USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 967 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 99 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 137 ASN : amide:sc= 0.504 K(o=0.5,f=-6.8!) USER MOD Set 2.1: A 94 LYS NZ :NH3+ -170:sc= 1.31 (180deg=0) USER MOD Set 2.2: A 107 HIS : no HE2:sc= 0.0532 K(o=1.1,f=-7) USER MOD Set 2.3: A 111 ASN : amide:sc= -0.213 K(o=1.1,f=-2.3!) USER MOD Set 3.1: A 60 ASN : amide:sc= 0.0541 K(o=0.054,f=-2.8!) USER MOD Set 3.2: A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.462 USER MOD Single : A 8 GLN : amide:sc= -0.349 K(o=-0.35,f=-2.2!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -72:sc= 1.22 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.00314 USER MOD Single : A 30 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0537) USER MOD Single : A 34 THR OG1 : rot 79:sc= 0.237 USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 77:sc= 0.145 USER MOD Single : A 41 GLN : amide:sc= 0.285 X(o=0.29,f=0) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.148 K(o=-0.15,f=-2.6!) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 87:sc= 0.86 USER MOD Single : A 71 MET CE :methyl 149:sc= -0.68 (180deg=-2.42!) USER MOD Single : A 72 MET CE :methyl -159:sc= -0.114 (180deg=-0.944) USER MOD Single : A 97 ASN : amide:sc= -0.114 K(o=-0.11,f=-2) USER MOD Single : A 101 SER OG : rot 180:sc= -0.012 USER MOD Single : A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 THR OG1 : rot 9:sc= 0.423 USER MOD Single : A 115 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.108) USER MOD Single : A 117 THR OG1 : rot -71:sc= 0.979 USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 GLN : amide:sc= -0.551 K(o=-0.55,f=-1.6) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.341 USER MOD Single : A 143 GLN : amide:sc= -0.238 X(o=-0.24,f=-0.24) USER MOD Single : A 144 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 145 MET CE :methyl 171:sc= -0.295 (180deg=-0.381) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -13.205 16.863 -1.424 1.00 0.00 N ATOM 59 CA THR A 5 -13.852 17.758 -2.333 1.00 0.00 C ATOM 60 C THR A 5 -15.179 17.181 -2.690 1.00 0.00 C ATOM 61 O THR A 5 -15.511 16.011 -2.506 1.00 0.00 O ATOM 62 CB THR A 5 -13.116 18.182 -3.568 1.00 0.00 C ATOM 63 OG1 THR A 5 -13.001 17.060 -4.431 1.00 0.00 O ATOM 64 CG2 THR A 5 -11.699 18.614 -3.153 1.00 0.00 C ATOM 0 HA THR A 5 -13.920 18.696 -1.783 1.00 0.00 H new ATOM 0 HB THR A 5 -13.641 18.996 -4.068 1.00 0.00 H new ATOM 0 HG1 THR A 5 -12.523 17.321 -5.245 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.141 18.928 -4.035 1.00 0.00 H new ATOM 0 HG22 THR A 5 -11.763 19.444 -2.450 1.00 0.00 H new ATOM 0 HG23 THR A 5 -11.187 17.776 -2.679 1.00 0.00 H new ATOM 72 N GLU A 6 -16.067 18.038 -3.224 1.00 0.00 N ATOM 73 CA GLU A 6 -17.277 17.606 -3.852 1.00 0.00 C ATOM 74 C GLU A 6 -17.089 16.628 -4.960 1.00 0.00 C ATOM 75 O GLU A 6 -17.811 15.634 -4.999 1.00 0.00 O ATOM 76 CB GLU A 6 -18.167 18.828 -4.137 1.00 0.00 C ATOM 77 CG GLU A 6 -17.706 19.695 -5.311 1.00 0.00 C ATOM 78 CD GLU A 6 -16.301 20.243 -5.108 1.00 0.00 C ATOM 79 OE1 GLU A 6 -16.082 21.025 -4.145 1.00 0.00 O ATOM 80 OE2 GLU A 6 -15.388 19.880 -5.897 1.00 0.00 O ATOM 0 H GLU A 6 -15.942 19.050 -3.220 1.00 0.00 H new ATOM 0 HA GLU A 6 -17.836 16.981 -3.156 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -19.182 18.483 -4.334 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -18.209 19.447 -3.241 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -17.735 19.106 -6.228 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -18.401 20.524 -5.443 1.00 0.00 H new ATOM 87 N GLU A 7 -16.100 16.815 -5.852 1.00 0.00 N ATOM 88 CA GLU A 7 -15.671 15.886 -6.851 1.00 0.00 C ATOM 89 C GLU A 7 -15.220 14.558 -6.348 1.00 0.00 C ATOM 90 O GLU A 7 -15.741 13.543 -6.807 1.00 0.00 O ATOM 91 CB GLU A 7 -14.498 16.441 -7.676 1.00 0.00 C ATOM 92 CG GLU A 7 -14.860 17.639 -8.555 1.00 0.00 C ATOM 93 CD GLU A 7 -15.715 17.273 -9.760 1.00 0.00 C ATOM 94 OE1 GLU A 7 -15.265 16.484 -10.633 1.00 0.00 O ATOM 95 OE2 GLU A 7 -16.837 17.840 -9.842 1.00 0.00 O ATOM 0 H GLU A 7 -15.561 17.681 -5.876 1.00 0.00 H new ATOM 0 HA GLU A 7 -16.576 15.745 -7.442 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -13.697 16.732 -6.997 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -14.106 15.645 -8.309 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -15.393 18.374 -7.952 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -13.943 18.115 -8.902 1.00 0.00 H new ATOM 102 N GLN A 8 -14.331 14.500 -5.340 1.00 0.00 N ATOM 103 CA GLN A 8 -14.033 13.294 -4.633 1.00 0.00 C ATOM 104 C GLN A 8 -15.200 12.603 -4.015 1.00 0.00 C ATOM 105 O GLN A 8 -15.373 11.387 -4.083 1.00 0.00 O ATOM 106 CB GLN A 8 -12.961 13.564 -3.563 1.00 0.00 C ATOM 107 CG GLN A 8 -11.544 13.792 -4.095 1.00 0.00 C ATOM 108 CD GLN A 8 -10.739 14.651 -3.130 1.00 0.00 C ATOM 109 OE1 GLN A 8 -11.175 15.035 -2.046 1.00 0.00 O ATOM 110 NE2 GLN A 8 -9.433 14.814 -3.475 1.00 0.00 N ATOM 0 H GLN A 8 -13.807 15.310 -5.009 1.00 0.00 H new ATOM 0 HA GLN A 8 -13.668 12.606 -5.395 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -13.260 14.440 -2.987 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -12.940 12.720 -2.873 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -11.046 12.833 -4.239 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -11.590 14.277 -5.070 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -9.100 14.485 -4.381 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -8.787 15.265 -2.827 1.00 0.00 H new ATOM 119 N ILE A 9 -16.211 13.308 -3.477 1.00 0.00 N ATOM 120 CA ILE A 9 -17.394 12.838 -2.826 1.00 0.00 C ATOM 121 C ILE A 9 -18.279 12.253 -3.873 1.00 0.00 C ATOM 122 O ILE A 9 -18.723 11.123 -3.674 1.00 0.00 O ATOM 123 CB ILE A 9 -18.011 13.821 -1.875 1.00 0.00 C ATOM 124 CG1 ILE A 9 -17.381 13.822 -0.472 1.00 0.00 C ATOM 125 CG2 ILE A 9 -19.514 13.508 -1.788 1.00 0.00 C ATOM 126 CD1 ILE A 9 -17.927 12.662 0.359 1.00 0.00 C ATOM 0 H ILE A 9 -16.193 14.327 -3.504 1.00 0.00 H new ATOM 0 HA ILE A 9 -17.155 12.042 -2.121 1.00 0.00 H new ATOM 0 HB ILE A 9 -17.828 14.822 -2.266 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -16.297 13.741 -0.553 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -17.593 14.767 0.028 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -19.992 14.207 -1.102 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -19.963 13.604 -2.776 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -19.653 12.490 -1.424 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -17.471 12.677 1.349 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -19.008 12.761 0.456 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -17.692 11.719 -0.134 1.00 0.00 H new ATOM 138 N ALA A 10 -18.421 12.904 -5.041 1.00 0.00 N ATOM 139 CA ALA A 10 -19.055 12.382 -6.212 1.00 0.00 C ATOM 140 C ALA A 10 -18.407 11.167 -6.782 1.00 0.00 C ATOM 141 O ALA A 10 -19.202 10.264 -7.038 1.00 0.00 O ATOM 142 CB ALA A 10 -19.152 13.400 -7.360 1.00 0.00 C ATOM 0 H ALA A 10 -18.072 13.853 -5.176 1.00 0.00 H new ATOM 0 HA ALA A 10 -20.045 12.125 -5.835 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -19.643 12.937 -8.216 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -19.731 14.264 -7.033 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -18.151 13.722 -7.647 1.00 0.00 H new ATOM 148 N GLU A 11 -17.070 11.058 -6.875 1.00 0.00 N ATOM 149 CA GLU A 11 -16.493 9.809 -7.265 1.00 0.00 C ATOM 150 C GLU A 11 -16.583 8.638 -6.347 1.00 0.00 C ATOM 151 O GLU A 11 -16.803 7.496 -6.745 1.00 0.00 O ATOM 152 CB GLU A 11 -14.999 9.895 -7.620 1.00 0.00 C ATOM 153 CG GLU A 11 -14.664 10.968 -8.658 1.00 0.00 C ATOM 154 CD GLU A 11 -13.318 10.736 -9.329 1.00 0.00 C ATOM 155 OE1 GLU A 11 -13.314 9.947 -10.311 1.00 0.00 O ATOM 156 OE2 GLU A 11 -12.243 11.275 -8.952 1.00 0.00 O ATOM 0 H GLU A 11 -16.406 11.809 -6.687 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.149 9.623 -8.115 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -14.432 10.094 -6.711 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.669 8.926 -7.995 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -15.445 10.989 -9.418 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -14.661 11.946 -8.176 1.00 0.00 H new ATOM 163 N PHE A 12 -16.442 8.935 -5.043 1.00 0.00 N ATOM 164 CA PHE A 12 -16.733 8.011 -3.991 1.00 0.00 C ATOM 165 C PHE A 12 -18.154 7.567 -3.937 1.00 0.00 C ATOM 166 O PHE A 12 -18.333 6.375 -3.690 1.00 0.00 O ATOM 167 CB PHE A 12 -16.316 8.515 -2.599 1.00 0.00 C ATOM 168 CG PHE A 12 -14.850 8.568 -2.335 1.00 0.00 C ATOM 169 CD1 PHE A 12 -14.034 7.531 -2.723 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.264 9.662 -1.744 1.00 0.00 C ATOM 171 CE1 PHE A 12 -12.743 7.436 -2.261 1.00 0.00 C ATOM 172 CE2 PHE A 12 -12.957 9.548 -1.331 1.00 0.00 C ATOM 173 CZ PHE A 12 -12.133 8.484 -1.612 1.00 0.00 C ATOM 0 H PHE A 12 -16.117 9.843 -4.711 1.00 0.00 H new ATOM 0 HA PHE A 12 -16.121 7.148 -4.254 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.727 9.515 -2.458 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.777 7.873 -1.849 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -14.413 6.780 -3.401 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -14.813 10.582 -1.608 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -12.195 6.517 -2.411 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.547 10.355 -0.742 1.00 0.00 H new ATOM 0 HZ PHE A 12 -11.087 8.472 -1.344 1.00 0.00 H new ATOM 183 N LYS A 13 -19.089 8.468 -4.290 1.00 0.00 N ATOM 184 CA LYS A 13 -20.484 8.208 -4.465 1.00 0.00 C ATOM 185 C LYS A 13 -20.801 7.340 -5.633 1.00 0.00 C ATOM 186 O LYS A 13 -21.576 6.389 -5.534 1.00 0.00 O ATOM 187 CB LYS A 13 -21.304 9.508 -4.538 1.00 0.00 C ATOM 188 CG LYS A 13 -22.827 9.432 -4.660 1.00 0.00 C ATOM 189 CD LYS A 13 -23.463 10.705 -5.223 1.00 0.00 C ATOM 190 CE LYS A 13 -23.367 11.880 -4.249 1.00 0.00 C ATOM 191 NZ LYS A 13 -24.102 13.100 -4.653 1.00 0.00 N ATOM 0 H LYS A 13 -18.852 9.445 -4.465 1.00 0.00 H new ATOM 0 HA LYS A 13 -20.773 7.650 -3.574 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -21.077 10.088 -3.644 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -20.936 10.079 -5.391 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -23.090 8.591 -5.301 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -23.252 9.228 -3.677 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -22.972 10.971 -6.159 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -24.510 10.513 -5.456 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -23.740 11.556 -3.277 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -22.316 12.136 -4.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -23.976 13.837 -3.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -23.734 13.442 -5.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -25.114 12.880 -4.750 1.00 0.00 H new ATOM 205 N GLU A 14 -20.225 7.637 -6.812 1.00 0.00 N ATOM 206 CA GLU A 14 -20.476 6.829 -7.964 1.00 0.00 C ATOM 207 C GLU A 14 -19.773 5.517 -7.909 1.00 0.00 C ATOM 208 O GLU A 14 -20.364 4.517 -8.316 1.00 0.00 O ATOM 209 CB GLU A 14 -19.991 7.629 -9.185 1.00 0.00 C ATOM 210 CG GLU A 14 -20.946 7.497 -10.373 1.00 0.00 C ATOM 211 CD GLU A 14 -20.549 8.433 -11.505 1.00 0.00 C ATOM 212 OE1 GLU A 14 -20.529 9.687 -11.383 1.00 0.00 O ATOM 213 OE2 GLU A 14 -20.443 7.874 -12.629 1.00 0.00 O ATOM 0 H GLU A 14 -19.595 8.424 -6.967 1.00 0.00 H new ATOM 0 HA GLU A 14 -21.541 6.603 -8.018 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.893 8.680 -8.914 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -19.000 7.281 -9.476 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -20.945 6.468 -10.731 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -21.963 7.721 -10.052 1.00 0.00 H new ATOM 220 N ALA A 15 -18.592 5.452 -7.268 1.00 0.00 N ATOM 221 CA ALA A 15 -17.980 4.227 -6.858 1.00 0.00 C ATOM 222 C ALA A 15 -18.802 3.327 -6.000 1.00 0.00 C ATOM 223 O ALA A 15 -18.951 2.115 -6.151 1.00 0.00 O ATOM 224 CB ALA A 15 -16.671 4.475 -6.090 1.00 0.00 C ATOM 0 H ALA A 15 -18.046 6.279 -7.027 1.00 0.00 H new ATOM 0 HA ALA A 15 -17.824 3.725 -7.813 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.236 3.520 -5.795 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -15.970 5.011 -6.729 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.878 5.069 -5.200 1.00 0.00 H new ATOM 230 N PHE A 16 -19.583 3.928 -5.085 1.00 0.00 N ATOM 231 CA PHE A 16 -20.514 3.322 -4.184 1.00 0.00 C ATOM 232 C PHE A 16 -21.596 2.657 -4.964 1.00 0.00 C ATOM 233 O PHE A 16 -21.968 1.487 -4.882 1.00 0.00 O ATOM 234 CB PHE A 16 -20.988 4.302 -3.098 1.00 0.00 C ATOM 235 CG PHE A 16 -21.738 3.613 -2.010 1.00 0.00 C ATOM 236 CD1 PHE A 16 -23.070 3.307 -2.164 1.00 0.00 C ATOM 237 CD2 PHE A 16 -20.996 3.176 -0.938 1.00 0.00 C ATOM 238 CE1 PHE A 16 -23.665 2.490 -1.232 1.00 0.00 C ATOM 239 CE2 PHE A 16 -21.683 2.498 0.041 1.00 0.00 C ATOM 240 CZ PHE A 16 -23.024 2.205 -0.049 1.00 0.00 C ATOM 0 H PHE A 16 -19.558 4.941 -4.966 1.00 0.00 H new ATOM 0 HA PHE A 16 -20.023 2.535 -3.612 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.126 4.817 -2.674 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -21.624 5.064 -3.550 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -23.635 3.699 -2.997 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -19.933 3.355 -0.869 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -24.640 2.070 -1.430 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -21.145 2.181 0.922 1.00 0.00 H new ATOM 0 HZ PHE A 16 -23.556 1.766 0.782 1.00 0.00 H new ATOM 250 N SER A 17 -22.232 3.391 -5.894 1.00 0.00 N ATOM 251 CA SER A 17 -23.236 2.977 -6.824 1.00 0.00 C ATOM 252 C SER A 17 -22.782 1.911 -7.762 1.00 0.00 C ATOM 253 O SER A 17 -23.642 1.086 -8.068 1.00 0.00 O ATOM 254 CB SER A 17 -23.733 4.183 -7.638 1.00 0.00 C ATOM 255 OG SER A 17 -24.420 5.172 -6.886 1.00 0.00 O ATOM 0 H SER A 17 -22.017 4.382 -6.004 1.00 0.00 H new ATOM 0 HA SER A 17 -24.042 2.554 -6.225 1.00 0.00 H new ATOM 0 HB2 SER A 17 -22.878 4.649 -8.128 1.00 0.00 H new ATOM 0 HB3 SER A 17 -24.394 3.823 -8.426 1.00 0.00 H new ATOM 0 HG SER A 17 -24.698 5.900 -7.480 1.00 0.00 H new ATOM 261 N LEU A 18 -21.541 1.880 -8.278 1.00 0.00 N ATOM 262 CA LEU A 18 -21.126 0.747 -9.046 1.00 0.00 C ATOM 263 C LEU A 18 -21.193 -0.560 -8.335 1.00 0.00 C ATOM 264 O LEU A 18 -21.441 -1.565 -9.000 1.00 0.00 O ATOM 265 CB LEU A 18 -19.773 1.030 -9.722 1.00 0.00 C ATOM 266 CG LEU A 18 -19.697 0.325 -11.086 1.00 0.00 C ATOM 267 CD1 LEU A 18 -20.587 1.081 -12.088 1.00 0.00 C ATOM 268 CD2 LEU A 18 -18.232 0.234 -11.546 1.00 0.00 C ATOM 0 H LEU A 18 -20.843 2.615 -8.169 1.00 0.00 H new ATOM 0 HA LEU A 18 -21.869 0.612 -9.832 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -19.642 2.104 -9.853 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -18.961 0.686 -9.082 1.00 0.00 H new ATOM 0 HG LEU A 18 -20.069 -0.697 -11.014 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -20.540 0.589 -13.059 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -21.617 1.082 -11.731 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -20.235 2.108 -12.184 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -18.185 -0.267 -12.513 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -17.816 1.237 -11.636 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -17.656 -0.333 -10.815 1.00 0.00 H new ATOM 280 N PHE A 19 -21.087 -0.525 -6.995 1.00 0.00 N ATOM 281 CA PHE A 19 -21.112 -1.683 -6.157 1.00 0.00 C ATOM 282 C PHE A 19 -22.534 -2.060 -5.916 1.00 0.00 C ATOM 283 O PHE A 19 -22.941 -3.217 -6.009 1.00 0.00 O ATOM 284 CB PHE A 19 -20.332 -1.545 -4.838 1.00 0.00 C ATOM 285 CG PHE A 19 -18.855 -1.392 -4.957 1.00 0.00 C ATOM 286 CD1 PHE A 19 -18.238 -2.441 -5.596 1.00 0.00 C ATOM 287 CD2 PHE A 19 -18.092 -0.322 -4.553 1.00 0.00 C ATOM 288 CE1 PHE A 19 -16.869 -2.480 -5.722 1.00 0.00 C ATOM 289 CE2 PHE A 19 -16.730 -0.331 -4.740 1.00 0.00 C ATOM 290 CZ PHE A 19 -16.102 -1.461 -5.209 1.00 0.00 C ATOM 0 H PHE A 19 -20.980 0.345 -6.474 1.00 0.00 H new ATOM 0 HA PHE A 19 -20.585 -2.476 -6.688 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.723 -0.682 -4.298 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -20.537 -2.424 -4.226 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -18.835 -3.243 -6.004 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.565 0.530 -4.087 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -16.396 -3.311 -6.224 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -16.151 0.553 -4.518 1.00 0.00 H new ATOM 0 HZ PHE A 19 -15.026 -1.546 -5.175 1.00 0.00 H new ATOM 300 N ASP A 20 -23.304 -1.025 -5.534 1.00 0.00 N ATOM 301 CA ASP A 20 -24.626 -1.269 -5.048 1.00 0.00 C ATOM 302 C ASP A 20 -25.582 -1.704 -6.105 1.00 0.00 C ATOM 303 O ASP A 20 -25.782 -1.004 -7.096 1.00 0.00 O ATOM 304 CB ASP A 20 -25.077 -0.104 -4.151 1.00 0.00 C ATOM 305 CG ASP A 20 -26.364 -0.403 -3.394 1.00 0.00 C ATOM 306 OD1 ASP A 20 -27.071 -1.443 -3.469 1.00 0.00 O ATOM 307 OD2 ASP A 20 -26.744 0.482 -2.581 1.00 0.00 O ATOM 0 H ASP A 20 -23.022 -0.045 -5.560 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.612 -2.148 -4.404 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.286 0.125 -3.437 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -25.220 0.786 -4.764 1.00 0.00 H new ATOM 312 N LYS A 21 -26.131 -2.930 -6.026 1.00 0.00 N ATOM 313 CA LYS A 21 -27.009 -3.516 -6.990 1.00 0.00 C ATOM 314 C LYS A 21 -28.428 -3.125 -6.757 1.00 0.00 C ATOM 315 O LYS A 21 -29.117 -2.861 -7.741 1.00 0.00 O ATOM 316 CB LYS A 21 -27.064 -5.051 -7.084 1.00 0.00 C ATOM 317 CG LYS A 21 -25.732 -5.717 -7.436 1.00 0.00 C ATOM 318 CD LYS A 21 -25.426 -5.389 -8.898 1.00 0.00 C ATOM 319 CE LYS A 21 -24.167 -5.983 -9.533 1.00 0.00 C ATOM 320 NZ LYS A 21 -24.069 -5.577 -10.952 1.00 0.00 N ATOM 0 H LYS A 21 -25.949 -3.551 -5.237 1.00 0.00 H new ATOM 0 HA LYS A 21 -26.564 -3.129 -7.907 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -27.413 -5.448 -6.130 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -27.804 -5.329 -7.835 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -24.937 -5.351 -6.786 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -25.792 -6.795 -7.290 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -26.280 -5.709 -9.495 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -25.362 -4.305 -8.988 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -23.284 -5.647 -8.989 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -24.192 -7.070 -9.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -23.210 -5.987 -11.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -24.904 -5.919 -11.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -24.024 -4.540 -11.014 1.00 0.00 H new ATOM 334 N ASP A 22 -28.854 -2.992 -5.488 1.00 0.00 N ATOM 335 CA ASP A 22 -30.131 -2.519 -5.051 1.00 0.00 C ATOM 336 C ASP A 22 -30.266 -1.064 -5.343 1.00 0.00 C ATOM 337 O ASP A 22 -31.307 -0.642 -5.843 1.00 0.00 O ATOM 338 CB ASP A 22 -30.442 -2.873 -3.587 1.00 0.00 C ATOM 339 CG ASP A 22 -30.013 -4.267 -3.153 1.00 0.00 C ATOM 340 OD1 ASP A 22 -30.588 -5.274 -3.647 1.00 0.00 O ATOM 341 OD2 ASP A 22 -29.002 -4.318 -2.403 1.00 0.00 O ATOM 0 H ASP A 22 -28.252 -3.237 -4.702 1.00 0.00 H new ATOM 0 HA ASP A 22 -30.894 -3.047 -5.623 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -29.954 -2.143 -2.942 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -31.515 -2.774 -3.426 1.00 0.00 H new ATOM 346 N GLY A 23 -29.258 -0.230 -5.029 1.00 0.00 N ATOM 347 CA GLY A 23 -29.315 1.196 -4.946 1.00 0.00 C ATOM 348 C GLY A 23 -29.942 1.539 -3.639 1.00 0.00 C ATOM 349 O GLY A 23 -30.633 2.555 -3.577 1.00 0.00 O ATOM 0 H GLY A 23 -28.326 -0.585 -4.816 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -28.316 1.625 -5.017 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -29.898 1.606 -5.771 1.00 0.00 H new ATOM 353 N ASP A 24 -29.640 0.791 -2.563 1.00 0.00 N ATOM 354 CA ASP A 24 -30.322 0.970 -1.318 1.00 0.00 C ATOM 355 C ASP A 24 -29.512 1.857 -0.437 1.00 0.00 C ATOM 356 O ASP A 24 -30.034 2.492 0.478 1.00 0.00 O ATOM 357 CB ASP A 24 -30.706 -0.370 -0.668 1.00 0.00 C ATOM 358 CG ASP A 24 -29.588 -1.120 0.042 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.684 -1.580 -0.705 1.00 0.00 O ATOM 360 OD2 ASP A 24 -29.583 -1.261 1.294 1.00 0.00 O ATOM 0 H ASP A 24 -28.925 0.063 -2.554 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.276 1.466 -1.496 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -31.504 -0.185 0.051 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -31.117 -1.020 -1.441 1.00 0.00 H new ATOM 365 N GLY A 25 -28.197 1.936 -0.712 1.00 0.00 N ATOM 366 CA GLY A 25 -27.304 2.502 0.251 1.00 0.00 C ATOM 367 C GLY A 25 -26.464 1.624 1.114 1.00 0.00 C ATOM 368 O GLY A 25 -25.668 2.184 1.865 1.00 0.00 O ATOM 0 H GLY A 25 -27.761 1.617 -1.577 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -26.627 3.164 -0.289 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -27.901 3.128 0.914 1.00 0.00 H new ATOM 372 N THR A 26 -26.542 0.293 0.941 1.00 0.00 N ATOM 373 CA THR A 26 -25.659 -0.545 1.691 1.00 0.00 C ATOM 374 C THR A 26 -24.968 -1.432 0.713 1.00 0.00 C ATOM 375 O THR A 26 -25.464 -1.753 -0.366 1.00 0.00 O ATOM 376 CB THR A 26 -26.288 -1.367 2.777 1.00 0.00 C ATOM 377 OG1 THR A 26 -27.254 -2.283 2.283 1.00 0.00 O ATOM 378 CG2 THR A 26 -26.787 -0.372 3.838 1.00 0.00 C ATOM 0 H THR A 26 -27.185 -0.187 0.312 1.00 0.00 H new ATOM 0 HA THR A 26 -24.980 0.115 2.232 1.00 0.00 H new ATOM 0 HB THR A 26 -25.570 -2.041 3.245 1.00 0.00 H new ATOM 0 HG1 THR A 26 -28.057 -1.794 2.005 1.00 0.00 H new ATOM 0 HG21 THR A 26 -27.256 -0.918 4.656 1.00 0.00 H new ATOM 0 HG22 THR A 26 -25.945 0.204 4.222 1.00 0.00 H new ATOM 0 HG23 THR A 26 -27.514 0.304 3.389 1.00 0.00 H new ATOM 386 N ILE A 27 -23.769 -1.956 1.024 1.00 0.00 N ATOM 387 CA ILE A 27 -22.997 -2.890 0.265 1.00 0.00 C ATOM 388 C ILE A 27 -22.852 -4.166 1.019 1.00 0.00 C ATOM 389 O ILE A 27 -22.444 -4.178 2.180 1.00 0.00 O ATOM 390 CB ILE A 27 -21.656 -2.471 -0.261 1.00 0.00 C ATOM 391 CG1 ILE A 27 -21.432 -0.958 -0.418 1.00 0.00 C ATOM 392 CG2 ILE A 27 -21.407 -3.231 -1.574 1.00 0.00 C ATOM 393 CD1 ILE A 27 -19.956 -0.701 -0.722 1.00 0.00 C ATOM 0 H ILE A 27 -23.297 -1.699 1.891 1.00 0.00 H new ATOM 0 HA ILE A 27 -23.593 -2.990 -0.642 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.920 -2.735 0.499 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -22.055 -0.567 -1.222 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -21.724 -0.438 0.494 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -20.437 -2.946 -1.981 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -21.419 -4.304 -1.381 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -22.189 -2.983 -2.292 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -19.789 0.370 -0.835 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -19.345 -1.079 0.097 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.681 -1.210 -1.645 1.00 0.00 H new ATOM 405 N THR A 28 -23.223 -5.281 0.364 1.00 0.00 N ATOM 406 CA THR A 28 -23.005 -6.512 1.057 1.00 0.00 C ATOM 407 C THR A 28 -21.721 -7.070 0.547 1.00 0.00 C ATOM 408 O THR A 28 -20.964 -6.474 -0.217 1.00 0.00 O ATOM 409 CB THR A 28 -24.210 -7.391 0.898 1.00 0.00 C ATOM 410 OG1 THR A 28 -24.425 -7.742 -0.461 1.00 0.00 O ATOM 411 CG2 THR A 28 -25.513 -6.690 1.317 1.00 0.00 C ATOM 0 H THR A 28 -23.639 -5.337 -0.566 1.00 0.00 H new ATOM 0 HA THR A 28 -22.896 -6.397 2.135 1.00 0.00 H new ATOM 0 HB THR A 28 -23.997 -8.255 1.527 1.00 0.00 H new ATOM 0 HG1 THR A 28 -25.216 -8.316 -0.529 1.00 0.00 H new ATOM 0 HG21 THR A 28 -26.353 -7.372 1.181 1.00 0.00 H new ATOM 0 HG22 THR A 28 -25.448 -6.398 2.365 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.663 -5.803 0.702 1.00 0.00 H new ATOM 419 N THR A 29 -21.282 -8.201 1.128 1.00 0.00 N ATOM 420 CA THR A 29 -20.041 -8.779 0.715 1.00 0.00 C ATOM 421 C THR A 29 -20.095 -9.332 -0.668 1.00 0.00 C ATOM 422 O THR A 29 -19.143 -9.207 -1.436 1.00 0.00 O ATOM 423 CB THR A 29 -19.451 -9.832 1.606 1.00 0.00 C ATOM 424 OG1 THR A 29 -20.484 -10.676 2.091 1.00 0.00 O ATOM 425 CG2 THR A 29 -18.801 -9.018 2.737 1.00 0.00 C ATOM 0 H THR A 29 -21.773 -8.705 1.866 1.00 0.00 H new ATOM 0 HA THR A 29 -19.380 -7.914 0.773 1.00 0.00 H new ATOM 0 HB THR A 29 -18.734 -10.486 1.110 1.00 0.00 H new ATOM 0 HG1 THR A 29 -20.098 -11.365 2.672 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.335 -9.696 3.452 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.043 -8.355 2.319 1.00 0.00 H new ATOM 0 HG23 THR A 29 -19.563 -8.425 3.243 1.00 0.00 H new ATOM 433 N LYS A 30 -21.207 -9.928 -1.135 1.00 0.00 N ATOM 434 CA LYS A 30 -21.459 -10.209 -2.515 1.00 0.00 C ATOM 435 C LYS A 30 -21.375 -9.102 -3.509 1.00 0.00 C ATOM 436 O LYS A 30 -20.737 -9.145 -4.560 1.00 0.00 O ATOM 437 CB LYS A 30 -22.646 -11.153 -2.770 1.00 0.00 C ATOM 438 CG LYS A 30 -24.042 -10.607 -2.463 1.00 0.00 C ATOM 439 CD LYS A 30 -25.219 -11.428 -2.995 1.00 0.00 C ATOM 440 CE LYS A 30 -25.232 -12.804 -2.325 1.00 0.00 C ATOM 441 NZ LYS A 30 -25.457 -12.808 -0.862 1.00 0.00 N ATOM 0 H LYS A 30 -21.965 -10.228 -0.522 1.00 0.00 H new ATOM 0 HA LYS A 30 -20.546 -10.760 -2.738 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -22.622 -11.453 -3.818 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -22.496 -12.055 -2.176 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -24.146 -10.520 -1.381 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -24.114 -9.599 -2.872 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -26.156 -10.908 -2.798 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -25.138 -11.540 -4.076 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -26.009 -13.408 -2.794 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -24.280 -13.295 -2.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -25.582 -13.787 -0.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -24.637 -12.384 -0.383 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -26.311 -12.257 -0.641 1.00 0.00 H new ATOM 455 N GLU A 31 -22.011 -7.968 -3.167 1.00 0.00 N ATOM 456 CA GLU A 31 -22.049 -6.750 -3.916 1.00 0.00 C ATOM 457 C GLU A 31 -20.730 -6.077 -4.080 1.00 0.00 C ATOM 458 O GLU A 31 -20.468 -5.684 -5.216 1.00 0.00 O ATOM 459 CB GLU A 31 -23.055 -5.711 -3.394 1.00 0.00 C ATOM 460 CG GLU A 31 -24.537 -6.023 -3.613 1.00 0.00 C ATOM 461 CD GLU A 31 -25.383 -4.835 -3.179 1.00 0.00 C ATOM 462 OE1 GLU A 31 -25.140 -4.259 -2.085 1.00 0.00 O ATOM 463 OE2 GLU A 31 -26.438 -4.596 -3.825 1.00 0.00 O ATOM 0 H GLU A 31 -22.540 -7.898 -2.298 1.00 0.00 H new ATOM 0 HA GLU A 31 -22.382 -7.107 -4.890 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.888 -5.582 -2.325 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -22.834 -4.755 -3.868 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -24.720 -6.247 -4.664 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -24.819 -6.909 -3.045 1.00 0.00 H new ATOM 470 N LEU A 32 -19.905 -6.112 -3.018 1.00 0.00 N ATOM 471 CA LEU A 32 -18.584 -5.589 -3.180 1.00 0.00 C ATOM 472 C LEU A 32 -17.745 -6.321 -4.170 1.00 0.00 C ATOM 473 O LEU A 32 -17.125 -5.854 -5.124 1.00 0.00 O ATOM 474 CB LEU A 32 -17.700 -5.554 -1.923 1.00 0.00 C ATOM 475 CG LEU A 32 -18.004 -4.407 -0.944 1.00 0.00 C ATOM 476 CD1 LEU A 32 -17.349 -4.754 0.404 1.00 0.00 C ATOM 477 CD2 LEU A 32 -17.452 -3.085 -1.502 1.00 0.00 C ATOM 0 H LEU A 32 -20.134 -6.481 -2.095 1.00 0.00 H new ATOM 0 HA LEU A 32 -18.843 -4.581 -3.502 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.809 -6.501 -1.394 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.658 -5.480 -2.233 1.00 0.00 H new ATOM 0 HG LEU A 32 -19.079 -4.285 -0.809 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -17.548 -3.957 1.121 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -17.762 -5.691 0.779 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.273 -4.860 0.269 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -17.670 -2.276 -0.804 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -16.373 -3.168 -1.635 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -17.921 -2.872 -2.463 1.00 0.00 H new ATOM 489 N GLY A 33 -17.711 -7.657 -4.013 1.00 0.00 N ATOM 490 CA GLY A 33 -16.967 -8.676 -4.686 1.00 0.00 C ATOM 491 C GLY A 33 -17.168 -8.756 -6.160 1.00 0.00 C ATOM 492 O GLY A 33 -16.252 -9.172 -6.867 1.00 0.00 O ATOM 0 H GLY A 33 -18.302 -8.081 -3.298 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -15.907 -8.515 -4.491 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.229 -9.640 -4.249 1.00 0.00 H new ATOM 496 N THR A 34 -18.436 -8.763 -6.609 1.00 0.00 N ATOM 497 CA THR A 34 -18.798 -8.867 -7.988 1.00 0.00 C ATOM 498 C THR A 34 -18.286 -7.805 -8.899 1.00 0.00 C ATOM 499 O THR A 34 -17.711 -8.104 -9.944 1.00 0.00 O ATOM 500 CB THR A 34 -20.270 -9.088 -8.177 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.619 -10.255 -7.448 1.00 0.00 O ATOM 502 CG2 THR A 34 -20.658 -9.334 -9.644 1.00 0.00 C ATOM 0 H THR A 34 -19.241 -8.693 -5.986 1.00 0.00 H new ATOM 0 HA THR A 34 -18.260 -9.760 -8.306 1.00 0.00 H new ATOM 0 HB THR A 34 -20.789 -8.191 -7.839 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.704 -10.033 -6.497 1.00 0.00 H new ATOM 0 HG21 THR A 34 -21.735 -9.487 -9.715 1.00 0.00 H new ATOM 0 HG22 THR A 34 -20.374 -8.470 -10.245 1.00 0.00 H new ATOM 0 HG23 THR A 34 -20.141 -10.220 -10.014 1.00 0.00 H new ATOM 510 N VAL A 35 -18.236 -6.522 -8.497 1.00 0.00 N ATOM 511 CA VAL A 35 -17.444 -5.555 -9.191 1.00 0.00 C ATOM 512 C VAL A 35 -15.969 -5.666 -9.015 1.00 0.00 C ATOM 513 O VAL A 35 -15.242 -5.258 -9.920 1.00 0.00 O ATOM 514 CB VAL A 35 -18.027 -4.184 -9.016 1.00 0.00 C ATOM 515 CG1 VAL A 35 -17.064 -3.008 -9.252 1.00 0.00 C ATOM 516 CG2 VAL A 35 -19.125 -4.091 -10.088 1.00 0.00 C ATOM 0 H VAL A 35 -18.744 -6.155 -7.692 1.00 0.00 H new ATOM 0 HA VAL A 35 -17.514 -5.795 -10.252 1.00 0.00 H new ATOM 0 HB VAL A 35 -18.349 -4.089 -7.979 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -17.593 -2.068 -9.098 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -16.231 -3.074 -8.553 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -16.685 -3.048 -10.273 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -19.607 -3.115 -10.032 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -18.682 -4.220 -11.075 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -19.866 -4.872 -9.918 1.00 0.00 H new ATOM 526 N MET A 36 -15.474 -6.173 -7.872 1.00 0.00 N ATOM 527 CA MET A 36 -14.065 -6.409 -7.923 1.00 0.00 C ATOM 528 C MET A 36 -13.577 -7.453 -8.868 1.00 0.00 C ATOM 529 O MET A 36 -12.565 -7.343 -9.558 1.00 0.00 O ATOM 530 CB MET A 36 -13.567 -6.706 -6.498 1.00 0.00 C ATOM 531 CG MET A 36 -13.691 -5.496 -5.570 1.00 0.00 C ATOM 532 SD MET A 36 -12.916 -5.891 -3.974 1.00 0.00 S ATOM 533 CE MET A 36 -13.365 -4.370 -3.088 1.00 0.00 C ATOM 0 H MET A 36 -15.973 -6.397 -7.011 1.00 0.00 H new ATOM 0 HA MET A 36 -13.644 -5.492 -8.336 1.00 0.00 H new ATOM 0 HB2 MET A 36 -14.137 -7.538 -6.083 1.00 0.00 H new ATOM 0 HB3 MET A 36 -12.525 -7.023 -6.539 1.00 0.00 H new ATOM 0 HG2 MET A 36 -13.208 -4.627 -6.018 1.00 0.00 H new ATOM 0 HG3 MET A 36 -14.740 -5.239 -5.425 1.00 0.00 H new ATOM 0 HE1 MET A 36 -12.976 -4.413 -2.071 1.00 0.00 H new ATOM 0 HE2 MET A 36 -12.938 -3.509 -3.603 1.00 0.00 H new ATOM 0 HE3 MET A 36 -14.450 -4.273 -3.058 1.00 0.00 H new ATOM 543 N ARG A 37 -14.379 -8.513 -9.077 1.00 0.00 N ATOM 544 CA ARG A 37 -14.189 -9.508 -10.086 1.00 0.00 C ATOM 545 C ARG A 37 -14.280 -8.980 -11.477 1.00 0.00 C ATOM 546 O ARG A 37 -13.403 -9.117 -12.328 1.00 0.00 O ATOM 547 CB ARG A 37 -15.240 -10.619 -9.916 1.00 0.00 C ATOM 548 CG ARG A 37 -14.788 -11.937 -10.548 1.00 0.00 C ATOM 549 CD ARG A 37 -13.696 -12.577 -9.690 1.00 0.00 C ATOM 550 NE ARG A 37 -13.342 -13.855 -10.370 1.00 0.00 N ATOM 551 CZ ARG A 37 -13.218 -15.073 -9.766 1.00 0.00 C ATOM 552 NH1 ARG A 37 -13.375 -15.440 -8.461 1.00 0.00 N ATOM 553 NH2 ARG A 37 -12.998 -16.160 -10.562 1.00 0.00 N ATOM 0 H ARG A 37 -15.208 -8.684 -8.508 1.00 0.00 H new ATOM 0 HA ARG A 37 -13.176 -9.887 -9.951 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -15.435 -10.774 -8.855 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -16.179 -10.302 -10.370 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -15.636 -12.616 -10.640 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -14.413 -11.758 -11.556 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -12.828 -11.923 -9.610 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -14.052 -12.759 -8.676 1.00 0.00 H new ATOM 0 HE ARG A 37 -13.178 -13.816 -11.376 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -13.627 -14.742 -7.762 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -13.240 -16.413 -8.185 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -12.931 -16.046 -11.573 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -12.900 -17.086 -10.145 1.00 0.00 H new ATOM 567 N SER A 38 -15.252 -8.102 -11.778 1.00 0.00 N ATOM 568 CA SER A 38 -15.355 -7.429 -13.036 1.00 0.00 C ATOM 569 C SER A 38 -14.308 -6.392 -13.258 1.00 0.00 C ATOM 570 O SER A 38 -13.972 -6.115 -14.408 1.00 0.00 O ATOM 571 CB SER A 38 -16.710 -6.718 -13.188 1.00 0.00 C ATOM 572 OG SER A 38 -17.768 -7.658 -13.066 1.00 0.00 O ATOM 0 H SER A 38 -15.993 -7.851 -11.123 1.00 0.00 H new ATOM 0 HA SER A 38 -15.231 -8.227 -13.769 1.00 0.00 H new ATOM 0 HB2 SER A 38 -16.811 -5.944 -12.428 1.00 0.00 H new ATOM 0 HB3 SER A 38 -16.763 -6.222 -14.157 1.00 0.00 H new ATOM 0 HG SER A 38 -17.899 -7.882 -12.121 1.00 0.00 H new ATOM 578 N LEU A 39 -13.606 -5.818 -12.264 1.00 0.00 N ATOM 579 CA LEU A 39 -12.492 -4.990 -12.607 1.00 0.00 C ATOM 580 C LEU A 39 -11.191 -5.716 -12.593 1.00 0.00 C ATOM 581 O LEU A 39 -10.135 -5.172 -12.911 1.00 0.00 O ATOM 582 CB LEU A 39 -12.410 -3.868 -11.558 1.00 0.00 C ATOM 583 CG LEU A 39 -13.567 -2.855 -11.585 1.00 0.00 C ATOM 584 CD1 LEU A 39 -13.613 -1.857 -10.416 1.00 0.00 C ATOM 585 CD2 LEU A 39 -13.505 -2.049 -12.894 1.00 0.00 C ATOM 0 H LEU A 39 -13.797 -5.919 -11.267 1.00 0.00 H new ATOM 0 HA LEU A 39 -12.652 -4.623 -13.621 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -12.370 -4.322 -10.568 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -11.474 -3.329 -11.700 1.00 0.00 H new ATOM 0 HG LEU A 39 -14.468 -3.462 -11.499 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -14.468 -1.192 -10.539 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -13.708 -2.401 -9.476 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -12.695 -1.269 -10.403 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -14.324 -1.330 -12.917 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -12.554 -1.519 -12.950 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -13.593 -2.727 -13.743 1.00 0.00 H new ATOM 597 N GLY A 40 -11.166 -7.054 -12.455 1.00 0.00 N ATOM 598 CA GLY A 40 -9.969 -7.808 -12.664 1.00 0.00 C ATOM 599 C GLY A 40 -9.232 -8.322 -11.475 1.00 0.00 C ATOM 600 O GLY A 40 -8.070 -8.676 -11.671 1.00 0.00 O ATOM 0 H GLY A 40 -11.978 -7.615 -12.198 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.222 -8.663 -13.292 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.281 -7.185 -13.236 1.00 0.00 H new ATOM 604 N GLN A 41 -9.819 -8.443 -10.271 1.00 0.00 N ATOM 605 CA GLN A 41 -9.230 -9.151 -9.177 1.00 0.00 C ATOM 606 C GLN A 41 -9.963 -10.417 -8.898 1.00 0.00 C ATOM 607 O GLN A 41 -11.060 -10.537 -9.443 1.00 0.00 O ATOM 608 CB GLN A 41 -9.157 -8.234 -7.945 1.00 0.00 C ATOM 609 CG GLN A 41 -8.392 -6.938 -8.226 1.00 0.00 C ATOM 610 CD GLN A 41 -6.893 -7.022 -8.472 1.00 0.00 C ATOM 611 OE1 GLN A 41 -6.061 -6.916 -7.572 1.00 0.00 O ATOM 612 NE2 GLN A 41 -6.393 -7.170 -9.729 1.00 0.00 N ATOM 0 H GLN A 41 -10.729 -8.037 -10.052 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.212 -9.438 -9.443 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.167 -7.992 -7.615 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.674 -8.768 -7.126 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.846 -6.467 -9.098 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.553 -6.268 -7.382 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -7.027 -7.263 -10.522 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.384 -7.188 -9.878 1.00 0.00 H new ATOM 621 N ASN A 42 -9.438 -11.310 -8.040 1.00 0.00 N ATOM 622 CA ASN A 42 -10.142 -12.479 -7.613 1.00 0.00 C ATOM 623 C ASN A 42 -10.293 -12.463 -6.130 1.00 0.00 C ATOM 624 O ASN A 42 -9.506 -13.083 -5.417 1.00 0.00 O ATOM 625 CB ASN A 42 -9.447 -13.806 -7.961 1.00 0.00 C ATOM 626 CG ASN A 42 -9.236 -13.669 -9.462 1.00 0.00 C ATOM 627 OD1 ASN A 42 -10.119 -13.423 -10.282 1.00 0.00 O ATOM 628 ND2 ASN A 42 -7.983 -13.917 -9.931 1.00 0.00 N ATOM 0 H ASN A 42 -8.506 -11.218 -7.635 1.00 0.00 H new ATOM 0 HA ASN A 42 -11.093 -12.440 -8.143 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -8.505 -13.926 -7.426 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -10.066 -14.668 -7.713 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -7.800 -13.895 -10.934 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -7.226 -14.125 -9.279 1.00 0.00 H new ATOM 635 N PRO A 43 -11.317 -11.893 -5.568 1.00 0.00 N ATOM 636 CA PRO A 43 -11.549 -11.887 -4.153 1.00 0.00 C ATOM 637 C PRO A 43 -12.272 -13.124 -3.742 1.00 0.00 C ATOM 638 O PRO A 43 -12.682 -13.978 -4.527 1.00 0.00 O ATOM 639 CB PRO A 43 -12.437 -10.670 -3.904 1.00 0.00 C ATOM 640 CG PRO A 43 -13.176 -10.476 -5.238 1.00 0.00 C ATOM 641 CD PRO A 43 -12.121 -10.904 -6.270 1.00 0.00 C ATOM 0 HA PRO A 43 -10.617 -11.849 -3.589 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -13.133 -10.844 -3.083 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -11.847 -9.792 -3.642 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -14.074 -11.091 -5.297 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -13.488 -9.442 -5.382 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -12.584 -11.327 -7.161 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -11.516 -10.058 -6.596 1.00 0.00 H new ATOM 649 N THR A 44 -12.430 -13.261 -2.413 1.00 0.00 N ATOM 650 CA THR A 44 -13.234 -14.177 -1.666 1.00 0.00 C ATOM 651 C THR A 44 -14.174 -13.482 -0.742 1.00 0.00 C ATOM 652 O THR A 44 -13.958 -12.376 -0.249 1.00 0.00 O ATOM 653 CB THR A 44 -12.551 -15.206 -0.813 1.00 0.00 C ATOM 654 OG1 THR A 44 -11.711 -14.632 0.177 1.00 0.00 O ATOM 655 CG2 THR A 44 -11.734 -16.084 -1.776 1.00 0.00 C ATOM 0 H THR A 44 -11.922 -12.642 -1.782 1.00 0.00 H new ATOM 0 HA THR A 44 -13.714 -14.701 -2.493 1.00 0.00 H new ATOM 0 HB THR A 44 -13.293 -15.783 -0.261 1.00 0.00 H new ATOM 0 HG1 THR A 44 -11.293 -15.344 0.704 1.00 0.00 H new ATOM 0 HG21 THR A 44 -11.212 -16.856 -1.210 1.00 0.00 H new ATOM 0 HG22 THR A 44 -12.403 -16.553 -2.497 1.00 0.00 H new ATOM 0 HG23 THR A 44 -11.007 -15.466 -2.304 1.00 0.00 H new ATOM 663 N GLU A 45 -15.199 -14.205 -0.259 1.00 0.00 N ATOM 664 CA GLU A 45 -16.241 -13.773 0.620 1.00 0.00 C ATOM 665 C GLU A 45 -15.638 -13.350 1.914 1.00 0.00 C ATOM 666 O GLU A 45 -15.790 -12.239 2.420 1.00 0.00 O ATOM 667 CB GLU A 45 -17.448 -14.721 0.726 1.00 0.00 C ATOM 668 CG GLU A 45 -18.477 -14.489 -0.382 1.00 0.00 C ATOM 669 CD GLU A 45 -19.354 -15.720 -0.557 1.00 0.00 C ATOM 670 OE1 GLU A 45 -18.804 -16.800 -0.904 1.00 0.00 O ATOM 671 OE2 GLU A 45 -20.586 -15.666 -0.297 1.00 0.00 O ATOM 0 H GLU A 45 -15.307 -15.188 -0.510 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.721 -12.901 0.176 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.100 -15.753 0.683 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.927 -14.586 1.696 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -19.096 -13.626 -0.138 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -17.968 -14.261 -1.318 1.00 0.00 H new ATOM 678 N ALA A 46 -14.833 -14.194 2.584 1.00 0.00 N ATOM 679 CA ALA A 46 -14.285 -13.922 3.877 1.00 0.00 C ATOM 680 C ALA A 46 -13.352 -12.765 3.985 1.00 0.00 C ATOM 681 O ALA A 46 -13.325 -12.021 4.964 1.00 0.00 O ATOM 682 CB ALA A 46 -13.776 -15.256 4.448 1.00 0.00 C ATOM 0 H ALA A 46 -14.553 -15.101 2.211 1.00 0.00 H new ATOM 0 HA ALA A 46 -15.079 -13.533 4.514 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -13.349 -15.089 5.437 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -14.605 -15.959 4.525 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -13.012 -15.667 3.788 1.00 0.00 H new ATOM 688 N GLU A 47 -12.428 -12.615 3.020 1.00 0.00 N ATOM 689 CA GLU A 47 -11.474 -11.550 3.048 1.00 0.00 C ATOM 690 C GLU A 47 -12.119 -10.232 2.793 1.00 0.00 C ATOM 691 O GLU A 47 -11.623 -9.245 3.336 1.00 0.00 O ATOM 692 CB GLU A 47 -10.360 -11.645 1.992 1.00 0.00 C ATOM 693 CG GLU A 47 -9.163 -12.556 2.270 1.00 0.00 C ATOM 694 CD GLU A 47 -8.472 -11.959 3.488 1.00 0.00 C ATOM 695 OE1 GLU A 47 -7.622 -11.052 3.286 1.00 0.00 O ATOM 696 OE2 GLU A 47 -8.838 -12.381 4.617 1.00 0.00 O ATOM 0 H GLU A 47 -12.341 -13.236 2.215 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.046 -11.639 4.047 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -10.816 -11.974 1.058 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -9.978 -10.638 1.823 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.485 -13.579 2.464 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -8.489 -12.591 1.414 1.00 0.00 H new ATOM 703 N LEU A 48 -13.234 -10.155 2.045 1.00 0.00 N ATOM 704 CA LEU A 48 -13.994 -8.944 2.004 1.00 0.00 C ATOM 705 C LEU A 48 -14.565 -8.697 3.358 1.00 0.00 C ATOM 706 O LEU A 48 -14.581 -7.541 3.778 1.00 0.00 O ATOM 707 CB LEU A 48 -14.942 -8.927 0.793 1.00 0.00 C ATOM 708 CG LEU A 48 -14.378 -8.651 -0.610 1.00 0.00 C ATOM 709 CD1 LEU A 48 -15.270 -9.191 -1.740 1.00 0.00 C ATOM 710 CD2 LEU A 48 -14.125 -7.134 -0.660 1.00 0.00 C ATOM 0 H LEU A 48 -13.605 -10.917 1.477 1.00 0.00 H new ATOM 0 HA LEU A 48 -13.380 -8.065 1.807 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -15.444 -9.894 0.758 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -15.708 -8.177 0.990 1.00 0.00 H new ATOM 0 HG LEU A 48 -13.448 -9.192 -0.783 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -14.815 -8.963 -2.704 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -15.376 -10.271 -1.635 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -16.253 -8.723 -1.683 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -13.721 -6.865 -1.636 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -15.063 -6.603 -0.497 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -13.412 -6.858 0.117 1.00 0.00 H new ATOM 722 N GLN A 49 -15.143 -9.668 4.087 1.00 0.00 N ATOM 723 CA GLN A 49 -15.771 -9.382 5.340 1.00 0.00 C ATOM 724 C GLN A 49 -14.889 -8.846 6.415 1.00 0.00 C ATOM 725 O GLN A 49 -15.226 -8.085 7.320 1.00 0.00 O ATOM 726 CB GLN A 49 -16.466 -10.693 5.746 1.00 0.00 C ATOM 727 CG GLN A 49 -17.103 -10.630 7.136 1.00 0.00 C ATOM 728 CD GLN A 49 -18.213 -11.656 7.317 1.00 0.00 C ATOM 729 OE1 GLN A 49 -18.540 -12.340 6.349 1.00 0.00 O ATOM 730 NE2 GLN A 49 -18.755 -11.816 8.554 1.00 0.00 N ATOM 0 H GLN A 49 -15.176 -10.649 3.810 1.00 0.00 H new ATOM 0 HA GLN A 49 -16.465 -8.552 5.209 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -17.235 -10.932 5.011 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -15.739 -11.505 5.723 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -16.335 -10.794 7.892 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -17.506 -9.631 7.302 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -18.449 -11.223 9.325 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -19.467 -12.529 8.710 1.00 0.00 H new ATOM 739 N ASP A 50 -13.596 -9.213 6.360 1.00 0.00 N ATOM 740 CA ASP A 50 -12.491 -8.897 7.212 1.00 0.00 C ATOM 741 C ASP A 50 -12.176 -7.442 7.255 1.00 0.00 C ATOM 742 O ASP A 50 -11.961 -6.870 8.323 1.00 0.00 O ATOM 743 CB ASP A 50 -11.221 -9.673 6.824 1.00 0.00 C ATOM 744 CG ASP A 50 -10.100 -9.644 7.853 1.00 0.00 C ATOM 745 OD1 ASP A 50 -10.276 -10.140 8.998 1.00 0.00 O ATOM 746 OD2 ASP A 50 -9.005 -9.117 7.520 1.00 0.00 O ATOM 0 H ASP A 50 -13.286 -9.822 5.603 1.00 0.00 H new ATOM 0 HA ASP A 50 -12.813 -9.203 8.207 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -11.493 -10.712 6.637 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -10.841 -9.269 5.886 1.00 0.00 H new ATOM 751 N MET A 51 -12.141 -6.816 6.065 1.00 0.00 N ATOM 752 CA MET A 51 -12.070 -5.399 5.883 1.00 0.00 C ATOM 753 C MET A 51 -13.199 -4.732 6.592 1.00 0.00 C ATOM 754 O MET A 51 -12.933 -3.815 7.367 1.00 0.00 O ATOM 755 CB MET A 51 -12.198 -5.083 4.384 1.00 0.00 C ATOM 756 CG MET A 51 -11.345 -3.933 3.844 1.00 0.00 C ATOM 757 SD MET A 51 -11.721 -3.619 2.093 1.00 0.00 S ATOM 758 CE MET A 51 -10.868 -4.919 1.154 1.00 0.00 C ATOM 0 H MET A 51 -12.163 -7.326 5.182 1.00 0.00 H new ATOM 0 HA MET A 51 -11.121 -5.039 6.280 1.00 0.00 H new ATOM 0 HB2 MET A 51 -11.946 -5.984 3.825 1.00 0.00 H new ATOM 0 HB3 MET A 51 -13.243 -4.858 4.173 1.00 0.00 H new ATOM 0 HG2 MET A 51 -11.530 -3.031 4.428 1.00 0.00 H new ATOM 0 HG3 MET A 51 -10.288 -4.174 3.956 1.00 0.00 H new ATOM 0 HE1 MET A 51 -11.057 -4.783 0.089 1.00 0.00 H new ATOM 0 HE2 MET A 51 -9.796 -4.860 1.342 1.00 0.00 H new ATOM 0 HE3 MET A 51 -11.238 -5.896 1.466 1.00 0.00 H new ATOM 768 N ILE A 52 -14.438 -5.207 6.374 1.00 0.00 N ATOM 769 CA ILE A 52 -15.627 -4.675 6.964 1.00 0.00 C ATOM 770 C ILE A 52 -15.548 -4.777 8.449 1.00 0.00 C ATOM 771 O ILE A 52 -15.748 -3.778 9.138 1.00 0.00 O ATOM 772 CB ILE A 52 -16.931 -5.304 6.572 1.00 0.00 C ATOM 773 CG1 ILE A 52 -17.041 -5.389 5.040 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.084 -4.589 7.297 1.00 0.00 C ATOM 775 CD1 ILE A 52 -18.341 -5.992 4.512 1.00 0.00 C ATOM 0 H ILE A 52 -14.619 -5.999 5.757 1.00 0.00 H new ATOM 0 HA ILE A 52 -15.645 -3.654 6.581 1.00 0.00 H new ATOM 0 HB ILE A 52 -16.991 -6.341 6.901 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -16.931 -4.386 4.628 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -16.206 -5.981 4.664 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.032 -5.046 7.012 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -17.947 -4.678 8.375 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -18.091 -3.535 7.018 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -18.319 -6.007 3.422 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -18.448 -7.010 4.887 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -19.185 -5.390 4.850 1.00 0.00 H new ATOM 787 N ASN A 53 -15.124 -5.911 9.033 1.00 0.00 N ATOM 788 CA ASN A 53 -14.911 -6.206 10.416 1.00 0.00 C ATOM 789 C ASN A 53 -13.967 -5.296 11.122 1.00 0.00 C ATOM 790 O ASN A 53 -14.168 -5.010 12.301 1.00 0.00 O ATOM 791 CB ASN A 53 -14.406 -7.646 10.609 1.00 0.00 C ATOM 792 CG ASN A 53 -14.220 -8.253 11.992 1.00 0.00 C ATOM 793 OD1 ASN A 53 -15.188 -8.391 12.737 1.00 0.00 O ATOM 794 ND2 ASN A 53 -12.986 -8.730 12.311 1.00 0.00 N ATOM 0 H ASN A 53 -14.903 -6.723 8.457 1.00 0.00 H new ATOM 0 HA ASN A 53 -15.896 -6.062 10.861 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -15.095 -8.296 10.069 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -13.443 -7.712 10.104 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -12.841 -9.221 13.193 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -12.206 -8.597 11.668 1.00 0.00 H new ATOM 801 N GLU A 54 -12.938 -4.826 10.394 1.00 0.00 N ATOM 802 CA GLU A 54 -12.038 -3.865 10.952 1.00 0.00 C ATOM 803 C GLU A 54 -12.715 -2.557 11.178 1.00 0.00 C ATOM 804 O GLU A 54 -12.508 -1.961 12.233 1.00 0.00 O ATOM 805 CB GLU A 54 -10.746 -3.625 10.152 1.00 0.00 C ATOM 806 CG GLU A 54 -9.738 -2.687 10.819 1.00 0.00 C ATOM 807 CD GLU A 54 -8.373 -2.695 10.145 1.00 0.00 C ATOM 808 OE1 GLU A 54 -8.304 -2.298 8.952 1.00 0.00 O ATOM 809 OE2 GLU A 54 -7.365 -3.062 10.807 1.00 0.00 O ATOM 0 H GLU A 54 -12.731 -5.105 9.435 1.00 0.00 H new ATOM 0 HA GLU A 54 -11.734 -4.316 11.897 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -10.263 -4.586 9.974 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.011 -3.216 9.177 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.135 -1.672 10.809 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -9.621 -2.974 11.864 1.00 0.00 H new ATOM 816 N VAL A 55 -13.493 -2.034 10.214 1.00 0.00 N ATOM 817 CA VAL A 55 -14.024 -0.712 10.338 1.00 0.00 C ATOM 818 C VAL A 55 -15.306 -0.790 11.092 1.00 0.00 C ATOM 819 O VAL A 55 -15.696 0.128 11.812 1.00 0.00 O ATOM 820 CB VAL A 55 -14.198 -0.100 8.979 1.00 0.00 C ATOM 821 CG1 VAL A 55 -15.361 -0.800 8.257 1.00 0.00 C ATOM 822 CG2 VAL A 55 -14.282 1.432 9.076 1.00 0.00 C ATOM 0 H VAL A 55 -13.753 -2.521 9.356 1.00 0.00 H new ATOM 0 HA VAL A 55 -13.338 -0.068 10.888 1.00 0.00 H new ATOM 0 HB VAL A 55 -13.323 -0.268 8.351 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -15.493 -0.360 7.268 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -15.139 -1.862 8.155 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -16.276 -0.675 8.835 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -14.408 1.853 8.079 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -15.133 1.711 9.698 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -13.365 1.819 9.520 1.00 0.00 H new ATOM 832 N ASP A 56 -16.018 -1.927 10.987 1.00 0.00 N ATOM 833 CA ASP A 56 -17.170 -2.206 11.787 1.00 0.00 C ATOM 834 C ASP A 56 -16.835 -2.448 13.218 1.00 0.00 C ATOM 835 O ASP A 56 -16.417 -3.509 13.679 1.00 0.00 O ATOM 836 CB ASP A 56 -17.998 -3.303 11.096 1.00 0.00 C ATOM 837 CG ASP A 56 -19.468 -3.248 11.489 1.00 0.00 C ATOM 838 OD1 ASP A 56 -19.993 -2.382 12.239 1.00 0.00 O ATOM 839 OD2 ASP A 56 -20.071 -4.290 11.118 1.00 0.00 O ATOM 0 H ASP A 56 -15.787 -2.671 10.329 1.00 0.00 H new ATOM 0 HA ASP A 56 -17.808 -1.324 11.849 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -17.909 -3.197 10.015 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -17.591 -4.280 11.355 1.00 0.00 H new ATOM 844 N ALA A 57 -17.045 -1.398 14.032 1.00 0.00 N ATOM 845 CA ALA A 57 -17.039 -1.388 15.462 1.00 0.00 C ATOM 846 C ALA A 57 -18.314 -1.846 16.082 1.00 0.00 C ATOM 847 O ALA A 57 -18.337 -2.400 17.180 1.00 0.00 O ATOM 848 CB ALA A 57 -16.612 0.036 15.855 1.00 0.00 C ATOM 0 H ALA A 57 -17.237 -0.471 13.652 1.00 0.00 H new ATOM 0 HA ALA A 57 -16.339 -2.124 15.857 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -16.584 0.121 16.941 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -15.622 0.244 15.449 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -17.327 0.754 15.453 1.00 0.00 H new ATOM 854 N ASP A 58 -19.440 -1.468 15.450 1.00 0.00 N ATOM 855 CA ASP A 58 -20.762 -1.700 15.942 1.00 0.00 C ATOM 856 C ASP A 58 -21.088 -3.135 15.706 1.00 0.00 C ATOM 857 O ASP A 58 -21.716 -3.820 16.511 1.00 0.00 O ATOM 858 CB ASP A 58 -21.853 -0.683 15.565 1.00 0.00 C ATOM 859 CG ASP A 58 -21.865 -0.444 14.062 1.00 0.00 C ATOM 860 OD1 ASP A 58 -21.144 0.464 13.569 1.00 0.00 O ATOM 861 OD2 ASP A 58 -22.555 -1.191 13.317 1.00 0.00 O ATOM 0 H ASP A 58 -19.427 -0.978 14.555 1.00 0.00 H new ATOM 0 HA ASP A 58 -20.758 -1.500 17.013 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -22.827 -1.050 15.888 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -21.677 0.258 16.087 1.00 0.00 H new ATOM 866 N GLY A 59 -20.664 -3.727 14.575 1.00 0.00 N ATOM 867 CA GLY A 59 -20.771 -5.092 14.163 1.00 0.00 C ATOM 868 C GLY A 59 -22.094 -5.565 13.667 1.00 0.00 C ATOM 869 O GLY A 59 -22.536 -6.670 13.978 1.00 0.00 O ATOM 0 H GLY A 59 -20.187 -3.175 13.863 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -20.037 -5.263 13.375 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -20.485 -5.720 15.007 1.00 0.00 H new ATOM 873 N ASN A 60 -22.798 -4.789 12.823 1.00 0.00 N ATOM 874 CA ASN A 60 -23.965 -5.021 12.031 1.00 0.00 C ATOM 875 C ASN A 60 -23.722 -5.949 10.891 1.00 0.00 C ATOM 876 O ASN A 60 -24.505 -6.860 10.627 1.00 0.00 O ATOM 877 CB ASN A 60 -24.805 -3.795 11.633 1.00 0.00 C ATOM 878 CG ASN A 60 -24.104 -2.946 10.582 1.00 0.00 C ATOM 879 OD1 ASN A 60 -22.930 -2.643 10.791 1.00 0.00 O ATOM 880 ND2 ASN A 60 -24.932 -2.537 9.583 1.00 0.00 N ATOM 0 H ASN A 60 -22.484 -3.830 12.678 1.00 0.00 H new ATOM 0 HA ASN A 60 -24.619 -5.529 12.740 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -25.770 -4.125 11.249 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -25.004 -3.188 12.517 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -24.593 -1.887 8.874 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -25.892 -2.880 9.543 1.00 0.00 H new ATOM 887 N GLY A 61 -22.579 -5.874 10.186 1.00 0.00 N ATOM 888 CA GLY A 61 -22.071 -6.749 9.174 1.00 0.00 C ATOM 889 C GLY A 61 -22.123 -6.176 7.800 1.00 0.00 C ATOM 890 O GLY A 61 -21.337 -6.590 6.949 1.00 0.00 O ATOM 0 H GLY A 61 -21.933 -5.102 10.349 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -21.038 -7.003 9.412 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -22.640 -7.678 9.191 1.00 0.00 H new ATOM 894 N THR A 62 -23.121 -5.316 7.529 1.00 0.00 N ATOM 895 CA THR A 62 -23.223 -4.727 6.230 1.00 0.00 C ATOM 896 C THR A 62 -22.584 -3.380 6.225 1.00 0.00 C ATOM 897 O THR A 62 -22.530 -2.756 7.283 1.00 0.00 O ATOM 898 CB THR A 62 -24.633 -4.489 5.779 1.00 0.00 C ATOM 899 OG1 THR A 62 -25.461 -3.887 6.764 1.00 0.00 O ATOM 900 CG2 THR A 62 -25.300 -5.821 5.398 1.00 0.00 C ATOM 0 H THR A 62 -23.842 -5.033 8.192 1.00 0.00 H new ATOM 0 HA THR A 62 -22.739 -5.442 5.565 1.00 0.00 H new ATOM 0 HB THR A 62 -24.547 -3.807 4.933 1.00 0.00 H new ATOM 0 HG1 THR A 62 -26.362 -3.761 6.401 1.00 0.00 H new ATOM 0 HG21 THR A 62 -26.323 -5.635 5.072 1.00 0.00 H new ATOM 0 HG22 THR A 62 -24.741 -6.289 4.588 1.00 0.00 H new ATOM 0 HG23 THR A 62 -25.309 -6.484 6.263 1.00 0.00 H new ATOM 908 N ILE A 63 -22.056 -2.875 5.096 1.00 0.00 N ATOM 909 CA ILE A 63 -21.433 -1.587 5.112 1.00 0.00 C ATOM 910 C ILE A 63 -22.170 -0.566 4.316 1.00 0.00 C ATOM 911 O ILE A 63 -22.814 -0.920 3.329 1.00 0.00 O ATOM 912 CB ILE A 63 -19.980 -1.721 4.767 1.00 0.00 C ATOM 913 CG1 ILE A 63 -19.129 -0.570 5.330 1.00 0.00 C ATOM 914 CG2 ILE A 63 -19.804 -1.867 3.246 1.00 0.00 C ATOM 915 CD1 ILE A 63 -17.642 -0.916 5.272 1.00 0.00 C ATOM 0 H ILE A 63 -22.059 -3.345 4.191 1.00 0.00 H new ATOM 0 HA ILE A 63 -21.484 -1.189 6.126 1.00 0.00 H new ATOM 0 HB ILE A 63 -19.612 -2.628 5.247 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -19.318 0.340 4.761 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -19.420 -0.367 6.361 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -18.744 -1.963 3.010 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -20.335 -2.755 2.902 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -20.208 -0.986 2.747 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -17.060 -0.088 5.675 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -17.454 -1.813 5.862 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -17.350 -1.095 4.237 1.00 0.00 H new ATOM 927 N ASP A 64 -22.030 0.712 4.712 1.00 0.00 N ATOM 928 CA ASP A 64 -22.861 1.795 4.287 1.00 0.00 C ATOM 929 C ASP A 64 -21.957 2.910 3.888 1.00 0.00 C ATOM 930 O ASP A 64 -20.742 2.723 3.943 1.00 0.00 O ATOM 931 CB ASP A 64 -23.892 2.002 5.409 1.00 0.00 C ATOM 932 CG ASP A 64 -23.304 2.142 6.807 1.00 0.00 C ATOM 933 OD1 ASP A 64 -22.761 3.225 7.149 1.00 0.00 O ATOM 934 OD2 ASP A 64 -23.353 1.146 7.578 1.00 0.00 O ATOM 0 H ASP A 64 -21.300 1.004 5.362 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.469 1.647 3.395 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -24.475 2.895 5.186 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -24.584 1.160 5.405 1.00 0.00 H new ATOM 939 N PHE A 65 -22.379 4.057 3.326 1.00 0.00 N ATOM 940 CA PHE A 65 -21.518 5.065 2.790 1.00 0.00 C ATOM 941 C PHE A 65 -20.603 5.680 3.792 1.00 0.00 C ATOM 942 O PHE A 65 -19.393 5.572 3.594 1.00 0.00 O ATOM 943 CB PHE A 65 -22.264 6.068 1.894 1.00 0.00 C ATOM 944 CG PHE A 65 -21.408 7.014 1.124 1.00 0.00 C ATOM 945 CD1 PHE A 65 -21.047 8.264 1.571 1.00 0.00 C ATOM 946 CD2 PHE A 65 -21.042 6.660 -0.153 1.00 0.00 C ATOM 947 CE1 PHE A 65 -20.328 9.153 0.807 1.00 0.00 C ATOM 948 CE2 PHE A 65 -20.227 7.453 -0.926 1.00 0.00 C ATOM 949 CZ PHE A 65 -19.967 8.715 -0.445 1.00 0.00 C ATOM 0 H PHE A 65 -23.368 4.292 3.242 1.00 0.00 H new ATOM 0 HA PHE A 65 -20.835 4.545 2.119 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -22.879 5.509 1.189 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -22.943 6.649 2.518 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -21.342 8.560 2.567 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -21.406 5.729 -0.562 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -20.063 10.136 1.169 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -19.813 7.104 -1.860 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.446 9.406 -1.092 1.00 0.00 H new ATOM 959 N PRO A 66 -20.919 6.368 4.849 1.00 0.00 N ATOM 960 CA PRO A 66 -19.891 6.954 5.659 1.00 0.00 C ATOM 961 C PRO A 66 -18.938 6.045 6.356 1.00 0.00 C ATOM 962 O PRO A 66 -17.798 6.416 6.628 1.00 0.00 O ATOM 963 CB PRO A 66 -20.681 7.912 6.548 1.00 0.00 C ATOM 964 CG PRO A 66 -22.039 7.208 6.697 1.00 0.00 C ATOM 965 CD PRO A 66 -22.281 6.565 5.322 1.00 0.00 C ATOM 0 HA PRO A 66 -19.139 7.449 5.045 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -20.196 8.060 7.513 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -20.785 8.895 6.089 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -22.015 6.459 7.489 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -22.829 7.915 6.951 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.828 5.625 5.399 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.855 7.214 4.661 1.00 0.00 H new ATOM 973 N GLU A 67 -19.411 4.815 6.627 1.00 0.00 N ATOM 974 CA GLU A 67 -18.644 3.725 7.144 1.00 0.00 C ATOM 975 C GLU A 67 -17.730 3.234 6.075 1.00 0.00 C ATOM 976 O GLU A 67 -16.527 3.123 6.303 1.00 0.00 O ATOM 977 CB GLU A 67 -19.387 2.592 7.873 1.00 0.00 C ATOM 978 CG GLU A 67 -18.641 1.879 9.002 1.00 0.00 C ATOM 979 CD GLU A 67 -19.567 1.011 9.844 1.00 0.00 C ATOM 980 OE1 GLU A 67 -20.429 1.616 10.535 1.00 0.00 O ATOM 981 OE2 GLU A 67 -19.400 -0.236 9.910 1.00 0.00 O ATOM 0 H GLU A 67 -20.389 4.568 6.475 1.00 0.00 H new ATOM 0 HA GLU A 67 -18.084 4.144 7.980 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -20.309 3.003 8.284 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -19.673 1.845 7.133 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -17.850 1.260 8.579 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -18.159 2.619 9.641 1.00 0.00 H new ATOM 988 N PHE A 68 -18.168 2.919 4.843 1.00 0.00 N ATOM 989 CA PHE A 68 -17.357 2.529 3.732 1.00 0.00 C ATOM 990 C PHE A 68 -16.313 3.542 3.410 1.00 0.00 C ATOM 991 O PHE A 68 -15.177 3.204 3.081 1.00 0.00 O ATOM 992 CB PHE A 68 -18.202 2.135 2.510 1.00 0.00 C ATOM 993 CG PHE A 68 -17.544 1.515 1.325 1.00 0.00 C ATOM 994 CD1 PHE A 68 -16.870 0.317 1.313 1.00 0.00 C ATOM 995 CD2 PHE A 68 -17.390 2.298 0.205 1.00 0.00 C ATOM 996 CE1 PHE A 68 -16.127 -0.109 0.237 1.00 0.00 C ATOM 997 CE2 PHE A 68 -16.790 1.871 -0.955 1.00 0.00 C ATOM 998 CZ PHE A 68 -16.149 0.655 -0.905 1.00 0.00 C ATOM 0 H PHE A 68 -19.160 2.939 4.608 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.820 1.630 4.034 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.970 1.443 2.855 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.714 3.033 2.165 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -16.926 -0.317 2.186 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.764 3.311 0.239 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -15.544 -1.017 0.288 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -16.820 2.460 -1.860 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.648 0.290 -1.789 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.694 4.829 3.500 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.868 5.959 3.209 1.00 0.00 C ATOM 1010 C LEU A 69 -14.770 6.112 4.204 1.00 0.00 C ATOM 1011 O LEU A 69 -13.645 6.379 3.783 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.615 7.301 3.120 1.00 0.00 C ATOM 1013 CG LEU A 69 -15.816 8.503 2.588 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -15.870 8.559 1.052 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -16.549 9.725 3.168 1.00 0.00 C ATOM 0 H LEU A 69 -17.634 5.095 3.793 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.471 5.734 2.219 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.487 7.163 2.481 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -16.984 7.551 4.114 1.00 0.00 H new ATOM 0 HG LEU A 69 -14.764 8.453 2.869 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -15.298 9.417 0.699 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -15.444 7.644 0.639 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -16.906 8.655 0.728 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -16.050 10.637 2.842 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -17.581 9.731 2.817 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -16.536 9.674 4.257 1.00 0.00 H new ATOM 1027 N THR A 70 -15.015 5.841 5.499 1.00 0.00 N ATOM 1028 CA THR A 70 -14.092 5.815 6.591 1.00 0.00 C ATOM 1029 C THR A 70 -13.268 4.574 6.556 1.00 0.00 C ATOM 1030 O THR A 70 -12.157 4.522 7.081 1.00 0.00 O ATOM 1031 CB THR A 70 -14.868 5.873 7.874 1.00 0.00 C ATOM 1032 OG1 THR A 70 -15.469 7.151 8.017 1.00 0.00 O ATOM 1033 CG2 THR A 70 -13.996 5.696 9.128 1.00 0.00 C ATOM 0 H THR A 70 -15.960 5.617 5.810 1.00 0.00 H new ATOM 0 HA THR A 70 -13.420 6.670 6.516 1.00 0.00 H new ATOM 0 HB THR A 70 -15.589 5.058 7.807 1.00 0.00 H new ATOM 0 HG1 THR A 70 -16.342 7.154 7.571 1.00 0.00 H new ATOM 0 HG21 THR A 70 -14.623 5.749 10.018 1.00 0.00 H new ATOM 0 HG22 THR A 70 -13.499 4.727 9.092 1.00 0.00 H new ATOM 0 HG23 THR A 70 -13.247 6.487 9.165 1.00 0.00 H new ATOM 1041 N MET A 71 -13.653 3.602 5.709 1.00 0.00 N ATOM 1042 CA MET A 71 -12.848 2.446 5.460 1.00 0.00 C ATOM 1043 C MET A 71 -11.775 2.784 4.483 1.00 0.00 C ATOM 1044 O MET A 71 -10.635 2.358 4.663 1.00 0.00 O ATOM 1045 CB MET A 71 -13.627 1.161 5.131 1.00 0.00 C ATOM 1046 CG MET A 71 -12.698 -0.052 5.052 1.00 0.00 C ATOM 1047 SD MET A 71 -13.691 -1.563 4.861 1.00 0.00 S ATOM 1048 CE MET A 71 -14.221 -1.057 3.199 1.00 0.00 C ATOM 0 H MET A 71 -14.532 3.618 5.191 1.00 0.00 H new ATOM 0 HA MET A 71 -12.374 2.175 6.404 1.00 0.00 H new ATOM 0 HB2 MET A 71 -14.387 0.990 5.893 1.00 0.00 H new ATOM 0 HB3 MET A 71 -14.149 1.283 4.182 1.00 0.00 H new ATOM 0 HG2 MET A 71 -12.013 0.055 4.211 1.00 0.00 H new ATOM 0 HG3 MET A 71 -12.088 -0.116 5.953 1.00 0.00 H new ATOM 0 HE1 MET A 71 -14.384 -1.942 2.584 1.00 0.00 H new ATOM 0 HE2 MET A 71 -15.148 -0.489 3.270 1.00 0.00 H new ATOM 0 HE3 MET A 71 -13.449 -0.436 2.744 1.00 0.00 H new ATOM 1058 N MET A 72 -12.099 3.424 3.345 1.00 0.00 N ATOM 1059 CA MET A 72 -11.114 3.663 2.337 1.00 0.00 C ATOM 1060 C MET A 72 -10.223 4.749 2.833 1.00 0.00 C ATOM 1061 O MET A 72 -9.064 4.757 2.419 1.00 0.00 O ATOM 1062 CB MET A 72 -11.841 4.035 1.034 1.00 0.00 C ATOM 1063 CG MET A 72 -12.709 2.880 0.530 1.00 0.00 C ATOM 1064 SD MET A 72 -13.327 3.079 -1.168 1.00 0.00 S ATOM 1065 CE MET A 72 -14.516 4.362 -0.682 1.00 0.00 C ATOM 0 H MET A 72 -13.032 3.772 3.124 1.00 0.00 H new ATOM 0 HA MET A 72 -10.500 2.787 2.129 1.00 0.00 H new ATOM 0 HB2 MET A 72 -12.464 4.914 1.201 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.110 4.303 0.271 1.00 0.00 H new ATOM 0 HG2 MET A 72 -12.131 1.958 0.586 1.00 0.00 H new ATOM 0 HG3 MET A 72 -13.560 2.764 1.201 1.00 0.00 H new ATOM 0 HE1 MET A 72 -15.304 4.431 -1.432 1.00 0.00 H new ATOM 0 HE2 MET A 72 -14.955 4.105 0.282 1.00 0.00 H new ATOM 0 HE3 MET A 72 -14.004 5.321 -0.604 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.614 5.674 3.728 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.675 6.587 4.302 1.00 0.00 C ATOM 1077 C ALA A 73 -8.773 5.941 5.297 1.00 0.00 C ATOM 1078 O ALA A 73 -7.599 6.276 5.149 1.00 0.00 O ATOM 1079 CB ALA A 73 -10.427 7.721 5.019 1.00 0.00 C ATOM 0 H ALA A 73 -11.574 5.790 4.053 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.068 6.963 3.479 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.709 8.415 5.455 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.055 8.251 4.303 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.051 7.302 5.808 1.00 0.00 H new ATOM 1234 N GLU A 83 2.261 6.962 -4.398 1.00 0.00 N ATOM 1235 CA GLU A 83 2.880 6.174 -5.418 1.00 0.00 C ATOM 1236 C GLU A 83 2.124 4.963 -5.844 1.00 0.00 C ATOM 1237 O GLU A 83 2.682 3.926 -6.199 1.00 0.00 O ATOM 1238 CB GLU A 83 4.281 5.794 -4.910 1.00 0.00 C ATOM 1239 CG GLU A 83 5.239 6.986 -4.858 1.00 0.00 C ATOM 1240 CD GLU A 83 6.639 6.519 -4.486 1.00 0.00 C ATOM 1241 OE1 GLU A 83 6.737 5.572 -3.661 1.00 0.00 O ATOM 1242 OE2 GLU A 83 7.692 7.126 -4.817 1.00 0.00 O ATOM 0 HA GLU A 83 2.915 6.781 -6.322 1.00 0.00 H new ATOM 0 HB2 GLU A 83 4.195 5.359 -3.914 1.00 0.00 H new ATOM 0 HB3 GLU A 83 4.701 5.025 -5.558 1.00 0.00 H new ATOM 0 HG2 GLU A 83 5.260 7.487 -5.826 1.00 0.00 H new ATOM 0 HG3 GLU A 83 4.885 7.715 -4.129 1.00 0.00 H new ATOM 1249 N GLU A 84 0.782 5.050 -5.797 1.00 0.00 N ATOM 1250 CA GLU A 84 -0.142 4.107 -6.347 1.00 0.00 C ATOM 1251 C GLU A 84 -0.080 3.819 -7.807 1.00 0.00 C ATOM 1252 O GLU A 84 0.282 2.732 -8.255 1.00 0.00 O ATOM 1253 CB GLU A 84 -1.572 4.301 -5.814 1.00 0.00 C ATOM 1254 CG GLU A 84 -2.639 3.312 -6.285 1.00 0.00 C ATOM 1255 CD GLU A 84 -4.014 3.720 -5.775 1.00 0.00 C ATOM 1256 OE1 GLU A 84 -4.104 3.872 -4.527 1.00 0.00 O ATOM 1257 OE2 GLU A 84 -5.051 3.794 -6.486 1.00 0.00 O ATOM 0 H GLU A 84 0.312 5.833 -5.343 1.00 0.00 H new ATOM 0 HA GLU A 84 0.242 3.167 -5.951 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -1.534 4.262 -4.725 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -1.899 5.304 -6.086 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -2.647 3.270 -7.374 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.396 2.311 -5.929 1.00 0.00 H new ATOM 1264 N ILE A 85 -0.317 4.839 -8.653 1.00 0.00 N ATOM 1265 CA ILE A 85 -0.259 4.719 -10.076 1.00 0.00 C ATOM 1266 C ILE A 85 1.145 4.737 -10.575 1.00 0.00 C ATOM 1267 O ILE A 85 1.469 4.185 -11.626 1.00 0.00 O ATOM 1268 CB ILE A 85 -1.048 5.830 -10.704 1.00 0.00 C ATOM 1269 CG1 ILE A 85 -0.329 7.188 -10.653 1.00 0.00 C ATOM 1270 CG2 ILE A 85 -2.453 5.845 -10.077 1.00 0.00 C ATOM 1271 CD1 ILE A 85 -1.171 8.434 -10.923 1.00 0.00 C ATOM 0 H ILE A 85 -0.557 5.778 -8.335 1.00 0.00 H new ATOM 0 HA ILE A 85 -0.691 3.758 -10.354 1.00 0.00 H new ATOM 0 HB ILE A 85 -1.148 5.640 -11.773 1.00 0.00 H new ATOM 0 HG12 ILE A 85 0.124 7.294 -9.667 1.00 0.00 H new ATOM 0 HG13 ILE A 85 0.485 7.167 -11.378 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -3.041 6.647 -10.522 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -2.944 4.890 -10.262 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -2.370 6.009 -9.003 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -0.541 9.321 -10.856 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -1.604 8.371 -11.921 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -1.970 8.500 -10.185 1.00 0.00 H new ATOM 1283 N ARG A 86 2.106 5.214 -9.765 1.00 0.00 N ATOM 1284 CA ARG A 86 3.481 5.013 -10.101 1.00 0.00 C ATOM 1285 C ARG A 86 3.918 3.600 -9.917 1.00 0.00 C ATOM 1286 O ARG A 86 4.538 3.000 -10.793 1.00 0.00 O ATOM 1287 CB ARG A 86 4.335 5.904 -9.183 1.00 0.00 C ATOM 1288 CG ARG A 86 4.135 7.356 -9.622 1.00 0.00 C ATOM 1289 CD ARG A 86 4.985 8.301 -8.770 1.00 0.00 C ATOM 1290 NE ARG A 86 4.647 9.697 -9.168 1.00 0.00 N ATOM 1291 CZ ARG A 86 5.382 10.352 -10.113 1.00 0.00 C ATOM 1292 NH1 ARG A 86 6.292 9.741 -10.928 1.00 0.00 N ATOM 1293 NH2 ARG A 86 5.147 11.677 -10.338 1.00 0.00 N ATOM 0 H ARG A 86 1.939 5.726 -8.899 1.00 0.00 H new ATOM 0 HA ARG A 86 3.606 5.265 -11.154 1.00 0.00 H new ATOM 0 HB2 ARG A 86 4.038 5.775 -8.142 1.00 0.00 H new ATOM 0 HB3 ARG A 86 5.387 5.626 -9.251 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.405 7.464 -10.673 1.00 0.00 H new ATOM 0 HG3 ARG A 86 3.083 7.626 -9.534 1.00 0.00 H new ATOM 0 HD2 ARG A 86 4.783 8.146 -7.710 1.00 0.00 H new ATOM 0 HD3 ARG A 86 6.046 8.105 -8.925 1.00 0.00 H new ATOM 0 HE ARG A 86 3.857 10.169 -8.729 1.00 0.00 H new ATOM 0 HH11 ARG A 86 6.454 8.737 -10.849 1.00 0.00 H new ATOM 0 HH12 ARG A 86 6.810 10.289 -11.615 1.00 0.00 H new ATOM 0 HH21 ARG A 86 4.429 12.166 -9.803 1.00 0.00 H new ATOM 0 HH22 ARG A 86 5.689 12.179 -11.041 1.00 0.00 H new ATOM 1307 N GLU A 87 3.535 2.882 -8.846 1.00 0.00 N ATOM 1308 CA GLU A 87 3.828 1.488 -8.724 1.00 0.00 C ATOM 1309 C GLU A 87 3.065 0.659 -9.698 1.00 0.00 C ATOM 1310 O GLU A 87 3.561 -0.331 -10.235 1.00 0.00 O ATOM 1311 CB GLU A 87 3.883 1.091 -7.239 1.00 0.00 C ATOM 1312 CG GLU A 87 4.272 -0.331 -6.829 1.00 0.00 C ATOM 1313 CD GLU A 87 5.760 -0.641 -6.904 1.00 0.00 C ATOM 1314 OE1 GLU A 87 6.596 -0.014 -7.608 1.00 0.00 O ATOM 1315 OE2 GLU A 87 6.169 -1.542 -6.124 1.00 0.00 O ATOM 0 H GLU A 87 3.018 3.272 -8.058 1.00 0.00 H new ATOM 0 HA GLU A 87 4.838 1.250 -9.059 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.582 1.769 -6.750 1.00 0.00 H new ATOM 0 HB3 GLU A 87 2.898 1.290 -6.816 1.00 0.00 H new ATOM 0 HG2 GLU A 87 3.932 -0.504 -5.808 1.00 0.00 H new ATOM 0 HG3 GLU A 87 3.738 -1.035 -7.467 1.00 0.00 H new ATOM 1322 N ALA A 88 1.795 0.976 -10.008 1.00 0.00 N ATOM 1323 CA ALA A 88 1.076 0.386 -11.094 1.00 0.00 C ATOM 1324 C ALA A 88 1.770 0.391 -12.412 1.00 0.00 C ATOM 1325 O ALA A 88 1.954 -0.646 -13.048 1.00 0.00 O ATOM 1326 CB ALA A 88 -0.332 0.944 -11.362 1.00 0.00 C ATOM 0 H ALA A 88 1.252 1.664 -9.487 1.00 0.00 H new ATOM 0 HA ALA A 88 1.006 -0.629 -10.703 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -0.777 0.419 -12.207 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -0.954 0.801 -10.478 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -0.264 2.008 -11.590 1.00 0.00 H new ATOM 1332 N PHE A 89 2.300 1.555 -12.829 1.00 0.00 N ATOM 1333 CA PHE A 89 3.268 1.693 -13.872 1.00 0.00 C ATOM 1334 C PHE A 89 4.486 0.839 -13.781 1.00 0.00 C ATOM 1335 O PHE A 89 4.923 0.175 -14.719 1.00 0.00 O ATOM 1336 CB PHE A 89 3.619 3.169 -14.120 1.00 0.00 C ATOM 1337 CG PHE A 89 4.094 3.322 -15.524 1.00 0.00 C ATOM 1338 CD1 PHE A 89 5.405 3.179 -15.914 1.00 0.00 C ATOM 1339 CD2 PHE A 89 3.117 3.526 -16.469 1.00 0.00 C ATOM 1340 CE1 PHE A 89 5.691 3.135 -17.258 1.00 0.00 C ATOM 1341 CE2 PHE A 89 3.411 3.678 -17.804 1.00 0.00 C ATOM 1342 CZ PHE A 89 4.691 3.344 -18.178 1.00 0.00 C ATOM 0 H PHE A 89 2.038 2.449 -12.415 1.00 0.00 H new ATOM 0 HA PHE A 89 2.756 1.290 -14.746 1.00 0.00 H new ATOM 0 HB2 PHE A 89 2.746 3.798 -13.947 1.00 0.00 H new ATOM 0 HB3 PHE A 89 4.391 3.495 -13.423 1.00 0.00 H new ATOM 0 HD1 PHE A 89 6.193 3.103 -15.180 1.00 0.00 H new ATOM 0 HD2 PHE A 89 2.085 3.568 -16.153 1.00 0.00 H new ATOM 0 HE1 PHE A 89 6.699 2.937 -17.590 1.00 0.00 H new ATOM 0 HE2 PHE A 89 2.681 4.038 -18.515 1.00 0.00 H new ATOM 0 HZ PHE A 89 4.918 3.242 -19.229 1.00 0.00 H new ATOM 1352 N ARG A 90 5.247 0.900 -12.673 1.00 0.00 N ATOM 1353 CA ARG A 90 6.497 0.233 -12.477 1.00 0.00 C ATOM 1354 C ARG A 90 6.325 -1.225 -12.729 1.00 0.00 C ATOM 1355 O ARG A 90 7.168 -1.932 -13.280 1.00 0.00 O ATOM 1356 CB ARG A 90 6.992 0.543 -11.054 1.00 0.00 C ATOM 1357 CG ARG A 90 8.499 0.416 -10.828 1.00 0.00 C ATOM 1358 CD ARG A 90 8.958 -0.996 -10.458 1.00 0.00 C ATOM 1359 NE ARG A 90 8.248 -1.557 -9.274 1.00 0.00 N ATOM 1360 CZ ARG A 90 8.226 -2.892 -8.992 1.00 0.00 C ATOM 1361 NH1 ARG A 90 9.089 -3.792 -9.547 1.00 0.00 N ATOM 1362 NH2 ARG A 90 7.318 -3.366 -8.089 1.00 0.00 N ATOM 0 H ARG A 90 4.970 1.452 -11.861 1.00 0.00 H new ATOM 0 HA ARG A 90 7.253 0.585 -13.178 1.00 0.00 H new ATOM 0 HB2 ARG A 90 6.690 1.559 -10.799 1.00 0.00 H new ATOM 0 HB3 ARG A 90 6.483 -0.125 -10.359 1.00 0.00 H new ATOM 0 HG2 ARG A 90 9.019 0.730 -11.733 1.00 0.00 H new ATOM 0 HG3 ARG A 90 8.796 1.103 -10.035 1.00 0.00 H new ATOM 0 HD2 ARG A 90 8.803 -1.656 -11.312 1.00 0.00 H new ATOM 0 HD3 ARG A 90 10.029 -0.981 -10.257 1.00 0.00 H new ATOM 0 HE ARG A 90 7.758 -0.917 -8.649 1.00 0.00 H new ATOM 0 HH11 ARG A 90 9.797 -3.477 -10.210 1.00 0.00 H new ATOM 0 HH12 ARG A 90 9.026 -4.779 -9.299 1.00 0.00 H new ATOM 0 HH21 ARG A 90 6.668 -2.725 -7.635 1.00 0.00 H new ATOM 0 HH22 ARG A 90 7.290 -4.361 -7.868 1.00 0.00 H new ATOM 1376 N VAL A 91 5.228 -1.733 -12.140 1.00 0.00 N ATOM 1377 CA VAL A 91 4.949 -3.135 -12.181 1.00 0.00 C ATOM 1378 C VAL A 91 4.626 -3.598 -13.560 1.00 0.00 C ATOM 1379 O VAL A 91 4.627 -4.808 -13.781 1.00 0.00 O ATOM 1380 CB VAL A 91 4.027 -3.757 -11.175 1.00 0.00 C ATOM 1381 CG1 VAL A 91 4.614 -3.602 -9.762 1.00 0.00 C ATOM 1382 CG2 VAL A 91 2.518 -3.482 -11.291 1.00 0.00 C ATOM 0 H VAL A 91 4.537 -1.176 -11.637 1.00 0.00 H new ATOM 0 HA VAL A 91 5.910 -3.520 -11.840 1.00 0.00 H new ATOM 0 HB VAL A 91 4.003 -4.815 -11.438 1.00 0.00 H new ATOM 0 HG11 VAL A 91 3.939 -4.056 -9.036 1.00 0.00 H new ATOM 0 HG12 VAL A 91 5.584 -4.097 -9.715 1.00 0.00 H new ATOM 0 HG13 VAL A 91 4.735 -2.543 -9.532 1.00 0.00 H new ATOM 0 HG21 VAL A 91 1.991 -4.002 -10.491 1.00 0.00 H new ATOM 0 HG22 VAL A 91 2.336 -2.410 -11.208 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.156 -3.838 -12.256 1.00 0.00 H new ATOM 1392 N PHE A 92 4.158 -2.745 -14.488 1.00 0.00 N ATOM 1393 CA PHE A 92 3.890 -3.066 -15.856 1.00 0.00 C ATOM 1394 C PHE A 92 5.101 -2.780 -16.676 1.00 0.00 C ATOM 1395 O PHE A 92 5.397 -3.643 -17.501 1.00 0.00 O ATOM 1396 CB PHE A 92 2.692 -2.397 -16.550 1.00 0.00 C ATOM 1397 CG PHE A 92 1.395 -2.721 -15.890 1.00 0.00 C ATOM 1398 CD1 PHE A 92 0.922 -4.009 -15.800 1.00 0.00 C ATOM 1399 CD2 PHE A 92 0.642 -1.668 -15.427 1.00 0.00 C ATOM 1400 CE1 PHE A 92 -0.305 -4.276 -15.241 1.00 0.00 C ATOM 1401 CE2 PHE A 92 -0.620 -1.904 -14.935 1.00 0.00 C ATOM 1402 CZ PHE A 92 -1.050 -3.204 -14.810 1.00 0.00 C ATOM 0 H PHE A 92 3.954 -1.770 -14.269 1.00 0.00 H new ATOM 0 HA PHE A 92 3.617 -4.120 -15.800 1.00 0.00 H new ATOM 0 HB2 PHE A 92 2.835 -1.316 -16.552 1.00 0.00 H new ATOM 0 HB3 PHE A 92 2.655 -2.716 -17.592 1.00 0.00 H new ATOM 0 HD1 PHE A 92 1.524 -4.824 -16.174 1.00 0.00 H new ATOM 0 HD2 PHE A 92 1.039 -0.664 -15.450 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -0.669 -5.288 -15.144 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -1.262 -1.083 -14.652 1.00 0.00 H new ATOM 0 HZ PHE A 92 -2.012 -3.390 -14.355 1.00 0.00 H new ATOM 1412 N ASP A 93 5.902 -1.719 -16.471 1.00 0.00 N ATOM 1413 CA ASP A 93 7.150 -1.564 -17.150 1.00 0.00 C ATOM 1414 C ASP A 93 8.248 -2.443 -16.657 1.00 0.00 C ATOM 1415 O ASP A 93 8.875 -2.279 -15.611 1.00 0.00 O ATOM 1416 CB ASP A 93 7.587 -0.091 -17.200 1.00 0.00 C ATOM 1417 CG ASP A 93 8.727 0.265 -18.143 1.00 0.00 C ATOM 1418 OD1 ASP A 93 9.081 -0.404 -19.151 1.00 0.00 O ATOM 1419 OD2 ASP A 93 9.281 1.371 -17.905 1.00 0.00 O ATOM 0 H ASP A 93 5.681 -0.960 -15.827 1.00 0.00 H new ATOM 0 HA ASP A 93 6.956 -1.906 -18.167 1.00 0.00 H new ATOM 0 HB2 ASP A 93 6.720 0.509 -17.476 1.00 0.00 H new ATOM 0 HB3 ASP A 93 7.875 0.210 -16.193 1.00 0.00 H new ATOM 1424 N LYS A 94 8.620 -3.458 -17.457 1.00 0.00 N ATOM 1425 CA LYS A 94 9.516 -4.525 -17.136 1.00 0.00 C ATOM 1426 C LYS A 94 10.921 -4.072 -17.336 1.00 0.00 C ATOM 1427 O LYS A 94 11.723 -4.212 -16.414 1.00 0.00 O ATOM 1428 CB LYS A 94 9.173 -5.780 -17.956 1.00 0.00 C ATOM 1429 CG LYS A 94 10.172 -6.934 -17.859 1.00 0.00 C ATOM 1430 CD LYS A 94 9.539 -8.314 -18.052 1.00 0.00 C ATOM 1431 CE LYS A 94 10.235 -9.467 -17.325 1.00 0.00 C ATOM 1432 NZ LYS A 94 10.077 -9.508 -15.854 1.00 0.00 N ATOM 0 H LYS A 94 8.262 -3.537 -18.409 1.00 0.00 H new ATOM 0 HA LYS A 94 9.406 -4.800 -16.087 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.196 -6.143 -17.637 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.080 -5.492 -19.003 1.00 0.00 H new ATOM 0 HG2 LYS A 94 10.950 -6.793 -18.609 1.00 0.00 H new ATOM 0 HG3 LYS A 94 10.659 -6.900 -16.884 1.00 0.00 H new ATOM 0 HD2 LYS A 94 8.503 -8.269 -17.717 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.519 -8.539 -19.118 1.00 0.00 H new ATOM 0 HE2 LYS A 94 9.861 -10.405 -17.735 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.300 -9.422 -17.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 10.721 -10.221 -15.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 10.303 -8.575 -15.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.096 -9.757 -15.617 1.00 0.00 H new ATOM 1446 N ASP A 95 11.312 -3.518 -18.498 1.00 0.00 N ATOM 1447 CA ASP A 95 12.675 -3.153 -18.730 1.00 0.00 C ATOM 1448 C ASP A 95 13.116 -1.788 -18.330 1.00 0.00 C ATOM 1449 O ASP A 95 14.319 -1.556 -18.224 1.00 0.00 O ATOM 1450 CB ASP A 95 12.815 -3.261 -20.258 1.00 0.00 C ATOM 1451 CG ASP A 95 11.797 -2.450 -21.047 1.00 0.00 C ATOM 1452 OD1 ASP A 95 11.834 -1.190 -21.039 1.00 0.00 O ATOM 1453 OD2 ASP A 95 10.800 -3.070 -21.503 1.00 0.00 O ATOM 0 H ASP A 95 10.684 -3.323 -19.277 1.00 0.00 H new ATOM 0 HA ASP A 95 13.296 -3.802 -18.113 1.00 0.00 H new ATOM 0 HB2 ASP A 95 13.816 -2.937 -20.542 1.00 0.00 H new ATOM 0 HB3 ASP A 95 12.726 -4.309 -20.545 1.00 0.00 H new ATOM 1458 N GLY A 96 12.133 -0.919 -18.031 1.00 0.00 N ATOM 1459 CA GLY A 96 12.357 0.395 -17.513 1.00 0.00 C ATOM 1460 C GLY A 96 12.518 1.574 -18.409 1.00 0.00 C ATOM 1461 O GLY A 96 12.794 2.691 -17.975 1.00 0.00 O ATOM 0 H GLY A 96 11.145 -1.140 -18.155 1.00 0.00 H new ATOM 0 HA2 GLY A 96 11.524 0.617 -16.846 1.00 0.00 H new ATOM 0 HA3 GLY A 96 13.254 0.342 -16.896 1.00 0.00 H new ATOM 1465 N ASN A 97 12.258 1.325 -19.705 1.00 0.00 N ATOM 1466 CA ASN A 97 12.336 2.412 -20.632 1.00 0.00 C ATOM 1467 C ASN A 97 11.293 3.469 -20.508 1.00 0.00 C ATOM 1468 O ASN A 97 11.493 4.550 -21.059 1.00 0.00 O ATOM 1469 CB ASN A 97 12.508 1.924 -22.080 1.00 0.00 C ATOM 1470 CG ASN A 97 11.301 1.236 -22.703 1.00 0.00 C ATOM 1471 OD1 ASN A 97 10.235 1.028 -22.127 1.00 0.00 O ATOM 1472 ND2 ASN A 97 11.655 0.702 -23.903 1.00 0.00 N ATOM 0 H ASN A 97 12.006 0.418 -20.098 1.00 0.00 H new ATOM 0 HA ASN A 97 13.246 2.933 -20.334 1.00 0.00 H new ATOM 0 HB2 ASN A 97 12.774 2.779 -22.701 1.00 0.00 H new ATOM 0 HB3 ASN A 97 13.351 1.233 -22.111 1.00 0.00 H new ATOM 0 HD21 ASN A 97 11.014 0.077 -24.392 1.00 0.00 H new ATOM 0 HD22 ASN A 97 12.561 0.926 -24.314 1.00 0.00 H new ATOM 1479 N GLY A 98 10.280 3.256 -19.649 1.00 0.00 N ATOM 1480 CA GLY A 98 9.216 4.192 -19.462 1.00 0.00 C ATOM 1481 C GLY A 98 7.969 4.032 -20.261 1.00 0.00 C ATOM 1482 O GLY A 98 7.149 4.946 -20.185 1.00 0.00 O ATOM 0 H GLY A 98 10.199 2.418 -19.074 1.00 0.00 H new ATOM 0 HA2 GLY A 98 8.938 4.169 -18.408 1.00 0.00 H new ATOM 0 HA3 GLY A 98 9.612 5.187 -19.665 1.00 0.00 H new ATOM 1486 N TYR A 99 7.909 2.896 -20.978 1.00 0.00 N ATOM 1487 CA TYR A 99 6.890 2.494 -21.898 1.00 0.00 C ATOM 1488 C TYR A 99 6.501 1.061 -21.780 1.00 0.00 C ATOM 1489 O TYR A 99 7.294 0.124 -21.695 1.00 0.00 O ATOM 1490 CB TYR A 99 7.301 2.586 -23.377 1.00 0.00 C ATOM 1491 CG TYR A 99 7.681 3.999 -23.658 1.00 0.00 C ATOM 1492 CD1 TYR A 99 8.979 4.385 -23.420 1.00 0.00 C ATOM 1493 CD2 TYR A 99 6.759 4.924 -24.088 1.00 0.00 C ATOM 1494 CE1 TYR A 99 9.366 5.690 -23.615 1.00 0.00 C ATOM 1495 CE2 TYR A 99 7.163 6.201 -24.398 1.00 0.00 C ATOM 1496 CZ TYR A 99 8.447 6.591 -24.099 1.00 0.00 C ATOM 1497 OH TYR A 99 8.792 7.946 -24.287 1.00 0.00 O ATOM 0 H TYR A 99 8.645 2.193 -20.905 1.00 0.00 H new ATOM 0 HA TYR A 99 6.090 3.185 -21.632 1.00 0.00 H new ATOM 0 HB2 TYR A 99 8.137 1.918 -23.583 1.00 0.00 H new ATOM 0 HB3 TYR A 99 6.479 2.276 -24.022 1.00 0.00 H new ATOM 0 HD1 TYR A 99 9.700 3.658 -23.077 1.00 0.00 H new ATOM 0 HD2 TYR A 99 5.719 4.648 -24.182 1.00 0.00 H new ATOM 0 HE1 TYR A 99 10.375 6.002 -23.392 1.00 0.00 H new ATOM 0 HE2 TYR A 99 6.479 6.890 -24.871 1.00 0.00 H new ATOM 0 HH TYR A 99 8.018 8.435 -24.637 1.00 0.00 H new ATOM 1507 N ILE A 100 5.171 0.872 -21.837 1.00 0.00 N ATOM 1508 CA ILE A 100 4.490 -0.384 -21.776 1.00 0.00 C ATOM 1509 C ILE A 100 4.234 -0.861 -23.164 1.00 0.00 C ATOM 1510 O ILE A 100 3.332 -0.249 -23.734 1.00 0.00 O ATOM 1511 CB ILE A 100 3.252 -0.444 -20.931 1.00 0.00 C ATOM 1512 CG1 ILE A 100 3.542 0.046 -19.502 1.00 0.00 C ATOM 1513 CG2 ILE A 100 2.655 -1.855 -20.802 1.00 0.00 C ATOM 1514 CD1 ILE A 100 2.307 0.482 -18.714 1.00 0.00 C ATOM 0 H ILE A 100 4.525 1.655 -21.933 1.00 0.00 H new ATOM 0 HA ILE A 100 5.164 -1.055 -21.244 1.00 0.00 H new ATOM 0 HB ILE A 100 2.536 0.196 -21.446 1.00 0.00 H new ATOM 0 HG12 ILE A 100 4.043 -0.752 -18.954 1.00 0.00 H new ATOM 0 HG13 ILE A 100 4.238 0.883 -19.554 1.00 0.00 H new ATOM 0 HG21 ILE A 100 1.763 -1.817 -20.177 1.00 0.00 H new ATOM 0 HG22 ILE A 100 2.389 -2.229 -21.791 1.00 0.00 H new ATOM 0 HG23 ILE A 100 3.389 -2.520 -20.347 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.608 0.811 -17.719 1.00 0.00 H new ATOM 0 HD12 ILE A 100 1.814 1.303 -19.235 1.00 0.00 H new ATOM 0 HD13 ILE A 100 1.617 -0.357 -18.625 1.00 0.00 H new ATOM 1526 N SER A 101 4.708 -2.012 -23.673 1.00 0.00 N ATOM 1527 CA SER A 101 4.105 -2.737 -24.748 1.00 0.00 C ATOM 1528 C SER A 101 3.107 -3.713 -24.226 1.00 0.00 C ATOM 1529 O SER A 101 3.289 -4.132 -23.084 1.00 0.00 O ATOM 1530 CB SER A 101 5.184 -3.472 -25.560 1.00 0.00 C ATOM 1531 OG SER A 101 5.795 -4.530 -24.837 1.00 0.00 O ATOM 0 H SER A 101 5.553 -2.459 -23.317 1.00 0.00 H new ATOM 0 HA SER A 101 3.591 -2.028 -25.398 1.00 0.00 H new ATOM 0 HB2 SER A 101 4.737 -3.872 -26.470 1.00 0.00 H new ATOM 0 HB3 SER A 101 5.949 -2.759 -25.867 1.00 0.00 H new ATOM 0 HG SER A 101 6.470 -4.963 -25.400 1.00 0.00 H new ATOM 1537 N ALA A 102 2.080 -4.179 -24.960 1.00 0.00 N ATOM 1538 CA ALA A 102 1.216 -5.270 -24.630 1.00 0.00 C ATOM 1539 C ALA A 102 1.882 -6.472 -24.054 1.00 0.00 C ATOM 1540 O ALA A 102 1.220 -7.081 -23.215 1.00 0.00 O ATOM 1541 CB ALA A 102 0.398 -5.678 -25.867 1.00 0.00 C ATOM 0 H ALA A 102 1.836 -3.757 -25.856 1.00 0.00 H new ATOM 0 HA ALA A 102 0.577 -4.890 -23.833 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -0.259 -6.509 -25.611 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -0.202 -4.832 -26.202 1.00 0.00 H new ATOM 0 HB3 ALA A 102 1.074 -5.982 -26.666 1.00 0.00 H new ATOM 1547 N ALA A 103 3.130 -6.745 -24.476 1.00 0.00 N ATOM 1548 CA ALA A 103 3.850 -7.863 -23.952 1.00 0.00 C ATOM 1549 C ALA A 103 4.189 -7.749 -22.505 1.00 0.00 C ATOM 1550 O ALA A 103 3.990 -8.722 -21.780 1.00 0.00 O ATOM 1551 CB ALA A 103 5.002 -8.309 -24.868 1.00 0.00 C ATOM 0 H ALA A 103 3.636 -6.198 -25.173 1.00 0.00 H new ATOM 0 HA ALA A 103 3.153 -8.701 -23.965 1.00 0.00 H new ATOM 0 HB1 ALA A 103 5.514 -9.161 -24.420 1.00 0.00 H new ATOM 0 HB2 ALA A 103 4.603 -8.595 -25.841 1.00 0.00 H new ATOM 0 HB3 ALA A 103 5.707 -7.487 -24.993 1.00 0.00 H new ATOM 1557 N GLU A 104 4.589 -6.564 -22.011 1.00 0.00 N ATOM 1558 CA GLU A 104 4.824 -6.210 -20.645 1.00 0.00 C ATOM 1559 C GLU A 104 3.535 -6.255 -19.898 1.00 0.00 C ATOM 1560 O GLU A 104 3.538 -6.629 -18.726 1.00 0.00 O ATOM 1561 CB GLU A 104 5.567 -4.863 -20.630 1.00 0.00 C ATOM 1562 CG GLU A 104 6.853 -4.825 -21.457 1.00 0.00 C ATOM 1563 CD GLU A 104 7.468 -3.440 -21.305 1.00 0.00 C ATOM 1564 OE1 GLU A 104 7.919 -3.068 -20.189 1.00 0.00 O ATOM 1565 OE2 GLU A 104 7.745 -2.843 -22.379 1.00 0.00 O ATOM 0 H GLU A 104 4.765 -5.775 -22.633 1.00 0.00 H new ATOM 0 HA GLU A 104 5.469 -6.916 -20.121 1.00 0.00 H new ATOM 0 HB2 GLU A 104 4.893 -4.089 -20.998 1.00 0.00 H new ATOM 0 HB3 GLU A 104 5.809 -4.610 -19.598 1.00 0.00 H new ATOM 0 HG2 GLU A 104 7.549 -5.591 -21.115 1.00 0.00 H new ATOM 0 HG3 GLU A 104 6.639 -5.034 -22.505 1.00 0.00 H new ATOM 1572 N LEU A 105 2.349 -6.104 -20.513 1.00 0.00 N ATOM 1573 CA LEU A 105 1.042 -6.139 -19.933 1.00 0.00 C ATOM 1574 C LEU A 105 0.624 -7.568 -19.878 1.00 0.00 C ATOM 1575 O LEU A 105 -0.081 -8.112 -19.030 1.00 0.00 O ATOM 1576 CB LEU A 105 0.033 -5.177 -20.584 1.00 0.00 C ATOM 1577 CG LEU A 105 -1.382 -5.198 -19.980 1.00 0.00 C ATOM 1578 CD1 LEU A 105 -1.415 -4.619 -18.555 1.00 0.00 C ATOM 1579 CD2 LEU A 105 -2.384 -4.453 -20.878 1.00 0.00 C ATOM 0 H LEU A 105 2.303 -5.941 -21.519 1.00 0.00 H new ATOM 0 HA LEU A 105 1.071 -5.742 -18.918 1.00 0.00 H new ATOM 0 HB2 LEU A 105 0.425 -4.163 -20.512 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -0.039 -5.417 -21.645 1.00 0.00 H new ATOM 0 HG LEU A 105 -1.678 -6.245 -19.920 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.435 -4.655 -18.171 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -0.763 -5.206 -17.909 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -1.071 -3.585 -18.574 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -3.374 -4.486 -20.424 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.070 -3.415 -20.990 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -2.418 -4.929 -21.858 1.00 0.00 H new ATOM 1591 N ARG A 106 1.156 -8.444 -20.749 1.00 0.00 N ATOM 1592 CA ARG A 106 0.801 -9.819 -20.914 1.00 0.00 C ATOM 1593 C ARG A 106 1.539 -10.643 -19.915 1.00 0.00 C ATOM 1594 O ARG A 106 0.886 -11.451 -19.257 1.00 0.00 O ATOM 1595 CB ARG A 106 1.095 -10.281 -22.351 1.00 0.00 C ATOM 1596 CG ARG A 106 0.405 -11.594 -22.726 1.00 0.00 C ATOM 1597 CD ARG A 106 0.590 -11.954 -24.202 1.00 0.00 C ATOM 1598 NE ARG A 106 2.025 -12.229 -24.497 1.00 0.00 N ATOM 1599 CZ ARG A 106 2.430 -13.261 -25.293 1.00 0.00 C ATOM 1600 NH1 ARG A 106 1.558 -13.768 -26.213 1.00 0.00 N ATOM 1601 NH2 ARG A 106 3.570 -13.942 -24.976 1.00 0.00 N ATOM 0 H ARG A 106 1.897 -8.164 -21.391 1.00 0.00 H new ATOM 0 HA ARG A 106 -0.268 -9.943 -20.744 1.00 0.00 H new ATOM 0 HB2 ARG A 106 0.779 -9.503 -23.046 1.00 0.00 H new ATOM 0 HB3 ARG A 106 2.172 -10.399 -22.473 1.00 0.00 H new ATOM 0 HG2 ARG A 106 0.802 -12.399 -22.107 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -0.660 -11.517 -22.505 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -0.012 -12.829 -24.447 1.00 0.00 H new ATOM 0 HD3 ARG A 106 0.234 -11.137 -24.829 1.00 0.00 H new ATOM 0 HE ARG A 106 2.734 -11.621 -24.087 1.00 0.00 H new ATOM 0 HH11 ARG A 106 0.620 -13.376 -26.297 1.00 0.00 H new ATOM 0 HH12 ARG A 106 1.844 -14.539 -26.816 1.00 0.00 H new ATOM 0 HH21 ARG A 106 4.109 -13.678 -24.152 1.00 0.00 H new ATOM 0 HH22 ARG A 106 3.882 -14.715 -25.564 1.00 0.00 H new ATOM 1615 N HIS A 107 2.857 -10.427 -19.765 1.00 0.00 N ATOM 1616 CA HIS A 107 3.655 -10.906 -18.679 1.00 0.00 C ATOM 1617 C HIS A 107 3.077 -10.629 -17.333 1.00 0.00 C ATOM 1618 O HIS A 107 3.136 -11.462 -16.430 1.00 0.00 O ATOM 1619 CB HIS A 107 5.049 -10.267 -18.786 1.00 0.00 C ATOM 1620 CG HIS A 107 5.991 -10.541 -17.651 1.00 0.00 C ATOM 1621 ND1 HIS A 107 6.456 -11.770 -17.230 1.00 0.00 N ATOM 1622 CD2 HIS A 107 6.561 -9.629 -16.819 1.00 0.00 C ATOM 1623 CE1 HIS A 107 7.247 -11.533 -16.150 1.00 0.00 C ATOM 1624 NE2 HIS A 107 7.307 -10.251 -15.839 1.00 0.00 N ATOM 0 H HIS A 107 3.397 -9.887 -20.441 1.00 0.00 H new ATOM 0 HA HIS A 107 3.700 -11.992 -18.765 1.00 0.00 H new ATOM 0 HB2 HIS A 107 5.515 -10.613 -19.709 1.00 0.00 H new ATOM 0 HB3 HIS A 107 4.925 -9.188 -18.876 1.00 0.00 H new ATOM 0 HD1 HIS A 107 6.247 -12.677 -17.647 1.00 0.00 H new ATOM 0 HD2 HIS A 107 6.445 -8.559 -16.913 1.00 0.00 H new ATOM 0 HE1 HIS A 107 7.768 -12.307 -15.607 1.00 0.00 H new ATOM 1632 N VAL A 108 2.370 -9.511 -17.093 1.00 0.00 N ATOM 1633 CA VAL A 108 1.909 -9.174 -15.781 1.00 0.00 C ATOM 1634 C VAL A 108 0.661 -9.934 -15.489 1.00 0.00 C ATOM 1635 O VAL A 108 0.435 -10.294 -14.335 1.00 0.00 O ATOM 1636 CB VAL A 108 1.737 -7.709 -15.507 1.00 0.00 C ATOM 1637 CG1 VAL A 108 1.341 -7.494 -14.037 1.00 0.00 C ATOM 1638 CG2 VAL A 108 3.158 -7.126 -15.578 1.00 0.00 C ATOM 0 H VAL A 108 2.116 -8.835 -17.813 1.00 0.00 H new ATOM 0 HA VAL A 108 2.707 -9.467 -15.099 1.00 0.00 H new ATOM 0 HB VAL A 108 1.004 -7.280 -16.190 1.00 0.00 H new ATOM 0 HG11 VAL A 108 1.218 -6.428 -13.846 1.00 0.00 H new ATOM 0 HG12 VAL A 108 0.403 -8.010 -13.834 1.00 0.00 H new ATOM 0 HG13 VAL A 108 2.121 -7.891 -13.388 1.00 0.00 H new ATOM 0 HG21 VAL A 108 3.121 -6.053 -15.388 1.00 0.00 H new ATOM 0 HG22 VAL A 108 3.786 -7.606 -14.827 1.00 0.00 H new ATOM 0 HG23 VAL A 108 3.576 -7.305 -16.569 1.00 0.00 H new ATOM 1648 N MET A 109 -0.131 -10.269 -16.522 1.00 0.00 N ATOM 1649 CA MET A 109 -1.268 -11.131 -16.420 1.00 0.00 C ATOM 1650 C MET A 109 -0.913 -12.563 -16.210 1.00 0.00 C ATOM 1651 O MET A 109 -1.620 -13.252 -15.477 1.00 0.00 O ATOM 1652 CB MET A 109 -2.305 -10.842 -17.518 1.00 0.00 C ATOM 1653 CG MET A 109 -2.904 -9.439 -17.402 1.00 0.00 C ATOM 1654 SD MET A 109 -4.052 -9.263 -16.004 1.00 0.00 S ATOM 1655 CE MET A 109 -4.973 -7.767 -16.464 1.00 0.00 C ATOM 0 H MET A 109 0.027 -9.925 -17.469 1.00 0.00 H new ATOM 0 HA MET A 109 -1.784 -10.886 -15.492 1.00 0.00 H new ATOM 0 HB2 MET A 109 -1.836 -10.954 -18.495 1.00 0.00 H new ATOM 0 HB3 MET A 109 -3.104 -11.581 -17.462 1.00 0.00 H new ATOM 0 HG2 MET A 109 -2.097 -8.714 -17.294 1.00 0.00 H new ATOM 0 HG3 MET A 109 -3.428 -9.197 -18.327 1.00 0.00 H new ATOM 0 HE1 MET A 109 -5.711 -7.543 -15.694 1.00 0.00 H new ATOM 0 HE2 MET A 109 -4.282 -6.929 -16.559 1.00 0.00 H new ATOM 0 HE3 MET A 109 -5.479 -7.929 -17.416 1.00 0.00 H new ATOM 1665 N THR A 110 0.211 -13.064 -16.752 1.00 0.00 N ATOM 1666 CA THR A 110 0.688 -14.374 -16.435 1.00 0.00 C ATOM 1667 C THR A 110 1.302 -14.493 -15.082 1.00 0.00 C ATOM 1668 O THR A 110 1.306 -15.574 -14.494 1.00 0.00 O ATOM 1669 CB THR A 110 1.658 -14.936 -17.431 1.00 0.00 C ATOM 1670 OG1 THR A 110 2.704 -14.048 -17.796 1.00 0.00 O ATOM 1671 CG2 THR A 110 0.908 -15.307 -18.722 1.00 0.00 C ATOM 0 H THR A 110 0.795 -12.556 -17.416 1.00 0.00 H new ATOM 0 HA THR A 110 -0.231 -14.959 -16.463 1.00 0.00 H new ATOM 0 HB THR A 110 2.110 -15.798 -16.940 1.00 0.00 H new ATOM 0 HG1 THR A 110 2.682 -13.260 -17.214 1.00 0.00 H new ATOM 0 HG21 THR A 110 1.612 -15.716 -19.447 1.00 0.00 H new ATOM 0 HG22 THR A 110 0.144 -16.052 -18.498 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.436 -14.417 -19.137 1.00 0.00 H new ATOM 1679 N ASN A 111 1.793 -13.394 -14.483 1.00 0.00 N ATOM 1680 CA ASN A 111 2.295 -13.303 -13.147 1.00 0.00 C ATOM 1681 C ASN A 111 1.125 -13.385 -12.227 1.00 0.00 C ATOM 1682 O ASN A 111 1.190 -14.298 -11.406 1.00 0.00 O ATOM 1683 CB ASN A 111 3.058 -12.009 -12.821 1.00 0.00 C ATOM 1684 CG ASN A 111 4.450 -12.030 -13.436 1.00 0.00 C ATOM 1685 OD1 ASN A 111 4.891 -13.133 -13.754 1.00 0.00 O ATOM 1686 ND2 ASN A 111 5.085 -10.832 -13.545 1.00 0.00 N ATOM 0 H ASN A 111 1.842 -12.500 -14.972 1.00 0.00 H new ATOM 0 HA ASN A 111 3.013 -14.115 -13.029 1.00 0.00 H new ATOM 0 HB2 ASN A 111 2.503 -11.150 -13.197 1.00 0.00 H new ATOM 0 HB3 ASN A 111 3.135 -11.890 -11.740 1.00 0.00 H new ATOM 0 HD21 ASN A 111 6.030 -10.789 -13.925 1.00 0.00 H new ATOM 0 HD22 ASN A 111 4.616 -9.977 -13.247 1.00 0.00 H new ATOM 1693 N LEU A 112 0.017 -12.652 -12.436 1.00 0.00 N ATOM 1694 CA LEU A 112 -1.200 -12.666 -11.684 1.00 0.00 C ATOM 1695 C LEU A 112 -1.897 -13.960 -11.926 1.00 0.00 C ATOM 1696 O LEU A 112 -2.430 -14.446 -10.929 1.00 0.00 O ATOM 1697 CB LEU A 112 -2.133 -11.510 -12.080 1.00 0.00 C ATOM 1698 CG LEU A 112 -1.517 -10.202 -11.557 1.00 0.00 C ATOM 1699 CD1 LEU A 112 -2.346 -8.990 -12.014 1.00 0.00 C ATOM 1700 CD2 LEU A 112 -1.576 -10.215 -10.020 1.00 0.00 C ATOM 0 H LEU A 112 -0.029 -11.986 -13.207 1.00 0.00 H new ATOM 0 HA LEU A 112 -0.950 -12.547 -10.630 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -2.251 -11.469 -13.163 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -3.126 -11.660 -11.656 1.00 0.00 H new ATOM 0 HG LEU A 112 -0.497 -10.128 -11.934 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -1.893 -8.075 -11.633 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -2.371 -8.956 -13.103 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -3.362 -9.079 -11.630 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -1.143 -9.293 -9.631 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -2.614 -10.293 -9.696 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -1.013 -11.068 -9.641 1.00 0.00 H new ATOM 1712 N GLY A 113 -1.943 -14.573 -13.122 1.00 0.00 N ATOM 1713 CA GLY A 113 -2.458 -15.879 -13.399 1.00 0.00 C ATOM 1714 C GLY A 113 -3.826 -15.807 -13.985 1.00 0.00 C ATOM 1715 O GLY A 113 -4.580 -16.773 -14.090 1.00 0.00 O ATOM 0 H GLY A 113 -1.591 -14.117 -13.964 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -1.791 -16.397 -14.089 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -2.484 -16.465 -12.480 1.00 0.00 H new ATOM 1719 N GLU A 114 -4.224 -14.602 -14.430 1.00 0.00 N ATOM 1720 CA GLU A 114 -5.481 -14.321 -15.052 1.00 0.00 C ATOM 1721 C GLU A 114 -5.445 -14.592 -16.516 1.00 0.00 C ATOM 1722 O GLU A 114 -4.600 -14.068 -17.240 1.00 0.00 O ATOM 1723 CB GLU A 114 -5.775 -12.819 -14.895 1.00 0.00 C ATOM 1724 CG GLU A 114 -7.224 -12.422 -15.181 1.00 0.00 C ATOM 1725 CD GLU A 114 -8.230 -13.149 -14.300 1.00 0.00 C ATOM 1726 OE1 GLU A 114 -8.385 -12.765 -13.110 1.00 0.00 O ATOM 1727 OE2 GLU A 114 -8.969 -14.019 -14.835 1.00 0.00 O ATOM 0 H GLU A 114 -3.633 -13.775 -14.351 1.00 0.00 H new ATOM 0 HA GLU A 114 -6.234 -14.953 -14.580 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -5.523 -12.517 -13.879 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -5.120 -12.262 -15.565 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -7.335 -11.347 -15.037 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -7.451 -12.628 -16.227 1.00 0.00 H new ATOM 1734 N LYS A 115 -6.377 -15.429 -17.005 1.00 0.00 N ATOM 1735 CA LYS A 115 -6.363 -15.803 -18.386 1.00 0.00 C ATOM 1736 C LYS A 115 -6.929 -14.712 -19.229 1.00 0.00 C ATOM 1737 O LYS A 115 -8.140 -14.502 -19.258 1.00 0.00 O ATOM 1738 CB LYS A 115 -7.064 -17.150 -18.629 1.00 0.00 C ATOM 1739 CG LYS A 115 -6.828 -17.863 -19.962 1.00 0.00 C ATOM 1740 CD LYS A 115 -7.648 -19.151 -20.055 1.00 0.00 C ATOM 1741 CE LYS A 115 -7.259 -20.076 -21.210 1.00 0.00 C ATOM 1742 NZ LYS A 115 -7.338 -19.316 -22.477 1.00 0.00 N ATOM 0 H LYS A 115 -7.130 -15.842 -16.455 1.00 0.00 H new ATOM 0 HA LYS A 115 -5.324 -15.947 -18.683 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -6.763 -17.829 -17.831 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -8.137 -16.990 -18.524 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -7.095 -17.199 -20.784 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -5.769 -18.095 -20.070 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -7.545 -19.699 -19.118 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -8.701 -18.888 -20.157 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -6.250 -20.460 -21.063 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -7.926 -20.938 -21.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -7.243 -19.970 -23.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -8.256 -18.830 -22.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -6.571 -18.614 -22.509 1.00 0.00 H new ATOM 1756 N LEU A 116 -6.043 -13.989 -19.937 1.00 0.00 N ATOM 1757 CA LEU A 116 -6.302 -13.073 -21.004 1.00 0.00 C ATOM 1758 C LEU A 116 -5.609 -13.608 -22.210 1.00 0.00 C ATOM 1759 O LEU A 116 -4.440 -13.993 -22.210 1.00 0.00 O ATOM 1760 CB LEU A 116 -5.740 -11.660 -20.773 1.00 0.00 C ATOM 1761 CG LEU A 116 -6.691 -10.713 -20.022 1.00 0.00 C ATOM 1762 CD1 LEU A 116 -6.731 -10.953 -18.504 1.00 0.00 C ATOM 1763 CD2 LEU A 116 -6.431 -9.227 -20.323 1.00 0.00 C ATOM 0 H LEU A 116 -5.044 -14.055 -19.740 1.00 0.00 H new ATOM 0 HA LEU A 116 -7.385 -12.986 -21.097 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -4.809 -11.740 -20.212 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.494 -11.218 -21.738 1.00 0.00 H new ATOM 0 HG LEU A 116 -7.676 -10.964 -20.415 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -7.423 -10.248 -18.042 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -7.064 -11.972 -18.305 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -5.734 -10.809 -18.087 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -7.136 -8.613 -19.762 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -5.413 -8.969 -20.031 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -6.560 -9.044 -21.390 1.00 0.00 H new ATOM 1775 N THR A 117 -6.253 -13.571 -23.389 1.00 0.00 N ATOM 1776 CA THR A 117 -5.775 -13.769 -24.722 1.00 0.00 C ATOM 1777 C THR A 117 -5.075 -12.526 -25.152 1.00 0.00 C ATOM 1778 O THR A 117 -5.121 -11.430 -24.595 1.00 0.00 O ATOM 1779 CB THR A 117 -6.883 -13.973 -25.713 1.00 0.00 C ATOM 1780 OG1 THR A 117 -7.762 -12.867 -25.862 1.00 0.00 O ATOM 1781 CG2 THR A 117 -7.594 -15.291 -25.364 1.00 0.00 C ATOM 0 H THR A 117 -7.254 -13.373 -23.403 1.00 0.00 H new ATOM 0 HA THR A 117 -5.138 -14.653 -24.704 1.00 0.00 H new ATOM 0 HB THR A 117 -6.447 -14.046 -26.709 1.00 0.00 H new ATOM 0 HG1 THR A 117 -8.320 -12.782 -25.061 1.00 0.00 H new ATOM 0 HG21 THR A 117 -8.406 -15.464 -26.070 1.00 0.00 H new ATOM 0 HG22 THR A 117 -6.882 -16.114 -25.420 1.00 0.00 H new ATOM 0 HG23 THR A 117 -7.999 -15.230 -24.354 1.00 0.00 H new ATOM 1789 N ASP A 118 -4.273 -12.633 -26.227 1.00 0.00 N ATOM 1790 CA ASP A 118 -3.569 -11.564 -26.864 1.00 0.00 C ATOM 1791 C ASP A 118 -4.521 -10.500 -27.291 1.00 0.00 C ATOM 1792 O ASP A 118 -4.192 -9.349 -27.007 1.00 0.00 O ATOM 1793 CB ASP A 118 -2.756 -12.141 -28.035 1.00 0.00 C ATOM 1794 CG ASP A 118 -1.610 -12.974 -27.477 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -1.727 -14.196 -27.194 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -0.562 -12.294 -27.313 1.00 0.00 O ATOM 0 H ASP A 118 -4.106 -13.531 -26.682 1.00 0.00 H new ATOM 0 HA ASP A 118 -2.874 -11.092 -26.169 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -3.394 -12.755 -28.670 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -2.368 -11.335 -28.658 1.00 0.00 H new ATOM 1801 N GLU A 119 -5.715 -10.820 -27.821 1.00 0.00 N ATOM 1802 CA GLU A 119 -6.623 -9.794 -28.229 1.00 0.00 C ATOM 1803 C GLU A 119 -7.121 -8.929 -27.122 1.00 0.00 C ATOM 1804 O GLU A 119 -7.234 -7.719 -27.316 1.00 0.00 O ATOM 1805 CB GLU A 119 -7.906 -10.400 -28.821 1.00 0.00 C ATOM 1806 CG GLU A 119 -7.731 -11.006 -30.216 1.00 0.00 C ATOM 1807 CD GLU A 119 -8.986 -11.285 -31.031 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -9.813 -10.351 -31.206 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -9.210 -12.475 -31.380 1.00 0.00 O ATOM 0 H GLU A 119 -6.048 -11.773 -27.965 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.036 -9.209 -28.937 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.274 -11.172 -28.146 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.672 -9.626 -28.867 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -7.098 -10.335 -30.796 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.186 -11.944 -30.108 1.00 0.00 H new ATOM 1816 N GLU A 120 -7.472 -9.514 -25.964 1.00 0.00 N ATOM 1817 CA GLU A 120 -7.777 -8.893 -24.713 1.00 0.00 C ATOM 1818 C GLU A 120 -6.794 -7.902 -24.192 1.00 0.00 C ATOM 1819 O GLU A 120 -7.218 -6.849 -23.717 1.00 0.00 O ATOM 1820 CB GLU A 120 -8.033 -9.866 -23.550 1.00 0.00 C ATOM 1821 CG GLU A 120 -9.336 -10.556 -23.959 1.00 0.00 C ATOM 1822 CD GLU A 120 -9.763 -11.782 -23.166 1.00 0.00 C ATOM 1823 OE1 GLU A 120 -9.164 -12.862 -23.416 1.00 0.00 O ATOM 1824 OE2 GLU A 120 -10.690 -11.690 -22.317 1.00 0.00 O ATOM 0 H GLU A 120 -7.550 -10.529 -25.900 1.00 0.00 H new ATOM 0 HA GLU A 120 -8.688 -8.375 -25.011 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -7.217 -10.580 -23.434 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -8.135 -9.341 -22.600 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -10.139 -9.821 -23.899 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -9.248 -10.847 -25.006 1.00 0.00 H new ATOM 1831 N VAL A 121 -5.483 -8.200 -24.246 1.00 0.00 N ATOM 1832 CA VAL A 121 -4.390 -7.430 -23.739 1.00 0.00 C ATOM 1833 C VAL A 121 -4.211 -6.226 -24.598 1.00 0.00 C ATOM 1834 O VAL A 121 -4.090 -5.119 -24.077 1.00 0.00 O ATOM 1835 CB VAL A 121 -3.145 -8.261 -23.639 1.00 0.00 C ATOM 1836 CG1 VAL A 121 -1.961 -7.405 -23.158 1.00 0.00 C ATOM 1837 CG2 VAL A 121 -3.410 -9.451 -22.702 1.00 0.00 C ATOM 0 H VAL A 121 -5.161 -9.062 -24.687 1.00 0.00 H new ATOM 0 HA VAL A 121 -4.608 -7.096 -22.724 1.00 0.00 H new ATOM 0 HB VAL A 121 -2.878 -8.648 -24.622 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -1.067 -8.025 -23.092 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -1.788 -6.593 -23.865 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.188 -6.989 -22.176 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -2.510 -10.060 -22.624 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -3.685 -9.082 -21.714 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -4.223 -10.056 -23.103 1.00 0.00 H new ATOM 1847 N ASP A 122 -4.335 -6.445 -25.919 1.00 0.00 N ATOM 1848 CA ASP A 122 -4.037 -5.489 -26.941 1.00 0.00 C ATOM 1849 C ASP A 122 -5.055 -4.402 -26.898 1.00 0.00 C ATOM 1850 O ASP A 122 -4.774 -3.225 -27.116 1.00 0.00 O ATOM 1851 CB ASP A 122 -3.918 -6.155 -28.322 1.00 0.00 C ATOM 1852 CG ASP A 122 -3.428 -5.250 -29.443 1.00 0.00 C ATOM 1853 OD1 ASP A 122 -2.236 -4.866 -29.307 1.00 0.00 O ATOM 1854 OD2 ASP A 122 -4.231 -4.931 -30.360 1.00 0.00 O ATOM 0 H ASP A 122 -4.660 -7.336 -26.294 1.00 0.00 H new ATOM 0 HA ASP A 122 -3.060 -5.043 -26.755 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -3.239 -7.004 -28.240 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -4.894 -6.553 -28.600 1.00 0.00 H new ATOM 1859 N GLU A 123 -6.303 -4.740 -26.528 1.00 0.00 N ATOM 1860 CA GLU A 123 -7.482 -3.954 -26.339 1.00 0.00 C ATOM 1861 C GLU A 123 -7.226 -2.904 -25.313 1.00 0.00 C ATOM 1862 O GLU A 123 -7.571 -1.744 -25.531 1.00 0.00 O ATOM 1863 CB GLU A 123 -8.727 -4.801 -26.025 1.00 0.00 C ATOM 1864 CG GLU A 123 -10.017 -4.074 -26.410 1.00 0.00 C ATOM 1865 CD GLU A 123 -11.224 -4.998 -26.491 1.00 0.00 C ATOM 1866 OE1 GLU A 123 -11.827 -5.252 -25.414 1.00 0.00 O ATOM 1867 OE2 GLU A 123 -11.605 -5.501 -27.582 1.00 0.00 O ATOM 0 H GLU A 123 -6.509 -5.720 -26.333 1.00 0.00 H new ATOM 0 HA GLU A 123 -7.714 -3.462 -27.284 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -8.668 -5.748 -26.562 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -8.747 -5.039 -24.961 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -10.216 -3.290 -25.680 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -9.877 -3.584 -27.374 1.00 0.00 H new ATOM 1874 N MET A 124 -6.699 -3.316 -24.146 1.00 0.00 N ATOM 1875 CA MET A 124 -6.394 -2.441 -23.057 1.00 0.00 C ATOM 1876 C MET A 124 -5.337 -1.429 -23.335 1.00 0.00 C ATOM 1877 O MET A 124 -5.508 -0.244 -23.054 1.00 0.00 O ATOM 1878 CB MET A 124 -6.009 -3.227 -21.792 1.00 0.00 C ATOM 1879 CG MET A 124 -7.033 -4.237 -21.270 1.00 0.00 C ATOM 1880 SD MET A 124 -6.278 -5.297 -20.002 1.00 0.00 S ATOM 1881 CE MET A 124 -7.862 -5.769 -19.248 1.00 0.00 C ATOM 0 H MET A 124 -6.477 -4.293 -23.954 1.00 0.00 H new ATOM 0 HA MET A 124 -7.321 -1.890 -22.901 1.00 0.00 H new ATOM 0 HB2 MET A 124 -5.079 -3.759 -21.992 1.00 0.00 H new ATOM 0 HB3 MET A 124 -5.802 -2.511 -20.997 1.00 0.00 H new ATOM 0 HG2 MET A 124 -7.892 -3.712 -20.851 1.00 0.00 H new ATOM 0 HG3 MET A 124 -7.403 -4.849 -22.093 1.00 0.00 H new ATOM 0 HE1 MET A 124 -7.680 -6.444 -18.411 1.00 0.00 H new ATOM 0 HE2 MET A 124 -8.375 -4.876 -18.889 1.00 0.00 H new ATOM 0 HE3 MET A 124 -8.483 -6.271 -19.990 1.00 0.00 H new ATOM 1891 N ILE A 125 -4.282 -1.847 -24.058 1.00 0.00 N ATOM 1892 CA ILE A 125 -3.248 -0.995 -24.557 1.00 0.00 C ATOM 1893 C ILE A 125 -3.680 0.030 -25.550 1.00 0.00 C ATOM 1894 O ILE A 125 -3.325 1.196 -25.388 1.00 0.00 O ATOM 1895 CB ILE A 125 -2.202 -1.917 -25.109 1.00 0.00 C ATOM 1896 CG1 ILE A 125 -1.551 -2.868 -24.091 1.00 0.00 C ATOM 1897 CG2 ILE A 125 -1.100 -1.013 -25.689 1.00 0.00 C ATOM 1898 CD1 ILE A 125 -0.632 -2.195 -23.073 1.00 0.00 C ATOM 0 H ILE A 125 -4.144 -2.827 -24.306 1.00 0.00 H new ATOM 0 HA ILE A 125 -2.873 -0.374 -23.744 1.00 0.00 H new ATOM 0 HB ILE A 125 -2.693 -2.566 -25.835 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -2.339 -3.395 -23.553 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -0.978 -3.620 -24.634 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -0.306 -1.631 -26.108 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -1.521 -0.383 -26.472 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -0.691 -0.384 -24.898 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.222 -2.948 -22.400 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.182 -1.692 -23.595 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -1.200 -1.464 -22.497 1.00 0.00 H new ATOM 1910 N ARG A 126 -4.505 -0.336 -26.547 1.00 0.00 N ATOM 1911 CA ARG A 126 -5.025 0.547 -27.544 1.00 0.00 C ATOM 1912 C ARG A 126 -5.912 1.609 -26.991 1.00 0.00 C ATOM 1913 O ARG A 126 -5.767 2.780 -27.341 1.00 0.00 O ATOM 1914 CB ARG A 126 -5.789 -0.268 -28.601 1.00 0.00 C ATOM 1915 CG ARG A 126 -6.452 0.534 -29.723 1.00 0.00 C ATOM 1916 CD ARG A 126 -5.469 1.328 -30.583 1.00 0.00 C ATOM 1917 NE ARG A 126 -6.172 1.424 -31.893 1.00 0.00 N ATOM 1918 CZ ARG A 126 -5.652 1.940 -33.045 1.00 0.00 C ATOM 1919 NH1 ARG A 126 -4.424 2.535 -33.019 1.00 0.00 N ATOM 1920 NH2 ARG A 126 -6.396 1.993 -34.189 1.00 0.00 N ATOM 0 H ARG A 126 -4.826 -1.297 -26.663 1.00 0.00 H new ATOM 0 HA ARG A 126 -4.171 1.057 -27.991 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -5.097 -0.979 -29.051 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -6.559 -0.850 -28.094 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -7.010 -0.149 -30.363 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -7.175 1.223 -29.285 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -5.267 2.312 -30.160 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -4.510 0.818 -30.676 1.00 0.00 H new ATOM 0 HE ARG A 126 -7.129 1.072 -31.933 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -3.903 2.591 -32.144 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -4.027 2.923 -33.875 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -7.354 1.644 -34.191 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -5.993 2.382 -35.042 1.00 0.00 H new ATOM 1934 N GLU A 127 -6.817 1.263 -26.058 1.00 0.00 N ATOM 1935 CA GLU A 127 -7.502 2.181 -25.203 1.00 0.00 C ATOM 1936 C GLU A 127 -6.675 3.129 -24.404 1.00 0.00 C ATOM 1937 O GLU A 127 -7.102 4.270 -24.236 1.00 0.00 O ATOM 1938 CB GLU A 127 -8.641 1.545 -24.387 1.00 0.00 C ATOM 1939 CG GLU A 127 -9.644 0.809 -25.278 1.00 0.00 C ATOM 1940 CD GLU A 127 -10.368 1.833 -26.141 1.00 0.00 C ATOM 1941 OE1 GLU A 127 -10.978 2.848 -25.711 1.00 0.00 O ATOM 1942 OE2 GLU A 127 -10.318 1.686 -27.391 1.00 0.00 O ATOM 0 H GLU A 127 -7.084 0.293 -25.892 1.00 0.00 H new ATOM 0 HA GLU A 127 -7.964 2.840 -25.938 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -8.222 0.848 -23.661 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -9.159 2.320 -23.822 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -9.130 0.081 -25.905 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -10.358 0.256 -24.668 1.00 0.00 H new ATOM 1949 N ALA A 128 -5.481 2.750 -23.915 1.00 0.00 N ATOM 1950 CA ALA A 128 -4.599 3.671 -23.268 1.00 0.00 C ATOM 1951 C ALA A 128 -3.806 4.553 -24.170 1.00 0.00 C ATOM 1952 O ALA A 128 -3.528 5.684 -23.773 1.00 0.00 O ATOM 1953 CB ALA A 128 -3.869 2.756 -22.271 1.00 0.00 C ATOM 0 H ALA A 128 -5.124 1.796 -23.969 1.00 0.00 H new ATOM 0 HA ALA A 128 -5.094 4.492 -22.749 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -3.150 3.342 -21.698 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -4.594 2.306 -21.592 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -3.345 1.970 -22.815 1.00 0.00 H new ATOM 1959 N ASP A 129 -3.203 3.986 -25.230 1.00 0.00 N ATOM 1960 CA ASP A 129 -2.299 4.670 -26.102 1.00 0.00 C ATOM 1961 C ASP A 129 -2.972 5.880 -26.654 1.00 0.00 C ATOM 1962 O ASP A 129 -4.042 5.779 -27.252 1.00 0.00 O ATOM 1963 CB ASP A 129 -1.615 3.778 -27.151 1.00 0.00 C ATOM 1964 CG ASP A 129 -0.823 4.458 -28.259 1.00 0.00 C ATOM 1965 OD1 ASP A 129 0.081 5.290 -27.979 1.00 0.00 O ATOM 1966 OD2 ASP A 129 -1.060 4.271 -29.483 1.00 0.00 O ATOM 0 H ASP A 129 -3.351 3.011 -25.490 1.00 0.00 H new ATOM 0 HA ASP A 129 -1.445 5.000 -25.510 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -0.941 3.101 -26.626 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -2.384 3.163 -27.619 1.00 0.00 H new ATOM 1971 N ILE A 130 -2.396 7.076 -26.438 1.00 0.00 N ATOM 1972 CA ILE A 130 -2.748 8.293 -27.101 1.00 0.00 C ATOM 1973 C ILE A 130 -2.113 8.479 -28.436 1.00 0.00 C ATOM 1974 O ILE A 130 -2.734 8.660 -29.483 1.00 0.00 O ATOM 1975 CB ILE A 130 -2.485 9.436 -26.166 1.00 0.00 C ATOM 1976 CG1 ILE A 130 -3.526 9.356 -25.037 1.00 0.00 C ATOM 1977 CG2 ILE A 130 -2.513 10.810 -26.857 1.00 0.00 C ATOM 1978 CD1 ILE A 130 -3.351 10.398 -23.933 1.00 0.00 C ATOM 0 H ILE A 130 -1.642 7.200 -25.762 1.00 0.00 H new ATOM 0 HA ILE A 130 -3.810 8.248 -27.340 1.00 0.00 H new ATOM 0 HB ILE A 130 -1.473 9.344 -25.772 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.520 9.468 -25.469 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -3.482 8.363 -24.591 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -2.315 11.591 -26.123 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.750 10.842 -27.635 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.494 10.973 -27.304 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -4.129 10.265 -23.181 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -2.373 10.275 -23.469 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -3.427 11.398 -24.361 1.00 0.00 H new ATOM 1990 N ASP A 131 -0.786 8.697 -28.433 1.00 0.00 N ATOM 1991 CA ASP A 131 0.074 9.080 -29.510 1.00 0.00 C ATOM 1992 C ASP A 131 0.145 8.225 -30.727 1.00 0.00 C ATOM 1993 O ASP A 131 0.845 8.610 -31.662 1.00 0.00 O ATOM 1994 CB ASP A 131 1.388 9.601 -28.905 1.00 0.00 C ATOM 1995 CG ASP A 131 2.075 8.449 -28.185 1.00 0.00 C ATOM 1996 OD1 ASP A 131 2.250 7.344 -28.762 1.00 0.00 O ATOM 1997 OD2 ASP A 131 2.375 8.545 -26.965 1.00 0.00 O ATOM 0 H ASP A 131 -0.255 8.591 -27.569 1.00 0.00 H new ATOM 0 HA ASP A 131 -0.414 9.896 -30.043 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.034 9.999 -29.687 1.00 0.00 H new ATOM 0 HB3 ASP A 131 1.189 10.417 -28.211 1.00 0.00 H new ATOM 2002 N GLY A 132 -0.349 6.974 -30.687 1.00 0.00 N ATOM 2003 CA GLY A 132 -0.545 6.348 -31.957 1.00 0.00 C ATOM 2004 C GLY A 132 0.428 5.241 -32.173 1.00 0.00 C ATOM 2005 O GLY A 132 0.404 4.495 -33.151 1.00 0.00 O ATOM 0 H GLY A 132 -0.594 6.435 -29.856 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -1.561 5.959 -32.020 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -0.438 7.088 -32.750 1.00 0.00 H new ATOM 2009 N ASP A 133 1.386 5.115 -31.236 1.00 0.00 N ATOM 2010 CA ASP A 133 2.418 4.127 -31.292 1.00 0.00 C ATOM 2011 C ASP A 133 2.114 2.767 -30.765 1.00 0.00 C ATOM 2012 O ASP A 133 2.811 1.769 -30.939 1.00 0.00 O ATOM 2013 CB ASP A 133 3.797 4.624 -30.826 1.00 0.00 C ATOM 2014 CG ASP A 133 3.973 4.734 -29.318 1.00 0.00 C ATOM 2015 OD1 ASP A 133 3.079 4.405 -28.493 1.00 0.00 O ATOM 2016 OD2 ASP A 133 5.021 5.331 -28.956 1.00 0.00 O ATOM 0 H ASP A 133 1.444 5.718 -30.416 1.00 0.00 H new ATOM 0 HA ASP A 133 2.463 3.970 -32.370 1.00 0.00 H new ATOM 0 HB2 ASP A 133 4.559 3.949 -31.216 1.00 0.00 H new ATOM 0 HB3 ASP A 133 3.981 5.603 -31.269 1.00 0.00 H new ATOM 2021 N GLY A 134 1.021 2.622 -29.995 1.00 0.00 N ATOM 2022 CA GLY A 134 0.731 1.343 -29.425 1.00 0.00 C ATOM 2023 C GLY A 134 1.506 0.919 -28.225 1.00 0.00 C ATOM 2024 O GLY A 134 1.384 -0.211 -27.756 1.00 0.00 O ATOM 0 H GLY A 134 0.357 3.363 -29.772 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -0.327 1.327 -29.162 1.00 0.00 H new ATOM 0 HA3 GLY A 134 0.878 0.591 -30.200 1.00 0.00 H new ATOM 2028 N GLN A 135 2.334 1.777 -27.602 1.00 0.00 N ATOM 2029 CA GLN A 135 2.971 1.635 -26.329 1.00 0.00 C ATOM 2030 C GLN A 135 2.440 2.705 -25.438 1.00 0.00 C ATOM 2031 O GLN A 135 1.989 3.792 -25.797 1.00 0.00 O ATOM 2032 CB GLN A 135 4.494 1.703 -26.534 1.00 0.00 C ATOM 2033 CG GLN A 135 4.952 0.454 -27.289 1.00 0.00 C ATOM 2034 CD GLN A 135 6.399 0.029 -27.085 1.00 0.00 C ATOM 2035 OE1 GLN A 135 6.831 -0.626 -26.137 1.00 0.00 O ATOM 2036 NE2 GLN A 135 7.257 0.467 -28.046 1.00 0.00 N ATOM 0 H GLN A 135 2.582 2.664 -28.040 1.00 0.00 H new ATOM 0 HA GLN A 135 2.761 0.676 -25.856 1.00 0.00 H new ATOM 0 HB2 GLN A 135 4.759 2.600 -27.094 1.00 0.00 H new ATOM 0 HB3 GLN A 135 5.001 1.768 -25.571 1.00 0.00 H new ATOM 0 HG2 GLN A 135 4.308 -0.376 -26.997 1.00 0.00 H new ATOM 0 HG3 GLN A 135 4.793 0.622 -28.354 1.00 0.00 H new ATOM 0 HE21 GLN A 135 6.905 1.010 -28.834 1.00 0.00 H new ATOM 0 HE22 GLN A 135 8.252 0.252 -27.978 1.00 0.00 H new ATOM 2045 N VAL A 136 2.425 2.442 -24.119 1.00 0.00 N ATOM 2046 CA VAL A 136 1.737 3.233 -23.147 1.00 0.00 C ATOM 2047 C VAL A 136 2.855 3.821 -22.358 1.00 0.00 C ATOM 2048 O VAL A 136 3.442 3.092 -21.560 1.00 0.00 O ATOM 2049 CB VAL A 136 0.717 2.394 -22.436 1.00 0.00 C ATOM 2050 CG1 VAL A 136 -0.001 3.288 -21.411 1.00 0.00 C ATOM 2051 CG2 VAL A 136 -0.179 1.678 -23.461 1.00 0.00 C ATOM 0 H VAL A 136 2.913 1.644 -23.713 1.00 0.00 H new ATOM 0 HA VAL A 136 1.111 4.047 -23.514 1.00 0.00 H new ATOM 0 HB VAL A 136 1.162 1.580 -21.864 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -0.750 2.702 -20.878 1.00 0.00 H new ATOM 0 HG12 VAL A 136 0.725 3.681 -20.700 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -0.488 4.115 -21.928 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -0.917 1.071 -22.937 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -0.689 2.418 -24.078 1.00 0.00 H new ATOM 0 HG23 VAL A 136 0.434 1.037 -24.095 1.00 0.00 H new ATOM 2061 N ASN A 137 2.829 5.164 -22.289 1.00 0.00 N ATOM 2062 CA ASN A 137 3.710 5.911 -21.446 1.00 0.00 C ATOM 2063 C ASN A 137 3.039 6.327 -20.182 1.00 0.00 C ATOM 2064 O ASN A 137 1.844 6.168 -19.939 1.00 0.00 O ATOM 2065 CB ASN A 137 4.312 7.047 -22.290 1.00 0.00 C ATOM 2066 CG ASN A 137 5.397 7.960 -21.736 1.00 0.00 C ATOM 2067 OD1 ASN A 137 5.849 7.858 -20.597 1.00 0.00 O ATOM 2068 ND2 ASN A 137 5.988 8.816 -22.612 1.00 0.00 N ATOM 0 H ASN A 137 2.184 5.742 -22.829 1.00 0.00 H new ATOM 0 HA ASN A 137 4.540 5.302 -21.089 1.00 0.00 H new ATOM 0 HB2 ASN A 137 4.713 6.591 -23.195 1.00 0.00 H new ATOM 0 HB3 ASN A 137 3.485 7.687 -22.596 1.00 0.00 H new ATOM 0 HD21 ASN A 137 6.797 9.365 -22.322 1.00 0.00 H new ATOM 0 HD22 ASN A 137 5.622 8.909 -23.560 1.00 0.00 H new ATOM 2075 N TYR A 138 3.800 6.870 -19.216 1.00 0.00 N ATOM 2076 CA TYR A 138 3.245 7.234 -17.949 1.00 0.00 C ATOM 2077 C TYR A 138 2.140 8.233 -17.967 1.00 0.00 C ATOM 2078 O TYR A 138 1.106 8.205 -17.301 1.00 0.00 O ATOM 2079 CB TYR A 138 4.359 7.676 -16.986 1.00 0.00 C ATOM 2080 CG TYR A 138 3.876 7.962 -15.606 1.00 0.00 C ATOM 2081 CD1 TYR A 138 3.464 6.883 -14.859 1.00 0.00 C ATOM 2082 CD2 TYR A 138 3.800 9.270 -15.189 1.00 0.00 C ATOM 2083 CE1 TYR A 138 2.844 7.127 -13.656 1.00 0.00 C ATOM 2084 CE2 TYR A 138 3.142 9.466 -13.998 1.00 0.00 C ATOM 2085 CZ TYR A 138 2.796 8.416 -13.181 1.00 0.00 C ATOM 2086 OH TYR A 138 2.275 8.641 -11.889 1.00 0.00 O ATOM 0 H TYR A 138 4.798 7.057 -19.311 1.00 0.00 H new ATOM 0 HA TYR A 138 2.764 6.321 -17.597 1.00 0.00 H new ATOM 0 HB2 TYR A 138 5.120 6.897 -16.941 1.00 0.00 H new ATOM 0 HB3 TYR A 138 4.840 8.569 -17.386 1.00 0.00 H new ATOM 0 HD1 TYR A 138 3.623 5.873 -15.207 1.00 0.00 H new ATOM 0 HD2 TYR A 138 4.226 10.084 -15.756 1.00 0.00 H new ATOM 0 HE1 TYR A 138 2.402 6.318 -13.093 1.00 0.00 H new ATOM 0 HE2 TYR A 138 2.890 10.472 -13.696 1.00 0.00 H new ATOM 0 HH TYR A 138 2.304 9.599 -11.687 1.00 0.00 H new ATOM 2096 N GLU A 139 2.282 9.223 -18.866 1.00 0.00 N ATOM 2097 CA GLU A 139 1.256 10.193 -19.094 1.00 0.00 C ATOM 2098 C GLU A 139 0.022 9.580 -19.661 1.00 0.00 C ATOM 2099 O GLU A 139 -1.106 9.759 -19.206 1.00 0.00 O ATOM 2100 CB GLU A 139 1.631 11.396 -19.977 1.00 0.00 C ATOM 2101 CG GLU A 139 0.612 12.530 -20.096 1.00 0.00 C ATOM 2102 CD GLU A 139 1.276 13.736 -20.745 1.00 0.00 C ATOM 2103 OE1 GLU A 139 1.758 13.669 -21.908 1.00 0.00 O ATOM 2104 OE2 GLU A 139 1.367 14.775 -20.038 1.00 0.00 O ATOM 0 H GLU A 139 3.115 9.352 -19.440 1.00 0.00 H new ATOM 0 HA GLU A 139 1.088 10.582 -18.090 1.00 0.00 H new ATOM 0 HB2 GLU A 139 2.560 11.818 -19.594 1.00 0.00 H new ATOM 0 HB3 GLU A 139 1.840 11.025 -20.980 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -0.242 12.206 -20.691 1.00 0.00 H new ATOM 0 HG3 GLU A 139 0.231 12.797 -19.110 1.00 0.00 H new ATOM 2111 N GLU A 140 0.089 8.705 -20.680 1.00 0.00 N ATOM 2112 CA GLU A 140 -1.067 8.027 -21.177 1.00 0.00 C ATOM 2113 C GLU A 140 -1.824 7.148 -20.242 1.00 0.00 C ATOM 2114 O GLU A 140 -3.047 7.017 -20.205 1.00 0.00 O ATOM 2115 CB GLU A 140 -0.732 7.340 -22.512 1.00 0.00 C ATOM 2116 CG GLU A 140 0.368 8.032 -23.320 1.00 0.00 C ATOM 2117 CD GLU A 140 0.726 7.175 -24.526 1.00 0.00 C ATOM 2118 OE1 GLU A 140 0.141 7.342 -25.629 1.00 0.00 O ATOM 2119 OE2 GLU A 140 1.669 6.345 -24.430 1.00 0.00 O ATOM 0 H GLU A 140 0.954 8.465 -21.164 1.00 0.00 H new ATOM 0 HA GLU A 140 -1.799 8.821 -21.329 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -0.427 6.313 -22.312 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -1.636 7.292 -23.119 1.00 0.00 H new ATOM 0 HG2 GLU A 140 0.030 9.016 -23.647 1.00 0.00 H new ATOM 0 HG3 GLU A 140 1.249 8.188 -22.697 1.00 0.00 H new ATOM 2126 N PHE A 141 -1.096 6.494 -19.320 1.00 0.00 N ATOM 2127 CA PHE A 141 -1.608 5.641 -18.293 1.00 0.00 C ATOM 2128 C PHE A 141 -2.211 6.434 -17.184 1.00 0.00 C ATOM 2129 O PHE A 141 -3.360 6.210 -16.806 1.00 0.00 O ATOM 2130 CB PHE A 141 -0.342 4.899 -17.835 1.00 0.00 C ATOM 2131 CG PHE A 141 -0.718 3.885 -16.810 1.00 0.00 C ATOM 2132 CD1 PHE A 141 -0.714 4.210 -15.473 1.00 0.00 C ATOM 2133 CD2 PHE A 141 -0.932 2.554 -17.078 1.00 0.00 C ATOM 2134 CE1 PHE A 141 -0.603 3.303 -14.446 1.00 0.00 C ATOM 2135 CE2 PHE A 141 -0.890 1.610 -16.079 1.00 0.00 C ATOM 2136 CZ PHE A 141 -0.701 1.969 -14.765 1.00 0.00 C ATOM 0 H PHE A 141 -0.079 6.567 -19.291 1.00 0.00 H new ATOM 0 HA PHE A 141 -2.406 4.978 -18.625 1.00 0.00 H new ATOM 0 HB2 PHE A 141 0.139 4.415 -18.685 1.00 0.00 H new ATOM 0 HB3 PHE A 141 0.378 5.604 -17.420 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -0.805 5.254 -15.211 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -1.137 2.244 -18.092 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -0.445 3.626 -13.428 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -1.008 0.566 -16.331 1.00 0.00 H new ATOM 0 HZ PHE A 141 -0.631 1.215 -13.995 1.00 0.00 H new ATOM 2146 N VAL A 142 -1.628 7.562 -16.742 1.00 0.00 N ATOM 2147 CA VAL A 142 -2.273 8.508 -15.885 1.00 0.00 C ATOM 2148 C VAL A 142 -3.511 9.056 -16.507 1.00 0.00 C ATOM 2149 O VAL A 142 -4.577 9.047 -15.894 1.00 0.00 O ATOM 2150 CB VAL A 142 -1.350 9.598 -15.426 1.00 0.00 C ATOM 2151 CG1 VAL A 142 -2.145 10.796 -14.880 1.00 0.00 C ATOM 2152 CG2 VAL A 142 -0.447 8.836 -14.442 1.00 0.00 C ATOM 0 H VAL A 142 -0.674 7.825 -16.990 1.00 0.00 H new ATOM 0 HA VAL A 142 -2.570 7.962 -14.989 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.746 10.089 -16.189 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -1.454 11.573 -14.554 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -2.791 11.191 -15.664 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -2.754 10.474 -14.035 1.00 0.00 H new ATOM 0 HG21 VAL A 142 0.290 9.519 -14.021 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -1.055 8.418 -13.639 1.00 0.00 H new ATOM 0 HG23 VAL A 142 0.065 8.030 -14.967 1.00 0.00 H new ATOM 2162 N GLN A 143 -3.486 9.424 -17.801 1.00 0.00 N ATOM 2163 CA GLN A 143 -4.619 9.978 -18.474 1.00 0.00 C ATOM 2164 C GLN A 143 -5.713 8.969 -18.546 1.00 0.00 C ATOM 2165 O GLN A 143 -6.899 9.277 -18.438 1.00 0.00 O ATOM 2166 CB GLN A 143 -4.350 10.548 -19.878 1.00 0.00 C ATOM 2167 CG GLN A 143 -3.435 11.773 -19.818 1.00 0.00 C ATOM 2168 CD GLN A 143 -4.185 12.919 -19.154 1.00 0.00 C ATOM 2169 OE1 GLN A 143 -3.618 13.481 -18.219 1.00 0.00 O ATOM 2170 NE2 GLN A 143 -5.300 13.473 -19.702 1.00 0.00 N ATOM 0 H GLN A 143 -2.660 9.334 -18.392 1.00 0.00 H new ATOM 0 HA GLN A 143 -4.907 10.837 -17.868 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -3.892 9.781 -20.502 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -5.295 10.820 -20.349 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -2.530 11.540 -19.257 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -3.123 12.059 -20.822 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -5.772 13.008 -20.478 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -5.664 14.353 -19.337 1.00 0.00 H new ATOM 2179 N MET A 144 -5.458 7.661 -18.727 1.00 0.00 N ATOM 2180 CA MET A 144 -6.324 6.528 -18.623 1.00 0.00 C ATOM 2181 C MET A 144 -6.965 6.325 -17.294 1.00 0.00 C ATOM 2182 O MET A 144 -8.153 6.026 -17.180 1.00 0.00 O ATOM 2183 CB MET A 144 -5.593 5.356 -19.300 1.00 0.00 C ATOM 2184 CG MET A 144 -6.451 4.089 -19.301 1.00 0.00 C ATOM 2185 SD MET A 144 -6.354 2.997 -17.851 1.00 0.00 S ATOM 2186 CE MET A 144 -4.794 2.191 -18.315 1.00 0.00 C ATOM 0 H MET A 144 -4.516 7.364 -18.980 1.00 0.00 H new ATOM 0 HA MET A 144 -7.256 6.680 -19.167 1.00 0.00 H new ATOM 0 HB2 MET A 144 -5.340 5.627 -20.325 1.00 0.00 H new ATOM 0 HB3 MET A 144 -4.655 5.162 -18.780 1.00 0.00 H new ATOM 0 HG2 MET A 144 -7.491 4.389 -19.425 1.00 0.00 H new ATOM 0 HG3 MET A 144 -6.182 3.503 -20.180 1.00 0.00 H new ATOM 0 HE1 MET A 144 -4.523 1.458 -17.555 1.00 0.00 H new ATOM 0 HE2 MET A 144 -4.915 1.690 -19.275 1.00 0.00 H new ATOM 0 HE3 MET A 144 -4.007 2.941 -18.394 1.00 0.00 H new ATOM 2196 N MET A 145 -6.316 6.566 -16.140 1.00 0.00 N ATOM 2197 CA MET A 145 -6.832 6.451 -14.811 1.00 0.00 C ATOM 2198 C MET A 145 -7.777 7.538 -14.431 1.00 0.00 C ATOM 2199 O MET A 145 -8.653 7.318 -13.596 1.00 0.00 O ATOM 2200 CB MET A 145 -5.663 6.244 -13.833 1.00 0.00 C ATOM 2201 CG MET A 145 -5.062 4.891 -14.219 1.00 0.00 C ATOM 2202 SD MET A 145 -3.770 4.275 -13.098 1.00 0.00 S ATOM 2203 CE MET A 145 -4.808 3.630 -11.755 1.00 0.00 C ATOM 0 H MET A 145 -5.342 6.869 -16.140 1.00 0.00 H new ATOM 0 HA MET A 145 -7.468 5.567 -14.761 1.00 0.00 H new ATOM 0 HB2 MET A 145 -4.927 7.043 -13.922 1.00 0.00 H new ATOM 0 HB3 MET A 145 -6.008 6.242 -12.799 1.00 0.00 H new ATOM 0 HG2 MET A 145 -5.864 4.154 -14.264 1.00 0.00 H new ATOM 0 HG3 MET A 145 -4.644 4.969 -15.223 1.00 0.00 H new ATOM 0 HE1 MET A 145 -4.189 3.071 -11.053 1.00 0.00 H new ATOM 0 HE2 MET A 145 -5.287 4.460 -11.235 1.00 0.00 H new ATOM 0 HE3 MET A 145 -5.572 2.972 -12.169 1.00 0.00 H new