USER MOD reduce.3.24.130724 H: found=0, std=0, add=780, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 782 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 97 THR OG1 : rot 98:sc= 1.69 USER MOD Set 1.2: A 112 LYS NZ :NH3+ -169:sc= 0.497 (180deg=0) USER MOD Set 2.1: A 71 SER OG : rot 77:sc= 2.19 USER MOD Set 2.2: A 86 THR OG1 : rot 22:sc= 0.206 USER MOD Set 3.1: A 73 TYR OH : rot 10:sc= 1.27 USER MOD Set 3.2: A 83 THR OG1 : rot 120:sc= 1.07 USER MOD Set 4.1: A 47 ASN : amide:sc= 0.922 K(o=1.7,f=-0.27) USER MOD Set 4.2: A 62 GLN : amide:sc= 0.813 K(o=1.7,f=-0.27) USER MOD Set 4.3: A 64 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 57 ASN : amide:sc= 0.728 K(o=2.6,f=0.87) USER MOD Set 5.2: A 72 GLN : amide:sc= 1.32 K(o=2.6,f=0.5) USER MOD Set 5.3: A 87 SER OG : rot 58:sc= 0.594 USER MOD Set 6.1: A 42 GLN : amide:sc= 0.272 X(o=0.51,f=0.059) USER MOD Set 6.2: A 44 SER OG : rot 180:sc= 0.237 USER MOD Set 7.1: A 41 SER OG : rot 90:sc= 1.47 USER MOD Set 7.2: A 53 THR OG1 : rot -85:sc= 0.898 USER MOD Set 8.1: A 24 ASN : amide:sc= 0.564 K(o=0.6,f=0.057) USER MOD Set 8.2: A 26 TYR OH : rot 148:sc= 0.0324 USER MOD Set 9.1: A 14 ASN : amide:sc= 1.01 K(o=2.8,f=0.55) USER MOD Set 9.2: A 29 ASN : amide:sc= 1.77 K(o=2.8,f=-0.66) USER MOD Set10.1: A 12 THR OG1 : rot -80:sc= 1.78 USER MOD Set10.2: A 15 SER OG : rot 98:sc= 1.89 USER MOD Set11.1: A 6 ASN : amide:sc= 1.36 K(o=2.3,f=-12!) USER MOD Set11.2: A 9 SER OG : rot 83:sc= 0.93 USER MOD Single : A 7 THR OG1 : rot 170:sc= -0.513 USER MOD Single : A 8 ASN : amide:sc= -0.315 K(o=-0.31,f=-0.82) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 151:sc= 1.26 (180deg=0.918) USER MOD Single : A 20 SER OG : rot 75:sc= 1.04 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 81:sc= 1.93 USER MOD Single : A 31 GLN : amide:sc= -0.281 X(o=-0.28,f=-0.64) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 79:sc= 1.3 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 TYR OH : rot 80:sc=-0.00344 USER MOD Single : A 49 LYS NZ :NH3+ 169:sc= 1.24 (180deg=1.17) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 63:sc= 1.7 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 1.01 (180deg=1.01) USER MOD Single : A 61 SER OG : rot 71:sc= 1.8 USER MOD Single : A 66 THR OG1 : rot 73:sc= 1.39 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 1.07 K(o=1.1,f=-0.071) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 69:sc= 1.55 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= -0.03 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 120:sc= 0.983 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 6:sc= 0.809 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 46 N VAL A 5 10.970 -2.987 -1.779 1.00 0.00 N ATOM 47 CA VAL A 5 11.677 -1.911 -2.464 1.00 0.00 C ATOM 48 C VAL A 5 13.166 -2.224 -2.312 1.00 0.00 C ATOM 49 O VAL A 5 13.651 -2.393 -1.193 1.00 0.00 O ATOM 50 CB VAL A 5 11.272 -0.543 -1.868 1.00 0.00 C ATOM 51 CG1 VAL A 5 11.948 0.612 -2.623 1.00 0.00 C ATOM 52 CG2 VAL A 5 9.750 -0.319 -1.911 1.00 0.00 C ATOM 0 HA VAL A 5 11.425 -1.847 -3.523 1.00 0.00 H new ATOM 0 HB VAL A 5 11.602 -0.557 -0.829 1.00 0.00 H new ATOM 0 HG11 VAL A 5 11.645 1.562 -2.182 1.00 0.00 H new ATOM 0 HG12 VAL A 5 13.031 0.508 -2.553 1.00 0.00 H new ATOM 0 HG13 VAL A 5 11.649 0.586 -3.671 1.00 0.00 H new ATOM 0 HG21 VAL A 5 9.513 0.655 -1.482 1.00 0.00 H new ATOM 0 HG22 VAL A 5 9.406 -0.353 -2.945 1.00 0.00 H new ATOM 0 HG23 VAL A 5 9.251 -1.100 -1.337 1.00 0.00 H new ATOM 62 N ASN A 6 13.888 -2.343 -3.429 1.00 0.00 N ATOM 63 CA ASN A 6 15.290 -2.749 -3.437 1.00 0.00 C ATOM 64 C ASN A 6 16.054 -1.938 -4.481 1.00 0.00 C ATOM 65 O ASN A 6 15.610 -1.872 -5.630 1.00 0.00 O ATOM 66 CB ASN A 6 15.394 -4.253 -3.751 1.00 0.00 C ATOM 67 CG ASN A 6 16.844 -4.710 -3.738 1.00 0.00 C ATOM 68 OD1 ASN A 6 17.696 -4.036 -3.176 1.00 0.00 O ATOM 69 ND2 ASN A 6 17.171 -5.841 -4.342 1.00 0.00 N ATOM 0 H ASN A 6 13.511 -2.158 -4.358 1.00 0.00 H new ATOM 0 HA ASN A 6 15.727 -2.563 -2.456 1.00 0.00 H new ATOM 0 HB2 ASN A 6 14.822 -4.822 -3.018 1.00 0.00 H new ATOM 0 HB3 ASN A 6 14.953 -4.456 -4.727 1.00 0.00 H new ATOM 0 HD21 ASN A 6 18.141 -6.158 -4.342 1.00 0.00 H new ATOM 0 HD22 ASN A 6 16.453 -6.396 -4.808 1.00 0.00 H new ATOM 76 N THR A 7 17.183 -1.331 -4.108 1.00 0.00 N ATOM 77 CA THR A 7 18.048 -0.630 -5.051 1.00 0.00 C ATOM 78 C THR A 7 18.911 -1.660 -5.798 1.00 0.00 C ATOM 79 O THR A 7 18.736 -1.887 -6.998 1.00 0.00 O ATOM 80 CB THR A 7 18.888 0.432 -4.307 1.00 0.00 C ATOM 81 OG1 THR A 7 19.756 -0.140 -3.344 1.00 0.00 O ATOM 82 CG2 THR A 7 17.998 1.423 -3.563 1.00 0.00 C ATOM 0 H THR A 7 17.520 -1.313 -3.145 1.00 0.00 H new ATOM 0 HA THR A 7 17.456 -0.095 -5.793 1.00 0.00 H new ATOM 0 HB THR A 7 19.470 0.931 -5.082 1.00 0.00 H new ATOM 0 HG1 THR A 7 20.377 0.544 -3.016 1.00 0.00 H new ATOM 0 HG21 THR A 7 18.620 2.157 -3.050 1.00 0.00 H new ATOM 0 HG22 THR A 7 17.347 1.932 -4.274 1.00 0.00 H new ATOM 0 HG23 THR A 7 17.390 0.889 -2.833 1.00 0.00 H new ATOM 90 N ASN A 8 19.821 -2.299 -5.059 1.00 0.00 N ATOM 91 CA ASN A 8 20.832 -3.249 -5.526 1.00 0.00 C ATOM 92 C ASN A 8 21.310 -4.122 -4.353 1.00 0.00 C ATOM 93 O ASN A 8 22.497 -4.420 -4.207 1.00 0.00 O ATOM 94 CB ASN A 8 22.004 -2.489 -6.180 1.00 0.00 C ATOM 95 CG ASN A 8 23.006 -3.432 -6.849 1.00 0.00 C ATOM 96 OD1 ASN A 8 22.638 -4.435 -7.454 1.00 0.00 O ATOM 97 ND2 ASN A 8 24.293 -3.128 -6.774 1.00 0.00 N ATOM 0 H ASN A 8 19.874 -2.156 -4.050 1.00 0.00 H new ATOM 0 HA ASN A 8 20.397 -3.906 -6.279 1.00 0.00 H new ATOM 0 HB2 ASN A 8 21.614 -1.792 -6.921 1.00 0.00 H new ATOM 0 HB3 ASN A 8 22.517 -1.895 -5.423 1.00 0.00 H new ATOM 0 HD21 ASN A 8 24.986 -3.729 -7.221 1.00 0.00 H new ATOM 0 HD22 ASN A 8 24.591 -2.293 -6.270 1.00 0.00 H new ATOM 104 N SER A 9 20.411 -4.432 -3.423 1.00 0.00 N ATOM 105 CA SER A 9 20.665 -5.327 -2.302 1.00 0.00 C ATOM 106 C SER A 9 20.573 -6.775 -2.750 1.00 0.00 C ATOM 107 O SER A 9 19.923 -7.093 -3.753 1.00 0.00 O ATOM 108 CB SER A 9 19.629 -5.111 -1.195 1.00 0.00 C ATOM 109 OG SER A 9 19.453 -3.728 -0.968 1.00 0.00 O ATOM 0 H SER A 9 19.462 -4.057 -3.430 1.00 0.00 H new ATOM 0 HA SER A 9 21.665 -5.110 -1.927 1.00 0.00 H new ATOM 0 HB2 SER A 9 18.680 -5.566 -1.479 1.00 0.00 H new ATOM 0 HB3 SER A 9 19.956 -5.601 -0.278 1.00 0.00 H new ATOM 0 HG SER A 9 18.817 -3.368 -1.621 1.00 0.00 H new ATOM 115 N GLN A 10 21.166 -7.644 -1.940 1.00 0.00 N ATOM 116 CA GLN A 10 21.022 -9.079 -2.043 1.00 0.00 C ATOM 117 C GLN A 10 19.957 -9.465 -1.025 1.00 0.00 C ATOM 118 O GLN A 10 20.036 -9.075 0.141 1.00 0.00 O ATOM 119 CB GLN A 10 22.382 -9.755 -1.792 1.00 0.00 C ATOM 120 CG GLN A 10 22.304 -11.116 -1.088 1.00 0.00 C ATOM 121 CD GLN A 10 23.679 -11.770 -0.955 1.00 0.00 C ATOM 122 OE1 GLN A 10 24.403 -11.531 0.006 1.00 0.00 O ATOM 123 NE2 GLN A 10 24.076 -12.598 -1.910 1.00 0.00 N ATOM 0 H GLN A 10 21.775 -7.355 -1.175 1.00 0.00 H new ATOM 0 HA GLN A 10 20.710 -9.408 -3.034 1.00 0.00 H new ATOM 0 HB2 GLN A 10 22.889 -9.885 -2.748 1.00 0.00 H new ATOM 0 HB3 GLN A 10 22.999 -9.086 -1.192 1.00 0.00 H new ATOM 0 HG2 GLN A 10 21.866 -10.988 -0.098 1.00 0.00 H new ATOM 0 HG3 GLN A 10 21.641 -11.776 -1.647 1.00 0.00 H new ATOM 0 HE21 GLN A 10 23.466 -12.790 -2.705 1.00 0.00 H new ATOM 0 HE22 GLN A 10 24.992 -13.044 -1.850 1.00 0.00 H new ATOM 132 N ILE A 11 19.015 -10.285 -1.475 1.00 0.00 N ATOM 133 CA ILE A 11 18.014 -10.960 -0.665 1.00 0.00 C ATOM 134 C ILE A 11 18.049 -12.397 -1.177 1.00 0.00 C ATOM 135 O ILE A 11 17.753 -12.647 -2.349 1.00 0.00 O ATOM 136 CB ILE A 11 16.614 -10.296 -0.768 1.00 0.00 C ATOM 137 CG1 ILE A 11 16.635 -8.775 -0.479 1.00 0.00 C ATOM 138 CG2 ILE A 11 15.656 -10.964 0.235 1.00 0.00 C ATOM 139 CD1 ILE A 11 16.728 -7.911 -1.741 1.00 0.00 C ATOM 0 H ILE A 11 18.926 -10.507 -2.467 1.00 0.00 H new ATOM 0 HA ILE A 11 18.226 -10.904 0.403 1.00 0.00 H new ATOM 0 HB ILE A 11 16.281 -10.433 -1.797 1.00 0.00 H new ATOM 0 HG12 ILE A 11 15.733 -8.506 0.070 1.00 0.00 H new ATOM 0 HG13 ILE A 11 17.482 -8.549 0.169 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.673 -10.499 0.164 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.572 -12.026 0.006 1.00 0.00 H new ATOM 0 HG23 ILE A 11 16.044 -10.840 1.246 1.00 0.00 H new ATOM 0 HD11 ILE A 11 16.738 -6.858 -1.461 1.00 0.00 H new ATOM 0 HD12 ILE A 11 17.644 -8.152 -2.280 1.00 0.00 H new ATOM 0 HD13 ILE A 11 15.868 -8.108 -2.381 1.00 0.00 H new ATOM 151 N THR A 12 18.523 -13.314 -0.336 1.00 0.00 N ATOM 152 CA THR A 12 18.723 -14.712 -0.726 1.00 0.00 C ATOM 153 C THR A 12 17.380 -15.437 -0.914 1.00 0.00 C ATOM 154 O THR A 12 16.322 -14.928 -0.534 1.00 0.00 O ATOM 155 CB THR A 12 19.653 -15.423 0.279 1.00 0.00 C ATOM 156 OG1 THR A 12 19.379 -15.020 1.602 1.00 0.00 O ATOM 157 CG2 THR A 12 21.125 -15.106 0.007 1.00 0.00 C ATOM 0 H THR A 12 18.779 -13.113 0.631 1.00 0.00 H new ATOM 0 HA THR A 12 19.220 -14.739 -1.696 1.00 0.00 H new ATOM 0 HB THR A 12 19.468 -16.490 0.157 1.00 0.00 H new ATOM 0 HG1 THR A 12 19.801 -14.152 1.774 1.00 0.00 H new ATOM 0 HG21 THR A 12 21.749 -15.624 0.735 1.00 0.00 H new ATOM 0 HG22 THR A 12 21.389 -15.436 -0.998 1.00 0.00 H new ATOM 0 HG23 THR A 12 21.287 -14.031 0.090 1.00 0.00 H new ATOM 165 N ALA A 13 17.424 -16.647 -1.485 1.00 0.00 N ATOM 166 CA ALA A 13 16.257 -17.428 -1.891 1.00 0.00 C ATOM 167 C ALA A 13 15.243 -17.685 -0.767 1.00 0.00 C ATOM 168 O ALA A 13 14.060 -17.874 -1.059 1.00 0.00 O ATOM 169 CB ALA A 13 16.740 -18.772 -2.445 1.00 0.00 C ATOM 0 H ALA A 13 18.305 -17.122 -1.682 1.00 0.00 H new ATOM 0 HA ALA A 13 15.732 -16.837 -2.641 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.881 -19.368 -2.753 1.00 0.00 H new ATOM 0 HB2 ALA A 13 17.389 -18.600 -3.304 1.00 0.00 H new ATOM 0 HB3 ALA A 13 17.294 -19.306 -1.673 1.00 0.00 H new ATOM 175 N ASN A 14 15.688 -17.701 0.496 1.00 0.00 N ATOM 176 CA ASN A 14 14.826 -17.949 1.662 1.00 0.00 C ATOM 177 C ASN A 14 14.775 -16.740 2.607 1.00 0.00 C ATOM 178 O ASN A 14 14.214 -16.811 3.702 1.00 0.00 O ATOM 179 CB ASN A 14 15.265 -19.234 2.380 1.00 0.00 C ATOM 180 CG ASN A 14 14.205 -19.713 3.373 1.00 0.00 C ATOM 181 OD1 ASN A 14 13.048 -19.917 3.015 1.00 0.00 O ATOM 182 ND2 ASN A 14 14.569 -19.932 4.625 1.00 0.00 N ATOM 0 H ASN A 14 16.665 -17.541 0.741 1.00 0.00 H new ATOM 0 HA ASN A 14 13.805 -18.094 1.309 1.00 0.00 H new ATOM 0 HB2 ASN A 14 15.455 -20.016 1.645 1.00 0.00 H new ATOM 0 HB3 ASN A 14 16.203 -19.056 2.906 1.00 0.00 H new ATOM 0 HD21 ASN A 14 13.887 -20.273 5.302 1.00 0.00 H new ATOM 0 HD22 ASN A 14 15.532 -19.760 4.914 1.00 0.00 H new ATOM 189 N SER A 15 15.373 -15.623 2.197 1.00 0.00 N ATOM 190 CA SER A 15 15.219 -14.350 2.875 1.00 0.00 C ATOM 191 C SER A 15 13.922 -13.677 2.417 1.00 0.00 C ATOM 192 O SER A 15 13.269 -14.136 1.474 1.00 0.00 O ATOM 193 CB SER A 15 16.420 -13.473 2.551 1.00 0.00 C ATOM 194 OG SER A 15 17.552 -13.990 3.209 1.00 0.00 O ATOM 0 H SER A 15 15.981 -15.582 1.379 1.00 0.00 H new ATOM 0 HA SER A 15 15.166 -14.502 3.953 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.589 -13.447 1.474 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.235 -12.447 2.869 1.00 0.00 H new ATOM 0 HG SER A 15 18.067 -14.545 2.587 1.00 0.00 H new ATOM 200 N GLN A 16 13.556 -12.573 3.072 1.00 0.00 N ATOM 201 CA GLN A 16 12.362 -11.799 2.761 1.00 0.00 C ATOM 202 C GLN A 16 12.670 -10.309 2.900 1.00 0.00 C ATOM 203 O GLN A 16 13.543 -9.940 3.691 1.00 0.00 O ATOM 204 CB GLN A 16 11.217 -12.188 3.713 1.00 0.00 C ATOM 205 CG GLN A 16 10.811 -13.666 3.621 1.00 0.00 C ATOM 206 CD GLN A 16 9.449 -13.907 4.269 1.00 0.00 C ATOM 207 OE1 GLN A 16 9.347 -14.333 5.418 1.00 0.00 O ATOM 208 NE2 GLN A 16 8.377 -13.631 3.546 1.00 0.00 N ATOM 0 H GLN A 16 14.095 -12.188 3.848 1.00 0.00 H new ATOM 0 HA GLN A 16 12.054 -12.011 1.737 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.517 -11.966 4.737 1.00 0.00 H new ATOM 0 HB3 GLN A 16 10.348 -11.568 3.494 1.00 0.00 H new ATOM 0 HG2 GLN A 16 10.778 -13.972 2.575 1.00 0.00 H new ATOM 0 HG3 GLN A 16 11.564 -14.284 4.111 1.00 0.00 H new ATOM 0 HE21 GLN A 16 8.481 -13.278 2.595 1.00 0.00 H new ATOM 0 HE22 GLN A 16 7.446 -13.771 3.940 1.00 0.00 H new ATOM 217 N CYS A 17 11.923 -9.473 2.174 1.00 0.00 N ATOM 218 CA CYS A 17 11.947 -8.014 2.269 1.00 0.00 C ATOM 219 C CYS A 17 10.524 -7.417 2.216 1.00 0.00 C ATOM 220 O CYS A 17 10.337 -6.296 1.738 1.00 0.00 O ATOM 221 CB CYS A 17 12.918 -7.424 1.238 1.00 0.00 C ATOM 222 SG CYS A 17 12.645 -7.786 -0.518 1.00 0.00 S ATOM 0 H CYS A 17 11.259 -9.809 1.477 1.00 0.00 H new ATOM 0 HA CYS A 17 12.334 -7.727 3.247 1.00 0.00 H new ATOM 0 HB2 CYS A 17 12.910 -6.341 1.358 1.00 0.00 H new ATOM 0 HB3 CYS A 17 13.921 -7.766 1.494 1.00 0.00 H new ATOM 0 HG CYS A 17 13.562 -7.201 -1.229 1.00 0.00 H new ATOM 227 N VAL A 18 9.510 -8.166 2.677 1.00 0.00 N ATOM 228 CA VAL A 18 8.096 -7.801 2.551 1.00 0.00 C ATOM 229 C VAL A 18 7.828 -6.425 3.175 1.00 0.00 C ATOM 230 O VAL A 18 8.208 -6.168 4.323 1.00 0.00 O ATOM 231 CB VAL A 18 7.166 -8.884 3.148 1.00 0.00 C ATOM 232 CG1 VAL A 18 5.695 -8.621 2.787 1.00 0.00 C ATOM 233 CG2 VAL A 18 7.496 -10.291 2.634 1.00 0.00 C ATOM 0 H VAL A 18 9.655 -9.055 3.155 1.00 0.00 H new ATOM 0 HA VAL A 18 7.867 -7.738 1.487 1.00 0.00 H new ATOM 0 HB VAL A 18 7.325 -8.832 4.225 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.069 -9.400 3.222 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.392 -7.650 3.180 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.580 -8.626 1.703 1.00 0.00 H new ATOM 0 HG21 VAL A 18 6.814 -11.012 3.084 1.00 0.00 H new ATOM 0 HG22 VAL A 18 7.388 -10.317 1.550 1.00 0.00 H new ATOM 0 HG23 VAL A 18 8.521 -10.545 2.902 1.00 0.00 H new ATOM 243 N LYS A 19 7.145 -5.562 2.412 1.00 0.00 N ATOM 244 CA LYS A 19 6.839 -4.158 2.700 1.00 0.00 C ATOM 245 C LYS A 19 7.985 -3.430 3.410 1.00 0.00 C ATOM 246 O LYS A 19 7.745 -2.648 4.328 1.00 0.00 O ATOM 247 CB LYS A 19 5.453 -3.992 3.365 1.00 0.00 C ATOM 248 CG LYS A 19 5.255 -4.776 4.672 1.00 0.00 C ATOM 249 CD LYS A 19 4.058 -4.239 5.472 1.00 0.00 C ATOM 250 CE LYS A 19 3.618 -5.246 6.545 1.00 0.00 C ATOM 251 NZ LYS A 19 2.785 -4.617 7.600 1.00 0.00 N ATOM 0 H LYS A 19 6.764 -5.850 1.511 1.00 0.00 H new ATOM 0 HA LYS A 19 6.756 -3.643 1.743 1.00 0.00 H new ATOM 0 HB2 LYS A 19 5.289 -2.933 3.567 1.00 0.00 H new ATOM 0 HB3 LYS A 19 4.687 -4.303 2.654 1.00 0.00 H new ATOM 0 HG2 LYS A 19 5.099 -5.831 4.445 1.00 0.00 H new ATOM 0 HG3 LYS A 19 6.159 -4.710 5.278 1.00 0.00 H new ATOM 0 HD2 LYS A 19 4.326 -3.293 5.943 1.00 0.00 H new ATOM 0 HD3 LYS A 19 3.227 -4.035 4.797 1.00 0.00 H new ATOM 0 HE2 LYS A 19 3.056 -6.053 6.074 1.00 0.00 H new ATOM 0 HE3 LYS A 19 4.500 -5.696 7.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 2.131 -5.323 7.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 3.399 -4.255 8.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 2.241 -3.831 7.190 1.00 0.00 H new ATOM 265 N SER A 20 9.222 -3.694 2.996 1.00 0.00 N ATOM 266 CA SER A 20 10.436 -3.154 3.587 1.00 0.00 C ATOM 267 C SER A 20 11.341 -2.639 2.464 1.00 0.00 C ATOM 268 O SER A 20 11.099 -2.916 1.281 1.00 0.00 O ATOM 269 CB SER A 20 11.093 -4.254 4.425 1.00 0.00 C ATOM 270 OG SER A 20 10.233 -4.610 5.489 1.00 0.00 O ATOM 0 H SER A 20 9.409 -4.315 2.209 1.00 0.00 H new ATOM 0 HA SER A 20 10.229 -2.313 4.248 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.301 -5.125 3.803 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.049 -3.906 4.816 1.00 0.00 H new ATOM 0 HG SER A 20 9.488 -5.145 5.143 1.00 0.00 H new ATOM 276 N THR A 21 12.373 -1.876 2.827 1.00 0.00 N ATOM 277 CA THR A 21 13.213 -1.158 1.876 1.00 0.00 C ATOM 278 C THR A 21 14.667 -1.556 2.112 1.00 0.00 C ATOM 279 O THR A 21 15.126 -1.587 3.255 1.00 0.00 O ATOM 280 CB THR A 21 12.990 0.358 2.029 1.00 0.00 C ATOM 281 OG1 THR A 21 11.612 0.672 1.928 1.00 0.00 O ATOM 282 CG2 THR A 21 13.735 1.173 0.966 1.00 0.00 C ATOM 0 H THR A 21 12.649 -1.740 3.799 1.00 0.00 H new ATOM 0 HA THR A 21 12.951 -1.419 0.851 1.00 0.00 H new ATOM 0 HB THR A 21 13.379 0.621 3.013 1.00 0.00 H new ATOM 0 HG1 THR A 21 11.489 1.639 2.029 1.00 0.00 H new ATOM 0 HG21 THR A 21 13.543 2.235 1.121 1.00 0.00 H new ATOM 0 HG22 THR A 21 14.805 0.983 1.045 1.00 0.00 H new ATOM 0 HG23 THR A 21 13.387 0.882 -0.025 1.00 0.00 H new ATOM 290 N ALA A 22 15.399 -1.844 1.036 1.00 0.00 N ATOM 291 CA ALA A 22 16.766 -2.320 1.105 1.00 0.00 C ATOM 292 C ALA A 22 17.632 -1.511 0.145 1.00 0.00 C ATOM 293 O ALA A 22 17.362 -1.465 -1.058 1.00 0.00 O ATOM 294 CB ALA A 22 16.787 -3.824 0.802 1.00 0.00 C ATOM 0 H ALA A 22 15.048 -1.750 0.083 1.00 0.00 H new ATOM 0 HA ALA A 22 17.179 -2.181 2.104 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.812 -4.191 0.852 1.00 0.00 H new ATOM 0 HB2 ALA A 22 16.177 -4.351 1.535 1.00 0.00 H new ATOM 0 HB3 ALA A 22 16.387 -4.000 -0.197 1.00 0.00 H new ATOM 300 N THR A 23 18.673 -0.883 0.689 1.00 0.00 N ATOM 301 CA THR A 23 19.600 -0.039 -0.047 1.00 0.00 C ATOM 302 C THR A 23 20.979 -0.716 -0.022 1.00 0.00 C ATOM 303 O THR A 23 21.723 -0.581 0.952 1.00 0.00 O ATOM 304 CB THR A 23 19.584 1.387 0.540 1.00 0.00 C ATOM 305 OG1 THR A 23 18.253 1.866 0.650 1.00 0.00 O ATOM 306 CG2 THR A 23 20.382 2.372 -0.320 1.00 0.00 C ATOM 0 H THR A 23 18.897 -0.952 1.682 1.00 0.00 H new ATOM 0 HA THR A 23 19.311 0.073 -1.092 1.00 0.00 H new ATOM 0 HB THR A 23 20.047 1.323 1.525 1.00 0.00 H new ATOM 0 HG1 THR A 23 18.261 2.771 1.026 1.00 0.00 H new ATOM 0 HG21 THR A 23 20.343 3.363 0.131 1.00 0.00 H new ATOM 0 HG22 THR A 23 21.419 2.042 -0.383 1.00 0.00 H new ATOM 0 HG23 THR A 23 19.952 2.412 -1.321 1.00 0.00 H new ATOM 314 N ASN A 24 21.306 -1.466 -1.082 1.00 0.00 N ATOM 315 CA ASN A 24 22.498 -2.315 -1.220 1.00 0.00 C ATOM 316 C ASN A 24 22.850 -3.087 0.068 1.00 0.00 C ATOM 317 O ASN A 24 23.986 -3.064 0.534 1.00 0.00 O ATOM 318 CB ASN A 24 23.667 -1.515 -1.823 1.00 0.00 C ATOM 319 CG ASN A 24 24.916 -2.371 -2.062 1.00 0.00 C ATOM 320 OD1 ASN A 24 26.003 -2.034 -1.602 1.00 0.00 O ATOM 321 ND2 ASN A 24 24.816 -3.474 -2.791 1.00 0.00 N ATOM 0 H ASN A 24 20.714 -1.499 -1.912 1.00 0.00 H new ATOM 0 HA ASN A 24 22.264 -3.106 -1.932 1.00 0.00 H new ATOM 0 HB2 ASN A 24 23.349 -1.073 -2.768 1.00 0.00 H new ATOM 0 HB3 ASN A 24 23.920 -0.691 -1.155 1.00 0.00 H new ATOM 0 HD21 ASN A 24 25.643 -4.044 -2.970 1.00 0.00 H new ATOM 0 HD22 ASN A 24 23.912 -3.753 -3.173 1.00 0.00 H new ATOM 328 N CYS A 25 21.858 -3.739 0.680 1.00 0.00 N ATOM 329 CA CYS A 25 22.041 -4.567 1.870 1.00 0.00 C ATOM 330 C CYS A 25 22.464 -5.970 1.429 1.00 0.00 C ATOM 331 O CYS A 25 22.412 -6.295 0.240 1.00 0.00 O ATOM 332 CB CYS A 25 20.730 -4.653 2.666 1.00 0.00 C ATOM 333 SG CYS A 25 19.874 -3.077 2.886 1.00 0.00 S ATOM 0 H CYS A 25 20.891 -3.705 0.356 1.00 0.00 H new ATOM 0 HA CYS A 25 22.807 -4.124 2.507 1.00 0.00 H new ATOM 0 HB2 CYS A 25 20.059 -5.348 2.161 1.00 0.00 H new ATOM 0 HB3 CYS A 25 20.944 -5.074 3.648 1.00 0.00 H new ATOM 338 N TYR A 26 22.789 -6.834 2.387 1.00 0.00 N ATOM 339 CA TYR A 26 23.140 -8.222 2.137 1.00 0.00 C ATOM 340 C TYR A 26 22.359 -9.037 3.159 1.00 0.00 C ATOM 341 O TYR A 26 22.587 -8.907 4.361 1.00 0.00 O ATOM 342 CB TYR A 26 24.663 -8.387 2.234 1.00 0.00 C ATOM 343 CG TYR A 26 25.419 -7.543 1.218 1.00 0.00 C ATOM 344 CD1 TYR A 26 25.613 -8.022 -0.093 1.00 0.00 C ATOM 345 CD2 TYR A 26 25.861 -6.249 1.560 1.00 0.00 C ATOM 346 CE1 TYR A 26 26.223 -7.207 -1.063 1.00 0.00 C ATOM 347 CE2 TYR A 26 26.472 -5.428 0.596 1.00 0.00 C ATOM 348 CZ TYR A 26 26.650 -5.902 -0.725 1.00 0.00 C ATOM 349 OH TYR A 26 27.226 -5.115 -1.679 1.00 0.00 O ATOM 0 H TYR A 26 22.815 -6.581 3.375 1.00 0.00 H new ATOM 0 HA TYR A 26 22.878 -8.567 1.137 1.00 0.00 H new ATOM 0 HB2 TYR A 26 24.989 -8.115 3.238 1.00 0.00 H new ATOM 0 HB3 TYR A 26 24.919 -9.436 2.089 1.00 0.00 H new ATOM 0 HD1 TYR A 26 25.292 -9.020 -0.354 1.00 0.00 H new ATOM 0 HD2 TYR A 26 25.730 -5.886 2.569 1.00 0.00 H new ATOM 0 HE1 TYR A 26 26.366 -7.578 -2.067 1.00 0.00 H new ATOM 0 HE2 TYR A 26 26.805 -4.436 0.864 1.00 0.00 H new ATOM 0 HH TYR A 26 27.007 -4.176 -1.504 1.00 0.00 H new ATOM 359 N ILE A 27 21.389 -9.819 2.689 1.00 0.00 N ATOM 360 CA ILE A 27 20.403 -10.483 3.528 1.00 0.00 C ATOM 361 C ILE A 27 20.511 -11.983 3.240 1.00 0.00 C ATOM 362 O ILE A 27 20.193 -12.443 2.137 1.00 0.00 O ATOM 363 CB ILE A 27 19.011 -9.850 3.248 1.00 0.00 C ATOM 364 CG1 ILE A 27 19.036 -8.314 3.466 1.00 0.00 C ATOM 365 CG2 ILE A 27 17.912 -10.496 4.098 1.00 0.00 C ATOM 366 CD1 ILE A 27 17.682 -7.610 3.325 1.00 0.00 C ATOM 0 H ILE A 27 21.267 -10.010 1.695 1.00 0.00 H new ATOM 0 HA ILE A 27 20.570 -10.352 4.597 1.00 0.00 H new ATOM 0 HB ILE A 27 18.779 -10.043 2.201 1.00 0.00 H new ATOM 0 HG12 ILE A 27 19.430 -8.111 4.462 1.00 0.00 H new ATOM 0 HG13 ILE A 27 19.732 -7.874 2.752 1.00 0.00 H new ATOM 0 HG21 ILE A 27 16.955 -10.026 3.873 1.00 0.00 H new ATOM 0 HG22 ILE A 27 17.856 -11.561 3.872 1.00 0.00 H new ATOM 0 HG23 ILE A 27 18.143 -10.361 5.155 1.00 0.00 H new ATOM 0 HD11 ILE A 27 17.808 -6.541 3.496 1.00 0.00 H new ATOM 0 HD12 ILE A 27 17.290 -7.773 2.321 1.00 0.00 H new ATOM 0 HD13 ILE A 27 16.984 -8.015 4.058 1.00 0.00 H new ATOM 378 N ASP A 28 21.002 -12.734 4.228 1.00 0.00 N ATOM 379 CA ASP A 28 21.300 -14.160 4.161 1.00 0.00 C ATOM 380 C ASP A 28 20.371 -14.894 5.122 1.00 0.00 C ATOM 381 O ASP A 28 20.425 -14.653 6.328 1.00 0.00 O ATOM 382 CB ASP A 28 22.766 -14.413 4.533 1.00 0.00 C ATOM 383 CG ASP A 28 23.038 -15.919 4.686 1.00 0.00 C ATOM 384 OD1 ASP A 28 22.834 -16.674 3.709 1.00 0.00 O ATOM 385 OD2 ASP A 28 23.488 -16.353 5.769 1.00 0.00 O ATOM 0 H ASP A 28 21.213 -12.339 5.145 1.00 0.00 H new ATOM 0 HA ASP A 28 21.143 -14.526 3.146 1.00 0.00 H new ATOM 0 HB2 ASP A 28 23.418 -13.997 3.765 1.00 0.00 H new ATOM 0 HB3 ASP A 28 23.003 -13.899 5.465 1.00 0.00 H new ATOM 390 N ASN A 29 19.503 -15.763 4.597 1.00 0.00 N ATOM 391 CA ASN A 29 18.435 -16.470 5.318 1.00 0.00 C ATOM 392 C ASN A 29 17.665 -15.597 6.330 1.00 0.00 C ATOM 393 O ASN A 29 17.249 -16.091 7.381 1.00 0.00 O ATOM 394 CB ASN A 29 18.995 -17.750 5.972 1.00 0.00 C ATOM 395 CG ASN A 29 17.879 -18.748 6.277 1.00 0.00 C ATOM 396 OD1 ASN A 29 17.179 -19.180 5.368 1.00 0.00 O ATOM 397 ND2 ASN A 29 17.675 -19.166 7.515 1.00 0.00 N ATOM 0 H ASN A 29 19.525 -16.007 3.607 1.00 0.00 H new ATOM 0 HA ASN A 29 17.689 -16.745 4.573 1.00 0.00 H new ATOM 0 HB2 ASN A 29 19.727 -18.210 5.308 1.00 0.00 H new ATOM 0 HB3 ASN A 29 19.518 -17.492 6.893 1.00 0.00 H new ATOM 0 HD21 ASN A 29 16.938 -19.844 7.709 1.00 0.00 H new ATOM 0 HD22 ASN A 29 18.254 -18.810 8.275 1.00 0.00 H new ATOM 404 N SER A 30 17.472 -14.306 6.046 1.00 0.00 N ATOM 405 CA SER A 30 16.961 -13.332 7.005 1.00 0.00 C ATOM 406 C SER A 30 15.679 -12.664 6.515 1.00 0.00 C ATOM 407 O SER A 30 15.440 -12.522 5.317 1.00 0.00 O ATOM 408 CB SER A 30 18.040 -12.287 7.285 1.00 0.00 C ATOM 409 OG SER A 30 19.174 -12.869 7.883 1.00 0.00 O ATOM 0 H SER A 30 17.670 -13.906 5.129 1.00 0.00 H new ATOM 0 HA SER A 30 16.710 -13.858 7.926 1.00 0.00 H new ATOM 0 HB2 SER A 30 18.327 -11.800 6.353 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.638 -11.513 7.939 1.00 0.00 H new ATOM 0 HG SER A 30 19.727 -13.291 7.193 1.00 0.00 H new ATOM 415 N GLN A 31 14.835 -12.245 7.455 1.00 0.00 N ATOM 416 CA GLN A 31 13.484 -11.782 7.191 1.00 0.00 C ATOM 417 C GLN A 31 13.405 -10.311 7.592 1.00 0.00 C ATOM 418 O GLN A 31 13.186 -9.979 8.757 1.00 0.00 O ATOM 419 CB GLN A 31 12.459 -12.675 7.914 1.00 0.00 C ATOM 420 CG GLN A 31 12.463 -14.138 7.424 1.00 0.00 C ATOM 421 CD GLN A 31 13.654 -14.968 7.924 1.00 0.00 C ATOM 422 OE1 GLN A 31 13.967 -14.986 9.111 1.00 0.00 O ATOM 423 NE2 GLN A 31 14.359 -15.658 7.038 1.00 0.00 N ATOM 0 H GLN A 31 15.082 -12.219 8.444 1.00 0.00 H new ATOM 0 HA GLN A 31 13.237 -11.857 6.132 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.665 -12.658 8.984 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.462 -12.256 7.775 1.00 0.00 H new ATOM 0 HG2 GLN A 31 11.539 -14.619 7.745 1.00 0.00 H new ATOM 0 HG3 GLN A 31 12.463 -14.144 6.334 1.00 0.00 H new ATOM 0 HE21 GLN A 31 14.096 -15.641 6.053 1.00 0.00 H new ATOM 0 HE22 GLN A 31 15.164 -16.206 7.342 1.00 0.00 H new ATOM 432 N LEU A 32 13.638 -9.428 6.620 1.00 0.00 N ATOM 433 CA LEU A 32 13.449 -7.992 6.759 1.00 0.00 C ATOM 434 C LEU A 32 11.962 -7.742 6.492 1.00 0.00 C ATOM 435 O LEU A 32 11.542 -7.911 5.349 1.00 0.00 O ATOM 436 CB LEU A 32 14.354 -7.294 5.719 1.00 0.00 C ATOM 437 CG LEU A 32 14.293 -5.758 5.741 1.00 0.00 C ATOM 438 CD1 LEU A 32 15.207 -5.191 6.833 1.00 0.00 C ATOM 439 CD2 LEU A 32 14.717 -5.170 4.390 1.00 0.00 C ATOM 0 H LEU A 32 13.971 -9.702 5.696 1.00 0.00 H new ATOM 0 HA LEU A 32 13.715 -7.604 7.742 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.385 -7.605 5.888 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.075 -7.641 4.724 1.00 0.00 H new ATOM 0 HG LEU A 32 13.260 -5.480 5.948 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.147 -4.103 6.829 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.890 -5.568 7.805 1.00 0.00 H new ATOM 0 HD13 LEU A 32 16.235 -5.498 6.643 1.00 0.00 H new ATOM 0 HD21 LEU A 32 14.664 -4.082 4.434 1.00 0.00 H new ATOM 0 HD22 LEU A 32 15.739 -5.475 4.165 1.00 0.00 H new ATOM 0 HD23 LEU A 32 14.049 -5.534 3.609 1.00 0.00 H new ATOM 451 N VAL A 33 11.141 -7.413 7.496 1.00 0.00 N ATOM 452 CA VAL A 33 9.700 -7.271 7.265 1.00 0.00 C ATOM 453 C VAL A 33 9.121 -6.034 7.963 1.00 0.00 C ATOM 454 O VAL A 33 9.748 -5.443 8.848 1.00 0.00 O ATOM 455 CB VAL A 33 8.944 -8.580 7.611 1.00 0.00 C ATOM 456 CG1 VAL A 33 9.321 -9.739 6.671 1.00 0.00 C ATOM 457 CG2 VAL A 33 9.133 -9.052 9.059 1.00 0.00 C ATOM 0 H VAL A 33 11.441 -7.243 8.456 1.00 0.00 H new ATOM 0 HA VAL A 33 9.550 -7.099 6.199 1.00 0.00 H new ATOM 0 HB VAL A 33 7.895 -8.315 7.477 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.765 -10.633 6.954 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.075 -9.469 5.644 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.390 -9.937 6.748 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.572 -9.973 9.218 1.00 0.00 H new ATOM 0 HG22 VAL A 33 10.191 -9.235 9.247 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.771 -8.284 9.742 1.00 0.00 H new ATOM 467 N ASP A 34 7.898 -5.673 7.560 1.00 0.00 N ATOM 468 CA ASP A 34 7.054 -4.643 8.163 1.00 0.00 C ATOM 469 C ASP A 34 7.758 -3.293 8.309 1.00 0.00 C ATOM 470 O ASP A 34 8.111 -2.880 9.407 1.00 0.00 O ATOM 471 CB ASP A 34 6.436 -5.151 9.473 1.00 0.00 C ATOM 472 CG ASP A 34 5.460 -4.134 10.079 1.00 0.00 C ATOM 473 OD1 ASP A 34 4.675 -3.524 9.315 1.00 0.00 O ATOM 474 OD2 ASP A 34 5.409 -4.033 11.325 1.00 0.00 O ATOM 0 H ASP A 34 7.448 -6.118 6.760 1.00 0.00 H new ATOM 0 HA ASP A 34 6.235 -4.446 7.471 1.00 0.00 H new ATOM 0 HB2 ASP A 34 5.913 -6.089 9.288 1.00 0.00 H new ATOM 0 HB3 ASP A 34 7.229 -5.364 10.190 1.00 0.00 H new ATOM 479 N THR A 35 7.964 -2.598 7.190 1.00 0.00 N ATOM 480 CA THR A 35 8.618 -1.307 7.088 1.00 0.00 C ATOM 481 C THR A 35 9.981 -1.240 7.792 1.00 0.00 C ATOM 482 O THR A 35 10.338 -0.231 8.407 1.00 0.00 O ATOM 483 CB THR A 35 7.636 -0.176 7.428 1.00 0.00 C ATOM 484 OG1 THR A 35 6.304 -0.472 7.032 1.00 0.00 O ATOM 485 CG2 THR A 35 8.049 1.103 6.691 1.00 0.00 C ATOM 0 H THR A 35 7.659 -2.947 6.282 1.00 0.00 H new ATOM 0 HA THR A 35 8.899 -1.154 6.046 1.00 0.00 H new ATOM 0 HB THR A 35 7.668 -0.054 8.511 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.718 0.276 7.271 1.00 0.00 H new ATOM 0 HG21 THR A 35 7.351 1.904 6.934 1.00 0.00 H new ATOM 0 HG22 THR A 35 9.054 1.392 6.999 1.00 0.00 H new ATOM 0 HG23 THR A 35 8.036 0.924 5.616 1.00 0.00 H new ATOM 493 N SER A 36 10.745 -2.330 7.736 1.00 0.00 N ATOM 494 CA SER A 36 12.134 -2.290 8.138 1.00 0.00 C ATOM 495 C SER A 36 12.885 -1.663 6.962 1.00 0.00 C ATOM 496 O SER A 36 12.453 -1.754 5.806 1.00 0.00 O ATOM 497 CB SER A 36 12.650 -3.689 8.458 1.00 0.00 C ATOM 498 OG SER A 36 12.002 -4.206 9.598 1.00 0.00 O ATOM 0 H SER A 36 10.420 -3.243 7.417 1.00 0.00 H new ATOM 0 HA SER A 36 12.276 -1.708 9.048 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.482 -4.348 7.607 1.00 0.00 H new ATOM 0 HB3 SER A 36 13.726 -3.656 8.628 1.00 0.00 H new ATOM 0 HG SER A 36 11.111 -4.530 9.349 1.00 0.00 H new ATOM 504 N ILE A 37 13.995 -0.993 7.242 1.00 0.00 N ATOM 505 CA ILE A 37 14.723 -0.215 6.253 1.00 0.00 C ATOM 506 C ILE A 37 16.210 -0.476 6.510 1.00 0.00 C ATOM 507 O ILE A 37 16.660 -0.366 7.654 1.00 0.00 O ATOM 508 CB ILE A 37 14.312 1.281 6.344 1.00 0.00 C ATOM 509 CG1 ILE A 37 12.806 1.479 6.037 1.00 0.00 C ATOM 510 CG2 ILE A 37 15.182 2.142 5.405 1.00 0.00 C ATOM 511 CD1 ILE A 37 12.316 2.932 6.083 1.00 0.00 C ATOM 0 H ILE A 37 14.418 -0.975 8.170 1.00 0.00 H new ATOM 0 HA ILE A 37 14.491 -0.505 5.228 1.00 0.00 H new ATOM 0 HB ILE A 37 14.482 1.609 7.370 1.00 0.00 H new ATOM 0 HG12 ILE A 37 12.597 1.073 5.047 1.00 0.00 H new ATOM 0 HG13 ILE A 37 12.226 0.894 6.751 1.00 0.00 H new ATOM 0 HG21 ILE A 37 14.879 3.186 5.483 1.00 0.00 H new ATOM 0 HG22 ILE A 37 16.230 2.046 5.690 1.00 0.00 H new ATOM 0 HG23 ILE A 37 15.053 1.803 4.377 1.00 0.00 H new ATOM 0 HD11 ILE A 37 11.251 2.964 5.854 1.00 0.00 H new ATOM 0 HD12 ILE A 37 12.486 3.342 7.079 1.00 0.00 H new ATOM 0 HD13 ILE A 37 12.863 3.524 5.349 1.00 0.00 H new ATOM 523 N CYS A 38 16.989 -0.814 5.479 1.00 0.00 N ATOM 524 CA CYS A 38 18.411 -1.085 5.639 1.00 0.00 C ATOM 525 C CYS A 38 19.213 -0.340 4.581 1.00 0.00 C ATOM 526 O CYS A 38 18.734 -0.126 3.464 1.00 0.00 O ATOM 527 CB CYS A 38 18.671 -2.603 5.633 1.00 0.00 C ATOM 528 SG CYS A 38 18.299 -3.503 4.107 1.00 0.00 S ATOM 0 H CYS A 38 16.651 -0.906 4.521 1.00 0.00 H new ATOM 0 HA CYS A 38 18.747 -0.714 6.607 1.00 0.00 H new ATOM 0 HB2 CYS A 38 19.722 -2.766 5.873 1.00 0.00 H new ATOM 0 HB3 CYS A 38 18.087 -3.048 6.438 1.00 0.00 H new ATOM 533 N THR A 39 20.452 0.003 4.933 1.00 0.00 N ATOM 534 CA THR A 39 21.417 0.636 4.056 1.00 0.00 C ATOM 535 C THR A 39 22.762 -0.031 4.329 1.00 0.00 C ATOM 536 O THR A 39 23.325 0.135 5.408 1.00 0.00 O ATOM 537 CB THR A 39 21.454 2.156 4.313 1.00 0.00 C ATOM 538 OG1 THR A 39 20.161 2.724 4.199 1.00 0.00 O ATOM 539 CG2 THR A 39 22.371 2.880 3.321 1.00 0.00 C ATOM 0 H THR A 39 20.817 -0.161 5.871 1.00 0.00 H new ATOM 0 HA THR A 39 21.152 0.512 3.006 1.00 0.00 H new ATOM 0 HB THR A 39 21.837 2.283 5.326 1.00 0.00 H new ATOM 0 HG1 THR A 39 20.211 3.688 4.368 1.00 0.00 H new ATOM 0 HG21 THR A 39 22.369 3.948 3.537 1.00 0.00 H new ATOM 0 HG22 THR A 39 23.386 2.493 3.414 1.00 0.00 H new ATOM 0 HG23 THR A 39 22.012 2.714 2.305 1.00 0.00 H new ATOM 547 N ARG A 40 23.274 -0.797 3.362 1.00 0.00 N ATOM 548 CA ARG A 40 24.589 -1.451 3.404 1.00 0.00 C ATOM 549 C ARG A 40 24.819 -2.370 4.614 1.00 0.00 C ATOM 550 O ARG A 40 25.964 -2.739 4.880 1.00 0.00 O ATOM 551 CB ARG A 40 25.708 -0.405 3.211 1.00 0.00 C ATOM 552 CG ARG A 40 25.585 0.356 1.879 1.00 0.00 C ATOM 553 CD ARG A 40 26.752 1.333 1.703 1.00 0.00 C ATOM 554 NE ARG A 40 26.649 2.082 0.437 1.00 0.00 N ATOM 555 CZ ARG A 40 27.537 2.979 -0.013 1.00 0.00 C ATOM 556 NH1 ARG A 40 28.628 3.268 0.694 1.00 0.00 N ATOM 557 NH2 ARG A 40 27.328 3.589 -1.176 1.00 0.00 N ATOM 0 H ARG A 40 22.768 -0.987 2.497 1.00 0.00 H new ATOM 0 HA ARG A 40 24.616 -2.146 2.565 1.00 0.00 H new ATOM 0 HB2 ARG A 40 25.680 0.307 4.036 1.00 0.00 H new ATOM 0 HB3 ARG A 40 26.677 -0.903 3.252 1.00 0.00 H new ATOM 0 HG2 ARG A 40 25.569 -0.352 1.050 1.00 0.00 H new ATOM 0 HG3 ARG A 40 24.641 0.901 1.851 1.00 0.00 H new ATOM 0 HD2 ARG A 40 26.771 2.032 2.539 1.00 0.00 H new ATOM 0 HD3 ARG A 40 27.693 0.784 1.726 1.00 0.00 H new ATOM 0 HE ARG A 40 25.832 1.902 -0.146 1.00 0.00 H new ATOM 0 HH11 ARG A 40 28.794 2.805 1.587 1.00 0.00 H new ATOM 0 HH12 ARG A 40 29.297 3.952 0.342 1.00 0.00 H new ATOM 0 HH21 ARG A 40 26.494 3.374 -1.722 1.00 0.00 H new ATOM 0 HH22 ARG A 40 28.002 4.272 -1.522 1.00 0.00 H new ATOM 571 N SER A 41 23.772 -2.775 5.336 1.00 0.00 N ATOM 572 CA SER A 41 23.913 -3.680 6.469 1.00 0.00 C ATOM 573 C SER A 41 23.915 -5.130 5.983 1.00 0.00 C ATOM 574 O SER A 41 23.345 -5.456 4.935 1.00 0.00 O ATOM 575 CB SER A 41 22.795 -3.443 7.489 1.00 0.00 C ATOM 576 OG SER A 41 22.888 -2.123 7.991 1.00 0.00 O ATOM 0 H SER A 41 22.812 -2.485 5.151 1.00 0.00 H new ATOM 0 HA SER A 41 24.864 -3.482 6.964 1.00 0.00 H new ATOM 0 HB2 SER A 41 21.823 -3.598 7.022 1.00 0.00 H new ATOM 0 HB3 SER A 41 22.875 -4.161 8.305 1.00 0.00 H new ATOM 0 HG SER A 41 22.356 -1.521 7.429 1.00 0.00 H new ATOM 582 N GLN A 42 24.535 -5.993 6.782 1.00 0.00 N ATOM 583 CA GLN A 42 24.499 -7.439 6.647 1.00 0.00 C ATOM 584 C GLN A 42 23.485 -7.961 7.667 1.00 0.00 C ATOM 585 O GLN A 42 23.538 -7.585 8.841 1.00 0.00 O ATOM 586 CB GLN A 42 25.911 -8.006 6.906 1.00 0.00 C ATOM 587 CG GLN A 42 26.007 -9.545 6.941 1.00 0.00 C ATOM 588 CD GLN A 42 25.774 -10.207 5.581 1.00 0.00 C ATOM 589 OE1 GLN A 42 26.410 -9.863 4.590 1.00 0.00 O ATOM 590 NE2 GLN A 42 24.882 -11.181 5.496 1.00 0.00 N ATOM 0 H GLN A 42 25.100 -5.687 7.574 1.00 0.00 H new ATOM 0 HA GLN A 42 24.200 -7.749 5.646 1.00 0.00 H new ATOM 0 HB2 GLN A 42 26.582 -7.634 6.131 1.00 0.00 H new ATOM 0 HB3 GLN A 42 26.273 -7.614 7.856 1.00 0.00 H new ATOM 0 HG2 GLN A 42 26.992 -9.830 7.310 1.00 0.00 H new ATOM 0 HG3 GLN A 42 25.276 -9.930 7.652 1.00 0.00 H new ATOM 0 HE21 GLN A 42 24.355 -11.464 6.323 1.00 0.00 H new ATOM 0 HE22 GLN A 42 24.721 -11.649 4.604 1.00 0.00 H new ATOM 599 N TYR A 43 22.615 -8.868 7.230 1.00 0.00 N ATOM 600 CA TYR A 43 21.716 -9.641 8.071 1.00 0.00 C ATOM 601 C TYR A 43 21.986 -11.104 7.753 1.00 0.00 C ATOM 602 O TYR A 43 22.055 -11.464 6.574 1.00 0.00 O ATOM 603 CB TYR A 43 20.249 -9.307 7.770 1.00 0.00 C ATOM 604 CG TYR A 43 19.724 -8.048 8.425 1.00 0.00 C ATOM 605 CD1 TYR A 43 19.507 -8.036 9.816 1.00 0.00 C ATOM 606 CD2 TYR A 43 19.386 -6.921 7.653 1.00 0.00 C ATOM 607 CE1 TYR A 43 18.967 -6.899 10.438 1.00 0.00 C ATOM 608 CE2 TYR A 43 18.828 -5.787 8.269 1.00 0.00 C ATOM 609 CZ TYR A 43 18.622 -5.769 9.669 1.00 0.00 C ATOM 610 OH TYR A 43 18.068 -4.691 10.293 1.00 0.00 O ATOM 0 H TYR A 43 22.516 -9.091 6.240 1.00 0.00 H new ATOM 0 HA TYR A 43 21.887 -9.414 9.123 1.00 0.00 H new ATOM 0 HB2 TYR A 43 20.129 -9.212 6.691 1.00 0.00 H new ATOM 0 HB3 TYR A 43 19.630 -10.147 8.087 1.00 0.00 H new ATOM 0 HD1 TYR A 43 19.757 -8.905 10.407 1.00 0.00 H new ATOM 0 HD2 TYR A 43 19.555 -6.927 6.586 1.00 0.00 H new ATOM 0 HE1 TYR A 43 18.816 -6.890 11.507 1.00 0.00 H new ATOM 0 HE2 TYR A 43 18.556 -4.928 7.673 1.00 0.00 H new ATOM 0 HH TYR A 43 18.774 -4.163 10.722 1.00 0.00 H new ATOM 620 N SER A 44 22.133 -11.933 8.781 1.00 0.00 N ATOM 621 CA SER A 44 22.484 -13.333 8.640 1.00 0.00 C ATOM 622 C SER A 44 21.652 -14.142 9.636 1.00 0.00 C ATOM 623 O SER A 44 21.774 -13.954 10.846 1.00 0.00 O ATOM 624 CB SER A 44 23.988 -13.508 8.885 1.00 0.00 C ATOM 625 OG SER A 44 24.750 -12.663 8.034 1.00 0.00 O ATOM 0 H SER A 44 22.008 -11.641 9.750 1.00 0.00 H new ATOM 0 HA SER A 44 22.268 -13.690 7.633 1.00 0.00 H new ATOM 0 HB2 SER A 44 24.218 -13.282 9.926 1.00 0.00 H new ATOM 0 HB3 SER A 44 24.268 -14.548 8.715 1.00 0.00 H new ATOM 0 HG SER A 44 25.705 -12.794 8.212 1.00 0.00 H new ATOM 631 N ASP A 45 20.814 -15.043 9.123 1.00 0.00 N ATOM 632 CA ASP A 45 19.844 -15.854 9.863 1.00 0.00 C ATOM 633 C ASP A 45 19.063 -15.055 10.927 1.00 0.00 C ATOM 634 O ASP A 45 18.868 -15.515 12.054 1.00 0.00 O ATOM 635 CB ASP A 45 20.539 -17.108 10.418 1.00 0.00 C ATOM 636 CG ASP A 45 19.518 -18.160 10.878 1.00 0.00 C ATOM 637 OD1 ASP A 45 18.621 -18.503 10.075 1.00 0.00 O ATOM 638 OD2 ASP A 45 19.651 -18.707 11.997 1.00 0.00 O ATOM 0 H ASP A 45 20.792 -15.238 8.122 1.00 0.00 H new ATOM 0 HA ASP A 45 19.070 -16.180 9.168 1.00 0.00 H new ATOM 0 HB2 ASP A 45 21.185 -17.537 9.652 1.00 0.00 H new ATOM 0 HB3 ASP A 45 21.179 -16.830 11.255 1.00 0.00 H new ATOM 643 N ALA A 46 18.642 -13.831 10.585 1.00 0.00 N ATOM 644 CA ALA A 46 18.081 -12.843 11.504 1.00 0.00 C ATOM 645 C ALA A 46 16.673 -12.403 11.081 1.00 0.00 C ATOM 646 O ALA A 46 16.251 -12.625 9.947 1.00 0.00 O ATOM 647 CB ALA A 46 19.038 -11.643 11.552 1.00 0.00 C ATOM 0 H ALA A 46 18.686 -13.493 9.624 1.00 0.00 H new ATOM 0 HA ALA A 46 17.979 -13.287 12.494 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.642 -10.889 12.232 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.016 -11.971 11.904 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.136 -11.216 10.554 1.00 0.00 H new ATOM 653 N ASN A 47 15.945 -11.732 11.978 1.00 0.00 N ATOM 654 CA ASN A 47 14.576 -11.260 11.745 1.00 0.00 C ATOM 655 C ASN A 47 14.469 -9.804 12.175 1.00 0.00 C ATOM 656 O ASN A 47 15.102 -9.398 13.152 1.00 0.00 O ATOM 657 CB ASN A 47 13.584 -12.122 12.536 1.00 0.00 C ATOM 658 CG ASN A 47 12.133 -11.662 12.406 1.00 0.00 C ATOM 659 OD1 ASN A 47 11.691 -11.228 11.349 1.00 0.00 O ATOM 660 ND2 ASN A 47 11.360 -11.753 13.473 1.00 0.00 N ATOM 0 H ASN A 47 16.298 -11.497 12.906 1.00 0.00 H new ATOM 0 HA ASN A 47 14.336 -11.341 10.685 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.661 -13.154 12.195 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.866 -12.112 13.589 1.00 0.00 H new ATOM 0 HD21 ASN A 47 10.384 -11.460 13.422 1.00 0.00 H new ATOM 0 HD22 ASN A 47 11.739 -12.116 14.348 1.00 0.00 H new ATOM 667 N VAL A 48 13.674 -9.023 11.455 1.00 0.00 N ATOM 668 CA VAL A 48 13.618 -7.572 11.589 1.00 0.00 C ATOM 669 C VAL A 48 12.168 -7.113 11.447 1.00 0.00 C ATOM 670 O VAL A 48 11.500 -7.501 10.486 1.00 0.00 O ATOM 671 CB VAL A 48 14.486 -6.888 10.508 1.00 0.00 C ATOM 672 CG1 VAL A 48 14.890 -5.487 10.976 1.00 0.00 C ATOM 673 CG2 VAL A 48 15.745 -7.665 10.090 1.00 0.00 C ATOM 0 H VAL A 48 13.037 -9.387 10.747 1.00 0.00 H new ATOM 0 HA VAL A 48 14.005 -7.293 12.569 1.00 0.00 H new ATOM 0 HB VAL A 48 13.855 -6.848 9.620 1.00 0.00 H new ATOM 0 HG11 VAL A 48 15.502 -5.010 10.210 1.00 0.00 H new ATOM 0 HG12 VAL A 48 13.995 -4.889 11.150 1.00 0.00 H new ATOM 0 HG13 VAL A 48 15.461 -5.563 11.901 1.00 0.00 H new ATOM 0 HG21 VAL A 48 16.284 -7.102 9.328 1.00 0.00 H new ATOM 0 HG22 VAL A 48 16.388 -7.809 10.958 1.00 0.00 H new ATOM 0 HG23 VAL A 48 15.456 -8.636 9.687 1.00 0.00 H new ATOM 683 N LYS A 49 11.711 -6.248 12.358 1.00 0.00 N ATOM 684 CA LYS A 49 10.388 -5.631 12.305 1.00 0.00 C ATOM 685 C LYS A 49 10.564 -4.135 12.501 1.00 0.00 C ATOM 686 O LYS A 49 11.134 -3.718 13.513 1.00 0.00 O ATOM 687 CB LYS A 49 9.478 -6.239 13.386 1.00 0.00 C ATOM 688 CG LYS A 49 8.082 -5.587 13.431 1.00 0.00 C ATOM 689 CD LYS A 49 7.209 -6.208 14.532 1.00 0.00 C ATOM 690 CE LYS A 49 5.883 -5.461 14.752 1.00 0.00 C ATOM 691 NZ LYS A 49 4.955 -5.537 13.596 1.00 0.00 N ATOM 0 H LYS A 49 12.261 -5.954 13.165 1.00 0.00 H new ATOM 0 HA LYS A 49 9.911 -5.816 11.343 1.00 0.00 H new ATOM 0 HB2 LYS A 49 9.369 -7.308 13.203 1.00 0.00 H new ATOM 0 HB3 LYS A 49 9.956 -6.130 14.360 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.184 -4.516 13.606 1.00 0.00 H new ATOM 0 HG3 LYS A 49 7.592 -5.706 12.465 1.00 0.00 H new ATOM 0 HD2 LYS A 49 6.995 -7.245 14.274 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.770 -6.221 15.467 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.387 -5.871 15.632 1.00 0.00 H new ATOM 0 HE3 LYS A 49 6.097 -4.414 14.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.020 -5.178 13.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 5.327 -4.961 12.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 4.867 -6.526 13.286 1.00 0.00 H new ATOM 705 N LYS A 50 10.033 -3.344 11.569 1.00 0.00 N ATOM 706 CA LYS A 50 9.995 -1.885 11.566 1.00 0.00 C ATOM 707 C LYS A 50 11.243 -1.238 12.178 1.00 0.00 C ATOM 708 O LYS A 50 11.131 -0.384 13.058 1.00 0.00 O ATOM 709 CB LYS A 50 8.669 -1.441 12.217 1.00 0.00 C ATOM 710 CG LYS A 50 8.249 -0.023 11.807 1.00 0.00 C ATOM 711 CD LYS A 50 6.912 0.334 12.464 1.00 0.00 C ATOM 712 CE LYS A 50 6.493 1.758 12.072 1.00 0.00 C ATOM 713 NZ LYS A 50 5.195 2.151 12.678 1.00 0.00 N ATOM 0 H LYS A 50 9.587 -3.735 10.739 1.00 0.00 H new ATOM 0 HA LYS A 50 10.020 -1.523 10.538 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.882 -2.142 11.941 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.769 -1.486 13.301 1.00 0.00 H new ATOM 0 HG2 LYS A 50 9.014 0.693 12.106 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.160 0.040 10.722 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.145 -0.377 12.155 1.00 0.00 H new ATOM 0 HD3 LYS A 50 6.999 0.258 13.548 1.00 0.00 H new ATOM 0 HE2 LYS A 50 7.265 2.461 12.385 1.00 0.00 H new ATOM 0 HE3 LYS A 50 6.420 1.827 10.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 4.954 3.119 12.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.451 1.498 12.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 5.270 2.112 13.715 1.00 0.00 H new ATOM 727 N SER A 51 12.433 -1.662 11.753 1.00 0.00 N ATOM 728 CA SER A 51 13.693 -1.188 12.315 1.00 0.00 C ATOM 729 C SER A 51 14.549 -0.606 11.201 1.00 0.00 C ATOM 730 O SER A 51 14.345 -0.932 10.031 1.00 0.00 O ATOM 731 CB SER A 51 14.403 -2.339 13.025 1.00 0.00 C ATOM 732 OG SER A 51 13.612 -2.808 14.101 1.00 0.00 O ATOM 0 H SER A 51 12.548 -2.347 11.006 1.00 0.00 H new ATOM 0 HA SER A 51 13.508 -0.405 13.050 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.591 -3.150 12.321 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.373 -2.006 13.394 1.00 0.00 H new ATOM 0 HG SER A 51 12.768 -3.166 13.755 1.00 0.00 H new ATOM 738 N VAL A 52 15.503 0.248 11.554 1.00 0.00 N ATOM 739 CA VAL A 52 16.299 1.010 10.604 1.00 0.00 C ATOM 740 C VAL A 52 17.758 0.646 10.864 1.00 0.00 C ATOM 741 O VAL A 52 18.186 0.631 12.019 1.00 0.00 O ATOM 742 CB VAL A 52 16.007 2.520 10.752 1.00 0.00 C ATOM 743 CG1 VAL A 52 16.749 3.332 9.679 1.00 0.00 C ATOM 744 CG2 VAL A 52 14.504 2.828 10.633 1.00 0.00 C ATOM 0 H VAL A 52 15.748 0.432 12.527 1.00 0.00 H new ATOM 0 HA VAL A 52 16.052 0.768 9.570 1.00 0.00 H new ATOM 0 HB VAL A 52 16.355 2.804 11.745 1.00 0.00 H new ATOM 0 HG11 VAL A 52 16.526 4.391 9.806 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.823 3.172 9.779 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.425 3.009 8.690 1.00 0.00 H new ATOM 0 HG21 VAL A 52 14.343 3.900 10.743 1.00 0.00 H new ATOM 0 HG22 VAL A 52 14.143 2.505 9.657 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.961 2.297 11.415 1.00 0.00 H new ATOM 754 N THR A 53 18.531 0.351 9.820 1.00 0.00 N ATOM 755 CA THR A 53 19.927 -0.030 9.988 1.00 0.00 C ATOM 756 C THR A 53 20.800 0.622 8.916 1.00 0.00 C ATOM 757 O THR A 53 20.381 0.773 7.762 1.00 0.00 O ATOM 758 CB THR A 53 20.035 -1.562 10.054 1.00 0.00 C ATOM 759 OG1 THR A 53 21.359 -1.953 10.320 1.00 0.00 O ATOM 760 CG2 THR A 53 19.623 -2.266 8.768 1.00 0.00 C ATOM 0 H THR A 53 18.212 0.369 8.851 1.00 0.00 H new ATOM 0 HA THR A 53 20.315 0.347 10.934 1.00 0.00 H new ATOM 0 HB THR A 53 19.350 -1.854 10.850 1.00 0.00 H new ATOM 0 HG1 THR A 53 21.861 -2.002 9.480 1.00 0.00 H new ATOM 0 HG21 THR A 53 19.727 -3.344 8.894 1.00 0.00 H new ATOM 0 HG22 THR A 53 18.585 -2.026 8.538 1.00 0.00 H new ATOM 0 HG23 THR A 53 20.262 -1.933 7.950 1.00 0.00 H new ATOM 768 N THR A 54 22.018 0.996 9.308 1.00 0.00 N ATOM 769 CA THR A 54 23.021 1.585 8.443 1.00 0.00 C ATOM 770 C THR A 54 24.363 0.923 8.765 1.00 0.00 C ATOM 771 O THR A 54 24.899 1.107 9.862 1.00 0.00 O ATOM 772 CB THR A 54 23.062 3.114 8.643 1.00 0.00 C ATOM 773 OG1 THR A 54 21.770 3.688 8.549 1.00 0.00 O ATOM 774 CG2 THR A 54 23.950 3.792 7.591 1.00 0.00 C ATOM 0 H THR A 54 22.337 0.890 10.271 1.00 0.00 H new ATOM 0 HA THR A 54 22.784 1.414 7.393 1.00 0.00 H new ATOM 0 HB THR A 54 23.469 3.277 9.641 1.00 0.00 H new ATOM 0 HG1 THR A 54 21.832 4.657 8.682 1.00 0.00 H new ATOM 0 HG21 THR A 54 23.957 4.869 7.760 1.00 0.00 H new ATOM 0 HG22 THR A 54 24.966 3.406 7.669 1.00 0.00 H new ATOM 0 HG23 THR A 54 23.558 3.584 6.595 1.00 0.00 H new ATOM 782 N ASP A 55 24.908 0.191 7.791 1.00 0.00 N ATOM 783 CA ASP A 55 26.213 -0.471 7.823 1.00 0.00 C ATOM 784 C ASP A 55 26.446 -1.260 9.121 1.00 0.00 C ATOM 785 O ASP A 55 27.452 -1.075 9.811 1.00 0.00 O ATOM 786 CB ASP A 55 27.326 0.537 7.491 1.00 0.00 C ATOM 787 CG ASP A 55 28.715 -0.121 7.394 1.00 0.00 C ATOM 788 OD1 ASP A 55 28.843 -1.227 6.821 1.00 0.00 O ATOM 789 OD2 ASP A 55 29.710 0.501 7.834 1.00 0.00 O ATOM 0 H ASP A 55 24.422 0.036 6.908 1.00 0.00 H new ATOM 0 HA ASP A 55 26.234 -1.233 7.044 1.00 0.00 H new ATOM 0 HB2 ASP A 55 27.095 1.029 6.546 1.00 0.00 H new ATOM 0 HB3 ASP A 55 27.349 1.312 8.257 1.00 0.00 H new ATOM 794 N CYS A 56 25.492 -2.127 9.474 1.00 0.00 N ATOM 795 CA CYS A 56 25.586 -3.001 10.640 1.00 0.00 C ATOM 796 C CYS A 56 25.825 -4.452 10.212 1.00 0.00 C ATOM 797 O CYS A 56 25.745 -4.769 9.024 1.00 0.00 O ATOM 798 CB CYS A 56 24.327 -2.884 11.510 1.00 0.00 C ATOM 799 SG CYS A 56 24.148 -1.316 12.403 1.00 0.00 S ATOM 0 H CYS A 56 24.624 -2.240 8.950 1.00 0.00 H new ATOM 0 HA CYS A 56 26.439 -2.682 11.239 1.00 0.00 H new ATOM 0 HB2 CYS A 56 23.452 -3.024 10.875 1.00 0.00 H new ATOM 0 HB3 CYS A 56 24.329 -3.698 12.235 1.00 0.00 H new ATOM 804 N ASN A 57 26.086 -5.349 11.169 1.00 0.00 N ATOM 805 CA ASN A 57 26.325 -6.768 10.924 1.00 0.00 C ATOM 806 C ASN A 57 25.523 -7.506 11.979 1.00 0.00 C ATOM 807 O ASN A 57 25.919 -7.530 13.141 1.00 0.00 O ATOM 808 CB ASN A 57 27.826 -7.077 11.027 1.00 0.00 C ATOM 809 CG ASN A 57 28.112 -8.574 11.094 1.00 0.00 C ATOM 810 OD1 ASN A 57 27.409 -9.386 10.500 1.00 0.00 O ATOM 811 ND2 ASN A 57 29.150 -8.969 11.814 1.00 0.00 N ATOM 0 H ASN A 57 26.137 -5.099 12.157 1.00 0.00 H new ATOM 0 HA ASN A 57 26.019 -7.074 9.924 1.00 0.00 H new ATOM 0 HB2 ASN A 57 28.341 -6.650 10.166 1.00 0.00 H new ATOM 0 HB3 ASN A 57 28.233 -6.593 11.915 1.00 0.00 H new ATOM 0 HD21 ASN A 57 29.376 -9.961 11.881 1.00 0.00 H new ATOM 0 HD22 ASN A 57 29.724 -8.281 12.301 1.00 0.00 H new ATOM 818 N ILE A 58 24.372 -8.048 11.598 1.00 0.00 N ATOM 819 CA ILE A 58 23.391 -8.579 12.528 1.00 0.00 C ATOM 820 C ILE A 58 23.255 -10.067 12.234 1.00 0.00 C ATOM 821 O ILE A 58 22.869 -10.453 11.130 1.00 0.00 O ATOM 822 CB ILE A 58 22.085 -7.760 12.384 1.00 0.00 C ATOM 823 CG1 ILE A 58 22.342 -6.298 12.836 1.00 0.00 C ATOM 824 CG2 ILE A 58 20.944 -8.428 13.173 1.00 0.00 C ATOM 825 CD1 ILE A 58 21.178 -5.324 12.626 1.00 0.00 C ATOM 0 H ILE A 58 24.093 -8.131 10.620 1.00 0.00 H new ATOM 0 HA ILE A 58 23.682 -8.486 13.574 1.00 0.00 H new ATOM 0 HB ILE A 58 21.773 -7.736 11.340 1.00 0.00 H new ATOM 0 HG12 ILE A 58 22.600 -6.304 13.895 1.00 0.00 H new ATOM 0 HG13 ILE A 58 23.211 -5.918 12.299 1.00 0.00 H new ATOM 0 HG21 ILE A 58 20.032 -7.841 13.062 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.776 -9.434 12.789 1.00 0.00 H new ATOM 0 HG23 ILE A 58 21.214 -8.483 14.228 1.00 0.00 H new ATOM 0 HD11 ILE A 58 21.466 -4.333 12.976 1.00 0.00 H new ATOM 0 HD12 ILE A 58 20.930 -5.277 11.566 1.00 0.00 H new ATOM 0 HD13 ILE A 58 20.309 -5.669 13.187 1.00 0.00 H new ATOM 837 N ASP A 59 23.579 -10.901 13.220 1.00 0.00 N ATOM 838 CA ASP A 59 23.713 -12.339 13.055 1.00 0.00 C ATOM 839 C ASP A 59 22.847 -13.043 14.092 1.00 0.00 C ATOM 840 O ASP A 59 22.889 -12.685 15.269 1.00 0.00 O ATOM 841 CB ASP A 59 25.193 -12.702 13.222 1.00 0.00 C ATOM 842 CG ASP A 59 25.392 -14.212 13.345 1.00 0.00 C ATOM 843 OD1 ASP A 59 25.306 -14.929 12.322 1.00 0.00 O ATOM 844 OD2 ASP A 59 25.661 -14.687 14.468 1.00 0.00 O ATOM 0 H ASP A 59 23.758 -10.586 14.173 1.00 0.00 H new ATOM 0 HA ASP A 59 23.380 -12.657 12.067 1.00 0.00 H new ATOM 0 HB2 ASP A 59 25.758 -12.328 12.368 1.00 0.00 H new ATOM 0 HB3 ASP A 59 25.591 -12.209 14.109 1.00 0.00 H new ATOM 849 N LYS A 60 22.052 -14.029 13.668 1.00 0.00 N ATOM 850 CA LYS A 60 21.233 -14.903 14.520 1.00 0.00 C ATOM 851 C LYS A 60 20.354 -14.138 15.524 1.00 0.00 C ATOM 852 O LYS A 60 20.065 -14.655 16.604 1.00 0.00 O ATOM 853 CB LYS A 60 22.132 -15.963 15.193 1.00 0.00 C ATOM 854 CG LYS A 60 22.866 -16.847 14.173 1.00 0.00 C ATOM 855 CD LYS A 60 23.867 -17.786 14.861 1.00 0.00 C ATOM 856 CE LYS A 60 24.825 -18.423 13.843 1.00 0.00 C ATOM 857 NZ LYS A 60 25.857 -17.469 13.365 1.00 0.00 N ATOM 0 H LYS A 60 21.956 -14.252 12.677 1.00 0.00 H new ATOM 0 HA LYS A 60 20.516 -15.415 13.878 1.00 0.00 H new ATOM 0 HB2 LYS A 60 22.863 -15.464 15.828 1.00 0.00 H new ATOM 0 HB3 LYS A 60 21.523 -16.592 15.842 1.00 0.00 H new ATOM 0 HG2 LYS A 60 22.141 -17.435 13.611 1.00 0.00 H new ATOM 0 HG3 LYS A 60 23.391 -16.217 13.455 1.00 0.00 H new ATOM 0 HD2 LYS A 60 24.439 -17.230 15.604 1.00 0.00 H new ATOM 0 HD3 LYS A 60 23.327 -18.568 15.395 1.00 0.00 H new ATOM 0 HE2 LYS A 60 25.313 -19.285 14.297 1.00 0.00 H new ATOM 0 HE3 LYS A 60 24.253 -18.793 12.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 26.479 -17.945 12.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 25.394 -16.658 12.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 26.422 -17.135 14.172 1.00 0.00 H new ATOM 871 N SER A 61 19.937 -12.913 15.195 1.00 0.00 N ATOM 872 CA SER A 61 19.278 -12.006 16.127 1.00 0.00 C ATOM 873 C SER A 61 17.862 -11.674 15.657 1.00 0.00 C ATOM 874 O SER A 61 17.531 -11.856 14.482 1.00 0.00 O ATOM 875 CB SER A 61 20.120 -10.733 16.268 1.00 0.00 C ATOM 876 OG SER A 61 21.410 -11.022 16.782 1.00 0.00 O ATOM 0 H SER A 61 20.051 -12.522 14.260 1.00 0.00 H new ATOM 0 HA SER A 61 19.193 -12.490 17.100 1.00 0.00 H new ATOM 0 HB2 SER A 61 20.214 -10.247 15.297 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.612 -10.030 16.928 1.00 0.00 H new ATOM 0 HG SER A 61 21.939 -11.484 16.098 1.00 0.00 H new ATOM 882 N GLN A 62 17.036 -11.143 16.559 1.00 0.00 N ATOM 883 CA GLN A 62 15.715 -10.623 16.243 1.00 0.00 C ATOM 884 C GLN A 62 15.666 -9.170 16.706 1.00 0.00 C ATOM 885 O GLN A 62 16.113 -8.839 17.808 1.00 0.00 O ATOM 886 CB GLN A 62 14.601 -11.492 16.842 1.00 0.00 C ATOM 887 CG GLN A 62 14.696 -12.953 16.359 1.00 0.00 C ATOM 888 CD GLN A 62 13.343 -13.666 16.344 1.00 0.00 C ATOM 889 OE1 GLN A 62 12.397 -13.218 15.699 1.00 0.00 O ATOM 890 NE2 GLN A 62 13.224 -14.804 17.009 1.00 0.00 N ATOM 0 H GLN A 62 17.276 -11.063 17.547 1.00 0.00 H new ATOM 0 HA GLN A 62 15.538 -10.657 15.168 1.00 0.00 H new ATOM 0 HB2 GLN A 62 14.662 -11.464 17.930 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.630 -11.080 16.567 1.00 0.00 H new ATOM 0 HG2 GLN A 62 15.121 -12.971 15.356 1.00 0.00 H new ATOM 0 HG3 GLN A 62 15.382 -13.500 17.006 1.00 0.00 H new ATOM 0 HE21 GLN A 62 14.014 -15.168 17.542 1.00 0.00 H new ATOM 0 HE22 GLN A 62 12.342 -15.317 16.989 1.00 0.00 H new ATOM 899 N VAL A 63 15.132 -8.310 15.846 1.00 0.00 N ATOM 900 CA VAL A 63 15.198 -6.866 15.976 1.00 0.00 C ATOM 901 C VAL A 63 13.790 -6.302 15.770 1.00 0.00 C ATOM 902 O VAL A 63 13.116 -6.685 14.811 1.00 0.00 O ATOM 903 CB VAL A 63 16.192 -6.369 14.899 1.00 0.00 C ATOM 904 CG1 VAL A 63 16.339 -4.849 14.925 1.00 0.00 C ATOM 905 CG2 VAL A 63 17.591 -7.000 15.021 1.00 0.00 C ATOM 0 H VAL A 63 14.626 -8.612 15.014 1.00 0.00 H new ATOM 0 HA VAL A 63 15.543 -6.540 16.957 1.00 0.00 H new ATOM 0 HB VAL A 63 15.758 -6.685 13.951 1.00 0.00 H new ATOM 0 HG11 VAL A 63 17.045 -4.539 14.155 1.00 0.00 H new ATOM 0 HG12 VAL A 63 15.370 -4.386 14.737 1.00 0.00 H new ATOM 0 HG13 VAL A 63 16.707 -4.536 15.902 1.00 0.00 H new ATOM 0 HG21 VAL A 63 18.237 -6.608 14.236 1.00 0.00 H new ATOM 0 HG22 VAL A 63 18.016 -6.758 15.995 1.00 0.00 H new ATOM 0 HG23 VAL A 63 17.512 -8.082 14.919 1.00 0.00 H new ATOM 915 N TYR A 64 13.354 -5.381 16.635 1.00 0.00 N ATOM 916 CA TYR A 64 12.019 -4.789 16.578 1.00 0.00 C ATOM 917 C TYR A 64 12.124 -3.297 16.904 1.00 0.00 C ATOM 918 O TYR A 64 12.757 -2.954 17.902 1.00 0.00 O ATOM 919 CB TYR A 64 11.094 -5.480 17.603 1.00 0.00 C ATOM 920 CG TYR A 64 11.165 -7.001 17.683 1.00 0.00 C ATOM 921 CD1 TYR A 64 12.059 -7.616 18.583 1.00 0.00 C ATOM 922 CD2 TYR A 64 10.315 -7.804 16.898 1.00 0.00 C ATOM 923 CE1 TYR A 64 12.101 -9.015 18.709 1.00 0.00 C ATOM 924 CE2 TYR A 64 10.350 -9.204 17.015 1.00 0.00 C ATOM 925 CZ TYR A 64 11.236 -9.818 17.929 1.00 0.00 C ATOM 926 OH TYR A 64 11.227 -11.173 18.067 1.00 0.00 O ATOM 0 H TYR A 64 13.925 -5.024 17.401 1.00 0.00 H new ATOM 0 HA TYR A 64 11.602 -4.922 15.580 1.00 0.00 H new ATOM 0 HB2 TYR A 64 11.322 -5.078 18.590 1.00 0.00 H new ATOM 0 HB3 TYR A 64 10.066 -5.200 17.374 1.00 0.00 H new ATOM 0 HD1 TYR A 64 12.719 -7.006 19.182 1.00 0.00 H new ATOM 0 HD2 TYR A 64 9.632 -7.341 16.202 1.00 0.00 H new ATOM 0 HE1 TYR A 64 12.792 -9.476 19.399 1.00 0.00 H new ATOM 0 HE2 TYR A 64 9.698 -9.812 16.405 1.00 0.00 H new ATOM 0 HH TYR A 64 10.570 -11.560 17.452 1.00 0.00 H new ATOM 936 N LEU A 65 11.482 -2.406 16.136 1.00 0.00 N ATOM 937 CA LEU A 65 11.405 -0.956 16.404 1.00 0.00 C ATOM 938 C LEU A 65 12.761 -0.302 16.765 1.00 0.00 C ATOM 939 O LEU A 65 12.797 0.707 17.472 1.00 0.00 O ATOM 940 CB LEU A 65 10.333 -0.699 17.489 1.00 0.00 C ATOM 941 CG LEU A 65 8.887 -0.995 17.048 1.00 0.00 C ATOM 942 CD1 LEU A 65 7.968 -1.044 18.274 1.00 0.00 C ATOM 943 CD2 LEU A 65 8.365 0.072 16.078 1.00 0.00 C ATOM 0 H LEU A 65 10.987 -2.678 15.287 1.00 0.00 H new ATOM 0 HA LEU A 65 11.114 -0.470 15.473 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.565 -1.310 18.361 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.396 0.343 17.804 1.00 0.00 H new ATOM 0 HG LEU A 65 8.888 -1.958 16.538 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.947 -1.254 17.955 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.305 -1.829 18.950 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.997 -0.084 18.789 1.00 0.00 H new ATOM 0 HD21 LEU A 65 7.342 -0.169 15.788 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.384 1.047 16.565 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.997 0.098 15.191 1.00 0.00 H new ATOM 955 N THR A 66 13.882 -0.847 16.292 1.00 0.00 N ATOM 956 CA THR A 66 15.228 -0.484 16.729 1.00 0.00 C ATOM 957 C THR A 66 15.973 0.288 15.629 1.00 0.00 C ATOM 958 O THR A 66 15.585 0.258 14.458 1.00 0.00 O ATOM 959 CB THR A 66 15.896 -1.797 17.191 1.00 0.00 C ATOM 960 OG1 THR A 66 15.297 -2.186 18.416 1.00 0.00 O ATOM 961 CG2 THR A 66 17.410 -1.794 17.411 1.00 0.00 C ATOM 0 H THR A 66 13.877 -1.573 15.575 1.00 0.00 H new ATOM 0 HA THR A 66 15.232 0.214 17.566 1.00 0.00 H new ATOM 0 HB THR A 66 15.737 -2.479 16.355 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.394 -2.527 18.245 1.00 0.00 H new ATOM 0 HG21 THR A 66 17.733 -2.784 17.733 1.00 0.00 H new ATOM 0 HG22 THR A 66 17.913 -1.534 16.479 1.00 0.00 H new ATOM 0 HG23 THR A 66 17.665 -1.062 18.178 1.00 0.00 H new ATOM 969 N THR A 67 17.047 0.986 16.003 1.00 0.00 N ATOM 970 CA THR A 67 17.876 1.775 15.100 1.00 0.00 C ATOM 971 C THR A 67 19.333 1.337 15.288 1.00 0.00 C ATOM 972 O THR A 67 19.828 1.312 16.415 1.00 0.00 O ATOM 973 CB THR A 67 17.664 3.273 15.389 1.00 0.00 C ATOM 974 OG1 THR A 67 16.285 3.603 15.351 1.00 0.00 O ATOM 975 CG2 THR A 67 18.383 4.160 14.367 1.00 0.00 C ATOM 0 H THR A 67 17.370 1.017 16.970 1.00 0.00 H new ATOM 0 HA THR A 67 17.602 1.612 14.058 1.00 0.00 H new ATOM 0 HB THR A 67 18.076 3.454 16.382 1.00 0.00 H new ATOM 0 HG1 THR A 67 16.172 4.558 15.539 1.00 0.00 H new ATOM 0 HG21 THR A 67 18.207 5.208 14.608 1.00 0.00 H new ATOM 0 HG22 THR A 67 19.453 3.955 14.397 1.00 0.00 H new ATOM 0 HG23 THR A 67 18.001 3.948 13.369 1.00 0.00 H new ATOM 983 N CYS A 68 20.027 1.006 14.196 1.00 0.00 N ATOM 984 CA CYS A 68 21.394 0.501 14.219 1.00 0.00 C ATOM 985 C CYS A 68 22.257 1.355 13.297 1.00 0.00 C ATOM 986 O CYS A 68 21.895 1.568 12.137 1.00 0.00 O ATOM 987 CB CYS A 68 21.403 -0.971 13.781 1.00 0.00 C ATOM 988 SG CYS A 68 22.991 -1.814 14.011 1.00 0.00 S ATOM 0 H CYS A 68 19.643 1.085 13.254 1.00 0.00 H new ATOM 0 HA CYS A 68 21.802 0.559 15.228 1.00 0.00 H new ATOM 0 HB2 CYS A 68 20.637 -1.508 14.340 1.00 0.00 H new ATOM 0 HB3 CYS A 68 21.126 -1.025 12.728 1.00 0.00 H new ATOM 993 N THR A 69 23.408 1.812 13.790 1.00 0.00 N ATOM 994 CA THR A 69 24.368 2.572 13.007 1.00 0.00 C ATOM 995 C THR A 69 25.757 2.019 13.318 1.00 0.00 C ATOM 996 O THR A 69 26.182 2.038 14.477 1.00 0.00 O ATOM 997 CB THR A 69 24.254 4.071 13.354 1.00 0.00 C ATOM 998 OG1 THR A 69 22.910 4.519 13.287 1.00 0.00 O ATOM 999 CG2 THR A 69 25.080 4.938 12.398 1.00 0.00 C ATOM 0 H THR A 69 23.698 1.660 14.756 1.00 0.00 H new ATOM 0 HA THR A 69 24.175 2.476 11.939 1.00 0.00 H new ATOM 0 HB THR A 69 24.634 4.173 14.371 1.00 0.00 H new ATOM 0 HG1 THR A 69 22.871 5.472 13.514 1.00 0.00 H new ATOM 0 HG21 THR A 69 24.974 5.987 12.675 1.00 0.00 H new ATOM 0 HG22 THR A 69 26.129 4.650 12.461 1.00 0.00 H new ATOM 0 HG23 THR A 69 24.725 4.794 11.378 1.00 0.00 H new ATOM 1007 N GLY A 70 26.463 1.528 12.295 1.00 0.00 N ATOM 1008 CA GLY A 70 27.863 1.129 12.392 1.00 0.00 C ATOM 1009 C GLY A 70 28.126 0.174 13.555 1.00 0.00 C ATOM 1010 O GLY A 70 29.084 0.386 14.298 1.00 0.00 O ATOM 0 H GLY A 70 26.068 1.396 11.364 1.00 0.00 H new ATOM 0 HA2 GLY A 70 28.166 0.652 11.460 1.00 0.00 H new ATOM 0 HA3 GLY A 70 28.482 2.018 12.510 1.00 0.00 H new ATOM 1014 N SER A 71 27.252 -0.816 13.761 1.00 0.00 N ATOM 1015 CA SER A 71 27.248 -1.673 14.940 1.00 0.00 C ATOM 1016 C SER A 71 27.031 -3.137 14.555 1.00 0.00 C ATOM 1017 O SER A 71 26.729 -3.446 13.402 1.00 0.00 O ATOM 1018 CB SER A 71 26.159 -1.197 15.913 1.00 0.00 C ATOM 1019 OG SER A 71 26.454 0.092 16.411 1.00 0.00 O ATOM 0 H SER A 71 26.514 -1.045 13.096 1.00 0.00 H new ATOM 0 HA SER A 71 28.220 -1.605 15.429 1.00 0.00 H new ATOM 0 HB2 SER A 71 25.194 -1.183 15.406 1.00 0.00 H new ATOM 0 HB3 SER A 71 26.074 -1.900 16.741 1.00 0.00 H new ATOM 0 HG SER A 71 26.240 0.763 15.729 1.00 0.00 H new ATOM 1025 N GLN A 72 27.178 -4.062 15.502 1.00 0.00 N ATOM 1026 CA GLN A 72 27.073 -5.488 15.243 1.00 0.00 C ATOM 1027 C GLN A 72 26.198 -6.136 16.303 1.00 0.00 C ATOM 1028 O GLN A 72 26.340 -5.809 17.481 1.00 0.00 O ATOM 1029 CB GLN A 72 28.457 -6.153 15.249 1.00 0.00 C ATOM 1030 CG GLN A 72 29.515 -5.433 14.405 1.00 0.00 C ATOM 1031 CD GLN A 72 30.742 -6.321 14.246 1.00 0.00 C ATOM 1032 OE1 GLN A 72 30.862 -7.065 13.272 1.00 0.00 O ATOM 1033 NE2 GLN A 72 31.648 -6.296 15.210 1.00 0.00 N ATOM 0 H GLN A 72 27.375 -3.836 16.477 1.00 0.00 H new ATOM 0 HA GLN A 72 26.627 -5.624 14.258 1.00 0.00 H new ATOM 0 HB2 GLN A 72 28.812 -6.214 16.278 1.00 0.00 H new ATOM 0 HB3 GLN A 72 28.356 -7.176 14.886 1.00 0.00 H new ATOM 0 HG2 GLN A 72 29.105 -5.185 13.426 1.00 0.00 H new ATOM 0 HG3 GLN A 72 29.795 -4.493 14.881 1.00 0.00 H new ATOM 0 HE21 GLN A 72 31.527 -5.671 16.007 1.00 0.00 H new ATOM 0 HE22 GLN A 72 32.467 -6.901 15.156 1.00 0.00 H new ATOM 1042 N TYR A 73 25.358 -7.091 15.908 1.00 0.00 N ATOM 1043 CA TYR A 73 24.596 -7.927 16.836 1.00 0.00 C ATOM 1044 C TYR A 73 24.942 -9.383 16.544 1.00 0.00 C ATOM 1045 O TYR A 73 25.030 -9.759 15.374 1.00 0.00 O ATOM 1046 CB TYR A 73 23.075 -7.759 16.651 1.00 0.00 C ATOM 1047 CG TYR A 73 22.433 -6.380 16.741 1.00 0.00 C ATOM 1048 CD1 TYR A 73 23.066 -5.294 17.375 1.00 0.00 C ATOM 1049 CD2 TYR A 73 21.152 -6.190 16.183 1.00 0.00 C ATOM 1050 CE1 TYR A 73 22.471 -4.023 17.380 1.00 0.00 C ATOM 1051 CE2 TYR A 73 20.543 -4.925 16.190 1.00 0.00 C ATOM 1052 CZ TYR A 73 21.208 -3.828 16.779 1.00 0.00 C ATOM 1053 OH TYR A 73 20.617 -2.604 16.771 1.00 0.00 O ATOM 0 H TYR A 73 25.185 -7.309 14.927 1.00 0.00 H new ATOM 0 HA TYR A 73 24.853 -7.632 17.853 1.00 0.00 H new ATOM 0 HB2 TYR A 73 22.823 -8.168 15.673 1.00 0.00 H new ATOM 0 HB3 TYR A 73 22.589 -8.390 17.395 1.00 0.00 H new ATOM 0 HD1 TYR A 73 24.019 -5.440 17.862 1.00 0.00 H new ATOM 0 HD2 TYR A 73 20.632 -7.029 15.744 1.00 0.00 H new ATOM 0 HE1 TYR A 73 22.980 -3.192 17.845 1.00 0.00 H new ATOM 0 HE2 TYR A 73 19.568 -4.791 15.746 1.00 0.00 H new ATOM 0 HH TYR A 73 21.256 -1.930 17.083 1.00 0.00 H new ATOM 1063 N ASN A 74 25.080 -10.218 17.574 1.00 0.00 N ATOM 1064 CA ASN A 74 25.192 -11.667 17.420 1.00 0.00 C ATOM 1065 C ASN A 74 24.339 -12.350 18.492 1.00 0.00 C ATOM 1066 O ASN A 74 24.633 -12.227 19.681 1.00 0.00 O ATOM 1067 CB ASN A 74 26.662 -12.115 17.517 1.00 0.00 C ATOM 1068 CG ASN A 74 26.805 -13.576 17.951 1.00 0.00 C ATOM 1069 OD1 ASN A 74 27.264 -13.860 19.054 1.00 0.00 O ATOM 1070 ND2 ASN A 74 26.421 -14.541 17.131 1.00 0.00 N ATOM 0 H ASN A 74 25.117 -9.905 18.544 1.00 0.00 H new ATOM 0 HA ASN A 74 24.828 -11.956 16.434 1.00 0.00 H new ATOM 0 HB2 ASN A 74 27.144 -11.979 16.549 1.00 0.00 H new ATOM 0 HB3 ASN A 74 27.187 -11.476 18.227 1.00 0.00 H new ATOM 0 HD21 ASN A 74 26.507 -15.517 17.416 1.00 0.00 H new ATOM 0 HD22 ASN A 74 26.039 -14.309 16.214 1.00 0.00 H new ATOM 1077 N GLY A 75 23.313 -13.094 18.080 1.00 0.00 N ATOM 1078 CA GLY A 75 22.495 -13.903 18.973 1.00 0.00 C ATOM 1079 C GLY A 75 21.721 -13.077 20.001 1.00 0.00 C ATOM 1080 O GLY A 75 21.739 -13.437 21.183 1.00 0.00 O ATOM 0 H GLY A 75 23.026 -13.150 17.103 1.00 0.00 H new ATOM 0 HA2 GLY A 75 21.790 -14.485 18.380 1.00 0.00 H new ATOM 0 HA3 GLY A 75 23.135 -14.614 19.496 1.00 0.00 H new ATOM 1084 N ILE A 76 21.077 -11.975 19.599 1.00 0.00 N ATOM 1085 CA ILE A 76 20.386 -11.076 20.529 1.00 0.00 C ATOM 1086 C ILE A 76 18.902 -10.929 20.169 1.00 0.00 C ATOM 1087 O ILE A 76 18.482 -11.211 19.047 1.00 0.00 O ATOM 1088 CB ILE A 76 21.111 -9.706 20.662 1.00 0.00 C ATOM 1089 CG1 ILE A 76 20.635 -8.637 19.648 1.00 0.00 C ATOM 1090 CG2 ILE A 76 22.647 -9.856 20.603 1.00 0.00 C ATOM 1091 CD1 ILE A 76 21.274 -7.261 19.864 1.00 0.00 C ATOM 0 H ILE A 76 21.021 -11.683 18.623 1.00 0.00 H new ATOM 0 HA ILE A 76 20.424 -11.534 21.517 1.00 0.00 H new ATOM 0 HB ILE A 76 20.830 -9.341 21.650 1.00 0.00 H new ATOM 0 HG12 ILE A 76 20.862 -8.979 18.638 1.00 0.00 H new ATOM 0 HG13 ILE A 76 19.551 -8.540 19.716 1.00 0.00 H new ATOM 0 HG21 ILE A 76 23.112 -8.875 20.700 1.00 0.00 H new ATOM 0 HG22 ILE A 76 22.981 -10.498 21.418 1.00 0.00 H new ATOM 0 HG23 ILE A 76 22.933 -10.301 19.650 1.00 0.00 H new ATOM 0 HD11 ILE A 76 20.895 -6.562 19.118 1.00 0.00 H new ATOM 0 HD12 ILE A 76 21.026 -6.897 20.861 1.00 0.00 H new ATOM 0 HD13 ILE A 76 22.357 -7.343 19.766 1.00 0.00 H new ATOM 1103 N TYR A 77 18.127 -10.405 21.112 1.00 0.00 N ATOM 1104 CA TYR A 77 16.753 -9.972 20.951 1.00 0.00 C ATOM 1105 C TYR A 77 16.764 -8.513 21.391 1.00 0.00 C ATOM 1106 O TYR A 77 17.144 -8.226 22.529 1.00 0.00 O ATOM 1107 CB TYR A 77 15.819 -10.814 21.835 1.00 0.00 C ATOM 1108 CG TYR A 77 15.744 -12.289 21.477 1.00 0.00 C ATOM 1109 CD1 TYR A 77 16.725 -13.184 21.948 1.00 0.00 C ATOM 1110 CD2 TYR A 77 14.674 -12.774 20.699 1.00 0.00 C ATOM 1111 CE1 TYR A 77 16.649 -14.551 21.636 1.00 0.00 C ATOM 1112 CE2 TYR A 77 14.582 -14.144 20.395 1.00 0.00 C ATOM 1113 CZ TYR A 77 15.573 -15.040 20.859 1.00 0.00 C ATOM 1114 OH TYR A 77 15.500 -16.372 20.578 1.00 0.00 O ATOM 0 H TYR A 77 18.466 -10.265 22.064 1.00 0.00 H new ATOM 0 HA TYR A 77 16.389 -10.088 19.930 1.00 0.00 H new ATOM 0 HB2 TYR A 77 16.147 -10.724 22.871 1.00 0.00 H new ATOM 0 HB3 TYR A 77 14.815 -10.392 21.781 1.00 0.00 H new ATOM 0 HD1 TYR A 77 17.541 -12.816 22.553 1.00 0.00 H new ATOM 0 HD2 TYR A 77 13.921 -12.091 20.335 1.00 0.00 H new ATOM 0 HE1 TYR A 77 17.412 -15.229 21.989 1.00 0.00 H new ATOM 0 HE2 TYR A 77 13.754 -14.512 19.807 1.00 0.00 H new ATOM 0 HH TYR A 77 14.703 -16.549 20.036 1.00 0.00 H new ATOM 1124 N ILE A 78 16.407 -7.583 20.508 1.00 0.00 N ATOM 1125 CA ILE A 78 16.513 -6.156 20.793 1.00 0.00 C ATOM 1126 C ILE A 78 15.242 -5.458 20.326 1.00 0.00 C ATOM 1127 O ILE A 78 14.812 -5.643 19.183 1.00 0.00 O ATOM 1128 CB ILE A 78 17.823 -5.581 20.206 1.00 0.00 C ATOM 1129 CG1 ILE A 78 17.953 -4.085 20.559 1.00 0.00 C ATOM 1130 CG2 ILE A 78 17.969 -5.817 18.692 1.00 0.00 C ATOM 1131 CD1 ILE A 78 19.367 -3.527 20.348 1.00 0.00 C ATOM 0 H ILE A 78 16.039 -7.796 19.581 1.00 0.00 H new ATOM 0 HA ILE A 78 16.586 -5.976 21.866 1.00 0.00 H new ATOM 0 HB ILE A 78 18.645 -6.128 20.668 1.00 0.00 H new ATOM 0 HG12 ILE A 78 17.251 -3.514 19.951 1.00 0.00 H new ATOM 0 HG13 ILE A 78 17.665 -3.939 21.600 1.00 0.00 H new ATOM 0 HG21 ILE A 78 18.910 -5.388 18.346 1.00 0.00 H new ATOM 0 HG22 ILE A 78 17.961 -6.888 18.488 1.00 0.00 H new ATOM 0 HG23 ILE A 78 17.140 -5.342 18.168 1.00 0.00 H new ATOM 0 HD11 ILE A 78 19.385 -2.471 20.616 1.00 0.00 H new ATOM 0 HD12 ILE A 78 20.071 -4.073 20.976 1.00 0.00 H new ATOM 0 HD13 ILE A 78 19.651 -3.641 19.302 1.00 0.00 H new ATOM 1143 N ARG A 79 14.625 -4.675 21.218 1.00 0.00 N ATOM 1144 CA ARG A 79 13.373 -3.987 20.931 1.00 0.00 C ATOM 1145 C ARG A 79 13.466 -2.523 21.329 1.00 0.00 C ATOM 1146 O ARG A 79 13.994 -2.194 22.399 1.00 0.00 O ATOM 1147 CB ARG A 79 12.170 -4.712 21.563 1.00 0.00 C ATOM 1148 CG ARG A 79 12.252 -4.854 23.087 1.00 0.00 C ATOM 1149 CD ARG A 79 11.065 -5.637 23.653 1.00 0.00 C ATOM 1150 NE ARG A 79 11.282 -5.878 25.084 1.00 0.00 N ATOM 1151 CZ ARG A 79 10.412 -6.338 25.984 1.00 0.00 C ATOM 1152 NH1 ARG A 79 9.174 -6.680 25.636 1.00 0.00 N ATOM 1153 NH2 ARG A 79 10.820 -6.442 27.243 1.00 0.00 N ATOM 0 H ARG A 79 14.984 -4.504 22.157 1.00 0.00 H new ATOM 0 HA ARG A 79 13.200 -4.012 19.855 1.00 0.00 H new ATOM 0 HB2 ARG A 79 11.259 -4.171 21.308 1.00 0.00 H new ATOM 0 HB3 ARG A 79 12.085 -5.705 21.121 1.00 0.00 H new ATOM 0 HG2 ARG A 79 13.180 -5.358 23.355 1.00 0.00 H new ATOM 0 HG3 ARG A 79 12.284 -3.864 23.542 1.00 0.00 H new ATOM 0 HD2 ARG A 79 10.141 -5.079 23.502 1.00 0.00 H new ATOM 0 HD3 ARG A 79 10.955 -6.584 23.125 1.00 0.00 H new ATOM 0 HE ARG A 79 12.216 -5.667 25.435 1.00 0.00 H new ATOM 0 HH11 ARG A 79 8.875 -6.592 24.665 1.00 0.00 H new ATOM 0 HH12 ARG A 79 8.524 -7.030 26.340 1.00 0.00 H new ATOM 0 HH21 ARG A 79 11.771 -6.174 27.495 1.00 0.00 H new ATOM 0 HH22 ARG A 79 10.182 -6.790 27.959 1.00 0.00 H new ATOM 1167 N SER A 80 12.916 -1.659 20.479 1.00 0.00 N ATOM 1168 CA SER A 80 12.729 -0.235 20.723 1.00 0.00 C ATOM 1169 C SER A 80 14.018 0.493 21.149 1.00 0.00 C ATOM 1170 O SER A 80 13.946 1.465 21.903 1.00 0.00 O ATOM 1171 CB SER A 80 11.570 -0.071 21.714 1.00 0.00 C ATOM 1172 OG SER A 80 10.417 -0.770 21.261 1.00 0.00 O ATOM 0 H SER A 80 12.574 -1.947 19.562 1.00 0.00 H new ATOM 0 HA SER A 80 12.469 0.259 19.786 1.00 0.00 H new ATOM 0 HB2 SER A 80 11.867 -0.446 22.693 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.336 0.987 21.835 1.00 0.00 H new ATOM 0 HG SER A 80 9.690 -0.655 21.907 1.00 0.00 H new ATOM 1178 N SER A 81 15.191 0.037 20.693 1.00 0.00 N ATOM 1179 CA SER A 81 16.489 0.497 21.186 1.00 0.00 C ATOM 1180 C SER A 81 17.316 1.172 20.082 1.00 0.00 C ATOM 1181 O SER A 81 16.914 1.193 18.916 1.00 0.00 O ATOM 1182 CB SER A 81 17.225 -0.706 21.789 1.00 0.00 C ATOM 1183 OG SER A 81 16.516 -1.233 22.897 1.00 0.00 O ATOM 0 H SER A 81 15.263 -0.671 19.962 1.00 0.00 H new ATOM 0 HA SER A 81 16.338 1.258 21.951 1.00 0.00 H new ATOM 0 HB2 SER A 81 17.348 -1.479 21.030 1.00 0.00 H new ATOM 0 HB3 SER A 81 18.225 -0.405 22.102 1.00 0.00 H new ATOM 0 HG SER A 81 15.690 -1.657 22.585 1.00 0.00 H new ATOM 1189 N THR A 82 18.480 1.718 20.438 1.00 0.00 N ATOM 1190 CA THR A 82 19.401 2.372 19.515 1.00 0.00 C ATOM 1191 C THR A 82 20.830 1.923 19.844 1.00 0.00 C ATOM 1192 O THR A 82 21.196 1.858 21.021 1.00 0.00 O ATOM 1193 CB THR A 82 19.236 3.900 19.622 1.00 0.00 C ATOM 1194 OG1 THR A 82 17.891 4.285 19.397 1.00 0.00 O ATOM 1195 CG2 THR A 82 20.105 4.660 18.612 1.00 0.00 C ATOM 0 H THR A 82 18.814 1.716 21.402 1.00 0.00 H new ATOM 0 HA THR A 82 19.184 2.090 18.485 1.00 0.00 H new ATOM 0 HB THR A 82 19.550 4.156 20.634 1.00 0.00 H new ATOM 0 HG1 THR A 82 17.813 5.259 19.472 1.00 0.00 H new ATOM 0 HG21 THR A 82 19.949 5.732 18.732 1.00 0.00 H new ATOM 0 HG22 THR A 82 21.155 4.424 18.786 1.00 0.00 H new ATOM 0 HG23 THR A 82 19.829 4.364 17.600 1.00 0.00 H new ATOM 1203 N THR A 83 21.642 1.642 18.826 1.00 0.00 N ATOM 1204 CA THR A 83 23.014 1.161 18.975 1.00 0.00 C ATOM 1205 C THR A 83 23.900 1.881 17.948 1.00 0.00 C ATOM 1206 O THR A 83 23.566 1.896 16.756 1.00 0.00 O ATOM 1207 CB THR A 83 23.037 -0.370 18.801 1.00 0.00 C ATOM 1208 OG1 THR A 83 22.353 -0.743 17.620 1.00 0.00 O ATOM 1209 CG2 THR A 83 22.367 -1.102 19.971 1.00 0.00 C ATOM 0 H THR A 83 21.357 1.745 17.852 1.00 0.00 H new ATOM 0 HA THR A 83 23.404 1.381 19.969 1.00 0.00 H new ATOM 0 HB THR A 83 24.088 -0.654 18.755 1.00 0.00 H new ATOM 0 HG1 THR A 83 22.968 -1.215 17.021 1.00 0.00 H new ATOM 0 HG21 THR A 83 22.410 -2.178 19.800 1.00 0.00 H new ATOM 0 HG22 THR A 83 22.888 -0.861 20.897 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.326 -0.788 20.048 1.00 0.00 H new ATOM 1217 N THR A 84 24.999 2.490 18.403 1.00 0.00 N ATOM 1218 CA THR A 84 25.867 3.332 17.589 1.00 0.00 C ATOM 1219 C THR A 84 27.332 3.025 17.925 1.00 0.00 C ATOM 1220 O THR A 84 27.778 3.261 19.050 1.00 0.00 O ATOM 1221 CB THR A 84 25.524 4.815 17.841 1.00 0.00 C ATOM 1222 OG1 THR A 84 24.135 5.058 17.705 1.00 0.00 O ATOM 1223 CG2 THR A 84 26.257 5.746 16.868 1.00 0.00 C ATOM 0 H THR A 84 25.313 2.407 19.370 1.00 0.00 H new ATOM 0 HA THR A 84 25.713 3.125 16.530 1.00 0.00 H new ATOM 0 HB THR A 84 25.844 5.023 18.862 1.00 0.00 H new ATOM 0 HG1 THR A 84 23.951 6.006 17.872 1.00 0.00 H new ATOM 0 HG21 THR A 84 25.987 6.780 17.081 1.00 0.00 H new ATOM 0 HG22 THR A 84 27.333 5.621 16.986 1.00 0.00 H new ATOM 0 HG23 THR A 84 25.973 5.500 15.845 1.00 0.00 H new ATOM 1231 N GLY A 85 28.109 2.540 16.952 1.00 0.00 N ATOM 1232 CA GLY A 85 29.514 2.205 17.165 1.00 0.00 C ATOM 1233 C GLY A 85 29.679 1.120 18.229 1.00 0.00 C ATOM 1234 O GLY A 85 30.555 1.226 19.090 1.00 0.00 O ATOM 0 H GLY A 85 27.781 2.370 16.001 1.00 0.00 H new ATOM 0 HA2 GLY A 85 29.954 1.866 16.227 1.00 0.00 H new ATOM 0 HA3 GLY A 85 30.060 3.099 17.468 1.00 0.00 H new ATOM 1238 N THR A 86 28.848 0.084 18.196 1.00 0.00 N ATOM 1239 CA THR A 86 28.745 -0.906 19.265 1.00 0.00 C ATOM 1240 C THR A 86 28.764 -2.326 18.704 1.00 0.00 C ATOM 1241 O THR A 86 28.353 -2.552 17.573 1.00 0.00 O ATOM 1242 CB THR A 86 27.442 -0.646 20.052 1.00 0.00 C ATOM 1243 OG1 THR A 86 26.391 -0.080 19.284 1.00 0.00 O ATOM 1244 CG2 THR A 86 27.659 0.325 21.206 1.00 0.00 C ATOM 0 H THR A 86 28.217 -0.095 17.415 1.00 0.00 H new ATOM 0 HA THR A 86 29.603 -0.811 19.930 1.00 0.00 H new ATOM 0 HB THR A 86 27.160 -1.643 20.389 1.00 0.00 H new ATOM 0 HG1 THR A 86 26.544 -0.264 18.334 1.00 0.00 H new ATOM 0 HG21 THR A 86 26.718 0.480 21.733 1.00 0.00 H new ATOM 0 HG22 THR A 86 28.397 -0.087 21.895 1.00 0.00 H new ATOM 0 HG23 THR A 86 28.018 1.278 20.817 1.00 0.00 H new ATOM 1252 N SER A 87 29.199 -3.303 19.494 1.00 0.00 N ATOM 1253 CA SER A 87 29.058 -4.715 19.175 1.00 0.00 C ATOM 1254 C SER A 87 28.369 -5.347 20.379 1.00 0.00 C ATOM 1255 O SER A 87 28.745 -5.075 21.524 1.00 0.00 O ATOM 1256 CB SER A 87 30.414 -5.349 18.862 1.00 0.00 C ATOM 1257 OG SER A 87 30.941 -4.821 17.658 1.00 0.00 O ATOM 0 H SER A 87 29.665 -3.131 20.385 1.00 0.00 H new ATOM 0 HA SER A 87 28.463 -4.873 18.275 1.00 0.00 H new ATOM 0 HB2 SER A 87 31.107 -5.163 19.682 1.00 0.00 H new ATOM 0 HB3 SER A 87 30.306 -6.430 18.775 1.00 0.00 H new ATOM 0 HG SER A 87 31.028 -3.848 17.738 1.00 0.00 H new ATOM 1263 N ILE A 88 27.337 -6.142 20.112 1.00 0.00 N ATOM 1264 CA ILE A 88 26.412 -6.677 21.095 1.00 0.00 C ATOM 1265 C ILE A 88 26.385 -8.187 20.867 1.00 0.00 C ATOM 1266 O ILE A 88 26.238 -8.648 19.728 1.00 0.00 O ATOM 1267 CB ILE A 88 24.996 -6.082 20.893 1.00 0.00 C ATOM 1268 CG1 ILE A 88 24.889 -4.579 20.531 1.00 0.00 C ATOM 1269 CG2 ILE A 88 24.142 -6.397 22.127 1.00 0.00 C ATOM 1270 CD1 ILE A 88 25.326 -3.581 21.606 1.00 0.00 C ATOM 0 H ILE A 88 27.117 -6.441 19.162 1.00 0.00 H new ATOM 0 HA ILE A 88 26.724 -6.427 22.109 1.00 0.00 H new ATOM 0 HB ILE A 88 24.626 -6.571 19.992 1.00 0.00 H new ATOM 0 HG12 ILE A 88 25.487 -4.401 19.638 1.00 0.00 H new ATOM 0 HG13 ILE A 88 23.853 -4.365 20.269 1.00 0.00 H new ATOM 0 HG21 ILE A 88 23.143 -5.982 21.994 1.00 0.00 H new ATOM 0 HG22 ILE A 88 24.072 -7.477 22.255 1.00 0.00 H new ATOM 0 HG23 ILE A 88 24.603 -5.956 23.011 1.00 0.00 H new ATOM 0 HD11 ILE A 88 25.203 -2.565 21.231 1.00 0.00 H new ATOM 0 HD12 ILE A 88 24.713 -3.715 22.498 1.00 0.00 H new ATOM 0 HD13 ILE A 88 26.373 -3.751 21.856 1.00 0.00 H new ATOM 1282 N SER A 89 26.536 -8.975 21.925 1.00 0.00 N ATOM 1283 CA SER A 89 26.517 -10.430 21.838 1.00 0.00 C ATOM 1284 C SER A 89 25.911 -11.027 23.109 1.00 0.00 C ATOM 1285 O SER A 89 25.712 -10.312 24.093 1.00 0.00 O ATOM 1286 CB SER A 89 27.941 -10.948 21.579 1.00 0.00 C ATOM 1287 OG SER A 89 28.516 -10.321 20.442 1.00 0.00 O ATOM 0 H SER A 89 26.676 -8.621 22.871 1.00 0.00 H new ATOM 0 HA SER A 89 25.889 -10.743 21.004 1.00 0.00 H new ATOM 0 HB2 SER A 89 28.563 -10.762 22.454 1.00 0.00 H new ATOM 0 HB3 SER A 89 27.917 -12.027 21.429 1.00 0.00 H new ATOM 0 HG SER A 89 29.422 -10.667 20.301 1.00 0.00 H new ATOM 1321 N CYS A 93 21.127 -12.756 24.487 1.00 0.00 N ATOM 1322 CA CYS A 93 21.109 -11.384 24.971 1.00 0.00 C ATOM 1323 C CYS A 93 19.736 -10.782 24.688 1.00 0.00 C ATOM 1324 O CYS A 93 19.152 -11.043 23.635 1.00 0.00 O ATOM 1325 CB CYS A 93 22.240 -10.631 24.257 1.00 0.00 C ATOM 1326 SG CYS A 93 22.206 -8.821 24.280 1.00 0.00 S ATOM 0 HA CYS A 93 21.274 -11.321 26.047 1.00 0.00 H new ATOM 0 HB2 CYS A 93 23.184 -10.952 24.697 1.00 0.00 H new ATOM 0 HB3 CYS A 93 22.248 -10.951 23.215 1.00 0.00 H new ATOM 1331 N SER A 94 19.255 -9.946 25.599 1.00 0.00 N ATOM 1332 CA SER A 94 17.934 -9.352 25.578 1.00 0.00 C ATOM 1333 C SER A 94 18.085 -7.880 25.953 1.00 0.00 C ATOM 1334 O SER A 94 18.704 -7.571 26.973 1.00 0.00 O ATOM 1335 CB SER A 94 17.061 -10.099 26.591 1.00 0.00 C ATOM 1336 OG SER A 94 16.840 -11.440 26.179 1.00 0.00 O ATOM 0 H SER A 94 19.804 -9.653 26.407 1.00 0.00 H new ATOM 0 HA SER A 94 17.465 -9.423 24.597 1.00 0.00 H new ATOM 0 HB2 SER A 94 17.543 -10.090 27.569 1.00 0.00 H new ATOM 0 HB3 SER A 94 16.106 -9.586 26.701 1.00 0.00 H new ATOM 0 HG SER A 94 16.282 -11.898 26.842 1.00 0.00 H new ATOM 1342 N ILE A 95 17.549 -6.978 25.124 1.00 0.00 N ATOM 1343 CA ILE A 95 17.701 -5.532 25.256 1.00 0.00 C ATOM 1344 C ILE A 95 16.339 -4.900 24.965 1.00 0.00 C ATOM 1345 O ILE A 95 15.715 -5.209 23.946 1.00 0.00 O ATOM 1346 CB ILE A 95 18.797 -5.022 24.282 1.00 0.00 C ATOM 1347 CG1 ILE A 95 20.152 -5.685 24.603 1.00 0.00 C ATOM 1348 CG2 ILE A 95 18.935 -3.491 24.339 1.00 0.00 C ATOM 1349 CD1 ILE A 95 21.358 -5.157 23.824 1.00 0.00 C ATOM 0 H ILE A 95 16.981 -7.246 24.320 1.00 0.00 H new ATOM 0 HA ILE A 95 18.020 -5.257 26.261 1.00 0.00 H new ATOM 0 HB ILE A 95 18.493 -5.296 23.272 1.00 0.00 H new ATOM 0 HG12 ILE A 95 20.351 -5.563 25.668 1.00 0.00 H new ATOM 0 HG13 ILE A 95 20.064 -6.755 24.416 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.711 -3.170 23.644 1.00 0.00 H new ATOM 0 HG22 ILE A 95 17.987 -3.030 24.063 1.00 0.00 H new ATOM 0 HG23 ILE A 95 19.205 -3.187 25.350 1.00 0.00 H new ATOM 0 HD11 ILE A 95 22.254 -5.696 24.132 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.195 -5.305 22.756 1.00 0.00 H new ATOM 0 HD13 ILE A 95 21.486 -4.094 24.028 1.00 0.00 H new ATOM 1361 N SER A 96 15.906 -3.983 25.830 1.00 0.00 N ATOM 1362 CA SER A 96 14.663 -3.243 25.673 1.00 0.00 C ATOM 1363 C SER A 96 14.924 -1.767 25.965 1.00 0.00 C ATOM 1364 O SER A 96 15.518 -1.440 26.998 1.00 0.00 O ATOM 1365 CB SER A 96 13.595 -3.785 26.632 1.00 0.00 C ATOM 1366 OG SER A 96 13.542 -5.205 26.646 1.00 0.00 O ATOM 0 H SER A 96 16.422 -3.732 26.673 1.00 0.00 H new ATOM 0 HA SER A 96 14.299 -3.359 24.652 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.800 -3.423 27.640 1.00 0.00 H new ATOM 0 HB3 SER A 96 12.620 -3.392 26.344 1.00 0.00 H new ATOM 0 HG SER A 96 13.729 -5.530 27.551 1.00 0.00 H new ATOM 1372 N THR A 97 14.442 -0.899 25.070 1.00 0.00 N ATOM 1373 CA THR A 97 14.433 0.559 25.208 1.00 0.00 C ATOM 1374 C THR A 97 15.782 1.173 25.647 1.00 0.00 C ATOM 1375 O THR A 97 15.814 2.201 26.330 1.00 0.00 O ATOM 1376 CB THR A 97 13.190 1.008 26.020 1.00 0.00 C ATOM 1377 OG1 THR A 97 12.935 0.202 27.154 1.00 0.00 O ATOM 1378 CG2 THR A 97 11.917 0.927 25.174 1.00 0.00 C ATOM 0 H THR A 97 14.029 -1.209 24.190 1.00 0.00 H new ATOM 0 HA THR A 97 14.325 0.990 24.213 1.00 0.00 H new ATOM 0 HB THR A 97 13.425 2.027 26.327 1.00 0.00 H new ATOM 0 HG1 THR A 97 13.310 0.631 27.951 1.00 0.00 H new ATOM 0 HG21 THR A 97 11.063 1.248 25.770 1.00 0.00 H new ATOM 0 HG22 THR A 97 12.016 1.576 24.304 1.00 0.00 H new ATOM 0 HG23 THR A 97 11.764 -0.101 24.844 1.00 0.00 H new ATOM 1386 N CYS A 98 16.907 0.566 25.252 1.00 0.00 N ATOM 1387 CA CYS A 98 18.246 1.061 25.560 1.00 0.00 C ATOM 1388 C CYS A 98 18.761 1.981 24.454 1.00 0.00 C ATOM 1389 O CYS A 98 18.325 1.908 23.305 1.00 0.00 O ATOM 1390 CB CYS A 98 19.212 -0.121 25.715 1.00 0.00 C ATOM 1391 SG CYS A 98 18.950 -1.145 27.186 1.00 0.00 S ATOM 0 H CYS A 98 16.909 -0.293 24.703 1.00 0.00 H new ATOM 0 HA CYS A 98 18.191 1.627 26.490 1.00 0.00 H new ATOM 0 HB2 CYS A 98 19.130 -0.755 24.832 1.00 0.00 H new ATOM 0 HB3 CYS A 98 20.231 0.264 25.737 1.00 0.00 H new ATOM 1396 N THR A 99 19.762 2.791 24.789 1.00 0.00 N ATOM 1397 CA THR A 99 20.542 3.579 23.847 1.00 0.00 C ATOM 1398 C THR A 99 21.986 3.266 24.222 1.00 0.00 C ATOM 1399 O THR A 99 22.352 3.417 25.390 1.00 0.00 O ATOM 1400 CB THR A 99 20.179 5.070 23.973 1.00 0.00 C ATOM 1401 OG1 THR A 99 18.797 5.258 23.724 1.00 0.00 O ATOM 1402 CG2 THR A 99 20.960 5.946 22.988 1.00 0.00 C ATOM 0 H THR A 99 20.060 2.919 25.756 1.00 0.00 H new ATOM 0 HA THR A 99 20.354 3.341 22.800 1.00 0.00 H new ATOM 0 HB THR A 99 20.438 5.368 24.989 1.00 0.00 H new ATOM 0 HG1 THR A 99 18.576 6.209 23.808 1.00 0.00 H new ATOM 0 HG21 THR A 99 20.668 6.988 23.117 1.00 0.00 H new ATOM 0 HG22 THR A 99 22.028 5.843 23.177 1.00 0.00 H new ATOM 0 HG23 THR A 99 20.740 5.631 21.968 1.00 0.00 H new ATOM 1410 N ILE A 100 22.790 2.774 23.283 1.00 0.00 N ATOM 1411 CA ILE A 100 24.125 2.253 23.554 1.00 0.00 C ATOM 1412 C ILE A 100 25.042 2.890 22.513 1.00 0.00 C ATOM 1413 O ILE A 100 24.718 2.896 21.323 1.00 0.00 O ATOM 1414 CB ILE A 100 24.139 0.698 23.505 1.00 0.00 C ATOM 1415 CG1 ILE A 100 22.912 0.064 24.213 1.00 0.00 C ATOM 1416 CG2 ILE A 100 25.438 0.144 24.124 1.00 0.00 C ATOM 1417 CD1 ILE A 100 22.905 -1.469 24.255 1.00 0.00 C ATOM 0 H ILE A 100 22.528 2.726 22.298 1.00 0.00 H new ATOM 0 HA ILE A 100 24.466 2.504 24.558 1.00 0.00 H new ATOM 0 HB ILE A 100 24.088 0.423 22.451 1.00 0.00 H new ATOM 0 HG12 ILE A 100 22.868 0.440 25.235 1.00 0.00 H new ATOM 0 HG13 ILE A 100 22.007 0.402 23.709 1.00 0.00 H new ATOM 0 HG21 ILE A 100 25.427 -0.945 24.079 1.00 0.00 H new ATOM 0 HG22 ILE A 100 26.296 0.521 23.567 1.00 0.00 H new ATOM 0 HG23 ILE A 100 25.511 0.464 25.163 1.00 0.00 H new ATOM 0 HD11 ILE A 100 22.008 -1.815 24.769 1.00 0.00 H new ATOM 0 HD12 ILE A 100 22.914 -1.861 23.238 1.00 0.00 H new ATOM 0 HD13 ILE A 100 23.788 -1.822 24.788 1.00 0.00 H new ATOM 1429 N THR A 101 26.174 3.435 22.957 1.00 0.00 N ATOM 1430 CA THR A 101 27.099 4.172 22.108 1.00 0.00 C ATOM 1431 C THR A 101 28.516 3.748 22.488 1.00 0.00 C ATOM 1432 O THR A 101 28.810 3.622 23.676 1.00 0.00 O ATOM 1433 CB THR A 101 26.884 5.689 22.288 1.00 0.00 C ATOM 1434 OG1 THR A 101 25.515 6.036 22.155 1.00 0.00 O ATOM 1435 CG2 THR A 101 27.666 6.509 21.255 1.00 0.00 C ATOM 0 H THR A 101 26.475 3.374 23.930 1.00 0.00 H new ATOM 0 HA THR A 101 26.929 3.950 21.054 1.00 0.00 H new ATOM 0 HB THR A 101 27.242 5.920 23.291 1.00 0.00 H new ATOM 0 HG1 THR A 101 25.409 7.003 22.275 1.00 0.00 H new ATOM 0 HG21 THR A 101 27.484 7.571 21.420 1.00 0.00 H new ATOM 0 HG22 THR A 101 28.731 6.303 21.358 1.00 0.00 H new ATOM 0 HG23 THR A 101 27.339 6.237 20.251 1.00 0.00 H new ATOM 1443 N ARG A 102 29.397 3.535 21.502 1.00 0.00 N ATOM 1444 CA ARG A 102 30.814 3.231 21.666 1.00 0.00 C ATOM 1445 C ARG A 102 31.108 2.264 22.827 1.00 0.00 C ATOM 1446 O ARG A 102 31.999 2.496 23.643 1.00 0.00 O ATOM 1447 CB ARG A 102 31.567 4.568 21.733 1.00 0.00 C ATOM 1448 CG ARG A 102 33.021 4.467 21.257 1.00 0.00 C ATOM 1449 CD ARG A 102 33.232 4.015 19.800 1.00 0.00 C ATOM 1450 NE ARG A 102 32.517 4.867 18.831 1.00 0.00 N ATOM 1451 CZ ARG A 102 32.490 4.678 17.506 1.00 0.00 C ATOM 1452 NH1 ARG A 102 33.147 3.666 16.945 1.00 0.00 N ATOM 1453 NH2 ARG A 102 31.791 5.509 16.739 1.00 0.00 N ATOM 0 H ARG A 102 29.121 3.573 20.521 1.00 0.00 H new ATOM 0 HA ARG A 102 31.178 2.666 20.807 1.00 0.00 H new ATOM 0 HB2 ARG A 102 31.042 5.304 21.124 1.00 0.00 H new ATOM 0 HB3 ARG A 102 31.552 4.935 22.759 1.00 0.00 H new ATOM 0 HG2 ARG A 102 33.491 5.442 21.384 1.00 0.00 H new ATOM 0 HG3 ARG A 102 33.547 3.772 21.911 1.00 0.00 H new ATOM 0 HD2 ARG A 102 34.298 4.027 19.571 1.00 0.00 H new ATOM 0 HD3 ARG A 102 32.894 2.985 19.691 1.00 0.00 H new ATOM 0 HE ARG A 102 32.001 5.665 19.201 1.00 0.00 H new ATOM 0 HH11 ARG A 102 33.681 3.020 17.526 1.00 0.00 H new ATOM 0 HH12 ARG A 102 33.116 3.536 15.934 1.00 0.00 H new ATOM 0 HH21 ARG A 102 31.280 6.284 17.161 1.00 0.00 H new ATOM 0 HH22 ARG A 102 31.766 5.371 15.729 1.00 0.00 H new ATOM 1467 N GLY A 103 30.332 1.180 22.912 1.00 0.00 N ATOM 1468 CA GLY A 103 30.559 0.089 23.852 1.00 0.00 C ATOM 1469 C GLY A 103 29.937 0.285 25.236 1.00 0.00 C ATOM 1470 O GLY A 103 30.113 -0.603 26.069 1.00 0.00 O ATOM 0 H GLY A 103 29.515 1.038 22.318 1.00 0.00 H new ATOM 0 HA2 GLY A 103 30.164 -0.830 23.420 1.00 0.00 H new ATOM 0 HA3 GLY A 103 31.634 -0.051 23.970 1.00 0.00 H new ATOM 1474 N VAL A 104 29.212 1.377 25.505 1.00 0.00 N ATOM 1475 CA VAL A 104 28.615 1.628 26.817 1.00 0.00 C ATOM 1476 C VAL A 104 27.141 2.028 26.670 1.00 0.00 C ATOM 1477 O VAL A 104 26.768 2.765 25.754 1.00 0.00 O ATOM 1478 CB VAL A 104 29.502 2.636 27.583 1.00 0.00 C ATOM 1479 CG1 VAL A 104 29.564 4.039 26.959 1.00 0.00 C ATOM 1480 CG2 VAL A 104 29.102 2.743 29.060 1.00 0.00 C ATOM 0 H VAL A 104 29.024 2.109 24.819 1.00 0.00 H new ATOM 0 HA VAL A 104 28.589 0.723 27.424 1.00 0.00 H new ATOM 0 HB VAL A 104 30.506 2.218 27.506 1.00 0.00 H new ATOM 0 HG11 VAL A 104 30.208 4.678 27.563 1.00 0.00 H new ATOM 0 HG12 VAL A 104 29.966 3.970 25.948 1.00 0.00 H new ATOM 0 HG13 VAL A 104 28.562 4.466 26.923 1.00 0.00 H new ATOM 0 HG21 VAL A 104 29.750 3.462 29.561 1.00 0.00 H new ATOM 0 HG22 VAL A 104 28.067 3.075 29.133 1.00 0.00 H new ATOM 0 HG23 VAL A 104 29.205 1.768 29.536 1.00 0.00 H new ATOM 1490 N ALA A 105 26.287 1.497 27.550 1.00 0.00 N ATOM 1491 CA ALA A 105 24.870 1.834 27.594 1.00 0.00 C ATOM 1492 C ALA A 105 24.681 3.193 28.271 1.00 0.00 C ATOM 1493 O ALA A 105 25.403 3.539 29.210 1.00 0.00 O ATOM 1494 CB ALA A 105 24.097 0.744 28.346 1.00 0.00 C ATOM 0 H ALA A 105 26.567 0.816 28.256 1.00 0.00 H new ATOM 0 HA ALA A 105 24.482 1.895 26.577 1.00 0.00 H new ATOM 0 HB1 ALA A 105 23.039 1.003 28.375 1.00 0.00 H new ATOM 0 HB2 ALA A 105 24.223 -0.210 27.835 1.00 0.00 H new ATOM 0 HB3 ALA A 105 24.479 0.664 29.364 1.00 0.00 H new ATOM 1548 N ALA A 110 15.096 3.803 31.237 1.00 0.00 N ATOM 1549 CA ALA A 110 14.413 3.163 30.119 1.00 0.00 C ATOM 1550 C ALA A 110 15.192 1.950 29.596 1.00 0.00 C ATOM 1551 O ALA A 110 14.575 1.038 29.050 1.00 0.00 O ATOM 1552 CB ALA A 110 14.209 4.181 28.992 1.00 0.00 C ATOM 0 HA ALA A 110 13.447 2.805 30.474 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.698 3.702 28.157 1.00 0.00 H new ATOM 0 HB2 ALA A 110 13.606 5.012 29.357 1.00 0.00 H new ATOM 0 HB3 ALA A 110 15.177 4.554 28.659 1.00 0.00 H new ATOM 1558 N CYS A 111 16.517 1.906 29.758 1.00 0.00 N ATOM 1559 CA CYS A 111 17.300 0.765 29.313 1.00 0.00 C ATOM 1560 C CYS A 111 17.064 -0.411 30.263 1.00 0.00 C ATOM 1561 O CYS A 111 17.215 -0.267 31.480 1.00 0.00 O ATOM 1562 CB CYS A 111 18.786 1.144 29.254 1.00 0.00 C ATOM 1563 SG CYS A 111 19.913 -0.168 28.698 1.00 0.00 S ATOM 0 H CYS A 111 17.063 2.649 30.194 1.00 0.00 H new ATOM 0 HA CYS A 111 16.990 0.468 28.311 1.00 0.00 H new ATOM 0 HB2 CYS A 111 18.898 2.000 28.588 1.00 0.00 H new ATOM 0 HB3 CYS A 111 19.099 1.470 30.246 1.00 0.00 H new ATOM 1568 N LYS A 112 16.754 -1.582 29.705 1.00 0.00 N ATOM 1569 CA LYS A 112 16.697 -2.862 30.410 1.00 0.00 C ATOM 1570 C LYS A 112 17.501 -3.844 29.566 1.00 0.00 C ATOM 1571 O LYS A 112 17.315 -3.896 28.349 1.00 0.00 O ATOM 1572 CB LYS A 112 15.241 -3.339 30.544 1.00 0.00 C ATOM 1573 CG LYS A 112 14.386 -2.505 31.521 1.00 0.00 C ATOM 1574 CD LYS A 112 12.932 -2.352 31.043 1.00 0.00 C ATOM 1575 CE LYS A 112 12.888 -1.369 29.865 1.00 0.00 C ATOM 1576 NZ LYS A 112 11.537 -1.201 29.276 1.00 0.00 N ATOM 0 H LYS A 112 16.528 -1.668 28.714 1.00 0.00 H new ATOM 0 HA LYS A 112 17.101 -2.778 31.419 1.00 0.00 H new ATOM 0 HB2 LYS A 112 14.772 -3.318 29.560 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.240 -4.378 30.875 1.00 0.00 H new ATOM 0 HG2 LYS A 112 14.395 -2.978 32.503 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.833 -1.518 31.639 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.533 -3.320 30.740 1.00 0.00 H new ATOM 0 HD3 LYS A 112 12.305 -1.990 31.858 1.00 0.00 H new ATOM 0 HE2 LYS A 112 13.251 -0.398 30.201 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.572 -1.715 29.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 11.611 -0.677 28.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.118 -2.136 29.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 10.933 -0.672 29.938 1.00 0.00 H new ATOM 1590 N ILE A 113 18.393 -4.603 30.195 1.00 0.00 N ATOM 1591 CA ILE A 113 19.333 -5.486 29.525 1.00 0.00 C ATOM 1592 C ILE A 113 19.516 -6.748 30.371 1.00 0.00 C ATOM 1593 O ILE A 113 19.453 -6.679 31.602 1.00 0.00 O ATOM 1594 CB ILE A 113 20.640 -4.695 29.282 1.00 0.00 C ATOM 1595 CG1 ILE A 113 21.613 -5.498 28.399 1.00 0.00 C ATOM 1596 CG2 ILE A 113 21.341 -4.223 30.572 1.00 0.00 C ATOM 1597 CD1 ILE A 113 22.644 -4.621 27.674 1.00 0.00 C ATOM 0 H ILE A 113 18.482 -4.619 31.211 1.00 0.00 H new ATOM 0 HA ILE A 113 18.972 -5.820 28.552 1.00 0.00 H new ATOM 0 HB ILE A 113 20.339 -3.788 28.758 1.00 0.00 H new ATOM 0 HG12 ILE A 113 22.137 -6.226 29.018 1.00 0.00 H new ATOM 0 HG13 ILE A 113 21.042 -6.060 27.660 1.00 0.00 H new ATOM 0 HG21 ILE A 113 22.248 -3.677 30.314 1.00 0.00 H new ATOM 0 HG22 ILE A 113 20.671 -3.570 31.132 1.00 0.00 H new ATOM 0 HG23 ILE A 113 21.599 -5.088 31.183 1.00 0.00 H new ATOM 0 HD11 ILE A 113 23.297 -5.251 27.070 1.00 0.00 H new ATOM 0 HD12 ILE A 113 22.128 -3.910 27.029 1.00 0.00 H new ATOM 0 HD13 ILE A 113 23.240 -4.078 28.408 1.00 0.00 H new ATOM 1609 N SER A 114 19.727 -7.906 29.741 1.00 0.00 N ATOM 1610 CA SER A 114 20.040 -9.165 30.415 1.00 0.00 C ATOM 1611 C SER A 114 20.748 -10.108 29.438 1.00 0.00 C ATOM 1612 O SER A 114 20.433 -10.119 28.247 1.00 0.00 O ATOM 1613 CB SER A 114 18.745 -9.824 30.918 1.00 0.00 C ATOM 1614 OG SER A 114 18.120 -9.042 31.923 1.00 0.00 O ATOM 0 H SER A 114 19.684 -7.995 28.726 1.00 0.00 H new ATOM 0 HA SER A 114 20.693 -8.964 31.264 1.00 0.00 H new ATOM 0 HB2 SER A 114 18.058 -9.962 30.083 1.00 0.00 H new ATOM 0 HB3 SER A 114 18.969 -10.815 31.313 1.00 0.00 H new ATOM 0 HG SER A 114 18.602 -8.195 32.025 1.00 0.00 H new ATOM 1620 N GLY A 115 21.679 -10.921 29.948 1.00 0.00 N ATOM 1621 CA GLY A 115 22.344 -11.977 29.187 1.00 0.00 C ATOM 1622 C GLY A 115 23.256 -11.454 28.074 1.00 0.00 C ATOM 1623 O GLY A 115 23.482 -12.174 27.101 1.00 0.00 O ATOM 0 H GLY A 115 21.995 -10.861 30.916 1.00 0.00 H new ATOM 0 HA2 GLY A 115 22.934 -12.588 29.870 1.00 0.00 H new ATOM 0 HA3 GLY A 115 21.588 -12.628 28.749 1.00 0.00 H new ATOM 1627 N CYS A 116 23.754 -10.217 28.183 1.00 0.00 N ATOM 1628 CA CYS A 116 24.476 -9.543 27.109 1.00 0.00 C ATOM 1629 C CYS A 116 25.934 -9.281 27.475 1.00 0.00 C ATOM 1630 O CYS A 116 26.297 -9.184 28.652 1.00 0.00 O ATOM 1631 CB CYS A 116 23.800 -8.203 26.796 1.00 0.00 C ATOM 1632 SG CYS A 116 22.085 -8.300 26.238 1.00 0.00 S ATOM 0 H CYS A 116 23.664 -9.654 29.029 1.00 0.00 H new ATOM 0 HA CYS A 116 24.454 -10.200 26.240 1.00 0.00 H new ATOM 0 HB2 CYS A 116 23.837 -7.581 27.691 1.00 0.00 H new ATOM 0 HB3 CYS A 116 24.384 -7.693 26.029 1.00 0.00 H new ATOM 1637 N SER A 117 26.733 -9.074 26.433 1.00 0.00 N ATOM 1638 CA SER A 117 28.104 -8.600 26.460 1.00 0.00 C ATOM 1639 C SER A 117 28.182 -7.455 25.445 1.00 0.00 C ATOM 1640 O SER A 117 27.498 -7.492 24.416 1.00 0.00 O ATOM 1641 CB SER A 117 29.058 -9.747 26.097 1.00 0.00 C ATOM 1642 OG SER A 117 28.888 -10.853 26.975 1.00 0.00 O ATOM 0 H SER A 117 26.412 -9.247 25.481 1.00 0.00 H new ATOM 0 HA SER A 117 28.398 -8.248 27.449 1.00 0.00 H new ATOM 0 HB2 SER A 117 28.877 -10.063 25.070 1.00 0.00 H new ATOM 0 HB3 SER A 117 30.089 -9.396 26.145 1.00 0.00 H new ATOM 0 HG SER A 117 29.506 -11.570 26.721 1.00 0.00 H new ATOM 1648 N LEU A 118 28.991 -6.435 25.742 1.00 0.00 N ATOM 1649 CA LEU A 118 29.099 -5.205 24.959 1.00 0.00 C ATOM 1650 C LEU A 118 30.575 -4.946 24.666 1.00 0.00 C ATOM 1651 O LEU A 118 31.418 -5.154 25.546 1.00 0.00 O ATOM 1652 CB LEU A 118 28.527 -4.004 25.742 1.00 0.00 C ATOM 1653 CG LEU A 118 27.039 -4.083 26.137 1.00 0.00 C ATOM 1654 CD1 LEU A 118 26.656 -2.853 26.969 1.00 0.00 C ATOM 1655 CD2 LEU A 118 26.120 -4.151 24.915 1.00 0.00 C ATOM 0 H LEU A 118 29.605 -6.444 26.556 1.00 0.00 H new ATOM 0 HA LEU A 118 28.532 -5.321 24.035 1.00 0.00 H new ATOM 0 HB2 LEU A 118 29.115 -3.879 26.651 1.00 0.00 H new ATOM 0 HB3 LEU A 118 28.673 -3.106 25.142 1.00 0.00 H new ATOM 0 HG LEU A 118 26.909 -4.997 26.716 1.00 0.00 H new ATOM 0 HD11 LEU A 118 25.603 -2.914 27.245 1.00 0.00 H new ATOM 0 HD12 LEU A 118 27.267 -2.819 27.871 1.00 0.00 H new ATOM 0 HD13 LEU A 118 26.825 -1.950 26.383 1.00 0.00 H new ATOM 0 HD21 LEU A 118 25.082 -4.205 25.243 1.00 0.00 H new ATOM 0 HD22 LEU A 118 26.261 -3.260 24.304 1.00 0.00 H new ATOM 0 HD23 LEU A 118 26.362 -5.036 24.327 1.00 0.00 H new ATOM 1667 N SER A 119 30.869 -4.425 23.476 1.00 0.00 N ATOM 1668 CA SER A 119 32.200 -3.987 23.070 1.00 0.00 C ATOM 1669 C SER A 119 32.067 -2.721 22.221 1.00 0.00 C ATOM 1670 O SER A 119 31.036 -2.502 21.574 1.00 0.00 O ATOM 1671 CB SER A 119 32.910 -5.101 22.281 1.00 0.00 C ATOM 1672 OG SER A 119 32.962 -6.322 23.006 1.00 0.00 O ATOM 0 H SER A 119 30.167 -4.293 22.748 1.00 0.00 H new ATOM 0 HA SER A 119 32.801 -3.767 23.952 1.00 0.00 H new ATOM 0 HB2 SER A 119 32.390 -5.263 21.337 1.00 0.00 H new ATOM 0 HB3 SER A 119 33.923 -4.782 22.037 1.00 0.00 H new ATOM 0 HG SER A 119 33.419 -7.002 22.469 1.00 0.00 H new ATOM 1678 N ALA A 120 33.097 -1.873 22.238 1.00 0.00 N ATOM 1679 CA ALA A 120 33.156 -0.665 21.427 1.00 0.00 C ATOM 1680 C ALA A 120 33.686 -1.000 20.033 1.00 0.00 C ATOM 1681 O ALA A 120 34.609 -1.809 19.893 1.00 0.00 O ATOM 1682 CB ALA A 120 34.093 0.350 22.093 1.00 0.00 C ATOM 0 H ALA A 120 33.921 -2.011 22.823 1.00 0.00 H new ATOM 0 HA ALA A 120 32.155 -0.243 21.341 1.00 0.00 H new ATOM 0 HB1 ALA A 120 34.139 1.255 21.487 1.00 0.00 H new ATOM 0 HB2 ALA A 120 33.716 0.596 23.086 1.00 0.00 H new ATOM 0 HB3 ALA A 120 35.091 -0.079 22.180 1.00 0.00 H new ATOM 1688 N MET A 121 33.121 -0.359 19.011 1.00 0.00 N ATOM 1689 CA MET A 121 33.656 -0.392 17.656 1.00 0.00 C ATOM 1690 C MET A 121 34.872 0.525 17.628 1.00 0.00 C ATOM 1691 O MET A 121 34.735 1.697 18.043 1.00 0.00 O ATOM 1692 CB MET A 121 32.589 0.080 16.664 1.00 0.00 C ATOM 1693 CG MET A 121 31.520 -1.000 16.449 1.00 0.00 C ATOM 1694 SD MET A 121 32.053 -2.462 15.514 1.00 0.00 S ATOM 1695 CE MET A 121 32.021 -1.797 13.827 1.00 0.00 C ATOM 1696 OXT MET A 121 35.954 0.076 17.197 1.00 0.00 O ATOM 0 H MET A 121 32.273 0.201 19.103 1.00 0.00 H new ATOM 0 HA MET A 121 33.944 -1.404 17.370 1.00 0.00 H new ATOM 0 HB2 MET A 121 32.120 0.991 17.035 1.00 0.00 H new ATOM 0 HB3 MET A 121 33.057 0.328 15.711 1.00 0.00 H new ATOM 0 HG2 MET A 121 31.159 -1.327 17.424 1.00 0.00 H new ATOM 0 HG3 MET A 121 30.674 -0.549 15.931 1.00 0.00 H new ATOM 0 HE1 MET A 121 32.324 -2.573 13.124 1.00 0.00 H new ATOM 0 HE2 MET A 121 31.011 -1.464 13.586 1.00 0.00 H new ATOM 0 HE3 MET A 121 32.708 -0.954 13.755 1.00 0.00 H new