USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=41 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 6 THR OG1 : rot -163:sc= 0.289 USER MOD Set 1.2: A 150 SER OG : rot -56:sc= 0.278 USER MOD Set 2.1: A 111 SER OG : rot 34:sc= 1.49 USER MOD Set 2.2: A 123 TYR OH : rot 167:sc= 0.379 USER MOD Set 3.1: A 74 TYR OH : rot 165:sc= 1.17 USER MOD Set 3.2: A 101 GLN : amide:sc= 1.07 K(o=2.2,f=-2.1) USER MOD Set 4.1: A 39 SER OG : rot 180:sc= 0.605 USER MOD Set 4.2: A 68 GLN : amide:sc= 0.177 K(o=0.78,f=-0.75) USER MOD Single : A 1 GLY N :NH3+ 139:sc= 0.0881 (180deg=0) USER MOD Single : A 2 MET CE :methyl 164:sc= -0.414 (180deg=-1.13) USER MOD Single : A 4 LYS NZ :NH3+ -156:sc= 1.22 (180deg=0.533) USER MOD Single : A 5 LYS NZ :NH3+ -178:sc= 1.28 (180deg=1.21) USER MOD Single : A 10 TYR OH : rot 130:sc= 0 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 77:sc= 1.44 USER MOD Single : A 14 SER OG : rot 180:sc= 0.111 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0.0414 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl 159:sc= -0.196 (180deg=-1.48) USER MOD Single : A 23 LYS NZ :NH3+ -163:sc= -0.0364 (180deg=-0.268) USER MOD Single : A 25 ASN :FLIP amide:sc= -0.131 F(o=-1.4!,f=-0.13) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot -150:sc= -0.133 USER MOD Single : A 34 LYS NZ :NH3+ -166:sc= 1.22 (180deg=1.08) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) 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 37:sc= 0.0963 USER MOD Single : A 57 GLN : amide:sc= -0.0612 X(o=-0.061,f=-0.061) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 ASN : amide:sc= 1.12 K(o=1.1,f=-2.9!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -0.125 X(o=-0.13,f=0) USER MOD Single : A 75 ASN : amide:sc= 0.402 X(o=0.4,f=-0.016) USER MOD Single : A 76 ASN :FLIP amide:sc= 0.445 F(o=-0.19,f=0.45) USER MOD Single : A 77 TYR OH : rot 32:sc= 0.951 USER MOD Single : A 84 SER OG : rot -72:sc= 0.0865 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 179:sc= 0.106 (180deg=0.106) USER MOD Single : A 97 THR OG1 : rot 140:sc= 0.0706 USER MOD Single : A 102 MET CE :methyl 148:sc= 0 (180deg=-1.43) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 TYR OH : rot 140:sc= 1.26 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot -160:sc= -0.136 USER MOD Single : A 118 THR OG1 : rot 122:sc= 0.37 USER MOD Single : A 119 ASN : amide:sc= 0.317 K(o=0.32,f=-5.4!) USER MOD Single : A 120 HIS : no HD1:sc= -0.692 X(o=-0.69,f=-0.29) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HD1:sc= -0.455 K(o=-0.46,f=-1.1) USER MOD Single : A 128 ASN : amide:sc= -0.141 K(o=-0.14,f=-1.1!) USER MOD Single : A 135 ASN : amide:sc= 0.116 X(o=0.12,f=0) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 178:sc= 1.19 (180deg=1.14) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -6.358 -23.592 -8.916 1.00 13.55 N ATOM 2 CA GLY A 1 -5.390 -23.004 -9.850 1.00 62.23 C ATOM 3 C GLY A 1 -3.975 -23.055 -9.289 1.00 63.20 C ATOM 4 O GLY A 1 -3.791 -23.184 -8.074 1.00 12.32 O ATOM 0 H1 GLY A 1 -7.221 -23.012 -8.900 1.00 13.55 H new ATOM 0 H2 GLY A 1 -6.595 -24.557 -9.223 1.00 13.55 H new ATOM 0 H3 GLY A 1 -5.945 -23.624 -7.962 1.00 13.55 H new ATOM 0 HA2 GLY A 1 -5.426 -23.539 -10.799 1.00 62.23 H new ATOM 0 HA3 GLY A 1 -5.664 -21.969 -10.057 1.00 62.23 H new ATOM 8 N MET A 2 -2.968 -22.961 -10.163 1.00 44.23 N ATOM 9 CA MET A 2 -1.541 -22.968 -9.844 1.00 55.21 C ATOM 10 C MET A 2 -0.886 -21.785 -10.566 1.00 42.34 C ATOM 11 O MET A 2 -0.629 -21.847 -11.772 1.00 55.12 O ATOM 12 CB MET A 2 -0.886 -24.304 -10.243 1.00 42.14 C ATOM 13 CG MET A 2 -1.393 -25.531 -9.465 1.00 43.10 C ATOM 14 SD MET A 2 -0.491 -26.016 -7.956 1.00 43.20 S ATOM 15 CE MET A 2 -0.766 -24.607 -6.850 1.00 41.44 C ATOM 0 H MET A 2 -3.138 -22.873 -11.165 1.00 44.23 H new ATOM 0 HA MET A 2 -1.401 -22.865 -8.768 1.00 55.21 H new ATOM 0 HB2 MET A 2 -1.054 -24.471 -11.307 1.00 42.14 H new ATOM 0 HB3 MET A 2 0.191 -24.221 -10.100 1.00 42.14 H new ATOM 0 HG2 MET A 2 -2.431 -25.347 -9.189 1.00 43.10 H new ATOM 0 HG3 MET A 2 -1.390 -26.383 -10.145 1.00 43.10 H new ATOM 0 HE1 MET A 2 -0.520 -24.894 -5.828 1.00 41.44 H new ATOM 0 HE2 MET A 2 -0.132 -23.775 -7.156 1.00 41.44 H new ATOM 0 HE3 MET A 2 -1.812 -24.304 -6.900 1.00 41.44 H new ATOM 23 N ALA A 3 -0.682 -20.687 -9.840 1.00 73.10 N ATOM 24 CA ALA A 3 -0.018 -19.444 -10.225 1.00 32.14 C ATOM 25 C ALA A 3 -0.191 -18.496 -9.052 1.00 35.14 C ATOM 26 O ALA A 3 -1.318 -18.299 -8.583 1.00 23.41 O ATOM 27 CB ALA A 3 -0.610 -18.782 -11.479 1.00 33.01 C ATOM 0 H ALA A 3 -1.009 -20.642 -8.875 1.00 73.10 H new ATOM 0 HA ALA A 3 1.022 -19.667 -10.465 1.00 32.14 H new ATOM 0 HB1 ALA A 3 -0.063 -17.865 -11.699 1.00 33.01 H new ATOM 0 HB2 ALA A 3 -0.528 -19.465 -12.324 1.00 33.01 H new ATOM 0 HB3 ALA A 3 -1.659 -18.545 -11.304 1.00 33.01 H new ATOM 33 N LYS A 4 0.908 -17.941 -8.549 1.00 33.21 N ATOM 34 CA LYS A 4 0.853 -16.835 -7.608 1.00 32.44 C ATOM 35 C LYS A 4 1.731 -15.701 -8.121 1.00 40.41 C ATOM 36 O LYS A 4 2.940 -15.684 -7.890 1.00 44.13 O ATOM 37 CB LYS A 4 1.117 -17.325 -6.181 1.00 21.45 C ATOM 38 CG LYS A 4 2.552 -17.772 -5.898 1.00 35.35 C ATOM 39 CD LYS A 4 3.331 -16.727 -5.073 1.00 44.52 C ATOM 40 CE LYS A 4 3.287 -17.049 -3.583 1.00 31.22 C ATOM 41 NZ LYS A 4 4.185 -18.175 -3.267 1.00 72.22 N ATOM 0 H LYS A 4 1.853 -18.245 -8.782 1.00 33.21 H new ATOM 0 HA LYS A 4 -0.147 -16.407 -7.541 1.00 32.44 H new ATOM 0 HB2 LYS A 4 0.859 -16.525 -5.486 1.00 21.45 H new ATOM 0 HB3 LYS A 4 0.446 -18.158 -5.971 1.00 21.45 H new ATOM 0 HG2 LYS A 4 2.537 -18.720 -5.361 1.00 35.35 H new ATOM 0 HG3 LYS A 4 3.069 -17.948 -6.841 1.00 35.35 H new ATOM 0 HD2 LYS A 4 4.367 -16.695 -5.409 1.00 44.52 H new ATOM 0 HD3 LYS A 4 2.909 -15.737 -5.245 1.00 44.52 H new ATOM 0 HE2 LYS A 4 3.580 -16.171 -3.007 1.00 31.22 H new ATOM 0 HE3 LYS A 4 2.267 -17.297 -3.289 1.00 31.22 H new ATOM 0 HZ1 LYS A 4 3.864 -18.640 -2.394 1.00 72.22 H new ATOM 0 HZ2 LYS A 4 4.172 -18.860 -4.050 1.00 72.22 H new ATOM 0 HZ3 LYS A 4 5.153 -17.820 -3.134 1.00 72.22 H new ATOM 51 N LYS A 5 1.162 -14.789 -8.906 1.00 54.14 N ATOM 52 CA LYS A 5 1.907 -13.593 -9.280 1.00 31.15 C ATOM 53 C LYS A 5 1.866 -12.610 -8.140 1.00 35.33 C ATOM 54 O LYS A 5 1.047 -12.707 -7.226 1.00 23.21 O ATOM 55 CB LYS A 5 1.400 -12.918 -10.555 1.00 12.31 C ATOM 56 CG LYS A 5 1.175 -13.915 -11.661 1.00 22.04 C ATOM 57 CD LYS A 5 1.244 -13.268 -13.042 1.00 54.41 C ATOM 58 CE LYS A 5 0.901 -14.346 -14.068 1.00 40.11 C ATOM 59 NZ LYS A 5 1.741 -14.250 -15.272 1.00 21.14 N ATOM 0 H LYS A 5 0.217 -14.851 -9.285 1.00 54.14 H new ATOM 0 HA LYS A 5 2.927 -13.914 -9.491 1.00 31.15 H new ATOM 0 HB2 LYS A 5 0.469 -12.393 -10.343 1.00 12.31 H new ATOM 0 HB3 LYS A 5 2.121 -12.169 -10.882 1.00 12.31 H new ATOM 0 HG2 LYS A 5 1.923 -14.705 -11.594 1.00 22.04 H new ATOM 0 HG3 LYS A 5 0.201 -14.386 -11.531 1.00 22.04 H new ATOM 0 HD2 LYS A 5 0.544 -12.435 -13.111 1.00 54.41 H new ATOM 0 HD3 LYS A 5 2.239 -12.864 -13.228 1.00 54.41 H new ATOM 0 HE2 LYS A 5 1.027 -15.330 -13.616 1.00 40.11 H new ATOM 0 HE3 LYS A 5 -0.148 -14.257 -14.350 1.00 40.11 H new ATOM 0 HZ1 LYS A 5 1.452 -14.978 -15.956 1.00 21.14 H new ATOM 0 HZ2 LYS A 5 1.628 -13.309 -15.700 1.00 21.14 H new ATOM 0 HZ3 LYS A 5 2.738 -14.395 -15.012 1.00 21.14 H new ATOM 69 N THR A 6 2.688 -11.596 -8.310 1.00 12.14 N ATOM 70 CA THR A 6 2.927 -10.558 -7.329 1.00 14.31 C ATOM 71 C THR A 6 2.874 -9.213 -8.062 1.00 0.44 C ATOM 72 O THR A 6 3.416 -9.099 -9.168 1.00 13.44 O ATOM 73 CB THR A 6 4.273 -10.845 -6.634 1.00 40.10 C ATOM 74 OG1 THR A 6 4.290 -12.156 -6.089 1.00 63.32 O ATOM 75 CG2 THR A 6 4.579 -9.836 -5.527 1.00 21.24 C ATOM 0 H THR A 6 3.228 -11.467 -9.166 1.00 12.14 H new ATOM 0 HA THR A 6 2.174 -10.530 -6.541 1.00 14.31 H new ATOM 0 HB THR A 6 5.043 -10.755 -7.400 1.00 40.10 H new ATOM 0 HG1 THR A 6 5.016 -12.229 -5.434 1.00 63.32 H new ATOM 0 HG21 THR A 6 5.537 -10.080 -5.067 1.00 21.24 H new ATOM 0 HG22 THR A 6 4.625 -8.833 -5.951 1.00 21.24 H new ATOM 0 HG23 THR A 6 3.794 -9.875 -4.772 1.00 21.24 H new ATOM 83 N LEU A 7 2.287 -8.165 -7.480 1.00 72.44 N ATOM 84 CA LEU A 7 2.307 -6.800 -8.030 1.00 32.34 C ATOM 85 C LEU A 7 3.017 -5.864 -7.050 1.00 63.30 C ATOM 86 O LEU A 7 2.914 -6.060 -5.840 1.00 52.12 O ATOM 87 CB LEU A 7 0.869 -6.337 -8.326 1.00 20.42 C ATOM 88 CG LEU A 7 0.753 -4.945 -8.985 1.00 24.21 C ATOM 89 CD1 LEU A 7 1.438 -4.880 -10.359 1.00 62.31 C ATOM 90 CD2 LEU A 7 -0.726 -4.579 -9.140 1.00 71.03 C ATOM 0 H LEU A 7 1.776 -8.238 -6.600 1.00 72.44 H new ATOM 0 HA LEU A 7 2.860 -6.783 -8.969 1.00 32.34 H new ATOM 0 HB2 LEU A 7 0.394 -7.071 -8.977 1.00 20.42 H new ATOM 0 HB3 LEU A 7 0.307 -6.328 -7.392 1.00 20.42 H new ATOM 0 HG LEU A 7 1.263 -4.235 -8.334 1.00 24.21 H new ATOM 0 HD11 LEU A 7 1.325 -3.879 -10.775 1.00 62.31 H new ATOM 0 HD12 LEU A 7 2.498 -5.109 -10.248 1.00 62.31 H new ATOM 0 HD13 LEU A 7 0.978 -5.606 -11.030 1.00 62.31 H new ATOM 0 HD21 LEU A 7 -0.811 -3.597 -9.605 1.00 71.03 H new ATOM 0 HD22 LEU A 7 -1.221 -5.321 -9.767 1.00 71.03 H new ATOM 0 HD23 LEU A 7 -1.200 -4.558 -8.159 1.00 71.03 H new ATOM 101 N ILE A 8 3.717 -4.849 -7.562 1.00 61.23 N ATOM 102 CA ILE A 8 4.429 -3.831 -6.794 1.00 35.11 C ATOM 103 C ILE A 8 3.881 -2.482 -7.268 1.00 41.03 C ATOM 104 O ILE A 8 4.014 -2.169 -8.451 1.00 13.11 O ATOM 105 CB ILE A 8 5.956 -3.967 -7.019 1.00 33.54 C ATOM 106 CG1 ILE A 8 6.531 -5.277 -6.432 1.00 15.43 C ATOM 107 CG2 ILE A 8 6.736 -2.789 -6.411 1.00 21.35 C ATOM 108 CD1 ILE A 8 7.769 -5.751 -7.208 1.00 53.21 C ATOM 0 H ILE A 8 3.805 -4.710 -8.569 1.00 61.23 H new ATOM 0 HA ILE A 8 4.276 -3.936 -5.720 1.00 35.11 H new ATOM 0 HB ILE A 8 6.081 -3.975 -8.102 1.00 33.54 H new ATOM 0 HG12 ILE A 8 6.794 -5.122 -5.386 1.00 15.43 H new ATOM 0 HG13 ILE A 8 5.766 -6.053 -6.457 1.00 15.43 H new ATOM 0 HG21 ILE A 8 7.802 -2.926 -6.592 1.00 21.35 H new ATOM 0 HG22 ILE A 8 6.406 -1.858 -6.872 1.00 21.35 H new ATOM 0 HG23 ILE A 8 6.553 -2.747 -5.337 1.00 21.35 H new ATOM 0 HD11 ILE A 8 8.144 -6.674 -6.766 1.00 53.21 H new ATOM 0 HD12 ILE A 8 7.499 -5.931 -8.249 1.00 53.21 H new ATOM 0 HD13 ILE A 8 8.543 -4.985 -7.161 1.00 53.21 H new ATOM 119 N LEU A 9 3.263 -1.702 -6.378 1.00 54.13 N ATOM 120 CA LEU A 9 2.699 -0.381 -6.644 1.00 0.02 C ATOM 121 C LEU A 9 3.477 0.674 -5.861 1.00 33.32 C ATOM 122 O LEU A 9 3.331 0.782 -4.636 1.00 72.23 O ATOM 123 CB LEU A 9 1.210 -0.377 -6.259 1.00 72.32 C ATOM 124 CG LEU A 9 0.329 -1.013 -7.346 1.00 4.12 C ATOM 125 CD1 LEU A 9 -0.990 -1.508 -6.743 1.00 32.04 C ATOM 126 CD2 LEU A 9 0.051 -0.016 -8.477 1.00 44.40 C ATOM 0 H LEU A 9 3.138 -1.990 -5.408 1.00 54.13 H new ATOM 0 HA LEU A 9 2.780 -0.144 -7.705 1.00 0.02 H new ATOM 0 HB2 LEU A 9 1.077 -0.919 -5.323 1.00 72.32 H new ATOM 0 HB3 LEU A 9 0.884 0.648 -6.083 1.00 72.32 H new ATOM 0 HG LEU A 9 0.867 -1.864 -7.763 1.00 4.12 H new ATOM 0 HD11 LEU A 9 -1.603 -1.956 -7.526 1.00 32.04 H new ATOM 0 HD12 LEU A 9 -0.782 -2.253 -5.975 1.00 32.04 H new ATOM 0 HD13 LEU A 9 -1.525 -0.668 -6.299 1.00 32.04 H new ATOM 0 HD21 LEU A 9 -0.574 -0.490 -9.234 1.00 44.40 H new ATOM 0 HD22 LEU A 9 -0.464 0.856 -8.075 1.00 44.40 H new ATOM 0 HD23 LEU A 9 0.993 0.295 -8.928 1.00 44.40 H new ATOM 137 N TYR A 10 4.293 1.471 -6.554 1.00 31.52 N ATOM 138 CA TYR A 10 4.972 2.623 -5.967 1.00 22.32 C ATOM 139 C TYR A 10 4.217 3.904 -6.294 1.00 62.10 C ATOM 140 O TYR A 10 4.115 4.292 -7.458 1.00 31.55 O ATOM 141 CB TYR A 10 6.440 2.736 -6.400 1.00 33.23 C ATOM 142 CG TYR A 10 6.744 2.376 -7.839 1.00 33.35 C ATOM 143 CD1 TYR A 10 6.673 3.332 -8.868 1.00 60.51 C ATOM 144 CD2 TYR A 10 7.105 1.055 -8.136 1.00 63.33 C ATOM 145 CE1 TYR A 10 6.964 2.966 -10.192 1.00 4.42 C ATOM 146 CE2 TYR A 10 7.434 0.693 -9.451 1.00 11.21 C ATOM 147 CZ TYR A 10 7.367 1.648 -10.486 1.00 32.25 C ATOM 148 OH TYR A 10 7.739 1.299 -11.748 1.00 23.55 O ATOM 0 H TYR A 10 4.501 1.333 -7.543 1.00 31.52 H new ATOM 0 HA TYR A 10 4.977 2.471 -4.888 1.00 22.32 H new ATOM 0 HB2 TYR A 10 6.770 3.760 -6.226 1.00 33.23 H new ATOM 0 HB3 TYR A 10 7.038 2.094 -5.753 1.00 33.23 H new ATOM 0 HD1 TYR A 10 6.394 4.350 -8.639 1.00 60.51 H new ATOM 0 HD2 TYR A 10 7.130 0.314 -7.351 1.00 63.33 H new ATOM 0 HE1 TYR A 10 6.879 3.694 -10.985 1.00 4.42 H new ATOM 0 HE2 TYR A 10 7.739 -0.319 -9.671 1.00 11.21 H new ATOM 0 HH TYR A 10 8.600 0.832 -11.718 1.00 23.55 H new ATOM 157 N TYR A 11 3.715 4.585 -5.267 1.00 14.02 N ATOM 158 CA TYR A 11 3.307 5.975 -5.392 1.00 0.41 C ATOM 159 C TYR A 11 4.526 6.877 -5.184 1.00 35.13 C ATOM 160 O TYR A 11 5.362 6.576 -4.320 1.00 75.22 O ATOM 161 CB TYR A 11 2.186 6.294 -4.399 1.00 71.41 C ATOM 162 CG TYR A 11 1.857 7.768 -4.390 1.00 64.42 C ATOM 163 CD1 TYR A 11 1.170 8.318 -5.484 1.00 32.53 C ATOM 164 CD2 TYR A 11 2.366 8.604 -3.376 1.00 42.13 C ATOM 165 CE1 TYR A 11 1.034 9.707 -5.589 1.00 72.24 C ATOM 166 CE2 TYR A 11 2.174 9.994 -3.449 1.00 40.42 C ATOM 167 CZ TYR A 11 1.532 10.546 -4.579 1.00 33.52 C ATOM 168 OH TYR A 11 1.451 11.886 -4.758 1.00 42.40 O ATOM 0 H TYR A 11 3.582 4.191 -4.336 1.00 14.02 H new ATOM 0 HA TYR A 11 2.911 6.157 -6.391 1.00 0.41 H new ATOM 0 HB2 TYR A 11 1.295 5.723 -4.659 1.00 71.41 H new ATOM 0 HB3 TYR A 11 2.485 5.981 -3.399 1.00 71.41 H new ATOM 0 HD1 TYR A 11 0.749 7.673 -6.241 1.00 32.53 H new ATOM 0 HD2 TYR A 11 2.904 8.176 -2.543 1.00 42.13 H new ATOM 0 HE1 TYR A 11 0.544 10.136 -6.451 1.00 72.24 H new ATOM 0 HE2 TYR A 11 2.514 10.634 -2.648 1.00 40.42 H new ATOM 0 HH TYR A 11 1.833 12.344 -3.980 1.00 42.40 H new ATOM 177 N SER A 12 4.575 7.982 -5.941 1.00 20.32 N ATOM 178 CA SER A 12 5.694 8.904 -6.127 1.00 60.30 C ATOM 179 C SER A 12 6.921 8.177 -6.682 1.00 74.14 C ATOM 180 O SER A 12 7.415 7.214 -6.096 1.00 4.25 O ATOM 181 CB SER A 12 5.974 9.725 -4.861 1.00 1.12 C ATOM 182 OG SER A 12 4.898 10.620 -4.644 1.00 71.11 O ATOM 0 H SER A 12 3.762 8.274 -6.483 1.00 20.32 H new ATOM 0 HA SER A 12 5.413 9.637 -6.884 1.00 60.30 H new ATOM 0 HB2 SER A 12 6.093 9.064 -4.002 1.00 1.12 H new ATOM 0 HB3 SER A 12 6.907 10.278 -4.969 1.00 1.12 H new ATOM 0 HG SER A 12 4.134 10.130 -4.276 1.00 71.11 H new ATOM 187 N TRP A 13 7.410 8.623 -7.841 1.00 43.32 N ATOM 188 CA TRP A 13 8.358 7.867 -8.647 1.00 20.32 C ATOM 189 C TRP A 13 9.754 8.514 -8.658 1.00 41.22 C ATOM 190 O TRP A 13 10.504 8.311 -9.616 1.00 43.31 O ATOM 191 CB TRP A 13 7.736 7.612 -10.036 1.00 53.13 C ATOM 192 CG TRP A 13 8.380 6.532 -10.853 1.00 53.40 C ATOM 193 CD1 TRP A 13 8.870 5.376 -10.362 1.00 32.52 C ATOM 194 CD2 TRP A 13 8.610 6.467 -12.293 1.00 72.13 C ATOM 195 NE1 TRP A 13 9.492 4.662 -11.360 1.00 35.34 N ATOM 196 CE2 TRP A 13 9.360 5.288 -12.575 1.00 63.22 C ATOM 197 CE3 TRP A 13 8.273 7.279 -13.395 1.00 63.23 C ATOM 198 CZ2 TRP A 13 9.784 4.952 -13.866 1.00 72.21 C ATOM 199 CZ3 TRP A 13 8.689 6.951 -14.700 1.00 35.31 C ATOM 200 CH2 TRP A 13 9.446 5.792 -14.940 1.00 71.43 C ATOM 0 H TRP A 13 7.155 9.524 -8.245 1.00 43.32 H new ATOM 0 HA TRP A 13 8.543 6.890 -8.201 1.00 20.32 H new ATOM 0 HB2 TRP A 13 6.684 7.361 -9.901 1.00 53.13 H new ATOM 0 HB3 TRP A 13 7.771 8.541 -10.605 1.00 53.13 H new ATOM 0 HD1 TRP A 13 8.786 5.057 -9.334 1.00 32.52 H new ATOM 0 HE1 TRP A 13 9.987 3.782 -11.216 1.00 35.34 H new ATOM 0 HE3 TRP A 13 7.684 8.170 -13.235 1.00 63.23 H new ATOM 0 HZ2 TRP A 13 10.364 4.057 -14.034 1.00 72.21 H new ATOM 0 HZ3 TRP A 13 8.424 7.597 -15.524 1.00 35.31 H new ATOM 0 HH2 TRP A 13 9.766 5.549 -15.943 1.00 71.43 H new ATOM 210 N SER A 14 10.110 9.253 -7.599 1.00 64.24 N ATOM 211 CA SER A 14 11.404 9.872 -7.304 1.00 40.11 C ATOM 212 C SER A 14 12.524 8.829 -7.137 1.00 62.54 C ATOM 213 O SER A 14 12.549 7.798 -7.815 1.00 20.33 O ATOM 214 CB SER A 14 11.243 10.789 -6.080 1.00 35.15 C ATOM 215 OG SER A 14 12.288 11.739 -6.011 1.00 61.55 O ATOM 0 H SER A 14 9.435 9.449 -6.860 1.00 64.24 H new ATOM 0 HA SER A 14 11.719 10.480 -8.152 1.00 40.11 H new ATOM 0 HB2 SER A 14 10.283 11.303 -6.132 1.00 35.15 H new ATOM 0 HB3 SER A 14 11.234 10.188 -5.171 1.00 35.15 H new ATOM 0 HG SER A 14 12.160 12.310 -5.225 1.00 61.55 H new ATOM 220 N GLY A 15 13.565 9.158 -6.371 1.00 13.25 N ATOM 221 CA GLY A 15 14.482 8.184 -5.802 1.00 63.55 C ATOM 222 C GLY A 15 13.729 7.250 -4.849 1.00 62.24 C ATOM 223 O GLY A 15 12.835 6.527 -5.269 1.00 62.53 O ATOM 0 H GLY A 15 13.793 10.122 -6.128 1.00 13.25 H new ATOM 0 HA2 GLY A 15 14.950 7.605 -6.598 1.00 63.55 H new ATOM 0 HA3 GLY A 15 15.282 8.695 -5.267 1.00 63.55 H new ATOM 227 N GLU A 16 14.131 7.228 -3.581 1.00 60.24 N ATOM 228 CA GLU A 16 13.561 6.497 -2.445 1.00 40.24 C ATOM 229 C GLU A 16 13.175 5.048 -2.751 1.00 34.33 C ATOM 230 O GLU A 16 14.011 4.154 -2.586 1.00 60.14 O ATOM 231 CB GLU A 16 12.414 7.270 -1.770 1.00 20.33 C ATOM 232 CG GLU A 16 12.919 8.538 -1.066 1.00 55.25 C ATOM 233 CD GLU A 16 11.940 9.083 -0.021 1.00 1.43 C ATOM 234 OE1 GLU A 16 10.744 8.719 -0.034 1.00 11.21 O ATOM 235 OE2 GLU A 16 12.401 9.856 0.857 1.00 4.00 O ATOM 0 H GLU A 16 14.943 7.774 -3.292 1.00 60.24 H new ATOM 0 HA GLU A 16 14.377 6.425 -1.726 1.00 40.24 H new ATOM 0 HB2 GLU A 16 11.669 7.541 -2.518 1.00 20.33 H new ATOM 0 HB3 GLU A 16 11.918 6.625 -1.045 1.00 20.33 H new ATOM 0 HG2 GLU A 16 13.872 8.322 -0.583 1.00 55.25 H new ATOM 0 HG3 GLU A 16 13.108 9.309 -1.813 1.00 55.25 H new ATOM 240 N THR A 17 11.957 4.837 -3.250 1.00 22.24 N ATOM 241 CA THR A 17 11.377 3.549 -3.567 1.00 64.31 C ATOM 242 C THR A 17 12.027 2.935 -4.809 1.00 33.22 C ATOM 243 O THR A 17 11.976 1.722 -4.949 1.00 32.55 O ATOM 244 CB THR A 17 9.852 3.715 -3.737 1.00 23.13 C ATOM 245 OG1 THR A 17 9.547 4.877 -4.489 1.00 41.11 O ATOM 246 CG2 THR A 17 9.142 3.891 -2.391 1.00 71.42 C ATOM 0 H THR A 17 11.320 5.608 -3.452 1.00 22.24 H new ATOM 0 HA THR A 17 11.567 2.855 -2.748 1.00 64.31 H new ATOM 0 HB THR A 17 9.513 2.809 -4.239 1.00 23.13 H new ATOM 0 HG1 THR A 17 8.575 4.959 -4.584 1.00 41.11 H new ATOM 0 HG21 THR A 17 8.071 4.004 -2.557 1.00 71.42 H new ATOM 0 HG22 THR A 17 9.322 3.015 -1.767 1.00 71.42 H new ATOM 0 HG23 THR A 17 9.528 4.779 -1.890 1.00 71.42 H new ATOM 254 N LYS A 18 12.710 3.702 -5.676 1.00 40.13 N ATOM 255 CA LYS A 18 13.243 3.187 -6.944 1.00 3.23 C ATOM 256 C LYS A 18 14.157 1.981 -6.751 1.00 72.42 C ATOM 257 O LYS A 18 14.191 1.087 -7.600 1.00 0.05 O ATOM 258 CB LYS A 18 13.981 4.296 -7.713 1.00 61.24 C ATOM 259 CG LYS A 18 14.325 3.842 -9.144 1.00 55.00 C ATOM 260 CD LYS A 18 14.554 5.003 -10.126 1.00 20.53 C ATOM 261 CE LYS A 18 13.289 5.316 -10.953 1.00 31.24 C ATOM 262 NZ LYS A 18 13.559 5.319 -12.409 1.00 3.41 N ATOM 0 H LYS A 18 12.906 4.690 -5.517 1.00 40.13 H new ATOM 0 HA LYS A 18 12.387 2.851 -7.530 1.00 3.23 H new ATOM 0 HB2 LYS A 18 13.361 5.191 -7.751 1.00 61.24 H new ATOM 0 HB3 LYS A 18 14.895 4.564 -7.183 1.00 61.24 H new ATOM 0 HG2 LYS A 18 15.221 3.223 -9.113 1.00 55.00 H new ATOM 0 HG3 LYS A 18 13.517 3.215 -9.520 1.00 55.00 H new ATOM 0 HD2 LYS A 18 14.855 5.892 -9.573 1.00 20.53 H new ATOM 0 HD3 LYS A 18 15.375 4.753 -10.798 1.00 20.53 H new ATOM 0 HE2 LYS A 18 12.519 4.578 -10.730 1.00 31.24 H new ATOM 0 HE3 LYS A 18 12.894 6.288 -10.656 1.00 31.24 H new ATOM 0 HZ1 LYS A 18 12.682 5.534 -12.924 1.00 3.41 H new ATOM 0 HZ2 LYS A 18 14.275 6.041 -12.628 1.00 3.41 H new ATOM 0 HZ3 LYS A 18 13.911 4.384 -12.699 1.00 3.41 H new ATOM 272 N LYS A 19 14.919 1.939 -5.655 1.00 35.33 N ATOM 273 CA LYS A 19 15.690 0.747 -5.329 1.00 1.42 C ATOM 274 C LYS A 19 14.719 -0.364 -4.957 1.00 24.45 C ATOM 275 O LYS A 19 14.648 -1.363 -5.669 1.00 33.32 O ATOM 276 CB LYS A 19 16.775 1.045 -4.290 1.00 12.34 C ATOM 277 CG LYS A 19 17.775 2.079 -4.852 1.00 12.34 C ATOM 278 CD LYS A 19 19.165 1.989 -4.210 1.00 53.14 C ATOM 279 CE LYS A 19 19.113 2.283 -2.705 1.00 44.42 C ATOM 280 NZ LYS A 19 19.948 1.342 -1.938 1.00 2.03 N ATOM 0 H LYS A 19 15.015 2.707 -4.990 1.00 35.33 H new ATOM 0 HA LYS A 19 16.257 0.398 -6.192 1.00 1.42 H new ATOM 0 HB2 LYS A 19 16.320 1.427 -3.376 1.00 12.34 H new ATOM 0 HB3 LYS A 19 17.299 0.127 -4.026 1.00 12.34 H new ATOM 0 HG2 LYS A 19 17.869 1.935 -5.928 1.00 12.34 H new ATOM 0 HG3 LYS A 19 17.375 3.081 -4.698 1.00 12.34 H new ATOM 0 HD2 LYS A 19 19.578 0.993 -4.373 1.00 53.14 H new ATOM 0 HD3 LYS A 19 19.837 2.696 -4.696 1.00 53.14 H new ATOM 0 HE2 LYS A 19 19.451 3.303 -2.521 1.00 44.42 H new ATOM 0 HE3 LYS A 19 18.082 2.222 -2.357 1.00 44.42 H new ATOM 0 HZ1 LYS A 19 19.888 1.571 -0.925 1.00 2.03 H new ATOM 0 HZ2 LYS A 19 19.610 0.371 -2.094 1.00 2.03 H new ATOM 0 HZ3 LYS A 19 20.936 1.419 -2.253 1.00 2.03 H new ATOM 290 N MET A 20 13.905 -0.155 -3.927 1.00 33.14 N ATOM 291 CA MET A 20 12.828 -1.016 -3.429 1.00 75.35 C ATOM 292 C MET A 20 11.625 -1.131 -4.401 1.00 24.24 C ATOM 293 O MET A 20 10.473 -1.249 -3.995 1.00 71.20 O ATOM 294 CB MET A 20 12.371 -0.448 -2.074 1.00 32.22 C ATOM 295 CG MET A 20 13.293 -0.736 -0.885 1.00 72.34 C ATOM 296 SD MET A 20 14.804 0.266 -0.835 1.00 54.33 S ATOM 297 CE MET A 20 15.903 -0.981 -1.503 1.00 20.44 C ATOM 0 H MET A 20 13.986 0.694 -3.368 1.00 33.14 H new ATOM 0 HA MET A 20 13.216 -2.030 -3.330 1.00 75.35 H new ATOM 0 HB2 MET A 20 12.263 0.632 -2.172 1.00 32.22 H new ATOM 0 HB3 MET A 20 11.383 -0.848 -1.848 1.00 32.22 H new ATOM 0 HG2 MET A 20 12.735 -0.573 0.037 1.00 72.34 H new ATOM 0 HG3 MET A 20 13.573 -1.789 -0.907 1.00 72.34 H new ATOM 0 HE1 MET A 20 16.793 -0.501 -1.911 1.00 20.44 H new ATOM 0 HE2 MET A 20 16.194 -1.672 -0.711 1.00 20.44 H new ATOM 0 HE3 MET A 20 15.392 -1.530 -2.294 1.00 20.44 H new ATOM 305 N ALA A 21 11.880 -1.088 -5.698 1.00 11.35 N ATOM 306 CA ALA A 21 10.941 -1.262 -6.786 1.00 53.00 C ATOM 307 C ALA A 21 11.636 -2.186 -7.768 1.00 20.51 C ATOM 308 O ALA A 21 11.241 -3.333 -7.967 1.00 35.11 O ATOM 309 CB ALA A 21 10.593 0.094 -7.426 1.00 44.13 C ATOM 0 H ALA A 21 12.825 -0.917 -6.041 1.00 11.35 H new ATOM 0 HA ALA A 21 9.993 -1.684 -6.451 1.00 53.00 H new ATOM 0 HB1 ALA A 21 9.886 -0.059 -8.241 1.00 44.13 H new ATOM 0 HB2 ALA A 21 10.146 0.746 -6.676 1.00 44.13 H new ATOM 0 HB3 ALA A 21 11.500 0.556 -7.815 1.00 44.13 H new ATOM 315 N GLU A 22 12.725 -1.683 -8.344 1.00 51.33 N ATOM 316 CA GLU A 22 13.431 -2.326 -9.430 1.00 75.41 C ATOM 317 C GLU A 22 14.231 -3.526 -8.940 1.00 54.22 C ATOM 318 O GLU A 22 14.440 -4.460 -9.716 1.00 4.04 O ATOM 319 CB GLU A 22 14.399 -1.323 -10.044 1.00 2.12 C ATOM 320 CG GLU A 22 13.718 -0.078 -10.613 1.00 51.13 C ATOM 321 CD GLU A 22 13.012 -0.308 -11.956 1.00 54.32 C ATOM 322 OE1 GLU A 22 13.115 -1.412 -12.545 1.00 52.24 O ATOM 323 OE2 GLU A 22 12.376 0.645 -12.464 1.00 40.44 O ATOM 0 H GLU A 22 13.144 -0.798 -8.057 1.00 51.33 H new ATOM 0 HA GLU A 22 12.698 -2.670 -10.160 1.00 75.41 H new ATOM 0 HB2 GLU A 22 15.120 -1.017 -9.286 1.00 2.12 H new ATOM 0 HB3 GLU A 22 14.961 -1.814 -10.839 1.00 2.12 H new ATOM 0 HG2 GLU A 22 12.989 0.287 -9.889 1.00 51.13 H new ATOM 0 HG3 GLU A 22 14.464 0.707 -10.737 1.00 51.13 H new ATOM 328 N LYS A 23 14.721 -3.503 -7.692 1.00 64.32 N ATOM 329 CA LYS A 23 15.257 -4.702 -7.060 1.00 55.33 C ATOM 330 C LYS A 23 14.125 -5.697 -6.870 1.00 52.24 C ATOM 331 O LYS A 23 14.217 -6.794 -7.407 1.00 63.32 O ATOM 332 CB LYS A 23 15.920 -4.415 -5.703 1.00 40.03 C ATOM 333 CG LYS A 23 17.446 -4.386 -5.729 1.00 24.31 C ATOM 334 CD LYS A 23 18.030 -2.977 -5.834 1.00 63.32 C ATOM 335 CE LYS A 23 18.140 -2.442 -7.264 1.00 54.31 C ATOM 336 NZ LYS A 23 19.095 -3.228 -8.073 1.00 4.12 N ATOM 0 H LYS A 23 14.754 -2.667 -7.108 1.00 64.32 H new ATOM 0 HA LYS A 23 16.032 -5.105 -7.713 1.00 55.33 H new ATOM 0 HB2 LYS A 23 15.559 -3.455 -5.334 1.00 40.03 H new ATOM 0 HB3 LYS A 23 15.597 -5.173 -4.989 1.00 40.03 H new ATOM 0 HG2 LYS A 23 17.825 -4.861 -4.824 1.00 24.31 H new ATOM 0 HG3 LYS A 23 17.798 -4.980 -6.573 1.00 24.31 H new ATOM 0 HD2 LYS A 23 17.410 -2.296 -5.251 1.00 63.32 H new ATOM 0 HD3 LYS A 23 19.021 -2.973 -5.381 1.00 63.32 H new ATOM 0 HE2 LYS A 23 17.158 -2.465 -7.737 1.00 54.31 H new ATOM 0 HE3 LYS A 23 18.457 -1.400 -7.239 1.00 54.31 H new ATOM 0 HZ1 LYS A 23 19.362 -2.686 -8.919 1.00 4.12 H new ATOM 0 HZ2 LYS A 23 19.945 -3.429 -7.508 1.00 4.12 H new ATOM 0 HZ3 LYS A 23 18.651 -4.123 -8.361 1.00 4.12 H new ATOM 346 N ILE A 24 13.090 -5.319 -6.111 1.00 35.14 N ATOM 347 CA ILE A 24 12.030 -6.217 -5.655 1.00 1.13 C ATOM 348 C ILE A 24 11.412 -6.947 -6.859 1.00 73.32 C ATOM 349 O ILE A 24 11.245 -8.159 -6.823 1.00 12.13 O ATOM 350 CB ILE A 24 10.995 -5.449 -4.794 1.00 55.24 C ATOM 351 CG1 ILE A 24 11.695 -4.725 -3.617 1.00 41.13 C ATOM 352 CG2 ILE A 24 9.918 -6.406 -4.255 1.00 13.04 C ATOM 353 CD1 ILE A 24 10.743 -4.109 -2.582 1.00 72.35 C ATOM 0 H ILE A 24 12.966 -4.358 -5.791 1.00 35.14 H new ATOM 0 HA ILE A 24 12.447 -6.985 -5.003 1.00 1.13 H new ATOM 0 HB ILE A 24 10.515 -4.705 -5.429 1.00 55.24 H new ATOM 0 HG12 ILE A 24 12.350 -5.434 -3.111 1.00 41.13 H new ATOM 0 HG13 ILE A 24 12.330 -3.936 -4.020 1.00 41.13 H new ATOM 0 HG21 ILE A 24 9.202 -5.846 -3.653 1.00 13.04 H new ATOM 0 HG22 ILE A 24 9.400 -6.878 -5.090 1.00 13.04 H new ATOM 0 HG23 ILE A 24 10.388 -7.173 -3.639 1.00 13.04 H new ATOM 0 HD11 ILE A 24 11.323 -3.625 -1.797 1.00 72.35 H new ATOM 0 HD12 ILE A 24 10.104 -3.372 -3.069 1.00 72.35 H new ATOM 0 HD13 ILE A 24 10.124 -4.893 -2.145 1.00 72.35 H new ATOM 364 N ASN A 25 11.150 -6.244 -7.963 1.00 74.44 N ATOM 365 CA ASN A 25 10.596 -6.841 -9.177 1.00 24.21 C ATOM 366 C ASN A 25 11.462 -7.974 -9.748 1.00 14.04 C ATOM 367 O ASN A 25 10.929 -8.914 -10.327 1.00 31.34 O ATOM 368 CB ASN A 25 10.438 -5.738 -10.229 1.00 41.33 C ATOM 369 CG ASN A 25 9.972 -6.287 -11.572 1.00 51.31 C ATOM 370 OD1 ASN A 25 8.870 -7.008 -11.621 1.00 44.44 O flip ATOM 371 ND2 ASN A 25 10.604 -6.058 -12.596 1.00 24.43 N flip ATOM 0 H ASN A 25 11.317 -5.241 -8.039 1.00 74.44 H new ATOM 0 HA ASN A 25 9.636 -7.287 -8.917 1.00 24.21 H new ATOM 0 HB2 ASN A 25 9.722 -4.998 -9.872 1.00 41.33 H new ATOM 0 HB3 ASN A 25 11.390 -5.223 -10.359 1.00 41.33 H new ATOM 0 HD21 ASN A 25 11.457 -5.500 -12.555 1.00 24.43 H new ATOM 0 HD22 ASN A 25 10.278 -6.426 -13.490 1.00 24.43 H new ATOM 377 N SER A 26 12.781 -7.867 -9.609 1.00 13.35 N ATOM 378 CA SER A 26 13.768 -8.844 -10.051 1.00 40.22 C ATOM 379 C SER A 26 14.043 -9.912 -8.972 1.00 52.00 C ATOM 380 O SER A 26 14.611 -10.957 -9.288 1.00 74.33 O ATOM 381 CB SER A 26 15.044 -8.067 -10.417 1.00 73.54 C ATOM 382 OG SER A 26 15.876 -8.743 -11.340 1.00 3.03 O ATOM 0 H SER A 26 13.210 -7.056 -9.163 1.00 13.35 H new ATOM 0 HA SER A 26 13.394 -9.391 -10.916 1.00 40.22 H new ATOM 0 HB2 SER A 26 14.763 -7.100 -10.835 1.00 73.54 H new ATOM 0 HB3 SER A 26 15.611 -7.868 -9.508 1.00 73.54 H new ATOM 0 HG SER A 26 16.666 -8.195 -11.530 1.00 3.03 H new ATOM 387 N GLU A 27 13.671 -9.681 -7.706 1.00 4.25 N ATOM 388 CA GLU A 27 13.831 -10.653 -6.620 1.00 21.22 C ATOM 389 C GLU A 27 12.749 -11.739 -6.678 1.00 12.03 C ATOM 390 O GLU A 27 12.905 -12.775 -6.029 1.00 12.14 O ATOM 391 CB GLU A 27 13.703 -9.965 -5.248 1.00 24.52 C ATOM 392 CG GLU A 27 14.861 -9.060 -4.820 1.00 0.15 C ATOM 393 CD GLU A 27 16.044 -9.825 -4.217 1.00 31.55 C ATOM 394 OE1 GLU A 27 16.099 -9.996 -2.973 1.00 21.34 O ATOM 395 OE2 GLU A 27 16.966 -10.172 -4.992 1.00 43.04 O ATOM 0 H GLU A 27 13.246 -8.804 -7.405 1.00 4.25 H new ATOM 0 HA GLU A 27 14.819 -11.095 -6.744 1.00 21.22 H new ATOM 0 HB2 GLU A 27 12.790 -9.370 -5.250 1.00 24.52 H new ATOM 0 HB3 GLU A 27 13.578 -10.738 -4.490 1.00 24.52 H new ATOM 0 HG2 GLU A 27 15.208 -8.493 -5.684 1.00 0.15 H new ATOM 0 HG3 GLU A 27 14.496 -8.337 -4.090 1.00 0.15 H new ATOM 400 N ILE A 28 11.650 -11.505 -7.397 1.00 12.03 N ATOM 401 CA ILE A 28 10.408 -12.266 -7.295 1.00 2.15 C ATOM 402 C ILE A 28 10.073 -12.856 -8.670 1.00 73.30 C ATOM 403 O ILE A 28 10.276 -12.224 -9.710 1.00 35.13 O ATOM 404 CB ILE A 28 9.294 -11.341 -6.760 1.00 33.45 C ATOM 405 CG1 ILE A 28 9.643 -10.733 -5.382 1.00 33.35 C ATOM 406 CG2 ILE A 28 7.954 -12.086 -6.634 1.00 64.20 C ATOM 407 CD1 ILE A 28 8.608 -9.698 -4.939 1.00 74.22 C ATOM 0 H ILE A 28 11.600 -10.756 -8.088 1.00 12.03 H new ATOM 0 HA ILE A 28 10.509 -13.096 -6.596 1.00 2.15 H new ATOM 0 HB ILE A 28 9.205 -10.537 -7.490 1.00 33.45 H new ATOM 0 HG12 ILE A 28 9.703 -11.528 -4.639 1.00 33.35 H new ATOM 0 HG13 ILE A 28 10.627 -10.266 -5.429 1.00 33.35 H new ATOM 0 HG21 ILE A 28 7.193 -11.404 -6.255 1.00 64.20 H new ATOM 0 HG22 ILE A 28 7.652 -12.459 -7.613 1.00 64.20 H new ATOM 0 HG23 ILE A 28 8.067 -12.923 -5.945 1.00 64.20 H new ATOM 0 HD11 ILE A 28 8.890 -9.295 -3.966 1.00 74.22 H new ATOM 0 HD12 ILE A 28 8.567 -8.889 -5.669 1.00 74.22 H new ATOM 0 HD13 ILE A 28 7.629 -10.171 -4.866 1.00 74.22 H new ATOM 418 N LYS A 29 9.557 -14.087 -8.692 1.00 32.42 N ATOM 419 CA LYS A 29 9.112 -14.740 -9.916 1.00 20.14 C ATOM 420 C LYS A 29 7.740 -14.207 -10.310 1.00 23.33 C ATOM 421 O LYS A 29 6.886 -13.979 -9.456 1.00 52.21 O ATOM 422 CB LYS A 29 9.073 -16.268 -9.715 1.00 31.32 C ATOM 423 CG LYS A 29 10.021 -16.994 -10.684 1.00 73.33 C ATOM 424 CD LYS A 29 11.512 -16.732 -10.392 1.00 74.20 C ATOM 425 CE LYS A 29 12.217 -16.223 -11.655 1.00 73.51 C ATOM 426 NZ LYS A 29 13.680 -16.104 -11.487 1.00 61.14 N ATOM 0 H LYS A 29 9.437 -14.658 -7.855 1.00 32.42 H new ATOM 0 HA LYS A 29 9.814 -14.522 -10.721 1.00 20.14 H new ATOM 0 HB2 LYS A 29 9.349 -16.507 -8.688 1.00 31.32 H new ATOM 0 HB3 LYS A 29 8.055 -16.629 -9.863 1.00 31.32 H new ATOM 0 HG2 LYS A 29 9.831 -18.066 -10.632 1.00 73.33 H new ATOM 0 HG3 LYS A 29 9.797 -16.680 -11.703 1.00 73.33 H new ATOM 0 HD2 LYS A 29 11.610 -15.999 -9.591 1.00 74.20 H new ATOM 0 HD3 LYS A 29 11.989 -17.649 -10.045 1.00 74.20 H new ATOM 0 HE2 LYS A 29 12.005 -16.901 -12.482 1.00 73.51 H new ATOM 0 HE3 LYS A 29 11.807 -15.250 -11.927 1.00 73.51 H new ATOM 0 HZ1 LYS A 29 14.104 -15.756 -12.371 1.00 61.14 H new ATOM 0 HZ2 LYS A 29 13.888 -15.436 -10.717 1.00 61.14 H new ATOM 0 HZ3 LYS A 29 14.080 -17.036 -11.255 1.00 61.14 H new ATOM 436 N ASP A 30 7.524 -14.076 -11.619 1.00 11.24 N ATOM 437 CA ASP A 30 6.250 -13.702 -12.246 1.00 34.14 C ATOM 438 C ASP A 30 5.721 -12.323 -11.819 1.00 14.25 C ATOM 439 O ASP A 30 4.561 -11.988 -12.055 1.00 42.30 O ATOM 440 CB ASP A 30 5.211 -14.828 -12.078 1.00 23.45 C ATOM 441 CG ASP A 30 4.624 -15.273 -13.416 1.00 22.33 C ATOM 442 OD1 ASP A 30 4.300 -14.438 -14.292 1.00 23.23 O ATOM 443 OD2 ASP A 30 4.578 -16.503 -13.658 1.00 61.40 O ATOM 0 H ASP A 30 8.263 -14.234 -12.304 1.00 11.24 H new ATOM 0 HA ASP A 30 6.447 -13.586 -13.312 1.00 34.14 H new ATOM 0 HB2 ASP A 30 5.678 -15.681 -11.586 1.00 23.45 H new ATOM 0 HB3 ASP A 30 4.407 -14.485 -11.426 1.00 23.45 H new ATOM 447 N SER A 31 6.567 -11.499 -11.195 1.00 72.20 N ATOM 448 CA SER A 31 6.225 -10.163 -10.745 1.00 55.03 C ATOM 449 C SER A 31 5.940 -9.188 -11.895 1.00 12.32 C ATOM 450 O SER A 31 6.267 -9.439 -13.056 1.00 14.11 O ATOM 451 CB SER A 31 7.373 -9.647 -9.866 1.00 41.01 C ATOM 452 OG SER A 31 7.048 -9.810 -8.510 1.00 4.23 O ATOM 0 H SER A 31 7.532 -11.757 -10.987 1.00 72.20 H new ATOM 0 HA SER A 31 5.296 -10.222 -10.178 1.00 55.03 H new ATOM 0 HB2 SER A 31 8.291 -10.188 -10.096 1.00 41.01 H new ATOM 0 HB3 SER A 31 7.561 -8.595 -10.080 1.00 41.01 H new ATOM 0 HG SER A 31 7.485 -9.109 -7.982 1.00 4.23 H new ATOM 457 N GLU A 32 5.399 -8.026 -11.529 1.00 71.44 N ATOM 458 CA GLU A 32 5.293 -6.788 -12.299 1.00 14.43 C ATOM 459 C GLU A 32 5.462 -5.614 -11.336 1.00 63.44 C ATOM 460 O GLU A 32 5.202 -5.756 -10.134 1.00 31.15 O ATOM 461 CB GLU A 32 3.921 -6.678 -12.993 1.00 54.44 C ATOM 462 CG GLU A 32 4.051 -7.100 -14.453 1.00 55.32 C ATOM 463 CD GLU A 32 2.737 -6.999 -15.221 1.00 34.15 C ATOM 464 OE1 GLU A 32 2.439 -5.910 -15.766 1.00 11.02 O ATOM 465 OE2 GLU A 32 2.003 -8.014 -15.283 1.00 34.43 O ATOM 0 H GLU A 32 4.987 -7.918 -10.602 1.00 71.44 H new ATOM 0 HA GLU A 32 6.064 -6.780 -13.070 1.00 14.43 H new ATOM 0 HB2 GLU A 32 3.193 -7.310 -12.485 1.00 54.44 H new ATOM 0 HB3 GLU A 32 3.552 -5.654 -12.931 1.00 54.44 H new ATOM 0 HG2 GLU A 32 4.800 -6.476 -14.941 1.00 55.32 H new ATOM 0 HG3 GLU A 32 4.414 -8.127 -14.498 1.00 55.32 H new ATOM 470 N LEU A 33 5.862 -4.449 -11.847 1.00 64.22 N ATOM 471 CA LEU A 33 6.011 -3.223 -11.096 1.00 62.12 C ATOM 472 C LEU A 33 5.312 -2.077 -11.826 1.00 75.23 C ATOM 473 O LEU A 33 5.418 -1.967 -13.050 1.00 42.04 O ATOM 474 CB LEU A 33 7.501 -2.997 -10.821 1.00 53.11 C ATOM 475 CG LEU A 33 8.359 -2.260 -11.874 1.00 24.44 C ATOM 476 CD1 LEU A 33 9.757 -1.984 -11.298 1.00 44.02 C ATOM 477 CD2 LEU A 33 8.528 -3.065 -13.166 1.00 73.33 C ATOM 0 H LEU A 33 6.098 -4.340 -12.833 1.00 64.22 H new ATOM 0 HA LEU A 33 5.521 -3.282 -10.124 1.00 62.12 H new ATOM 0 HB2 LEU A 33 7.582 -2.443 -9.886 1.00 53.11 H new ATOM 0 HB3 LEU A 33 7.955 -3.973 -10.653 1.00 53.11 H new ATOM 0 HG LEU A 33 7.836 -1.334 -12.113 1.00 24.44 H new ATOM 0 HD11 LEU A 33 10.361 -1.464 -12.042 1.00 44.02 H new ATOM 0 HD12 LEU A 33 9.667 -1.364 -10.406 1.00 44.02 H new ATOM 0 HD13 LEU A 33 10.236 -2.928 -11.037 1.00 44.02 H new ATOM 0 HD21 LEU A 33 9.139 -2.500 -13.870 1.00 73.33 H new ATOM 0 HD22 LEU A 33 9.016 -4.014 -12.942 1.00 73.33 H new ATOM 0 HD23 LEU A 33 7.549 -3.255 -13.607 1.00 73.33 H new ATOM 488 N LYS A 34 4.559 -1.268 -11.079 1.00 51.21 N ATOM 489 CA LYS A 34 3.614 -0.272 -11.568 1.00 20.32 C ATOM 490 C LYS A 34 3.787 1.001 -10.746 1.00 72.54 C ATOM 491 O LYS A 34 3.990 0.947 -9.532 1.00 34.23 O ATOM 492 CB LYS A 34 2.174 -0.810 -11.400 1.00 1.31 C ATOM 493 CG LYS A 34 1.432 -1.124 -12.705 1.00 60.30 C ATOM 494 CD LYS A 34 2.046 -2.259 -13.527 1.00 0.01 C ATOM 495 CE LYS A 34 1.295 -2.456 -14.853 1.00 3.14 C ATOM 496 NZ LYS A 34 2.108 -3.163 -15.864 1.00 12.43 N ATOM 0 H LYS A 34 4.597 -1.295 -10.060 1.00 51.21 H new ATOM 0 HA LYS A 34 3.796 -0.061 -12.622 1.00 20.32 H new ATOM 0 HB2 LYS A 34 2.211 -1.717 -10.796 1.00 1.31 H new ATOM 0 HB3 LYS A 34 1.594 -0.077 -10.839 1.00 1.31 H new ATOM 0 HG2 LYS A 34 0.400 -1.381 -12.468 1.00 60.30 H new ATOM 0 HG3 LYS A 34 1.403 -0.223 -13.318 1.00 60.30 H new ATOM 0 HD2 LYS A 34 3.094 -2.039 -13.729 1.00 0.01 H new ATOM 0 HD3 LYS A 34 2.020 -3.184 -12.951 1.00 0.01 H new ATOM 0 HE2 LYS A 34 0.380 -3.019 -14.669 1.00 3.14 H new ATOM 0 HE3 LYS A 34 0.997 -1.484 -15.246 1.00 3.14 H new ATOM 0 HZ1 LYS A 34 1.662 -3.065 -16.799 1.00 12.43 H new ATOM 0 HZ2 LYS A 34 3.063 -2.752 -15.891 1.00 12.43 H new ATOM 0 HZ3 LYS A 34 2.172 -4.171 -15.615 1.00 12.43 H new ATOM 506 N GLU A 35 3.648 2.141 -11.412 1.00 34.25 N ATOM 507 CA GLU A 35 3.555 3.439 -10.755 1.00 14.43 C ATOM 508 C GLU A 35 2.116 3.661 -10.284 1.00 53.03 C ATOM 509 O GLU A 35 1.174 3.089 -10.846 1.00 41.23 O ATOM 510 CB GLU A 35 4.031 4.523 -11.742 1.00 20.51 C ATOM 511 CG GLU A 35 4.119 5.958 -11.181 1.00 21.11 C ATOM 512 CD GLU A 35 2.968 6.869 -11.632 1.00 54.12 C ATOM 513 OE1 GLU A 35 1.847 6.379 -11.893 1.00 22.53 O ATOM 514 OE2 GLU A 35 3.197 8.085 -11.830 1.00 12.44 O ATOM 0 H GLU A 35 3.596 2.191 -12.429 1.00 34.25 H new ATOM 0 HA GLU A 35 4.194 3.486 -9.873 1.00 14.43 H new ATOM 0 HB2 GLU A 35 5.015 4.239 -12.115 1.00 20.51 H new ATOM 0 HB3 GLU A 35 3.355 4.529 -12.597 1.00 20.51 H new ATOM 0 HG2 GLU A 35 4.129 5.913 -10.092 1.00 21.11 H new ATOM 0 HG3 GLU A 35 5.065 6.402 -11.491 1.00 21.11 H new ATOM 519 N VAL A 36 1.958 4.527 -9.287 1.00 20.34 N ATOM 520 CA VAL A 36 0.715 5.177 -8.898 1.00 34.43 C ATOM 521 C VAL A 36 0.996 6.698 -8.861 1.00 21.11 C ATOM 522 O VAL A 36 2.094 7.106 -8.459 1.00 1.33 O ATOM 523 CB VAL A 36 0.249 4.669 -7.520 1.00 35.45 C ATOM 524 CG1 VAL A 36 -1.104 5.276 -7.121 1.00 21.13 C ATOM 525 CG2 VAL A 36 0.109 3.149 -7.507 1.00 24.11 C ATOM 0 H VAL A 36 2.741 4.809 -8.696 1.00 20.34 H new ATOM 0 HA VAL A 36 -0.082 4.952 -9.606 1.00 34.43 H new ATOM 0 HB VAL A 36 1.013 4.978 -6.806 1.00 35.45 H new ATOM 0 HG11 VAL A 36 -1.400 4.894 -6.144 1.00 21.13 H new ATOM 0 HG12 VAL A 36 -1.017 6.362 -7.075 1.00 21.13 H new ATOM 0 HG13 VAL A 36 -1.857 5.004 -7.860 1.00 21.13 H new ATOM 0 HG21 VAL A 36 -0.221 2.822 -6.521 1.00 24.11 H new ATOM 0 HG22 VAL A 36 -0.624 2.845 -8.254 1.00 24.11 H new ATOM 0 HG23 VAL A 36 1.072 2.693 -7.737 1.00 24.11 H new ATOM 535 N LYS A 37 0.008 7.546 -9.160 1.00 15.43 N ATOM 536 CA LYS A 37 0.021 9.005 -9.018 1.00 63.54 C ATOM 537 C LYS A 37 -1.307 9.478 -8.392 1.00 61.40 C ATOM 538 O LYS A 37 -2.088 8.646 -7.921 1.00 33.55 O ATOM 539 CB LYS A 37 0.325 9.660 -10.372 1.00 13.25 C ATOM 540 CG LYS A 37 -0.573 9.159 -11.506 1.00 35.31 C ATOM 541 CD LYS A 37 -0.461 10.046 -12.746 1.00 51.33 C ATOM 542 CE LYS A 37 -1.156 9.347 -13.919 1.00 61.11 C ATOM 543 NZ LYS A 37 -0.496 9.643 -15.203 1.00 35.15 N ATOM 0 H LYS A 37 -0.880 7.210 -9.532 1.00 15.43 H new ATOM 0 HA LYS A 37 0.816 9.315 -8.340 1.00 63.54 H new ATOM 0 HB2 LYS A 37 0.211 10.740 -10.278 1.00 13.25 H new ATOM 0 HB3 LYS A 37 1.366 9.471 -10.633 1.00 13.25 H new ATOM 0 HG2 LYS A 37 -0.298 8.136 -11.764 1.00 35.31 H new ATOM 0 HG3 LYS A 37 -1.609 9.135 -11.167 1.00 35.31 H new ATOM 0 HD2 LYS A 37 -0.921 11.016 -12.559 1.00 51.33 H new ATOM 0 HD3 LYS A 37 0.586 10.231 -12.984 1.00 51.33 H new ATOM 0 HE2 LYS A 37 -1.157 8.270 -13.751 1.00 61.11 H new ATOM 0 HE3 LYS A 37 -2.198 9.664 -13.965 1.00 61.11 H new ATOM 0 HZ1 LYS A 37 -0.996 9.152 -15.972 1.00 35.15 H new ATOM 0 HZ2 LYS A 37 -0.517 10.668 -15.376 1.00 35.15 H new ATOM 0 HZ3 LYS A 37 0.491 9.318 -15.169 1.00 35.15 H new ATOM 553 N VAL A 38 -1.568 10.788 -8.336 1.00 2.02 N ATOM 554 CA VAL A 38 -2.764 11.370 -7.716 1.00 73.32 C ATOM 555 C VAL A 38 -3.521 12.269 -8.696 1.00 35.52 C ATOM 556 O VAL A 38 -2.993 12.664 -9.742 1.00 44.44 O ATOM 557 CB VAL A 38 -2.419 12.113 -6.402 1.00 20.51 C ATOM 558 CG1 VAL A 38 -2.253 11.124 -5.239 1.00 54.43 C ATOM 559 CG2 VAL A 38 -1.188 13.024 -6.529 1.00 12.25 C ATOM 0 H VAL A 38 -0.940 11.489 -8.729 1.00 2.02 H new ATOM 0 HA VAL A 38 -3.430 10.548 -7.453 1.00 73.32 H new ATOM 0 HB VAL A 38 -3.264 12.767 -6.188 1.00 20.51 H new ATOM 0 HG11 VAL A 38 -2.011 11.671 -4.328 1.00 54.43 H new ATOM 0 HG12 VAL A 38 -3.182 10.572 -5.095 1.00 54.43 H new ATOM 0 HG13 VAL A 38 -1.448 10.426 -5.467 1.00 54.43 H new ATOM 0 HG21 VAL A 38 -0.999 13.516 -5.575 1.00 12.25 H new ATOM 0 HG22 VAL A 38 -0.320 12.426 -6.807 1.00 12.25 H new ATOM 0 HG23 VAL A 38 -1.370 13.777 -7.295 1.00 12.25 H new ATOM 569 N SER A 39 -4.766 12.589 -8.346 1.00 33.53 N ATOM 570 CA SER A 39 -5.651 13.435 -9.105 1.00 44.14 C ATOM 571 C SER A 39 -5.660 14.869 -8.559 1.00 31.14 C ATOM 572 O SER A 39 -5.279 15.122 -7.412 1.00 35.12 O ATOM 573 CB SER A 39 -7.018 12.763 -9.045 1.00 32.15 C ATOM 574 OG SER A 39 -7.004 11.636 -9.905 1.00 72.21 O ATOM 0 H SER A 39 -5.193 12.244 -7.486 1.00 33.53 H new ATOM 0 HA SER A 39 -5.327 13.540 -10.141 1.00 44.14 H new ATOM 0 HB2 SER A 39 -7.245 12.457 -8.024 1.00 32.15 H new ATOM 0 HB3 SER A 39 -7.797 13.462 -9.349 1.00 32.15 H new ATOM 0 HG SER A 39 -7.877 11.192 -9.876 1.00 72.21 H new ATOM 579 N GLU A 40 -6.102 15.815 -9.385 1.00 51.20 N ATOM 580 CA GLU A 40 -6.359 17.210 -9.029 1.00 53.44 C ATOM 581 C GLU A 40 -7.537 17.311 -8.051 1.00 44.31 C ATOM 582 O GLU A 40 -8.263 16.332 -7.851 1.00 12.21 O ATOM 583 CB GLU A 40 -6.640 18.016 -10.314 1.00 20.12 C ATOM 584 CG GLU A 40 -8.009 17.703 -10.950 1.00 11.41 C ATOM 585 CD GLU A 40 -8.138 18.285 -12.358 1.00 12.25 C ATOM 586 OE1 GLU A 40 -8.145 19.530 -12.486 1.00 41.10 O ATOM 587 OE2 GLU A 40 -8.191 17.487 -13.327 1.00 64.12 O ATOM 0 H GLU A 40 -6.300 15.621 -10.367 1.00 51.20 H new ATOM 0 HA GLU A 40 -5.482 17.624 -8.532 1.00 53.44 H new ATOM 0 HB2 GLU A 40 -6.590 19.080 -10.084 1.00 20.12 H new ATOM 0 HB3 GLU A 40 -5.855 17.810 -11.041 1.00 20.12 H new ATOM 0 HG2 GLU A 40 -8.150 16.623 -10.991 1.00 11.41 H new ATOM 0 HG3 GLU A 40 -8.801 18.105 -10.319 1.00 11.41 H new ATOM 592 N GLY A 41 -7.774 18.498 -7.495 1.00 72.33 N ATOM 593 CA GLY A 41 -8.899 18.803 -6.618 1.00 22.12 C ATOM 594 C GLY A 41 -8.457 19.016 -5.172 1.00 20.11 C ATOM 595 O GLY A 41 -7.263 19.037 -4.872 1.00 13.33 O ATOM 0 H GLY A 41 -7.165 19.301 -7.650 1.00 72.33 H new ATOM 0 HA2 GLY A 41 -9.406 19.698 -6.977 1.00 22.12 H new ATOM 0 HA3 GLY A 41 -9.622 17.988 -6.660 1.00 22.12 H new ATOM 599 N THR A 42 -9.432 19.189 -4.281 1.00 55.50 N ATOM 600 CA THR A 42 -9.363 20.055 -3.103 1.00 44.42 C ATOM 601 C THR A 42 -8.741 21.406 -3.509 1.00 22.34 C ATOM 602 O THR A 42 -7.796 21.916 -2.901 1.00 23.44 O ATOM 603 CB THR A 42 -8.900 19.314 -1.826 1.00 63.44 C ATOM 604 OG1 THR A 42 -9.407 19.972 -0.679 1.00 73.05 O ATOM 605 CG2 THR A 42 -7.396 19.094 -1.611 1.00 20.34 C ATOM 0 H THR A 42 -10.329 18.710 -4.363 1.00 55.50 H new ATOM 0 HA THR A 42 -10.348 20.347 -2.738 1.00 44.42 H new ATOM 0 HB THR A 42 -9.303 18.313 -1.982 1.00 63.44 H new ATOM 0 HG1 THR A 42 -9.113 19.498 0.127 1.00 73.05 H new ATOM 0 HG21 THR A 42 -7.237 18.562 -0.673 1.00 20.34 H new ATOM 0 HG22 THR A 42 -6.993 18.506 -2.435 1.00 20.34 H new ATOM 0 HG23 THR A 42 -6.889 20.058 -1.572 1.00 20.34 H new ATOM 613 N PHE A 43 -9.325 21.969 -4.582 1.00 51.10 N ATOM 614 CA PHE A 43 -8.867 23.124 -5.354 1.00 63.54 C ATOM 615 C PHE A 43 -7.361 23.048 -5.648 1.00 42.42 C ATOM 616 O PHE A 43 -6.733 21.992 -5.541 1.00 11.12 O ATOM 617 CB PHE A 43 -9.396 24.457 -4.767 1.00 2.22 C ATOM 618 CG PHE A 43 -9.037 24.766 -3.327 1.00 31.45 C ATOM 619 CD1 PHE A 43 -9.732 24.124 -2.287 1.00 44.13 C ATOM 620 CD2 PHE A 43 -8.005 25.676 -3.017 1.00 53.14 C ATOM 621 CE1 PHE A 43 -9.326 24.302 -0.957 1.00 24.21 C ATOM 622 CE2 PHE A 43 -7.641 25.897 -1.676 1.00 1.23 C ATOM 623 CZ PHE A 43 -8.275 25.182 -0.643 1.00 13.22 C ATOM 0 H PHE A 43 -10.197 21.594 -4.956 1.00 51.10 H new ATOM 0 HA PHE A 43 -9.319 23.095 -6.346 1.00 63.54 H new ATOM 0 HB2 PHE A 43 -9.027 25.272 -5.390 1.00 2.22 H new ATOM 0 HB3 PHE A 43 -10.483 24.457 -4.853 1.00 2.22 H new ATOM 0 HD1 PHE A 43 -10.579 23.493 -2.513 1.00 44.13 H new ATOM 0 HD2 PHE A 43 -7.494 26.203 -3.809 1.00 53.14 H new ATOM 0 HE1 PHE A 43 -9.824 23.759 -0.167 1.00 24.21 H new ATOM 0 HE2 PHE A 43 -6.872 26.618 -1.439 1.00 1.23 H new ATOM 0 HZ PHE A 43 -7.957 25.308 0.382 1.00 13.22 H new ATOM 632 N ASP A 44 -6.789 24.148 -6.112 1.00 53.42 N ATOM 633 CA ASP A 44 -5.358 24.384 -6.208 1.00 21.52 C ATOM 634 C ASP A 44 -5.142 25.881 -5.977 1.00 64.11 C ATOM 635 O ASP A 44 -6.112 26.644 -5.981 1.00 54.32 O ATOM 636 CB ASP A 44 -4.799 23.906 -7.560 1.00 42.13 C ATOM 637 CG ASP A 44 -4.977 24.936 -8.674 1.00 62.44 C ATOM 638 OD1 ASP A 44 -4.095 25.802 -8.842 1.00 24.24 O ATOM 639 OD2 ASP A 44 -5.985 24.866 -9.411 1.00 72.33 O ATOM 0 H ASP A 44 -7.338 24.939 -6.448 1.00 53.42 H new ATOM 0 HA ASP A 44 -4.813 23.811 -5.458 1.00 21.52 H new ATOM 0 HB2 ASP A 44 -3.739 23.678 -7.449 1.00 42.13 H new ATOM 0 HB3 ASP A 44 -5.296 22.979 -7.846 1.00 42.13 H new ATOM 643 N ALA A 45 -3.899 26.312 -5.767 1.00 71.30 N ATOM 644 CA ALA A 45 -3.563 27.717 -5.526 1.00 11.31 C ATOM 645 C ALA A 45 -2.599 28.275 -6.578 1.00 75.33 C ATOM 646 O ALA A 45 -2.198 29.432 -6.469 1.00 32.22 O ATOM 647 CB ALA A 45 -2.998 27.871 -4.112 1.00 64.31 C ATOM 0 H ALA A 45 -3.089 25.692 -5.759 1.00 71.30 H new ATOM 0 HA ALA A 45 -4.477 28.305 -5.612 1.00 11.31 H new ATOM 0 HB1 ALA A 45 -2.748 28.917 -3.932 1.00 64.31 H new ATOM 0 HB2 ALA A 45 -3.742 27.546 -3.385 1.00 64.31 H new ATOM 0 HB3 ALA A 45 -2.101 27.260 -4.010 1.00 64.31 H new ATOM 653 N ASP A 46 -2.202 27.468 -7.559 1.00 74.52 N ATOM 654 CA ASP A 46 -1.548 27.805 -8.829 1.00 24.33 C ATOM 655 C ASP A 46 -1.184 26.493 -9.523 1.00 20.52 C ATOM 656 O ASP A 46 -1.265 26.391 -10.749 1.00 61.33 O ATOM 657 CB ASP A 46 -0.281 28.679 -8.698 1.00 4.02 C ATOM 658 CG ASP A 46 -0.423 29.993 -9.470 1.00 0.44 C ATOM 659 OD1 ASP A 46 -0.722 29.969 -10.686 1.00 24.22 O ATOM 660 OD2 ASP A 46 -0.287 31.072 -8.843 1.00 14.02 O ATOM 0 H ASP A 46 -2.343 26.461 -7.480 1.00 74.52 H new ATOM 0 HA ASP A 46 -2.254 28.407 -9.401 1.00 24.33 H new ATOM 0 HB2 ASP A 46 -0.092 28.893 -7.646 1.00 4.02 H new ATOM 0 HB3 ASP A 46 0.582 28.128 -9.071 1.00 4.02 H new ATOM 664 N MET A 47 -0.772 25.504 -8.719 1.00 71.42 N ATOM 665 CA MET A 47 -0.288 24.174 -9.072 1.00 24.32 C ATOM 666 C MET A 47 -0.703 23.212 -7.955 1.00 54.30 C ATOM 667 O MET A 47 -1.247 23.649 -6.935 1.00 31.54 O ATOM 668 CB MET A 47 1.249 24.176 -9.175 1.00 51.13 C ATOM 669 CG MET A 47 1.784 25.098 -10.270 1.00 75.53 C ATOM 670 SD MET A 47 3.525 25.527 -10.051 1.00 42.01 S ATOM 671 CE MET A 47 3.433 27.142 -10.845 1.00 0.33 C ATOM 0 H MET A 47 -0.772 25.634 -7.707 1.00 71.42 H new ATOM 0 HA MET A 47 -0.707 23.872 -10.032 1.00 24.32 H new ATOM 0 HB2 MET A 47 1.669 24.481 -8.217 1.00 51.13 H new ATOM 0 HB3 MET A 47 1.594 23.160 -9.366 1.00 51.13 H new ATOM 0 HG2 MET A 47 1.655 24.615 -11.238 1.00 75.53 H new ATOM 0 HG3 MET A 47 1.191 26.012 -10.288 1.00 75.53 H new ATOM 0 HE1 MET A 47 4.417 27.611 -10.830 1.00 0.33 H new ATOM 0 HE2 MET A 47 3.104 27.022 -11.877 1.00 0.33 H new ATOM 0 HE3 MET A 47 2.722 27.771 -10.309 1.00 0.33 H new ATOM 679 N TYR A 48 -0.392 21.921 -8.125 1.00 71.52 N ATOM 680 CA TYR A 48 -0.569 20.907 -7.092 1.00 42.44 C ATOM 681 C TYR A 48 0.156 21.292 -5.799 1.00 13.45 C ATOM 682 O TYR A 48 1.232 21.905 -5.828 1.00 71.33 O ATOM 683 CB TYR A 48 -0.007 19.558 -7.549 1.00 11.44 C ATOM 684 CG TYR A 48 -0.482 19.016 -8.879 1.00 60.43 C ATOM 685 CD1 TYR A 48 -1.766 18.445 -9.004 1.00 13.25 C ATOM 686 CD2 TYR A 48 0.415 18.987 -9.963 1.00 71.31 C ATOM 687 CE1 TYR A 48 -2.134 17.810 -10.206 1.00 22.53 C ATOM 688 CE2 TYR A 48 0.050 18.359 -11.161 1.00 11.14 C ATOM 689 CZ TYR A 48 -1.220 17.760 -11.284 1.00 20.43 C ATOM 690 OH TYR A 48 -1.543 17.105 -12.426 1.00 0.32 O ATOM 0 H TYR A 48 -0.007 21.553 -8.995 1.00 71.52 H new ATOM 0 HA TYR A 48 -1.641 20.834 -6.911 1.00 42.44 H new ATOM 0 HB2 TYR A 48 1.079 19.643 -7.589 1.00 11.44 H new ATOM 0 HB3 TYR A 48 -0.241 18.819 -6.782 1.00 11.44 H new ATOM 0 HD1 TYR A 48 -2.464 18.495 -8.181 1.00 13.25 H new ATOM 0 HD2 TYR A 48 1.387 19.450 -9.871 1.00 71.31 H new ATOM 0 HE1 TYR A 48 -3.112 17.362 -10.304 1.00 22.53 H new ATOM 0 HE2 TYR A 48 0.742 18.334 -11.990 1.00 11.14 H new ATOM 0 HH TYR A 48 -0.801 17.171 -13.062 1.00 0.32 H new ATOM 699 N LYS A 49 -0.366 20.817 -4.666 1.00 52.33 N ATOM 700 CA LYS A 49 0.126 21.125 -3.321 1.00 64.42 C ATOM 701 C LYS A 49 0.206 19.868 -2.463 1.00 32.54 C ATOM 702 O LYS A 49 0.414 19.949 -1.250 1.00 44.04 O ATOM 703 CB LYS A 49 -0.763 22.221 -2.697 1.00 22.22 C ATOM 704 CG LYS A 49 -0.265 23.602 -3.145 1.00 71.52 C ATOM 705 CD LYS A 49 -1.052 24.764 -2.524 1.00 63.34 C ATOM 706 CE LYS A 49 -0.134 25.989 -2.411 1.00 74.13 C ATOM 707 NZ LYS A 49 0.723 25.920 -1.207 1.00 73.33 N ATOM 0 H LYS A 49 -1.168 20.187 -4.659 1.00 52.33 H new ATOM 0 HA LYS A 49 1.144 21.510 -3.379 1.00 64.42 H new ATOM 0 HB2 LYS A 49 -1.800 22.080 -3.002 1.00 22.22 H new ATOM 0 HB3 LYS A 49 -0.738 22.149 -1.610 1.00 22.22 H new ATOM 0 HG2 LYS A 49 0.788 23.704 -2.881 1.00 71.52 H new ATOM 0 HG3 LYS A 49 -0.329 23.669 -4.231 1.00 71.52 H new ATOM 0 HD2 LYS A 49 -1.921 25.001 -3.138 1.00 63.34 H new ATOM 0 HD3 LYS A 49 -1.425 24.482 -1.540 1.00 63.34 H new ATOM 0 HE2 LYS A 49 0.492 26.058 -3.300 1.00 74.13 H new ATOM 0 HE3 LYS A 49 -0.739 26.895 -2.376 1.00 74.13 H new ATOM 0 HZ1 LYS A 49 1.329 26.764 -1.164 1.00 73.33 H new ATOM 0 HZ2 LYS A 49 0.125 25.879 -0.357 1.00 73.33 H new ATOM 0 HZ3 LYS A 49 1.318 25.068 -1.253 1.00 73.33 H new ATOM 717 N THR A 50 0.051 18.697 -3.075 1.00 1.01 N ATOM 718 CA THR A 50 -0.180 17.436 -2.399 1.00 44.02 C ATOM 719 C THR A 50 0.880 16.433 -2.888 1.00 74.52 C ATOM 720 O THR A 50 0.569 15.400 -3.479 1.00 73.55 O ATOM 721 CB THR A 50 -1.652 17.043 -2.625 1.00 35.21 C ATOM 722 OG1 THR A 50 -2.504 18.139 -2.330 1.00 34.52 O ATOM 723 CG2 THR A 50 -2.112 15.870 -1.753 1.00 23.34 C ATOM 0 H THR A 50 0.085 18.603 -4.090 1.00 1.01 H new ATOM 0 HA THR A 50 -0.055 17.479 -1.317 1.00 44.02 H new ATOM 0 HB THR A 50 -1.715 16.746 -3.672 1.00 35.21 H new ATOM 0 HG1 THR A 50 -3.437 17.878 -2.479 1.00 34.52 H new ATOM 0 HG21 THR A 50 -3.158 15.648 -1.965 1.00 23.34 H new ATOM 0 HG22 THR A 50 -1.503 14.993 -1.972 1.00 23.34 H new ATOM 0 HG23 THR A 50 -2.003 16.134 -0.701 1.00 23.34 H new ATOM 731 N SER A 51 2.156 16.720 -2.615 1.00 43.42 N ATOM 732 CA SER A 51 3.275 15.791 -2.680 1.00 54.23 C ATOM 733 C SER A 51 4.224 16.114 -1.512 1.00 34.44 C ATOM 734 O SER A 51 4.845 17.174 -1.489 1.00 71.55 O ATOM 735 CB SER A 51 3.933 15.846 -4.067 1.00 12.03 C ATOM 736 OG SER A 51 4.308 17.161 -4.444 1.00 61.52 O ATOM 0 H SER A 51 2.445 17.655 -2.329 1.00 43.42 H new ATOM 0 HA SER A 51 2.952 14.757 -2.564 1.00 54.23 H new ATOM 0 HB2 SER A 51 4.815 15.206 -4.072 1.00 12.03 H new ATOM 0 HB3 SER A 51 3.243 15.443 -4.808 1.00 12.03 H new ATOM 0 HG SER A 51 4.629 17.648 -3.657 1.00 61.52 H new ATOM 741 N ASP A 52 4.262 15.241 -0.502 1.00 11.01 N ATOM 742 CA ASP A 52 5.060 15.314 0.730 1.00 11.22 C ATOM 743 C ASP A 52 5.071 16.692 1.424 1.00 20.23 C ATOM 744 O ASP A 52 6.117 17.338 1.529 1.00 43.04 O ATOM 745 CB ASP A 52 6.480 14.759 0.497 1.00 53.34 C ATOM 746 CG ASP A 52 7.313 14.755 1.786 1.00 40.32 C ATOM 747 OD1 ASP A 52 6.741 14.445 2.858 1.00 51.02 O ATOM 748 OD2 ASP A 52 8.525 15.071 1.731 1.00 43.31 O ATOM 0 H ASP A 52 3.691 14.396 -0.524 1.00 11.01 H new ATOM 0 HA ASP A 52 4.549 14.672 1.447 1.00 11.22 H new ATOM 0 HB2 ASP A 52 6.413 13.744 0.105 1.00 53.34 H new ATOM 0 HB3 ASP A 52 6.985 15.360 -0.259 1.00 53.34 H new ATOM 752 N ILE A 53 3.927 17.152 1.952 1.00 24.22 N ATOM 753 CA ILE A 53 3.908 18.301 2.870 1.00 3.40 C ATOM 754 C ILE A 53 4.342 17.852 4.271 1.00 24.32 C ATOM 755 O ILE A 53 5.236 18.467 4.856 1.00 44.04 O ATOM 756 CB ILE A 53 2.543 19.042 2.863 1.00 71.15 C ATOM 757 CG1 ILE A 53 2.524 20.304 3.751 1.00 34.33 C ATOM 758 CG2 ILE A 53 1.348 18.159 3.247 1.00 63.52 C ATOM 759 CD1 ILE A 53 3.351 21.448 3.167 1.00 55.11 C ATOM 0 H ILE A 53 3.009 16.750 1.761 1.00 24.22 H new ATOM 0 HA ILE A 53 4.629 19.039 2.518 1.00 3.40 H new ATOM 0 HB ILE A 53 2.433 19.337 1.820 1.00 71.15 H new ATOM 0 HG12 ILE A 53 1.494 20.636 3.882 1.00 34.33 H new ATOM 0 HG13 ILE A 53 2.906 20.053 4.740 1.00 34.33 H new ATOM 0 HG21 ILE A 53 0.434 18.752 3.218 1.00 63.52 H new ATOM 0 HG22 ILE A 53 1.266 17.331 2.543 1.00 63.52 H new ATOM 0 HG23 ILE A 53 1.494 17.767 4.253 1.00 63.52 H new ATOM 0 HD11 ILE A 53 3.302 22.309 3.833 1.00 55.11 H new ATOM 0 HD12 ILE A 53 4.388 21.130 3.061 1.00 55.11 H new ATOM 0 HD13 ILE A 53 2.954 21.722 2.190 1.00 55.11 H new ATOM 770 N ALA A 54 3.767 16.747 4.766 1.00 55.03 N ATOM 771 CA ALA A 54 3.577 16.386 6.172 1.00 3.24 C ATOM 772 C ALA A 54 2.541 17.307 6.827 1.00 43.23 C ATOM 773 O ALA A 54 2.614 18.531 6.700 1.00 3.30 O ATOM 774 CB ALA A 54 4.892 16.295 6.963 1.00 44.22 C ATOM 0 H ALA A 54 3.395 16.030 4.144 1.00 55.03 H new ATOM 0 HA ALA A 54 3.179 15.372 6.196 1.00 3.24 H new ATOM 0 HB1 ALA A 54 4.677 16.024 7.997 1.00 44.22 H new ATOM 0 HB2 ALA A 54 5.534 15.537 6.515 1.00 44.22 H new ATOM 0 HB3 ALA A 54 5.398 17.260 6.939 1.00 44.22 H new ATOM 780 N LEU A 55 1.583 16.703 7.536 1.00 44.21 N ATOM 781 CA LEU A 55 0.324 17.280 7.943 1.00 60.13 C ATOM 782 C LEU A 55 -0.518 17.746 6.754 1.00 63.14 C ATOM 783 O LEU A 55 -0.452 17.138 5.695 1.00 61.45 O ATOM 784 CB LEU A 55 0.556 18.293 9.063 1.00 75.15 C ATOM 785 CG LEU A 55 -0.510 18.099 10.158 1.00 41.13 C ATOM 786 CD1 LEU A 55 0.176 17.720 11.458 1.00 64.54 C ATOM 787 CD2 LEU A 55 -1.386 19.331 10.345 1.00 44.14 C ATOM 0 H LEU A 55 1.684 15.739 7.854 1.00 44.21 H new ATOM 0 HA LEU A 55 -0.315 16.514 8.383 1.00 60.13 H new ATOM 0 HB2 LEU A 55 1.553 18.164 9.484 1.00 75.15 H new ATOM 0 HB3 LEU A 55 0.506 19.307 8.667 1.00 75.15 H new ATOM 0 HG LEU A 55 -1.177 17.296 9.843 1.00 41.13 H new ATOM 0 HD11 LEU A 55 -0.573 17.581 12.238 1.00 64.54 H new ATOM 0 HD12 LEU A 55 0.732 16.793 11.319 1.00 64.54 H new ATOM 0 HD13 LEU A 55 0.863 18.514 11.752 1.00 64.54 H new ATOM 0 HD21 LEU A 55 -2.120 19.140 11.128 1.00 44.14 H new ATOM 0 HD22 LEU A 55 -0.764 20.180 10.629 1.00 44.14 H new ATOM 0 HD23 LEU A 55 -1.902 19.556 9.411 1.00 44.14 H new ATOM 798 N ASP A 56 -1.425 18.681 7.000 1.00 20.32 N ATOM 799 CA ASP A 56 -2.490 19.217 6.165 1.00 60.23 C ATOM 800 C ASP A 56 -3.369 18.231 5.395 1.00 21.50 C ATOM 801 O ASP A 56 -4.196 18.641 4.591 1.00 62.42 O ATOM 802 CB ASP A 56 -2.011 20.398 5.312 1.00 74.15 C ATOM 803 CG ASP A 56 -3.122 21.460 5.231 1.00 4.12 C ATOM 804 OD1 ASP A 56 -3.423 22.079 6.287 1.00 20.11 O ATOM 805 OD2 ASP A 56 -3.676 21.703 4.135 1.00 64.33 O ATOM 0 H ASP A 56 -1.430 19.141 7.910 1.00 20.32 H new ATOM 0 HA ASP A 56 -3.202 19.586 6.903 1.00 60.23 H new ATOM 0 HB2 ASP A 56 -1.110 20.832 5.746 1.00 74.15 H new ATOM 0 HB3 ASP A 56 -1.749 20.054 4.311 1.00 74.15 H new ATOM 809 N GLN A 57 -3.257 16.937 5.662 1.00 32.52 N ATOM 810 CA GLN A 57 -3.955 15.838 4.995 1.00 35.42 C ATOM 811 C GLN A 57 -4.531 14.831 6.009 1.00 54.44 C ATOM 812 O GLN A 57 -4.851 13.694 5.654 1.00 2.50 O ATOM 813 CB GLN A 57 -2.960 15.149 4.029 1.00 20.23 C ATOM 814 CG GLN A 57 -3.528 14.973 2.615 1.00 20.32 C ATOM 815 CD GLN A 57 -3.768 16.309 1.921 1.00 20.21 C ATOM 816 OE1 GLN A 57 -4.883 16.612 1.511 1.00 40.21 O ATOM 817 NE2 GLN A 57 -2.735 17.121 1.777 1.00 23.43 N ATOM 0 H GLN A 57 -2.636 16.601 6.398 1.00 32.52 H new ATOM 0 HA GLN A 57 -4.804 16.233 4.437 1.00 35.42 H new ATOM 0 HB2 GLN A 57 -2.044 15.738 3.977 1.00 20.23 H new ATOM 0 HB3 GLN A 57 -2.688 14.173 4.430 1.00 20.23 H new ATOM 0 HG2 GLN A 57 -2.838 14.375 2.020 1.00 20.32 H new ATOM 0 HG3 GLN A 57 -4.465 14.419 2.668 1.00 20.32 H new ATOM 0 HE21 GLN A 57 -1.817 16.846 2.127 1.00 23.43 H new ATOM 0 HE22 GLN A 57 -2.856 18.023 1.316 1.00 23.43 H new ATOM 824 N ILE A 58 -4.568 15.182 7.303 1.00 25.20 N ATOM 825 CA ILE A 58 -4.661 14.196 8.382 1.00 11.11 C ATOM 826 C ILE A 58 -5.726 14.602 9.394 1.00 53.14 C ATOM 827 O ILE A 58 -6.608 13.794 9.694 1.00 73.21 O ATOM 828 CB ILE A 58 -3.260 13.995 9.025 1.00 24.24 C ATOM 829 CG1 ILE A 58 -2.338 13.166 8.094 1.00 25.01 C ATOM 830 CG2 ILE A 58 -3.305 13.276 10.388 1.00 25.23 C ATOM 831 CD1 ILE A 58 -1.391 14.017 7.245 1.00 61.34 C ATOM 0 H ILE A 58 -4.534 16.149 7.626 1.00 25.20 H new ATOM 0 HA ILE A 58 -4.977 13.234 7.977 1.00 11.11 H new ATOM 0 HB ILE A 58 -2.872 15.002 9.175 1.00 24.24 H new ATOM 0 HG12 ILE A 58 -1.748 12.479 8.701 1.00 25.01 H new ATOM 0 HG13 ILE A 58 -2.956 12.558 7.433 1.00 25.01 H new ATOM 0 HG21 ILE A 58 -2.292 13.170 10.777 1.00 25.23 H new ATOM 0 HG22 ILE A 58 -3.904 13.859 11.088 1.00 25.23 H new ATOM 0 HG23 ILE A 58 -3.751 12.289 10.264 1.00 25.23 H new ATOM 0 HD11 ILE A 58 -0.779 13.367 6.620 1.00 61.34 H new ATOM 0 HD12 ILE A 58 -1.973 14.686 6.611 1.00 61.34 H new ATOM 0 HD13 ILE A 58 -0.746 14.605 7.898 1.00 61.34 H new ATOM 842 N GLN A 59 -5.584 15.778 9.999 1.00 33.44 N ATOM 843 CA GLN A 59 -6.293 16.207 11.181 1.00 13.52 C ATOM 844 C GLN A 59 -6.863 17.588 10.891 1.00 64.12 C ATOM 845 O GLN A 59 -6.103 18.533 10.679 1.00 34.01 O ATOM 846 CB GLN A 59 -5.358 16.176 12.399 1.00 3.42 C ATOM 847 CG GLN A 59 -3.929 16.714 12.205 1.00 43.34 C ATOM 848 CD GLN A 59 -3.079 16.542 13.465 1.00 31.12 C ATOM 849 OE1 GLN A 59 -2.844 17.496 14.207 1.00 63.35 O ATOM 850 NE2 GLN A 59 -2.580 15.337 13.721 1.00 50.34 N ATOM 0 H GLN A 59 -4.937 16.487 9.654 1.00 33.44 H new ATOM 0 HA GLN A 59 -7.117 15.537 11.427 1.00 13.52 H new ATOM 0 HB2 GLN A 59 -5.828 16.747 13.200 1.00 3.42 H new ATOM 0 HB3 GLN A 59 -5.286 15.144 12.743 1.00 3.42 H new ATOM 0 HG2 GLN A 59 -3.455 16.193 11.373 1.00 43.34 H new ATOM 0 HG3 GLN A 59 -3.972 17.770 11.937 1.00 43.34 H new ATOM 0 HE21 GLN A 59 -2.784 14.557 13.096 1.00 50.34 H new ATOM 0 HE22 GLN A 59 -1.993 15.192 14.542 1.00 50.34 H new ATOM 857 N GLY A 60 -8.185 17.696 10.796 1.00 30.20 N ATOM 858 CA GLY A 60 -8.888 18.940 10.535 1.00 34.24 C ATOM 859 C GLY A 60 -8.978 19.278 9.051 1.00 73.34 C ATOM 860 O GLY A 60 -9.959 19.916 8.651 1.00 65.21 O ATOM 0 H GLY A 60 -8.810 16.897 10.902 1.00 30.20 H new ATOM 0 HA2 GLY A 60 -9.895 18.875 10.948 1.00 34.24 H new ATOM 0 HA3 GLY A 60 -8.382 19.752 11.056 1.00 34.24 H new ATOM 864 N ASN A 61 -8.037 18.807 8.227 1.00 12.11 N ATOM 865 CA ASN A 61 -8.315 18.570 6.817 1.00 32.30 C ATOM 866 C ASN A 61 -8.491 17.068 6.648 1.00 71.41 C ATOM 867 O ASN A 61 -7.956 16.276 7.433 1.00 71.15 O ATOM 868 CB ASN A 61 -7.216 19.110 5.893 1.00 72.21 C ATOM 869 CG ASN A 61 -7.662 19.056 4.431 1.00 23.13 C ATOM 870 OD1 ASN A 61 -8.853 19.159 4.144 1.00 1.33 O ATOM 871 ND2 ASN A 61 -6.749 18.910 3.495 1.00 65.35 N ATOM 0 H ASN A 61 -7.084 18.585 8.514 1.00 12.11 H new ATOM 0 HA ASN A 61 -9.217 19.108 6.527 1.00 32.30 H new ATOM 0 HB2 ASN A 61 -6.976 20.137 6.167 1.00 72.21 H new ATOM 0 HB3 ASN A 61 -6.306 18.525 6.022 1.00 72.21 H new ATOM 0 HD21 ASN A 61 -7.025 18.881 2.513 1.00 65.35 H new ATOM 0 HD22 ASN A 61 -5.765 18.826 3.751 1.00 65.35 H new ATOM 877 N LYS A 62 -9.281 16.679 5.656 1.00 74.32 N ATOM 878 CA LYS A 62 -9.662 15.306 5.379 1.00 41.24 C ATOM 879 C LYS A 62 -9.963 15.226 3.885 1.00 23.21 C ATOM 880 O LYS A 62 -9.575 16.130 3.148 1.00 71.01 O ATOM 881 CB LYS A 62 -10.854 14.894 6.268 1.00 34.43 C ATOM 882 CG LYS A 62 -10.686 13.431 6.694 1.00 25.22 C ATOM 883 CD LYS A 62 -11.977 12.852 7.276 1.00 65.41 C ATOM 884 CE LYS A 62 -11.653 11.478 7.868 1.00 41.33 C ATOM 885 NZ LYS A 62 -12.864 10.704 8.189 1.00 23.32 N ATOM 0 H LYS A 62 -9.689 17.342 4.997 1.00 74.32 H new ATOM 0 HA LYS A 62 -8.866 14.601 5.618 1.00 41.24 H new ATOM 0 HB2 LYS A 62 -10.907 15.537 7.147 1.00 34.43 H new ATOM 0 HB3 LYS A 62 -11.790 15.021 5.724 1.00 34.43 H new ATOM 0 HG2 LYS A 62 -10.377 12.836 5.834 1.00 25.22 H new ATOM 0 HG3 LYS A 62 -9.890 13.358 7.435 1.00 25.22 H new ATOM 0 HD2 LYS A 62 -12.379 13.513 8.044 1.00 65.41 H new ATOM 0 HD3 LYS A 62 -12.738 12.763 6.501 1.00 65.41 H new ATOM 0 HE2 LYS A 62 -11.043 10.916 7.161 1.00 41.33 H new ATOM 0 HE3 LYS A 62 -11.057 11.606 8.772 1.00 41.33 H new ATOM 0 HZ1 LYS A 62 -12.592 9.782 8.587 1.00 23.32 H new ATOM 0 HZ2 LYS A 62 -13.435 11.226 8.884 1.00 23.32 H new ATOM 0 HZ3 LYS A 62 -13.421 10.557 7.323 1.00 23.32 H new ATOM 895 N ASP A 63 -10.635 14.160 3.448 1.00 31.22 N ATOM 896 CA ASP A 63 -11.075 13.967 2.068 1.00 70.03 C ATOM 897 C ASP A 63 -9.833 13.750 1.218 1.00 33.01 C ATOM 898 O ASP A 63 -9.409 14.587 0.417 1.00 25.14 O ATOM 899 CB ASP A 63 -12.028 15.081 1.606 1.00 71.23 C ATOM 900 CG ASP A 63 -13.228 15.184 2.541 1.00 61.43 C ATOM 901 OD1 ASP A 63 -14.024 14.219 2.627 1.00 5.12 O ATOM 902 OD2 ASP A 63 -13.371 16.206 3.258 1.00 64.43 O ATOM 0 H ASP A 63 -10.894 13.387 4.061 1.00 31.22 H new ATOM 0 HA ASP A 63 -11.695 13.077 1.962 1.00 70.03 H new ATOM 0 HB2 ASP A 63 -11.498 16.033 1.580 1.00 71.23 H new ATOM 0 HB3 ASP A 63 -12.368 14.878 0.590 1.00 71.23 H new ATOM 906 N PHE A 64 -9.197 12.610 1.504 1.00 51.32 N ATOM 907 CA PHE A 64 -7.908 12.246 0.941 1.00 54.53 C ATOM 908 C PHE A 64 -8.064 12.110 -0.575 1.00 45.52 C ATOM 909 O PHE A 64 -9.102 11.602 -1.014 1.00 3.32 O ATOM 910 CB PHE A 64 -7.428 10.909 1.527 1.00 13.54 C ATOM 911 CG PHE A 64 -7.241 10.786 3.032 1.00 10.23 C ATOM 912 CD1 PHE A 64 -7.319 11.880 3.918 1.00 51.51 C ATOM 913 CD2 PHE A 64 -6.952 9.511 3.548 1.00 62.33 C ATOM 914 CE1 PHE A 64 -7.146 11.682 5.299 1.00 33.42 C ATOM 915 CE2 PHE A 64 -6.766 9.311 4.926 1.00 34.01 C ATOM 916 CZ PHE A 64 -6.867 10.401 5.806 1.00 30.11 C ATOM 0 H PHE A 64 -9.574 11.910 2.142 1.00 51.32 H new ATOM 0 HA PHE A 64 -7.174 13.015 1.182 1.00 54.53 H new ATOM 0 HB2 PHE A 64 -8.139 10.142 1.220 1.00 13.54 H new ATOM 0 HB3 PHE A 64 -6.475 10.667 1.056 1.00 13.54 H new ATOM 0 HD1 PHE A 64 -7.512 12.871 3.535 1.00 51.51 H new ATOM 0 HD2 PHE A 64 -6.872 8.671 2.874 1.00 62.33 H new ATOM 0 HE1 PHE A 64 -7.228 12.520 5.975 1.00 33.42 H new ATOM 0 HE2 PHE A 64 -6.547 8.324 5.307 1.00 34.01 H new ATOM 0 HZ PHE A 64 -6.731 10.256 6.867 1.00 30.11 H new ATOM 925 N PRO A 65 -7.044 12.483 -1.364 1.00 22.25 N ATOM 926 CA PRO A 65 -7.174 12.578 -2.805 1.00 62.12 C ATOM 927 C PRO A 65 -7.488 11.225 -3.425 1.00 74.04 C ATOM 928 O PRO A 65 -7.008 10.166 -2.993 1.00 51.51 O ATOM 929 CB PRO A 65 -5.845 13.142 -3.319 1.00 4.12 C ATOM 930 CG PRO A 65 -4.862 12.775 -2.217 1.00 64.30 C ATOM 931 CD PRO A 65 -5.715 12.908 -0.957 1.00 52.25 C ATOM 0 HA PRO A 65 -8.004 13.227 -3.082 1.00 62.12 H new ATOM 0 HB2 PRO A 65 -5.562 12.700 -4.274 1.00 4.12 H new ATOM 0 HB3 PRO A 65 -5.897 14.220 -3.470 1.00 4.12 H new ATOM 0 HG2 PRO A 65 -4.474 11.764 -2.340 1.00 64.30 H new ATOM 0 HG3 PRO A 65 -4.003 13.446 -2.199 1.00 64.30 H new ATOM 0 HD2 PRO A 65 -5.330 12.284 -0.150 1.00 52.25 H new ATOM 0 HD3 PRO A 65 -5.723 13.935 -0.591 1.00 52.25 H new ATOM 936 N GLU A 66 -8.254 11.286 -4.506 1.00 44.51 N ATOM 937 CA GLU A 66 -8.384 10.165 -5.392 1.00 2.44 C ATOM 938 C GLU A 66 -7.052 9.994 -6.122 1.00 42.34 C ATOM 939 O GLU A 66 -6.255 10.928 -6.270 1.00 15.45 O ATOM 940 CB GLU A 66 -9.561 10.338 -6.350 1.00 55.10 C ATOM 941 CG GLU A 66 -10.927 10.380 -5.646 1.00 3.12 C ATOM 942 CD GLU A 66 -11.323 11.789 -5.202 1.00 50.41 C ATOM 943 OE1 GLU A 66 -11.916 12.544 -6.010 1.00 42.44 O ATOM 944 OE2 GLU A 66 -11.030 12.174 -4.053 1.00 42.22 O ATOM 0 H GLU A 66 -8.792 12.108 -4.781 1.00 44.51 H new ATOM 0 HA GLU A 66 -8.606 9.259 -4.828 1.00 2.44 H new ATOM 0 HB2 GLU A 66 -9.425 11.259 -6.916 1.00 55.10 H new ATOM 0 HB3 GLU A 66 -9.557 9.518 -7.069 1.00 55.10 H new ATOM 0 HG2 GLU A 66 -11.690 9.989 -6.319 1.00 3.12 H new ATOM 0 HG3 GLU A 66 -10.902 9.724 -4.776 1.00 3.12 H new ATOM 949 N ILE A 67 -6.812 8.774 -6.580 1.00 22.03 N ATOM 950 CA ILE A 67 -5.533 8.377 -7.143 1.00 52.23 C ATOM 951 C ILE A 67 -5.688 8.179 -8.645 1.00 71.41 C ATOM 952 O ILE A 67 -6.807 8.162 -9.165 1.00 24.44 O ATOM 953 CB ILE A 67 -4.995 7.144 -6.389 1.00 11.44 C ATOM 954 CG1 ILE A 67 -5.987 5.963 -6.440 1.00 3.11 C ATOM 955 CG2 ILE A 67 -4.680 7.550 -4.937 1.00 34.31 C ATOM 956 CD1 ILE A 67 -5.364 4.651 -5.971 1.00 22.24 C ATOM 0 H ILE A 67 -7.506 8.027 -6.571 1.00 22.03 H new ATOM 0 HA ILE A 67 -4.782 9.156 -7.013 1.00 52.23 H new ATOM 0 HB ILE A 67 -4.083 6.799 -6.876 1.00 11.44 H new ATOM 0 HG12 ILE A 67 -6.852 6.193 -5.818 1.00 3.11 H new ATOM 0 HG13 ILE A 67 -6.351 5.843 -7.460 1.00 3.11 H new ATOM 0 HG21 ILE A 67 -4.298 6.686 -4.392 1.00 34.31 H new ATOM 0 HG22 ILE A 67 -3.930 8.341 -4.935 1.00 34.31 H new ATOM 0 HG23 ILE A 67 -5.589 7.911 -4.455 1.00 34.31 H new ATOM 0 HD11 ILE A 67 -6.106 3.855 -6.028 1.00 22.24 H new ATOM 0 HD12 ILE A 67 -4.516 4.402 -6.609 1.00 22.24 H new ATOM 0 HD13 ILE A 67 -5.024 4.757 -4.941 1.00 22.24 H new ATOM 967 N GLN A 68 -4.571 8.000 -9.334 1.00 12.01 N ATOM 968 CA GLN A 68 -4.529 7.613 -10.728 1.00 14.22 C ATOM 969 C GLN A 68 -3.460 6.547 -10.862 1.00 0.24 C ATOM 970 O GLN A 68 -2.435 6.575 -10.183 1.00 61.23 O ATOM 971 CB GLN A 68 -4.198 8.822 -11.610 1.00 15.32 C ATOM 972 CG GLN A 68 -5.430 9.434 -12.264 1.00 43.03 C ATOM 973 CD GLN A 68 -5.040 10.737 -12.948 1.00 0.05 C ATOM 974 OE1 GLN A 68 -4.261 10.755 -13.899 1.00 0.01 O ATOM 975 NE2 GLN A 68 -5.500 11.857 -12.432 1.00 61.21 N ATOM 0 H GLN A 68 -3.646 8.124 -8.924 1.00 12.01 H new ATOM 0 HA GLN A 68 -5.497 7.230 -11.053 1.00 14.22 H new ATOM 0 HB2 GLN A 68 -3.699 9.580 -11.006 1.00 15.32 H new ATOM 0 HB3 GLN A 68 -3.495 8.518 -12.385 1.00 15.32 H new ATOM 0 HG2 GLN A 68 -5.853 8.740 -12.991 1.00 43.03 H new ATOM 0 HG3 GLN A 68 -6.200 9.619 -11.515 1.00 43.03 H new ATOM 0 HE21 GLN A 68 -6.146 11.828 -11.643 1.00 61.21 H new ATOM 0 HE22 GLN A 68 -5.211 12.754 -12.821 1.00 61.21 H new ATOM 982 N LEU A 69 -3.716 5.610 -11.756 1.00 42.00 N ATOM 983 CA LEU A 69 -2.806 4.599 -12.249 1.00 74.10 C ATOM 984 C LEU A 69 -3.404 4.130 -13.576 1.00 34.24 C ATOM 985 O LEU A 69 -4.459 4.618 -13.991 1.00 43.43 O ATOM 986 CB LEU A 69 -2.593 3.472 -11.214 1.00 40.32 C ATOM 987 CG LEU A 69 -3.674 2.378 -11.133 1.00 11.13 C ATOM 988 CD1 LEU A 69 -3.247 1.343 -10.090 1.00 60.22 C ATOM 989 CD2 LEU A 69 -5.070 2.903 -10.772 1.00 1.15 C ATOM 0 H LEU A 69 -4.637 5.532 -12.188 1.00 42.00 H new ATOM 0 HA LEU A 69 -1.799 4.984 -12.412 1.00 74.10 H new ATOM 0 HB2 LEU A 69 -1.640 2.990 -11.431 1.00 40.32 H new ATOM 0 HB3 LEU A 69 -2.502 3.930 -10.229 1.00 40.32 H new ATOM 0 HG LEU A 69 -3.756 1.944 -12.130 1.00 11.13 H new ATOM 0 HD11 LEU A 69 -4.004 0.562 -10.022 1.00 60.22 H new ATOM 0 HD12 LEU A 69 -2.295 0.901 -10.384 1.00 60.22 H new ATOM 0 HD13 LEU A 69 -3.138 1.828 -9.120 1.00 60.22 H new ATOM 0 HD21 LEU A 69 -5.773 2.071 -10.735 1.00 1.15 H new ATOM 0 HD22 LEU A 69 -5.034 3.391 -9.798 1.00 1.15 H new ATOM 0 HD23 LEU A 69 -5.395 3.620 -11.526 1.00 1.15 H new ATOM 1000 N ASP A 70 -2.726 3.212 -14.246 1.00 14.44 N ATOM 1001 CA ASP A 70 -3.174 2.628 -15.507 1.00 64.10 C ATOM 1002 C ASP A 70 -4.448 1.778 -15.337 1.00 20.21 C ATOM 1003 O ASP A 70 -4.996 1.671 -14.236 1.00 71.31 O ATOM 1004 CB ASP A 70 -2.019 1.825 -16.092 1.00 21.25 C ATOM 1005 CG ASP A 70 -2.079 1.802 -17.615 1.00 42.01 C ATOM 1006 OD1 ASP A 70 -1.958 2.879 -18.240 1.00 64.41 O ATOM 1007 OD2 ASP A 70 -2.289 0.703 -18.176 1.00 54.31 O ATOM 0 H ASP A 70 -1.831 2.843 -13.925 1.00 14.44 H new ATOM 0 HA ASP A 70 -3.453 3.423 -16.198 1.00 64.10 H new ATOM 0 HB2 ASP A 70 -1.072 2.257 -15.769 1.00 21.25 H new ATOM 0 HB3 ASP A 70 -2.051 0.805 -15.709 1.00 21.25 H new ATOM 1011 N ASN A 71 -4.945 1.148 -16.402 1.00 4.35 N ATOM 1012 CA ASN A 71 -5.980 0.122 -16.272 1.00 42.41 C ATOM 1013 C ASN A 71 -5.305 -1.228 -16.061 1.00 63.03 C ATOM 1014 O ASN A 71 -5.110 -2.010 -16.990 1.00 21.11 O ATOM 1015 CB ASN A 71 -6.892 0.090 -17.492 1.00 24.13 C ATOM 1016 CG ASN A 71 -7.993 -0.955 -17.348 1.00 73.00 C ATOM 1017 OD1 ASN A 71 -8.224 -1.756 -18.247 1.00 52.43 O ATOM 1018 ND2 ASN A 71 -8.741 -0.956 -16.257 1.00 52.40 N ATOM 0 H ASN A 71 -4.649 1.329 -17.361 1.00 4.35 H new ATOM 0 HA ASN A 71 -6.610 0.357 -15.414 1.00 42.41 H new ATOM 0 HB2 ASN A 71 -7.340 1.073 -17.637 1.00 24.13 H new ATOM 0 HB3 ASN A 71 -6.301 -0.125 -18.382 1.00 24.13 H new ATOM 0 HD21 ASN A 71 -9.508 -1.622 -16.165 1.00 52.40 H new ATOM 0 HD22 ASN A 71 -8.551 -0.291 -15.508 1.00 52.40 H new ATOM 1024 N ILE A 72 -4.868 -1.453 -14.833 1.00 63.30 N ATOM 1025 CA ILE A 72 -4.396 -2.746 -14.344 1.00 14.44 C ATOM 1026 C ILE A 72 -5.616 -3.503 -13.827 1.00 60.41 C ATOM 1027 O ILE A 72 -6.666 -2.911 -13.548 1.00 12.52 O ATOM 1028 CB ILE A 72 -3.325 -2.525 -13.246 1.00 74.31 C ATOM 1029 CG1 ILE A 72 -2.174 -1.653 -13.811 1.00 23.53 C ATOM 1030 CG2 ILE A 72 -2.683 -3.803 -12.671 1.00 40.53 C ATOM 1031 CD1 ILE A 72 -2.061 -0.316 -13.089 1.00 43.04 C ATOM 0 H ILE A 72 -4.829 -0.721 -14.124 1.00 63.30 H new ATOM 0 HA ILE A 72 -3.920 -3.332 -15.130 1.00 14.44 H new ATOM 0 HB ILE A 72 -3.870 -2.048 -12.431 1.00 74.31 H new ATOM 0 HG12 ILE A 72 -1.232 -2.194 -13.721 1.00 23.53 H new ATOM 0 HG13 ILE A 72 -2.341 -1.478 -14.874 1.00 23.53 H new ATOM 0 HG21 ILE A 72 -1.949 -3.532 -11.912 1.00 40.53 H new ATOM 0 HG22 ILE A 72 -3.455 -4.428 -12.222 1.00 40.53 H new ATOM 0 HG23 ILE A 72 -2.190 -4.354 -13.472 1.00 40.53 H new ATOM 0 HD11 ILE A 72 -1.242 0.261 -13.518 1.00 43.04 H new ATOM 0 HD12 ILE A 72 -2.993 0.238 -13.201 1.00 43.04 H new ATOM 0 HD13 ILE A 72 -1.867 -0.489 -12.030 1.00 43.04 H new ATOM 1042 N ASP A 73 -5.458 -4.804 -13.622 1.00 2.23 N ATOM 1043 CA ASP A 73 -6.372 -5.600 -12.827 1.00 34.33 C ATOM 1044 C ASP A 73 -5.558 -6.234 -11.713 1.00 51.21 C ATOM 1045 O ASP A 73 -4.481 -6.770 -11.966 1.00 43.10 O ATOM 1046 CB ASP A 73 -7.031 -6.669 -13.690 1.00 42.32 C ATOM 1047 CG ASP A 73 -8.197 -7.337 -12.962 1.00 1.13 C ATOM 1048 OD1 ASP A 73 -8.398 -7.098 -11.749 1.00 71.33 O ATOM 1049 OD2 ASP A 73 -8.932 -8.101 -13.622 1.00 31.15 O ATOM 0 H ASP A 73 -4.681 -5.339 -14.010 1.00 2.23 H new ATOM 0 HA ASP A 73 -7.169 -4.982 -12.413 1.00 34.33 H new ATOM 0 HB2 ASP A 73 -7.389 -6.220 -14.617 1.00 42.32 H new ATOM 0 HB3 ASP A 73 -6.293 -7.422 -13.965 1.00 42.32 H new ATOM 1053 N TYR A 74 -6.034 -6.155 -10.475 1.00 15.44 N ATOM 1054 CA TYR A 74 -5.401 -6.830 -9.357 1.00 1.55 C ATOM 1055 C TYR A 74 -5.674 -8.335 -9.394 1.00 3.45 C ATOM 1056 O TYR A 74 -4.908 -9.103 -8.813 1.00 31.32 O ATOM 1057 CB TYR A 74 -5.890 -6.176 -8.058 1.00 1.11 C ATOM 1058 CG TYR A 74 -5.672 -4.669 -8.001 1.00 33.21 C ATOM 1059 CD1 TYR A 74 -4.478 -4.097 -8.491 1.00 54.34 C ATOM 1060 CD2 TYR A 74 -6.693 -3.827 -7.521 1.00 51.11 C ATOM 1061 CE1 TYR A 74 -4.314 -2.703 -8.516 1.00 55.33 C ATOM 1062 CE2 TYR A 74 -6.524 -2.429 -7.528 1.00 44.33 C ATOM 1063 CZ TYR A 74 -5.335 -1.859 -8.035 1.00 53.51 C ATOM 1064 OH TYR A 74 -5.138 -0.513 -8.060 1.00 62.21 O ATOM 0 H TYR A 74 -6.867 -5.622 -10.223 1.00 15.44 H new ATOM 0 HA TYR A 74 -4.318 -6.723 -9.417 1.00 1.55 H new ATOM 0 HB2 TYR A 74 -6.953 -6.384 -7.937 1.00 1.11 H new ATOM 0 HB3 TYR A 74 -5.377 -6.639 -7.215 1.00 1.11 H new ATOM 0 HD1 TYR A 74 -3.685 -4.737 -8.849 1.00 54.34 H new ATOM 0 HD2 TYR A 74 -7.611 -4.255 -7.145 1.00 51.11 H new ATOM 0 HE1 TYR A 74 -3.402 -2.276 -8.905 1.00 55.33 H new ATOM 0 HE2 TYR A 74 -7.306 -1.790 -7.144 1.00 44.33 H new ATOM 0 HH TYR A 74 -5.994 -0.055 -7.930 1.00 62.21 H new ATOM 1073 N ASN A 75 -6.728 -8.778 -10.089 1.00 61.41 N ATOM 1074 CA ASN A 75 -7.214 -10.148 -9.980 1.00 2.34 C ATOM 1075 C ASN A 75 -6.322 -11.175 -10.650 1.00 35.31 C ATOM 1076 O ASN A 75 -6.383 -12.342 -10.274 1.00 43.13 O ATOM 1077 CB ASN A 75 -8.652 -10.271 -10.501 1.00 32.43 C ATOM 1078 CG ASN A 75 -9.620 -9.581 -9.567 1.00 2.52 C ATOM 1079 OD1 ASN A 75 -10.400 -8.717 -9.951 1.00 31.04 O ATOM 1080 ND2 ASN A 75 -9.563 -9.914 -8.300 1.00 21.44 N ATOM 0 H ASN A 75 -7.261 -8.198 -10.737 1.00 61.41 H new ATOM 0 HA ASN A 75 -7.195 -10.375 -8.914 1.00 2.34 H new ATOM 0 HB2 ASN A 75 -8.722 -9.831 -11.496 1.00 32.43 H new ATOM 0 HB3 ASN A 75 -8.920 -11.323 -10.598 1.00 32.43 H new ATOM 0 HD21 ASN A 75 -10.171 -9.453 -7.624 1.00 21.44 H new ATOM 0 HD22 ASN A 75 -8.910 -10.634 -7.991 1.00 21.44 H new ATOM 1086 N ASN A 76 -5.461 -10.786 -11.593 1.00 44.13 N ATOM 1087 CA ASN A 76 -4.511 -11.728 -12.160 1.00 44.44 C ATOM 1088 C ASN A 76 -3.302 -11.970 -11.242 1.00 21.35 C ATOM 1089 O ASN A 76 -2.525 -12.891 -11.529 1.00 0.12 O ATOM 1090 CB ASN A 76 -4.120 -11.312 -13.584 1.00 72.11 C ATOM 1091 CG ASN A 76 -3.294 -10.047 -13.638 1.00 74.20 C ATOM 1092 OD1 ASN A 76 -3.953 -8.929 -13.880 1.00 12.51 O flip ATOM 1093 ND2 ASN A 76 -2.076 -10.098 -13.503 1.00 11.42 N flip ATOM 0 H ASN A 76 -5.406 -9.840 -11.971 1.00 44.13 H new ATOM 0 HA ASN A 76 -5.004 -12.697 -12.235 1.00 44.44 H new ATOM 0 HB2 ASN A 76 -3.559 -12.123 -14.050 1.00 72.11 H new ATOM 0 HB3 ASN A 76 -5.025 -11.171 -14.174 1.00 72.11 H new ATOM 0 HD21 ASN A 76 -1.620 -10.991 -13.317 1.00 11.42 H new ATOM 0 HD22 ASN A 76 -1.519 -9.247 -13.577 1.00 11.42 H new ATOM 1099 N TYR A 77 -3.162 -11.238 -10.128 1.00 1.14 N ATOM 1100 CA TYR A 77 -2.137 -11.460 -9.111 1.00 73.00 C ATOM 1101 C TYR A 77 -2.740 -12.141 -7.884 1.00 34.01 C ATOM 1102 O TYR A 77 -3.945 -12.053 -7.640 1.00 0.24 O ATOM 1103 CB TYR A 77 -1.456 -10.139 -8.718 1.00 52.24 C ATOM 1104 CG TYR A 77 -0.939 -9.339 -9.897 1.00 20.25 C ATOM 1105 CD1 TYR A 77 0.308 -9.636 -10.481 1.00 13.31 C ATOM 1106 CD2 TYR A 77 -1.730 -8.311 -10.436 1.00 73.02 C ATOM 1107 CE1 TYR A 77 0.737 -8.955 -11.634 1.00 73.51 C ATOM 1108 CE2 TYR A 77 -1.295 -7.601 -11.564 1.00 60.32 C ATOM 1109 CZ TYR A 77 -0.077 -7.945 -12.188 1.00 64.04 C ATOM 1110 OH TYR A 77 0.294 -7.282 -13.313 1.00 62.51 O ATOM 0 H TYR A 77 -3.778 -10.455 -9.908 1.00 1.14 H new ATOM 0 HA TYR A 77 -1.377 -12.118 -9.533 1.00 73.00 H new ATOM 0 HB2 TYR A 77 -2.166 -9.528 -8.160 1.00 52.24 H new ATOM 0 HB3 TYR A 77 -0.625 -10.356 -8.046 1.00 52.24 H new ATOM 0 HD1 TYR A 77 0.940 -10.393 -10.040 1.00 13.31 H new ATOM 0 HD2 TYR A 77 -2.678 -8.066 -9.979 1.00 73.02 H new ATOM 0 HE1 TYR A 77 1.683 -9.203 -12.092 1.00 73.51 H new ATOM 0 HE2 TYR A 77 -1.892 -6.791 -11.955 1.00 60.32 H new ATOM 0 HH TYR A 77 0.812 -7.881 -13.890 1.00 62.51 H new ATOM 1119 N ASP A 78 -1.881 -12.791 -7.100 1.00 71.41 N ATOM 1120 CA ASP A 78 -2.231 -13.512 -5.870 1.00 31.32 C ATOM 1121 C ASP A 78 -1.502 -12.920 -4.653 1.00 11.34 C ATOM 1122 O ASP A 78 -1.667 -13.402 -3.530 1.00 64.03 O ATOM 1123 CB ASP A 78 -1.845 -14.982 -6.056 1.00 64.34 C ATOM 1124 CG ASP A 78 -2.462 -15.942 -5.037 1.00 73.02 C ATOM 1125 OD1 ASP A 78 -3.703 -16.131 -5.020 1.00 52.41 O ATOM 1126 OD2 ASP A 78 -1.706 -16.680 -4.363 1.00 10.14 O ATOM 0 H ASP A 78 -0.884 -12.833 -7.309 1.00 71.41 H new ATOM 0 HA ASP A 78 -3.301 -13.419 -5.684 1.00 31.32 H new ATOM 0 HB2 ASP A 78 -2.141 -15.297 -7.056 1.00 64.34 H new ATOM 0 HB3 ASP A 78 -0.760 -15.067 -6.004 1.00 64.34 H new ATOM 1130 N LEU A 79 -0.665 -11.896 -4.860 1.00 21.12 N ATOM 1131 CA LEU A 79 0.043 -11.171 -3.812 1.00 32.12 C ATOM 1132 C LEU A 79 0.263 -9.730 -4.277 1.00 60.20 C ATOM 1133 O LEU A 79 0.527 -9.505 -5.460 1.00 63.22 O ATOM 1134 CB LEU A 79 1.362 -11.903 -3.511 1.00 51.52 C ATOM 1135 CG LEU A 79 1.534 -12.169 -2.005 1.00 42.12 C ATOM 1136 CD1 LEU A 79 2.607 -13.240 -1.822 1.00 54.40 C ATOM 1137 CD2 LEU A 79 1.915 -10.904 -1.225 1.00 73.34 C ATOM 0 H LEU A 79 -0.459 -11.542 -5.794 1.00 21.12 H new ATOM 0 HA LEU A 79 -0.533 -11.136 -2.887 1.00 32.12 H new ATOM 0 HB2 LEU A 79 1.385 -12.849 -4.053 1.00 51.52 H new ATOM 0 HB3 LEU A 79 2.200 -11.307 -3.873 1.00 51.52 H new ATOM 0 HG LEU A 79 0.578 -12.506 -1.606 1.00 42.12 H new ATOM 0 HD11 LEU A 79 2.742 -13.442 -0.759 1.00 54.40 H new ATOM 0 HD12 LEU A 79 2.298 -14.155 -2.328 1.00 54.40 H new ATOM 0 HD13 LEU A 79 3.547 -12.889 -2.247 1.00 54.40 H new ATOM 0 HD21 LEU A 79 2.024 -11.147 -0.168 1.00 73.34 H new ATOM 0 HD22 LEU A 79 2.858 -10.512 -1.606 1.00 73.34 H new ATOM 0 HD23 LEU A 79 1.134 -10.153 -1.346 1.00 73.34 H new ATOM 1148 N ILE A 80 0.172 -8.737 -3.386 1.00 3.33 N ATOM 1149 CA ILE A 80 0.397 -7.330 -3.734 1.00 3.15 C ATOM 1150 C ILE A 80 1.292 -6.696 -2.666 1.00 40.20 C ATOM 1151 O ILE A 80 1.161 -6.997 -1.478 1.00 34.04 O ATOM 1152 CB ILE A 80 -0.938 -6.584 -3.993 1.00 15.12 C ATOM 1153 CG1 ILE A 80 -1.734 -7.325 -5.093 1.00 44.41 C ATOM 1154 CG2 ILE A 80 -0.674 -5.118 -4.398 1.00 13.42 C ATOM 1155 CD1 ILE A 80 -2.992 -6.631 -5.618 1.00 23.02 C ATOM 0 H ILE A 80 -0.060 -8.886 -2.404 1.00 3.33 H new ATOM 0 HA ILE A 80 0.928 -7.251 -4.683 1.00 3.15 H new ATOM 0 HB ILE A 80 -1.526 -6.572 -3.075 1.00 15.12 H new ATOM 0 HG12 ILE A 80 -1.066 -7.501 -5.936 1.00 44.41 H new ATOM 0 HG13 ILE A 80 -2.022 -8.302 -4.705 1.00 44.41 H new ATOM 0 HG21 ILE A 80 -1.623 -4.613 -4.575 1.00 13.42 H new ATOM 0 HG22 ILE A 80 -0.137 -4.610 -3.597 1.00 13.42 H new ATOM 0 HG23 ILE A 80 -0.075 -5.094 -5.308 1.00 13.42 H new ATOM 0 HD11 ILE A 80 -3.458 -7.252 -6.383 1.00 23.02 H new ATOM 0 HD12 ILE A 80 -3.693 -6.480 -4.797 1.00 23.02 H new ATOM 0 HD13 ILE A 80 -2.723 -5.666 -6.048 1.00 23.02 H new ATOM 1166 N LEU A 81 2.211 -5.832 -3.101 1.00 71.54 N ATOM 1167 CA LEU A 81 3.254 -5.189 -2.312 1.00 24.34 C ATOM 1168 C LEU A 81 3.178 -3.686 -2.603 1.00 20.41 C ATOM 1169 O LEU A 81 3.024 -3.296 -3.766 1.00 40.31 O ATOM 1170 CB LEU A 81 4.633 -5.746 -2.720 1.00 51.24 C ATOM 1171 CG LEU A 81 4.790 -7.277 -2.700 1.00 24.14 C ATOM 1172 CD1 LEU A 81 6.167 -7.645 -3.254 1.00 1.13 C ATOM 1173 CD2 LEU A 81 4.653 -7.854 -1.290 1.00 73.22 C ATOM 0 H LEU A 81 2.245 -5.546 -4.080 1.00 71.54 H new ATOM 0 HA LEU A 81 3.116 -5.379 -1.248 1.00 24.34 H new ATOM 0 HB2 LEU A 81 4.859 -5.393 -3.726 1.00 51.24 H new ATOM 0 HB3 LEU A 81 5.384 -5.318 -2.056 1.00 51.24 H new ATOM 0 HG LEU A 81 3.994 -7.700 -3.313 1.00 24.14 H new ATOM 0 HD11 LEU A 81 6.286 -8.728 -3.243 1.00 1.13 H new ATOM 0 HD12 LEU A 81 6.257 -7.280 -4.277 1.00 1.13 H new ATOM 0 HD13 LEU A 81 6.941 -7.189 -2.637 1.00 1.13 H new ATOM 0 HD21 LEU A 81 4.771 -8.937 -1.327 1.00 73.22 H new ATOM 0 HD22 LEU A 81 5.422 -7.427 -0.646 1.00 73.22 H new ATOM 0 HD23 LEU A 81 3.668 -7.610 -0.891 1.00 73.22 H new ATOM 1184 N ILE A 82 3.244 -2.830 -1.576 1.00 63.40 N ATOM 1185 CA ILE A 82 2.972 -1.397 -1.722 1.00 40.40 C ATOM 1186 C ILE A 82 3.911 -0.569 -0.834 1.00 41.23 C ATOM 1187 O ILE A 82 4.043 -0.920 0.339 1.00 35.33 O ATOM 1188 CB ILE A 82 1.511 -1.101 -1.304 1.00 33.31 C ATOM 1189 CG1 ILE A 82 0.402 -2.108 -1.714 1.00 40.23 C ATOM 1190 CG2 ILE A 82 1.147 0.268 -1.882 1.00 40.03 C ATOM 1191 CD1 ILE A 82 -0.585 -2.344 -0.567 1.00 35.21 C ATOM 0 H ILE A 82 3.486 -3.110 -0.626 1.00 63.40 H new ATOM 0 HA ILE A 82 3.133 -1.125 -2.765 1.00 40.40 H new ATOM 0 HB ILE A 82 1.521 -1.167 -0.216 1.00 33.31 H new ATOM 0 HG12 ILE A 82 -0.133 -1.729 -2.585 1.00 40.23 H new ATOM 0 HG13 ILE A 82 0.857 -3.055 -2.006 1.00 40.23 H new ATOM 0 HG21 ILE A 82 0.121 0.517 -1.610 1.00 40.03 H new ATOM 0 HG22 ILE A 82 1.822 1.024 -1.481 1.00 40.03 H new ATOM 0 HG23 ILE A 82 1.238 0.240 -2.968 1.00 40.03 H new ATOM 0 HD11 ILE A 82 -1.349 -3.053 -0.885 1.00 35.21 H new ATOM 0 HD12 ILE A 82 -0.052 -2.746 0.295 1.00 35.21 H new ATOM 0 HD13 ILE A 82 -1.057 -1.400 -0.293 1.00 35.21 H new ATOM 1202 N GLY A 83 4.466 0.567 -1.294 1.00 32.11 N ATOM 1203 CA GLY A 83 5.206 1.455 -0.382 1.00 33.54 C ATOM 1204 C GLY A 83 4.759 2.912 -0.316 1.00 24.10 C ATOM 1205 O GLY A 83 3.991 3.381 -1.156 1.00 42.35 O ATOM 0 H GLY A 83 4.419 0.885 -2.262 1.00 32.11 H new ATOM 0 HA2 GLY A 83 5.144 1.036 0.622 1.00 33.54 H new ATOM 0 HA3 GLY A 83 6.257 1.436 -0.670 1.00 33.54 H new ATOM 1209 N SER A 84 5.267 3.645 0.681 1.00 61.53 N ATOM 1210 CA SER A 84 5.054 5.075 0.873 1.00 1.43 C ATOM 1211 C SER A 84 6.112 5.641 1.830 1.00 31.53 C ATOM 1212 O SER A 84 6.476 4.957 2.791 1.00 71.14 O ATOM 1213 CB SER A 84 3.663 5.284 1.498 1.00 15.20 C ATOM 1214 OG SER A 84 3.361 6.647 1.748 1.00 75.33 O ATOM 0 H SER A 84 5.861 3.237 1.403 1.00 61.53 H new ATOM 0 HA SER A 84 5.127 5.584 -0.088 1.00 1.43 H new ATOM 0 HB2 SER A 84 2.907 4.867 0.833 1.00 15.20 H new ATOM 0 HB3 SER A 84 3.605 4.728 2.434 1.00 15.20 H new ATOM 0 HG SER A 84 3.895 6.967 2.505 1.00 75.33 H new ATOM 1219 N PRO A 85 6.522 6.915 1.664 1.00 60.12 N ATOM 1220 CA PRO A 85 7.337 7.609 2.653 1.00 12.42 C ATOM 1221 C PRO A 85 6.565 7.863 3.951 1.00 31.12 C ATOM 1222 O PRO A 85 5.327 7.852 3.962 1.00 15.23 O ATOM 1223 CB PRO A 85 7.761 8.921 1.985 1.00 4.43 C ATOM 1224 CG PRO A 85 6.622 9.197 1.008 1.00 75.15 C ATOM 1225 CD PRO A 85 6.216 7.801 0.548 1.00 64.11 C ATOM 0 HA PRO A 85 8.200 7.010 2.946 1.00 12.42 H new ATOM 0 HB2 PRO A 85 7.872 9.726 2.712 1.00 4.43 H new ATOM 0 HB3 PRO A 85 8.717 8.821 1.471 1.00 4.43 H new ATOM 0 HG2 PRO A 85 5.795 9.719 1.490 1.00 75.15 H new ATOM 0 HG3 PRO A 85 6.948 9.818 0.173 1.00 75.15 H new ATOM 0 HD2 PRO A 85 5.156 7.764 0.298 1.00 64.11 H new ATOM 0 HD3 PRO A 85 6.765 7.508 -0.347 1.00 64.11 H new ATOM 1230 N VAL A 86 7.301 8.142 5.036 1.00 53.42 N ATOM 1231 CA VAL A 86 6.754 8.350 6.371 1.00 72.24 C ATOM 1232 C VAL A 86 7.736 9.100 7.281 1.00 2.43 C ATOM 1233 O VAL A 86 8.883 8.695 7.457 1.00 71.31 O ATOM 1234 CB VAL A 86 6.311 7.001 6.961 1.00 43.31 C ATOM 1235 CG1 VAL A 86 7.382 5.922 7.123 1.00 60.54 C ATOM 1236 CG2 VAL A 86 5.600 7.246 8.299 1.00 3.30 C ATOM 0 H VAL A 86 8.317 8.230 5.002 1.00 53.42 H new ATOM 0 HA VAL A 86 5.876 8.992 6.298 1.00 72.24 H new ATOM 0 HB VAL A 86 5.645 6.581 6.208 1.00 43.31 H new ATOM 0 HG11 VAL A 86 6.933 5.025 7.549 1.00 60.54 H new ATOM 0 HG12 VAL A 86 7.811 5.686 6.149 1.00 60.54 H new ATOM 0 HG13 VAL A 86 8.167 6.285 7.787 1.00 60.54 H new ATOM 0 HG21 VAL A 86 5.283 6.293 8.723 1.00 3.30 H new ATOM 0 HG22 VAL A 86 6.284 7.741 8.989 1.00 3.30 H new ATOM 0 HG23 VAL A 86 4.727 7.879 8.137 1.00 3.30 H new ATOM 1246 N TRP A 87 7.273 10.193 7.884 1.00 61.12 N ATOM 1247 CA TRP A 87 8.112 11.092 8.684 1.00 4.12 C ATOM 1248 C TRP A 87 7.387 11.745 9.862 1.00 3.03 C ATOM 1249 O TRP A 87 8.041 12.302 10.745 1.00 11.32 O ATOM 1250 CB TRP A 87 8.745 12.128 7.735 1.00 24.43 C ATOM 1251 CG TRP A 87 9.877 12.946 8.279 1.00 41.03 C ATOM 1252 CD1 TRP A 87 10.987 12.453 8.875 1.00 33.42 C ATOM 1253 CD2 TRP A 87 10.048 14.398 8.256 1.00 54.44 C ATOM 1254 NE1 TRP A 87 11.810 13.493 9.248 1.00 35.50 N ATOM 1255 CE2 TRP A 87 11.280 14.715 8.899 1.00 61.55 C ATOM 1256 CE3 TRP A 87 9.294 15.484 7.754 1.00 64.31 C ATOM 1257 CZ2 TRP A 87 11.716 16.033 9.088 1.00 62.41 C ATOM 1258 CZ3 TRP A 87 9.728 16.814 7.926 1.00 60.53 C ATOM 1259 CH2 TRP A 87 10.929 17.087 8.604 1.00 35.53 C ATOM 0 H TRP A 87 6.297 10.485 7.833 1.00 61.12 H new ATOM 0 HA TRP A 87 8.889 10.497 9.163 1.00 4.12 H new ATOM 0 HB2 TRP A 87 9.102 11.603 6.849 1.00 24.43 H new ATOM 0 HB3 TRP A 87 7.961 12.810 7.407 1.00 24.43 H new ATOM 0 HD1 TRP A 87 11.196 11.405 9.034 1.00 33.42 H new ATOM 0 HE1 TRP A 87 12.704 13.372 9.725 1.00 35.50 H new ATOM 0 HE3 TRP A 87 8.370 15.291 7.230 1.00 64.31 H new ATOM 0 HZ2 TRP A 87 12.646 16.234 9.600 1.00 62.41 H new ATOM 0 HZ3 TRP A 87 9.135 17.627 7.535 1.00 60.53 H new ATOM 0 HH2 TRP A 87 11.245 18.109 8.752 1.00 35.53 H new ATOM 1269 N SER A 88 6.060 11.620 9.930 1.00 54.41 N ATOM 1270 CA SER A 88 5.246 12.094 11.041 1.00 40.25 C ATOM 1271 C SER A 88 4.105 11.110 11.330 1.00 42.25 C ATOM 1272 O SER A 88 2.947 11.504 11.484 1.00 64.25 O ATOM 1273 CB SER A 88 4.698 13.492 10.724 1.00 21.31 C ATOM 1274 OG SER A 88 5.713 14.410 10.378 1.00 3.40 O ATOM 0 H SER A 88 5.512 11.175 9.194 1.00 54.41 H new ATOM 0 HA SER A 88 5.866 12.158 11.935 1.00 40.25 H new ATOM 0 HB2 SER A 88 3.984 13.420 9.904 1.00 21.31 H new ATOM 0 HB3 SER A 88 4.153 13.869 11.589 1.00 21.31 H new ATOM 0 HG SER A 88 5.312 15.283 10.184 1.00 3.40 H new ATOM 1279 N GLY A 89 4.393 9.808 11.320 1.00 21.34 N ATOM 1280 CA GLY A 89 3.410 8.743 11.472 1.00 25.14 C ATOM 1281 C GLY A 89 2.682 8.481 10.157 1.00 3.41 C ATOM 1282 O GLY A 89 2.684 7.350 9.683 1.00 63.32 O ATOM 0 H GLY A 89 5.344 9.459 11.202 1.00 21.34 H new ATOM 0 HA2 GLY A 89 3.905 7.831 11.806 1.00 25.14 H new ATOM 0 HA3 GLY A 89 2.689 9.015 12.243 1.00 25.14 H new ATOM 1286 N TYR A 90 2.103 9.525 9.565 1.00 75.42 N ATOM 1287 CA TYR A 90 1.311 9.502 8.343 1.00 73.22 C ATOM 1288 C TYR A 90 1.376 10.875 7.644 1.00 74.54 C ATOM 1289 O TYR A 90 0.383 11.593 7.643 1.00 31.40 O ATOM 1290 CB TYR A 90 -0.141 9.081 8.688 1.00 61.45 C ATOM 1291 CG TYR A 90 -0.768 9.604 9.989 1.00 62.11 C ATOM 1292 CD1 TYR A 90 -0.391 10.835 10.572 1.00 32.30 C ATOM 1293 CD2 TYR A 90 -1.710 8.800 10.664 1.00 42.43 C ATOM 1294 CE1 TYR A 90 -0.872 11.211 11.837 1.00 74.03 C ATOM 1295 CE2 TYR A 90 -2.191 9.172 11.930 1.00 52.51 C ATOM 1296 CZ TYR A 90 -1.750 10.364 12.540 1.00 4.44 C ATOM 1297 OH TYR A 90 -2.160 10.705 13.791 1.00 72.22 O ATOM 0 H TYR A 90 2.181 10.465 9.952 1.00 75.42 H new ATOM 0 HA TYR A 90 1.715 8.771 7.642 1.00 73.22 H new ATOM 0 HB2 TYR A 90 -0.781 9.393 7.863 1.00 61.45 H new ATOM 0 HB3 TYR A 90 -0.171 7.992 8.720 1.00 61.45 H new ATOM 0 HD1 TYR A 90 0.276 11.495 10.038 1.00 32.30 H new ATOM 0 HD2 TYR A 90 -2.065 7.890 10.203 1.00 42.43 H new ATOM 0 HE1 TYR A 90 -0.568 12.152 12.271 1.00 74.03 H new ATOM 0 HE2 TYR A 90 -2.904 8.541 12.440 1.00 52.51 H new ATOM 0 HH TYR A 90 -2.764 10.015 14.137 1.00 72.22 H new ATOM 1306 N PRO A 91 2.515 11.324 7.086 1.00 55.15 N ATOM 1307 CA PRO A 91 2.553 12.555 6.298 1.00 3.43 C ATOM 1308 C PRO A 91 1.806 12.435 4.959 1.00 62.31 C ATOM 1309 O PRO A 91 1.481 13.469 4.369 1.00 20.41 O ATOM 1310 CB PRO A 91 4.040 12.832 6.059 1.00 13.00 C ATOM 1311 CG PRO A 91 4.647 11.436 6.071 1.00 33.10 C ATOM 1312 CD PRO A 91 3.845 10.757 7.185 1.00 34.12 C ATOM 0 HA PRO A 91 2.051 13.363 6.831 1.00 3.43 H new ATOM 0 HB2 PRO A 91 4.210 13.339 5.109 1.00 13.00 H new ATOM 0 HB3 PRO A 91 4.464 13.465 6.839 1.00 13.00 H new ATOM 0 HG2 PRO A 91 4.527 10.929 5.113 1.00 33.10 H new ATOM 0 HG3 PRO A 91 5.715 11.456 6.289 1.00 33.10 H new ATOM 0 HD2 PRO A 91 3.824 9.675 7.054 1.00 34.12 H new ATOM 0 HD3 PRO A 91 4.285 10.951 8.163 1.00 34.12 H new ATOM 1317 N ALA A 92 1.562 11.212 4.472 1.00 4.01 N ATOM 1318 CA ALA A 92 1.002 10.937 3.160 1.00 61.53 C ATOM 1319 C ALA A 92 -0.328 10.186 3.308 1.00 72.24 C ATOM 1320 O ALA A 92 -0.574 9.560 4.345 1.00 4.31 O ATOM 1321 CB ALA A 92 2.035 10.131 2.354 1.00 22.43 C ATOM 0 H ALA A 92 1.758 10.365 5.005 1.00 4.01 H new ATOM 0 HA ALA A 92 0.788 11.863 2.626 1.00 61.53 H new ATOM 0 HB1 ALA A 92 1.634 9.913 1.364 1.00 22.43 H new ATOM 0 HB2 ALA A 92 2.952 10.711 2.255 1.00 22.43 H new ATOM 0 HB3 ALA A 92 2.251 9.196 2.871 1.00 22.43 H new ATOM 1327 N THR A 93 -1.149 10.137 2.255 1.00 24.41 N ATOM 1328 CA THR A 93 -2.281 9.208 2.180 1.00 2.31 C ATOM 1329 C THR A 93 -2.379 8.498 0.806 1.00 15.23 C ATOM 1330 O THR A 93 -3.473 8.369 0.253 1.00 21.30 O ATOM 1331 CB THR A 93 -3.584 9.982 2.510 1.00 64.23 C ATOM 1332 OG1 THR A 93 -3.764 11.106 1.664 1.00 23.43 O ATOM 1333 CG2 THR A 93 -3.637 10.583 3.921 1.00 63.22 C ATOM 0 H THR A 93 -1.049 10.736 1.435 1.00 24.41 H new ATOM 0 HA THR A 93 -2.127 8.415 2.912 1.00 2.31 H new ATOM 0 HB THR A 93 -4.346 9.213 2.386 1.00 64.23 H new ATOM 0 HG1 THR A 93 -4.596 11.565 1.903 1.00 23.43 H new ATOM 0 HG21 THR A 93 -4.584 11.104 4.059 1.00 63.22 H new ATOM 0 HG22 THR A 93 -3.550 9.786 4.659 1.00 63.22 H new ATOM 0 HG23 THR A 93 -2.814 11.286 4.048 1.00 63.22 H new ATOM 1341 N PRO A 94 -1.306 7.864 0.292 1.00 71.23 N ATOM 1342 CA PRO A 94 -1.369 7.070 -0.927 1.00 0.01 C ATOM 1343 C PRO A 94 -1.777 5.627 -0.664 1.00 23.20 C ATOM 1344 O PRO A 94 -1.933 4.859 -1.613 1.00 35.01 O ATOM 1345 CB PRO A 94 0.041 7.132 -1.510 1.00 32.40 C ATOM 1346 CG PRO A 94 0.924 7.213 -0.271 1.00 2.11 C ATOM 1347 CD PRO A 94 0.085 8.086 0.641 1.00 51.12 C ATOM 0 HA PRO A 94 -2.125 7.462 -1.607 1.00 0.01 H new ATOM 0 HB2 PRO A 94 0.268 6.251 -2.110 1.00 32.40 H new ATOM 0 HB3 PRO A 94 0.172 8.000 -2.156 1.00 32.40 H new ATOM 0 HG2 PRO A 94 1.114 6.231 0.162 1.00 2.11 H new ATOM 0 HG3 PRO A 94 1.895 7.659 -0.487 1.00 2.11 H new ATOM 0 HD2 PRO A 94 0.264 7.833 1.686 1.00 51.12 H new ATOM 0 HD3 PRO A 94 0.349 9.136 0.517 1.00 51.12 H new ATOM 1352 N ILE A 95 -2.001 5.228 0.585 1.00 21.42 N ATOM 1353 CA ILE A 95 -2.471 3.897 0.943 1.00 21.30 C ATOM 1354 C ILE A 95 -3.747 4.138 1.770 1.00 11.52 C ATOM 1355 O ILE A 95 -3.768 4.021 2.994 1.00 25.13 O ATOM 1356 CB ILE A 95 -1.363 3.099 1.686 1.00 21.01 C ATOM 1357 CG1 ILE A 95 0.110 3.517 1.423 1.00 11.23 C ATOM 1358 CG2 ILE A 95 -1.494 1.588 1.431 1.00 51.43 C ATOM 1359 CD1 ILE A 95 0.655 3.244 0.012 1.00 4.04 C ATOM 0 H ILE A 95 -1.857 5.835 1.392 1.00 21.42 H new ATOM 0 HA ILE A 95 -2.703 3.272 0.080 1.00 21.30 H new ATOM 0 HB ILE A 95 -1.555 3.355 2.728 1.00 21.01 H new ATOM 0 HG12 ILE A 95 0.204 4.584 1.625 1.00 11.23 H new ATOM 0 HG13 ILE A 95 0.746 2.999 2.141 1.00 11.23 H new ATOM 0 HG21 ILE A 95 -0.704 1.059 1.965 1.00 51.43 H new ATOM 0 HG22 ILE A 95 -2.465 1.242 1.785 1.00 51.43 H new ATOM 0 HG23 ILE A 95 -1.405 1.390 0.363 1.00 51.43 H new ATOM 0 HD11 ILE A 95 1.691 3.578 -0.049 1.00 4.04 H new ATOM 0 HD12 ILE A 95 0.606 2.175 -0.197 1.00 4.04 H new ATOM 0 HD13 ILE A 95 0.056 3.785 -0.720 1.00 4.04 H new ATOM 1370 N LYS A 96 -4.781 4.635 1.096 1.00 42.13 N ATOM 1371 CA LYS A 96 -6.179 4.618 1.532 1.00 41.11 C ATOM 1372 C LYS A 96 -7.104 4.359 0.346 1.00 50.20 C ATOM 1373 O LYS A 96 -7.900 3.420 0.385 1.00 34.43 O ATOM 1374 CB LYS A 96 -6.523 5.920 2.281 1.00 63.42 C ATOM 1375 CG LYS A 96 -7.985 6.007 2.769 1.00 2.40 C ATOM 1376 CD LYS A 96 -8.407 4.889 3.733 1.00 13.54 C ATOM 1377 CE LYS A 96 -7.705 4.947 5.096 1.00 4.23 C ATOM 1378 NZ LYS A 96 -8.514 5.583 6.157 1.00 50.25 N ATOM 0 H LYS A 96 -4.664 5.083 0.187 1.00 42.13 H new ATOM 0 HA LYS A 96 -6.329 3.798 2.235 1.00 41.11 H new ATOM 0 HB2 LYS A 96 -5.859 6.017 3.140 1.00 63.42 H new ATOM 0 HB3 LYS A 96 -6.321 6.767 1.625 1.00 63.42 H new ATOM 0 HG2 LYS A 96 -8.133 6.968 3.262 1.00 2.40 H new ATOM 0 HG3 LYS A 96 -8.645 5.989 1.902 1.00 2.40 H new ATOM 0 HD2 LYS A 96 -9.485 4.943 3.888 1.00 13.54 H new ATOM 0 HD3 LYS A 96 -8.200 3.925 3.269 1.00 13.54 H new ATOM 0 HE2 LYS A 96 -7.449 3.934 5.406 1.00 4.23 H new ATOM 0 HE3 LYS A 96 -6.768 5.494 4.989 1.00 4.23 H new ATOM 0 HZ1 LYS A 96 -7.984 5.572 7.052 1.00 50.25 H new ATOM 0 HZ2 LYS A 96 -8.724 6.566 5.891 1.00 50.25 H new ATOM 0 HZ3 LYS A 96 -9.405 5.059 6.276 1.00 50.25 H new ATOM 1388 N THR A 97 -7.010 5.169 -0.704 1.00 62.44 N ATOM 1389 CA THR A 97 -7.886 5.061 -1.865 1.00 25.35 C ATOM 1390 C THR A 97 -7.677 3.721 -2.592 1.00 12.41 C ATOM 1391 O THR A 97 -8.634 3.089 -3.026 1.00 64.14 O ATOM 1392 CB THR A 97 -7.637 6.274 -2.780 1.00 21.31 C ATOM 1393 OG1 THR A 97 -7.399 7.436 -1.987 1.00 63.00 O ATOM 1394 CG2 THR A 97 -8.806 6.482 -3.742 1.00 2.54 C ATOM 0 H THR A 97 -6.323 5.920 -0.774 1.00 62.44 H new ATOM 0 HA THR A 97 -8.930 5.071 -1.551 1.00 25.35 H new ATOM 0 HB THR A 97 -6.751 6.084 -3.387 1.00 21.31 H new ATOM 0 HG1 THR A 97 -6.682 7.968 -2.392 1.00 63.00 H new ATOM 0 HG21 THR A 97 -8.605 7.345 -4.377 1.00 2.54 H new ATOM 0 HG22 THR A 97 -8.928 5.595 -4.363 1.00 2.54 H new ATOM 0 HG23 THR A 97 -9.719 6.655 -3.173 1.00 2.54 H new ATOM 1402 N LEU A 98 -6.433 3.244 -2.700 1.00 25.42 N ATOM 1403 CA LEU A 98 -6.113 1.997 -3.403 1.00 12.55 C ATOM 1404 C LEU A 98 -6.831 0.810 -2.755 1.00 25.04 C ATOM 1405 O LEU A 98 -7.470 0.011 -3.429 1.00 14.45 O ATOM 1406 CB LEU A 98 -4.586 1.803 -3.406 1.00 43.33 C ATOM 1407 CG LEU A 98 -4.037 0.867 -4.515 1.00 75.03 C ATOM 1408 CD1 LEU A 98 -4.795 -0.434 -4.770 1.00 12.43 C ATOM 1409 CD2 LEU A 98 -3.898 1.629 -5.824 1.00 31.34 C ATOM 0 H LEU A 98 -5.619 3.712 -2.302 1.00 25.42 H new ATOM 0 HA LEU A 98 -6.462 2.056 -4.434 1.00 12.55 H new ATOM 0 HB2 LEU A 98 -4.113 2.779 -3.511 1.00 43.33 H new ATOM 0 HB3 LEU A 98 -4.285 1.405 -2.437 1.00 43.33 H new ATOM 0 HG LEU A 98 -3.074 0.547 -4.118 1.00 75.03 H new ATOM 0 HD11 LEU A 98 -4.304 -0.991 -5.568 1.00 12.43 H new ATOM 0 HD12 LEU A 98 -4.803 -1.035 -3.861 1.00 12.43 H new ATOM 0 HD13 LEU A 98 -5.820 -0.206 -5.063 1.00 12.43 H new ATOM 0 HD21 LEU A 98 -3.512 0.961 -6.594 1.00 31.34 H new ATOM 0 HD22 LEU A 98 -4.873 2.009 -6.129 1.00 31.34 H new ATOM 0 HD23 LEU A 98 -3.209 2.463 -5.688 1.00 31.34 H new ATOM 1420 N LEU A 99 -6.776 0.707 -1.429 1.00 34.32 N ATOM 1421 CA LEU A 99 -7.438 -0.358 -0.678 1.00 45.51 C ATOM 1422 C LEU A 99 -8.926 -0.475 -1.029 1.00 71.01 C ATOM 1423 O LEU A 99 -9.475 -1.574 -1.034 1.00 70.41 O ATOM 1424 CB LEU A 99 -7.295 -0.093 0.819 1.00 41.40 C ATOM 1425 CG LEU A 99 -5.885 -0.276 1.415 1.00 50.31 C ATOM 1426 CD1 LEU A 99 -4.889 -1.148 0.647 1.00 25.45 C ATOM 1427 CD2 LEU A 99 -5.243 1.070 1.741 1.00 63.34 C ATOM 0 H LEU A 99 -6.266 1.366 -0.840 1.00 34.32 H new ATOM 0 HA LEU A 99 -6.956 -1.297 -0.948 1.00 45.51 H new ATOM 0 HB2 LEU A 99 -7.620 0.928 1.018 1.00 41.40 H new ATOM 0 HB3 LEU A 99 -7.979 -0.755 1.350 1.00 41.40 H new ATOM 0 HG LEU A 99 -6.094 -0.851 2.317 1.00 50.31 H new ATOM 0 HD11 LEU A 99 -3.943 -1.183 1.188 1.00 25.45 H new ATOM 0 HD12 LEU A 99 -5.289 -2.157 0.550 1.00 25.45 H new ATOM 0 HD13 LEU A 99 -4.725 -0.726 -0.344 1.00 25.45 H new ATOM 0 HD21 LEU A 99 -4.250 0.908 2.160 1.00 63.34 H new ATOM 0 HD22 LEU A 99 -5.160 1.664 0.831 1.00 63.34 H new ATOM 0 HD23 LEU A 99 -5.860 1.601 2.466 1.00 63.34 H new ATOM 1438 N ASP A 100 -9.595 0.640 -1.312 1.00 25.22 N ATOM 1439 CA ASP A 100 -11.007 0.671 -1.705 1.00 62.40 C ATOM 1440 C ASP A 100 -11.248 0.098 -3.104 1.00 23.24 C ATOM 1441 O ASP A 100 -12.320 -0.429 -3.396 1.00 4.55 O ATOM 1442 CB ASP A 100 -11.458 2.121 -1.649 1.00 72.12 C ATOM 1443 CG ASP A 100 -12.947 2.315 -1.900 1.00 30.05 C ATOM 1444 OD1 ASP A 100 -13.738 2.136 -0.945 1.00 22.01 O ATOM 1445 OD2 ASP A 100 -13.296 2.849 -2.981 1.00 62.41 O ATOM 0 H ASP A 100 -9.166 1.565 -1.275 1.00 25.22 H new ATOM 0 HA ASP A 100 -11.579 0.043 -1.021 1.00 62.40 H new ATOM 0 HB2 ASP A 100 -11.208 2.531 -0.671 1.00 72.12 H new ATOM 0 HB3 ASP A 100 -10.898 2.694 -2.388 1.00 72.12 H new ATOM 1449 N GLN A 101 -10.241 0.146 -3.972 1.00 64.11 N ATOM 1450 CA GLN A 101 -10.281 -0.476 -5.289 1.00 14.52 C ATOM 1451 C GLN A 101 -10.151 -1.998 -5.166 1.00 23.35 C ATOM 1452 O GLN A 101 -10.645 -2.731 -6.016 1.00 5.14 O ATOM 1453 CB GLN A 101 -9.144 0.072 -6.169 1.00 2.31 C ATOM 1454 CG GLN A 101 -9.118 1.597 -6.355 1.00 23.11 C ATOM 1455 CD GLN A 101 -8.005 2.045 -7.300 1.00 20.32 C ATOM 1456 OE1 GLN A 101 -7.046 1.321 -7.546 1.00 2.34 O ATOM 1457 NE2 GLN A 101 -8.096 3.247 -7.850 1.00 75.31 N ATOM 0 H GLN A 101 -9.362 0.625 -3.776 1.00 64.11 H new ATOM 0 HA GLN A 101 -11.239 -0.240 -5.753 1.00 14.52 H new ATOM 0 HB2 GLN A 101 -8.193 -0.239 -5.736 1.00 2.31 H new ATOM 0 HB3 GLN A 101 -9.214 -0.394 -7.152 1.00 2.31 H new ATOM 0 HG2 GLN A 101 -10.080 1.930 -6.746 1.00 23.11 H new ATOM 0 HG3 GLN A 101 -8.984 2.077 -5.386 1.00 23.11 H new ATOM 0 HE21 GLN A 101 -8.896 3.844 -7.641 1.00 75.31 H new ATOM 0 HE22 GLN A 101 -7.366 3.575 -8.482 1.00 75.31 H new ATOM 1464 N MET A 102 -9.503 -2.512 -4.112 1.00 42.40 N ATOM 1465 CA MET A 102 -9.200 -3.939 -3.929 1.00 50.32 C ATOM 1466 C MET A 102 -10.411 -4.762 -3.442 1.00 33.15 C ATOM 1467 O MET A 102 -10.242 -5.876 -2.945 1.00 51.21 O ATOM 1468 CB MET A 102 -7.997 -4.093 -2.978 1.00 3.14 C ATOM 1469 CG MET A 102 -6.709 -3.512 -3.572 1.00 74.03 C ATOM 1470 SD MET A 102 -5.242 -3.609 -2.506 1.00 34.43 S ATOM 1471 CE MET A 102 -5.005 -5.402 -2.407 1.00 54.10 C ATOM 0 H MET A 102 -9.166 -1.933 -3.343 1.00 42.40 H new ATOM 0 HA MET A 102 -8.945 -4.347 -4.907 1.00 50.32 H new ATOM 0 HB2 MET A 102 -8.217 -3.594 -2.034 1.00 3.14 H new ATOM 0 HB3 MET A 102 -7.847 -5.149 -2.753 1.00 3.14 H new ATOM 0 HG2 MET A 102 -6.493 -4.032 -4.505 1.00 74.03 H new ATOM 0 HG3 MET A 102 -6.885 -2.466 -3.823 1.00 74.03 H new ATOM 0 HE1 MET A 102 -3.942 -5.624 -2.315 1.00 54.10 H new ATOM 0 HE2 MET A 102 -5.534 -5.791 -1.537 1.00 54.10 H new ATOM 0 HE3 MET A 102 -5.397 -5.871 -3.309 1.00 54.10 H new ATOM 1479 N LYS A 103 -11.644 -4.257 -3.556 1.00 71.11 N ATOM 1480 CA LYS A 103 -12.832 -4.923 -3.006 1.00 14.25 C ATOM 1481 C LYS A 103 -13.163 -6.271 -3.643 1.00 70.21 C ATOM 1482 O LYS A 103 -14.005 -6.983 -3.092 1.00 2.25 O ATOM 1483 CB LYS A 103 -14.051 -3.993 -3.120 1.00 61.12 C ATOM 1484 CG LYS A 103 -14.002 -2.876 -2.077 1.00 4.15 C ATOM 1485 CD LYS A 103 -14.359 -3.385 -0.676 1.00 12.11 C ATOM 1486 CE LYS A 103 -14.142 -2.244 0.314 1.00 10.41 C ATOM 1487 NZ LYS A 103 -14.351 -2.684 1.704 1.00 5.41 N ATOM 0 H LYS A 103 -11.847 -3.377 -4.031 1.00 71.11 H new ATOM 0 HA LYS A 103 -12.590 -5.134 -1.964 1.00 14.25 H new ATOM 0 HB2 LYS A 103 -14.086 -3.558 -4.119 1.00 61.12 H new ATOM 0 HB3 LYS A 103 -14.965 -4.572 -2.992 1.00 61.12 H new ATOM 0 HG2 LYS A 103 -13.004 -2.438 -2.061 1.00 4.15 H new ATOM 0 HG3 LYS A 103 -14.693 -2.083 -2.362 1.00 4.15 H new ATOM 0 HD2 LYS A 103 -15.395 -3.722 -0.646 1.00 12.11 H new ATOM 0 HD3 LYS A 103 -13.737 -4.241 -0.412 1.00 12.11 H new ATOM 0 HE2 LYS A 103 -13.130 -1.854 0.204 1.00 10.41 H new ATOM 0 HE3 LYS A 103 -14.826 -1.427 0.084 1.00 10.41 H new ATOM 0 HZ1 LYS A 103 -14.195 -1.883 2.349 1.00 5.41 H new ATOM 0 HZ2 LYS A 103 -15.324 -3.033 1.815 1.00 5.41 H new ATOM 0 HZ3 LYS A 103 -13.681 -3.447 1.931 1.00 5.41 H new ATOM 1497 N ASN A 104 -12.547 -6.648 -4.762 1.00 45.54 N ATOM 1498 CA ASN A 104 -12.717 -7.962 -5.375 1.00 63.42 C ATOM 1499 C ASN A 104 -11.395 -8.724 -5.410 1.00 22.43 C ATOM 1500 O ASN A 104 -11.296 -9.734 -6.097 1.00 42.44 O ATOM 1501 CB ASN A 104 -13.382 -7.831 -6.754 1.00 65.00 C ATOM 1502 CG ASN A 104 -14.809 -7.320 -6.617 1.00 63.02 C ATOM 1503 OD1 ASN A 104 -15.686 -8.026 -6.124 1.00 21.34 O ATOM 1504 ND2 ASN A 104 -15.079 -6.081 -6.981 1.00 12.33 N ATOM 0 H ASN A 104 -11.908 -6.041 -5.274 1.00 45.54 H new ATOM 0 HA ASN A 104 -13.392 -8.558 -4.761 1.00 63.42 H new ATOM 0 HB2 ASN A 104 -12.805 -7.149 -7.378 1.00 65.00 H new ATOM 0 HB3 ASN A 104 -13.384 -8.799 -7.256 1.00 65.00 H new ATOM 0 HD21 ASN A 104 -16.019 -5.705 -6.854 1.00 12.33 H new ATOM 0 HD22 ASN A 104 -14.348 -5.499 -7.390 1.00 12.33 H new ATOM 1510 N TYR A 105 -10.363 -8.251 -4.706 1.00 52.51 N ATOM 1511 CA TYR A 105 -9.068 -8.909 -4.664 1.00 54.34 C ATOM 1512 C TYR A 105 -9.139 -10.180 -3.816 1.00 5.22 C ATOM 1513 O TYR A 105 -9.848 -10.217 -2.807 1.00 33.34 O ATOM 1514 CB TYR A 105 -8.045 -7.931 -4.077 1.00 14.34 C ATOM 1515 CG TYR A 105 -6.670 -8.526 -3.902 1.00 31.05 C ATOM 1516 CD1 TYR A 105 -5.913 -8.904 -5.026 1.00 22.42 C ATOM 1517 CD2 TYR A 105 -6.190 -8.781 -2.605 1.00 33.11 C ATOM 1518 CE1 TYR A 105 -4.663 -9.519 -4.851 1.00 22.32 C ATOM 1519 CE2 TYR A 105 -4.938 -9.381 -2.424 1.00 72.23 C ATOM 1520 CZ TYR A 105 -4.164 -9.732 -3.549 1.00 65.11 C ATOM 1521 OH TYR A 105 -2.932 -10.267 -3.379 1.00 64.30 O ATOM 0 H TYR A 105 -10.409 -7.397 -4.149 1.00 52.51 H new ATOM 0 HA TYR A 105 -8.769 -9.197 -5.672 1.00 54.34 H new ATOM 0 HB2 TYR A 105 -7.974 -7.059 -4.727 1.00 14.34 H new ATOM 0 HB3 TYR A 105 -8.405 -7.579 -3.110 1.00 14.34 H new ATOM 0 HD1 TYR A 105 -6.292 -8.722 -6.021 1.00 22.42 H new ATOM 0 HD2 TYR A 105 -6.788 -8.513 -1.747 1.00 33.11 H new ATOM 0 HE1 TYR A 105 -4.086 -9.828 -5.710 1.00 22.32 H new ATOM 0 HE2 TYR A 105 -4.567 -9.574 -1.428 1.00 72.23 H new ATOM 0 HH TYR A 105 -2.475 -9.809 -2.642 1.00 64.30 H new ATOM 1530 N ARG A 106 -8.337 -11.179 -4.195 1.00 30.34 N ATOM 1531 CA ARG A 106 -8.117 -12.452 -3.516 1.00 11.12 C ATOM 1532 C ARG A 106 -6.611 -12.703 -3.533 1.00 52.52 C ATOM 1533 O ARG A 106 -6.037 -12.750 -4.622 1.00 32.32 O ATOM 1534 CB ARG A 106 -8.831 -13.575 -4.283 1.00 54.21 C ATOM 1535 CG ARG A 106 -10.359 -13.537 -4.117 1.00 3.32 C ATOM 1536 CD ARG A 106 -10.864 -14.708 -3.267 1.00 43.31 C ATOM 1537 NE ARG A 106 -10.692 -15.998 -3.963 1.00 22.15 N ATOM 1538 CZ ARG A 106 -11.282 -17.164 -3.670 1.00 61.30 C ATOM 1539 NH1 ARG A 106 -12.073 -17.290 -2.609 1.00 14.52 N ATOM 1540 NH2 ARG A 106 -11.084 -18.220 -4.456 1.00 31.02 N ATOM 0 H ARG A 106 -7.784 -11.110 -5.050 1.00 30.34 H new ATOM 0 HA ARG A 106 -8.504 -12.428 -2.497 1.00 11.12 H new ATOM 0 HB2 ARG A 106 -8.584 -13.499 -5.342 1.00 54.21 H new ATOM 0 HB3 ARG A 106 -8.457 -14.539 -3.937 1.00 54.21 H new ATOM 0 HG2 ARG A 106 -10.652 -12.596 -3.651 1.00 3.32 H new ATOM 0 HG3 ARG A 106 -10.833 -13.568 -5.098 1.00 3.32 H new ATOM 0 HD2 ARG A 106 -10.325 -14.730 -2.320 1.00 43.31 H new ATOM 0 HD3 ARG A 106 -11.918 -14.559 -3.031 1.00 43.31 H new ATOM 0 HE ARG A 106 -10.051 -16.002 -4.757 1.00 22.15 H new ATOM 0 HH11 ARG A 106 -12.240 -16.489 -2.000 1.00 14.52 H new ATOM 0 HH12 ARG A 106 -12.512 -18.187 -2.404 1.00 14.52 H new ATOM 0 HH21 ARG A 106 -10.485 -18.139 -5.278 1.00 31.02 H new ATOM 0 HH22 ARG A 106 -11.531 -19.110 -4.237 1.00 31.02 H new ATOM 1551 N GLY A 107 -5.955 -12.866 -2.389 1.00 10.14 N ATOM 1552 CA GLY A 107 -4.523 -13.154 -2.348 1.00 61.33 C ATOM 1553 C GLY A 107 -3.989 -12.833 -0.965 1.00 23.22 C ATOM 1554 O GLY A 107 -4.656 -13.194 0.009 1.00 65.34 O ATOM 0 H GLY A 107 -6.395 -12.803 -1.471 1.00 10.14 H new ATOM 0 HA2 GLY A 107 -4.344 -14.203 -2.586 1.00 61.33 H new ATOM 0 HA3 GLY A 107 -3.999 -12.563 -3.099 1.00 61.33 H new ATOM 1558 N GLU A 108 -2.866 -12.114 -0.864 1.00 54.30 N ATOM 1559 CA GLU A 108 -2.386 -11.498 0.378 1.00 43.12 C ATOM 1560 C GLU A 108 -1.787 -10.127 0.044 1.00 10.51 C ATOM 1561 O GLU A 108 -1.592 -9.804 -1.135 1.00 52.21 O ATOM 1562 CB GLU A 108 -1.342 -12.371 1.107 1.00 62.01 C ATOM 1563 CG GLU A 108 -1.852 -13.768 1.486 1.00 13.11 C ATOM 1564 CD GLU A 108 -1.126 -14.372 2.687 1.00 64.13 C ATOM 1565 OE1 GLU A 108 0.121 -14.417 2.687 1.00 22.12 O ATOM 1566 OE2 GLU A 108 -1.835 -14.741 3.658 1.00 64.33 O ATOM 0 H GLU A 108 -2.252 -11.940 -1.660 1.00 54.30 H new ATOM 0 HA GLU A 108 -3.233 -11.394 1.056 1.00 43.12 H new ATOM 0 HB2 GLU A 108 -0.463 -12.476 0.470 1.00 62.01 H new ATOM 0 HB3 GLU A 108 -1.020 -11.855 2.012 1.00 62.01 H new ATOM 0 HG2 GLU A 108 -2.918 -13.710 1.706 1.00 13.11 H new ATOM 0 HG3 GLU A 108 -1.739 -14.433 0.630 1.00 13.11 H new ATOM 1571 N VAL A 109 -1.504 -9.305 1.058 1.00 44.30 N ATOM 1572 CA VAL A 109 -1.048 -7.924 0.862 1.00 43.34 C ATOM 1573 C VAL A 109 0.027 -7.542 1.892 1.00 14.34 C ATOM 1574 O VAL A 109 -0.207 -7.663 3.098 1.00 74.34 O ATOM 1575 CB VAL A 109 -2.239 -6.938 0.948 1.00 72.02 C ATOM 1576 CG1 VAL A 109 -1.885 -5.660 0.176 1.00 45.22 C ATOM 1577 CG2 VAL A 109 -3.574 -7.449 0.380 1.00 2.31 C ATOM 0 H VAL A 109 -1.584 -9.577 2.038 1.00 44.30 H new ATOM 0 HA VAL A 109 -0.607 -7.859 -0.133 1.00 43.34 H new ATOM 0 HB VAL A 109 -2.391 -6.781 2.016 1.00 72.02 H new ATOM 0 HG11 VAL A 109 -2.718 -4.959 0.231 1.00 45.22 H new ATOM 0 HG12 VAL A 109 -0.998 -5.204 0.615 1.00 45.22 H new ATOM 0 HG13 VAL A 109 -1.687 -5.908 -0.867 1.00 45.22 H new ATOM 0 HG21 VAL A 109 -4.336 -6.678 0.493 1.00 2.31 H new ATOM 0 HG22 VAL A 109 -3.452 -7.687 -0.677 1.00 2.31 H new ATOM 0 HG23 VAL A 109 -3.881 -8.344 0.921 1.00 2.31 H new ATOM 1587 N ALA A 110 1.185 -7.029 1.461 1.00 34.31 N ATOM 1588 CA ALA A 110 2.200 -6.455 2.349 1.00 72.11 C ATOM 1589 C ALA A 110 2.483 -4.995 1.983 1.00 60.03 C ATOM 1590 O ALA A 110 2.202 -4.560 0.862 1.00 75.42 O ATOM 1591 CB ALA A 110 3.490 -7.277 2.291 1.00 0.31 C ATOM 0 H ALA A 110 1.446 -7.001 0.475 1.00 34.31 H new ATOM 0 HA ALA A 110 1.813 -6.483 3.368 1.00 72.11 H new ATOM 0 HB1 ALA A 110 4.232 -6.836 2.956 1.00 0.31 H new ATOM 0 HB2 ALA A 110 3.284 -8.300 2.604 1.00 0.31 H new ATOM 0 HB3 ALA A 110 3.874 -7.280 1.271 1.00 0.31 H new ATOM 1597 N SER A 111 3.116 -4.258 2.898 1.00 23.33 N ATOM 1598 CA SER A 111 3.622 -2.924 2.632 1.00 64.55 C ATOM 1599 C SER A 111 5.072 -2.817 3.103 1.00 0.24 C ATOM 1600 O SER A 111 5.480 -3.450 4.082 1.00 63.11 O ATOM 1601 CB SER A 111 2.683 -1.872 3.249 1.00 51.22 C ATOM 1602 OG SER A 111 3.041 -0.544 2.893 1.00 2.41 O ATOM 0 H SER A 111 3.290 -4.580 3.850 1.00 23.33 H new ATOM 0 HA SER A 111 3.634 -2.725 1.560 1.00 64.55 H new ATOM 0 HB2 SER A 111 1.661 -2.068 2.925 1.00 51.22 H new ATOM 0 HB3 SER A 111 2.697 -1.970 4.335 1.00 51.22 H new ATOM 0 HG SER A 111 3.405 -0.536 1.983 1.00 2.41 H new ATOM 1607 N PHE A 112 5.845 -1.995 2.398 1.00 13.21 N ATOM 1608 CA PHE A 112 7.266 -1.784 2.596 1.00 4.01 C ATOM 1609 C PHE A 112 7.532 -0.284 2.492 1.00 63.32 C ATOM 1610 O PHE A 112 7.037 0.356 1.573 1.00 40.45 O ATOM 1611 CB PHE A 112 8.048 -2.603 1.558 1.00 44.04 C ATOM 1612 CG PHE A 112 7.758 -2.276 0.103 1.00 35.31 C ATOM 1613 CD1 PHE A 112 8.476 -1.256 -0.549 1.00 41.41 C ATOM 1614 CD2 PHE A 112 6.768 -2.987 -0.603 1.00 32.43 C ATOM 1615 CE1 PHE A 112 8.193 -0.928 -1.881 1.00 44.35 C ATOM 1616 CE2 PHE A 112 6.501 -2.664 -1.944 1.00 71.10 C ATOM 1617 CZ PHE A 112 7.194 -1.626 -2.575 1.00 12.13 C ATOM 0 H PHE A 112 5.472 -1.431 1.634 1.00 13.21 H new ATOM 0 HA PHE A 112 7.597 -2.123 3.578 1.00 4.01 H new ATOM 0 HB2 PHE A 112 9.113 -2.459 1.738 1.00 44.04 H new ATOM 0 HB3 PHE A 112 7.837 -3.660 1.722 1.00 44.04 H new ATOM 0 HD1 PHE A 112 9.251 -0.722 -0.018 1.00 41.41 H new ATOM 0 HD2 PHE A 112 6.216 -3.777 -0.115 1.00 32.43 H new ATOM 0 HE1 PHE A 112 8.743 -0.139 -2.373 1.00 44.35 H new ATOM 0 HE2 PHE A 112 5.755 -3.221 -2.491 1.00 71.10 H new ATOM 0 HZ PHE A 112 6.960 -1.362 -3.596 1.00 12.13 H new ATOM 1626 N PHE A 113 8.264 0.318 3.426 1.00 75.23 N ATOM 1627 CA PHE A 113 8.566 1.753 3.378 1.00 62.22 C ATOM 1628 C PHE A 113 10.073 1.973 3.331 1.00 72.32 C ATOM 1629 O PHE A 113 10.847 1.133 3.796 1.00 11.41 O ATOM 1630 CB PHE A 113 7.868 2.500 4.529 1.00 64.33 C ATOM 1631 CG PHE A 113 7.959 1.840 5.893 1.00 73.43 C ATOM 1632 CD1 PHE A 113 6.985 0.902 6.279 1.00 72.52 C ATOM 1633 CD2 PHE A 113 9.009 2.149 6.775 1.00 24.53 C ATOM 1634 CE1 PHE A 113 7.067 0.269 7.531 1.00 32.42 C ATOM 1635 CE2 PHE A 113 9.087 1.521 8.029 1.00 2.43 C ATOM 1636 CZ PHE A 113 8.115 0.577 8.409 1.00 1.04 C ATOM 0 H PHE A 113 8.663 -0.166 4.231 1.00 75.23 H new ATOM 0 HA PHE A 113 8.162 2.180 2.460 1.00 62.22 H new ATOM 0 HB2 PHE A 113 8.295 3.500 4.600 1.00 64.33 H new ATOM 0 HB3 PHE A 113 6.815 2.621 4.274 1.00 64.33 H new ATOM 0 HD1 PHE A 113 6.170 0.667 5.610 1.00 72.52 H new ATOM 0 HD2 PHE A 113 9.758 2.872 6.488 1.00 24.53 H new ATOM 0 HE1 PHE A 113 6.320 -0.457 7.817 1.00 32.42 H new ATOM 0 HE2 PHE A 113 9.895 1.763 8.703 1.00 2.43 H new ATOM 0 HZ PHE A 113 8.176 0.092 9.372 1.00 1.04 H new ATOM 1645 N THR A 114 10.493 3.109 2.778 1.00 53.42 N ATOM 1646 CA THR A 114 11.896 3.494 2.607 1.00 64.42 C ATOM 1647 C THR A 114 12.217 4.762 3.411 1.00 71.21 C ATOM 1648 O THR A 114 13.139 5.509 3.075 1.00 73.55 O ATOM 1649 CB THR A 114 12.248 3.576 1.106 1.00 11.22 C ATOM 1650 OG1 THR A 114 11.298 4.258 0.313 1.00 73.14 O ATOM 1651 CG2 THR A 114 12.338 2.183 0.500 1.00 73.21 C ATOM 0 H THR A 114 9.845 3.812 2.424 1.00 53.42 H new ATOM 0 HA THR A 114 12.547 2.724 3.022 1.00 64.42 H new ATOM 0 HB THR A 114 13.192 4.121 1.092 1.00 11.22 H new ATOM 0 HG1 THR A 114 11.597 4.266 -0.620 1.00 73.14 H new ATOM 0 HG21 THR A 114 12.587 2.262 -0.558 1.00 73.21 H new ATOM 0 HG22 THR A 114 13.112 1.612 1.013 1.00 73.21 H new ATOM 0 HG23 THR A 114 11.380 1.676 0.610 1.00 73.21 H new ATOM 1659 N SER A 115 11.441 5.010 4.468 1.00 55.21 N ATOM 1660 CA SER A 115 11.479 6.179 5.325 1.00 55.01 C ATOM 1661 C SER A 115 11.440 5.686 6.766 1.00 15.01 C ATOM 1662 O SER A 115 10.450 5.112 7.223 1.00 72.11 O ATOM 1663 CB SER A 115 10.290 7.063 4.989 1.00 55.23 C ATOM 1664 OG SER A 115 10.445 7.640 3.706 1.00 61.34 O ATOM 0 H SER A 115 10.722 4.348 4.761 1.00 55.21 H new ATOM 0 HA SER A 115 12.382 6.772 5.180 1.00 55.01 H new ATOM 0 HB2 SER A 115 9.373 6.475 5.021 1.00 55.23 H new ATOM 0 HB3 SER A 115 10.191 7.849 5.738 1.00 55.23 H new ATOM 0 HG SER A 115 9.866 8.427 3.629 1.00 61.34 H new ATOM 1669 N ALA A 116 12.576 5.827 7.435 1.00 54.23 N ATOM 1670 CA ALA A 116 12.877 5.162 8.696 1.00 24.14 C ATOM 1671 C ALA A 116 13.634 6.052 9.683 1.00 52.04 C ATOM 1672 O ALA A 116 14.021 5.569 10.746 1.00 73.45 O ATOM 1673 CB ALA A 116 13.686 3.903 8.380 1.00 23.43 C ATOM 0 H ALA A 116 13.335 6.424 7.107 1.00 54.23 H new ATOM 0 HA ALA A 116 11.936 4.914 9.187 1.00 24.14 H new ATOM 0 HB1 ALA A 116 13.927 3.383 9.307 1.00 23.43 H new ATOM 0 HB2 ALA A 116 13.100 3.246 7.737 1.00 23.43 H new ATOM 0 HB3 ALA A 116 14.608 4.182 7.870 1.00 23.43 H new ATOM 1679 N GLY A 117 13.854 7.329 9.354 1.00 11.14 N ATOM 1680 CA GLY A 117 14.648 8.224 10.184 1.00 75.42 C ATOM 1681 C GLY A 117 13.952 8.470 11.520 1.00 64.11 C ATOM 1682 O GLY A 117 14.580 8.365 12.575 1.00 74.13 O ATOM 0 H GLY A 117 13.486 7.764 8.508 1.00 11.14 H new ATOM 0 HA2 GLY A 117 15.634 7.792 10.355 1.00 75.42 H new ATOM 0 HA3 GLY A 117 14.800 9.171 9.666 1.00 75.42 H new ATOM 1686 N THR A 118 12.648 8.752 11.483 1.00 40.42 N ATOM 1687 CA THR A 118 11.939 9.309 12.640 1.00 24.21 C ATOM 1688 C THR A 118 10.661 8.514 12.952 1.00 63.31 C ATOM 1689 O THR A 118 9.899 8.866 13.862 1.00 60.31 O ATOM 1690 CB THR A 118 11.711 10.825 12.424 1.00 22.54 C ATOM 1691 OG1 THR A 118 12.739 11.362 11.606 1.00 12.31 O ATOM 1692 CG2 THR A 118 11.711 11.578 13.761 1.00 40.32 C ATOM 0 H THR A 118 12.059 8.604 10.663 1.00 40.42 H new ATOM 0 HA THR A 118 12.551 9.207 13.536 1.00 24.21 H new ATOM 0 HB THR A 118 10.742 10.947 11.941 1.00 22.54 H new ATOM 0 HG1 THR A 118 12.343 11.767 10.807 1.00 12.31 H new ATOM 0 HG21 THR A 118 11.549 12.641 13.580 1.00 40.32 H new ATOM 0 HG22 THR A 118 10.913 11.192 14.396 1.00 40.32 H new ATOM 0 HG23 THR A 118 12.671 11.437 14.258 1.00 40.32 H new ATOM 1700 N ASN A 119 10.425 7.405 12.242 1.00 74.52 N ATOM 1701 CA ASN A 119 9.278 6.527 12.424 1.00 55.24 C ATOM 1702 C ASN A 119 9.697 5.084 12.192 1.00 13.03 C ATOM 1703 O ASN A 119 10.565 4.803 11.365 1.00 21.20 O ATOM 1704 CB ASN A 119 8.162 6.884 11.427 1.00 34.51 C ATOM 1705 CG ASN A 119 7.283 8.036 11.881 1.00 24.13 C ATOM 1706 OD1 ASN A 119 7.066 8.985 11.141 1.00 21.13 O ATOM 1707 ND2 ASN A 119 6.708 7.964 13.072 1.00 14.02 N ATOM 0 H ASN A 119 11.052 7.089 11.502 1.00 74.52 H new ATOM 0 HA ASN A 119 8.907 6.652 13.441 1.00 55.24 H new ATOM 0 HB2 ASN A 119 8.612 7.138 10.467 1.00 34.51 H new ATOM 0 HB3 ASN A 119 7.538 6.005 11.264 1.00 34.51 H new ATOM 0 HD21 ASN A 119 6.077 8.704 13.380 1.00 14.02 H new ATOM 0 HD22 ASN A 119 6.896 7.168 13.682 1.00 14.02 H new ATOM 1713 N HIS A 120 9.011 4.172 12.878 1.00 1.11 N ATOM 1714 CA HIS A 120 8.924 2.766 12.529 1.00 24.41 C ATOM 1715 C HIS A 120 7.552 2.255 12.972 1.00 61.12 C ATOM 1716 O HIS A 120 6.662 2.039 12.149 1.00 4.23 O ATOM 1717 CB HIS A 120 10.086 1.979 13.161 1.00 15.43 C ATOM 1718 CG HIS A 120 10.131 0.543 12.705 1.00 24.12 C ATOM 1719 ND1 HIS A 120 10.349 -0.562 13.497 1.00 3.33 N ATOM 1720 CD2 HIS A 120 9.985 0.106 11.416 1.00 32.43 C ATOM 1721 CE1 HIS A 120 10.348 -1.640 12.690 1.00 14.13 C ATOM 1722 NE2 HIS A 120 10.130 -1.279 11.415 1.00 41.32 N ATOM 0 H HIS A 120 8.484 4.405 13.720 1.00 1.11 H new ATOM 0 HA HIS A 120 9.018 2.625 11.452 1.00 24.41 H new ATOM 0 HB2 HIS A 120 11.028 2.466 12.910 1.00 15.43 H new ATOM 0 HB3 HIS A 120 9.992 2.009 14.247 1.00 15.43 H new ATOM 0 HD2 HIS A 120 9.792 0.726 10.553 1.00 32.43 H new ATOM 0 HE1 HIS A 120 10.502 -2.656 13.023 1.00 14.13 H new ATOM 0 HE2 HIS A 120 10.080 -1.897 10.605 1.00 41.32 H new ATOM 1729 N LYS A 121 7.345 2.135 14.289 1.00 62.14 N ATOM 1730 CA LYS A 121 6.127 1.585 14.880 1.00 33.30 C ATOM 1731 C LYS A 121 4.884 2.372 14.471 1.00 4.23 C ATOM 1732 O LYS A 121 3.825 1.764 14.305 1.00 22.11 O ATOM 1733 CB LYS A 121 6.265 1.545 16.418 1.00 71.22 C ATOM 1734 CG LYS A 121 6.359 0.123 16.998 1.00 42.21 C ATOM 1735 CD LYS A 121 5.093 -0.735 16.826 1.00 14.51 C ATOM 1736 CE LYS A 121 3.863 -0.066 17.449 1.00 74.14 C ATOM 1737 NZ LYS A 121 2.682 -0.950 17.473 1.00 72.33 N ATOM 0 H LYS A 121 8.034 2.424 14.983 1.00 62.14 H new ATOM 0 HA LYS A 121 6.000 0.571 14.501 1.00 33.30 H new ATOM 0 HB2 LYS A 121 7.154 2.105 16.708 1.00 71.22 H new ATOM 0 HB3 LYS A 121 5.409 2.053 16.863 1.00 71.22 H new ATOM 0 HG2 LYS A 121 7.195 -0.392 16.525 1.00 42.21 H new ATOM 0 HG3 LYS A 121 6.589 0.195 18.061 1.00 42.21 H new ATOM 0 HD2 LYS A 121 4.914 -0.910 15.765 1.00 14.51 H new ATOM 0 HD3 LYS A 121 5.249 -1.710 17.287 1.00 14.51 H new ATOM 0 HE2 LYS A 121 4.100 0.244 18.467 1.00 74.14 H new ATOM 0 HE3 LYS A 121 3.623 0.838 16.888 1.00 74.14 H new ATOM 0 HZ1 LYS A 121 1.880 -0.447 17.904 1.00 72.33 H new ATOM 0 HZ2 LYS A 121 2.435 -1.226 16.501 1.00 72.33 H new ATOM 0 HZ3 LYS A 121 2.897 -1.801 18.031 1.00 72.33 H new ATOM 1747 N ALA A 122 4.996 3.699 14.311 1.00 12.30 N ATOM 1748 CA ALA A 122 3.834 4.514 13.995 1.00 74.31 C ATOM 1749 C ALA A 122 3.247 4.145 12.636 1.00 30.43 C ATOM 1750 O ALA A 122 2.030 4.011 12.539 1.00 34.21 O ATOM 1751 CB ALA A 122 4.196 5.998 14.043 1.00 53.02 C ATOM 0 H ALA A 122 5.871 4.217 14.396 1.00 12.30 H new ATOM 0 HA ALA A 122 3.071 4.316 14.748 1.00 74.31 H new ATOM 0 HB1 ALA A 122 3.316 6.595 13.804 1.00 53.02 H new ATOM 0 HB2 ALA A 122 4.548 6.254 15.042 1.00 53.02 H new ATOM 0 HB3 ALA A 122 4.982 6.204 13.317 1.00 53.02 H new ATOM 1757 N TYR A 123 4.094 3.955 11.610 1.00 62.31 N ATOM 1758 CA TYR A 123 3.612 3.617 10.273 1.00 14.33 C ATOM 1759 C TYR A 123 2.761 2.364 10.357 1.00 45.11 C ATOM 1760 O TYR A 123 1.635 2.378 9.889 1.00 12.52 O ATOM 1761 CB TYR A 123 4.745 3.401 9.260 1.00 54.01 C ATOM 1762 CG TYR A 123 4.235 3.115 7.850 1.00 54.05 C ATOM 1763 CD1 TYR A 123 3.909 4.164 6.964 1.00 74.34 C ATOM 1764 CD2 TYR A 123 4.043 1.781 7.435 1.00 14.42 C ATOM 1765 CE1 TYR A 123 3.446 3.880 5.664 1.00 72.33 C ATOM 1766 CE2 TYR A 123 3.571 1.489 6.142 1.00 1.42 C ATOM 1767 CZ TYR A 123 3.286 2.538 5.242 1.00 15.42 C ATOM 1768 OH TYR A 123 2.846 2.265 3.982 1.00 54.35 O ATOM 0 H TYR A 123 5.108 4.031 11.686 1.00 62.31 H new ATOM 0 HA TYR A 123 3.028 4.465 9.915 1.00 14.33 H new ATOM 0 HB2 TYR A 123 5.380 4.287 9.238 1.00 54.01 H new ATOM 0 HB3 TYR A 123 5.368 2.570 9.591 1.00 54.01 H new ATOM 0 HD1 TYR A 123 4.015 5.190 7.284 1.00 74.34 H new ATOM 0 HD2 TYR A 123 4.261 0.973 8.118 1.00 14.42 H new ATOM 0 HE1 TYR A 123 3.212 4.689 4.987 1.00 72.33 H new ATOM 0 HE2 TYR A 123 3.427 0.463 5.838 1.00 1.42 H new ATOM 0 HH TYR A 123 2.982 1.314 3.787 1.00 54.35 H new ATOM 1777 N VAL A 124 3.271 1.302 10.986 1.00 65.41 N ATOM 1778 CA VAL A 124 2.573 0.026 11.090 1.00 21.12 C ATOM 1779 C VAL A 124 1.170 0.221 11.676 1.00 45.53 C ATOM 1780 O VAL A 124 0.196 -0.267 11.107 1.00 41.25 O ATOM 1781 CB VAL A 124 3.437 -0.973 11.888 1.00 43.51 C ATOM 1782 CG1 VAL A 124 2.755 -2.342 11.983 1.00 33.12 C ATOM 1783 CG2 VAL A 124 4.831 -1.142 11.249 1.00 52.52 C ATOM 0 H VAL A 124 4.185 1.307 11.439 1.00 65.41 H new ATOM 0 HA VAL A 124 2.425 -0.399 10.097 1.00 21.12 H new ATOM 0 HB VAL A 124 3.554 -0.563 12.891 1.00 43.51 H new ATOM 0 HG11 VAL A 124 3.387 -3.025 12.551 1.00 33.12 H new ATOM 0 HG12 VAL A 124 1.793 -2.235 12.485 1.00 33.12 H new ATOM 0 HG13 VAL A 124 2.599 -2.741 10.981 1.00 33.12 H new ATOM 0 HG21 VAL A 124 5.416 -1.852 11.834 1.00 52.52 H new ATOM 0 HG22 VAL A 124 4.722 -1.514 10.230 1.00 52.52 H new ATOM 0 HG23 VAL A 124 5.342 -0.179 11.230 1.00 52.52 H new ATOM 1793 N SER A 125 1.062 0.950 12.786 1.00 61.15 N ATOM 1794 CA SER A 125 -0.198 1.174 13.475 1.00 72.21 C ATOM 1795 C SER A 125 -1.177 1.954 12.582 1.00 51.55 C ATOM 1796 O SER A 125 -2.330 1.551 12.403 1.00 25.43 O ATOM 1797 CB SER A 125 0.129 1.907 14.783 1.00 13.10 C ATOM 1798 OG SER A 125 -0.876 1.771 15.768 1.00 43.52 O ATOM 0 H SER A 125 1.858 1.404 13.233 1.00 61.15 H new ATOM 0 HA SER A 125 -0.700 0.234 13.704 1.00 72.21 H new ATOM 0 HB2 SER A 125 1.070 1.526 15.179 1.00 13.10 H new ATOM 0 HB3 SER A 125 0.278 2.966 14.570 1.00 13.10 H new ATOM 0 HG SER A 125 -0.610 2.257 16.576 1.00 43.52 H new ATOM 1803 N HIS A 126 -0.730 3.079 12.026 1.00 21.14 N ATOM 1804 CA HIS A 126 -1.545 3.966 11.203 1.00 2.13 C ATOM 1805 C HIS A 126 -1.900 3.345 9.852 1.00 10.21 C ATOM 1806 O HIS A 126 -2.952 3.651 9.295 1.00 42.55 O ATOM 1807 CB HIS A 126 -0.784 5.280 11.030 1.00 3.20 C ATOM 1808 CG HIS A 126 -0.719 6.050 12.328 1.00 4.23 C ATOM 1809 ND1 HIS A 126 -1.773 6.272 13.187 1.00 72.24 N ATOM 1810 CD2 HIS A 126 0.390 6.632 12.875 1.00 45.52 C ATOM 1811 CE1 HIS A 126 -1.303 6.963 14.241 1.00 64.32 C ATOM 1812 NE2 HIS A 126 0.008 7.220 14.087 1.00 74.01 N ATOM 0 H HIS A 126 0.230 3.405 12.139 1.00 21.14 H new ATOM 0 HA HIS A 126 -2.497 4.144 11.703 1.00 2.13 H new ATOM 0 HB2 HIS A 126 0.226 5.074 10.676 1.00 3.20 H new ATOM 0 HB3 HIS A 126 -1.272 5.888 10.268 1.00 3.20 H new ATOM 0 HD2 HIS A 126 1.382 6.637 12.449 1.00 45.52 H new ATOM 0 HE1 HIS A 126 -1.895 7.268 15.091 1.00 64.32 H new ATOM 0 HE2 HIS A 126 0.607 7.741 14.728 1.00 74.01 H new ATOM 1819 N PHE A 127 -1.035 2.499 9.301 1.00 2.51 N ATOM 1820 CA PHE A 127 -1.282 1.762 8.075 1.00 53.12 C ATOM 1821 C PHE A 127 -2.357 0.709 8.320 1.00 62.43 C ATOM 1822 O PHE A 127 -3.299 0.628 7.542 1.00 13.34 O ATOM 1823 CB PHE A 127 0.013 1.110 7.578 1.00 44.22 C ATOM 1824 CG PHE A 127 -0.267 0.009 6.588 1.00 65.03 C ATOM 1825 CD1 PHE A 127 -0.837 0.315 5.338 1.00 32.43 C ATOM 1826 CD2 PHE A 127 -0.159 -1.327 7.010 1.00 24.40 C ATOM 1827 CE1 PHE A 127 -1.254 -0.724 4.494 1.00 65.01 C ATOM 1828 CE2 PHE A 127 -0.602 -2.360 6.177 1.00 23.24 C ATOM 1829 CZ PHE A 127 -1.151 -2.055 4.926 1.00 2.10 C ATOM 0 H PHE A 127 -0.120 2.305 9.709 1.00 2.51 H new ATOM 0 HA PHE A 127 -1.632 2.450 7.305 1.00 53.12 H new ATOM 0 HB2 PHE A 127 0.647 1.865 7.114 1.00 44.22 H new ATOM 0 HB3 PHE A 127 0.567 0.706 8.426 1.00 44.22 H new ATOM 0 HD1 PHE A 127 -0.952 1.344 5.031 1.00 32.43 H new ATOM 0 HD2 PHE A 127 0.266 -1.556 7.976 1.00 24.40 H new ATOM 0 HE1 PHE A 127 -1.653 -0.501 3.515 1.00 65.01 H new ATOM 0 HE2 PHE A 127 -0.521 -3.388 6.498 1.00 23.24 H new ATOM 0 HZ PHE A 127 -1.499 -2.853 4.286 1.00 2.10 H new ATOM 1838 N ASN A 128 -2.230 -0.080 9.394 1.00 52.54 N ATOM 1839 CA ASN A 128 -3.156 -1.164 9.707 1.00 52.55 C ATOM 1840 C ASN A 128 -4.591 -0.653 9.747 1.00 22.24 C ATOM 1841 O ASN A 128 -5.487 -1.260 9.162 1.00 63.31 O ATOM 1842 CB ASN A 128 -2.783 -1.825 11.045 1.00 53.11 C ATOM 1843 CG ASN A 128 -1.897 -3.049 10.867 1.00 72.42 C ATOM 1844 OD1 ASN A 128 -2.035 -3.815 9.917 1.00 44.14 O ATOM 1845 ND2 ASN A 128 -0.998 -3.302 11.800 1.00 22.31 N ATOM 0 H ASN A 128 -1.475 0.020 10.072 1.00 52.54 H new ATOM 0 HA ASN A 128 -3.081 -1.913 8.919 1.00 52.55 H new ATOM 0 HB2 ASN A 128 -2.270 -1.098 11.674 1.00 53.11 H new ATOM 0 HB3 ASN A 128 -3.694 -2.114 11.570 1.00 53.11 H new ATOM 0 HD21 ASN A 128 -0.415 -4.136 11.733 1.00 22.31 H new ATOM 0 HD22 ASN A 128 -0.887 -2.663 12.587 1.00 22.31 H new ATOM 1851 N GLU A 129 -4.804 0.489 10.397 1.00 54.34 N ATOM 1852 CA GLU A 129 -6.111 1.126 10.470 1.00 41.23 C ATOM 1853 C GLU A 129 -6.637 1.576 9.114 1.00 50.42 C ATOM 1854 O GLU A 129 -7.845 1.781 8.957 1.00 4.24 O ATOM 1855 CB GLU A 129 -6.015 2.359 11.372 1.00 74.41 C ATOM 1856 CG GLU A 129 -5.921 2.020 12.857 1.00 61.24 C ATOM 1857 CD GLU A 129 -7.193 1.407 13.458 1.00 71.23 C ATOM 1858 OE1 GLU A 129 -8.243 1.315 12.782 1.00 32.01 O ATOM 1859 OE2 GLU A 129 -7.162 1.030 14.648 1.00 34.20 O ATOM 0 H GLU A 129 -4.070 0.998 10.889 1.00 54.34 H new ATOM 0 HA GLU A 129 -6.802 0.381 10.865 1.00 41.23 H new ATOM 0 HB2 GLU A 129 -5.141 2.943 11.084 1.00 74.41 H new ATOM 0 HB3 GLU A 129 -6.888 2.990 11.206 1.00 74.41 H new ATOM 0 HG2 GLU A 129 -5.094 1.325 13.005 1.00 61.24 H new ATOM 0 HG3 GLU A 129 -5.677 2.928 13.408 1.00 61.24 H new ATOM 1864 N TRP A 130 -5.750 1.811 8.151 1.00 34.40 N ATOM 1865 CA TRP A 130 -6.088 2.341 6.841 1.00 74.13 C ATOM 1866 C TRP A 130 -6.157 1.244 5.781 1.00 61.14 C ATOM 1867 O TRP A 130 -6.523 1.541 4.646 1.00 41.12 O ATOM 1868 CB TRP A 130 -5.094 3.454 6.478 1.00 42.11 C ATOM 1869 CG TRP A 130 -5.239 4.743 7.241 1.00 34.30 C ATOM 1870 CD1 TRP A 130 -5.885 4.939 8.414 1.00 71.11 C ATOM 1871 CD2 TRP A 130 -4.612 6.019 6.940 1.00 21.30 C ATOM 1872 NE1 TRP A 130 -5.758 6.252 8.808 1.00 12.34 N ATOM 1873 CE2 TRP A 130 -4.903 6.947 7.983 1.00 12.20 C ATOM 1874 CE3 TRP A 130 -3.744 6.442 5.920 1.00 51.53 C ATOM 1875 CZ2 TRP A 130 -4.335 8.232 8.020 1.00 43.14 C ATOM 1876 CZ3 TRP A 130 -3.125 7.699 5.978 1.00 33.04 C ATOM 1877 CH2 TRP A 130 -3.427 8.601 7.015 1.00 61.11 C ATOM 0 H TRP A 130 -4.752 1.632 8.267 1.00 34.40 H new ATOM 0 HA TRP A 130 -7.089 2.771 6.876 1.00 74.13 H new ATOM 0 HB2 TRP A 130 -4.083 3.076 6.632 1.00 42.11 H new ATOM 0 HB3 TRP A 130 -5.195 3.671 5.415 1.00 42.11 H new ATOM 0 HD1 TRP A 130 -6.421 4.177 8.961 1.00 71.11 H new ATOM 0 HE1 TRP A 130 -6.238 6.659 9.611 1.00 12.34 H new ATOM 0 HE3 TRP A 130 -3.551 5.791 5.080 1.00 51.53 H new ATOM 0 HZ2 TRP A 130 -4.593 8.924 8.808 1.00 43.14 H new ATOM 0 HZ3 TRP A 130 -2.409 7.978 5.219 1.00 33.04 H new ATOM 0 HH2 TRP A 130 -2.961 9.575 7.038 1.00 61.11 H new ATOM 1887 N ALA A 131 -5.879 -0.006 6.158 1.00 65.15 N ATOM 1888 CA ALA A 131 -5.976 -1.199 5.329 1.00 52.51 C ATOM 1889 C ALA A 131 -6.856 -2.268 5.992 1.00 51.12 C ATOM 1890 O ALA A 131 -6.772 -3.452 5.651 1.00 1.31 O ATOM 1891 CB ALA A 131 -4.556 -1.697 5.047 1.00 12.34 C ATOM 0 H ALA A 131 -5.563 -0.220 7.104 1.00 65.15 H new ATOM 0 HA ALA A 131 -6.464 -0.965 4.383 1.00 52.51 H new ATOM 0 HB1 ALA A 131 -4.601 -2.592 4.426 1.00 12.34 H new ATOM 0 HB2 ALA A 131 -3.995 -0.921 4.525 1.00 12.34 H new ATOM 0 HB3 ALA A 131 -4.059 -1.933 5.988 1.00 12.34 H new ATOM 1897 N ASP A 132 -7.677 -1.847 6.960 1.00 43.51 N ATOM 1898 CA ASP A 132 -8.541 -2.701 7.749 1.00 61.03 C ATOM 1899 C ASP A 132 -9.557 -3.357 6.829 1.00 41.31 C ATOM 1900 O ASP A 132 -10.301 -2.669 6.130 1.00 64.01 O ATOM 1901 CB ASP A 132 -9.231 -1.906 8.863 1.00 32.04 C ATOM 1902 CG ASP A 132 -10.161 -2.801 9.681 1.00 54.45 C ATOM 1903 OD1 ASP A 132 -9.654 -3.698 10.396 1.00 43.22 O ATOM 1904 OD2 ASP A 132 -11.397 -2.614 9.640 1.00 72.45 O ATOM 0 H ASP A 132 -7.753 -0.863 7.217 1.00 43.51 H new ATOM 0 HA ASP A 132 -7.944 -3.474 8.233 1.00 61.03 H new ATOM 0 HB2 ASP A 132 -8.480 -1.463 9.517 1.00 32.04 H new ATOM 0 HB3 ASP A 132 -9.801 -1.084 8.429 1.00 32.04 H new ATOM 1908 N GLY A 133 -9.545 -4.685 6.793 1.00 64.41 N ATOM 1909 CA GLY A 133 -10.460 -5.503 6.006 1.00 10.20 C ATOM 1910 C GLY A 133 -9.783 -6.266 4.867 1.00 23.44 C ATOM 1911 O GLY A 133 -10.424 -7.120 4.256 1.00 42.44 O ATOM 0 H GLY A 133 -8.877 -5.239 7.328 1.00 64.41 H new ATOM 0 HA2 GLY A 133 -10.953 -6.217 6.666 1.00 10.20 H new ATOM 0 HA3 GLY A 133 -11.238 -4.863 5.590 1.00 10.20 H new ATOM 1915 N LEU A 134 -8.498 -6.021 4.580 1.00 70.05 N ATOM 1916 CA LEU A 134 -7.720 -6.757 3.578 1.00 23.23 C ATOM 1917 C LEU A 134 -6.570 -7.491 4.280 1.00 65.45 C ATOM 1918 O LEU A 134 -6.227 -7.175 5.421 1.00 34.22 O ATOM 1919 CB LEU A 134 -7.238 -5.788 2.486 1.00 64.33 C ATOM 1920 CG LEU A 134 -8.364 -5.188 1.615 1.00 32.31 C ATOM 1921 CD1 LEU A 134 -7.797 -4.004 0.830 1.00 52.42 C ATOM 1922 CD2 LEU A 134 -8.992 -6.187 0.628 1.00 61.01 C ATOM 0 H LEU A 134 -7.961 -5.291 5.048 1.00 70.05 H new ATOM 0 HA LEU A 134 -8.333 -7.510 3.082 1.00 23.23 H new ATOM 0 HB2 LEU A 134 -6.689 -4.973 2.958 1.00 64.33 H new ATOM 0 HB3 LEU A 134 -6.536 -6.312 1.838 1.00 64.33 H new ATOM 0 HG LEU A 134 -9.160 -4.884 2.295 1.00 32.31 H new ATOM 0 HD11 LEU A 134 -8.581 -3.570 0.210 1.00 52.42 H new ATOM 0 HD12 LEU A 134 -7.425 -3.251 1.525 1.00 52.42 H new ATOM 0 HD13 LEU A 134 -6.980 -4.346 0.195 1.00 52.42 H new ATOM 0 HD21 LEU A 134 -9.774 -5.689 0.054 1.00 61.01 H new ATOM 0 HD22 LEU A 134 -8.225 -6.559 -0.051 1.00 61.01 H new ATOM 0 HD23 LEU A 134 -9.423 -7.022 1.180 1.00 61.01 H new ATOM 1933 N ASN A 135 -5.999 -8.516 3.644 1.00 14.40 N ATOM 1934 CA ASN A 135 -5.184 -9.533 4.315 1.00 31.23 C ATOM 1935 C ASN A 135 -3.728 -9.079 4.457 1.00 31.04 C ATOM 1936 O ASN A 135 -2.880 -9.397 3.619 1.00 1.33 O ATOM 1937 CB ASN A 135 -5.279 -10.862 3.563 1.00 50.14 C ATOM 1938 CG ASN A 135 -4.641 -11.994 4.353 1.00 2.44 C ATOM 1939 OD1 ASN A 135 -5.223 -12.542 5.285 1.00 44.32 O ATOM 1940 ND2 ASN A 135 -3.429 -12.359 4.003 1.00 41.53 N ATOM 0 H ASN A 135 -6.090 -8.666 2.639 1.00 14.40 H new ATOM 0 HA ASN A 135 -5.575 -9.676 5.322 1.00 31.23 H new ATOM 0 HB2 ASN A 135 -6.325 -11.097 3.368 1.00 50.14 H new ATOM 0 HB3 ASN A 135 -4.787 -10.770 2.595 1.00 50.14 H new ATOM 0 HD21 ASN A 135 -2.956 -13.109 4.508 1.00 41.53 H new ATOM 0 HD22 ASN A 135 -2.960 -11.893 3.226 1.00 41.53 H new ATOM 1946 N VAL A 136 -3.445 -8.297 5.496 1.00 1.42 N ATOM 1947 CA VAL A 136 -2.123 -7.761 5.802 1.00 41.32 C ATOM 1948 C VAL A 136 -1.246 -8.874 6.382 1.00 24.43 C ATOM 1949 O VAL A 136 -1.560 -9.402 7.451 1.00 34.22 O ATOM 1950 CB VAL A 136 -2.244 -6.585 6.797 1.00 34.23 C ATOM 1951 CG1 VAL A 136 -0.859 -6.049 7.204 1.00 25.43 C ATOM 1952 CG2 VAL A 136 -3.044 -5.421 6.193 1.00 45.53 C ATOM 0 H VAL A 136 -4.154 -8.010 6.170 1.00 1.42 H new ATOM 0 HA VAL A 136 -1.661 -7.387 4.889 1.00 41.32 H new ATOM 0 HB VAL A 136 -2.762 -6.976 7.673 1.00 34.23 H new ATOM 0 HG11 VAL A 136 -0.980 -5.223 7.904 1.00 25.43 H new ATOM 0 HG12 VAL A 136 -0.286 -6.845 7.678 1.00 25.43 H new ATOM 0 HG13 VAL A 136 -0.330 -5.699 6.318 1.00 25.43 H new ATOM 0 HG21 VAL A 136 -3.111 -4.610 6.918 1.00 45.53 H new ATOM 0 HG22 VAL A 136 -2.543 -5.063 5.294 1.00 45.53 H new ATOM 0 HG23 VAL A 136 -4.047 -5.763 5.938 1.00 45.53 H new ATOM 1962 N ILE A 137 -0.112 -9.189 5.743 1.00 25.13 N ATOM 1963 CA ILE A 137 0.878 -10.129 6.287 1.00 70.11 C ATOM 1964 C ILE A 137 2.282 -9.528 6.434 1.00 5.31 C ATOM 1965 O ILE A 137 3.226 -10.241 6.781 1.00 64.01 O ATOM 1966 CB ILE A 137 0.871 -11.456 5.505 1.00 53.42 C ATOM 1967 CG1 ILE A 137 1.604 -11.442 4.149 1.00 74.12 C ATOM 1968 CG2 ILE A 137 -0.553 -11.990 5.341 1.00 64.15 C ATOM 1969 CD1 ILE A 137 1.269 -10.328 3.168 1.00 25.23 C ATOM 0 H ILE A 137 0.145 -8.800 4.836 1.00 25.13 H new ATOM 0 HA ILE A 137 0.569 -10.351 7.308 1.00 70.11 H new ATOM 0 HB ILE A 137 1.456 -12.133 6.127 1.00 53.42 H new ATOM 0 HG12 ILE A 137 2.675 -11.401 4.349 1.00 74.12 H new ATOM 0 HG13 ILE A 137 1.409 -12.393 3.654 1.00 74.12 H new ATOM 0 HG21 ILE A 137 -0.528 -12.927 4.785 1.00 64.15 H new ATOM 0 HG22 ILE A 137 -0.993 -12.162 6.324 1.00 64.15 H new ATOM 0 HG23 ILE A 137 -1.154 -11.262 4.797 1.00 64.15 H new ATOM 0 HD11 ILE A 137 1.862 -10.451 2.262 1.00 25.23 H new ATOM 0 HD12 ILE A 137 0.209 -10.371 2.917 1.00 25.23 H new ATOM 0 HD13 ILE A 137 1.495 -9.363 3.622 1.00 25.23 H new ATOM 1980 N GLY A 138 2.448 -8.230 6.181 1.00 1.43 N ATOM 1981 CA GLY A 138 3.750 -7.593 6.226 1.00 62.11 C ATOM 1982 C GLY A 138 3.649 -6.087 6.289 1.00 5.24 C ATOM 1983 O GLY A 138 2.893 -5.503 5.509 1.00 63.21 O ATOM 0 H GLY A 138 1.683 -7.599 5.941 1.00 1.43 H new ATOM 0 HA2 GLY A 138 4.299 -7.955 7.095 1.00 62.11 H new ATOM 0 HA3 GLY A 138 4.323 -7.880 5.344 1.00 62.11 H new ATOM 1987 N VAL A 139 4.419 -5.465 7.187 1.00 41.33 N ATOM 1988 CA VAL A 139 4.588 -4.017 7.242 1.00 21.40 C ATOM 1989 C VAL A 139 6.016 -3.749 7.754 1.00 44.45 C ATOM 1990 O VAL A 139 6.230 -3.723 8.969 1.00 31.13 O ATOM 1991 CB VAL A 139 3.493 -3.331 8.107 1.00 70.15 C ATOM 1992 CG1 VAL A 139 3.339 -1.881 7.631 1.00 5.50 C ATOM 1993 CG2 VAL A 139 2.093 -3.968 8.101 1.00 13.52 C ATOM 0 H VAL A 139 4.947 -5.963 7.903 1.00 41.33 H new ATOM 0 HA VAL A 139 4.464 -3.578 6.252 1.00 21.40 H new ATOM 0 HB VAL A 139 3.853 -3.437 9.130 1.00 70.15 H new ATOM 0 HG11 VAL A 139 2.574 -1.382 8.226 1.00 5.50 H new ATOM 0 HG12 VAL A 139 4.288 -1.357 7.747 1.00 5.50 H new ATOM 0 HG13 VAL A 139 3.045 -1.872 6.581 1.00 5.50 H new ATOM 0 HG21 VAL A 139 1.428 -3.391 8.744 1.00 13.52 H new ATOM 0 HG22 VAL A 139 1.700 -3.973 7.084 1.00 13.52 H new ATOM 0 HG23 VAL A 139 2.157 -4.991 8.471 1.00 13.52 H new ATOM 2003 N ALA A 140 7.012 -3.632 6.869 1.00 54.31 N ATOM 2004 CA ALA A 140 8.432 -3.536 7.246 1.00 20.10 C ATOM 2005 C ALA A 140 9.141 -2.419 6.472 1.00 71.23 C ATOM 2006 O ALA A 140 8.526 -1.793 5.611 1.00 15.14 O ATOM 2007 CB ALA A 140 9.112 -4.895 7.031 1.00 0.40 C ATOM 0 H ALA A 140 6.857 -3.601 5.861 1.00 54.31 H new ATOM 0 HA ALA A 140 8.501 -3.276 8.302 1.00 20.10 H new ATOM 0 HB1 ALA A 140 10.163 -4.824 7.310 1.00 0.40 H new ATOM 0 HB2 ALA A 140 8.623 -5.648 7.648 1.00 0.40 H new ATOM 0 HB3 ALA A 140 9.034 -5.179 5.982 1.00 0.40 H new ATOM 2013 N ARG A 141 10.420 -2.152 6.770 1.00 44.25 N ATOM 2014 CA ARG A 141 11.211 -1.179 6.030 1.00 3.02 C ATOM 2015 C ARG A 141 12.180 -1.898 5.100 1.00 32.52 C ATOM 2016 O ARG A 141 12.571 -3.035 5.394 1.00 54.05 O ATOM 2017 CB ARG A 141 11.916 -0.210 6.991 1.00 63.21 C ATOM 2018 CG ARG A 141 13.362 -0.585 7.359 1.00 20.42 C ATOM 2019 CD ARG A 141 13.960 0.427 8.338 1.00 13.20 C ATOM 2020 NE ARG A 141 14.250 -0.206 9.629 1.00 60.52 N ATOM 2021 CZ ARG A 141 13.615 0.012 10.781 1.00 60.52 C ATOM 2022 NH1 ARG A 141 12.871 1.101 10.964 1.00 23.52 N ATOM 2023 NH2 ARG A 141 13.734 -0.872 11.756 1.00 71.12 N ATOM 0 H ARG A 141 10.927 -2.607 7.529 1.00 44.25 H new ATOM 0 HA ARG A 141 10.554 -0.572 5.407 1.00 3.02 H new ATOM 0 HB2 ARG A 141 11.919 0.783 6.542 1.00 63.21 H new ATOM 0 HB3 ARG A 141 11.331 -0.144 7.908 1.00 63.21 H new ATOM 0 HG2 ARG A 141 13.381 -1.580 7.803 1.00 20.42 H new ATOM 0 HG3 ARG A 141 13.971 -0.627 6.456 1.00 20.42 H new ATOM 0 HD2 ARG A 141 14.875 0.847 7.920 1.00 13.20 H new ATOM 0 HD3 ARG A 141 13.266 1.255 8.482 1.00 13.20 H new ATOM 0 HE ARG A 141 15.014 -0.881 9.647 1.00 60.52 H new ATOM 0 HH11 ARG A 141 12.779 1.787 10.215 1.00 23.52 H new ATOM 0 HH12 ARG A 141 12.393 1.249 11.853 1.00 23.52 H new ATOM 0 HH21 ARG A 141 14.305 -1.706 11.621 1.00 71.12 H new ATOM 0 HH22 ARG A 141 13.255 -0.720 12.643 1.00 71.12 H new ATOM 2034 N ASP A 142 12.651 -1.179 4.082 1.00 2.21 N ATOM 2035 CA ASP A 142 13.520 -1.667 3.008 1.00 31.32 C ATOM 2036 C ASP A 142 12.959 -2.982 2.438 1.00 23.43 C ATOM 2037 O ASP A 142 11.745 -3.208 2.496 1.00 64.11 O ATOM 2038 CB ASP A 142 14.992 -1.682 3.464 1.00 1.13 C ATOM 2039 CG ASP A 142 15.625 -0.283 3.550 1.00 20.42 C ATOM 2040 OD1 ASP A 142 14.939 0.763 3.436 1.00 2.21 O ATOM 2041 OD2 ASP A 142 16.859 -0.224 3.761 1.00 61.31 O ATOM 0 H ASP A 142 12.426 -0.190 3.977 1.00 2.21 H new ATOM 0 HA ASP A 142 13.523 -0.983 2.160 1.00 31.32 H new ATOM 0 HB2 ASP A 142 15.056 -2.161 4.441 1.00 1.13 H new ATOM 0 HB3 ASP A 142 15.572 -2.292 2.771 1.00 1.13 H new ATOM 2045 N ASP A 143 13.791 -3.806 1.806 1.00 11.00 N ATOM 2046 CA ASP A 143 13.453 -5.013 1.052 1.00 52.22 C ATOM 2047 C ASP A 143 14.088 -6.222 1.745 1.00 13.21 C ATOM 2048 O ASP A 143 14.929 -6.928 1.188 1.00 64.34 O ATOM 2049 CB ASP A 143 13.851 -4.887 -0.435 1.00 51.15 C ATOM 2050 CG ASP A 143 15.271 -4.388 -0.707 1.00 31.24 C ATOM 2051 OD1 ASP A 143 16.078 -4.195 0.237 1.00 64.55 O ATOM 2052 OD2 ASP A 143 15.556 -4.059 -1.880 1.00 74.42 O ATOM 0 H ASP A 143 14.797 -3.635 1.807 1.00 11.00 H new ATOM 0 HA ASP A 143 12.372 -5.153 1.046 1.00 52.22 H new ATOM 0 HB2 ASP A 143 13.733 -5.863 -0.906 1.00 51.15 H new ATOM 0 HB3 ASP A 143 13.149 -4.210 -0.923 1.00 51.15 H new ATOM 2056 N SER A 144 13.651 -6.457 2.986 1.00 54.45 N ATOM 2057 CA SER A 144 14.203 -7.431 3.924 1.00 23.53 C ATOM 2058 C SER A 144 13.160 -8.446 4.423 1.00 34.32 C ATOM 2059 O SER A 144 13.513 -9.402 5.119 1.00 64.32 O ATOM 2060 CB SER A 144 14.824 -6.647 5.090 1.00 21.52 C ATOM 2061 OG SER A 144 16.198 -6.944 5.230 1.00 14.01 O ATOM 0 H SER A 144 12.862 -5.945 3.381 1.00 54.45 H new ATOM 0 HA SER A 144 14.957 -8.030 3.413 1.00 23.53 H new ATOM 0 HB2 SER A 144 14.696 -5.578 4.922 1.00 21.52 H new ATOM 0 HB3 SER A 144 14.301 -6.890 6.015 1.00 21.52 H new ATOM 0 HG SER A 144 16.569 -6.431 5.978 1.00 14.01 H new ATOM 2066 N GLU A 145 11.881 -8.262 4.085 1.00 22.43 N ATOM 2067 CA GLU A 145 10.808 -9.211 4.367 1.00 52.43 C ATOM 2068 C GLU A 145 10.125 -9.666 3.065 1.00 54.15 C ATOM 2069 O GLU A 145 9.118 -10.363 3.103 1.00 1.02 O ATOM 2070 CB GLU A 145 9.859 -8.659 5.453 1.00 24.33 C ATOM 2071 CG GLU A 145 10.600 -8.344 6.776 1.00 53.21 C ATOM 2072 CD GLU A 145 9.703 -8.156 8.014 1.00 63.52 C ATOM 2073 OE1 GLU A 145 8.526 -8.586 8.050 1.00 43.03 O ATOM 2074 OE2 GLU A 145 10.205 -7.705 9.070 1.00 35.53 O ATOM 0 H GLU A 145 11.558 -7.427 3.596 1.00 22.43 H new ATOM 0 HA GLU A 145 11.222 -10.123 4.797 1.00 52.43 H new ATOM 0 HB2 GLU A 145 9.377 -7.754 5.085 1.00 24.33 H new ATOM 0 HB3 GLU A 145 9.069 -9.385 5.645 1.00 24.33 H new ATOM 0 HG2 GLU A 145 11.303 -9.152 6.979 1.00 53.21 H new ATOM 0 HG3 GLU A 145 11.188 -7.437 6.635 1.00 53.21 H new ATOM 2079 N VAL A 146 10.701 -9.351 1.904 1.00 13.04 N ATOM 2080 CA VAL A 146 10.221 -9.769 0.587 1.00 64.32 C ATOM 2081 C VAL A 146 10.120 -11.300 0.527 1.00 11.44 C ATOM 2082 O VAL A 146 9.140 -11.837 0.013 1.00 64.53 O ATOM 2083 CB VAL A 146 11.186 -9.215 -0.488 1.00 31.41 C ATOM 2084 CG1 VAL A 146 10.716 -9.510 -1.911 1.00 40.42 C ATOM 2085 CG2 VAL A 146 11.363 -7.692 -0.360 1.00 75.53 C ATOM 0 H VAL A 146 11.543 -8.778 1.854 1.00 13.04 H new ATOM 0 HA VAL A 146 9.224 -9.371 0.400 1.00 64.32 H new ATOM 0 HB VAL A 146 12.133 -9.724 -0.310 1.00 31.41 H new ATOM 0 HG11 VAL A 146 11.431 -9.098 -2.623 1.00 40.42 H new ATOM 0 HG12 VAL A 146 10.642 -10.588 -2.053 1.00 40.42 H new ATOM 0 HG13 VAL A 146 9.739 -9.054 -2.073 1.00 40.42 H new ATOM 0 HG21 VAL A 146 12.047 -7.339 -1.132 1.00 75.53 H new ATOM 0 HG22 VAL A 146 10.397 -7.202 -0.480 1.00 75.53 H new ATOM 0 HG23 VAL A 146 11.770 -7.454 0.623 1.00 75.53 H new ATOM 2095 N ASP A 147 11.098 -11.996 1.113 1.00 2.11 N ATOM 2096 CA ASP A 147 11.297 -13.441 0.992 1.00 73.11 C ATOM 2097 C ASP A 147 10.139 -14.249 1.560 1.00 74.51 C ATOM 2098 O ASP A 147 9.920 -15.381 1.138 1.00 41.13 O ATOM 2099 CB ASP A 147 12.571 -13.866 1.731 1.00 63.41 C ATOM 2100 CG ASP A 147 13.753 -13.957 0.787 1.00 22.20 C ATOM 2101 OD1 ASP A 147 13.903 -15.017 0.141 1.00 43.31 O ATOM 2102 OD2 ASP A 147 14.524 -12.976 0.695 1.00 11.11 O ATOM 0 H ASP A 147 11.798 -11.551 1.706 1.00 2.11 H new ATOM 0 HA ASP A 147 11.372 -13.645 -0.076 1.00 73.11 H new ATOM 0 HB2 ASP A 147 12.790 -13.150 2.523 1.00 63.41 H new ATOM 0 HB3 ASP A 147 12.411 -14.832 2.210 1.00 63.41 H new ATOM 2106 N LYS A 148 9.407 -13.701 2.533 1.00 74.12 N ATOM 2107 CA LYS A 148 8.221 -14.326 3.109 1.00 3.30 C ATOM 2108 C LYS A 148 7.005 -13.926 2.287 1.00 71.32 C ATOM 2109 O LYS A 148 6.180 -14.793 2.014 1.00 32.24 O ATOM 2110 CB LYS A 148 8.057 -14.005 4.607 1.00 22.54 C ATOM 2111 CG LYS A 148 8.262 -12.521 4.939 1.00 63.15 C ATOM 2112 CD LYS A 148 7.931 -12.135 6.380 1.00 43.32 C ATOM 2113 CE LYS A 148 9.192 -11.958 7.229 1.00 42.05 C ATOM 2114 NZ LYS A 148 8.869 -11.308 8.514 1.00 73.44 N ATOM 0 H LYS A 148 9.628 -12.796 2.947 1.00 74.12 H new ATOM 0 HA LYS A 148 8.333 -15.409 3.064 1.00 3.30 H new ATOM 0 HB2 LYS A 148 7.060 -14.307 4.929 1.00 22.54 H new ATOM 0 HB3 LYS A 148 8.770 -14.599 5.178 1.00 22.54 H new ATOM 0 HG2 LYS A 148 9.300 -12.258 4.737 1.00 63.15 H new ATOM 0 HG3 LYS A 148 7.645 -11.924 4.267 1.00 63.15 H new ATOM 0 HD2 LYS A 148 7.358 -11.208 6.385 1.00 43.32 H new ATOM 0 HD3 LYS A 148 7.299 -12.903 6.825 1.00 43.32 H new ATOM 0 HE2 LYS A 148 9.652 -12.929 7.413 1.00 42.05 H new ATOM 0 HE3 LYS A 148 9.921 -11.357 6.685 1.00 42.05 H new ATOM 0 HZ1 LYS A 148 9.732 -11.228 9.089 1.00 73.44 H new ATOM 0 HZ2 LYS A 148 8.482 -10.359 8.336 1.00 73.44 H new ATOM 0 HZ3 LYS A 148 8.165 -11.878 9.024 1.00 73.44 H new ATOM 2124 N TRP A 149 6.915 -12.672 1.834 1.00 74.33 N ATOM 2125 CA TRP A 149 5.766 -12.162 1.090 1.00 43.45 C ATOM 2126 C TRP A 149 5.769 -12.626 -0.377 1.00 31.43 C ATOM 2127 O TRP A 149 5.294 -11.897 -1.244 1.00 42.04 O ATOM 2128 CB TRP A 149 5.728 -10.633 1.171 1.00 3.10 C ATOM 2129 CG TRP A 149 5.902 -10.002 2.515 1.00 43.24 C ATOM 2130 CD1 TRP A 149 5.490 -10.489 3.706 1.00 23.31 C ATOM 2131 CD2 TRP A 149 6.505 -8.711 2.795 1.00 21.10 C ATOM 2132 NE1 TRP A 149 5.854 -9.611 4.705 1.00 11.31 N ATOM 2133 CE2 TRP A 149 6.429 -8.463 4.193 1.00 12.00 C ATOM 2134 CE3 TRP A 149 7.072 -7.707 1.990 1.00 63.45 C ATOM 2135 CZ2 TRP A 149 6.838 -7.243 4.758 1.00 55.03 C ATOM 2136 CZ3 TRP A 149 7.497 -6.490 2.540 1.00 62.51 C ATOM 2137 CH2 TRP A 149 7.359 -6.242 3.917 1.00 43.14 C ATOM 0 H TRP A 149 7.648 -11.977 1.977 1.00 74.33 H new ATOM 0 HA TRP A 149 4.867 -12.571 1.551 1.00 43.45 H new ATOM 0 HB2 TRP A 149 6.506 -10.243 0.515 1.00 3.10 H new ATOM 0 HB3 TRP A 149 4.773 -10.300 0.766 1.00 3.10 H new ATOM 0 HD1 TRP A 149 4.960 -11.418 3.852 1.00 23.31 H new ATOM 0 HE1 TRP A 149 5.716 -9.787 5.700 1.00 11.31 H new ATOM 0 HE3 TRP A 149 7.182 -7.877 0.929 1.00 63.45 H new ATOM 0 HZ2 TRP A 149 6.754 -7.076 5.822 1.00 55.03 H new ATOM 0 HZ3 TRP A 149 7.934 -5.737 1.901 1.00 62.51 H new ATOM 0 HH2 TRP A 149 7.652 -5.287 4.328 1.00 43.14 H new ATOM 2147 N SER A 150 6.362 -13.775 -0.695 1.00 52.40 N ATOM 2148 CA SER A 150 6.130 -14.534 -1.913 1.00 43.02 C ATOM 2149 C SER A 150 6.414 -16.033 -1.688 1.00 53.23 C ATOM 2150 O SER A 150 6.455 -16.782 -2.667 1.00 42.50 O ATOM 2151 CB SER A 150 6.965 -13.936 -3.057 1.00 53.00 C ATOM 2152 OG SER A 150 6.118 -13.341 -4.029 1.00 75.32 O ATOM 0 H SER A 150 7.046 -14.218 -0.082 1.00 52.40 H new ATOM 0 HA SER A 150 5.080 -14.462 -2.197 1.00 43.02 H new ATOM 0 HB2 SER A 150 7.655 -13.191 -2.661 1.00 53.00 H new ATOM 0 HB3 SER A 150 7.570 -14.716 -3.520 1.00 53.00 H new ATOM 0 HG SER A 150 5.470 -14.004 -4.348 1.00 75.32 H new ATOM 2157 N LYS A 151 6.618 -16.489 -0.439 1.00 42.52 N ATOM 2158 CA LYS A 151 6.995 -17.869 -0.141 1.00 41.54 C ATOM 2159 C LYS A 151 5.820 -18.839 -0.197 1.00 55.54 C ATOM 2160 O LYS A 151 5.976 -19.998 0.241 1.00 64.44 O ATOM 2161 CB LYS A 151 7.707 -17.913 1.217 1.00 13.40 C ATOM 2162 CG LYS A 151 8.879 -18.895 1.139 1.00 15.24 C ATOM 2163 CD LYS A 151 9.636 -19.045 2.454 1.00 41.35 C ATOM 2164 CE LYS A 151 10.477 -17.824 2.826 1.00 13.31 C ATOM 2165 NZ LYS A 151 11.192 -18.038 4.097 1.00 74.41 N ATOM 0 H LYS A 151 6.524 -15.903 0.390 1.00 42.52 H new ATOM 0 HA LYS A 151 7.678 -18.207 -0.921 1.00 41.54 H new ATOM 0 HB2 LYS A 151 8.067 -16.920 1.485 1.00 13.40 H new ATOM 0 HB3 LYS A 151 7.010 -18.221 1.997 1.00 13.40 H new ATOM 0 HG2 LYS A 151 8.505 -19.871 0.831 1.00 15.24 H new ATOM 0 HG3 LYS A 151 9.572 -18.561 0.366 1.00 15.24 H new ATOM 0 HD2 LYS A 151 8.921 -19.239 3.254 1.00 41.35 H new ATOM 0 HD3 LYS A 151 10.287 -19.917 2.390 1.00 41.35 H new ATOM 0 HE2 LYS A 151 11.195 -17.618 2.032 1.00 13.31 H new ATOM 0 HE3 LYS A 151 9.834 -16.948 2.910 1.00 13.31 H new ATOM 0 HZ1 LYS A 151 11.755 -17.194 4.325 1.00 74.41 H new ATOM 0 HZ2 LYS A 151 10.504 -18.211 4.857 1.00 74.41 H new ATOM 0 HZ3 LYS A 151 11.822 -18.860 4.006 1.00 74.41 H new TER 2175 LYS A 151