 O ATOM 1807 CB HIS A 126 -0.677 4.593 10.931 1.00 64.11 C ATOM 1808 CG HIS A 126 -0.223 5.500 12.048 1.00 73.11 C ATOM 1809 ND1 HIS A 126 0.684 6.517 11.900 1.00 2.13 N ATOM 1810 CD2 HIS A 126 -0.679 5.540 13.339 1.00 42.22 C ATOM 1811 CE1 HIS A 126 0.729 7.193 13.060 1.00 72.21 C ATOM 1812 NE2 HIS A 126 -0.078 6.633 13.975 1.00 62.11 N ATOM 0 H HIS A 126 0.027 2.865 12.482 1.00 10.02 H new ATOM 0 HA HIS A 126 -2.467 3.855 11.884 1.00 5.02 H new ATOM 0 HB2 HIS A 126 0.204 4.163 10.455 1.00 64.11 H new ATOM 0 HB3 HIS A 126 -1.182 5.198 10.178 1.00 64.11 H new ATOM 0 HD1 HIS A 126 1.226 6.723 11.061 1.00 2.13 H new ATOM 0 HD2 HIS A 126 -1.379 4.850 13.787 1.00 42.22 H new ATOM 0 HE1 HIS A 126 1.334 8.071 13.233 1.00 72.21 H new ATOM 1819 N PHE A 127 -1.285 2.118 9.313 1.00 30.54 N ATOM 1820 CA PHE A 127 -1.660 1.504 8.049 1.00 73.24 C ATOM 1821 C PHE A 127 -2.673 0.371 8.268 1.00 72.40 C ATOM 1822 O PHE A 127 -3.557 0.198 7.438 1.00 12.03 O ATOM 1823 CB PHE A 127 -0.394 1.050 7.304 1.00 12.05 C ATOM 1824 CG PHE A 127 -0.633 0.309 5.999 1.00 41.22 C ATOM 1825 CD1 PHE A 127 -1.456 0.853 4.996 1.00 71.14 C ATOM 1826 CD2 PHE A 127 -0.056 -0.957 5.798 1.00 22.14 C ATOM 1827 CE1 PHE A 127 -1.712 0.121 3.823 1.00 41.21 C ATOM 1828 CE2 PHE A 127 -0.315 -1.692 4.628 1.00 44.24 C ATOM 1829 CZ PHE A 127 -1.144 -1.149 3.632 1.00 64.21 C ATOM 0 H PHE A 127 -0.293 2.030 9.535 1.00 30.54 H new ATOM 0 HA PHE A 127 -2.165 2.235 7.418 1.00 73.24 H new ATOM 0 HB2 PHE A 127 0.219 1.927 7.096 1.00 12.05 H new ATOM 0 HB3 PHE A 127 0.185 0.406 7.966 1.00 12.05 H new ATOM 0 HD1 PHE A 127 -1.891 1.833 5.127 1.00 71.14 H new ATOM 0 HD2 PHE A 127 0.596 -1.371 6.553 1.00 22.14 H new ATOM 0 HE1 PHE A 127 -2.352 0.540 3.061 1.00 41.21 H new ATOM 0 HE2 PHE A 127 0.122 -2.671 4.495 1.00 44.24 H new ATOM 0 HZ PHE A 127 -1.343 -1.704 2.727 1.00 64.21 H new ATOM 1838 N ASN A 128 -2.622 -0.341 9.404 1.00 50.00 N ATOM 1839 CA ASN A 128 -3.603 -1.379 9.720 1.00 22.44 C ATOM 1840 C ASN A 128 -5.022 -0.827 9.827 1.00 30.14 C ATOM 1841 O ASN A 128 -5.965 -1.517 9.457 1.00 2.01 O ATOM 1842 CB ASN A 128 -3.242 -2.105 11.030 1.00 33.23 C ATOM 1843 CG ASN A 128 -2.415 -3.361 10.828 1.00 74.11 C ATOM 1844 OD1 ASN A 128 -2.463 -4.013 9.793 1.00 2.15 O ATOM 1845 ND2 ASN A 128 -1.578 -3.704 11.787 1.00 54.43 N ATOM 0 H ASN A 128 -1.906 -0.212 10.119 1.00 50.00 H new ATOM 0 HA ASN A 128 -3.574 -2.086 8.891 1.00 22.44 H new ATOM 0 HB2 ASN A 128 -2.692 -1.419 11.675 1.00 33.23 H new ATOM 0 HB3 ASN A 128 -4.161 -2.367 11.554 1.00 33.23 H new ATOM 0 HD21 ASN A 128 -0.969 -4.514 11.667 1.00 54.43 H new ATOM 0 HD22 ASN A 128 -1.539 -3.160 12.649 1.00 54.43 H new ATOM 1851 N GLU A 129 -5.201 0.393 10.335 1.00 54.23 N ATOM 1852 CA GLU A 129 -6.531 0.983 10.429 1.00 31.52 C ATOM 1853 C GLU A 129 -7.008 1.493 9.067 1.00 50.33 C ATOM 1854 O GLU A 129 -8.204 1.495 8.769 1.00 32.54 O ATOM 1855 CB GLU A 129 -6.510 2.128 11.449 1.00 31.32 C ATOM 1856 CG GLU A 129 -6.082 1.719 12.868 1.00 61.53 C ATOM 1857 CD GLU A 129 -6.803 0.469 13.400 1.00 30.13 C ATOM 1858 OE1 GLU A 129 -8.039 0.344 13.238 1.00 32.53 O ATOM 1859 OE2 GLU A 129 -6.144 -0.425 13.983 1.00 71.22 O ATOM 0 H GLU A 129 -4.447 0.985 10.684 1.00 54.23 H new ATOM 0 HA GLU A 129 -7.230 0.214 10.758 1.00 31.52 H new ATOM 0 HB2 GLU A 129 -5.833 2.904 11.090 1.00 31.32 H new ATOM 0 HB3 GLU A 129 -7.505 2.571 11.498 1.00 31.32 H new ATOM 0 HG2 GLU A 129 -5.007 1.537 12.875 1.00 61.53 H new ATOM 0 HG3 GLU A 129 -6.269 2.551 13.547 1.00 61.53 H new ATOM 1864 N TRP A 130 -6.076 1.941 8.227 1.00 64.53 N ATOM 1865 CA TRP A 130 -6.375 2.483 6.910 1.00 10.42 C ATOM 1866 C TRP A 130 -6.537 1.386 5.857 1.00 45.41 C ATOM 1867 O TRP A 130 -6.989 1.680 4.750 1.00 43.23 O ATOM 1868 CB TRP A 130 -5.287 3.488 6.528 1.00 44.42 C ATOM 1869 CG TRP A 130 -5.201 4.739 7.360 1.00 72.22 C ATOM 1870 CD1 TRP A 130 -5.824 4.997 8.539 1.00 61.43 C ATOM 1871 CD2 TRP A 130 -4.442 5.943 7.057 1.00 13.03 C ATOM 1872 NE1 TRP A 130 -5.493 6.260 8.982 1.00 32.11 N ATOM 1873 CE2 TRP A 130 -4.642 6.888 8.105 1.00 50.01 C ATOM 1874 CE3 TRP A 130 -3.607 6.333 5.991 1.00 50.10 C ATOM 1875 CZ2 TRP A 130 -4.046 8.153 8.098 1.00 54.44 C ATOM 1876 CZ3 TRP A 130 -2.987 7.595 5.982 1.00 11.12 C ATOM 1877 CH2 TRP A 130 -3.220 8.511 7.022 1.00 13.14 C ATOM 0 H TRP A 130 -5.080 1.936 8.449 1.00 64.53 H new ATOM 0 HA TRP A 130 -7.336 2.996 6.949 1.00 10.42 H new ATOM 0 HB2 TRP A 130 -4.323 2.981 6.575 1.00 44.42 H new ATOM 0 HB3 TRP A 130 -5.443 3.780 5.489 1.00 44.42 H new ATOM 0 HD1 TRP A 130 -6.482 4.313 9.054 1.00 61.43 H new ATOM 0 HE1 TRP A 130 -5.836 6.675 9.849 1.00 32.11 H new ATOM 0 HE3 TRP A 130 -3.441 5.653 5.169 1.00 50.10 H new ATOM 0 HZ2 TRP A 130 -4.219 8.845 8.909 1.00 54.44 H new ATOM 0 HZ3 TRP A 130 -2.327 7.862 5.170 1.00 11.12 H new ATOM 0 HH2 TRP A 130 -2.764 9.489 6.993 1.00 13.14 H new ATOM 1887 N ALA A 131 -6.221 0.136 6.201 1.00 74.52 N ATOM 1888 CA ALA A 131 -6.275 -1.035 5.343 1.00 34.51 C ATOM 1889 C ALA A 131 -6.970 -2.189 6.073 1.00 22.25 C ATOM 1890 O ALA A 131 -6.549 -3.346 5.997 1.00 50.02 O ATOM 1891 CB ALA A 131 -4.853 -1.375 4.910 1.00 22.41 C ATOM 0 H ALA A 131 -5.903 -0.093 7.143 1.00 74.52 H new ATOM 0 HA ALA A 131 -6.865 -0.841 4.447 1.00 34.51 H new ATOM 0 HB1 ALA A 131 -4.869 -2.253 4.264 1.00 22.41 H new ATOM 0 HB2 ALA A 131 -4.427 -0.532 4.366 1.00 22.41 H new ATOM 0 HB3 ALA A 131 -4.245 -1.584 5.790 1.00 22.41 H new ATOM 1897 N ASP A 132 -8.010 -1.872 6.830 1.00 71.34 N ATOM 1898 CA ASP A 132 -8.873 -2.839 7.486 1.00 3.03 C ATOM 1899 C ASP A 132 -9.719 -3.537 6.432 1.00 25.53 C ATOM 1900 O ASP A 132 -10.452 -2.881 5.691 1.00 61.33 O ATOM 1901 CB ASP A 132 -9.766 -2.118 8.492 1.00 74.34 C ATOM 1902 CG ASP A 132 -10.806 -3.056 9.087 1.00 73.11 C ATOM 1903 OD1 ASP A 132 -10.444 -4.175 9.506 1.00 10.31 O ATOM 1904 OD2 ASP A 132 -12.000 -2.688 9.102 1.00 13.14 O ATOM 0 H ASP A 132 -8.283 -0.906 7.009 1.00 71.34 H new ATOM 0 HA ASP A 132 -8.275 -3.581 8.016 1.00 3.03 H new ATOM 0 HB2 ASP A 132 -9.153 -1.700 9.290 1.00 74.34 H new ATOM 0 HB3 ASP A 132 -10.266 -1.282 8.003 1.00 74.34 H new ATOM 1908 N GLY A 133 -9.610 -4.860 6.354 1.00 63.21 N ATOM 1909 CA GLY A 133 -10.460 -5.695 5.517 1.00 43.21 C ATOM 1910 C GLY A 133 -9.736 -6.456 4.402 1.00 13.35 C ATOM 1911 O GLY A 133 -10.392 -7.220 3.686 1.00 70.10 O ATOM 0 H GLY A 133 -8.915 -5.390 6.881 1.00 63.21 H new ATOM 0 HA2 GLY A 133 -10.972 -6.417 6.153 1.00 43.21 H new ATOM 0 HA3 GLY A 133 -11.228 -5.066 5.066 1.00 43.21 H new ATOM 1915 N LEU A 134 -8.416 -6.296 4.241 1.00 73.34 N ATOM 1916 CA LEU A 134 -7.584 -7.054 3.300 1.00 30.52 C ATOM 1917 C LEU A 134 -6.428 -7.698 4.075 1.00 10.41 C ATOM 1918 O LEU A 134 -6.041 -7.197 5.139 1.00 42.33 O ATOM 1919 CB LEU A 134 -7.073 -6.132 2.175 1.00 1.25 C ATOM 1920 CG LEU A 134 -8.186 -5.507 1.307 1.00 71.50 C ATOM 1921 CD1 LEU A 134 -7.664 -4.284 0.554 1.00 53.22 C ATOM 1922 CD2 LEU A 134 -8.756 -6.516 0.311 1.00 44.42 C ATOM 0 H LEU A 134 -7.882 -5.614 4.779 1.00 73.34 H new ATOM 0 HA LEU A 134 -8.171 -7.841 2.827 1.00 30.52 H new ATOM 0 HB2 LEU A 134 -6.482 -5.331 2.619 1.00 1.25 H new ATOM 0 HB3 LEU A 134 -6.404 -6.702 1.531 1.00 1.25 H new ATOM 0 HG LEU A 134 -8.985 -5.200 1.982 1.00 71.50 H new ATOM 0 HD11 LEU A 134 -8.465 -3.860 -0.051 1.00 53.22 H new ATOM 0 HD12 LEU A 134 -7.315 -3.538 1.268 1.00 53.22 H new ATOM 0 HD13 LEU A 134 -6.838 -4.580 -0.093 1.00 53.22 H new ATOM 0 HD21 LEU A 134 -9.537 -6.040 -0.282 1.00 44.42 H new ATOM 0 HD22 LEU A 134 -7.961 -6.865 -0.348 1.00 44.42 H new ATOM 0 HD23 LEU A 134 -9.177 -7.363 0.852 1.00 44.42 H new ATOM 1933 N ASN A 135 -5.891 -8.804 3.560 1.00 1.22 N ATOM 1934 CA ASN A 135 -5.053 -9.738 4.310 1.00 3.44 C ATOM 1935 C ASN A 135 -3.595 -9.303 4.344 1.00 64.51 C ATOM 1936 O ASN A 135 -2.870 -9.502 3.366 1.00 61.42 O ATOM 1937 CB ASN A 135 -5.128 -11.135 3.694 1.00 21.34 C ATOM 1938 CG ASN A 135 -4.423 -12.136 4.599 1.00 64.53 C ATOM 1939 OD1 ASN A 135 -3.404 -12.818 4.107 1.00 14.25 O flip ATOM 1940 ND2 ASN A 135 -4.809 -12.310 5.750 1.00 33.15 N flip ATOM 0 H ASN A 135 -6.030 -9.081 2.588 1.00 1.22 H new ATOM 0 HA ASN A 135 -5.436 -9.750 5.330 1.00 3.44 H new ATOM 0 HB2 ASN A 135 -6.169 -11.426 3.556 1.00 21.34 H new ATOM 0 HB3 ASN A 135 -4.664 -11.133 2.708 1.00 21.34 H new ATOM 0 HD21 ASN A 135 -5.598 -11.773 6.110 1.00 33.15 H new ATOM 0 HD22 ASN A 135 -4.341 -12.992 6.347 1.00 33.15 H new ATOM 1946 N VAL A 136 -3.154 -8.724 5.457 1.00 62.11 N ATOM 1947 CA VAL A 136 -1.781 -8.277 5.610 1.00 53.40 C ATOM 1948 C VAL A 136 -0.928 -9.444 6.111 1.00 14.31 C ATOM 1949 O VAL A 136 -1.283 -10.109 7.088 1.00 30.15 O ATOM 1950 CB VAL A 136 -1.701 -7.068 6.561 1.00 3.15 C ATOM 1951 CG1 VAL A 136 -0.309 -6.425 6.514 1.00 41.40 C ATOM 1952 CG2 VAL A 136 -2.708 -5.969 6.211 1.00 43.30 C ATOM 0 H VAL A 136 -3.740 -8.554 6.274 1.00 62.11 H new ATOM 0 HA VAL A 136 -1.395 -7.949 4.645 1.00 53.40 H new ATOM 0 HB VAL A 136 -1.924 -7.466 7.551 1.00 3.15 H new ATOM 0 HG11 VAL A 136 -0.278 -5.574 7.194 1.00 41.40 H new ATOM 0 HG12 VAL A 136 0.440 -7.157 6.815 1.00 41.40 H new ATOM 0 HG13 VAL A 136 -0.099 -6.087 5.499 1.00 41.40 H new ATOM 0 HG21 VAL A 136 -2.605 -5.143 6.915 1.00 43.30 H new ATOM 0 HG22 VAL A 136 -2.517 -5.610 5.200 1.00 43.30 H new ATOM 0 HG23 VAL A 136 -3.720 -6.371 6.269 1.00 43.30 H new ATOM 1962 N ILE A 137 0.214 -9.664 5.459 1.00 33.45 N ATOM 1963 CA ILE A 137 1.227 -10.655 5.822 1.00 73.41 C ATOM 1964 C ILE A 137 2.616 -10.015 6.014 1.00 45.02 C ATOM 1965 O ILE A 137 3.601 -10.725 6.217 1.00 24.14 O ATOM 1966 CB ILE A 137 1.166 -11.882 4.871 1.00 74.40 C ATOM 1967 CG1 ILE A 137 1.123 -11.571 3.361 1.00 41.01 C ATOM 1968 CG2 ILE A 137 -0.102 -12.688 5.199 1.00 34.33 C ATOM 1969 CD1 ILE A 137 2.444 -11.072 2.789 1.00 53.42 C ATOM 0 H ILE A 137 0.469 -9.133 4.627 1.00 33.45 H new ATOM 0 HA ILE A 137 1.000 -11.061 6.808 1.00 73.41 H new ATOM 0 HB ILE A 137 2.099 -12.418 5.047 1.00 74.40 H new ATOM 0 HG12 ILE A 137 0.824 -12.471 2.824 1.00 41.01 H new ATOM 0 HG13 ILE A 137 0.354 -10.821 3.178 1.00 41.01 H new ATOM 0 HG21 ILE A 137 -0.163 -13.555 4.541 1.00 34.33 H new ATOM 0 HG22 ILE A 137 -0.063 -13.022 6.236 1.00 34.33 H new ATOM 0 HG23 ILE A 137 -0.981 -12.060 5.053 1.00 34.33 H new ATOM 0 HD11 ILE A 137 2.328 -10.877 1.723 1.00 53.42 H new ATOM 0 HD12 ILE A 137 2.736 -10.153 3.297 1.00 53.42 H new ATOM 0 HD13 ILE A 137 3.214 -11.829 2.938 1.00 53.42 H new ATOM 1980 N GLY A 138 2.708 -8.683 6.037 1.00 13.23 N ATOM 1981 CA GLY A 138 3.755 -7.971 6.767 1.00 24.42 C ATOM 1982 C GLY A 138 3.843 -6.498 6.377 1.00 1.05 C ATOM 1983 O GLY A 138 3.372 -6.092 5.319 1.00 25.52 O ATOM 0 H GLY A 138 2.057 -8.069 5.549 1.00 13.23 H new ATOM 0 HA2 GLY A 138 3.564 -8.049 7.837 1.00 24.42 H new ATOM 0 HA3 GLY A 138 4.715 -8.451 6.579 1.00 24.42 H new ATOM 1987 N VAL A 139 4.450 -5.683 7.237 1.00 52.04 N ATOM 1988 CA VAL A 139 4.571 -4.234 7.098 1.00 63.30 C ATOM 1989 C VAL A 139 5.921 -3.891 7.705 1.00 5.34 C ATOM 1990 O VAL A 139 6.102 -4.025 8.922 1.00 11.32 O ATOM 1991 CB VAL A 139 3.391 -3.529 7.807 1.00 42.30 C ATOM 1992 CG1 VAL A 139 3.563 -2.016 8.004 1.00 44.33 C ATOM 1993 CG2 VAL A 139 2.102 -3.780 7.019 1.00 70.31 C ATOM 0 H VAL A 139 4.891 -6.031 8.088 1.00 52.04 H new ATOM 0 HA VAL A 139 4.525 -3.897 6.063 1.00 63.30 H new ATOM 0 HB VAL A 139 3.352 -3.962 8.807 1.00 42.30 H new ATOM 0 HG11 VAL A 139 2.685 -1.613 8.509 1.00 44.33 H new ATOM 0 HG12 VAL A 139 4.449 -1.826 8.610 1.00 44.33 H new ATOM 0 HG13 VAL A 139 3.677 -1.533 7.033 1.00 44.33 H new ATOM 0 HG21 VAL A 139 1.269 -3.284 7.517 1.00 70.31 H new ATOM 0 HG22 VAL A 139 2.210 -3.383 6.009 1.00 70.31 H new ATOM 0 HG23 VAL A 139 1.909 -4.852 6.969 1.00 70.31 H new ATOM 2003 N ALA A 140 6.888 -3.527 6.865 1.00 21.54 N ATOM 2004 CA ALA A 140 8.261 -3.270 7.268 1.00 5.11 C ATOM 2005 C ALA A 140 8.837 -2.134 6.421 1.00 3.31 C ATOM 2006 O ALA A 140 8.250 -1.727 5.417 1.00 70.44 O ATOM 2007 CB ALA A 140 9.063 -4.567 7.104 1.00 2.12 C ATOM 0 H ALA A 140 6.731 -3.401 5.865 1.00 21.54 H new ATOM 0 HA ALA A 140 8.311 -2.959 8.311 1.00 5.11 H new ATOM 0 HB1 ALA A 140 10.097 -4.395 7.402 1.00 2.12 H new ATOM 0 HB2 ALA A 140 8.629 -5.345 7.732 1.00 2.12 H new ATOM 0 HB3 ALA A 140 9.033 -4.884 6.061 1.00 2.12 H new ATOM 2013 N ARG A 141 9.999 -1.611 6.814 1.00 34.12 N ATOM 2014 CA ARG A 141 10.797 -0.792 5.910 1.00 43.30 C ATOM 2015 C ARG A 141 11.563 -1.718 4.974 1.00 71.14 C ATOM 2016 O ARG A 141 11.861 -2.863 5.345 1.00 64.11 O ATOM 2017 CB ARG A 141 11.772 0.124 6.671 1.00 53.10 C ATOM 2018 CG ARG A 141 12.790 -0.669 7.490 1.00 71.40 C ATOM 2019 CD ARG A 141 13.743 0.184 8.330 1.00 52.44 C ATOM 2020 NE ARG A 141 14.097 -0.572 9.534 1.00 22.54 N ATOM 2021 CZ ARG A 141 15.155 -0.445 10.332 1.00 3.22 C ATOM 2022 NH1 ARG A 141 16.119 0.439 10.123 1.00 24.55 N ATOM 2023 NH2 ARG A 141 15.234 -1.262 11.366 1.00 32.44 N ATOM 0 H ARG A 141 10.403 -1.739 7.742 1.00 34.12 H new ATOM 0 HA ARG A 141 10.130 -0.142 5.344 1.00 43.30 H new ATOM 0 HB2 ARG A 141 12.298 0.762 5.961 1.00 53.10 H new ATOM 0 HB3 ARG A 141 11.208 0.781 7.333 1.00 53.10 H new ATOM 0 HG2 ARG A 141 12.253 -1.348 8.153 1.00 71.40 H new ATOM 0 HG3 ARG A 141 13.379 -1.286 6.812 1.00 71.40 H new ATOM 0 HD2 ARG A 141 14.638 0.428 7.758 1.00 52.44 H new ATOM 0 HD3 ARG A 141 13.270 1.128 8.600 1.00 52.44 H new ATOM 0 HE ARG A 141 13.436 -1.302 9.800 1.00 22.54 H new ATOM 0 HH11 ARG A 141 16.072 1.064 9.319 1.00 24.55 H new ATOM 0 HH12 ARG A 141 16.908 0.494 10.766 1.00 24.55 H new ATOM 0 HH21 ARG A 141 14.502 -1.954 11.526 1.00 32.44 H new ATOM 0 HH22 ARG A 141 16.027 -1.201 12.005 1.00 32.44 H new ATOM 2034 N ASP A 142 12.003 -1.133 3.866 1.00 50.13 N ATOM 2035 CA ASP A 142 12.946 -1.684 2.897 1.00 53.33 C ATOM 2036 C ASP A 142 12.485 -3.061 2.415 1.00 25.54 C ATOM 2037 O ASP A 142 11.293 -3.359 2.425 1.00 45.33 O ATOM 2038 CB ASP A 142 14.387 -1.643 3.451 1.00 2.44 C ATOM 2039 CG ASP A 142 14.790 -0.244 3.908 1.00 31.44 C ATOM 2040 OD1 ASP A 142 14.650 0.721 3.118 1.00 71.11 O ATOM 2041 OD2 ASP A 142 15.204 -0.080 5.079 1.00 70.51 O ATOM 0 H ASP A 142 11.690 -0.199 3.602 1.00 50.13 H new ATOM 0 HA ASP A 142 12.964 -1.058 2.005 1.00 53.33 H new ATOM 0 HB2 ASP A 142 14.472 -2.335 4.289 1.00 2.44 H new ATOM 0 HB3 ASP A 142 15.080 -1.986 2.682 1.00 2.44 H new ATOM 2045 N ASP A 143 13.408 -3.894 1.948 1.00 64.44 N ATOM 2046 CA ASP A 143 13.163 -5.190 1.311 1.00 31.25 C ATOM 2047 C ASP A 143 13.553 -6.355 2.235 1.00 12.44 C ATOM 2048 O ASP A 143 13.625 -7.498 1.787 1.00 13.15 O ATOM 2049 CB ASP A 143 13.896 -5.225 -0.045 1.00 14.43 C ATOM 2050 CG ASP A 143 15.399 -4.974 0.068 1.00 63.50 C ATOM 2051 OD1 ASP A 143 16.032 -5.336 1.089 1.00 5.35 O ATOM 2052 OD2 ASP A 143 15.923 -4.275 -0.823 1.00 74.12 O ATOM 0 H ASP A 143 14.403 -3.675 2.005 1.00 64.44 H new ATOM 0 HA ASP A 143 12.096 -5.314 1.125 1.00 31.25 H new ATOM 0 HB2 ASP A 143 13.732 -6.196 -0.513 1.00 14.43 H new ATOM 0 HB3 ASP A 143 13.459 -4.475 -0.705 1.00 14.43 H new ATOM 2056 N SER A 144 13.793 -6.082 3.522 1.00 14.05 N ATOM 2057 CA SER A 144 14.268 -7.025 4.528 1.00 64.21 C ATOM 2058 C SER A 144 13.291 -8.174 4.800 1.00 12.33 C ATOM 2059 O SER A 144 13.699 -9.148 5.432 1.00 34.12 O ATOM 2060 CB SER A 144 14.501 -6.249 5.832 1.00 44.31 C ATOM 2061 OG SER A 144 15.183 -7.023 6.800 1.00 24.53 O ATOM 0 H SER A 144 13.652 -5.147 3.905 1.00 14.05 H new ATOM 0 HA SER A 144 15.183 -7.479 4.148 1.00 64.21 H new ATOM 0 HB2 SER A 144 15.076 -5.348 5.619 1.00 44.31 H new ATOM 0 HB3 SER A 144 13.542 -5.926 6.237 1.00 44.31 H new ATOM 0 HG SER A 144 14.916 -7.962 6.715 1.00 24.53 H new ATOM 2066 N GLU A 145 12.022 -8.056 4.401 1.00 33.41 N ATOM 2067 CA GLU A 145 10.986 -9.040 4.681 1.00 44.21 C ATOM 2068 C GLU A 145 10.302 -9.513 3.390 1.00 50.41 C ATOM 2069 O GLU A 145 9.307 -10.225 3.453 1.00 14.41 O ATOM 2070 CB GLU A 145 10.000 -8.503 5.740 1.00 61.34 C ATOM 2071 CG GLU A 145 10.695 -8.045 7.043 1.00 43.40 C ATOM 2072 CD GLU A 145 9.815 -8.154 8.299 1.00 65.40 C ATOM 2073 OE1 GLU A 145 9.251 -9.243 8.585 1.00 2.44 O ATOM 2074 OE2 GLU A 145 9.734 -7.177 9.085 1.00 4.43 O ATOM 0 H GLU A 145 11.685 -7.257 3.864 1.00 33.41 H new ATOM 0 HA GLU A 145 11.449 -9.928 5.111 1.00 44.21 H new ATOM 0 HB2 GLU A 145 9.445 -7.665 5.318 1.00 61.34 H new ATOM 0 HB3 GLU A 145 9.273 -9.280 5.977 1.00 61.34 H new ATOM 0 HG2 GLU A 145 11.595 -8.642 7.191 1.00 43.40 H new ATOM 0 HG3 GLU A 145 11.015 -7.010 6.926 1.00 43.40 H new ATOM 2079 N VAL A 146 10.832 -9.197 2.204 1.00 51.31 N ATOM 2080 CA VAL A 146 10.278 -9.718 0.947 1.00 1.45 C ATOM 2081 C VAL A 146 10.323 -11.252 0.934 1.00 33.23 C ATOM 2082 O VAL A 146 9.443 -11.910 0.383 1.00 21.31 O ATOM 2083 CB VAL A 146 11.042 -9.092 -0.235 1.00 45.21 C ATOM 2084 CG1 VAL A 146 10.576 -9.629 -1.590 1.00 4.03 C ATOM 2085 CG2 VAL A 146 10.825 -7.571 -0.253 1.00 23.35 C ATOM 0 H VAL A 146 11.640 -8.586 2.087 1.00 51.31 H new ATOM 0 HA VAL A 146 9.228 -9.440 0.854 1.00 1.45 H new ATOM 0 HB VAL A 146 12.091 -9.351 -0.090 1.00 45.21 H new ATOM 0 HG11 VAL A 146 11.148 -9.153 -2.386 1.00 4.03 H new ATOM 0 HG12 VAL A 146 10.730 -10.707 -1.627 1.00 4.03 H new ATOM 0 HG13 VAL A 146 9.517 -9.409 -1.724 1.00 4.03 H new ATOM 0 HG21 VAL A 146 11.368 -7.136 -1.092 1.00 23.35 H new ATOM 0 HG22 VAL A 146 9.762 -7.356 -0.359 1.00 23.35 H new ATOM 0 HG23 VAL A 146 11.191 -7.140 0.679 1.00 23.35 H new ATOM 2095 N ASP A 147 11.313 -11.821 1.615 1.00 25.14 N ATOM 2096 CA ASP A 147 11.647 -13.237 1.621 1.00 25.23 C ATOM 2097 C ASP A 147 10.610 -14.115 2.347 1.00 12.22 C ATOM 2098 O ASP A 147 10.724 -15.339 2.358 1.00 53.23 O ATOM 2099 CB ASP A 147 13.026 -13.366 2.275 1.00 4.24 C ATOM 2100 CG ASP A 147 13.908 -14.448 1.655 1.00 61.41 C ATOM 2101 OD1 ASP A 147 13.819 -14.733 0.435 1.00 74.20 O ATOM 2102 OD2 ASP A 147 14.790 -14.967 2.373 1.00 5.23 O ATOM 0 H ASP A 147 11.936 -11.275 2.209 1.00 25.14 H new ATOM 0 HA ASP A 147 11.650 -13.603 0.594 1.00 25.23 H new ATOM 0 HB2 ASP A 147 13.541 -12.408 2.206 1.00 4.24 H new ATOM 0 HB3 ASP A 147 12.895 -13.582 3.335 1.00 4.24 H new ATOM 2106 N LYS A 148 9.585 -13.502 2.952 1.00 44.33 N ATOM 2107 CA LYS A 148 8.387 -14.137 3.494 1.00 65.31 C ATOM 2108 C LYS A 148 7.181 -13.820 2.615 1.00 22.21 C ATOM 2109 O LYS A 148 6.349 -14.705 2.426 1.00 25.34 O ATOM 2110 CB LYS A 148 8.146 -13.737 4.965 1.00 61.43 C ATOM 2111 CG LYS A 148 8.195 -12.234 5.243 1.00 72.32 C ATOM 2112 CD LYS A 148 7.437 -11.772 6.484 1.00 31.41 C ATOM 2113 CE LYS A 148 7.958 -12.375 7.791 1.00 21.32 C ATOM 2114 NZ LYS A 148 7.164 -11.883 8.934 1.00 44.44 N ATOM 0 H LYS A 148 9.573 -12.490 3.082 1.00 44.33 H new ATOM 0 HA LYS A 148 8.538 -15.216 3.487 1.00 65.31 H new ATOM 0 HB2 LYS A 148 7.172 -14.117 5.274 1.00 61.43 H new ATOM 0 HB3 LYS A 148 8.893 -14.231 5.587 1.00 61.43 H new ATOM 0 HG2 LYS A 148 9.238 -11.934 5.343 1.00 72.32 H new ATOM 0 HG3 LYS A 148 7.794 -11.708 4.377 1.00 72.32 H new ATOM 0 HD2 LYS A 148 7.494 -10.685 6.549 1.00 31.41 H new ATOM 0 HD3 LYS A 148 6.384 -12.030 6.371 1.00 31.41 H new ATOM 0 HE2 LYS A 148 7.905 -13.463 7.744 1.00 21.32 H new ATOM 0 HE3 LYS A 148 9.007 -12.112 7.928 1.00 21.32 H new ATOM 0 HZ1 LYS A 148 7.528 -12.300 9.815 1.00 44.44 H new ATOM 0 HZ2 LYS A 148 7.236 -10.847 8.986 1.00 44.44 H new ATOM 0 HZ3 LYS A 148 6.168 -12.155 8.808 1.00 44.44 H new ATOM 2124 N TRP A 149 7.101 -12.621 2.025 1.00 13.02 N ATOM 2125 CA TRP A 149 6.051 -12.174 1.103 1.00 44.32 C ATOM 2126 C TRP A 149 6.203 -12.811 -0.292 1.00 42.43 C ATOM 2127 O TRP A 149 6.043 -12.166 -1.335 1.00 71.11 O ATOM 2128 CB TRP A 149 6.080 -10.646 1.010 1.00 2.12 C ATOM 2129 CG TRP A 149 6.175 -9.868 2.294 1.00 34.44 C ATOM 2130 CD1 TRP A 149 5.675 -10.240 3.494 1.00 44.02 C ATOM 2131 CD2 TRP A 149 6.796 -8.566 2.521 1.00 65.34 C ATOM 2132 NE1 TRP A 149 5.951 -9.277 4.439 1.00 2.02 N ATOM 2133 CE2 TRP A 149 6.624 -8.206 3.891 1.00 62.32 C ATOM 2134 CE3 TRP A 149 7.471 -7.642 1.699 1.00 70.40 C ATOM 2135 CZ2 TRP A 149 7.066 -6.976 4.406 1.00 12.14 C ATOM 2136 CZ3 TRP A 149 7.956 -6.427 2.210 1.00 34.52 C ATOM 2137 CH2 TRP A 149 7.741 -6.085 3.555 1.00 31.42 C ATOM 0 H TRP A 149 7.804 -11.899 2.187 1.00 13.02 H new ATOM 0 HA TRP A 149 5.086 -12.498 1.494 1.00 44.32 H new ATOM 0 HB2 TRP A 149 6.927 -10.364 0.384 1.00 2.12 H new ATOM 0 HB3 TRP A 149 5.178 -10.325 0.489 1.00 2.12 H new ATOM 0 HD1 TRP A 149 5.138 -11.158 3.684 1.00 44.02 H new ATOM 0 HE1 TRP A 149 5.690 -9.347 5.422 1.00 2.02 H new ATOM 0 HE3 TRP A 149 7.619 -7.873 0.654 1.00 70.40 H new ATOM 0 HZ2 TRP A 149 6.890 -6.719 5.440 1.00 12.14 H new ATOM 0 HZ3 TRP A 149 8.498 -5.751 1.565 1.00 34.52 H new ATOM 0 HH2 TRP A 149 8.094 -5.138 3.935 1.00 31.42 H new ATOM 2147 N SER A 150 6.610 -14.076 -0.310 1.00 32.52 N ATOM 2148 CA SER A 150 6.950 -14.845 -1.486 1.00 63.13 C ATOM 2149 C SER A 150 6.946 -16.350 -1.209 1.00 42.20 C ATOM 2150 O SER A 150 7.021 -17.122 -2.167 1.00 3.45 O ATOM 2151 CB SER A 150 8.334 -14.374 -1.977 1.00 10.32 C ATOM 2152 OG SER A 150 8.495 -14.606 -3.360 1.00 23.54 O ATOM 0 H SER A 150 6.715 -14.616 0.549 1.00 32.52 H new ATOM 0 HA SER A 150 6.198 -14.678 -2.257 1.00 63.13 H new ATOM 0 HB2 SER A 150 8.454 -13.311 -1.768 1.00 10.32 H new ATOM 0 HB3 SER A 150 9.115 -14.897 -1.425 1.00 10.32 H new ATOM 0 HG SER A 150 9.381 -14.296 -3.643 1.00 23.54 H new ATOM 2157 N LYS A 151 6.889 -16.795 0.054 1.00 44.23 N ATOM 2158 CA LYS A 151 7.050 -18.215 0.374 1.00 71.42 C ATOM 2159 C LYS A 151 5.876 -18.666 1.218 1.00 61.24 C ATOM 2160 O LYS A 151 5.999 -18.691 2.462 1.00 13.15 O ATOM 2161 CB LYS A 151 8.424 -18.447 1.025 1.00 33.34 C ATOM 2162 CG LYS A 151 9.588 -18.007 0.116 1.00 24.14 C ATOM 2163 CD LYS A 151 10.941 -18.235 0.793 1.00 70.33 C ATOM 2164 CE LYS A 151 12.037 -17.378 0.162 1.00 72.44 C ATOM 2165 NZ LYS A 151 13.267 -17.413 0.976 1.00 12.01 N ATOM 0 H LYS A 151 6.734 -16.195 0.864 1.00 44.23 H new ATOM 0 HA LYS A 151 7.040 -18.830 -0.526 1.00 71.42 H new ATOM 0 HB2 LYS A 151 8.474 -17.899 1.966 1.00 33.34 H new ATOM 0 HB3 LYS A 151 8.535 -19.504 1.266 1.00 33.34 H new ATOM 0 HG2 LYS A 151 9.550 -18.562 -0.821 1.00 24.14 H new ATOM 0 HG3 LYS A 151 9.478 -16.952 -0.134 1.00 24.14 H new ATOM 0 HD2 LYS A 151 10.861 -18.001 1.855 1.00 70.33 H new ATOM 0 HD3 LYS A 151 11.213 -19.288 0.718 1.00 70.33 H new ATOM 0 HE2 LYS A 151 12.252 -17.738 -0.844 1.00 72.44 H new ATOM 0 HE3 LYS A 151 11.689 -16.349 0.065 1.00 72.44 H new ATOM 0 HZ1 LYS A 151 13.922 -16.675 0.647 1.00 12.01 H new ATOM 0 HZ2 LYS A 151 13.028 -17.244 1.974 1.00 12.01 H new ATOM 0 HZ3 LYS A 151 13.719 -18.345 0.881 1.00 12.01 H new TER 2175 LYS A 151