USER MOD reduce.3.24.130724 H: found=0, std=0, add=1044, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1040 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 45 THR OG1 : rot -55:sc= 1.72 USER MOD Set 1.2: A 103 SER OG : rot 160:sc= 0.672 USER MOD Set 2.1: A 29 SER OG : rot 72:sc= -1! USER MOD Set 2.2: A 34 GLN : amide:sc= -2.21 K(o=-3.2,f=-7.3!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -162:sc= 0 (180deg=-0.095) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc= -0.269 K(o=-0.27,f=-2) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 HIS : no HD1:sc= -0.163 X(o=-0.16,f=-0.036) USER MOD Single : A 19 THR OG1 : rot 71:sc= 0.687 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 GLN : amide:sc= -0.365 K(o=-0.36,f=-1.1) USER MOD Single : A 30 CYS SG : rot -25:sc= 0.581 USER MOD Single : A 31 ASN : amide:sc= -0.0456 X(o=-0.046,f=-0.046) USER MOD Single : A 32 TYR OH : rot 30:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.378) USER MOD Single : A 40 ASN : amide:sc= -1.65 X(o=-1.7,f=-1.9) USER MOD Single : A 43 THR OG1 : rot 94:sc= 1.39 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 ASN : amide:sc= -0.0256 X(o=-0.026,f=-0.5) USER MOD Single : A 51 SER OG : rot 34:sc= 0.806 USER MOD Single : A 56 MET CE :methyl 157:sc= -0.266 (180deg=-2.01!) USER MOD Single : A 68 HIS : no HD1:sc= -0.0626 X(o=-0.063,f=0) USER MOD Single : A 73 CYS SG : rot -95:sc= 0.638 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 ASN : amide:sc= -0.4 X(o=-0.4,f=-0.4) USER MOD Single : A 80 TYR OH : rot 150:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 93 CYS SG : rot 81:sc= -0.322 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 102 CYS SG : rot -46:sc= -0.241 USER MOD Single : A 105 THR OG1 : rot 180:sc=-0.00152 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 65:sc= 1.04 USER MOD Single : A 111 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 GLN : amide:sc= -0.0206 X(o=-0.021,f=0) USER MOD Single : A 115 GLN : amide:sc= -0.283 X(o=-0.28,f=-0.42) USER MOD Single : A 117 GLN : amide:sc=-0.00935 K(o=-0.0094,f=-0.84!) USER MOD Single : A 118 SER OG : rot 74:sc=0.000561 USER MOD Single : A 120 GLN : amide:sc= -3.67! C(o=-3.7!,f=-8.2!) USER MOD Single : A 121 GLN : amide:sc= -0.0494 K(o=-0.049,f=-1.5!) USER MOD Single : A 122 SER OG : rot -140:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.759 13.884 6.178 1.00 0.00 N ATOM 2 CA MET A 1 -7.577 14.105 5.354 1.00 52.33 C ATOM 3 C MET A 1 -6.433 13.194 5.790 1.00 74.22 C ATOM 4 O MET A 1 -5.504 13.629 6.471 1.00 62.34 O ATOM 5 CB MET A 1 -7.139 15.568 5.435 1.00 63.05 C ATOM 6 CG MET A 1 -8.073 16.523 4.712 1.00 31.52 C ATOM 7 SD MET A 1 -8.300 18.078 5.597 1.00 64.22 S ATOM 8 CE MET A 1 -7.976 19.260 4.291 1.00 74.33 C ATOM 0 H1 MET A 1 -9.596 14.268 5.695 1.00 0.00 H new ATOM 0 H2 MET A 1 -8.887 12.864 6.334 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.638 14.362 7.094 1.00 0.00 H new ATOM 0 HA MET A 1 -7.834 13.867 4.322 1.00 52.33 H new ATOM 0 HB2 MET A 1 -7.073 15.861 6.483 1.00 63.05 H new ATOM 0 HB3 MET A 1 -6.138 15.663 5.014 1.00 63.05 H new ATOM 0 HG2 MET A 1 -7.676 16.730 3.718 1.00 31.52 H new ATOM 0 HG3 MET A 1 -9.042 16.043 4.575 1.00 31.52 H new ATOM 0 HE1 MET A 1 -8.078 20.272 4.683 1.00 74.33 H new ATOM 0 HE2 MET A 1 -6.963 19.117 3.914 1.00 74.33 H new ATOM 0 HE3 MET A 1 -8.690 19.111 3.481 1.00 74.33 H new ATOM 18 N THR A 2 -6.507 11.928 5.392 1.00 4.51 N ATOM 19 CA THR A 2 -5.478 10.956 5.744 1.00 24.43 C ATOM 20 C THR A 2 -4.729 10.478 4.505 1.00 63.04 C ATOM 21 O THR A 2 -4.456 9.288 4.355 1.00 24.42 O ATOM 22 CB THR A 2 -6.081 9.737 6.467 1.00 62.21 C ATOM 23 OG1 THR A 2 -7.247 10.129 7.199 1.00 33.03 O ATOM 24 CG2 THR A 2 -5.067 9.115 7.416 1.00 64.33 C ATOM 0 H THR A 2 -7.268 11.552 4.826 1.00 4.51 H new ATOM 0 HA THR A 2 -4.782 11.460 6.415 1.00 24.43 H new ATOM 0 HB THR A 2 -6.356 8.996 5.716 1.00 62.21 H new ATOM 0 HG1 THR A 2 -7.625 9.348 7.654 1.00 33.03 H new ATOM 0 HG21 THR A 2 -5.515 8.256 7.915 1.00 64.33 H new ATOM 0 HG22 THR A 2 -4.192 8.791 6.852 1.00 64.33 H new ATOM 0 HG23 THR A 2 -4.766 9.852 8.161 1.00 64.33 H new ATOM 32 N GLU A 3 -4.397 11.414 3.621 1.00 21.32 N ATOM 33 CA GLU A 3 -3.678 11.086 2.395 1.00 52.13 C ATOM 34 C GLU A 3 -2.706 12.201 2.020 1.00 1.44 C ATOM 35 O GLU A 3 -2.621 12.601 0.860 1.00 41.11 O ATOM 36 CB GLU A 3 -4.663 10.847 1.249 1.00 10.33 C ATOM 37 CG GLU A 3 -5.541 12.047 0.940 1.00 32.14 C ATOM 38 CD GLU A 3 -6.822 11.664 0.225 1.00 21.13 C ATOM 39 OE1 GLU A 3 -6.760 10.826 -0.698 1.00 0.33 O ATOM 40 OE2 GLU A 3 -7.888 12.203 0.590 1.00 33.22 O ATOM 0 H GLU A 3 -4.614 12.405 3.731 1.00 21.32 H new ATOM 0 HA GLU A 3 -3.108 10.174 2.571 1.00 52.13 H new ATOM 0 HB2 GLU A 3 -4.105 10.575 0.353 1.00 10.33 H new ATOM 0 HB3 GLU A 3 -5.298 9.997 1.499 1.00 10.33 H new ATOM 0 HG2 GLU A 3 -5.788 12.561 1.869 1.00 32.14 H new ATOM 0 HG3 GLU A 3 -4.983 12.752 0.324 1.00 32.14 H new ATOM 47 N ALA A 4 -1.974 12.698 3.013 1.00 71.44 N ATOM 48 CA ALA A 4 -1.007 13.765 2.788 1.00 64.21 C ATOM 49 C ALA A 4 0.159 13.278 1.934 1.00 42.14 C ATOM 50 O ALA A 4 0.586 12.129 2.047 1.00 41.21 O ATOM 51 CB ALA A 4 -0.501 14.307 4.116 1.00 44.31 C ATOM 0 H ALA A 4 -2.033 12.379 3.980 1.00 71.44 H new ATOM 0 HA ALA A 4 -1.508 14.568 2.248 1.00 64.21 H new ATOM 0 HB1 ALA A 4 0.220 15.103 3.933 1.00 44.31 H new ATOM 0 HB2 ALA A 4 -1.339 14.702 4.691 1.00 44.31 H new ATOM 0 HB3 ALA A 4 -0.022 13.505 4.677 1.00 44.31 H new ATOM 57 N ASP A 5 0.669 14.158 1.079 1.00 13.21 N ATOM 58 CA ASP A 5 1.787 13.817 0.207 1.00 74.34 C ATOM 59 C ASP A 5 3.116 13.969 0.941 1.00 20.11 C ATOM 60 O ASP A 5 3.731 12.982 1.342 1.00 63.13 O ATOM 61 CB ASP A 5 1.775 14.701 -1.041 1.00 74.55 C ATOM 62 CG ASP A 5 0.808 14.202 -2.096 1.00 43.32 C ATOM 63 OD1 ASP A 5 0.887 13.008 -2.454 1.00 64.03 O ATOM 64 OD2 ASP A 5 -0.026 15.004 -2.566 1.00 10.41 O ATOM 0 H ASP A 5 0.326 15.113 0.971 1.00 13.21 H new ATOM 0 HA ASP A 5 1.677 12.775 -0.094 1.00 74.34 H new ATOM 0 HB2 ASP A 5 1.506 15.719 -0.759 1.00 74.55 H new ATOM 0 HB3 ASP A 5 2.779 14.742 -1.463 1.00 74.55 H new ATOM 69 N VAL A 6 3.552 15.213 1.111 1.00 52.12 N ATOM 70 CA VAL A 6 4.808 15.494 1.796 1.00 14.33 C ATOM 71 C VAL A 6 5.997 14.949 1.012 1.00 74.40 C ATOM 72 O VAL A 6 5.872 13.971 0.277 1.00 32.43 O ATOM 73 CB VAL A 6 4.822 14.890 3.214 1.00 71.23 C ATOM 74 CG1 VAL A 6 6.025 15.394 3.997 1.00 3.24 C ATOM 75 CG2 VAL A 6 3.527 15.214 3.943 1.00 53.30 C ATOM 0 H VAL A 6 3.055 16.041 0.784 1.00 52.12 H new ATOM 0 HA VAL A 6 4.892 16.578 1.870 1.00 14.33 H new ATOM 0 HB VAL A 6 4.903 13.806 3.128 1.00 71.23 H new ATOM 0 HG11 VAL A 6 6.018 14.957 4.996 1.00 3.24 H new ATOM 0 HG12 VAL A 6 6.941 15.106 3.481 1.00 3.24 H new ATOM 0 HG13 VAL A 6 5.979 16.480 4.076 1.00 3.24 H new ATOM 0 HG21 VAL A 6 3.554 14.780 4.943 1.00 53.30 H new ATOM 0 HG22 VAL A 6 3.413 16.295 4.020 1.00 53.30 H new ATOM 0 HG23 VAL A 6 2.684 14.799 3.390 1.00 53.30 H new ATOM 85 N ASN A 7 7.149 15.590 1.176 1.00 43.42 N ATOM 86 CA ASN A 7 8.362 15.169 0.482 1.00 13.44 C ATOM 87 C ASN A 7 8.944 13.911 1.119 1.00 41.42 C ATOM 88 O ASN A 7 8.646 13.569 2.264 1.00 53.01 O ATOM 89 CB ASN A 7 9.401 16.292 0.502 1.00 50.11 C ATOM 90 CG ASN A 7 9.395 17.108 -0.776 1.00 25.41 C ATOM 91 OD1 ASN A 7 9.189 16.574 -1.866 1.00 22.22 O ATOM 92 ND2 ASN A 7 9.621 18.410 -0.648 1.00 20.40 N ATOM 0 H ASN A 7 7.269 16.402 1.782 1.00 43.42 H new ATOM 0 HA ASN A 7 8.100 14.943 -0.552 1.00 13.44 H new ATOM 0 HB2 ASN A 7 9.206 16.949 1.350 1.00 50.11 H new ATOM 0 HB3 ASN A 7 10.392 15.864 0.652 1.00 50.11 H new ATOM 0 HD21 ASN A 7 9.629 19.010 -1.473 1.00 20.40 H new ATOM 0 HD22 ASN A 7 9.787 18.810 0.275 1.00 20.40 H new ATOM 99 N PRO A 8 9.796 13.204 0.362 1.00 3.23 N ATOM 100 CA PRO A 8 10.440 11.973 0.832 1.00 31.32 C ATOM 101 C PRO A 8 11.474 12.239 1.920 1.00 64.22 C ATOM 102 O PRO A 8 11.822 11.346 2.692 1.00 65.02 O ATOM 103 CB PRO A 8 11.115 11.424 -0.427 1.00 42.51 C ATOM 104 CG PRO A 8 11.344 12.619 -1.287 1.00 20.31 C ATOM 105 CD PRO A 8 10.197 13.552 -1.012 1.00 41.43 C ATOM 0 HA PRO A 8 9.725 11.285 1.283 1.00 31.32 H new ATOM 0 HB2 PRO A 8 12.053 10.924 -0.187 1.00 42.51 H new ATOM 0 HB3 PRO A 8 10.482 10.691 -0.928 1.00 42.51 H new ATOM 0 HG2 PRO A 8 12.297 13.092 -1.052 1.00 20.31 H new ATOM 0 HG3 PRO A 8 11.377 12.341 -2.340 1.00 20.31 H new ATOM 0 HD2 PRO A 8 10.501 14.596 -1.090 1.00 41.43 H new ATOM 0 HD3 PRO A 8 9.380 13.404 -1.719 1.00 41.43 H new ATOM 113 N LYS A 9 11.963 13.473 1.976 1.00 72.45 N ATOM 114 CA LYS A 9 12.957 13.859 2.971 1.00 5.03 C ATOM 115 C LYS A 9 12.287 14.414 4.223 1.00 1.23 C ATOM 116 O LYS A 9 12.654 15.481 4.714 1.00 61.42 O ATOM 117 CB LYS A 9 13.915 14.900 2.388 1.00 71.33 C ATOM 118 CG LYS A 9 14.885 14.331 1.367 1.00 32.20 C ATOM 119 CD LYS A 9 16.182 15.123 1.328 1.00 1.41 C ATOM 120 CE LYS A 9 17.186 14.597 2.343 1.00 42.05 C ATOM 121 NZ LYS A 9 18.507 15.272 2.215 1.00 51.53 N ATOM 0 H LYS A 9 11.687 14.224 1.343 1.00 72.45 H new ATOM 0 HA LYS A 9 13.522 12.969 3.247 1.00 5.03 H new ATOM 0 HB2 LYS A 9 13.334 15.695 1.921 1.00 71.33 H new ATOM 0 HB3 LYS A 9 14.482 15.355 3.200 1.00 71.33 H new ATOM 0 HG2 LYS A 9 15.100 13.290 1.609 1.00 32.20 H new ATOM 0 HG3 LYS A 9 14.422 14.340 0.380 1.00 32.20 H new ATOM 0 HD2 LYS A 9 16.612 15.070 0.328 1.00 1.41 H new ATOM 0 HD3 LYS A 9 15.974 16.174 1.531 1.00 1.41 H new ATOM 0 HE2 LYS A 9 16.797 14.747 3.350 1.00 42.05 H new ATOM 0 HE3 LYS A 9 17.312 13.523 2.207 1.00 42.05 H new ATOM 0 HZ1 LYS A 9 19.164 14.887 2.923 1.00 51.53 H new ATOM 0 HZ2 LYS A 9 18.890 15.108 1.262 1.00 51.53 H new ATOM 0 HZ3 LYS A 9 18.391 16.294 2.370 1.00 51.53 H new ATOM 135 N ALA A 10 11.304 13.682 4.737 1.00 24.31 N ATOM 136 CA ALA A 10 10.584 14.100 5.934 1.00 42.34 C ATOM 137 C ALA A 10 10.038 12.896 6.694 1.00 52.02 C ATOM 138 O ALA A 10 9.045 13.004 7.413 1.00 22.21 O ATOM 139 CB ALA A 10 9.457 15.052 5.567 1.00 22.23 C ATOM 0 H ALA A 10 10.988 12.796 4.343 1.00 24.31 H new ATOM 0 HA ALA A 10 11.285 14.621 6.587 1.00 42.34 H new ATOM 0 HB1 ALA A 10 8.928 15.356 6.471 1.00 22.23 H new ATOM 0 HB2 ALA A 10 9.870 15.933 5.075 1.00 22.23 H new ATOM 0 HB3 ALA A 10 8.763 14.551 4.892 1.00 22.23 H new ATOM 145 N TYR A 11 10.692 11.752 6.530 1.00 65.22 N ATOM 146 CA TYR A 11 10.269 10.527 7.198 1.00 33.31 C ATOM 147 C TYR A 11 11.345 10.032 8.159 1.00 44.13 C ATOM 148 O TYR A 11 12.519 10.389 8.055 1.00 33.35 O ATOM 149 CB TYR A 11 9.951 9.442 6.167 1.00 55.32 C ATOM 150 CG TYR A 11 8.470 9.202 5.979 1.00 65.20 C ATOM 151 CD1 TYR A 11 7.615 10.243 5.642 1.00 34.12 C ATOM 152 CD2 TYR A 11 7.927 7.933 6.137 1.00 35.44 C ATOM 153 CE1 TYR A 11 6.261 10.029 5.469 1.00 32.13 C ATOM 154 CE2 TYR A 11 6.575 7.709 5.965 1.00 23.00 C ATOM 155 CZ TYR A 11 5.746 8.760 5.631 1.00 0.41 C ATOM 156 OH TYR A 11 4.398 8.540 5.461 1.00 72.14 O ATOM 0 H TYR A 11 11.517 11.647 5.940 1.00 65.22 H new ATOM 0 HA TYR A 11 9.369 10.748 7.772 1.00 33.31 H new ATOM 0 HB2 TYR A 11 10.390 9.723 5.209 1.00 55.32 H new ATOM 0 HB3 TYR A 11 10.426 8.510 6.474 1.00 55.32 H new ATOM 0 HD1 TYR A 11 8.016 11.238 5.513 1.00 34.12 H new ATOM 0 HD2 TYR A 11 8.573 7.108 6.399 1.00 35.44 H new ATOM 0 HE1 TYR A 11 5.610 10.850 5.209 1.00 32.13 H new ATOM 0 HE2 TYR A 11 6.169 6.716 6.091 1.00 23.00 H new ATOM 0 HH TYR A 11 4.200 7.592 5.610 1.00 72.14 H new ATOM 166 N PRO A 12 10.937 9.187 9.117 1.00 12.30 N ATOM 167 CA PRO A 12 9.543 8.755 9.251 1.00 31.15 C ATOM 168 C PRO A 12 8.628 9.882 9.718 1.00 10.41 C ATOM 169 O PRO A 12 9.097 10.933 10.159 1.00 20.24 O ATOM 170 CB PRO A 12 9.614 7.650 10.308 1.00 23.44 C ATOM 171 CG PRO A 12 10.830 7.967 11.106 1.00 51.20 C ATOM 172 CD PRO A 12 11.805 8.589 10.146 1.00 41.22 C ATOM 0 HA PRO A 12 9.125 8.427 8.299 1.00 31.15 H new ATOM 0 HB2 PRO A 12 8.721 7.642 10.933 1.00 23.44 H new ATOM 0 HB3 PRO A 12 9.689 6.665 9.847 1.00 23.44 H new ATOM 0 HG2 PRO A 12 10.594 8.651 11.921 1.00 51.20 H new ATOM 0 HG3 PRO A 12 11.247 7.066 11.557 1.00 51.20 H new ATOM 0 HD2 PRO A 12 12.426 9.340 10.634 1.00 41.22 H new ATOM 0 HD3 PRO A 12 12.479 7.846 9.720 1.00 41.22 H new ATOM 180 N LEU A 13 7.323 9.658 9.621 1.00 25.34 N ATOM 181 CA LEU A 13 6.342 10.655 10.035 1.00 71.04 C ATOM 182 C LEU A 13 5.453 10.115 11.151 1.00 25.31 C ATOM 183 O LEU A 13 4.791 9.090 10.988 1.00 11.04 O ATOM 184 CB LEU A 13 5.483 11.080 8.843 1.00 23.22 C ATOM 185 CG LEU A 13 4.343 12.051 9.150 1.00 62.10 C ATOM 186 CD1 LEU A 13 4.889 13.440 9.445 1.00 13.43 C ATOM 187 CD2 LEU A 13 3.357 12.100 7.991 1.00 1.13 C ATOM 0 H LEU A 13 6.919 8.794 9.259 1.00 25.34 H new ATOM 0 HA LEU A 13 6.881 11.523 10.414 1.00 71.04 H new ATOM 0 HB2 LEU A 13 6.133 11.538 8.097 1.00 23.22 H new ATOM 0 HB3 LEU A 13 5.059 10.185 8.389 1.00 23.22 H new ATOM 0 HG LEU A 13 3.816 11.694 10.035 1.00 62.10 H new ATOM 0 HD11 LEU A 13 4.063 14.117 9.661 1.00 13.43 H new ATOM 0 HD12 LEU A 13 5.555 13.394 10.306 1.00 13.43 H new ATOM 0 HD13 LEU A 13 5.441 13.806 8.579 1.00 13.43 H new ATOM 0 HD21 LEU A 13 2.552 12.796 8.227 1.00 1.13 H new ATOM 0 HD22 LEU A 13 3.872 12.432 7.089 1.00 1.13 H new ATOM 0 HD23 LEU A 13 2.940 11.106 7.826 1.00 1.13 H new ATOM 199 N ALA A 14 5.442 10.812 12.282 1.00 4.24 N ATOM 200 CA ALA A 14 4.631 10.404 13.422 1.00 51.54 C ATOM 201 C ALA A 14 3.233 11.009 13.346 1.00 5.31 C ATOM 202 O ALA A 14 3.073 12.192 13.051 1.00 72.34 O ATOM 203 CB ALA A 14 5.311 10.805 14.724 1.00 70.44 C ATOM 0 H ALA A 14 5.985 11.662 12.433 1.00 4.24 H new ATOM 0 HA ALA A 14 4.531 9.319 13.395 1.00 51.54 H new ATOM 0 HB1 ALA A 14 4.694 10.494 15.567 1.00 70.44 H new ATOM 0 HB2 ALA A 14 6.286 10.321 14.789 1.00 70.44 H new ATOM 0 HB3 ALA A 14 5.441 11.887 14.749 1.00 70.44 H new ATOM 209 N ASP A 15 2.224 10.187 13.612 1.00 24.32 N ATOM 210 CA ASP A 15 0.839 10.640 13.574 1.00 32.33 C ATOM 211 C ASP A 15 0.482 11.408 14.843 1.00 64.01 C ATOM 212 O ASP A 15 1.122 11.240 15.881 1.00 22.12 O ATOM 213 CB ASP A 15 -0.106 9.449 13.401 1.00 60.02 C ATOM 214 CG ASP A 15 -0.099 8.526 14.602 1.00 14.21 C ATOM 215 OD1 ASP A 15 0.841 8.622 15.419 1.00 73.51 O ATOM 216 OD2 ASP A 15 -1.033 7.705 14.727 1.00 44.14 O ATOM 0 H ASP A 15 2.339 9.203 13.856 1.00 24.32 H new ATOM 0 HA ASP A 15 0.726 11.310 12.722 1.00 32.33 H new ATOM 0 HB2 ASP A 15 -1.119 9.814 13.233 1.00 60.02 H new ATOM 0 HB3 ASP A 15 0.182 8.887 12.513 1.00 60.02 H new ATOM 221 N ALA A 16 -0.541 12.250 14.752 1.00 24.33 N ATOM 222 CA ALA A 16 -0.983 13.043 15.892 1.00 12.42 C ATOM 223 C ALA A 16 -1.240 12.159 17.108 1.00 2.20 C ATOM 224 O ALA A 16 -1.046 12.582 18.249 1.00 71.21 O ATOM 225 CB ALA A 16 -2.236 13.829 15.536 1.00 41.24 C ATOM 0 H ALA A 16 -1.080 12.401 13.899 1.00 24.33 H new ATOM 0 HA ALA A 16 -0.188 13.744 16.145 1.00 12.42 H new ATOM 0 HB1 ALA A 16 -2.554 14.416 16.397 1.00 41.24 H new ATOM 0 HB2 ALA A 16 -2.022 14.496 14.701 1.00 41.24 H new ATOM 0 HB3 ALA A 16 -3.031 13.138 15.254 1.00 41.24 H new ATOM 231 N HIS A 17 -1.676 10.928 16.858 1.00 33.32 N ATOM 232 CA HIS A 17 -1.960 9.985 17.934 1.00 1.24 C ATOM 233 C HIS A 17 -0.758 9.842 18.862 1.00 21.23 C ATOM 234 O HIS A 17 -0.903 9.832 20.085 1.00 14.41 O ATOM 235 CB HIS A 17 -2.338 8.620 17.356 1.00 34.21 C ATOM 236 CG HIS A 17 -3.281 7.843 18.223 1.00 60.32 C ATOM 237 ND1 HIS A 17 -3.240 6.470 18.338 1.00 51.51 N ATOM 238 CD2 HIS A 17 -4.294 8.256 19.021 1.00 72.32 C ATOM 239 CE1 HIS A 17 -4.188 6.071 19.167 1.00 53.33 C ATOM 240 NE2 HIS A 17 -4.841 7.136 19.596 1.00 61.13 N ATOM 0 H HIS A 17 -1.840 10.561 15.921 1.00 33.32 H new ATOM 0 HA HIS A 17 -2.799 10.372 18.512 1.00 1.24 H new ATOM 0 HB2 HIS A 17 -2.793 8.763 16.376 1.00 34.21 H new ATOM 0 HB3 HIS A 17 -1.431 8.035 17.204 1.00 34.21 H new ATOM 0 HD2 HIS A 17 -4.612 9.276 19.176 1.00 72.32 H new ATOM 0 HE1 HIS A 17 -4.394 5.048 19.446 1.00 53.33 H new ATOM 0 HE2 HIS A 17 -5.625 7.128 20.249 1.00 61.13 H new ATOM 248 N LEU A 18 0.428 9.731 18.274 1.00 0.44 N ATOM 249 CA LEU A 18 1.656 9.588 19.048 1.00 15.55 C ATOM 250 C LEU A 18 2.203 10.952 19.459 1.00 62.21 C ATOM 251 O LEU A 18 2.770 11.106 20.541 1.00 42.23 O ATOM 252 CB LEU A 18 2.708 8.827 18.239 1.00 30.33 C ATOM 253 CG LEU A 18 3.028 7.411 18.719 1.00 53.23 C ATOM 254 CD1 LEU A 18 3.552 7.438 20.147 1.00 4.51 C ATOM 255 CD2 LEU A 18 1.798 6.521 18.618 1.00 13.31 C ATOM 0 H LEU A 18 0.565 9.737 17.263 1.00 0.44 H new ATOM 0 HA LEU A 18 1.423 9.023 19.951 1.00 15.55 H new ATOM 0 HB2 LEU A 18 2.371 8.771 17.204 1.00 30.33 H new ATOM 0 HB3 LEU A 18 3.630 9.408 18.243 1.00 30.33 H new ATOM 0 HG LEU A 18 3.804 6.997 18.075 1.00 53.23 H new ATOM 0 HD11 LEU A 18 3.775 6.422 20.472 1.00 4.51 H new ATOM 0 HD12 LEU A 18 4.460 8.040 20.190 1.00 4.51 H new ATOM 0 HD13 LEU A 18 2.798 7.872 20.803 1.00 4.51 H new ATOM 0 HD21 LEU A 18 2.046 5.517 18.964 1.00 13.31 H new ATOM 0 HD22 LEU A 18 1.000 6.932 19.237 1.00 13.31 H new ATOM 0 HD23 LEU A 18 1.466 6.476 17.581 1.00 13.31 H new ATOM 267 N THR A 19 2.027 11.940 18.587 1.00 53.44 N ATOM 268 CA THR A 19 2.502 13.292 18.857 1.00 14.43 C ATOM 269 C THR A 19 1.820 13.878 20.089 1.00 22.24 C ATOM 270 O THR A 19 2.398 14.698 20.801 1.00 43.12 O ATOM 271 CB THR A 19 2.257 14.224 17.657 1.00 74.22 C ATOM 272 OG1 THR A 19 2.625 13.565 16.441 1.00 45.34 O ATOM 273 CG2 THR A 19 3.053 15.513 17.801 1.00 54.41 C ATOM 0 H THR A 19 1.559 11.829 17.688 1.00 53.44 H new ATOM 0 HA THR A 19 3.574 13.220 19.038 1.00 14.43 H new ATOM 0 HB THR A 19 1.196 14.471 17.629 1.00 74.22 H new ATOM 0 HG1 THR A 19 1.976 12.859 16.242 1.00 45.34 H new ATOM 0 HG21 THR A 19 2.864 16.156 16.941 1.00 54.41 H new ATOM 0 HG22 THR A 19 2.750 16.028 18.713 1.00 54.41 H new ATOM 0 HG23 THR A 19 4.117 15.280 17.853 1.00 54.41 H new ATOM 281 N LYS A 20 0.586 13.449 20.336 1.00 74.35 N ATOM 282 CA LYS A 20 -0.175 13.930 21.483 1.00 61.43 C ATOM 283 C LYS A 20 0.611 13.741 22.776 1.00 21.01 C ATOM 284 O LYS A 20 0.787 14.681 23.552 1.00 32.24 O ATOM 285 CB LYS A 20 -1.515 13.196 21.575 1.00 2.41 C ATOM 286 CG LYS A 20 -2.559 13.935 22.393 1.00 12.41 C ATOM 287 CD LYS A 20 -3.792 13.079 22.628 1.00 34.12 C ATOM 288 CE LYS A 20 -3.800 12.485 24.028 1.00 43.51 C ATOM 289 NZ LYS A 20 -3.905 11.000 24.000 1.00 43.14 N ATOM 0 H LYS A 20 0.092 12.769 19.757 1.00 74.35 H new ATOM 0 HA LYS A 20 -0.360 14.995 21.344 1.00 61.43 H new ATOM 0 HB2 LYS A 20 -1.901 13.035 20.569 1.00 2.41 H new ATOM 0 HB3 LYS A 20 -1.351 12.212 22.014 1.00 2.41 H new ATOM 0 HG2 LYS A 20 -2.131 14.228 23.351 1.00 12.41 H new ATOM 0 HG3 LYS A 20 -2.844 14.852 21.877 1.00 12.41 H new ATOM 0 HD2 LYS A 20 -4.688 13.682 22.483 1.00 34.12 H new ATOM 0 HD3 LYS A 20 -3.825 12.277 21.891 1.00 34.12 H new ATOM 0 HE2 LYS A 20 -2.888 12.775 24.551 1.00 43.51 H new ATOM 0 HE3 LYS A 20 -4.636 12.898 24.593 1.00 43.51 H new ATOM 0 HZ1 LYS A 20 -3.907 10.634 24.973 1.00 43.14 H new ATOM 0 HZ2 LYS A 20 -4.787 10.723 23.524 1.00 43.14 H new ATOM 0 HZ3 LYS A 20 -3.094 10.604 23.483 1.00 43.14 H new ATOM 303 N LYS A 21 1.085 12.520 23.001 1.00 14.03 N ATOM 304 CA LYS A 21 1.855 12.207 24.199 1.00 62.11 C ATOM 305 C LYS A 21 3.253 12.811 24.120 1.00 72.45 C ATOM 306 O LYS A 21 3.832 13.197 25.136 1.00 43.24 O ATOM 307 CB LYS A 21 1.953 10.691 24.386 1.00 61.24 C ATOM 308 CG LYS A 21 0.842 10.110 25.242 1.00 53.23 C ATOM 309 CD LYS A 21 -0.025 9.145 24.452 1.00 73.45 C ATOM 310 CE LYS A 21 0.459 7.711 24.600 1.00 33.45 C ATOM 311 NZ LYS A 21 -0.661 6.734 24.494 1.00 60.14 N ATOM 0 H LYS A 21 0.949 11.731 22.369 1.00 14.03 H new ATOM 0 HA LYS A 21 1.339 12.640 25.056 1.00 62.11 H new ATOM 0 HB2 LYS A 21 1.935 10.211 23.408 1.00 61.24 H new ATOM 0 HB3 LYS A 21 2.914 10.451 24.841 1.00 61.24 H new ATOM 0 HG2 LYS A 21 1.274 9.594 26.099 1.00 53.23 H new ATOM 0 HG3 LYS A 21 0.224 10.918 25.635 1.00 53.23 H new ATOM 0 HD2 LYS A 21 -1.057 9.219 24.794 1.00 73.45 H new ATOM 0 HD3 LYS A 21 -0.017 9.426 23.399 1.00 73.45 H new ATOM 0 HE2 LYS A 21 1.202 7.497 23.831 1.00 33.45 H new ATOM 0 HE3 LYS A 21 0.954 7.592 25.564 1.00 33.45 H new ATOM 0 HZ1 LYS A 21 -0.290 5.768 24.600 1.00 60.14 H new ATOM 0 HZ2 LYS A 21 -1.358 6.922 25.243 1.00 60.14 H new ATOM 0 HZ3 LYS A 21 -1.118 6.829 23.565 1.00 60.14 H new ATOM 325 N LEU A 22 3.790 12.893 22.907 1.00 32.44 N ATOM 326 CA LEU A 22 5.119 13.453 22.695 1.00 41.55 C ATOM 327 C LEU A 22 5.191 14.894 23.192 1.00 20.55 C ATOM 328 O LEU A 22 6.183 15.307 23.792 1.00 71.23 O ATOM 329 CB LEU A 22 5.490 13.395 21.212 1.00 35.15 C ATOM 330 CG LEU A 22 6.753 14.154 20.804 1.00 10.43 C ATOM 331 CD1 LEU A 22 7.533 13.368 19.762 1.00 45.23 C ATOM 332 CD2 LEU A 22 6.398 15.536 20.277 1.00 30.05 C ATOM 0 H LEU A 22 3.325 12.578 22.056 1.00 32.44 H new ATOM 0 HA LEU A 22 5.831 12.856 23.265 1.00 41.55 H new ATOM 0 HB2 LEU A 22 5.612 12.349 20.930 1.00 35.15 H new ATOM 0 HB3 LEU A 22 4.653 13.786 20.633 1.00 35.15 H new ATOM 0 HG LEU A 22 7.383 14.275 21.685 1.00 10.43 H new ATOM 0 HD11 LEU A 22 8.429 13.923 19.483 1.00 45.23 H new ATOM 0 HD12 LEU A 22 7.819 12.401 20.175 1.00 45.23 H new ATOM 0 HD13 LEU A 22 6.911 13.216 18.880 1.00 45.23 H new ATOM 0 HD21 LEU A 22 7.309 16.062 19.991 1.00 30.05 H new ATOM 0 HD22 LEU A 22 5.748 15.438 19.407 1.00 30.05 H new ATOM 0 HD23 LEU A 22 5.882 16.100 21.054 1.00 30.05 H new ATOM 344 N LEU A 23 4.129 15.653 22.940 1.00 61.13 N ATOM 345 CA LEU A 23 4.069 17.048 23.363 1.00 62.22 C ATOM 346 C LEU A 23 4.309 17.172 24.865 1.00 24.21 C ATOM 347 O LEU A 23 4.800 18.196 25.342 1.00 4.23 O ATOM 348 CB LEU A 23 2.711 17.653 23.001 1.00 43.52 C ATOM 349 CG LEU A 23 2.725 18.730 21.915 1.00 32.54 C ATOM 350 CD1 LEU A 23 3.342 18.189 20.634 1.00 3.24 C ATOM 351 CD2 LEU A 23 1.315 19.243 21.655 1.00 45.33 C ATOM 0 H LEU A 23 3.299 15.326 22.445 1.00 61.13 H new ATOM 0 HA LEU A 23 4.855 17.595 22.841 1.00 62.22 H new ATOM 0 HB2 LEU A 23 2.051 16.848 22.678 1.00 43.52 H new ATOM 0 HB3 LEU A 23 2.274 18.081 23.903 1.00 43.52 H new ATOM 0 HG LEU A 23 3.335 19.563 22.264 1.00 32.54 H new ATOM 0 HD11 LEU A 23 3.343 18.969 19.873 1.00 3.24 H new ATOM 0 HD12 LEU A 23 4.366 17.871 20.829 1.00 3.24 H new ATOM 0 HD13 LEU A 23 2.759 17.338 20.280 1.00 3.24 H new ATOM 0 HD21 LEU A 23 1.344 20.009 20.880 1.00 45.33 H new ATOM 0 HD22 LEU A 23 0.682 18.418 21.327 1.00 45.33 H new ATOM 0 HD23 LEU A 23 0.908 19.670 22.572 1.00 45.33 H new ATOM 363 N ASP A 24 3.963 16.124 25.603 1.00 31.42 N ATOM 364 CA ASP A 24 4.143 16.114 27.049 1.00 40.11 C ATOM 365 C ASP A 24 5.617 15.956 27.412 1.00 20.42 C ATOM 366 O ASP A 24 6.064 16.424 28.460 1.00 31.34 O ATOM 367 CB ASP A 24 3.327 14.985 27.679 1.00 33.14 C ATOM 368 CG ASP A 24 2.841 15.329 29.074 1.00 72.21 C ATOM 369 OD1 ASP A 24 2.479 16.502 29.302 1.00 53.32 O ATOM 370 OD2 ASP A 24 2.824 14.426 29.936 1.00 30.20 O ATOM 0 H ASP A 24 3.556 15.269 25.223 1.00 31.42 H new ATOM 0 HA ASP A 24 3.790 17.068 27.440 1.00 40.11 H new ATOM 0 HB2 ASP A 24 2.470 14.762 27.044 1.00 33.14 H new ATOM 0 HB3 ASP A 24 3.935 14.082 27.722 1.00 33.14 H new ATOM 375 N LEU A 25 6.367 15.293 26.539 1.00 5.14 N ATOM 376 CA LEU A 25 7.791 15.071 26.767 1.00 62.10 C ATOM 377 C LEU A 25 8.515 16.391 27.013 1.00 32.33 C ATOM 378 O LEU A 25 9.479 16.449 27.777 1.00 53.01 O ATOM 379 CB LEU A 25 8.413 14.351 25.569 1.00 43.43 C ATOM 380 CG LEU A 25 9.441 13.267 25.897 1.00 15.23 C ATOM 381 CD1 LEU A 25 10.651 13.871 26.593 1.00 11.23 C ATOM 382 CD2 LEU A 25 8.813 12.181 26.760 1.00 62.24 C ATOM 0 H LEU A 25 6.013 14.900 25.667 1.00 5.14 H new ATOM 0 HA LEU A 25 7.899 14.447 27.654 1.00 62.10 H new ATOM 0 HB2 LEU A 25 7.611 13.898 24.986 1.00 43.43 H new ATOM 0 HB3 LEU A 25 8.890 15.095 24.931 1.00 43.43 H new ATOM 0 HG LEU A 25 9.774 12.814 24.963 1.00 15.23 H new ATOM 0 HD11 LEU A 25 11.371 13.085 26.818 1.00 11.23 H new ATOM 0 HD12 LEU A 25 11.114 14.611 25.941 1.00 11.23 H new ATOM 0 HD13 LEU A 25 10.336 14.351 27.520 1.00 11.23 H new ATOM 0 HD21 LEU A 25 9.558 11.418 26.984 1.00 62.24 H new ATOM 0 HD22 LEU A 25 8.451 12.619 27.690 1.00 62.24 H new ATOM 0 HD23 LEU A 25 7.979 11.728 26.224 1.00 62.24 H new ATOM 394 N VAL A 26 8.042 17.449 26.363 1.00 72.12 N ATOM 395 CA VAL A 26 8.642 18.770 26.514 1.00 31.20 C ATOM 396 C VAL A 26 8.352 19.351 27.894 1.00 1.43 C ATOM 397 O VAL A 26 9.264 19.780 28.600 1.00 4.52 O ATOM 398 CB VAL A 26 8.126 19.746 25.440 1.00 52.01 C ATOM 399 CG1 VAL A 26 8.741 21.125 25.633 1.00 21.45 C ATOM 400 CG2 VAL A 26 8.424 19.211 24.048 1.00 33.41 C ATOM 0 H VAL A 26 7.245 17.418 25.727 1.00 72.12 H new ATOM 0 HA VAL A 26 9.718 18.645 26.394 1.00 31.20 H new ATOM 0 HB VAL A 26 7.045 19.838 25.545 1.00 52.01 H new ATOM 0 HG11 VAL A 26 8.365 21.802 24.865 1.00 21.45 H new ATOM 0 HG12 VAL A 26 8.473 21.508 26.618 1.00 21.45 H new ATOM 0 HG13 VAL A 26 9.826 21.054 25.554 1.00 21.45 H new ATOM 0 HG21 VAL A 26 8.053 19.913 23.301 1.00 33.41 H new ATOM 0 HG22 VAL A 26 9.500 19.089 23.928 1.00 33.41 H new ATOM 0 HG23 VAL A 26 7.933 18.247 23.916 1.00 33.41 H new ATOM 410 N GLN A 27 7.077 19.359 28.270 1.00 52.41 N ATOM 411 CA GLN A 27 6.669 19.887 29.567 1.00 1.34 C ATOM 412 C GLN A 27 7.373 19.151 30.701 1.00 32.03 C ATOM 413 O GLN A 27 7.630 19.724 31.759 1.00 53.31 O ATOM 414 CB GLN A 27 5.152 19.772 29.733 1.00 5.01 C ATOM 415 CG GLN A 27 4.653 20.224 31.095 1.00 20.22 C ATOM 416 CD GLN A 27 3.575 21.286 30.999 1.00 64.31 C ATOM 417 OE1 GLN A 27 2.391 20.975 30.866 1.00 10.52 O ATOM 418 NE2 GLN A 27 3.980 22.548 31.065 1.00 54.11 N ATOM 0 H GLN A 27 6.310 19.007 27.697 1.00 52.41 H new ATOM 0 HA GLN A 27 6.954 20.938 29.609 1.00 1.34 H new ATOM 0 HB2 GLN A 27 4.664 20.367 28.961 1.00 5.01 H new ATOM 0 HB3 GLN A 27 4.855 18.736 29.572 1.00 5.01 H new ATOM 0 HG2 GLN A 27 4.263 19.364 31.638 1.00 20.22 H new ATOM 0 HG3 GLN A 27 5.491 20.613 31.674 1.00 20.22 H new ATOM 0 HE21 GLN A 27 4.972 22.760 31.176 1.00 54.11 H new ATOM 0 HE22 GLN A 27 3.300 23.306 31.005 1.00 54.11 H new ATOM 427 N GLN A 28 7.682 17.878 30.473 1.00 40.24 N ATOM 428 CA GLN A 28 8.356 17.065 31.477 1.00 11.32 C ATOM 429 C GLN A 28 9.832 17.434 31.577 1.00 52.32 C ATOM 430 O GLN A 28 10.435 17.341 32.647 1.00 62.32 O ATOM 431 CB GLN A 28 8.213 15.579 31.141 1.00 20.23 C ATOM 432 CG GLN A 28 6.851 15.004 31.499 1.00 42.33 C ATOM 433 CD GLN A 28 6.901 13.513 31.767 1.00 22.11 C ATOM 434 OE1 GLN A 28 6.853 12.702 30.841 1.00 51.21 O ATOM 435 NE2 GLN A 28 6.996 13.142 33.038 1.00 15.04 N ATOM 0 H GLN A 28 7.476 17.388 29.602 1.00 40.24 H new ATOM 0 HA GLN A 28 7.885 17.261 32.440 1.00 11.32 H new ATOM 0 HB2 GLN A 28 8.390 15.437 30.075 1.00 20.23 H new ATOM 0 HB3 GLN A 28 8.985 15.019 31.669 1.00 20.23 H new ATOM 0 HG2 GLN A 28 6.465 15.515 32.381 1.00 42.33 H new ATOM 0 HG3 GLN A 28 6.152 15.200 30.686 1.00 42.33 H new ATOM 0 HE21 GLN A 28 7.033 13.847 33.774 1.00 15.04 H new ATOM 0 HE22 GLN A 28 7.032 12.151 33.279 1.00 15.04 H new ATOM 444 N SER A 29 10.409 17.854 30.455 1.00 73.14 N ATOM 445 CA SER A 29 11.817 18.235 30.415 1.00 10.21 C ATOM 446 C SER A 29 12.039 19.567 31.123 1.00 40.13 C ATOM 447 O SER A 29 12.895 19.680 32.003 1.00 25.44 O ATOM 448 CB SER A 29 12.301 18.326 28.968 1.00 64.55 C ATOM 449 OG SER A 29 12.191 17.074 28.312 1.00 41.40 O ATOM 0 H SER A 29 9.924 17.939 29.562 1.00 73.14 H new ATOM 0 HA SER A 29 12.391 17.468 30.934 1.00 10.21 H new ATOM 0 HB2 SER A 29 11.716 19.073 28.432 1.00 64.55 H new ATOM 0 HB3 SER A 29 13.338 18.660 28.949 1.00 64.55 H new ATOM 0 HG SER A 29 11.247 16.877 28.139 1.00 41.40 H new ATOM 455 N CYS A 30 11.265 20.573 30.734 1.00 51.13 N ATOM 456 CA CYS A 30 11.377 21.900 31.330 1.00 63.03 C ATOM 457 C CYS A 30 11.119 21.845 32.832 1.00 4.44 C ATOM 458 O CYS A 30 11.612 22.681 33.587 1.00 14.43 O ATOM 459 CB CYS A 30 10.395 22.865 30.666 1.00 14.05 C ATOM 460 SG CYS A 30 8.663 22.562 31.090 1.00 61.42 S ATOM 0 H CYS A 30 10.553 20.496 30.008 1.00 51.13 H new ATOM 0 HA CYS A 30 12.393 22.259 31.168 1.00 63.03 H new ATOM 0 HB2 CYS A 30 10.655 23.884 30.951 1.00 14.05 H new ATOM 0 HB3 CYS A 30 10.511 22.797 29.584 1.00 14.05 H new ATOM 0 HG CYS A 30 8.510 21.316 31.427 1.00 61.42 H new ATOM 466 N ASN A 31 10.341 20.855 33.258 1.00 4.02 N ATOM 467 CA ASN A 31 10.015 20.691 34.669 1.00 74.42 C ATOM 468 C ASN A 31 11.236 20.233 35.460 1.00 55.22 C ATOM 469 O ASN A 31 11.311 20.428 36.674 1.00 1.35 O ATOM 470 CB ASN A 31 8.877 19.683 34.838 1.00 31.15 C ATOM 471 CG ASN A 31 8.642 19.313 36.290 1.00 33.03 C ATOM 472 OD1 ASN A 31 8.232 20.148 37.096 1.00 30.33 O ATOM 473 ND2 ASN A 31 8.903 18.056 36.630 1.00 61.12 N ATOM 0 H ASN A 31 9.925 20.154 32.645 1.00 4.02 H new ATOM 0 HA ASN A 31 9.695 21.658 35.056 1.00 74.42 H new ATOM 0 HB2 ASN A 31 7.961 20.100 34.420 1.00 31.15 H new ATOM 0 HB3 ASN A 31 9.106 18.782 34.269 1.00 31.15 H new ATOM 0 HD21 ASN A 31 8.765 17.749 37.593 1.00 61.12 H new ATOM 0 HD22 ASN A 31 9.241 17.398 35.928 1.00 61.12 H new ATOM 480 N TYR A 32 12.191 19.626 34.765 1.00 32.33 N ATOM 481 CA TYR A 32 13.409 19.139 35.401 1.00 12.35 C ATOM 482 C TYR A 32 14.532 20.164 35.285 1.00 0.00 C ATOM 483 O TYR A 32 15.713 19.820 35.349 1.00 35.44 O ATOM 484 CB TYR A 32 13.844 17.815 34.772 1.00 11.43 C ATOM 485 CG TYR A 32 13.215 16.601 35.419 1.00 4.10 C ATOM 486 CD1 TYR A 32 11.848 16.371 35.328 1.00 20.23 C ATOM 487 CD2 TYR A 32 13.989 15.684 36.119 1.00 43.23 C ATOM 488 CE1 TYR A 32 11.270 15.264 35.919 1.00 62.31 C ATOM 489 CE2 TYR A 32 13.419 14.573 36.711 1.00 24.03 C ATOM 490 CZ TYR A 32 12.059 14.368 36.607 1.00 14.42 C ATOM 491 OH TYR A 32 11.487 13.263 37.195 1.00 15.31 O ATOM 0 H TYR A 32 12.145 19.459 33.760 1.00 32.33 H new ATOM 0 HA TYR A 32 13.197 18.978 36.458 1.00 12.35 H new ATOM 0 HB2 TYR A 32 13.589 17.825 33.712 1.00 11.43 H new ATOM 0 HB3 TYR A 32 14.929 17.730 34.838 1.00 11.43 H new ATOM 0 HD1 TYR A 32 11.227 17.069 34.786 1.00 20.23 H new ATOM 0 HD2 TYR A 32 15.054 15.842 36.202 1.00 43.23 H new ATOM 0 HE1 TYR A 32 10.205 15.102 35.842 1.00 62.31 H new ATOM 0 HE2 TYR A 32 14.035 13.870 37.252 1.00 24.03 H new ATOM 0 HH TYR A 32 10.697 12.992 36.682 1.00 15.31 H new ATOM 501 N LYS A 33 14.157 21.427 35.114 1.00 21.33 N ATOM 502 CA LYS A 33 15.129 22.505 34.989 1.00 55.23 C ATOM 503 C LYS A 33 16.090 22.242 33.834 1.00 30.52 C ATOM 504 O LYS A 33 17.221 22.726 33.833 1.00 41.40 O ATOM 505 CB LYS A 33 15.916 22.664 36.293 1.00 10.34 C ATOM 506 CG LYS A 33 15.034 22.776 37.526 1.00 62.53 C ATOM 507 CD LYS A 33 15.857 22.774 38.802 1.00 13.52 C ATOM 508 CE LYS A 33 16.646 24.065 38.958 1.00 11.31 C ATOM 509 NZ LYS A 33 17.720 23.938 39.982 1.00 0.22 N ATOM 0 H LYS A 33 13.184 21.729 35.059 1.00 21.33 H new ATOM 0 HA LYS A 33 14.585 23.427 34.784 1.00 55.23 H new ATOM 0 HB2 LYS A 33 16.584 21.811 36.411 1.00 10.34 H new ATOM 0 HB3 LYS A 33 16.543 23.553 36.223 1.00 10.34 H new ATOM 0 HG2 LYS A 33 14.447 23.693 37.472 1.00 62.53 H new ATOM 0 HG3 LYS A 33 14.328 21.946 37.546 1.00 62.53 H new ATOM 0 HD2 LYS A 33 15.199 22.643 39.661 1.00 13.52 H new ATOM 0 HD3 LYS A 33 16.542 21.926 38.793 1.00 13.52 H new ATOM 0 HE2 LYS A 33 17.088 24.339 38.000 1.00 11.31 H new ATOM 0 HE3 LYS A 33 15.970 24.872 39.239 1.00 11.31 H new ATOM 0 HZ1 LYS A 33 18.235 24.838 40.059 1.00 0.22 H new ATOM 0 HZ2 LYS A 33 17.296 23.702 40.902 1.00 0.22 H new ATOM 0 HZ3 LYS A 33 18.380 23.185 39.701 1.00 0.22 H new ATOM 523 N GLN A 34 15.629 21.474 32.852 1.00 2.23 N ATOM 524 CA GLN A 34 16.448 21.148 31.691 1.00 23.21 C ATOM 525 C GLN A 34 15.643 21.283 30.402 1.00 25.52 C ATOM 526 O GLN A 34 14.506 20.817 30.316 1.00 72.22 O ATOM 527 CB GLN A 34 17.001 19.727 31.813 1.00 41.51 C ATOM 528 CG GLN A 34 15.926 18.668 31.994 1.00 63.00 C ATOM 529 CD GLN A 34 15.475 18.064 30.677 1.00 52.32 C ATOM 530 OE1 GLN A 34 15.758 18.601 29.606 1.00 61.22 O ATOM 531 NE2 GLN A 34 14.769 16.942 30.752 1.00 45.31 N ATOM 0 H GLN A 34 14.694 21.067 32.837 1.00 2.23 H new ATOM 0 HA GLN A 34 17.279 21.852 31.655 1.00 23.21 H new ATOM 0 HB2 GLN A 34 17.581 19.494 30.920 1.00 41.51 H new ATOM 0 HB3 GLN A 34 17.687 19.685 32.659 1.00 41.51 H new ATOM 0 HG2 GLN A 34 16.305 17.877 32.641 1.00 63.00 H new ATOM 0 HG3 GLN A 34 15.067 19.110 32.500 1.00 63.00 H new ATOM 0 HE21 GLN A 34 14.558 16.532 31.662 1.00 45.31 H new ATOM 0 HE22 GLN A 34 14.438 16.490 29.900 1.00 45.31 H new ATOM 540 N LEU A 35 16.240 21.922 29.402 1.00 52.01 N ATOM 541 CA LEU A 35 15.578 22.120 28.117 1.00 41.21 C ATOM 542 C LEU A 35 16.562 22.634 27.071 1.00 14.54 C ATOM 543 O LEU A 35 17.428 23.456 27.371 1.00 34.33 O ATOM 544 CB LEU A 35 14.414 23.101 28.265 1.00 10.32 C ATOM 545 CG LEU A 35 13.157 22.779 27.457 1.00 45.22 C ATOM 546 CD1 LEU A 35 13.453 22.832 25.966 1.00 1.10 C ATOM 547 CD2 LEU A 35 12.609 21.413 27.846 1.00 63.01 C ATOM 0 H LEU A 35 17.181 22.312 29.456 1.00 52.01 H new ATOM 0 HA LEU A 35 15.192 21.157 27.784 1.00 41.21 H new ATOM 0 HB2 LEU A 35 14.141 23.153 29.319 1.00 10.32 H new ATOM 0 HB3 LEU A 35 14.762 24.093 27.977 1.00 10.32 H new ATOM 0 HG LEU A 35 12.400 23.530 27.683 1.00 45.22 H new ATOM 0 HD11 LEU A 35 12.547 22.600 25.407 1.00 1.10 H new ATOM 0 HD12 LEU A 35 13.799 23.831 25.699 1.00 1.10 H new ATOM 0 HD13 LEU A 35 14.226 22.103 25.722 1.00 1.10 H new ATOM 0 HD21 LEU A 35 11.714 21.200 27.261 1.00 63.01 H new ATOM 0 HD22 LEU A 35 13.362 20.650 27.649 1.00 63.01 H new ATOM 0 HD23 LEU A 35 12.358 21.410 28.907 1.00 63.01 H new ATOM 559 N ARG A 36 16.422 22.146 25.843 1.00 32.34 N ATOM 560 CA ARG A 36 17.298 22.557 24.752 1.00 12.14 C ATOM 561 C ARG A 36 16.531 22.621 23.434 1.00 41.51 C ATOM 562 O ARG A 36 16.013 21.612 22.955 1.00 50.34 O ATOM 563 CB ARG A 36 18.476 21.589 24.624 1.00 72.22 C ATOM 564 CG ARG A 36 19.802 22.278 24.348 1.00 74.22 C ATOM 565 CD ARG A 36 20.282 23.068 25.556 1.00 0.11 C ATOM 566 NE ARG A 36 20.028 24.499 25.411 1.00 4.15 N ATOM 567 CZ ARG A 36 20.525 25.419 26.229 1.00 75.32 C ATOM 568 NH1 ARG A 36 21.299 25.061 27.245 1.00 24.44 N ATOM 569 NH2 ARG A 36 20.249 26.703 26.031 1.00 5.51 N ATOM 0 H ARG A 36 15.710 21.465 25.578 1.00 32.34 H new ATOM 0 HA ARG A 36 17.678 23.553 24.979 1.00 12.14 H new ATOM 0 HB2 ARG A 36 18.561 21.010 25.544 1.00 72.22 H new ATOM 0 HB3 ARG A 36 18.269 20.882 23.820 1.00 72.22 H new ATOM 0 HG2 ARG A 36 20.551 21.533 24.078 1.00 74.22 H new ATOM 0 HG3 ARG A 36 19.695 22.947 23.494 1.00 74.22 H new ATOM 0 HD2 ARG A 36 19.782 22.700 26.452 1.00 0.11 H new ATOM 0 HD3 ARG A 36 21.350 22.902 25.697 1.00 0.11 H new ATOM 0 HE ARG A 36 19.437 24.808 24.640 1.00 4.15 H new ATOM 0 HH11 ARG A 36 21.514 24.076 27.400 1.00 24.44 H new ATOM 0 HH12 ARG A 36 21.679 25.771 27.871 1.00 24.44 H new ATOM 0 HH21 ARG A 36 19.655 26.982 25.250 1.00 5.51 H new ATOM 0 HH22 ARG A 36 20.631 27.410 26.660 1.00 5.51 H new ATOM 583 N LYS A 37 16.463 23.813 22.853 1.00 73.10 N ATOM 584 CA LYS A 37 15.762 24.010 21.590 1.00 32.11 C ATOM 585 C LYS A 37 16.620 24.804 20.609 1.00 34.33 C ATOM 586 O LYS A 37 16.458 26.016 20.470 1.00 25.30 O ATOM 587 CB LYS A 37 14.435 24.736 21.828 1.00 62.54 C ATOM 588 CG LYS A 37 13.523 24.027 22.813 1.00 23.05 C ATOM 589 CD LYS A 37 12.678 25.014 23.600 1.00 14.31 C ATOM 590 CE LYS A 37 13.514 25.779 24.615 1.00 42.20 C ATOM 591 NZ LYS A 37 13.452 27.249 24.389 1.00 71.23 N ATOM 0 H LYS A 37 16.885 24.658 23.237 1.00 73.10 H new ATOM 0 HA LYS A 37 15.561 23.030 21.158 1.00 32.11 H new ATOM 0 HB2 LYS A 37 14.641 25.741 22.195 1.00 62.54 H new ATOM 0 HB3 LYS A 37 13.914 24.845 20.877 1.00 62.54 H new ATOM 0 HG2 LYS A 37 12.872 23.337 22.276 1.00 23.05 H new ATOM 0 HG3 LYS A 37 14.122 23.430 23.501 1.00 23.05 H new ATOM 0 HD2 LYS A 37 12.204 25.716 22.914 1.00 14.31 H new ATOM 0 HD3 LYS A 37 11.878 24.481 24.114 1.00 14.31 H new ATOM 0 HE2 LYS A 37 13.162 25.551 25.621 1.00 42.20 H new ATOM 0 HE3 LYS A 37 14.550 25.446 24.557 1.00 42.20 H new ATOM 0 HZ1 LYS A 37 14.273 27.704 24.837 1.00 71.23 H new ATOM 0 HZ2 LYS A 37 13.462 27.444 23.367 1.00 71.23 H new ATOM 0 HZ3 LYS A 37 12.577 27.628 24.805 1.00 71.23 H new ATOM 605 N GLY A 38 17.530 24.112 19.932 1.00 21.32 N ATOM 606 CA GLY A 38 18.397 24.770 18.972 1.00 4.42 C ATOM 607 C GLY A 38 19.243 23.786 18.187 1.00 74.25 C ATOM 608 O GLY A 38 19.988 22.997 18.767 1.00 5.22 O ATOM 0 H GLY A 38 17.683 23.108 20.031 1.00 21.32 H new ATOM 0 HA2 GLY A 38 17.791 25.356 18.281 1.00 4.42 H new ATOM 0 HA3 GLY A 38 19.049 25.469 19.495 1.00 4.42 H new ATOM 612 N ALA A 39 19.129 23.833 16.864 1.00 54.21 N ATOM 613 CA ALA A 39 19.889 22.940 15.998 1.00 15.02 C ATOM 614 C ALA A 39 21.387 23.196 16.127 1.00 51.33 C ATOM 615 O ALA A 39 22.176 22.262 16.259 1.00 41.41 O ATOM 616 CB ALA A 39 19.446 23.102 14.553 1.00 62.25 C ATOM 0 H ALA A 39 18.517 24.481 16.368 1.00 54.21 H new ATOM 0 HA ALA A 39 19.693 21.915 16.312 1.00 15.02 H new ATOM 0 HB1 ALA A 39 20.022 22.429 13.918 1.00 62.25 H new ATOM 0 HB2 ALA A 39 18.386 22.862 14.468 1.00 62.25 H new ATOM 0 HB3 ALA A 39 19.612 24.131 14.235 1.00 62.25 H new ATOM 622 N ASN A 40 21.771 24.468 16.086 1.00 44.12 N ATOM 623 CA ASN A 40 23.175 24.846 16.196 1.00 2.42 C ATOM 624 C ASN A 40 23.740 24.450 17.557 1.00 54.13 C ATOM 625 O ASN A 40 24.897 24.044 17.666 1.00 70.40 O ATOM 626 CB ASN A 40 23.338 26.351 15.982 1.00 73.34 C ATOM 627 CG ASN A 40 23.413 26.723 14.513 1.00 1.10 C ATOM 628 OD1 ASN A 40 22.675 27.587 14.041 1.00 44.21 O ATOM 629 ND2 ASN A 40 24.309 26.068 13.783 1.00 30.11 N ATOM 0 H ASN A 40 21.130 25.254 15.977 1.00 44.12 H new ATOM 0 HA ASN A 40 23.730 24.314 15.423 1.00 2.42 H new ATOM 0 HB2 ASN A 40 22.500 26.873 16.444 1.00 73.34 H new ATOM 0 HB3 ASN A 40 24.243 26.691 16.486 1.00 73.34 H new ATOM 0 HD21 ASN A 40 24.406 26.274 12.789 1.00 30.11 H new ATOM 0 HD22 ASN A 40 24.900 25.359 14.217 1.00 30.11 H new ATOM 636 N GLU A 41 22.915 24.571 18.592 1.00 3.34 N ATOM 637 CA GLU A 41 23.332 24.226 19.946 1.00 64.22 C ATOM 638 C GLU A 41 23.332 22.713 20.146 1.00 54.51 C ATOM 639 O GLU A 41 24.087 22.185 20.962 1.00 61.10 O ATOM 640 CB GLU A 41 22.410 24.887 20.972 1.00 60.02 C ATOM 641 CG GLU A 41 22.809 26.311 21.321 1.00 23.03 C ATOM 642 CD GLU A 41 22.474 26.676 22.754 1.00 55.43 C ATOM 643 OE1 GLU A 41 21.282 26.906 23.044 1.00 33.53 O ATOM 644 OE2 GLU A 41 23.405 26.732 23.585 1.00 71.14 O ATOM 0 H GLU A 41 21.954 24.905 18.519 1.00 3.34 H new ATOM 0 HA GLU A 41 24.347 24.595 20.091 1.00 64.22 H new ATOM 0 HB2 GLU A 41 21.391 24.889 20.584 1.00 60.02 H new ATOM 0 HB3 GLU A 41 22.404 24.287 21.882 1.00 60.02 H new ATOM 0 HG2 GLU A 41 23.880 26.434 21.159 1.00 23.03 H new ATOM 0 HG3 GLU A 41 22.303 27.002 20.646 1.00 23.03 H new ATOM 651 N ALA A 42 22.481 22.022 19.395 1.00 34.21 N ATOM 652 CA ALA A 42 22.383 20.571 19.489 1.00 52.41 C ATOM 653 C ALA A 42 23.753 19.918 19.343 1.00 61.32 C ATOM 654 O ALA A 42 24.018 18.868 19.928 1.00 44.42 O ATOM 655 CB ALA A 42 21.426 20.037 18.434 1.00 64.34 C ATOM 0 H ALA A 42 21.849 22.444 18.714 1.00 34.21 H new ATOM 0 HA ALA A 42 21.994 20.321 20.476 1.00 52.41 H new ATOM 0 HB1 ALA A 42 21.363 18.952 18.516 1.00 64.34 H new ATOM 0 HB2 ALA A 42 20.438 20.471 18.586 1.00 64.34 H new ATOM 0 HB3 ALA A 42 21.791 20.305 17.443 1.00 64.34 H new ATOM 661 N THR A 43 24.622 20.547 18.556 1.00 0.34 N ATOM 662 CA THR A 43 25.964 20.026 18.331 1.00 41.12 C ATOM 663 C THR A 43 26.707 19.833 19.648 1.00 44.11 C ATOM 664 O THR A 43 27.626 19.018 19.742 1.00 25.20 O ATOM 665 CB THR A 43 26.785 20.962 17.424 1.00 54.44 C ATOM 666 OG1 THR A 43 25.910 21.824 16.690 1.00 73.54 O ATOM 667 CG2 THR A 43 27.647 20.163 16.459 1.00 22.33 C ATOM 0 H THR A 43 24.419 21.417 18.064 1.00 0.34 H new ATOM 0 HA THR A 43 25.850 19.061 17.837 1.00 41.12 H new ATOM 0 HB THR A 43 27.439 21.563 18.056 1.00 54.44 H new ATOM 0 HG1 THR A 43 25.797 22.667 17.177 1.00 73.54 H new ATOM 0 HG21 THR A 43 28.217 20.846 15.829 1.00 22.33 H new ATOM 0 HG22 THR A 43 28.333 19.530 17.022 1.00 22.33 H new ATOM 0 HG23 THR A 43 27.009 19.539 15.833 1.00 22.33 H new ATOM 675 N LYS A 44 26.303 20.586 20.666 1.00 42.40 N ATOM 676 CA LYS A 44 26.929 20.496 21.980 1.00 45.23 C ATOM 677 C LYS A 44 26.416 19.280 22.745 1.00 72.31 C ATOM 678 O LYS A 44 27.198 18.499 23.287 1.00 2.43 O ATOM 679 CB LYS A 44 26.659 21.770 22.784 1.00 2.12 C ATOM 680 CG LYS A 44 27.460 22.970 22.309 1.00 2.51 C ATOM 681 CD LYS A 44 28.874 22.953 22.868 1.00 2.33 C ATOM 682 CE LYS A 44 29.899 23.302 21.799 1.00 14.21 C ATOM 683 NZ LYS A 44 31.188 23.754 22.395 1.00 32.34 N ATOM 0 H LYS A 44 25.545 21.266 20.606 1.00 42.40 H new ATOM 0 HA LYS A 44 28.004 20.385 21.837 1.00 45.23 H new ATOM 0 HB2 LYS A 44 25.597 22.007 22.727 1.00 2.12 H new ATOM 0 HB3 LYS A 44 26.888 21.583 23.833 1.00 2.12 H new ATOM 0 HG2 LYS A 44 27.498 22.975 21.220 1.00 2.51 H new ATOM 0 HG3 LYS A 44 26.958 23.888 22.615 1.00 2.51 H new ATOM 0 HD2 LYS A 44 28.950 23.663 23.692 1.00 2.33 H new ATOM 0 HD3 LYS A 44 29.093 21.966 23.276 1.00 2.33 H new ATOM 0 HE2 LYS A 44 30.076 22.432 21.167 1.00 14.21 H new ATOM 0 HE3 LYS A 44 29.501 24.087 21.156 1.00 14.21 H new ATOM 0 HZ1 LYS A 44 31.860 23.983 21.635 1.00 32.34 H new ATOM 0 HZ2 LYS A 44 31.023 24.600 22.978 1.00 32.34 H new ATOM 0 HZ3 LYS A 44 31.581 22.996 22.988 1.00 32.34 H new ATOM 697 N THR A 45 25.096 19.126 22.785 1.00 25.54 N ATOM 698 CA THR A 45 24.478 18.006 23.483 1.00 1.02 C ATOM 699 C THR A 45 25.084 16.680 23.040 1.00 50.54 C ATOM 700 O THR A 45 25.529 15.881 23.867 1.00 63.40 O ATOM 701 CB THR A 45 22.957 17.967 23.247 1.00 24.33 C ATOM 702 OG1 THR A 45 22.682 17.751 21.858 1.00 42.34 O ATOM 703 CG2 THR A 45 22.304 19.263 23.703 1.00 64.40 C ATOM 0 H THR A 45 24.434 19.763 22.342 1.00 25.54 H new ATOM 0 HA THR A 45 24.669 18.152 24.546 1.00 1.02 H new ATOM 0 HB THR A 45 22.542 17.145 23.831 1.00 24.33 H new ATOM 0 HG1 THR A 45 23.133 18.438 21.325 1.00 42.34 H new ATOM 0 HG21 THR A 45 21.230 19.211 23.526 1.00 64.40 H new ATOM 0 HG22 THR A 45 22.490 19.409 24.767 1.00 64.40 H new ATOM 0 HG23 THR A 45 22.724 20.099 23.143 1.00 64.40 H new ATOM 711 N LEU A 46 25.101 16.451 21.732 1.00 41.41 N ATOM 712 CA LEU A 46 25.655 15.219 21.178 1.00 50.25 C ATOM 713 C LEU A 46 27.081 14.994 21.671 1.00 24.52 C ATOM 714 O LEU A 46 27.527 13.855 21.810 1.00 33.40 O ATOM 715 CB LEU A 46 25.634 15.270 19.649 1.00 40.12 C ATOM 716 CG LEU A 46 25.254 13.970 18.940 1.00 33.42 C ATOM 717 CD1 LEU A 46 25.378 14.129 17.432 1.00 22.22 C ATOM 718 CD2 LEU A 46 26.122 12.821 19.430 1.00 23.03 C ATOM 0 H LEU A 46 24.738 17.101 21.035 1.00 41.41 H new ATOM 0 HA LEU A 46 25.037 14.387 21.516 1.00 50.25 H new ATOM 0 HB2 LEU A 46 24.934 16.047 19.341 1.00 40.12 H new ATOM 0 HB3 LEU A 46 26.621 15.575 19.302 1.00 40.12 H new ATOM 0 HG LEU A 46 24.215 13.740 19.177 1.00 33.42 H new ATOM 0 HD11 LEU A 46 25.104 13.194 16.944 1.00 22.22 H new ATOM 0 HD12 LEU A 46 24.713 14.924 17.094 1.00 22.22 H new ATOM 0 HD13 LEU A 46 26.407 14.384 17.176 1.00 22.22 H new ATOM 0 HD21 LEU A 46 25.837 11.904 18.914 1.00 23.03 H new ATOM 0 HD22 LEU A 46 27.169 13.043 19.224 1.00 23.03 H new ATOM 0 HD23 LEU A 46 25.983 12.692 20.503 1.00 23.03 H new ATOM 730 N ASN A 47 27.790 16.086 21.936 1.00 43.24 N ATOM 731 CA ASN A 47 29.165 16.006 22.416 1.00 61.53 C ATOM 732 C ASN A 47 29.203 15.764 23.921 1.00 32.01 C ATOM 733 O ASN A 47 30.162 15.198 24.446 1.00 63.22 O ATOM 734 CB ASN A 47 29.921 17.293 22.076 1.00 31.43 C ATOM 735 CG ASN A 47 31.425 17.097 22.079 1.00 71.43 C ATOM 736 OD1 ASN A 47 31.937 16.124 21.526 1.00 22.21 O ATOM 737 ND2 ASN A 47 32.140 18.025 22.703 1.00 34.10 N ATOM 0 H ASN A 47 27.436 17.036 21.827 1.00 43.24 H new ATOM 0 HA ASN A 47 29.649 15.165 21.919 1.00 61.53 H new ATOM 0 HB2 ASN A 47 29.605 17.648 21.095 1.00 31.43 H new ATOM 0 HB3 ASN A 47 29.657 18.068 22.796 1.00 31.43 H new ATOM 0 HD21 ASN A 47 33.157 17.948 22.738 1.00 34.10 H new ATOM 0 HD22 ASN A 47 31.673 18.815 23.148 1.00 34.10 H new ATOM 744 N ARG A 48 28.152 16.196 24.611 1.00 24.22 N ATOM 745 CA ARG A 48 28.065 16.026 26.057 1.00 70.32 C ATOM 746 C ARG A 48 27.710 14.585 26.415 1.00 71.33 C ATOM 747 O ARG A 48 28.014 14.114 27.510 1.00 60.33 O ATOM 748 CB ARG A 48 27.023 16.981 26.641 1.00 11.35 C ATOM 749 CG ARG A 48 27.593 18.327 27.053 1.00 35.13 C ATOM 750 CD ARG A 48 26.865 18.894 28.263 1.00 64.10 C ATOM 751 NE ARG A 48 26.898 20.354 28.286 1.00 14.13 N ATOM 752 CZ ARG A 48 26.313 21.087 29.227 1.00 12.32 C ATOM 753 NH1 ARG A 48 25.653 20.499 30.216 1.00 72.33 N ATOM 754 NH2 ARG A 48 26.386 22.411 29.180 1.00 42.41 N ATOM 0 H ARG A 48 27.349 16.666 24.192 1.00 24.22 H new ATOM 0 HA ARG A 48 29.040 16.258 26.485 1.00 70.32 H new ATOM 0 HB2 ARG A 48 26.235 17.140 25.905 1.00 11.35 H new ATOM 0 HB3 ARG A 48 26.559 16.512 27.508 1.00 11.35 H new ATOM 0 HG2 ARG A 48 28.653 18.220 27.282 1.00 35.13 H new ATOM 0 HG3 ARG A 48 27.516 19.026 26.220 1.00 35.13 H new ATOM 0 HD2 ARG A 48 25.829 18.555 28.255 1.00 64.10 H new ATOM 0 HD3 ARG A 48 27.320 18.507 29.174 1.00 64.10 H new ATOM 0 HE ARG A 48 27.397 20.837 27.539 1.00 14.13 H new ATOM 0 HH11 ARG A 48 25.594 19.481 30.255 1.00 72.33 H new ATOM 0 HH12 ARG A 48 25.205 21.064 30.937 1.00 72.33 H new ATOM 0 HH21 ARG A 48 26.892 22.867 28.421 1.00 42.41 H new ATOM 0 HH22 ARG A 48 25.936 22.973 29.903 1.00 42.41 H new ATOM 768 N GLY A 49 27.063 13.892 25.483 1.00 21.24 N ATOM 769 CA GLY A 49 26.676 12.513 25.719 1.00 51.23 C ATOM 770 C GLY A 49 25.367 12.400 26.477 1.00 45.35 C ATOM 771 O GLY A 49 25.249 11.604 27.408 1.00 44.50 O ATOM 0 H GLY A 49 26.800 14.261 24.569 1.00 21.24 H new ATOM 0 HA2 GLY A 49 26.585 11.996 24.764 1.00 51.23 H new ATOM 0 HA3 GLY A 49 27.462 12.009 26.281 1.00 51.23 H new ATOM 775 N ILE A 50 24.384 13.200 26.078 1.00 41.44 N ATOM 776 CA ILE A 50 23.079 13.186 26.726 1.00 5.25 C ATOM 777 C ILE A 50 21.958 13.363 25.708 1.00 21.32 C ATOM 778 O ILE A 50 20.804 13.591 26.073 1.00 25.22 O ATOM 779 CB ILE A 50 22.968 14.291 27.793 1.00 12.52 C ATOM 780 CG1 ILE A 50 22.675 15.640 27.133 1.00 13.30 C ATOM 781 CG2 ILE A 50 24.246 14.363 28.615 1.00 32.31 C ATOM 782 CD1 ILE A 50 23.713 16.050 26.111 1.00 13.32 C ATOM 0 H ILE A 50 24.467 13.866 25.309 1.00 41.44 H new ATOM 0 HA ILE A 50 22.977 12.214 27.210 1.00 5.25 H new ATOM 0 HB ILE A 50 22.142 14.049 28.462 1.00 12.52 H new ATOM 0 HG12 ILE A 50 21.699 15.595 26.650 1.00 13.30 H new ATOM 0 HG13 ILE A 50 22.613 16.407 27.905 1.00 13.30 H new ATOM 0 HG21 ILE A 50 24.153 15.148 29.365 1.00 32.31 H new ATOM 0 HG22 ILE A 50 24.414 13.407 29.110 1.00 32.31 H new ATOM 0 HG23 ILE A 50 25.088 14.585 27.960 1.00 32.31 H new ATOM 0 HD11 ILE A 50 23.441 17.015 25.684 1.00 13.32 H new ATOM 0 HD12 ILE A 50 24.687 16.128 26.593 1.00 13.32 H new ATOM 0 HD13 ILE A 50 23.759 15.303 25.319 1.00 13.32 H new ATOM 794 N SER A 51 22.304 13.256 24.429 1.00 34.11 N ATOM 795 CA SER A 51 21.327 13.407 23.357 1.00 2.22 C ATOM 796 C SER A 51 20.706 12.061 22.996 1.00 22.41 C ATOM 797 O SER A 51 21.240 11.321 22.171 1.00 63.23 O ATOM 798 CB SER A 51 21.985 14.026 22.122 1.00 52.33 C ATOM 799 OG SER A 51 22.989 13.174 21.598 1.00 13.41 O ATOM 0 H SER A 51 23.254 13.065 24.110 1.00 34.11 H new ATOM 0 HA SER A 51 20.537 14.070 23.709 1.00 2.22 H new ATOM 0 HB2 SER A 51 21.229 14.215 21.359 1.00 52.33 H new ATOM 0 HB3 SER A 51 22.422 14.990 22.383 1.00 52.33 H new ATOM 0 HG SER A 51 22.724 12.239 21.726 1.00 13.41 H new ATOM 805 N GLU A 52 19.574 11.751 23.621 1.00 74.24 N ATOM 806 CA GLU A 52 18.880 10.495 23.366 1.00 60.11 C ATOM 807 C GLU A 52 17.600 10.732 22.570 1.00 64.44 C ATOM 808 O GLU A 52 17.165 9.874 21.802 1.00 4.02 O ATOM 809 CB GLU A 52 18.550 9.792 24.684 1.00 51.32 C ATOM 810 CG GLU A 52 19.282 8.473 24.869 1.00 11.52 C ATOM 811 CD GLU A 52 18.748 7.378 23.966 1.00 32.02 C ATOM 812 OE1 GLU A 52 18.628 7.619 22.747 1.00 42.04 O ATOM 813 OE2 GLU A 52 18.449 6.279 24.480 1.00 50.11 O ATOM 0 H GLU A 52 19.119 12.353 24.307 1.00 74.24 H new ATOM 0 HA GLU A 52 19.541 9.858 22.778 1.00 60.11 H new ATOM 0 HB2 GLU A 52 18.799 10.455 25.512 1.00 51.32 H new ATOM 0 HB3 GLU A 52 17.476 9.612 24.731 1.00 51.32 H new ATOM 0 HG2 GLU A 52 20.343 8.619 24.668 1.00 11.52 H new ATOM 0 HG3 GLU A 52 19.195 8.156 25.908 1.00 11.52 H new ATOM 820 N PHE A 53 17.001 11.904 22.759 1.00 24.10 N ATOM 821 CA PHE A 53 15.770 12.254 22.060 1.00 60.34 C ATOM 822 C PHE A 53 15.877 13.641 21.431 1.00 45.43 C ATOM 823 O PHE A 53 16.226 14.612 22.102 1.00 60.02 O ATOM 824 CB PHE A 53 14.581 12.209 23.022 1.00 50.40 C ATOM 825 CG PHE A 53 13.283 11.855 22.356 1.00 71.11 C ATOM 826 CD1 PHE A 53 12.762 12.658 21.354 1.00 31.41 C ATOM 827 CD2 PHE A 53 12.584 10.719 22.730 1.00 55.10 C ATOM 828 CE1 PHE A 53 11.568 12.336 20.739 1.00 23.34 C ATOM 829 CE2 PHE A 53 11.389 10.392 22.118 1.00 22.23 C ATOM 830 CZ PHE A 53 10.879 11.201 21.122 1.00 63.01 C ATOM 0 H PHE A 53 17.348 12.626 23.390 1.00 24.10 H new ATOM 0 HA PHE A 53 15.613 11.524 21.265 1.00 60.34 H new ATOM 0 HB2 PHE A 53 14.787 11.482 23.807 1.00 50.40 H new ATOM 0 HB3 PHE A 53 14.479 13.180 23.506 1.00 50.40 H new ATOM 0 HD1 PHE A 53 13.296 13.546 21.050 1.00 31.41 H new ATOM 0 HD2 PHE A 53 12.977 10.082 23.508 1.00 55.10 H new ATOM 0 HE1 PHE A 53 11.173 12.971 19.959 1.00 23.34 H new ATOM 0 HE2 PHE A 53 10.854 9.503 22.419 1.00 22.23 H new ATOM 0 HZ PHE A 53 9.944 10.947 20.644 1.00 63.01 H new ATOM 840 N ILE A 54 15.576 13.723 20.140 1.00 23.23 N ATOM 841 CA ILE A 54 15.638 14.990 19.421 1.00 4.24 C ATOM 842 C ILE A 54 14.529 15.085 18.378 1.00 25.15 C ATOM 843 O ILE A 54 14.364 14.189 17.549 1.00 34.42 O ATOM 844 CB ILE A 54 16.999 15.176 18.725 1.00 11.03 C ATOM 845 CG1 ILE A 54 18.131 15.138 19.753 1.00 42.54 C ATOM 846 CG2 ILE A 54 17.024 16.485 17.950 1.00 33.35 C ATOM 847 CD1 ILE A 54 18.650 13.744 20.029 1.00 44.41 C ATOM 0 H ILE A 54 15.287 12.928 19.570 1.00 23.23 H new ATOM 0 HA ILE A 54 15.506 15.780 20.161 1.00 4.24 H new ATOM 0 HB ILE A 54 17.145 14.357 18.021 1.00 11.03 H new ATOM 0 HG12 ILE A 54 18.953 15.760 19.399 1.00 42.54 H new ATOM 0 HG13 ILE A 54 17.778 15.577 20.686 1.00 42.54 H new ATOM 0 HG21 ILE A 54 17.993 16.602 17.464 1.00 33.35 H new ATOM 0 HG22 ILE A 54 16.238 16.476 17.195 1.00 33.35 H new ATOM 0 HG23 ILE A 54 16.859 17.317 18.635 1.00 33.35 H new ATOM 0 HD11 ILE A 54 19.451 13.793 20.767 1.00 44.41 H new ATOM 0 HD12 ILE A 54 17.840 13.124 20.413 1.00 44.41 H new ATOM 0 HD13 ILE A 54 19.034 13.309 19.106 1.00 44.41 H new ATOM 859 N VAL A 55 13.772 16.176 18.425 1.00 0.04 N ATOM 860 CA VAL A 55 12.681 16.390 17.482 1.00 34.00 C ATOM 861 C VAL A 55 12.982 17.557 16.548 1.00 12.04 C ATOM 862 O VAL A 55 13.538 18.572 16.966 1.00 4.22 O ATOM 863 CB VAL A 55 11.353 16.663 18.213 1.00 12.55 C ATOM 864 CG1 VAL A 55 10.196 16.696 17.227 1.00 1.10 C ATOM 865 CG2 VAL A 55 11.114 15.617 19.292 1.00 2.22 C ATOM 0 H VAL A 55 13.894 16.925 19.106 1.00 0.04 H new ATOM 0 HA VAL A 55 12.585 15.475 16.897 1.00 34.00 H new ATOM 0 HB VAL A 55 11.418 17.640 18.693 1.00 12.55 H new ATOM 0 HG11 VAL A 55 9.267 16.890 17.763 1.00 1.10 H new ATOM 0 HG12 VAL A 55 10.364 17.486 16.495 1.00 1.10 H new ATOM 0 HG13 VAL A 55 10.126 15.736 16.716 1.00 1.10 H new ATOM 0 HG21 VAL A 55 10.171 15.825 19.798 1.00 2.22 H new ATOM 0 HG22 VAL A 55 11.070 14.628 18.836 1.00 2.22 H new ATOM 0 HG23 VAL A 55 11.929 15.648 20.015 1.00 2.22 H new ATOM 875 N MET A 56 12.610 17.405 15.282 1.00 62.14 N ATOM 876 CA MET A 56 12.839 18.447 14.288 1.00 62.03 C ATOM 877 C MET A 56 11.662 18.547 13.322 1.00 4.41 C ATOM 878 O MET A 56 11.271 17.558 12.703 1.00 22.31 O ATOM 879 CB MET A 56 14.128 18.168 13.512 1.00 4.15 C ATOM 880 CG MET A 56 15.310 17.820 14.402 1.00 24.11 C ATOM 881 SD MET A 56 15.498 16.043 14.643 1.00 42.32 S ATOM 882 CE MET A 56 17.220 15.822 14.204 1.00 45.25 C ATOM 0 H MET A 56 12.149 16.571 14.920 1.00 62.14 H new ATOM 0 HA MET A 56 12.937 19.398 14.812 1.00 62.03 H new ATOM 0 HB2 MET A 56 13.953 17.347 12.817 1.00 4.15 H new ATOM 0 HB3 MET A 56 14.379 19.044 12.914 1.00 4.15 H new ATOM 0 HG2 MET A 56 16.222 18.222 13.961 1.00 24.11 H new ATOM 0 HG3 MET A 56 15.185 18.303 15.371 1.00 24.11 H new ATOM 0 HE1 MET A 56 17.601 14.913 14.670 1.00 45.25 H new ATOM 0 HE2 MET A 56 17.312 15.740 13.121 1.00 45.25 H new ATOM 0 HE3 MET A 56 17.797 16.678 14.553 1.00 45.25 H new ATOM 892 N ALA A 57 11.103 19.745 13.201 1.00 33.55 N ATOM 893 CA ALA A 57 9.971 19.973 12.311 1.00 24.51 C ATOM 894 C ALA A 57 10.360 19.729 10.856 1.00 32.34 C ATOM 895 O ALA A 57 11.434 20.134 10.414 1.00 10.20 O ATOM 896 CB ALA A 57 9.438 21.388 12.486 1.00 25.21 C ATOM 0 H ALA A 57 11.415 20.573 13.708 1.00 33.55 H new ATOM 0 HA ALA A 57 9.185 19.265 12.574 1.00 24.51 H new ATOM 0 HB1 ALA A 57 8.593 21.544 11.815 1.00 25.21 H new ATOM 0 HB2 ALA A 57 9.114 21.530 13.517 1.00 25.21 H new ATOM 0 HB3 ALA A 57 10.225 22.105 12.251 1.00 25.21 H new ATOM 902 N ALA A 58 9.477 19.064 10.117 1.00 41.51 N ATOM 903 CA ALA A 58 9.728 18.766 8.712 1.00 11.40 C ATOM 904 C ALA A 58 9.822 20.046 7.889 1.00 61.21 C ATOM 905 O ALA A 58 10.681 20.173 7.016 1.00 4.23 O ATOM 906 CB ALA A 58 8.636 17.861 8.161 1.00 41.44 C ATOM 0 H ALA A 58 8.582 18.722 10.468 1.00 41.51 H new ATOM 0 HA ALA A 58 10.684 18.247 8.641 1.00 11.40 H new ATOM 0 HB1 ALA A 58 8.836 17.647 7.111 1.00 41.44 H new ATOM 0 HB2 ALA A 58 8.618 16.928 8.725 1.00 41.44 H new ATOM 0 HB3 ALA A 58 7.671 18.359 8.252 1.00 41.44 H new ATOM 912 N ASP A 59 8.934 20.992 8.171 1.00 40.33 N ATOM 913 CA ASP A 59 8.917 22.263 7.456 1.00 33.21 C ATOM 914 C ASP A 59 9.633 23.346 8.257 1.00 75.52 C ATOM 915 O ASP A 59 9.239 24.512 8.233 1.00 72.23 O ATOM 916 CB ASP A 59 7.477 22.692 7.168 1.00 45.10 C ATOM 917 CG ASP A 59 7.362 23.517 5.902 1.00 70.22 C ATOM 918 OD1 ASP A 59 8.409 23.817 5.291 1.00 24.12 O ATOM 919 OD2 ASP A 59 6.223 23.864 5.522 1.00 63.24 O ATOM 0 H ASP A 59 8.216 20.903 8.890 1.00 40.33 H new ATOM 0 HA ASP A 59 9.443 22.127 6.511 1.00 33.21 H new ATOM 0 HB2 ASP A 59 6.848 21.806 7.080 1.00 45.10 H new ATOM 0 HB3 ASP A 59 7.098 23.270 8.011 1.00 45.10 H new ATOM 924 N ALA A 60 10.684 22.953 8.967 1.00 11.41 N ATOM 925 CA ALA A 60 11.455 23.891 9.774 1.00 11.54 C ATOM 926 C ALA A 60 12.830 24.140 9.164 1.00 0.01 C ATOM 927 O ALA A 60 13.469 23.220 8.656 1.00 21.22 O ATOM 928 CB ALA A 60 11.594 23.371 11.199 1.00 64.22 C ATOM 0 H ALA A 60 11.022 21.991 9.000 1.00 11.41 H new ATOM 0 HA ALA A 60 10.919 24.840 9.795 1.00 11.54 H new ATOM 0 HB1 ALA A 60 12.172 24.081 11.791 1.00 64.22 H new ATOM 0 HB2 ALA A 60 10.605 23.251 11.641 1.00 64.22 H new ATOM 0 HB3 ALA A 60 12.105 22.408 11.187 1.00 64.22 H new ATOM 934 N GLU A 61 13.279 25.390 9.217 1.00 12.23 N ATOM 935 CA GLU A 61 14.577 25.759 8.667 1.00 54.02 C ATOM 936 C GLU A 61 15.334 26.675 9.625 1.00 34.23 C ATOM 937 O GLU A 61 14.752 27.316 10.501 1.00 31.10 O ATOM 938 CB GLU A 61 14.405 26.451 7.313 1.00 2.04 C ATOM 939 CG GLU A 61 13.140 27.287 7.214 1.00 41.43 C ATOM 940 CD GLU A 61 13.008 28.283 8.350 1.00 4.41 C ATOM 941 OE1 GLU A 61 13.629 29.363 8.267 1.00 10.03 O ATOM 942 OE2 GLU A 61 12.285 27.981 9.322 1.00 34.23 O ATOM 0 H GLU A 61 12.763 26.164 9.635 1.00 12.23 H new ATOM 0 HA GLU A 61 15.156 24.846 8.530 1.00 54.02 H new ATOM 0 HB2 GLU A 61 15.268 27.090 7.129 1.00 2.04 H new ATOM 0 HB3 GLU A 61 14.394 25.696 6.527 1.00 2.04 H new ATOM 0 HG2 GLU A 61 13.136 27.822 6.264 1.00 41.43 H new ATOM 0 HG3 GLU A 61 12.272 26.627 7.212 1.00 41.43 H new ATOM 949 N PRO A 62 16.662 26.740 9.457 1.00 41.32 N ATOM 950 CA PRO A 62 17.366 25.981 8.418 1.00 11.41 C ATOM 951 C PRO A 62 17.376 24.482 8.701 1.00 72.24 C ATOM 952 O PRO A 62 17.528 24.058 9.847 1.00 0.24 O ATOM 953 CB PRO A 62 18.788 26.544 8.471 1.00 43.25 C ATOM 954 CG PRO A 62 18.941 27.062 9.859 1.00 21.22 C ATOM 955 CD PRO A 62 17.581 27.557 10.268 1.00 24.11 C ATOM 0 HA PRO A 62 16.888 26.083 7.444 1.00 11.41 H new ATOM 0 HB2 PRO A 62 19.527 25.773 8.253 1.00 43.25 H new ATOM 0 HB3 PRO A 62 18.927 27.336 7.736 1.00 43.25 H new ATOM 0 HG2 PRO A 62 19.290 26.279 10.532 1.00 21.22 H new ATOM 0 HG3 PRO A 62 19.677 27.866 9.897 1.00 21.22 H new ATOM 0 HD2 PRO A 62 17.407 27.418 11.335 1.00 24.11 H new ATOM 0 HD3 PRO A 62 17.462 28.621 10.062 1.00 24.11 H new ATOM 963 N LEU A 63 17.214 23.686 7.651 1.00 70.31 N ATOM 964 CA LEU A 63 17.204 22.234 7.785 1.00 14.01 C ATOM 965 C LEU A 63 18.608 21.663 7.616 1.00 1.35 C ATOM 966 O LEU A 63 18.921 20.595 8.143 1.00 13.30 O ATOM 967 CB LEU A 63 16.261 21.612 6.754 1.00 33.53 C ATOM 968 CG LEU A 63 15.057 20.853 7.316 1.00 54.14 C ATOM 969 CD1 LEU A 63 13.847 21.027 6.413 1.00 60.22 C ATOM 970 CD2 LEU A 63 15.390 19.378 7.487 1.00 54.22 C ATOM 0 H LEU A 63 17.088 24.022 6.696 1.00 70.31 H new ATOM 0 HA LEU A 63 16.849 21.989 8.786 1.00 14.01 H new ATOM 0 HB2 LEU A 63 15.893 22.405 6.103 1.00 33.53 H new ATOM 0 HB3 LEU A 63 16.837 20.928 6.130 1.00 33.53 H new ATOM 0 HG LEU A 63 14.815 21.267 8.295 1.00 54.14 H new ATOM 0 HD11 LEU A 63 13.001 20.480 6.829 1.00 60.22 H new ATOM 0 HD12 LEU A 63 13.595 22.085 6.342 1.00 60.22 H new ATOM 0 HD13 LEU A 63 14.076 20.641 5.420 1.00 60.22 H new ATOM 0 HD21 LEU A 63 14.523 18.853 7.888 1.00 54.22 H new ATOM 0 HD22 LEU A 63 15.658 18.951 6.521 1.00 54.22 H new ATOM 0 HD23 LEU A 63 16.228 19.272 8.176 1.00 54.22 H new ATOM 982 N GLU A 64 19.450 22.380 6.880 1.00 74.53 N ATOM 983 CA GLU A 64 20.821 21.945 6.644 1.00 24.21 C ATOM 984 C GLU A 64 21.541 21.675 7.961 1.00 10.25 C ATOM 985 O GLU A 64 22.225 20.662 8.111 1.00 61.23 O ATOM 986 CB GLU A 64 21.583 22.999 5.840 1.00 71.25 C ATOM 987 CG GLU A 64 22.726 22.428 5.015 1.00 33.41 C ATOM 988 CD GLU A 64 23.742 23.481 4.618 1.00 30.45 C ATOM 989 OE1 GLU A 64 24.557 23.873 5.480 1.00 3.01 O ATOM 990 OE2 GLU A 64 23.722 23.914 3.448 1.00 22.42 O ATOM 0 H GLU A 64 19.207 23.266 6.436 1.00 74.53 H new ATOM 0 HA GLU A 64 20.787 21.018 6.072 1.00 24.21 H new ATOM 0 HB2 GLU A 64 20.887 23.510 5.175 1.00 71.25 H new ATOM 0 HB3 GLU A 64 21.979 23.749 6.524 1.00 71.25 H new ATOM 0 HG2 GLU A 64 23.225 21.644 5.585 1.00 33.41 H new ATOM 0 HG3 GLU A 64 22.323 21.961 4.117 1.00 33.41 H new ATOM 997 N ILE A 65 21.380 22.587 8.914 1.00 50.05 N ATOM 998 CA ILE A 65 22.014 22.447 10.219 1.00 74.44 C ATOM 999 C ILE A 65 21.622 21.131 10.883 1.00 32.41 C ATOM 1000 O ILE A 65 22.460 20.449 11.472 1.00 12.31 O ATOM 1001 CB ILE A 65 21.639 23.613 11.154 1.00 12.52 C ATOM 1002 CG1 ILE A 65 22.053 24.947 10.532 1.00 53.33 C ATOM 1003 CG2 ILE A 65 22.294 23.430 12.515 1.00 15.45 C ATOM 1004 CD1 ILE A 65 21.708 26.146 11.388 1.00 52.40 C ATOM 0 H ILE A 65 20.816 23.430 8.807 1.00 50.05 H new ATOM 0 HA ILE A 65 23.091 22.459 10.050 1.00 74.44 H new ATOM 0 HB ILE A 65 20.558 23.618 11.290 1.00 12.52 H new ATOM 0 HG12 ILE A 65 23.128 24.937 10.352 1.00 53.33 H new ATOM 0 HG13 ILE A 65 21.568 25.052 9.561 1.00 53.33 H new ATOM 0 HG21 ILE A 65 22.020 24.261 13.165 1.00 15.45 H new ATOM 0 HG22 ILE A 65 21.954 22.494 12.959 1.00 15.45 H new ATOM 0 HG23 ILE A 65 23.377 23.403 12.397 1.00 15.45 H new ATOM 0 HD11 ILE A 65 22.031 27.057 10.885 1.00 52.40 H new ATOM 0 HD12 ILE A 65 20.630 26.181 11.547 1.00 52.40 H new ATOM 0 HD13 ILE A 65 22.214 26.064 12.350 1.00 52.40 H new ATOM 1016 N ILE A 66 20.344 20.782 10.781 1.00 45.41 N ATOM 1017 CA ILE A 66 19.842 19.546 11.368 1.00 3.24 C ATOM 1018 C ILE A 66 20.562 18.331 10.793 1.00 40.22 C ATOM 1019 O ILE A 66 20.733 17.317 11.472 1.00 53.13 O ATOM 1020 CB ILE A 66 18.328 19.387 11.138 1.00 31.24 C ATOM 1021 CG1 ILE A 66 17.571 20.574 11.737 1.00 55.12 C ATOM 1022 CG2 ILE A 66 17.835 18.080 11.739 1.00 21.35 C ATOM 1023 CD1 ILE A 66 16.177 20.748 11.175 1.00 15.40 C ATOM 0 H ILE A 66 19.638 21.337 10.298 1.00 45.41 H new ATOM 0 HA ILE A 66 20.034 19.606 12.439 1.00 3.24 H new ATOM 0 HB ILE A 66 18.140 19.364 10.065 1.00 31.24 H new ATOM 0 HG12 ILE A 66 17.505 20.445 12.817 1.00 55.12 H new ATOM 0 HG13 ILE A 66 18.142 21.485 11.560 1.00 55.12 H new ATOM 0 HG21 ILE A 66 16.763 17.982 11.568 1.00 21.35 H new ATOM 0 HG22 ILE A 66 18.355 17.245 11.270 1.00 21.35 H new ATOM 0 HG23 ILE A 66 18.033 18.075 12.811 1.00 21.35 H new ATOM 0 HD11 ILE A 66 15.700 21.608 11.645 1.00 15.40 H new ATOM 0 HD12 ILE A 66 16.236 20.909 10.099 1.00 15.40 H new ATOM 0 HD13 ILE A 66 15.589 19.852 11.376 1.00 15.40 H new ATOM 1035 N LEU A 67 20.985 18.440 9.538 1.00 0.23 N ATOM 1036 CA LEU A 67 21.690 17.351 8.871 1.00 33.23 C ATOM 1037 C LEU A 67 23.104 17.199 9.421 1.00 53.43 C ATOM 1038 O LEU A 67 23.782 16.207 9.156 1.00 64.44 O ATOM 1039 CB LEU A 67 21.741 17.599 7.363 1.00 64.15 C ATOM 1040 CG LEU A 67 20.737 16.814 6.518 1.00 2.21 C ATOM 1041 CD1 LEU A 67 20.292 17.634 5.318 1.00 71.25 C ATOM 1042 CD2 LEU A 67 21.339 15.490 6.068 1.00 71.01 C ATOM 0 H LEU A 67 20.852 19.271 8.962 1.00 0.23 H new ATOM 0 HA LEU A 67 21.145 16.427 9.063 1.00 33.23 H new ATOM 0 HB2 LEU A 67 21.582 18.663 7.185 1.00 64.15 H new ATOM 0 HB3 LEU A 67 22.745 17.363 7.010 1.00 64.15 H new ATOM 0 HG LEU A 67 19.861 16.603 7.132 1.00 2.21 H new ATOM 0 HD11 LEU A 67 19.578 17.059 4.729 1.00 71.25 H new ATOM 0 HD12 LEU A 67 19.821 18.555 5.661 1.00 71.25 H new ATOM 0 HD13 LEU A 67 21.158 17.877 4.702 1.00 71.25 H new ATOM 0 HD21 LEU A 67 20.611 14.944 5.468 1.00 71.01 H new ATOM 0 HD22 LEU A 67 22.231 15.680 5.472 1.00 71.01 H new ATOM 0 HD23 LEU A 67 21.607 14.896 6.942 1.00 71.01 H new ATOM 1054 N HIS A 68 23.543 18.189 10.193 1.00 70.35 N ATOM 1055 CA HIS A 68 24.876 18.165 10.784 1.00 15.45 C ATOM 1056 C HIS A 68 24.967 17.103 11.877 1.00 24.43 C ATOM 1057 O HIS A 68 25.967 16.393 11.986 1.00 62.41 O ATOM 1058 CB HIS A 68 25.227 19.537 11.360 1.00 4.33 C ATOM 1059 CG HIS A 68 26.692 19.724 11.614 1.00 24.14 C ATOM 1060 ND1 HIS A 68 27.220 20.872 12.164 1.00 0.51 N ATOM 1061 CD2 HIS A 68 27.741 18.898 11.390 1.00 71.44 C ATOM 1062 CE1 HIS A 68 28.530 20.746 12.267 1.00 44.03 C ATOM 1063 NE2 HIS A 68 28.872 19.557 11.803 1.00 53.41 N ATOM 0 H HIS A 68 22.995 19.018 10.424 1.00 70.35 H new ATOM 0 HA HIS A 68 25.590 17.916 9.999 1.00 15.45 H new ATOM 0 HB2 HIS A 68 24.885 20.309 10.671 1.00 4.33 H new ATOM 0 HB3 HIS A 68 24.684 19.679 12.294 1.00 4.33 H new ATOM 0 HD2 HIS A 68 27.696 17.906 10.966 1.00 71.44 H new ATOM 0 HE1 HIS A 68 29.207 21.488 12.663 1.00 44.03 H new ATOM 0 HE2 HIS A 68 29.822 19.189 11.759 1.00 53.41 H new ATOM 1071 N LEU A 69 23.916 17.000 12.683 1.00 73.20 N ATOM 1072 CA LEU A 69 23.877 16.026 13.769 1.00 61.11 C ATOM 1073 C LEU A 69 24.205 14.627 13.256 1.00 14.13 C ATOM 1074 O LEU A 69 25.164 13.990 13.690 1.00 11.43 O ATOM 1075 CB LEU A 69 22.499 16.029 14.433 1.00 11.11 C ATOM 1076 CG LEU A 69 22.387 16.810 15.743 1.00 61.31 C ATOM 1077 CD1 LEU A 69 20.980 17.358 15.919 1.00 31.52 C ATOM 1078 CD2 LEU A 69 22.770 15.929 16.923 1.00 41.21 C ATOM 0 H LEU A 69 23.080 17.579 12.605 1.00 73.20 H new ATOM 0 HA LEU A 69 24.629 16.308 14.506 1.00 61.11 H new ATOM 0 HB2 LEU A 69 21.778 16.439 13.726 1.00 11.11 H new ATOM 0 HB3 LEU A 69 22.207 14.996 14.623 1.00 11.11 H new ATOM 0 HG LEU A 69 23.080 17.651 15.703 1.00 61.31 H new ATOM 0 HD11 LEU A 69 20.919 17.911 16.857 1.00 31.52 H new ATOM 0 HD12 LEU A 69 20.742 18.024 15.089 1.00 31.52 H new ATOM 0 HD13 LEU A 69 20.268 16.533 15.938 1.00 31.52 H new ATOM 0 HD21 LEU A 69 22.685 16.501 17.847 1.00 41.21 H new ATOM 0 HD22 LEU A 69 22.103 15.068 16.966 1.00 41.21 H new ATOM 0 HD23 LEU A 69 23.798 15.586 16.802 1.00 41.21 H new ATOM 1090 N PRO A 70 23.391 14.138 12.309 1.00 62.20 N ATOM 1091 CA PRO A 70 23.575 12.811 11.715 1.00 62.45 C ATOM 1092 C PRO A 70 24.813 12.740 10.826 1.00 55.25 C ATOM 1093 O PRO A 70 24.875 13.386 9.778 1.00 33.10 O ATOM 1094 CB PRO A 70 22.307 12.616 10.881 1.00 63.35 C ATOM 1095 CG PRO A 70 21.847 13.997 10.562 1.00 63.35 C ATOM 1096 CD PRO A 70 22.228 14.843 11.744 1.00 53.34 C ATOM 0 HA PRO A 70 23.725 12.043 12.474 1.00 62.45 H new ATOM 0 HB2 PRO A 70 22.513 12.048 9.974 1.00 63.35 H new ATOM 0 HB3 PRO A 70 21.549 12.065 11.437 1.00 63.35 H new ATOM 0 HG2 PRO A 70 22.319 14.365 9.651 1.00 63.35 H new ATOM 0 HG3 PRO A 70 20.770 14.021 10.396 1.00 63.35 H new ATOM 0 HD2 PRO A 70 22.481 15.860 11.445 1.00 53.34 H new ATOM 0 HD3 PRO A 70 21.414 14.916 12.465 1.00 53.34 H new ATOM 1104 N LEU A 71 25.796 11.954 11.250 1.00 51.25 N ATOM 1105 CA LEU A 71 27.032 11.799 10.492 1.00 42.42 C ATOM 1106 C LEU A 71 26.880 10.733 9.413 1.00 63.43 C ATOM 1107 O LEU A 71 27.086 10.999 8.228 1.00 71.32 O ATOM 1108 CB LEU A 71 28.185 11.431 11.428 1.00 53.14 C ATOM 1109 CG LEU A 71 28.809 12.588 12.211 1.00 32.32 C ATOM 1110 CD1 LEU A 71 27.976 12.911 13.441 1.00 32.03 C ATOM 1111 CD2 LEU A 71 30.240 12.254 12.606 1.00 4.40 C ATOM 0 H LEU A 71 25.761 11.414 12.115 1.00 51.25 H new ATOM 0 HA LEU A 71 27.253 12.750 10.008 1.00 42.42 H new ATOM 0 HB2 LEU A 71 27.825 10.688 12.140 1.00 53.14 H new ATOM 0 HB3 LEU A 71 28.968 10.954 10.838 1.00 53.14 H new ATOM 0 HG LEU A 71 28.827 13.468 11.569 1.00 32.32 H new ATOM 0 HD11 LEU A 71 28.435 13.736 13.985 1.00 32.03 H new ATOM 0 HD12 LEU A 71 26.969 13.194 13.134 1.00 32.03 H new ATOM 0 HD13 LEU A 71 27.925 12.034 14.087 1.00 32.03 H new ATOM 0 HD21 LEU A 71 30.668 13.088 13.162 1.00 4.40 H new ATOM 0 HD22 LEU A 71 30.246 11.361 13.230 1.00 4.40 H new ATOM 0 HD23 LEU A 71 30.832 12.074 11.709 1.00 4.40 H new ATOM 1123 N LEU A 72 26.515 9.525 9.829 1.00 22.12 N ATOM 1124 CA LEU A 72 26.331 8.418 8.897 1.00 5.24 C ATOM 1125 C LEU A 72 24.860 8.027 8.798 1.00 34.12 C ATOM 1126 O LEU A 72 24.194 8.323 7.805 1.00 64.03 O ATOM 1127 CB LEU A 72 27.162 7.211 9.338 1.00 71.32 C ATOM 1128 CG LEU A 72 28.496 7.015 8.617 1.00 75.24 C ATOM 1129 CD1 LEU A 72 28.267 6.708 7.145 1.00 50.35 C ATOM 1130 CD2 LEU A 72 29.375 8.248 8.777 1.00 24.21 C ATOM 0 H LEU A 72 26.341 9.287 10.805 1.00 22.12 H new ATOM 0 HA LEU A 72 26.668 8.745 7.913 1.00 5.24 H new ATOM 0 HB2 LEU A 72 27.359 7.302 10.406 1.00 71.32 H new ATOM 0 HB3 LEU A 72 26.562 6.312 9.200 1.00 71.32 H new ATOM 0 HG LEU A 72 29.010 6.166 9.068 1.00 75.24 H new ATOM 0 HD11 LEU A 72 29.227 6.572 6.648 1.00 50.35 H new ATOM 0 HD12 LEU A 72 27.677 5.796 7.051 1.00 50.35 H new ATOM 0 HD13 LEU A 72 27.732 7.536 6.680 1.00 50.35 H new ATOM 0 HD21 LEU A 72 30.320 8.091 8.258 1.00 24.21 H new ATOM 0 HD22 LEU A 72 28.867 9.114 8.353 1.00 24.21 H new ATOM 0 HD23 LEU A 72 29.567 8.423 9.836 1.00 24.21 H new ATOM 1142 N CYS A 73 24.358 7.365 9.834 1.00 15.32 N ATOM 1143 CA CYS A 73 22.964 6.936 9.865 1.00 21.12 C ATOM 1144 C CYS A 73 22.593 6.392 11.241 1.00 63.34 C ATOM 1145 O CYS A 73 23.349 6.539 12.201 1.00 33.52 O ATOM 1146 CB CYS A 73 22.714 5.870 8.797 1.00 33.21 C ATOM 1147 SG CYS A 73 21.313 6.229 7.710 1.00 2.53 S ATOM 0 H CYS A 73 24.895 7.113 10.664 1.00 15.32 H new ATOM 0 HA CYS A 73 22.337 7.803 9.657 1.00 21.12 H new ATOM 0 HB2 CYS A 73 23.613 5.761 8.190 1.00 33.21 H new ATOM 0 HB3 CYS A 73 22.543 4.912 9.288 1.00 33.21 H new ATOM 0 HG CYS A 73 20.251 5.628 8.158 1.00 2.53 H new ATOM 1153 N GLU A 74 21.424 5.765 11.327 1.00 52.43 N ATOM 1154 CA GLU A 74 20.951 5.202 12.587 1.00 42.43 C ATOM 1155 C GLU A 74 22.006 4.287 13.203 1.00 24.34 C ATOM 1156 O GLU A 74 22.133 4.202 14.424 1.00 60.10 O ATOM 1157 CB GLU A 74 19.651 4.426 12.369 1.00 74.11 C ATOM 1158 CG GLU A 74 18.591 5.214 11.617 1.00 13.52 C ATOM 1159 CD GLU A 74 18.463 4.785 10.169 1.00 52.21 C ATOM 1160 OE1 GLU A 74 19.501 4.472 9.550 1.00 4.01 O ATOM 1161 OE2 GLU A 74 17.325 4.762 9.655 1.00 55.11 O ATOM 0 H GLU A 74 20.788 5.634 10.541 1.00 52.43 H new ATOM 0 HA GLU A 74 20.762 6.026 13.275 1.00 42.43 H new ATOM 0 HB2 GLU A 74 19.871 3.512 11.818 1.00 74.11 H new ATOM 0 HB3 GLU A 74 19.250 4.126 13.337 1.00 74.11 H new ATOM 0 HG2 GLU A 74 17.630 5.090 12.115 1.00 13.52 H new ATOM 0 HG3 GLU A 74 18.836 6.275 11.657 1.00 13.52 H new ATOM 1168 N ASP A 75 22.759 3.602 12.348 1.00 13.02 N ATOM 1169 CA ASP A 75 23.802 2.692 12.806 1.00 13.32 C ATOM 1170 C ASP A 75 24.818 3.426 13.676 1.00 3.20 C ATOM 1171 O ASP A 75 25.425 2.836 14.571 1.00 74.14 O ATOM 1172 CB ASP A 75 24.507 2.046 11.612 1.00 35.03 C ATOM 1173 CG ASP A 75 25.395 0.888 12.020 1.00 12.21 C ATOM 1174 OD1 ASP A 75 24.852 -0.164 12.420 1.00 40.23 O ATOM 1175 OD2 ASP A 75 26.632 1.033 11.940 1.00 43.12 O ATOM 0 H ASP A 75 22.666 3.660 11.334 1.00 13.02 H new ATOM 0 HA ASP A 75 23.332 1.912 13.405 1.00 13.32 H new ATOM 0 HB2 ASP A 75 23.760 1.694 10.900 1.00 35.03 H new ATOM 0 HB3 ASP A 75 25.108 2.797 11.099 1.00 35.03 H new ATOM 1180 N LYS A 76 25.000 4.714 13.406 1.00 1.44 N ATOM 1181 CA LYS A 76 25.942 5.529 14.164 1.00 51.11 C ATOM 1182 C LYS A 76 25.253 6.198 15.349 1.00 70.23 C ATOM 1183 O LYS A 76 25.799 7.117 15.958 1.00 53.41 O ATOM 1184 CB LYS A 76 26.572 6.591 13.259 1.00 2.14 C ATOM 1185 CG LYS A 76 28.089 6.609 13.308 1.00 52.24 C ATOM 1186 CD LYS A 76 28.630 8.030 13.330 1.00 11.31 C ATOM 1187 CE LYS A 76 30.149 8.050 13.248 1.00 33.43 C ATOM 1188 NZ LYS A 76 30.779 7.893 14.588 1.00 74.04 N ATOM 0 H LYS A 76 24.507 5.216 12.668 1.00 1.44 H new ATOM 0 HA LYS A 76 26.726 4.874 14.545 1.00 51.11 H new ATOM 0 HB2 LYS A 76 26.252 6.417 12.232 1.00 2.14 H new ATOM 0 HB3 LYS A 76 26.196 7.572 13.548 1.00 2.14 H new ATOM 0 HG2 LYS A 76 28.432 6.075 14.194 1.00 52.24 H new ATOM 0 HG3 LYS A 76 28.488 6.080 12.443 1.00 52.24 H new ATOM 0 HD2 LYS A 76 28.212 8.592 12.495 1.00 11.31 H new ATOM 0 HD3 LYS A 76 28.307 8.529 14.244 1.00 11.31 H new ATOM 0 HE2 LYS A 76 30.488 7.249 12.591 1.00 33.43 H new ATOM 0 HE3 LYS A 76 30.476 8.989 12.801 1.00 33.43 H new ATOM 0 HZ1 LYS A 76 31.814 7.912 14.489 1.00 74.04 H new ATOM 0 HZ2 LYS A 76 30.476 8.672 15.207 1.00 74.04 H new ATOM 0 HZ3 LYS A 76 30.487 6.986 15.005 1.00 74.04 H new ATOM 1202 N ASN A 77 24.051 5.732 15.669 1.00 10.54 N ATOM 1203 CA ASN A 77 23.288 6.285 16.782 1.00 12.24 C ATOM 1204 C ASN A 77 22.903 7.735 16.509 1.00 54.02 C ATOM 1205 O ASN A 77 23.630 8.661 16.871 1.00 13.34 O ATOM 1206 CB ASN A 77 24.097 6.196 18.077 1.00 14.42 C ATOM 1207 CG ASN A 77 24.928 4.929 18.154 1.00 40.21 C ATOM 1208 OD1 ASN A 77 24.393 3.820 18.130 1.00 45.04 O ATOM 1209 ND2 ASN A 77 26.243 5.089 18.247 1.00 63.11 N ATOM 0 H ASN A 77 23.584 4.973 15.174 1.00 10.54 H new ATOM 0 HA ASN A 77 22.375 5.699 16.891 1.00 12.24 H new ATOM 0 HB2 ASN A 77 24.753 7.063 18.152 1.00 14.42 H new ATOM 0 HB3 ASN A 77 23.419 6.235 18.929 1.00 14.42 H new ATOM 0 HD21 ASN A 77 26.853 4.274 18.302 1.00 63.11 H new ATOM 0 HD22 ASN A 77 26.643 6.027 18.263 1.00 63.11 H new ATOM 1216 N VAL A 78 21.754 7.927 15.868 1.00 1.25 N ATOM 1217 CA VAL A 78 21.271 9.265 15.548 1.00 12.11 C ATOM 1218 C VAL A 78 19.747 9.306 15.521 1.00 63.13 C ATOM 1219 O VAL A 78 19.114 9.086 14.488 1.00 63.51 O ATOM 1220 CB VAL A 78 21.811 9.746 14.189 1.00 25.50 C ATOM 1221 CG1 VAL A 78 21.265 11.126 13.855 1.00 73.43 C ATOM 1222 CG2 VAL A 78 23.332 9.753 14.192 1.00 45.22 C ATOM 0 H VAL A 78 21.140 7.173 15.560 1.00 1.25 H new ATOM 0 HA VAL A 78 21.636 9.930 16.331 1.00 12.11 H new ATOM 0 HB VAL A 78 21.475 9.052 13.419 1.00 25.50 H new ATOM 0 HG11 VAL A 78 21.658 11.449 12.891 1.00 73.43 H new ATOM 0 HG12 VAL A 78 20.177 11.085 13.808 1.00 73.43 H new ATOM 0 HG13 VAL A 78 21.569 11.834 14.626 1.00 73.43 H new ATOM 0 HG21 VAL A 78 23.696 10.096 13.223 1.00 45.22 H new ATOM 0 HG22 VAL A 78 23.691 10.424 14.973 1.00 45.22 H new ATOM 0 HG23 VAL A 78 23.700 8.745 14.382 1.00 45.22 H new ATOM 1232 N PRO A 79 19.142 9.596 16.682 1.00 24.50 N ATOM 1233 CA PRO A 79 17.684 9.674 16.817 1.00 62.32 C ATOM 1234 C PRO A 79 17.100 10.886 16.098 1.00 24.11 C ATOM 1235 O PRO A 79 17.816 11.835 15.779 1.00 71.31 O ATOM 1236 CB PRO A 79 17.474 9.797 18.328 1.00 41.23 C ATOM 1237 CG PRO A 79 18.739 10.395 18.839 1.00 60.22 C ATOM 1238 CD PRO A 79 19.834 9.869 17.953 1.00 62.13 C ATOM 0 HA PRO A 79 17.187 8.812 16.372 1.00 62.32 H new ATOM 0 HB2 PRO A 79 16.616 10.429 18.558 1.00 41.23 H new ATOM 0 HB3 PRO A 79 17.284 8.824 18.782 1.00 41.23 H new ATOM 0 HG2 PRO A 79 18.698 11.484 18.804 1.00 60.22 H new ATOM 0 HG3 PRO A 79 18.910 10.116 19.879 1.00 60.22 H new ATOM 0 HD2 PRO A 79 20.634 10.598 17.826 1.00 62.13 H new ATOM 0 HD3 PRO A 79 20.287 8.968 18.366 1.00 62.13 H new ATOM 1246 N TYR A 80 15.797 10.846 15.846 1.00 15.15 N ATOM 1247 CA TYR A 80 15.116 11.940 15.163 1.00 62.14 C ATOM 1248 C TYR A 80 13.626 11.648 15.017 1.00 22.23 C ATOM 1249 O TYR A 80 13.161 10.554 15.338 1.00 35.20 O ATOM 1250 CB TYR A 80 15.739 12.173 13.785 1.00 33.11 C ATOM 1251 CG TYR A 80 15.943 10.904 12.990 1.00 61.12 C ATOM 1252 CD1 TYR A 80 14.859 10.179 12.511 1.00 44.12 C ATOM 1253 CD2 TYR A 80 17.220 10.429 12.718 1.00 74.15 C ATOM 1254 CE1 TYR A 80 15.041 9.019 11.784 1.00 2.35 C ATOM 1255 CE2 TYR A 80 17.411 9.271 11.991 1.00 43.42 C ATOM 1256 CZ TYR A 80 16.319 8.568 11.526 1.00 13.11 C ATOM 1257 OH TYR A 80 16.506 7.413 10.803 1.00 22.01 O ATOM 0 H TYR A 80 15.190 10.068 16.104 1.00 15.15 H new ATOM 0 HA TYR A 80 15.233 12.841 15.766 1.00 62.14 H new ATOM 0 HB2 TYR A 80 15.100 12.849 13.217 1.00 33.11 H new ATOM 0 HB3 TYR A 80 16.700 12.672 13.910 1.00 33.11 H new ATOM 0 HD1 TYR A 80 13.857 10.529 12.711 1.00 44.12 H new ATOM 0 HD2 TYR A 80 18.078 10.975 13.082 1.00 74.15 H new ATOM 0 HE1 TYR A 80 14.187 8.468 11.419 1.00 2.35 H new ATOM 0 HE2 TYR A 80 18.411 8.917 11.787 1.00 43.42 H new ATOM 0 HH TYR A 80 17.351 7.469 10.309 1.00 22.01 H new ATOM 1267 N VAL A 81 12.881 12.635 14.529 1.00 73.13 N ATOM 1268 CA VAL A 81 11.443 12.486 14.338 1.00 41.30 C ATOM 1269 C VAL A 81 10.846 13.722 13.676 1.00 61.23 C ATOM 1270 O VAL A 81 11.157 14.853 14.051 1.00 13.12 O ATOM 1271 CB VAL A 81 10.723 12.235 15.676 1.00 34.51 C ATOM 1272 CG1 VAL A 81 10.923 13.412 16.620 1.00 43.45 C ATOM 1273 CG2 VAL A 81 9.242 11.976 15.443 1.00 60.20 C ATOM 0 H VAL A 81 13.250 13.547 14.259 1.00 73.13 H new ATOM 0 HA VAL A 81 11.297 11.623 13.688 1.00 41.30 H new ATOM 0 HB VAL A 81 11.156 11.349 16.141 1.00 34.51 H new ATOM 0 HG11 VAL A 81 10.407 13.216 17.560 1.00 43.45 H new ATOM 0 HG12 VAL A 81 11.987 13.548 16.812 1.00 43.45 H new ATOM 0 HG13 VAL A 81 10.518 14.316 16.165 1.00 43.45 H new ATOM 0 HG21 VAL A 81 8.749 11.801 16.399 1.00 60.20 H new ATOM 0 HG22 VAL A 81 8.793 12.842 14.957 1.00 60.20 H new ATOM 0 HG23 VAL A 81 9.122 11.099 14.806 1.00 60.20 H new ATOM 1283 N PHE A 82 9.986 13.500 12.687 1.00 24.24 N ATOM 1284 CA PHE A 82 9.344 14.595 11.970 1.00 54.24 C ATOM 1285 C PHE A 82 7.887 14.744 12.396 1.00 21.41 C ATOM 1286 O PHE A 82 7.114 13.787 12.351 1.00 24.13 O ATOM 1287 CB PHE A 82 9.425 14.363 10.460 1.00 1.40 C ATOM 1288 CG PHE A 82 10.809 14.530 9.901 1.00 42.35 C ATOM 1289 CD1 PHE A 82 11.385 15.787 9.807 1.00 2.43 C ATOM 1290 CD2 PHE A 82 11.534 13.431 9.469 1.00 14.21 C ATOM 1291 CE1 PHE A 82 12.659 15.945 9.294 1.00 33.43 C ATOM 1292 CE2 PHE A 82 12.809 13.583 8.955 1.00 34.04 C ATOM 1293 CZ PHE A 82 13.370 14.841 8.866 1.00 41.24 C ATOM 0 H PHE A 82 9.718 12.570 12.364 1.00 24.24 H new ATOM 0 HA PHE A 82 9.872 15.516 12.217 1.00 54.24 H new ATOM 0 HB2 PHE A 82 9.070 13.357 10.236 1.00 1.40 H new ATOM 0 HB3 PHE A 82 8.752 15.058 9.957 1.00 1.40 H new ATOM 0 HD1 PHE A 82 10.832 16.653 10.138 1.00 2.43 H new ATOM 0 HD2 PHE A 82 11.099 12.445 9.534 1.00 14.21 H new ATOM 0 HE1 PHE A 82 13.097 16.930 9.228 1.00 33.43 H new ATOM 0 HE2 PHE A 82 13.365 12.718 8.624 1.00 34.04 H new ATOM 0 HZ PHE A 82 14.364 14.962 8.462 1.00 41.24 H new ATOM 1303 N VAL A 83 7.517 15.952 12.810 1.00 14.34 N ATOM 1304 CA VAL A 83 6.153 16.227 13.244 1.00 3.21 C ATOM 1305 C VAL A 83 5.498 17.282 12.361 1.00 23.43 C ATOM 1306 O VAL A 83 6.139 18.251 11.953 1.00 65.11 O ATOM 1307 CB VAL A 83 6.115 16.704 14.708 1.00 13.00 C ATOM 1308 CG1 VAL A 83 6.365 15.540 15.656 1.00 35.22 C ATOM 1309 CG2 VAL A 83 7.131 17.814 14.933 1.00 24.14 C ATOM 0 H VAL A 83 8.143 16.756 12.854 1.00 14.34 H new ATOM 0 HA VAL A 83 5.600 15.292 13.160 1.00 3.21 H new ATOM 0 HB VAL A 83 5.123 17.104 14.916 1.00 13.00 H new ATOM 0 HG11 VAL A 83 6.334 15.896 16.686 1.00 35.22 H new ATOM 0 HG12 VAL A 83 5.596 14.781 15.512 1.00 35.22 H new ATOM 0 HG13 VAL A 83 7.344 15.107 15.451 1.00 35.22 H new ATOM 0 HG21 VAL A 83 7.091 18.139 15.973 1.00 24.14 H new ATOM 0 HG22 VAL A 83 8.131 17.443 14.707 1.00 24.14 H new ATOM 0 HG23 VAL A 83 6.900 18.656 14.280 1.00 24.14 H new ATOM 1319 N ARG A 84 4.215 17.087 12.067 1.00 54.43 N ATOM 1320 CA ARG A 84 3.473 18.022 11.231 1.00 21.33 C ATOM 1321 C ARG A 84 2.891 19.157 12.068 1.00 63.33 C ATOM 1322 O ARG A 84 1.692 19.433 12.011 1.00 1.40 O ATOM 1323 CB ARG A 84 2.350 17.294 10.489 1.00 61.14 C ATOM 1324 CG ARG A 84 1.997 17.924 9.150 1.00 12.01 C ATOM 1325 CD ARG A 84 0.881 17.160 8.454 1.00 61.04 C ATOM 1326 NE ARG A 84 -0.438 17.557 8.937 1.00 1.11 N ATOM 1327 CZ ARG A 84 -0.991 18.736 8.680 1.00 30.53 C ATOM 1328 NH1 ARG A 84 -0.344 19.631 7.947 1.00 44.32 N ATOM 1329 NH2 ARG A 84 -2.196 19.023 9.156 1.00 23.14 N ATOM 0 H ARG A 84 3.670 16.290 12.396 1.00 54.43 H new ATOM 0 HA ARG A 84 4.164 18.448 10.504 1.00 21.33 H new ATOM 0 HB2 ARG A 84 2.645 16.257 10.327 1.00 61.14 H new ATOM 0 HB3 ARG A 84 1.461 17.277 11.119 1.00 61.14 H new ATOM 0 HG2 ARG A 84 1.691 18.959 9.303 1.00 12.01 H new ATOM 0 HG3 ARG A 84 2.880 17.943 8.511 1.00 12.01 H new ATOM 0 HD2 ARG A 84 0.940 17.331 7.379 1.00 61.04 H new ATOM 0 HD3 ARG A 84 1.019 16.091 8.614 1.00 61.04 H new ATOM 0 HE ARG A 84 -0.964 16.891 9.503 1.00 1.11 H new ATOM 0 HH11 ARG A 84 0.582 19.415 7.578 1.00 44.32 H new ATOM 0 HH12 ARG A 84 -0.772 20.536 7.752 1.00 44.32 H new ATOM 0 HH21 ARG A 84 -2.698 18.337 9.720 1.00 23.14 H new ATOM 0 HH22 ARG A 84 -2.620 19.929 8.958 1.00 23.14 H new ATOM 1343 N SER A 85 3.748 19.813 12.845 1.00 65.12 N ATOM 1344 CA SER A 85 3.318 20.915 13.697 1.00 42.34 C ATOM 1345 C SER A 85 4.511 21.556 14.398 1.00 42.23 C ATOM 1346 O SER A 85 5.002 21.048 15.407 1.00 31.13 O ATOM 1347 CB SER A 85 2.309 20.421 14.735 1.00 31.54 C ATOM 1348 OG SER A 85 1.249 21.348 14.897 1.00 53.13 O ATOM 0 H SER A 85 4.744 19.600 12.902 1.00 65.12 H new ATOM 0 HA SER A 85 2.842 21.665 13.066 1.00 42.34 H new ATOM 0 HB2 SER A 85 1.908 19.456 14.426 1.00 31.54 H new ATOM 0 HB3 SER A 85 2.811 20.267 15.690 1.00 31.54 H new ATOM 0 HG SER A 85 0.617 21.009 15.564 1.00 53.13 H new ATOM 1354 N LYS A 86 4.976 22.678 13.856 1.00 24.45 N ATOM 1355 CA LYS A 86 6.110 23.392 14.427 1.00 53.51 C ATOM 1356 C LYS A 86 5.660 24.318 15.553 1.00 33.12 C ATOM 1357 O LYS A 86 6.420 24.597 16.479 1.00 54.14 O ATOM 1358 CB LYS A 86 6.829 24.200 13.344 1.00 33.14 C ATOM 1359 CG LYS A 86 5.911 25.133 12.573 1.00 44.42 C ATOM 1360 CD LYS A 86 5.603 24.590 11.187 1.00 14.31 C ATOM 1361 CE LYS A 86 4.997 25.660 10.292 1.00 62.34 C ATOM 1362 NZ LYS A 86 4.805 25.173 8.898 1.00 54.03 N ATOM 0 H LYS A 86 4.583 23.112 13.021 1.00 24.45 H new ATOM 0 HA LYS A 86 6.800 22.656 14.840 1.00 53.51 H new ATOM 0 HB2 LYS A 86 7.624 24.786 13.806 1.00 33.14 H new ATOM 0 HB3 LYS A 86 7.305 23.512 12.645 1.00 33.14 H new ATOM 0 HG2 LYS A 86 4.982 25.270 13.126 1.00 44.42 H new ATOM 0 HG3 LYS A 86 6.378 26.114 12.485 1.00 44.42 H new ATOM 0 HD2 LYS A 86 6.518 24.209 10.733 1.00 14.31 H new ATOM 0 HD3 LYS A 86 4.914 23.749 11.269 1.00 14.31 H new ATOM 0 HE2 LYS A 86 4.038 25.976 10.702 1.00 62.34 H new ATOM 0 HE3 LYS A 86 5.645 26.537 10.285 1.00 62.34 H new ATOM 0 HZ1 LYS A 86 4.390 25.931 8.319 1.00 54.03 H new ATOM 0 HZ2 LYS A 86 5.724 24.895 8.498 1.00 54.03 H new ATOM 0 HZ3 LYS A 86 4.167 24.352 8.902 1.00 54.03 H new ATOM 1376 N GLN A 87 4.420 24.788 15.465 1.00 4.23 N ATOM 1377 CA GLN A 87 3.870 25.681 16.477 1.00 34.23 C ATOM 1378 C GLN A 87 3.567 24.924 17.766 1.00 34.24 C ATOM 1379 O GLN A 87 3.961 25.346 18.853 1.00 3.05 O ATOM 1380 CB GLN A 87 2.598 26.354 15.956 1.00 14.33 C ATOM 1381 CG GLN A 87 2.414 27.778 16.457 1.00 32.25 C ATOM 1382 CD GLN A 87 1.006 28.295 16.239 1.00 75.53 C ATOM 1383 OE1 GLN A 87 0.130 27.568 15.771 1.00 11.52 O ATOM 1384 NE2 GLN A 87 0.781 29.559 16.579 1.00 63.42 N ATOM 0 H GLN A 87 3.778 24.565 14.704 1.00 4.23 H new ATOM 0 HA GLN A 87 4.616 26.446 16.694 1.00 34.23 H new ATOM 0 HB2 GLN A 87 2.621 26.361 14.866 1.00 14.33 H new ATOM 0 HB3 GLN A 87 1.734 25.759 16.253 1.00 14.33 H new ATOM 0 HG2 GLN A 87 2.652 27.819 17.520 1.00 32.25 H new ATOM 0 HG3 GLN A 87 3.121 28.433 15.947 1.00 32.25 H new ATOM 0 HE21 GLN A 87 1.537 30.126 16.964 1.00 63.42 H new ATOM 0 HE22 GLN A 87 -0.147 29.963 16.456 1.00 63.42 H new ATOM 1393 N ALA A 88 2.864 23.804 17.637 1.00 12.14 N ATOM 1394 CA ALA A 88 2.510 22.986 18.791 1.00 74.51 C ATOM 1395 C ALA A 88 3.739 22.667 19.635 1.00 34.34 C ATOM 1396 O ALA A 88 3.672 22.649 20.865 1.00 45.11 O ATOM 1397 CB ALA A 88 1.828 21.703 18.340 1.00 62.55 C ATOM 0 H ALA A 88 2.528 23.442 16.745 1.00 12.14 H new ATOM 0 HA ALA A 88 1.815 23.555 19.409 1.00 74.51 H new ATOM 0 HB1 ALA A 88 1.570 21.102 19.212 1.00 62.55 H new ATOM 0 HB2 ALA A 88 0.922 21.948 17.786 1.00 62.55 H new ATOM 0 HB3 ALA A 88 2.504 21.138 17.698 1.00 62.55 H new ATOM 1403 N LEU A 89 4.859 22.414 18.968 1.00 40.25 N ATOM 1404 CA LEU A 89 6.104 22.094 19.657 1.00 62.15 C ATOM 1405 C LEU A 89 6.586 23.278 20.488 1.00 53.35 C ATOM 1406 O LEU A 89 6.811 23.155 21.692 1.00 13.14 O ATOM 1407 CB LEU A 89 7.181 21.693 18.648 1.00 63.51 C ATOM 1408 CG LEU A 89 8.617 21.663 19.172 1.00 54.41 C ATOM 1409 CD1 LEU A 89 8.763 20.619 20.267 1.00 4.32 C ATOM 1410 CD2 LEU A 89 9.595 21.392 18.039 1.00 32.54 C ATOM 0 H LEU A 89 4.931 22.424 17.951 1.00 40.25 H new ATOM 0 HA LEU A 89 5.914 21.256 20.328 1.00 62.15 H new ATOM 0 HB2 LEU A 89 6.937 20.704 18.261 1.00 63.51 H new ATOM 0 HB3 LEU A 89 7.137 22.385 17.807 1.00 63.51 H new ATOM 0 HG LEU A 89 8.848 22.640 19.596 1.00 54.41 H new ATOM 0 HD11 LEU A 89 9.791 20.612 20.628 1.00 4.32 H new ATOM 0 HD12 LEU A 89 8.091 20.859 21.091 1.00 4.32 H new ATOM 0 HD13 LEU A 89 8.511 19.636 19.869 1.00 4.32 H new ATOM 0 HD21 LEU A 89 10.611 21.375 18.432 1.00 32.54 H new ATOM 0 HD22 LEU A 89 9.366 20.429 17.583 1.00 32.54 H new ATOM 0 HD23 LEU A 89 9.510 22.178 17.289 1.00 32.54 H new ATOM 1422 N GLY A 90 6.744 24.427 19.838 1.00 34.50 N ATOM 1423 CA GLY A 90 7.196 25.618 20.533 1.00 30.42 C ATOM 1424 C GLY A 90 6.251 26.035 21.644 1.00 63.22 C ATOM 1425 O GLY A 90 6.680 26.588 22.656 1.00 52.02 O ATOM 0 H GLY A 90 6.567 24.554 18.842 1.00 34.50 H new ATOM 0 HA2 GLY A 90 8.186 25.437 20.951 1.00 30.42 H new ATOM 0 HA3 GLY A 90 7.296 26.436 19.819 1.00 30.42 H new ATOM 1429 N ARG A 91 4.963 25.771 21.453 1.00 24.31 N ATOM 1430 CA ARG A 91 3.956 26.125 22.445 1.00 30.24 C ATOM 1431 C ARG A 91 4.288 25.509 23.802 1.00 22.01 C ATOM 1432 O ARG A 91 4.400 26.214 24.803 1.00 54.03 O ATOM 1433 CB ARG A 91 2.572 25.658 21.988 1.00 60.31 C ATOM 1434 CG ARG A 91 1.711 26.774 21.418 1.00 44.34 C ATOM 1435 CD ARG A 91 0.306 26.746 22.000 1.00 70.44 C ATOM 1436 NE ARG A 91 0.237 27.416 23.295 1.00 41.11 N ATOM 1437 CZ ARG A 91 -0.842 27.406 24.070 1.00 55.32 C ATOM 1438 NH1 ARG A 91 -1.935 26.764 23.682 1.00 14.20 N ATOM 1439 NH2 ARG A 91 -0.828 28.039 25.236 1.00 32.14 N ATOM 0 H ARG A 91 4.592 25.313 20.620 1.00 24.31 H new ATOM 0 HA ARG A 91 3.951 27.210 22.548 1.00 30.24 H new ATOM 0 HB2 ARG A 91 2.691 24.881 21.233 1.00 60.31 H new ATOM 0 HB3 ARG A 91 2.053 25.205 22.833 1.00 60.31 H new ATOM 0 HG2 ARG A 91 2.175 27.737 21.630 1.00 44.34 H new ATOM 0 HG3 ARG A 91 1.659 26.677 20.334 1.00 44.34 H new ATOM 0 HD2 ARG A 91 -0.384 27.227 21.306 1.00 70.44 H new ATOM 0 HD3 ARG A 91 -0.021 25.712 22.109 1.00 70.44 H new ATOM 0 HE ARG A 91 1.062 27.919 23.623 1.00 41.11 H new ATOM 0 HH11 ARG A 91 -1.949 26.276 22.786 1.00 14.20 H new ATOM 0 HH12 ARG A 91 -2.762 26.758 24.279 1.00 14.20 H new ATOM 0 HH21 ARG A 91 0.011 28.534 25.538 1.00 32.14 H new ATOM 0 HH22 ARG A 91 -1.657 28.031 25.831 1.00 32.14 H new ATOM 1453 N ALA A 92 4.445 24.190 23.824 1.00 1.13 N ATOM 1454 CA ALA A 92 4.766 23.480 25.056 1.00 33.35 C ATOM 1455 C ALA A 92 6.178 23.811 25.528 1.00 22.34 C ATOM 1456 O ALA A 92 6.483 23.714 26.717 1.00 20.21 O ATOM 1457 CB ALA A 92 4.612 21.979 24.856 1.00 74.22 C ATOM 0 H ALA A 92 4.355 23.591 23.003 1.00 1.13 H new ATOM 0 HA ALA A 92 4.068 23.806 25.827 1.00 33.35 H new ATOM 0 HB1 ALA A 92 4.855 21.461 25.784 1.00 74.22 H new ATOM 0 HB2 ALA A 92 3.584 21.753 24.573 1.00 74.22 H new ATOM 0 HB3 ALA A 92 5.287 21.646 24.067 1.00 74.22 H new ATOM 1463 N CYS A 93 7.034 24.199 24.590 1.00 31.55 N ATOM 1464 CA CYS A 93 8.415 24.542 24.910 1.00 73.24 C ATOM 1465 C CYS A 93 8.477 25.812 25.754 1.00 45.24 C ATOM 1466 O CYS A 93 9.383 25.983 26.569 1.00 41.22 O ATOM 1467 CB CYS A 93 9.226 24.728 23.628 1.00 2.20 C ATOM 1468 SG CYS A 93 9.766 23.180 22.865 1.00 0.53 S ATOM 0 H CYS A 93 6.796 24.284 23.602 1.00 31.55 H new ATOM 0 HA CYS A 93 8.844 23.722 25.486 1.00 73.24 H new ATOM 0 HB2 CYS A 93 8.626 25.285 22.909 1.00 2.20 H new ATOM 0 HB3 CYS A 93 10.103 25.336 23.850 1.00 2.20 H new ATOM 0 HG CYS A 93 8.791 22.676 22.169 1.00 0.53 H new ATOM 1474 N GLY A 94 7.509 26.700 25.551 1.00 52.21 N ATOM 1475 CA GLY A 94 7.474 27.943 26.300 1.00 65.54 C ATOM 1476 C GLY A 94 8.175 29.076 25.575 1.00 62.13 C ATOM 1477 O GLY A 94 8.875 29.878 26.192 1.00 63.24 O ATOM 0 H GLY A 94 6.749 26.581 24.882 1.00 52.21 H new ATOM 0 HA2 GLY A 94 6.437 28.222 26.487 1.00 65.54 H new ATOM 0 HA3 GLY A 94 7.944 27.792 27.272 1.00 65.54 H new ATOM 1481 N VAL A 95 7.989 29.141 24.260 1.00 31.23 N ATOM 1482 CA VAL A 95 8.608 30.183 23.450 1.00 72.31 C ATOM 1483 C VAL A 95 7.582 30.866 22.553 1.00 30.25 C ATOM 1484 O VAL A 95 6.430 30.439 22.475 1.00 54.01 O ATOM 1485 CB VAL A 95 9.741 29.614 22.575 1.00 51.02 C ATOM 1486 CG1 VAL A 95 10.966 29.304 23.423 1.00 24.12 C ATOM 1487 CG2 VAL A 95 9.269 28.374 21.832 1.00 32.42 C ATOM 0 H VAL A 95 7.414 28.484 23.733 1.00 31.23 H new ATOM 0 HA VAL A 95 9.025 30.915 24.142 1.00 72.31 H new ATOM 0 HB VAL A 95 10.020 30.367 21.838 1.00 51.02 H new ATOM 0 HG11 VAL A 95 11.756 28.903 22.788 1.00 24.12 H new ATOM 0 HG12 VAL A 95 11.316 30.217 23.904 1.00 24.12 H new ATOM 0 HG13 VAL A 95 10.705 28.569 24.185 1.00 24.12 H new ATOM 0 HG21 VAL A 95 10.082 27.986 21.219 1.00 32.42 H new ATOM 0 HG22 VAL A 95 8.962 27.614 22.551 1.00 32.42 H new ATOM 0 HG23 VAL A 95 8.424 28.632 21.193 1.00 32.42 H new ATOM 1497 N SER A 96 8.008 31.927 21.877 1.00 73.23 N ATOM 1498 CA SER A 96 7.125 32.672 20.987 1.00 65.01 C ATOM 1499 C SER A 96 7.281 32.197 19.545 1.00 60.13 C ATOM 1500 O SER A 96 6.355 32.308 18.740 1.00 42.45 O ATOM 1501 CB SER A 96 7.420 34.170 21.077 1.00 34.03 C ATOM 1502 OG SER A 96 6.955 34.709 22.303 1.00 43.43 O ATOM 0 H SER A 96 8.960 32.291 21.928 1.00 73.23 H new ATOM 0 HA SER A 96 6.097 32.492 21.302 1.00 65.01 H new ATOM 0 HB2 SER A 96 8.493 34.339 20.986 1.00 34.03 H new ATOM 0 HB3 SER A 96 6.944 34.688 20.245 1.00 34.03 H new ATOM 0 HG SER A 96 7.157 35.667 22.337 1.00 43.43 H new ATOM 1508 N ARG A 97 8.457 31.668 19.228 1.00 63.01 N ATOM 1509 CA ARG A 97 8.736 31.177 17.883 1.00 3.25 C ATOM 1510 C ARG A 97 8.890 29.659 17.880 1.00 42.42 C ATOM 1511 O ARG A 97 9.133 29.033 18.912 1.00 21.13 O ATOM 1512 CB ARG A 97 10.004 31.830 17.332 1.00 44.55 C ATOM 1513 CG ARG A 97 9.732 32.947 16.338 1.00 73.24 C ATOM 1514 CD ARG A 97 9.290 34.222 17.040 1.00 64.04 C ATOM 1515 NE ARG A 97 9.805 35.417 16.378 1.00 33.02 N ATOM 1516 CZ ARG A 97 9.335 35.880 15.226 1.00 60.41 C ATOM 1517 NH1 ARG A 97 8.344 35.251 14.609 1.00 40.41 N ATOM 1518 NH2 ARG A 97 9.857 36.975 14.686 1.00 33.14 N ATOM 0 H ARG A 97 9.232 31.568 19.883 1.00 63.01 H new ATOM 0 HA ARG A 97 7.893 31.441 17.244 1.00 3.25 H new ATOM 0 HB2 ARG A 97 10.587 32.228 18.162 1.00 44.55 H new ATOM 0 HB3 ARG A 97 10.615 31.067 16.850 1.00 44.55 H new ATOM 0 HG2 ARG A 97 10.632 33.144 15.755 1.00 73.24 H new ATOM 0 HG3 ARG A 97 8.961 32.631 15.636 1.00 73.24 H new ATOM 0 HD2 ARG A 97 8.201 34.263 17.066 1.00 64.04 H new ATOM 0 HD3 ARG A 97 9.633 34.204 18.074 1.00 64.04 H new ATOM 0 HE ARG A 97 10.568 35.924 16.826 1.00 33.02 H new ATOM 0 HH11 ARG A 97 7.941 34.409 15.019 1.00 40.41 H new ATOM 0 HH12 ARG A 97 7.985 35.609 13.724 1.00 40.41 H new ATOM 0 HH21 ARG A 97 10.620 37.462 15.156 1.00 33.14 H new ATOM 0 HH22 ARG A 97 9.495 37.330 13.801 1.00 33.14 H new ATOM 1532 N PRO A 98 8.746 29.051 16.693 1.00 70.14 N ATOM 1533 CA PRO A 98 8.865 27.600 16.526 1.00 20.14 C ATOM 1534 C PRO A 98 10.297 27.111 16.713 1.00 61.10 C ATOM 1535 O PRO A 98 11.214 27.905 16.923 1.00 34.41 O ATOM 1536 CB PRO A 98 8.405 27.370 15.085 1.00 45.10 C ATOM 1537 CG PRO A 98 8.670 28.661 14.391 1.00 44.42 C ATOM 1538 CD PRO A 98 8.456 29.736 15.421 1.00 41.43 C ATOM 0 HA PRO A 98 8.280 27.055 17.267 1.00 20.14 H new ATOM 0 HB2 PRO A 98 8.954 26.551 14.620 1.00 45.10 H new ATOM 0 HB3 PRO A 98 7.348 27.109 15.044 1.00 45.10 H new ATOM 0 HG2 PRO A 98 9.687 28.692 14.000 1.00 44.42 H new ATOM 0 HG3 PRO A 98 7.998 28.793 13.543 1.00 44.42 H new ATOM 0 HD2 PRO A 98 9.121 30.585 15.261 1.00 41.43 H new ATOM 0 HD3 PRO A 98 7.436 30.121 15.395 1.00 41.43 H new ATOM 1546 N VAL A 99 10.484 25.796 16.634 1.00 71.43 N ATOM 1547 CA VAL A 99 11.804 25.201 16.793 1.00 43.15 C ATOM 1548 C VAL A 99 12.160 24.324 15.597 1.00 32.10 C ATOM 1549 O VAL A 99 11.283 23.739 14.962 1.00 31.23 O ATOM 1550 CB VAL A 99 11.890 24.356 18.078 1.00 33.01 C ATOM 1551 CG1 VAL A 99 13.320 23.904 18.327 1.00 41.14 C ATOM 1552 CG2 VAL A 99 11.356 25.141 19.267 1.00 32.12 C ATOM 0 H VAL A 99 9.737 25.124 16.461 1.00 71.43 H new ATOM 0 HA VAL A 99 12.515 26.025 16.861 1.00 43.15 H new ATOM 0 HB VAL A 99 11.272 23.468 17.949 1.00 33.01 H new ATOM 0 HG11 VAL A 99 13.360 23.309 19.239 1.00 41.14 H new ATOM 0 HG12 VAL A 99 13.663 23.302 17.485 1.00 41.14 H new ATOM 0 HG13 VAL A 99 13.964 24.777 18.435 1.00 41.14 H new ATOM 0 HG21 VAL A 99 11.424 24.530 20.167 1.00 32.12 H new ATOM 0 HG22 VAL A 99 11.946 26.048 19.399 1.00 32.12 H new ATOM 0 HG23 VAL A 99 10.315 25.409 19.088 1.00 32.12 H new ATOM 1562 N ILE A 100 13.451 24.238 15.296 1.00 13.24 N ATOM 1563 CA ILE A 100 13.922 23.431 14.177 1.00 13.24 C ATOM 1564 C ILE A 100 14.530 22.119 14.664 1.00 31.11 C ATOM 1565 O ILE A 100 14.446 21.096 13.985 1.00 54.11 O ATOM 1566 CB ILE A 100 14.968 24.188 13.339 1.00 42.12 C ATOM 1567 CG1 ILE A 100 16.085 24.723 14.237 1.00 1.24 C ATOM 1568 CG2 ILE A 100 14.309 25.324 12.571 1.00 32.51 C ATOM 1569 CD1 ILE A 100 17.209 25.387 13.473 1.00 64.10 C ATOM 0 H ILE A 100 14.190 24.717 15.811 1.00 13.24 H new ATOM 0 HA ILE A 100 13.054 23.218 13.553 1.00 13.24 H new ATOM 0 HB ILE A 100 15.406 23.495 12.621 1.00 42.12 H new ATOM 0 HG12 ILE A 100 15.662 25.440 14.941 1.00 1.24 H new ATOM 0 HG13 ILE A 100 16.492 23.901 14.825 1.00 1.24 H new ATOM 0 HG21 ILE A 100 15.061 25.850 11.983 1.00 32.51 H new ATOM 0 HG22 ILE A 100 13.546 24.919 11.906 1.00 32.51 H new ATOM 0 HG23 ILE A 100 13.847 26.018 13.273 1.00 32.51 H new ATOM 0 HD11 ILE A 100 17.965 25.742 14.173 1.00 64.10 H new ATOM 0 HD12 ILE A 100 17.658 24.668 12.788 1.00 64.10 H new ATOM 0 HD13 ILE A 100 16.815 26.230 12.906 1.00 64.10 H new ATOM 1581 N ALA A 101 15.140 22.158 15.843 1.00 12.53 N ATOM 1582 CA ALA A 101 15.758 20.971 16.422 1.00 42.30 C ATOM 1583 C ALA A 101 15.999 21.151 17.917 1.00 55.33 C ATOM 1584 O ALA A 101 16.764 22.024 18.331 1.00 3.42 O ATOM 1585 CB ALA A 101 17.065 20.655 15.709 1.00 14.33 C ATOM 0 H ALA A 101 15.220 22.998 16.416 1.00 12.53 H new ATOM 0 HA ALA A 101 15.073 20.134 16.289 1.00 42.30 H new ATOM 0 HB1 ALA A 101 17.515 19.767 16.152 1.00 14.33 H new ATOM 0 HB2 ALA A 101 16.868 20.474 14.652 1.00 14.33 H new ATOM 0 HB3 ALA A 101 17.749 21.498 15.812 1.00 14.33 H new ATOM 1591 N CYS A 102 15.343 20.323 18.722 1.00 21.53 N ATOM 1592 CA CYS A 102 15.485 20.393 20.172 1.00 11.01 C ATOM 1593 C CYS A 102 16.165 19.139 20.712 1.00 31.32 C ATOM 1594 O CYS A 102 15.989 18.046 20.175 1.00 3.34 O ATOM 1595 CB CYS A 102 14.116 20.570 20.831 1.00 50.24 C ATOM 1596 SG CYS A 102 12.913 19.294 20.391 1.00 53.21 S ATOM 0 H CYS A 102 14.707 19.595 18.395 1.00 21.53 H new ATOM 0 HA CYS A 102 16.109 21.254 20.411 1.00 11.01 H new ATOM 0 HB2 CYS A 102 14.244 20.575 21.913 1.00 50.24 H new ATOM 0 HB3 CYS A 102 13.714 21.544 20.553 1.00 50.24 H new ATOM 0 HG CYS A 102 12.936 19.101 19.106 1.00 53.21 H new ATOM 1602 N SER A 103 16.942 19.306 21.778 1.00 62.52 N ATOM 1603 CA SER A 103 17.653 18.189 22.387 1.00 32.24 C ATOM 1604 C SER A 103 17.136 17.921 23.797 1.00 5.24 C ATOM 1605 O SER A 103 17.413 18.677 24.727 1.00 51.13 O ATOM 1606 CB SER A 103 19.156 18.474 22.428 1.00 32.15 C ATOM 1607 OG SER A 103 19.905 17.276 22.322 1.00 71.12 O ATOM 0 H SER A 103 17.095 20.204 22.237 1.00 62.52 H new ATOM 0 HA SER A 103 17.476 17.302 21.778 1.00 32.24 H new ATOM 0 HB2 SER A 103 19.424 19.147 21.614 1.00 32.15 H new ATOM 0 HB3 SER A 103 19.408 18.983 23.359 1.00 32.15 H new ATOM 0 HG SER A 103 20.819 17.486 22.036 1.00 71.12 H new ATOM 1613 N VAL A 104 16.381 16.837 23.948 1.00 11.04 N ATOM 1614 CA VAL A 104 15.825 16.466 25.244 1.00 71.52 C ATOM 1615 C VAL A 104 16.763 15.529 25.996 1.00 12.04 C ATOM 1616 O VAL A 104 16.937 14.370 25.617 1.00 63.14 O ATOM 1617 CB VAL A 104 14.451 15.787 25.091 1.00 12.31 C ATOM 1618 CG1 VAL A 104 13.818 15.549 26.454 1.00 51.43 C ATOM 1619 CG2 VAL A 104 13.537 16.626 24.210 1.00 40.35 C ATOM 0 H VAL A 104 16.140 16.200 23.188 1.00 11.04 H new ATOM 0 HA VAL A 104 15.705 17.388 25.813 1.00 71.52 H new ATOM 0 HB VAL A 104 14.595 14.820 24.609 1.00 12.31 H new ATOM 0 HG11 VAL A 104 12.848 15.069 26.326 1.00 51.43 H new ATOM 0 HG12 VAL A 104 14.466 14.905 27.049 1.00 51.43 H new ATOM 0 HG13 VAL A 104 13.686 16.503 26.965 1.00 51.43 H new ATOM 0 HG21 VAL A 104 12.571 16.131 24.113 1.00 40.35 H new ATOM 0 HG22 VAL A 104 13.398 17.608 24.661 1.00 40.35 H new ATOM 0 HG23 VAL A 104 13.987 16.740 23.224 1.00 40.35 H new ATOM 1629 N THR A 105 17.365 16.036 27.067 1.00 34.24 N ATOM 1630 CA THR A 105 18.285 15.245 27.874 1.00 12.22 C ATOM 1631 C THR A 105 17.533 14.397 28.893 1.00 62.00 C ATOM 1632 O THR A 105 16.650 14.891 29.595 1.00 4.02 O ATOM 1633 CB THR A 105 19.295 16.141 28.614 1.00 10.52 C ATOM 1634 OG1 THR A 105 18.647 16.824 29.693 1.00 31.42 O ATOM 1635 CG2 THR A 105 19.917 17.155 27.665 1.00 12.13 C ATOM 0 H THR A 105 17.232 16.992 27.396 1.00 34.24 H new ATOM 0 HA THR A 105 18.824 14.591 27.189 1.00 12.22 H new ATOM 0 HB THR A 105 20.087 15.506 29.011 1.00 10.52 H new ATOM 0 HG1 THR A 105 19.297 17.390 30.159 1.00 31.42 H new ATOM 0 HG21 THR A 105 20.627 17.776 28.211 1.00 12.13 H new ATOM 0 HG22 THR A 105 20.436 16.631 26.862 1.00 12.13 H new ATOM 0 HG23 THR A 105 19.135 17.785 27.241 1.00 12.13 H new ATOM 1643 N ILE A 106 17.889 13.119 28.970 1.00 60.23 N ATOM 1644 CA ILE A 106 17.249 12.202 29.905 1.00 74.23 C ATOM 1645 C ILE A 106 17.821 12.361 31.309 1.00 55.03 C ATOM 1646 O ILE A 106 19.038 12.375 31.498 1.00 73.23 O ATOM 1647 CB ILE A 106 17.411 10.738 29.459 1.00 40.21 C ATOM 1648 CG1 ILE A 106 16.636 9.807 30.395 1.00 62.52 C ATOM 1649 CG2 ILE A 106 18.884 10.356 29.424 1.00 0.35 C ATOM 1650 CD1 ILE A 106 16.612 8.368 29.931 1.00 12.43 C ATOM 0 H ILE A 106 18.618 12.695 28.396 1.00 60.23 H new ATOM 0 HA ILE A 106 16.188 12.453 29.917 1.00 74.23 H new ATOM 0 HB ILE A 106 17.003 10.633 28.454 1.00 40.21 H new ATOM 0 HG12 ILE A 106 17.080 9.852 31.389 1.00 62.52 H new ATOM 0 HG13 ILE A 106 15.612 10.168 30.487 1.00 62.52 H new ATOM 0 HG21 ILE A 106 18.983 9.318 29.107 1.00 0.35 H new ATOM 0 HG22 ILE A 106 19.411 11.002 28.722 1.00 0.35 H new ATOM 0 HG23 ILE A 106 19.314 10.474 30.418 1.00 0.35 H new ATOM 0 HD11 ILE A 106 16.046 7.766 30.642 1.00 12.43 H new ATOM 0 HD12 ILE A 106 16.141 8.310 28.950 1.00 12.43 H new ATOM 0 HD13 ILE A 106 17.632 7.990 29.866 1.00 12.43 H new ATOM 1662 N LYS A 107 16.936 12.479 32.294 1.00 52.14 N ATOM 1663 CA LYS A 107 17.352 12.634 33.683 1.00 61.01 C ATOM 1664 C LYS A 107 17.482 11.276 34.367 1.00 21.50 C ATOM 1665 O LYS A 107 16.483 10.615 34.646 1.00 13.04 O ATOM 1666 CB LYS A 107 16.350 13.505 34.443 1.00 73.32 C ATOM 1667 CG LYS A 107 16.867 14.003 35.781 1.00 4.32 C ATOM 1668 CD LYS A 107 17.557 15.350 35.647 1.00 31.55 C ATOM 1669 CE LYS A 107 17.892 15.942 37.007 1.00 75.52 C ATOM 1670 NZ LYS A 107 17.782 17.428 37.007 1.00 62.22 N ATOM 0 H LYS A 107 15.925 12.470 32.155 1.00 52.14 H new ATOM 0 HA LYS A 107 18.327 13.121 33.692 1.00 61.01 H new ATOM 0 HB2 LYS A 107 16.084 14.362 33.824 1.00 73.32 H new ATOM 0 HB3 LYS A 107 15.436 12.934 34.606 1.00 73.32 H new ATOM 0 HG2 LYS A 107 16.038 14.086 36.484 1.00 4.32 H new ATOM 0 HG3 LYS A 107 17.565 13.276 36.196 1.00 4.32 H new ATOM 0 HD2 LYS A 107 18.471 15.236 35.064 1.00 31.55 H new ATOM 0 HD3 LYS A 107 16.913 16.037 35.099 1.00 31.55 H new ATOM 0 HE2 LYS A 107 17.220 15.528 37.759 1.00 75.52 H new ATOM 0 HE3 LYS A 107 18.904 15.653 37.290 1.00 75.52 H new ATOM 0 HZ1 LYS A 107 18.018 17.794 37.952 1.00 62.22 H new ATOM 0 HZ2 LYS A 107 18.441 17.825 36.307 1.00 62.22 H new ATOM 0 HZ3 LYS A 107 16.810 17.704 36.762 1.00 62.22 H new ATOM 1684 N GLU A 108 18.719 10.868 34.633 1.00 73.24 N ATOM 1685 CA GLU A 108 18.977 9.590 35.284 1.00 43.54 C ATOM 1686 C GLU A 108 18.581 9.639 36.757 1.00 54.21 C ATOM 1687 O GLU A 108 18.924 10.581 37.472 1.00 1.15 O ATOM 1688 CB GLU A 108 20.455 9.216 35.155 1.00 62.03 C ATOM 1689 CG GLU A 108 20.718 7.724 35.271 1.00 34.11 C ATOM 1690 CD GLU A 108 21.557 7.188 34.127 1.00 73.24 C ATOM 1691 OE1 GLU A 108 22.793 7.359 34.169 1.00 64.02 O ATOM 1692 OE2 GLU A 108 20.978 6.599 33.190 1.00 54.31 O ATOM 0 H GLU A 108 19.557 11.404 34.408 1.00 73.24 H new ATOM 0 HA GLU A 108 18.372 8.831 34.788 1.00 43.54 H new ATOM 0 HB2 GLU A 108 20.828 9.568 34.193 1.00 62.03 H new ATOM 0 HB3 GLU A 108 21.022 9.737 35.927 1.00 62.03 H new ATOM 0 HG2 GLU A 108 21.225 7.521 36.214 1.00 34.11 H new ATOM 0 HG3 GLU A 108 19.767 7.192 35.299 1.00 34.11 H new ATOM 1699 N GLY A 109 17.856 8.619 37.204 1.00 13.34 N ATOM 1700 CA GLY A 109 17.424 8.565 38.589 1.00 31.50 C ATOM 1701 C GLY A 109 16.068 9.210 38.798 1.00 11.43 C ATOM 1702 O GLY A 109 15.793 9.760 39.864 1.00 71.04 O ATOM 0 H GLY A 109 17.560 7.828 36.632 1.00 13.34 H new ATOM 0 HA2 GLY A 109 17.382 7.525 38.913 1.00 31.50 H new ATOM 0 HA3 GLY A 109 18.162 9.065 39.216 1.00 31.50 H new ATOM 1706 N SER A 110 15.219 9.141 37.778 1.00 73.22 N ATOM 1707 CA SER A 110 13.885 9.728 37.854 1.00 43.12 C ATOM 1708 C SER A 110 12.893 8.932 37.013 1.00 4.11 C ATOM 1709 O SER A 110 13.286 8.134 36.161 1.00 32.20 O ATOM 1710 CB SER A 110 13.918 11.184 37.382 1.00 44.31 C ATOM 1711 OG SER A 110 15.186 11.517 36.844 1.00 12.25 O ATOM 0 H SER A 110 15.430 8.685 36.890 1.00 73.22 H new ATOM 0 HA SER A 110 13.560 9.697 38.894 1.00 43.12 H new ATOM 0 HB2 SER A 110 13.147 11.343 36.628 1.00 44.31 H new ATOM 0 HB3 SER A 110 13.689 11.846 38.217 1.00 44.31 H new ATOM 0 HG SER A 110 15.344 10.993 36.031 1.00 12.25 H new ATOM 1717 N GLN A 111 11.606 9.153 37.258 1.00 54.02 N ATOM 1718 CA GLN A 111 10.557 8.456 36.525 1.00 23.24 C ATOM 1719 C GLN A 111 10.590 8.826 35.046 1.00 22.35 C ATOM 1720 O GLN A 111 10.155 8.051 34.191 1.00 52.15 O ATOM 1721 CB GLN A 111 9.185 8.788 37.116 1.00 3.11 C ATOM 1722 CG GLN A 111 8.880 10.276 37.147 1.00 74.55 C ATOM 1723 CD GLN A 111 7.476 10.574 37.636 1.00 43.12 C ATOM 1724 OE1 GLN A 111 6.725 9.666 37.990 1.00 33.01 O ATOM 1725 NE2 GLN A 111 7.116 11.852 37.658 1.00 33.31 N ATOM 0 H GLN A 111 11.265 9.810 37.959 1.00 54.02 H new ATOM 0 HA GLN A 111 10.734 7.384 36.617 1.00 23.24 H new ATOM 0 HB2 GLN A 111 8.416 8.280 36.535 1.00 3.11 H new ATOM 0 HB3 GLN A 111 9.131 8.393 38.131 1.00 3.11 H new ATOM 0 HG2 GLN A 111 9.600 10.777 37.794 1.00 74.55 H new ATOM 0 HG3 GLN A 111 9.008 10.690 36.147 1.00 74.55 H new ATOM 0 HE21 GLN A 111 7.772 12.572 37.355 1.00 33.31 H new ATOM 0 HE22 GLN A 111 6.183 12.114 37.978 1.00 33.31 H new ATOM 1734 N LEU A 112 11.105 10.014 34.749 1.00 20.03 N ATOM 1735 CA LEU A 112 11.194 10.486 33.372 1.00 62.24 C ATOM 1736 C LEU A 112 11.877 9.452 32.483 1.00 0.42 C ATOM 1737 O LEU A 112 11.475 9.237 31.339 1.00 72.04 O ATOM 1738 CB LEU A 112 11.961 11.809 33.315 1.00 30.42 C ATOM 1739 CG LEU A 112 11.137 13.048 32.963 1.00 33.22 C ATOM 1740 CD1 LEU A 112 12.026 14.281 32.901 1.00 13.32 C ATOM 1741 CD2 LEU A 112 10.409 12.847 31.643 1.00 33.33 C ATOM 0 H LEU A 112 11.467 10.668 35.443 1.00 20.03 H new ATOM 0 HA LEU A 112 10.181 10.642 33.002 1.00 62.24 H new ATOM 0 HB2 LEU A 112 12.433 11.974 34.284 1.00 30.42 H new ATOM 0 HB3 LEU A 112 12.762 11.710 32.583 1.00 30.42 H new ATOM 0 HG LEU A 112 10.394 13.200 33.746 1.00 33.22 H new ATOM 0 HD11 LEU A 112 11.422 15.153 32.649 1.00 13.32 H new ATOM 0 HD12 LEU A 112 12.501 14.436 33.870 1.00 13.32 H new ATOM 0 HD13 LEU A 112 12.793 14.139 32.140 1.00 13.32 H new ATOM 0 HD21 LEU A 112 9.828 13.739 31.409 1.00 33.33 H new ATOM 0 HD22 LEU A 112 11.136 12.669 30.850 1.00 33.33 H new ATOM 0 HD23 LEU A 112 9.741 11.989 31.723 1.00 33.33 H new ATOM 1753 N LYS A 113 12.909 8.809 33.018 1.00 41.34 N ATOM 1754 CA LYS A 113 13.646 7.793 32.277 1.00 65.04 C ATOM 1755 C LYS A 113 12.700 6.739 31.710 1.00 62.12 C ATOM 1756 O LYS A 113 12.912 6.230 30.609 1.00 34.05 O ATOM 1757 CB LYS A 113 14.686 7.127 33.180 1.00 43.23 C ATOM 1758 CG LYS A 113 15.472 6.023 32.493 1.00 21.21 C ATOM 1759 CD LYS A 113 16.959 6.131 32.786 1.00 61.11 C ATOM 1760 CE LYS A 113 17.786 5.373 31.759 1.00 4.23 C ATOM 1761 NZ LYS A 113 18.615 4.309 32.390 1.00 35.01 N ATOM 0 H LYS A 113 13.254 8.974 33.964 1.00 41.34 H new ATOM 0 HA LYS A 113 14.155 8.283 31.447 1.00 65.04 H new ATOM 0 HB2 LYS A 113 15.381 7.886 33.540 1.00 43.23 H new ATOM 0 HB3 LYS A 113 14.184 6.713 34.055 1.00 43.23 H new ATOM 0 HG2 LYS A 113 15.104 5.052 32.826 1.00 21.21 H new ATOM 0 HG3 LYS A 113 15.308 6.074 31.417 1.00 21.21 H new ATOM 0 HD2 LYS A 113 17.255 7.180 32.790 1.00 61.11 H new ATOM 0 HD3 LYS A 113 17.164 5.738 33.782 1.00 61.11 H new ATOM 0 HE2 LYS A 113 17.124 4.926 31.018 1.00 4.23 H new ATOM 0 HE3 LYS A 113 18.433 6.071 31.228 1.00 4.23 H new ATOM 0 HZ1 LYS A 113 19.164 3.816 31.657 1.00 35.01 H new ATOM 0 HZ2 LYS A 113 19.265 4.738 33.079 1.00 35.01 H new ATOM 0 HZ3 LYS A 113 17.996 3.629 32.876 1.00 35.01 H new ATOM 1775 N GLN A 114 11.657 6.419 32.469 1.00 44.22 N ATOM 1776 CA GLN A 114 10.679 5.426 32.040 1.00 12.14 C ATOM 1777 C GLN A 114 9.714 6.018 31.019 1.00 44.01 C ATOM 1778 O GLN A 114 9.293 5.338 30.082 1.00 74.10 O ATOM 1779 CB GLN A 114 9.901 4.893 33.245 1.00 1.42 C ATOM 1780 CG GLN A 114 9.003 3.711 32.916 1.00 62.32 C ATOM 1781 CD GLN A 114 8.916 2.710 34.050 1.00 13.01 C ATOM 1782 OE1 GLN A 114 7.861 2.540 34.664 1.00 65.54 O ATOM 1783 NE2 GLN A 114 10.026 2.041 34.337 1.00 10.11 N ATOM 0 H GLN A 114 11.468 6.832 33.382 1.00 44.22 H new ATOM 0 HA GLN A 114 11.217 4.603 31.570 1.00 12.14 H new ATOM 0 HB2 GLN A 114 10.607 4.597 34.021 1.00 1.42 H new ATOM 0 HB3 GLN A 114 9.292 5.697 33.658 1.00 1.42 H new ATOM 0 HG2 GLN A 114 8.003 4.074 32.680 1.00 62.32 H new ATOM 0 HG3 GLN A 114 9.379 3.211 32.024 1.00 62.32 H new ATOM 0 HE21 GLN A 114 10.878 2.213 33.803 1.00 10.11 H new ATOM 0 HE22 GLN A 114 10.027 1.355 35.092 1.00 10.11 H new ATOM 1792 N GLN A 115 9.368 7.288 31.205 1.00 5.44 N ATOM 1793 CA GLN A 115 8.452 7.970 30.299 1.00 55.01 C ATOM 1794 C GLN A 115 9.025 8.029 28.887 1.00 74.31 C ATOM 1795 O GLN A 115 8.407 7.553 27.935 1.00 22.24 O ATOM 1796 CB GLN A 115 8.161 9.384 30.804 1.00 32.03 C ATOM 1797 CG GLN A 115 7.278 9.419 32.041 1.00 31.34 C ATOM 1798 CD GLN A 115 5.956 8.705 31.835 1.00 44.12 C ATOM 1799 OE1 GLN A 115 5.826 7.518 32.136 1.00 12.13 O ATOM 1800 NE2 GLN A 115 4.968 9.425 31.318 1.00 14.01 N ATOM 0 H GLN A 115 9.708 7.865 31.974 1.00 5.44 H new ATOM 0 HA GLN A 115 7.521 7.403 30.270 1.00 55.01 H new ATOM 0 HB2 GLN A 115 9.104 9.882 31.027 1.00 32.03 H new ATOM 0 HB3 GLN A 115 7.680 9.953 30.008 1.00 32.03 H new ATOM 0 HG2 GLN A 115 7.809 8.959 32.875 1.00 31.34 H new ATOM 0 HG3 GLN A 115 7.087 10.456 32.317 1.00 31.34 H new ATOM 0 HE21 GLN A 115 5.120 10.406 31.083 1.00 14.01 H new ATOM 0 HE22 GLN A 115 4.056 8.997 31.155 1.00 14.01 H new ATOM 1809 N ILE A 116 10.210 8.617 28.759 1.00 52.22 N ATOM 1810 CA ILE A 116 10.867 8.737 27.464 1.00 72.34 C ATOM 1811 C ILE A 116 11.181 7.366 26.877 1.00 3.32 C ATOM 1812 O ILE A 116 11.160 7.181 25.660 1.00 61.00 O ATOM 1813 CB ILE A 116 12.171 9.550 27.567 1.00 33.34 C ATOM 1814 CG1 ILE A 116 11.885 10.946 28.127 1.00 25.23 C ATOM 1815 CG2 ILE A 116 12.844 9.647 26.206 1.00 25.25 C ATOM 1816 CD1 ILE A 116 13.131 11.772 28.354 1.00 43.43 C ATOM 0 H ILE A 116 10.734 9.018 29.537 1.00 52.22 H new ATOM 0 HA ILE A 116 10.173 9.260 26.806 1.00 72.34 H new ATOM 0 HB ILE A 116 12.848 9.037 28.250 1.00 33.34 H new ATOM 0 HG12 ILE A 116 11.227 11.477 27.439 1.00 25.23 H new ATOM 0 HG13 ILE A 116 11.347 10.847 29.070 1.00 25.23 H new ATOM 0 HG21 ILE A 116 13.764 10.225 26.295 1.00 25.25 H new ATOM 0 HG22 ILE A 116 13.078 8.646 25.843 1.00 25.25 H new ATOM 0 HG23 ILE A 116 12.173 10.140 25.503 1.00 25.25 H new ATOM 0 HD11 ILE A 116 12.853 12.748 28.751 1.00 43.43 H new ATOM 0 HD12 ILE A 116 13.781 11.262 29.065 1.00 43.43 H new ATOM 0 HD13 ILE A 116 13.659 11.902 27.409 1.00 43.43 H new ATOM 1828 N GLN A 117 11.470 6.407 27.750 1.00 4.11 N ATOM 1829 CA GLN A 117 11.787 5.051 27.318 1.00 4.41 C ATOM 1830 C GLN A 117 10.611 4.429 26.571 1.00 43.43 C ATOM 1831 O GLN A 117 10.794 3.546 25.733 1.00 0.45 O ATOM 1832 CB GLN A 117 12.158 4.183 28.521 1.00 51.44 C ATOM 1833 CG GLN A 117 12.438 2.732 28.162 1.00 53.02 C ATOM 1834 CD GLN A 117 11.324 1.800 28.594 1.00 24.33 C ATOM 1835 OE1 GLN A 117 10.294 1.694 27.927 1.00 23.13 O ATOM 1836 NE2 GLN A 117 11.523 1.116 29.715 1.00 32.20 N ATOM 0 H GLN A 117 11.491 6.544 28.761 1.00 4.11 H new ATOM 0 HA GLN A 117 12.639 5.103 26.640 1.00 4.41 H new ATOM 0 HB2 GLN A 117 13.039 4.605 29.005 1.00 51.44 H new ATOM 0 HB3 GLN A 117 11.347 4.219 29.248 1.00 51.44 H new ATOM 0 HG2 GLN A 117 12.579 2.649 27.084 1.00 53.02 H new ATOM 0 HG3 GLN A 117 13.371 2.419 28.631 1.00 53.02 H new ATOM 0 HE21 GLN A 117 12.391 1.234 30.237 1.00 32.20 H new ATOM 0 HE22 GLN A 117 10.808 0.473 30.054 1.00 32.20 H new ATOM 1845 N SER A 118 9.407 4.895 26.882 1.00 24.15 N ATOM 1846 CA SER A 118 8.200 4.381 26.243 1.00 24.03 C ATOM 1847 C SER A 118 8.060 4.930 24.827 1.00 20.33 C ATOM 1848 O SER A 118 7.873 4.175 23.872 1.00 72.41 O ATOM 1849 CB SER A 118 6.965 4.745 27.069 1.00 11.34 C ATOM 1850 OG SER A 118 6.872 3.938 28.230 1.00 71.11 O ATOM 0 H SER A 118 9.240 5.627 27.572 1.00 24.15 H new ATOM 0 HA SER A 118 8.282 3.296 26.187 1.00 24.03 H new ATOM 0 HB2 SER A 118 7.012 5.796 27.355 1.00 11.34 H new ATOM 0 HB3 SER A 118 6.068 4.620 26.462 1.00 11.34 H new ATOM 0 HG SER A 118 7.549 4.221 28.880 1.00 71.11 H new ATOM 1856 N ILE A 119 8.150 6.249 24.700 1.00 71.43 N ATOM 1857 CA ILE A 119 8.034 6.901 23.401 1.00 21.42 C ATOM 1858 C ILE A 119 9.231 6.576 22.514 1.00 61.12 C ATOM 1859 O ILE A 119 9.105 6.487 21.293 1.00 15.04 O ATOM 1860 CB ILE A 119 7.916 8.429 23.546 1.00 60.33 C ATOM 1861 CG1 ILE A 119 6.703 8.790 24.405 1.00 72.20 C ATOM 1862 CG2 ILE A 119 7.818 9.086 22.177 1.00 31.14 C ATOM 1863 CD1 ILE A 119 6.529 10.279 24.610 1.00 71.41 C ATOM 0 H ILE A 119 8.303 6.888 25.480 1.00 71.43 H new ATOM 0 HA ILE A 119 7.126 6.518 22.936 1.00 21.42 H new ATOM 0 HB ILE A 119 8.812 8.802 24.042 1.00 60.33 H new ATOM 0 HG12 ILE A 119 5.804 8.388 23.937 1.00 72.20 H new ATOM 0 HG13 ILE A 119 6.800 8.306 25.377 1.00 72.20 H new ATOM 0 HG21 ILE A 119 7.735 10.166 22.297 1.00 31.14 H new ATOM 0 HG22 ILE A 119 8.711 8.853 21.597 1.00 31.14 H new ATOM 0 HG23 ILE A 119 6.938 8.710 21.655 1.00 31.14 H new ATOM 0 HD11 ILE A 119 5.650 10.461 25.228 1.00 71.41 H new ATOM 0 HD12 ILE A 119 7.411 10.684 25.106 1.00 71.41 H new ATOM 0 HD13 ILE A 119 6.400 10.767 23.644 1.00 71.41 H new ATOM 1875 N GLN A 120 10.391 6.400 23.137 1.00 24.20 N ATOM 1876 CA GLN A 120 11.611 6.083 22.403 1.00 52.55 C ATOM 1877 C GLN A 120 11.437 4.810 21.582 1.00 71.25 C ATOM 1878 O GLN A 120 12.037 4.663 20.517 1.00 25.30 O ATOM 1879 CB GLN A 120 12.787 5.923 23.370 1.00 34.45 C ATOM 1880 CG GLN A 120 13.687 7.146 23.441 1.00 62.34 C ATOM 1881 CD GLN A 120 14.514 7.190 24.709 1.00 13.22 C ATOM 1882 OE1 GLN A 120 14.204 6.511 25.689 1.00 55.31 O ATOM 1883 NE2 GLN A 120 15.573 7.990 24.699 1.00 54.13 N ATOM 0 H GLN A 120 10.512 6.471 24.147 1.00 24.20 H new ATOM 0 HA GLN A 120 11.819 6.908 21.722 1.00 52.55 H new ATOM 0 HB2 GLN A 120 12.401 5.708 24.366 1.00 34.45 H new ATOM 0 HB3 GLN A 120 13.382 5.062 23.066 1.00 34.45 H new ATOM 0 HG2 GLN A 120 14.352 7.153 22.578 1.00 62.34 H new ATOM 0 HG3 GLN A 120 13.075 8.046 23.379 1.00 62.34 H new ATOM 0 HE21 GLN A 120 15.793 8.535 23.865 1.00 54.13 H new ATOM 0 HE22 GLN A 120 16.167 8.060 25.525 1.00 54.13 H new ATOM 1892 N GLN A 121 10.614 3.896 22.083 1.00 1.45 N ATOM 1893 CA GLN A 121 10.364 2.635 21.395 1.00 22.42 C ATOM 1894 C GLN A 121 9.701 2.876 20.042 1.00 51.14 C ATOM 1895 O GLN A 121 9.969 2.165 19.073 1.00 73.25 O ATOM 1896 CB GLN A 121 9.481 1.727 22.254 1.00 71.32 C ATOM 1897 CG GLN A 121 9.318 0.326 21.689 1.00 24.31 C ATOM 1898 CD GLN A 121 10.541 -0.541 21.914 1.00 1.42 C ATOM 1899 OE1 GLN A 121 11.359 -0.264 22.792 1.00 30.51 O ATOM 1900 NE2 GLN A 121 10.674 -1.598 21.121 1.00 33.02 N ATOM 0 H GLN A 121 10.109 4.004 22.962 1.00 1.45 H new ATOM 0 HA GLN A 121 11.323 2.145 21.228 1.00 22.42 H new ATOM 0 HB2 GLN A 121 9.909 1.659 23.254 1.00 71.32 H new ATOM 0 HB3 GLN A 121 8.497 2.184 22.359 1.00 71.32 H new ATOM 0 HG2 GLN A 121 8.451 -0.149 22.149 1.00 24.31 H new ATOM 0 HG3 GLN A 121 9.115 0.391 20.620 1.00 24.31 H new ATOM 0 HE21 GLN A 121 9.972 -1.791 20.406 1.00 33.02 H new ATOM 0 HE22 GLN A 121 11.478 -2.217 21.227 1.00 33.02 H new ATOM 1909 N SER A 122 8.834 3.882 19.984 1.00 62.23 N ATOM 1910 CA SER A 122 8.130 4.214 18.751 1.00 33.32 C ATOM 1911 C SER A 122 9.114 4.589 17.648 1.00 64.32 C ATOM 1912 O SER A 122 9.030 4.083 16.528 1.00 71.33 O ATOM 1913 CB SER A 122 7.152 5.366 18.992 1.00 61.11 C ATOM 1914 OG SER A 122 6.049 5.292 18.106 1.00 70.51 O ATOM 0 H SER A 122 8.602 4.481 20.776 1.00 62.23 H new ATOM 0 HA SER A 122 7.572 3.334 18.432 1.00 33.32 H new ATOM 0 HB2 SER A 122 6.797 5.337 20.022 1.00 61.11 H new ATOM 0 HB3 SER A 122 7.666 6.318 18.859 1.00 61.11 H new ATOM 0 HG SER A 122 5.815 6.193 17.799 1.00 70.51 H new ATOM 1920 N ILE A 123 10.045 5.479 17.972 1.00 43.14 N ATOM 1921 CA ILE A 123 11.047 5.922 17.009 1.00 13.01 C ATOM 1922 C ILE A 123 12.088 4.836 16.760 1.00 34.14 C ATOM 1923 O ILE A 123 12.570 4.670 15.641 1.00 64.35 O ATOM 1924 CB ILE A 123 11.759 7.201 17.487 1.00 65.23 C ATOM 1925 CG1 ILE A 123 10.734 8.248 17.926 1.00 12.41 C ATOM 1926 CG2 ILE A 123 12.648 7.755 16.383 1.00 4.34 C ATOM 1927 CD1 ILE A 123 11.358 9.533 18.425 1.00 23.34 C ATOM 0 H ILE A 123 10.127 5.908 18.894 1.00 43.14 H new ATOM 0 HA ILE A 123 10.519 6.135 16.079 1.00 13.01 H new ATOM 0 HB ILE A 123 12.386 6.952 18.343 1.00 65.23 H new ATOM 0 HG12 ILE A 123 10.076 8.475 17.087 1.00 12.41 H new ATOM 0 HG13 ILE A 123 10.111 7.826 18.714 1.00 12.41 H new ATOM 0 HG21 ILE A 123 13.145 8.659 16.735 1.00 4.34 H new ATOM 0 HG22 ILE A 123 13.397 7.011 16.112 1.00 4.34 H new ATOM 0 HG23 ILE A 123 12.039 7.992 15.510 1.00 4.34 H new ATOM 0 HD11 ILE A 123 10.572 10.229 18.719 1.00 23.34 H new ATOM 0 HD12 ILE A 123 11.993 9.319 19.284 1.00 23.34 H new ATOM 0 HD13 ILE A 123 11.958 9.978 17.632 1.00 23.34 H new ATOM 1939 N GLU A 124 12.428 4.098 17.812 1.00 51.22 N ATOM 1940 CA GLU A 124 13.412 3.027 17.707 1.00 72.22 C ATOM 1941 C GLU A 124 12.997 2.009 16.647 1.00 54.32 C ATOM 1942 O GLU A 124 13.839 1.453 15.943 1.00 64.14 O ATOM 1943 CB GLU A 124 13.587 2.330 19.057 1.00 40.53 C ATOM 1944 CG GLU A 124 14.846 1.484 19.148 1.00 63.03 C ATOM 1945 CD GLU A 124 14.621 0.180 19.886 1.00 4.01 C ATOM 1946 OE1 GLU A 124 14.790 0.162 21.123 1.00 52.33 O ATOM 1947 OE2 GLU A 124 14.276 -0.824 19.228 1.00 42.30 O ATOM 0 H GLU A 124 12.037 4.222 18.746 1.00 51.22 H new ATOM 0 HA GLU A 124 14.362 3.470 17.409 1.00 72.22 H new ATOM 0 HB2 GLU A 124 13.608 3.083 19.845 1.00 40.53 H new ATOM 0 HB3 GLU A 124 12.720 1.697 19.244 1.00 40.53 H new ATOM 0 HG2 GLU A 124 15.209 1.270 18.143 1.00 63.03 H new ATOM 0 HG3 GLU A 124 15.626 2.053 19.654 1.00 63.03 H new ATOM 1954 N ARG A 125 11.694 1.772 16.542 1.00 22.11 N ATOM 1955 CA ARG A 125 11.167 0.821 15.570 1.00 53.13 C ATOM 1956 C ARG A 125 11.664 1.147 14.165 1.00 72.42 C ATOM 1957 O ARG A 125 12.052 0.256 13.409 1.00 52.24 O ATOM 1958 CB ARG A 125 9.637 0.829 15.597 1.00 5.44 C ATOM 1959 CG ARG A 125 9.047 0.195 16.847 1.00 20.24 C ATOM 1960 CD ARG A 125 8.166 -0.996 16.505 1.00 25.42 C ATOM 1961 NE ARG A 125 7.328 -1.398 17.631 1.00 1.11 N ATOM 1962 CZ ARG A 125 6.377 -2.322 17.547 1.00 34.32 C ATOM 1963 NH1 ARG A 125 6.145 -2.935 16.395 1.00 24.12 N ATOM 1964 NH2 ARG A 125 5.656 -2.633 18.616 1.00 12.33 N ATOM 0 H ARG A 125 10.984 2.225 17.117 1.00 22.11 H new ATOM 0 HA ARG A 125 11.524 -0.173 15.840 1.00 53.13 H new ATOM 0 HB2 ARG A 125 9.286 1.858 15.521 1.00 5.44 H new ATOM 0 HB3 ARG A 125 9.264 0.300 14.720 1.00 5.44 H new ATOM 0 HG2 ARG A 125 9.852 -0.125 17.509 1.00 20.24 H new ATOM 0 HG3 ARG A 125 8.463 0.937 17.391 1.00 20.24 H new ATOM 0 HD2 ARG A 125 7.533 -0.746 15.653 1.00 25.42 H new ATOM 0 HD3 ARG A 125 8.792 -1.835 16.202 1.00 25.42 H new ATOM 0 HE ARG A 125 7.481 -0.945 18.532 1.00 1.11 H new ATOM 0 HH11 ARG A 125 6.697 -2.698 15.571 1.00 24.12 H new ATOM 0 HH12 ARG A 125 5.414 -3.644 16.333 1.00 24.12 H new ATOM 0 HH21 ARG A 125 5.831 -2.163 19.504 1.00 12.33 H new ATOM 0 HH22 ARG A 125 4.926 -3.343 18.550 1.00 12.33 H new ATOM 1978 N LEU A 126 11.648 2.430 13.821 1.00 75.00 N ATOM 1979 CA LEU A 126 12.096 2.876 12.506 1.00 20.12 C ATOM 1980 C LEU A 126 13.594 3.161 12.509 1.00 73.13 C ATOM 1981 O LEU A 126 14.262 3.045 11.480 1.00 13.12 O ATOM 1982 CB LEU A 126 11.328 4.127 12.080 1.00 33.21 C ATOM 1983 CG LEU A 126 9.806 4.063 12.225 1.00 73.33 C ATOM 1984 CD1 LEU A 126 9.286 5.295 12.948 1.00 54.23 C ATOM 1985 CD2 LEU A 126 9.146 3.925 10.861 1.00 10.25 C ATOM 0 H LEU A 126 11.330 3.180 14.434 1.00 75.00 H new ATOM 0 HA LEU A 126 11.898 2.076 11.792 1.00 20.12 H new ATOM 0 HB2 LEU A 126 11.694 4.970 12.666 1.00 33.21 H new ATOM 0 HB3 LEU A 126 11.565 4.337 11.037 1.00 33.21 H new ATOM 0 HG LEU A 126 9.554 3.185 12.819 1.00 73.33 H new ATOM 0 HD11 LEU A 126 8.202 5.231 13.042 1.00 54.23 H new ATOM 0 HD12 LEU A 126 9.733 5.350 13.940 1.00 54.23 H new ATOM 0 HD13 LEU A 126 9.549 6.188 12.381 1.00 54.23 H new ATOM 0 HD21 LEU A 126 8.064 3.881 10.983 1.00 10.25 H new ATOM 0 HD22 LEU A 126 9.407 4.784 10.242 1.00 10.25 H new ATOM 0 HD23 LEU A 126 9.494 3.011 10.379 1.00 10.25 H new ATOM 1997 N LEU A 127 14.117 3.533 13.672 1.00 54.40 N ATOM 1998 CA LEU A 127 15.538 3.834 13.811 1.00 13.22 C ATOM 1999 C LEU A 127 16.373 2.560 13.740 1.00 64.33 C ATOM 2000 O LEU A 127 17.034 2.294 12.735 1.00 51.32 O ATOM 2001 CB LEU A 127 15.801 4.555 15.134 1.00 75.30 C ATOM 2002 CG LEU A 127 16.098 6.052 15.036 1.00 22.04 C ATOM 2003 CD1 LEU A 127 17.467 6.284 14.414 1.00 24.45 C ATOM 2004 CD2 LEU A 127 15.017 6.759 14.230 1.00 3.40 C ATOM 0 H LEU A 127 13.579 3.634 14.533 1.00 54.40 H new ATOM 0 HA LEU A 127 15.828 4.485 12.986 1.00 13.22 H new ATOM 0 HB2 LEU A 127 14.932 4.419 15.778 1.00 75.30 H new ATOM 0 HB3 LEU A 127 16.643 4.070 15.628 1.00 75.30 H new ATOM 0 HG LEU A 127 16.103 6.469 16.043 1.00 22.04 H new ATOM 0 HD11 LEU A 127 17.662 7.355 14.352 1.00 24.45 H new ATOM 0 HD12 LEU A 127 18.232 5.811 15.030 1.00 24.45 H new ATOM 0 HD13 LEU A 127 17.490 5.853 13.413 1.00 24.45 H new ATOM 0 HD21 LEU A 127 15.245 7.823 14.171 1.00 3.40 H new ATOM 0 HD22 LEU A 127 14.980 6.339 13.225 1.00 3.40 H new ATOM 0 HD23 LEU A 127 14.052 6.621 14.717 1.00 3.40 H new ATOM 2016 N VAL A 128 16.338 1.773 14.810 1.00 20.14 N ATOM 2017 CA VAL A 128 17.089 0.525 14.868 1.00 41.32 C ATOM 2018 C VAL A 128 16.259 -0.640 14.341 1.00 3.21 C ATOM 2019 O VAL A 128 15.141 -0.454 13.861 1.00 74.13 O ATOM 2020 CB VAL A 128 17.544 0.209 16.305 1.00 14.10 C ATOM 2021 CG1 VAL A 128 18.426 -1.030 16.326 1.00 62.41 C ATOM 2022 CG2 VAL A 128 18.271 1.401 16.908 1.00 33.41 C ATOM 0 H VAL A 128 15.797 1.978 15.650 1.00 20.14 H new ATOM 0 HA VAL A 128 17.969 0.655 14.238 1.00 41.32 H new ATOM 0 HB VAL A 128 16.661 0.007 16.911 1.00 14.10 H new ATOM 0 HG11 VAL A 128 18.738 -1.237 17.350 1.00 62.41 H new ATOM 0 HG12 VAL A 128 17.867 -1.881 15.937 1.00 62.41 H new ATOM 0 HG13 VAL A 128 19.306 -0.860 15.706 1.00 62.41 H new ATOM 0 HG21 VAL A 128 18.585 1.160 17.923 1.00 33.41 H new ATOM 0 HG22 VAL A 128 19.147 1.637 16.303 1.00 33.41 H new ATOM 0 HG23 VAL A 128 17.603 2.262 16.930 1.00 33.41 H new TER 2032 VAL A 128