USER MOD reduce.3.24.130724 H: found=0, std=0, add=1065, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1067 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 83 SER OG : rot 72:sc= 1.12 USER MOD Set 1.2: A 96 TYR OH : rot 1:sc= 1.16 USER MOD Set 1.3: A 119 TYR OH : rot -115:sc= 1.89 USER MOD Set 2.1: A 82 THR OG1 : rot 93:sc= 1.79 USER MOD Set 2.2: A 99 ASN : amide:sc= 0.769 K(o=2.6,f=-0.45) USER MOD Set 3.1: A 40 TYR OH : rot 180:sc= 0.498 USER MOD Set 3.2: A 110 THR OG1 : rot 141:sc= 0.793 USER MOD Set 4.1: A 38 SER OG : rot -61:sc= 0.486 USER MOD Set 4.2: A 39 HIS : no HD1:sc= -0.0599 K(o=0.43,f=-0.81) USER MOD Set 5.1: A 14 GLN :FLIP amide:sc=-0.000625 F(o=-1.2!,f=-0.00062) USER MOD Set 5.2: A 18 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0321) USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 13 LYS NZ :NH3+ -173:sc= 0.76 (180deg=0.592) USER MOD Single : A 21 ASN : amide:sc= -0.0061 X(o=-0.0061,f=0) USER MOD Single : A 24 ASN : amide:sc= 0.617 K(o=0.62,f=-7.6!) USER MOD Single : A 25 TYR OH : rot 30:sc= -0.18 USER MOD Single : A 26 GLN : amide:sc= -1.11! C(o=-1.1!,f=-3.5!) USER MOD Single : A 29 TYR OH : rot 180:sc= 0.943 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc= -0.198 X(o=-0.2,f=-0.056) USER MOD Single : A 36 ASN : amide:sc= -1.99! X(o=-2!,f=-2.5) USER MOD Single : A 42 TYR OH : rot 57:sc= 1.22 USER MOD Single : A 43 TYR OH : rot 180:sc= -0.0137 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0.0132 USER MOD Single : A 48 ASN : amide:sc= 0 K(o=0,f=-0.99) USER MOD Single : A 50 HIS : no HD1:sc= 0 X(o=0,f=-0.0085) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -0.133 K(o=-0.13,f=-1.2!) USER MOD Single : A 57 ASN : amide:sc= -0.0969 K(o=-0.097,f=-2.5!) USER MOD Single : A 58 THR OG1 : rot 180:sc=-0.00653 USER MOD Single : A 62 LYS NZ :NH3+ 167:sc= -0.0288 (180deg=-0.239) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 81 THR OG1 : rot 79:sc= 1.28 USER MOD Single : A 84 ASN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 85 LYS NZ :NH3+ -171:sc= 0.115 (180deg=-0.109) USER MOD Single : A 87 LYS NZ :NH3+ 169:sc=-0.000911 (180deg=-0.106) USER MOD Single : A 88 SER OG : rot 82:sc= 0.441 USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.0391 USER MOD Single : A 94 GLN : amide:sc= 0.688 K(o=0.69,f=-0.28) USER MOD Single : A 102 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0483) USER MOD Single : A 111 ASN : amide:sc= -1.11 K(o=-1.1,f=-11!) USER MOD Single : A 113 HIS : no HD1:sc= 0 X(o=0,f=-0.0041) USER MOD Single : A 115 GLN :FLIP amide:sc= -0.0818 F(o=-2.6!,f=-0.082) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 0:sc= -0.0873 USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot -109:sc= 0.958 USER MOD Single : A 124 ASN : amide:sc=-0.00123 K(o=-0.0012,f=-0.79) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 129 THR OG1 : rot 29:sc= 1.3 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -1.32 K(o=-1.3,f=-5.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 7 -6.542 15.569 -15.262 1.00 0.00 N ATOM 2 CA ASP A 7 -6.831 14.202 -14.840 1.00 0.00 C ATOM 3 C ASP A 7 -6.379 13.938 -13.406 1.00 0.00 C ATOM 4 O ASP A 7 -5.229 14.195 -13.042 1.00 0.00 O ATOM 5 CB ASP A 7 -6.176 13.193 -15.785 1.00 0.00 C ATOM 6 CG ASP A 7 -6.808 11.820 -15.676 1.00 0.00 C ATOM 7 OD1 ASP A 7 -6.882 11.276 -14.557 1.00 0.00 O ATOM 8 OD2 ASP A 7 -7.261 11.287 -16.709 1.00 0.00 O ATOM 0 HA ASP A 7 -7.913 14.080 -14.878 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -6.260 13.550 -16.811 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -5.112 13.122 -15.558 1.00 0.00 H new ATOM 13 N GLN A 8 -7.296 13.391 -12.614 1.00 0.00 N ATOM 14 CA GLN A 8 -7.062 13.117 -11.201 1.00 0.00 C ATOM 15 C GLN A 8 -5.973 12.058 -11.011 1.00 0.00 C ATOM 16 O GLN A 8 -5.291 12.034 -9.981 1.00 0.00 O ATOM 17 CB GLN A 8 -8.367 12.645 -10.554 1.00 0.00 C ATOM 18 CG GLN A 8 -8.287 12.464 -9.049 1.00 0.00 C ATOM 19 CD GLN A 8 -8.215 13.777 -8.296 1.00 0.00 C ATOM 20 OE1 GLN A 8 -7.136 14.309 -8.049 1.00 0.00 O ATOM 21 NE2 GLN A 8 -9.371 14.301 -7.914 1.00 0.00 N ATOM 0 H GLN A 8 -8.226 13.124 -12.936 1.00 0.00 H new ATOM 0 HA GLN A 8 -6.721 14.036 -10.723 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -9.153 13.366 -10.780 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -8.662 11.699 -11.007 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -9.159 11.904 -8.709 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -7.409 11.865 -8.807 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -10.245 13.827 -8.140 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -9.386 15.179 -7.394 1.00 0.00 H new ATOM 30 N VAL A 9 -5.806 11.192 -12.009 1.00 0.00 N ATOM 31 CA VAL A 9 -4.804 10.132 -11.951 1.00 0.00 C ATOM 32 C VAL A 9 -3.409 10.725 -11.779 1.00 0.00 C ATOM 33 O VAL A 9 -2.580 10.187 -11.045 1.00 0.00 O ATOM 34 CB VAL A 9 -4.850 9.241 -13.220 1.00 0.00 C ATOM 35 CG1 VAL A 9 -3.691 8.252 -13.245 1.00 0.00 C ATOM 36 CG2 VAL A 9 -6.176 8.493 -13.299 1.00 0.00 C ATOM 0 H VAL A 9 -6.354 11.205 -12.869 1.00 0.00 H new ATOM 0 HA VAL A 9 -5.034 9.506 -11.089 1.00 0.00 H new ATOM 0 HB VAL A 9 -4.758 9.895 -14.087 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -3.752 7.643 -14.147 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -2.747 8.797 -13.239 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -3.744 7.608 -12.367 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -6.191 7.873 -14.195 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -6.290 7.861 -12.418 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -6.996 9.210 -13.340 1.00 0.00 H new ATOM 46 N VAL A 10 -3.178 11.863 -12.421 1.00 0.00 N ATOM 47 CA VAL A 10 -1.881 12.525 -12.363 1.00 0.00 C ATOM 48 C VAL A 10 -1.569 12.972 -10.936 1.00 0.00 C ATOM 49 O VAL A 10 -0.426 12.896 -10.484 1.00 0.00 O ATOM 50 CB VAL A 10 -1.832 13.744 -13.308 1.00 0.00 C ATOM 51 CG1 VAL A 10 -0.455 14.392 -13.294 1.00 0.00 C ATOM 52 CG2 VAL A 10 -2.214 13.338 -14.722 1.00 0.00 C ATOM 0 H VAL A 10 -3.873 12.348 -12.989 1.00 0.00 H new ATOM 0 HA VAL A 10 -1.130 11.804 -12.687 1.00 0.00 H new ATOM 0 HB VAL A 10 -2.554 14.477 -12.949 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -0.449 15.248 -13.969 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -0.220 14.725 -12.283 1.00 0.00 H new ATOM 0 HG13 VAL A 10 0.291 13.668 -13.620 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -2.174 14.210 -15.374 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -1.518 12.582 -15.084 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -3.225 12.930 -14.723 1.00 0.00 H new ATOM 62 N ILE A 11 -2.599 13.411 -10.225 1.00 0.00 N ATOM 63 CA ILE A 11 -2.440 13.887 -8.858 1.00 0.00 C ATOM 64 C ILE A 11 -2.064 12.739 -7.925 1.00 0.00 C ATOM 65 O ILE A 11 -1.038 12.792 -7.245 1.00 0.00 O ATOM 66 CB ILE A 11 -3.722 14.587 -8.327 1.00 0.00 C ATOM 67 CG1 ILE A 11 -3.945 15.937 -9.019 1.00 0.00 C ATOM 68 CG2 ILE A 11 -3.651 14.786 -6.820 1.00 0.00 C ATOM 69 CD1 ILE A 11 -4.459 15.834 -10.437 1.00 0.00 C ATOM 0 H ILE A 11 -3.557 13.447 -10.574 1.00 0.00 H new ATOM 0 HA ILE A 11 -1.636 14.622 -8.875 1.00 0.00 H new ATOM 0 HB ILE A 11 -4.565 13.936 -8.556 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -4.653 16.521 -8.430 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -3.005 16.488 -9.025 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -4.560 15.278 -6.475 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -3.553 13.818 -6.329 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -2.788 15.405 -6.575 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -4.588 16.834 -10.851 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -3.743 15.280 -11.044 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -5.417 15.313 -10.440 1.00 0.00 H new ATOM 81 N PHE A 12 -2.884 11.693 -7.914 1.00 0.00 N ATOM 82 CA PHE A 12 -2.684 10.576 -6.996 1.00 0.00 C ATOM 83 C PHE A 12 -1.428 9.783 -7.324 1.00 0.00 C ATOM 84 O PHE A 12 -0.698 9.381 -6.419 1.00 0.00 O ATOM 85 CB PHE A 12 -3.903 9.656 -6.979 1.00 0.00 C ATOM 86 CG PHE A 12 -5.029 10.186 -6.140 1.00 0.00 C ATOM 87 CD1 PHE A 12 -5.003 10.044 -4.761 1.00 0.00 C ATOM 88 CD2 PHE A 12 -6.106 10.825 -6.724 1.00 0.00 C ATOM 89 CE1 PHE A 12 -6.034 10.529 -3.982 1.00 0.00 C ATOM 90 CE2 PHE A 12 -7.139 11.314 -5.949 1.00 0.00 C ATOM 91 CZ PHE A 12 -7.103 11.167 -4.577 1.00 0.00 C ATOM 0 H PHE A 12 -3.692 11.595 -8.529 1.00 0.00 H new ATOM 0 HA PHE A 12 -2.553 11.003 -6.002 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -4.256 9.511 -8.000 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -3.607 8.677 -6.602 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -4.166 9.548 -4.291 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -6.140 10.943 -7.797 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -6.004 10.409 -2.909 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -7.976 11.812 -6.417 1.00 0.00 H new ATOM 0 HZ PHE A 12 -7.910 11.551 -3.970 1.00 0.00 H new ATOM 101 N LYS A 13 -1.167 9.565 -8.607 1.00 0.00 N ATOM 102 CA LYS A 13 0.004 8.796 -9.004 1.00 0.00 C ATOM 103 C LYS A 13 1.273 9.525 -8.592 1.00 0.00 C ATOM 104 O LYS A 13 2.235 8.907 -8.143 1.00 0.00 O ATOM 105 CB LYS A 13 0.024 8.530 -10.510 1.00 0.00 C ATOM 106 CG LYS A 13 1.067 7.502 -10.914 1.00 0.00 C ATOM 107 CD LYS A 13 1.178 7.365 -12.421 1.00 0.00 C ATOM 108 CE LYS A 13 2.069 6.195 -12.804 1.00 0.00 C ATOM 109 NZ LYS A 13 3.431 6.298 -12.209 1.00 0.00 N ATOM 0 H LYS A 13 -1.741 9.904 -9.379 1.00 0.00 H new ATOM 0 HA LYS A 13 -0.046 7.834 -8.495 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -0.960 8.185 -10.826 1.00 0.00 H new ATOM 0 HB3 LYS A 13 0.219 9.464 -11.037 1.00 0.00 H new ATOM 0 HG2 LYS A 13 2.036 7.788 -10.504 1.00 0.00 H new ATOM 0 HG3 LYS A 13 0.810 6.536 -10.480 1.00 0.00 H new ATOM 0 HD2 LYS A 13 0.186 7.225 -12.850 1.00 0.00 H new ATOM 0 HD3 LYS A 13 1.581 8.285 -12.843 1.00 0.00 H new ATOM 0 HE2 LYS A 13 1.603 5.265 -12.478 1.00 0.00 H new ATOM 0 HE3 LYS A 13 2.153 6.146 -13.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 4.035 5.544 -12.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 3.843 7.224 -12.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 3.367 6.198 -11.176 1.00 0.00 H new ATOM 123 N GLN A 14 1.254 10.848 -8.720 1.00 0.00 N ATOM 124 CA GLN A 14 2.394 11.673 -8.344 1.00 0.00 C ATOM 125 C GLN A 14 2.674 11.547 -6.848 1.00 0.00 C ATOM 126 O GLN A 14 3.821 11.635 -6.413 1.00 0.00 O ATOM 127 CB GLN A 14 2.131 13.130 -8.722 1.00 0.00 C ATOM 128 CG GLN A 14 3.342 14.038 -8.588 1.00 0.00 C ATOM 129 CD GLN A 14 3.053 15.459 -9.031 1.00 0.00 C ATOM 130 OE1 GLN A 14 2.136 15.616 -9.976 1.00 0.00 O flip ATOM 131 NE2 GLN A 14 3.649 16.414 -8.534 1.00 0.00 N flip ATOM 0 H GLN A 14 0.458 11.372 -9.083 1.00 0.00 H new ATOM 0 HA GLN A 14 3.274 11.325 -8.885 1.00 0.00 H new ATOM 0 HB2 GLN A 14 1.775 13.168 -9.752 1.00 0.00 H new ATOM 0 HB3 GLN A 14 1.329 13.517 -8.093 1.00 0.00 H new ATOM 0 HG2 GLN A 14 3.674 14.045 -7.550 1.00 0.00 H new ATOM 0 HG3 GLN A 14 4.162 13.635 -9.182 1.00 0.00 H new ATOM 0 HE21 GLN A 14 4.349 16.257 -7.809 1.00 0.00 H new ATOM 0 HE22 GLN A 14 3.443 17.363 -8.847 1.00 0.00 H new ATOM 140 N ILE A 15 1.616 11.332 -6.066 1.00 0.00 N ATOM 141 CA ILE A 15 1.753 11.124 -4.627 1.00 0.00 C ATOM 142 C ILE A 15 2.496 9.823 -4.337 1.00 0.00 C ATOM 143 O ILE A 15 3.523 9.820 -3.654 1.00 0.00 O ATOM 144 CB ILE A 15 0.376 11.079 -3.920 1.00 0.00 C ATOM 145 CG1 ILE A 15 -0.415 12.359 -4.194 1.00 0.00 C ATOM 146 CG2 ILE A 15 0.553 10.874 -2.420 1.00 0.00 C ATOM 147 CD1 ILE A 15 -1.814 12.349 -3.609 1.00 0.00 C ATOM 0 H ILE A 15 0.655 11.298 -6.406 1.00 0.00 H new ATOM 0 HA ILE A 15 2.321 11.970 -4.239 1.00 0.00 H new ATOM 0 HB ILE A 15 -0.187 10.236 -4.321 1.00 0.00 H new ATOM 0 HG12 ILE A 15 0.133 13.208 -3.787 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -0.482 12.510 -5.271 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -0.425 10.845 -1.939 1.00 0.00 H new ATOM 0 HG22 ILE A 15 1.074 9.934 -2.240 1.00 0.00 H new ATOM 0 HG23 ILE A 15 1.136 11.697 -2.007 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -2.313 13.289 -3.844 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.380 11.521 -4.035 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.755 12.230 -2.527 1.00 0.00 H new ATOM 159 N PHE A 16 1.977 8.722 -4.871 1.00 0.00 N ATOM 160 CA PHE A 16 2.564 7.406 -4.639 1.00 0.00 C ATOM 161 C PHE A 16 3.967 7.317 -5.231 1.00 0.00 C ATOM 162 O PHE A 16 4.894 6.846 -4.576 1.00 0.00 O ATOM 163 CB PHE A 16 1.670 6.308 -5.222 1.00 0.00 C ATOM 164 CG PHE A 16 0.412 6.070 -4.431 1.00 0.00 C ATOM 165 CD1 PHE A 16 -0.706 6.872 -4.613 1.00 0.00 C ATOM 166 CD2 PHE A 16 0.347 5.044 -3.502 1.00 0.00 C ATOM 167 CE1 PHE A 16 -1.859 6.654 -3.882 1.00 0.00 C ATOM 168 CE2 PHE A 16 -0.804 4.822 -2.769 1.00 0.00 C ATOM 169 CZ PHE A 16 -1.908 5.627 -2.960 1.00 0.00 C ATOM 0 H PHE A 16 1.150 8.715 -5.468 1.00 0.00 H new ATOM 0 HA PHE A 16 2.641 7.259 -3.562 1.00 0.00 H new ATOM 0 HB2 PHE A 16 1.401 6.575 -6.244 1.00 0.00 H new ATOM 0 HB3 PHE A 16 2.237 5.379 -5.274 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -0.675 7.676 -5.334 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.207 4.409 -3.348 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.721 7.287 -4.032 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -0.839 4.019 -2.048 1.00 0.00 H new ATOM 0 HZ PHE A 16 -2.809 5.454 -2.390 1.00 0.00 H new ATOM 179 N ASP A 17 4.130 7.795 -6.460 1.00 0.00 N ATOM 180 CA ASP A 17 5.432 7.771 -7.124 1.00 0.00 C ATOM 181 C ASP A 17 6.451 8.627 -6.377 1.00 0.00 C ATOM 182 O ASP A 17 7.654 8.372 -6.440 1.00 0.00 O ATOM 183 CB ASP A 17 5.311 8.235 -8.579 1.00 0.00 C ATOM 184 CG ASP A 17 4.980 7.099 -9.531 1.00 0.00 C ATOM 185 OD1 ASP A 17 3.880 6.512 -9.425 1.00 0.00 O ATOM 186 OD2 ASP A 17 5.824 6.777 -10.394 1.00 0.00 O ATOM 0 H ASP A 17 3.380 8.203 -7.017 1.00 0.00 H new ATOM 0 HA ASP A 17 5.786 6.740 -7.117 1.00 0.00 H new ATOM 0 HB2 ASP A 17 4.537 8.999 -8.649 1.00 0.00 H new ATOM 0 HB3 ASP A 17 6.247 8.700 -8.887 1.00 0.00 H new ATOM 191 N LYS A 18 5.965 9.629 -5.657 1.00 0.00 N ATOM 192 CA LYS A 18 6.834 10.500 -4.880 1.00 0.00 C ATOM 193 C LYS A 18 7.392 9.759 -3.668 1.00 0.00 C ATOM 194 O LYS A 18 8.601 9.756 -3.430 1.00 0.00 O ATOM 195 CB LYS A 18 6.068 11.739 -4.417 1.00 0.00 C ATOM 196 CG LYS A 18 6.956 12.840 -3.857 1.00 0.00 C ATOM 197 CD LYS A 18 6.137 13.981 -3.266 1.00 0.00 C ATOM 198 CE LYS A 18 5.164 14.577 -4.276 1.00 0.00 C ATOM 199 NZ LYS A 18 5.852 15.114 -5.483 1.00 0.00 N ATOM 0 H LYS A 18 4.973 9.858 -5.595 1.00 0.00 H new ATOM 0 HA LYS A 18 7.663 10.809 -5.517 1.00 0.00 H new ATOM 0 HB2 LYS A 18 5.499 12.137 -5.257 1.00 0.00 H new ATOM 0 HB3 LYS A 18 5.347 11.444 -3.654 1.00 0.00 H new ATOM 0 HG2 LYS A 18 7.609 12.425 -3.089 1.00 0.00 H new ATOM 0 HG3 LYS A 18 7.599 13.226 -4.648 1.00 0.00 H new ATOM 0 HD2 LYS A 18 5.582 13.617 -2.401 1.00 0.00 H new ATOM 0 HD3 LYS A 18 6.809 14.761 -2.908 1.00 0.00 H new ATOM 0 HE2 LYS A 18 4.448 13.814 -4.580 1.00 0.00 H new ATOM 0 HE3 LYS A 18 4.596 15.376 -3.800 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 5.155 15.568 -6.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 6.565 15.814 -5.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 6.317 14.336 -5.992 1.00 0.00 H new ATOM 213 N VAL A 19 6.507 9.107 -2.920 1.00 0.00 N ATOM 214 CA VAL A 19 6.892 8.459 -1.670 1.00 0.00 C ATOM 215 C VAL A 19 7.826 7.269 -1.922 1.00 0.00 C ATOM 216 O VAL A 19 8.573 6.866 -1.034 1.00 0.00 O ATOM 217 CB VAL A 19 5.654 8.007 -0.851 1.00 0.00 C ATOM 218 CG1 VAL A 19 4.956 6.822 -1.502 1.00 0.00 C ATOM 219 CG2 VAL A 19 6.040 7.680 0.585 1.00 0.00 C ATOM 0 H VAL A 19 5.519 9.013 -3.157 1.00 0.00 H new ATOM 0 HA VAL A 19 7.431 9.202 -1.083 1.00 0.00 H new ATOM 0 HB VAL A 19 4.951 8.840 -0.836 1.00 0.00 H new ATOM 0 HG11 VAL A 19 4.094 6.533 -0.901 1.00 0.00 H new ATOM 0 HG12 VAL A 19 4.624 7.100 -2.502 1.00 0.00 H new ATOM 0 HG13 VAL A 19 5.649 5.984 -1.569 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.154 7.366 1.137 1.00 0.00 H new ATOM 0 HG22 VAL A 19 6.775 6.875 0.590 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.467 8.565 1.057 1.00 0.00 H new ATOM 229 N ARG A 20 7.804 6.739 -3.147 1.00 0.00 N ATOM 230 CA ARG A 20 8.678 5.622 -3.520 1.00 0.00 C ATOM 231 C ARG A 20 10.146 5.989 -3.319 1.00 0.00 C ATOM 232 O ARG A 20 10.967 5.143 -2.964 1.00 0.00 O ATOM 233 CB ARG A 20 8.484 5.236 -4.988 1.00 0.00 C ATOM 234 CG ARG A 20 7.046 4.988 -5.396 1.00 0.00 C ATOM 235 CD ARG A 20 6.958 4.593 -6.860 1.00 0.00 C ATOM 236 NE ARG A 20 5.586 4.619 -7.366 1.00 0.00 N ATOM 237 CZ ARG A 20 4.777 3.567 -7.368 1.00 0.00 C ATOM 238 NH1 ARG A 20 5.163 2.435 -6.801 1.00 0.00 N ATOM 239 NH2 ARG A 20 3.575 3.656 -7.921 1.00 0.00 N ATOM 0 H ARG A 20 7.193 7.063 -3.896 1.00 0.00 H new ATOM 0 HA ARG A 20 8.411 4.783 -2.878 1.00 0.00 H new ATOM 0 HB2 ARG A 20 8.893 6.029 -5.614 1.00 0.00 H new ATOM 0 HB3 ARG A 20 9.065 4.337 -5.192 1.00 0.00 H new ATOM 0 HG2 ARG A 20 6.619 4.200 -4.776 1.00 0.00 H new ATOM 0 HG3 ARG A 20 6.454 5.887 -5.221 1.00 0.00 H new ATOM 0 HD2 ARG A 20 7.573 5.270 -7.453 1.00 0.00 H new ATOM 0 HD3 ARG A 20 7.370 3.592 -6.988 1.00 0.00 H new ATOM 0 HE ARG A 20 5.230 5.499 -7.740 1.00 0.00 H new ATOM 0 HH11 ARG A 20 6.082 2.372 -6.363 1.00 0.00 H new ATOM 0 HH12 ARG A 20 4.542 1.626 -6.802 1.00 0.00 H new ATOM 0 HH21 ARG A 20 3.272 4.533 -8.345 1.00 0.00 H new ATOM 0 HH22 ARG A 20 2.953 2.847 -7.923 1.00 0.00 H new ATOM 253 N ASN A 21 10.465 7.257 -3.554 1.00 0.00 N ATOM 254 CA ASN A 21 11.852 7.708 -3.536 1.00 0.00 C ATOM 255 C ASN A 21 12.098 8.720 -2.424 1.00 0.00 C ATOM 256 O ASN A 21 13.147 8.703 -1.778 1.00 0.00 O ATOM 257 CB ASN A 21 12.232 8.332 -4.886 1.00 0.00 C ATOM 258 CG ASN A 21 12.100 7.360 -6.046 1.00 0.00 C ATOM 259 OD1 ASN A 21 13.024 6.605 -6.348 1.00 0.00 O ATOM 260 ND2 ASN A 21 10.953 7.378 -6.718 1.00 0.00 N ATOM 0 H ASN A 21 9.785 7.989 -3.759 1.00 0.00 H new ATOM 0 HA ASN A 21 12.475 6.833 -3.350 1.00 0.00 H new ATOM 0 HB2 ASN A 21 11.597 9.199 -5.071 1.00 0.00 H new ATOM 0 HB3 ASN A 21 13.259 8.694 -4.837 1.00 0.00 H new ATOM 0 HD21 ASN A 21 10.817 6.753 -7.512 1.00 0.00 H new ATOM 0 HD22 ASN A 21 10.209 8.017 -6.439 1.00 0.00 H new ATOM 267 N ASP A 22 11.132 9.602 -2.202 1.00 0.00 N ATOM 268 CA ASP A 22 11.291 10.674 -1.226 1.00 0.00 C ATOM 269 C ASP A 22 10.989 10.185 0.188 1.00 0.00 C ATOM 270 O ASP A 22 11.547 10.696 1.161 1.00 0.00 O ATOM 271 CB ASP A 22 10.387 11.856 -1.582 1.00 0.00 C ATOM 272 CG ASP A 22 10.680 13.079 -0.740 1.00 0.00 C ATOM 273 OD1 ASP A 22 11.729 13.719 -0.963 1.00 0.00 O ATOM 274 OD2 ASP A 22 9.870 13.402 0.146 1.00 0.00 O ATOM 0 H ASP A 22 10.232 9.597 -2.683 1.00 0.00 H new ATOM 0 HA ASP A 22 12.330 11.001 -1.254 1.00 0.00 H new ATOM 0 HB2 ASP A 22 10.516 12.104 -2.636 1.00 0.00 H new ATOM 0 HB3 ASP A 22 9.345 11.567 -1.448 1.00 0.00 H new ATOM 279 N LEU A 23 10.114 9.183 0.283 1.00 0.00 N ATOM 280 CA LEU A 23 9.717 8.592 1.563 1.00 0.00 C ATOM 281 C LEU A 23 9.048 9.618 2.479 1.00 0.00 C ATOM 282 O LEU A 23 9.156 9.537 3.706 1.00 0.00 O ATOM 283 CB LEU A 23 10.919 7.940 2.263 1.00 0.00 C ATOM 284 CG LEU A 23 11.500 6.714 1.552 1.00 0.00 C ATOM 285 CD1 LEU A 23 12.652 6.127 2.349 1.00 0.00 C ATOM 286 CD2 LEU A 23 10.422 5.665 1.324 1.00 0.00 C ATOM 0 H LEU A 23 9.660 8.758 -0.525 1.00 0.00 H new ATOM 0 HA LEU A 23 8.982 7.817 1.347 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.706 8.686 2.369 1.00 0.00 H new ATOM 0 HB3 LEU A 23 10.619 7.648 3.270 1.00 0.00 H new ATOM 0 HG LEU A 23 11.881 7.033 0.582 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.050 5.257 1.826 1.00 0.00 H new ATOM 0 HD12 LEU A 23 13.437 6.875 2.459 1.00 0.00 H new ATOM 0 HD13 LEU A 23 12.297 5.827 3.335 1.00 0.00 H new ATOM 0 HD21 LEU A 23 10.855 4.802 0.818 1.00 0.00 H new ATOM 0 HD22 LEU A 23 10.009 5.353 2.283 1.00 0.00 H new ATOM 0 HD23 LEU A 23 9.628 6.087 0.707 1.00 0.00 H new ATOM 298 N ASN A 24 8.342 10.572 1.882 1.00 0.00 N ATOM 299 CA ASN A 24 7.562 11.535 2.648 1.00 0.00 C ATOM 300 C ASN A 24 6.238 10.909 3.061 1.00 0.00 C ATOM 301 O ASN A 24 5.250 10.972 2.326 1.00 0.00 O ATOM 302 CB ASN A 24 7.304 12.804 1.830 1.00 0.00 C ATOM 303 CG ASN A 24 6.682 13.928 2.646 1.00 0.00 C ATOM 304 OD1 ASN A 24 6.003 13.697 3.651 1.00 0.00 O ATOM 305 ND2 ASN A 24 6.895 15.159 2.211 1.00 0.00 N ATOM 0 H ASN A 24 8.294 10.698 0.871 1.00 0.00 H new ATOM 0 HA ASN A 24 8.129 11.810 3.537 1.00 0.00 H new ATOM 0 HB2 ASN A 24 8.245 13.151 1.404 1.00 0.00 H new ATOM 0 HB3 ASN A 24 6.646 12.563 0.995 1.00 0.00 H new ATOM 0 HD21 ASN A 24 6.493 15.953 2.710 1.00 0.00 H new ATOM 0 HD22 ASN A 24 7.461 15.314 1.377 1.00 0.00 H new ATOM 312 N TYR A 25 6.227 10.283 4.226 1.00 0.00 N ATOM 313 CA TYR A 25 5.028 9.623 4.722 1.00 0.00 C ATOM 314 C TYR A 25 4.052 10.642 5.293 1.00 0.00 C ATOM 315 O TYR A 25 2.841 10.425 5.286 1.00 0.00 O ATOM 316 CB TYR A 25 5.382 8.575 5.780 1.00 0.00 C ATOM 317 CG TYR A 25 6.200 7.421 5.243 1.00 0.00 C ATOM 318 CD1 TYR A 25 5.600 6.393 4.528 1.00 0.00 C ATOM 319 CD2 TYR A 25 7.573 7.355 5.452 1.00 0.00 C ATOM 320 CE1 TYR A 25 6.339 5.334 4.038 1.00 0.00 C ATOM 321 CE2 TYR A 25 8.323 6.300 4.963 1.00 0.00 C ATOM 322 CZ TYR A 25 7.700 5.293 4.258 1.00 0.00 C ATOM 323 OH TYR A 25 8.443 4.239 3.771 1.00 0.00 O ATOM 0 H TYR A 25 7.034 10.217 4.847 1.00 0.00 H new ATOM 0 HA TYR A 25 4.550 9.117 3.883 1.00 0.00 H new ATOM 0 HB2 TYR A 25 5.936 9.057 6.586 1.00 0.00 H new ATOM 0 HB3 TYR A 25 4.462 8.185 6.215 1.00 0.00 H new ATOM 0 HD1 TYR A 25 4.535 6.422 4.352 1.00 0.00 H new ATOM 0 HD2 TYR A 25 8.063 8.142 6.006 1.00 0.00 H new ATOM 0 HE1 TYR A 25 5.854 4.543 3.486 1.00 0.00 H new ATOM 0 HE2 TYR A 25 9.389 6.266 5.133 1.00 0.00 H new ATOM 0 HH TYR A 25 8.027 3.896 2.953 1.00 0.00 H new ATOM 333 N GLN A 26 4.588 11.764 5.763 1.00 0.00 N ATOM 334 CA GLN A 26 3.777 12.815 6.369 1.00 0.00 C ATOM 335 C GLN A 26 2.760 13.345 5.366 1.00 0.00 C ATOM 336 O GLN A 26 1.556 13.338 5.625 1.00 0.00 O ATOM 337 CB GLN A 26 4.648 13.976 6.871 1.00 0.00 C ATOM 338 CG GLN A 26 5.742 13.576 7.857 1.00 0.00 C ATOM 339 CD GLN A 26 6.964 12.982 7.178 1.00 0.00 C ATOM 340 OE1 GLN A 26 7.065 11.768 6.995 1.00 0.00 O ATOM 341 NE2 GLN A 26 7.890 13.837 6.782 1.00 0.00 N ATOM 0 H GLN A 26 5.587 11.970 5.735 1.00 0.00 H new ATOM 0 HA GLN A 26 3.257 12.377 7.221 1.00 0.00 H new ATOM 0 HB2 GLN A 26 5.112 14.461 6.012 1.00 0.00 H new ATOM 0 HB3 GLN A 26 4.004 14.716 7.346 1.00 0.00 H new ATOM 0 HG2 GLN A 26 6.043 14.451 8.433 1.00 0.00 H new ATOM 0 HG3 GLN A 26 5.339 12.852 8.565 1.00 0.00 H new ATOM 0 HE21 GLN A 26 7.769 14.835 6.953 1.00 0.00 H new ATOM 0 HE22 GLN A 26 8.726 13.499 6.306 1.00 0.00 H new ATOM 350 N TRP A 27 3.250 13.783 4.213 1.00 0.00 N ATOM 351 CA TRP A 27 2.392 14.324 3.169 1.00 0.00 C ATOM 352 C TRP A 27 1.554 13.209 2.550 1.00 0.00 C ATOM 353 O TRP A 27 0.413 13.426 2.142 1.00 0.00 O ATOM 354 CB TRP A 27 3.244 15.018 2.099 1.00 0.00 C ATOM 355 CG TRP A 27 2.450 15.767 1.073 1.00 0.00 C ATOM 356 CD1 TRP A 27 1.814 16.964 1.239 1.00 0.00 C ATOM 357 CD2 TRP A 27 2.224 15.378 -0.284 1.00 0.00 C ATOM 358 NE1 TRP A 27 1.201 17.337 0.068 1.00 0.00 N ATOM 359 CE2 TRP A 27 1.436 16.380 -0.879 1.00 0.00 C ATOM 360 CE3 TRP A 27 2.608 14.277 -1.052 1.00 0.00 C ATOM 361 CZ2 TRP A 27 1.028 16.316 -2.206 1.00 0.00 C ATOM 362 CZ3 TRP A 27 2.202 14.214 -2.370 1.00 0.00 C ATOM 363 CH2 TRP A 27 1.417 15.228 -2.935 1.00 0.00 C ATOM 0 H TRP A 27 4.242 13.773 3.978 1.00 0.00 H new ATOM 0 HA TRP A 27 1.717 15.060 3.606 1.00 0.00 H new ATOM 0 HB2 TRP A 27 3.929 15.710 2.589 1.00 0.00 H new ATOM 0 HB3 TRP A 27 3.854 14.269 1.594 1.00 0.00 H new ATOM 0 HD1 TRP A 27 1.796 17.534 2.156 1.00 0.00 H new ATOM 0 HE1 TRP A 27 0.659 18.189 -0.072 1.00 0.00 H new ATOM 0 HE3 TRP A 27 3.211 13.490 -0.623 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 0.426 17.098 -2.645 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 2.494 13.369 -2.976 1.00 0.00 H new ATOM 0 HH2 TRP A 27 1.113 15.148 -3.968 1.00 0.00 H new ATOM 374 N PHE A 28 2.125 12.010 2.509 1.00 0.00 N ATOM 375 CA PHE A 28 1.435 10.841 1.980 1.00 0.00 C ATOM 376 C PHE A 28 0.150 10.576 2.761 1.00 0.00 C ATOM 377 O PHE A 28 -0.934 10.498 2.181 1.00 0.00 O ATOM 378 CB PHE A 28 2.360 9.622 2.040 1.00 0.00 C ATOM 379 CG PHE A 28 1.775 8.369 1.452 1.00 0.00 C ATOM 380 CD1 PHE A 28 1.579 8.257 0.083 1.00 0.00 C ATOM 381 CD2 PHE A 28 1.439 7.298 2.264 1.00 0.00 C ATOM 382 CE1 PHE A 28 1.055 7.102 -0.461 1.00 0.00 C ATOM 383 CE2 PHE A 28 0.913 6.140 1.722 1.00 0.00 C ATOM 384 CZ PHE A 28 0.721 6.042 0.357 1.00 0.00 C ATOM 0 H PHE A 28 3.072 11.823 2.839 1.00 0.00 H new ATOM 0 HA PHE A 28 1.167 11.031 0.941 1.00 0.00 H new ATOM 0 HB2 PHE A 28 3.286 9.857 1.515 1.00 0.00 H new ATOM 0 HB3 PHE A 28 2.623 9.432 3.080 1.00 0.00 H new ATOM 0 HD1 PHE A 28 1.839 9.082 -0.563 1.00 0.00 H new ATOM 0 HD2 PHE A 28 1.589 7.368 3.331 1.00 0.00 H new ATOM 0 HE1 PHE A 28 0.906 7.028 -1.528 1.00 0.00 H new ATOM 0 HE2 PHE A 28 0.652 5.312 2.365 1.00 0.00 H new ATOM 0 HZ PHE A 28 0.311 5.138 -0.068 1.00 0.00 H new ATOM 394 N TYR A 29 0.271 10.462 4.080 1.00 0.00 N ATOM 395 CA TYR A 29 -0.890 10.235 4.934 1.00 0.00 C ATOM 396 C TYR A 29 -1.814 11.445 4.934 1.00 0.00 C ATOM 397 O TYR A 29 -3.036 11.299 4.995 1.00 0.00 O ATOM 398 CB TYR A 29 -0.475 9.913 6.371 1.00 0.00 C ATOM 399 CG TYR A 29 0.119 8.535 6.551 1.00 0.00 C ATOM 400 CD1 TYR A 29 -0.635 7.394 6.310 1.00 0.00 C ATOM 401 CD2 TYR A 29 1.430 8.375 6.978 1.00 0.00 C ATOM 402 CE1 TYR A 29 -0.099 6.133 6.491 1.00 0.00 C ATOM 403 CE2 TYR A 29 1.974 7.121 7.157 1.00 0.00 C ATOM 404 CZ TYR A 29 1.206 6.002 6.913 1.00 0.00 C ATOM 405 OH TYR A 29 1.745 4.749 7.099 1.00 0.00 O ATOM 0 H TYR A 29 1.158 10.523 4.580 1.00 0.00 H new ATOM 0 HA TYR A 29 -1.423 9.377 4.524 1.00 0.00 H new ATOM 0 HB2 TYR A 29 0.251 10.655 6.702 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -1.346 10.008 7.019 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -1.657 7.494 5.976 1.00 0.00 H new ATOM 0 HD2 TYR A 29 2.035 9.248 7.173 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -0.700 5.255 6.303 1.00 0.00 H new ATOM 0 HE2 TYR A 29 2.997 7.015 7.487 1.00 0.00 H new ATOM 0 HH TYR A 29 2.675 4.834 7.397 1.00 0.00 H new ATOM 415 N SER A 30 -1.228 12.634 4.860 1.00 0.00 N ATOM 416 CA SER A 30 -2.002 13.866 4.871 1.00 0.00 C ATOM 417 C SER A 30 -2.952 13.918 3.679 1.00 0.00 C ATOM 418 O SER A 30 -4.124 14.262 3.827 1.00 0.00 O ATOM 419 CB SER A 30 -1.070 15.080 4.853 1.00 0.00 C ATOM 420 OG SER A 30 -1.791 16.291 5.014 1.00 0.00 O ATOM 0 H SER A 30 -0.219 12.770 4.792 1.00 0.00 H new ATOM 0 HA SER A 30 -2.594 13.888 5.786 1.00 0.00 H new ATOM 0 HB2 SER A 30 -0.332 14.986 5.650 1.00 0.00 H new ATOM 0 HB3 SER A 30 -0.521 15.105 3.912 1.00 0.00 H new ATOM 0 HG SER A 30 -1.168 17.047 5.000 1.00 0.00 H new ATOM 426 N GLU A 31 -2.451 13.566 2.502 1.00 0.00 N ATOM 427 CA GLU A 31 -3.268 13.593 1.299 1.00 0.00 C ATOM 428 C GLU A 31 -4.276 12.459 1.280 1.00 0.00 C ATOM 429 O GLU A 31 -5.384 12.621 0.765 1.00 0.00 O ATOM 430 CB GLU A 31 -2.401 13.549 0.044 1.00 0.00 C ATOM 431 CG GLU A 31 -1.727 14.872 -0.250 1.00 0.00 C ATOM 432 CD GLU A 31 -2.708 16.020 -0.175 1.00 0.00 C ATOM 433 OE1 GLU A 31 -3.595 16.108 -1.049 1.00 0.00 O ATOM 434 OE2 GLU A 31 -2.619 16.824 0.773 1.00 0.00 O ATOM 0 H GLU A 31 -1.489 13.260 2.356 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.819 14.533 1.308 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.640 12.777 0.160 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -3.018 13.263 -0.808 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -0.918 15.036 0.462 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.277 14.840 -1.242 1.00 0.00 H new ATOM 441 N LEU A 32 -3.903 11.316 1.839 1.00 0.00 N ATOM 442 CA LEU A 32 -4.831 10.205 1.954 1.00 0.00 C ATOM 443 C LEU A 32 -6.013 10.600 2.829 1.00 0.00 C ATOM 444 O LEU A 32 -7.160 10.361 2.477 1.00 0.00 O ATOM 445 CB LEU A 32 -4.143 8.968 2.538 1.00 0.00 C ATOM 446 CG LEU A 32 -3.085 8.320 1.643 1.00 0.00 C ATOM 447 CD1 LEU A 32 -2.481 7.111 2.338 1.00 0.00 C ATOM 448 CD2 LEU A 32 -3.688 7.922 0.305 1.00 0.00 C ATOM 0 H LEU A 32 -2.972 11.137 2.216 1.00 0.00 H new ATOM 0 HA LEU A 32 -5.187 9.958 0.954 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -3.675 9.246 3.482 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -4.906 8.224 2.767 1.00 0.00 H new ATOM 0 HG LEU A 32 -2.294 9.046 1.457 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -1.729 6.658 1.692 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -2.015 7.424 3.273 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -3.265 6.383 2.549 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.920 7.463 -0.318 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -4.497 7.210 0.468 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -4.080 8.808 -0.195 1.00 0.00 H new ATOM 460 N LYS A 33 -5.721 11.251 3.945 1.00 0.00 N ATOM 461 CA LYS A 33 -6.747 11.630 4.909 1.00 0.00 C ATOM 462 C LYS A 33 -7.616 12.774 4.373 1.00 0.00 C ATOM 463 O LYS A 33 -8.731 12.988 4.845 1.00 0.00 O ATOM 464 CB LYS A 33 -6.080 12.043 6.226 1.00 0.00 C ATOM 465 CG LYS A 33 -7.009 12.049 7.431 1.00 0.00 C ATOM 466 CD LYS A 33 -6.304 12.598 8.663 1.00 0.00 C ATOM 467 CE LYS A 33 -7.155 12.452 9.917 1.00 0.00 C ATOM 468 NZ LYS A 33 -7.158 11.057 10.439 1.00 0.00 N ATOM 0 H LYS A 33 -4.776 11.530 4.208 1.00 0.00 H new ATOM 0 HA LYS A 33 -7.397 10.772 5.081 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.251 11.365 6.426 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -5.655 13.040 6.106 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.889 12.653 7.212 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -7.359 11.036 7.629 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -5.358 12.075 8.803 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -6.066 13.650 8.506 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -6.780 13.125 10.688 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -8.178 12.757 9.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -7.750 11.007 11.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -7.540 10.416 9.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -6.186 10.773 10.675 1.00 0.00 H new ATOM 482 N ARG A 34 -7.105 13.509 3.390 1.00 0.00 N ATOM 483 CA ARG A 34 -7.840 14.649 2.843 1.00 0.00 C ATOM 484 C ARG A 34 -8.539 14.307 1.527 1.00 0.00 C ATOM 485 O ARG A 34 -9.327 15.104 1.017 1.00 0.00 O ATOM 486 CB ARG A 34 -6.908 15.854 2.645 1.00 0.00 C ATOM 487 CG ARG A 34 -6.324 16.387 3.946 1.00 0.00 C ATOM 488 CD ARG A 34 -5.771 17.799 3.798 1.00 0.00 C ATOM 489 NE ARG A 34 -4.532 17.857 3.020 1.00 0.00 N ATOM 490 CZ ARG A 34 -3.699 18.901 3.037 1.00 0.00 C ATOM 491 NH1 ARG A 34 -3.977 19.967 3.777 1.00 0.00 N ATOM 492 NH2 ARG A 34 -2.592 18.881 2.310 1.00 0.00 N ATOM 0 H ARG A 34 -6.196 13.340 2.959 1.00 0.00 H new ATOM 0 HA ARG A 34 -8.610 14.907 3.570 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -6.093 15.568 1.980 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -7.459 16.653 2.149 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -7.095 16.380 4.717 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -5.529 15.722 4.284 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -6.522 18.428 3.320 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -5.590 18.217 4.788 1.00 0.00 H new ATOM 0 HE ARG A 34 -4.292 17.058 2.434 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -4.830 19.991 4.336 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -3.338 20.762 3.787 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -2.374 18.067 1.735 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -1.958 19.680 2.325 1.00 0.00 H new ATOM 506 N HIS A 35 -8.260 13.131 0.974 1.00 0.00 N ATOM 507 CA HIS A 35 -8.834 12.747 -0.317 1.00 0.00 C ATOM 508 C HIS A 35 -9.437 11.346 -0.272 1.00 0.00 C ATOM 509 O HIS A 35 -10.591 11.149 -0.648 1.00 0.00 O ATOM 510 CB HIS A 35 -7.782 12.838 -1.430 1.00 0.00 C ATOM 511 CG HIS A 35 -7.498 14.242 -1.883 1.00 0.00 C ATOM 512 ND1 HIS A 35 -6.316 14.903 -1.614 1.00 0.00 N ATOM 513 CD2 HIS A 35 -8.249 15.106 -2.613 1.00 0.00 C ATOM 514 CE1 HIS A 35 -6.356 16.107 -2.157 1.00 0.00 C ATOM 515 NE2 HIS A 35 -7.514 16.256 -2.769 1.00 0.00 N ATOM 0 H HIS A 35 -7.647 12.431 1.392 1.00 0.00 H new ATOM 0 HA HIS A 35 -9.638 13.450 -0.536 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -6.855 12.385 -1.079 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -8.119 12.252 -2.285 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -9.241 14.923 -3.000 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -5.570 16.846 -2.108 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -7.815 17.089 -3.275 1.00 0.00 H new ATOM 524 N ASN A 36 -8.655 10.377 0.181 1.00 0.00 N ATOM 525 CA ASN A 36 -9.124 8.998 0.271 1.00 0.00 C ATOM 526 C ASN A 36 -9.851 8.780 1.593 1.00 0.00 C ATOM 527 O ASN A 36 -9.254 8.385 2.595 1.00 0.00 O ATOM 528 CB ASN A 36 -7.959 8.013 0.136 1.00 0.00 C ATOM 529 CG ASN A 36 -8.406 6.564 0.255 1.00 0.00 C ATOM 530 OD1 ASN A 36 -9.515 6.206 -0.126 1.00 0.00 O ATOM 531 ND2 ASN A 36 -7.538 5.722 0.791 1.00 0.00 N ATOM 0 H ASN A 36 -7.694 10.518 0.492 1.00 0.00 H new ATOM 0 HA ASN A 36 -9.817 8.816 -0.551 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -7.471 8.162 -0.827 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -7.217 8.225 0.905 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -7.782 4.738 0.899 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -6.624 6.057 1.096 1.00 0.00 H new ATOM 538 N VAL A 37 -11.136 9.072 1.588 1.00 0.00 N ATOM 539 CA VAL A 37 -11.945 8.995 2.791 1.00 0.00 C ATOM 540 C VAL A 37 -12.255 7.546 3.168 1.00 0.00 C ATOM 541 O VAL A 37 -12.369 7.220 4.352 1.00 0.00 O ATOM 542 CB VAL A 37 -13.258 9.793 2.625 1.00 0.00 C ATOM 543 CG1 VAL A 37 -14.087 9.757 3.900 1.00 0.00 C ATOM 544 CG2 VAL A 37 -12.956 11.230 2.225 1.00 0.00 C ATOM 0 H VAL A 37 -11.648 9.368 0.757 1.00 0.00 H new ATOM 0 HA VAL A 37 -11.364 9.439 3.600 1.00 0.00 H new ATOM 0 HB VAL A 37 -13.842 9.324 1.833 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -15.005 10.327 3.754 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -14.336 8.724 4.143 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -13.515 10.194 4.718 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -13.890 11.780 2.112 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -12.348 11.702 2.997 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -12.413 11.238 1.280 1.00 0.00 H new ATOM 554 N SER A 38 -12.386 6.668 2.179 1.00 0.00 N ATOM 555 CA SER A 38 -12.734 5.286 2.471 1.00 0.00 C ATOM 556 C SER A 38 -11.512 4.359 2.420 1.00 0.00 C ATOM 557 O SER A 38 -10.900 4.086 3.454 1.00 0.00 O ATOM 558 CB SER A 38 -13.856 4.788 1.546 1.00 0.00 C ATOM 559 OG SER A 38 -13.480 4.832 0.181 1.00 0.00 O ATOM 0 H SER A 38 -12.259 6.883 1.190 1.00 0.00 H new ATOM 0 HA SER A 38 -13.108 5.259 3.494 1.00 0.00 H new ATOM 0 HB2 SER A 38 -14.121 3.766 1.816 1.00 0.00 H new ATOM 0 HB3 SER A 38 -14.747 5.398 1.696 1.00 0.00 H new ATOM 0 HG SER A 38 -13.284 5.758 -0.075 1.00 0.00 H new ATOM 565 N HIS A 39 -11.129 3.899 1.229 1.00 0.00 N ATOM 566 CA HIS A 39 -10.113 2.854 1.120 1.00 0.00 C ATOM 567 C HIS A 39 -9.566 2.747 -0.302 1.00 0.00 C ATOM 568 O HIS A 39 -10.263 3.042 -1.270 1.00 0.00 O ATOM 569 CB HIS A 39 -10.709 1.500 1.547 1.00 0.00 C ATOM 570 CG HIS A 39 -11.733 0.941 0.592 1.00 0.00 C ATOM 571 ND1 HIS A 39 -12.841 1.646 0.162 1.00 0.00 N ATOM 572 CD2 HIS A 39 -11.795 -0.262 -0.032 1.00 0.00 C ATOM 573 CE1 HIS A 39 -13.536 0.901 -0.680 1.00 0.00 C ATOM 574 NE2 HIS A 39 -12.922 -0.260 -0.815 1.00 0.00 N ATOM 0 H HIS A 39 -11.501 4.228 0.338 1.00 0.00 H new ATOM 0 HA HIS A 39 -9.288 3.121 1.780 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -9.899 0.778 1.655 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -11.169 1.613 2.529 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -11.088 -1.072 0.069 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -14.451 1.193 -1.174 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -13.235 -1.031 -1.406 1.00 0.00 H new ATOM 583 N TYR A 40 -8.324 2.297 -0.423 1.00 0.00 N ATOM 584 CA TYR A 40 -7.723 2.056 -1.730 1.00 0.00 C ATOM 585 C TYR A 40 -7.128 0.652 -1.783 1.00 0.00 C ATOM 586 O TYR A 40 -6.660 0.129 -0.768 1.00 0.00 O ATOM 587 CB TYR A 40 -6.651 3.111 -2.056 1.00 0.00 C ATOM 588 CG TYR A 40 -5.388 3.020 -1.222 1.00 0.00 C ATOM 589 CD1 TYR A 40 -4.323 2.218 -1.620 1.00 0.00 C ATOM 590 CD2 TYR A 40 -5.261 3.737 -0.042 1.00 0.00 C ATOM 591 CE1 TYR A 40 -3.172 2.132 -0.862 1.00 0.00 C ATOM 592 CE2 TYR A 40 -4.111 3.658 0.720 1.00 0.00 C ATOM 593 CZ TYR A 40 -3.068 2.854 0.305 1.00 0.00 C ATOM 594 OH TYR A 40 -1.926 2.763 1.071 1.00 0.00 O ATOM 0 H TYR A 40 -7.713 2.091 0.367 1.00 0.00 H new ATOM 0 HA TYR A 40 -8.506 2.137 -2.484 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -6.381 3.020 -3.108 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -7.086 4.102 -1.923 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -4.398 1.653 -2.537 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -6.074 4.367 0.287 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -2.357 1.501 -1.184 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -4.028 4.223 1.637 1.00 0.00 H new ATOM 0 HH TYR A 40 -2.015 3.337 1.861 1.00 0.00 H new ATOM 604 N ILE A 41 -7.164 0.045 -2.960 1.00 0.00 N ATOM 605 CA ILE A 41 -6.632 -1.297 -3.148 1.00 0.00 C ATOM 606 C ILE A 41 -5.337 -1.239 -3.945 1.00 0.00 C ATOM 607 O ILE A 41 -5.336 -0.877 -5.122 1.00 0.00 O ATOM 608 CB ILE A 41 -7.627 -2.236 -3.877 1.00 0.00 C ATOM 609 CG1 ILE A 41 -8.961 -2.336 -3.126 1.00 0.00 C ATOM 610 CG2 ILE A 41 -7.020 -3.623 -4.045 1.00 0.00 C ATOM 611 CD1 ILE A 41 -9.921 -1.199 -3.409 1.00 0.00 C ATOM 0 H ILE A 41 -7.558 0.463 -3.803 1.00 0.00 H new ATOM 0 HA ILE A 41 -6.452 -1.704 -2.153 1.00 0.00 H new ATOM 0 HB ILE A 41 -7.825 -1.808 -4.860 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -9.443 -3.277 -3.389 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -8.760 -2.369 -2.055 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -7.730 -4.271 -4.558 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -6.104 -3.551 -4.632 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -6.790 -4.041 -3.065 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -10.838 -1.347 -2.839 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -9.462 -0.254 -3.119 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -10.155 -1.177 -4.473 1.00 0.00 H new ATOM 623 N TYR A 42 -4.244 -1.585 -3.296 1.00 0.00 N ATOM 624 CA TYR A 42 -2.933 -1.549 -3.915 1.00 0.00 C ATOM 625 C TYR A 42 -2.527 -2.952 -4.361 1.00 0.00 C ATOM 626 O TYR A 42 -2.267 -3.823 -3.532 1.00 0.00 O ATOM 627 CB TYR A 42 -1.914 -1.008 -2.907 1.00 0.00 C ATOM 628 CG TYR A 42 -0.680 -0.367 -3.510 1.00 0.00 C ATOM 629 CD1 TYR A 42 0.007 -0.948 -4.573 1.00 0.00 C ATOM 630 CD2 TYR A 42 -0.193 0.829 -2.994 1.00 0.00 C ATOM 631 CE1 TYR A 42 1.136 -0.352 -5.106 1.00 0.00 C ATOM 632 CE2 TYR A 42 0.933 1.429 -3.522 1.00 0.00 C ATOM 633 CZ TYR A 42 1.595 0.834 -4.573 1.00 0.00 C ATOM 634 OH TYR A 42 2.713 1.429 -5.100 1.00 0.00 O ATOM 0 H TYR A 42 -4.238 -1.899 -2.326 1.00 0.00 H new ATOM 0 HA TYR A 42 -2.963 -0.898 -4.789 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -2.411 -0.274 -2.272 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -1.598 -1.827 -2.260 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -0.348 -1.880 -4.988 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -0.704 1.297 -2.166 1.00 0.00 H new ATOM 0 HE1 TYR A 42 1.654 -0.813 -5.934 1.00 0.00 H new ATOM 0 HE2 TYR A 42 1.293 2.361 -3.112 1.00 0.00 H new ATOM 0 HH TYR A 42 2.579 1.585 -6.058 1.00 0.00 H new ATOM 644 N TYR A 43 -2.500 -3.175 -5.667 1.00 0.00 N ATOM 645 CA TYR A 43 -2.008 -4.433 -6.208 1.00 0.00 C ATOM 646 C TYR A 43 -0.499 -4.361 -6.384 1.00 0.00 C ATOM 647 O TYR A 43 -0.004 -3.728 -7.316 1.00 0.00 O ATOM 648 CB TYR A 43 -2.679 -4.762 -7.543 1.00 0.00 C ATOM 649 CG TYR A 43 -4.155 -5.087 -7.425 1.00 0.00 C ATOM 650 CD1 TYR A 43 -4.575 -6.223 -6.743 1.00 0.00 C ATOM 651 CD2 TYR A 43 -5.125 -4.269 -7.998 1.00 0.00 C ATOM 652 CE1 TYR A 43 -5.917 -6.535 -6.635 1.00 0.00 C ATOM 653 CE2 TYR A 43 -6.470 -4.576 -7.891 1.00 0.00 C ATOM 654 CZ TYR A 43 -6.859 -5.711 -7.210 1.00 0.00 C ATOM 655 OH TYR A 43 -8.194 -6.027 -7.105 1.00 0.00 O ATOM 0 H TYR A 43 -2.812 -2.504 -6.369 1.00 0.00 H new ATOM 0 HA TYR A 43 -2.254 -5.228 -5.504 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -2.556 -3.915 -8.218 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -2.166 -5.609 -7.997 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -3.841 -6.873 -6.290 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -4.823 -3.381 -8.534 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -6.226 -7.422 -6.102 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -7.211 -3.930 -8.338 1.00 0.00 H new ATOM 0 HH TYR A 43 -8.729 -5.345 -7.563 1.00 0.00 H new ATOM 665 N LEU A 44 0.218 -5.012 -5.478 1.00 0.00 N ATOM 666 CA LEU A 44 1.676 -4.918 -5.426 1.00 0.00 C ATOM 667 C LEU A 44 2.332 -5.487 -6.679 1.00 0.00 C ATOM 668 O LEU A 44 3.313 -4.939 -7.173 1.00 0.00 O ATOM 669 CB LEU A 44 2.232 -5.651 -4.196 1.00 0.00 C ATOM 670 CG LEU A 44 1.836 -5.083 -2.828 1.00 0.00 C ATOM 671 CD1 LEU A 44 0.422 -5.502 -2.455 1.00 0.00 C ATOM 672 CD2 LEU A 44 2.829 -5.534 -1.766 1.00 0.00 C ATOM 0 H LEU A 44 -0.187 -5.616 -4.763 1.00 0.00 H new ATOM 0 HA LEU A 44 1.914 -3.856 -5.360 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.907 -6.690 -4.242 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.320 -5.654 -4.263 1.00 0.00 H new ATOM 0 HG LEU A 44 1.858 -3.995 -2.886 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.165 -5.087 -1.481 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -0.277 -5.130 -3.204 1.00 0.00 H new ATOM 0 HD13 LEU A 44 0.364 -6.590 -2.413 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.538 -5.125 -0.799 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.835 -6.623 -1.712 1.00 0.00 H new ATOM 0 HD23 LEU A 44 3.826 -5.178 -2.025 1.00 0.00 H new ATOM 684 N ALA A 45 1.782 -6.577 -7.197 1.00 0.00 N ATOM 685 CA ALA A 45 2.407 -7.293 -8.304 1.00 0.00 C ATOM 686 C ALA A 45 2.386 -6.487 -9.598 1.00 0.00 C ATOM 687 O ALA A 45 3.383 -6.423 -10.309 1.00 0.00 O ATOM 688 CB ALA A 45 1.741 -8.642 -8.506 1.00 0.00 C ATOM 0 H ALA A 45 0.906 -6.985 -6.870 1.00 0.00 H new ATOM 0 HA ALA A 45 3.453 -7.448 -8.039 1.00 0.00 H new ATOM 0 HB1 ALA A 45 2.219 -9.163 -9.335 1.00 0.00 H new ATOM 0 HB2 ALA A 45 1.841 -9.237 -7.598 1.00 0.00 H new ATOM 0 HB3 ALA A 45 0.684 -8.496 -8.730 1.00 0.00 H new ATOM 694 N THR A 46 1.252 -5.871 -9.897 1.00 0.00 N ATOM 695 CA THR A 46 1.093 -5.146 -11.149 1.00 0.00 C ATOM 696 C THR A 46 1.334 -3.652 -10.976 1.00 0.00 C ATOM 697 O THR A 46 1.350 -2.907 -11.959 1.00 0.00 O ATOM 698 CB THR A 46 -0.312 -5.374 -11.736 1.00 0.00 C ATOM 699 OG1 THR A 46 -1.296 -5.248 -10.699 1.00 0.00 O ATOM 700 CG2 THR A 46 -0.414 -6.750 -12.375 1.00 0.00 C ATOM 0 H THR A 46 0.431 -5.858 -9.292 1.00 0.00 H new ATOM 0 HA THR A 46 1.843 -5.535 -11.838 1.00 0.00 H new ATOM 0 HB THR A 46 -0.492 -4.622 -12.504 1.00 0.00 H new ATOM 0 HG1 THR A 46 -2.189 -5.392 -11.076 1.00 0.00 H new ATOM 0 HG21 THR A 46 -1.415 -6.888 -12.783 1.00 0.00 H new ATOM 0 HG22 THR A 46 0.319 -6.834 -13.177 1.00 0.00 H new ATOM 0 HG23 THR A 46 -0.219 -7.515 -11.624 1.00 0.00 H new ATOM 708 N GLU A 47 1.532 -3.227 -9.725 1.00 0.00 N ATOM 709 CA GLU A 47 1.709 -1.812 -9.405 1.00 0.00 C ATOM 710 C GLU A 47 0.441 -1.039 -9.795 1.00 0.00 C ATOM 711 O GLU A 47 0.490 0.050 -10.369 1.00 0.00 O ATOM 712 CB GLU A 47 2.963 -1.270 -10.112 1.00 0.00 C ATOM 713 CG GLU A 47 3.327 0.159 -9.753 1.00 0.00 C ATOM 714 CD GLU A 47 3.518 0.359 -8.270 1.00 0.00 C ATOM 715 OE1 GLU A 47 4.515 -0.152 -7.716 1.00 0.00 O ATOM 716 OE2 GLU A 47 2.696 1.064 -7.651 1.00 0.00 O ATOM 0 H GLU A 47 1.573 -3.847 -8.916 1.00 0.00 H new ATOM 0 HA GLU A 47 1.860 -1.683 -8.333 1.00 0.00 H new ATOM 0 HB2 GLU A 47 3.807 -1.917 -9.871 1.00 0.00 H new ATOM 0 HB3 GLU A 47 2.811 -1.332 -11.190 1.00 0.00 H new ATOM 0 HG2 GLU A 47 4.243 0.437 -10.273 1.00 0.00 H new ATOM 0 HG3 GLU A 47 2.543 0.829 -10.107 1.00 0.00 H new ATOM 723 N ASN A 48 -0.702 -1.635 -9.470 1.00 0.00 N ATOM 724 CA ASN A 48 -2.003 -1.043 -9.764 1.00 0.00 C ATOM 725 C ASN A 48 -2.686 -0.592 -8.481 1.00 0.00 C ATOM 726 O ASN A 48 -3.082 -1.415 -7.657 1.00 0.00 O ATOM 727 CB ASN A 48 -2.904 -2.043 -10.495 1.00 0.00 C ATOM 728 CG ASN A 48 -2.650 -2.093 -11.991 1.00 0.00 C ATOM 729 OD1 ASN A 48 -1.553 -1.811 -12.463 1.00 0.00 O ATOM 730 ND2 ASN A 48 -3.669 -2.476 -12.744 1.00 0.00 N ATOM 0 H ASN A 48 -0.753 -2.538 -8.998 1.00 0.00 H new ATOM 0 HA ASN A 48 -1.838 -0.179 -10.407 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -2.751 -3.036 -10.073 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -3.947 -1.779 -10.318 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -3.558 -2.545 -13.756 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -4.565 -2.702 -12.313 1.00 0.00 H new ATOM 737 N VAL A 49 -2.823 0.708 -8.313 1.00 0.00 N ATOM 738 CA VAL A 49 -3.436 1.258 -7.115 1.00 0.00 C ATOM 739 C VAL A 49 -4.843 1.765 -7.426 1.00 0.00 C ATOM 740 O VAL A 49 -5.014 2.686 -8.218 1.00 0.00 O ATOM 741 CB VAL A 49 -2.598 2.413 -6.532 1.00 0.00 C ATOM 742 CG1 VAL A 49 -3.029 2.719 -5.102 1.00 0.00 C ATOM 743 CG2 VAL A 49 -1.113 2.091 -6.599 1.00 0.00 C ATOM 0 H VAL A 49 -2.518 1.407 -8.991 1.00 0.00 H new ATOM 0 HA VAL A 49 -3.486 0.458 -6.376 1.00 0.00 H new ATOM 0 HB VAL A 49 -2.774 3.303 -7.136 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -2.426 3.537 -4.707 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -4.081 3.006 -5.092 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -2.889 1.833 -4.482 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -0.542 2.920 -6.182 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.911 1.186 -6.026 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.821 1.935 -7.638 1.00 0.00 H new ATOM 753 N HIS A 50 -5.844 1.147 -6.824 1.00 0.00 N ATOM 754 CA HIS A 50 -7.231 1.545 -7.036 1.00 0.00 C ATOM 755 C HIS A 50 -7.749 2.338 -5.844 1.00 0.00 C ATOM 756 O HIS A 50 -8.126 1.759 -4.827 1.00 0.00 O ATOM 757 CB HIS A 50 -8.116 0.316 -7.261 1.00 0.00 C ATOM 758 CG HIS A 50 -8.006 -0.285 -8.631 1.00 0.00 C ATOM 759 ND1 HIS A 50 -9.096 -0.750 -9.332 1.00 0.00 N ATOM 760 CD2 HIS A 50 -6.931 -0.500 -9.430 1.00 0.00 C ATOM 761 CE1 HIS A 50 -8.700 -1.225 -10.498 1.00 0.00 C ATOM 762 NE2 HIS A 50 -7.391 -1.085 -10.584 1.00 0.00 N ATOM 0 H HIS A 50 -5.725 0.364 -6.181 1.00 0.00 H new ATOM 0 HA HIS A 50 -7.268 2.176 -7.924 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -7.857 -0.443 -6.523 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -9.155 0.594 -7.082 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -5.904 -0.256 -9.201 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -9.340 -1.656 -11.254 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -6.815 -1.365 -11.378 1.00 0.00 H new ATOM 771 N ILE A 51 -7.760 3.659 -5.965 1.00 0.00 N ATOM 772 CA ILE A 51 -8.191 4.523 -4.872 1.00 0.00 C ATOM 773 C ILE A 51 -9.681 4.835 -4.975 1.00 0.00 C ATOM 774 O ILE A 51 -10.111 5.573 -5.862 1.00 0.00 O ATOM 775 CB ILE A 51 -7.412 5.864 -4.828 1.00 0.00 C ATOM 776 CG1 ILE A 51 -5.905 5.638 -4.665 1.00 0.00 C ATOM 777 CG2 ILE A 51 -7.925 6.744 -3.696 1.00 0.00 C ATOM 778 CD1 ILE A 51 -5.187 5.334 -5.961 1.00 0.00 C ATOM 0 H ILE A 51 -7.476 4.156 -6.809 1.00 0.00 H new ATOM 0 HA ILE A 51 -7.983 3.970 -3.956 1.00 0.00 H new ATOM 0 HB ILE A 51 -7.579 6.367 -5.780 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -5.461 6.526 -4.215 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -5.744 4.814 -3.970 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -7.367 7.680 -3.681 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -8.983 6.955 -3.850 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -7.793 6.228 -2.745 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -4.125 5.187 -5.763 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -5.603 4.429 -6.403 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -5.315 6.167 -6.652 1.00 0.00 H new ATOM 790 N VAL A 52 -10.460 4.261 -4.078 1.00 0.00 N ATOM 791 CA VAL A 52 -11.865 4.604 -3.972 1.00 0.00 C ATOM 792 C VAL A 52 -12.007 5.744 -2.977 1.00 0.00 C ATOM 793 O VAL A 52 -11.794 5.555 -1.784 1.00 0.00 O ATOM 794 CB VAL A 52 -12.718 3.404 -3.503 1.00 0.00 C ATOM 795 CG1 VAL A 52 -14.199 3.756 -3.513 1.00 0.00 C ATOM 796 CG2 VAL A 52 -12.448 2.178 -4.363 1.00 0.00 C ATOM 0 H VAL A 52 -10.144 3.555 -3.413 1.00 0.00 H new ATOM 0 HA VAL A 52 -12.225 4.897 -4.958 1.00 0.00 H new ATOM 0 HB VAL A 52 -12.433 3.167 -2.478 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -14.780 2.896 -3.179 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -14.378 4.597 -2.843 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -14.502 4.028 -4.524 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.060 1.346 -4.013 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -12.696 2.400 -5.401 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -11.394 1.908 -4.291 1.00 0.00 H new ATOM 806 N LEU A 53 -12.331 6.929 -3.474 1.00 0.00 N ATOM 807 CA LEU A 53 -12.376 8.119 -2.626 1.00 0.00 C ATOM 808 C LEU A 53 -13.419 7.982 -1.522 1.00 0.00 C ATOM 809 O LEU A 53 -13.091 7.746 -0.360 1.00 0.00 O ATOM 810 CB LEU A 53 -12.673 9.366 -3.461 1.00 0.00 C ATOM 811 CG LEU A 53 -11.634 9.694 -4.533 1.00 0.00 C ATOM 812 CD1 LEU A 53 -12.012 10.968 -5.267 1.00 0.00 C ATOM 813 CD2 LEU A 53 -10.248 9.819 -3.916 1.00 0.00 C ATOM 0 H LEU A 53 -12.566 7.095 -4.453 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.396 8.222 -2.161 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -13.642 9.238 -3.944 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -12.762 10.220 -2.790 1.00 0.00 H new ATOM 0 HG LEU A 53 -11.613 8.877 -5.254 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -11.261 11.187 -6.027 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -12.984 10.839 -5.744 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -12.063 11.795 -4.558 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -9.523 10.053 -4.695 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -10.251 10.616 -3.172 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -9.976 8.878 -3.438 1.00 0.00 H new ATOM 825 N LYS A 54 -14.675 8.127 -1.899 1.00 0.00 N ATOM 826 CA LYS A 54 -15.777 8.055 -0.957 1.00 0.00 C ATOM 827 C LYS A 54 -16.984 7.445 -1.652 1.00 0.00 C ATOM 828 O LYS A 54 -17.359 6.304 -1.392 1.00 0.00 O ATOM 829 CB LYS A 54 -16.103 9.459 -0.428 1.00 0.00 C ATOM 830 CG LYS A 54 -17.211 9.499 0.611 1.00 0.00 C ATOM 831 CD LYS A 54 -17.483 10.926 1.061 1.00 0.00 C ATOM 832 CE LYS A 54 -18.608 10.990 2.078 1.00 0.00 C ATOM 833 NZ LYS A 54 -18.860 12.381 2.536 1.00 0.00 N ATOM 0 H LYS A 54 -14.960 8.297 -2.863 1.00 0.00 H new ATOM 0 HA LYS A 54 -15.502 7.428 -0.109 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -15.200 9.889 0.005 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -16.387 10.093 -1.268 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -18.120 9.065 0.195 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -16.931 8.890 1.470 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -16.577 11.350 1.494 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -17.739 11.538 0.196 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -19.518 10.581 1.639 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -18.359 10.365 2.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -19.635 12.383 3.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -17.999 12.762 2.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -19.123 12.972 1.722 1.00 0.00 H new ATOM 847 N ASN A 55 -17.571 8.208 -2.560 1.00 0.00 N ATOM 848 CA ASN A 55 -18.666 7.719 -3.390 1.00 0.00 C ATOM 849 C ASN A 55 -18.577 8.336 -4.775 1.00 0.00 C ATOM 850 O ASN A 55 -19.488 8.204 -5.594 1.00 0.00 O ATOM 851 CB ASN A 55 -20.023 8.045 -2.756 1.00 0.00 C ATOM 852 CG ASN A 55 -20.243 9.535 -2.576 1.00 0.00 C ATOM 853 OD1 ASN A 55 -19.927 10.097 -1.527 1.00 0.00 O ATOM 854 ND2 ASN A 55 -20.783 10.185 -3.596 1.00 0.00 N ATOM 0 H ASN A 55 -17.307 9.176 -2.743 1.00 0.00 H new ATOM 0 HA ASN A 55 -18.580 6.635 -3.470 1.00 0.00 H new ATOM 0 HB2 ASN A 55 -20.818 7.637 -3.380 1.00 0.00 H new ATOM 0 HB3 ASN A 55 -20.094 7.552 -1.787 1.00 0.00 H new ATOM 0 HD21 ASN A 55 -20.951 11.189 -3.529 1.00 0.00 H new ATOM 0 HD22 ASN A 55 -21.031 9.682 -4.448 1.00 0.00 H new ATOM 861 N ASP A 56 -17.459 9.000 -5.029 1.00 0.00 N ATOM 862 CA ASP A 56 -17.259 9.723 -6.276 1.00 0.00 C ATOM 863 C ASP A 56 -16.838 8.770 -7.382 1.00 0.00 C ATOM 864 O ASP A 56 -17.622 8.451 -8.274 1.00 0.00 O ATOM 865 CB ASP A 56 -16.192 10.805 -6.100 1.00 0.00 C ATOM 866 CG ASP A 56 -16.429 11.666 -4.877 1.00 0.00 C ATOM 867 OD1 ASP A 56 -15.970 11.277 -3.779 1.00 0.00 O ATOM 868 OD2 ASP A 56 -17.062 12.732 -5.003 1.00 0.00 O ATOM 0 H ASP A 56 -16.671 9.053 -4.383 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.203 10.193 -6.551 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -15.212 10.334 -6.023 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -16.173 11.438 -6.987 1.00 0.00 H new ATOM 873 N ASN A 57 -15.595 8.308 -7.307 1.00 0.00 N ATOM 874 CA ASN A 57 -15.046 7.411 -8.314 1.00 0.00 C ATOM 875 C ASN A 57 -13.875 6.616 -7.755 1.00 0.00 C ATOM 876 O ASN A 57 -13.487 6.788 -6.590 1.00 0.00 O ATOM 877 CB ASN A 57 -14.582 8.194 -9.552 1.00 0.00 C ATOM 878 CG ASN A 57 -13.396 9.109 -9.273 1.00 0.00 C ATOM 879 OD1 ASN A 57 -13.266 9.676 -8.188 1.00 0.00 O ATOM 880 ND2 ASN A 57 -12.517 9.257 -10.253 1.00 0.00 N ATOM 0 H ASN A 57 -14.947 8.542 -6.555 1.00 0.00 H new ATOM 0 HA ASN A 57 -15.839 6.722 -8.603 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -14.312 7.490 -10.339 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -15.413 8.791 -9.929 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -11.702 9.856 -10.121 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -12.655 8.772 -11.140 1.00 0.00 H new ATOM 887 N THR A 58 -13.332 5.740 -8.585 1.00 0.00 N ATOM 888 CA THR A 58 -12.147 4.980 -8.245 1.00 0.00 C ATOM 889 C THR A 58 -10.984 5.385 -9.146 1.00 0.00 C ATOM 890 O THR A 58 -11.002 5.135 -10.353 1.00 0.00 O ATOM 891 CB THR A 58 -12.399 3.468 -8.395 1.00 0.00 C ATOM 892 OG1 THR A 58 -13.586 3.098 -7.678 1.00 0.00 O ATOM 893 CG2 THR A 58 -11.218 2.665 -7.877 1.00 0.00 C ATOM 0 H THR A 58 -13.703 5.538 -9.513 1.00 0.00 H new ATOM 0 HA THR A 58 -11.900 5.196 -7.206 1.00 0.00 H new ATOM 0 HB THR A 58 -12.528 3.247 -9.455 1.00 0.00 H new ATOM 0 HG1 THR A 58 -13.742 2.136 -7.778 1.00 0.00 H new ATOM 0 HG21 THR A 58 -11.422 1.601 -7.995 1.00 0.00 H new ATOM 0 HG22 THR A 58 -10.324 2.928 -8.442 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.060 2.890 -6.822 1.00 0.00 H new ATOM 901 N VAL A 59 -9.986 6.024 -8.563 1.00 0.00 N ATOM 902 CA VAL A 59 -8.810 6.438 -9.307 1.00 0.00 C ATOM 903 C VAL A 59 -7.836 5.268 -9.416 1.00 0.00 C ATOM 904 O VAL A 59 -7.251 4.840 -8.422 1.00 0.00 O ATOM 905 CB VAL A 59 -8.110 7.647 -8.643 1.00 0.00 C ATOM 906 CG1 VAL A 59 -6.933 8.118 -9.481 1.00 0.00 C ATOM 907 CG2 VAL A 59 -9.094 8.789 -8.417 1.00 0.00 C ATOM 0 H VAL A 59 -9.967 6.268 -7.573 1.00 0.00 H new ATOM 0 HA VAL A 59 -9.131 6.747 -10.302 1.00 0.00 H new ATOM 0 HB VAL A 59 -7.733 7.324 -7.673 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -6.457 8.969 -8.994 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -6.211 7.307 -9.583 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -7.286 8.416 -10.468 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -8.578 9.627 -7.949 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -9.509 9.107 -9.374 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -9.901 8.451 -7.766 1.00 0.00 H new ATOM 917 N LEU A 60 -7.694 4.730 -10.620 1.00 0.00 N ATOM 918 CA LEU A 60 -6.827 3.582 -10.843 1.00 0.00 C ATOM 919 C LEU A 60 -5.470 4.017 -11.385 1.00 0.00 C ATOM 920 O LEU A 60 -5.356 4.504 -12.511 1.00 0.00 O ATOM 921 CB LEU A 60 -7.480 2.559 -11.791 1.00 0.00 C ATOM 922 CG LEU A 60 -7.849 3.063 -13.191 1.00 0.00 C ATOM 923 CD1 LEU A 60 -7.979 1.895 -14.153 1.00 0.00 C ATOM 924 CD2 LEU A 60 -9.148 3.854 -13.162 1.00 0.00 C ATOM 0 H LEU A 60 -8.168 5.070 -11.457 1.00 0.00 H new ATOM 0 HA LEU A 60 -6.674 3.099 -9.878 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -6.801 1.713 -11.901 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -8.385 2.181 -11.315 1.00 0.00 H new ATOM 0 HG LEU A 60 -7.051 3.723 -13.532 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -8.241 2.267 -15.143 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -7.031 1.360 -14.206 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -8.758 1.219 -13.801 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -9.386 4.200 -14.168 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -9.954 3.217 -12.797 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -9.036 4.713 -12.500 1.00 0.00 H new ATOM 936 N LEU A 61 -4.451 3.850 -10.560 1.00 0.00 N ATOM 937 CA LEU A 61 -3.088 4.186 -10.936 1.00 0.00 C ATOM 938 C LEU A 61 -2.355 2.927 -11.364 1.00 0.00 C ATOM 939 O LEU A 61 -2.012 2.088 -10.532 1.00 0.00 O ATOM 940 CB LEU A 61 -2.349 4.820 -9.755 1.00 0.00 C ATOM 941 CG LEU A 61 -3.123 5.886 -8.980 1.00 0.00 C ATOM 942 CD1 LEU A 61 -2.329 6.328 -7.764 1.00 0.00 C ATOM 943 CD2 LEU A 61 -3.444 7.076 -9.868 1.00 0.00 C ATOM 0 H LEU A 61 -4.544 3.479 -9.614 1.00 0.00 H new ATOM 0 HA LEU A 61 -3.118 4.898 -11.761 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.065 4.028 -9.062 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -1.426 5.266 -10.126 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.065 5.452 -8.645 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.890 7.088 -7.220 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.153 5.471 -7.114 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -1.373 6.743 -8.085 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.995 7.821 -9.293 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -2.517 7.515 -10.237 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.051 6.747 -10.712 1.00 0.00 H new ATOM 955 N LYS A 62 -2.135 2.779 -12.656 1.00 0.00 N ATOM 956 CA LYS A 62 -1.439 1.614 -13.169 1.00 0.00 C ATOM 957 C LYS A 62 0.000 1.962 -13.527 1.00 0.00 C ATOM 958 O LYS A 62 0.278 2.529 -14.585 1.00 0.00 O ATOM 959 CB LYS A 62 -2.182 1.025 -14.373 1.00 0.00 C ATOM 960 CG LYS A 62 -2.572 2.045 -15.431 1.00 0.00 C ATOM 961 CD LYS A 62 -3.308 1.391 -16.586 1.00 0.00 C ATOM 962 CE LYS A 62 -3.717 2.411 -17.637 1.00 0.00 C ATOM 963 NZ LYS A 62 -2.541 3.105 -18.223 1.00 0.00 N ATOM 0 H LYS A 62 -2.427 3.448 -13.368 1.00 0.00 H new ATOM 0 HA LYS A 62 -1.416 0.855 -12.387 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -1.554 0.263 -14.835 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -3.083 0.524 -14.019 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -3.203 2.813 -14.983 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -1.678 2.545 -15.804 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -2.671 0.633 -17.042 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -4.194 0.879 -16.211 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -4.276 1.912 -18.429 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -4.386 3.146 -17.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -2.833 3.623 -19.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -2.151 3.774 -17.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -1.815 2.405 -18.475 1.00 0.00 H new ATOM 1039 N ILE A 67 6.785 -6.133 -12.759 1.00 0.00 N ATOM 1040 CA ILE A 67 5.822 -6.976 -12.069 1.00 0.00 C ATOM 1041 C ILE A 67 6.537 -7.895 -11.084 1.00 0.00 C ATOM 1042 O ILE A 67 7.390 -8.700 -11.476 1.00 0.00 O ATOM 1043 CB ILE A 67 4.980 -7.826 -13.062 1.00 0.00 C ATOM 1044 CG1 ILE A 67 4.050 -6.940 -13.905 1.00 0.00 C ATOM 1045 CG2 ILE A 67 4.167 -8.880 -12.321 1.00 0.00 C ATOM 1046 CD1 ILE A 67 4.745 -6.183 -15.017 1.00 0.00 C ATOM 0 HA ILE A 67 5.141 -6.318 -11.529 1.00 0.00 H new ATOM 0 HB ILE A 67 5.676 -8.329 -13.733 1.00 0.00 H new ATOM 0 HG12 ILE A 67 3.269 -7.564 -14.340 1.00 0.00 H new ATOM 0 HG13 ILE A 67 3.556 -6.224 -13.248 1.00 0.00 H new ATOM 0 HG21 ILE A 67 3.587 -9.462 -13.037 1.00 0.00 H new ATOM 0 HG22 ILE A 67 4.840 -9.542 -11.776 1.00 0.00 H new ATOM 0 HG23 ILE A 67 3.492 -8.391 -11.619 1.00 0.00 H new ATOM 0 HD11 ILE A 67 4.015 -5.584 -15.561 1.00 0.00 H new ATOM 0 HD12 ILE A 67 5.506 -5.529 -14.592 1.00 0.00 H new ATOM 0 HD13 ILE A 67 5.215 -6.890 -15.700 1.00 0.00 H new ATOM 1058 N VAL A 68 6.202 -7.761 -9.807 1.00 0.00 N ATOM 1059 CA VAL A 68 6.801 -8.588 -8.774 1.00 0.00 C ATOM 1060 C VAL A 68 6.039 -9.908 -8.653 1.00 0.00 C ATOM 1061 O VAL A 68 4.852 -9.986 -8.978 1.00 0.00 O ATOM 1062 CB VAL A 68 6.846 -7.848 -7.410 1.00 0.00 C ATOM 1063 CG1 VAL A 68 5.451 -7.657 -6.838 1.00 0.00 C ATOM 1064 CG2 VAL A 68 7.748 -8.576 -6.419 1.00 0.00 C ATOM 0 H VAL A 68 5.518 -7.086 -9.464 1.00 0.00 H new ATOM 0 HA VAL A 68 7.830 -8.801 -9.062 1.00 0.00 H new ATOM 0 HB VAL A 68 7.270 -6.859 -7.586 1.00 0.00 H new ATOM 0 HG11 VAL A 68 5.518 -7.136 -5.883 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.851 -7.068 -7.532 1.00 0.00 H new ATOM 0 HG13 VAL A 68 4.983 -8.630 -6.689 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.760 -8.035 -5.473 1.00 0.00 H new ATOM 0 HG22 VAL A 68 7.369 -9.585 -6.255 1.00 0.00 H new ATOM 0 HG23 VAL A 68 8.760 -8.629 -6.820 1.00 0.00 H new ATOM 1074 N SER A 69 6.727 -10.948 -8.213 1.00 0.00 N ATOM 1075 CA SER A 69 6.139 -12.272 -8.153 1.00 0.00 C ATOM 1076 C SER A 69 5.528 -12.540 -6.779 1.00 0.00 C ATOM 1077 O SER A 69 6.241 -12.694 -5.785 1.00 0.00 O ATOM 1078 CB SER A 69 7.201 -13.325 -8.485 1.00 0.00 C ATOM 1079 OG SER A 69 6.609 -14.585 -8.759 1.00 0.00 O ATOM 0 H SER A 69 7.694 -10.899 -7.892 1.00 0.00 H new ATOM 0 HA SER A 69 5.337 -12.330 -8.889 1.00 0.00 H new ATOM 0 HB2 SER A 69 7.783 -12.999 -9.347 1.00 0.00 H new ATOM 0 HB3 SER A 69 7.895 -13.421 -7.650 1.00 0.00 H new ATOM 0 HG SER A 69 7.310 -15.237 -8.969 1.00 0.00 H new ATOM 1085 N VAL A 70 4.204 -12.564 -6.729 1.00 0.00 N ATOM 1086 CA VAL A 70 3.493 -12.923 -5.514 1.00 0.00 C ATOM 1087 C VAL A 70 3.309 -14.435 -5.466 1.00 0.00 C ATOM 1088 O VAL A 70 2.622 -15.012 -6.308 1.00 0.00 O ATOM 1089 CB VAL A 70 2.115 -12.231 -5.431 1.00 0.00 C ATOM 1090 CG1 VAL A 70 1.388 -12.618 -4.153 1.00 0.00 C ATOM 1091 CG2 VAL A 70 2.268 -10.721 -5.516 1.00 0.00 C ATOM 0 H VAL A 70 3.600 -12.338 -7.519 1.00 0.00 H new ATOM 0 HA VAL A 70 4.086 -12.587 -4.664 1.00 0.00 H new ATOM 0 HB VAL A 70 1.518 -12.568 -6.278 1.00 0.00 H new ATOM 0 HG11 VAL A 70 0.420 -12.117 -4.119 1.00 0.00 H new ATOM 0 HG12 VAL A 70 1.239 -13.698 -4.132 1.00 0.00 H new ATOM 0 HG13 VAL A 70 1.983 -12.317 -3.291 1.00 0.00 H new ATOM 0 HG21 VAL A 70 1.286 -10.252 -5.456 1.00 0.00 H new ATOM 0 HG22 VAL A 70 2.889 -10.371 -4.691 1.00 0.00 H new ATOM 0 HG23 VAL A 70 2.739 -10.456 -6.462 1.00 0.00 H new ATOM 1101 N LYS A 71 3.943 -15.069 -4.495 1.00 0.00 N ATOM 1102 CA LYS A 71 3.941 -16.522 -4.405 1.00 0.00 C ATOM 1103 C LYS A 71 2.857 -17.020 -3.463 1.00 0.00 C ATOM 1104 O LYS A 71 2.403 -16.294 -2.576 1.00 0.00 O ATOM 1105 CB LYS A 71 5.295 -17.025 -3.911 1.00 0.00 C ATOM 1106 CG LYS A 71 6.462 -16.660 -4.813 1.00 0.00 C ATOM 1107 CD LYS A 71 7.776 -17.175 -4.247 1.00 0.00 C ATOM 1108 CE LYS A 71 7.772 -18.691 -4.109 1.00 0.00 C ATOM 1109 NZ LYS A 71 9.050 -19.203 -3.553 1.00 0.00 N ATOM 0 H LYS A 71 4.467 -14.601 -3.756 1.00 0.00 H new ATOM 0 HA LYS A 71 3.742 -16.909 -5.405 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.479 -16.620 -2.916 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.253 -18.110 -3.811 1.00 0.00 H new ATOM 0 HG2 LYS A 71 6.302 -17.079 -5.807 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.512 -15.577 -4.928 1.00 0.00 H new ATOM 0 HD2 LYS A 71 8.597 -16.871 -4.897 1.00 0.00 H new ATOM 0 HD3 LYS A 71 7.956 -16.721 -3.272 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.948 -18.994 -3.462 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.594 -19.143 -5.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 9.005 -20.239 -3.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 9.834 -18.937 -4.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 9.208 -18.792 -2.611 1.00 0.00 H new ATOM 1123 N PHE A 72 2.460 -18.274 -3.645 1.00 0.00 N ATOM 1124 CA PHE A 72 1.520 -18.911 -2.737 1.00 0.00 C ATOM 1125 C PHE A 72 2.261 -19.455 -1.521 1.00 0.00 C ATOM 1126 O PHE A 72 2.355 -20.666 -1.315 1.00 0.00 O ATOM 1127 CB PHE A 72 0.747 -20.033 -3.433 1.00 0.00 C ATOM 1128 CG PHE A 72 -0.344 -19.545 -4.343 1.00 0.00 C ATOM 1129 CD1 PHE A 72 -1.620 -19.325 -3.848 1.00 0.00 C ATOM 1130 CD2 PHE A 72 -0.100 -19.315 -5.686 1.00 0.00 C ATOM 1131 CE1 PHE A 72 -2.631 -18.881 -4.677 1.00 0.00 C ATOM 1132 CE2 PHE A 72 -1.108 -18.872 -6.522 1.00 0.00 C ATOM 1133 CZ PHE A 72 -2.376 -18.655 -6.016 1.00 0.00 C ATOM 0 H PHE A 72 2.775 -18.867 -4.413 1.00 0.00 H new ATOM 0 HA PHE A 72 0.798 -18.161 -2.413 1.00 0.00 H new ATOM 0 HB2 PHE A 72 1.445 -20.638 -4.011 1.00 0.00 H new ATOM 0 HB3 PHE A 72 0.311 -20.685 -2.676 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -1.826 -19.503 -2.803 1.00 0.00 H new ATOM 0 HD2 PHE A 72 0.889 -19.484 -6.085 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -3.620 -18.710 -4.279 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -0.905 -18.696 -7.568 1.00 0.00 H new ATOM 0 HZ PHE A 72 -3.166 -18.309 -6.666 1.00 0.00 H new ATOM 1143 N SER A 73 2.824 -18.546 -0.745 1.00 0.00 N ATOM 1144 CA SER A 73 3.536 -18.892 0.470 1.00 0.00 C ATOM 1145 C SER A 73 3.287 -17.816 1.513 1.00 0.00 C ATOM 1146 O SER A 73 3.993 -16.809 1.564 1.00 0.00 O ATOM 1147 CB SER A 73 5.033 -19.038 0.188 1.00 0.00 C ATOM 1148 OG SER A 73 5.262 -19.979 -0.851 1.00 0.00 O ATOM 0 H SER A 73 2.800 -17.545 -0.941 1.00 0.00 H new ATOM 0 HA SER A 73 3.173 -19.848 0.847 1.00 0.00 H new ATOM 0 HB2 SER A 73 5.451 -18.071 -0.093 1.00 0.00 H new ATOM 0 HB3 SER A 73 5.549 -19.357 1.094 1.00 0.00 H new ATOM 0 HG SER A 73 6.225 -20.056 -1.016 1.00 0.00 H new ATOM 1154 N LYS A 74 2.262 -18.028 2.321 1.00 0.00 N ATOM 1155 CA LYS A 74 1.780 -17.007 3.235 1.00 0.00 C ATOM 1156 C LYS A 74 2.452 -17.126 4.600 1.00 0.00 C ATOM 1157 O LYS A 74 2.441 -18.190 5.223 1.00 0.00 O ATOM 1158 CB LYS A 74 0.256 -17.108 3.370 1.00 0.00 C ATOM 1159 CG LYS A 74 -0.233 -18.491 3.763 1.00 0.00 C ATOM 1160 CD LYS A 74 -1.750 -18.570 3.760 1.00 0.00 C ATOM 1161 CE LYS A 74 -2.230 -19.981 4.050 1.00 0.00 C ATOM 1162 NZ LYS A 74 -3.712 -20.088 3.997 1.00 0.00 N ATOM 0 H LYS A 74 1.744 -18.906 2.362 1.00 0.00 H new ATOM 0 HA LYS A 74 2.036 -16.029 2.827 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -0.082 -16.388 4.115 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -0.203 -16.826 2.422 1.00 0.00 H new ATOM 0 HG2 LYS A 74 0.172 -19.230 3.072 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.143 -18.742 4.755 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -2.153 -17.886 4.507 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -2.131 -18.246 2.792 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -1.791 -20.669 3.327 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -1.880 -20.288 5.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -3.997 -21.067 4.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -4.132 -19.451 4.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -4.046 -19.821 3.049 1.00 0.00 H new ATOM 1176 N ASP A 75 3.047 -16.032 5.052 1.00 0.00 N ATOM 1177 CA ASP A 75 3.704 -15.997 6.351 1.00 0.00 C ATOM 1178 C ASP A 75 3.573 -14.620 6.983 1.00 0.00 C ATOM 1179 O ASP A 75 3.840 -13.601 6.346 1.00 0.00 O ATOM 1180 CB ASP A 75 5.180 -16.372 6.224 1.00 0.00 C ATOM 1181 CG ASP A 75 5.938 -16.136 7.515 1.00 0.00 C ATOM 1182 OD1 ASP A 75 5.489 -16.613 8.578 1.00 0.00 O ATOM 1183 OD2 ASP A 75 6.971 -15.443 7.478 1.00 0.00 O ATOM 0 H ASP A 75 3.088 -15.153 4.536 1.00 0.00 H new ATOM 0 HA ASP A 75 3.212 -16.727 6.994 1.00 0.00 H new ATOM 0 HB2 ASP A 75 5.265 -17.421 5.940 1.00 0.00 H new ATOM 0 HB3 ASP A 75 5.635 -15.788 5.424 1.00 0.00 H new ATOM 1188 N ARG A 76 3.155 -14.604 8.241 1.00 0.00 N ATOM 1189 CA ARG A 76 3.003 -13.360 8.980 1.00 0.00 C ATOM 1190 C ARG A 76 4.345 -12.853 9.487 1.00 0.00 C ATOM 1191 O ARG A 76 4.543 -11.647 9.631 1.00 0.00 O ATOM 1192 CB ARG A 76 2.057 -13.544 10.167 1.00 0.00 C ATOM 1193 CG ARG A 76 0.589 -13.595 9.791 1.00 0.00 C ATOM 1194 CD ARG A 76 -0.290 -13.680 11.027 1.00 0.00 C ATOM 1195 NE ARG A 76 -1.707 -13.551 10.702 1.00 0.00 N ATOM 1196 CZ ARG A 76 -2.698 -13.834 11.545 1.00 0.00 C ATOM 1197 NH1 ARG A 76 -2.431 -14.258 12.774 1.00 0.00 N ATOM 1198 NH2 ARG A 76 -3.958 -13.689 11.161 1.00 0.00 N ATOM 0 H ARG A 76 2.915 -15.441 8.772 1.00 0.00 H new ATOM 0 HA ARG A 76 2.583 -12.626 8.292 1.00 0.00 H new ATOM 0 HB2 ARG A 76 2.319 -14.466 10.687 1.00 0.00 H new ATOM 0 HB3 ARG A 76 2.212 -12.726 10.871 1.00 0.00 H new ATOM 0 HG2 ARG A 76 0.327 -12.707 9.215 1.00 0.00 H new ATOM 0 HG3 ARG A 76 0.404 -14.457 9.150 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -0.119 -14.632 11.529 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -0.006 -12.895 11.728 1.00 0.00 H new ATOM 0 HE ARG A 76 -1.954 -13.223 9.768 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -1.463 -14.368 13.076 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -3.194 -14.473 13.416 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -4.169 -13.360 10.219 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -4.716 -13.906 11.808 1.00 0.00 H new ATOM 1212 N HIS A 77 5.273 -13.772 9.734 1.00 0.00 N ATOM 1213 CA HIS A 77 6.549 -13.418 10.347 1.00 0.00 C ATOM 1214 C HIS A 77 7.402 -12.580 9.404 1.00 0.00 C ATOM 1215 O HIS A 77 8.100 -11.670 9.842 1.00 0.00 O ATOM 1216 CB HIS A 77 7.311 -14.668 10.794 1.00 0.00 C ATOM 1217 CG HIS A 77 6.720 -15.333 12.002 1.00 0.00 C ATOM 1218 ND1 HIS A 77 7.229 -15.174 13.276 1.00 0.00 N ATOM 1219 CD2 HIS A 77 5.654 -16.161 12.128 1.00 0.00 C ATOM 1220 CE1 HIS A 77 6.503 -15.874 14.126 1.00 0.00 C ATOM 1221 NE2 HIS A 77 5.544 -16.480 13.457 1.00 0.00 N ATOM 0 H HIS A 77 5.167 -14.764 9.520 1.00 0.00 H new ATOM 0 HA HIS A 77 6.332 -12.817 11.230 1.00 0.00 H new ATOM 0 HB2 HIS A 77 7.334 -15.383 9.971 1.00 0.00 H new ATOM 0 HB3 HIS A 77 8.344 -14.396 11.009 1.00 0.00 H new ATOM 0 HD2 HIS A 77 5.012 -16.505 11.331 1.00 0.00 H new ATOM 0 HE1 HIS A 77 6.667 -15.939 15.191 1.00 0.00 H new ATOM 0 HE2 HIS A 77 4.833 -17.089 13.863 1.00 0.00 H new ATOM 1230 N LEU A 78 7.348 -12.889 8.116 1.00 0.00 N ATOM 1231 CA LEU A 78 8.047 -12.090 7.117 1.00 0.00 C ATOM 1232 C LEU A 78 7.500 -10.667 7.105 1.00 0.00 C ATOM 1233 O LEU A 78 8.264 -9.703 7.161 1.00 0.00 O ATOM 1234 CB LEU A 78 7.927 -12.721 5.724 1.00 0.00 C ATOM 1235 CG LEU A 78 8.661 -11.976 4.603 1.00 0.00 C ATOM 1236 CD1 LEU A 78 10.135 -11.808 4.941 1.00 0.00 C ATOM 1237 CD2 LEU A 78 8.506 -12.719 3.286 1.00 0.00 C ATOM 0 H LEU A 78 6.830 -13.683 7.739 1.00 0.00 H new ATOM 0 HA LEU A 78 9.104 -12.060 7.383 1.00 0.00 H new ATOM 0 HB2 LEU A 78 8.309 -13.741 5.771 1.00 0.00 H new ATOM 0 HB3 LEU A 78 6.871 -12.788 5.463 1.00 0.00 H new ATOM 0 HG LEU A 78 8.216 -10.986 4.503 1.00 0.00 H new ATOM 0 HD11 LEU A 78 10.636 -11.277 4.131 1.00 0.00 H new ATOM 0 HD12 LEU A 78 10.234 -11.238 5.865 1.00 0.00 H new ATOM 0 HD13 LEU A 78 10.593 -12.789 5.069 1.00 0.00 H new ATOM 0 HD21 LEU A 78 9.032 -12.178 2.499 1.00 0.00 H new ATOM 0 HD22 LEU A 78 8.926 -13.720 3.382 1.00 0.00 H new ATOM 0 HD23 LEU A 78 7.449 -12.792 3.032 1.00 0.00 H new ATOM 1249 N ILE A 79 6.177 -10.542 7.055 1.00 0.00 N ATOM 1250 CA ILE A 79 5.520 -9.236 7.099 1.00 0.00 C ATOM 1251 C ILE A 79 5.915 -8.490 8.373 1.00 0.00 C ATOM 1252 O ILE A 79 6.292 -7.315 8.338 1.00 0.00 O ATOM 1253 CB ILE A 79 3.984 -9.389 7.057 1.00 0.00 C ATOM 1254 CG1 ILE A 79 3.561 -10.161 5.805 1.00 0.00 C ATOM 1255 CG2 ILE A 79 3.310 -8.024 7.104 1.00 0.00 C ATOM 1256 CD1 ILE A 79 2.084 -10.488 5.764 1.00 0.00 C ATOM 0 H ILE A 79 5.535 -11.332 6.984 1.00 0.00 H new ATOM 0 HA ILE A 79 5.843 -8.669 6.226 1.00 0.00 H new ATOM 0 HB ILE A 79 3.666 -9.955 7.933 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.819 -9.575 4.923 1.00 0.00 H new ATOM 0 HG13 ILE A 79 4.131 -11.088 5.750 1.00 0.00 H new ATOM 0 HG21 ILE A 79 2.228 -8.151 7.073 1.00 0.00 H new ATOM 0 HG22 ILE A 79 3.589 -7.512 8.025 1.00 0.00 H new ATOM 0 HG23 ILE A 79 3.630 -7.431 6.247 1.00 0.00 H new ATOM 0 HD11 ILE A 79 1.858 -11.035 4.849 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.823 -11.101 6.627 1.00 0.00 H new ATOM 0 HD13 ILE A 79 1.506 -9.564 5.787 1.00 0.00 H new ATOM 1268 N GLU A 80 5.833 -9.203 9.488 1.00 0.00 N ATOM 1269 CA GLU A 80 6.203 -8.681 10.793 1.00 0.00 C ATOM 1270 C GLU A 80 7.645 -8.174 10.790 1.00 0.00 C ATOM 1271 O GLU A 80 7.910 -7.016 11.119 1.00 0.00 O ATOM 1272 CB GLU A 80 6.034 -9.792 11.828 1.00 0.00 C ATOM 1273 CG GLU A 80 6.330 -9.382 13.255 1.00 0.00 C ATOM 1274 CD GLU A 80 6.233 -10.553 14.208 1.00 0.00 C ATOM 1275 OE1 GLU A 80 5.106 -11.029 14.460 1.00 0.00 O ATOM 1276 OE2 GLU A 80 7.282 -11.016 14.698 1.00 0.00 O ATOM 0 H GLU A 80 5.505 -10.168 9.510 1.00 0.00 H new ATOM 0 HA GLU A 80 5.558 -7.839 11.041 1.00 0.00 H new ATOM 0 HB2 GLU A 80 5.011 -10.164 11.777 1.00 0.00 H new ATOM 0 HB3 GLU A 80 6.689 -10.621 11.560 1.00 0.00 H new ATOM 0 HG2 GLU A 80 7.330 -8.951 13.309 1.00 0.00 H new ATOM 0 HG3 GLU A 80 5.631 -8.604 13.562 1.00 0.00 H new ATOM 1283 N THR A 81 8.564 -9.043 10.393 1.00 0.00 N ATOM 1284 CA THR A 81 9.981 -8.712 10.376 1.00 0.00 C ATOM 1285 C THR A 81 10.271 -7.540 9.440 1.00 0.00 C ATOM 1286 O THR A 81 11.078 -6.668 9.757 1.00 0.00 O ATOM 1287 CB THR A 81 10.827 -9.930 9.954 1.00 0.00 C ATOM 1288 OG1 THR A 81 10.499 -11.054 10.780 1.00 0.00 O ATOM 1289 CG2 THR A 81 12.318 -9.634 10.068 1.00 0.00 C ATOM 0 H THR A 81 8.351 -9.989 10.076 1.00 0.00 H new ATOM 0 HA THR A 81 10.254 -8.422 11.391 1.00 0.00 H new ATOM 0 HB THR A 81 10.601 -10.155 8.912 1.00 0.00 H new ATOM 0 HG1 THR A 81 9.665 -11.460 10.464 1.00 0.00 H new ATOM 0 HG21 THR A 81 12.888 -10.512 9.764 1.00 0.00 H new ATOM 0 HG22 THR A 81 12.573 -8.794 9.422 1.00 0.00 H new ATOM 0 HG23 THR A 81 12.561 -9.384 11.101 1.00 0.00 H new ATOM 1297 N THR A 82 9.600 -7.512 8.295 1.00 0.00 N ATOM 1298 CA THR A 82 9.812 -6.451 7.321 1.00 0.00 C ATOM 1299 C THR A 82 9.310 -5.111 7.856 1.00 0.00 C ATOM 1300 O THR A 82 9.900 -4.066 7.587 1.00 0.00 O ATOM 1301 CB THR A 82 9.123 -6.774 5.984 1.00 0.00 C ATOM 1302 OG1 THR A 82 9.514 -8.086 5.556 1.00 0.00 O ATOM 1303 CG2 THR A 82 9.508 -5.761 4.915 1.00 0.00 C ATOM 0 H THR A 82 8.908 -8.209 8.020 1.00 0.00 H new ATOM 0 HA THR A 82 10.885 -6.379 7.146 1.00 0.00 H new ATOM 0 HB THR A 82 8.044 -6.730 6.130 1.00 0.00 H new ATOM 0 HG1 THR A 82 8.865 -8.744 5.883 1.00 0.00 H new ATOM 0 HG21 THR A 82 9.008 -6.011 3.979 1.00 0.00 H new ATOM 0 HG22 THR A 82 9.205 -4.763 5.233 1.00 0.00 H new ATOM 0 HG23 THR A 82 10.588 -5.782 4.766 1.00 0.00 H new ATOM 1311 N SER A 83 8.235 -5.146 8.635 1.00 0.00 N ATOM 1312 CA SER A 83 7.715 -3.940 9.259 1.00 0.00 C ATOM 1313 C SER A 83 8.703 -3.422 10.304 1.00 0.00 C ATOM 1314 O SER A 83 8.926 -2.216 10.425 1.00 0.00 O ATOM 1315 CB SER A 83 6.352 -4.218 9.892 1.00 0.00 C ATOM 1316 OG SER A 83 5.430 -4.688 8.920 1.00 0.00 O ATOM 0 H SER A 83 7.710 -5.994 8.848 1.00 0.00 H new ATOM 0 HA SER A 83 7.587 -3.172 8.496 1.00 0.00 H new ATOM 0 HB2 SER A 83 6.459 -4.957 10.686 1.00 0.00 H new ATOM 0 HB3 SER A 83 5.968 -3.308 10.354 1.00 0.00 H new ATOM 0 HG SER A 83 5.665 -5.604 8.662 1.00 0.00 H new ATOM 1322 N ASN A 84 9.308 -4.348 11.041 1.00 0.00 N ATOM 1323 CA ASN A 84 10.337 -3.999 12.012 1.00 0.00 C ATOM 1324 C ASN A 84 11.584 -3.486 11.301 1.00 0.00 C ATOM 1325 O ASN A 84 12.247 -2.563 11.775 1.00 0.00 O ATOM 1326 CB ASN A 84 10.688 -5.210 12.882 1.00 0.00 C ATOM 1327 CG ASN A 84 9.550 -5.635 13.789 1.00 0.00 C ATOM 1328 OD1 ASN A 84 8.730 -4.815 14.202 1.00 0.00 O ATOM 1329 ND2 ASN A 84 9.491 -6.917 14.117 1.00 0.00 N ATOM 0 H ASN A 84 9.103 -5.346 10.984 1.00 0.00 H new ATOM 0 HA ASN A 84 9.949 -3.209 12.655 1.00 0.00 H new ATOM 0 HB2 ASN A 84 10.964 -6.045 12.239 1.00 0.00 H new ATOM 0 HB3 ASN A 84 11.561 -4.973 13.490 1.00 0.00 H new ATOM 0 HD21 ASN A 84 8.749 -7.253 14.731 1.00 0.00 H new ATOM 0 HD22 ASN A 84 10.188 -7.568 13.756 1.00 0.00 H new ATOM 1336 N LYS A 85 11.892 -4.094 10.159 1.00 0.00 N ATOM 1337 CA LYS A 85 13.019 -3.681 9.330 1.00 0.00 C ATOM 1338 C LYS A 85 12.806 -2.252 8.835 1.00 0.00 C ATOM 1339 O LYS A 85 13.716 -1.426 8.877 1.00 0.00 O ATOM 1340 CB LYS A 85 13.167 -4.645 8.143 1.00 0.00 C ATOM 1341 CG LYS A 85 14.484 -4.531 7.382 1.00 0.00 C ATOM 1342 CD LYS A 85 14.549 -5.544 6.245 1.00 0.00 C ATOM 1343 CE LYS A 85 15.962 -5.712 5.692 1.00 0.00 C ATOM 1344 NZ LYS A 85 16.466 -4.489 5.011 1.00 0.00 N ATOM 0 H LYS A 85 11.369 -4.885 9.783 1.00 0.00 H new ATOM 0 HA LYS A 85 13.933 -3.709 9.922 1.00 0.00 H new ATOM 0 HB2 LYS A 85 13.063 -5.667 8.509 1.00 0.00 H new ATOM 0 HB3 LYS A 85 12.346 -4.470 7.447 1.00 0.00 H new ATOM 0 HG2 LYS A 85 14.590 -3.523 6.982 1.00 0.00 H new ATOM 0 HG3 LYS A 85 15.318 -4.692 8.065 1.00 0.00 H new ATOM 0 HD2 LYS A 85 14.184 -6.508 6.600 1.00 0.00 H new ATOM 0 HD3 LYS A 85 13.883 -5.227 5.442 1.00 0.00 H new ATOM 0 HE2 LYS A 85 16.637 -5.972 6.507 1.00 0.00 H new ATOM 0 HE3 LYS A 85 15.975 -6.545 4.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 17.360 -4.705 4.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 15.764 -4.165 4.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 16.627 -3.741 5.715 1.00 0.00 H new ATOM 1358 N LEU A 86 11.583 -1.973 8.391 1.00 0.00 N ATOM 1359 CA LEU A 86 11.211 -0.644 7.916 1.00 0.00 C ATOM 1360 C LEU A 86 11.289 0.377 9.048 1.00 0.00 C ATOM 1361 O LEU A 86 11.817 1.471 8.875 1.00 0.00 O ATOM 1362 CB LEU A 86 9.791 -0.671 7.339 1.00 0.00 C ATOM 1363 CG LEU A 86 9.288 0.659 6.767 1.00 0.00 C ATOM 1364 CD1 LEU A 86 10.057 1.037 5.513 1.00 0.00 C ATOM 1365 CD2 LEU A 86 7.800 0.584 6.473 1.00 0.00 C ATOM 0 H LEU A 86 10.827 -2.657 8.351 1.00 0.00 H new ATOM 0 HA LEU A 86 11.912 -0.351 7.135 1.00 0.00 H new ATOM 0 HB2 LEU A 86 9.751 -1.424 6.552 1.00 0.00 H new ATOM 0 HB3 LEU A 86 9.105 -0.993 8.122 1.00 0.00 H new ATOM 0 HG LEU A 86 9.456 1.433 7.516 1.00 0.00 H new ATOM 0 HD11 LEU A 86 9.681 1.984 5.127 1.00 0.00 H new ATOM 0 HD12 LEU A 86 11.116 1.137 5.752 1.00 0.00 H new ATOM 0 HD13 LEU A 86 9.927 0.261 4.759 1.00 0.00 H new ATOM 0 HD21 LEU A 86 7.461 1.537 6.068 1.00 0.00 H new ATOM 0 HD22 LEU A 86 7.612 -0.207 5.747 1.00 0.00 H new ATOM 0 HD23 LEU A 86 7.258 0.368 7.393 1.00 0.00 H new ATOM 1377 N LYS A 87 10.771 0.008 10.207 1.00 0.00 N ATOM 1378 CA LYS A 87 10.736 0.913 11.348 1.00 0.00 C ATOM 1379 C LYS A 87 12.140 1.194 11.882 1.00 0.00 C ATOM 1380 O LYS A 87 12.509 2.347 12.107 1.00 0.00 O ATOM 1381 CB LYS A 87 9.863 0.324 12.459 1.00 0.00 C ATOM 1382 CG LYS A 87 9.674 1.251 13.650 1.00 0.00 C ATOM 1383 CD LYS A 87 8.891 2.502 13.273 1.00 0.00 C ATOM 1384 CE LYS A 87 8.748 3.451 14.454 1.00 0.00 C ATOM 1385 NZ LYS A 87 10.052 4.030 14.873 1.00 0.00 N ATOM 0 H LYS A 87 10.368 -0.912 10.385 1.00 0.00 H new ATOM 0 HA LYS A 87 10.308 1.858 11.013 1.00 0.00 H new ATOM 0 HB2 LYS A 87 8.885 0.075 12.046 1.00 0.00 H new ATOM 0 HB3 LYS A 87 10.310 -0.608 12.804 1.00 0.00 H new ATOM 0 HG2 LYS A 87 9.150 0.720 14.445 1.00 0.00 H new ATOM 0 HG3 LYS A 87 10.648 1.537 14.046 1.00 0.00 H new ATOM 0 HD2 LYS A 87 9.395 3.014 12.453 1.00 0.00 H new ATOM 0 HD3 LYS A 87 7.902 2.218 12.912 1.00 0.00 H new ATOM 0 HE2 LYS A 87 8.063 4.257 14.189 1.00 0.00 H new ATOM 0 HE3 LYS A 87 8.303 2.918 15.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 9.887 4.803 15.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 10.630 3.293 15.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 10.552 4.400 14.039 1.00 0.00 H new ATOM 1399 N SER A 88 12.920 0.141 12.074 1.00 0.00 N ATOM 1400 CA SER A 88 14.221 0.262 12.718 1.00 0.00 C ATOM 1401 C SER A 88 15.295 0.780 11.761 1.00 0.00 C ATOM 1402 O SER A 88 16.058 1.684 12.105 1.00 0.00 O ATOM 1403 CB SER A 88 14.640 -1.093 13.289 1.00 0.00 C ATOM 1404 OG SER A 88 13.639 -1.613 14.151 1.00 0.00 O ATOM 0 H SER A 88 12.675 -0.808 11.793 1.00 0.00 H new ATOM 0 HA SER A 88 14.124 0.992 13.522 1.00 0.00 H new ATOM 0 HB2 SER A 88 14.824 -1.794 12.475 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.577 -0.987 13.836 1.00 0.00 H new ATOM 0 HG SER A 88 12.940 -2.046 13.617 1.00 0.00 H new ATOM 1410 N ARG A 89 15.355 0.220 10.561 1.00 0.00 N ATOM 1411 CA ARG A 89 16.447 0.530 9.643 1.00 0.00 C ATOM 1412 C ARG A 89 16.024 1.544 8.587 1.00 0.00 C ATOM 1413 O ARG A 89 16.858 2.008 7.806 1.00 0.00 O ATOM 1414 CB ARG A 89 16.953 -0.748 8.971 1.00 0.00 C ATOM 1415 CG ARG A 89 17.314 -1.845 9.961 1.00 0.00 C ATOM 1416 CD ARG A 89 18.408 -1.402 10.918 1.00 0.00 C ATOM 1417 NE ARG A 89 18.532 -2.311 12.055 1.00 0.00 N ATOM 1418 CZ ARG A 89 19.550 -2.310 12.912 1.00 0.00 C ATOM 1419 NH1 ARG A 89 20.597 -1.515 12.710 1.00 0.00 N ATOM 1420 NH2 ARG A 89 19.528 -3.117 13.966 1.00 0.00 N ATOM 0 H ARG A 89 14.670 -0.444 10.201 1.00 0.00 H new ATOM 0 HA ARG A 89 17.253 0.974 10.227 1.00 0.00 H new ATOM 0 HB2 ARG A 89 16.187 -1.120 8.290 1.00 0.00 H new ATOM 0 HB3 ARG A 89 17.829 -0.511 8.367 1.00 0.00 H new ATOM 0 HG2 ARG A 89 16.428 -2.129 10.528 1.00 0.00 H new ATOM 0 HG3 ARG A 89 17.643 -2.731 9.418 1.00 0.00 H new ATOM 0 HD2 ARG A 89 19.358 -1.352 10.386 1.00 0.00 H new ATOM 0 HD3 ARG A 89 18.191 -0.396 11.278 1.00 0.00 H new ATOM 0 HE ARG A 89 17.788 -2.993 12.202 1.00 0.00 H new ATOM 0 HH11 ARG A 89 20.622 -0.902 11.895 1.00 0.00 H new ATOM 0 HH12 ARG A 89 21.375 -1.518 13.370 1.00 0.00 H new ATOM 0 HH21 ARG A 89 18.732 -3.736 14.118 1.00 0.00 H new ATOM 0 HH22 ARG A 89 20.307 -3.118 14.624 1.00 0.00 H new ATOM 1434 N GLU A 90 14.726 1.865 8.563 1.00 0.00 N ATOM 1435 CA GLU A 90 14.148 2.833 7.620 1.00 0.00 C ATOM 1436 C GLU A 90 14.063 2.253 6.204 1.00 0.00 C ATOM 1437 O GLU A 90 13.028 2.371 5.546 1.00 0.00 O ATOM 1438 CB GLU A 90 14.941 4.143 7.615 1.00 0.00 C ATOM 1439 CG GLU A 90 14.301 5.236 6.781 1.00 0.00 C ATOM 1440 CD GLU A 90 15.146 6.487 6.728 1.00 0.00 C ATOM 1441 OE1 GLU A 90 15.089 7.291 7.679 1.00 0.00 O ATOM 1442 OE2 GLU A 90 15.880 6.673 5.732 1.00 0.00 O ATOM 0 H GLU A 90 14.041 1.459 9.201 1.00 0.00 H new ATOM 0 HA GLU A 90 13.134 3.048 7.958 1.00 0.00 H new ATOM 0 HB2 GLU A 90 15.050 4.496 8.640 1.00 0.00 H new ATOM 0 HB3 GLU A 90 15.945 3.949 7.237 1.00 0.00 H new ATOM 0 HG2 GLU A 90 14.137 4.868 5.768 1.00 0.00 H new ATOM 0 HG3 GLU A 90 13.322 5.479 7.194 1.00 0.00 H new ATOM 1449 N ILE A 91 15.160 1.625 5.765 1.00 0.00 N ATOM 1450 CA ILE A 91 15.271 0.985 4.450 1.00 0.00 C ATOM 1451 C ILE A 91 14.590 1.796 3.345 1.00 0.00 C ATOM 1452 O ILE A 91 14.820 3.001 3.220 1.00 0.00 O ATOM 1453 CB ILE A 91 14.761 -0.483 4.462 1.00 0.00 C ATOM 1454 CG1 ILE A 91 13.304 -0.589 4.937 1.00 0.00 C ATOM 1455 CG2 ILE A 91 15.659 -1.331 5.346 1.00 0.00 C ATOM 1456 CD1 ILE A 91 12.739 -1.993 4.877 1.00 0.00 C ATOM 0 H ILE A 91 16.010 1.546 6.324 1.00 0.00 H new ATOM 0 HA ILE A 91 16.336 0.958 4.221 1.00 0.00 H new ATOM 0 HB ILE A 91 14.795 -0.851 3.437 1.00 0.00 H new ATOM 0 HG12 ILE A 91 13.239 -0.225 5.963 1.00 0.00 H new ATOM 0 HG13 ILE A 91 12.684 0.068 4.326 1.00 0.00 H new ATOM 0 HG21 ILE A 91 15.298 -2.359 5.352 1.00 0.00 H new ATOM 0 HG22 ILE A 91 16.678 -1.306 4.960 1.00 0.00 H new ATOM 0 HG23 ILE A 91 15.647 -0.937 6.362 1.00 0.00 H new ATOM 0 HD11 ILE A 91 11.707 -1.985 5.228 1.00 0.00 H new ATOM 0 HD12 ILE A 91 12.770 -2.354 3.849 1.00 0.00 H new ATOM 0 HD13 ILE A 91 13.333 -2.652 5.511 1.00 0.00 H new ATOM 1468 N THR A 92 13.777 1.142 2.533 1.00 0.00 N ATOM 1469 CA THR A 92 13.093 1.812 1.445 1.00 0.00 C ATOM 1470 C THR A 92 11.708 1.202 1.235 1.00 0.00 C ATOM 1471 O THR A 92 11.494 0.018 1.520 1.00 0.00 O ATOM 1472 CB THR A 92 13.912 1.713 0.142 1.00 0.00 C ATOM 1473 OG1 THR A 92 15.286 2.019 0.411 1.00 0.00 O ATOM 1474 CG2 THR A 92 13.385 2.673 -0.917 1.00 0.00 C ATOM 0 H THR A 92 13.575 0.145 2.609 1.00 0.00 H new ATOM 0 HA THR A 92 12.983 2.864 1.708 1.00 0.00 H new ATOM 0 HB THR A 92 13.820 0.695 -0.236 1.00 0.00 H new ATOM 0 HG1 THR A 92 15.804 1.954 -0.418 1.00 0.00 H new ATOM 0 HG21 THR A 92 13.983 2.579 -1.823 1.00 0.00 H new ATOM 0 HG22 THR A 92 12.346 2.432 -1.142 1.00 0.00 H new ATOM 0 HG23 THR A 92 13.448 3.696 -0.545 1.00 0.00 H new ATOM 1482 N PHE A 93 10.775 2.018 0.743 1.00 0.00 N ATOM 1483 CA PHE A 93 9.400 1.589 0.502 1.00 0.00 C ATOM 1484 C PHE A 93 9.364 0.384 -0.441 1.00 0.00 C ATOM 1485 O PHE A 93 8.484 -0.478 -0.340 1.00 0.00 O ATOM 1486 CB PHE A 93 8.589 2.754 -0.082 1.00 0.00 C ATOM 1487 CG PHE A 93 7.111 2.494 -0.172 1.00 0.00 C ATOM 1488 CD1 PHE A 93 6.352 2.321 0.976 1.00 0.00 C ATOM 1489 CD2 PHE A 93 6.480 2.438 -1.403 1.00 0.00 C ATOM 1490 CE1 PHE A 93 4.993 2.096 0.896 1.00 0.00 C ATOM 1491 CE2 PHE A 93 5.119 2.211 -1.489 1.00 0.00 C ATOM 1492 CZ PHE A 93 4.375 2.041 -0.338 1.00 0.00 C ATOM 0 H PHE A 93 10.952 2.993 0.501 1.00 0.00 H new ATOM 0 HA PHE A 93 8.956 1.286 1.450 1.00 0.00 H new ATOM 0 HB2 PHE A 93 8.754 3.640 0.532 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.968 2.982 -1.078 1.00 0.00 H new ATOM 0 HD1 PHE A 93 6.830 2.363 1.943 1.00 0.00 H new ATOM 0 HD2 PHE A 93 7.057 2.573 -2.306 1.00 0.00 H new ATOM 0 HE1 PHE A 93 4.413 1.963 1.797 1.00 0.00 H new ATOM 0 HE2 PHE A 93 4.638 2.167 -2.455 1.00 0.00 H new ATOM 0 HZ PHE A 93 3.311 1.865 -0.403 1.00 0.00 H new ATOM 1502 N GLN A 94 10.332 0.327 -1.351 1.00 0.00 N ATOM 1503 CA GLN A 94 10.453 -0.790 -2.278 1.00 0.00 C ATOM 1504 C GLN A 94 10.635 -2.110 -1.531 1.00 0.00 C ATOM 1505 O GLN A 94 9.883 -3.056 -1.764 1.00 0.00 O ATOM 1506 CB GLN A 94 11.620 -0.576 -3.245 1.00 0.00 C ATOM 1507 CG GLN A 94 11.298 0.318 -4.434 1.00 0.00 C ATOM 1508 CD GLN A 94 10.904 1.726 -4.038 1.00 0.00 C ATOM 1509 OE1 GLN A 94 9.726 2.015 -3.830 1.00 0.00 O ATOM 1510 NE2 GLN A 94 11.883 2.611 -3.938 1.00 0.00 N ATOM 0 H GLN A 94 11.047 1.046 -1.465 1.00 0.00 H new ATOM 0 HA GLN A 94 9.527 -0.839 -2.851 1.00 0.00 H new ATOM 0 HB2 GLN A 94 12.456 -0.142 -2.696 1.00 0.00 H new ATOM 0 HB3 GLN A 94 11.951 -1.546 -3.615 1.00 0.00 H new ATOM 0 HG2 GLN A 94 12.166 0.363 -5.091 1.00 0.00 H new ATOM 0 HG3 GLN A 94 10.487 -0.131 -5.008 1.00 0.00 H new ATOM 0 HE21 GLN A 94 12.846 2.329 -4.119 1.00 0.00 H new ATOM 0 HE22 GLN A 94 11.674 3.575 -3.680 1.00 0.00 H new ATOM 1519 N GLU A 95 11.616 -2.158 -0.625 1.00 0.00 N ATOM 1520 CA GLU A 95 11.904 -3.372 0.147 1.00 0.00 C ATOM 1521 C GLU A 95 10.678 -3.856 0.901 1.00 0.00 C ATOM 1522 O GLU A 95 10.383 -5.052 0.916 1.00 0.00 O ATOM 1523 CB GLU A 95 13.033 -3.137 1.152 1.00 0.00 C ATOM 1524 CG GLU A 95 14.426 -3.215 0.557 1.00 0.00 C ATOM 1525 CD GLU A 95 15.500 -3.201 1.624 1.00 0.00 C ATOM 1526 OE1 GLU A 95 15.516 -4.126 2.471 1.00 0.00 O ATOM 1527 OE2 GLU A 95 16.333 -2.274 1.621 1.00 0.00 O ATOM 0 H GLU A 95 12.225 -1.369 -0.407 1.00 0.00 H new ATOM 0 HA GLU A 95 12.209 -4.132 -0.573 1.00 0.00 H new ATOM 0 HB2 GLU A 95 12.900 -2.156 1.607 1.00 0.00 H new ATOM 0 HB3 GLU A 95 12.951 -3.873 1.952 1.00 0.00 H new ATOM 0 HG2 GLU A 95 14.516 -4.125 -0.036 1.00 0.00 H new ATOM 0 HG3 GLU A 95 14.578 -2.376 -0.121 1.00 0.00 H new ATOM 1534 N TYR A 96 9.970 -2.922 1.524 1.00 0.00 N ATOM 1535 CA TYR A 96 8.785 -3.257 2.301 1.00 0.00 C ATOM 1536 C TYR A 96 7.773 -4.002 1.434 1.00 0.00 C ATOM 1537 O TYR A 96 7.192 -5.001 1.855 1.00 0.00 O ATOM 1538 CB TYR A 96 8.163 -1.989 2.894 1.00 0.00 C ATOM 1539 CG TYR A 96 7.053 -2.254 3.889 1.00 0.00 C ATOM 1540 CD1 TYR A 96 7.297 -2.976 5.050 1.00 0.00 C ATOM 1541 CD2 TYR A 96 5.763 -1.790 3.668 1.00 0.00 C ATOM 1542 CE1 TYR A 96 6.290 -3.227 5.962 1.00 0.00 C ATOM 1543 CE2 TYR A 96 4.750 -2.036 4.577 1.00 0.00 C ATOM 1544 CZ TYR A 96 5.018 -2.756 5.720 1.00 0.00 C ATOM 1545 OH TYR A 96 4.011 -3.008 6.625 1.00 0.00 O ATOM 0 H TYR A 96 10.196 -1.928 1.506 1.00 0.00 H new ATOM 0 HA TYR A 96 9.078 -3.912 3.122 1.00 0.00 H new ATOM 0 HB2 TYR A 96 8.945 -1.408 3.384 1.00 0.00 H new ATOM 0 HB3 TYR A 96 7.771 -1.376 2.083 1.00 0.00 H new ATOM 0 HD1 TYR A 96 8.292 -3.348 5.243 1.00 0.00 H new ATOM 0 HD2 TYR A 96 5.547 -1.228 2.772 1.00 0.00 H new ATOM 0 HE1 TYR A 96 6.499 -3.790 6.860 1.00 0.00 H new ATOM 0 HE2 TYR A 96 3.753 -1.665 4.391 1.00 0.00 H new ATOM 0 HH TYR A 96 4.371 -3.516 7.382 1.00 0.00 H new ATOM 1555 N ARG A 97 7.593 -3.538 0.204 1.00 0.00 N ATOM 1556 CA ARG A 97 6.633 -4.155 -0.702 1.00 0.00 C ATOM 1557 C ARG A 97 7.173 -5.457 -1.291 1.00 0.00 C ATOM 1558 O ARG A 97 6.415 -6.400 -1.519 1.00 0.00 O ATOM 1559 CB ARG A 97 6.256 -3.196 -1.830 1.00 0.00 C ATOM 1560 CG ARG A 97 5.649 -1.893 -1.340 1.00 0.00 C ATOM 1561 CD ARG A 97 5.055 -1.091 -2.485 1.00 0.00 C ATOM 1562 NE ARG A 97 6.043 -0.772 -3.517 1.00 0.00 N ATOM 1563 CZ ARG A 97 5.749 -0.690 -4.818 1.00 0.00 C ATOM 1564 NH1 ARG A 97 4.516 -0.922 -5.234 1.00 0.00 N ATOM 1565 NH2 ARG A 97 6.679 -0.364 -5.706 1.00 0.00 N ATOM 0 H ARG A 97 8.096 -2.741 -0.187 1.00 0.00 H new ATOM 0 HA ARG A 97 5.742 -4.386 -0.118 1.00 0.00 H new ATOM 0 HB2 ARG A 97 7.145 -2.974 -2.420 1.00 0.00 H new ATOM 0 HB3 ARG A 97 5.548 -3.690 -2.495 1.00 0.00 H new ATOM 0 HG2 ARG A 97 4.875 -2.106 -0.603 1.00 0.00 H new ATOM 0 HG3 ARG A 97 6.413 -1.300 -0.837 1.00 0.00 H new ATOM 0 HD2 ARG A 97 4.236 -1.654 -2.932 1.00 0.00 H new ATOM 0 HD3 ARG A 97 4.630 -0.166 -2.095 1.00 0.00 H new ATOM 0 HE ARG A 97 7.007 -0.603 -3.228 1.00 0.00 H new ATOM 0 HH11 ARG A 97 3.788 -1.164 -4.562 1.00 0.00 H new ATOM 0 HH12 ARG A 97 4.293 -0.859 -6.227 1.00 0.00 H new ATOM 0 HH21 ARG A 97 7.633 -0.172 -5.399 1.00 0.00 H new ATOM 0 HH22 ARG A 97 6.441 -0.305 -6.696 1.00 0.00 H new ATOM 1579 N ARG A 98 8.481 -5.504 -1.537 1.00 0.00 N ATOM 1580 CA ARG A 98 9.121 -6.702 -2.081 1.00 0.00 C ATOM 1581 C ARG A 98 8.914 -7.888 -1.150 1.00 0.00 C ATOM 1582 O ARG A 98 8.605 -8.997 -1.588 1.00 0.00 O ATOM 1583 CB ARG A 98 10.623 -6.468 -2.289 1.00 0.00 C ATOM 1584 CG ARG A 98 10.947 -5.446 -3.368 1.00 0.00 C ATOM 1585 CD ARG A 98 10.599 -5.959 -4.754 1.00 0.00 C ATOM 1586 NE ARG A 98 10.738 -4.917 -5.772 1.00 0.00 N ATOM 1587 CZ ARG A 98 11.716 -4.879 -6.679 1.00 0.00 C ATOM 1588 NH1 ARG A 98 12.651 -5.818 -6.697 1.00 0.00 N ATOM 1589 NH2 ARG A 98 11.753 -3.897 -7.570 1.00 0.00 N ATOM 0 H ARG A 98 9.119 -4.726 -1.368 1.00 0.00 H new ATOM 0 HA ARG A 98 8.660 -6.920 -3.044 1.00 0.00 H new ATOM 0 HB2 ARG A 98 11.063 -6.139 -1.348 1.00 0.00 H new ATOM 0 HB3 ARG A 98 11.095 -7.416 -2.547 1.00 0.00 H new ATOM 0 HG2 ARG A 98 10.398 -4.525 -3.173 1.00 0.00 H new ATOM 0 HG3 ARG A 98 12.008 -5.199 -3.328 1.00 0.00 H new ATOM 0 HD2 ARG A 98 11.247 -6.799 -5.004 1.00 0.00 H new ATOM 0 HD3 ARG A 98 9.576 -6.334 -4.756 1.00 0.00 H new ATOM 0 HE ARG A 98 10.042 -4.171 -5.789 1.00 0.00 H new ATOM 0 HH11 ARG A 98 12.626 -6.576 -6.015 1.00 0.00 H new ATOM 0 HH12 ARG A 98 13.396 -5.783 -7.393 1.00 0.00 H new ATOM 0 HH21 ARG A 98 11.035 -3.173 -7.561 1.00 0.00 H new ATOM 0 HH22 ARG A 98 12.500 -3.866 -8.264 1.00 0.00 H new ATOM 1603 N ASN A 99 9.074 -7.639 0.139 1.00 0.00 N ATOM 1604 CA ASN A 99 8.921 -8.677 1.145 1.00 0.00 C ATOM 1605 C ASN A 99 7.455 -9.053 1.331 1.00 0.00 C ATOM 1606 O ASN A 99 7.132 -10.213 1.567 1.00 0.00 O ATOM 1607 CB ASN A 99 9.519 -8.220 2.472 1.00 0.00 C ATOM 1608 CG ASN A 99 11.038 -8.195 2.466 1.00 0.00 C ATOM 1609 OD1 ASN A 99 11.673 -8.059 1.418 1.00 0.00 O ATOM 1610 ND2 ASN A 99 11.630 -8.306 3.645 1.00 0.00 N ATOM 0 H ASN A 99 9.311 -6.721 0.515 1.00 0.00 H new ATOM 0 HA ASN A 99 9.456 -9.561 0.799 1.00 0.00 H new ATOM 0 HB2 ASN A 99 9.146 -7.223 2.707 1.00 0.00 H new ATOM 0 HB3 ASN A 99 9.176 -8.884 3.266 1.00 0.00 H new ATOM 0 HD21 ASN A 99 12.648 -8.280 3.709 1.00 0.00 H new ATOM 0 HD22 ASN A 99 11.068 -8.417 4.489 1.00 0.00 H new ATOM 1617 N LEU A 100 6.570 -8.069 1.218 1.00 0.00 N ATOM 1618 CA LEU A 100 5.135 -8.317 1.347 1.00 0.00 C ATOM 1619 C LEU A 100 4.631 -9.240 0.245 1.00 0.00 C ATOM 1620 O LEU A 100 3.919 -10.208 0.513 1.00 0.00 O ATOM 1621 CB LEU A 100 4.361 -6.999 1.331 1.00 0.00 C ATOM 1622 CG LEU A 100 4.478 -6.174 2.613 1.00 0.00 C ATOM 1623 CD1 LEU A 100 3.885 -4.793 2.420 1.00 0.00 C ATOM 1624 CD2 LEU A 100 3.789 -6.881 3.766 1.00 0.00 C ATOM 0 H LEU A 100 6.817 -7.096 1.038 1.00 0.00 H new ATOM 0 HA LEU A 100 4.967 -8.812 2.303 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.714 -6.396 0.494 1.00 0.00 H new ATOM 0 HB3 LEU A 100 3.308 -7.214 1.148 1.00 0.00 H new ATOM 0 HG LEU A 100 5.536 -6.066 2.850 1.00 0.00 H new ATOM 0 HD11 LEU A 100 3.979 -4.224 3.345 1.00 0.00 H new ATOM 0 HD12 LEU A 100 4.417 -4.277 1.621 1.00 0.00 H new ATOM 0 HD13 LEU A 100 2.831 -4.883 2.155 1.00 0.00 H new ATOM 0 HD21 LEU A 100 3.883 -6.279 4.670 1.00 0.00 H new ATOM 0 HD22 LEU A 100 2.734 -7.019 3.530 1.00 0.00 H new ATOM 0 HD23 LEU A 100 4.255 -7.853 3.927 1.00 0.00 H new ATOM 1636 N ALA A 101 5.017 -8.951 -0.994 1.00 0.00 N ATOM 1637 CA ALA A 101 4.646 -9.797 -2.126 1.00 0.00 C ATOM 1638 C ALA A 101 5.265 -11.183 -1.980 1.00 0.00 C ATOM 1639 O ALA A 101 4.693 -12.186 -2.409 1.00 0.00 O ATOM 1640 CB ALA A 101 5.084 -9.154 -3.435 1.00 0.00 C ATOM 0 H ALA A 101 5.585 -8.140 -1.240 1.00 0.00 H new ATOM 0 HA ALA A 101 3.561 -9.903 -2.138 1.00 0.00 H new ATOM 0 HB1 ALA A 101 4.800 -9.796 -4.269 1.00 0.00 H new ATOM 0 HB2 ALA A 101 4.600 -8.184 -3.544 1.00 0.00 H new ATOM 0 HB3 ALA A 101 6.166 -9.021 -3.431 1.00 0.00 H new ATOM 1646 N LYS A 102 6.427 -11.224 -1.343 1.00 0.00 N ATOM 1647 CA LYS A 102 7.139 -12.468 -1.098 1.00 0.00 C ATOM 1648 C LYS A 102 6.417 -13.298 -0.031 1.00 0.00 C ATOM 1649 O LYS A 102 6.592 -14.515 0.053 1.00 0.00 O ATOM 1650 CB LYS A 102 8.568 -12.149 -0.651 1.00 0.00 C ATOM 1651 CG LYS A 102 9.523 -13.328 -0.696 1.00 0.00 C ATOM 1652 CD LYS A 102 9.700 -13.848 -2.113 1.00 0.00 C ATOM 1653 CE LYS A 102 10.862 -14.823 -2.209 1.00 0.00 C ATOM 1654 NZ LYS A 102 10.718 -15.964 -1.267 1.00 0.00 N ATOM 0 H LYS A 102 6.901 -10.396 -0.982 1.00 0.00 H new ATOM 0 HA LYS A 102 7.170 -13.053 -2.017 1.00 0.00 H new ATOM 0 HB2 LYS A 102 8.963 -11.354 -1.283 1.00 0.00 H new ATOM 0 HB3 LYS A 102 8.538 -11.761 0.367 1.00 0.00 H new ATOM 0 HG2 LYS A 102 10.491 -13.029 -0.294 1.00 0.00 H new ATOM 0 HG3 LYS A 102 9.146 -14.128 -0.058 1.00 0.00 H new ATOM 0 HD2 LYS A 102 8.783 -14.340 -2.438 1.00 0.00 H new ATOM 0 HD3 LYS A 102 9.870 -13.011 -2.790 1.00 0.00 H new ATOM 0 HE2 LYS A 102 10.932 -15.203 -3.228 1.00 0.00 H new ATOM 0 HE3 LYS A 102 11.793 -14.297 -2.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 11.447 -16.677 -1.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 10.830 -15.624 -0.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 9.776 -16.390 -1.379 1.00 0.00 H new ATOM 1668 N ALA A 103 5.595 -12.627 0.770 1.00 0.00 N ATOM 1669 CA ALA A 103 4.838 -13.282 1.834 1.00 0.00 C ATOM 1670 C ALA A 103 3.423 -13.625 1.377 1.00 0.00 C ATOM 1671 O ALA A 103 2.626 -14.160 2.148 1.00 0.00 O ATOM 1672 CB ALA A 103 4.791 -12.399 3.071 1.00 0.00 C ATOM 0 H ALA A 103 5.435 -11.622 0.702 1.00 0.00 H new ATOM 0 HA ALA A 103 5.347 -14.213 2.082 1.00 0.00 H new ATOM 0 HB1 ALA A 103 4.224 -12.901 3.855 1.00 0.00 H new ATOM 0 HB2 ALA A 103 5.806 -12.210 3.422 1.00 0.00 H new ATOM 0 HB3 ALA A 103 4.310 -11.452 2.824 1.00 0.00 H new ATOM 1678 N GLY A 104 3.110 -13.303 0.126 1.00 0.00 N ATOM 1679 CA GLY A 104 1.818 -13.659 -0.428 1.00 0.00 C ATOM 1680 C GLY A 104 0.832 -12.507 -0.438 1.00 0.00 C ATOM 1681 O GLY A 104 -0.337 -12.697 -0.772 1.00 0.00 O ATOM 0 H GLY A 104 3.728 -12.802 -0.513 1.00 0.00 H new ATOM 0 HA2 GLY A 104 1.955 -14.020 -1.447 1.00 0.00 H new ATOM 0 HA3 GLY A 104 1.398 -14.483 0.149 1.00 0.00 H new ATOM 1685 N VAL A 105 1.291 -11.315 -0.079 1.00 0.00 N ATOM 1686 CA VAL A 105 0.422 -10.145 -0.059 1.00 0.00 C ATOM 1687 C VAL A 105 0.218 -9.607 -1.471 1.00 0.00 C ATOM 1688 O VAL A 105 1.109 -8.984 -2.050 1.00 0.00 O ATOM 1689 CB VAL A 105 0.979 -9.027 0.848 1.00 0.00 C ATOM 1690 CG1 VAL A 105 0.054 -7.817 0.850 1.00 0.00 C ATOM 1691 CG2 VAL A 105 1.189 -9.544 2.265 1.00 0.00 C ATOM 0 H VAL A 105 2.255 -11.133 0.201 1.00 0.00 H new ATOM 0 HA VAL A 105 -0.536 -10.464 0.351 1.00 0.00 H new ATOM 0 HB VAL A 105 1.944 -8.714 0.448 1.00 0.00 H new ATOM 0 HG11 VAL A 105 0.468 -7.043 1.496 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -0.041 -7.430 -0.165 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -0.928 -8.111 1.220 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.582 -8.742 2.890 1.00 0.00 H new ATOM 0 HG22 VAL A 105 0.238 -9.888 2.671 1.00 0.00 H new ATOM 0 HG23 VAL A 105 1.898 -10.372 2.249 1.00 0.00 H new ATOM 1701 N PHE A 106 -0.958 -9.868 -2.022 1.00 0.00 N ATOM 1702 CA PHE A 106 -1.290 -9.425 -3.366 1.00 0.00 C ATOM 1703 C PHE A 106 -2.232 -8.226 -3.320 1.00 0.00 C ATOM 1704 O PHE A 106 -2.203 -7.361 -4.199 1.00 0.00 O ATOM 1705 CB PHE A 106 -1.928 -10.578 -4.148 1.00 0.00 C ATOM 1706 CG PHE A 106 -2.309 -10.228 -5.559 1.00 0.00 C ATOM 1707 CD1 PHE A 106 -1.343 -10.094 -6.541 1.00 0.00 C ATOM 1708 CD2 PHE A 106 -3.639 -10.036 -5.904 1.00 0.00 C ATOM 1709 CE1 PHE A 106 -1.693 -9.774 -7.839 1.00 0.00 C ATOM 1710 CE2 PHE A 106 -3.994 -9.717 -7.200 1.00 0.00 C ATOM 1711 CZ PHE A 106 -3.019 -9.585 -8.169 1.00 0.00 C ATOM 0 H PHE A 106 -1.701 -10.387 -1.555 1.00 0.00 H new ATOM 0 HA PHE A 106 -0.375 -9.117 -3.871 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -1.232 -11.417 -4.169 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -2.818 -10.915 -3.616 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -0.303 -10.241 -6.290 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -4.406 -10.137 -5.150 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -0.928 -9.672 -8.595 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -5.033 -9.571 -7.455 1.00 0.00 H new ATOM 0 HZ PHE A 106 -3.294 -9.334 -9.183 1.00 0.00 H new ATOM 1721 N ARG A 107 -3.051 -8.171 -2.283 1.00 0.00 N ATOM 1722 CA ARG A 107 -4.029 -7.103 -2.140 1.00 0.00 C ATOM 1723 C ARG A 107 -3.745 -6.261 -0.908 1.00 0.00 C ATOM 1724 O ARG A 107 -4.082 -6.644 0.212 1.00 0.00 O ATOM 1725 CB ARG A 107 -5.448 -7.674 -2.072 1.00 0.00 C ATOM 1726 CG ARG A 107 -5.979 -8.150 -3.412 1.00 0.00 C ATOM 1727 CD ARG A 107 -7.344 -8.814 -3.279 1.00 0.00 C ATOM 1728 NE ARG A 107 -8.312 -7.987 -2.549 1.00 0.00 N ATOM 1729 CZ ARG A 107 -9.105 -7.072 -3.116 1.00 0.00 C ATOM 1730 NH1 ARG A 107 -8.991 -6.782 -4.406 1.00 0.00 N ATOM 1731 NH2 ARG A 107 -10.013 -6.435 -2.386 1.00 0.00 N ATOM 0 H ARG A 107 -3.059 -8.854 -1.526 1.00 0.00 H new ATOM 0 HA ARG A 107 -3.950 -6.462 -3.018 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -5.462 -8.507 -1.369 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -6.118 -6.911 -1.676 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -6.052 -7.304 -4.095 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -5.274 -8.855 -3.852 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -7.735 -9.031 -4.273 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -7.230 -9.769 -2.766 1.00 0.00 H new ATOM 0 HE ARG A 107 -8.385 -8.119 -1.540 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -8.293 -7.259 -4.976 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -9.602 -6.082 -4.827 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -10.106 -6.644 -1.392 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -10.618 -5.737 -2.819 1.00 0.00 H new ATOM 1745 N TRP A 108 -3.106 -5.125 -1.122 1.00 0.00 N ATOM 1746 CA TRP A 108 -2.845 -4.175 -0.055 1.00 0.00 C ATOM 1747 C TRP A 108 -3.992 -3.170 0.003 1.00 0.00 C ATOM 1748 O TRP A 108 -4.009 -2.188 -0.731 1.00 0.00 O ATOM 1749 CB TRP A 108 -1.500 -3.474 -0.306 1.00 0.00 C ATOM 1750 CG TRP A 108 -1.070 -2.500 0.755 1.00 0.00 C ATOM 1751 CD1 TRP A 108 -1.865 -1.809 1.622 1.00 0.00 C ATOM 1752 CD2 TRP A 108 0.274 -2.091 1.040 1.00 0.00 C ATOM 1753 NE1 TRP A 108 -1.104 -1.003 2.424 1.00 0.00 N ATOM 1754 CE2 TRP A 108 0.212 -1.154 2.088 1.00 0.00 C ATOM 1755 CE3 TRP A 108 1.523 -2.426 0.512 1.00 0.00 C ATOM 1756 CZ2 TRP A 108 1.347 -0.550 2.614 1.00 0.00 C ATOM 1757 CZ3 TRP A 108 2.650 -1.825 1.037 1.00 0.00 C ATOM 1758 CH2 TRP A 108 2.556 -0.895 2.079 1.00 0.00 C ATOM 0 H TRP A 108 -2.755 -4.836 -2.035 1.00 0.00 H new ATOM 0 HA TRP A 108 -2.782 -4.689 0.904 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -0.727 -4.236 -0.410 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -1.557 -2.946 -1.258 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -2.941 -1.887 1.669 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -1.461 -0.388 3.155 1.00 0.00 H new ATOM 0 HE3 TRP A 108 1.606 -3.142 -0.292 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 1.276 0.168 3.418 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 3.621 -2.077 0.637 1.00 0.00 H new ATOM 0 HH2 TRP A 108 3.456 -0.442 2.467 1.00 0.00 H new ATOM 1769 N VAL A 109 -4.965 -3.436 0.852 1.00 0.00 N ATOM 1770 CA VAL A 109 -6.122 -2.566 0.962 1.00 0.00 C ATOM 1771 C VAL A 109 -6.027 -1.705 2.215 1.00 0.00 C ATOM 1772 O VAL A 109 -6.297 -2.169 3.319 1.00 0.00 O ATOM 1773 CB VAL A 109 -7.441 -3.371 0.990 1.00 0.00 C ATOM 1774 CG1 VAL A 109 -8.644 -2.439 0.995 1.00 0.00 C ATOM 1775 CG2 VAL A 109 -7.512 -4.331 -0.189 1.00 0.00 C ATOM 0 H VAL A 109 -4.979 -4.244 1.474 1.00 0.00 H new ATOM 0 HA VAL A 109 -6.129 -1.926 0.080 1.00 0.00 H new ATOM 0 HB VAL A 109 -7.460 -3.956 1.909 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -9.561 -3.028 1.015 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -8.605 -1.799 1.877 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -8.629 -1.821 0.097 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -8.449 -4.887 -0.149 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -7.464 -3.767 -1.121 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -6.674 -5.027 -0.142 1.00 0.00 H new ATOM 1785 N THR A 110 -5.618 -0.459 2.053 1.00 0.00 N ATOM 1786 CA THR A 110 -5.566 0.453 3.178 1.00 0.00 C ATOM 1787 C THR A 110 -6.885 1.197 3.299 1.00 0.00 C ATOM 1788 O THR A 110 -7.296 1.916 2.384 1.00 0.00 O ATOM 1789 CB THR A 110 -4.423 1.475 3.057 1.00 0.00 C ATOM 1790 OG1 THR A 110 -3.176 0.805 2.848 1.00 0.00 O ATOM 1791 CG2 THR A 110 -4.326 2.328 4.312 1.00 0.00 C ATOM 0 H THR A 110 -5.320 -0.060 1.163 1.00 0.00 H new ATOM 0 HA THR A 110 -5.381 -0.149 4.068 1.00 0.00 H new ATOM 0 HB THR A 110 -4.639 2.118 2.204 1.00 0.00 H new ATOM 0 HG1 THR A 110 -2.638 1.309 2.202 1.00 0.00 H new ATOM 0 HG21 THR A 110 -3.511 3.043 4.204 1.00 0.00 H new ATOM 0 HG22 THR A 110 -5.263 2.865 4.460 1.00 0.00 H new ATOM 0 HG23 THR A 110 -4.135 1.688 5.173 1.00 0.00 H new ATOM 1799 N ASN A 111 -7.549 1.002 4.420 1.00 0.00 N ATOM 1800 CA ASN A 111 -8.807 1.670 4.684 1.00 0.00 C ATOM 1801 C ASN A 111 -8.563 2.836 5.634 1.00 0.00 C ATOM 1802 O ASN A 111 -8.353 2.641 6.832 1.00 0.00 O ATOM 1803 CB ASN A 111 -9.821 0.673 5.267 1.00 0.00 C ATOM 1804 CG ASN A 111 -11.218 1.250 5.416 1.00 0.00 C ATOM 1805 OD1 ASN A 111 -11.397 2.422 5.726 1.00 0.00 O ATOM 1806 ND2 ASN A 111 -12.225 0.426 5.184 1.00 0.00 N ATOM 0 H ASN A 111 -7.236 0.382 5.167 1.00 0.00 H new ATOM 0 HA ASN A 111 -9.224 2.060 3.756 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -9.866 -0.206 4.624 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -9.469 0.337 6.242 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -13.186 0.760 5.261 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -12.042 -0.544 4.928 1.00 0.00 H new ATOM 1813 N ILE A 112 -8.573 4.042 5.083 1.00 0.00 N ATOM 1814 CA ILE A 112 -8.285 5.249 5.850 1.00 0.00 C ATOM 1815 C ILE A 112 -9.430 5.554 6.808 1.00 0.00 C ATOM 1816 O ILE A 112 -9.212 6.062 7.909 1.00 0.00 O ATOM 1817 CB ILE A 112 -8.051 6.462 4.920 1.00 0.00 C ATOM 1818 CG1 ILE A 112 -6.910 6.171 3.938 1.00 0.00 C ATOM 1819 CG2 ILE A 112 -7.750 7.721 5.725 1.00 0.00 C ATOM 1820 CD1 ILE A 112 -5.582 5.883 4.607 1.00 0.00 C ATOM 0 H ILE A 112 -8.779 4.212 4.099 1.00 0.00 H new ATOM 0 HA ILE A 112 -7.373 5.069 6.420 1.00 0.00 H new ATOM 0 HB ILE A 112 -8.966 6.634 4.354 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -7.186 5.318 3.318 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -6.792 7.025 3.271 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -7.590 8.558 5.045 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -8.591 7.943 6.382 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -6.853 7.564 6.325 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.826 5.687 3.846 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -5.281 6.744 5.204 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -5.682 5.010 5.253 1.00 0.00 H new ATOM 1832 N HIS A 113 -10.642 5.211 6.389 1.00 0.00 N ATOM 1833 CA HIS A 113 -11.830 5.399 7.216 1.00 0.00 C ATOM 1834 C HIS A 113 -11.718 4.570 8.485 1.00 0.00 C ATOM 1835 O HIS A 113 -12.199 4.960 9.548 1.00 0.00 O ATOM 1836 CB HIS A 113 -13.084 4.975 6.451 1.00 0.00 C ATOM 1837 CG HIS A 113 -14.362 5.394 7.110 1.00 0.00 C ATOM 1838 ND1 HIS A 113 -15.235 4.504 7.695 1.00 0.00 N ATOM 1839 CD2 HIS A 113 -14.918 6.619 7.264 1.00 0.00 C ATOM 1840 CE1 HIS A 113 -16.270 5.163 8.183 1.00 0.00 C ATOM 1841 NE2 HIS A 113 -16.102 6.449 7.937 1.00 0.00 N ATOM 0 H HIS A 113 -10.830 4.798 5.475 1.00 0.00 H new ATOM 0 HA HIS A 113 -11.905 6.455 7.474 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -13.047 5.399 5.447 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -13.082 3.891 6.340 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -14.506 7.556 6.921 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -17.112 4.724 8.697 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -16.746 7.194 8.203 1.00 0.00 H new ATOM 1850 N GLU A 114 -11.084 3.415 8.356 1.00 0.00 N ATOM 1851 CA GLU A 114 -10.923 2.501 9.469 1.00 0.00 C ATOM 1852 C GLU A 114 -9.579 2.718 10.151 1.00 0.00 C ATOM 1853 O GLU A 114 -9.359 2.246 11.268 1.00 0.00 O ATOM 1854 CB GLU A 114 -11.037 1.067 8.970 1.00 0.00 C ATOM 1855 CG GLU A 114 -11.741 0.151 9.945 1.00 0.00 C ATOM 1856 CD GLU A 114 -13.139 0.626 10.262 1.00 0.00 C ATOM 1857 OE1 GLU A 114 -14.072 0.271 9.515 1.00 0.00 O ATOM 1858 OE2 GLU A 114 -13.312 1.364 11.255 1.00 0.00 O ATOM 0 H GLU A 114 -10.670 3.089 7.482 1.00 0.00 H new ATOM 0 HA GLU A 114 -11.709 2.691 10.200 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -11.575 1.061 8.022 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -10.038 0.678 8.772 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -11.786 -0.855 9.529 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -11.162 0.089 10.866 1.00 0.00 H new ATOM 1865 N GLN A 115 -8.694 3.436 9.458 1.00 0.00 N ATOM 1866 CA GLN A 115 -7.356 3.752 9.956 1.00 0.00 C ATOM 1867 C GLN A 115 -6.494 2.486 10.021 1.00 0.00 C ATOM 1868 O GLN A 115 -5.599 2.368 10.855 1.00 0.00 O ATOM 1869 CB GLN A 115 -7.441 4.419 11.341 1.00 0.00 C ATOM 1870 CG GLN A 115 -6.296 5.377 11.644 1.00 0.00 C ATOM 1871 CD GLN A 115 -6.482 6.752 11.017 1.00 0.00 C ATOM 1872 OE1 GLN A 115 -7.207 6.819 9.912 1.00 0.00 O flip ATOM 1873 NE2 GLN A 115 -5.995 7.755 11.536 1.00 0.00 N flip ATOM 0 H GLN A 115 -8.887 3.816 8.531 1.00 0.00 H new ATOM 0 HA GLN A 115 -6.887 4.452 9.264 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -8.383 4.962 11.413 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -7.462 3.642 12.105 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -6.200 5.487 12.724 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -5.363 4.944 11.283 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -5.441 7.670 12.388 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -6.145 8.672 11.114 1.00 0.00 H new ATOM 1882 N LYS A 116 -6.742 1.551 9.105 1.00 0.00 N ATOM 1883 CA LYS A 116 -6.040 0.269 9.120 1.00 0.00 C ATOM 1884 C LYS A 116 -5.589 -0.146 7.724 1.00 0.00 C ATOM 1885 O LYS A 116 -6.240 0.162 6.727 1.00 0.00 O ATOM 1886 CB LYS A 116 -6.938 -0.838 9.687 1.00 0.00 C ATOM 1887 CG LYS A 116 -7.457 -0.562 11.086 1.00 0.00 C ATOM 1888 CD LYS A 116 -8.359 -1.685 11.566 1.00 0.00 C ATOM 1889 CE LYS A 116 -9.023 -1.336 12.885 1.00 0.00 C ATOM 1890 NZ LYS A 116 -9.921 -2.422 13.355 1.00 0.00 N ATOM 0 H LYS A 116 -7.418 1.656 8.349 1.00 0.00 H new ATOM 0 HA LYS A 116 -5.163 0.402 9.754 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -7.787 -0.980 9.018 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -6.380 -1.774 9.697 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -6.618 -0.447 11.772 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -8.007 0.379 11.094 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -9.122 -1.887 10.815 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -7.776 -2.598 11.681 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -8.258 -1.146 13.638 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -9.595 -0.415 12.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -10.356 -2.146 14.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -10.666 -2.587 12.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -9.371 -3.294 13.488 1.00 0.00 H new ATOM 1904 N ARG A 117 -4.464 -0.841 7.670 1.00 0.00 N ATOM 1905 CA ARG A 117 -4.014 -1.489 6.448 1.00 0.00 C ATOM 1906 C ARG A 117 -4.464 -2.940 6.468 1.00 0.00 C ATOM 1907 O ARG A 117 -4.327 -3.613 7.492 1.00 0.00 O ATOM 1908 CB ARG A 117 -2.489 -1.474 6.329 1.00 0.00 C ATOM 1909 CG ARG A 117 -1.847 -0.100 6.310 1.00 0.00 C ATOM 1910 CD ARG A 117 -0.345 -0.241 6.141 1.00 0.00 C ATOM 1911 NE ARG A 117 0.367 1.036 6.172 1.00 0.00 N ATOM 1912 CZ ARG A 117 1.680 1.144 5.965 1.00 0.00 C ATOM 1913 NH1 ARG A 117 2.397 0.056 5.690 1.00 0.00 N ATOM 1914 NH2 ARG A 117 2.279 2.329 6.030 1.00 0.00 N ATOM 0 H ARG A 117 -3.840 -0.972 8.467 1.00 0.00 H new ATOM 0 HA ARG A 117 -4.440 -0.945 5.605 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -2.072 -2.039 7.163 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -2.208 -1.999 5.416 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -2.260 0.494 5.495 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -2.071 0.430 7.236 1.00 0.00 H new ATOM 0 HD2 ARG A 117 0.043 -0.884 6.931 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -0.139 -0.740 5.194 1.00 0.00 H new ATOM 0 HE ARG A 117 -0.166 1.885 6.361 1.00 0.00 H new ATOM 0 HH11 ARG A 117 1.942 -0.855 5.638 1.00 0.00 H new ATOM 0 HH12 ARG A 117 3.402 0.134 5.531 1.00 0.00 H new ATOM 0 HH21 ARG A 117 1.734 3.165 6.240 1.00 0.00 H new ATOM 0 HH22 ARG A 117 3.284 2.402 5.870 1.00 0.00 H new ATOM 1928 N TYR A 118 -4.992 -3.422 5.362 1.00 0.00 N ATOM 1929 CA TYR A 118 -5.373 -4.819 5.257 1.00 0.00 C ATOM 1930 C TYR A 118 -4.544 -5.514 4.185 1.00 0.00 C ATOM 1931 O TYR A 118 -4.687 -5.232 2.995 1.00 0.00 O ATOM 1932 CB TYR A 118 -6.863 -4.953 4.933 1.00 0.00 C ATOM 1933 CG TYR A 118 -7.783 -4.388 5.992 1.00 0.00 C ATOM 1934 CD1 TYR A 118 -8.086 -5.115 7.137 1.00 0.00 C ATOM 1935 CD2 TYR A 118 -8.353 -3.129 5.845 1.00 0.00 C ATOM 1936 CE1 TYR A 118 -8.930 -4.604 8.103 1.00 0.00 C ATOM 1937 CE2 TYR A 118 -9.199 -2.613 6.806 1.00 0.00 C ATOM 1938 CZ TYR A 118 -9.484 -3.353 7.932 1.00 0.00 C ATOM 1939 OH TYR A 118 -10.333 -2.842 8.885 1.00 0.00 O ATOM 0 H TYR A 118 -5.168 -2.869 4.523 1.00 0.00 H new ATOM 0 HA TYR A 118 -5.183 -5.296 6.218 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -7.064 -4.449 3.987 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -7.098 -6.008 4.789 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -7.654 -6.096 7.273 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -8.130 -2.545 4.964 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -9.155 -5.181 8.988 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -9.635 -1.634 6.675 1.00 0.00 H new ATOM 0 HH TYR A 118 -10.436 -3.490 9.613 1.00 0.00 H new ATOM 1949 N TYR A 119 -3.667 -6.411 4.611 1.00 0.00 N ATOM 1950 CA TYR A 119 -2.834 -7.165 3.688 1.00 0.00 C ATOM 1951 C TYR A 119 -3.500 -8.495 3.362 1.00 0.00 C ATOM 1952 O TYR A 119 -3.543 -9.402 4.199 1.00 0.00 O ATOM 1953 CB TYR A 119 -1.440 -7.414 4.279 1.00 0.00 C ATOM 1954 CG TYR A 119 -0.669 -6.155 4.614 1.00 0.00 C ATOM 1955 CD1 TYR A 119 -0.260 -5.280 3.618 1.00 0.00 C ATOM 1956 CD2 TYR A 119 -0.335 -5.856 5.928 1.00 0.00 C ATOM 1957 CE1 TYR A 119 0.462 -4.141 3.922 1.00 0.00 C ATOM 1958 CE2 TYR A 119 0.383 -4.716 6.242 1.00 0.00 C ATOM 1959 CZ TYR A 119 0.779 -3.863 5.235 1.00 0.00 C ATOM 1960 OH TYR A 119 1.505 -2.733 5.543 1.00 0.00 O ATOM 0 H TYR A 119 -3.514 -6.635 5.594 1.00 0.00 H new ATOM 0 HA TYR A 119 -2.719 -6.580 2.776 1.00 0.00 H new ATOM 0 HB2 TYR A 119 -1.544 -8.013 5.183 1.00 0.00 H new ATOM 0 HB3 TYR A 119 -0.858 -8.004 3.571 1.00 0.00 H new ATOM 0 HD1 TYR A 119 -0.510 -5.492 2.589 1.00 0.00 H new ATOM 0 HD2 TYR A 119 -0.641 -6.525 6.719 1.00 0.00 H new ATOM 0 HE1 TYR A 119 0.776 -3.472 3.135 1.00 0.00 H new ATOM 0 HE2 TYR A 119 0.632 -4.496 7.270 1.00 0.00 H new ATOM 0 HH TYR A 119 2.372 -2.993 5.919 1.00 0.00 H new ATOM 1970 N TYR A 120 -4.039 -8.597 2.159 1.00 0.00 N ATOM 1971 CA TYR A 120 -4.722 -9.807 1.731 1.00 0.00 C ATOM 1972 C TYR A 120 -3.838 -10.646 0.820 1.00 0.00 C ATOM 1973 O TYR A 120 -3.142 -10.120 -0.055 1.00 0.00 O ATOM 1974 CB TYR A 120 -6.022 -9.473 0.997 1.00 0.00 C ATOM 1975 CG TYR A 120 -7.077 -8.812 1.854 1.00 0.00 C ATOM 1976 CD1 TYR A 120 -7.942 -9.567 2.638 1.00 0.00 C ATOM 1977 CD2 TYR A 120 -7.220 -7.433 1.866 1.00 0.00 C ATOM 1978 CE1 TYR A 120 -8.914 -8.964 3.410 1.00 0.00 C ATOM 1979 CE2 TYR A 120 -8.192 -6.825 2.632 1.00 0.00 C ATOM 1980 CZ TYR A 120 -9.036 -7.592 3.403 1.00 0.00 C ATOM 1981 OH TYR A 120 -10.008 -6.985 4.164 1.00 0.00 O ATOM 0 H TYR A 120 -4.017 -7.855 1.460 1.00 0.00 H new ATOM 0 HA TYR A 120 -4.952 -10.379 2.630 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -5.792 -8.817 0.157 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -6.435 -10.392 0.580 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -7.852 -10.643 2.643 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -6.559 -6.825 1.266 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -9.576 -9.565 4.017 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -8.291 -5.750 2.627 1.00 0.00 H new ATOM 0 HH TYR A 120 -9.957 -6.013 4.046 1.00 0.00 H new ATOM 1991 N THR A 121 -3.876 -11.949 1.035 1.00 0.00 N ATOM 1992 CA THR A 121 -3.205 -12.901 0.164 1.00 0.00 C ATOM 1993 C THR A 121 -3.915 -12.965 -1.194 1.00 0.00 C ATOM 1994 O THR A 121 -4.982 -12.373 -1.372 1.00 0.00 O ATOM 1995 CB THR A 121 -3.156 -14.298 0.832 1.00 0.00 C ATOM 1996 OG1 THR A 121 -2.760 -15.317 -0.097 1.00 0.00 O ATOM 1997 CG2 THR A 121 -4.501 -14.654 1.440 1.00 0.00 C ATOM 0 H THR A 121 -4.372 -12.378 1.817 1.00 0.00 H new ATOM 0 HA THR A 121 -2.180 -12.569 -0.002 1.00 0.00 H new ATOM 0 HB THR A 121 -2.408 -14.248 1.623 1.00 0.00 H new ATOM 0 HG1 THR A 121 -3.529 -15.888 -0.304 1.00 0.00 H new ATOM 0 HG21 THR A 121 -4.442 -15.639 1.903 1.00 0.00 H new ATOM 0 HG22 THR A 121 -4.767 -13.914 2.195 1.00 0.00 H new ATOM 0 HG23 THR A 121 -5.262 -14.665 0.659 1.00 0.00 H new ATOM 2005 N PHE A 122 -3.318 -13.676 -2.147 1.00 0.00 N ATOM 2006 CA PHE A 122 -3.857 -13.770 -3.505 1.00 0.00 C ATOM 2007 C PHE A 122 -5.260 -14.375 -3.500 1.00 0.00 C ATOM 2008 O PHE A 122 -6.116 -13.987 -4.293 1.00 0.00 O ATOM 2009 CB PHE A 122 -2.924 -14.605 -4.391 1.00 0.00 C ATOM 2010 CG PHE A 122 -3.323 -14.626 -5.843 1.00 0.00 C ATOM 2011 CD1 PHE A 122 -2.916 -13.617 -6.698 1.00 0.00 C ATOM 2012 CD2 PHE A 122 -4.101 -15.654 -6.347 1.00 0.00 C ATOM 2013 CE1 PHE A 122 -3.278 -13.632 -8.032 1.00 0.00 C ATOM 2014 CE2 PHE A 122 -4.468 -15.676 -7.678 1.00 0.00 C ATOM 2015 CZ PHE A 122 -4.056 -14.664 -8.522 1.00 0.00 C ATOM 0 H PHE A 122 -2.454 -14.200 -2.004 1.00 0.00 H new ATOM 0 HA PHE A 122 -3.924 -12.761 -3.912 1.00 0.00 H new ATOM 0 HB2 PHE A 122 -1.911 -14.212 -4.308 1.00 0.00 H new ATOM 0 HB3 PHE A 122 -2.901 -15.628 -4.015 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -2.309 -12.809 -6.319 1.00 0.00 H new ATOM 0 HD2 PHE A 122 -4.425 -16.449 -5.691 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -2.954 -12.839 -8.690 1.00 0.00 H new ATOM 0 HE2 PHE A 122 -5.076 -16.483 -8.058 1.00 0.00 H new ATOM 0 HZ PHE A 122 -4.341 -14.679 -9.564 1.00 0.00 H new ATOM 2025 N ASP A 123 -5.494 -15.314 -2.587 1.00 0.00 N ATOM 2026 CA ASP A 123 -6.798 -15.967 -2.464 1.00 0.00 C ATOM 2027 C ASP A 123 -7.763 -15.114 -1.640 1.00 0.00 C ATOM 2028 O ASP A 123 -8.848 -15.566 -1.273 1.00 0.00 O ATOM 2029 CB ASP A 123 -6.646 -17.357 -1.830 1.00 0.00 C ATOM 2030 CG ASP A 123 -6.016 -17.311 -0.452 1.00 0.00 C ATOM 2031 OD1 ASP A 123 -4.797 -17.054 -0.362 1.00 0.00 O ATOM 2032 OD2 ASP A 123 -6.735 -17.539 0.550 1.00 0.00 O ATOM 0 H ASP A 123 -4.797 -15.642 -1.919 1.00 0.00 H new ATOM 0 HA ASP A 123 -7.212 -16.081 -3.466 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -7.626 -17.828 -1.760 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -6.037 -17.983 -2.482 1.00 0.00 H new ATOM 2037 N ASN A 124 -7.347 -13.882 -1.368 1.00 0.00 N ATOM 2038 CA ASN A 124 -8.147 -12.894 -0.641 1.00 0.00 C ATOM 2039 C ASN A 124 -8.473 -13.361 0.774 1.00 0.00 C ATOM 2040 O ASN A 124 -9.523 -13.953 1.036 1.00 0.00 O ATOM 2041 CB ASN A 124 -9.432 -12.540 -1.397 1.00 0.00 C ATOM 2042 CG ASN A 124 -10.151 -11.349 -0.787 1.00 0.00 C ATOM 2043 OD1 ASN A 124 -9.527 -10.437 -0.235 1.00 0.00 O ATOM 2044 ND2 ASN A 124 -11.470 -11.344 -0.890 1.00 0.00 N ATOM 0 H ASN A 124 -6.431 -13.533 -1.649 1.00 0.00 H new ATOM 0 HA ASN A 124 -7.539 -11.993 -0.566 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -9.190 -12.322 -2.437 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -10.099 -13.402 -1.399 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -12.009 -10.568 -0.506 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -11.948 -12.117 -1.354 1.00 0.00 H new ATOM 2051 N SER A 125 -7.548 -13.102 1.677 1.00 0.00 N ATOM 2052 CA SER A 125 -7.712 -13.425 3.080 1.00 0.00 C ATOM 2053 C SER A 125 -6.784 -12.529 3.888 1.00 0.00 C ATOM 2054 O SER A 125 -5.674 -12.224 3.439 1.00 0.00 O ATOM 2055 CB SER A 125 -7.403 -14.904 3.329 1.00 0.00 C ATOM 2056 OG SER A 125 -7.707 -15.278 4.659 1.00 0.00 O ATOM 0 H SER A 125 -6.656 -12.659 1.456 1.00 0.00 H new ATOM 0 HA SER A 125 -8.744 -13.253 3.387 1.00 0.00 H new ATOM 0 HB2 SER A 125 -7.977 -15.519 2.636 1.00 0.00 H new ATOM 0 HB3 SER A 125 -6.349 -15.096 3.127 1.00 0.00 H new ATOM 0 HG SER A 125 -7.501 -16.227 4.787 1.00 0.00 H new ATOM 2062 N LEU A 126 -7.242 -12.078 5.048 1.00 0.00 N ATOM 2063 CA LEU A 126 -6.473 -11.143 5.853 1.00 0.00 C ATOM 2064 C LEU A 126 -5.276 -11.831 6.499 1.00 0.00 C ATOM 2065 O LEU A 126 -5.409 -12.512 7.517 1.00 0.00 O ATOM 2066 CB LEU A 126 -7.354 -10.501 6.926 1.00 0.00 C ATOM 2067 CG LEU A 126 -6.668 -9.419 7.763 1.00 0.00 C ATOM 2068 CD1 LEU A 126 -6.208 -8.266 6.882 1.00 0.00 C ATOM 2069 CD2 LEU A 126 -7.603 -8.919 8.854 1.00 0.00 C ATOM 0 H LEU A 126 -8.140 -12.345 5.451 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.102 -10.361 5.190 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -8.229 -10.066 6.444 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.714 -11.283 7.595 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.789 -9.857 8.235 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -5.723 -7.508 7.498 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -5.502 -8.636 6.138 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -7.069 -7.827 6.378 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -7.100 -8.150 9.440 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -8.501 -8.500 8.400 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -7.879 -9.749 9.505 1.00 0.00 H new ATOM 2081 N LEU A 127 -4.114 -11.660 5.890 1.00 0.00 N ATOM 2082 CA LEU A 127 -2.885 -12.208 6.433 1.00 0.00 C ATOM 2083 C LEU A 127 -2.379 -11.342 7.571 1.00 0.00 C ATOM 2084 O LEU A 127 -2.009 -11.844 8.629 1.00 0.00 O ATOM 2085 CB LEU A 127 -1.806 -12.317 5.353 1.00 0.00 C ATOM 2086 CG LEU A 127 -1.959 -13.492 4.389 1.00 0.00 C ATOM 2087 CD1 LEU A 127 -0.855 -13.457 3.343 1.00 0.00 C ATOM 2088 CD2 LEU A 127 -1.933 -14.807 5.156 1.00 0.00 C ATOM 0 H LEU A 127 -3.998 -11.145 5.018 1.00 0.00 H new ATOM 0 HA LEU A 127 -3.103 -13.208 6.809 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -1.800 -11.393 4.775 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -0.834 -12.394 5.841 1.00 0.00 H new ATOM 0 HG LEU A 127 -2.919 -13.411 3.880 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -0.973 -14.299 2.661 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -0.915 -12.524 2.782 1.00 0.00 H new ATOM 0 HD13 LEU A 127 0.115 -13.523 3.836 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -2.043 -15.637 4.458 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.985 -14.901 5.685 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -2.753 -14.826 5.874 1.00 0.00 H new ATOM 2100 N PHE A 128 -2.376 -10.037 7.355 1.00 0.00 N ATOM 2101 CA PHE A 128 -1.854 -9.110 8.341 1.00 0.00 C ATOM 2102 C PHE A 128 -2.594 -7.781 8.252 1.00 0.00 C ATOM 2103 O PHE A 128 -2.932 -7.323 7.162 1.00 0.00 O ATOM 2104 CB PHE A 128 -0.354 -8.902 8.105 1.00 0.00 C ATOM 2105 CG PHE A 128 0.375 -8.244 9.243 1.00 0.00 C ATOM 2106 CD1 PHE A 128 0.912 -9.011 10.265 1.00 0.00 C ATOM 2107 CD2 PHE A 128 0.535 -6.869 9.288 1.00 0.00 C ATOM 2108 CE1 PHE A 128 1.596 -8.416 11.307 1.00 0.00 C ATOM 2109 CE2 PHE A 128 1.215 -6.269 10.328 1.00 0.00 C ATOM 2110 CZ PHE A 128 1.748 -7.045 11.340 1.00 0.00 C ATOM 0 H PHE A 128 -2.729 -9.597 6.505 1.00 0.00 H new ATOM 0 HA PHE A 128 -2.003 -9.523 9.339 1.00 0.00 H new ATOM 0 HB2 PHE A 128 0.107 -9.870 7.907 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -0.222 -8.297 7.208 1.00 0.00 H new ATOM 0 HD1 PHE A 128 0.794 -10.084 10.246 1.00 0.00 H new ATOM 0 HD2 PHE A 128 0.122 -6.258 8.499 1.00 0.00 H new ATOM 0 HE1 PHE A 128 2.012 -9.024 12.096 1.00 0.00 H new ATOM 0 HE2 PHE A 128 1.330 -5.195 10.351 1.00 0.00 H new ATOM 0 HZ PHE A 128 2.282 -6.579 12.155 1.00 0.00 H new ATOM 2120 N THR A 129 -2.862 -7.178 9.397 1.00 0.00 N ATOM 2121 CA THR A 129 -3.486 -5.868 9.432 1.00 0.00 C ATOM 2122 C THR A 129 -2.764 -4.986 10.444 1.00 0.00 C ATOM 2123 O THR A 129 -2.311 -5.464 11.485 1.00 0.00 O ATOM 2124 CB THR A 129 -4.996 -5.953 9.772 1.00 0.00 C ATOM 2125 OG1 THR A 129 -5.610 -4.667 9.622 1.00 0.00 O ATOM 2126 CG2 THR A 129 -5.224 -6.456 11.192 1.00 0.00 C ATOM 0 H THR A 129 -2.657 -7.575 10.314 1.00 0.00 H new ATOM 0 HA THR A 129 -3.404 -5.430 8.437 1.00 0.00 H new ATOM 0 HB THR A 129 -5.448 -6.663 9.079 1.00 0.00 H new ATOM 0 HG1 THR A 129 -5.132 -4.154 8.937 1.00 0.00 H new ATOM 0 HG21 THR A 129 -6.294 -6.502 11.394 1.00 0.00 H new ATOM 0 HG22 THR A 129 -4.791 -7.450 11.300 1.00 0.00 H new ATOM 0 HG23 THR A 129 -4.750 -5.775 11.900 1.00 0.00 H new ATOM 2134 N GLU A 130 -2.624 -3.713 10.125 1.00 0.00 N ATOM 2135 CA GLU A 130 -1.933 -2.791 11.006 1.00 0.00 C ATOM 2136 C GLU A 130 -2.633 -1.442 10.997 1.00 0.00 C ATOM 2137 O GLU A 130 -3.115 -0.993 9.961 1.00 0.00 O ATOM 2138 CB GLU A 130 -0.470 -2.635 10.579 1.00 0.00 C ATOM 2139 CG GLU A 130 0.356 -1.810 11.550 1.00 0.00 C ATOM 2140 CD GLU A 130 0.272 -2.339 12.967 1.00 0.00 C ATOM 2141 OE1 GLU A 130 1.041 -3.258 13.308 1.00 0.00 O ATOM 2142 OE2 GLU A 130 -0.575 -1.848 13.746 1.00 0.00 O ATOM 0 H GLU A 130 -2.979 -3.295 9.265 1.00 0.00 H new ATOM 0 HA GLU A 130 -1.953 -3.193 12.019 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -0.021 -3.623 10.480 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -0.434 -2.168 9.595 1.00 0.00 H new ATOM 0 HG2 GLU A 130 1.397 -1.806 11.227 1.00 0.00 H new ATOM 0 HG3 GLU A 130 0.012 -0.776 11.529 1.00 0.00 H new ATOM 2149 N SER A 131 -2.687 -0.808 12.151 1.00 0.00 N ATOM 2150 CA SER A 131 -3.355 0.470 12.282 1.00 0.00 C ATOM 2151 C SER A 131 -2.364 1.609 12.075 1.00 0.00 C ATOM 2152 O SER A 131 -1.324 1.667 12.734 1.00 0.00 O ATOM 2153 CB SER A 131 -4.010 0.571 13.659 1.00 0.00 C ATOM 2154 OG SER A 131 -4.880 -0.529 13.876 1.00 0.00 O ATOM 0 H SER A 131 -2.274 -1.159 13.015 1.00 0.00 H new ATOM 0 HA SER A 131 -4.128 0.548 11.518 1.00 0.00 H new ATOM 0 HB2 SER A 131 -3.243 0.594 14.433 1.00 0.00 H new ATOM 0 HB3 SER A 131 -4.568 1.504 13.736 1.00 0.00 H new ATOM 0 HG SER A 131 -5.291 -0.451 14.762 1.00 0.00 H new ATOM 2160 N ILE A 132 -2.680 2.498 11.146 1.00 0.00 N ATOM 2161 CA ILE A 132 -1.815 3.627 10.855 1.00 0.00 C ATOM 2162 C ILE A 132 -1.925 4.680 11.955 1.00 0.00 C ATOM 2163 O ILE A 132 -2.870 5.469 11.989 1.00 0.00 O ATOM 2164 CB ILE A 132 -2.115 4.247 9.469 1.00 0.00 C ATOM 2165 CG1 ILE A 132 -3.621 4.452 9.271 1.00 0.00 C ATOM 2166 CG2 ILE A 132 -1.548 3.361 8.369 1.00 0.00 C ATOM 2167 CD1 ILE A 132 -3.981 5.155 7.978 1.00 0.00 C ATOM 0 H ILE A 132 -3.529 2.458 10.582 1.00 0.00 H new ATOM 0 HA ILE A 132 -0.791 3.255 10.825 1.00 0.00 H new ATOM 0 HB ILE A 132 -1.636 5.225 9.419 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -4.116 3.481 9.295 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -4.012 5.030 10.108 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -1.764 3.805 7.397 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -0.469 3.270 8.495 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -2.005 2.373 8.426 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -5.064 5.263 7.912 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -3.517 6.141 7.958 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -3.622 4.568 7.133 1.00 0.00 H new ATOM 2179 N GLN A 133 -0.950 4.642 12.862 1.00 0.00 N ATOM 2180 CA GLN A 133 -0.908 5.501 14.042 1.00 0.00 C ATOM 2181 C GLN A 133 -1.920 5.015 15.081 1.00 0.00 C ATOM 2182 O GLN A 133 -3.126 5.204 14.933 1.00 0.00 O ATOM 2183 CB GLN A 133 -1.150 6.976 13.687 1.00 0.00 C ATOM 2184 CG GLN A 133 -0.875 7.939 14.833 1.00 0.00 C ATOM 2185 CD GLN A 133 0.604 8.054 15.164 1.00 0.00 C ATOM 2186 OE1 GLN A 133 1.377 7.116 14.972 1.00 0.00 O ATOM 2187 NE2 GLN A 133 1.006 9.209 15.671 1.00 0.00 N ATOM 0 H GLN A 133 -0.157 4.004 12.796 1.00 0.00 H new ATOM 0 HA GLN A 133 0.094 5.437 14.467 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -0.518 7.244 12.840 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -2.184 7.097 13.364 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -1.262 8.924 14.574 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -1.416 7.606 15.719 1.00 0.00 H new ATOM 0 HE21 GLN A 133 0.335 9.964 15.816 1.00 0.00 H new ATOM 0 HE22 GLN A 133 1.987 9.344 15.917 1.00 0.00 H new