USER MOD reduce.3.24.130724 H: found=0, std=0, add=1560, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1558 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 157 LYS NZ :NH3+ 146:sc= 0.51 (180deg=0) USER MOD Set 1.2: A 167 TYR OH : rot 166:sc= 0.479 USER MOD Set 2.1: A 138 ASN : amide:sc= -0.473 K(o=-1.4,f=-4.8!) USER MOD Set 2.2: A 139 GLN :FLIP amide:sc= -0.944 F(o=-3.7!,f=-1.4) USER MOD Set 3.1: A 122 TYR OH : rot -155:sc= 1.14 USER MOD Set 3.2: A 166 THR OG1 : rot 180:sc= 0.0929 USER MOD Set 4.1: A 86 CYS SG : rot 96:sc= -0.0634 USER MOD Set 4.2: A 103 THR OG1 : rot 99:sc= 0.22 USER MOD Set 5.1: A 79 LYS NZ :NH3+ 161:sc= 0.695 (180deg=0) USER MOD Set 5.2: A 81 CYS SG : rot -7:sc= 0.489 USER MOD Set 6.1: A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: A 13 HIS : no HD1:sc= -0.176 X(o=-0.18,f=-0.17) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.32 USER MOD Single : A 6 GLN : amide:sc= -0.728! C(o=-0.73!,f=-1.4!) USER MOD Single : A 8 LYS NZ :NH3+ -154:sc= 0.0868 (180deg=-0.0544) USER MOD Single : A 12 ASN : amide:sc= 1.06 K(o=1.1,f=-4.9!) USER MOD Single : A 16 SER OG : rot -43:sc= 1.03 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0.0854 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -0.0144 X(o=-0.014,f=-0.18) USER MOD Single : A 39 SER OG : rot 139:sc= 1.3 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 MET CE :methyl 138:sc= -0.0917 (180deg=-0.86) USER MOD Single : A 48 ASN : amide:sc= -0.217 K(o=-0.22,f=-0.94) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -177:sc= 1.12 (180deg=1.11) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -0.0762 K(o=-0.076,f=-0.79) USER MOD Single : A 68 ASN : amide:sc= 0.976 K(o=0.98,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.25 X(o=-0.25,f=-0.62) USER MOD Single : A 109 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0186) USER MOD Single : A 111 TYR OH : rot -71:sc= -2.54! USER MOD Single : A 115 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 117 THR OG1 : rot -85:sc= 1.22 USER MOD Single : A 121 SER OG : rot 122:sc= 1.36 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 161:sc= -0.0396 (180deg=-0.31) USER MOD Single : A 134 ASN : amide:sc= -0.0088 K(o=-0.0088,f=-0.71) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 TYR OH : rot 41:sc= 1.24 USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 146 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 THR OG1 : rot 80:sc= 0.0408 USER MOD Single : A 152 LYS NZ :NH3+ -130:sc= 0.495 (180deg=-1.46!) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 THR OG1 : rot -110:sc= -1.24 USER MOD Single : A 161 LYS NZ :NH3+ -143:sc= 1.23 (180deg=0.472) USER MOD Single : A 171 LYS NZ :NH3+ 177:sc= 0.184! (180deg=0.0722!) USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N LEU A 2 -12.273 -16.267 2.904 1.00 0.32 N ATOM 21 CA LEU A 2 -12.523 -15.766 1.566 1.00 0.29 C ATOM 22 C LEU A 2 -11.677 -16.510 0.564 1.00 0.25 C ATOM 23 O LEU A 2 -10.720 -17.189 0.925 1.00 0.26 O ATOM 24 CB LEU A 2 -12.209 -14.276 1.470 1.00 0.38 C ATOM 25 CG LEU A 2 -13.157 -13.345 2.214 1.00 0.51 C ATOM 26 CD1 LEU A 2 -12.818 -13.328 3.691 1.00 0.63 C ATOM 27 CD2 LEU A 2 -13.086 -11.945 1.633 1.00 0.62 C ATOM 0 HA LEU A 2 -13.579 -15.921 1.347 1.00 0.29 H new ATOM 0 HB2 LEU A 2 -11.200 -14.112 1.848 1.00 0.38 H new ATOM 0 HB3 LEU A 2 -12.205 -13.993 0.417 1.00 0.38 H new ATOM 0 HG LEU A 2 -14.176 -13.713 2.096 1.00 0.51 H new ATOM 0 HD11 LEU A 2 -13.502 -12.659 4.214 1.00 0.63 H new ATOM 0 HD12 LEU A 2 -12.913 -14.335 4.098 1.00 0.63 H new ATOM 0 HD13 LEU A 2 -11.795 -12.978 3.825 1.00 0.63 H new ATOM 0 HD21 LEU A 2 -13.769 -11.291 2.175 1.00 0.62 H new ATOM 0 HD22 LEU A 2 -12.069 -11.564 1.725 1.00 0.62 H new ATOM 0 HD23 LEU A 2 -13.369 -11.973 0.581 1.00 0.62 H new ATOM 39 N THR A 3 -12.061 -16.416 -0.680 1.00 0.24 N ATOM 40 CA THR A 3 -11.314 -17.033 -1.747 1.00 0.22 C ATOM 41 C THR A 3 -10.439 -15.980 -2.416 1.00 0.20 C ATOM 42 O THR A 3 -10.684 -14.782 -2.252 1.00 0.20 O ATOM 43 CB THR A 3 -12.261 -17.675 -2.773 1.00 0.24 C ATOM 44 OG1 THR A 3 -13.619 -17.533 -2.323 1.00 0.40 O ATOM 45 CG2 THR A 3 -11.932 -19.151 -2.959 1.00 0.42 C ATOM 0 H THR A 3 -12.895 -15.913 -0.984 1.00 0.24 H new ATOM 0 HA THR A 3 -10.684 -17.821 -1.335 1.00 0.22 H new ATOM 0 HB THR A 3 -12.136 -17.170 -3.731 1.00 0.24 H new ATOM 0 HG1 THR A 3 -14.225 -17.940 -2.977 1.00 0.40 H new ATOM 0 HG21 THR A 3 -12.614 -19.587 -3.689 1.00 0.42 H new ATOM 0 HG22 THR A 3 -10.907 -19.253 -3.314 1.00 0.42 H new ATOM 0 HG23 THR A 3 -12.040 -19.671 -2.007 1.00 0.42 H new ATOM 53 N LEU A 4 -9.423 -16.420 -3.144 1.00 0.19 N ATOM 54 CA LEU A 4 -8.506 -15.514 -3.833 1.00 0.19 C ATOM 55 C LEU A 4 -9.280 -14.498 -4.669 1.00 0.18 C ATOM 56 O LEU A 4 -9.053 -13.289 -4.589 1.00 0.18 O ATOM 57 CB LEU A 4 -7.572 -16.319 -4.740 1.00 0.22 C ATOM 58 CG LEU A 4 -6.194 -15.704 -4.999 1.00 0.25 C ATOM 59 CD1 LEU A 4 -5.284 -16.738 -5.635 1.00 0.64 C ATOM 60 CD2 LEU A 4 -6.295 -14.476 -5.893 1.00 0.52 C ATOM 0 H LEU A 4 -9.209 -17.409 -3.275 1.00 0.19 H new ATOM 0 HA LEU A 4 -7.921 -14.978 -3.086 1.00 0.19 H new ATOM 0 HB2 LEU A 4 -7.431 -17.306 -4.299 1.00 0.22 H new ATOM 0 HB3 LEU A 4 -8.068 -16.467 -5.699 1.00 0.22 H new ATOM 0 HG LEU A 4 -5.776 -15.388 -4.043 1.00 0.25 H new ATOM 0 HD11 LEU A 4 -4.304 -16.297 -5.818 1.00 0.64 H new ATOM 0 HD12 LEU A 4 -5.179 -17.591 -4.965 1.00 0.64 H new ATOM 0 HD13 LEU A 4 -5.715 -17.070 -6.580 1.00 0.64 H new ATOM 0 HD21 LEU A 4 -5.300 -14.063 -6.058 1.00 0.52 H new ATOM 0 HD22 LEU A 4 -6.734 -14.758 -6.850 1.00 0.52 H new ATOM 0 HD23 LEU A 4 -6.924 -13.727 -5.412 1.00 0.52 H new ATOM 72 N ILE A 5 -10.213 -15.010 -5.449 1.00 0.19 N ATOM 73 CA ILE A 5 -11.030 -14.184 -6.325 1.00 0.20 C ATOM 74 C ILE A 5 -11.988 -13.307 -5.530 1.00 0.19 C ATOM 75 O ILE A 5 -12.297 -12.194 -5.949 1.00 0.19 O ATOM 76 CB ILE A 5 -11.799 -15.057 -7.335 1.00 0.24 C ATOM 77 CG1 ILE A 5 -10.809 -15.674 -8.321 1.00 0.27 C ATOM 78 CG2 ILE A 5 -12.863 -14.247 -8.071 1.00 0.27 C ATOM 79 CD1 ILE A 5 -11.461 -16.440 -9.453 1.00 0.33 C ATOM 0 H ILE A 5 -10.427 -16.006 -5.495 1.00 0.19 H new ATOM 0 HA ILE A 5 -10.361 -13.525 -6.878 1.00 0.20 H new ATOM 0 HB ILE A 5 -12.314 -15.851 -6.794 1.00 0.24 H new ATOM 0 HG12 ILE A 5 -10.190 -14.882 -8.742 1.00 0.27 H new ATOM 0 HG13 ILE A 5 -10.143 -16.345 -7.779 1.00 0.27 H new ATOM 0 HG21 ILE A 5 -13.388 -14.891 -8.776 1.00 0.27 H new ATOM 0 HG22 ILE A 5 -13.574 -13.842 -7.351 1.00 0.27 H new ATOM 0 HG23 ILE A 5 -12.388 -13.429 -8.612 1.00 0.27 H new ATOM 0 HD11 ILE A 5 -10.691 -16.846 -10.108 1.00 0.33 H new ATOM 0 HD12 ILE A 5 -12.057 -17.256 -9.044 1.00 0.33 H new ATOM 0 HD13 ILE A 5 -12.105 -15.770 -10.022 1.00 0.33 H new ATOM 91 N GLN A 6 -12.441 -13.799 -4.381 1.00 0.19 N ATOM 92 CA GLN A 6 -13.345 -13.030 -3.539 1.00 0.20 C ATOM 93 C GLN A 6 -12.716 -11.689 -3.197 1.00 0.17 C ATOM 94 O GLN A 6 -13.326 -10.641 -3.390 1.00 0.17 O ATOM 95 CB GLN A 6 -13.677 -13.788 -2.257 1.00 0.23 C ATOM 96 CG GLN A 6 -14.965 -14.589 -2.340 1.00 0.28 C ATOM 97 CD GLN A 6 -16.077 -13.847 -3.057 1.00 0.39 C ATOM 98 OE1 GLN A 6 -16.244 -13.968 -4.271 1.00 0.60 O ATOM 99 NE2 GLN A 6 -16.846 -13.075 -2.307 1.00 0.47 N ATOM 0 H GLN A 6 -12.198 -14.720 -4.015 1.00 0.19 H new ATOM 0 HA GLN A 6 -14.271 -12.868 -4.090 1.00 0.20 H new ATOM 0 HB2 GLN A 6 -12.854 -14.463 -2.020 1.00 0.23 H new ATOM 0 HB3 GLN A 6 -13.753 -13.077 -1.434 1.00 0.23 H new ATOM 0 HG2 GLN A 6 -14.770 -15.528 -2.857 1.00 0.28 H new ATOM 0 HG3 GLN A 6 -15.295 -14.842 -1.332 1.00 0.28 H new ATOM 0 HE21 GLN A 6 -16.673 -13.003 -1.304 1.00 0.47 H new ATOM 0 HE22 GLN A 6 -17.612 -12.552 -2.731 1.00 0.47 H new ATOM 108 N GLY A 7 -11.480 -11.735 -2.712 1.00 0.16 N ATOM 109 CA GLY A 7 -10.775 -10.518 -2.370 1.00 0.15 C ATOM 110 C GLY A 7 -10.506 -9.673 -3.596 1.00 0.13 C ATOM 111 O GLY A 7 -10.557 -8.446 -3.535 1.00 0.13 O ATOM 0 H GLY A 7 -10.955 -12.595 -2.550 1.00 0.16 H new ATOM 0 HA2 GLY A 7 -11.362 -9.945 -1.653 1.00 0.15 H new ATOM 0 HA3 GLY A 7 -9.832 -10.767 -1.883 1.00 0.15 H new ATOM 115 N LYS A 8 -10.229 -10.337 -4.713 1.00 0.14 N ATOM 116 CA LYS A 8 -9.954 -9.650 -5.965 1.00 0.16 C ATOM 117 C LYS A 8 -11.179 -8.874 -6.423 1.00 0.16 C ATOM 118 O LYS A 8 -11.087 -7.687 -6.722 1.00 0.18 O ATOM 119 CB LYS A 8 -9.519 -10.648 -7.042 1.00 0.21 C ATOM 120 CG LYS A 8 -8.659 -10.033 -8.138 1.00 0.94 C ATOM 121 CD LYS A 8 -7.209 -9.861 -7.698 1.00 1.38 C ATOM 122 CE LYS A 8 -6.483 -11.198 -7.604 1.00 1.68 C ATOM 123 NZ LYS A 8 -5.016 -11.057 -7.828 1.00 2.00 N ATOM 0 H LYS A 8 -10.189 -11.354 -4.774 1.00 0.14 H new ATOM 0 HA LYS A 8 -9.139 -8.946 -5.800 1.00 0.16 H new ATOM 0 HB2 LYS A 8 -8.964 -11.459 -6.570 1.00 0.21 H new ATOM 0 HB3 LYS A 8 -10.407 -11.090 -7.495 1.00 0.21 H new ATOM 0 HG2 LYS A 8 -8.696 -10.665 -9.025 1.00 0.94 H new ATOM 0 HG3 LYS A 8 -9.070 -9.063 -8.420 1.00 0.94 H new ATOM 0 HD2 LYS A 8 -6.689 -9.214 -8.405 1.00 1.38 H new ATOM 0 HD3 LYS A 8 -7.180 -9.363 -6.729 1.00 1.38 H new ATOM 0 HE2 LYS A 8 -6.659 -11.637 -6.622 1.00 1.68 H new ATOM 0 HE3 LYS A 8 -6.897 -11.887 -8.340 1.00 1.68 H new ATOM 0 HZ1 LYS A 8 -4.632 -11.954 -8.189 1.00 2.00 H new ATOM 0 HZ2 LYS A 8 -4.842 -10.302 -8.521 1.00 2.00 H new ATOM 0 HZ3 LYS A 8 -4.549 -10.817 -6.930 1.00 2.00 H new ATOM 137 N LYS A 9 -12.321 -9.546 -6.466 1.00 0.17 N ATOM 138 CA LYS A 9 -13.566 -8.913 -6.875 1.00 0.21 C ATOM 139 C LYS A 9 -13.964 -7.820 -5.886 1.00 0.18 C ATOM 140 O LYS A 9 -14.401 -6.741 -6.285 1.00 0.18 O ATOM 141 CB LYS A 9 -14.679 -9.953 -6.988 1.00 0.27 C ATOM 142 CG LYS A 9 -15.435 -9.891 -8.304 1.00 0.45 C ATOM 143 CD LYS A 9 -16.885 -9.478 -8.102 1.00 0.91 C ATOM 144 CE LYS A 9 -17.616 -9.360 -9.428 1.00 1.53 C ATOM 145 NZ LYS A 9 -19.086 -9.237 -9.247 1.00 1.85 N ATOM 0 H LYS A 9 -12.411 -10.532 -6.222 1.00 0.17 H new ATOM 0 HA LYS A 9 -13.413 -8.456 -7.852 1.00 0.21 H new ATOM 0 HB2 LYS A 9 -14.249 -10.948 -6.872 1.00 0.27 H new ATOM 0 HB3 LYS A 9 -15.382 -9.812 -6.167 1.00 0.27 H new ATOM 0 HG2 LYS A 9 -14.945 -9.183 -8.972 1.00 0.45 H new ATOM 0 HG3 LYS A 9 -15.399 -10.866 -8.791 1.00 0.45 H new ATOM 0 HD2 LYS A 9 -17.389 -10.210 -7.471 1.00 0.91 H new ATOM 0 HD3 LYS A 9 -16.924 -8.524 -7.577 1.00 0.91 H new ATOM 0 HE2 LYS A 9 -17.244 -8.491 -9.970 1.00 1.53 H new ATOM 0 HE3 LYS A 9 -17.399 -10.235 -10.040 1.00 1.53 H new ATOM 0 HZ1 LYS A 9 -19.545 -9.159 -10.177 1.00 1.85 H new ATOM 0 HZ2 LYS A 9 -19.446 -10.078 -8.752 1.00 1.85 H new ATOM 0 HZ3 LYS A 9 -19.297 -8.388 -8.685 1.00 1.85 H new ATOM 159 N ILE A 10 -13.798 -8.108 -4.598 1.00 0.16 N ATOM 160 CA ILE A 10 -14.120 -7.156 -3.542 1.00 0.17 C ATOM 161 C ILE A 10 -13.289 -5.895 -3.694 1.00 0.14 C ATOM 162 O ILE A 10 -13.822 -4.789 -3.748 1.00 0.15 O ATOM 163 CB ILE A 10 -13.884 -7.783 -2.141 1.00 0.19 C ATOM 164 CG1 ILE A 10 -15.107 -8.602 -1.723 1.00 0.23 C ATOM 165 CG2 ILE A 10 -13.569 -6.721 -1.093 1.00 0.19 C ATOM 166 CD1 ILE A 10 -14.805 -9.678 -0.697 1.00 0.28 C ATOM 0 H ILE A 10 -13.439 -9.001 -4.260 1.00 0.16 H new ATOM 0 HA ILE A 10 -15.175 -6.897 -3.631 1.00 0.17 H new ATOM 0 HB ILE A 10 -13.017 -8.440 -2.209 1.00 0.19 H new ATOM 0 HG12 ILE A 10 -15.862 -7.928 -1.317 1.00 0.23 H new ATOM 0 HG13 ILE A 10 -15.539 -9.069 -2.608 1.00 0.23 H new ATOM 0 HG21 ILE A 10 -13.410 -7.199 -0.127 1.00 0.19 H new ATOM 0 HG22 ILE A 10 -12.668 -6.180 -1.382 1.00 0.19 H new ATOM 0 HG23 ILE A 10 -14.403 -6.023 -1.020 1.00 0.19 H new ATOM 0 HD11 ILE A 10 -15.722 -10.215 -0.452 1.00 0.28 H new ATOM 0 HD12 ILE A 10 -14.074 -10.376 -1.106 1.00 0.28 H new ATOM 0 HD13 ILE A 10 -14.402 -9.218 0.205 1.00 0.28 H new ATOM 178 N VAL A 11 -11.985 -6.073 -3.799 1.00 0.12 N ATOM 179 CA VAL A 11 -11.076 -4.952 -3.937 1.00 0.11 C ATOM 180 C VAL A 11 -11.274 -4.240 -5.269 1.00 0.12 C ATOM 181 O VAL A 11 -11.286 -3.008 -5.320 1.00 0.12 O ATOM 182 CB VAL A 11 -9.611 -5.393 -3.775 1.00 0.14 C ATOM 183 CG1 VAL A 11 -8.681 -4.571 -4.655 1.00 0.16 C ATOM 184 CG2 VAL A 11 -9.207 -5.287 -2.314 1.00 0.17 C ATOM 0 H VAL A 11 -11.531 -6.986 -3.791 1.00 0.12 H new ATOM 0 HA VAL A 11 -11.308 -4.249 -3.137 1.00 0.11 H new ATOM 0 HB VAL A 11 -9.524 -6.431 -4.097 1.00 0.14 H new ATOM 0 HG11 VAL A 11 -7.654 -4.909 -4.515 1.00 0.16 H new ATOM 0 HG12 VAL A 11 -8.965 -4.695 -5.700 1.00 0.16 H new ATOM 0 HG13 VAL A 11 -8.757 -3.519 -4.381 1.00 0.16 H new ATOM 0 HG21 VAL A 11 -8.169 -5.600 -2.200 1.00 0.17 H new ATOM 0 HG22 VAL A 11 -9.314 -4.255 -1.981 1.00 0.17 H new ATOM 0 HG23 VAL A 11 -9.848 -5.931 -1.712 1.00 0.17 H new ATOM 194 N ASN A 12 -11.428 -5.009 -6.342 1.00 0.13 N ATOM 195 CA ASN A 12 -11.638 -4.423 -7.660 1.00 0.17 C ATOM 196 C ASN A 12 -12.868 -3.530 -7.649 1.00 0.17 C ATOM 197 O ASN A 12 -12.870 -2.459 -8.250 1.00 0.19 O ATOM 198 CB ASN A 12 -11.781 -5.499 -8.735 1.00 0.22 C ATOM 199 CG ASN A 12 -11.483 -4.960 -10.120 1.00 0.52 C ATOM 200 OD1 ASN A 12 -10.378 -4.485 -10.387 1.00 1.14 O ATOM 201 ND2 ASN A 12 -12.463 -5.019 -11.006 1.00 0.83 N ATOM 0 H ASN A 12 -11.412 -6.029 -6.326 1.00 0.13 H new ATOM 0 HA ASN A 12 -10.760 -3.823 -7.900 1.00 0.17 H new ATOM 0 HB2 ASN A 12 -11.105 -6.325 -8.514 1.00 0.22 H new ATOM 0 HB3 ASN A 12 -12.794 -5.902 -8.713 1.00 0.22 H new ATOM 0 HD21 ASN A 12 -12.318 -4.663 -11.951 1.00 0.83 H new ATOM 0 HD22 ASN A 12 -13.364 -5.420 -10.744 1.00 0.83 H new ATOM 208 N HIS A 13 -13.904 -3.961 -6.941 1.00 0.17 N ATOM 209 CA HIS A 13 -15.125 -3.182 -6.832 1.00 0.19 C ATOM 210 C HIS A 13 -14.901 -2.003 -5.891 1.00 0.16 C ATOM 211 O HIS A 13 -15.324 -0.885 -6.173 1.00 0.17 O ATOM 212 CB HIS A 13 -16.281 -4.052 -6.326 1.00 0.24 C ATOM 213 CG HIS A 13 -17.322 -4.327 -7.366 1.00 0.40 C ATOM 214 ND1 HIS A 13 -17.541 -5.595 -7.847 1.00 1.00 N ATOM 215 CD2 HIS A 13 -18.176 -3.470 -7.975 1.00 1.16 C ATOM 216 CE1 HIS A 13 -18.514 -5.481 -8.733 1.00 0.93 C ATOM 217 NE2 HIS A 13 -18.930 -4.213 -8.844 1.00 1.07 N ATOM 0 H HIS A 13 -13.921 -4.846 -6.435 1.00 0.17 H new ATOM 0 HA HIS A 13 -15.390 -2.807 -7.821 1.00 0.19 H new ATOM 0 HB2 HIS A 13 -15.881 -4.999 -5.965 1.00 0.24 H new ATOM 0 HB3 HIS A 13 -16.751 -3.559 -5.475 1.00 0.24 H new ATOM 0 HD2 HIS A 13 -18.248 -2.406 -7.808 1.00 1.16 H new ATOM 0 HE1 HIS A 13 -18.923 -6.307 -9.297 1.00 0.93 H new ATOM 0 HE2 HIS A 13 -19.667 -3.867 -9.458 1.00 1.07 H new ATOM 225 N LEU A 14 -14.217 -2.271 -4.783 1.00 0.15 N ATOM 226 CA LEU A 14 -13.899 -1.264 -3.771 1.00 0.14 C ATOM 227 C LEU A 14 -13.228 -0.034 -4.374 1.00 0.14 C ATOM 228 O LEU A 14 -13.718 1.078 -4.253 1.00 0.17 O ATOM 229 CB LEU A 14 -12.956 -1.884 -2.739 1.00 0.14 C ATOM 230 CG LEU A 14 -13.524 -2.075 -1.340 1.00 0.20 C ATOM 231 CD1 LEU A 14 -13.789 -0.735 -0.677 1.00 0.39 C ATOM 232 CD2 LEU A 14 -14.784 -2.917 -1.394 1.00 0.31 C ATOM 0 H LEU A 14 -13.864 -3.201 -4.558 1.00 0.15 H new ATOM 0 HA LEU A 14 -14.834 -0.944 -3.311 1.00 0.14 H new ATOM 0 HB2 LEU A 14 -12.630 -2.855 -3.112 1.00 0.14 H new ATOM 0 HB3 LEU A 14 -12.068 -1.256 -2.666 1.00 0.14 H new ATOM 0 HG LEU A 14 -12.787 -2.603 -0.736 1.00 0.20 H new ATOM 0 HD11 LEU A 14 -14.195 -0.897 0.322 1.00 0.39 H new ATOM 0 HD12 LEU A 14 -12.857 -0.175 -0.604 1.00 0.39 H new ATOM 0 HD13 LEU A 14 -14.506 -0.170 -1.272 1.00 0.39 H new ATOM 0 HD21 LEU A 14 -15.179 -3.045 -0.386 1.00 0.31 H new ATOM 0 HD22 LEU A 14 -15.528 -2.419 -2.015 1.00 0.31 H new ATOM 0 HD23 LEU A 14 -14.551 -3.893 -1.820 1.00 0.31 H new ATOM 244 N ARG A 15 -12.115 -0.261 -5.040 1.00 0.11 N ATOM 245 CA ARG A 15 -11.334 0.807 -5.654 1.00 0.13 C ATOM 246 C ARG A 15 -12.018 1.392 -6.870 1.00 0.13 C ATOM 247 O ARG A 15 -11.631 2.445 -7.353 1.00 0.14 O ATOM 248 CB ARG A 15 -9.984 0.258 -6.066 1.00 0.15 C ATOM 249 CG ARG A 15 -10.053 -0.822 -7.130 1.00 0.15 C ATOM 250 CD ARG A 15 -8.676 -1.394 -7.415 1.00 0.24 C ATOM 251 NE ARG A 15 -8.702 -2.369 -8.502 1.00 0.44 N ATOM 252 CZ ARG A 15 -7.642 -2.686 -9.246 1.00 0.49 C ATOM 253 NH1 ARG A 15 -6.478 -2.072 -9.052 1.00 0.57 N ATOM 254 NH2 ARG A 15 -7.757 -3.598 -10.200 1.00 0.86 N ATOM 0 H ARG A 15 -11.720 -1.192 -5.174 1.00 0.11 H new ATOM 0 HA ARG A 15 -11.226 1.603 -4.918 1.00 0.13 H new ATOM 0 HB2 ARG A 15 -9.368 1.078 -6.435 1.00 0.15 H new ATOM 0 HB3 ARG A 15 -9.484 -0.146 -5.186 1.00 0.15 H new ATOM 0 HG2 ARG A 15 -10.721 -1.619 -6.802 1.00 0.15 H new ATOM 0 HG3 ARG A 15 -10.476 -0.409 -8.046 1.00 0.15 H new ATOM 0 HD2 ARG A 15 -7.993 -0.584 -7.671 1.00 0.24 H new ATOM 0 HD3 ARG A 15 -8.286 -1.867 -6.513 1.00 0.24 H new ATOM 0 HE ARG A 15 -9.586 -2.836 -8.705 1.00 0.44 H new ATOM 0 HH11 ARG A 15 -6.393 -1.355 -8.331 1.00 0.57 H new ATOM 0 HH12 ARG A 15 -5.670 -2.318 -9.624 1.00 0.57 H new ATOM 0 HH21 ARG A 15 -8.654 -4.055 -10.363 1.00 0.86 H new ATOM 0 HH22 ARG A 15 -6.948 -3.843 -10.771 1.00 0.86 H new ATOM 268 N SER A 16 -13.006 0.701 -7.382 1.00 0.13 N ATOM 269 CA SER A 16 -13.719 1.178 -8.534 1.00 0.15 C ATOM 270 C SER A 16 -14.832 2.086 -8.064 1.00 0.14 C ATOM 271 O SER A 16 -15.111 3.109 -8.692 1.00 0.15 O ATOM 272 CB SER A 16 -14.229 0.010 -9.383 1.00 0.18 C ATOM 273 OG SER A 16 -15.414 -0.563 -8.852 1.00 0.22 O ATOM 0 H SER A 16 -13.333 -0.194 -7.017 1.00 0.13 H new ATOM 0 HA SER A 16 -13.055 1.751 -9.181 1.00 0.15 H new ATOM 0 HB2 SER A 16 -14.419 0.357 -10.399 1.00 0.18 H new ATOM 0 HB3 SER A 16 -13.455 -0.755 -9.447 1.00 0.18 H new ATOM 0 HG SER A 16 -15.325 -0.657 -7.881 1.00 0.22 H new ATOM 279 N ARG A 17 -15.476 1.732 -6.950 1.00 0.13 N ATOM 280 CA ARG A 17 -16.447 2.622 -6.424 1.00 0.14 C ATOM 281 C ARG A 17 -15.912 3.094 -5.086 1.00 0.13 C ATOM 282 O ARG A 17 -16.158 2.558 -4.006 1.00 0.13 O ATOM 283 CB ARG A 17 -17.791 1.887 -6.284 1.00 0.16 C ATOM 284 CG ARG A 17 -17.807 0.799 -5.221 1.00 0.15 C ATOM 285 CD ARG A 17 -18.514 -0.445 -5.695 1.00 0.18 C ATOM 286 NE ARG A 17 -18.675 -1.422 -4.615 1.00 0.23 N ATOM 287 CZ ARG A 17 -19.788 -2.128 -4.404 1.00 0.36 C ATOM 288 NH1 ARG A 17 -20.834 -1.975 -5.200 1.00 0.60 N ATOM 289 NH2 ARG A 17 -19.854 -2.988 -3.396 1.00 0.40 N ATOM 0 H ARG A 17 -15.334 0.866 -6.430 1.00 0.13 H new ATOM 0 HA ARG A 17 -16.624 3.479 -7.074 1.00 0.14 H new ATOM 0 HB2 ARG A 17 -18.567 2.616 -6.051 1.00 0.16 H new ATOM 0 HB3 ARG A 17 -18.049 1.442 -7.245 1.00 0.16 H new ATOM 0 HG2 ARG A 17 -16.783 0.550 -4.942 1.00 0.15 H new ATOM 0 HG3 ARG A 17 -18.299 1.176 -4.324 1.00 0.15 H new ATOM 0 HD2 ARG A 17 -19.493 -0.178 -6.093 1.00 0.18 H new ATOM 0 HD3 ARG A 17 -17.950 -0.895 -6.512 1.00 0.18 H new ATOM 0 HE ARG A 17 -17.887 -1.572 -3.985 1.00 0.23 H new ATOM 0 HH11 ARG A 17 -20.791 -1.316 -5.977 1.00 0.60 H new ATOM 0 HH12 ARG A 17 -21.683 -2.516 -5.036 1.00 0.60 H new ATOM 0 HH21 ARG A 17 -19.052 -3.112 -2.778 1.00 0.40 H new ATOM 0 HH22 ARG A 17 -20.707 -3.525 -3.239 1.00 0.40 H new ATOM 303 N LEU A 18 -15.173 4.143 -5.210 1.00 0.13 N ATOM 304 CA LEU A 18 -14.632 4.844 -4.072 1.00 0.13 C ATOM 305 C LEU A 18 -14.735 6.352 -4.324 1.00 0.14 C ATOM 306 O LEU A 18 -14.456 6.804 -5.434 1.00 0.16 O ATOM 307 CB LEU A 18 -13.183 4.393 -3.835 1.00 0.12 C ATOM 308 CG LEU A 18 -12.772 4.216 -2.368 1.00 0.17 C ATOM 309 CD1 LEU A 18 -13.201 5.401 -1.522 1.00 0.40 C ATOM 310 CD2 LEU A 18 -13.357 2.931 -1.809 1.00 0.61 C ATOM 0 H LEU A 18 -14.919 4.551 -6.110 1.00 0.13 H new ATOM 0 HA LEU A 18 -15.198 4.613 -3.169 1.00 0.13 H new ATOM 0 HB2 LEU A 18 -13.027 3.447 -4.353 1.00 0.12 H new ATOM 0 HB3 LEU A 18 -12.515 5.122 -4.295 1.00 0.12 H new ATOM 0 HG LEU A 18 -11.684 4.158 -2.332 1.00 0.17 H new ATOM 0 HD11 LEU A 18 -12.893 5.241 -0.489 1.00 0.40 H new ATOM 0 HD12 LEU A 18 -12.733 6.309 -1.903 1.00 0.40 H new ATOM 0 HD13 LEU A 18 -14.285 5.506 -1.566 1.00 0.40 H new ATOM 0 HD21 LEU A 18 -13.057 2.818 -0.767 1.00 0.61 H new ATOM 0 HD22 LEU A 18 -14.445 2.969 -1.872 1.00 0.61 H new ATOM 0 HD23 LEU A 18 -12.990 2.083 -2.386 1.00 0.61 H new ATOM 322 N ALA A 19 -15.155 7.128 -3.331 1.00 0.15 N ATOM 323 CA ALA A 19 -15.252 8.574 -3.503 1.00 0.16 C ATOM 324 C ALA A 19 -15.138 9.309 -2.175 1.00 0.17 C ATOM 325 O ALA A 19 -15.725 8.900 -1.178 1.00 0.16 O ATOM 326 CB ALA A 19 -16.564 8.934 -4.189 1.00 0.18 C ATOM 0 H ALA A 19 -15.431 6.787 -2.410 1.00 0.15 H new ATOM 0 HA ALA A 19 -14.417 8.889 -4.129 1.00 0.16 H new ATOM 0 HB1 ALA A 19 -16.625 10.015 -4.312 1.00 0.18 H new ATOM 0 HB2 ALA A 19 -16.607 8.454 -5.167 1.00 0.18 H new ATOM 0 HB3 ALA A 19 -17.400 8.590 -3.579 1.00 0.18 H new ATOM 332 N PHE A 20 -14.368 10.382 -2.152 1.00 0.17 N ATOM 333 CA PHE A 20 -14.229 11.167 -0.935 1.00 0.18 C ATOM 334 C PHE A 20 -14.452 12.635 -1.226 1.00 0.18 C ATOM 335 O PHE A 20 -14.115 13.125 -2.303 1.00 0.19 O ATOM 336 CB PHE A 20 -12.862 10.947 -0.275 1.00 0.19 C ATOM 337 CG PHE A 20 -11.686 11.535 -1.012 1.00 0.19 C ATOM 338 CD1 PHE A 20 -11.294 12.851 -0.801 1.00 1.04 C ATOM 339 CD2 PHE A 20 -10.958 10.761 -1.901 1.00 1.21 C ATOM 340 CE1 PHE A 20 -10.204 13.380 -1.465 1.00 0.99 C ATOM 341 CE2 PHE A 20 -9.870 11.285 -2.569 1.00 1.27 C ATOM 342 CZ PHE A 20 -9.491 12.596 -2.350 1.00 0.25 C ATOM 0 H PHE A 20 -13.835 10.728 -2.950 1.00 0.17 H new ATOM 0 HA PHE A 20 -14.991 10.830 -0.232 1.00 0.18 H new ATOM 0 HB2 PHE A 20 -12.889 11.372 0.728 1.00 0.19 H new ATOM 0 HB3 PHE A 20 -12.700 9.875 -0.163 1.00 0.19 H new ATOM 0 HD1 PHE A 20 -11.848 13.468 -0.109 1.00 1.04 H new ATOM 0 HD2 PHE A 20 -11.246 9.734 -2.073 1.00 1.21 H new ATOM 0 HE1 PHE A 20 -9.910 14.405 -1.292 1.00 0.99 H new ATOM 0 HE2 PHE A 20 -9.315 10.671 -3.263 1.00 1.27 H new ATOM 0 HZ PHE A 20 -8.638 13.007 -2.870 1.00 0.25 H new ATOM 352 N GLU A 21 -15.037 13.334 -0.276 1.00 0.18 N ATOM 353 CA GLU A 21 -15.286 14.745 -0.446 1.00 0.20 C ATOM 354 C GLU A 21 -14.233 15.538 0.303 1.00 0.20 C ATOM 355 O GLU A 21 -14.024 15.339 1.507 1.00 0.20 O ATOM 356 CB GLU A 21 -16.692 15.131 0.027 1.00 0.23 C ATOM 357 CG GLU A 21 -17.723 14.026 -0.150 1.00 0.29 C ATOM 358 CD GLU A 21 -19.110 14.438 0.298 1.00 0.43 C ATOM 359 OE1 GLU A 21 -19.227 15.380 1.110 1.00 1.17 O ATOM 360 OE2 GLU A 21 -20.095 13.817 -0.157 1.00 1.24 O ATOM 0 H GLU A 21 -15.346 12.949 0.616 1.00 0.18 H new ATOM 0 HA GLU A 21 -15.228 14.979 -1.509 1.00 0.20 H new ATOM 0 HB2 GLU A 21 -16.648 15.409 1.080 1.00 0.23 H new ATOM 0 HB3 GLU A 21 -17.021 16.013 -0.522 1.00 0.23 H new ATOM 0 HG2 GLU A 21 -17.758 13.733 -1.199 1.00 0.29 H new ATOM 0 HG3 GLU A 21 -17.409 13.149 0.416 1.00 0.29 H new ATOM 367 N TYR A 22 -13.542 16.395 -0.429 1.00 0.20 N ATOM 368 CA TYR A 22 -12.513 17.244 0.133 1.00 0.22 C ATOM 369 C TYR A 22 -12.805 18.686 -0.241 1.00 0.25 C ATOM 370 O TYR A 22 -12.987 19.002 -1.416 1.00 0.26 O ATOM 371 CB TYR A 22 -11.129 16.821 -0.374 1.00 0.22 C ATOM 372 CG TYR A 22 -10.025 17.804 -0.045 1.00 0.27 C ATOM 373 CD1 TYR A 22 -9.846 18.271 1.252 1.00 1.22 C ATOM 374 CD2 TYR A 22 -9.162 18.264 -1.032 1.00 1.24 C ATOM 375 CE1 TYR A 22 -8.841 19.167 1.554 1.00 1.27 C ATOM 376 CE2 TYR A 22 -8.154 19.161 -0.736 1.00 1.27 C ATOM 377 CZ TYR A 22 -7.999 19.609 0.558 1.00 0.50 C ATOM 378 OH TYR A 22 -6.994 20.498 0.862 1.00 0.63 O ATOM 0 H TYR A 22 -13.681 16.520 -1.432 1.00 0.20 H new ATOM 0 HA TYR A 22 -12.512 17.146 1.219 1.00 0.22 H new ATOM 0 HB2 TYR A 22 -10.877 15.851 0.055 1.00 0.22 H new ATOM 0 HB3 TYR A 22 -11.174 16.690 -1.455 1.00 0.22 H new ATOM 0 HD1 TYR A 22 -10.504 17.927 2.036 1.00 1.22 H new ATOM 0 HD2 TYR A 22 -9.281 17.915 -2.047 1.00 1.24 H new ATOM 0 HE1 TYR A 22 -8.715 19.520 2.567 1.00 1.27 H new ATOM 0 HE2 TYR A 22 -7.491 19.509 -1.514 1.00 1.27 H new ATOM 0 HH TYR A 22 -6.488 20.710 0.050 1.00 0.63 H new ATOM 388 N ASN A 23 -12.895 19.544 0.770 1.00 0.29 N ATOM 389 CA ASN A 23 -13.180 20.964 0.571 1.00 0.34 C ATOM 390 C ASN A 23 -14.561 21.142 -0.056 1.00 0.32 C ATOM 391 O ASN A 23 -14.847 22.149 -0.709 1.00 0.34 O ATOM 392 CB ASN A 23 -12.106 21.623 -0.296 1.00 0.38 C ATOM 393 CG ASN A 23 -11.722 23.001 0.206 1.00 0.58 C ATOM 394 OD1 ASN A 23 -10.860 23.143 1.073 1.00 1.22 O ATOM 395 ND2 ASN A 23 -12.347 24.030 -0.344 1.00 1.27 N ATOM 0 H ASN A 23 -12.773 19.278 1.747 1.00 0.29 H new ATOM 0 HA ASN A 23 -13.172 21.454 1.544 1.00 0.34 H new ATOM 0 HB2 ASN A 23 -11.221 20.988 -0.318 1.00 0.38 H new ATOM 0 HB3 ASN A 23 -12.468 21.701 -1.321 1.00 0.38 H new ATOM 0 HD21 ASN A 23 -12.119 24.980 -0.052 1.00 1.27 H new ATOM 0 HD22 ASN A 23 -13.056 23.873 -1.060 1.00 1.27 H new ATOM 402 N GLY A 24 -15.411 20.141 0.151 1.00 0.30 N ATOM 403 CA GLY A 24 -16.759 20.176 -0.377 1.00 0.30 C ATOM 404 C GLY A 24 -16.879 19.539 -1.749 1.00 0.28 C ATOM 405 O GLY A 24 -17.986 19.318 -2.238 1.00 0.33 O ATOM 0 H GLY A 24 -15.185 19.299 0.681 1.00 0.30 H new ATOM 0 HA2 GLY A 24 -17.427 19.663 0.315 1.00 0.30 H new ATOM 0 HA3 GLY A 24 -17.094 21.212 -0.434 1.00 0.30 H new ATOM 409 N GLN A 25 -15.749 19.233 -2.371 1.00 0.25 N ATOM 410 CA GLN A 25 -15.751 18.637 -3.701 1.00 0.25 C ATOM 411 C GLN A 25 -15.615 17.123 -3.625 1.00 0.22 C ATOM 412 O GLN A 25 -14.907 16.595 -2.771 1.00 0.22 O ATOM 413 CB GLN A 25 -14.623 19.217 -4.547 1.00 0.26 C ATOM 414 CG GLN A 25 -14.270 20.651 -4.183 1.00 0.31 C ATOM 415 CD GLN A 25 -14.073 21.530 -5.398 1.00 0.49 C ATOM 416 OE1 GLN A 25 -12.953 21.735 -5.859 1.00 1.04 O ATOM 417 NE2 GLN A 25 -15.167 22.044 -5.935 1.00 1.12 N ATOM 0 H GLN A 25 -14.821 19.387 -1.978 1.00 0.25 H new ATOM 0 HA GLN A 25 -16.706 18.873 -4.170 1.00 0.25 H new ATOM 0 HB2 GLN A 25 -13.737 18.593 -4.434 1.00 0.26 H new ATOM 0 HB3 GLN A 25 -14.910 19.177 -5.598 1.00 0.26 H new ATOM 0 HG2 GLN A 25 -15.062 21.069 -3.562 1.00 0.31 H new ATOM 0 HG3 GLN A 25 -13.359 20.656 -3.585 1.00 0.31 H new ATOM 0 HE21 GLN A 25 -16.079 21.849 -5.521 1.00 1.12 H new ATOM 0 HE22 GLN A 25 -15.099 22.635 -6.763 1.00 1.12 H new ATOM 426 N LEU A 26 -16.303 16.438 -4.520 1.00 0.22 N ATOM 427 CA LEU A 26 -16.286 14.979 -4.565 1.00 0.21 C ATOM 428 C LEU A 26 -15.184 14.437 -5.469 1.00 0.20 C ATOM 429 O LEU A 26 -15.258 14.549 -6.694 1.00 0.22 O ATOM 430 CB LEU A 26 -17.638 14.463 -5.051 1.00 0.25 C ATOM 431 CG LEU A 26 -18.622 14.075 -3.950 1.00 0.29 C ATOM 432 CD1 LEU A 26 -20.051 14.257 -4.435 1.00 0.41 C ATOM 433 CD2 LEU A 26 -18.383 12.636 -3.515 1.00 0.33 C ATOM 0 H LEU A 26 -16.888 16.870 -5.235 1.00 0.22 H new ATOM 0 HA LEU A 26 -16.085 14.627 -3.553 1.00 0.21 H new ATOM 0 HB2 LEU A 26 -18.099 15.230 -5.674 1.00 0.25 H new ATOM 0 HB3 LEU A 26 -17.469 13.594 -5.688 1.00 0.25 H new ATOM 0 HG LEU A 26 -18.464 14.726 -3.090 1.00 0.29 H new ATOM 0 HD11 LEU A 26 -20.743 13.977 -3.641 1.00 0.41 H new ATOM 0 HD12 LEU A 26 -20.213 15.300 -4.707 1.00 0.41 H new ATOM 0 HD13 LEU A 26 -20.223 13.625 -5.306 1.00 0.41 H new ATOM 0 HD21 LEU A 26 -19.091 12.371 -2.730 1.00 0.33 H new ATOM 0 HD22 LEU A 26 -18.521 11.971 -4.367 1.00 0.33 H new ATOM 0 HD23 LEU A 26 -17.366 12.535 -3.136 1.00 0.33 H new ATOM 445 N ILE A 27 -14.175 13.843 -4.856 1.00 0.19 N ATOM 446 CA ILE A 27 -13.065 13.253 -5.574 1.00 0.18 C ATOM 447 C ILE A 27 -13.177 11.733 -5.546 1.00 0.17 C ATOM 448 O ILE A 27 -13.081 11.106 -4.492 1.00 0.18 O ATOM 449 CB ILE A 27 -11.712 13.670 -4.967 1.00 0.18 C ATOM 450 CG1 ILE A 27 -11.543 15.190 -5.009 1.00 0.21 C ATOM 451 CG2 ILE A 27 -10.569 12.980 -5.696 1.00 0.19 C ATOM 452 CD1 ILE A 27 -11.997 15.889 -3.749 1.00 0.22 C ATOM 0 H ILE A 27 -14.105 13.757 -3.842 1.00 0.19 H new ATOM 0 HA ILE A 27 -13.108 13.614 -6.602 1.00 0.18 H new ATOM 0 HB ILE A 27 -11.693 13.358 -3.923 1.00 0.18 H new ATOM 0 HG12 ILE A 27 -10.493 15.425 -5.185 1.00 0.21 H new ATOM 0 HG13 ILE A 27 -12.105 15.585 -5.855 1.00 0.21 H new ATOM 0 HG21 ILE A 27 -9.620 13.285 -5.255 1.00 0.19 H new ATOM 0 HG22 ILE A 27 -10.680 11.899 -5.607 1.00 0.19 H new ATOM 0 HG23 ILE A 27 -10.587 13.261 -6.749 1.00 0.19 H new ATOM 0 HD11 ILE A 27 -11.846 16.963 -3.854 1.00 0.22 H new ATOM 0 HD12 ILE A 27 -13.055 15.686 -3.581 1.00 0.22 H new ATOM 0 HD13 ILE A 27 -11.418 15.523 -2.901 1.00 0.22 H new ATOM 464 N LYS A 28 -13.408 11.155 -6.708 1.00 0.17 N ATOM 465 CA LYS A 28 -13.543 9.713 -6.837 1.00 0.17 C ATOM 466 C LYS A 28 -12.179 9.037 -6.980 1.00 0.16 C ATOM 467 O LYS A 28 -11.242 9.599 -7.549 1.00 0.17 O ATOM 468 CB LYS A 28 -14.452 9.356 -8.025 1.00 0.19 C ATOM 469 CG LYS A 28 -14.276 10.253 -9.246 1.00 0.22 C ATOM 470 CD LYS A 28 -15.217 11.455 -9.213 1.00 0.28 C ATOM 471 CE LYS A 28 -16.666 11.055 -9.448 1.00 0.41 C ATOM 472 NZ LYS A 28 -17.518 12.226 -9.793 1.00 1.11 N ATOM 0 H LYS A 28 -13.507 11.665 -7.586 1.00 0.17 H new ATOM 0 HA LYS A 28 -14.006 9.340 -5.923 1.00 0.17 H new ATOM 0 HB2 LYS A 28 -14.259 8.324 -8.317 1.00 0.19 H new ATOM 0 HB3 LYS A 28 -15.491 9.406 -7.699 1.00 0.19 H new ATOM 0 HG2 LYS A 28 -13.244 10.601 -9.294 1.00 0.22 H new ATOM 0 HG3 LYS A 28 -14.459 9.674 -10.151 1.00 0.22 H new ATOM 0 HD2 LYS A 28 -15.131 11.955 -8.248 1.00 0.28 H new ATOM 0 HD3 LYS A 28 -14.912 12.174 -9.973 1.00 0.28 H new ATOM 0 HE2 LYS A 28 -16.714 10.322 -10.253 1.00 0.41 H new ATOM 0 HE3 LYS A 28 -17.059 10.572 -8.553 1.00 0.41 H new ATOM 0 HZ1 LYS A 28 -18.497 11.910 -9.945 1.00 1.11 H new ATOM 0 HZ2 LYS A 28 -17.493 12.915 -9.014 1.00 1.11 H new ATOM 0 HZ3 LYS A 28 -17.159 12.672 -10.661 1.00 1.11 H new ATOM 486 N ILE A 29 -12.097 7.825 -6.458 1.00 0.15 N ATOM 487 CA ILE A 29 -10.873 7.022 -6.488 1.00 0.14 C ATOM 488 C ILE A 29 -11.084 5.783 -7.337 1.00 0.13 C ATOM 489 O ILE A 29 -12.152 5.177 -7.286 1.00 0.14 O ATOM 490 CB ILE A 29 -10.391 6.582 -5.092 1.00 0.14 C ATOM 491 CG1 ILE A 29 -10.982 7.480 -3.999 1.00 0.14 C ATOM 492 CG2 ILE A 29 -8.868 6.626 -5.054 1.00 0.15 C ATOM 493 CD1 ILE A 29 -10.434 7.190 -2.621 1.00 0.16 C ATOM 0 H ILE A 29 -12.880 7.362 -5.997 1.00 0.15 H new ATOM 0 HA ILE A 29 -10.103 7.666 -6.914 1.00 0.14 H new ATOM 0 HB ILE A 29 -10.731 5.564 -4.902 1.00 0.14 H new ATOM 0 HG12 ILE A 29 -10.783 8.522 -4.249 1.00 0.14 H new ATOM 0 HG13 ILE A 29 -12.065 7.357 -3.984 1.00 0.14 H new ATOM 0 HG21 ILE A 29 -8.520 6.316 -4.069 1.00 0.15 H new ATOM 0 HG22 ILE A 29 -8.466 5.952 -5.810 1.00 0.15 H new ATOM 0 HG23 ILE A 29 -8.528 7.642 -5.256 1.00 0.15 H new ATOM 0 HD11 ILE A 29 -10.895 7.862 -1.897 1.00 0.16 H new ATOM 0 HD12 ILE A 29 -10.656 6.158 -2.351 1.00 0.16 H new ATOM 0 HD13 ILE A 29 -9.355 7.341 -2.619 1.00 0.16 H new ATOM 505 N LEU A 30 -10.088 5.430 -8.141 1.00 0.13 N ATOM 506 CA LEU A 30 -10.197 4.275 -9.011 1.00 0.13 C ATOM 507 C LEU A 30 -8.934 3.437 -8.950 1.00 0.13 C ATOM 508 O LEU A 30 -7.996 3.758 -8.221 1.00 0.13 O ATOM 509 CB LEU A 30 -10.466 4.694 -10.453 1.00 0.16 C ATOM 510 CG LEU A 30 -11.941 4.812 -10.843 1.00 0.22 C ATOM 511 CD1 LEU A 30 -12.423 6.246 -10.702 1.00 0.26 C ATOM 512 CD2 LEU A 30 -12.153 4.312 -12.264 1.00 0.31 C ATOM 0 H LEU A 30 -9.200 5.928 -8.206 1.00 0.13 H new ATOM 0 HA LEU A 30 -11.039 3.678 -8.660 1.00 0.13 H new ATOM 0 HB2 LEU A 30 -9.984 5.656 -10.629 1.00 0.16 H new ATOM 0 HB3 LEU A 30 -9.990 3.973 -11.117 1.00 0.16 H new ATOM 0 HG LEU A 30 -12.527 4.191 -10.166 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -13.474 6.306 -10.985 1.00 0.26 H new ATOM 0 HD12 LEU A 30 -12.306 6.569 -9.668 1.00 0.26 H new ATOM 0 HD13 LEU A 30 -11.835 6.893 -11.353 1.00 0.26 H new ATOM 0 HD21 LEU A 30 -13.207 4.402 -12.528 1.00 0.31 H new ATOM 0 HD22 LEU A 30 -11.554 4.908 -12.953 1.00 0.31 H new ATOM 0 HD23 LEU A 30 -11.850 3.267 -12.331 1.00 0.31 H new ATOM 524 N SER A 31 -8.915 2.388 -9.753 1.00 0.14 N ATOM 525 CA SER A 31 -7.797 1.460 -9.831 1.00 0.17 C ATOM 526 C SER A 31 -6.496 2.137 -10.277 1.00 0.18 C ATOM 527 O SER A 31 -5.413 1.574 -10.128 1.00 0.22 O ATOM 528 CB SER A 31 -8.174 0.339 -10.794 1.00 0.21 C ATOM 529 OG SER A 31 -9.012 0.834 -11.827 1.00 0.28 O ATOM 0 H SER A 31 -9.685 2.152 -10.378 1.00 0.14 H new ATOM 0 HA SER A 31 -7.605 1.065 -8.833 1.00 0.17 H new ATOM 0 HB2 SER A 31 -7.273 -0.096 -11.226 1.00 0.21 H new ATOM 0 HB3 SER A 31 -8.685 -0.457 -10.253 1.00 0.21 H new ATOM 0 HG SER A 31 -9.244 0.104 -12.438 1.00 0.28 H new ATOM 535 N LYS A 32 -6.600 3.339 -10.827 1.00 0.19 N ATOM 536 CA LYS A 32 -5.420 4.070 -11.272 1.00 0.22 C ATOM 537 C LYS A 32 -4.733 4.736 -10.092 1.00 0.20 C ATOM 538 O LYS A 32 -3.535 5.004 -10.121 1.00 0.24 O ATOM 539 CB LYS A 32 -5.805 5.133 -12.293 1.00 0.27 C ATOM 540 CG LYS A 32 -5.731 4.653 -13.732 1.00 0.38 C ATOM 541 CD LYS A 32 -5.742 5.814 -14.710 1.00 0.58 C ATOM 542 CE LYS A 32 -5.522 5.337 -16.134 1.00 1.10 C ATOM 543 NZ LYS A 32 -5.474 6.465 -17.101 1.00 1.55 N ATOM 0 H LYS A 32 -7.483 3.827 -10.975 1.00 0.19 H new ATOM 0 HA LYS A 32 -4.736 3.358 -11.734 1.00 0.22 H new ATOM 0 HB2 LYS A 32 -6.819 5.474 -12.085 1.00 0.27 H new ATOM 0 HB3 LYS A 32 -5.148 5.995 -12.173 1.00 0.27 H new ATOM 0 HG2 LYS A 32 -4.824 4.066 -13.874 1.00 0.38 H new ATOM 0 HG3 LYS A 32 -6.574 3.993 -13.940 1.00 0.38 H new ATOM 0 HD2 LYS A 32 -6.695 6.340 -14.643 1.00 0.58 H new ATOM 0 HD3 LYS A 32 -4.964 6.528 -14.439 1.00 0.58 H new ATOM 0 HE2 LYS A 32 -4.590 4.775 -16.187 1.00 1.10 H new ATOM 0 HE3 LYS A 32 -6.323 4.653 -16.415 1.00 1.10 H new ATOM 0 HZ1 LYS A 32 -5.322 6.094 -18.060 1.00 1.55 H new ATOM 0 HZ2 LYS A 32 -6.373 6.987 -17.070 1.00 1.55 H new ATOM 0 HZ3 LYS A 32 -4.693 7.105 -16.850 1.00 1.55 H new ATOM 557 N ASN A 33 -5.509 5.002 -9.056 1.00 0.17 N ATOM 558 CA ASN A 33 -4.988 5.636 -7.853 1.00 0.17 C ATOM 559 C ASN A 33 -4.908 4.638 -6.710 1.00 0.15 C ATOM 560 O ASN A 33 -4.255 4.888 -5.694 1.00 0.15 O ATOM 561 CB ASN A 33 -5.861 6.820 -7.451 1.00 0.18 C ATOM 562 CG ASN A 33 -5.449 8.095 -8.155 1.00 0.28 C ATOM 563 OD1 ASN A 33 -4.276 8.465 -8.174 1.00 0.91 O ATOM 564 ND2 ASN A 33 -6.411 8.765 -8.759 1.00 1.19 N ATOM 0 H ASN A 33 -6.506 4.789 -9.022 1.00 0.17 H new ATOM 0 HA ASN A 33 -3.983 5.998 -8.070 1.00 0.17 H new ATOM 0 HB2 ASN A 33 -6.902 6.598 -7.684 1.00 0.18 H new ATOM 0 HB3 ASN A 33 -5.800 6.966 -6.373 1.00 0.18 H new ATOM 0 HD21 ASN A 33 -6.194 9.623 -9.265 1.00 1.19 H new ATOM 0 HD22 ASN A 33 -7.372 8.425 -8.720 1.00 1.19 H new ATOM 571 N ILE A 34 -5.552 3.492 -6.904 1.00 0.14 N ATOM 572 CA ILE A 34 -5.580 2.450 -5.891 1.00 0.13 C ATOM 573 C ILE A 34 -5.080 1.121 -6.454 1.00 0.14 C ATOM 574 O ILE A 34 -5.532 0.659 -7.503 1.00 0.16 O ATOM 575 CB ILE A 34 -6.996 2.273 -5.296 1.00 0.14 C ATOM 576 CG1 ILE A 34 -7.257 3.336 -4.236 1.00 0.15 C ATOM 577 CG2 ILE A 34 -7.152 0.887 -4.679 1.00 0.14 C ATOM 578 CD1 ILE A 34 -8.699 3.394 -3.777 1.00 0.18 C ATOM 0 H ILE A 34 -6.062 3.263 -7.757 1.00 0.14 H new ATOM 0 HA ILE A 34 -4.911 2.765 -5.090 1.00 0.13 H new ATOM 0 HB ILE A 34 -7.721 2.382 -6.103 1.00 0.14 H new ATOM 0 HG12 ILE A 34 -6.618 3.143 -3.375 1.00 0.15 H new ATOM 0 HG13 ILE A 34 -6.971 4.310 -4.633 1.00 0.15 H new ATOM 0 HG21 ILE A 34 -8.155 0.783 -4.266 1.00 0.14 H new ATOM 0 HG22 ILE A 34 -6.995 0.128 -5.445 1.00 0.14 H new ATOM 0 HG23 ILE A 34 -6.417 0.758 -3.884 1.00 0.14 H new ATOM 0 HD11 ILE A 34 -8.810 4.173 -3.023 1.00 0.18 H new ATOM 0 HD12 ILE A 34 -9.343 3.618 -4.627 1.00 0.18 H new ATOM 0 HD13 ILE A 34 -8.984 2.432 -3.350 1.00 0.18 H new ATOM 590 N VAL A 35 -4.171 0.500 -5.723 1.00 0.13 N ATOM 591 CA VAL A 35 -3.581 -0.770 -6.128 1.00 0.14 C ATOM 592 C VAL A 35 -3.881 -1.841 -5.083 1.00 0.13 C ATOM 593 O VAL A 35 -3.922 -1.551 -3.891 1.00 0.16 O ATOM 594 CB VAL A 35 -2.053 -0.642 -6.327 1.00 0.17 C ATOM 595 CG1 VAL A 35 -1.458 -1.945 -6.843 1.00 0.22 C ATOM 596 CG2 VAL A 35 -1.737 0.498 -7.282 1.00 0.24 C ATOM 0 H VAL A 35 -3.820 0.858 -4.835 1.00 0.13 H new ATOM 0 HA VAL A 35 -4.023 -1.058 -7.082 1.00 0.14 H new ATOM 0 HB VAL A 35 -1.603 -0.424 -5.359 1.00 0.17 H new ATOM 0 HG11 VAL A 35 -0.382 -1.827 -6.974 1.00 0.22 H new ATOM 0 HG12 VAL A 35 -1.651 -2.742 -6.125 1.00 0.22 H new ATOM 0 HG13 VAL A 35 -1.914 -2.200 -7.800 1.00 0.22 H new ATOM 0 HG21 VAL A 35 -0.658 0.575 -7.412 1.00 0.24 H new ATOM 0 HG22 VAL A 35 -2.206 0.305 -8.247 1.00 0.24 H new ATOM 0 HG23 VAL A 35 -2.121 1.432 -6.873 1.00 0.24 H new ATOM 606 N ALA A 36 -4.107 -3.069 -5.536 1.00 0.14 N ATOM 607 CA ALA A 36 -4.416 -4.178 -4.638 1.00 0.13 C ATOM 608 C ALA A 36 -3.146 -4.809 -4.084 1.00 0.13 C ATOM 609 O ALA A 36 -2.303 -5.286 -4.846 1.00 0.15 O ATOM 610 CB ALA A 36 -5.242 -5.223 -5.372 1.00 0.14 C ATOM 0 H ALA A 36 -4.082 -3.323 -6.523 1.00 0.14 H new ATOM 0 HA ALA A 36 -4.991 -3.787 -3.799 1.00 0.13 H new ATOM 0 HB1 ALA A 36 -5.469 -6.048 -4.696 1.00 0.14 H new ATOM 0 HB2 ALA A 36 -6.172 -4.773 -5.721 1.00 0.14 H new ATOM 0 HB3 ALA A 36 -4.678 -5.598 -6.226 1.00 0.14 H new ATOM 616 N VAL A 37 -2.999 -4.817 -2.760 1.00 0.13 N ATOM 617 CA VAL A 37 -1.808 -5.403 -2.158 1.00 0.13 C ATOM 618 C VAL A 37 -2.134 -6.408 -1.050 1.00 0.14 C ATOM 619 O VAL A 37 -3.304 -6.672 -0.734 1.00 0.14 O ATOM 620 CB VAL A 37 -0.841 -4.330 -1.604 1.00 0.16 C ATOM 621 CG1 VAL A 37 0.589 -4.643 -2.020 1.00 0.21 C ATOM 622 CG2 VAL A 37 -1.232 -2.937 -2.069 1.00 0.15 C ATOM 0 H VAL A 37 -3.674 -4.433 -2.099 1.00 0.13 H new ATOM 0 HA VAL A 37 -1.316 -5.937 -2.971 1.00 0.13 H new ATOM 0 HB VAL A 37 -0.908 -4.350 -0.516 1.00 0.16 H new ATOM 0 HG11 VAL A 37 1.259 -3.880 -1.623 1.00 0.21 H new ATOM 0 HG12 VAL A 37 0.877 -5.618 -1.627 1.00 0.21 H new ATOM 0 HG13 VAL A 37 0.657 -4.655 -3.108 1.00 0.21 H new ATOM 0 HG21 VAL A 37 -0.532 -2.208 -1.662 1.00 0.15 H new ATOM 0 HG22 VAL A 37 -1.206 -2.896 -3.158 1.00 0.15 H new ATOM 0 HG23 VAL A 37 -2.239 -2.707 -1.721 1.00 0.15 H new ATOM 632 N GLY A 38 -1.081 -7.002 -0.494 1.00 0.16 N ATOM 633 CA GLY A 38 -1.247 -7.961 0.570 1.00 0.18 C ATOM 634 C GLY A 38 -1.671 -9.311 0.051 1.00 0.17 C ATOM 635 O GLY A 38 -1.001 -9.877 -0.813 1.00 0.18 O ATOM 0 H GLY A 38 -0.113 -6.831 -0.767 1.00 0.16 H new ATOM 0 HA2 GLY A 38 -0.310 -8.061 1.118 1.00 0.18 H new ATOM 0 HA3 GLY A 38 -1.991 -7.594 1.276 1.00 0.18 H new ATOM 639 N SER A 39 -2.797 -9.818 0.541 1.00 0.18 N ATOM 640 CA SER A 39 -3.281 -11.131 0.115 1.00 0.20 C ATOM 641 C SER A 39 -3.663 -11.128 -1.356 1.00 0.19 C ATOM 642 O SER A 39 -3.675 -12.170 -2.007 1.00 0.22 O ATOM 643 CB SER A 39 -4.464 -11.568 0.974 1.00 0.24 C ATOM 644 OG SER A 39 -4.166 -11.427 2.353 1.00 0.88 O ATOM 0 H SER A 39 -3.388 -9.348 1.226 1.00 0.18 H new ATOM 0 HA SER A 39 -2.469 -11.846 0.248 1.00 0.20 H new ATOM 0 HB2 SER A 39 -5.341 -10.970 0.724 1.00 0.24 H new ATOM 0 HB3 SER A 39 -4.713 -12.606 0.756 1.00 0.24 H new ATOM 0 HG SER A 39 -4.950 -11.074 2.823 1.00 0.88 H new ATOM 650 N LEU A 40 -3.953 -9.950 -1.881 1.00 0.18 N ATOM 651 CA LEU A 40 -4.306 -9.821 -3.276 1.00 0.19 C ATOM 652 C LEU A 40 -3.067 -9.958 -4.129 1.00 0.20 C ATOM 653 O LEU A 40 -3.123 -10.461 -5.247 1.00 0.24 O ATOM 654 CB LEU A 40 -4.955 -8.475 -3.525 1.00 0.19 C ATOM 655 CG LEU A 40 -6.364 -8.353 -2.976 1.00 0.20 C ATOM 656 CD1 LEU A 40 -6.440 -7.224 -1.970 1.00 0.21 C ATOM 657 CD2 LEU A 40 -7.352 -8.145 -4.107 1.00 0.22 C ATOM 0 H LEU A 40 -3.950 -9.073 -1.360 1.00 0.18 H new ATOM 0 HA LEU A 40 -5.013 -10.608 -3.539 1.00 0.19 H new ATOM 0 HB2 LEU A 40 -4.335 -7.697 -3.079 1.00 0.19 H new ATOM 0 HB3 LEU A 40 -4.978 -8.288 -4.599 1.00 0.19 H new ATOM 0 HG LEU A 40 -6.626 -9.279 -2.464 1.00 0.20 H new ATOM 0 HD11 LEU A 40 -7.457 -7.148 -1.584 1.00 0.21 H new ATOM 0 HD12 LEU A 40 -5.754 -7.423 -1.147 1.00 0.21 H new ATOM 0 HD13 LEU A 40 -6.164 -6.287 -2.453 1.00 0.21 H new ATOM 0 HD21 LEU A 40 -8.359 -8.059 -3.699 1.00 0.22 H new ATOM 0 HD22 LEU A 40 -7.100 -7.232 -4.647 1.00 0.22 H new ATOM 0 HD23 LEU A 40 -7.308 -8.994 -4.789 1.00 0.22 H new ATOM 669 N ARG A 41 -1.963 -9.446 -3.607 1.00 0.19 N ATOM 670 CA ARG A 41 -0.687 -9.520 -4.285 1.00 0.21 C ATOM 671 C ARG A 41 -0.047 -10.896 -4.094 1.00 0.20 C ATOM 672 O ARG A 41 0.606 -11.410 -5.004 1.00 0.23 O ATOM 673 CB ARG A 41 0.244 -8.418 -3.783 1.00 0.24 C ATOM 674 CG ARG A 41 1.266 -7.969 -4.815 1.00 0.67 C ATOM 675 CD ARG A 41 0.608 -7.341 -6.036 1.00 0.93 C ATOM 676 NE ARG A 41 1.472 -7.415 -7.213 1.00 1.26 N ATOM 677 CZ ARG A 41 1.403 -8.377 -8.141 1.00 1.76 C ATOM 678 NH1 ARG A 41 0.510 -9.357 -8.032 1.00 2.40 N ATOM 679 NH2 ARG A 41 2.234 -8.355 -9.176 1.00 2.26 N ATOM 0 H ARG A 41 -1.931 -8.970 -2.705 1.00 0.19 H new ATOM 0 HA ARG A 41 -0.856 -9.373 -5.352 1.00 0.21 H new ATOM 0 HB2 ARG A 41 -0.354 -7.559 -3.478 1.00 0.24 H new ATOM 0 HB3 ARG A 41 0.768 -8.773 -2.895 1.00 0.24 H new ATOM 0 HG2 ARG A 41 1.948 -7.250 -4.361 1.00 0.67 H new ATOM 0 HG3 ARG A 41 1.866 -8.824 -5.126 1.00 0.67 H new ATOM 0 HD2 ARG A 41 -0.334 -7.849 -6.243 1.00 0.93 H new ATOM 0 HD3 ARG A 41 0.369 -6.299 -5.825 1.00 0.93 H new ATOM 0 HE ARG A 41 2.174 -6.685 -7.335 1.00 1.26 H new ATOM 0 HH11 ARG A 41 -0.129 -9.379 -7.237 1.00 2.40 H new ATOM 0 HH12 ARG A 41 0.464 -10.086 -8.744 1.00 2.40 H new ATOM 0 HH21 ARG A 41 2.922 -7.607 -9.262 1.00 2.26 H new ATOM 0 HH22 ARG A 41 2.185 -9.086 -9.885 1.00 2.26 H new ATOM 693 N ARG A 42 -0.219 -11.483 -2.906 1.00 0.19 N ATOM 694 CA ARG A 42 0.353 -12.800 -2.629 1.00 0.20 C ATOM 695 C ARG A 42 -0.434 -13.895 -3.345 1.00 0.22 C ATOM 696 O ARG A 42 0.134 -14.937 -3.676 1.00 0.26 O ATOM 697 CB ARG A 42 0.338 -13.089 -1.124 1.00 0.22 C ATOM 698 CG ARG A 42 1.299 -12.242 -0.303 1.00 0.26 C ATOM 699 CD ARG A 42 0.690 -11.829 1.037 1.00 0.42 C ATOM 700 NE ARG A 42 -0.355 -12.755 1.489 1.00 1.18 N ATOM 701 CZ ARG A 42 -1.076 -12.600 2.603 1.00 1.76 C ATOM 702 NH1 ARG A 42 -0.860 -11.568 3.417 1.00 1.94 N ATOM 703 NH2 ARG A 42 -2.014 -13.488 2.900 1.00 2.64 N ATOM 0 H ARG A 42 -0.742 -11.073 -2.132 1.00 0.19 H new ATOM 0 HA ARG A 42 1.381 -12.794 -2.992 1.00 0.20 H new ATOM 0 HB2 ARG A 42 -0.673 -12.934 -0.748 1.00 0.22 H new ATOM 0 HB3 ARG A 42 0.578 -14.141 -0.968 1.00 0.22 H new ATOM 0 HG2 ARG A 42 2.218 -12.802 -0.127 1.00 0.26 H new ATOM 0 HG3 ARG A 42 1.572 -11.351 -0.868 1.00 0.26 H new ATOM 0 HD2 ARG A 42 1.477 -11.779 1.790 1.00 0.42 H new ATOM 0 HD3 ARG A 42 0.270 -10.827 0.948 1.00 0.42 H new ATOM 0 HE ARG A 42 -0.544 -13.575 0.912 1.00 1.18 H new ATOM 0 HH11 ARG A 42 -0.137 -10.884 3.193 1.00 1.94 H new ATOM 0 HH12 ARG A 42 -1.418 -11.461 4.264 1.00 1.94 H new ATOM 0 HH21 ARG A 42 -2.180 -14.281 2.280 1.00 2.64 H new ATOM 0 HH22 ARG A 42 -2.570 -13.378 3.748 1.00 2.64 H new ATOM 717 N GLU A 43 -1.726 -13.626 -3.611 1.00 0.24 N ATOM 718 CA GLU A 43 -2.612 -14.537 -4.343 1.00 0.27 C ATOM 719 C GLU A 43 -2.365 -15.991 -3.981 1.00 0.29 C ATOM 720 O GLU A 43 -1.700 -16.704 -4.741 1.00 0.49 O ATOM 721 CB GLU A 43 -2.395 -14.372 -5.854 1.00 0.44 C ATOM 722 CG GLU A 43 -2.017 -12.963 -6.293 1.00 0.64 C ATOM 723 CD GLU A 43 -1.100 -12.955 -7.506 1.00 0.74 C ATOM 724 OE1 GLU A 43 -0.276 -13.885 -7.638 1.00 1.41 O ATOM 725 OE2 GLU A 43 -1.190 -12.014 -8.324 1.00 1.44 O ATOM 0 H GLU A 43 -2.183 -12.762 -3.320 1.00 0.24 H new ATOM 0 HA GLU A 43 -3.634 -14.279 -4.065 1.00 0.27 H new ATOM 0 HB2 GLU A 43 -1.611 -15.059 -6.172 1.00 0.44 H new ATOM 0 HB3 GLU A 43 -3.307 -14.667 -6.373 1.00 0.44 H new ATOM 0 HG2 GLU A 43 -2.923 -12.403 -6.523 1.00 0.64 H new ATOM 0 HG3 GLU A 43 -1.526 -12.449 -5.467 1.00 0.64 H new ATOM 732 N GLU A 44 -2.858 -16.473 -2.843 1.00 0.45 N ATOM 733 CA GLU A 44 -2.582 -17.878 -2.568 1.00 0.85 C ATOM 734 C GLU A 44 -3.763 -18.779 -2.890 1.00 1.04 C ATOM 735 O GLU A 44 -4.021 -19.074 -4.058 1.00 1.93 O ATOM 736 CB GLU A 44 -2.172 -18.012 -1.087 1.00 1.03 C ATOM 737 CG GLU A 44 -3.069 -17.251 -0.106 1.00 1.32 C ATOM 738 CD GLU A 44 -2.281 -16.499 0.948 1.00 1.61 C ATOM 739 OE1 GLU A 44 -1.957 -17.101 1.994 1.00 2.31 O ATOM 740 OE2 GLU A 44 -1.975 -15.305 0.739 1.00 2.18 O ATOM 0 H GLU A 44 -3.405 -15.963 -2.149 1.00 0.45 H new ATOM 0 HA GLU A 44 -1.770 -18.207 -3.217 1.00 0.85 H new ATOM 0 HB2 GLU A 44 -2.174 -19.068 -0.817 1.00 1.03 H new ATOM 0 HB3 GLU A 44 -1.148 -17.656 -0.973 1.00 1.03 H new ATOM 0 HG2 GLU A 44 -3.690 -16.547 -0.660 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -3.743 -17.954 0.383 1.00 1.32 H new ATOM 747 N LYS A 45 -4.459 -19.205 -1.891 1.00 0.66 N ATOM 748 CA LYS A 45 -5.677 -19.964 -2.086 1.00 0.75 C ATOM 749 C LYS A 45 -6.853 -19.255 -1.461 1.00 0.38 C ATOM 750 O LYS A 45 -7.927 -19.118 -2.044 1.00 0.43 O ATOM 751 CB LYS A 45 -5.564 -21.393 -1.553 1.00 1.05 C ATOM 752 CG LYS A 45 -6.763 -22.261 -1.919 1.00 1.01 C ATOM 753 CD LYS A 45 -6.354 -23.702 -2.152 1.00 1.40 C ATOM 754 CE LYS A 45 -7.561 -24.565 -2.499 1.00 1.53 C ATOM 755 NZ LYS A 45 -7.184 -25.871 -3.103 1.00 2.08 N ATOM 0 H LYS A 45 -4.213 -19.045 -0.914 1.00 0.66 H new ATOM 0 HA LYS A 45 -5.839 -20.035 -3.161 1.00 0.75 H new ATOM 0 HB2 LYS A 45 -4.657 -21.851 -1.947 1.00 1.05 H new ATOM 0 HB3 LYS A 45 -5.461 -21.363 -0.468 1.00 1.05 H new ATOM 0 HG2 LYS A 45 -7.503 -22.216 -1.120 1.00 1.01 H new ATOM 0 HG3 LYS A 45 -7.239 -21.867 -2.817 1.00 1.01 H new ATOM 0 HD2 LYS A 45 -5.624 -23.750 -2.960 1.00 1.40 H new ATOM 0 HD3 LYS A 45 -5.867 -24.094 -1.259 1.00 1.40 H new ATOM 0 HE2 LYS A 45 -8.146 -24.743 -1.596 1.00 1.53 H new ATOM 0 HE3 LYS A 45 -8.203 -24.021 -3.192 1.00 1.53 H new ATOM 0 HZ1 LYS A 45 -8.044 -26.415 -3.318 1.00 2.08 H new ATOM 0 HZ2 LYS A 45 -6.650 -25.707 -3.980 1.00 2.08 H new ATOM 0 HZ3 LYS A 45 -6.594 -26.406 -2.434 1.00 2.08 H new ATOM 769 N MET A 46 -6.598 -18.796 -0.242 1.00 0.29 N ATOM 770 CA MET A 46 -7.626 -18.190 0.585 1.00 0.43 C ATOM 771 C MET A 46 -7.334 -16.748 0.927 1.00 0.45 C ATOM 772 O MET A 46 -6.185 -16.336 1.079 1.00 0.63 O ATOM 773 CB MET A 46 -7.771 -18.995 1.882 1.00 0.62 C ATOM 774 CG MET A 46 -7.820 -20.502 1.675 1.00 0.68 C ATOM 775 SD MET A 46 -9.451 -21.200 2.003 1.00 1.00 S ATOM 776 CE MET A 46 -10.387 -20.506 0.644 1.00 1.09 C ATOM 0 H MET A 46 -5.678 -18.834 0.196 1.00 0.29 H new ATOM 0 HA MET A 46 -8.551 -18.204 0.009 1.00 0.43 H new ATOM 0 HB2 MET A 46 -6.936 -18.756 2.541 1.00 0.62 H new ATOM 0 HB3 MET A 46 -8.680 -18.679 2.393 1.00 0.62 H new ATOM 0 HG2 MET A 46 -7.530 -20.733 0.650 1.00 0.68 H new ATOM 0 HG3 MET A 46 -7.088 -20.978 2.328 1.00 0.68 H new ATOM 0 HE1 MET A 46 -11.048 -21.268 0.231 1.00 1.09 H new ATOM 0 HE2 MET A 46 -10.981 -19.666 1.003 1.00 1.09 H new ATOM 0 HE3 MET A 46 -9.702 -20.162 -0.131 1.00 1.09 H new ATOM 786 N LEU A 47 -8.405 -15.998 1.043 1.00 0.36 N ATOM 787 CA LEU A 47 -8.359 -14.603 1.405 1.00 0.36 C ATOM 788 C LEU A 47 -8.984 -14.406 2.786 1.00 0.36 C ATOM 789 O LEU A 47 -9.898 -15.130 3.162 1.00 0.43 O ATOM 790 CB LEU A 47 -9.134 -13.805 0.358 1.00 0.34 C ATOM 791 CG LEU A 47 -8.279 -13.133 -0.723 1.00 0.33 C ATOM 792 CD1 LEU A 47 -7.823 -11.762 -0.266 1.00 0.32 C ATOM 793 CD2 LEU A 47 -7.073 -13.988 -1.075 1.00 0.34 C ATOM 0 H LEU A 47 -9.350 -16.348 0.885 1.00 0.36 H new ATOM 0 HA LEU A 47 -7.326 -14.258 1.441 1.00 0.36 H new ATOM 0 HB2 LEU A 47 -9.846 -14.472 -0.128 1.00 0.34 H new ATOM 0 HB3 LEU A 47 -9.714 -13.036 0.868 1.00 0.34 H new ATOM 0 HG LEU A 47 -8.897 -13.022 -1.614 1.00 0.33 H new ATOM 0 HD11 LEU A 47 -7.218 -11.301 -1.046 1.00 0.32 H new ATOM 0 HD12 LEU A 47 -8.693 -11.137 -0.065 1.00 0.32 H new ATOM 0 HD13 LEU A 47 -7.230 -11.860 0.643 1.00 0.32 H new ATOM 0 HD21 LEU A 47 -6.484 -13.488 -1.844 1.00 0.34 H new ATOM 0 HD22 LEU A 47 -6.459 -14.135 -0.186 1.00 0.34 H new ATOM 0 HD23 LEU A 47 -7.409 -14.956 -1.448 1.00 0.34 H new ATOM 805 N ASN A 48 -8.460 -13.473 3.560 1.00 0.32 N ATOM 806 CA ASN A 48 -9.017 -13.181 4.881 1.00 0.36 C ATOM 807 C ASN A 48 -8.868 -11.705 5.176 1.00 0.30 C ATOM 808 O ASN A 48 -9.753 -11.069 5.746 1.00 0.34 O ATOM 809 CB ASN A 48 -8.317 -13.993 5.967 1.00 0.46 C ATOM 810 CG ASN A 48 -9.289 -14.818 6.792 1.00 0.73 C ATOM 811 OD1 ASN A 48 -10.319 -15.282 6.291 1.00 1.01 O ATOM 812 ND2 ASN A 48 -8.976 -14.997 8.065 1.00 1.26 N ATOM 0 H ASN A 48 -7.653 -12.903 3.304 1.00 0.32 H new ATOM 0 HA ASN A 48 -10.072 -13.456 4.877 1.00 0.36 H new ATOM 0 HB2 ASN A 48 -7.584 -14.655 5.506 1.00 0.46 H new ATOM 0 HB3 ASN A 48 -7.769 -13.318 6.624 1.00 0.46 H new ATOM 0 HD21 ASN A 48 -9.595 -15.535 8.672 1.00 1.26 H new ATOM 0 HD22 ASN A 48 -8.116 -14.597 8.440 1.00 1.26 H new ATOM 819 N ASP A 49 -7.734 -11.179 4.759 1.00 0.25 N ATOM 820 CA ASP A 49 -7.413 -9.778 4.927 1.00 0.25 C ATOM 821 C ASP A 49 -6.967 -9.248 3.585 1.00 0.21 C ATOM 822 O ASP A 49 -6.221 -9.914 2.874 1.00 0.24 O ATOM 823 CB ASP A 49 -6.302 -9.572 5.961 1.00 0.32 C ATOM 824 CG ASP A 49 -6.694 -10.042 7.347 1.00 0.56 C ATOM 825 OD1 ASP A 49 -7.481 -9.345 8.016 1.00 1.23 O ATOM 826 OD2 ASP A 49 -6.212 -11.112 7.773 1.00 1.41 O ATOM 0 H ASP A 49 -7.005 -11.717 4.291 1.00 0.25 H new ATOM 0 HA ASP A 49 -8.293 -9.246 5.290 1.00 0.25 H new ATOM 0 HB2 ASP A 49 -5.409 -10.108 5.640 1.00 0.32 H new ATOM 0 HB3 ASP A 49 -6.041 -8.514 6.001 1.00 0.32 H new ATOM 831 N VAL A 50 -7.434 -8.078 3.220 1.00 0.17 N ATOM 832 CA VAL A 50 -7.072 -7.501 1.935 1.00 0.16 C ATOM 833 C VAL A 50 -6.385 -6.164 2.124 1.00 0.16 C ATOM 834 O VAL A 50 -6.842 -5.331 2.904 1.00 0.20 O ATOM 835 CB VAL A 50 -8.313 -7.315 1.027 1.00 0.18 C ATOM 836 CG1 VAL A 50 -8.721 -8.628 0.384 1.00 0.21 C ATOM 837 CG2 VAL A 50 -9.483 -6.737 1.811 1.00 0.21 C ATOM 0 H VAL A 50 -8.061 -7.506 3.785 1.00 0.17 H new ATOM 0 HA VAL A 50 -6.387 -8.197 1.450 1.00 0.16 H new ATOM 0 HB VAL A 50 -8.039 -6.612 0.240 1.00 0.18 H new ATOM 0 HG11 VAL A 50 -9.595 -8.468 -0.248 1.00 0.21 H new ATOM 0 HG12 VAL A 50 -7.899 -9.007 -0.223 1.00 0.21 H new ATOM 0 HG13 VAL A 50 -8.963 -9.354 1.160 1.00 0.21 H new ATOM 0 HG21 VAL A 50 -10.341 -6.617 1.149 1.00 0.21 H new ATOM 0 HG22 VAL A 50 -9.745 -7.413 2.625 1.00 0.21 H new ATOM 0 HG23 VAL A 50 -9.202 -5.767 2.221 1.00 0.21 H new ATOM 847 N ASP A 51 -5.271 -5.963 1.438 1.00 0.14 N ATOM 848 CA ASP A 51 -4.556 -4.712 1.561 1.00 0.14 C ATOM 849 C ASP A 51 -4.670 -3.907 0.276 1.00 0.13 C ATOM 850 O ASP A 51 -4.880 -4.459 -0.804 1.00 0.13 O ATOM 851 CB ASP A 51 -3.089 -4.974 1.911 1.00 0.15 C ATOM 852 CG ASP A 51 -2.921 -6.020 3.003 1.00 0.21 C ATOM 853 OD1 ASP A 51 -3.014 -7.232 2.700 1.00 1.10 O ATOM 854 OD2 ASP A 51 -2.688 -5.640 4.168 1.00 1.13 O ATOM 0 H ASP A 51 -4.851 -6.640 0.801 1.00 0.14 H new ATOM 0 HA ASP A 51 -5.003 -4.130 2.367 1.00 0.14 H new ATOM 0 HB2 ASP A 51 -2.560 -5.301 1.016 1.00 0.15 H new ATOM 0 HB3 ASP A 51 -2.625 -4.042 2.233 1.00 0.15 H new ATOM 859 N LEU A 52 -4.561 -2.601 0.396 1.00 0.13 N ATOM 860 CA LEU A 52 -4.649 -1.718 -0.752 1.00 0.13 C ATOM 861 C LEU A 52 -3.626 -0.597 -0.636 1.00 0.13 C ATOM 862 O LEU A 52 -3.193 -0.248 0.459 1.00 0.15 O ATOM 863 CB LEU A 52 -6.048 -1.097 -0.869 1.00 0.13 C ATOM 864 CG LEU A 52 -7.147 -1.993 -1.438 1.00 0.15 C ATOM 865 CD1 LEU A 52 -8.456 -1.228 -1.544 1.00 0.15 C ATOM 866 CD2 LEU A 52 -6.746 -2.527 -2.797 1.00 0.23 C ATOM 0 H LEU A 52 -4.410 -2.122 1.284 1.00 0.13 H new ATOM 0 HA LEU A 52 -4.448 -2.316 -1.641 1.00 0.13 H new ATOM 0 HB2 LEU A 52 -6.358 -0.765 0.122 1.00 0.13 H new ATOM 0 HB3 LEU A 52 -5.975 -0.208 -1.495 1.00 0.13 H new ATOM 0 HG LEU A 52 -7.287 -2.834 -0.759 1.00 0.15 H new ATOM 0 HD11 LEU A 52 -9.227 -1.882 -1.951 1.00 0.15 H new ATOM 0 HD12 LEU A 52 -8.757 -0.884 -0.555 1.00 0.15 H new ATOM 0 HD13 LEU A 52 -8.323 -0.369 -2.202 1.00 0.15 H new ATOM 0 HD21 LEU A 52 -7.541 -3.163 -3.187 1.00 0.23 H new ATOM 0 HD22 LEU A 52 -6.579 -1.694 -3.480 1.00 0.23 H new ATOM 0 HD23 LEU A 52 -5.829 -3.109 -2.703 1.00 0.23 H new ATOM 878 N LEU A 53 -3.286 -0.006 -1.763 1.00 0.13 N ATOM 879 CA LEU A 53 -2.315 1.071 -1.785 1.00 0.14 C ATOM 880 C LEU A 53 -2.799 2.228 -2.645 1.00 0.12 C ATOM 881 O LEU A 53 -2.879 2.112 -3.867 1.00 0.15 O ATOM 882 CB LEU A 53 -0.962 0.549 -2.297 1.00 0.18 C ATOM 883 CG LEU A 53 0.192 1.565 -2.365 1.00 0.24 C ATOM 884 CD1 LEU A 53 0.289 2.182 -3.752 1.00 0.63 C ATOM 885 CD2 LEU A 53 0.041 2.648 -1.303 1.00 0.75 C ATOM 0 H LEU A 53 -3.667 -0.253 -2.676 1.00 0.13 H new ATOM 0 HA LEU A 53 -2.191 1.441 -0.767 1.00 0.14 H new ATOM 0 HB2 LEU A 53 -0.651 -0.276 -1.656 1.00 0.18 H new ATOM 0 HB3 LEU A 53 -1.112 0.138 -3.295 1.00 0.18 H new ATOM 0 HG LEU A 53 1.118 1.027 -2.163 1.00 0.24 H new ATOM 0 HD11 LEU A 53 1.112 2.897 -3.776 1.00 0.63 H new ATOM 0 HD12 LEU A 53 0.469 1.398 -4.487 1.00 0.63 H new ATOM 0 HD13 LEU A 53 -0.644 2.694 -3.988 1.00 0.63 H new ATOM 0 HD21 LEU A 53 0.872 3.349 -1.378 1.00 0.75 H new ATOM 0 HD22 LEU A 53 -0.898 3.180 -1.457 1.00 0.75 H new ATOM 0 HD23 LEU A 53 0.041 2.190 -0.314 1.00 0.75 H new ATOM 897 N ILE A 54 -3.174 3.319 -1.998 1.00 0.11 N ATOM 898 CA ILE A 54 -3.597 4.512 -2.713 1.00 0.11 C ATOM 899 C ILE A 54 -2.446 5.518 -2.747 1.00 0.12 C ATOM 900 O ILE A 54 -1.905 5.900 -1.704 1.00 0.14 O ATOM 901 CB ILE A 54 -4.872 5.142 -2.105 1.00 0.13 C ATOM 902 CG1 ILE A 54 -5.240 6.438 -2.840 1.00 0.70 C ATOM 903 CG2 ILE A 54 -4.705 5.394 -0.619 1.00 0.62 C ATOM 904 CD1 ILE A 54 -6.494 7.103 -2.310 1.00 0.75 C ATOM 0 H ILE A 54 -3.194 3.404 -0.982 1.00 0.11 H new ATOM 0 HA ILE A 54 -3.856 4.223 -3.732 1.00 0.11 H new ATOM 0 HB ILE A 54 -5.689 4.432 -2.232 1.00 0.13 H new ATOM 0 HG12 ILE A 54 -4.408 7.138 -2.763 1.00 0.70 H new ATOM 0 HG13 ILE A 54 -5.375 6.219 -3.899 1.00 0.70 H new ATOM 0 HG21 ILE A 54 -5.618 5.837 -0.220 1.00 0.62 H new ATOM 0 HG22 ILE A 54 -4.507 4.451 -0.110 1.00 0.62 H new ATOM 0 HG23 ILE A 54 -3.870 6.076 -0.457 1.00 0.62 H new ATOM 0 HD11 ILE A 54 -6.691 8.012 -2.878 1.00 0.75 H new ATOM 0 HD12 ILE A 54 -7.338 6.421 -2.412 1.00 0.75 H new ATOM 0 HD13 ILE A 54 -6.356 7.354 -1.258 1.00 0.75 H new ATOM 916 N ILE A 55 -2.044 5.924 -3.941 1.00 0.12 N ATOM 917 CA ILE A 55 -0.954 6.876 -4.090 1.00 0.13 C ATOM 918 C ILE A 55 -1.495 8.285 -4.262 1.00 0.14 C ATOM 919 O ILE A 55 -2.550 8.491 -4.864 1.00 0.15 O ATOM 920 CB ILE A 55 -0.052 6.532 -5.285 1.00 0.16 C ATOM 921 CG1 ILE A 55 -0.891 6.018 -6.458 1.00 0.17 C ATOM 922 CG2 ILE A 55 0.990 5.505 -4.872 1.00 0.21 C ATOM 923 CD1 ILE A 55 -0.099 5.799 -7.722 1.00 0.46 C ATOM 0 H ILE A 55 -2.455 5.610 -4.820 1.00 0.12 H new ATOM 0 HA ILE A 55 -0.356 6.819 -3.180 1.00 0.13 H new ATOM 0 HB ILE A 55 0.464 7.435 -5.610 1.00 0.16 H new ATOM 0 HG12 ILE A 55 -1.365 5.080 -6.170 1.00 0.17 H new ATOM 0 HG13 ILE A 55 -1.691 6.730 -6.660 1.00 0.17 H new ATOM 0 HG21 ILE A 55 1.625 5.267 -5.726 1.00 0.21 H new ATOM 0 HG22 ILE A 55 1.602 5.911 -4.067 1.00 0.21 H new ATOM 0 HG23 ILE A 55 0.491 4.599 -4.527 1.00 0.21 H new ATOM 0 HD11 ILE A 55 -0.761 5.435 -8.508 1.00 0.46 H new ATOM 0 HD12 ILE A 55 0.353 6.740 -8.036 1.00 0.46 H new ATOM 0 HD13 ILE A 55 0.684 5.064 -7.538 1.00 0.46 H new ATOM 935 N VAL A 56 -0.765 9.248 -3.733 1.00 0.14 N ATOM 936 CA VAL A 56 -1.165 10.633 -3.789 1.00 0.15 C ATOM 937 C VAL A 56 -0.037 11.485 -4.367 1.00 0.16 C ATOM 938 O VAL A 56 1.096 11.422 -3.904 1.00 0.18 O ATOM 939 CB VAL A 56 -1.533 11.145 -2.384 1.00 0.15 C ATOM 940 CG1 VAL A 56 -2.291 12.448 -2.486 1.00 0.17 C ATOM 941 CG2 VAL A 56 -2.349 10.110 -1.609 1.00 0.15 C ATOM 0 H VAL A 56 0.121 9.088 -3.253 1.00 0.14 H new ATOM 0 HA VAL A 56 -2.040 10.711 -4.434 1.00 0.15 H new ATOM 0 HB VAL A 56 -0.607 11.316 -1.834 1.00 0.15 H new ATOM 0 HG11 VAL A 56 -2.546 12.800 -1.486 1.00 0.17 H new ATOM 0 HG12 VAL A 56 -1.670 13.192 -2.985 1.00 0.17 H new ATOM 0 HG13 VAL A 56 -3.205 12.293 -3.060 1.00 0.17 H new ATOM 0 HG21 VAL A 56 -2.592 10.503 -0.622 1.00 0.15 H new ATOM 0 HG22 VAL A 56 -3.270 9.894 -2.150 1.00 0.15 H new ATOM 0 HG23 VAL A 56 -1.767 9.194 -1.502 1.00 0.15 H new ATOM 951 N PRO A 57 -0.332 12.290 -5.394 1.00 0.17 N ATOM 952 CA PRO A 57 0.668 13.146 -6.043 1.00 0.19 C ATOM 953 C PRO A 57 0.980 14.430 -5.270 1.00 0.19 C ATOM 954 O PRO A 57 1.705 15.291 -5.763 1.00 0.21 O ATOM 955 CB PRO A 57 0.005 13.488 -7.375 1.00 0.23 C ATOM 956 CG PRO A 57 -1.458 13.452 -7.093 1.00 0.23 C ATOM 957 CD PRO A 57 -1.661 12.412 -6.023 1.00 0.19 C ATOM 0 HA PRO A 57 1.630 12.640 -6.122 1.00 0.19 H new ATOM 0 HB2 PRO A 57 0.315 14.471 -7.730 1.00 0.23 H new ATOM 0 HB3 PRO A 57 0.277 12.769 -8.148 1.00 0.23 H new ATOM 0 HG2 PRO A 57 -1.813 14.427 -6.759 1.00 0.23 H new ATOM 0 HG3 PRO A 57 -2.020 13.199 -7.992 1.00 0.23 H new ATOM 0 HD2 PRO A 57 -2.418 12.722 -5.302 1.00 0.19 H new ATOM 0 HD3 PRO A 57 -1.992 11.463 -6.445 1.00 0.19 H new ATOM 965 N GLU A 58 0.443 14.551 -4.064 1.00 0.19 N ATOM 966 CA GLU A 58 0.650 15.726 -3.249 1.00 0.22 C ATOM 967 C GLU A 58 0.624 15.354 -1.781 1.00 0.21 C ATOM 968 O GLU A 58 -0.247 14.609 -1.341 1.00 0.19 O ATOM 969 CB GLU A 58 -0.439 16.755 -3.532 1.00 0.26 C ATOM 970 CG GLU A 58 -0.061 17.780 -4.582 1.00 0.62 C ATOM 971 CD GLU A 58 -0.973 18.983 -4.554 1.00 1.03 C ATOM 972 OE1 GLU A 58 -0.769 19.862 -3.690 1.00 1.62 O ATOM 973 OE2 GLU A 58 -1.897 19.057 -5.388 1.00 1.85 O ATOM 0 H GLU A 58 -0.144 13.838 -3.630 1.00 0.19 H new ATOM 0 HA GLU A 58 1.623 16.153 -3.493 1.00 0.22 H new ATOM 0 HB2 GLU A 58 -1.341 16.235 -3.855 1.00 0.26 H new ATOM 0 HB3 GLU A 58 -0.685 17.273 -2.605 1.00 0.26 H new ATOM 0 HG2 GLU A 58 0.968 18.102 -4.421 1.00 0.62 H new ATOM 0 HG3 GLU A 58 -0.100 17.319 -5.569 1.00 0.62 H new ATOM 980 N LYS A 59 1.571 15.878 -1.030 1.00 0.24 N ATOM 981 CA LYS A 59 1.653 15.592 0.396 1.00 0.25 C ATOM 982 C LYS A 59 0.456 16.190 1.130 1.00 0.25 C ATOM 983 O LYS A 59 -0.054 15.612 2.097 1.00 0.25 O ATOM 984 CB LYS A 59 2.977 16.095 0.998 1.00 0.31 C ATOM 985 CG LYS A 59 3.500 17.402 0.409 1.00 0.47 C ATOM 986 CD LYS A 59 2.875 18.615 1.076 1.00 1.09 C ATOM 987 CE LYS A 59 3.576 19.902 0.666 1.00 1.71 C ATOM 988 NZ LYS A 59 3.250 21.033 1.575 1.00 2.18 N ATOM 0 H LYS A 59 2.296 16.504 -1.379 1.00 0.24 H new ATOM 0 HA LYS A 59 1.630 14.510 0.522 1.00 0.25 H new ATOM 0 HB2 LYS A 59 2.843 16.226 2.072 1.00 0.31 H new ATOM 0 HB3 LYS A 59 3.736 15.324 0.863 1.00 0.31 H new ATOM 0 HG2 LYS A 59 4.583 17.443 0.523 1.00 0.47 H new ATOM 0 HG3 LYS A 59 3.290 17.428 -0.660 1.00 0.47 H new ATOM 0 HD2 LYS A 59 1.820 18.674 0.810 1.00 1.09 H new ATOM 0 HD3 LYS A 59 2.925 18.502 2.159 1.00 1.09 H new ATOM 0 HE2 LYS A 59 4.654 19.741 0.661 1.00 1.71 H new ATOM 0 HE3 LYS A 59 3.288 20.162 -0.353 1.00 1.71 H new ATOM 0 HZ1 LYS A 59 3.749 21.888 1.258 1.00 2.18 H new ATOM 0 HZ2 LYS A 59 2.224 21.205 1.561 1.00 2.18 H new ATOM 0 HZ3 LYS A 59 3.548 20.797 2.543 1.00 2.18 H new ATOM 1002 N LYS A 60 -0.028 17.327 0.636 1.00 0.27 N ATOM 1003 CA LYS A 60 -1.173 17.978 1.247 1.00 0.28 C ATOM 1004 C LYS A 60 -2.418 17.162 0.935 1.00 0.25 C ATOM 1005 O LYS A 60 -3.285 16.962 1.790 1.00 0.26 O ATOM 1006 CB LYS A 60 -1.308 19.433 0.765 1.00 0.34 C ATOM 1007 CG LYS A 60 -1.815 19.596 -0.661 1.00 0.92 C ATOM 1008 CD LYS A 60 -3.253 20.085 -0.681 1.00 1.61 C ATOM 1009 CE LYS A 60 -3.820 20.112 -2.094 1.00 2.20 C ATOM 1010 NZ LYS A 60 -3.057 21.023 -2.991 1.00 2.58 N ATOM 0 H LYS A 60 0.354 17.809 -0.178 1.00 0.27 H new ATOM 0 HA LYS A 60 -1.038 18.023 2.328 1.00 0.28 H new ATOM 0 HB2 LYS A 60 -1.984 19.961 1.437 1.00 0.34 H new ATOM 0 HB3 LYS A 60 -0.335 19.918 0.846 1.00 0.34 H new ATOM 0 HG2 LYS A 60 -1.181 20.302 -1.197 1.00 0.92 H new ATOM 0 HG3 LYS A 60 -1.745 18.643 -1.186 1.00 0.92 H new ATOM 0 HD2 LYS A 60 -3.866 19.437 -0.055 1.00 1.61 H new ATOM 0 HD3 LYS A 60 -3.303 21.085 -0.250 1.00 1.61 H new ATOM 0 HE2 LYS A 60 -3.807 19.104 -2.508 1.00 2.20 H new ATOM 0 HE3 LYS A 60 -4.862 20.429 -2.059 1.00 2.20 H new ATOM 0 HZ1 LYS A 60 -3.510 21.048 -3.927 1.00 2.58 H new ATOM 0 HZ2 LYS A 60 -3.047 21.981 -2.586 1.00 2.58 H new ATOM 0 HZ3 LYS A 60 -2.081 20.678 -3.087 1.00 2.58 H new ATOM 1024 N LEU A 61 -2.474 16.652 -0.293 1.00 0.23 N ATOM 1025 CA LEU A 61 -3.581 15.833 -0.727 1.00 0.22 C ATOM 1026 C LEU A 61 -3.576 14.533 0.064 1.00 0.20 C ATOM 1027 O LEU A 61 -4.615 13.964 0.326 1.00 0.20 O ATOM 1028 CB LEU A 61 -3.469 15.560 -2.230 1.00 0.23 C ATOM 1029 CG LEU A 61 -4.759 15.120 -2.928 1.00 0.34 C ATOM 1030 CD1 LEU A 61 -5.833 16.190 -2.796 1.00 0.55 C ATOM 1031 CD2 LEU A 61 -4.488 14.817 -4.394 1.00 0.28 C ATOM 0 H LEU A 61 -1.756 16.798 -1.002 1.00 0.23 H new ATOM 0 HA LEU A 61 -4.522 16.352 -0.547 1.00 0.22 H new ATOM 0 HB2 LEU A 61 -3.105 16.464 -2.718 1.00 0.23 H new ATOM 0 HB3 LEU A 61 -2.714 14.789 -2.384 1.00 0.23 H new ATOM 0 HG LEU A 61 -5.120 14.212 -2.445 1.00 0.34 H new ATOM 0 HD11 LEU A 61 -6.741 15.858 -3.299 1.00 0.55 H new ATOM 0 HD12 LEU A 61 -6.045 16.364 -1.741 1.00 0.55 H new ATOM 0 HD13 LEU A 61 -5.483 17.115 -3.254 1.00 0.55 H new ATOM 0 HD21 LEU A 61 -5.413 14.505 -4.878 1.00 0.28 H new ATOM 0 HD22 LEU A 61 -4.105 15.711 -4.885 1.00 0.28 H new ATOM 0 HD23 LEU A 61 -3.752 14.017 -4.470 1.00 0.28 H new ATOM 1043 N LEU A 62 -2.381 14.074 0.421 1.00 0.18 N ATOM 1044 CA LEU A 62 -2.219 12.862 1.209 1.00 0.18 C ATOM 1045 C LEU A 62 -2.842 13.050 2.589 1.00 0.20 C ATOM 1046 O LEU A 62 -3.640 12.233 3.044 1.00 0.21 O ATOM 1047 CB LEU A 62 -0.728 12.525 1.340 1.00 0.19 C ATOM 1048 CG LEU A 62 -0.400 11.066 1.668 1.00 0.20 C ATOM 1049 CD1 LEU A 62 1.016 10.739 1.229 1.00 0.23 C ATOM 1050 CD2 LEU A 62 -0.561 10.789 3.155 1.00 0.25 C ATOM 0 H LEU A 62 -1.503 14.530 0.173 1.00 0.18 H new ATOM 0 HA LEU A 62 -2.725 12.037 0.707 1.00 0.18 H new ATOM 0 HB2 LEU A 62 -0.232 12.788 0.405 1.00 0.19 H new ATOM 0 HB3 LEU A 62 -0.299 13.157 2.117 1.00 0.19 H new ATOM 0 HG LEU A 62 -1.101 10.431 1.126 1.00 0.20 H new ATOM 0 HD11 LEU A 62 1.240 9.699 1.467 1.00 0.23 H new ATOM 0 HD12 LEU A 62 1.108 10.893 0.154 1.00 0.23 H new ATOM 0 HD13 LEU A 62 1.718 11.389 1.751 1.00 0.23 H new ATOM 0 HD21 LEU A 62 -0.322 9.745 3.359 1.00 0.25 H new ATOM 0 HD22 LEU A 62 0.113 11.433 3.720 1.00 0.25 H new ATOM 0 HD23 LEU A 62 -1.590 10.990 3.453 1.00 0.25 H new ATOM 1062 N LYS A 63 -2.478 14.144 3.239 1.00 0.22 N ATOM 1063 CA LYS A 63 -2.988 14.453 4.571 1.00 0.26 C ATOM 1064 C LYS A 63 -4.474 14.796 4.544 1.00 0.24 C ATOM 1065 O LYS A 63 -5.168 14.693 5.557 1.00 0.27 O ATOM 1066 CB LYS A 63 -2.213 15.626 5.157 1.00 0.33 C ATOM 1067 CG LYS A 63 -0.754 15.318 5.422 1.00 0.40 C ATOM 1068 CD LYS A 63 -0.039 16.520 6.011 1.00 0.56 C ATOM 1069 CE LYS A 63 1.289 16.132 6.638 1.00 1.38 C ATOM 1070 NZ LYS A 63 1.892 17.265 7.388 1.00 2.15 N ATOM 0 H LYS A 63 -1.829 14.837 2.866 1.00 0.22 H new ATOM 0 HA LYS A 63 -2.857 13.565 5.190 1.00 0.26 H new ATOM 0 HB2 LYS A 63 -2.278 16.472 4.473 1.00 0.33 H new ATOM 0 HB3 LYS A 63 -2.686 15.933 6.090 1.00 0.33 H new ATOM 0 HG2 LYS A 63 -0.676 14.473 6.107 1.00 0.40 H new ATOM 0 HG3 LYS A 63 -0.267 15.021 4.493 1.00 0.40 H new ATOM 0 HD2 LYS A 63 0.130 17.262 5.230 1.00 0.56 H new ATOM 0 HD3 LYS A 63 -0.674 16.988 6.763 1.00 0.56 H new ATOM 0 HE2 LYS A 63 1.141 15.287 7.311 1.00 1.38 H new ATOM 0 HE3 LYS A 63 1.977 15.803 5.859 1.00 1.38 H new ATOM 0 HZ1 LYS A 63 2.797 16.964 7.803 1.00 2.15 H new ATOM 0 HZ2 LYS A 63 2.056 18.062 6.740 1.00 2.15 H new ATOM 0 HZ3 LYS A 63 1.246 17.562 8.147 1.00 2.15 H new ATOM 1084 N HIS A 64 -4.947 15.211 3.385 1.00 0.22 N ATOM 1085 CA HIS A 64 -6.341 15.613 3.210 1.00 0.23 C ATOM 1086 C HIS A 64 -7.094 14.690 2.256 1.00 0.19 C ATOM 1087 O HIS A 64 -8.084 15.089 1.654 1.00 0.20 O ATOM 1088 CB HIS A 64 -6.414 17.060 2.730 1.00 0.29 C ATOM 1089 CG HIS A 64 -6.219 18.058 3.831 1.00 0.51 C ATOM 1090 ND1 HIS A 64 -7.285 18.712 4.401 1.00 1.18 N ATOM 1091 CD2 HIS A 64 -5.077 18.469 4.436 1.00 1.18 C ATOM 1092 CE1 HIS A 64 -6.775 19.499 5.331 1.00 1.14 C ATOM 1093 NE2 HIS A 64 -5.443 19.383 5.388 1.00 1.11 N ATOM 0 H HIS A 64 -4.384 15.281 2.538 1.00 0.22 H new ATOM 0 HA HIS A 64 -6.830 15.532 4.181 1.00 0.23 H new ATOM 0 HB2 HIS A 64 -5.655 17.221 1.964 1.00 0.29 H new ATOM 0 HB3 HIS A 64 -7.382 17.232 2.260 1.00 0.29 H new ATOM 0 HD2 HIS A 64 -4.073 18.139 4.211 1.00 1.18 H new ATOM 0 HE1 HIS A 64 -7.358 20.152 5.964 1.00 1.14 H new ATOM 0 HE2 HIS A 64 -4.818 19.882 6.021 1.00 1.11 H new ATOM 1101 N VAL A 65 -6.586 13.480 2.086 1.00 0.18 N ATOM 1102 CA VAL A 65 -7.176 12.515 1.166 1.00 0.18 C ATOM 1103 C VAL A 65 -8.326 11.730 1.788 1.00 0.19 C ATOM 1104 O VAL A 65 -9.126 11.125 1.075 1.00 0.22 O ATOM 1105 CB VAL A 65 -6.104 11.543 0.613 1.00 0.19 C ATOM 1106 CG1 VAL A 65 -5.886 10.355 1.540 1.00 0.23 C ATOM 1107 CG2 VAL A 65 -6.467 11.078 -0.785 1.00 0.21 C ATOM 0 H VAL A 65 -5.759 13.139 2.577 1.00 0.18 H new ATOM 0 HA VAL A 65 -7.590 13.096 0.342 1.00 0.18 H new ATOM 0 HB VAL A 65 -5.163 12.091 0.560 1.00 0.19 H new ATOM 0 HG11 VAL A 65 -5.127 9.697 1.116 1.00 0.23 H new ATOM 0 HG12 VAL A 65 -5.554 10.711 2.515 1.00 0.23 H new ATOM 0 HG13 VAL A 65 -6.820 9.805 1.653 1.00 0.23 H new ATOM 0 HG21 VAL A 65 -5.700 10.397 -1.152 1.00 0.21 H new ATOM 0 HG22 VAL A 65 -7.427 10.563 -0.759 1.00 0.21 H new ATOM 0 HG23 VAL A 65 -6.535 11.940 -1.449 1.00 0.21 H new ATOM 1117 N LEU A 66 -8.431 11.735 3.111 1.00 0.21 N ATOM 1118 CA LEU A 66 -9.514 11.008 3.760 1.00 0.25 C ATOM 1119 C LEU A 66 -10.467 11.923 4.560 1.00 0.24 C ATOM 1120 O LEU A 66 -10.919 11.534 5.637 1.00 0.28 O ATOM 1121 CB LEU A 66 -8.942 9.915 4.672 1.00 0.33 C ATOM 1122 CG LEU A 66 -7.982 10.400 5.760 1.00 1.22 C ATOM 1123 CD1 LEU A 66 -8.486 9.988 7.134 1.00 2.00 C ATOM 1124 CD2 LEU A 66 -6.583 9.852 5.519 1.00 2.15 C ATOM 0 H LEU A 66 -7.796 12.222 3.743 1.00 0.21 H new ATOM 0 HA LEU A 66 -10.108 10.557 2.966 1.00 0.25 H new ATOM 0 HB2 LEU A 66 -9.772 9.394 5.150 1.00 0.33 H new ATOM 0 HB3 LEU A 66 -8.422 9.185 4.052 1.00 0.33 H new ATOM 0 HG LEU A 66 -7.937 11.488 5.721 1.00 1.22 H new ATOM 0 HD11 LEU A 66 -7.792 10.341 7.897 1.00 2.00 H new ATOM 0 HD12 LEU A 66 -9.469 10.426 7.307 1.00 2.00 H new ATOM 0 HD13 LEU A 66 -8.559 8.902 7.184 1.00 2.00 H new ATOM 0 HD21 LEU A 66 -5.913 10.207 6.302 1.00 2.15 H new ATOM 0 HD22 LEU A 66 -6.612 8.762 5.532 1.00 2.15 H new ATOM 0 HD23 LEU A 66 -6.221 10.193 4.549 1.00 2.15 H new ATOM 1136 N PRO A 67 -10.821 13.137 4.059 1.00 0.20 N ATOM 1137 CA PRO A 67 -11.736 14.025 4.779 1.00 0.21 C ATOM 1138 C PRO A 67 -13.150 13.445 4.843 1.00 0.21 C ATOM 1139 O PRO A 67 -13.634 13.088 5.918 1.00 0.24 O ATOM 1140 CB PRO A 67 -11.714 15.328 3.973 1.00 0.20 C ATOM 1141 CG PRO A 67 -11.243 14.941 2.615 1.00 0.18 C ATOM 1142 CD PRO A 67 -10.365 13.738 2.790 1.00 0.18 C ATOM 0 HA PRO A 67 -11.433 14.169 5.816 1.00 0.21 H new ATOM 0 HB2 PRO A 67 -12.704 15.782 3.932 1.00 0.20 H new ATOM 0 HB3 PRO A 67 -11.047 16.060 4.427 1.00 0.20 H new ATOM 0 HG2 PRO A 67 -12.086 14.713 1.963 1.00 0.18 H new ATOM 0 HG3 PRO A 67 -10.692 15.758 2.149 1.00 0.18 H new ATOM 0 HD2 PRO A 67 -10.473 13.042 1.958 1.00 0.18 H new ATOM 0 HD3 PRO A 67 -9.312 14.017 2.837 1.00 0.18 H new ATOM 1150 N ASN A 68 -13.819 13.351 3.697 1.00 0.20 N ATOM 1151 CA ASN A 68 -15.160 12.783 3.656 1.00 0.21 C ATOM 1152 C ASN A 68 -15.172 11.567 2.751 1.00 0.19 C ATOM 1153 O ASN A 68 -15.779 11.584 1.685 1.00 0.18 O ATOM 1154 CB ASN A 68 -16.186 13.800 3.154 1.00 0.23 C ATOM 1155 CG ASN A 68 -16.327 15.007 4.058 1.00 0.27 C ATOM 1156 OD1 ASN A 68 -17.129 15.011 4.990 1.00 0.33 O ATOM 1157 ND2 ASN A 68 -15.558 16.048 3.777 1.00 0.27 N ATOM 0 H ASN A 68 -13.458 13.658 2.794 1.00 0.20 H new ATOM 0 HA ASN A 68 -15.434 12.497 4.672 1.00 0.21 H new ATOM 0 HB2 ASN A 68 -15.898 14.133 2.157 1.00 0.23 H new ATOM 0 HB3 ASN A 68 -17.155 13.311 3.059 1.00 0.23 H new ATOM 0 HD21 ASN A 68 -15.618 16.894 4.343 1.00 0.27 H new ATOM 0 HD22 ASN A 68 -14.905 16.003 2.994 1.00 0.27 H new ATOM 1164 N ILE A 69 -14.491 10.520 3.179 1.00 0.18 N ATOM 1165 CA ILE A 69 -14.411 9.297 2.398 1.00 0.17 C ATOM 1166 C ILE A 69 -15.711 8.496 2.494 1.00 0.18 C ATOM 1167 O ILE A 69 -16.319 8.391 3.564 1.00 0.20 O ATOM 1168 CB ILE A 69 -13.204 8.446 2.870 1.00 0.19 C ATOM 1169 CG1 ILE A 69 -12.858 7.370 1.845 1.00 0.19 C ATOM 1170 CG2 ILE A 69 -13.456 7.828 4.238 1.00 0.22 C ATOM 1171 CD1 ILE A 69 -11.876 7.847 0.800 1.00 0.28 C ATOM 0 H ILE A 69 -13.984 10.491 4.064 1.00 0.18 H new ATOM 0 HA ILE A 69 -14.265 9.564 1.351 1.00 0.17 H new ATOM 0 HB ILE A 69 -12.349 9.116 2.962 1.00 0.19 H new ATOM 0 HG12 ILE A 69 -12.441 6.505 2.361 1.00 0.19 H new ATOM 0 HG13 ILE A 69 -13.772 7.037 1.353 1.00 0.19 H new ATOM 0 HG21 ILE A 69 -12.589 7.239 4.536 1.00 0.22 H new ATOM 0 HG22 ILE A 69 -13.626 8.619 4.969 1.00 0.22 H new ATOM 0 HG23 ILE A 69 -14.334 7.183 4.190 1.00 0.22 H new ATOM 0 HD11 ILE A 69 -11.669 7.038 0.099 1.00 0.28 H new ATOM 0 HD12 ILE A 69 -12.301 8.694 0.261 1.00 0.28 H new ATOM 0 HD13 ILE A 69 -10.949 8.153 1.285 1.00 0.28 H new ATOM 1183 N ARG A 70 -16.158 7.980 1.351 1.00 0.17 N ATOM 1184 CA ARG A 70 -17.391 7.212 1.285 1.00 0.20 C ATOM 1185 C ARG A 70 -17.357 6.202 0.135 1.00 0.17 C ATOM 1186 O ARG A 70 -16.648 6.387 -0.856 1.00 0.17 O ATOM 1187 CB ARG A 70 -18.581 8.156 1.101 1.00 0.25 C ATOM 1188 CG ARG A 70 -19.846 7.690 1.801 1.00 1.04 C ATOM 1189 CD ARG A 70 -20.271 8.674 2.876 1.00 1.23 C ATOM 1190 NE ARG A 70 -19.210 8.918 3.855 1.00 1.76 N ATOM 1191 CZ ARG A 70 -19.154 9.990 4.642 1.00 2.27 C ATOM 1192 NH1 ARG A 70 -20.079 10.936 4.551 1.00 2.45 N ATOM 1193 NH2 ARG A 70 -18.160 10.124 5.512 1.00 3.18 N ATOM 0 H ARG A 70 -15.679 8.083 0.456 1.00 0.17 H new ATOM 0 HA ARG A 70 -17.496 6.662 2.220 1.00 0.20 H new ATOM 0 HB2 ARG A 70 -18.311 9.143 1.477 1.00 0.25 H new ATOM 0 HB3 ARG A 70 -18.785 8.265 0.036 1.00 0.25 H new ATOM 0 HG2 ARG A 70 -20.648 7.575 1.071 1.00 1.04 H new ATOM 0 HG3 ARG A 70 -19.678 6.710 2.247 1.00 1.04 H new ATOM 0 HD2 ARG A 70 -20.557 9.617 2.410 1.00 1.23 H new ATOM 0 HD3 ARG A 70 -21.154 8.291 3.388 1.00 1.23 H new ATOM 0 HE ARG A 70 -18.468 8.223 3.939 1.00 1.76 H new ATOM 0 HH11 ARG A 70 -20.838 10.844 3.876 1.00 2.45 H new ATOM 0 HH12 ARG A 70 -20.032 11.756 5.156 1.00 2.45 H new ATOM 0 HH21 ARG A 70 -17.439 9.405 5.577 1.00 3.18 H new ATOM 0 HH22 ARG A 70 -18.117 10.946 6.115 1.00 3.18 H new ATOM 1207 N ILE A 71 -18.112 5.126 0.288 1.00 0.18 N ATOM 1208 CA ILE A 71 -18.198 4.098 -0.737 1.00 0.17 C ATOM 1209 C ILE A 71 -19.586 4.122 -1.354 1.00 0.18 C ATOM 1210 O ILE A 71 -20.548 4.539 -0.712 1.00 0.21 O ATOM 1211 CB ILE A 71 -17.881 2.700 -0.159 1.00 0.17 C ATOM 1212 CG1 ILE A 71 -16.443 2.677 0.353 1.00 0.18 C ATOM 1213 CG2 ILE A 71 -18.084 1.613 -1.206 1.00 0.20 C ATOM 1214 CD1 ILE A 71 -16.040 1.369 0.997 1.00 0.19 C ATOM 0 H ILE A 71 -18.677 4.941 1.117 1.00 0.18 H new ATOM 0 HA ILE A 71 -17.455 4.306 -1.507 1.00 0.17 H new ATOM 0 HB ILE A 71 -18.566 2.501 0.665 1.00 0.17 H new ATOM 0 HG12 ILE A 71 -15.769 2.884 -0.478 1.00 0.18 H new ATOM 0 HG13 ILE A 71 -16.313 3.482 1.077 1.00 0.18 H new ATOM 0 HG21 ILE A 71 -17.853 0.641 -0.770 1.00 0.20 H new ATOM 0 HG22 ILE A 71 -19.120 1.623 -1.544 1.00 0.20 H new ATOM 0 HG23 ILE A 71 -17.424 1.797 -2.054 1.00 0.20 H new ATOM 0 HD11 ILE A 71 -15.005 1.433 1.334 1.00 0.19 H new ATOM 0 HD12 ILE A 71 -16.688 1.169 1.850 1.00 0.19 H new ATOM 0 HD13 ILE A 71 -16.136 0.561 0.271 1.00 0.19 H new ATOM 1226 N LYS A 72 -19.684 3.707 -2.605 1.00 0.18 N ATOM 1227 CA LYS A 72 -20.943 3.713 -3.297 1.00 0.21 C ATOM 1228 C LYS A 72 -21.452 2.301 -3.493 1.00 0.20 C ATOM 1229 O LYS A 72 -21.092 1.599 -4.439 1.00 0.26 O ATOM 1230 CB LYS A 72 -20.813 4.411 -4.637 1.00 0.30 C ATOM 1231 CG LYS A 72 -19.867 5.607 -4.618 1.00 0.41 C ATOM 1232 CD LYS A 72 -20.467 6.783 -3.861 1.00 0.78 C ATOM 1233 CE LYS A 72 -20.822 7.931 -4.793 1.00 1.53 C ATOM 1234 NZ LYS A 72 -21.832 8.839 -4.189 1.00 2.05 N ATOM 0 H LYS A 72 -18.898 3.362 -3.157 1.00 0.18 H new ATOM 0 HA LYS A 72 -21.661 4.260 -2.687 1.00 0.21 H new ATOM 0 HB2 LYS A 72 -20.461 3.693 -5.378 1.00 0.30 H new ATOM 0 HB3 LYS A 72 -21.799 4.745 -4.960 1.00 0.30 H new ATOM 0 HG2 LYS A 72 -18.924 5.318 -4.155 1.00 0.41 H new ATOM 0 HG3 LYS A 72 -19.641 5.909 -5.641 1.00 0.41 H new ATOM 0 HD2 LYS A 72 -21.361 6.456 -3.330 1.00 0.78 H new ATOM 0 HD3 LYS A 72 -19.759 7.131 -3.109 1.00 0.78 H new ATOM 0 HE2 LYS A 72 -19.922 8.497 -5.033 1.00 1.53 H new ATOM 0 HE3 LYS A 72 -21.207 7.532 -5.731 1.00 1.53 H new ATOM 0 HZ1 LYS A 72 -22.048 9.609 -4.854 1.00 2.05 H new ATOM 0 HZ2 LYS A 72 -22.700 8.305 -3.983 1.00 2.05 H new ATOM 0 HZ3 LYS A 72 -21.455 9.240 -3.306 1.00 2.05 H new ATOM 1248 N GLY A 73 -22.264 1.910 -2.564 1.00 0.20 N ATOM 1249 CA GLY A 73 -22.900 0.602 -2.592 1.00 0.25 C ATOM 1250 C GLY A 73 -22.389 -0.351 -1.528 1.00 0.22 C ATOM 1251 O GLY A 73 -22.679 -1.546 -1.572 1.00 0.25 O ATOM 0 H GLY A 73 -22.515 2.479 -1.756 1.00 0.20 H new ATOM 0 HA2 GLY A 73 -23.975 0.729 -2.467 1.00 0.25 H new ATOM 0 HA3 GLY A 73 -22.744 0.154 -3.573 1.00 0.25 H new ATOM 1255 N LEU A 74 -21.630 0.164 -0.577 1.00 0.17 N ATOM 1256 CA LEU A 74 -21.086 -0.648 0.492 1.00 0.15 C ATOM 1257 C LEU A 74 -20.770 0.219 1.707 1.00 0.15 C ATOM 1258 O LEU A 74 -20.571 1.429 1.579 1.00 0.15 O ATOM 1259 CB LEU A 74 -19.839 -1.349 -0.036 1.00 0.16 C ATOM 1260 CG LEU A 74 -18.764 -1.698 0.986 1.00 0.15 C ATOM 1261 CD1 LEU A 74 -19.138 -2.954 1.742 1.00 0.16 C ATOM 1262 CD2 LEU A 74 -17.426 -1.886 0.306 1.00 0.18 C ATOM 0 H LEU A 74 -21.376 1.150 -0.525 1.00 0.17 H new ATOM 0 HA LEU A 74 -21.811 -1.395 0.814 1.00 0.15 H new ATOM 0 HB2 LEU A 74 -20.150 -2.269 -0.530 1.00 0.16 H new ATOM 0 HB3 LEU A 74 -19.389 -0.714 -0.799 1.00 0.16 H new ATOM 0 HG LEU A 74 -18.686 -0.872 1.693 1.00 0.15 H new ATOM 0 HD11 LEU A 74 -18.359 -3.188 2.467 1.00 0.16 H new ATOM 0 HD12 LEU A 74 -20.083 -2.798 2.262 1.00 0.16 H new ATOM 0 HD13 LEU A 74 -19.242 -3.783 1.042 1.00 0.16 H new ATOM 0 HD21 LEU A 74 -16.671 -2.135 1.052 1.00 0.18 H new ATOM 0 HD22 LEU A 74 -17.498 -2.695 -0.421 1.00 0.18 H new ATOM 0 HD23 LEU A 74 -17.144 -0.964 -0.203 1.00 0.18 H new ATOM 1274 N SER A 75 -20.745 -0.397 2.880 1.00 0.15 N ATOM 1275 CA SER A 75 -20.465 0.314 4.112 1.00 0.15 C ATOM 1276 C SER A 75 -19.028 0.071 4.552 1.00 0.14 C ATOM 1277 O SER A 75 -18.406 -0.894 4.122 1.00 0.14 O ATOM 1278 CB SER A 75 -21.432 -0.152 5.185 1.00 0.17 C ATOM 1279 OG SER A 75 -22.595 0.657 5.212 1.00 0.29 O ATOM 0 H SER A 75 -20.917 -1.395 3.001 1.00 0.15 H new ATOM 0 HA SER A 75 -20.592 1.384 3.949 1.00 0.15 H new ATOM 0 HB2 SER A 75 -21.711 -1.189 5.001 1.00 0.17 H new ATOM 0 HB3 SER A 75 -20.942 -0.122 6.158 1.00 0.17 H new ATOM 0 HG SER A 75 -23.202 0.334 5.911 1.00 0.29 H new ATOM 1285 N PHE A 76 -18.488 0.962 5.375 1.00 0.15 N ATOM 1286 CA PHE A 76 -17.124 0.822 5.858 1.00 0.16 C ATOM 1287 C PHE A 76 -16.821 1.812 6.972 1.00 0.18 C ATOM 1288 O PHE A 76 -17.614 2.705 7.265 1.00 0.23 O ATOM 1289 CB PHE A 76 -16.128 1.015 4.711 1.00 0.15 C ATOM 1290 CG PHE A 76 -16.004 2.442 4.253 1.00 0.16 C ATOM 1291 CD1 PHE A 76 -17.128 3.161 3.881 1.00 1.21 C ATOM 1292 CD2 PHE A 76 -14.767 3.062 4.202 1.00 1.19 C ATOM 1293 CE1 PHE A 76 -17.025 4.468 3.467 1.00 1.23 C ATOM 1294 CE2 PHE A 76 -14.656 4.373 3.786 1.00 1.20 C ATOM 1295 CZ PHE A 76 -15.786 5.078 3.419 1.00 0.22 C ATOM 0 H PHE A 76 -18.976 1.788 5.721 1.00 0.15 H new ATOM 0 HA PHE A 76 -17.022 -0.186 6.260 1.00 0.16 H new ATOM 0 HB2 PHE A 76 -15.148 0.658 5.028 1.00 0.15 H new ATOM 0 HB3 PHE A 76 -16.435 0.397 3.867 1.00 0.15 H new ATOM 0 HD1 PHE A 76 -18.098 2.688 3.917 1.00 1.21 H new ATOM 0 HD2 PHE A 76 -13.882 2.515 4.490 1.00 1.19 H new ATOM 0 HE1 PHE A 76 -17.910 5.016 3.180 1.00 1.23 H new ATOM 0 HE2 PHE A 76 -13.687 4.848 3.747 1.00 1.20 H new ATOM 0 HZ PHE A 76 -15.701 6.105 3.095 1.00 0.22 H new ATOM 1305 N SER A 77 -15.660 1.638 7.575 1.00 0.19 N ATOM 1306 CA SER A 77 -15.178 2.516 8.632 1.00 0.21 C ATOM 1307 C SER A 77 -13.678 2.709 8.450 1.00 0.20 C ATOM 1308 O SER A 77 -12.948 1.729 8.328 1.00 0.21 O ATOM 1309 CB SER A 77 -15.480 1.929 10.005 1.00 0.25 C ATOM 1310 OG SER A 77 -16.076 0.645 9.897 1.00 0.34 O ATOM 0 H SER A 77 -15.018 0.879 7.346 1.00 0.19 H new ATOM 0 HA SER A 77 -15.687 3.478 8.570 1.00 0.21 H new ATOM 0 HB2 SER A 77 -14.559 1.857 10.583 1.00 0.25 H new ATOM 0 HB3 SER A 77 -16.147 2.597 10.550 1.00 0.25 H new ATOM 0 HG SER A 77 -16.257 0.292 10.793 1.00 0.34 H new ATOM 1316 N VAL A 78 -13.221 3.955 8.423 1.00 0.23 N ATOM 1317 CA VAL A 78 -11.802 4.234 8.207 1.00 0.25 C ATOM 1318 C VAL A 78 -11.093 4.713 9.478 1.00 0.22 C ATOM 1319 O VAL A 78 -11.636 5.500 10.259 1.00 0.26 O ATOM 1320 CB VAL A 78 -11.607 5.273 7.075 1.00 0.35 C ATOM 1321 CG1 VAL A 78 -12.147 6.638 7.478 1.00 0.42 C ATOM 1322 CG2 VAL A 78 -10.142 5.367 6.670 1.00 0.43 C ATOM 0 H VAL A 78 -13.804 4.783 8.546 1.00 0.23 H new ATOM 0 HA VAL A 78 -11.346 3.288 7.913 1.00 0.25 H new ATOM 0 HB VAL A 78 -12.177 4.932 6.211 1.00 0.35 H new ATOM 0 HG11 VAL A 78 -11.995 7.345 6.662 1.00 0.42 H new ATOM 0 HG12 VAL A 78 -13.212 6.558 7.695 1.00 0.42 H new ATOM 0 HG13 VAL A 78 -11.621 6.990 8.365 1.00 0.42 H new ATOM 0 HG21 VAL A 78 -10.031 6.103 5.874 1.00 0.43 H new ATOM 0 HG22 VAL A 78 -9.545 5.670 7.530 1.00 0.43 H new ATOM 0 HG23 VAL A 78 -9.799 4.395 6.316 1.00 0.43 H new ATOM 1332 N LYS A 79 -9.888 4.201 9.686 1.00 0.20 N ATOM 1333 CA LYS A 79 -9.064 4.560 10.828 1.00 0.21 C ATOM 1334 C LYS A 79 -7.666 4.956 10.348 1.00 0.21 C ATOM 1335 O LYS A 79 -6.856 4.099 10.000 1.00 0.26 O ATOM 1336 CB LYS A 79 -8.995 3.375 11.788 1.00 0.27 C ATOM 1337 CG LYS A 79 -8.956 3.775 13.246 1.00 1.04 C ATOM 1338 CD LYS A 79 -7.531 3.871 13.755 1.00 1.33 C ATOM 1339 CE LYS A 79 -6.825 2.524 13.678 1.00 2.05 C ATOM 1340 NZ LYS A 79 -5.801 2.368 14.741 1.00 2.54 N ATOM 0 H LYS A 79 -9.453 3.521 9.062 1.00 0.20 H new ATOM 0 HA LYS A 79 -9.500 5.411 11.352 1.00 0.21 H new ATOM 0 HB2 LYS A 79 -9.859 2.732 11.620 1.00 0.27 H new ATOM 0 HB3 LYS A 79 -8.108 2.784 11.559 1.00 0.27 H new ATOM 0 HG2 LYS A 79 -9.456 4.735 13.375 1.00 1.04 H new ATOM 0 HG3 LYS A 79 -9.508 3.046 13.840 1.00 1.04 H new ATOM 0 HD2 LYS A 79 -6.981 4.606 13.167 1.00 1.33 H new ATOM 0 HD3 LYS A 79 -7.534 4.224 14.786 1.00 1.33 H new ATOM 0 HE2 LYS A 79 -7.561 1.724 13.764 1.00 2.05 H new ATOM 0 HE3 LYS A 79 -6.352 2.418 12.702 1.00 2.05 H new ATOM 0 HZ1 LYS A 79 -5.578 1.360 14.863 1.00 2.54 H new ATOM 0 HZ2 LYS A 79 -4.939 2.883 14.471 1.00 2.54 H new ATOM 0 HZ3 LYS A 79 -6.168 2.752 15.635 1.00 2.54 H new ATOM 1354 N VAL A 80 -7.393 6.256 10.326 1.00 0.25 N ATOM 1355 CA VAL A 80 -6.104 6.760 9.853 1.00 0.26 C ATOM 1356 C VAL A 80 -5.022 6.686 10.935 1.00 0.29 C ATOM 1357 O VAL A 80 -5.287 6.907 12.121 1.00 0.40 O ATOM 1358 CB VAL A 80 -6.230 8.214 9.332 1.00 0.37 C ATOM 1359 CG1 VAL A 80 -6.745 9.146 10.421 1.00 0.50 C ATOM 1360 CG2 VAL A 80 -4.901 8.718 8.779 1.00 0.38 C ATOM 0 H VAL A 80 -8.044 6.980 10.629 1.00 0.25 H new ATOM 0 HA VAL A 80 -5.800 6.113 9.030 1.00 0.26 H new ATOM 0 HB VAL A 80 -6.956 8.209 8.519 1.00 0.37 H new ATOM 0 HG11 VAL A 80 -6.823 10.159 10.026 1.00 0.50 H new ATOM 0 HG12 VAL A 80 -7.727 8.810 10.753 1.00 0.50 H new ATOM 0 HG13 VAL A 80 -6.054 9.137 11.264 1.00 0.50 H new ATOM 0 HG21 VAL A 80 -5.020 9.741 8.421 1.00 0.38 H new ATOM 0 HG22 VAL A 80 -4.147 8.695 9.566 1.00 0.38 H new ATOM 0 HG23 VAL A 80 -4.584 8.079 7.954 1.00 0.38 H new ATOM 1370 N CYS A 81 -3.811 6.344 10.507 1.00 0.26 N ATOM 1371 CA CYS A 81 -2.656 6.231 11.384 1.00 0.33 C ATOM 1372 C CYS A 81 -1.384 6.637 10.637 1.00 0.29 C ATOM 1373 O CYS A 81 -1.209 6.320 9.443 1.00 0.25 O ATOM 1374 CB CYS A 81 -2.514 4.795 11.898 1.00 0.41 C ATOM 1375 SG CYS A 81 -3.994 4.152 12.710 1.00 1.05 S ATOM 0 H CYS A 81 -3.604 6.136 9.530 1.00 0.26 H new ATOM 0 HA CYS A 81 -2.802 6.899 12.233 1.00 0.33 H new ATOM 0 HB2 CYS A 81 -2.260 4.144 11.061 1.00 0.41 H new ATOM 0 HB3 CYS A 81 -1.680 4.752 12.599 1.00 0.41 H new ATOM 0 HG CYS A 81 -4.867 5.106 12.839 1.00 1.05 H new ATOM 1381 N GLY A 82 -0.499 7.339 11.340 1.00 0.34 N ATOM 1382 CA GLY A 82 0.744 7.775 10.743 1.00 0.35 C ATOM 1383 C GLY A 82 0.510 8.584 9.493 1.00 0.34 C ATOM 1384 O GLY A 82 -0.327 9.489 9.471 1.00 0.37 O ATOM 0 H GLY A 82 -0.624 7.612 12.315 1.00 0.34 H new ATOM 0 HA2 GLY A 82 1.304 8.372 11.463 1.00 0.35 H new ATOM 0 HA3 GLY A 82 1.357 6.906 10.504 1.00 0.35 H new ATOM 1388 N GLU A 83 1.267 8.274 8.464 1.00 0.33 N ATOM 1389 CA GLU A 83 1.137 8.946 7.191 1.00 0.33 C ATOM 1390 C GLU A 83 0.419 8.039 6.198 1.00 0.27 C ATOM 1391 O GLU A 83 -0.689 8.333 5.751 1.00 0.27 O ATOM 1392 CB GLU A 83 2.519 9.344 6.668 1.00 0.39 C ATOM 1393 CG GLU A 83 3.381 10.023 7.723 1.00 0.88 C ATOM 1394 CD GLU A 83 4.485 10.871 7.135 1.00 1.67 C ATOM 1395 OE1 GLU A 83 4.196 11.702 6.250 1.00 2.27 O ATOM 1396 OE2 GLU A 83 5.644 10.727 7.576 1.00 2.45 O ATOM 0 H GLU A 83 1.987 7.552 8.486 1.00 0.33 H new ATOM 0 HA GLU A 83 0.545 9.853 7.318 1.00 0.33 H new ATOM 0 HB2 GLU A 83 3.033 8.455 6.304 1.00 0.39 H new ATOM 0 HB3 GLU A 83 2.400 10.015 5.817 1.00 0.39 H new ATOM 0 HG2 GLU A 83 2.748 10.648 8.353 1.00 0.88 H new ATOM 0 HG3 GLU A 83 3.821 9.262 8.368 1.00 0.88 H new ATOM 1403 N ARG A 84 1.061 6.925 5.874 1.00 0.24 N ATOM 1404 CA ARG A 84 0.521 5.967 4.940 1.00 0.21 C ATOM 1405 C ARG A 84 -0.159 4.774 5.601 1.00 0.21 C ATOM 1406 O ARG A 84 -0.129 3.688 5.041 1.00 0.26 O ATOM 1407 CB ARG A 84 1.643 5.461 4.021 1.00 0.25 C ATOM 1408 CG ARG A 84 2.911 5.037 4.743 1.00 0.88 C ATOM 1409 CD ARG A 84 4.085 4.962 3.785 1.00 1.10 C ATOM 1410 NE ARG A 84 4.760 3.665 3.835 1.00 1.55 N ATOM 1411 CZ ARG A 84 5.895 3.397 3.190 1.00 2.14 C ATOM 1412 NH1 ARG A 84 6.502 4.349 2.486 1.00 2.53 N ATOM 1413 NH2 ARG A 84 6.433 2.181 3.263 1.00 2.95 N ATOM 0 H ARG A 84 1.971 6.667 6.256 1.00 0.24 H new ATOM 0 HA ARG A 84 -0.250 6.492 4.375 1.00 0.21 H new ATOM 0 HB2 ARG A 84 1.269 4.615 3.445 1.00 0.25 H new ATOM 0 HB3 ARG A 84 1.892 6.247 3.308 1.00 0.25 H new ATOM 0 HG2 ARG A 84 3.133 5.746 5.541 1.00 0.88 H new ATOM 0 HG3 ARG A 84 2.758 4.065 5.213 1.00 0.88 H new ATOM 0 HD2 ARG A 84 3.735 5.148 2.770 1.00 1.10 H new ATOM 0 HD3 ARG A 84 4.799 5.750 4.026 1.00 1.10 H new ATOM 0 HE ARG A 84 4.338 2.924 4.395 1.00 1.55 H new ATOM 0 HH11 ARG A 84 6.099 5.285 2.440 1.00 2.53 H new ATOM 0 HH12 ARG A 84 7.371 4.143 1.993 1.00 2.53 H new ATOM 0 HH21 ARG A 84 5.976 1.453 3.813 1.00 2.95 H new ATOM 0 HH22 ARG A 84 7.302 1.977 2.769 1.00 2.95 H new ATOM 1427 N LYS A 85 -0.778 4.923 6.768 1.00 0.21 N ATOM 1428 CA LYS A 85 -1.436 3.768 7.365 1.00 0.22 C ATOM 1429 C LYS A 85 -2.903 4.037 7.650 1.00 0.21 C ATOM 1430 O LYS A 85 -3.241 4.809 8.530 1.00 0.25 O ATOM 1431 CB LYS A 85 -0.727 3.332 8.644 1.00 0.26 C ATOM 1432 CG LYS A 85 0.643 2.723 8.398 1.00 0.46 C ATOM 1433 CD LYS A 85 1.155 1.993 9.626 1.00 1.10 C ATOM 1434 CE LYS A 85 2.402 1.182 9.311 1.00 1.79 C ATOM 1435 NZ LYS A 85 2.639 0.119 10.322 1.00 2.46 N ATOM 0 H LYS A 85 -0.838 5.792 7.299 1.00 0.21 H new ATOM 0 HA LYS A 85 -1.377 2.959 6.637 1.00 0.22 H new ATOM 0 HB2 LYS A 85 -0.620 4.194 9.303 1.00 0.26 H new ATOM 0 HB3 LYS A 85 -1.350 2.606 9.167 1.00 0.26 H new ATOM 0 HG2 LYS A 85 0.589 2.031 7.558 1.00 0.46 H new ATOM 0 HG3 LYS A 85 1.347 3.508 8.120 1.00 0.46 H new ATOM 0 HD2 LYS A 85 1.377 2.714 10.413 1.00 1.10 H new ATOM 0 HD3 LYS A 85 0.377 1.333 10.009 1.00 1.10 H new ATOM 0 HE2 LYS A 85 2.302 0.729 8.324 1.00 1.79 H new ATOM 0 HE3 LYS A 85 3.266 1.845 9.271 1.00 1.79 H new ATOM 0 HZ1 LYS A 85 3.498 -0.412 10.073 1.00 2.46 H new ATOM 0 HZ2 LYS A 85 2.760 0.552 11.260 1.00 2.46 H new ATOM 0 HZ3 LYS A 85 1.825 -0.528 10.342 1.00 2.46 H new ATOM 1449 N CYS A 86 -3.781 3.408 6.899 1.00 0.20 N ATOM 1450 CA CYS A 86 -5.203 3.580 7.109 1.00 0.19 C ATOM 1451 C CYS A 86 -5.878 2.221 7.195 1.00 0.18 C ATOM 1452 O CYS A 86 -5.891 1.454 6.237 1.00 0.20 O ATOM 1453 CB CYS A 86 -5.817 4.412 5.981 1.00 0.21 C ATOM 1454 SG CYS A 86 -5.246 6.127 5.930 1.00 0.58 S ATOM 0 H CYS A 86 -3.536 2.774 6.139 1.00 0.20 H new ATOM 0 HA CYS A 86 -5.359 4.113 8.047 1.00 0.19 H new ATOM 0 HB2 CYS A 86 -5.588 3.936 5.028 1.00 0.21 H new ATOM 0 HB3 CYS A 86 -6.902 4.405 6.088 1.00 0.21 H new ATOM 0 HG CYS A 86 -4.274 6.235 5.074 1.00 0.58 H new ATOM 1460 N VAL A 87 -6.445 1.933 8.349 1.00 0.18 N ATOM 1461 CA VAL A 87 -7.121 0.668 8.563 1.00 0.19 C ATOM 1462 C VAL A 87 -8.620 0.859 8.426 1.00 0.17 C ATOM 1463 O VAL A 87 -9.222 1.634 9.162 1.00 0.19 O ATOM 1464 CB VAL A 87 -6.807 0.078 9.956 1.00 0.26 C ATOM 1465 CG1 VAL A 87 -7.343 -1.342 10.072 1.00 0.85 C ATOM 1466 CG2 VAL A 87 -5.310 0.108 10.227 1.00 0.94 C ATOM 0 H VAL A 87 -6.451 2.558 9.155 1.00 0.18 H new ATOM 0 HA VAL A 87 -6.759 -0.032 7.809 1.00 0.19 H new ATOM 0 HB VAL A 87 -7.303 0.694 10.706 1.00 0.26 H new ATOM 0 HG11 VAL A 87 -7.111 -1.739 11.060 1.00 0.85 H new ATOM 0 HG12 VAL A 87 -8.423 -1.336 9.928 1.00 0.85 H new ATOM 0 HG13 VAL A 87 -6.879 -1.969 9.311 1.00 0.85 H new ATOM 0 HG21 VAL A 87 -5.110 -0.312 11.213 1.00 0.94 H new ATOM 0 HG22 VAL A 87 -4.791 -0.480 9.470 1.00 0.94 H new ATOM 0 HG23 VAL A 87 -4.955 1.138 10.192 1.00 0.94 H new ATOM 1476 N LEU A 88 -9.219 0.174 7.475 1.00 0.16 N ATOM 1477 CA LEU A 88 -10.645 0.293 7.269 1.00 0.17 C ATOM 1478 C LEU A 88 -11.319 -1.069 7.253 1.00 0.16 C ATOM 1479 O LEU A 88 -10.698 -2.092 6.962 1.00 0.16 O ATOM 1480 CB LEU A 88 -10.961 1.081 5.988 1.00 0.21 C ATOM 1481 CG LEU A 88 -10.503 0.447 4.674 1.00 0.31 C ATOM 1482 CD1 LEU A 88 -11.686 -0.152 3.928 1.00 0.58 C ATOM 1483 CD2 LEU A 88 -9.800 1.484 3.813 1.00 0.58 C ATOM 0 H LEU A 88 -8.745 -0.466 6.838 1.00 0.16 H new ATOM 0 HA LEU A 88 -11.050 0.853 8.112 1.00 0.17 H new ATOM 0 HB2 LEU A 88 -12.039 1.234 5.937 1.00 0.21 H new ATOM 0 HB3 LEU A 88 -10.503 2.067 6.071 1.00 0.21 H new ATOM 0 HG LEU A 88 -9.801 -0.356 4.899 1.00 0.31 H new ATOM 0 HD11 LEU A 88 -11.340 -0.598 2.996 1.00 0.58 H new ATOM 0 HD12 LEU A 88 -12.155 -0.918 4.545 1.00 0.58 H new ATOM 0 HD13 LEU A 88 -12.412 0.631 3.708 1.00 0.58 H new ATOM 0 HD21 LEU A 88 -9.477 1.023 2.879 1.00 0.58 H new ATOM 0 HD22 LEU A 88 -10.486 2.302 3.596 1.00 0.58 H new ATOM 0 HD23 LEU A 88 -8.931 1.871 4.346 1.00 0.58 H new ATOM 1495 N PHE A 89 -12.592 -1.072 7.595 1.00 0.17 N ATOM 1496 CA PHE A 89 -13.381 -2.289 7.631 1.00 0.17 C ATOM 1497 C PHE A 89 -14.630 -2.083 6.800 1.00 0.17 C ATOM 1498 O PHE A 89 -15.385 -1.145 7.049 1.00 0.18 O ATOM 1499 CB PHE A 89 -13.767 -2.644 9.070 1.00 0.21 C ATOM 1500 CG PHE A 89 -12.606 -2.667 10.024 1.00 0.39 C ATOM 1501 CD1 PHE A 89 -11.750 -3.755 10.065 1.00 1.33 C ATOM 1502 CD2 PHE A 89 -12.372 -1.599 10.875 1.00 1.20 C ATOM 1503 CE1 PHE A 89 -10.679 -3.775 10.939 1.00 1.48 C ATOM 1504 CE2 PHE A 89 -11.304 -1.615 11.751 1.00 1.29 C ATOM 1505 CZ PHE A 89 -10.457 -2.706 11.783 1.00 0.89 C ATOM 0 H PHE A 89 -13.109 -0.232 7.856 1.00 0.17 H new ATOM 0 HA PHE A 89 -12.791 -3.111 7.226 1.00 0.17 H new ATOM 0 HB2 PHE A 89 -14.503 -1.924 9.426 1.00 0.21 H new ATOM 0 HB3 PHE A 89 -14.249 -3.622 9.076 1.00 0.21 H new ATOM 0 HD1 PHE A 89 -11.921 -4.595 9.408 1.00 1.33 H new ATOM 0 HD2 PHE A 89 -13.032 -0.744 10.853 1.00 1.20 H new ATOM 0 HE1 PHE A 89 -10.016 -4.627 10.961 1.00 1.48 H new ATOM 0 HE2 PHE A 89 -11.132 -0.776 12.409 1.00 1.29 H new ATOM 0 HZ PHE A 89 -9.622 -2.722 12.468 1.00 0.89 H new ATOM 1515 N ILE A 90 -14.846 -2.940 5.817 1.00 0.15 N ATOM 1516 CA ILE A 90 -16.009 -2.811 4.946 1.00 0.16 C ATOM 1517 C ILE A 90 -17.146 -3.700 5.428 1.00 0.16 C ATOM 1518 O ILE A 90 -16.909 -4.794 5.944 1.00 0.19 O ATOM 1519 CB ILE A 90 -15.662 -3.147 3.483 1.00 0.16 C ATOM 1520 CG1 ILE A 90 -15.106 -4.572 3.388 1.00 0.17 C ATOM 1521 CG2 ILE A 90 -14.675 -2.124 2.930 1.00 0.22 C ATOM 1522 CD1 ILE A 90 -14.074 -4.781 2.296 1.00 0.64 C ATOM 0 H ILE A 90 -14.237 -3.729 5.600 1.00 0.15 H new ATOM 0 HA ILE A 90 -16.331 -1.770 4.988 1.00 0.16 H new ATOM 0 HB ILE A 90 -16.567 -3.100 2.877 1.00 0.16 H new ATOM 0 HG12 ILE A 90 -14.659 -4.837 4.346 1.00 0.17 H new ATOM 0 HG13 ILE A 90 -15.935 -5.260 3.222 1.00 0.17 H new ATOM 0 HG21 ILE A 90 -14.436 -2.371 1.895 1.00 0.22 H new ATOM 0 HG22 ILE A 90 -15.119 -1.130 2.973 1.00 0.22 H new ATOM 0 HG23 ILE A 90 -13.763 -2.139 3.526 1.00 0.22 H new ATOM 0 HD11 ILE A 90 -13.739 -5.818 2.306 1.00 0.64 H new ATOM 0 HD12 ILE A 90 -14.518 -4.552 1.327 1.00 0.64 H new ATOM 0 HD13 ILE A 90 -13.223 -4.123 2.469 1.00 0.64 H new ATOM 1534 N GLU A 91 -18.370 -3.223 5.265 1.00 0.14 N ATOM 1535 CA GLU A 91 -19.540 -3.957 5.704 1.00 0.16 C ATOM 1536 C GLU A 91 -20.548 -4.176 4.580 1.00 0.16 C ATOM 1537 O GLU A 91 -21.042 -3.216 3.971 1.00 0.17 O ATOM 1538 CB GLU A 91 -20.214 -3.222 6.857 1.00 0.18 C ATOM 1539 CG GLU A 91 -19.670 -3.613 8.218 1.00 0.31 C ATOM 1540 CD GLU A 91 -20.740 -3.648 9.287 1.00 0.83 C ATOM 1541 OE1 GLU A 91 -21.647 -4.502 9.205 1.00 1.57 O ATOM 1542 OE2 GLU A 91 -20.678 -2.820 10.223 1.00 1.47 O ATOM 0 H GLU A 91 -18.577 -2.325 4.829 1.00 0.14 H new ATOM 0 HA GLU A 91 -19.197 -4.938 6.033 1.00 0.16 H new ATOM 0 HB2 GLU A 91 -20.087 -2.148 6.718 1.00 0.18 H new ATOM 0 HB3 GLU A 91 -21.285 -3.423 6.830 1.00 0.18 H new ATOM 0 HG2 GLU A 91 -19.200 -4.594 8.148 1.00 0.31 H new ATOM 0 HG3 GLU A 91 -18.893 -2.907 8.511 1.00 0.31 H new ATOM 1549 N TRP A 92 -20.856 -5.450 4.333 1.00 0.17 N ATOM 1550 CA TRP A 92 -21.818 -5.843 3.312 1.00 0.19 C ATOM 1551 C TRP A 92 -22.920 -6.646 3.975 1.00 0.21 C ATOM 1552 O TRP A 92 -22.745 -7.841 4.224 1.00 0.22 O ATOM 1553 CB TRP A 92 -21.211 -6.724 2.204 1.00 0.23 C ATOM 1554 CG TRP A 92 -19.729 -6.632 2.024 1.00 0.20 C ATOM 1555 CD1 TRP A 92 -18.765 -6.971 2.927 1.00 0.20 C ATOM 1556 CD2 TRP A 92 -19.047 -6.206 0.844 1.00 0.19 C ATOM 1557 NE1 TRP A 92 -17.522 -6.768 2.383 1.00 0.21 N ATOM 1558 CE2 TRP A 92 -17.670 -6.294 1.104 1.00 0.20 C ATOM 1559 CE3 TRP A 92 -19.471 -5.750 -0.408 1.00 0.22 C ATOM 1560 CZ2 TRP A 92 -16.714 -5.950 0.155 1.00 0.22 C ATOM 1561 CZ3 TRP A 92 -18.521 -5.405 -1.347 1.00 0.25 C ATOM 1562 CH2 TRP A 92 -17.157 -5.502 -1.061 1.00 0.25 C ATOM 0 H TRP A 92 -20.444 -6.235 4.837 1.00 0.17 H new ATOM 0 HA TRP A 92 -22.180 -4.925 2.850 1.00 0.19 H new ATOM 0 HB2 TRP A 92 -21.467 -7.763 2.414 1.00 0.23 H new ATOM 0 HB3 TRP A 92 -21.688 -6.463 1.259 1.00 0.23 H new ATOM 0 HD1 TRP A 92 -18.952 -7.344 3.923 1.00 0.20 H new ATOM 0 HE1 TRP A 92 -16.633 -6.941 2.853 1.00 0.21 H new ATOM 0 HE3 TRP A 92 -20.524 -5.669 -0.636 1.00 0.22 H new ATOM 0 HZ2 TRP A 92 -15.659 -6.033 0.369 1.00 0.22 H new ATOM 0 HZ3 TRP A 92 -18.837 -5.054 -2.318 1.00 0.25 H new ATOM 0 HH2 TRP A 92 -16.437 -5.218 -1.814 1.00 0.25 H new ATOM 1573 N GLU A 93 -24.034 -5.996 4.267 1.00 0.26 N ATOM 1574 CA GLU A 93 -25.163 -6.653 4.908 1.00 0.35 C ATOM 1575 C GLU A 93 -24.732 -7.332 6.206 1.00 0.32 C ATOM 1576 O GLU A 93 -24.826 -8.554 6.346 1.00 0.37 O ATOM 1577 CB GLU A 93 -25.793 -7.667 3.961 1.00 0.46 C ATOM 1578 CG GLU A 93 -27.281 -7.466 3.769 1.00 0.97 C ATOM 1579 CD GLU A 93 -27.923 -8.609 3.013 1.00 1.24 C ATOM 1580 OE1 GLU A 93 -27.593 -8.800 1.825 1.00 1.71 O ATOM 1581 OE2 GLU A 93 -28.764 -9.322 3.602 1.00 1.85 O ATOM 0 H GLU A 93 -24.182 -5.006 4.069 1.00 0.26 H new ATOM 0 HA GLU A 93 -25.906 -5.894 5.152 1.00 0.35 H new ATOM 0 HB2 GLU A 93 -25.297 -7.605 2.992 1.00 0.46 H new ATOM 0 HB3 GLU A 93 -25.616 -8.671 4.346 1.00 0.46 H new ATOM 0 HG2 GLU A 93 -27.760 -7.363 4.743 1.00 0.97 H new ATOM 0 HG3 GLU A 93 -27.453 -6.535 3.229 1.00 0.97 H new ATOM 1588 N LYS A 94 -24.230 -6.517 7.127 1.00 0.30 N ATOM 1589 CA LYS A 94 -23.770 -6.963 8.444 1.00 0.32 C ATOM 1590 C LYS A 94 -22.433 -7.711 8.413 1.00 0.28 C ATOM 1591 O LYS A 94 -21.882 -8.032 9.466 1.00 0.38 O ATOM 1592 CB LYS A 94 -24.835 -7.802 9.140 1.00 0.39 C ATOM 1593 CG LYS A 94 -25.931 -6.953 9.747 1.00 0.54 C ATOM 1594 CD LYS A 94 -25.388 -6.051 10.843 1.00 0.84 C ATOM 1595 CE LYS A 94 -25.417 -6.733 12.198 1.00 1.48 C ATOM 1596 NZ LYS A 94 -24.781 -5.898 13.250 1.00 2.01 N ATOM 0 H LYS A 94 -24.128 -5.513 6.981 1.00 0.30 H new ATOM 0 HA LYS A 94 -23.596 -6.053 9.018 1.00 0.32 H new ATOM 0 HB2 LYS A 94 -25.272 -8.497 8.423 1.00 0.39 H new ATOM 0 HB3 LYS A 94 -24.368 -8.402 9.922 1.00 0.39 H new ATOM 0 HG2 LYS A 94 -26.396 -6.346 8.970 1.00 0.54 H new ATOM 0 HG3 LYS A 94 -26.709 -7.598 10.156 1.00 0.54 H new ATOM 0 HD2 LYS A 94 -24.365 -5.762 10.603 1.00 0.84 H new ATOM 0 HD3 LYS A 94 -25.976 -5.134 10.884 1.00 0.84 H new ATOM 0 HE2 LYS A 94 -26.449 -6.944 12.476 1.00 1.48 H new ATOM 0 HE3 LYS A 94 -24.902 -7.691 12.134 1.00 1.48 H new ATOM 0 HZ1 LYS A 94 -24.820 -6.398 14.161 1.00 2.01 H new ATOM 0 HZ2 LYS A 94 -23.789 -5.717 12.997 1.00 2.01 H new ATOM 0 HZ3 LYS A 94 -25.288 -4.994 13.329 1.00 2.01 H new ATOM 1610 N LYS A 95 -21.905 -8.003 7.230 1.00 0.22 N ATOM 1611 CA LYS A 95 -20.622 -8.689 7.148 1.00 0.21 C ATOM 1612 C LYS A 95 -19.519 -7.659 7.145 1.00 0.20 C ATOM 1613 O LYS A 95 -19.666 -6.602 6.555 1.00 0.29 O ATOM 1614 CB LYS A 95 -20.520 -9.562 5.902 1.00 0.24 C ATOM 1615 CG LYS A 95 -20.672 -11.048 6.188 1.00 0.37 C ATOM 1616 CD LYS A 95 -21.149 -11.819 4.965 1.00 0.65 C ATOM 1617 CE LYS A 95 -22.667 -11.908 4.919 1.00 1.18 C ATOM 1618 NZ LYS A 95 -23.146 -12.636 3.713 1.00 1.70 N ATOM 0 H LYS A 95 -22.335 -7.781 6.332 1.00 0.22 H new ATOM 0 HA LYS A 95 -20.528 -9.347 8.012 1.00 0.21 H new ATOM 0 HB2 LYS A 95 -21.287 -9.257 5.190 1.00 0.24 H new ATOM 0 HB3 LYS A 95 -19.556 -9.389 5.425 1.00 0.24 H new ATOM 0 HG2 LYS A 95 -19.716 -11.452 6.521 1.00 0.37 H new ATOM 0 HG3 LYS A 95 -21.380 -11.189 7.004 1.00 0.37 H new ATOM 0 HD2 LYS A 95 -20.785 -11.331 4.061 1.00 0.65 H new ATOM 0 HD3 LYS A 95 -20.725 -12.823 4.978 1.00 0.65 H new ATOM 0 HE2 LYS A 95 -23.028 -12.413 5.815 1.00 1.18 H new ATOM 0 HE3 LYS A 95 -23.090 -10.903 4.928 1.00 1.18 H new ATOM 0 HZ1 LYS A 95 -24.185 -12.674 3.720 1.00 1.70 H new ATOM 0 HZ2 LYS A 95 -22.824 -12.140 2.857 1.00 1.70 H new ATOM 0 HZ3 LYS A 95 -22.764 -13.603 3.717 1.00 1.70 H new ATOM 1632 N THR A 96 -18.416 -7.974 7.780 1.00 0.18 N ATOM 1633 CA THR A 96 -17.304 -7.038 7.870 1.00 0.19 C ATOM 1634 C THR A 96 -15.994 -7.694 7.464 1.00 0.17 C ATOM 1635 O THR A 96 -15.710 -8.828 7.853 1.00 0.24 O ATOM 1636 CB THR A 96 -17.165 -6.478 9.297 1.00 0.26 C ATOM 1637 OG1 THR A 96 -18.461 -6.346 9.900 1.00 0.32 O ATOM 1638 CG2 THR A 96 -16.467 -5.126 9.284 1.00 0.34 C ATOM 0 H THR A 96 -18.257 -8.868 8.244 1.00 0.18 H new ATOM 0 HA THR A 96 -17.521 -6.221 7.182 1.00 0.19 H new ATOM 0 HB THR A 96 -16.562 -7.174 9.879 1.00 0.26 H new ATOM 0 HG1 THR A 96 -18.365 -5.991 10.808 1.00 0.32 H new ATOM 0 HG21 THR A 96 -16.381 -4.751 10.304 1.00 0.34 H new ATOM 0 HG22 THR A 96 -15.472 -5.234 8.852 1.00 0.34 H new ATOM 0 HG23 THR A 96 -17.047 -4.423 8.687 1.00 0.34 H new ATOM 1646 N TYR A 97 -15.199 -6.977 6.685 1.00 0.16 N ATOM 1647 CA TYR A 97 -13.925 -7.471 6.223 1.00 0.16 C ATOM 1648 C TYR A 97 -12.836 -6.449 6.502 1.00 0.15 C ATOM 1649 O TYR A 97 -13.085 -5.239 6.459 1.00 0.16 O ATOM 1650 CB TYR A 97 -14.014 -7.803 4.743 1.00 0.17 C ATOM 1651 CG TYR A 97 -14.721 -9.115 4.462 1.00 0.95 C ATOM 1652 CD1 TYR A 97 -14.546 -10.214 5.296 1.00 1.23 C ATOM 1653 CD2 TYR A 97 -15.575 -9.249 3.374 1.00 1.61 C ATOM 1654 CE1 TYR A 97 -15.198 -11.404 5.054 1.00 2.05 C ATOM 1655 CE2 TYR A 97 -16.232 -10.441 3.125 1.00 2.45 C ATOM 1656 CZ TYR A 97 -16.039 -11.515 3.970 1.00 2.65 C ATOM 1657 OH TYR A 97 -16.684 -12.708 3.727 1.00 3.49 O ATOM 0 H TYR A 97 -15.425 -6.037 6.359 1.00 0.16 H new ATOM 0 HA TYR A 97 -13.667 -8.383 6.761 1.00 0.16 H new ATOM 0 HB2 TYR A 97 -14.539 -6.998 4.229 1.00 0.17 H new ATOM 0 HB3 TYR A 97 -13.008 -7.844 4.326 1.00 0.17 H new ATOM 0 HD1 TYR A 97 -13.888 -10.134 6.148 1.00 1.23 H new ATOM 0 HD2 TYR A 97 -15.728 -8.409 2.712 1.00 1.61 H new ATOM 0 HE1 TYR A 97 -15.049 -12.247 5.713 1.00 2.05 H new ATOM 0 HE2 TYR A 97 -16.892 -10.530 2.275 1.00 2.45 H new ATOM 0 HH TYR A 97 -17.241 -12.621 2.926 1.00 3.49 H new ATOM 1667 N GLN A 98 -11.638 -6.941 6.789 1.00 0.16 N ATOM 1668 CA GLN A 98 -10.508 -6.082 7.120 1.00 0.16 C ATOM 1669 C GLN A 98 -9.717 -5.692 5.880 1.00 0.15 C ATOM 1670 O GLN A 98 -9.179 -6.551 5.171 1.00 0.15 O ATOM 1671 CB GLN A 98 -9.575 -6.775 8.122 1.00 0.20 C ATOM 1672 CG GLN A 98 -10.276 -7.294 9.372 1.00 1.13 C ATOM 1673 CD GLN A 98 -10.861 -8.685 9.193 1.00 1.77 C ATOM 1674 OE1 GLN A 98 -11.955 -8.972 9.677 1.00 2.37 O ATOM 1675 NE2 GLN A 98 -10.130 -9.562 8.524 1.00 2.49 N ATOM 0 H GLN A 98 -11.423 -7.938 6.799 1.00 0.16 H new ATOM 0 HA GLN A 98 -10.915 -5.176 7.569 1.00 0.16 H new ATOM 0 HB2 GLN A 98 -9.080 -7.609 7.624 1.00 0.20 H new ATOM 0 HB3 GLN A 98 -8.796 -6.074 8.421 1.00 0.20 H new ATOM 0 HG2 GLN A 98 -9.567 -7.308 10.200 1.00 1.13 H new ATOM 0 HG3 GLN A 98 -11.073 -6.604 9.647 1.00 1.13 H new ATOM 0 HE21 GLN A 98 -9.228 -9.285 8.138 1.00 2.49 H new ATOM 0 HE22 GLN A 98 -10.469 -10.515 8.394 1.00 2.49 H new ATOM 1684 N LEU A 99 -9.657 -4.396 5.619 1.00 0.15 N ATOM 1685 CA LEU A 99 -8.920 -3.880 4.484 1.00 0.16 C ATOM 1686 C LEU A 99 -7.904 -2.843 4.947 1.00 0.15 C ATOM 1687 O LEU A 99 -8.267 -1.796 5.488 1.00 0.16 O ATOM 1688 CB LEU A 99 -9.883 -3.270 3.458 1.00 0.18 C ATOM 1689 CG LEU A 99 -9.297 -3.049 2.059 1.00 0.43 C ATOM 1690 CD1 LEU A 99 -10.400 -3.077 1.011 1.00 1.11 C ATOM 1691 CD2 LEU A 99 -8.542 -1.729 1.995 1.00 1.09 C ATOM 0 H LEU A 99 -10.114 -3.680 6.184 1.00 0.15 H new ATOM 0 HA LEU A 99 -8.385 -4.702 4.008 1.00 0.16 H new ATOM 0 HB2 LEU A 99 -10.754 -3.920 3.371 1.00 0.18 H new ATOM 0 HB3 LEU A 99 -10.237 -2.313 3.841 1.00 0.18 H new ATOM 0 HG LEU A 99 -8.596 -3.857 1.850 1.00 0.43 H new ATOM 0 HD11 LEU A 99 -9.967 -2.919 0.023 1.00 1.11 H new ATOM 0 HD12 LEU A 99 -10.902 -4.044 1.037 1.00 1.11 H new ATOM 0 HD13 LEU A 99 -11.122 -2.288 1.222 1.00 1.11 H new ATOM 0 HD21 LEU A 99 -8.134 -1.591 0.994 1.00 1.09 H new ATOM 0 HD22 LEU A 99 -9.222 -0.909 2.225 1.00 1.09 H new ATOM 0 HD23 LEU A 99 -7.728 -1.740 2.720 1.00 1.09 H new ATOM 1703 N ASP A 100 -6.635 -3.141 4.741 1.00 0.16 N ATOM 1704 CA ASP A 100 -5.572 -2.228 5.129 1.00 0.17 C ATOM 1705 C ASP A 100 -5.193 -1.364 3.938 1.00 0.17 C ATOM 1706 O ASP A 100 -4.648 -1.854 2.954 1.00 0.19 O ATOM 1707 CB ASP A 100 -4.351 -2.998 5.634 1.00 0.20 C ATOM 1708 CG ASP A 100 -3.727 -2.369 6.867 1.00 0.42 C ATOM 1709 OD1 ASP A 100 -4.224 -2.622 7.984 1.00 1.20 O ATOM 1710 OD2 ASP A 100 -2.723 -1.635 6.733 1.00 1.21 O ATOM 0 H ASP A 100 -6.314 -4.007 4.308 1.00 0.16 H new ATOM 0 HA ASP A 100 -5.929 -1.594 5.941 1.00 0.17 H new ATOM 0 HB2 ASP A 100 -4.643 -4.023 5.863 1.00 0.20 H new ATOM 0 HB3 ASP A 100 -3.605 -3.048 4.841 1.00 0.20 H new ATOM 1715 N LEU A 101 -5.496 -0.087 4.025 1.00 0.18 N ATOM 1716 CA LEU A 101 -5.211 0.841 2.956 1.00 0.21 C ATOM 1717 C LEU A 101 -4.018 1.709 3.318 1.00 0.21 C ATOM 1718 O LEU A 101 -3.960 2.278 4.404 1.00 0.30 O ATOM 1719 CB LEU A 101 -6.437 1.722 2.698 1.00 0.27 C ATOM 1720 CG LEU A 101 -6.265 2.775 1.607 1.00 0.65 C ATOM 1721 CD1 LEU A 101 -6.008 2.099 0.280 1.00 1.21 C ATOM 1722 CD2 LEU A 101 -7.494 3.671 1.524 1.00 1.14 C ATOM 0 H LEU A 101 -5.946 0.335 4.837 1.00 0.18 H new ATOM 0 HA LEU A 101 -4.974 0.279 2.053 1.00 0.21 H new ATOM 0 HB2 LEU A 101 -7.276 1.079 2.431 1.00 0.27 H new ATOM 0 HB3 LEU A 101 -6.704 2.225 3.627 1.00 0.27 H new ATOM 0 HG LEU A 101 -5.409 3.402 1.856 1.00 0.65 H new ATOM 0 HD11 LEU A 101 -5.886 2.855 -0.496 1.00 1.21 H new ATOM 0 HD12 LEU A 101 -5.101 1.498 0.347 1.00 1.21 H new ATOM 0 HD13 LEU A 101 -6.852 1.456 0.030 1.00 1.21 H new ATOM 0 HD21 LEU A 101 -7.350 4.414 0.740 1.00 1.14 H new ATOM 0 HD22 LEU A 101 -8.371 3.066 1.294 1.00 1.14 H new ATOM 0 HD23 LEU A 101 -7.642 4.175 2.479 1.00 1.14 H new ATOM 1734 N PHE A 102 -3.070 1.811 2.415 1.00 0.16 N ATOM 1735 CA PHE A 102 -1.902 2.630 2.644 1.00 0.17 C ATOM 1736 C PHE A 102 -2.023 3.885 1.819 1.00 0.15 C ATOM 1737 O PHE A 102 -2.330 3.808 0.630 1.00 0.15 O ATOM 1738 CB PHE A 102 -0.625 1.884 2.242 1.00 0.20 C ATOM 1739 CG PHE A 102 0.138 1.289 3.393 1.00 0.27 C ATOM 1740 CD1 PHE A 102 -0.524 0.747 4.485 1.00 1.25 C ATOM 1741 CD2 PHE A 102 1.523 1.278 3.381 1.00 1.22 C ATOM 1742 CE1 PHE A 102 0.181 0.204 5.540 1.00 1.29 C ATOM 1743 CE2 PHE A 102 2.234 0.737 4.434 1.00 1.27 C ATOM 1744 CZ PHE A 102 1.562 0.198 5.516 1.00 0.53 C ATOM 0 H PHE A 102 -3.085 1.336 1.513 1.00 0.16 H new ATOM 0 HA PHE A 102 -1.841 2.872 3.705 1.00 0.17 H new ATOM 0 HB2 PHE A 102 -0.889 1.087 1.547 1.00 0.20 H new ATOM 0 HB3 PHE A 102 0.029 2.572 1.706 1.00 0.20 H new ATOM 0 HD1 PHE A 102 -1.604 0.750 4.510 1.00 1.25 H new ATOM 0 HD2 PHE A 102 2.053 1.697 2.539 1.00 1.22 H new ATOM 0 HE1 PHE A 102 -0.347 -0.216 6.384 1.00 1.29 H new ATOM 0 HE2 PHE A 102 3.314 0.735 4.413 1.00 1.27 H new ATOM 0 HZ PHE A 102 2.116 -0.227 6.340 1.00 0.53 H new ATOM 1754 N THR A 103 -1.815 5.040 2.423 1.00 0.15 N ATOM 1755 CA THR A 103 -1.879 6.263 1.658 1.00 0.15 C ATOM 1756 C THR A 103 -0.470 6.752 1.512 1.00 0.16 C ATOM 1757 O THR A 103 0.148 7.198 2.466 1.00 0.18 O ATOM 1758 CB THR A 103 -2.720 7.329 2.391 1.00 0.17 C ATOM 1759 OG1 THR A 103 -2.524 7.203 3.809 1.00 0.19 O ATOM 1760 CG2 THR A 103 -4.199 7.180 2.082 1.00 0.21 C ATOM 0 H THR A 103 -1.606 5.154 3.415 1.00 0.15 H new ATOM 0 HA THR A 103 -2.348 6.082 0.691 1.00 0.15 H new ATOM 0 HB THR A 103 -2.393 8.310 2.046 1.00 0.17 H new ATOM 0 HG1 THR A 103 -1.873 7.871 4.110 1.00 0.19 H new ATOM 0 HG21 THR A 103 -4.761 7.947 2.615 1.00 0.21 H new ATOM 0 HG22 THR A 103 -4.360 7.292 1.010 1.00 0.21 H new ATOM 0 HG23 THR A 103 -4.539 6.194 2.399 1.00 0.21 H new ATOM 1768 N ALA A 104 -0.004 6.788 0.303 1.00 0.15 N ATOM 1769 CA ALA A 104 1.365 7.177 0.076 1.00 0.16 C ATOM 1770 C ALA A 104 1.469 8.183 -1.041 1.00 0.16 C ATOM 1771 O ALA A 104 0.486 8.502 -1.680 1.00 0.19 O ATOM 1772 CB ALA A 104 2.197 5.944 -0.237 1.00 0.17 C ATOM 0 H ALA A 104 -0.537 6.558 -0.536 1.00 0.15 H new ATOM 0 HA ALA A 104 1.747 7.651 0.980 1.00 0.16 H new ATOM 0 HB1 ALA A 104 3.233 6.238 -0.409 1.00 0.17 H new ATOM 0 HB2 ALA A 104 2.151 5.251 0.603 1.00 0.17 H new ATOM 0 HB3 ALA A 104 1.805 5.458 -1.130 1.00 0.17 H new ATOM 1778 N LEU A 105 2.662 8.682 -1.259 1.00 0.16 N ATOM 1779 CA LEU A 105 2.896 9.642 -2.298 1.00 0.17 C ATOM 1780 C LEU A 105 3.137 8.902 -3.586 1.00 0.17 C ATOM 1781 O LEU A 105 3.386 7.697 -3.569 1.00 0.16 O ATOM 1782 CB LEU A 105 4.096 10.510 -1.949 1.00 0.20 C ATOM 1783 CG LEU A 105 3.962 11.973 -2.349 1.00 0.28 C ATOM 1784 CD1 LEU A 105 2.880 12.662 -1.533 1.00 0.66 C ATOM 1785 CD2 LEU A 105 5.287 12.678 -2.180 1.00 0.85 C ATOM 0 H LEU A 105 3.492 8.432 -0.721 1.00 0.16 H new ATOM 0 HA LEU A 105 2.029 10.294 -2.406 1.00 0.17 H new ATOM 0 HB2 LEU A 105 4.266 10.456 -0.874 1.00 0.20 H new ATOM 0 HB3 LEU A 105 4.980 10.095 -2.433 1.00 0.20 H new ATOM 0 HG LEU A 105 3.670 12.020 -3.398 1.00 0.28 H new ATOM 0 HD11 LEU A 105 2.804 13.706 -1.838 1.00 0.66 H new ATOM 0 HD12 LEU A 105 1.925 12.164 -1.701 1.00 0.66 H new ATOM 0 HD13 LEU A 105 3.134 12.611 -0.474 1.00 0.66 H new ATOM 0 HD21 LEU A 105 5.182 13.724 -2.468 1.00 0.85 H new ATOM 0 HD22 LEU A 105 5.600 12.619 -1.138 1.00 0.85 H new ATOM 0 HD23 LEU A 105 6.036 12.201 -2.812 1.00 0.85 H new ATOM 1797 N ALA A 106 3.056 9.604 -4.698 1.00 0.19 N ATOM 1798 CA ALA A 106 3.295 8.981 -5.986 1.00 0.22 C ATOM 1799 C ALA A 106 4.688 8.354 -6.017 1.00 0.24 C ATOM 1800 O ALA A 106 4.952 7.435 -6.789 1.00 0.27 O ATOM 1801 CB ALA A 106 3.138 9.998 -7.108 1.00 0.26 C ATOM 0 H ALA A 106 2.829 10.598 -4.738 1.00 0.19 H new ATOM 0 HA ALA A 106 2.557 8.193 -6.136 1.00 0.22 H new ATOM 0 HB1 ALA A 106 3.321 9.513 -8.067 1.00 0.26 H new ATOM 0 HB2 ALA A 106 2.126 10.403 -7.093 1.00 0.26 H new ATOM 0 HB3 ALA A 106 3.855 10.807 -6.968 1.00 0.26 H new ATOM 1807 N GLU A 107 5.575 8.866 -5.170 1.00 0.25 N ATOM 1808 CA GLU A 107 6.934 8.362 -5.095 1.00 0.30 C ATOM 1809 C GLU A 107 7.030 7.150 -4.173 1.00 0.26 C ATOM 1810 O GLU A 107 7.918 6.310 -4.326 1.00 0.28 O ATOM 1811 CB GLU A 107 7.888 9.458 -4.628 1.00 0.38 C ATOM 1812 CG GLU A 107 9.254 9.380 -5.285 1.00 1.06 C ATOM 1813 CD GLU A 107 10.075 10.631 -5.072 1.00 1.19 C ATOM 1814 OE1 GLU A 107 9.629 11.720 -5.485 1.00 1.85 O ATOM 1815 OE2 GLU A 107 11.181 10.533 -4.508 1.00 1.81 O ATOM 0 H GLU A 107 5.373 9.631 -4.526 1.00 0.25 H new ATOM 0 HA GLU A 107 7.224 8.046 -6.097 1.00 0.30 H new ATOM 0 HB2 GLU A 107 7.445 10.431 -4.840 1.00 0.38 H new ATOM 0 HB3 GLU A 107 8.007 9.391 -3.547 1.00 0.38 H new ATOM 0 HG2 GLU A 107 9.796 8.522 -4.887 1.00 1.06 H new ATOM 0 HG3 GLU A 107 9.129 9.210 -6.354 1.00 1.06 H new ATOM 1822 N GLU A 108 6.110 7.060 -3.214 1.00 0.23 N ATOM 1823 CA GLU A 108 6.110 5.961 -2.256 1.00 0.23 C ATOM 1824 C GLU A 108 5.373 4.747 -2.795 1.00 0.19 C ATOM 1825 O GLU A 108 5.162 3.768 -2.084 1.00 0.21 O ATOM 1826 CB GLU A 108 5.484 6.404 -0.940 1.00 0.27 C ATOM 1827 CG GLU A 108 6.343 7.362 -0.142 1.00 0.50 C ATOM 1828 CD GLU A 108 5.719 7.703 1.194 1.00 1.51 C ATOM 1829 OE1 GLU A 108 5.845 6.886 2.133 1.00 2.23 O ATOM 1830 OE2 GLU A 108 5.085 8.772 1.295 1.00 2.25 O ATOM 0 H GLU A 108 5.357 7.735 -3.082 1.00 0.23 H new ATOM 0 HA GLU A 108 7.148 5.677 -2.085 1.00 0.23 H new ATOM 0 HB2 GLU A 108 4.525 6.878 -1.147 1.00 0.27 H new ATOM 0 HB3 GLU A 108 5.279 5.523 -0.332 1.00 0.27 H new ATOM 0 HG2 GLU A 108 7.326 6.920 0.019 1.00 0.50 H new ATOM 0 HG3 GLU A 108 6.495 8.276 -0.715 1.00 0.50 H new ATOM 1837 N LYS A 109 5.030 4.815 -4.067 1.00 0.18 N ATOM 1838 CA LYS A 109 4.303 3.748 -4.748 1.00 0.18 C ATOM 1839 C LYS A 109 5.025 2.387 -4.664 1.00 0.18 C ATOM 1840 O LYS A 109 4.409 1.393 -4.289 1.00 0.20 O ATOM 1841 CB LYS A 109 4.048 4.158 -6.207 1.00 0.22 C ATOM 1842 CG LYS A 109 3.718 3.004 -7.144 1.00 0.42 C ATOM 1843 CD LYS A 109 2.341 2.425 -6.865 1.00 0.85 C ATOM 1844 CE LYS A 109 2.106 1.162 -7.673 1.00 1.21 C ATOM 1845 NZ LYS A 109 2.031 1.443 -9.134 1.00 1.51 N ATOM 0 H LYS A 109 5.246 5.613 -4.664 1.00 0.18 H new ATOM 0 HA LYS A 109 3.350 3.610 -4.238 1.00 0.18 H new ATOM 0 HB2 LYS A 109 3.226 4.874 -6.231 1.00 0.22 H new ATOM 0 HB3 LYS A 109 4.931 4.674 -6.585 1.00 0.22 H new ATOM 0 HG2 LYS A 109 3.764 3.350 -8.177 1.00 0.42 H new ATOM 0 HG3 LYS A 109 4.470 2.222 -7.036 1.00 0.42 H new ATOM 0 HD2 LYS A 109 2.245 2.204 -5.802 1.00 0.85 H new ATOM 0 HD3 LYS A 109 1.577 3.163 -7.108 1.00 0.85 H new ATOM 0 HE2 LYS A 109 2.911 0.453 -7.481 1.00 1.21 H new ATOM 0 HE3 LYS A 109 1.180 0.689 -7.346 1.00 1.21 H new ATOM 0 HZ1 LYS A 109 1.819 0.563 -9.646 1.00 1.51 H new ATOM 0 HZ2 LYS A 109 1.280 2.139 -9.316 1.00 1.51 H new ATOM 0 HZ3 LYS A 109 2.942 1.824 -9.462 1.00 1.51 H new ATOM 1859 N PRO A 110 6.331 2.311 -4.991 1.00 0.16 N ATOM 1860 CA PRO A 110 7.069 1.046 -4.936 1.00 0.17 C ATOM 1861 C PRO A 110 7.250 0.546 -3.504 1.00 0.15 C ATOM 1862 O PRO A 110 6.919 -0.596 -3.190 1.00 0.17 O ATOM 1863 CB PRO A 110 8.421 1.391 -5.564 1.00 0.19 C ATOM 1864 CG PRO A 110 8.572 2.858 -5.360 1.00 0.18 C ATOM 1865 CD PRO A 110 7.185 3.428 -5.424 1.00 0.17 C ATOM 0 HA PRO A 110 6.543 0.243 -5.452 1.00 0.17 H new ATOM 0 HB2 PRO A 110 9.231 0.840 -5.086 1.00 0.19 H new ATOM 0 HB3 PRO A 110 8.442 1.135 -6.623 1.00 0.19 H new ATOM 0 HG2 PRO A 110 9.038 3.073 -4.398 1.00 0.18 H new ATOM 0 HG3 PRO A 110 9.210 3.295 -6.128 1.00 0.18 H new ATOM 0 HD2 PRO A 110 7.076 4.293 -4.769 1.00 0.17 H new ATOM 0 HD3 PRO A 110 6.933 3.758 -6.432 1.00 0.17 H new ATOM 1873 N TYR A 111 7.779 1.414 -2.648 1.00 0.14 N ATOM 1874 CA TYR A 111 8.001 1.091 -1.242 1.00 0.14 C ATOM 1875 C TYR A 111 6.726 0.625 -0.557 1.00 0.15 C ATOM 1876 O TYR A 111 6.770 -0.177 0.373 1.00 0.17 O ATOM 1877 CB TYR A 111 8.533 2.307 -0.500 1.00 0.17 C ATOM 1878 CG TYR A 111 9.993 2.204 -0.152 1.00 0.21 C ATOM 1879 CD1 TYR A 111 10.940 2.004 -1.138 1.00 0.41 C ATOM 1880 CD2 TYR A 111 10.425 2.305 1.164 1.00 0.49 C ATOM 1881 CE1 TYR A 111 12.279 1.907 -0.830 1.00 0.44 C ATOM 1882 CE2 TYR A 111 11.765 2.211 1.480 1.00 0.56 C ATOM 1883 CZ TYR A 111 12.685 2.012 0.477 1.00 0.39 C ATOM 1884 OH TYR A 111 14.018 1.922 0.779 1.00 0.49 O ATOM 0 H TYR A 111 8.065 2.358 -2.907 1.00 0.14 H new ATOM 0 HA TYR A 111 8.728 0.280 -1.214 1.00 0.14 H new ATOM 0 HB2 TYR A 111 8.375 3.195 -1.112 1.00 0.17 H new ATOM 0 HB3 TYR A 111 7.958 2.445 0.416 1.00 0.17 H new ATOM 0 HD1 TYR A 111 10.625 1.922 -2.168 1.00 0.41 H new ATOM 0 HD2 TYR A 111 9.702 2.459 1.951 1.00 0.49 H new ATOM 0 HE1 TYR A 111 13.006 1.749 -1.613 1.00 0.44 H new ATOM 0 HE2 TYR A 111 12.089 2.293 2.507 1.00 0.56 H new ATOM 0 HH TYR A 111 14.320 0.998 0.655 1.00 0.49 H new ATOM 1894 N ALA A 112 5.602 1.148 -1.008 1.00 0.15 N ATOM 1895 CA ALA A 112 4.312 0.793 -0.433 1.00 0.18 C ATOM 1896 C ALA A 112 4.024 -0.684 -0.628 1.00 0.19 C ATOM 1897 O ALA A 112 3.671 -1.392 0.319 1.00 0.22 O ATOM 1898 CB ALA A 112 3.218 1.631 -1.056 1.00 0.19 C ATOM 0 H ALA A 112 5.553 1.822 -1.772 1.00 0.15 H new ATOM 0 HA ALA A 112 4.343 0.994 0.638 1.00 0.18 H new ATOM 0 HB1 ALA A 112 2.257 1.358 -0.619 1.00 0.19 H new ATOM 0 HB2 ALA A 112 3.416 2.686 -0.867 1.00 0.19 H new ATOM 0 HB3 ALA A 112 3.191 1.454 -2.131 1.00 0.19 H new ATOM 1904 N ILE A 113 4.205 -1.146 -1.853 1.00 0.19 N ATOM 1905 CA ILE A 113 3.969 -2.538 -2.171 1.00 0.23 C ATOM 1906 C ILE A 113 5.010 -3.404 -1.473 1.00 0.22 C ATOM 1907 O ILE A 113 4.675 -4.451 -0.935 1.00 0.24 O ATOM 1908 CB ILE A 113 3.977 -2.786 -3.704 1.00 0.26 C ATOM 1909 CG1 ILE A 113 2.626 -2.412 -4.324 1.00 0.28 C ATOM 1910 CG2 ILE A 113 4.297 -4.240 -4.024 1.00 0.38 C ATOM 1911 CD1 ILE A 113 2.316 -0.932 -4.310 1.00 0.28 C ATOM 0 H ILE A 113 4.514 -0.576 -2.641 1.00 0.19 H new ATOM 0 HA ILE A 113 2.977 -2.810 -1.811 1.00 0.23 H new ATOM 0 HB ILE A 113 4.754 -2.153 -4.132 1.00 0.26 H new ATOM 0 HG12 ILE A 113 2.604 -2.765 -5.355 1.00 0.28 H new ATOM 0 HG13 ILE A 113 1.837 -2.940 -3.789 1.00 0.28 H new ATOM 0 HG21 ILE A 113 4.296 -4.384 -5.105 1.00 0.38 H new ATOM 0 HG22 ILE A 113 5.280 -4.492 -3.626 1.00 0.38 H new ATOM 0 HG23 ILE A 113 3.545 -4.886 -3.571 1.00 0.38 H new ATOM 0 HD11 ILE A 113 1.342 -0.760 -4.768 1.00 0.28 H new ATOM 0 HD12 ILE A 113 2.302 -0.573 -3.281 1.00 0.28 H new ATOM 0 HD13 ILE A 113 3.081 -0.395 -4.871 1.00 0.28 H new ATOM 1923 N PHE A 114 6.250 -2.913 -1.424 1.00 0.19 N ATOM 1924 CA PHE A 114 7.356 -3.634 -0.790 1.00 0.19 C ATOM 1925 C PHE A 114 7.079 -3.872 0.689 1.00 0.20 C ATOM 1926 O PHE A 114 7.319 -4.957 1.218 1.00 0.23 O ATOM 1927 CB PHE A 114 8.643 -2.825 -0.944 1.00 0.17 C ATOM 1928 CG PHE A 114 9.913 -3.639 -0.884 1.00 0.16 C ATOM 1929 CD1 PHE A 114 9.967 -4.934 -1.384 1.00 0.22 C ATOM 1930 CD2 PHE A 114 11.061 -3.095 -0.328 1.00 0.20 C ATOM 1931 CE1 PHE A 114 11.140 -5.666 -1.329 1.00 0.24 C ATOM 1932 CE2 PHE A 114 12.235 -3.821 -0.273 1.00 0.20 C ATOM 1933 CZ PHE A 114 12.274 -5.108 -0.773 1.00 0.18 C ATOM 0 H PHE A 114 6.515 -2.011 -1.820 1.00 0.19 H new ATOM 0 HA PHE A 114 7.462 -4.602 -1.279 1.00 0.19 H new ATOM 0 HB2 PHE A 114 8.612 -2.296 -1.897 1.00 0.17 H new ATOM 0 HB3 PHE A 114 8.676 -2.068 -0.160 1.00 0.17 H new ATOM 0 HD1 PHE A 114 9.083 -5.375 -1.821 1.00 0.22 H new ATOM 0 HD2 PHE A 114 11.037 -2.090 0.067 1.00 0.20 H new ATOM 0 HE1 PHE A 114 11.168 -6.672 -1.720 1.00 0.24 H new ATOM 0 HE2 PHE A 114 13.122 -3.383 0.161 1.00 0.20 H new ATOM 0 HZ PHE A 114 13.191 -5.677 -0.729 1.00 0.18 H new ATOM 1943 N HIS A 115 6.577 -2.839 1.345 1.00 0.20 N ATOM 1944 CA HIS A 115 6.254 -2.903 2.759 1.00 0.22 C ATOM 1945 C HIS A 115 5.051 -3.812 2.981 1.00 0.25 C ATOM 1946 O HIS A 115 4.955 -4.503 3.992 1.00 0.29 O ATOM 1947 CB HIS A 115 5.965 -1.492 3.286 1.00 0.24 C ATOM 1948 CG HIS A 115 6.149 -1.339 4.765 1.00 0.48 C ATOM 1949 ND1 HIS A 115 7.321 -0.854 5.296 1.00 1.26 N ATOM 1950 CD2 HIS A 115 5.285 -1.606 5.773 1.00 0.74 C ATOM 1951 CE1 HIS A 115 7.146 -0.843 6.606 1.00 1.37 C ATOM 1952 NE2 HIS A 115 5.928 -1.290 6.940 1.00 0.94 N ATOM 0 H HIS A 115 6.383 -1.936 0.913 1.00 0.20 H new ATOM 0 HA HIS A 115 7.103 -3.316 3.304 1.00 0.22 H new ATOM 0 HB2 HIS A 115 6.618 -0.785 2.775 1.00 0.24 H new ATOM 0 HB3 HIS A 115 4.940 -1.223 3.029 1.00 0.24 H new ATOM 0 HD2 HIS A 115 4.282 -1.994 5.675 1.00 0.74 H new ATOM 0 HE1 HIS A 115 7.890 -0.515 7.317 1.00 1.37 H new ATOM 0 HE2 HIS A 115 5.551 -1.378 7.884 1.00 0.94 H new ATOM 1960 N PHE A 116 4.112 -3.771 2.049 1.00 0.25 N ATOM 1961 CA PHE A 116 2.912 -4.589 2.142 1.00 0.30 C ATOM 1962 C PHE A 116 3.191 -6.075 1.883 1.00 0.34 C ATOM 1963 O PHE A 116 2.700 -6.938 2.618 1.00 0.40 O ATOM 1964 CB PHE A 116 1.859 -4.075 1.168 1.00 0.29 C ATOM 1965 CG PHE A 116 0.706 -3.388 1.838 1.00 0.29 C ATOM 1966 CD1 PHE A 116 0.239 -3.825 3.067 1.00 1.12 C ATOM 1967 CD2 PHE A 116 0.091 -2.303 1.240 1.00 1.06 C ATOM 1968 CE1 PHE A 116 -0.821 -3.193 3.682 1.00 1.15 C ATOM 1969 CE2 PHE A 116 -0.970 -1.671 1.852 1.00 1.07 C ATOM 1970 CZ PHE A 116 -1.426 -2.115 3.074 1.00 0.41 C ATOM 0 H PHE A 116 4.157 -3.180 1.219 1.00 0.25 H new ATOM 0 HA PHE A 116 2.542 -4.508 3.164 1.00 0.30 H new ATOM 0 HB2 PHE A 116 2.329 -3.382 0.471 1.00 0.29 H new ATOM 0 HB3 PHE A 116 1.481 -4.911 0.580 1.00 0.29 H new ATOM 0 HD1 PHE A 116 0.710 -4.669 3.548 1.00 1.12 H new ATOM 0 HD2 PHE A 116 0.446 -1.947 0.284 1.00 1.06 H new ATOM 0 HE1 PHE A 116 -1.177 -3.543 4.640 1.00 1.15 H new ATOM 0 HE2 PHE A 116 -1.444 -0.827 1.373 1.00 1.07 H new ATOM 0 HZ PHE A 116 -2.256 -1.619 3.554 1.00 0.41 H new ATOM 1980 N THR A 117 3.948 -6.375 0.833 1.00 0.33 N ATOM 1981 CA THR A 117 4.275 -7.757 0.493 1.00 0.39 C ATOM 1982 C THR A 117 5.137 -8.408 1.567 1.00 0.31 C ATOM 1983 O THR A 117 4.853 -9.513 2.032 1.00 0.27 O ATOM 1984 CB THR A 117 5.036 -7.843 -0.836 1.00 0.50 C ATOM 1985 OG1 THR A 117 5.955 -6.750 -0.959 1.00 0.89 O ATOM 1986 CG2 THR A 117 4.076 -7.851 -2.011 1.00 0.84 C ATOM 0 H THR A 117 4.347 -5.680 0.202 1.00 0.33 H new ATOM 0 HA THR A 117 3.324 -8.283 0.412 1.00 0.39 H new ATOM 0 HB THR A 117 5.596 -8.778 -0.843 1.00 0.50 H new ATOM 0 HG1 THR A 117 5.489 -5.970 -1.326 1.00 0.89 H new ATOM 0 HG21 THR A 117 4.640 -7.912 -2.942 1.00 0.84 H new ATOM 0 HG22 THR A 117 3.411 -8.711 -1.932 1.00 0.84 H new ATOM 0 HG23 THR A 117 3.486 -6.935 -2.005 1.00 0.84 H new ATOM 1994 N GLY A 118 6.193 -7.706 1.940 1.00 0.34 N ATOM 1995 CA GLY A 118 7.114 -8.178 2.940 1.00 0.29 C ATOM 1996 C GLY A 118 6.694 -7.702 4.281 1.00 0.29 C ATOM 1997 O GLY A 118 6.771 -6.508 4.555 1.00 0.35 O ATOM 0 H GLY A 118 6.430 -6.792 1.553 1.00 0.34 H new ATOM 0 HA2 GLY A 118 7.151 -9.267 2.927 1.00 0.29 H new ATOM 0 HA3 GLY A 118 8.120 -7.822 2.717 1.00 0.29 H new ATOM 2001 N PRO A 119 6.232 -8.611 5.142 1.00 0.29 N ATOM 2002 CA PRO A 119 5.762 -8.249 6.456 1.00 0.34 C ATOM 2003 C PRO A 119 6.691 -7.314 7.170 1.00 0.34 C ATOM 2004 O PRO A 119 6.255 -6.360 7.819 1.00 0.43 O ATOM 2005 CB PRO A 119 5.624 -9.583 7.185 1.00 0.37 C ATOM 2006 CG PRO A 119 5.372 -10.572 6.099 1.00 0.44 C ATOM 2007 CD PRO A 119 6.104 -10.057 4.889 1.00 0.32 C ATOM 0 HA PRO A 119 4.822 -7.698 6.409 1.00 0.34 H new ATOM 0 HB2 PRO A 119 6.528 -9.827 7.743 1.00 0.37 H new ATOM 0 HB3 PRO A 119 4.803 -9.562 7.902 1.00 0.37 H new ATOM 0 HG2 PRO A 119 5.733 -11.561 6.381 1.00 0.44 H new ATOM 0 HG3 PRO A 119 4.305 -10.667 5.898 1.00 0.44 H new ATOM 0 HD2 PRO A 119 7.079 -10.531 4.780 1.00 0.32 H new ATOM 0 HD3 PRO A 119 5.549 -10.255 3.972 1.00 0.32 H new ATOM 2015 N VAL A 120 7.953 -7.600 7.021 1.00 0.27 N ATOM 2016 CA VAL A 120 9.006 -6.786 7.587 1.00 0.27 C ATOM 2017 C VAL A 120 10.331 -7.532 7.629 1.00 0.25 C ATOM 2018 O VAL A 120 11.380 -6.925 7.503 1.00 0.24 O ATOM 2019 CB VAL A 120 8.675 -6.255 9.012 1.00 0.34 C ATOM 2020 CG1 VAL A 120 8.799 -7.349 10.066 1.00 0.39 C ATOM 2021 CG2 VAL A 120 9.559 -5.065 9.360 1.00 0.35 C ATOM 0 H VAL A 120 8.289 -8.410 6.500 1.00 0.27 H new ATOM 0 HA VAL A 120 9.090 -5.927 6.921 1.00 0.27 H new ATOM 0 HB VAL A 120 7.636 -5.925 9.007 1.00 0.34 H new ATOM 0 HG11 VAL A 120 8.560 -6.938 11.047 1.00 0.39 H new ATOM 0 HG12 VAL A 120 8.107 -8.159 9.833 1.00 0.39 H new ATOM 0 HG13 VAL A 120 9.819 -7.734 10.073 1.00 0.39 H new ATOM 0 HG21 VAL A 120 9.312 -4.708 10.360 1.00 0.35 H new ATOM 0 HG22 VAL A 120 10.606 -5.368 9.331 1.00 0.35 H new ATOM 0 HG23 VAL A 120 9.393 -4.265 8.638 1.00 0.35 H new ATOM 2031 N SER A 121 10.272 -8.848 7.769 1.00 0.28 N ATOM 2032 CA SER A 121 11.474 -9.673 7.872 1.00 0.31 C ATOM 2033 C SER A 121 12.458 -9.415 6.730 1.00 0.27 C ATOM 2034 O SER A 121 13.648 -9.187 6.971 1.00 0.28 O ATOM 2035 CB SER A 121 11.072 -11.145 7.910 1.00 0.36 C ATOM 2036 OG SER A 121 9.723 -11.280 8.331 1.00 0.49 O ATOM 0 H SER A 121 9.399 -9.374 7.814 1.00 0.28 H new ATOM 0 HA SER A 121 11.989 -9.404 8.794 1.00 0.31 H new ATOM 0 HB2 SER A 121 11.197 -11.588 6.922 1.00 0.36 H new ATOM 0 HB3 SER A 121 11.728 -11.690 8.589 1.00 0.36 H new ATOM 0 HG SER A 121 9.212 -11.755 7.643 1.00 0.49 H new ATOM 2042 N TYR A 122 11.968 -9.431 5.498 1.00 0.25 N ATOM 2043 CA TYR A 122 12.820 -9.184 4.341 1.00 0.26 C ATOM 2044 C TYR A 122 13.372 -7.766 4.401 1.00 0.22 C ATOM 2045 O TYR A 122 14.500 -7.502 3.990 1.00 0.23 O ATOM 2046 CB TYR A 122 12.040 -9.394 3.039 1.00 0.28 C ATOM 2047 CG TYR A 122 12.912 -9.692 1.834 1.00 0.29 C ATOM 2048 CD1 TYR A 122 13.968 -10.593 1.917 1.00 0.39 C ATOM 2049 CD2 TYR A 122 12.674 -9.075 0.611 1.00 0.33 C ATOM 2050 CE1 TYR A 122 14.761 -10.868 0.819 1.00 0.43 C ATOM 2051 CE2 TYR A 122 13.463 -9.347 -0.492 1.00 0.34 C ATOM 2052 CZ TYR A 122 14.505 -10.244 -0.383 1.00 0.35 C ATOM 2053 OH TYR A 122 15.297 -10.518 -1.476 1.00 0.41 O ATOM 0 H TYR A 122 10.990 -9.611 5.274 1.00 0.25 H new ATOM 0 HA TYR A 122 13.649 -9.892 4.360 1.00 0.26 H new ATOM 0 HB2 TYR A 122 11.338 -10.216 3.178 1.00 0.28 H new ATOM 0 HB3 TYR A 122 11.449 -8.501 2.834 1.00 0.28 H new ATOM 0 HD1 TYR A 122 14.172 -11.086 2.856 1.00 0.39 H new ATOM 0 HD2 TYR A 122 11.859 -8.372 0.521 1.00 0.33 H new ATOM 0 HE1 TYR A 122 15.578 -11.569 0.903 1.00 0.43 H new ATOM 0 HE2 TYR A 122 13.264 -8.859 -1.435 1.00 0.34 H new ATOM 0 HH TYR A 122 15.272 -9.760 -2.096 1.00 0.41 H new ATOM 2063 N LEU A 123 12.585 -6.873 4.978 1.00 0.19 N ATOM 2064 CA LEU A 123 12.964 -5.477 5.104 1.00 0.19 C ATOM 2065 C LEU A 123 14.010 -5.312 6.201 1.00 0.19 C ATOM 2066 O LEU A 123 14.886 -4.455 6.111 1.00 0.19 O ATOM 2067 CB LEU A 123 11.719 -4.624 5.388 1.00 0.21 C ATOM 2068 CG LEU A 123 10.963 -4.110 4.156 1.00 0.24 C ATOM 2069 CD1 LEU A 123 11.375 -4.858 2.897 1.00 0.31 C ATOM 2070 CD2 LEU A 123 9.463 -4.237 4.370 1.00 0.29 C ATOM 0 H LEU A 123 11.670 -7.095 5.370 1.00 0.19 H new ATOM 0 HA LEU A 123 13.406 -5.136 4.168 1.00 0.19 H new ATOM 0 HB2 LEU A 123 11.030 -5.212 5.994 1.00 0.21 H new ATOM 0 HB3 LEU A 123 12.020 -3.766 5.990 1.00 0.21 H new ATOM 0 HG LEU A 123 11.220 -3.059 4.022 1.00 0.24 H new ATOM 0 HD11 LEU A 123 10.820 -4.468 2.044 1.00 0.31 H new ATOM 0 HD12 LEU A 123 12.443 -4.723 2.727 1.00 0.31 H new ATOM 0 HD13 LEU A 123 11.158 -5.919 3.017 1.00 0.31 H new ATOM 0 HD21 LEU A 123 8.937 -3.869 3.489 1.00 0.29 H new ATOM 0 HD22 LEU A 123 9.206 -5.283 4.535 1.00 0.29 H new ATOM 0 HD23 LEU A 123 9.169 -3.650 5.240 1.00 0.29 H new ATOM 2082 N ILE A 124 13.927 -6.159 7.222 1.00 0.21 N ATOM 2083 CA ILE A 124 14.874 -6.114 8.331 1.00 0.23 C ATOM 2084 C ILE A 124 16.232 -6.606 7.875 1.00 0.23 C ATOM 2085 O ILE A 124 17.257 -5.980 8.151 1.00 0.24 O ATOM 2086 CB ILE A 124 14.447 -6.982 9.542 1.00 0.28 C ATOM 2087 CG1 ILE A 124 12.972 -6.771 9.896 1.00 0.30 C ATOM 2088 CG2 ILE A 124 15.339 -6.676 10.740 1.00 0.32 C ATOM 2089 CD1 ILE A 124 12.606 -7.194 11.306 1.00 0.38 C ATOM 0 H ILE A 124 13.215 -6.884 7.305 1.00 0.21 H new ATOM 0 HA ILE A 124 14.906 -5.072 8.649 1.00 0.23 H new ATOM 0 HB ILE A 124 14.567 -8.030 9.267 1.00 0.28 H new ATOM 0 HG12 ILE A 124 12.726 -5.717 9.769 1.00 0.30 H new ATOM 0 HG13 ILE A 124 12.357 -7.329 9.190 1.00 0.30 H new ATOM 0 HG21 ILE A 124 15.033 -7.290 11.587 1.00 0.32 H new ATOM 0 HG22 ILE A 124 16.376 -6.897 10.487 1.00 0.32 H new ATOM 0 HG23 ILE A 124 15.246 -5.622 11.003 1.00 0.32 H new ATOM 0 HD11 ILE A 124 11.545 -7.012 11.477 1.00 0.38 H new ATOM 0 HD12 ILE A 124 12.817 -8.256 11.434 1.00 0.38 H new ATOM 0 HD13 ILE A 124 13.193 -6.619 12.022 1.00 0.38 H new ATOM 2101 N ARG A 125 16.234 -7.717 7.152 1.00 0.24 N ATOM 2102 CA ARG A 125 17.473 -8.307 6.682 1.00 0.26 C ATOM 2103 C ARG A 125 18.093 -7.445 5.596 1.00 0.24 C ATOM 2104 O ARG A 125 19.309 -7.334 5.517 1.00 0.26 O ATOM 2105 CB ARG A 125 17.246 -9.743 6.188 1.00 0.31 C ATOM 2106 CG ARG A 125 16.420 -9.847 4.918 1.00 1.06 C ATOM 2107 CD ARG A 125 17.226 -10.438 3.773 1.00 2.18 C ATOM 2108 NE ARG A 125 17.358 -11.891 3.885 1.00 2.73 N ATOM 2109 CZ ARG A 125 17.950 -12.657 2.970 1.00 3.68 C ATOM 2110 NH1 ARG A 125 18.504 -12.106 1.894 1.00 4.16 N ATOM 2111 NH2 ARG A 125 17.995 -13.972 3.140 1.00 4.42 N ATOM 0 H ARG A 125 15.392 -8.225 6.880 1.00 0.24 H new ATOM 0 HA ARG A 125 18.170 -8.353 7.519 1.00 0.26 H new ATOM 0 HB2 ARG A 125 18.215 -10.212 6.016 1.00 0.31 H new ATOM 0 HB3 ARG A 125 16.752 -10.311 6.976 1.00 0.31 H new ATOM 0 HG2 ARG A 125 15.543 -10.466 5.104 1.00 1.06 H new ATOM 0 HG3 ARG A 125 16.058 -8.858 4.637 1.00 1.06 H new ATOM 0 HD2 ARG A 125 16.746 -10.190 2.826 1.00 2.18 H new ATOM 0 HD3 ARG A 125 18.217 -9.985 3.756 1.00 2.18 H new ATOM 0 HE ARG A 125 16.974 -12.345 4.714 1.00 2.73 H new ATOM 0 HH11 ARG A 125 18.476 -11.094 1.768 1.00 4.16 H new ATOM 0 HH12 ARG A 125 18.957 -12.695 1.195 1.00 4.16 H new ATOM 0 HH21 ARG A 125 17.577 -14.394 3.969 1.00 4.42 H new ATOM 0 HH22 ARG A 125 18.448 -14.561 2.441 1.00 4.42 H new ATOM 2125 N ILE A 126 17.261 -6.817 4.774 1.00 0.21 N ATOM 2126 CA ILE A 126 17.769 -5.956 3.719 1.00 0.21 C ATOM 2127 C ILE A 126 18.354 -4.693 4.331 1.00 0.20 C ATOM 2128 O ILE A 126 19.443 -4.267 3.963 1.00 0.21 O ATOM 2129 CB ILE A 126 16.676 -5.594 2.681 1.00 0.21 C ATOM 2130 CG1 ILE A 126 16.408 -6.790 1.764 1.00 0.23 C ATOM 2131 CG2 ILE A 126 17.082 -4.376 1.858 1.00 0.22 C ATOM 2132 CD1 ILE A 126 15.371 -6.516 0.697 1.00 0.25 C ATOM 0 H ILE A 126 16.244 -6.887 4.818 1.00 0.21 H new ATOM 0 HA ILE A 126 18.547 -6.504 3.186 1.00 0.21 H new ATOM 0 HB ILE A 126 15.762 -5.346 3.220 1.00 0.21 H new ATOM 0 HG12 ILE A 126 17.341 -7.085 1.284 1.00 0.23 H new ATOM 0 HG13 ILE A 126 16.079 -7.635 2.369 1.00 0.23 H new ATOM 0 HG21 ILE A 126 16.297 -4.145 1.138 1.00 0.22 H new ATOM 0 HG22 ILE A 126 17.230 -3.523 2.520 1.00 0.22 H new ATOM 0 HG23 ILE A 126 18.010 -4.589 1.327 1.00 0.22 H new ATOM 0 HD11 ILE A 126 15.234 -7.408 0.086 1.00 0.25 H new ATOM 0 HD12 ILE A 126 14.425 -6.250 1.169 1.00 0.25 H new ATOM 0 HD13 ILE A 126 15.706 -5.692 0.067 1.00 0.25 H new ATOM 2144 N ARG A 127 17.640 -4.121 5.293 1.00 0.19 N ATOM 2145 CA ARG A 127 18.099 -2.903 5.962 1.00 0.19 C ATOM 2146 C ARG A 127 19.395 -3.159 6.719 1.00 0.20 C ATOM 2147 O ARG A 127 20.286 -2.318 6.733 1.00 0.21 O ATOM 2148 CB ARG A 127 17.029 -2.373 6.916 1.00 0.21 C ATOM 2149 CG ARG A 127 17.230 -0.915 7.297 1.00 0.68 C ATOM 2150 CD ARG A 127 15.909 -0.225 7.591 1.00 0.86 C ATOM 2151 NE ARG A 127 15.467 -0.436 8.968 1.00 1.25 N ATOM 2152 CZ ARG A 127 14.282 -0.043 9.433 1.00 1.55 C ATOM 2153 NH1 ARG A 127 13.410 0.535 8.621 1.00 1.70 N ATOM 2154 NH2 ARG A 127 13.967 -0.236 10.709 1.00 2.38 N ATOM 0 H ARG A 127 16.745 -4.476 5.628 1.00 0.19 H new ATOM 0 HA ARG A 127 18.286 -2.150 5.197 1.00 0.19 H new ATOM 0 HB2 ARG A 127 16.049 -2.488 6.452 1.00 0.21 H new ATOM 0 HB3 ARG A 127 17.026 -2.981 7.821 1.00 0.21 H new ATOM 0 HG2 ARG A 127 17.876 -0.853 8.173 1.00 0.68 H new ATOM 0 HG3 ARG A 127 17.741 -0.394 6.487 1.00 0.68 H new ATOM 0 HD2 ARG A 127 16.011 0.844 7.404 1.00 0.86 H new ATOM 0 HD3 ARG A 127 15.147 -0.597 6.906 1.00 0.86 H new ATOM 0 HE ARG A 127 16.102 -0.911 9.609 1.00 1.25 H new ATOM 0 HH11 ARG A 127 13.646 0.679 7.639 1.00 1.70 H new ATOM 0 HH12 ARG A 127 12.503 0.836 8.977 1.00 1.70 H new ATOM 0 HH21 ARG A 127 14.633 -0.686 11.336 1.00 2.38 H new ATOM 0 HH22 ARG A 127 13.059 0.066 11.061 1.00 2.38 H new ATOM 2168 N ALA A 128 19.495 -4.324 7.343 1.00 0.20 N ATOM 2169 CA ALA A 128 20.690 -4.684 8.094 1.00 0.22 C ATOM 2170 C ALA A 128 21.824 -5.063 7.157 1.00 0.22 C ATOM 2171 O ALA A 128 22.985 -4.742 7.414 1.00 0.23 O ATOM 2172 CB ALA A 128 20.393 -5.815 9.064 1.00 0.24 C ATOM 0 H ALA A 128 18.764 -5.036 7.344 1.00 0.20 H new ATOM 0 HA ALA A 128 21.004 -3.813 8.670 1.00 0.22 H new ATOM 0 HB1 ALA A 128 21.298 -6.069 9.615 1.00 0.24 H new ATOM 0 HB2 ALA A 128 19.619 -5.500 9.764 1.00 0.24 H new ATOM 0 HB3 ALA A 128 20.049 -6.688 8.510 1.00 0.24 H new ATOM 2178 N ALA A 129 21.493 -5.741 6.068 1.00 0.21 N ATOM 2179 CA ALA A 129 22.505 -6.134 5.102 1.00 0.22 C ATOM 2180 C ALA A 129 23.031 -4.906 4.379 1.00 0.21 C ATOM 2181 O ALA A 129 24.234 -4.764 4.168 1.00 0.22 O ATOM 2182 CB ALA A 129 21.952 -7.140 4.107 1.00 0.23 C ATOM 0 H ALA A 129 20.542 -6.027 5.834 1.00 0.21 H new ATOM 0 HA ALA A 129 23.325 -6.612 5.637 1.00 0.22 H new ATOM 0 HB1 ALA A 129 22.732 -7.416 3.397 1.00 0.23 H new ATOM 0 HB2 ALA A 129 21.615 -8.030 4.639 1.00 0.23 H new ATOM 0 HB3 ALA A 129 21.113 -6.698 3.571 1.00 0.23 H new ATOM 2188 N LEU A 130 22.120 -4.012 4.013 1.00 0.19 N ATOM 2189 CA LEU A 130 22.493 -2.789 3.323 1.00 0.19 C ATOM 2190 C LEU A 130 23.199 -1.827 4.269 1.00 0.19 C ATOM 2191 O LEU A 130 24.032 -1.026 3.845 1.00 0.19 O ATOM 2192 CB LEU A 130 21.258 -2.126 2.719 1.00 0.19 C ATOM 2193 CG LEU A 130 20.841 -2.649 1.340 1.00 0.20 C ATOM 2194 CD1 LEU A 130 19.760 -1.768 0.737 1.00 0.23 C ATOM 2195 CD2 LEU A 130 22.035 -2.728 0.402 1.00 0.21 C ATOM 0 H LEU A 130 21.119 -4.113 4.184 1.00 0.19 H new ATOM 0 HA LEU A 130 23.184 -3.046 2.520 1.00 0.19 H new ATOM 0 HB2 LEU A 130 20.423 -2.257 3.407 1.00 0.19 H new ATOM 0 HB3 LEU A 130 21.442 -1.054 2.642 1.00 0.19 H new ATOM 0 HG LEU A 130 20.441 -3.654 1.472 1.00 0.20 H new ATOM 0 HD11 LEU A 130 19.478 -2.156 -0.242 1.00 0.23 H new ATOM 0 HD12 LEU A 130 18.888 -1.763 1.391 1.00 0.23 H new ATOM 0 HD13 LEU A 130 20.138 -0.751 0.629 1.00 0.23 H new ATOM 0 HD21 LEU A 130 21.711 -3.102 -0.569 1.00 0.21 H new ATOM 0 HD22 LEU A 130 22.470 -1.736 0.282 1.00 0.21 H new ATOM 0 HD23 LEU A 130 22.782 -3.403 0.820 1.00 0.21 H new ATOM 2207 N LYS A 131 22.869 -1.925 5.554 1.00 0.19 N ATOM 2208 CA LYS A 131 23.469 -1.084 6.586 1.00 0.19 C ATOM 2209 C LYS A 131 24.984 -1.230 6.575 1.00 0.20 C ATOM 2210 O LYS A 131 25.717 -0.287 6.887 1.00 0.22 O ATOM 2211 CB LYS A 131 22.933 -1.488 7.955 1.00 0.22 C ATOM 2212 CG LYS A 131 22.502 -0.323 8.826 1.00 0.41 C ATOM 2213 CD LYS A 131 21.963 -0.817 10.157 1.00 0.61 C ATOM 2214 CE LYS A 131 20.555 -1.376 10.022 1.00 1.34 C ATOM 2215 NZ LYS A 131 20.175 -2.198 11.200 1.00 1.79 N ATOM 0 H LYS A 131 22.180 -2.588 5.909 1.00 0.19 H new ATOM 0 HA LYS A 131 23.211 -0.045 6.382 1.00 0.19 H new ATOM 0 HB2 LYS A 131 22.083 -2.157 7.817 1.00 0.22 H new ATOM 0 HB3 LYS A 131 23.702 -2.054 8.481 1.00 0.22 H new ATOM 0 HG2 LYS A 131 23.348 0.343 8.996 1.00 0.41 H new ATOM 0 HG3 LYS A 131 21.737 0.258 8.312 1.00 0.41 H new ATOM 0 HD2 LYS A 131 22.624 -1.588 10.554 1.00 0.61 H new ATOM 0 HD3 LYS A 131 21.962 0.003 10.876 1.00 0.61 H new ATOM 0 HE2 LYS A 131 19.847 -0.555 9.907 1.00 1.34 H new ATOM 0 HE3 LYS A 131 20.489 -1.982 9.119 1.00 1.34 H new ATOM 0 HZ1 LYS A 131 19.209 -2.562 11.072 1.00 1.79 H new ATOM 0 HZ2 LYS A 131 20.836 -2.995 11.295 1.00 1.79 H new ATOM 0 HZ3 LYS A 131 20.214 -1.613 12.059 1.00 1.79 H new ATOM 2229 N LYS A 132 25.441 -2.426 6.219 1.00 0.22 N ATOM 2230 CA LYS A 132 26.859 -2.729 6.138 1.00 0.24 C ATOM 2231 C LYS A 132 27.528 -1.888 5.061 1.00 0.23 C ATOM 2232 O LYS A 132 28.691 -1.508 5.173 1.00 0.25 O ATOM 2233 CB LYS A 132 27.026 -4.194 5.784 1.00 0.28 C ATOM 2234 CG LYS A 132 26.809 -5.137 6.953 1.00 0.39 C ATOM 2235 CD LYS A 132 28.001 -5.169 7.894 1.00 0.57 C ATOM 2236 CE LYS A 132 27.752 -6.124 9.048 1.00 1.06 C ATOM 2237 NZ LYS A 132 28.985 -6.400 9.829 1.00 1.52 N ATOM 0 H LYS A 132 24.835 -3.211 5.979 1.00 0.22 H new ATOM 0 HA LYS A 132 27.322 -2.507 7.099 1.00 0.24 H new ATOM 0 HB2 LYS A 132 26.324 -4.448 4.990 1.00 0.28 H new ATOM 0 HB3 LYS A 132 28.029 -4.350 5.385 1.00 0.28 H new ATOM 0 HG2 LYS A 132 25.921 -4.830 7.505 1.00 0.39 H new ATOM 0 HG3 LYS A 132 26.619 -6.142 6.576 1.00 0.39 H new ATOM 0 HD2 LYS A 132 28.893 -5.476 7.348 1.00 0.57 H new ATOM 0 HD3 LYS A 132 28.193 -4.168 8.280 1.00 0.57 H new ATOM 0 HE2 LYS A 132 26.994 -5.703 9.708 1.00 1.06 H new ATOM 0 HE3 LYS A 132 27.353 -7.061 8.661 1.00 1.06 H new ATOM 0 HZ1 LYS A 132 28.765 -7.056 10.605 1.00 1.52 H new ATOM 0 HZ2 LYS A 132 29.701 -6.827 9.207 1.00 1.52 H new ATOM 0 HZ3 LYS A 132 29.353 -5.510 10.222 1.00 1.52 H new ATOM 2251 N LYS A 133 26.763 -1.598 4.028 1.00 0.22 N ATOM 2252 CA LYS A 133 27.228 -0.800 2.905 1.00 0.25 C ATOM 2253 C LYS A 133 26.856 0.666 3.092 1.00 0.23 C ATOM 2254 O LYS A 133 27.007 1.474 2.175 1.00 0.25 O ATOM 2255 CB LYS A 133 26.612 -1.321 1.611 1.00 0.30 C ATOM 2256 CG LYS A 133 27.632 -1.876 0.633 1.00 0.49 C ATOM 2257 CD LYS A 133 27.024 -2.105 -0.739 1.00 0.65 C ATOM 2258 CE LYS A 133 26.947 -0.813 -1.538 1.00 1.12 C ATOM 2259 NZ LYS A 133 28.295 -0.319 -1.925 1.00 1.56 N ATOM 0 H LYS A 133 25.796 -1.910 3.941 1.00 0.22 H new ATOM 0 HA LYS A 133 28.314 -0.880 2.853 1.00 0.25 H new ATOM 0 HB2 LYS A 133 25.889 -2.101 1.851 1.00 0.30 H new ATOM 0 HB3 LYS A 133 26.061 -0.513 1.129 1.00 0.30 H new ATOM 0 HG2 LYS A 133 28.470 -1.184 0.549 1.00 0.49 H new ATOM 0 HG3 LYS A 133 28.031 -2.815 1.016 1.00 0.49 H new ATOM 0 HD2 LYS A 133 27.620 -2.836 -1.285 1.00 0.65 H new ATOM 0 HD3 LYS A 133 26.025 -2.526 -0.629 1.00 0.65 H new ATOM 0 HE2 LYS A 133 26.349 -0.976 -2.435 1.00 1.12 H new ATOM 0 HE3 LYS A 133 26.437 -0.051 -0.948 1.00 1.12 H new ATOM 0 HZ1 LYS A 133 28.205 0.353 -2.714 1.00 1.56 H new ATOM 0 HZ2 LYS A 133 28.736 0.158 -1.113 1.00 1.56 H new ATOM 0 HZ3 LYS A 133 28.887 -1.121 -2.219 1.00 1.56 H new ATOM 2273 N ASN A 134 26.353 0.984 4.284 1.00 0.20 N ATOM 2274 CA ASN A 134 25.940 2.341 4.641 1.00 0.21 C ATOM 2275 C ASN A 134 24.669 2.740 3.891 1.00 0.21 C ATOM 2276 O ASN A 134 24.389 3.924 3.702 1.00 0.26 O ATOM 2277 CB ASN A 134 27.062 3.350 4.371 1.00 0.25 C ATOM 2278 CG ASN A 134 27.048 4.525 5.334 1.00 0.31 C ATOM 2279 OD1 ASN A 134 26.036 4.820 5.973 1.00 1.09 O ATOM 2280 ND2 ASN A 134 28.175 5.211 5.440 1.00 1.15 N ATOM 0 H ASN A 134 26.220 0.305 5.033 1.00 0.20 H new ATOM 0 HA ASN A 134 25.725 2.351 5.710 1.00 0.21 H new ATOM 0 HB2 ASN A 134 28.024 2.842 4.440 1.00 0.25 H new ATOM 0 HB3 ASN A 134 26.970 3.722 3.351 1.00 0.25 H new ATOM 0 HD21 ASN A 134 28.226 6.014 6.067 1.00 1.15 H new ATOM 0 HD22 ASN A 134 28.992 4.937 4.895 1.00 1.15 H new ATOM 2287 N TYR A 135 23.914 1.740 3.455 1.00 0.19 N ATOM 2288 CA TYR A 135 22.665 1.966 2.750 1.00 0.19 C ATOM 2289 C TYR A 135 21.500 1.702 3.692 1.00 0.19 C ATOM 2290 O TYR A 135 21.354 0.610 4.237 1.00 0.20 O ATOM 2291 CB TYR A 135 22.571 1.051 1.529 1.00 0.20 C ATOM 2292 CG TYR A 135 22.540 1.776 0.203 1.00 0.24 C ATOM 2293 CD1 TYR A 135 21.465 2.583 -0.144 1.00 1.21 C ATOM 2294 CD2 TYR A 135 23.579 1.640 -0.706 1.00 1.21 C ATOM 2295 CE1 TYR A 135 21.431 3.239 -1.359 1.00 1.26 C ATOM 2296 CE2 TYR A 135 23.551 2.292 -1.923 1.00 1.22 C ATOM 2297 CZ TYR A 135 22.476 3.091 -2.246 1.00 0.43 C ATOM 2298 OH TYR A 135 22.445 3.742 -3.460 1.00 0.55 O ATOM 0 H TYR A 135 24.151 0.756 3.580 1.00 0.19 H new ATOM 0 HA TYR A 135 22.628 3.001 2.409 1.00 0.19 H new ATOM 0 HB2 TYR A 135 23.421 0.369 1.536 1.00 0.20 H new ATOM 0 HB3 TYR A 135 21.672 0.441 1.616 1.00 0.20 H new ATOM 0 HD1 TYR A 135 20.643 2.700 0.547 1.00 1.21 H new ATOM 0 HD2 TYR A 135 24.423 1.014 -0.458 1.00 1.21 H new ATOM 0 HE1 TYR A 135 20.589 3.866 -1.613 1.00 1.26 H new ATOM 0 HE2 TYR A 135 24.369 2.176 -2.619 1.00 1.22 H new ATOM 0 HH TYR A 135 23.258 3.532 -3.965 1.00 0.55 H new ATOM 2308 N LYS A 136 20.687 2.709 3.895 1.00 0.19 N ATOM 2309 CA LYS A 136 19.544 2.602 4.772 1.00 0.20 C ATOM 2310 C LYS A 136 18.277 2.933 4.019 1.00 0.20 C ATOM 2311 O LYS A 136 18.263 3.830 3.191 1.00 0.22 O ATOM 2312 CB LYS A 136 19.718 3.541 5.957 1.00 0.22 C ATOM 2313 CG LYS A 136 20.513 2.916 7.085 1.00 0.28 C ATOM 2314 CD LYS A 136 21.406 3.930 7.789 1.00 0.58 C ATOM 2315 CE LYS A 136 20.601 5.067 8.397 1.00 1.52 C ATOM 2316 NZ LYS A 136 21.469 6.077 9.061 1.00 1.80 N ATOM 0 H LYS A 136 20.797 3.624 3.459 1.00 0.19 H new ATOM 0 HA LYS A 136 19.469 1.579 5.140 1.00 0.20 H new ATOM 0 HB2 LYS A 136 20.219 4.450 5.625 1.00 0.22 H new ATOM 0 HB3 LYS A 136 18.737 3.836 6.329 1.00 0.22 H new ATOM 0 HG2 LYS A 136 19.828 2.473 7.808 1.00 0.28 H new ATOM 0 HG3 LYS A 136 21.127 2.106 6.690 1.00 0.28 H new ATOM 0 HD2 LYS A 136 21.977 3.430 8.572 1.00 0.58 H new ATOM 0 HD3 LYS A 136 22.127 4.335 7.078 1.00 0.58 H new ATOM 0 HE2 LYS A 136 20.013 5.552 7.617 1.00 1.52 H new ATOM 0 HE3 LYS A 136 19.896 4.663 9.123 1.00 1.52 H new ATOM 0 HZ1 LYS A 136 20.878 6.833 9.461 1.00 1.80 H new ATOM 0 HZ2 LYS A 136 22.011 5.622 9.823 1.00 1.80 H new ATOM 0 HZ3 LYS A 136 22.125 6.483 8.364 1.00 1.80 H new ATOM 2330 N LEU A 137 17.226 2.194 4.305 1.00 0.19 N ATOM 2331 CA LEU A 137 15.940 2.393 3.647 1.00 0.20 C ATOM 2332 C LEU A 137 14.972 3.097 4.588 1.00 0.23 C ATOM 2333 O LEU A 137 14.968 2.821 5.788 1.00 0.25 O ATOM 2334 CB LEU A 137 15.339 1.044 3.238 1.00 0.23 C ATOM 2335 CG LEU A 137 16.264 0.080 2.472 1.00 0.23 C ATOM 2336 CD1 LEU A 137 17.103 0.821 1.442 1.00 0.22 C ATOM 2337 CD2 LEU A 137 17.151 -0.702 3.434 1.00 0.25 C ATOM 0 H LEU A 137 17.232 1.442 4.994 1.00 0.19 H new ATOM 0 HA LEU A 137 16.101 3.006 2.760 1.00 0.20 H new ATOM 0 HB2 LEU A 137 14.992 0.539 4.139 1.00 0.23 H new ATOM 0 HB3 LEU A 137 14.461 1.235 2.621 1.00 0.23 H new ATOM 0 HG LEU A 137 15.633 -0.630 1.938 1.00 0.23 H new ATOM 0 HD11 LEU A 137 17.745 0.113 0.918 1.00 0.22 H new ATOM 0 HD12 LEU A 137 16.447 1.315 0.725 1.00 0.22 H new ATOM 0 HD13 LEU A 137 17.719 1.567 1.943 1.00 0.22 H new ATOM 0 HD21 LEU A 137 17.795 -1.376 2.869 1.00 0.25 H new ATOM 0 HD22 LEU A 137 17.766 -0.008 4.008 1.00 0.25 H new ATOM 0 HD23 LEU A 137 16.527 -1.282 4.114 1.00 0.25 H new ATOM 2349 N ASN A 138 14.152 3.998 4.060 1.00 0.24 N ATOM 2350 CA ASN A 138 13.197 4.703 4.891 1.00 0.30 C ATOM 2351 C ASN A 138 11.972 5.062 4.084 1.00 0.38 C ATOM 2352 O ASN A 138 12.017 5.051 2.844 1.00 0.37 O ATOM 2353 CB ASN A 138 13.820 5.965 5.493 1.00 0.34 C ATOM 2354 CG ASN A 138 13.170 6.343 6.805 1.00 0.47 C ATOM 2355 OD1 ASN A 138 12.632 5.486 7.501 1.00 1.20 O ATOM 2356 ND2 ASN A 138 13.222 7.615 7.156 1.00 0.96 N ATOM 0 H ASN A 138 14.132 4.252 3.072 1.00 0.24 H new ATOM 0 HA ASN A 138 12.905 4.044 5.709 1.00 0.30 H new ATOM 0 HB2 ASN A 138 14.887 5.804 5.649 1.00 0.34 H new ATOM 0 HB3 ASN A 138 13.722 6.790 4.788 1.00 0.34 H new ATOM 0 HD21 ASN A 138 12.805 7.919 8.036 1.00 0.96 H new ATOM 0 HD22 ASN A 138 13.679 8.294 6.547 1.00 0.96 H new ATOM 2363 N GLN A 139 10.869 5.379 4.775 1.00 0.47 N ATOM 2364 CA GLN A 139 9.652 5.753 4.083 1.00 0.58 C ATOM 2365 C GLN A 139 9.970 6.913 3.174 1.00 0.62 C ATOM 2366 O GLN A 139 9.353 7.073 2.130 1.00 0.71 O ATOM 2367 CB GLN A 139 8.495 6.089 5.035 1.00 0.69 C ATOM 2368 CG GLN A 139 8.848 7.035 6.166 1.00 0.83 C ATOM 2369 CD GLN A 139 9.436 6.341 7.377 1.00 1.61 C ATOM 2370 OE1 GLN A 139 9.090 5.077 7.573 1.00 2.30 O flip ATOM 2371 NE2 GLN A 139 10.204 6.937 8.127 1.00 2.08 N flip ATOM 0 H GLN A 139 10.804 5.381 5.793 1.00 0.47 H new ATOM 0 HA GLN A 139 9.304 4.898 3.504 1.00 0.58 H new ATOM 0 HB2 GLN A 139 7.683 6.528 4.455 1.00 0.69 H new ATOM 0 HB3 GLN A 139 8.116 5.161 5.463 1.00 0.69 H new ATOM 0 HG2 GLN A 139 9.560 7.775 5.801 1.00 0.83 H new ATOM 0 HG3 GLN A 139 7.952 7.577 6.468 1.00 0.83 H new ATOM 0 HE21 GLN A 139 10.445 7.910 7.941 1.00 2.08 H new ATOM 0 HE22 GLN A 139 10.601 6.459 8.936 1.00 2.08 H new ATOM 2380 N TYR A 140 10.954 7.727 3.556 1.00 0.58 N ATOM 2381 CA TYR A 140 11.340 8.783 2.695 1.00 0.64 C ATOM 2382 C TYR A 140 12.689 8.467 2.055 1.00 0.49 C ATOM 2383 O TYR A 140 13.679 9.172 2.266 1.00 0.55 O ATOM 2384 CB TYR A 140 11.498 10.078 3.469 1.00 0.83 C ATOM 2385 CG TYR A 140 10.602 10.244 4.677 1.00 1.13 C ATOM 2386 CD1 TYR A 140 9.323 10.767 4.550 1.00 1.83 C ATOM 2387 CD2 TYR A 140 11.055 9.915 5.949 1.00 1.76 C ATOM 2388 CE1 TYR A 140 8.520 10.957 5.659 1.00 2.16 C ATOM 2389 CE2 TYR A 140 10.255 10.095 7.060 1.00 2.14 C ATOM 2390 CZ TYR A 140 8.989 10.619 6.909 1.00 2.03 C ATOM 2391 OH TYR A 140 8.192 10.816 8.011 1.00 2.52 O ATOM 0 H TYR A 140 11.469 7.660 4.434 1.00 0.58 H new ATOM 0 HA TYR A 140 10.564 8.890 1.937 1.00 0.64 H new ATOM 0 HB2 TYR A 140 12.534 10.158 3.797 1.00 0.83 H new ATOM 0 HB3 TYR A 140 11.314 10.909 2.788 1.00 0.83 H new ATOM 0 HD1 TYR A 140 8.950 11.029 3.571 1.00 1.83 H new ATOM 0 HD2 TYR A 140 12.049 9.512 6.071 1.00 1.76 H new ATOM 0 HE1 TYR A 140 7.528 11.369 5.546 1.00 2.16 H new ATOM 0 HE2 TYR A 140 10.619 9.827 8.041 1.00 2.14 H new ATOM 0 HH TYR A 140 7.270 10.563 7.797 1.00 2.52 H new ATOM 2401 N GLY A 141 12.711 7.388 1.301 1.00 0.36 N ATOM 2402 CA GLY A 141 13.864 7.076 0.489 1.00 0.27 C ATOM 2403 C GLY A 141 14.959 6.338 1.207 1.00 0.23 C ATOM 2404 O GLY A 141 14.833 5.974 2.369 1.00 0.24 O ATOM 0 H GLY A 141 11.946 6.716 1.235 1.00 0.36 H new ATOM 0 HA2 GLY A 141 13.540 6.478 -0.363 1.00 0.27 H new ATOM 0 HA3 GLY A 141 14.272 8.005 0.090 1.00 0.27 H new ATOM 2408 N LEU A 142 16.031 6.112 0.483 1.00 0.21 N ATOM 2409 CA LEU A 142 17.188 5.424 1.011 1.00 0.19 C ATOM 2410 C LEU A 142 18.294 6.440 1.284 1.00 0.20 C ATOM 2411 O LEU A 142 18.441 7.412 0.551 1.00 0.24 O ATOM 2412 CB LEU A 142 17.694 4.347 0.031 1.00 0.20 C ATOM 2413 CG LEU A 142 17.088 4.365 -1.382 1.00 0.24 C ATOM 2414 CD1 LEU A 142 18.038 3.712 -2.374 1.00 0.27 C ATOM 2415 CD2 LEU A 142 15.750 3.647 -1.406 1.00 0.34 C ATOM 0 H LEU A 142 16.126 6.400 -0.491 1.00 0.21 H new ATOM 0 HA LEU A 142 16.903 4.925 1.937 1.00 0.19 H new ATOM 0 HB2 LEU A 142 18.775 4.450 -0.060 1.00 0.20 H new ATOM 0 HB3 LEU A 142 17.503 3.368 0.471 1.00 0.20 H new ATOM 0 HG LEU A 142 16.931 5.405 -1.668 1.00 0.24 H new ATOM 0 HD11 LEU A 142 17.595 3.732 -3.370 1.00 0.27 H new ATOM 0 HD12 LEU A 142 18.982 4.256 -2.386 1.00 0.27 H new ATOM 0 HD13 LEU A 142 18.219 2.679 -2.078 1.00 0.27 H new ATOM 0 HD21 LEU A 142 15.341 3.673 -2.416 1.00 0.34 H new ATOM 0 HD22 LEU A 142 15.887 2.611 -1.097 1.00 0.34 H new ATOM 0 HD23 LEU A 142 15.060 4.141 -0.722 1.00 0.34 H new ATOM 2427 N PHE A 143 19.041 6.248 2.353 1.00 0.20 N ATOM 2428 CA PHE A 143 20.133 7.148 2.692 1.00 0.23 C ATOM 2429 C PHE A 143 21.438 6.382 2.647 1.00 0.23 C ATOM 2430 O PHE A 143 21.615 5.394 3.356 1.00 0.24 O ATOM 2431 CB PHE A 143 19.931 7.762 4.079 1.00 0.26 C ATOM 2432 CG PHE A 143 18.495 8.078 4.399 1.00 0.28 C ATOM 2433 CD1 PHE A 143 17.709 8.791 3.507 1.00 1.22 C ATOM 2434 CD2 PHE A 143 17.930 7.651 5.589 1.00 1.23 C ATOM 2435 CE1 PHE A 143 16.387 9.073 3.798 1.00 1.23 C ATOM 2436 CE2 PHE A 143 16.610 7.930 5.883 1.00 1.25 C ATOM 2437 CZ PHE A 143 15.838 8.642 4.985 1.00 0.35 C ATOM 0 H PHE A 143 18.914 5.475 3.006 1.00 0.20 H new ATOM 0 HA PHE A 143 20.156 7.962 1.967 1.00 0.23 H new ATOM 0 HB2 PHE A 143 20.318 7.074 4.831 1.00 0.26 H new ATOM 0 HB3 PHE A 143 20.519 8.677 4.151 1.00 0.26 H new ATOM 0 HD1 PHE A 143 18.134 9.130 2.574 1.00 1.22 H new ATOM 0 HD2 PHE A 143 18.528 7.094 6.295 1.00 1.23 H new ATOM 0 HE1 PHE A 143 15.786 9.631 3.095 1.00 1.23 H new ATOM 0 HE2 PHE A 143 16.181 7.592 6.815 1.00 1.25 H new ATOM 0 HZ PHE A 143 14.805 8.860 5.214 1.00 0.35 H new ATOM 2447 N LYS A 144 22.333 6.826 1.786 1.00 0.24 N ATOM 2448 CA LYS A 144 23.626 6.184 1.630 1.00 0.27 C ATOM 2449 C LYS A 144 24.737 7.201 1.773 1.00 0.29 C ATOM 2450 O LYS A 144 24.749 8.215 1.078 1.00 0.30 O ATOM 2451 CB LYS A 144 23.714 5.496 0.267 1.00 0.30 C ATOM 2452 CG LYS A 144 25.083 4.916 -0.055 1.00 0.40 C ATOM 2453 CD LYS A 144 25.738 5.649 -1.215 1.00 0.54 C ATOM 2454 CE LYS A 144 27.036 4.980 -1.630 1.00 1.20 C ATOM 2455 NZ LYS A 144 27.623 5.610 -2.840 1.00 1.67 N ATOM 0 H LYS A 144 22.188 7.634 1.180 1.00 0.24 H new ATOM 0 HA LYS A 144 23.738 5.431 2.411 1.00 0.27 H new ATOM 0 HB2 LYS A 144 22.975 4.695 0.229 1.00 0.30 H new ATOM 0 HB3 LYS A 144 23.446 6.215 -0.507 1.00 0.30 H new ATOM 0 HG2 LYS A 144 25.723 4.980 0.825 1.00 0.40 H new ATOM 0 HG3 LYS A 144 24.983 3.859 -0.301 1.00 0.40 H new ATOM 0 HD2 LYS A 144 25.054 5.677 -2.063 1.00 0.54 H new ATOM 0 HD3 LYS A 144 25.934 6.683 -0.930 1.00 0.54 H new ATOM 0 HE2 LYS A 144 27.751 5.035 -0.809 1.00 1.20 H new ATOM 0 HE3 LYS A 144 26.854 3.923 -1.824 1.00 1.20 H new ATOM 0 HZ1 LYS A 144 28.508 5.124 -3.090 1.00 1.67 H new ATOM 0 HZ2 LYS A 144 26.952 5.535 -3.631 1.00 1.67 H new ATOM 0 HZ3 LYS A 144 27.821 6.613 -2.648 1.00 1.67 H new ATOM 2469 N ASN A 145 25.658 6.923 2.687 1.00 0.33 N ATOM 2470 CA ASN A 145 26.796 7.807 2.951 1.00 0.37 C ATOM 2471 C ASN A 145 26.325 9.220 3.277 1.00 0.38 C ATOM 2472 O ASN A 145 26.940 10.201 2.858 1.00 0.41 O ATOM 2473 CB ASN A 145 27.742 7.835 1.747 1.00 0.41 C ATOM 2474 CG ASN A 145 29.096 7.232 2.059 1.00 0.73 C ATOM 2475 OD1 ASN A 145 30.031 7.933 2.440 1.00 1.40 O ATOM 2476 ND2 ASN A 145 29.209 5.924 1.892 1.00 1.35 N ATOM 0 H ASN A 145 25.642 6.083 3.266 1.00 0.33 H new ATOM 0 HA ASN A 145 27.333 7.415 3.815 1.00 0.37 H new ATOM 0 HB2 ASN A 145 27.288 7.291 0.919 1.00 0.41 H new ATOM 0 HB3 ASN A 145 27.874 8.865 1.417 1.00 0.41 H new ATOM 0 HD21 ASN A 145 30.098 5.461 2.081 1.00 1.35 H new ATOM 0 HD22 ASN A 145 28.407 5.379 1.574 1.00 1.35 H new ATOM 2483 N GLN A 146 25.209 9.300 3.999 1.00 0.36 N ATOM 2484 CA GLN A 146 24.617 10.579 4.413 1.00 0.40 C ATOM 2485 C GLN A 146 23.993 11.310 3.223 1.00 0.38 C ATOM 2486 O GLN A 146 23.727 12.510 3.278 1.00 0.46 O ATOM 2487 CB GLN A 146 25.666 11.465 5.100 1.00 0.48 C ATOM 2488 CG GLN A 146 25.084 12.454 6.094 1.00 0.93 C ATOM 2489 CD GLN A 146 26.159 13.205 6.854 1.00 1.34 C ATOM 2490 OE1 GLN A 146 26.640 12.744 7.890 1.00 2.04 O ATOM 2491 NE2 GLN A 146 26.543 14.365 6.348 1.00 1.78 N ATOM 0 H GLN A 146 24.687 8.483 4.315 1.00 0.36 H new ATOM 0 HA GLN A 146 23.824 10.364 5.129 1.00 0.40 H new ATOM 0 HB2 GLN A 146 26.384 10.827 5.616 1.00 0.48 H new ATOM 0 HB3 GLN A 146 26.218 12.014 4.337 1.00 0.48 H new ATOM 0 HG2 GLN A 146 24.450 13.167 5.566 1.00 0.93 H new ATOM 0 HG3 GLN A 146 24.446 11.923 6.801 1.00 0.93 H new ATOM 0 HE21 GLN A 146 26.119 14.711 5.487 1.00 1.78 H new ATOM 0 HE22 GLN A 146 27.263 14.913 6.818 1.00 1.78 H new ATOM 2500 N THR A 147 23.753 10.576 2.151 1.00 0.32 N ATOM 2501 CA THR A 147 23.156 11.144 0.961 1.00 0.33 C ATOM 2502 C THR A 147 21.769 10.561 0.756 1.00 0.30 C ATOM 2503 O THR A 147 21.615 9.353 0.561 1.00 0.28 O ATOM 2504 CB THR A 147 24.012 10.882 -0.288 1.00 0.36 C ATOM 2505 OG1 THR A 147 25.404 11.018 0.036 1.00 0.41 O ATOM 2506 CG2 THR A 147 23.647 11.848 -1.404 1.00 0.45 C ATOM 0 H THR A 147 23.965 9.581 2.083 1.00 0.32 H new ATOM 0 HA THR A 147 23.092 12.223 1.104 1.00 0.33 H new ATOM 0 HB THR A 147 23.817 9.866 -0.632 1.00 0.36 H new ATOM 0 HG1 THR A 147 25.718 10.203 0.480 1.00 0.41 H new ATOM 0 HG21 THR A 147 24.265 11.644 -2.278 1.00 0.45 H new ATOM 0 HG22 THR A 147 22.596 11.722 -1.665 1.00 0.45 H new ATOM 0 HG23 THR A 147 23.817 12.871 -1.070 1.00 0.45 H new ATOM 2514 N LEU A 148 20.769 11.418 0.839 1.00 0.31 N ATOM 2515 CA LEU A 148 19.388 11.004 0.667 1.00 0.29 C ATOM 2516 C LEU A 148 19.101 10.705 -0.796 1.00 0.29 C ATOM 2517 O LEU A 148 19.084 11.611 -1.633 1.00 0.35 O ATOM 2518 CB LEU A 148 18.442 12.102 1.172 1.00 0.32 C ATOM 2519 CG LEU A 148 17.044 11.643 1.608 1.00 0.37 C ATOM 2520 CD1 LEU A 148 16.391 12.704 2.478 1.00 0.40 C ATOM 2521 CD2 LEU A 148 16.161 11.334 0.406 1.00 0.54 C ATOM 0 H LEU A 148 20.888 12.414 1.026 1.00 0.31 H new ATOM 0 HA LEU A 148 19.223 10.097 1.248 1.00 0.29 H new ATOM 0 HB2 LEU A 148 18.917 12.602 2.016 1.00 0.32 H new ATOM 0 HB3 LEU A 148 18.328 12.846 0.383 1.00 0.32 H new ATOM 0 HG LEU A 148 17.158 10.726 2.186 1.00 0.37 H new ATOM 0 HD11 LEU A 148 15.400 12.367 2.781 1.00 0.40 H new ATOM 0 HD12 LEU A 148 17.003 12.875 3.364 1.00 0.40 H new ATOM 0 HD13 LEU A 148 16.302 13.632 1.914 1.00 0.40 H new ATOM 0 HD21 LEU A 148 15.178 11.012 0.750 1.00 0.54 H new ATOM 0 HD22 LEU A 148 16.055 12.229 -0.208 1.00 0.54 H new ATOM 0 HD23 LEU A 148 16.617 10.540 -0.186 1.00 0.54 H new ATOM 2533 N VAL A 149 18.901 9.436 -1.101 1.00 0.25 N ATOM 2534 CA VAL A 149 18.576 9.021 -2.453 1.00 0.27 C ATOM 2535 C VAL A 149 17.170 8.429 -2.449 1.00 0.24 C ATOM 2536 O VAL A 149 16.941 7.318 -1.973 1.00 0.23 O ATOM 2537 CB VAL A 149 19.614 8.027 -3.053 1.00 0.29 C ATOM 2538 CG1 VAL A 149 20.010 6.952 -2.052 1.00 0.88 C ATOM 2539 CG2 VAL A 149 19.086 7.400 -4.338 1.00 1.04 C ATOM 0 H VAL A 149 18.958 8.672 -0.428 1.00 0.25 H new ATOM 0 HA VAL A 149 18.613 9.896 -3.102 1.00 0.27 H new ATOM 0 HB VAL A 149 20.511 8.599 -3.292 1.00 0.29 H new ATOM 0 HG11 VAL A 149 20.735 6.279 -2.509 1.00 0.88 H new ATOM 0 HG12 VAL A 149 20.453 7.419 -1.172 1.00 0.88 H new ATOM 0 HG13 VAL A 149 19.126 6.387 -1.757 1.00 0.88 H new ATOM 0 HG21 VAL A 149 19.829 6.710 -4.738 1.00 1.04 H new ATOM 0 HG22 VAL A 149 18.164 6.858 -4.126 1.00 1.04 H new ATOM 0 HG23 VAL A 149 18.887 8.183 -5.070 1.00 1.04 H new ATOM 2549 N PRO A 150 16.195 9.198 -2.943 1.00 0.26 N ATOM 2550 CA PRO A 150 14.801 8.775 -2.970 1.00 0.25 C ATOM 2551 C PRO A 150 14.543 7.667 -3.979 1.00 0.25 C ATOM 2552 O PRO A 150 15.373 7.394 -4.847 1.00 0.28 O ATOM 2553 CB PRO A 150 14.050 10.047 -3.354 1.00 0.31 C ATOM 2554 CG PRO A 150 15.037 10.852 -4.121 1.00 0.37 C ATOM 2555 CD PRO A 150 16.379 10.539 -3.525 1.00 0.31 C ATOM 0 HA PRO A 150 14.487 8.354 -2.015 1.00 0.25 H new ATOM 0 HB2 PRO A 150 13.170 9.821 -3.956 1.00 0.31 H new ATOM 0 HB3 PRO A 150 13.702 10.583 -2.471 1.00 0.31 H new ATOM 0 HG2 PRO A 150 15.011 10.595 -5.180 1.00 0.37 H new ATOM 0 HG3 PRO A 150 14.815 11.917 -4.045 1.00 0.37 H new ATOM 0 HD2 PRO A 150 17.164 10.544 -4.281 1.00 0.31 H new ATOM 0 HD3 PRO A 150 16.661 11.270 -2.767 1.00 0.31 H new ATOM 2563 N LEU A 151 13.381 7.037 -3.835 1.00 0.25 N ATOM 2564 CA LEU A 151 12.952 5.947 -4.698 1.00 0.28 C ATOM 2565 C LEU A 151 13.081 6.336 -6.177 1.00 0.48 C ATOM 2566 O LEU A 151 14.007 5.904 -6.863 1.00 1.50 O ATOM 2567 CB LEU A 151 11.494 5.562 -4.365 1.00 0.51 C ATOM 2568 CG LEU A 151 11.169 5.248 -2.886 1.00 0.27 C ATOM 2569 CD1 LEU A 151 12.409 4.855 -2.102 1.00 0.47 C ATOM 2570 CD2 LEU A 151 10.481 6.435 -2.229 1.00 0.48 C ATOM 0 H LEU A 151 12.706 7.273 -3.108 1.00 0.25 H new ATOM 0 HA LEU A 151 13.597 5.087 -4.521 1.00 0.28 H new ATOM 0 HB2 LEU A 151 10.847 6.377 -4.688 1.00 0.51 H new ATOM 0 HB3 LEU A 151 11.230 4.689 -4.962 1.00 0.51 H new ATOM 0 HG LEU A 151 10.492 4.394 -2.876 1.00 0.27 H new ATOM 0 HD11 LEU A 151 12.134 4.643 -1.069 1.00 0.47 H new ATOM 0 HD12 LEU A 151 12.855 3.966 -2.548 1.00 0.47 H new ATOM 0 HD13 LEU A 151 13.129 5.673 -2.126 1.00 0.47 H new ATOM 0 HD21 LEU A 151 10.259 6.197 -1.189 1.00 0.48 H new ATOM 0 HD22 LEU A 151 11.137 7.304 -2.271 1.00 0.48 H new ATOM 0 HD23 LEU A 151 9.553 6.655 -2.756 1.00 0.48 H new ATOM 2582 N LYS A 152 12.133 7.143 -6.649 1.00 0.64 N ATOM 2583 CA LYS A 152 12.116 7.639 -8.029 1.00 0.53 C ATOM 2584 C LYS A 152 12.038 6.503 -9.051 1.00 0.49 C ATOM 2585 O LYS A 152 12.561 6.619 -10.160 1.00 0.63 O ATOM 2586 CB LYS A 152 13.344 8.517 -8.303 1.00 0.55 C ATOM 2587 CG LYS A 152 13.315 9.868 -7.597 1.00 1.12 C ATOM 2588 CD LYS A 152 12.113 10.697 -8.026 1.00 1.33 C ATOM 2589 CE LYS A 152 12.271 12.167 -7.661 1.00 1.84 C ATOM 2590 NZ LYS A 152 12.390 12.381 -6.192 1.00 2.27 N ATOM 0 H LYS A 152 11.350 7.474 -6.085 1.00 0.64 H new ATOM 0 HA LYS A 152 11.214 8.241 -8.141 1.00 0.53 H new ATOM 0 HB2 LYS A 152 14.239 7.977 -7.994 1.00 0.55 H new ATOM 0 HB3 LYS A 152 13.426 8.682 -9.377 1.00 0.55 H new ATOM 0 HG2 LYS A 152 13.286 9.715 -6.518 1.00 1.12 H new ATOM 0 HG3 LYS A 152 14.232 10.414 -7.817 1.00 1.12 H new ATOM 0 HD2 LYS A 152 11.975 10.604 -9.103 1.00 1.33 H new ATOM 0 HD3 LYS A 152 11.213 10.301 -7.554 1.00 1.33 H new ATOM 0 HE2 LYS A 152 13.156 12.568 -8.156 1.00 1.84 H new ATOM 0 HE3 LYS A 152 11.414 12.726 -8.038 1.00 1.84 H new ATOM 0 HZ1 LYS A 152 11.721 13.119 -5.893 1.00 2.27 H new ATOM 0 HZ2 LYS A 152 12.172 11.495 -5.693 1.00 2.27 H new ATOM 0 HZ3 LYS A 152 13.360 12.678 -5.962 1.00 2.27 H new ATOM 2604 N ILE A 153 11.375 5.414 -8.685 1.00 0.42 N ATOM 2605 CA ILE A 153 11.224 4.283 -9.575 1.00 0.41 C ATOM 2606 C ILE A 153 9.743 4.009 -9.803 1.00 0.46 C ATOM 2607 O ILE A 153 8.891 4.632 -9.166 1.00 0.53 O ATOM 2608 CB ILE A 153 11.940 3.027 -9.040 1.00 0.36 C ATOM 2609 CG1 ILE A 153 11.303 2.547 -7.731 1.00 0.34 C ATOM 2610 CG2 ILE A 153 13.421 3.327 -8.846 1.00 0.52 C ATOM 2611 CD1 ILE A 153 12.041 2.989 -6.485 1.00 0.45 C ATOM 0 H ILE A 153 10.934 5.295 -7.773 1.00 0.42 H new ATOM 0 HA ILE A 153 11.696 4.532 -10.525 1.00 0.41 H new ATOM 0 HB ILE A 153 11.834 2.224 -9.769 1.00 0.36 H new ATOM 0 HG12 ILE A 153 10.278 2.914 -7.682 1.00 0.34 H new ATOM 0 HG13 ILE A 153 11.251 1.458 -7.743 1.00 0.34 H new ATOM 0 HG21 ILE A 153 13.926 2.438 -8.468 1.00 0.52 H new ATOM 0 HG22 ILE A 153 13.862 3.616 -9.800 1.00 0.52 H new ATOM 0 HG23 ILE A 153 13.537 4.142 -8.131 1.00 0.52 H new ATOM 0 HD11 ILE A 153 11.526 2.608 -5.603 1.00 0.45 H new ATOM 0 HD12 ILE A 153 13.059 2.599 -6.507 1.00 0.45 H new ATOM 0 HD13 ILE A 153 12.070 4.078 -6.446 1.00 0.45 H new ATOM 2623 N THR A 154 9.431 3.074 -10.681 1.00 0.51 N ATOM 2624 CA THR A 154 8.038 2.795 -11.016 1.00 0.62 C ATOM 2625 C THR A 154 7.495 1.463 -10.479 1.00 0.50 C ATOM 2626 O THR A 154 6.300 1.362 -10.192 1.00 0.54 O ATOM 2627 CB THR A 154 7.829 2.857 -12.548 1.00 0.81 C ATOM 2628 OG1 THR A 154 6.446 2.671 -12.879 1.00 1.76 O ATOM 2629 CG2 THR A 154 8.669 1.809 -13.263 1.00 1.20 C ATOM 0 H THR A 154 10.113 2.497 -11.174 1.00 0.51 H new ATOM 0 HA THR A 154 7.467 3.575 -10.512 1.00 0.62 H new ATOM 0 HB THR A 154 8.148 3.845 -12.881 1.00 0.81 H new ATOM 0 HG1 THR A 154 6.334 2.715 -13.852 1.00 1.76 H new ATOM 0 HG21 THR A 154 8.500 1.878 -14.338 1.00 1.20 H new ATOM 0 HG22 THR A 154 9.724 1.981 -13.050 1.00 1.20 H new ATOM 0 HG23 THR A 154 8.386 0.816 -12.914 1.00 1.20 H new ATOM 2637 N THR A 155 8.330 0.446 -10.318 1.00 0.41 N ATOM 2638 CA THR A 155 7.823 -0.837 -9.854 1.00 0.40 C ATOM 2639 C THR A 155 8.629 -1.421 -8.700 1.00 0.38 C ATOM 2640 O THR A 155 9.702 -0.920 -8.355 1.00 0.35 O ATOM 2641 CB THR A 155 7.787 -1.853 -11.004 1.00 0.45 C ATOM 2642 OG1 THR A 155 8.421 -1.311 -12.172 1.00 1.11 O ATOM 2643 CG2 THR A 155 6.356 -2.246 -11.333 1.00 1.00 C ATOM 0 H THR A 155 9.334 0.480 -10.496 1.00 0.41 H new ATOM 0 HA THR A 155 6.815 -0.644 -9.487 1.00 0.40 H new ATOM 0 HB THR A 155 8.329 -2.743 -10.684 1.00 0.45 H new ATOM 0 HG1 THR A 155 7.745 -1.132 -12.858 1.00 1.11 H new ATOM 0 HG21 THR A 155 6.355 -2.967 -12.151 1.00 1.00 H new ATOM 0 HG22 THR A 155 5.890 -2.693 -10.455 1.00 1.00 H new ATOM 0 HG23 THR A 155 5.794 -1.360 -11.630 1.00 1.00 H new ATOM 2651 N GLU A 156 8.074 -2.480 -8.101 1.00 0.42 N ATOM 2652 CA GLU A 156 8.701 -3.187 -6.988 1.00 0.44 C ATOM 2653 C GLU A 156 10.104 -3.644 -7.372 1.00 0.39 C ATOM 2654 O GLU A 156 11.072 -3.383 -6.658 1.00 0.35 O ATOM 2655 CB GLU A 156 7.832 -4.391 -6.600 1.00 0.59 C ATOM 2656 CG GLU A 156 8.096 -4.940 -5.205 1.00 0.63 C ATOM 2657 CD GLU A 156 7.079 -5.992 -4.800 1.00 1.32 C ATOM 2658 OE1 GLU A 156 6.349 -6.486 -5.693 1.00 2.02 O ATOM 2659 OE2 GLU A 156 6.996 -6.317 -3.596 1.00 1.90 O ATOM 0 H GLU A 156 7.173 -2.870 -8.379 1.00 0.42 H new ATOM 0 HA GLU A 156 8.786 -2.514 -6.134 1.00 0.44 H new ATOM 0 HB2 GLU A 156 6.783 -4.103 -6.670 1.00 0.59 H new ATOM 0 HB3 GLU A 156 7.993 -5.188 -7.326 1.00 0.59 H new ATOM 0 HG2 GLU A 156 9.096 -5.372 -5.170 1.00 0.63 H new ATOM 0 HG3 GLU A 156 8.076 -4.122 -4.485 1.00 0.63 H new ATOM 2666 N LYS A 157 10.202 -4.314 -8.515 1.00 0.41 N ATOM 2667 CA LYS A 157 11.482 -4.795 -9.015 1.00 0.41 C ATOM 2668 C LYS A 157 12.475 -3.642 -9.134 1.00 0.36 C ATOM 2669 O LYS A 157 13.612 -3.746 -8.676 1.00 0.35 O ATOM 2670 CB LYS A 157 11.295 -5.483 -10.370 1.00 0.47 C ATOM 2671 CG LYS A 157 12.594 -5.908 -11.033 1.00 1.15 C ATOM 2672 CD LYS A 157 12.331 -6.766 -12.260 1.00 1.40 C ATOM 2673 CE LYS A 157 13.598 -6.989 -13.069 1.00 2.34 C ATOM 2674 NZ LYS A 157 13.486 -8.171 -13.964 1.00 2.88 N ATOM 0 H LYS A 157 9.407 -4.536 -9.114 1.00 0.41 H new ATOM 0 HA LYS A 157 11.882 -5.521 -8.308 1.00 0.41 H new ATOM 0 HB2 LYS A 157 10.664 -6.361 -10.236 1.00 0.47 H new ATOM 0 HB3 LYS A 157 10.762 -4.807 -11.039 1.00 0.47 H new ATOM 0 HG2 LYS A 157 13.165 -5.025 -11.319 1.00 1.15 H new ATOM 0 HG3 LYS A 157 13.204 -6.464 -10.321 1.00 1.15 H new ATOM 0 HD2 LYS A 157 11.922 -7.728 -11.951 1.00 1.40 H new ATOM 0 HD3 LYS A 157 11.579 -6.286 -12.886 1.00 1.40 H new ATOM 0 HE2 LYS A 157 13.808 -6.101 -13.665 1.00 2.34 H new ATOM 0 HE3 LYS A 157 14.441 -7.125 -12.392 1.00 2.34 H new ATOM 0 HZ1 LYS A 157 14.017 -7.994 -14.840 1.00 2.88 H new ATOM 0 HZ2 LYS A 157 13.877 -9.007 -13.485 1.00 2.88 H new ATOM 0 HZ3 LYS A 157 12.486 -8.339 -14.194 1.00 2.88 H new ATOM 2688 N GLU A 158 12.029 -2.543 -9.739 1.00 0.35 N ATOM 2689 CA GLU A 158 12.862 -1.354 -9.912 1.00 0.34 C ATOM 2690 C GLU A 158 13.351 -0.822 -8.571 1.00 0.29 C ATOM 2691 O GLU A 158 14.502 -0.398 -8.439 1.00 0.30 O ATOM 2692 CB GLU A 158 12.085 -0.261 -10.647 1.00 0.39 C ATOM 2693 CG GLU A 158 11.633 -0.665 -12.039 1.00 0.61 C ATOM 2694 CD GLU A 158 12.729 -1.343 -12.833 1.00 1.09 C ATOM 2695 OE1 GLU A 158 13.652 -0.642 -13.306 1.00 1.83 O ATOM 2696 OE2 GLU A 158 12.677 -2.577 -12.985 1.00 1.85 O ATOM 0 H GLU A 158 11.088 -2.451 -10.121 1.00 0.35 H new ATOM 0 HA GLU A 158 13.730 -1.641 -10.506 1.00 0.34 H new ATOM 0 HB2 GLU A 158 11.211 0.011 -10.056 1.00 0.39 H new ATOM 0 HB3 GLU A 158 12.710 0.629 -10.721 1.00 0.39 H new ATOM 0 HG2 GLU A 158 10.779 -1.337 -11.959 1.00 0.61 H new ATOM 0 HG3 GLU A 158 11.293 0.220 -12.578 1.00 0.61 H new ATOM 2703 N LEU A 159 12.471 -0.856 -7.577 1.00 0.25 N ATOM 2704 CA LEU A 159 12.801 -0.383 -6.245 1.00 0.23 C ATOM 2705 C LEU A 159 13.932 -1.221 -5.658 1.00 0.22 C ATOM 2706 O LEU A 159 14.944 -0.684 -5.210 1.00 0.22 O ATOM 2707 CB LEU A 159 11.546 -0.414 -5.347 1.00 0.21 C ATOM 2708 CG LEU A 159 11.605 -1.343 -4.133 1.00 0.55 C ATOM 2709 CD1 LEU A 159 12.136 -0.614 -2.916 1.00 0.86 C ATOM 2710 CD2 LEU A 159 10.235 -1.929 -3.850 1.00 0.66 C ATOM 0 H LEU A 159 11.519 -1.209 -7.673 1.00 0.25 H new ATOM 0 HA LEU A 159 13.146 0.650 -6.302 1.00 0.23 H new ATOM 0 HB2 LEU A 159 11.353 0.599 -4.994 1.00 0.21 H new ATOM 0 HB3 LEU A 159 10.693 -0.706 -5.960 1.00 0.21 H new ATOM 0 HG LEU A 159 12.292 -2.158 -4.361 1.00 0.55 H new ATOM 0 HD11 LEU A 159 12.168 -1.297 -2.067 1.00 0.86 H new ATOM 0 HD12 LEU A 159 13.141 -0.245 -3.122 1.00 0.86 H new ATOM 0 HD13 LEU A 159 11.482 0.226 -2.681 1.00 0.86 H new ATOM 0 HD21 LEU A 159 10.293 -2.588 -2.984 1.00 0.66 H new ATOM 0 HD22 LEU A 159 9.530 -1.123 -3.647 1.00 0.66 H new ATOM 0 HD23 LEU A 159 9.896 -2.498 -4.716 1.00 0.66 H new ATOM 2722 N ILE A 160 13.766 -2.539 -5.691 1.00 0.24 N ATOM 2723 CA ILE A 160 14.774 -3.449 -5.166 1.00 0.26 C ATOM 2724 C ILE A 160 16.071 -3.332 -5.961 1.00 0.27 C ATOM 2725 O ILE A 160 17.167 -3.464 -5.409 1.00 0.28 O ATOM 2726 CB ILE A 160 14.269 -4.905 -5.162 1.00 0.30 C ATOM 2727 CG1 ILE A 160 12.902 -4.975 -4.475 1.00 0.28 C ATOM 2728 CG2 ILE A 160 15.268 -5.801 -4.447 1.00 0.40 C ATOM 2729 CD1 ILE A 160 12.011 -6.089 -4.978 1.00 0.37 C ATOM 0 H ILE A 160 12.942 -3.000 -6.076 1.00 0.24 H new ATOM 0 HA ILE A 160 14.974 -3.163 -4.133 1.00 0.26 H new ATOM 0 HB ILE A 160 14.166 -5.253 -6.190 1.00 0.30 H new ATOM 0 HG12 ILE A 160 13.053 -5.102 -3.403 1.00 0.28 H new ATOM 0 HG13 ILE A 160 12.389 -4.024 -4.614 1.00 0.28 H new ATOM 0 HG21 ILE A 160 14.902 -6.828 -4.449 1.00 0.40 H new ATOM 0 HG22 ILE A 160 16.229 -5.757 -4.960 1.00 0.40 H new ATOM 0 HG23 ILE A 160 15.390 -5.462 -3.418 1.00 0.40 H new ATOM 0 HD11 ILE A 160 11.063 -6.068 -4.440 1.00 0.37 H new ATOM 0 HD12 ILE A 160 11.826 -5.954 -6.044 1.00 0.37 H new ATOM 0 HD13 ILE A 160 12.501 -7.049 -4.813 1.00 0.37 H new ATOM 2741 N LYS A 161 15.941 -3.074 -7.260 1.00 0.29 N ATOM 2742 CA LYS A 161 17.097 -2.899 -8.127 1.00 0.32 C ATOM 2743 C LYS A 161 17.911 -1.702 -7.658 1.00 0.29 C ATOM 2744 O LYS A 161 19.139 -1.753 -7.599 1.00 0.32 O ATOM 2745 CB LYS A 161 16.662 -2.672 -9.574 1.00 0.36 C ATOM 2746 CG LYS A 161 16.421 -3.945 -10.366 1.00 0.96 C ATOM 2747 CD LYS A 161 15.757 -3.647 -11.706 1.00 1.15 C ATOM 2748 CE LYS A 161 16.525 -2.592 -12.492 1.00 1.50 C ATOM 2749 NZ LYS A 161 15.822 -2.197 -13.741 1.00 2.13 N ATOM 0 H LYS A 161 15.043 -2.982 -7.734 1.00 0.29 H new ATOM 0 HA LYS A 161 17.702 -3.805 -8.079 1.00 0.32 H new ATOM 0 HB2 LYS A 161 15.747 -2.079 -9.576 1.00 0.36 H new ATOM 0 HB3 LYS A 161 17.426 -2.082 -10.081 1.00 0.36 H new ATOM 0 HG2 LYS A 161 17.369 -4.457 -10.533 1.00 0.96 H new ATOM 0 HG3 LYS A 161 15.791 -4.622 -9.788 1.00 0.96 H new ATOM 0 HD2 LYS A 161 15.693 -4.563 -12.293 1.00 1.15 H new ATOM 0 HD3 LYS A 161 14.736 -3.304 -11.538 1.00 1.15 H new ATOM 0 HE2 LYS A 161 16.672 -1.712 -11.866 1.00 1.50 H new ATOM 0 HE3 LYS A 161 17.515 -2.976 -12.740 1.00 1.50 H new ATOM 0 HZ1 LYS A 161 16.520 -2.030 -14.494 1.00 2.13 H new ATOM 0 HZ2 LYS A 161 15.175 -2.958 -14.031 1.00 2.13 H new ATOM 0 HZ3 LYS A 161 15.279 -1.326 -13.573 1.00 2.13 H new ATOM 2763 N GLU A 162 17.201 -0.630 -7.307 1.00 0.27 N ATOM 2764 CA GLU A 162 17.827 0.598 -6.833 1.00 0.27 C ATOM 2765 C GLU A 162 18.548 0.362 -5.507 1.00 0.27 C ATOM 2766 O GLU A 162 19.569 0.989 -5.220 1.00 0.30 O ATOM 2767 CB GLU A 162 16.777 1.698 -6.677 1.00 0.29 C ATOM 2768 CG GLU A 162 17.336 3.104 -6.840 1.00 0.41 C ATOM 2769 CD GLU A 162 18.050 3.298 -8.163 1.00 0.56 C ATOM 2770 OE1 GLU A 162 17.378 3.618 -9.170 1.00 1.34 O ATOM 2771 OE2 GLU A 162 19.289 3.127 -8.206 1.00 1.17 O ATOM 0 H GLU A 162 16.182 -0.591 -7.344 1.00 0.27 H new ATOM 0 HA GLU A 162 18.564 0.915 -7.571 1.00 0.27 H new ATOM 0 HB2 GLU A 162 15.988 1.542 -7.413 1.00 0.29 H new ATOM 0 HB3 GLU A 162 16.316 1.611 -5.693 1.00 0.29 H new ATOM 0 HG2 GLU A 162 16.523 3.826 -6.761 1.00 0.41 H new ATOM 0 HG3 GLU A 162 18.028 3.313 -6.024 1.00 0.41 H new ATOM 2778 N LEU A 163 18.010 -0.544 -4.695 1.00 0.28 N ATOM 2779 CA LEU A 163 18.612 -0.870 -3.403 1.00 0.33 C ATOM 2780 C LEU A 163 19.888 -1.682 -3.582 1.00 0.27 C ATOM 2781 O LEU A 163 20.703 -1.777 -2.665 1.00 0.27 O ATOM 2782 CB LEU A 163 17.645 -1.677 -2.530 1.00 0.48 C ATOM 2783 CG LEU A 163 16.192 -1.219 -2.551 1.00 0.38 C ATOM 2784 CD1 LEU A 163 15.339 -2.136 -1.687 1.00 0.80 C ATOM 2785 CD2 LEU A 163 16.073 0.223 -2.079 1.00 0.58 C ATOM 0 H LEU A 163 17.159 -1.065 -4.907 1.00 0.28 H new ATOM 0 HA LEU A 163 18.844 0.077 -2.915 1.00 0.33 H new ATOM 0 HB2 LEU A 163 17.682 -2.719 -2.847 1.00 0.48 H new ATOM 0 HB3 LEU A 163 18.002 -1.645 -1.500 1.00 0.48 H new ATOM 0 HG LEU A 163 15.830 -1.270 -3.578 1.00 0.38 H new ATOM 0 HD11 LEU A 163 14.303 -1.798 -1.710 1.00 0.80 H new ATOM 0 HD12 LEU A 163 15.397 -3.155 -2.070 1.00 0.80 H new ATOM 0 HD13 LEU A 163 15.705 -2.113 -0.661 1.00 0.80 H new ATOM 0 HD21 LEU A 163 15.027 0.528 -2.102 1.00 0.58 H new ATOM 0 HD22 LEU A 163 16.452 0.305 -1.060 1.00 0.58 H new ATOM 0 HD23 LEU A 163 16.655 0.870 -2.736 1.00 0.58 H new ATOM 2797 N GLY A 164 20.079 -2.244 -4.771 1.00 0.26 N ATOM 2798 CA GLY A 164 21.237 -3.065 -5.014 1.00 0.26 C ATOM 2799 C GLY A 164 21.097 -4.405 -4.341 1.00 0.25 C ATOM 2800 O GLY A 164 22.087 -5.006 -3.918 1.00 0.32 O ATOM 0 H GLY A 164 19.449 -2.142 -5.567 1.00 0.26 H new ATOM 0 HA2 GLY A 164 21.370 -3.205 -6.087 1.00 0.26 H new ATOM 0 HA3 GLY A 164 22.130 -2.560 -4.645 1.00 0.26 H new ATOM 2804 N PHE A 165 19.862 -4.874 -4.229 1.00 0.23 N ATOM 2805 CA PHE A 165 19.603 -6.146 -3.585 1.00 0.24 C ATOM 2806 C PHE A 165 18.846 -7.096 -4.509 1.00 0.25 C ATOM 2807 O PHE A 165 18.532 -6.755 -5.650 1.00 0.27 O ATOM 2808 CB PHE A 165 18.834 -5.935 -2.283 1.00 0.24 C ATOM 2809 CG PHE A 165 19.399 -6.702 -1.122 1.00 0.28 C ATOM 2810 CD1 PHE A 165 20.460 -6.193 -0.393 1.00 0.34 C ATOM 2811 CD2 PHE A 165 18.870 -7.931 -0.762 1.00 0.30 C ATOM 2812 CE1 PHE A 165 20.984 -6.895 0.674 1.00 0.41 C ATOM 2813 CE2 PHE A 165 19.390 -8.639 0.303 1.00 0.37 C ATOM 2814 CZ PHE A 165 20.449 -8.121 1.023 1.00 0.41 C ATOM 0 H PHE A 165 19.031 -4.394 -4.574 1.00 0.23 H new ATOM 0 HA PHE A 165 20.564 -6.607 -3.354 1.00 0.24 H new ATOM 0 HB2 PHE A 165 18.832 -4.872 -2.040 1.00 0.24 H new ATOM 0 HB3 PHE A 165 17.795 -6.230 -2.432 1.00 0.24 H new ATOM 0 HD1 PHE A 165 20.883 -5.236 -0.662 1.00 0.34 H new ATOM 0 HD2 PHE A 165 18.041 -8.340 -1.321 1.00 0.30 H new ATOM 0 HE1 PHE A 165 21.811 -6.487 1.236 1.00 0.41 H new ATOM 0 HE2 PHE A 165 18.969 -9.596 0.573 1.00 0.37 H new ATOM 0 HZ PHE A 165 20.858 -8.673 1.857 1.00 0.41 H new ATOM 2824 N THR A 166 18.560 -8.285 -4.002 1.00 0.28 N ATOM 2825 CA THR A 166 17.862 -9.303 -4.748 1.00 0.32 C ATOM 2826 C THR A 166 16.352 -9.106 -4.694 1.00 0.28 C ATOM 2827 O THR A 166 15.781 -8.925 -3.615 1.00 0.29 O ATOM 2828 CB THR A 166 18.206 -10.673 -4.168 1.00 0.42 C ATOM 2829 OG1 THR A 166 18.439 -10.555 -2.754 1.00 1.37 O ATOM 2830 CG2 THR A 166 19.428 -11.265 -4.852 1.00 1.15 C ATOM 0 H THR A 166 18.810 -8.566 -3.054 1.00 0.28 H new ATOM 0 HA THR A 166 18.177 -9.234 -5.789 1.00 0.32 H new ATOM 0 HB THR A 166 17.364 -11.343 -4.343 1.00 0.42 H new ATOM 0 HG1 THR A 166 18.658 -11.436 -2.384 1.00 1.37 H new ATOM 0 HG21 THR A 166 19.650 -12.240 -4.419 1.00 1.15 H new ATOM 0 HG22 THR A 166 19.230 -11.378 -5.918 1.00 1.15 H new ATOM 0 HG23 THR A 166 20.281 -10.602 -4.710 1.00 1.15 H new ATOM 2838 N TYR A 167 15.707 -9.147 -5.851 1.00 0.35 N ATOM 2839 CA TYR A 167 14.264 -8.980 -5.916 1.00 0.41 C ATOM 2840 C TYR A 167 13.575 -10.336 -5.974 1.00 0.42 C ATOM 2841 O TYR A 167 14.128 -11.303 -6.499 1.00 0.44 O ATOM 2842 CB TYR A 167 13.863 -8.107 -7.114 1.00 0.51 C ATOM 2843 CG TYR A 167 14.104 -8.727 -8.475 1.00 0.55 C ATOM 2844 CD1 TYR A 167 15.359 -8.684 -9.071 1.00 1.22 C ATOM 2845 CD2 TYR A 167 13.065 -9.327 -9.177 1.00 1.46 C ATOM 2846 CE1 TYR A 167 15.572 -9.224 -10.325 1.00 1.28 C ATOM 2847 CE2 TYR A 167 13.272 -9.873 -10.428 1.00 1.60 C ATOM 2848 CZ TYR A 167 14.525 -9.816 -10.999 1.00 0.94 C ATOM 2849 OH TYR A 167 14.726 -10.340 -12.254 1.00 1.18 O ATOM 0 H TYR A 167 16.159 -9.294 -6.754 1.00 0.35 H new ATOM 0 HA TYR A 167 13.938 -8.468 -5.011 1.00 0.41 H new ATOM 0 HB2 TYR A 167 12.804 -7.863 -7.026 1.00 0.51 H new ATOM 0 HB3 TYR A 167 14.413 -7.167 -7.058 1.00 0.51 H new ATOM 0 HD1 TYR A 167 16.181 -8.221 -8.545 1.00 1.22 H new ATOM 0 HD2 TYR A 167 12.080 -9.367 -8.737 1.00 1.46 H new ATOM 0 HE1 TYR A 167 16.553 -9.183 -10.775 1.00 1.28 H new ATOM 0 HE2 TYR A 167 12.456 -10.343 -10.957 1.00 1.60 H new ATOM 0 HH TYR A 167 13.969 -10.914 -12.494 1.00 1.18 H new ATOM 2859 N ARG A 168 12.374 -10.400 -5.421 1.00 0.48 N ATOM 2860 CA ARG A 168 11.604 -11.634 -5.394 1.00 0.54 C ATOM 2861 C ARG A 168 10.160 -11.364 -5.789 1.00 0.57 C ATOM 2862 O ARG A 168 9.812 -10.251 -6.180 1.00 0.81 O ATOM 2863 CB ARG A 168 11.650 -12.263 -3.995 1.00 0.61 C ATOM 2864 CG ARG A 168 12.987 -12.893 -3.642 1.00 0.89 C ATOM 2865 CD ARG A 168 13.290 -14.093 -4.527 1.00 1.36 C ATOM 2866 NE ARG A 168 14.503 -14.788 -4.104 1.00 1.90 N ATOM 2867 CZ ARG A 168 15.283 -15.493 -4.922 1.00 2.59 C ATOM 2868 NH1 ARG A 168 14.975 -15.613 -6.209 1.00 3.05 N ATOM 2869 NH2 ARG A 168 16.374 -16.081 -4.448 1.00 3.19 N ATOM 0 H ARG A 168 11.909 -9.606 -4.982 1.00 0.48 H new ATOM 0 HA ARG A 168 12.044 -12.329 -6.109 1.00 0.54 H new ATOM 0 HB2 ARG A 168 11.415 -11.497 -3.256 1.00 0.61 H new ATOM 0 HB3 ARG A 168 10.872 -13.023 -3.924 1.00 0.61 H new ATOM 0 HG2 ARG A 168 13.779 -12.152 -3.749 1.00 0.89 H new ATOM 0 HG3 ARG A 168 12.980 -13.203 -2.597 1.00 0.89 H new ATOM 0 HD2 ARG A 168 12.448 -14.784 -4.502 1.00 1.36 H new ATOM 0 HD3 ARG A 168 13.402 -13.764 -5.560 1.00 1.36 H new ATOM 0 HE ARG A 168 14.769 -14.730 -3.121 1.00 1.90 H new ATOM 0 HH11 ARG A 168 14.136 -15.164 -6.577 1.00 3.05 H new ATOM 0 HH12 ARG A 168 15.577 -16.154 -6.829 1.00 3.05 H new ATOM 0 HH21 ARG A 168 16.613 -15.992 -3.460 1.00 3.19 H new ATOM 0 HH22 ARG A 168 16.974 -16.622 -5.071 1.00 3.19 H new ATOM 2883 N ILE A 169 9.328 -12.389 -5.684 1.00 0.50 N ATOM 2884 CA ILE A 169 7.920 -12.268 -6.021 1.00 0.54 C ATOM 2885 C ILE A 169 7.119 -11.802 -4.807 1.00 0.47 C ATOM 2886 O ILE A 169 7.481 -12.097 -3.668 1.00 0.50 O ATOM 2887 CB ILE A 169 7.346 -13.606 -6.536 1.00 0.65 C ATOM 2888 CG1 ILE A 169 7.614 -14.732 -5.531 1.00 0.73 C ATOM 2889 CG2 ILE A 169 7.943 -13.944 -7.896 1.00 0.96 C ATOM 2890 CD1 ILE A 169 6.964 -16.048 -5.902 1.00 0.98 C ATOM 0 H ILE A 169 9.606 -13.317 -5.366 1.00 0.50 H new ATOM 0 HA ILE A 169 7.836 -11.528 -6.817 1.00 0.54 H new ATOM 0 HB ILE A 169 6.267 -13.502 -6.647 1.00 0.65 H new ATOM 0 HG12 ILE A 169 8.690 -14.881 -5.444 1.00 0.73 H new ATOM 0 HG13 ILE A 169 7.255 -14.424 -4.549 1.00 0.73 H new ATOM 0 HG21 ILE A 169 7.531 -14.889 -8.249 1.00 0.96 H new ATOM 0 HG22 ILE A 169 7.700 -13.154 -8.607 1.00 0.96 H new ATOM 0 HG23 ILE A 169 9.026 -14.031 -7.807 1.00 0.96 H new ATOM 0 HD11 ILE A 169 7.198 -16.796 -5.144 1.00 0.98 H new ATOM 0 HD12 ILE A 169 5.884 -15.916 -5.960 1.00 0.98 H new ATOM 0 HD13 ILE A 169 7.342 -16.381 -6.869 1.00 0.98 H new ATOM 2902 N PRO A 170 6.014 -11.076 -5.036 1.00 0.46 N ATOM 2903 CA PRO A 170 5.152 -10.556 -3.961 1.00 0.44 C ATOM 2904 C PRO A 170 4.511 -11.666 -3.131 1.00 0.39 C ATOM 2905 O PRO A 170 4.078 -11.457 -1.999 1.00 0.43 O ATOM 2906 CB PRO A 170 4.067 -9.782 -4.716 1.00 0.51 C ATOM 2907 CG PRO A 170 4.088 -10.332 -6.099 1.00 0.56 C ATOM 2908 CD PRO A 170 5.519 -10.687 -6.367 1.00 0.54 C ATOM 0 HA PRO A 170 5.720 -9.955 -3.251 1.00 0.44 H new ATOM 0 HB2 PRO A 170 3.090 -9.919 -4.252 1.00 0.51 H new ATOM 0 HB3 PRO A 170 4.273 -8.712 -4.714 1.00 0.51 H new ATOM 0 HG2 PRO A 170 3.444 -11.207 -6.183 1.00 0.56 H new ATOM 0 HG3 PRO A 170 3.724 -9.599 -6.819 1.00 0.56 H new ATOM 0 HD2 PRO A 170 5.606 -11.503 -7.085 1.00 0.54 H new ATOM 0 HD3 PRO A 170 6.075 -9.843 -6.775 1.00 0.54 H new ATOM 2916 N LYS A 171 4.475 -12.850 -3.710 1.00 0.38 N ATOM 2917 CA LYS A 171 3.894 -14.019 -3.073 1.00 0.43 C ATOM 2918 C LYS A 171 4.876 -14.650 -2.089 1.00 0.50 C ATOM 2919 O LYS A 171 4.521 -15.562 -1.348 1.00 0.57 O ATOM 2920 CB LYS A 171 3.490 -15.029 -4.148 1.00 0.50 C ATOM 2921 CG LYS A 171 2.882 -14.375 -5.383 1.00 1.43 C ATOM 2922 CD LYS A 171 2.878 -15.307 -6.584 1.00 1.73 C ATOM 2923 CE LYS A 171 1.868 -16.429 -6.420 1.00 2.23 C ATOM 2924 NZ LYS A 171 0.490 -15.915 -6.212 1.00 2.51 N ATOM 0 H LYS A 171 4.850 -13.031 -4.641 1.00 0.38 H new ATOM 0 HA LYS A 171 3.012 -13.714 -2.510 1.00 0.43 H new ATOM 0 HB2 LYS A 171 4.366 -15.606 -4.444 1.00 0.50 H new ATOM 0 HB3 LYS A 171 2.772 -15.733 -3.726 1.00 0.50 H new ATOM 0 HG2 LYS A 171 1.860 -14.065 -5.162 1.00 1.43 H new ATOM 0 HG3 LYS A 171 3.443 -13.473 -5.627 1.00 1.43 H new ATOM 0 HD2 LYS A 171 2.648 -14.739 -7.485 1.00 1.73 H new ATOM 0 HD3 LYS A 171 3.873 -15.730 -6.720 1.00 1.73 H new ATOM 0 HE2 LYS A 171 1.887 -17.066 -7.305 1.00 2.23 H new ATOM 0 HE3 LYS A 171 2.154 -17.052 -5.573 1.00 2.23 H new ATOM 0 HZ1 LYS A 171 -0.174 -16.714 -6.156 1.00 2.51 H new ATOM 0 HZ2 LYS A 171 0.452 -15.371 -5.327 1.00 2.51 H new ATOM 0 HZ3 LYS A 171 0.225 -15.300 -7.008 1.00 2.51 H new ATOM 2938 N LYS A 172 6.113 -14.159 -2.090 1.00 0.62 N ATOM 2939 CA LYS A 172 7.143 -14.673 -1.192 1.00 0.74 C ATOM 2940 C LYS A 172 6.846 -14.283 0.252 1.00 0.58 C ATOM 2941 O LYS A 172 7.071 -15.076 1.164 1.00 0.64 O ATOM 2942 CB LYS A 172 8.527 -14.155 -1.600 1.00 1.09 C ATOM 2943 CG LYS A 172 9.650 -14.614 -0.683 1.00 1.53 C ATOM 2944 CD LYS A 172 9.926 -16.103 -0.833 1.00 1.82 C ATOM 2945 CE LYS A 172 10.969 -16.577 0.166 1.00 2.39 C ATOM 2946 NZ LYS A 172 11.423 -17.963 -0.110 1.00 2.96 N ATOM 0 H LYS A 172 6.426 -13.406 -2.703 1.00 0.62 H new ATOM 0 HA LYS A 172 7.140 -15.760 -1.268 1.00 0.74 H new ATOM 0 HB2 LYS A 172 8.743 -14.485 -2.616 1.00 1.09 H new ATOM 0 HB3 LYS A 172 8.506 -13.065 -1.616 1.00 1.09 H new ATOM 0 HG2 LYS A 172 10.556 -14.051 -0.908 1.00 1.53 H new ATOM 0 HG3 LYS A 172 9.387 -14.395 0.352 1.00 1.53 H new ATOM 0 HD2 LYS A 172 9.002 -16.662 -0.689 1.00 1.82 H new ATOM 0 HD3 LYS A 172 10.270 -16.311 -1.846 1.00 1.82 H new ATOM 0 HE2 LYS A 172 11.826 -15.904 0.140 1.00 2.39 H new ATOM 0 HE3 LYS A 172 10.554 -16.526 1.173 1.00 2.39 H new ATOM 0 HZ1 LYS A 172 12.133 -18.243 0.596 1.00 2.96 H new ATOM 0 HZ2 LYS A 172 10.611 -18.611 -0.060 1.00 2.96 H new ATOM 0 HZ3 LYS A 172 11.843 -18.008 -1.060 1.00 2.96 H new ATOM 2960 N ARG A 173 6.315 -13.062 0.428 1.00 0.56 N ATOM 2961 CA ARG A 173 5.956 -12.502 1.744 1.00 0.65 C ATOM 2962 C ARG A 173 6.927 -12.915 2.855 1.00 0.87 C ATOM 2963 O ARG A 173 6.650 -13.827 3.637 1.00 1.49 O ATOM 2964 CB ARG A 173 4.517 -12.883 2.130 1.00 0.64 C ATOM 2965 CG ARG A 173 4.197 -14.360 1.966 1.00 1.35 C ATOM 2966 CD ARG A 173 2.850 -14.717 2.557 1.00 1.61 C ATOM 2967 NE ARG A 173 2.438 -16.061 2.170 1.00 2.41 N ATOM 2968 CZ ARG A 173 1.180 -16.476 2.161 1.00 3.10 C ATOM 2969 NH1 ARG A 173 0.218 -15.691 2.612 1.00 3.34 N ATOM 2970 NH2 ARG A 173 0.877 -17.687 1.720 1.00 4.00 N ATOM 0 H ARG A 173 6.120 -12.428 -0.347 1.00 0.56 H new ATOM 0 HA ARG A 173 6.027 -11.419 1.643 1.00 0.65 H new ATOM 0 HB2 ARG A 173 4.344 -12.599 3.168 1.00 0.64 H new ATOM 0 HB3 ARG A 173 3.824 -12.303 1.521 1.00 0.64 H new ATOM 0 HG2 ARG A 173 4.208 -14.618 0.907 1.00 1.35 H new ATOM 0 HG3 ARG A 173 4.973 -14.955 2.447 1.00 1.35 H new ATOM 0 HD2 ARG A 173 2.898 -14.649 3.644 1.00 1.61 H new ATOM 0 HD3 ARG A 173 2.103 -13.996 2.225 1.00 1.61 H new ATOM 0 HE ARG A 173 3.162 -16.722 1.889 1.00 2.41 H new ATOM 0 HH11 ARG A 173 0.443 -14.762 2.969 1.00 3.34 H new ATOM 0 HH12 ARG A 173 -0.750 -16.014 2.604 1.00 3.34 H new ATOM 0 HH21 ARG A 173 1.614 -18.307 1.384 1.00 4.00 H new ATOM 0 HH22 ARG A 173 -0.094 -18.000 1.716 1.00 4.00 H new ATOM 2984 N LEU A 174 8.057 -12.234 2.931 1.00 0.50 N ATOM 2985 CA LEU A 174 9.053 -12.545 3.943 1.00 0.68 C ATOM 2986 C LEU A 174 9.023 -11.516 5.067 1.00 1.39 C ATOM 2987 O LEU A 174 8.444 -11.818 6.132 1.00 2.08 O ATOM 2988 CB LEU A 174 10.445 -12.616 3.320 1.00 1.19 C ATOM 2989 CG LEU A 174 11.006 -14.027 3.132 1.00 1.76 C ATOM 2990 CD1 LEU A 174 12.282 -13.986 2.306 1.00 2.44 C ATOM 2991 CD2 LEU A 174 11.271 -14.677 4.480 1.00 2.36 C ATOM 2992 OXT LEU A 174 9.559 -10.404 4.878 1.00 2.14 O ATOM 0 H LEU A 174 8.308 -11.466 2.308 1.00 0.50 H new ATOM 0 HA LEU A 174 8.814 -13.520 4.367 1.00 0.68 H new ATOM 0 HB2 LEU A 174 10.416 -12.122 2.349 1.00 1.19 H new ATOM 0 HB3 LEU A 174 11.134 -12.049 3.946 1.00 1.19 H new ATOM 0 HG LEU A 174 10.266 -14.623 2.598 1.00 1.76 H new ATOM 0 HD11 LEU A 174 12.668 -14.998 2.182 1.00 2.44 H new ATOM 0 HD12 LEU A 174 12.068 -13.557 1.327 1.00 2.44 H new ATOM 0 HD13 LEU A 174 13.026 -13.374 2.816 1.00 2.44 H new ATOM 0 HD21 LEU A 174 11.670 -15.680 4.328 1.00 2.36 H new ATOM 0 HD22 LEU A 174 11.993 -14.080 5.036 1.00 2.36 H new ATOM 0 HD23 LEU A 174 10.340 -14.738 5.044 1.00 2.36 H new