USER MOD reduce.3.24.130724 H: found=0, std=0, add=1089, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1098 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 119 MET CE :methyl -168:sc= 0 (180deg=-0.0302) USER MOD Set 1.2: A 126 CYS SG : rot 165:sc= 0.525 USER MOD Set 1.3: A 128 GLN : amide:sc= 0 K(o=0.53,f=-0.037) USER MOD Set 2.1: A 94 GLN : amide:sc= 0.991 K(o=2.2,f=-0.22) USER MOD Set 2.2: A 107 THR OG1 : rot -45:sc= 1.2 USER MOD Set 3.1: A 62 MET CE :methyl -174:sc=-0.00937 (180deg=-0.0431) USER MOD Set 3.2: A 95 CYS SG : rot -150:sc= -1.46 USER MOD Set 4.1: A 40 LYS NZ :NH3+ -173:sc= 0.215 (180deg=0) USER MOD Set 4.2: A 53 THR OG1 : rot 180:sc= 0.219 USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ 159:sc= 1.38 (180deg=0.623) USER MOD Single : A 5 ASN : amide:sc= 0.485 K(o=0.49,f=-2.3!) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 MET CE :methyl -168:sc= -0.142 (180deg=-0.415) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0.327 K(o=0.33,f=-3.5!) USER MOD Single : A 15 ASN : amide:sc= 0.711 K(o=0.71,f=-0.14) USER MOD Single : A 19 TYR OH : rot 108:sc= 0.12 USER MOD Single : A 26 ASN : amide:sc= 0.703 K(o=0.7,f=-3!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -0.136 K(o=-0.14,f=-4.5!) USER MOD Single : A 37 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0355) USER MOD Single : A 44 GLN : amide:sc= 0.279 K(o=0.28,f=-1.7!) USER MOD Single : A 48 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 49 MET CE :methyl 164:sc=-0.00728 (180deg=-0.773) USER MOD Single : A 55 SER OG : rot -150:sc= 0.177 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -0.152 K(o=-0.15,f=-4.4!) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot -12:sc= 1.84 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 CYS SG : rot 3:sc= -0.399 USER MOD Single : A 83 MET CE :methyl 172:sc= 0 (180deg=-0.0451) USER MOD Single : A 84 THR OG1 : rot 62:sc= 1.06 USER MOD Single : A 85 THR OG1 : rot 92:sc= 0.39 USER MOD Single : A 87 SER OG : rot 7:sc= 0.369 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ -177:sc= 1.24 (180deg=1.23) USER MOD Single : A 108 GLN : amide:sc= -0.0572 X(o=-0.057,f=0.003) USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ -178:sc= 0.607 (180deg=0.602) USER MOD Single : A 132 LYS NZ :NH3+ -147:sc= 0.809 (180deg=0.478) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 2.797 2.761 -0.593 1.00 0.00 N ATOM 2 CA MET A 0 2.855 1.606 -1.522 1.00 0.00 C ATOM 3 C MET A 0 4.152 0.765 -1.240 1.00 0.00 C ATOM 4 O MET A 0 5.207 1.116 -1.785 1.00 0.00 O ATOM 5 CB MET A 0 2.742 2.097 -2.993 1.00 0.00 C ATOM 6 CG MET A 0 1.350 2.581 -3.456 1.00 0.00 C ATOM 7 SD MET A 0 0.872 4.115 -2.633 1.00 0.00 S ATOM 8 CE MET A 0 -0.778 4.329 -3.322 1.00 0.00 C ATOM 0 H1 MET A 0 2.171 3.492 -0.987 1.00 0.00 H new ATOM 0 H2 MET A 0 2.427 2.448 0.327 1.00 0.00 H new ATOM 0 H3 MET A 0 3.752 3.154 -0.467 1.00 0.00 H new ATOM 0 HA MET A 0 2.007 0.942 -1.355 1.00 0.00 H new ATOM 0 HB2 MET A 0 3.451 2.913 -3.135 1.00 0.00 H new ATOM 0 HB3 MET A 0 3.055 1.284 -3.648 1.00 0.00 H new ATOM 0 HG2 MET A 0 1.358 2.734 -4.535 1.00 0.00 H new ATOM 0 HG3 MET A 0 0.608 1.810 -3.248 1.00 0.00 H new ATOM 0 HE1 MET A 0 -1.226 5.237 -2.918 1.00 0.00 H new ATOM 0 HE2 MET A 0 -0.712 4.408 -4.407 1.00 0.00 H new ATOM 0 HE3 MET A 0 -1.397 3.471 -3.058 1.00 0.00 H new ATOM 19 N PRO A 1 4.152 -0.335 -0.422 1.00 0.00 N ATOM 20 CA PRO A 1 5.393 -1.092 -0.104 1.00 0.00 C ATOM 21 C PRO A 1 5.832 -2.083 -1.222 1.00 0.00 C ATOM 22 O PRO A 1 5.241 -3.146 -1.439 1.00 0.00 O ATOM 23 CB PRO A 1 5.034 -1.755 1.232 1.00 0.00 C ATOM 24 CG PRO A 1 3.526 -1.954 1.191 1.00 0.00 C ATOM 25 CD PRO A 1 2.999 -0.751 0.406 1.00 0.00 C ATOM 0 HA PRO A 1 6.279 -0.461 -0.035 1.00 0.00 H new ATOM 0 HB2 PRO A 1 5.553 -2.706 1.351 1.00 0.00 H new ATOM 0 HB3 PRO A 1 5.325 -1.126 2.074 1.00 0.00 H new ATOM 0 HG2 PRO A 1 3.263 -2.892 0.702 1.00 0.00 H new ATOM 0 HG3 PRO A 1 3.103 -1.988 2.195 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.141 -1.020 -0.210 1.00 0.00 H new ATOM 0 HD3 PRO A 1 2.675 0.049 1.071 1.00 0.00 H new ATOM 33 N VAL A 2 6.890 -1.688 -1.934 1.00 0.00 N ATOM 34 CA VAL A 2 7.401 -2.424 -3.127 1.00 0.00 C ATOM 35 C VAL A 2 8.249 -3.691 -2.757 1.00 0.00 C ATOM 36 O VAL A 2 8.864 -3.783 -1.689 1.00 0.00 O ATOM 37 CB VAL A 2 8.157 -1.440 -4.094 1.00 0.00 C ATOM 38 CG1 VAL A 2 7.243 -0.352 -4.704 1.00 0.00 C ATOM 39 CG2 VAL A 2 9.409 -0.760 -3.493 1.00 0.00 C ATOM 0 H VAL A 2 7.427 -0.850 -1.712 1.00 0.00 H new ATOM 0 HA VAL A 2 6.538 -2.820 -3.662 1.00 0.00 H new ATOM 0 HB VAL A 2 8.496 -2.111 -4.883 1.00 0.00 H new ATOM 0 HG11 VAL A 2 7.830 0.291 -5.360 1.00 0.00 H new ATOM 0 HG12 VAL A 2 6.447 -0.826 -5.278 1.00 0.00 H new ATOM 0 HG13 VAL A 2 6.807 0.247 -3.905 1.00 0.00 H new ATOM 0 HG21 VAL A 2 9.858 -0.102 -4.237 1.00 0.00 H new ATOM 0 HG22 VAL A 2 9.121 -0.176 -2.619 1.00 0.00 H new ATOM 0 HG23 VAL A 2 10.131 -1.522 -3.199 1.00 0.00 H new ATOM 49 N ASP A 3 8.312 -4.669 -3.677 1.00 0.00 N ATOM 50 CA ASP A 3 9.126 -5.898 -3.510 1.00 0.00 C ATOM 51 C ASP A 3 10.668 -5.648 -3.555 1.00 0.00 C ATOM 52 O ASP A 3 11.253 -5.548 -4.638 1.00 0.00 O ATOM 53 CB ASP A 3 8.626 -6.948 -4.545 1.00 0.00 C ATOM 54 CG ASP A 3 8.572 -6.620 -6.048 1.00 0.00 C ATOM 55 OD1 ASP A 3 7.563 -6.791 -6.725 1.00 0.00 O ATOM 56 OD2 ASP A 3 9.752 -6.135 -6.539 1.00 0.00 O ATOM 0 H ASP A 3 7.802 -4.635 -4.560 1.00 0.00 H new ATOM 0 HA ASP A 3 8.980 -6.290 -2.503 1.00 0.00 H new ATOM 0 HB2 ASP A 3 9.256 -7.830 -4.434 1.00 0.00 H new ATOM 0 HB3 ASP A 3 7.618 -7.236 -4.245 1.00 0.00 H new ATOM 62 N PHE A 4 11.331 -5.606 -2.385 1.00 0.00 N ATOM 63 CA PHE A 4 12.819 -5.430 -2.312 1.00 0.00 C ATOM 64 C PHE A 4 13.707 -6.649 -2.787 1.00 0.00 C ATOM 65 O PHE A 4 14.935 -6.524 -2.815 1.00 0.00 O ATOM 66 CB PHE A 4 13.205 -4.959 -0.873 1.00 0.00 C ATOM 67 CG PHE A 4 12.843 -3.544 -0.343 1.00 0.00 C ATOM 68 CD1 PHE A 4 11.887 -2.703 -0.930 1.00 0.00 C ATOM 69 CD2 PHE A 4 13.511 -3.098 0.805 1.00 0.00 C ATOM 70 CE1 PHE A 4 11.619 -1.445 -0.395 1.00 0.00 C ATOM 71 CE2 PHE A 4 13.238 -1.842 1.343 1.00 0.00 C ATOM 72 CZ PHE A 4 12.290 -1.020 0.744 1.00 0.00 C ATOM 0 H PHE A 4 10.877 -5.690 -1.476 1.00 0.00 H new ATOM 0 HA PHE A 4 13.057 -4.668 -3.054 1.00 0.00 H new ATOM 0 HB2 PHE A 4 12.765 -5.676 -0.180 1.00 0.00 H new ATOM 0 HB3 PHE A 4 14.287 -5.058 -0.790 1.00 0.00 H new ATOM 0 HD1 PHE A 4 11.352 -3.035 -1.808 1.00 0.00 H new ATOM 0 HD2 PHE A 4 14.245 -3.734 1.278 1.00 0.00 H new ATOM 0 HE1 PHE A 4 10.890 -0.801 -0.865 1.00 0.00 H new ATOM 0 HE2 PHE A 4 13.763 -1.507 2.225 1.00 0.00 H new ATOM 0 HZ PHE A 4 12.075 -0.049 1.165 1.00 0.00 H new ATOM 82 N ASN A 5 13.103 -7.784 -3.200 1.00 0.00 N ATOM 83 CA ASN A 5 13.771 -8.970 -3.806 1.00 0.00 C ATOM 84 C ASN A 5 14.838 -8.670 -4.912 1.00 0.00 C ATOM 85 O ASN A 5 14.491 -8.226 -6.014 1.00 0.00 O ATOM 86 CB ASN A 5 12.643 -9.858 -4.420 1.00 0.00 C ATOM 87 CG ASN A 5 11.560 -10.374 -3.467 1.00 0.00 C ATOM 88 OD1 ASN A 5 10.570 -9.705 -3.186 1.00 0.00 O ATOM 89 ND2 ASN A 5 11.739 -11.541 -2.911 1.00 0.00 N ATOM 0 H ASN A 5 12.094 -7.910 -3.120 1.00 0.00 H new ATOM 0 HA ASN A 5 14.335 -9.453 -3.008 1.00 0.00 H new ATOM 0 HB2 ASN A 5 12.154 -9.286 -5.208 1.00 0.00 H new ATOM 0 HB3 ASN A 5 13.112 -10.719 -4.896 1.00 0.00 H new ATOM 0 HD21 ASN A 5 11.056 -11.898 -2.243 1.00 0.00 H new ATOM 0 HD22 ASN A 5 12.562 -12.097 -3.145 1.00 0.00 H new ATOM 96 N GLY A 6 16.126 -8.918 -4.627 1.00 0.00 N ATOM 97 CA GLY A 6 17.196 -8.664 -5.623 1.00 0.00 C ATOM 98 C GLY A 6 18.638 -8.663 -5.089 1.00 0.00 C ATOM 99 O GLY A 6 18.905 -8.762 -3.888 1.00 0.00 O ATOM 0 H GLY A 6 16.455 -9.287 -3.735 1.00 0.00 H new ATOM 0 HA2 GLY A 6 17.121 -9.419 -6.405 1.00 0.00 H new ATOM 0 HA3 GLY A 6 17.004 -7.699 -6.092 1.00 0.00 H new ATOM 103 N TYR A 7 19.569 -8.517 -6.039 1.00 0.00 N ATOM 104 CA TYR A 7 21.016 -8.341 -5.745 1.00 0.00 C ATOM 105 C TYR A 7 21.425 -6.878 -6.107 1.00 0.00 C ATOM 106 O TYR A 7 21.194 -6.406 -7.229 1.00 0.00 O ATOM 107 CB TYR A 7 21.819 -9.414 -6.534 1.00 0.00 C ATOM 108 CG TYR A 7 23.229 -9.700 -5.989 1.00 0.00 C ATOM 109 CD1 TYR A 7 24.298 -8.852 -6.294 1.00 0.00 C ATOM 110 CD2 TYR A 7 23.458 -10.831 -5.197 1.00 0.00 C ATOM 111 CE1 TYR A 7 25.576 -9.132 -5.818 1.00 0.00 C ATOM 112 CE2 TYR A 7 24.735 -11.103 -4.710 1.00 0.00 C ATOM 113 CZ TYR A 7 25.791 -10.249 -5.018 1.00 0.00 C ATOM 114 OH TYR A 7 27.046 -10.500 -4.532 1.00 0.00 O ATOM 0 H TYR A 7 19.352 -8.516 -7.036 1.00 0.00 H new ATOM 0 HA TYR A 7 21.236 -8.486 -4.687 1.00 0.00 H new ATOM 0 HB2 TYR A 7 21.250 -10.344 -6.535 1.00 0.00 H new ATOM 0 HB3 TYR A 7 21.905 -9.092 -7.572 1.00 0.00 H new ATOM 0 HD1 TYR A 7 24.131 -7.975 -6.902 1.00 0.00 H new ATOM 0 HD2 TYR A 7 22.641 -11.497 -4.962 1.00 0.00 H new ATOM 0 HE1 TYR A 7 26.401 -8.482 -6.070 1.00 0.00 H new ATOM 0 HE2 TYR A 7 24.905 -11.974 -4.095 1.00 0.00 H new ATOM 0 HH TYR A 7 27.030 -11.316 -3.990 1.00 0.00 H new ATOM 124 N TRP A 8 22.018 -6.170 -5.138 1.00 0.00 N ATOM 125 CA TRP A 8 22.221 -4.700 -5.204 1.00 0.00 C ATOM 126 C TRP A 8 23.736 -4.360 -5.008 1.00 0.00 C ATOM 127 O TRP A 8 24.341 -4.759 -4.007 1.00 0.00 O ATOM 128 CB TRP A 8 21.371 -4.038 -4.081 1.00 0.00 C ATOM 129 CG TRP A 8 19.847 -4.250 -4.097 1.00 0.00 C ATOM 130 CD1 TRP A 8 19.146 -5.319 -3.491 1.00 0.00 C ATOM 131 CD2 TRP A 8 18.877 -3.454 -4.670 1.00 0.00 C ATOM 132 NE1 TRP A 8 17.760 -5.225 -3.703 1.00 0.00 N ATOM 133 CE2 TRP A 8 17.615 -4.055 -4.425 1.00 0.00 C ATOM 134 CE3 TRP A 8 18.964 -2.233 -5.382 1.00 0.00 C ATOM 135 CZ2 TRP A 8 16.436 -3.443 -4.899 1.00 0.00 C ATOM 136 CZ3 TRP A 8 17.784 -1.649 -5.845 1.00 0.00 C ATOM 137 CH2 TRP A 8 16.540 -2.247 -5.614 1.00 0.00 C ATOM 0 H TRP A 8 22.375 -6.592 -4.281 1.00 0.00 H new ATOM 0 HA TRP A 8 21.910 -4.321 -6.177 1.00 0.00 H new ATOM 0 HB2 TRP A 8 21.747 -4.399 -3.124 1.00 0.00 H new ATOM 0 HB3 TRP A 8 21.557 -2.965 -4.112 1.00 0.00 H new ATOM 0 HD1 TRP A 8 19.620 -6.113 -2.932 1.00 0.00 H new ATOM 0 HE1 TRP A 8 17.031 -5.869 -3.396 1.00 0.00 H new ATOM 0 HE3 TRP A 8 19.920 -1.765 -5.562 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 15.471 -3.890 -4.713 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 17.832 -0.719 -6.391 1.00 0.00 H new ATOM 0 HH2 TRP A 8 15.646 -1.776 -5.995 1.00 0.00 H new ATOM 148 N LYS A 9 24.340 -3.582 -5.922 1.00 0.00 N ATOM 149 CA LYS A 9 25.756 -3.110 -5.784 1.00 0.00 C ATOM 150 C LYS A 9 25.860 -1.666 -5.192 1.00 0.00 C ATOM 151 O LYS A 9 25.080 -0.790 -5.580 1.00 0.00 O ATOM 152 CB LYS A 9 26.487 -3.237 -7.152 1.00 0.00 C ATOM 153 CG LYS A 9 26.056 -2.273 -8.288 1.00 0.00 C ATOM 154 CD LYS A 9 26.930 -2.408 -9.552 1.00 0.00 C ATOM 155 CE LYS A 9 26.447 -1.566 -10.747 1.00 0.00 C ATOM 156 NZ LYS A 9 26.740 -0.133 -10.556 1.00 0.00 N ATOM 0 H LYS A 9 23.880 -3.258 -6.773 1.00 0.00 H new ATOM 0 HA LYS A 9 26.255 -3.754 -5.060 1.00 0.00 H new ATOM 0 HB2 LYS A 9 27.554 -3.095 -6.978 1.00 0.00 H new ATOM 0 HB3 LYS A 9 26.355 -4.258 -7.510 1.00 0.00 H new ATOM 0 HG2 LYS A 9 25.016 -2.468 -8.549 1.00 0.00 H new ATOM 0 HG3 LYS A 9 26.106 -1.246 -7.925 1.00 0.00 H new ATOM 0 HD2 LYS A 9 27.951 -2.117 -9.306 1.00 0.00 H new ATOM 0 HD3 LYS A 9 26.960 -3.456 -9.849 1.00 0.00 H new ATOM 0 HE2 LYS A 9 26.929 -1.918 -11.659 1.00 0.00 H new ATOM 0 HE3 LYS A 9 25.374 -1.704 -10.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 26.401 0.403 -11.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 26.260 0.208 -9.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 27.766 0.001 -10.454 1.00 0.00 H new ATOM 169 N MET A 10 26.834 -1.380 -4.302 1.00 0.00 N ATOM 170 CA MET A 10 27.017 -0.007 -3.741 1.00 0.00 C ATOM 171 C MET A 10 27.570 1.016 -4.792 1.00 0.00 C ATOM 172 O MET A 10 28.641 0.830 -5.378 1.00 0.00 O ATOM 173 CB MET A 10 27.909 -0.074 -2.472 1.00 0.00 C ATOM 174 CG MET A 10 28.031 1.259 -1.696 1.00 0.00 C ATOM 175 SD MET A 10 29.224 1.125 -0.352 1.00 0.00 S ATOM 176 CE MET A 10 28.161 0.591 0.994 1.00 0.00 C ATOM 0 H MET A 10 27.503 -2.067 -3.954 1.00 0.00 H new ATOM 0 HA MET A 10 26.033 0.371 -3.462 1.00 0.00 H new ATOM 0 HB2 MET A 10 27.507 -0.833 -1.801 1.00 0.00 H new ATOM 0 HB3 MET A 10 28.907 -0.402 -2.763 1.00 0.00 H new ATOM 0 HG2 MET A 10 28.335 2.053 -2.378 1.00 0.00 H new ATOM 0 HG3 MET A 10 27.057 1.539 -1.295 1.00 0.00 H new ATOM 0 HE1 MET A 10 28.702 0.668 1.937 1.00 0.00 H new ATOM 0 HE2 MET A 10 27.275 1.224 1.031 1.00 0.00 H new ATOM 0 HE3 MET A 10 27.861 -0.444 0.832 1.00 0.00 H new ATOM 186 N LEU A 11 26.838 2.127 -4.963 1.00 0.00 N ATOM 187 CA LEU A 11 27.329 3.327 -5.697 1.00 0.00 C ATOM 188 C LEU A 11 28.174 4.295 -4.801 1.00 0.00 C ATOM 189 O LEU A 11 29.269 4.690 -5.205 1.00 0.00 O ATOM 190 CB LEU A 11 26.128 4.083 -6.342 1.00 0.00 C ATOM 191 CG LEU A 11 25.275 3.359 -7.416 1.00 0.00 C ATOM 192 CD1 LEU A 11 24.159 4.301 -7.903 1.00 0.00 C ATOM 193 CD2 LEU A 11 26.094 2.887 -8.630 1.00 0.00 C ATOM 0 H LEU A 11 25.890 2.230 -4.601 1.00 0.00 H new ATOM 0 HA LEU A 11 28.001 2.970 -6.477 1.00 0.00 H new ATOM 0 HB2 LEU A 11 25.458 4.384 -5.537 1.00 0.00 H new ATOM 0 HB3 LEU A 11 26.517 4.997 -6.791 1.00 0.00 H new ATOM 0 HG LEU A 11 24.863 2.469 -6.940 1.00 0.00 H new ATOM 0 HD11 LEU A 11 23.558 3.794 -8.658 1.00 0.00 H new ATOM 0 HD12 LEU A 11 23.525 4.579 -7.061 1.00 0.00 H new ATOM 0 HD13 LEU A 11 24.603 5.198 -8.335 1.00 0.00 H new ATOM 0 HD21 LEU A 11 25.436 2.389 -9.342 1.00 0.00 H new ATOM 0 HD22 LEU A 11 26.563 3.747 -9.109 1.00 0.00 H new ATOM 0 HD23 LEU A 11 26.865 2.190 -8.300 1.00 0.00 H new ATOM 205 N SER A 12 27.660 4.705 -3.622 1.00 0.00 N ATOM 206 CA SER A 12 28.394 5.585 -2.668 1.00 0.00 C ATOM 207 C SER A 12 28.088 5.226 -1.179 1.00 0.00 C ATOM 208 O SER A 12 26.987 4.772 -0.843 1.00 0.00 O ATOM 209 CB SER A 12 28.063 7.070 -2.978 1.00 0.00 C ATOM 210 OG SER A 12 26.689 7.385 -2.746 1.00 0.00 O ATOM 0 H SER A 12 26.729 4.441 -3.299 1.00 0.00 H new ATOM 0 HA SER A 12 29.463 5.423 -2.803 1.00 0.00 H new ATOM 0 HB2 SER A 12 28.689 7.715 -2.361 1.00 0.00 H new ATOM 0 HB3 SER A 12 28.311 7.285 -4.017 1.00 0.00 H new ATOM 0 HG SER A 12 26.530 8.330 -2.953 1.00 0.00 H new ATOM 216 N ASN A 13 29.061 5.476 -0.280 1.00 0.00 N ATOM 217 CA ASN A 13 28.826 5.490 1.193 1.00 0.00 C ATOM 218 C ASN A 13 29.323 6.848 1.795 1.00 0.00 C ATOM 219 O ASN A 13 30.516 7.163 1.755 1.00 0.00 O ATOM 220 CB ASN A 13 29.389 4.207 1.868 1.00 0.00 C ATOM 221 CG ASN A 13 30.904 4.046 2.035 1.00 0.00 C ATOM 222 OD1 ASN A 13 31.470 4.439 3.045 1.00 0.00 O ATOM 223 ND2 ASN A 13 31.601 3.445 1.104 1.00 0.00 N ATOM 0 H ASN A 13 30.027 5.673 -0.543 1.00 0.00 H new ATOM 0 HA ASN A 13 27.758 5.448 1.409 1.00 0.00 H new ATOM 0 HB2 ASN A 13 28.942 4.136 2.859 1.00 0.00 H new ATOM 0 HB3 ASN A 13 29.031 3.352 1.295 1.00 0.00 H new ATOM 0 HD21 ASN A 13 32.605 3.309 1.226 1.00 0.00 H new ATOM 0 HD22 ASN A 13 31.141 3.113 0.257 1.00 0.00 H new ATOM 230 N GLU A 14 28.394 7.667 2.314 1.00 0.00 N ATOM 231 CA GLU A 14 28.667 9.083 2.690 1.00 0.00 C ATOM 232 C GLU A 14 28.508 9.256 4.229 1.00 0.00 C ATOM 233 O GLU A 14 27.457 8.927 4.789 1.00 0.00 O ATOM 234 CB GLU A 14 27.683 10.022 1.934 1.00 0.00 C ATOM 235 CG GLU A 14 27.697 9.989 0.383 1.00 0.00 C ATOM 236 CD GLU A 14 29.005 10.426 -0.275 1.00 0.00 C ATOM 237 OE1 GLU A 14 29.308 11.596 -0.482 1.00 0.00 O ATOM 238 OE2 GLU A 14 29.800 9.372 -0.609 1.00 0.00 O ATOM 0 H GLU A 14 27.432 7.377 2.488 1.00 0.00 H new ATOM 0 HA GLU A 14 29.688 9.345 2.411 1.00 0.00 H new ATOM 0 HB2 GLU A 14 26.672 9.783 2.265 1.00 0.00 H new ATOM 0 HB3 GLU A 14 27.888 11.045 2.249 1.00 0.00 H new ATOM 0 HG2 GLU A 14 27.468 8.974 0.057 1.00 0.00 H new ATOM 0 HG3 GLU A 14 26.895 10.630 0.017 1.00 0.00 H new ATOM 246 N ASN A 15 29.553 9.757 4.919 1.00 0.00 N ATOM 247 CA ASN A 15 29.600 9.819 6.421 1.00 0.00 C ATOM 248 C ASN A 15 29.547 8.439 7.191 1.00 0.00 C ATOM 249 O ASN A 15 29.193 8.386 8.374 1.00 0.00 O ATOM 250 CB ASN A 15 28.602 10.917 6.910 1.00 0.00 C ATOM 251 CG ASN A 15 28.851 11.467 8.316 1.00 0.00 C ATOM 252 OD1 ASN A 15 29.902 12.022 8.615 1.00 0.00 O ATOM 253 ND2 ASN A 15 27.906 11.353 9.217 1.00 0.00 N ATOM 0 H ASN A 15 30.389 10.131 4.469 1.00 0.00 H new ATOM 0 HA ASN A 15 30.608 10.121 6.706 1.00 0.00 H new ATOM 0 HB2 ASN A 15 28.632 11.748 6.205 1.00 0.00 H new ATOM 0 HB3 ASN A 15 27.593 10.505 6.875 1.00 0.00 H new ATOM 0 HD21 ASN A 15 28.049 11.724 10.156 1.00 0.00 H new ATOM 0 HD22 ASN A 15 27.027 10.893 8.979 1.00 0.00 H new ATOM 260 N PHE A 16 29.976 7.329 6.551 1.00 0.00 N ATOM 261 CA PHE A 16 30.064 5.991 7.200 1.00 0.00 C ATOM 262 C PHE A 16 31.157 5.880 8.318 1.00 0.00 C ATOM 263 O PHE A 16 30.822 5.397 9.400 1.00 0.00 O ATOM 264 CB PHE A 16 30.105 4.913 6.077 1.00 0.00 C ATOM 265 CG PHE A 16 29.883 3.430 6.446 1.00 0.00 C ATOM 266 CD1 PHE A 16 28.882 3.028 7.340 1.00 0.00 C ATOM 267 CD2 PHE A 16 30.632 2.449 5.787 1.00 0.00 C ATOM 268 CE1 PHE A 16 28.673 1.677 7.605 1.00 0.00 C ATOM 269 CE2 PHE A 16 30.406 1.098 6.034 1.00 0.00 C ATOM 270 CZ PHE A 16 29.434 0.713 6.951 1.00 0.00 C ATOM 0 H PHE A 16 30.271 7.329 5.575 1.00 0.00 H new ATOM 0 HA PHE A 16 29.170 5.809 7.797 1.00 0.00 H new ATOM 0 HB2 PHE A 16 29.352 5.183 5.336 1.00 0.00 H new ATOM 0 HB3 PHE A 16 31.076 4.987 5.587 1.00 0.00 H new ATOM 0 HD1 PHE A 16 28.268 3.771 7.827 1.00 0.00 H new ATOM 0 HD2 PHE A 16 31.393 2.743 5.080 1.00 0.00 H new ATOM 0 HE1 PHE A 16 27.920 1.377 8.319 1.00 0.00 H new ATOM 0 HE2 PHE A 16 30.985 0.349 5.514 1.00 0.00 H new ATOM 0 HZ PHE A 16 29.270 -0.335 7.156 1.00 0.00 H new ATOM 280 N GLU A 17 32.394 6.405 8.141 1.00 0.00 N ATOM 281 CA GLU A 17 33.389 6.581 9.257 1.00 0.00 C ATOM 282 C GLU A 17 32.842 7.209 10.589 1.00 0.00 C ATOM 283 O GLU A 17 33.098 6.662 11.664 1.00 0.00 O ATOM 284 CB GLU A 17 34.718 7.332 8.880 1.00 0.00 C ATOM 285 CG GLU A 17 35.150 7.539 7.408 1.00 0.00 C ATOM 286 CD GLU A 17 34.381 8.621 6.628 1.00 0.00 C ATOM 287 OE1 GLU A 17 33.425 9.256 7.073 1.00 0.00 O ATOM 288 OE2 GLU A 17 34.885 8.785 5.370 1.00 0.00 O ATOM 0 H GLU A 17 32.739 6.719 7.234 1.00 0.00 H new ATOM 0 HA GLU A 17 33.615 5.531 9.441 1.00 0.00 H new ATOM 0 HB2 GLU A 17 34.660 8.322 9.333 1.00 0.00 H new ATOM 0 HB3 GLU A 17 35.531 6.801 9.375 1.00 0.00 H new ATOM 0 HG2 GLU A 17 36.210 7.792 7.393 1.00 0.00 H new ATOM 0 HG3 GLU A 17 35.041 6.591 6.881 1.00 0.00 H new ATOM 296 N GLU A 18 32.123 8.348 10.523 1.00 0.00 N ATOM 297 CA GLU A 18 31.526 9.012 11.719 1.00 0.00 C ATOM 298 C GLU A 18 30.310 8.262 12.371 1.00 0.00 C ATOM 299 O GLU A 18 30.251 8.160 13.599 1.00 0.00 O ATOM 300 CB GLU A 18 31.203 10.472 11.312 1.00 0.00 C ATOM 301 CG GLU A 18 30.968 11.440 12.496 1.00 0.00 C ATOM 302 CD GLU A 18 30.594 12.854 12.063 1.00 0.00 C ATOM 303 OE1 GLU A 18 31.370 13.802 12.095 1.00 0.00 O ATOM 304 OE2 GLU A 18 29.301 12.949 11.643 1.00 0.00 O ATOM 0 H GLU A 18 31.936 8.838 9.648 1.00 0.00 H new ATOM 0 HA GLU A 18 32.254 8.987 12.530 1.00 0.00 H new ATOM 0 HB2 GLU A 18 32.024 10.855 10.706 1.00 0.00 H new ATOM 0 HB3 GLU A 18 30.314 10.470 10.681 1.00 0.00 H new ATOM 0 HG2 GLU A 18 30.175 11.041 13.129 1.00 0.00 H new ATOM 0 HG3 GLU A 18 31.871 11.482 13.105 1.00 0.00 H new ATOM 312 N TYR A 19 29.378 7.695 11.576 1.00 0.00 N ATOM 313 CA TYR A 19 28.432 6.632 12.047 1.00 0.00 C ATOM 314 C TYR A 19 29.111 5.419 12.777 1.00 0.00 C ATOM 315 O TYR A 19 28.679 5.044 13.869 1.00 0.00 O ATOM 316 CB TYR A 19 27.580 6.224 10.809 1.00 0.00 C ATOM 317 CG TYR A 19 26.695 4.966 10.937 1.00 0.00 C ATOM 318 CD1 TYR A 19 25.409 5.033 11.479 1.00 0.00 C ATOM 319 CD2 TYR A 19 27.207 3.725 10.539 1.00 0.00 C ATOM 320 CE1 TYR A 19 24.648 3.873 11.613 1.00 0.00 C ATOM 321 CE2 TYR A 19 26.439 2.571 10.666 1.00 0.00 C ATOM 322 CZ TYR A 19 25.156 2.649 11.194 1.00 0.00 C ATOM 323 OH TYR A 19 24.392 1.520 11.319 1.00 0.00 O ATOM 0 H TYR A 19 29.251 7.950 10.597 1.00 0.00 H new ATOM 0 HA TYR A 19 27.798 7.032 12.838 1.00 0.00 H new ATOM 0 HB2 TYR A 19 26.935 7.064 10.553 1.00 0.00 H new ATOM 0 HB3 TYR A 19 28.258 6.074 9.969 1.00 0.00 H new ATOM 0 HD1 TYR A 19 25.005 5.984 11.794 1.00 0.00 H new ATOM 0 HD2 TYR A 19 28.205 3.663 10.131 1.00 0.00 H new ATOM 0 HE1 TYR A 19 23.659 3.925 12.044 1.00 0.00 H new ATOM 0 HE2 TYR A 19 26.839 1.617 10.355 1.00 0.00 H new ATOM 0 HH TYR A 19 24.081 1.236 10.434 1.00 0.00 H new ATOM 333 N LEU A 20 30.164 4.825 12.189 1.00 0.00 N ATOM 334 CA LEU A 20 30.976 3.770 12.850 1.00 0.00 C ATOM 335 C LEU A 20 31.732 4.234 14.150 1.00 0.00 C ATOM 336 O LEU A 20 31.719 3.497 15.139 1.00 0.00 O ATOM 337 CB LEU A 20 31.922 3.144 11.786 1.00 0.00 C ATOM 338 CG LEU A 20 31.304 2.429 10.549 1.00 0.00 C ATOM 339 CD1 LEU A 20 32.393 2.081 9.522 1.00 0.00 C ATOM 340 CD2 LEU A 20 30.528 1.158 10.911 1.00 0.00 C ATOM 0 H LEU A 20 30.481 5.056 11.247 1.00 0.00 H new ATOM 0 HA LEU A 20 30.293 3.011 13.232 1.00 0.00 H new ATOM 0 HB2 LEU A 20 32.571 3.938 11.416 1.00 0.00 H new ATOM 0 HB3 LEU A 20 32.560 2.423 12.297 1.00 0.00 H new ATOM 0 HG LEU A 20 30.594 3.136 10.119 1.00 0.00 H new ATOM 0 HD11 LEU A 20 31.939 1.582 8.666 1.00 0.00 H new ATOM 0 HD12 LEU A 20 32.886 2.995 9.190 1.00 0.00 H new ATOM 0 HD13 LEU A 20 33.127 1.419 9.981 1.00 0.00 H new ATOM 0 HD21 LEU A 20 30.123 0.708 10.004 1.00 0.00 H new ATOM 0 HD22 LEU A 20 31.197 0.450 11.400 1.00 0.00 H new ATOM 0 HD23 LEU A 20 29.711 1.411 11.587 1.00 0.00 H new ATOM 352 N ARG A 21 32.306 5.456 14.210 1.00 0.00 N ATOM 353 CA ARG A 21 32.735 6.101 15.494 1.00 0.00 C ATOM 354 C ARG A 21 31.626 6.168 16.611 1.00 0.00 C ATOM 355 O ARG A 21 31.852 5.703 17.730 1.00 0.00 O ATOM 356 CB ARG A 21 33.300 7.510 15.161 1.00 0.00 C ATOM 357 CG ARG A 21 34.064 8.204 16.318 1.00 0.00 C ATOM 358 CD ARG A 21 34.687 9.570 15.953 1.00 0.00 C ATOM 359 NE ARG A 21 33.680 10.621 15.624 1.00 0.00 N ATOM 360 CZ ARG A 21 33.003 11.353 16.509 1.00 0.00 C ATOM 361 NH1 ARG A 21 33.118 11.237 17.815 1.00 0.00 N ATOM 362 NH2 ARG A 21 32.170 12.246 16.050 1.00 0.00 N ATOM 0 H ARG A 21 32.488 6.027 13.385 1.00 0.00 H new ATOM 0 HA ARG A 21 33.502 5.466 15.937 1.00 0.00 H new ATOM 0 HB2 ARG A 21 33.970 7.423 14.305 1.00 0.00 H new ATOM 0 HB3 ARG A 21 32.474 8.152 14.855 1.00 0.00 H new ATOM 0 HG2 ARG A 21 33.379 8.344 17.155 1.00 0.00 H new ATOM 0 HG3 ARG A 21 34.856 7.539 16.662 1.00 0.00 H new ATOM 0 HD2 ARG A 21 35.299 9.914 16.787 1.00 0.00 H new ATOM 0 HD3 ARG A 21 35.354 9.439 15.101 1.00 0.00 H new ATOM 0 HE ARG A 21 33.493 10.794 14.636 1.00 0.00 H new ATOM 0 HH11 ARG A 21 33.760 10.550 18.211 1.00 0.00 H new ATOM 0 HH12 ARG A 21 32.566 11.834 18.431 1.00 0.00 H new ATOM 0 HH21 ARG A 21 32.054 12.366 15.044 1.00 0.00 H new ATOM 0 HH22 ARG A 21 31.635 12.825 16.697 1.00 0.00 H new ATOM 376 N ALA A 22 30.423 6.676 16.279 1.00 0.00 N ATOM 377 CA ALA A 22 29.208 6.566 17.134 1.00 0.00 C ATOM 378 C ALA A 22 28.666 5.134 17.488 1.00 0.00 C ATOM 379 O ALA A 22 27.875 5.003 18.427 1.00 0.00 O ATOM 380 CB ALA A 22 28.136 7.398 16.403 1.00 0.00 C ATOM 0 H ALA A 22 30.258 7.178 15.407 1.00 0.00 H new ATOM 0 HA ALA A 22 29.479 6.925 18.127 1.00 0.00 H new ATOM 0 HB1 ALA A 22 27.205 7.370 16.969 1.00 0.00 H new ATOM 0 HB2 ALA A 22 28.475 8.430 16.314 1.00 0.00 H new ATOM 0 HB3 ALA A 22 27.969 6.984 15.409 1.00 0.00 H new ATOM 386 N LEU A 23 29.104 4.069 16.789 1.00 0.00 N ATOM 387 CA LEU A 23 28.923 2.661 17.246 1.00 0.00 C ATOM 388 C LEU A 23 30.161 2.033 17.980 1.00 0.00 C ATOM 389 O LEU A 23 30.213 0.810 18.141 1.00 0.00 O ATOM 390 CB LEU A 23 28.490 1.829 16.005 1.00 0.00 C ATOM 391 CG LEU A 23 27.085 2.145 15.426 1.00 0.00 C ATOM 392 CD1 LEU A 23 26.880 1.424 14.091 1.00 0.00 C ATOM 393 CD2 LEU A 23 25.961 1.747 16.396 1.00 0.00 C ATOM 0 H LEU A 23 29.591 4.150 15.897 1.00 0.00 H new ATOM 0 HA LEU A 23 28.156 2.650 18.020 1.00 0.00 H new ATOM 0 HB2 LEU A 23 29.228 1.980 15.217 1.00 0.00 H new ATOM 0 HB3 LEU A 23 28.521 0.773 16.273 1.00 0.00 H new ATOM 0 HG LEU A 23 27.039 3.223 15.273 1.00 0.00 H new ATOM 0 HD11 LEU A 23 25.890 1.657 13.700 1.00 0.00 H new ATOM 0 HD12 LEU A 23 27.638 1.753 13.380 1.00 0.00 H new ATOM 0 HD13 LEU A 23 26.967 0.348 14.242 1.00 0.00 H new ATOM 0 HD21 LEU A 23 24.995 1.986 15.951 1.00 0.00 H new ATOM 0 HD22 LEU A 23 26.014 0.677 16.595 1.00 0.00 H new ATOM 0 HD23 LEU A 23 26.076 2.296 17.331 1.00 0.00 H new ATOM 405 N ASP A 24 31.140 2.839 18.451 1.00 0.00 N ATOM 406 CA ASP A 24 32.390 2.349 19.116 1.00 0.00 C ATOM 407 C ASP A 24 33.310 1.426 18.235 1.00 0.00 C ATOM 408 O ASP A 24 33.823 0.404 18.702 1.00 0.00 O ATOM 409 CB ASP A 24 32.084 1.767 20.531 1.00 0.00 C ATOM 410 CG ASP A 24 31.493 2.726 21.563 1.00 0.00 C ATOM 411 OD1 ASP A 24 30.425 2.535 22.134 1.00 0.00 O ATOM 412 OD2 ASP A 24 32.294 3.801 21.797 1.00 0.00 O ATOM 0 H ASP A 24 31.094 3.856 18.384 1.00 0.00 H new ATOM 0 HA ASP A 24 33.013 3.233 19.252 1.00 0.00 H new ATOM 0 HB2 ASP A 24 31.395 0.931 20.412 1.00 0.00 H new ATOM 0 HB3 ASP A 24 33.010 1.361 20.938 1.00 0.00 H new ATOM 418 N VAL A 25 33.552 1.812 16.968 1.00 0.00 N ATOM 419 CA VAL A 25 34.374 1.004 16.013 1.00 0.00 C ATOM 420 C VAL A 25 35.826 1.588 15.937 1.00 0.00 C ATOM 421 O VAL A 25 36.034 2.804 15.850 1.00 0.00 O ATOM 422 CB VAL A 25 33.658 0.934 14.619 1.00 0.00 C ATOM 423 CG1 VAL A 25 34.430 0.156 13.529 1.00 0.00 C ATOM 424 CG2 VAL A 25 32.249 0.296 14.677 1.00 0.00 C ATOM 0 H VAL A 25 33.194 2.680 16.570 1.00 0.00 H new ATOM 0 HA VAL A 25 34.467 -0.023 16.367 1.00 0.00 H new ATOM 0 HB VAL A 25 33.603 1.989 14.351 1.00 0.00 H new ATOM 0 HG11 VAL A 25 33.856 0.162 12.602 1.00 0.00 H new ATOM 0 HG12 VAL A 25 35.397 0.629 13.360 1.00 0.00 H new ATOM 0 HG13 VAL A 25 34.581 -0.873 13.855 1.00 0.00 H new ATOM 0 HG21 VAL A 25 31.815 0.281 13.677 1.00 0.00 H new ATOM 0 HG22 VAL A 25 32.327 -0.724 15.054 1.00 0.00 H new ATOM 0 HG23 VAL A 25 31.612 0.881 15.341 1.00 0.00 H new ATOM 434 N ASN A 26 36.837 0.698 15.915 1.00 0.00 N ATOM 435 CA ASN A 26 38.270 1.088 15.760 1.00 0.00 C ATOM 436 C ASN A 26 38.630 1.774 14.394 1.00 0.00 C ATOM 437 O ASN A 26 38.009 1.497 13.365 1.00 0.00 O ATOM 438 CB ASN A 26 39.146 -0.163 16.072 1.00 0.00 C ATOM 439 CG ASN A 26 39.155 -1.297 15.032 1.00 0.00 C ATOM 440 OD1 ASN A 26 39.763 -1.193 13.973 1.00 0.00 O ATOM 441 ND2 ASN A 26 38.495 -2.402 15.283 1.00 0.00 N ATOM 0 H ASN A 26 36.695 -0.308 16.003 1.00 0.00 H new ATOM 0 HA ASN A 26 38.483 1.881 16.476 1.00 0.00 H new ATOM 0 HB2 ASN A 26 40.173 0.172 16.214 1.00 0.00 H new ATOM 0 HB3 ASN A 26 38.812 -0.580 17.022 1.00 0.00 H new ATOM 0 HD21 ASN A 26 38.492 -3.161 14.601 1.00 0.00 H new ATOM 0 HD22 ASN A 26 37.984 -2.503 16.160 1.00 0.00 H new ATOM 448 N VAL A 27 39.668 2.633 14.379 1.00 0.00 N ATOM 449 CA VAL A 27 40.090 3.394 13.151 1.00 0.00 C ATOM 450 C VAL A 27 40.479 2.508 11.912 1.00 0.00 C ATOM 451 O VAL A 27 40.067 2.840 10.797 1.00 0.00 O ATOM 452 CB VAL A 27 41.135 4.504 13.533 1.00 0.00 C ATOM 453 CG1 VAL A 27 41.746 5.265 12.328 1.00 0.00 C ATOM 454 CG2 VAL A 27 40.530 5.593 14.455 1.00 0.00 C ATOM 0 H VAL A 27 40.242 2.829 15.199 1.00 0.00 H new ATOM 0 HA VAL A 27 39.204 3.903 12.771 1.00 0.00 H new ATOM 0 HB VAL A 27 41.914 3.930 14.034 1.00 0.00 H new ATOM 0 HG11 VAL A 27 42.455 6.010 12.690 1.00 0.00 H new ATOM 0 HG12 VAL A 27 42.262 4.560 11.676 1.00 0.00 H new ATOM 0 HG13 VAL A 27 40.952 5.761 11.770 1.00 0.00 H new ATOM 0 HG21 VAL A 27 41.292 6.336 14.690 1.00 0.00 H new ATOM 0 HG22 VAL A 27 39.696 6.077 13.947 1.00 0.00 H new ATOM 0 HG23 VAL A 27 40.176 5.133 15.378 1.00 0.00 H new ATOM 464 N ALA A 28 41.199 1.382 12.084 1.00 0.00 N ATOM 465 CA ALA A 28 41.394 0.378 10.999 1.00 0.00 C ATOM 466 C ALA A 28 40.087 -0.209 10.365 1.00 0.00 C ATOM 467 O ALA A 28 39.941 -0.160 9.142 1.00 0.00 O ATOM 468 CB ALA A 28 42.339 -0.710 11.545 1.00 0.00 C ATOM 0 H ALA A 28 41.658 1.138 12.961 1.00 0.00 H new ATOM 0 HA ALA A 28 41.837 0.891 10.146 1.00 0.00 H new ATOM 0 HB1 ALA A 28 42.506 -1.465 10.777 1.00 0.00 H new ATOM 0 HB2 ALA A 28 43.291 -0.259 11.824 1.00 0.00 H new ATOM 0 HB3 ALA A 28 41.889 -1.177 12.421 1.00 0.00 H new ATOM 474 N LEU A 29 39.120 -0.693 11.169 1.00 0.00 N ATOM 475 CA LEU A 29 37.770 -1.091 10.672 1.00 0.00 C ATOM 476 C LEU A 29 36.861 0.074 10.134 1.00 0.00 C ATOM 477 O LEU A 29 36.221 -0.116 9.097 1.00 0.00 O ATOM 478 CB LEU A 29 37.115 -1.986 11.760 1.00 0.00 C ATOM 479 CG LEU A 29 35.795 -2.720 11.396 1.00 0.00 C ATOM 480 CD1 LEU A 29 35.916 -3.606 10.140 1.00 0.00 C ATOM 481 CD2 LEU A 29 35.342 -3.599 12.577 1.00 0.00 C ATOM 0 H LEU A 29 39.242 -0.822 12.174 1.00 0.00 H new ATOM 0 HA LEU A 29 37.896 -1.664 9.754 1.00 0.00 H new ATOM 0 HB2 LEU A 29 37.845 -2.738 12.059 1.00 0.00 H new ATOM 0 HB3 LEU A 29 36.922 -1.364 12.634 1.00 0.00 H new ATOM 0 HG LEU A 29 35.062 -1.942 11.181 1.00 0.00 H new ATOM 0 HD11 LEU A 29 34.959 -4.089 9.942 1.00 0.00 H new ATOM 0 HD12 LEU A 29 36.195 -2.990 9.285 1.00 0.00 H new ATOM 0 HD13 LEU A 29 36.680 -4.366 10.303 1.00 0.00 H new ATOM 0 HD21 LEU A 29 34.416 -4.111 12.315 1.00 0.00 H new ATOM 0 HD22 LEU A 29 36.114 -4.336 12.799 1.00 0.00 H new ATOM 0 HD23 LEU A 29 35.175 -2.973 13.454 1.00 0.00 H new ATOM 493 N ARG A 30 36.847 1.276 10.754 1.00 0.00 N ATOM 494 CA ARG A 30 36.321 2.528 10.117 1.00 0.00 C ATOM 495 C ARG A 30 36.893 2.846 8.686 1.00 0.00 C ATOM 496 O ARG A 30 36.118 3.115 7.764 1.00 0.00 O ATOM 497 CB ARG A 30 36.545 3.749 11.059 1.00 0.00 C ATOM 498 CG ARG A 30 35.766 3.792 12.401 1.00 0.00 C ATOM 499 CD ARG A 30 36.111 4.982 13.323 1.00 0.00 C ATOM 500 NE ARG A 30 35.745 6.281 12.698 1.00 0.00 N ATOM 501 CZ ARG A 30 36.393 7.435 12.842 1.00 0.00 C ATOM 502 NH1 ARG A 30 37.489 7.592 13.545 1.00 0.00 N ATOM 503 NH2 ARG A 30 35.896 8.488 12.253 1.00 0.00 N ATOM 0 H ARG A 30 37.195 1.416 11.703 1.00 0.00 H new ATOM 0 HA ARG A 30 35.257 2.341 9.969 1.00 0.00 H new ATOM 0 HB2 ARG A 30 37.609 3.801 11.290 1.00 0.00 H new ATOM 0 HB3 ARG A 30 36.296 4.651 10.500 1.00 0.00 H new ATOM 0 HG2 ARG A 30 34.699 3.820 12.182 1.00 0.00 H new ATOM 0 HG3 ARG A 30 35.956 2.866 12.943 1.00 0.00 H new ATOM 0 HD2 ARG A 30 35.585 4.873 14.272 1.00 0.00 H new ATOM 0 HD3 ARG A 30 37.178 4.973 13.547 1.00 0.00 H new ATOM 0 HE ARG A 30 34.918 6.288 12.101 1.00 0.00 H new ATOM 0 HH11 ARG A 30 37.903 6.795 14.029 1.00 0.00 H new ATOM 0 HH12 ARG A 30 37.928 8.511 13.607 1.00 0.00 H new ATOM 0 HH21 ARG A 30 35.039 8.409 11.705 1.00 0.00 H new ATOM 0 HH22 ARG A 30 36.364 9.390 12.340 1.00 0.00 H new ATOM 517 N LYS A 31 38.226 2.778 8.497 1.00 0.00 N ATOM 518 CA LYS A 31 38.878 2.851 7.160 1.00 0.00 C ATOM 519 C LYS A 31 38.545 1.658 6.206 1.00 0.00 C ATOM 520 O LYS A 31 38.063 1.910 5.103 1.00 0.00 O ATOM 521 CB LYS A 31 40.414 3.018 7.349 1.00 0.00 C ATOM 522 CG LYS A 31 40.910 4.360 7.938 1.00 0.00 C ATOM 523 CD LYS A 31 40.803 5.556 6.972 1.00 0.00 C ATOM 524 CE LYS A 31 41.377 6.840 7.590 1.00 0.00 C ATOM 525 NZ LYS A 31 41.320 7.941 6.608 1.00 0.00 N ATOM 0 H LYS A 31 38.889 2.671 9.265 1.00 0.00 H new ATOM 0 HA LYS A 31 38.462 3.723 6.654 1.00 0.00 H new ATOM 0 HB2 LYS A 31 40.764 2.214 7.997 1.00 0.00 H new ATOM 0 HB3 LYS A 31 40.891 2.877 6.379 1.00 0.00 H new ATOM 0 HG2 LYS A 31 40.336 4.582 8.838 1.00 0.00 H new ATOM 0 HG3 LYS A 31 41.950 4.247 8.243 1.00 0.00 H new ATOM 0 HD2 LYS A 31 41.336 5.327 6.049 1.00 0.00 H new ATOM 0 HD3 LYS A 31 39.758 5.716 6.706 1.00 0.00 H new ATOM 0 HE2 LYS A 31 40.812 7.108 8.483 1.00 0.00 H new ATOM 0 HE3 LYS A 31 42.408 6.674 7.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 41.710 8.806 7.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 41.878 7.686 5.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 40.332 8.107 6.330 1.00 0.00 H new ATOM 538 N ILE A 32 38.752 0.384 6.606 1.00 0.00 N ATOM 539 CA ILE A 32 38.378 -0.822 5.789 1.00 0.00 C ATOM 540 C ILE A 32 36.886 -0.797 5.297 1.00 0.00 C ATOM 541 O ILE A 32 36.653 -0.854 4.088 1.00 0.00 O ATOM 542 CB ILE A 32 38.814 -2.133 6.554 1.00 0.00 C ATOM 543 CG1 ILE A 32 40.365 -2.296 6.643 1.00 0.00 C ATOM 544 CG2 ILE A 32 38.211 -3.442 5.973 1.00 0.00 C ATOM 545 CD1 ILE A 32 40.864 -3.242 7.752 1.00 0.00 C ATOM 0 H ILE A 32 39.182 0.149 7.501 1.00 0.00 H new ATOM 0 HA ILE A 32 38.935 -0.806 4.852 1.00 0.00 H new ATOM 0 HB ILE A 32 38.404 -1.988 7.553 1.00 0.00 H new ATOM 0 HG12 ILE A 32 40.731 -2.662 5.684 1.00 0.00 H new ATOM 0 HG13 ILE A 32 40.809 -1.313 6.800 1.00 0.00 H new ATOM 0 HG21 ILE A 32 38.561 -4.294 6.556 1.00 0.00 H new ATOM 0 HG22 ILE A 32 37.123 -3.393 6.019 1.00 0.00 H new ATOM 0 HG23 ILE A 32 38.526 -3.559 4.936 1.00 0.00 H new ATOM 0 HD11 ILE A 32 41.953 -3.286 7.730 1.00 0.00 H new ATOM 0 HD12 ILE A 32 40.536 -2.870 8.723 1.00 0.00 H new ATOM 0 HD13 ILE A 32 40.457 -4.240 7.589 1.00 0.00 H new ATOM 557 N ALA A 33 35.902 -0.666 6.205 1.00 0.00 N ATOM 558 CA ALA A 33 34.468 -0.556 5.831 1.00 0.00 C ATOM 559 C ALA A 33 34.018 0.666 4.967 1.00 0.00 C ATOM 560 O ALA A 33 33.157 0.494 4.101 1.00 0.00 O ATOM 561 CB ALA A 33 33.685 -0.674 7.153 1.00 0.00 C ATOM 0 H ALA A 33 36.069 -0.633 7.211 1.00 0.00 H new ATOM 0 HA ALA A 33 34.254 -1.358 5.124 1.00 0.00 H new ATOM 0 HB1 ALA A 33 32.616 -0.601 6.951 1.00 0.00 H new ATOM 0 HB2 ALA A 33 33.901 -1.635 7.619 1.00 0.00 H new ATOM 0 HB3 ALA A 33 33.983 0.131 7.825 1.00 0.00 H new ATOM 567 N ASN A 34 34.594 1.868 5.155 1.00 0.00 N ATOM 568 CA ASN A 34 34.354 3.024 4.242 1.00 0.00 C ATOM 569 C ASN A 34 35.098 2.978 2.866 1.00 0.00 C ATOM 570 O ASN A 34 34.561 3.489 1.879 1.00 0.00 O ATOM 571 CB ASN A 34 34.639 4.334 5.034 1.00 0.00 C ATOM 572 CG ASN A 34 33.943 5.613 4.545 1.00 0.00 C ATOM 573 OD1 ASN A 34 33.111 6.196 5.228 1.00 0.00 O ATOM 574 ND2 ASN A 34 34.272 6.141 3.394 1.00 0.00 N ATOM 0 H ASN A 34 35.229 2.073 5.926 1.00 0.00 H new ATOM 0 HA ASN A 34 33.309 2.976 3.935 1.00 0.00 H new ATOM 0 HB2 ASN A 34 34.354 4.170 6.073 1.00 0.00 H new ATOM 0 HB3 ASN A 34 35.715 4.509 5.023 1.00 0.00 H new ATOM 0 HD21 ASN A 34 33.838 7.013 3.090 1.00 0.00 H new ATOM 0 HD22 ASN A 34 34.962 5.681 2.800 1.00 0.00 H new ATOM 581 N LEU A 35 36.314 2.413 2.793 1.00 0.00 N ATOM 582 CA LEU A 35 37.082 2.299 1.518 1.00 0.00 C ATOM 583 C LEU A 35 36.545 1.237 0.505 1.00 0.00 C ATOM 584 O LEU A 35 36.619 1.478 -0.703 1.00 0.00 O ATOM 585 CB LEU A 35 38.587 2.052 1.839 1.00 0.00 C ATOM 586 CG LEU A 35 39.378 3.235 2.463 1.00 0.00 C ATOM 587 CD1 LEU A 35 40.730 2.744 3.010 1.00 0.00 C ATOM 588 CD2 LEU A 35 39.617 4.378 1.461 1.00 0.00 C ATOM 0 H LEU A 35 36.799 2.022 3.601 1.00 0.00 H new ATOM 0 HA LEU A 35 36.948 3.250 1.003 1.00 0.00 H new ATOM 0 HB2 LEU A 35 38.653 1.203 2.520 1.00 0.00 H new ATOM 0 HB3 LEU A 35 39.087 1.760 0.916 1.00 0.00 H new ATOM 0 HG LEU A 35 38.767 3.628 3.275 1.00 0.00 H new ATOM 0 HD11 LEU A 35 41.273 3.583 3.444 1.00 0.00 H new ATOM 0 HD12 LEU A 35 40.560 1.987 3.776 1.00 0.00 H new ATOM 0 HD13 LEU A 35 41.316 2.313 2.198 1.00 0.00 H new ATOM 0 HD21 LEU A 35 40.174 5.179 1.948 1.00 0.00 H new ATOM 0 HD22 LEU A 35 40.188 4.004 0.612 1.00 0.00 H new ATOM 0 HD23 LEU A 35 38.659 4.763 1.112 1.00 0.00 H new ATOM 600 N LEU A 36 36.038 0.079 0.970 1.00 0.00 N ATOM 601 CA LEU A 36 35.494 -0.982 0.070 1.00 0.00 C ATOM 602 C LEU A 36 33.949 -0.875 -0.145 1.00 0.00 C ATOM 603 O LEU A 36 33.208 -0.374 0.707 1.00 0.00 O ATOM 604 CB LEU A 36 36.048 -2.378 0.467 1.00 0.00 C ATOM 605 CG LEU A 36 35.572 -2.982 1.809 1.00 0.00 C ATOM 606 CD1 LEU A 36 34.301 -3.831 1.669 1.00 0.00 C ATOM 607 CD2 LEU A 36 36.685 -3.828 2.450 1.00 0.00 C ATOM 0 H LEU A 36 35.989 -0.155 1.962 1.00 0.00 H new ATOM 0 HA LEU A 36 35.869 -0.814 -0.940 1.00 0.00 H new ATOM 0 HB2 LEU A 36 35.791 -3.079 -0.327 1.00 0.00 H new ATOM 0 HB3 LEU A 36 37.136 -2.312 0.495 1.00 0.00 H new ATOM 0 HG LEU A 36 35.331 -2.136 2.452 1.00 0.00 H new ATOM 0 HD11 LEU A 36 34.018 -4.226 2.645 1.00 0.00 H new ATOM 0 HD12 LEU A 36 33.492 -3.213 1.279 1.00 0.00 H new ATOM 0 HD13 LEU A 36 34.489 -4.657 0.983 1.00 0.00 H new ATOM 0 HD21 LEU A 36 36.329 -4.243 3.393 1.00 0.00 H new ATOM 0 HD22 LEU A 36 36.959 -4.640 1.776 1.00 0.00 H new ATOM 0 HD23 LEU A 36 37.557 -3.201 2.636 1.00 0.00 H new ATOM 619 N LYS A 37 33.470 -1.350 -1.309 1.00 0.00 N ATOM 620 CA LYS A 37 32.047 -1.203 -1.723 1.00 0.00 C ATOM 621 C LYS A 37 31.317 -2.595 -1.647 1.00 0.00 C ATOM 622 O LYS A 37 31.392 -3.346 -2.627 1.00 0.00 O ATOM 623 CB LYS A 37 32.000 -0.537 -3.135 1.00 0.00 C ATOM 624 CG LYS A 37 32.598 0.887 -3.295 1.00 0.00 C ATOM 625 CD LYS A 37 31.993 1.967 -2.369 1.00 0.00 C ATOM 626 CE LYS A 37 32.635 3.358 -2.521 1.00 0.00 C ATOM 627 NZ LYS A 37 32.058 4.095 -3.663 1.00 0.00 N ATOM 0 H LYS A 37 34.047 -1.844 -1.990 1.00 0.00 H new ATOM 0 HA LYS A 37 31.504 -0.547 -1.043 1.00 0.00 H new ATOM 0 HB2 LYS A 37 32.519 -1.196 -3.831 1.00 0.00 H new ATOM 0 HB3 LYS A 37 30.957 -0.498 -3.450 1.00 0.00 H new ATOM 0 HG2 LYS A 37 33.671 0.835 -3.112 1.00 0.00 H new ATOM 0 HG3 LYS A 37 32.466 1.204 -4.330 1.00 0.00 H new ATOM 0 HD2 LYS A 37 30.925 2.048 -2.572 1.00 0.00 H new ATOM 0 HD3 LYS A 37 32.097 1.642 -1.334 1.00 0.00 H new ATOM 0 HE2 LYS A 37 32.488 3.930 -1.605 1.00 0.00 H new ATOM 0 HE3 LYS A 37 33.711 3.251 -2.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 32.437 5.064 -3.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 32.307 3.612 -4.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 31.023 4.129 -3.567 1.00 0.00 H new ATOM 640 N PRO A 38 30.620 -3.005 -0.538 1.00 0.00 N ATOM 641 CA PRO A 38 29.964 -4.342 -0.448 1.00 0.00 C ATOM 642 C PRO A 38 28.633 -4.498 -1.256 1.00 0.00 C ATOM 643 O PRO A 38 28.060 -3.529 -1.769 1.00 0.00 O ATOM 644 CB PRO A 38 29.784 -4.484 1.080 1.00 0.00 C ATOM 645 CG PRO A 38 29.594 -3.059 1.595 1.00 0.00 C ATOM 646 CD PRO A 38 30.541 -2.238 0.722 1.00 0.00 C ATOM 0 HA PRO A 38 30.556 -5.132 -0.910 1.00 0.00 H new ATOM 0 HB2 PRO A 38 28.922 -5.107 1.319 1.00 0.00 H new ATOM 0 HB3 PRO A 38 30.654 -4.955 1.537 1.00 0.00 H new ATOM 0 HG2 PRO A 38 28.561 -2.728 1.489 1.00 0.00 H new ATOM 0 HG3 PRO A 38 29.848 -2.976 2.652 1.00 0.00 H new ATOM 0 HD2 PRO A 38 30.157 -1.232 0.553 1.00 0.00 H new ATOM 0 HD3 PRO A 38 31.521 -2.132 1.187 1.00 0.00 H new ATOM 654 N ASP A 39 28.152 -5.749 -1.365 1.00 0.00 N ATOM 655 CA ASP A 39 26.919 -6.069 -2.154 1.00 0.00 C ATOM 656 C ASP A 39 25.743 -6.541 -1.241 1.00 0.00 C ATOM 657 O ASP A 39 25.921 -7.388 -0.364 1.00 0.00 O ATOM 658 CB ASP A 39 27.258 -7.121 -3.240 1.00 0.00 C ATOM 659 CG ASP A 39 28.068 -6.572 -4.415 1.00 0.00 C ATOM 660 OD1 ASP A 39 27.565 -6.065 -5.413 1.00 0.00 O ATOM 661 OD2 ASP A 39 29.411 -6.699 -4.227 1.00 0.00 O ATOM 0 H ASP A 39 28.586 -6.560 -0.924 1.00 0.00 H new ATOM 0 HA ASP A 39 26.576 -5.157 -2.642 1.00 0.00 H new ATOM 0 HB2 ASP A 39 27.816 -7.936 -2.779 1.00 0.00 H new ATOM 0 HB3 ASP A 39 26.329 -7.546 -3.621 1.00 0.00 H new ATOM 667 N LYS A 40 24.526 -6.012 -1.457 1.00 0.00 N ATOM 668 CA LYS A 40 23.324 -6.386 -0.661 1.00 0.00 C ATOM 669 C LYS A 40 22.419 -7.365 -1.464 1.00 0.00 C ATOM 670 O LYS A 40 21.823 -6.994 -2.476 1.00 0.00 O ATOM 671 CB LYS A 40 22.559 -5.117 -0.193 1.00 0.00 C ATOM 672 CG LYS A 40 23.237 -4.388 0.988 1.00 0.00 C ATOM 673 CD LYS A 40 22.590 -3.041 1.366 1.00 0.00 C ATOM 674 CE LYS A 40 21.382 -3.127 2.301 1.00 0.00 C ATOM 675 NZ LYS A 40 21.806 -3.320 3.704 1.00 0.00 N ATOM 0 H LYS A 40 24.339 -5.318 -2.180 1.00 0.00 H new ATOM 0 HA LYS A 40 23.644 -6.913 0.238 1.00 0.00 H new ATOM 0 HB2 LYS A 40 22.469 -4.427 -1.032 1.00 0.00 H new ATOM 0 HB3 LYS A 40 21.547 -5.399 0.098 1.00 0.00 H new ATOM 0 HG2 LYS A 40 23.220 -5.042 1.860 1.00 0.00 H new ATOM 0 HG3 LYS A 40 24.284 -4.216 0.739 1.00 0.00 H new ATOM 0 HD2 LYS A 40 23.347 -2.414 1.837 1.00 0.00 H new ATOM 0 HD3 LYS A 40 22.283 -2.536 0.450 1.00 0.00 H new ATOM 0 HE2 LYS A 40 20.790 -2.216 2.219 1.00 0.00 H new ATOM 0 HE3 LYS A 40 20.740 -3.953 1.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 20.970 -3.493 4.298 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 22.448 -4.136 3.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 22.298 -2.467 4.039 1.00 0.00 H new ATOM 688 N GLU A 41 22.294 -8.612 -0.991 1.00 0.00 N ATOM 689 CA GLU A 41 21.270 -9.568 -1.495 1.00 0.00 C ATOM 690 C GLU A 41 20.043 -9.565 -0.532 1.00 0.00 C ATOM 691 O GLU A 41 20.126 -10.047 0.602 1.00 0.00 O ATOM 692 CB GLU A 41 21.922 -10.962 -1.678 1.00 0.00 C ATOM 693 CG GLU A 41 21.018 -12.008 -2.379 1.00 0.00 C ATOM 694 CD GLU A 41 21.681 -13.379 -2.503 1.00 0.00 C ATOM 695 OE1 GLU A 41 22.619 -13.606 -3.263 1.00 0.00 O ATOM 696 OE2 GLU A 41 21.120 -14.310 -1.674 1.00 0.00 O ATOM 0 H GLU A 41 22.888 -8.994 -0.255 1.00 0.00 H new ATOM 0 HA GLU A 41 20.894 -9.270 -2.474 1.00 0.00 H new ATOM 0 HB2 GLU A 41 22.839 -10.847 -2.256 1.00 0.00 H new ATOM 0 HB3 GLU A 41 22.209 -11.346 -0.699 1.00 0.00 H new ATOM 0 HG2 GLU A 41 20.088 -12.109 -1.820 1.00 0.00 H new ATOM 0 HG3 GLU A 41 20.755 -11.646 -3.373 1.00 0.00 H new ATOM 704 N ILE A 42 18.905 -9.016 -0.983 1.00 0.00 N ATOM 705 CA ILE A 42 17.663 -8.939 -0.155 1.00 0.00 C ATOM 706 C ILE A 42 16.695 -10.062 -0.644 1.00 0.00 C ATOM 707 O ILE A 42 16.267 -10.070 -1.803 1.00 0.00 O ATOM 708 CB ILE A 42 17.025 -7.500 -0.166 1.00 0.00 C ATOM 709 CG1 ILE A 42 18.011 -6.403 0.341 1.00 0.00 C ATOM 710 CG2 ILE A 42 15.714 -7.466 0.671 1.00 0.00 C ATOM 711 CD1 ILE A 42 17.538 -4.943 0.226 1.00 0.00 C ATOM 0 H ILE A 42 18.806 -8.615 -1.916 1.00 0.00 H new ATOM 0 HA ILE A 42 17.897 -9.111 0.896 1.00 0.00 H new ATOM 0 HB ILE A 42 16.792 -7.274 -1.207 1.00 0.00 H new ATOM 0 HG12 ILE A 42 18.237 -6.606 1.388 1.00 0.00 H new ATOM 0 HG13 ILE A 42 18.945 -6.503 -0.212 1.00 0.00 H new ATOM 0 HG21 ILE A 42 15.293 -6.461 0.647 1.00 0.00 H new ATOM 0 HG22 ILE A 42 14.996 -8.170 0.251 1.00 0.00 H new ATOM 0 HG23 ILE A 42 15.933 -7.743 1.702 1.00 0.00 H new ATOM 0 HD11 ILE A 42 18.311 -4.279 0.611 1.00 0.00 H new ATOM 0 HD12 ILE A 42 17.343 -4.705 -0.820 1.00 0.00 H new ATOM 0 HD13 ILE A 42 16.624 -4.810 0.805 1.00 0.00 H new ATOM 723 N VAL A 43 16.324 -10.978 0.266 1.00 0.00 N ATOM 724 CA VAL A 43 15.312 -12.039 -0.014 1.00 0.00 C ATOM 725 C VAL A 43 14.033 -11.688 0.818 1.00 0.00 C ATOM 726 O VAL A 43 13.928 -12.048 1.994 1.00 0.00 O ATOM 727 CB VAL A 43 15.910 -13.466 0.258 1.00 0.00 C ATOM 728 CG1 VAL A 43 14.886 -14.607 0.052 1.00 0.00 C ATOM 729 CG2 VAL A 43 17.142 -13.803 -0.619 1.00 0.00 C ATOM 0 H VAL A 43 16.706 -11.014 1.211 1.00 0.00 H new ATOM 0 HA VAL A 43 15.027 -12.070 -1.066 1.00 0.00 H new ATOM 0 HB VAL A 43 16.207 -13.410 1.305 1.00 0.00 H new ATOM 0 HG11 VAL A 43 15.363 -15.565 0.256 1.00 0.00 H new ATOM 0 HG12 VAL A 43 14.045 -14.468 0.732 1.00 0.00 H new ATOM 0 HG13 VAL A 43 14.527 -14.592 -0.977 1.00 0.00 H new ATOM 0 HG21 VAL A 43 17.500 -14.803 -0.375 1.00 0.00 H new ATOM 0 HG22 VAL A 43 16.861 -13.765 -1.671 1.00 0.00 H new ATOM 0 HG23 VAL A 43 17.934 -13.078 -0.428 1.00 0.00 H new ATOM 739 N GLN A 44 13.058 -10.994 0.198 1.00 0.00 N ATOM 740 CA GLN A 44 11.733 -10.707 0.821 1.00 0.00 C ATOM 741 C GLN A 44 10.741 -11.886 0.557 1.00 0.00 C ATOM 742 O GLN A 44 10.118 -11.971 -0.506 1.00 0.00 O ATOM 743 CB GLN A 44 11.268 -9.312 0.311 1.00 0.00 C ATOM 744 CG GLN A 44 10.039 -8.669 1.015 1.00 0.00 C ATOM 745 CD GLN A 44 8.650 -9.280 0.786 1.00 0.00 C ATOM 746 OE1 GLN A 44 7.981 -9.735 1.710 1.00 0.00 O ATOM 747 NE2 GLN A 44 8.159 -9.295 -0.431 1.00 0.00 N ATOM 0 H GLN A 44 13.157 -10.615 -0.744 1.00 0.00 H new ATOM 0 HA GLN A 44 11.787 -10.647 1.908 1.00 0.00 H new ATOM 0 HB2 GLN A 44 12.107 -8.623 0.401 1.00 0.00 H new ATOM 0 HB3 GLN A 44 11.041 -9.400 -0.751 1.00 0.00 H new ATOM 0 HG2 GLN A 44 10.231 -8.680 2.088 1.00 0.00 H new ATOM 0 HG3 GLN A 44 9.994 -7.624 0.710 1.00 0.00 H new ATOM 0 HE21 GLN A 44 8.706 -8.920 -1.206 1.00 0.00 H new ATOM 0 HE22 GLN A 44 7.231 -9.682 -0.602 1.00 0.00 H new ATOM 756 N ASP A 45 10.606 -12.799 1.532 1.00 0.00 N ATOM 757 CA ASP A 45 9.731 -13.998 1.421 1.00 0.00 C ATOM 758 C ASP A 45 8.391 -13.801 2.210 1.00 0.00 C ATOM 759 O ASP A 45 8.164 -14.458 3.234 1.00 0.00 O ATOM 760 CB ASP A 45 10.613 -15.187 1.906 1.00 0.00 C ATOM 761 CG ASP A 45 10.028 -16.586 1.710 1.00 0.00 C ATOM 762 OD1 ASP A 45 10.499 -17.408 0.931 1.00 0.00 O ATOM 763 OD2 ASP A 45 8.940 -16.812 2.506 1.00 0.00 O ATOM 0 H ASP A 45 11.097 -12.735 2.424 1.00 0.00 H new ATOM 0 HA ASP A 45 9.389 -14.190 0.404 1.00 0.00 H new ATOM 0 HB2 ASP A 45 11.569 -15.139 1.384 1.00 0.00 H new ATOM 0 HB3 ASP A 45 10.821 -15.048 2.967 1.00 0.00 H new ATOM 769 N GLY A 46 7.497 -12.923 1.714 1.00 0.00 N ATOM 770 CA GLY A 46 6.158 -12.679 2.330 1.00 0.00 C ATOM 771 C GLY A 46 6.128 -12.213 3.803 1.00 0.00 C ATOM 772 O GLY A 46 5.679 -12.959 4.673 1.00 0.00 O ATOM 0 H GLY A 46 7.672 -12.361 0.881 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.642 -11.930 1.729 1.00 0.00 H new ATOM 0 HA3 GLY A 46 5.580 -13.600 2.256 1.00 0.00 H new ATOM 776 N ASP A 47 6.641 -11.007 4.080 1.00 0.00 N ATOM 777 CA ASP A 47 6.982 -10.534 5.461 1.00 0.00 C ATOM 778 C ASP A 47 8.364 -10.996 6.036 1.00 0.00 C ATOM 779 O ASP A 47 8.988 -10.213 6.752 1.00 0.00 O ATOM 780 CB ASP A 47 5.802 -10.506 6.488 1.00 0.00 C ATOM 781 CG ASP A 47 5.757 -11.564 7.601 1.00 0.00 C ATOM 782 OD1 ASP A 47 5.908 -11.291 8.788 1.00 0.00 O ATOM 783 OD2 ASP A 47 5.555 -12.827 7.127 1.00 0.00 O ATOM 0 H ASP A 47 6.839 -10.314 3.358 1.00 0.00 H new ATOM 0 HA ASP A 47 7.160 -9.474 5.278 1.00 0.00 H new ATOM 0 HB2 ASP A 47 5.805 -9.526 6.966 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.873 -10.583 5.923 1.00 0.00 H new ATOM 789 N HIS A 48 8.843 -12.228 5.776 1.00 0.00 N ATOM 790 CA HIS A 48 10.195 -12.672 6.214 1.00 0.00 C ATOM 791 C HIS A 48 11.290 -12.126 5.246 1.00 0.00 C ATOM 792 O HIS A 48 11.561 -12.708 4.191 1.00 0.00 O ATOM 793 CB HIS A 48 10.198 -14.215 6.377 1.00 0.00 C ATOM 794 CG HIS A 48 11.487 -14.839 6.932 1.00 0.00 C ATOM 795 ND1 HIS A 48 11.962 -16.068 6.499 1.00 0.00 N ATOM 796 CD2 HIS A 48 12.314 -14.326 7.956 1.00 0.00 C ATOM 797 CE1 HIS A 48 13.056 -16.186 7.318 1.00 0.00 C ATOM 798 NE2 HIS A 48 13.355 -15.196 8.215 1.00 0.00 N ATOM 0 H HIS A 48 8.319 -12.939 5.265 1.00 0.00 H new ATOM 0 HA HIS A 48 10.441 -12.254 7.190 1.00 0.00 H new ATOM 0 HB2 HIS A 48 9.374 -14.491 7.035 1.00 0.00 H new ATOM 0 HB3 HIS A 48 9.993 -14.662 5.404 1.00 0.00 H new ATOM 0 HD2 HIS A 48 12.155 -13.387 8.464 1.00 0.00 H new ATOM 0 HE1 HIS A 48 13.683 -17.063 7.255 1.00 0.00 H new ATOM 0 HE2 HIS A 48 14.124 -15.122 8.881 1.00 0.00 H new ATOM 806 N MET A 49 11.894 -10.985 5.605 1.00 0.00 N ATOM 807 CA MET A 49 12.888 -10.294 4.756 1.00 0.00 C ATOM 808 C MET A 49 14.318 -10.523 5.315 1.00 0.00 C ATOM 809 O MET A 49 14.637 -10.178 6.458 1.00 0.00 O ATOM 810 CB MET A 49 12.437 -8.825 4.578 1.00 0.00 C ATOM 811 CG MET A 49 13.342 -7.951 3.678 1.00 0.00 C ATOM 812 SD MET A 49 12.429 -6.802 2.614 1.00 0.00 S ATOM 813 CE MET A 49 11.229 -6.029 3.713 1.00 0.00 C ATOM 0 H MET A 49 11.711 -10.512 6.490 1.00 0.00 H new ATOM 0 HA MET A 49 12.940 -10.706 3.748 1.00 0.00 H new ATOM 0 HB2 MET A 49 11.430 -8.821 4.162 1.00 0.00 H new ATOM 0 HB3 MET A 49 12.377 -8.361 5.562 1.00 0.00 H new ATOM 0 HG2 MET A 49 14.025 -7.382 4.309 1.00 0.00 H new ATOM 0 HG3 MET A 49 13.953 -8.602 3.053 1.00 0.00 H new ATOM 0 HE1 MET A 49 10.829 -5.131 3.241 1.00 0.00 H new ATOM 0 HE2 MET A 49 10.416 -6.727 3.913 1.00 0.00 H new ATOM 0 HE3 MET A 49 11.715 -5.760 4.651 1.00 0.00 H new ATOM 823 N ILE A 50 15.162 -11.145 4.477 1.00 0.00 N ATOM 824 CA ILE A 50 16.560 -11.488 4.840 1.00 0.00 C ATOM 825 C ILE A 50 17.480 -10.487 4.068 1.00 0.00 C ATOM 826 O ILE A 50 17.739 -10.667 2.872 1.00 0.00 O ATOM 827 CB ILE A 50 16.885 -13.003 4.571 1.00 0.00 C ATOM 828 CG1 ILE A 50 15.888 -14.019 5.216 1.00 0.00 C ATOM 829 CG2 ILE A 50 18.326 -13.329 5.041 1.00 0.00 C ATOM 830 CD1 ILE A 50 15.959 -15.450 4.651 1.00 0.00 C ATOM 0 H ILE A 50 14.903 -11.426 3.531 1.00 0.00 H new ATOM 0 HA ILE A 50 16.733 -11.380 5.911 1.00 0.00 H new ATOM 0 HB ILE A 50 16.782 -13.128 3.493 1.00 0.00 H new ATOM 0 HG12 ILE A 50 16.077 -14.059 6.289 1.00 0.00 H new ATOM 0 HG13 ILE A 50 14.874 -13.643 5.084 1.00 0.00 H new ATOM 0 HG21 ILE A 50 18.542 -14.380 4.851 1.00 0.00 H new ATOM 0 HG22 ILE A 50 19.036 -12.708 4.495 1.00 0.00 H new ATOM 0 HG23 ILE A 50 18.415 -13.128 6.109 1.00 0.00 H new ATOM 0 HD11 ILE A 50 15.230 -16.079 5.162 1.00 0.00 H new ATOM 0 HD12 ILE A 50 15.738 -15.431 3.584 1.00 0.00 H new ATOM 0 HD13 ILE A 50 16.959 -15.854 4.807 1.00 0.00 H new ATOM 842 N ILE A 51 17.980 -9.445 4.758 1.00 0.00 N ATOM 843 CA ILE A 51 18.923 -8.451 4.157 1.00 0.00 C ATOM 844 C ILE A 51 20.383 -8.981 4.377 1.00 0.00 C ATOM 845 O ILE A 51 20.874 -9.034 5.511 1.00 0.00 O ATOM 846 CB ILE A 51 18.662 -6.998 4.706 1.00 0.00 C ATOM 847 CG1 ILE A 51 17.228 -6.461 4.397 1.00 0.00 C ATOM 848 CG2 ILE A 51 19.715 -5.983 4.187 1.00 0.00 C ATOM 849 CD1 ILE A 51 16.825 -5.156 5.108 1.00 0.00 C ATOM 0 H ILE A 51 17.753 -9.259 5.735 1.00 0.00 H new ATOM 0 HA ILE A 51 18.761 -8.355 3.083 1.00 0.00 H new ATOM 0 HB ILE A 51 18.753 -7.091 5.788 1.00 0.00 H new ATOM 0 HG12 ILE A 51 17.144 -6.305 3.321 1.00 0.00 H new ATOM 0 HG13 ILE A 51 16.507 -7.234 4.664 1.00 0.00 H new ATOM 0 HG21 ILE A 51 19.497 -4.994 4.590 1.00 0.00 H new ATOM 0 HG22 ILE A 51 20.709 -6.294 4.507 1.00 0.00 H new ATOM 0 HG23 ILE A 51 19.680 -5.947 3.098 1.00 0.00 H new ATOM 0 HD11 ILE A 51 15.811 -4.881 4.817 1.00 0.00 H new ATOM 0 HD12 ILE A 51 16.866 -5.302 6.187 1.00 0.00 H new ATOM 0 HD13 ILE A 51 17.513 -4.359 4.824 1.00 0.00 H new ATOM 861 N ARG A 52 21.065 -9.367 3.283 1.00 0.00 N ATOM 862 CA ARG A 52 22.414 -9.998 3.341 1.00 0.00 C ATOM 863 C ARG A 52 23.471 -8.992 2.793 1.00 0.00 C ATOM 864 O ARG A 52 23.606 -8.847 1.575 1.00 0.00 O ATOM 865 CB ARG A 52 22.439 -11.332 2.537 1.00 0.00 C ATOM 866 CG ARG A 52 21.342 -12.367 2.877 1.00 0.00 C ATOM 867 CD ARG A 52 21.450 -13.663 2.059 1.00 0.00 C ATOM 868 NE ARG A 52 20.203 -14.443 2.254 1.00 0.00 N ATOM 869 CZ ARG A 52 19.947 -15.634 1.727 1.00 0.00 C ATOM 870 NH1 ARG A 52 20.780 -16.302 0.959 1.00 0.00 N ATOM 871 NH2 ARG A 52 18.789 -16.172 1.992 1.00 0.00 N ATOM 0 H ARG A 52 20.706 -9.255 2.335 1.00 0.00 H new ATOM 0 HA ARG A 52 22.655 -10.241 4.376 1.00 0.00 H new ATOM 0 HB2 ARG A 52 22.364 -11.092 1.476 1.00 0.00 H new ATOM 0 HB3 ARG A 52 23.410 -11.803 2.689 1.00 0.00 H new ATOM 0 HG2 ARG A 52 21.399 -12.610 3.938 1.00 0.00 H new ATOM 0 HG3 ARG A 52 20.364 -11.918 2.705 1.00 0.00 H new ATOM 0 HD2 ARG A 52 21.594 -13.434 1.003 1.00 0.00 H new ATOM 0 HD3 ARG A 52 22.315 -14.243 2.380 1.00 0.00 H new ATOM 0 HE ARG A 52 19.481 -14.029 2.843 1.00 0.00 H new ATOM 0 HH11 ARG A 52 21.693 -15.908 0.733 1.00 0.00 H new ATOM 0 HH12 ARG A 52 20.513 -17.214 0.590 1.00 0.00 H new ATOM 0 HH21 ARG A 52 18.121 -15.678 2.584 1.00 0.00 H new ATOM 0 HH22 ARG A 52 18.551 -17.086 1.607 1.00 0.00 H new ATOM 885 N THR A 53 24.213 -8.293 3.671 1.00 0.00 N ATOM 886 CA THR A 53 25.266 -7.317 3.239 1.00 0.00 C ATOM 887 C THR A 53 26.643 -8.051 3.177 1.00 0.00 C ATOM 888 O THR A 53 27.199 -8.463 4.200 1.00 0.00 O ATOM 889 CB THR A 53 25.275 -6.056 4.152 1.00 0.00 C ATOM 890 OG1 THR A 53 23.951 -5.552 4.309 1.00 0.00 O ATOM 891 CG2 THR A 53 26.128 -4.896 3.611 1.00 0.00 C ATOM 0 H THR A 53 24.114 -8.375 4.683 1.00 0.00 H new ATOM 0 HA THR A 53 25.044 -6.944 2.239 1.00 0.00 H new ATOM 0 HB THR A 53 25.707 -6.395 5.094 1.00 0.00 H new ATOM 0 HG1 THR A 53 23.969 -4.760 4.886 1.00 0.00 H new ATOM 0 HG21 THR A 53 26.082 -4.056 4.304 1.00 0.00 H new ATOM 0 HG22 THR A 53 27.162 -5.223 3.506 1.00 0.00 H new ATOM 0 HG23 THR A 53 25.745 -4.585 2.639 1.00 0.00 H new ATOM 899 N LEU A 54 27.149 -8.257 1.956 1.00 0.00 N ATOM 900 CA LEU A 54 28.183 -9.282 1.663 1.00 0.00 C ATOM 901 C LEU A 54 29.588 -8.627 1.508 1.00 0.00 C ATOM 902 O LEU A 54 29.776 -7.719 0.687 1.00 0.00 O ATOM 903 CB LEU A 54 27.751 -10.041 0.372 1.00 0.00 C ATOM 904 CG LEU A 54 26.426 -10.857 0.445 1.00 0.00 C ATOM 905 CD1 LEU A 54 25.906 -11.189 -0.964 1.00 0.00 C ATOM 906 CD2 LEU A 54 26.593 -12.149 1.263 1.00 0.00 C ATOM 0 H LEU A 54 26.860 -7.723 1.136 1.00 0.00 H new ATOM 0 HA LEU A 54 28.264 -9.988 2.490 1.00 0.00 H new ATOM 0 HB2 LEU A 54 27.657 -9.313 -0.434 1.00 0.00 H new ATOM 0 HB3 LEU A 54 28.555 -10.723 0.094 1.00 0.00 H new ATOM 0 HG LEU A 54 25.694 -10.230 0.953 1.00 0.00 H new ATOM 0 HD11 LEU A 54 24.980 -11.759 -0.885 1.00 0.00 H new ATOM 0 HD12 LEU A 54 25.718 -10.264 -1.510 1.00 0.00 H new ATOM 0 HD13 LEU A 54 26.651 -11.779 -1.497 1.00 0.00 H new ATOM 0 HD21 LEU A 54 25.646 -12.688 1.289 1.00 0.00 H new ATOM 0 HD22 LEU A 54 27.355 -12.776 0.801 1.00 0.00 H new ATOM 0 HD23 LEU A 54 26.896 -11.899 2.280 1.00 0.00 H new ATOM 918 N SER A 55 30.573 -9.079 2.308 1.00 0.00 N ATOM 919 CA SER A 55 31.939 -8.484 2.326 1.00 0.00 C ATOM 920 C SER A 55 33.044 -9.529 2.719 1.00 0.00 C ATOM 921 O SER A 55 32.763 -10.555 3.350 1.00 0.00 O ATOM 922 CB SER A 55 31.940 -7.285 3.312 1.00 0.00 C ATOM 923 OG SER A 55 33.127 -6.509 3.164 1.00 0.00 O ATOM 0 H SER A 55 30.455 -9.858 2.956 1.00 0.00 H new ATOM 0 HA SER A 55 32.184 -8.147 1.319 1.00 0.00 H new ATOM 0 HB2 SER A 55 31.066 -6.659 3.131 1.00 0.00 H new ATOM 0 HB3 SER A 55 31.864 -7.650 4.336 1.00 0.00 H new ATOM 0 HG SER A 55 33.359 -6.100 4.024 1.00 0.00 H new ATOM 929 N THR A 56 34.325 -9.246 2.390 1.00 0.00 N ATOM 930 CA THR A 56 35.482 -10.115 2.799 1.00 0.00 C ATOM 931 C THR A 56 35.770 -10.273 4.333 1.00 0.00 C ATOM 932 O THR A 56 36.224 -11.343 4.746 1.00 0.00 O ATOM 933 CB THR A 56 36.780 -9.742 2.014 1.00 0.00 C ATOM 934 OG1 THR A 56 37.728 -10.798 2.150 1.00 0.00 O ATOM 935 CG2 THR A 56 37.505 -8.446 2.429 1.00 0.00 C ATOM 0 H THR A 56 34.596 -8.428 1.844 1.00 0.00 H new ATOM 0 HA THR A 56 35.141 -11.111 2.516 1.00 0.00 H new ATOM 0 HB THR A 56 36.423 -9.579 0.997 1.00 0.00 H new ATOM 0 HG1 THR A 56 38.544 -10.570 1.658 1.00 0.00 H new ATOM 0 HG21 THR A 56 38.388 -8.307 1.805 1.00 0.00 H new ATOM 0 HG22 THR A 56 36.834 -7.597 2.302 1.00 0.00 H new ATOM 0 HG23 THR A 56 37.807 -8.517 3.474 1.00 0.00 H new ATOM 943 N PHE A 57 35.578 -9.223 5.151 1.00 0.00 N ATOM 944 CA PHE A 57 35.741 -9.301 6.633 1.00 0.00 C ATOM 945 C PHE A 57 34.558 -10.001 7.381 1.00 0.00 C ATOM 946 O PHE A 57 34.788 -10.918 8.174 1.00 0.00 O ATOM 947 CB PHE A 57 36.150 -7.909 7.207 1.00 0.00 C ATOM 948 CG PHE A 57 35.192 -6.708 7.032 1.00 0.00 C ATOM 949 CD1 PHE A 57 34.197 -6.445 7.981 1.00 0.00 C ATOM 950 CD2 PHE A 57 35.336 -5.846 5.939 1.00 0.00 C ATOM 951 CE1 PHE A 57 33.349 -5.351 7.828 1.00 0.00 C ATOM 952 CE2 PHE A 57 34.498 -4.742 5.797 1.00 0.00 C ATOM 953 CZ PHE A 57 33.506 -4.497 6.741 1.00 0.00 C ATOM 0 H PHE A 57 35.307 -8.298 4.817 1.00 0.00 H new ATOM 0 HA PHE A 57 36.568 -9.982 6.834 1.00 0.00 H new ATOM 0 HB2 PHE A 57 36.327 -8.034 8.275 1.00 0.00 H new ATOM 0 HB3 PHE A 57 37.104 -7.636 6.756 1.00 0.00 H new ATOM 0 HD1 PHE A 57 34.086 -7.094 8.837 1.00 0.00 H new ATOM 0 HD2 PHE A 57 36.101 -6.038 5.201 1.00 0.00 H new ATOM 0 HE1 PHE A 57 32.570 -5.166 8.553 1.00 0.00 H new ATOM 0 HE2 PHE A 57 34.618 -4.077 4.955 1.00 0.00 H new ATOM 0 HZ PHE A 57 32.856 -3.642 6.630 1.00 0.00 H new ATOM 963 N ARG A 58 33.307 -9.568 7.147 1.00 0.00 N ATOM 964 CA ARG A 58 32.099 -10.121 7.800 1.00 0.00 C ATOM 965 C ARG A 58 30.896 -10.001 6.814 1.00 0.00 C ATOM 966 O ARG A 58 30.688 -8.971 6.165 1.00 0.00 O ATOM 967 CB ARG A 58 31.916 -9.358 9.141 1.00 0.00 C ATOM 968 CG ARG A 58 30.695 -9.724 10.019 1.00 0.00 C ATOM 969 CD ARG A 58 29.393 -8.934 9.751 1.00 0.00 C ATOM 970 NE ARG A 58 29.502 -7.490 10.103 1.00 0.00 N ATOM 971 CZ ARG A 58 29.698 -6.493 9.240 1.00 0.00 C ATOM 972 NH1 ARG A 58 29.796 -6.634 7.936 1.00 0.00 N ATOM 973 NH2 ARG A 58 29.799 -5.289 9.724 1.00 0.00 N ATOM 0 H ARG A 58 33.100 -8.815 6.491 1.00 0.00 H new ATOM 0 HA ARG A 58 32.181 -11.182 8.037 1.00 0.00 H new ATOM 0 HB2 ARG A 58 32.815 -9.510 9.738 1.00 0.00 H new ATOM 0 HB3 ARG A 58 31.859 -8.293 8.915 1.00 0.00 H new ATOM 0 HG2 ARG A 58 30.484 -10.785 9.886 1.00 0.00 H new ATOM 0 HG3 ARG A 58 30.971 -9.583 11.064 1.00 0.00 H new ATOM 0 HD2 ARG A 58 29.130 -9.026 8.697 1.00 0.00 H new ATOM 0 HD3 ARG A 58 28.580 -9.381 10.323 1.00 0.00 H new ATOM 0 HE ARG A 58 29.420 -7.243 11.089 1.00 0.00 H new ATOM 0 HH11 ARG A 58 29.722 -7.561 7.516 1.00 0.00 H new ATOM 0 HH12 ARG A 58 29.946 -5.817 7.345 1.00 0.00 H new ATOM 0 HH21 ARG A 58 29.728 -5.136 10.730 1.00 0.00 H new ATOM 0 HH22 ARG A 58 29.949 -4.498 9.097 1.00 0.00 H new ATOM 987 N ASN A 59 30.069 -11.055 6.744 1.00 0.00 N ATOM 988 CA ASN A 59 28.810 -11.034 5.943 1.00 0.00 C ATOM 989 C ASN A 59 27.614 -10.826 6.918 1.00 0.00 C ATOM 990 O ASN A 59 27.359 -11.662 7.789 1.00 0.00 O ATOM 991 CB ASN A 59 28.659 -12.341 5.126 1.00 0.00 C ATOM 992 CG ASN A 59 29.692 -12.532 4.008 1.00 0.00 C ATOM 993 OD1 ASN A 59 29.612 -11.934 2.943 1.00 0.00 O ATOM 994 ND2 ASN A 59 30.704 -13.339 4.203 1.00 0.00 N ATOM 0 H ASN A 59 30.239 -11.937 7.227 1.00 0.00 H new ATOM 0 HA ASN A 59 28.835 -10.215 5.224 1.00 0.00 H new ATOM 0 HB2 ASN A 59 28.725 -13.188 5.809 1.00 0.00 H new ATOM 0 HB3 ASN A 59 27.662 -12.363 4.686 1.00 0.00 H new ATOM 0 HD21 ASN A 59 31.407 -13.460 3.474 1.00 0.00 H new ATOM 0 HD22 ASN A 59 30.789 -13.847 5.084 1.00 0.00 H new ATOM 1001 N TYR A 60 26.918 -9.688 6.796 1.00 0.00 N ATOM 1002 CA TYR A 60 25.846 -9.289 7.752 1.00 0.00 C ATOM 1003 C TYR A 60 24.475 -9.886 7.318 1.00 0.00 C ATOM 1004 O TYR A 60 24.002 -9.604 6.215 1.00 0.00 O ATOM 1005 CB TYR A 60 25.808 -7.737 7.867 1.00 0.00 C ATOM 1006 CG TYR A 60 25.257 -7.138 9.181 1.00 0.00 C ATOM 1007 CD1 TYR A 60 23.988 -7.468 9.682 1.00 0.00 C ATOM 1008 CD2 TYR A 60 26.016 -6.177 9.855 1.00 0.00 C ATOM 1009 CE1 TYR A 60 23.510 -6.864 10.843 1.00 0.00 C ATOM 1010 CE2 TYR A 60 25.524 -5.560 11.000 1.00 0.00 C ATOM 1011 CZ TYR A 60 24.267 -5.899 11.488 1.00 0.00 C ATOM 1012 OH TYR A 60 23.761 -5.257 12.584 1.00 0.00 O ATOM 0 H TYR A 60 27.071 -9.016 6.044 1.00 0.00 H new ATOM 0 HA TYR A 60 26.063 -9.693 8.741 1.00 0.00 H new ATOM 0 HB2 TYR A 60 26.822 -7.363 7.725 1.00 0.00 H new ATOM 0 HB3 TYR A 60 25.208 -7.352 7.043 1.00 0.00 H new ATOM 0 HD1 TYR A 60 23.379 -8.194 9.165 1.00 0.00 H new ATOM 0 HD2 TYR A 60 26.994 -5.911 9.483 1.00 0.00 H new ATOM 0 HE1 TYR A 60 22.547 -7.149 11.241 1.00 0.00 H new ATOM 0 HE2 TYR A 60 26.119 -4.817 11.511 1.00 0.00 H new ATOM 0 HH TYR A 60 24.419 -4.611 12.918 1.00 0.00 H new ATOM 1022 N ILE A 61 23.841 -10.687 8.187 1.00 0.00 N ATOM 1023 CA ILE A 61 22.548 -11.365 7.880 1.00 0.00 C ATOM 1024 C ILE A 61 21.460 -10.765 8.832 1.00 0.00 C ATOM 1025 O ILE A 61 21.370 -11.157 10.000 1.00 0.00 O ATOM 1026 CB ILE A 61 22.711 -12.929 8.001 1.00 0.00 C ATOM 1027 CG1 ILE A 61 23.875 -13.570 7.180 1.00 0.00 C ATOM 1028 CG2 ILE A 61 21.398 -13.702 7.714 1.00 0.00 C ATOM 1029 CD1 ILE A 61 23.853 -13.369 5.653 1.00 0.00 C ATOM 0 H ILE A 61 24.198 -10.890 9.121 1.00 0.00 H new ATOM 0 HA ILE A 61 22.231 -11.187 6.852 1.00 0.00 H new ATOM 0 HB ILE A 61 22.984 -13.039 9.050 1.00 0.00 H new ATOM 0 HG12 ILE A 61 24.816 -13.171 7.560 1.00 0.00 H new ATOM 0 HG13 ILE A 61 23.879 -14.642 7.380 1.00 0.00 H new ATOM 0 HG21 ILE A 61 21.577 -14.773 7.814 1.00 0.00 H new ATOM 0 HG22 ILE A 61 20.632 -13.394 8.426 1.00 0.00 H new ATOM 0 HG23 ILE A 61 21.061 -13.483 6.701 1.00 0.00 H new ATOM 0 HD11 ILE A 61 24.716 -13.864 5.208 1.00 0.00 H new ATOM 0 HD12 ILE A 61 22.938 -13.797 5.243 1.00 0.00 H new ATOM 0 HD13 ILE A 61 23.889 -12.304 5.426 1.00 0.00 H new ATOM 1041 N MET A 62 20.603 -9.851 8.336 1.00 0.00 N ATOM 1042 CA MET A 62 19.395 -9.402 9.090 1.00 0.00 C ATOM 1043 C MET A 62 18.162 -10.239 8.626 1.00 0.00 C ATOM 1044 O MET A 62 17.462 -9.866 7.681 1.00 0.00 O ATOM 1045 CB MET A 62 19.155 -7.877 8.928 1.00 0.00 C ATOM 1046 CG MET A 62 20.129 -6.944 9.665 1.00 0.00 C ATOM 1047 SD MET A 62 19.569 -5.229 9.558 1.00 0.00 S ATOM 1048 CE MET A 62 18.384 -5.158 10.918 1.00 0.00 C ATOM 0 H MET A 62 20.715 -9.407 7.425 1.00 0.00 H new ATOM 0 HA MET A 62 19.554 -9.573 10.155 1.00 0.00 H new ATOM 0 HB2 MET A 62 19.192 -7.637 7.865 1.00 0.00 H new ATOM 0 HB3 MET A 62 18.145 -7.653 9.270 1.00 0.00 H new ATOM 0 HG2 MET A 62 20.207 -7.243 10.710 1.00 0.00 H new ATOM 0 HG3 MET A 62 21.126 -7.035 9.233 1.00 0.00 H new ATOM 0 HE1 MET A 62 17.878 -4.193 10.909 1.00 0.00 H new ATOM 0 HE2 MET A 62 17.649 -5.954 10.802 1.00 0.00 H new ATOM 0 HE3 MET A 62 18.909 -5.284 11.865 1.00 0.00 H new ATOM 1058 N ASP A 63 17.905 -11.371 9.304 1.00 0.00 N ATOM 1059 CA ASP A 63 16.751 -12.259 9.021 1.00 0.00 C ATOM 1060 C ASP A 63 15.534 -11.941 9.945 1.00 0.00 C ATOM 1061 O ASP A 63 15.587 -12.244 11.142 1.00 0.00 O ATOM 1062 CB ASP A 63 17.240 -13.733 9.124 1.00 0.00 C ATOM 1063 CG ASP A 63 17.998 -14.254 10.358 1.00 0.00 C ATOM 1064 OD1 ASP A 63 18.984 -14.979 10.266 1.00 0.00 O ATOM 1065 OD2 ASP A 63 17.460 -13.839 11.544 1.00 0.00 O ATOM 0 H ASP A 63 18.492 -11.702 10.069 1.00 0.00 H new ATOM 0 HA ASP A 63 16.379 -12.087 8.011 1.00 0.00 H new ATOM 0 HB2 ASP A 63 16.360 -14.366 9.005 1.00 0.00 H new ATOM 0 HB3 ASP A 63 17.881 -13.913 8.261 1.00 0.00 H new ATOM 1071 N PHE A 64 14.454 -11.341 9.414 1.00 0.00 N ATOM 1072 CA PHE A 64 13.355 -10.790 10.266 1.00 0.00 C ATOM 1073 C PHE A 64 11.945 -10.871 9.606 1.00 0.00 C ATOM 1074 O PHE A 64 11.769 -10.600 8.416 1.00 0.00 O ATOM 1075 CB PHE A 64 13.695 -9.333 10.713 1.00 0.00 C ATOM 1076 CG PHE A 64 13.912 -8.284 9.602 1.00 0.00 C ATOM 1077 CD1 PHE A 64 12.828 -7.697 8.940 1.00 0.00 C ATOM 1078 CD2 PHE A 64 15.210 -8.012 9.164 1.00 0.00 C ATOM 1079 CE1 PHE A 64 13.043 -6.894 7.825 1.00 0.00 C ATOM 1080 CE2 PHE A 64 15.422 -7.203 8.051 1.00 0.00 C ATOM 1081 CZ PHE A 64 14.337 -6.648 7.380 1.00 0.00 C ATOM 0 H PHE A 64 14.308 -11.220 8.412 1.00 0.00 H new ATOM 0 HA PHE A 64 13.295 -11.429 11.147 1.00 0.00 H new ATOM 0 HB2 PHE A 64 12.889 -8.981 11.357 1.00 0.00 H new ATOM 0 HB3 PHE A 64 14.597 -9.369 11.323 1.00 0.00 H new ATOM 0 HD1 PHE A 64 11.823 -7.868 9.296 1.00 0.00 H new ATOM 0 HD2 PHE A 64 16.054 -8.432 9.692 1.00 0.00 H new ATOM 0 HE1 PHE A 64 12.203 -6.460 7.303 1.00 0.00 H new ATOM 0 HE2 PHE A 64 16.427 -7.007 7.709 1.00 0.00 H new ATOM 0 HZ PHE A 64 14.500 -6.025 6.513 1.00 0.00 H new ATOM 1091 N GLN A 65 10.917 -11.149 10.422 1.00 0.00 N ATOM 1092 CA GLN A 65 9.497 -10.907 10.055 1.00 0.00 C ATOM 1093 C GLN A 65 9.136 -9.399 10.251 1.00 0.00 C ATOM 1094 O GLN A 65 9.277 -8.851 11.350 1.00 0.00 O ATOM 1095 CB GLN A 65 8.587 -11.827 10.916 1.00 0.00 C ATOM 1096 CG GLN A 65 8.440 -13.301 10.449 1.00 0.00 C ATOM 1097 CD GLN A 65 9.623 -14.252 10.695 1.00 0.00 C ATOM 1098 OE1 GLN A 65 10.596 -13.973 11.389 1.00 0.00 O ATOM 1099 NE2 GLN A 65 9.564 -15.438 10.141 1.00 0.00 N ATOM 0 H GLN A 65 11.037 -11.547 11.354 1.00 0.00 H new ATOM 0 HA GLN A 65 9.339 -11.146 9.003 1.00 0.00 H new ATOM 0 HB2 GLN A 65 8.974 -11.830 11.935 1.00 0.00 H new ATOM 0 HB3 GLN A 65 7.593 -11.382 10.954 1.00 0.00 H new ATOM 0 HG2 GLN A 65 7.563 -13.722 10.941 1.00 0.00 H new ATOM 0 HG3 GLN A 65 8.232 -13.294 9.379 1.00 0.00 H new ATOM 0 HE21 GLN A 65 8.764 -15.690 9.560 1.00 0.00 H new ATOM 0 HE22 GLN A 65 10.318 -16.109 10.290 1.00 0.00 H new ATOM 1108 N VAL A 66 8.653 -8.733 9.186 1.00 0.00 N ATOM 1109 CA VAL A 66 8.282 -7.284 9.222 1.00 0.00 C ATOM 1110 C VAL A 66 7.052 -7.056 10.175 1.00 0.00 C ATOM 1111 O VAL A 66 5.971 -7.617 9.967 1.00 0.00 O ATOM 1112 CB VAL A 66 8.045 -6.736 7.771 1.00 0.00 C ATOM 1113 CG1 VAL A 66 7.738 -5.222 7.763 1.00 0.00 C ATOM 1114 CG2 VAL A 66 9.231 -6.913 6.791 1.00 0.00 C ATOM 0 H VAL A 66 8.505 -9.170 8.276 1.00 0.00 H new ATOM 0 HA VAL A 66 9.111 -6.710 9.637 1.00 0.00 H new ATOM 0 HB VAL A 66 7.203 -7.341 7.435 1.00 0.00 H new ATOM 0 HG11 VAL A 66 7.581 -4.888 6.737 1.00 0.00 H new ATOM 0 HG12 VAL A 66 6.839 -5.030 8.349 1.00 0.00 H new ATOM 0 HG13 VAL A 66 8.577 -4.678 8.197 1.00 0.00 H new ATOM 0 HG21 VAL A 66 8.963 -6.501 5.818 1.00 0.00 H new ATOM 0 HG22 VAL A 66 10.105 -6.389 7.179 1.00 0.00 H new ATOM 0 HG23 VAL A 66 9.461 -7.973 6.686 1.00 0.00 H new ATOM 1124 N GLY A 67 7.258 -6.274 11.246 1.00 0.00 N ATOM 1125 CA GLY A 67 6.365 -6.285 12.439 1.00 0.00 C ATOM 1126 C GLY A 67 7.006 -6.772 13.763 1.00 0.00 C ATOM 1127 O GLY A 67 6.763 -6.165 14.808 1.00 0.00 O ATOM 0 H GLY A 67 8.037 -5.619 11.320 1.00 0.00 H new ATOM 0 HA2 GLY A 67 5.985 -5.275 12.593 1.00 0.00 H new ATOM 0 HA3 GLY A 67 5.506 -6.919 12.219 1.00 0.00 H new ATOM 1131 N LYS A 68 7.767 -7.880 13.745 1.00 0.00 N ATOM 1132 CA LYS A 68 8.319 -8.515 14.976 1.00 0.00 C ATOM 1133 C LYS A 68 9.636 -7.836 15.486 1.00 0.00 C ATOM 1134 O LYS A 68 10.493 -7.422 14.697 1.00 0.00 O ATOM 1135 CB LYS A 68 8.561 -10.032 14.721 1.00 0.00 C ATOM 1136 CG LYS A 68 7.314 -10.875 14.352 1.00 0.00 C ATOM 1137 CD LYS A 68 7.545 -12.392 14.504 1.00 0.00 C ATOM 1138 CE LYS A 68 6.343 -13.215 14.014 1.00 0.00 C ATOM 1139 NZ LYS A 68 6.647 -14.656 14.115 1.00 0.00 N ATOM 0 H LYS A 68 8.022 -8.366 12.885 1.00 0.00 H new ATOM 0 HA LYS A 68 7.577 -8.379 15.763 1.00 0.00 H new ATOM 0 HB2 LYS A 68 9.291 -10.131 13.918 1.00 0.00 H new ATOM 0 HB3 LYS A 68 9.011 -10.462 15.616 1.00 0.00 H new ATOM 0 HG2 LYS A 68 6.479 -10.575 14.985 1.00 0.00 H new ATOM 0 HG3 LYS A 68 7.027 -10.658 13.323 1.00 0.00 H new ATOM 0 HD2 LYS A 68 8.434 -12.680 13.942 1.00 0.00 H new ATOM 0 HD3 LYS A 68 7.740 -12.625 15.551 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.461 -12.978 14.610 1.00 0.00 H new ATOM 0 HE3 LYS A 68 6.110 -12.955 12.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 5.830 -15.207 13.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 7.477 -14.878 13.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 6.849 -14.900 15.106 1.00 0.00 H new ATOM 1152 N GLU A 69 9.808 -7.766 16.822 1.00 0.00 N ATOM 1153 CA GLU A 69 11.043 -7.217 17.447 1.00 0.00 C ATOM 1154 C GLU A 69 12.060 -8.352 17.799 1.00 0.00 C ATOM 1155 O GLU A 69 11.813 -9.161 18.699 1.00 0.00 O ATOM 1156 CB GLU A 69 10.640 -6.340 18.662 1.00 0.00 C ATOM 1157 CG GLU A 69 11.820 -5.509 19.227 1.00 0.00 C ATOM 1158 CD GLU A 69 11.435 -4.404 20.201 1.00 0.00 C ATOM 1159 OE1 GLU A 69 11.318 -3.226 19.876 1.00 0.00 O ATOM 1160 OE2 GLU A 69 11.258 -4.866 21.470 1.00 0.00 O ATOM 0 H GLU A 69 9.110 -8.082 17.495 1.00 0.00 H new ATOM 0 HA GLU A 69 11.572 -6.580 16.738 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.837 -5.665 18.366 1.00 0.00 H new ATOM 0 HB3 GLU A 69 10.244 -6.981 19.450 1.00 0.00 H new ATOM 0 HG2 GLU A 69 12.512 -6.186 19.728 1.00 0.00 H new ATOM 0 HG3 GLU A 69 12.360 -5.062 18.392 1.00 0.00 H new ATOM 1168 N PHE A 70 13.204 -8.398 17.092 1.00 0.00 N ATOM 1169 CA PHE A 70 14.244 -9.454 17.281 1.00 0.00 C ATOM 1170 C PHE A 70 15.520 -8.922 18.011 1.00 0.00 C ATOM 1171 O PHE A 70 15.989 -7.814 17.738 1.00 0.00 O ATOM 1172 CB PHE A 70 14.547 -10.117 15.900 1.00 0.00 C ATOM 1173 CG PHE A 70 15.426 -9.348 14.888 1.00 0.00 C ATOM 1174 CD1 PHE A 70 14.873 -8.364 14.061 1.00 0.00 C ATOM 1175 CD2 PHE A 70 16.793 -9.636 14.789 1.00 0.00 C ATOM 1176 CE1 PHE A 70 15.673 -7.683 13.147 1.00 0.00 C ATOM 1177 CE2 PHE A 70 17.588 -8.964 13.864 1.00 0.00 C ATOM 1178 CZ PHE A 70 17.026 -7.997 13.038 1.00 0.00 C ATOM 0 H PHE A 70 13.443 -7.713 16.375 1.00 0.00 H new ATOM 0 HA PHE A 70 13.857 -10.221 17.951 1.00 0.00 H new ATOM 0 HB2 PHE A 70 15.026 -11.077 16.092 1.00 0.00 H new ATOM 0 HB3 PHE A 70 13.593 -10.327 15.417 1.00 0.00 H new ATOM 0 HD1 PHE A 70 13.821 -8.132 14.132 1.00 0.00 H new ATOM 0 HD2 PHE A 70 17.233 -10.383 15.433 1.00 0.00 H new ATOM 0 HE1 PHE A 70 15.245 -6.912 12.523 1.00 0.00 H new ATOM 0 HE2 PHE A 70 18.641 -9.194 13.788 1.00 0.00 H new ATOM 0 HZ PHE A 70 17.640 -7.488 12.310 1.00 0.00 H new ATOM 1188 N GLU A 71 16.145 -9.727 18.887 1.00 0.00 N ATOM 1189 CA GLU A 71 17.472 -9.391 19.477 1.00 0.00 C ATOM 1190 C GLU A 71 18.631 -9.502 18.428 1.00 0.00 C ATOM 1191 O GLU A 71 18.939 -10.591 17.932 1.00 0.00 O ATOM 1192 CB GLU A 71 17.724 -10.209 20.781 1.00 0.00 C ATOM 1193 CG GLU A 71 17.812 -11.761 20.723 1.00 0.00 C ATOM 1194 CD GLU A 71 16.473 -12.496 20.618 1.00 0.00 C ATOM 1195 OE1 GLU A 71 15.805 -12.563 19.589 1.00 0.00 O ATOM 1196 OE2 GLU A 71 16.096 -13.061 21.799 1.00 0.00 O ATOM 0 H GLU A 71 15.761 -10.616 19.208 1.00 0.00 H new ATOM 0 HA GLU A 71 17.458 -8.341 19.770 1.00 0.00 H new ATOM 0 HB2 GLU A 71 18.657 -9.848 21.215 1.00 0.00 H new ATOM 0 HB3 GLU A 71 16.928 -9.956 21.481 1.00 0.00 H new ATOM 0 HG2 GLU A 71 18.427 -12.040 19.868 1.00 0.00 H new ATOM 0 HG3 GLU A 71 18.329 -12.111 21.616 1.00 0.00 H new ATOM 1204 N GLU A 72 19.272 -8.368 18.082 1.00 0.00 N ATOM 1205 CA GLU A 72 20.329 -8.332 17.031 1.00 0.00 C ATOM 1206 C GLU A 72 21.705 -8.833 17.591 1.00 0.00 C ATOM 1207 O GLU A 72 22.586 -8.053 17.960 1.00 0.00 O ATOM 1208 CB GLU A 72 20.350 -6.897 16.420 1.00 0.00 C ATOM 1209 CG GLU A 72 20.888 -6.765 14.973 1.00 0.00 C ATOM 1210 CD GLU A 72 22.345 -7.162 14.740 1.00 0.00 C ATOM 1211 OE1 GLU A 72 23.307 -6.529 15.168 1.00 0.00 O ATOM 1212 OE2 GLU A 72 22.448 -8.294 13.988 1.00 0.00 O ATOM 0 H GLU A 72 19.082 -7.462 18.510 1.00 0.00 H new ATOM 0 HA GLU A 72 20.109 -9.028 16.221 1.00 0.00 H new ATOM 0 HB2 GLU A 72 19.334 -6.503 16.443 1.00 0.00 H new ATOM 0 HB3 GLU A 72 20.954 -6.260 17.067 1.00 0.00 H new ATOM 0 HG2 GLU A 72 20.262 -7.374 14.321 1.00 0.00 H new ATOM 0 HG3 GLU A 72 20.764 -5.729 14.658 1.00 0.00 H new ATOM 1220 N ASP A 73 21.849 -10.165 17.662 1.00 0.00 N ATOM 1221 CA ASP A 73 23.102 -10.847 18.096 1.00 0.00 C ATOM 1222 C ASP A 73 23.814 -11.636 16.945 1.00 0.00 C ATOM 1223 O ASP A 73 25.047 -11.613 16.891 1.00 0.00 O ATOM 1224 CB ASP A 73 22.743 -11.713 19.334 1.00 0.00 C ATOM 1225 CG ASP A 73 23.922 -12.378 20.047 1.00 0.00 C ATOM 1226 OD1 ASP A 73 24.109 -13.590 20.041 1.00 0.00 O ATOM 1227 OD2 ASP A 73 24.728 -11.476 20.683 1.00 0.00 O ATOM 0 H ASP A 73 21.100 -10.814 17.420 1.00 0.00 H new ATOM 0 HA ASP A 73 23.855 -10.110 18.375 1.00 0.00 H new ATOM 0 HB2 ASP A 73 22.216 -11.085 20.052 1.00 0.00 H new ATOM 0 HB3 ASP A 73 22.047 -12.491 19.020 1.00 0.00 H new ATOM 1233 N LEU A 74 23.085 -12.325 16.037 1.00 0.00 N ATOM 1234 CA LEU A 74 23.688 -12.974 14.841 1.00 0.00 C ATOM 1235 C LEU A 74 24.194 -11.918 13.800 1.00 0.00 C ATOM 1236 O LEU A 74 23.409 -11.297 13.076 1.00 0.00 O ATOM 1237 CB LEU A 74 22.717 -14.065 14.290 1.00 0.00 C ATOM 1238 CG LEU A 74 21.410 -13.622 13.560 1.00 0.00 C ATOM 1239 CD1 LEU A 74 21.556 -13.695 12.027 1.00 0.00 C ATOM 1240 CD2 LEU A 74 20.200 -14.479 13.970 1.00 0.00 C ATOM 0 H LEU A 74 22.075 -12.448 16.107 1.00 0.00 H new ATOM 0 HA LEU A 74 24.599 -13.506 15.117 1.00 0.00 H new ATOM 0 HB2 LEU A 74 23.283 -14.690 13.599 1.00 0.00 H new ATOM 0 HB3 LEU A 74 22.426 -14.699 15.128 1.00 0.00 H new ATOM 0 HG LEU A 74 21.241 -12.589 13.863 1.00 0.00 H new ATOM 0 HD11 LEU A 74 20.625 -13.379 11.557 1.00 0.00 H new ATOM 0 HD12 LEU A 74 22.365 -13.039 11.707 1.00 0.00 H new ATOM 0 HD13 LEU A 74 21.782 -14.720 11.731 1.00 0.00 H new ATOM 0 HD21 LEU A 74 19.313 -14.135 13.438 1.00 0.00 H new ATOM 0 HD22 LEU A 74 20.392 -15.522 13.720 1.00 0.00 H new ATOM 0 HD23 LEU A 74 20.037 -14.388 15.044 1.00 0.00 H new ATOM 1252 N THR A 75 25.521 -11.685 13.765 1.00 0.00 N ATOM 1253 CA THR A 75 26.179 -10.679 12.869 1.00 0.00 C ATOM 1254 C THR A 75 25.957 -9.203 13.343 1.00 0.00 C ATOM 1255 O THR A 75 24.814 -8.754 13.465 1.00 0.00 O ATOM 1256 CB THR A 75 25.909 -10.849 11.339 1.00 0.00 C ATOM 1257 OG1 THR A 75 24.563 -10.531 11.007 1.00 0.00 O ATOM 1258 CG2 THR A 75 26.201 -12.246 10.770 1.00 0.00 C ATOM 0 H THR A 75 26.182 -12.187 14.357 1.00 0.00 H new ATOM 0 HA THR A 75 27.239 -10.908 12.980 1.00 0.00 H new ATOM 0 HB THR A 75 26.614 -10.152 10.886 1.00 0.00 H new ATOM 0 HG1 THR A 75 24.031 -10.462 11.827 1.00 0.00 H new ATOM 0 HG21 THR A 75 25.981 -12.257 9.702 1.00 0.00 H new ATOM 0 HG22 THR A 75 27.252 -12.490 10.927 1.00 0.00 H new ATOM 0 HG23 THR A 75 25.578 -12.983 11.277 1.00 0.00 H new ATOM 1266 N GLY A 76 27.037 -8.448 13.603 1.00 0.00 N ATOM 1267 CA GLY A 76 26.938 -7.037 14.071 1.00 0.00 C ATOM 1268 C GLY A 76 27.978 -6.070 13.461 1.00 0.00 C ATOM 1269 O GLY A 76 28.865 -6.453 12.691 1.00 0.00 O ATOM 0 H GLY A 76 27.995 -8.783 13.500 1.00 0.00 H new ATOM 0 HA2 GLY A 76 25.940 -6.664 13.842 1.00 0.00 H new ATOM 0 HA3 GLY A 76 27.043 -7.022 15.156 1.00 0.00 H new ATOM 1273 N ILE A 77 27.858 -4.786 13.838 1.00 0.00 N ATOM 1274 CA ILE A 77 28.893 -3.747 13.520 1.00 0.00 C ATOM 1275 C ILE A 77 30.030 -3.852 14.600 1.00 0.00 C ATOM 1276 O ILE A 77 31.055 -4.495 14.365 1.00 0.00 O ATOM 1277 CB ILE A 77 28.237 -2.323 13.338 1.00 0.00 C ATOM 1278 CG1 ILE A 77 27.138 -2.181 12.244 1.00 0.00 C ATOM 1279 CG2 ILE A 77 29.301 -1.221 13.133 1.00 0.00 C ATOM 1280 CD1 ILE A 77 27.562 -2.453 10.789 1.00 0.00 C ATOM 0 H ILE A 77 27.061 -4.428 14.364 1.00 0.00 H new ATOM 0 HA ILE A 77 29.364 -3.923 12.553 1.00 0.00 H new ATOM 0 HB ILE A 77 27.713 -2.194 14.285 1.00 0.00 H new ATOM 0 HG12 ILE A 77 26.323 -2.861 12.492 1.00 0.00 H new ATOM 0 HG13 ILE A 77 26.736 -1.169 12.296 1.00 0.00 H new ATOM 0 HG21 ILE A 77 28.807 -0.257 13.012 1.00 0.00 H new ATOM 0 HG22 ILE A 77 29.959 -1.185 14.001 1.00 0.00 H new ATOM 0 HG23 ILE A 77 29.888 -1.443 12.242 1.00 0.00 H new ATOM 0 HD11 ILE A 77 26.705 -2.320 10.129 1.00 0.00 H new ATOM 0 HD12 ILE A 77 28.351 -1.757 10.504 1.00 0.00 H new ATOM 0 HD13 ILE A 77 27.931 -3.475 10.703 1.00 0.00 H new ATOM 1292 N ASP A 78 29.808 -3.281 15.797 1.00 0.00 N ATOM 1293 CA ASP A 78 30.446 -3.760 17.049 1.00 0.00 C ATOM 1294 C ASP A 78 29.574 -4.899 17.699 1.00 0.00 C ATOM 1295 O ASP A 78 28.408 -5.117 17.337 1.00 0.00 O ATOM 1296 CB ASP A 78 30.622 -2.483 17.922 1.00 0.00 C ATOM 1297 CG ASP A 78 31.442 -2.647 19.202 1.00 0.00 C ATOM 1298 OD1 ASP A 78 32.313 -3.499 19.358 1.00 0.00 O ATOM 1299 OD2 ASP A 78 31.087 -1.750 20.160 1.00 0.00 O ATOM 0 H ASP A 78 29.188 -2.482 15.930 1.00 0.00 H new ATOM 0 HA ASP A 78 31.419 -4.229 16.904 1.00 0.00 H new ATOM 0 HB2 ASP A 78 31.092 -1.712 17.311 1.00 0.00 H new ATOM 0 HB3 ASP A 78 29.633 -2.115 18.194 1.00 0.00 H new ATOM 1305 N ASP A 79 30.127 -5.629 18.686 1.00 0.00 N ATOM 1306 CA ASP A 79 29.382 -6.704 19.413 1.00 0.00 C ATOM 1307 C ASP A 79 28.358 -6.119 20.449 1.00 0.00 C ATOM 1308 O ASP A 79 28.607 -6.069 21.657 1.00 0.00 O ATOM 1309 CB ASP A 79 30.403 -7.686 20.054 1.00 0.00 C ATOM 1310 CG ASP A 79 31.200 -8.541 19.066 1.00 0.00 C ATOM 1311 OD1 ASP A 79 32.332 -8.254 18.688 1.00 0.00 O ATOM 1312 OD2 ASP A 79 30.504 -9.644 18.657 1.00 0.00 O ATOM 0 H ASP A 79 31.087 -5.503 19.007 1.00 0.00 H new ATOM 0 HA ASP A 79 28.773 -7.261 18.702 1.00 0.00 H new ATOM 0 HB2 ASP A 79 31.104 -7.111 20.659 1.00 0.00 H new ATOM 0 HB3 ASP A 79 29.867 -8.350 20.732 1.00 0.00 H new ATOM 1318 N ARG A 80 27.201 -5.663 19.936 1.00 0.00 N ATOM 1319 CA ARG A 80 26.196 -4.899 20.720 1.00 0.00 C ATOM 1320 C ARG A 80 24.771 -5.438 20.397 1.00 0.00 C ATOM 1321 O ARG A 80 24.267 -5.293 19.279 1.00 0.00 O ATOM 1322 CB ARG A 80 26.392 -3.390 20.393 1.00 0.00 C ATOM 1323 CG ARG A 80 25.484 -2.361 21.117 1.00 0.00 C ATOM 1324 CD ARG A 80 25.490 -2.419 22.661 1.00 0.00 C ATOM 1325 NE ARG A 80 24.324 -3.180 23.191 1.00 0.00 N ATOM 1326 CZ ARG A 80 24.165 -3.549 24.460 1.00 0.00 C ATOM 1327 NH1 ARG A 80 25.018 -3.290 25.426 1.00 0.00 N ATOM 1328 NH2 ARG A 80 23.088 -4.214 24.766 1.00 0.00 N ATOM 0 H ARG A 80 26.930 -5.811 18.964 1.00 0.00 H new ATOM 0 HA ARG A 80 26.324 -5.023 21.795 1.00 0.00 H new ATOM 0 HB2 ARG A 80 27.428 -3.133 20.613 1.00 0.00 H new ATOM 0 HB3 ARG A 80 26.253 -3.261 19.320 1.00 0.00 H new ATOM 0 HG2 ARG A 80 25.787 -1.360 20.810 1.00 0.00 H new ATOM 0 HG3 ARG A 80 24.460 -2.504 20.772 1.00 0.00 H new ATOM 0 HD2 ARG A 80 26.414 -2.885 23.004 1.00 0.00 H new ATOM 0 HD3 ARG A 80 25.476 -1.406 23.063 1.00 0.00 H new ATOM 0 HE ARG A 80 23.591 -3.438 22.530 1.00 0.00 H new ATOM 0 HH11 ARG A 80 25.873 -2.772 25.226 1.00 0.00 H new ATOM 0 HH12 ARG A 80 24.825 -3.607 26.376 1.00 0.00 H new ATOM 0 HH21 ARG A 80 22.402 -4.434 24.044 1.00 0.00 H new ATOM 0 HH22 ARG A 80 22.930 -4.514 25.728 1.00 0.00 H new ATOM 1342 N LYS A 81 24.113 -6.037 21.404 1.00 0.00 N ATOM 1343 CA LYS A 81 22.729 -6.569 21.269 1.00 0.00 C ATOM 1344 C LYS A 81 21.663 -5.428 21.255 1.00 0.00 C ATOM 1345 O LYS A 81 21.649 -4.566 22.142 1.00 0.00 O ATOM 1346 CB LYS A 81 22.453 -7.555 22.437 1.00 0.00 C ATOM 1347 CG LYS A 81 23.236 -8.887 22.372 1.00 0.00 C ATOM 1348 CD LYS A 81 22.944 -9.854 23.539 1.00 0.00 C ATOM 1349 CE LYS A 81 23.582 -9.425 24.873 1.00 0.00 C ATOM 1350 NZ LYS A 81 23.261 -10.406 25.928 1.00 0.00 N ATOM 0 H LYS A 81 24.515 -6.170 22.332 1.00 0.00 H new ATOM 0 HA LYS A 81 22.650 -7.088 20.314 1.00 0.00 H new ATOM 0 HB2 LYS A 81 22.692 -7.057 23.376 1.00 0.00 H new ATOM 0 HB3 LYS A 81 21.387 -7.779 22.458 1.00 0.00 H new ATOM 0 HG2 LYS A 81 23.000 -9.388 21.433 1.00 0.00 H new ATOM 0 HG3 LYS A 81 24.303 -8.667 22.357 1.00 0.00 H new ATOM 0 HD2 LYS A 81 21.865 -9.934 23.672 1.00 0.00 H new ATOM 0 HD3 LYS A 81 23.307 -10.847 23.276 1.00 0.00 H new ATOM 0 HE2 LYS A 81 24.663 -9.343 24.758 1.00 0.00 H new ATOM 0 HE3 LYS A 81 23.216 -8.439 25.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 23.696 -10.107 26.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 22.229 -10.463 26.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 23.631 -11.340 25.658 1.00 0.00 H new ATOM 1363 N CYS A 82 20.782 -5.426 20.242 1.00 0.00 N ATOM 1364 CA CYS A 82 19.707 -4.405 20.116 1.00 0.00 C ATOM 1365 C CYS A 82 18.352 -5.059 19.710 1.00 0.00 C ATOM 1366 O CYS A 82 18.244 -5.734 18.679 1.00 0.00 O ATOM 1367 CB CYS A 82 20.162 -3.333 19.111 1.00 0.00 C ATOM 1368 SG CYS A 82 21.587 -2.407 19.779 1.00 0.00 S ATOM 0 H CYS A 82 20.786 -6.118 19.492 1.00 0.00 H new ATOM 0 HA CYS A 82 19.534 -3.929 21.081 1.00 0.00 H new ATOM 0 HB2 CYS A 82 20.435 -3.803 18.166 1.00 0.00 H new ATOM 0 HB3 CYS A 82 19.340 -2.648 18.901 1.00 0.00 H new ATOM 0 HG CYS A 82 21.936 -2.914 20.924 1.00 0.00 H new ATOM 1374 N MET A 83 17.301 -4.820 20.512 1.00 0.00 N ATOM 1375 CA MET A 83 15.925 -5.320 20.234 1.00 0.00 C ATOM 1376 C MET A 83 15.299 -4.542 19.036 1.00 0.00 C ATOM 1377 O MET A 83 14.939 -3.368 19.143 1.00 0.00 O ATOM 1378 CB MET A 83 15.075 -5.204 21.529 1.00 0.00 C ATOM 1379 CG MET A 83 15.392 -6.250 22.620 1.00 0.00 C ATOM 1380 SD MET A 83 15.144 -7.933 22.006 1.00 0.00 S ATOM 1381 CE MET A 83 13.366 -8.150 22.210 1.00 0.00 C ATOM 0 H MET A 83 17.371 -4.277 21.372 1.00 0.00 H new ATOM 0 HA MET A 83 15.954 -6.370 19.943 1.00 0.00 H new ATOM 0 HB2 MET A 83 15.218 -4.209 21.950 1.00 0.00 H new ATOM 0 HB3 MET A 83 14.022 -5.289 21.262 1.00 0.00 H new ATOM 0 HG2 MET A 83 16.423 -6.130 22.954 1.00 0.00 H new ATOM 0 HG3 MET A 83 14.754 -6.079 23.487 1.00 0.00 H new ATOM 0 HE1 MET A 83 13.057 -9.085 21.742 1.00 0.00 H new ATOM 0 HE2 MET A 83 13.122 -8.179 23.272 1.00 0.00 H new ATOM 0 HE3 MET A 83 12.842 -7.318 21.740 1.00 0.00 H new ATOM 1391 N THR A 84 15.257 -5.186 17.863 1.00 0.00 N ATOM 1392 CA THR A 84 15.130 -4.481 16.565 1.00 0.00 C ATOM 1393 C THR A 84 13.728 -4.722 15.939 1.00 0.00 C ATOM 1394 O THR A 84 13.419 -5.825 15.479 1.00 0.00 O ATOM 1395 CB THR A 84 16.306 -4.903 15.639 1.00 0.00 C ATOM 1396 OG1 THR A 84 17.557 -4.572 16.244 1.00 0.00 O ATOM 1397 CG2 THR A 84 16.264 -4.179 14.284 1.00 0.00 C ATOM 0 H THR A 84 15.309 -6.201 17.778 1.00 0.00 H new ATOM 0 HA THR A 84 15.202 -3.403 16.712 1.00 0.00 H new ATOM 0 HB THR A 84 16.204 -5.978 15.488 1.00 0.00 H new ATOM 0 HG1 THR A 84 17.657 -5.069 17.082 1.00 0.00 H new ATOM 0 HG21 THR A 84 17.104 -4.505 13.671 1.00 0.00 H new ATOM 0 HG22 THR A 84 15.330 -4.415 13.774 1.00 0.00 H new ATOM 0 HG23 THR A 84 16.328 -3.103 14.444 1.00 0.00 H new ATOM 1405 N THR A 85 12.913 -3.659 15.884 1.00 0.00 N ATOM 1406 CA THR A 85 11.621 -3.666 15.138 1.00 0.00 C ATOM 1407 C THR A 85 11.851 -3.084 13.708 1.00 0.00 C ATOM 1408 O THR A 85 12.379 -1.975 13.563 1.00 0.00 O ATOM 1409 CB THR A 85 10.561 -2.846 15.931 1.00 0.00 C ATOM 1410 OG1 THR A 85 10.340 -3.403 17.222 1.00 0.00 O ATOM 1411 CG2 THR A 85 9.165 -2.798 15.284 1.00 0.00 C ATOM 0 H THR A 85 13.117 -2.773 16.346 1.00 0.00 H new ATOM 0 HA THR A 85 11.246 -4.684 15.033 1.00 0.00 H new ATOM 0 HB THR A 85 10.992 -1.845 15.956 1.00 0.00 H new ATOM 0 HG1 THR A 85 10.943 -2.980 17.868 1.00 0.00 H new ATOM 0 HG21 THR A 85 8.495 -2.205 15.907 1.00 0.00 H new ATOM 0 HG22 THR A 85 9.237 -2.344 14.296 1.00 0.00 H new ATOM 0 HG23 THR A 85 8.772 -3.811 15.190 1.00 0.00 H new ATOM 1419 N VAL A 86 11.415 -3.816 12.667 1.00 0.00 N ATOM 1420 CA VAL A 86 11.426 -3.321 11.256 1.00 0.00 C ATOM 1421 C VAL A 86 9.937 -3.244 10.775 1.00 0.00 C ATOM 1422 O VAL A 86 9.174 -4.202 10.942 1.00 0.00 O ATOM 1423 CB VAL A 86 12.318 -4.202 10.315 1.00 0.00 C ATOM 1424 CG1 VAL A 86 12.459 -3.557 8.918 1.00 0.00 C ATOM 1425 CG2 VAL A 86 13.757 -4.472 10.816 1.00 0.00 C ATOM 0 H VAL A 86 11.046 -4.762 12.766 1.00 0.00 H new ATOM 0 HA VAL A 86 11.882 -2.332 11.213 1.00 0.00 H new ATOM 0 HB VAL A 86 11.784 -5.152 10.291 1.00 0.00 H new ATOM 0 HG11 VAL A 86 13.083 -4.190 8.286 1.00 0.00 H new ATOM 0 HG12 VAL A 86 11.473 -3.451 8.465 1.00 0.00 H new ATOM 0 HG13 VAL A 86 12.921 -2.574 9.016 1.00 0.00 H new ATOM 0 HG21 VAL A 86 14.285 -5.090 10.090 1.00 0.00 H new ATOM 0 HG22 VAL A 86 14.283 -3.525 10.938 1.00 0.00 H new ATOM 0 HG23 VAL A 86 13.717 -4.991 11.774 1.00 0.00 H new ATOM 1435 N SER A 87 9.492 -2.110 10.203 1.00 0.00 N ATOM 1436 CA SER A 87 8.075 -1.918 9.765 1.00 0.00 C ATOM 1437 C SER A 87 7.932 -0.970 8.526 1.00 0.00 C ATOM 1438 O SER A 87 8.803 -0.148 8.227 1.00 0.00 O ATOM 1439 CB SER A 87 7.225 -1.471 10.981 1.00 0.00 C ATOM 1440 OG SER A 87 7.103 -2.546 11.914 1.00 0.00 O ATOM 0 H SER A 87 10.089 -1.302 10.028 1.00 0.00 H new ATOM 0 HA SER A 87 7.691 -2.873 9.407 1.00 0.00 H new ATOM 0 HB2 SER A 87 7.690 -0.611 11.463 1.00 0.00 H new ATOM 0 HB3 SER A 87 6.237 -1.154 10.648 1.00 0.00 H new ATOM 0 HG SER A 87 7.669 -3.293 11.628 1.00 0.00 H new ATOM 1446 N TRP A 88 6.819 -1.097 7.778 1.00 0.00 N ATOM 1447 CA TRP A 88 6.608 -0.348 6.504 1.00 0.00 C ATOM 1448 C TRP A 88 5.978 1.070 6.703 1.00 0.00 C ATOM 1449 O TRP A 88 4.860 1.211 7.206 1.00 0.00 O ATOM 1450 CB TRP A 88 5.707 -1.186 5.552 1.00 0.00 C ATOM 1451 CG TRP A 88 6.381 -2.373 4.853 1.00 0.00 C ATOM 1452 CD1 TRP A 88 5.988 -3.722 4.958 1.00 0.00 C ATOM 1453 CD2 TRP A 88 7.338 -2.341 3.854 1.00 0.00 C ATOM 1454 NE1 TRP A 88 6.712 -4.549 4.075 1.00 0.00 N ATOM 1455 CE2 TRP A 88 7.525 -3.668 3.384 1.00 0.00 C ATOM 1456 CE3 TRP A 88 7.945 -1.248 3.183 1.00 0.00 C ATOM 1457 CZ2 TRP A 88 8.310 -3.906 2.232 1.00 0.00 C ATOM 1458 CZ3 TRP A 88 8.702 -1.510 2.043 1.00 0.00 C ATOM 1459 CH2 TRP A 88 8.893 -2.818 1.582 1.00 0.00 C ATOM 0 H TRP A 88 6.044 -1.711 8.027 1.00 0.00 H new ATOM 0 HA TRP A 88 7.596 -0.191 6.071 1.00 0.00 H new ATOM 0 HB2 TRP A 88 4.860 -1.562 6.125 1.00 0.00 H new ATOM 0 HB3 TRP A 88 5.305 -0.521 4.787 1.00 0.00 H new ATOM 0 HD1 TRP A 88 5.225 -4.079 5.633 1.00 0.00 H new ATOM 0 HE1 TRP A 88 6.651 -5.562 3.970 1.00 0.00 H new ATOM 0 HE3 TRP A 88 7.823 -0.238 3.547 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 8.455 -4.910 1.863 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 9.150 -0.688 1.505 1.00 0.00 H new ATOM 0 HH2 TRP A 88 9.503 -2.988 0.707 1.00 0.00 H new ATOM 1470 N ASP A 89 6.667 2.107 6.203 1.00 0.00 N ATOM 1471 CA ASP A 89 6.094 3.465 5.992 1.00 0.00 C ATOM 1472 C ASP A 89 5.937 3.730 4.453 1.00 0.00 C ATOM 1473 O ASP A 89 6.703 4.507 3.866 1.00 0.00 O ATOM 1474 CB ASP A 89 7.056 4.429 6.744 1.00 0.00 C ATOM 1475 CG ASP A 89 6.687 5.911 6.762 1.00 0.00 C ATOM 1476 OD1 ASP A 89 6.398 6.520 7.787 1.00 0.00 O ATOM 1477 OD2 ASP A 89 6.755 6.477 5.520 1.00 0.00 O ATOM 0 H ASP A 89 7.647 2.036 5.928 1.00 0.00 H new ATOM 0 HA ASP A 89 5.088 3.603 6.388 1.00 0.00 H new ATOM 0 HB2 ASP A 89 7.136 4.088 7.776 1.00 0.00 H new ATOM 0 HB3 ASP A 89 8.046 4.333 6.299 1.00 0.00 H new ATOM 1483 N GLY A 90 4.947 3.084 3.804 1.00 0.00 N ATOM 1484 CA GLY A 90 4.784 3.128 2.322 1.00 0.00 C ATOM 1485 C GLY A 90 5.937 2.469 1.526 1.00 0.00 C ATOM 1486 O GLY A 90 6.316 1.334 1.816 1.00 0.00 O ATOM 0 H GLY A 90 4.241 2.521 4.279 1.00 0.00 H new ATOM 0 HA2 GLY A 90 3.849 2.634 2.058 1.00 0.00 H new ATOM 0 HA3 GLY A 90 4.694 4.169 2.010 1.00 0.00 H new ATOM 1490 N ASP A 91 6.555 3.212 0.591 1.00 0.00 N ATOM 1491 CA ASP A 91 7.858 2.804 -0.032 1.00 0.00 C ATOM 1492 C ASP A 91 9.088 2.653 0.943 1.00 0.00 C ATOM 1493 O ASP A 91 10.069 1.999 0.572 1.00 0.00 O ATOM 1494 CB ASP A 91 8.148 3.814 -1.183 1.00 0.00 C ATOM 1495 CG ASP A 91 9.241 3.414 -2.187 1.00 0.00 C ATOM 1496 OD1 ASP A 91 9.199 2.391 -2.861 1.00 0.00 O ATOM 1497 OD2 ASP A 91 10.246 4.333 -2.274 1.00 0.00 O ATOM 0 H ASP A 91 6.187 4.097 0.241 1.00 0.00 H new ATOM 0 HA ASP A 91 7.737 1.784 -0.397 1.00 0.00 H new ATOM 0 HB2 ASP A 91 7.222 3.978 -1.734 1.00 0.00 H new ATOM 0 HB3 ASP A 91 8.427 4.769 -0.737 1.00 0.00 H new ATOM 1503 N LYS A 92 9.058 3.255 2.151 1.00 0.00 N ATOM 1504 CA LYS A 92 10.207 3.263 3.086 1.00 0.00 C ATOM 1505 C LYS A 92 10.078 2.144 4.160 1.00 0.00 C ATOM 1506 O LYS A 92 9.137 2.120 4.957 1.00 0.00 O ATOM 1507 CB LYS A 92 10.368 4.663 3.750 1.00 0.00 C ATOM 1508 CG LYS A 92 10.442 5.895 2.806 1.00 0.00 C ATOM 1509 CD LYS A 92 11.351 7.018 3.337 1.00 0.00 C ATOM 1510 CE LYS A 92 11.463 8.204 2.368 1.00 0.00 C ATOM 1511 NZ LYS A 92 12.434 9.183 2.899 1.00 0.00 N ATOM 0 H LYS A 92 8.239 3.749 2.506 1.00 0.00 H new ATOM 0 HA LYS A 92 11.107 3.055 2.508 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.531 4.811 4.433 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.274 4.647 4.355 1.00 0.00 H new ATOM 0 HG2 LYS A 92 10.806 5.574 1.830 1.00 0.00 H new ATOM 0 HG3 LYS A 92 9.437 6.291 2.657 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.963 7.371 4.292 1.00 0.00 H new ATOM 0 HD3 LYS A 92 12.346 6.615 3.526 1.00 0.00 H new ATOM 0 HE2 LYS A 92 11.782 7.856 1.385 1.00 0.00 H new ATOM 0 HE3 LYS A 92 10.489 8.675 2.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 12.511 9.987 2.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 12.112 9.523 3.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 13.364 8.729 3.000 1.00 0.00 H new ATOM 1524 N LEU A 93 11.062 1.241 4.219 1.00 0.00 N ATOM 1525 CA LEU A 93 11.194 0.246 5.310 1.00 0.00 C ATOM 1526 C LEU A 93 11.952 0.902 6.512 1.00 0.00 C ATOM 1527 O LEU A 93 13.151 1.197 6.436 1.00 0.00 O ATOM 1528 CB LEU A 93 11.912 -0.972 4.674 1.00 0.00 C ATOM 1529 CG LEU A 93 12.021 -2.248 5.540 1.00 0.00 C ATOM 1530 CD1 LEU A 93 10.659 -2.952 5.695 1.00 0.00 C ATOM 1531 CD2 LEU A 93 13.037 -3.211 4.906 1.00 0.00 C ATOM 0 H LEU A 93 11.796 1.172 3.514 1.00 0.00 H new ATOM 0 HA LEU A 93 10.245 -0.091 5.728 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.390 -1.231 3.753 1.00 0.00 H new ATOM 0 HB3 LEU A 93 12.920 -0.664 4.394 1.00 0.00 H new ATOM 0 HG LEU A 93 12.355 -1.954 6.535 1.00 0.00 H new ATOM 0 HD11 LEU A 93 10.778 -3.844 6.310 1.00 0.00 H new ATOM 0 HD12 LEU A 93 9.951 -2.274 6.172 1.00 0.00 H new ATOM 0 HD13 LEU A 93 10.283 -3.237 4.712 1.00 0.00 H new ATOM 0 HD21 LEU A 93 13.115 -4.111 5.516 1.00 0.00 H new ATOM 0 HD22 LEU A 93 12.706 -3.480 3.903 1.00 0.00 H new ATOM 0 HD23 LEU A 93 14.012 -2.726 4.849 1.00 0.00 H new ATOM 1543 N GLN A 94 11.215 1.180 7.596 1.00 0.00 N ATOM 1544 CA GLN A 94 11.748 1.867 8.802 1.00 0.00 C ATOM 1545 C GLN A 94 12.219 0.838 9.868 1.00 0.00 C ATOM 1546 O GLN A 94 11.478 -0.087 10.217 1.00 0.00 O ATOM 1547 CB GLN A 94 10.637 2.769 9.407 1.00 0.00 C ATOM 1548 CG GLN A 94 10.345 4.060 8.620 1.00 0.00 C ATOM 1549 CD GLN A 94 11.472 5.098 8.657 1.00 0.00 C ATOM 1550 OE1 GLN A 94 12.603 4.909 9.097 1.00 0.00 O ATOM 1551 NE2 GLN A 94 11.211 6.231 8.094 1.00 0.00 N ATOM 0 H GLN A 94 10.227 0.938 7.671 1.00 0.00 H new ATOM 0 HA GLN A 94 12.606 2.472 8.508 1.00 0.00 H new ATOM 0 HB2 GLN A 94 9.717 2.189 9.477 1.00 0.00 H new ATOM 0 HB3 GLN A 94 10.922 3.038 10.424 1.00 0.00 H new ATOM 0 HG2 GLN A 94 10.143 3.799 7.581 1.00 0.00 H new ATOM 0 HG3 GLN A 94 9.437 4.514 9.017 1.00 0.00 H new ATOM 0 HE21 GLN A 94 10.279 6.412 7.721 1.00 0.00 H new ATOM 0 HE22 GLN A 94 11.937 6.944 8.023 1.00 0.00 H new ATOM 1560 N CYS A 95 13.426 1.024 10.417 1.00 0.00 N ATOM 1561 CA CYS A 95 13.986 0.139 11.464 1.00 0.00 C ATOM 1562 C CYS A 95 14.446 0.951 12.701 1.00 0.00 C ATOM 1563 O CYS A 95 15.243 1.888 12.579 1.00 0.00 O ATOM 1564 CB CYS A 95 15.156 -0.639 10.840 1.00 0.00 C ATOM 1565 SG CYS A 95 15.979 -1.704 12.071 1.00 0.00 S ATOM 0 H CYS A 95 14.047 1.789 10.153 1.00 0.00 H new ATOM 0 HA CYS A 95 13.222 -0.553 11.818 1.00 0.00 H new ATOM 0 HB2 CYS A 95 14.790 -1.250 10.015 1.00 0.00 H new ATOM 0 HB3 CYS A 95 15.879 0.062 10.422 1.00 0.00 H new ATOM 0 HG CYS A 95 17.235 -1.834 11.761 1.00 0.00 H new ATOM 1571 N VAL A 96 13.986 0.549 13.899 1.00 0.00 N ATOM 1572 CA VAL A 96 14.540 1.060 15.187 1.00 0.00 C ATOM 1573 C VAL A 96 15.335 -0.093 15.883 1.00 0.00 C ATOM 1574 O VAL A 96 14.772 -1.139 16.222 1.00 0.00 O ATOM 1575 CB VAL A 96 13.431 1.746 16.058 1.00 0.00 C ATOM 1576 CG1 VAL A 96 12.308 0.817 16.577 1.00 0.00 C ATOM 1577 CG2 VAL A 96 14.024 2.522 17.254 1.00 0.00 C ATOM 0 H VAL A 96 13.232 -0.128 14.013 1.00 0.00 H new ATOM 0 HA VAL A 96 15.255 1.865 15.015 1.00 0.00 H new ATOM 0 HB VAL A 96 12.964 2.430 15.349 1.00 0.00 H new ATOM 0 HG11 VAL A 96 11.598 1.398 17.166 1.00 0.00 H new ATOM 0 HG12 VAL A 96 11.792 0.363 15.731 1.00 0.00 H new ATOM 0 HG13 VAL A 96 12.742 0.035 17.200 1.00 0.00 H new ATOM 0 HG21 VAL A 96 13.217 2.979 17.827 1.00 0.00 H new ATOM 0 HG22 VAL A 96 14.580 1.836 17.893 1.00 0.00 H new ATOM 0 HG23 VAL A 96 14.694 3.299 16.887 1.00 0.00 H new ATOM 1587 N GLN A 97 16.649 0.104 16.086 1.00 0.00 N ATOM 1588 CA GLN A 97 17.536 -0.884 16.766 1.00 0.00 C ATOM 1589 C GLN A 97 17.748 -0.467 18.258 1.00 0.00 C ATOM 1590 O GLN A 97 18.817 0.015 18.643 1.00 0.00 O ATOM 1591 CB GLN A 97 18.868 -0.955 15.960 1.00 0.00 C ATOM 1592 CG GLN A 97 18.784 -1.608 14.557 1.00 0.00 C ATOM 1593 CD GLN A 97 20.040 -1.458 13.697 1.00 0.00 C ATOM 1594 OE1 GLN A 97 20.224 -0.478 12.985 1.00 0.00 O ATOM 1595 NE2 GLN A 97 20.933 -2.417 13.717 1.00 0.00 N ATOM 0 H GLN A 97 17.136 0.949 15.787 1.00 0.00 H new ATOM 0 HA GLN A 97 17.091 -1.879 16.787 1.00 0.00 H new ATOM 0 HB2 GLN A 97 19.253 0.058 15.844 1.00 0.00 H new ATOM 0 HB3 GLN A 97 19.598 -1.507 16.552 1.00 0.00 H new ATOM 0 HG2 GLN A 97 18.571 -2.670 14.679 1.00 0.00 H new ATOM 0 HG3 GLN A 97 17.941 -1.173 14.020 1.00 0.00 H new ATOM 0 HE21 GLN A 97 20.788 -3.237 14.307 1.00 0.00 H new ATOM 0 HE22 GLN A 97 21.773 -2.344 13.143 1.00 0.00 H new ATOM 1604 N LYS A 98 16.728 -0.643 19.117 1.00 0.00 N ATOM 1605 CA LYS A 98 16.743 -0.084 20.500 1.00 0.00 C ATOM 1606 C LYS A 98 17.494 -0.985 21.537 1.00 0.00 C ATOM 1607 O LYS A 98 17.320 -2.205 21.602 1.00 0.00 O ATOM 1608 CB LYS A 98 15.309 0.326 20.935 1.00 0.00 C ATOM 1609 CG LYS A 98 14.253 -0.799 21.032 1.00 0.00 C ATOM 1610 CD LYS A 98 12.858 -0.347 21.501 1.00 0.00 C ATOM 1611 CE LYS A 98 12.061 0.414 20.427 1.00 0.00 C ATOM 1612 NZ LYS A 98 10.730 0.776 20.946 1.00 0.00 N ATOM 0 H LYS A 98 15.882 -1.164 18.888 1.00 0.00 H new ATOM 0 HA LYS A 98 17.344 0.825 20.480 1.00 0.00 H new ATOM 0 HB2 LYS A 98 15.377 0.811 21.909 1.00 0.00 H new ATOM 0 HB3 LYS A 98 14.943 1.074 20.231 1.00 0.00 H new ATOM 0 HG2 LYS A 98 14.155 -1.270 20.054 1.00 0.00 H new ATOM 0 HG3 LYS A 98 14.620 -1.562 21.718 1.00 0.00 H new ATOM 0 HD2 LYS A 98 12.288 -1.222 21.812 1.00 0.00 H new ATOM 0 HD3 LYS A 98 12.968 0.290 22.379 1.00 0.00 H new ATOM 0 HE2 LYS A 98 12.601 1.313 20.131 1.00 0.00 H new ATOM 0 HE3 LYS A 98 11.957 -0.203 19.535 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 10.200 1.289 20.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 10.213 -0.088 21.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 10.837 1.382 21.784 1.00 0.00 H new ATOM 1625 N GLY A 99 18.343 -0.349 22.351 1.00 0.00 N ATOM 1626 CA GLY A 99 19.176 -1.057 23.356 1.00 0.00 C ATOM 1627 C GLY A 99 20.088 -0.091 24.130 1.00 0.00 C ATOM 1628 O GLY A 99 19.714 0.368 25.210 1.00 0.00 O ATOM 0 H GLY A 99 18.479 0.662 22.341 1.00 0.00 H new ATOM 0 HA2 GLY A 99 18.529 -1.585 24.057 1.00 0.00 H new ATOM 0 HA3 GLY A 99 19.786 -1.810 22.856 1.00 0.00 H new ATOM 1632 N GLU A 100 21.269 0.223 23.571 1.00 0.00 N ATOM 1633 CA GLU A 100 22.227 1.186 24.192 1.00 0.00 C ATOM 1634 C GLU A 100 22.254 2.592 23.502 1.00 0.00 C ATOM 1635 O GLU A 100 22.045 3.596 24.187 1.00 0.00 O ATOM 1636 CB GLU A 100 23.619 0.501 24.280 1.00 0.00 C ATOM 1637 CG GLU A 100 24.639 1.249 25.177 1.00 0.00 C ATOM 1638 CD GLU A 100 26.037 0.639 25.187 1.00 0.00 C ATOM 1639 OE1 GLU A 100 26.976 1.101 24.547 1.00 0.00 O ATOM 1640 OE2 GLU A 100 26.116 -0.467 25.981 1.00 0.00 O ATOM 0 H GLU A 100 21.594 -0.171 22.688 1.00 0.00 H new ATOM 0 HA GLU A 100 21.885 1.423 25.199 1.00 0.00 H new ATOM 0 HB2 GLU A 100 23.490 -0.512 24.662 1.00 0.00 H new ATOM 0 HB3 GLU A 100 24.032 0.412 23.275 1.00 0.00 H new ATOM 0 HG2 GLU A 100 24.710 2.283 24.841 1.00 0.00 H new ATOM 0 HG3 GLU A 100 24.258 1.271 26.198 1.00 0.00 H new ATOM 1648 N LYS A 101 22.554 2.694 22.188 1.00 0.00 N ATOM 1649 CA LYS A 101 22.728 4.008 21.501 1.00 0.00 C ATOM 1650 C LYS A 101 21.360 4.699 21.201 1.00 0.00 C ATOM 1651 O LYS A 101 20.423 4.083 20.683 1.00 0.00 O ATOM 1652 CB LYS A 101 23.586 3.855 20.210 1.00 0.00 C ATOM 1653 CG LYS A 101 25.122 3.832 20.388 1.00 0.00 C ATOM 1654 CD LYS A 101 25.663 2.593 21.119 1.00 0.00 C ATOM 1655 CE LYS A 101 27.197 2.555 21.136 1.00 0.00 C ATOM 1656 NZ LYS A 101 27.679 1.310 21.761 1.00 0.00 N ATOM 0 H LYS A 101 22.682 1.888 21.577 1.00 0.00 H new ATOM 0 HA LYS A 101 23.267 4.662 22.186 1.00 0.00 H new ATOM 0 HB2 LYS A 101 23.289 2.932 19.713 1.00 0.00 H new ATOM 0 HB3 LYS A 101 23.335 4.675 19.537 1.00 0.00 H new ATOM 0 HG2 LYS A 101 25.589 3.891 19.405 1.00 0.00 H new ATOM 0 HG3 LYS A 101 25.424 4.723 20.938 1.00 0.00 H new ATOM 0 HD2 LYS A 101 25.290 2.585 22.143 1.00 0.00 H new ATOM 0 HD3 LYS A 101 25.284 1.693 20.635 1.00 0.00 H new ATOM 0 HE2 LYS A 101 27.579 2.629 20.118 1.00 0.00 H new ATOM 0 HE3 LYS A 101 27.581 3.416 21.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 28.718 1.325 21.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 27.289 1.230 22.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 27.371 0.495 21.193 1.00 0.00 H new ATOM 1669 N GLU A 102 21.275 6.001 21.522 1.00 0.00 N ATOM 1670 CA GLU A 102 19.976 6.745 21.568 1.00 0.00 C ATOM 1671 C GLU A 102 19.183 6.832 20.223 1.00 0.00 C ATOM 1672 O GLU A 102 18.024 6.415 20.173 1.00 0.00 O ATOM 1673 CB GLU A 102 20.196 8.150 22.207 1.00 0.00 C ATOM 1674 CG GLU A 102 20.735 8.211 23.661 1.00 0.00 C ATOM 1675 CD GLU A 102 19.816 7.616 24.728 1.00 0.00 C ATOM 1676 OE1 GLU A 102 18.944 8.250 25.313 1.00 0.00 O ATOM 1677 OE2 GLU A 102 20.078 6.300 24.958 1.00 0.00 O ATOM 0 H GLU A 102 22.086 6.574 21.756 1.00 0.00 H new ATOM 0 HA GLU A 102 19.320 6.143 22.197 1.00 0.00 H new ATOM 0 HB2 GLU A 102 20.888 8.702 21.571 1.00 0.00 H new ATOM 0 HB3 GLU A 102 19.245 8.682 22.180 1.00 0.00 H new ATOM 0 HG2 GLU A 102 21.691 7.689 23.698 1.00 0.00 H new ATOM 0 HG3 GLU A 102 20.930 9.253 23.914 1.00 0.00 H new ATOM 1685 N GLY A 103 19.809 7.327 19.143 1.00 0.00 N ATOM 1686 CA GLY A 103 19.229 7.236 17.775 1.00 0.00 C ATOM 1687 C GLY A 103 19.761 6.093 16.892 1.00 0.00 C ATOM 1688 O GLY A 103 20.181 6.365 15.770 1.00 0.00 O ATOM 0 H GLY A 103 20.715 7.795 19.181 1.00 0.00 H new ATOM 0 HA2 GLY A 103 18.149 7.125 17.866 1.00 0.00 H new ATOM 0 HA3 GLY A 103 19.410 8.180 17.261 1.00 0.00 H new ATOM 1692 N ARG A 104 19.725 4.837 17.371 1.00 0.00 N ATOM 1693 CA ARG A 104 20.199 3.655 16.602 1.00 0.00 C ATOM 1694 C ARG A 104 19.068 3.059 15.702 1.00 0.00 C ATOM 1695 O ARG A 104 18.026 2.611 16.193 1.00 0.00 O ATOM 1696 CB ARG A 104 20.776 2.626 17.612 1.00 0.00 C ATOM 1697 CG ARG A 104 21.813 1.631 17.031 1.00 0.00 C ATOM 1698 CD ARG A 104 22.155 0.497 18.020 1.00 0.00 C ATOM 1699 NE ARG A 104 23.429 -0.186 17.660 1.00 0.00 N ATOM 1700 CZ ARG A 104 23.548 -1.389 17.098 1.00 0.00 C ATOM 1701 NH1 ARG A 104 22.541 -2.131 16.704 1.00 0.00 N ATOM 1702 NH2 ARG A 104 24.751 -1.866 16.928 1.00 0.00 N ATOM 0 H ARG A 104 19.369 4.605 18.298 1.00 0.00 H new ATOM 0 HA ARG A 104 20.986 3.948 15.907 1.00 0.00 H new ATOM 0 HB2 ARG A 104 21.242 3.171 18.433 1.00 0.00 H new ATOM 0 HB3 ARG A 104 19.949 2.056 18.036 1.00 0.00 H new ATOM 0 HG2 ARG A 104 21.423 1.200 16.109 1.00 0.00 H new ATOM 0 HG3 ARG A 104 22.724 2.170 16.771 1.00 0.00 H new ATOM 0 HD2 ARG A 104 22.234 0.905 19.028 1.00 0.00 H new ATOM 0 HD3 ARG A 104 21.344 -0.231 18.033 1.00 0.00 H new ATOM 0 HE ARG A 104 24.294 0.315 17.863 1.00 0.00 H new ATOM 0 HH11 ARG A 104 21.585 -1.796 16.820 1.00 0.00 H new ATOM 0 HH12 ARG A 104 22.714 -3.043 16.282 1.00 0.00 H new ATOM 0 HH21 ARG A 104 25.562 -1.321 17.222 1.00 0.00 H new ATOM 0 HH22 ARG A 104 24.880 -2.783 16.501 1.00 0.00 H new ATOM 1716 N GLY A 105 19.283 3.054 14.381 1.00 0.00 N ATOM 1717 CA GLY A 105 18.289 2.529 13.411 1.00 0.00 C ATOM 1718 C GLY A 105 18.636 2.809 11.936 1.00 0.00 C ATOM 1719 O GLY A 105 19.744 3.238 11.596 1.00 0.00 O ATOM 0 H GLY A 105 20.137 3.407 13.949 1.00 0.00 H new ATOM 0 HA2 GLY A 105 18.194 1.452 13.552 1.00 0.00 H new ATOM 0 HA3 GLY A 105 17.316 2.966 13.633 1.00 0.00 H new ATOM 1723 N TRP A 106 17.670 2.564 11.039 1.00 0.00 N ATOM 1724 CA TRP A 106 17.837 2.860 9.586 1.00 0.00 C ATOM 1725 C TRP A 106 16.496 3.075 8.817 1.00 0.00 C ATOM 1726 O TRP A 106 15.430 2.587 9.198 1.00 0.00 O ATOM 1727 CB TRP A 106 18.811 1.868 8.871 1.00 0.00 C ATOM 1728 CG TRP A 106 18.547 0.358 8.928 1.00 0.00 C ATOM 1729 CD1 TRP A 106 19.271 -0.540 9.737 1.00 0.00 C ATOM 1730 CD2 TRP A 106 17.612 -0.411 8.260 1.00 0.00 C ATOM 1731 NE1 TRP A 106 18.806 -1.861 9.597 1.00 0.00 N ATOM 1732 CE2 TRP A 106 17.766 -1.755 8.689 1.00 0.00 C ATOM 1733 CE3 TRP A 106 16.565 -0.058 7.374 1.00 0.00 C ATOM 1734 CZ2 TRP A 106 16.856 -2.748 8.251 1.00 0.00 C ATOM 1735 CZ3 TRP A 106 15.670 -1.048 6.972 1.00 0.00 C ATOM 1736 CH2 TRP A 106 15.817 -2.375 7.396 1.00 0.00 C ATOM 0 H TRP A 106 16.764 2.163 11.281 1.00 0.00 H new ATOM 0 HA TRP A 106 18.325 3.834 9.553 1.00 0.00 H new ATOM 0 HB2 TRP A 106 18.847 2.151 7.819 1.00 0.00 H new ATOM 0 HB3 TRP A 106 19.806 2.039 9.281 1.00 0.00 H new ATOM 0 HD1 TRP A 106 20.084 -0.250 10.386 1.00 0.00 H new ATOM 0 HE1 TRP A 106 19.154 -2.702 10.058 1.00 0.00 H new ATOM 0 HE3 TRP A 106 16.462 0.956 7.018 1.00 0.00 H new ATOM 0 HZ2 TRP A 106 16.964 -3.774 8.572 1.00 0.00 H new ATOM 0 HZ3 TRP A 106 14.848 -0.787 6.322 1.00 0.00 H new ATOM 0 HH2 TRP A 106 15.115 -3.122 7.056 1.00 0.00 H new ATOM 1747 N THR A 107 16.583 3.790 7.683 1.00 0.00 N ATOM 1748 CA THR A 107 15.437 4.024 6.761 1.00 0.00 C ATOM 1749 C THR A 107 15.864 3.568 5.329 1.00 0.00 C ATOM 1750 O THR A 107 16.759 4.169 4.723 1.00 0.00 O ATOM 1751 CB THR A 107 15.040 5.532 6.814 1.00 0.00 C ATOM 1752 OG1 THR A 107 14.716 5.945 8.141 1.00 0.00 O ATOM 1753 CG2 THR A 107 13.835 5.884 5.935 1.00 0.00 C ATOM 0 H THR A 107 17.450 4.228 7.370 1.00 0.00 H new ATOM 0 HA THR A 107 14.559 3.448 7.054 1.00 0.00 H new ATOM 0 HB THR A 107 15.922 6.052 6.439 1.00 0.00 H new ATOM 0 HG1 THR A 107 14.132 5.278 8.558 1.00 0.00 H new ATOM 0 HG21 THR A 107 13.619 6.949 6.024 1.00 0.00 H new ATOM 0 HG22 THR A 107 14.060 5.645 4.896 1.00 0.00 H new ATOM 0 HG23 THR A 107 12.968 5.309 6.260 1.00 0.00 H new ATOM 1761 N GLN A 108 15.225 2.514 4.792 1.00 0.00 N ATOM 1762 CA GLN A 108 15.598 1.908 3.481 1.00 0.00 C ATOM 1763 C GLN A 108 14.432 2.027 2.455 1.00 0.00 C ATOM 1764 O GLN A 108 13.331 1.536 2.714 1.00 0.00 O ATOM 1765 CB GLN A 108 15.972 0.432 3.766 1.00 0.00 C ATOM 1766 CG GLN A 108 16.600 -0.331 2.579 1.00 0.00 C ATOM 1767 CD GLN A 108 16.945 -1.789 2.900 1.00 0.00 C ATOM 1768 OE1 GLN A 108 16.103 -2.679 2.886 1.00 0.00 O ATOM 1769 NE2 GLN A 108 18.184 -2.089 3.194 1.00 0.00 N ATOM 0 H GLN A 108 14.436 2.052 5.245 1.00 0.00 H new ATOM 0 HA GLN A 108 16.441 2.432 3.031 1.00 0.00 H new ATOM 0 HB2 GLN A 108 16.670 0.406 4.603 1.00 0.00 H new ATOM 0 HB3 GLN A 108 15.074 -0.098 4.083 1.00 0.00 H new ATOM 0 HG2 GLN A 108 15.909 -0.307 1.736 1.00 0.00 H new ATOM 0 HG3 GLN A 108 17.506 0.187 2.263 1.00 0.00 H new ATOM 0 HE21 GLN A 108 18.896 -1.358 3.210 1.00 0.00 H new ATOM 0 HE22 GLN A 108 18.438 -3.053 3.408 1.00 0.00 H new ATOM 1778 N TRP A 109 14.654 2.648 1.284 1.00 0.00 N ATOM 1779 CA TRP A 109 13.575 2.867 0.275 1.00 0.00 C ATOM 1780 C TRP A 109 14.076 2.753 -1.194 1.00 0.00 C ATOM 1781 O TRP A 109 15.211 3.126 -1.502 1.00 0.00 O ATOM 1782 CB TRP A 109 12.853 4.212 0.578 1.00 0.00 C ATOM 1783 CG TRP A 109 13.535 5.527 0.183 1.00 0.00 C ATOM 1784 CD1 TRP A 109 13.303 6.213 -1.019 1.00 0.00 C ATOM 1785 CD2 TRP A 109 14.461 6.284 0.873 1.00 0.00 C ATOM 1786 NE1 TRP A 109 14.081 7.382 -1.117 1.00 0.00 N ATOM 1787 CE2 TRP A 109 14.778 7.413 0.076 1.00 0.00 C ATOM 1788 CE3 TRP A 109 15.094 6.088 2.126 1.00 0.00 C ATOM 1789 CZ2 TRP A 109 15.735 8.350 0.523 1.00 0.00 C ATOM 1790 CZ3 TRP A 109 16.032 7.029 2.551 1.00 0.00 C ATOM 1791 CH2 TRP A 109 16.348 8.143 1.760 1.00 0.00 C ATOM 0 H TRP A 109 15.565 3.011 1.003 1.00 0.00 H new ATOM 0 HA TRP A 109 12.848 2.060 0.367 1.00 0.00 H new ATOM 0 HB2 TRP A 109 11.882 4.183 0.083 1.00 0.00 H new ATOM 0 HB3 TRP A 109 12.663 4.249 1.651 1.00 0.00 H new ATOM 0 HD1 TRP A 109 12.610 5.883 -1.779 1.00 0.00 H new ATOM 0 HE1 TRP A 109 14.121 8.049 -1.887 1.00 0.00 H new ATOM 0 HE3 TRP A 109 14.856 5.230 2.737 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 15.988 9.210 -0.080 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 16.523 6.898 3.504 1.00 0.00 H new ATOM 0 HH2 TRP A 109 17.079 8.854 2.114 1.00 0.00 H new ATOM 1802 N ILE A 110 13.215 2.294 -2.121 1.00 0.00 N ATOM 1803 CA ILE A 110 13.580 2.196 -3.569 1.00 0.00 C ATOM 1804 C ILE A 110 13.053 3.447 -4.350 1.00 0.00 C ATOM 1805 O ILE A 110 11.906 3.888 -4.199 1.00 0.00 O ATOM 1806 CB ILE A 110 13.173 0.807 -4.187 1.00 0.00 C ATOM 1807 CG1 ILE A 110 13.918 -0.373 -3.494 1.00 0.00 C ATOM 1808 CG2 ILE A 110 13.435 0.722 -5.719 1.00 0.00 C ATOM 1809 CD1 ILE A 110 13.413 -1.780 -3.836 1.00 0.00 C ATOM 0 H ILE A 110 12.267 1.985 -1.908 1.00 0.00 H new ATOM 0 HA ILE A 110 14.665 2.220 -3.668 1.00 0.00 H new ATOM 0 HB ILE A 110 12.100 0.723 -4.013 1.00 0.00 H new ATOM 0 HG12 ILE A 110 14.974 -0.314 -3.756 1.00 0.00 H new ATOM 0 HG13 ILE A 110 13.849 -0.236 -2.415 1.00 0.00 H new ATOM 0 HG21 ILE A 110 13.134 -0.259 -6.086 1.00 0.00 H new ATOM 0 HG22 ILE A 110 12.858 1.493 -6.230 1.00 0.00 H new ATOM 0 HG23 ILE A 110 14.496 0.873 -5.916 1.00 0.00 H new ATOM 0 HD11 ILE A 110 14.005 -2.520 -3.297 1.00 0.00 H new ATOM 0 HD12 ILE A 110 12.366 -1.871 -3.546 1.00 0.00 H new ATOM 0 HD13 ILE A 110 13.509 -1.950 -4.908 1.00 0.00 H new ATOM 1821 N GLU A 111 13.938 3.971 -5.211 1.00 0.00 N ATOM 1822 CA GLU A 111 13.650 5.079 -6.159 1.00 0.00 C ATOM 1823 C GLU A 111 13.968 4.568 -7.601 1.00 0.00 C ATOM 1824 O GLU A 111 15.093 4.699 -8.098 1.00 0.00 O ATOM 1825 CB GLU A 111 14.522 6.298 -5.736 1.00 0.00 C ATOM 1826 CG GLU A 111 14.068 7.006 -4.442 1.00 0.00 C ATOM 1827 CD GLU A 111 13.083 8.163 -4.604 1.00 0.00 C ATOM 1828 OE1 GLU A 111 12.160 8.181 -5.413 1.00 0.00 O ATOM 1829 OE2 GLU A 111 13.333 9.172 -3.723 1.00 0.00 O ATOM 0 H GLU A 111 14.899 3.634 -5.276 1.00 0.00 H new ATOM 0 HA GLU A 111 12.607 5.395 -6.144 1.00 0.00 H new ATOM 0 HB2 GLU A 111 15.551 5.962 -5.607 1.00 0.00 H new ATOM 0 HB3 GLU A 111 14.523 7.024 -6.549 1.00 0.00 H new ATOM 0 HG2 GLU A 111 13.614 6.262 -3.788 1.00 0.00 H new ATOM 0 HG3 GLU A 111 14.954 7.382 -3.931 1.00 0.00 H new ATOM 1837 N GLY A 112 12.979 3.927 -8.256 1.00 0.00 N ATOM 1838 CA GLY A 112 13.175 3.293 -9.591 1.00 0.00 C ATOM 1839 C GLY A 112 14.044 2.014 -9.578 1.00 0.00 C ATOM 1840 O GLY A 112 13.591 0.959 -9.131 1.00 0.00 O ATOM 0 H GLY A 112 12.033 3.831 -7.888 1.00 0.00 H new ATOM 0 HA2 GLY A 112 12.198 3.048 -10.009 1.00 0.00 H new ATOM 0 HA3 GLY A 112 13.634 4.021 -10.260 1.00 0.00 H new ATOM 1844 N ASP A 113 15.294 2.127 -10.050 1.00 0.00 N ATOM 1845 CA ASP A 113 16.328 1.057 -9.890 1.00 0.00 C ATOM 1846 C ASP A 113 17.381 1.252 -8.736 1.00 0.00 C ATOM 1847 O ASP A 113 18.321 0.454 -8.656 1.00 0.00 O ATOM 1848 CB ASP A 113 16.985 0.822 -11.282 1.00 0.00 C ATOM 1849 CG ASP A 113 17.832 1.947 -11.896 1.00 0.00 C ATOM 1850 OD1 ASP A 113 18.099 3.008 -11.340 1.00 0.00 O ATOM 1851 OD2 ASP A 113 18.259 1.629 -13.148 1.00 0.00 O ATOM 0 H ASP A 113 15.629 2.950 -10.551 1.00 0.00 H new ATOM 0 HA ASP A 113 15.809 0.164 -9.542 1.00 0.00 H new ATOM 0 HB2 ASP A 113 17.617 -0.063 -11.204 1.00 0.00 H new ATOM 0 HB3 ASP A 113 16.189 0.585 -11.988 1.00 0.00 H new ATOM 1857 N GLU A 114 17.247 2.263 -7.852 1.00 0.00 N ATOM 1858 CA GLU A 114 18.223 2.536 -6.763 1.00 0.00 C ATOM 1859 C GLU A 114 17.585 2.334 -5.352 1.00 0.00 C ATOM 1860 O GLU A 114 16.530 2.886 -5.038 1.00 0.00 O ATOM 1861 CB GLU A 114 18.812 3.964 -6.916 1.00 0.00 C ATOM 1862 CG GLU A 114 19.818 4.131 -8.084 1.00 0.00 C ATOM 1863 CD GLU A 114 20.473 5.508 -8.204 1.00 0.00 C ATOM 1864 OE1 GLU A 114 20.326 6.432 -7.408 1.00 0.00 O ATOM 1865 OE2 GLU A 114 21.263 5.592 -9.308 1.00 0.00 O ATOM 0 H GLU A 114 16.463 2.915 -7.868 1.00 0.00 H new ATOM 0 HA GLU A 114 19.036 1.815 -6.850 1.00 0.00 H new ATOM 0 HB2 GLU A 114 17.991 4.667 -7.059 1.00 0.00 H new ATOM 0 HB3 GLU A 114 19.309 4.239 -5.985 1.00 0.00 H new ATOM 0 HG2 GLU A 114 20.604 3.384 -7.972 1.00 0.00 H new ATOM 0 HG3 GLU A 114 19.301 3.912 -9.018 1.00 0.00 H new ATOM 1873 N LEU A 115 18.274 1.567 -4.494 1.00 0.00 N ATOM 1874 CA LEU A 115 17.942 1.419 -3.053 1.00 0.00 C ATOM 1875 C LEU A 115 18.719 2.494 -2.230 1.00 0.00 C ATOM 1876 O LEU A 115 19.954 2.497 -2.165 1.00 0.00 O ATOM 1877 CB LEU A 115 18.317 -0.036 -2.662 1.00 0.00 C ATOM 1878 CG LEU A 115 18.043 -0.502 -1.209 1.00 0.00 C ATOM 1879 CD1 LEU A 115 16.570 -0.910 -1.025 1.00 0.00 C ATOM 1880 CD2 LEU A 115 18.954 -1.690 -0.858 1.00 0.00 C ATOM 0 H LEU A 115 19.089 1.022 -4.776 1.00 0.00 H new ATOM 0 HA LEU A 115 16.885 1.583 -2.844 1.00 0.00 H new ATOM 0 HB2 LEU A 115 17.782 -0.708 -3.333 1.00 0.00 H new ATOM 0 HB3 LEU A 115 19.381 -0.169 -2.858 1.00 0.00 H new ATOM 0 HG LEU A 115 18.256 0.333 -0.541 1.00 0.00 H new ATOM 0 HD11 LEU A 115 16.407 -1.232 0.004 1.00 0.00 H new ATOM 0 HD12 LEU A 115 15.926 -0.058 -1.244 1.00 0.00 H new ATOM 0 HD13 LEU A 115 16.332 -1.729 -1.704 1.00 0.00 H new ATOM 0 HD21 LEU A 115 18.755 -2.011 0.164 1.00 0.00 H new ATOM 0 HD22 LEU A 115 18.756 -2.515 -1.543 1.00 0.00 H new ATOM 0 HD23 LEU A 115 19.997 -1.387 -0.947 1.00 0.00 H new ATOM 1892 N HIS A 116 17.970 3.406 -1.605 1.00 0.00 N ATOM 1893 CA HIS A 116 18.526 4.520 -0.796 1.00 0.00 C ATOM 1894 C HIS A 116 18.389 4.168 0.716 1.00 0.00 C ATOM 1895 O HIS A 116 17.292 3.902 1.219 1.00 0.00 O ATOM 1896 CB HIS A 116 17.761 5.820 -1.162 1.00 0.00 C ATOM 1897 CG HIS A 116 18.174 6.483 -2.479 1.00 0.00 C ATOM 1898 ND1 HIS A 116 17.893 5.964 -3.737 1.00 0.00 N ATOM 1899 CD2 HIS A 116 18.906 7.678 -2.589 1.00 0.00 C ATOM 1900 CE1 HIS A 116 18.520 6.906 -4.509 1.00 0.00 C ATOM 1901 NE2 HIS A 116 19.150 7.968 -3.919 1.00 0.00 N ATOM 0 H HIS A 116 16.951 3.401 -1.640 1.00 0.00 H new ATOM 0 HA HIS A 116 19.584 4.674 -1.006 1.00 0.00 H new ATOM 0 HB2 HIS A 116 16.696 5.592 -1.209 1.00 0.00 H new ATOM 0 HB3 HIS A 116 17.898 6.540 -0.355 1.00 0.00 H new ATOM 0 HD2 HIS A 116 19.231 8.282 -1.755 1.00 0.00 H new ATOM 0 HE1 HIS A 116 18.517 6.810 -5.585 1.00 0.00 H new ATOM 0 HE2 HIS A 116 19.654 8.749 -4.339 1.00 0.00 H new ATOM 1909 N LEU A 117 19.524 4.155 1.427 1.00 0.00 N ATOM 1910 CA LEU A 117 19.602 3.727 2.847 1.00 0.00 C ATOM 1911 C LEU A 117 20.202 4.875 3.716 1.00 0.00 C ATOM 1912 O LEU A 117 21.368 5.251 3.556 1.00 0.00 O ATOM 1913 CB LEU A 117 20.437 2.414 2.879 1.00 0.00 C ATOM 1914 CG LEU A 117 20.679 1.780 4.274 1.00 0.00 C ATOM 1915 CD1 LEU A 117 19.401 1.214 4.910 1.00 0.00 C ATOM 1916 CD2 LEU A 117 21.741 0.672 4.183 1.00 0.00 C ATOM 0 H LEU A 117 20.423 4.441 1.040 1.00 0.00 H new ATOM 0 HA LEU A 117 18.620 3.523 3.275 1.00 0.00 H new ATOM 0 HB2 LEU A 117 19.937 1.676 2.251 1.00 0.00 H new ATOM 0 HB3 LEU A 117 21.406 2.615 2.423 1.00 0.00 H new ATOM 0 HG LEU A 117 21.031 2.586 4.918 1.00 0.00 H new ATOM 0 HD11 LEU A 117 19.638 0.785 5.884 1.00 0.00 H new ATOM 0 HD12 LEU A 117 18.671 2.014 5.034 1.00 0.00 H new ATOM 0 HD13 LEU A 117 18.985 0.440 4.264 1.00 0.00 H new ATOM 0 HD21 LEU A 117 21.899 0.238 5.170 1.00 0.00 H new ATOM 0 HD22 LEU A 117 21.401 -0.103 3.496 1.00 0.00 H new ATOM 0 HD23 LEU A 117 22.677 1.095 3.818 1.00 0.00 H new ATOM 1928 N GLU A 118 19.420 5.391 4.678 1.00 0.00 N ATOM 1929 CA GLU A 118 19.933 6.330 5.716 1.00 0.00 C ATOM 1930 C GLU A 118 20.073 5.559 7.062 1.00 0.00 C ATOM 1931 O GLU A 118 19.064 5.227 7.689 1.00 0.00 O ATOM 1932 CB GLU A 118 18.992 7.557 5.857 1.00 0.00 C ATOM 1933 CG GLU A 118 18.970 8.522 4.650 1.00 0.00 C ATOM 1934 CD GLU A 118 18.099 9.753 4.880 1.00 0.00 C ATOM 1935 OE1 GLU A 118 16.921 9.833 4.547 1.00 0.00 O ATOM 1936 OE2 GLU A 118 18.777 10.757 5.502 1.00 0.00 O ATOM 0 H GLU A 118 18.426 5.179 4.767 1.00 0.00 H new ATOM 0 HA GLU A 118 20.911 6.711 5.422 1.00 0.00 H new ATOM 0 HB2 GLU A 118 17.978 7.197 6.030 1.00 0.00 H new ATOM 0 HB3 GLU A 118 19.287 8.119 6.743 1.00 0.00 H new ATOM 0 HG2 GLU A 118 19.989 8.842 4.430 1.00 0.00 H new ATOM 0 HG3 GLU A 118 18.607 7.987 3.772 1.00 0.00 H new ATOM 1944 N MET A 119 21.309 5.268 7.501 1.00 0.00 N ATOM 1945 CA MET A 119 21.564 4.562 8.792 1.00 0.00 C ATOM 1946 C MET A 119 21.967 5.575 9.902 1.00 0.00 C ATOM 1947 O MET A 119 22.887 6.373 9.706 1.00 0.00 O ATOM 1948 CB MET A 119 22.659 3.475 8.642 1.00 0.00 C ATOM 1949 CG MET A 119 22.420 2.353 7.615 1.00 0.00 C ATOM 1950 SD MET A 119 23.596 1.010 7.865 1.00 0.00 S ATOM 1951 CE MET A 119 25.067 1.734 7.126 1.00 0.00 C ATOM 0 H MET A 119 22.157 5.507 6.987 1.00 0.00 H new ATOM 0 HA MET A 119 20.636 4.069 9.081 1.00 0.00 H new ATOM 0 HB2 MET A 119 23.593 3.974 8.382 1.00 0.00 H new ATOM 0 HB3 MET A 119 22.806 3.011 9.617 1.00 0.00 H new ATOM 0 HG2 MET A 119 21.402 1.976 7.710 1.00 0.00 H new ATOM 0 HG3 MET A 119 22.520 2.749 6.604 1.00 0.00 H new ATOM 0 HE1 MET A 119 25.829 0.964 7.003 1.00 0.00 H new ATOM 0 HE2 MET A 119 24.816 2.155 6.152 1.00 0.00 H new ATOM 0 HE3 MET A 119 25.449 2.522 7.774 1.00 0.00 H new ATOM 1961 N ARG A 120 21.303 5.537 11.070 1.00 0.00 N ATOM 1962 CA ARG A 120 21.583 6.480 12.193 1.00 0.00 C ATOM 1963 C ARG A 120 22.148 5.741 13.445 1.00 0.00 C ATOM 1964 O ARG A 120 21.711 4.634 13.776 1.00 0.00 O ATOM 1965 CB ARG A 120 20.309 7.289 12.565 1.00 0.00 C ATOM 1966 CG ARG A 120 19.724 8.172 11.430 1.00 0.00 C ATOM 1967 CD ARG A 120 18.607 9.139 11.865 1.00 0.00 C ATOM 1968 NE ARG A 120 19.140 10.318 12.601 1.00 0.00 N ATOM 1969 CZ ARG A 120 18.400 11.325 13.061 1.00 0.00 C ATOM 1970 NH1 ARG A 120 17.088 11.383 12.980 1.00 0.00 N ATOM 1971 NH2 ARG A 120 19.020 12.322 13.627 1.00 0.00 N ATOM 0 H ARG A 120 20.563 4.864 11.272 1.00 0.00 H new ATOM 0 HA ARG A 120 22.349 7.175 11.849 1.00 0.00 H new ATOM 0 HB2 ARG A 120 19.539 6.591 12.892 1.00 0.00 H new ATOM 0 HB3 ARG A 120 20.542 7.929 13.416 1.00 0.00 H new ATOM 0 HG2 ARG A 120 20.534 8.752 10.988 1.00 0.00 H new ATOM 0 HG3 ARG A 120 19.335 7.520 10.648 1.00 0.00 H new ATOM 0 HD2 ARG A 120 18.060 9.479 10.986 1.00 0.00 H new ATOM 0 HD3 ARG A 120 17.896 8.609 12.498 1.00 0.00 H new ATOM 0 HE ARG A 120 20.146 10.357 12.765 1.00 0.00 H new ATOM 0 HH11 ARG A 120 16.570 10.622 12.541 1.00 0.00 H new ATOM 0 HH12 ARG A 120 16.589 12.189 13.356 1.00 0.00 H new ATOM 0 HH21 ARG A 120 20.037 12.312 13.705 1.00 0.00 H new ATOM 0 HH22 ARG A 120 18.488 13.112 13.992 1.00 0.00 H new ATOM 1985 N ALA A 121 23.090 6.374 14.171 1.00 0.00 N ATOM 1986 CA ALA A 121 23.470 5.949 15.548 1.00 0.00 C ATOM 1987 C ALA A 121 23.905 7.156 16.417 1.00 0.00 C ATOM 1988 O ALA A 121 24.705 7.994 15.991 1.00 0.00 O ATOM 1989 CB ALA A 121 24.566 4.884 15.521 1.00 0.00 C ATOM 0 H ALA A 121 23.608 7.185 13.832 1.00 0.00 H new ATOM 0 HA ALA A 121 22.582 5.510 16.003 1.00 0.00 H new ATOM 0 HB1 ALA A 121 24.819 4.597 16.541 1.00 0.00 H new ATOM 0 HB2 ALA A 121 24.211 4.010 14.975 1.00 0.00 H new ATOM 0 HB3 ALA A 121 25.451 5.285 15.027 1.00 0.00 H new ATOM 1995 N GLU A 122 23.336 7.277 17.634 1.00 0.00 N ATOM 1996 CA GLU A 122 23.447 8.525 18.470 1.00 0.00 C ATOM 1997 C GLU A 122 22.902 9.851 17.800 1.00 0.00 C ATOM 1998 O GLU A 122 23.360 10.951 18.119 1.00 0.00 O ATOM 1999 CB GLU A 122 24.881 8.703 19.069 1.00 0.00 C ATOM 2000 CG GLU A 122 25.524 7.453 19.720 1.00 0.00 C ATOM 2001 CD GLU A 122 26.746 7.742 20.592 1.00 0.00 C ATOM 2002 OE1 GLU A 122 27.903 7.606 20.208 1.00 0.00 O ATOM 2003 OE2 GLU A 122 26.395 8.169 21.841 1.00 0.00 O ATOM 0 H GLU A 122 22.792 6.535 18.074 1.00 0.00 H new ATOM 0 HA GLU A 122 22.756 8.354 19.295 1.00 0.00 H new ATOM 0 HB2 GLU A 122 25.541 9.050 18.274 1.00 0.00 H new ATOM 0 HB3 GLU A 122 24.841 9.494 19.818 1.00 0.00 H new ATOM 0 HG2 GLU A 122 24.772 6.950 20.328 1.00 0.00 H new ATOM 0 HG3 GLU A 122 25.814 6.758 18.932 1.00 0.00 H new ATOM 2011 N GLY A 123 21.952 9.742 16.849 1.00 0.00 N ATOM 2012 CA GLY A 123 21.685 10.824 15.857 1.00 0.00 C ATOM 2013 C GLY A 123 22.467 10.794 14.511 1.00 0.00 C ATOM 2014 O GLY A 123 21.924 11.224 13.490 1.00 0.00 O ATOM 0 H GLY A 123 21.355 8.922 16.740 1.00 0.00 H new ATOM 0 HA2 GLY A 123 20.620 10.808 15.624 1.00 0.00 H new ATOM 0 HA3 GLY A 123 21.891 11.779 16.341 1.00 0.00 H new ATOM 2018 N VAL A 124 23.734 10.335 14.495 1.00 0.00 N ATOM 2019 CA VAL A 124 24.688 10.534 13.360 1.00 0.00 C ATOM 2020 C VAL A 124 24.283 9.685 12.112 1.00 0.00 C ATOM 2021 O VAL A 124 24.259 8.454 12.178 1.00 0.00 O ATOM 2022 CB VAL A 124 26.152 10.200 13.817 1.00 0.00 C ATOM 2023 CG1 VAL A 124 27.197 10.364 12.691 1.00 0.00 C ATOM 2024 CG2 VAL A 124 26.663 11.024 15.025 1.00 0.00 C ATOM 0 H VAL A 124 24.138 9.810 15.271 1.00 0.00 H new ATOM 0 HA VAL A 124 24.646 11.582 13.064 1.00 0.00 H new ATOM 0 HB VAL A 124 26.062 9.155 14.112 1.00 0.00 H new ATOM 0 HG11 VAL A 124 28.187 10.117 13.075 1.00 0.00 H new ATOM 0 HG12 VAL A 124 26.951 9.696 11.866 1.00 0.00 H new ATOM 0 HG13 VAL A 124 27.192 11.395 12.337 1.00 0.00 H new ATOM 0 HG21 VAL A 124 27.682 10.722 15.266 1.00 0.00 H new ATOM 0 HG22 VAL A 124 26.648 12.085 14.774 1.00 0.00 H new ATOM 0 HG23 VAL A 124 26.019 10.846 15.886 1.00 0.00 H new ATOM 2034 N THR A 125 24.007 10.355 10.981 1.00 0.00 N ATOM 2035 CA THR A 125 23.482 9.687 9.754 1.00 0.00 C ATOM 2036 C THR A 125 24.625 9.319 8.749 1.00 0.00 C ATOM 2037 O THR A 125 25.355 10.190 8.264 1.00 0.00 O ATOM 2038 CB THR A 125 22.379 10.572 9.093 1.00 0.00 C ATOM 2039 OG1 THR A 125 21.410 10.978 10.057 1.00 0.00 O ATOM 2040 CG2 THR A 125 21.580 9.850 7.993 1.00 0.00 C ATOM 0 H THR A 125 24.135 11.362 10.880 1.00 0.00 H new ATOM 0 HA THR A 125 23.027 8.741 10.049 1.00 0.00 H new ATOM 0 HB THR A 125 22.928 11.410 8.664 1.00 0.00 H new ATOM 0 HG1 THR A 125 20.729 11.533 9.623 1.00 0.00 H new ATOM 0 HG21 THR A 125 20.833 10.528 7.581 1.00 0.00 H new ATOM 0 HG22 THR A 125 22.257 9.532 7.200 1.00 0.00 H new ATOM 0 HG23 THR A 125 21.083 8.978 8.417 1.00 0.00 H new ATOM 2048 N CYS A 126 24.720 8.029 8.392 1.00 0.00 N ATOM 2049 CA CYS A 126 25.415 7.567 7.163 1.00 0.00 C ATOM 2050 C CYS A 126 24.411 7.411 5.978 1.00 0.00 C ATOM 2051 O CYS A 126 23.369 6.759 6.120 1.00 0.00 O ATOM 2052 CB CYS A 126 26.082 6.221 7.507 1.00 0.00 C ATOM 2053 SG CYS A 126 26.674 5.363 6.010 1.00 0.00 S ATOM 0 H CYS A 126 24.319 7.270 8.943 1.00 0.00 H new ATOM 0 HA CYS A 126 26.160 8.295 6.843 1.00 0.00 H new ATOM 0 HB2 CYS A 126 26.919 6.392 8.184 1.00 0.00 H new ATOM 0 HB3 CYS A 126 25.370 5.586 8.034 1.00 0.00 H new ATOM 0 HG CYS A 126 27.495 4.414 6.350 1.00 0.00 H new ATOM 2059 N LYS A 127 24.735 7.973 4.799 1.00 0.00 N ATOM 2060 CA LYS A 127 23.853 7.885 3.598 1.00 0.00 C ATOM 2061 C LYS A 127 24.496 6.922 2.550 1.00 0.00 C ATOM 2062 O LYS A 127 25.546 7.220 1.969 1.00 0.00 O ATOM 2063 CB LYS A 127 23.574 9.301 3.021 1.00 0.00 C ATOM 2064 CG LYS A 127 22.841 10.275 3.976 1.00 0.00 C ATOM 2065 CD LYS A 127 22.479 11.614 3.307 1.00 0.00 C ATOM 2066 CE LYS A 127 21.803 12.580 4.293 1.00 0.00 C ATOM 2067 NZ LYS A 127 21.450 13.840 3.613 1.00 0.00 N ATOM 0 H LYS A 127 25.598 8.494 4.642 1.00 0.00 H new ATOM 0 HA LYS A 127 22.885 7.469 3.878 1.00 0.00 H new ATOM 0 HB2 LYS A 127 24.524 9.750 2.730 1.00 0.00 H new ATOM 0 HB3 LYS A 127 22.981 9.194 2.113 1.00 0.00 H new ATOM 0 HG2 LYS A 127 21.931 9.800 4.342 1.00 0.00 H new ATOM 0 HG3 LYS A 127 23.471 10.467 4.844 1.00 0.00 H new ATOM 0 HD2 LYS A 127 23.381 12.076 2.906 1.00 0.00 H new ATOM 0 HD3 LYS A 127 21.813 11.431 2.464 1.00 0.00 H new ATOM 0 HE2 LYS A 127 20.907 12.119 4.708 1.00 0.00 H new ATOM 0 HE3 LYS A 127 22.472 12.785 5.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 20.994 14.484 4.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 22.312 14.285 3.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 20.795 13.640 2.830 1.00 0.00 H new ATOM 2080 N GLN A 128 23.868 5.757 2.328 1.00 0.00 N ATOM 2081 CA GLN A 128 24.338 4.741 1.345 1.00 0.00 C ATOM 2082 C GLN A 128 23.361 4.626 0.135 1.00 0.00 C ATOM 2083 O GLN A 128 22.145 4.488 0.307 1.00 0.00 O ATOM 2084 CB GLN A 128 24.504 3.378 2.071 1.00 0.00 C ATOM 2085 CG GLN A 128 25.828 3.243 2.862 1.00 0.00 C ATOM 2086 CD GLN A 128 26.055 1.906 3.578 1.00 0.00 C ATOM 2087 OE1 GLN A 128 25.294 0.947 3.498 1.00 0.00 O ATOM 2088 NE2 GLN A 128 27.143 1.788 4.296 1.00 0.00 N ATOM 0 H GLN A 128 23.018 5.483 2.820 1.00 0.00 H new ATOM 0 HA GLN A 128 25.301 5.052 0.940 1.00 0.00 H new ATOM 0 HB2 GLN A 128 23.668 3.239 2.756 1.00 0.00 H new ATOM 0 HB3 GLN A 128 24.450 2.577 1.334 1.00 0.00 H new ATOM 0 HG2 GLN A 128 26.657 3.408 2.174 1.00 0.00 H new ATOM 0 HG3 GLN A 128 25.867 4.040 3.604 1.00 0.00 H new ATOM 0 HE21 GLN A 128 27.789 2.573 4.376 1.00 0.00 H new ATOM 0 HE22 GLN A 128 27.345 0.911 4.776 1.00 0.00 H new ATOM 2097 N VAL A 129 23.908 4.645 -1.093 1.00 0.00 N ATOM 2098 CA VAL A 129 23.104 4.472 -2.344 1.00 0.00 C ATOM 2099 C VAL A 129 23.560 3.147 -3.034 1.00 0.00 C ATOM 2100 O VAL A 129 24.753 2.911 -3.255 1.00 0.00 O ATOM 2101 CB VAL A 129 23.196 5.711 -3.300 1.00 0.00 C ATOM 2102 CG1 VAL A 129 22.285 5.566 -4.544 1.00 0.00 C ATOM 2103 CG2 VAL A 129 22.799 7.047 -2.630 1.00 0.00 C ATOM 0 H VAL A 129 24.905 4.778 -1.260 1.00 0.00 H new ATOM 0 HA VAL A 129 22.047 4.403 -2.087 1.00 0.00 H new ATOM 0 HB VAL A 129 24.249 5.734 -3.580 1.00 0.00 H new ATOM 0 HG11 VAL A 129 22.385 6.450 -5.174 1.00 0.00 H new ATOM 0 HG12 VAL A 129 22.580 4.682 -5.110 1.00 0.00 H new ATOM 0 HG13 VAL A 129 21.248 5.464 -4.225 1.00 0.00 H new ATOM 0 HG21 VAL A 129 22.888 7.857 -3.354 1.00 0.00 H new ATOM 0 HG22 VAL A 129 21.769 6.986 -2.278 1.00 0.00 H new ATOM 0 HG23 VAL A 129 23.460 7.241 -1.785 1.00 0.00 H new ATOM 2113 N PHE A 130 22.584 2.305 -3.396 1.00 0.00 N ATOM 2114 CA PHE A 130 22.815 0.978 -4.027 1.00 0.00 C ATOM 2115 C PHE A 130 22.005 0.848 -5.357 1.00 0.00 C ATOM 2116 O PHE A 130 20.853 1.273 -5.423 1.00 0.00 O ATOM 2117 CB PHE A 130 22.366 -0.099 -3.001 1.00 0.00 C ATOM 2118 CG PHE A 130 23.414 -0.540 -1.973 1.00 0.00 C ATOM 2119 CD1 PHE A 130 23.686 0.226 -0.833 1.00 0.00 C ATOM 2120 CD2 PHE A 130 24.082 -1.752 -2.160 1.00 0.00 C ATOM 2121 CE1 PHE A 130 24.619 -0.221 0.101 1.00 0.00 C ATOM 2122 CE2 PHE A 130 25.016 -2.193 -1.231 1.00 0.00 C ATOM 2123 CZ PHE A 130 25.281 -1.430 -0.098 1.00 0.00 C ATOM 0 H PHE A 130 21.596 2.519 -3.262 1.00 0.00 H new ATOM 0 HA PHE A 130 23.867 0.851 -4.282 1.00 0.00 H new ATOM 0 HB2 PHE A 130 21.499 0.283 -2.462 1.00 0.00 H new ATOM 0 HB3 PHE A 130 22.037 -0.980 -3.552 1.00 0.00 H new ATOM 0 HD1 PHE A 130 23.173 1.163 -0.677 1.00 0.00 H new ATOM 0 HD2 PHE A 130 23.871 -2.351 -3.033 1.00 0.00 H new ATOM 0 HE1 PHE A 130 24.829 0.371 0.980 1.00 0.00 H new ATOM 0 HE2 PHE A 130 25.536 -3.127 -1.388 1.00 0.00 H new ATOM 0 HZ PHE A 130 26.001 -1.776 0.628 1.00 0.00 H new ATOM 2133 N LYS A 131 22.570 0.218 -6.400 1.00 0.00 N ATOM 2134 CA LYS A 131 21.888 0.038 -7.721 1.00 0.00 C ATOM 2135 C LYS A 131 21.504 -1.454 -7.992 1.00 0.00 C ATOM 2136 O LYS A 131 22.283 -2.372 -7.711 1.00 0.00 O ATOM 2137 CB LYS A 131 22.806 0.652 -8.817 1.00 0.00 C ATOM 2138 CG LYS A 131 22.120 0.967 -10.170 1.00 0.00 C ATOM 2139 CD LYS A 131 22.161 -0.188 -11.192 1.00 0.00 C ATOM 2140 CE LYS A 131 21.089 -0.035 -12.280 1.00 0.00 C ATOM 2141 NZ LYS A 131 21.124 -1.207 -13.174 1.00 0.00 N ATOM 0 H LYS A 131 23.507 -0.184 -6.366 1.00 0.00 H new ATOM 0 HA LYS A 131 20.932 0.562 -7.726 1.00 0.00 H new ATOM 0 HB2 LYS A 131 23.239 1.573 -8.427 1.00 0.00 H new ATOM 0 HB3 LYS A 131 23.631 -0.036 -9.001 1.00 0.00 H new ATOM 0 HG2 LYS A 131 21.080 1.233 -9.982 1.00 0.00 H new ATOM 0 HG3 LYS A 131 22.598 1.842 -10.610 1.00 0.00 H new ATOM 0 HD2 LYS A 131 23.146 -0.225 -11.657 1.00 0.00 H new ATOM 0 HD3 LYS A 131 22.018 -1.136 -10.673 1.00 0.00 H new ATOM 0 HE2 LYS A 131 20.103 0.058 -11.824 1.00 0.00 H new ATOM 0 HE3 LYS A 131 21.263 0.877 -12.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 20.421 -1.087 -13.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 22.072 -1.296 -13.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 20.904 -2.065 -12.630 1.00 0.00 H new ATOM 2154 N LYS A 132 20.306 -1.692 -8.567 1.00 0.00 N ATOM 2155 CA LYS A 132 19.793 -3.064 -8.842 1.00 0.00 C ATOM 2156 C LYS A 132 20.506 -3.766 -10.043 1.00 0.00 C ATOM 2157 O LYS A 132 20.406 -3.317 -11.190 1.00 0.00 O ATOM 2158 CB LYS A 132 18.259 -2.979 -9.090 1.00 0.00 C ATOM 2159 CG LYS A 132 17.507 -4.303 -8.816 1.00 0.00 C ATOM 2160 CD LYS A 132 15.983 -4.171 -9.020 1.00 0.00 C ATOM 2161 CE LYS A 132 15.175 -5.431 -8.655 1.00 0.00 C ATOM 2162 NZ LYS A 132 15.047 -5.594 -7.191 1.00 0.00 N ATOM 0 H LYS A 132 19.667 -0.950 -8.854 1.00 0.00 H new ATOM 0 HA LYS A 132 20.010 -3.681 -7.970 1.00 0.00 H new ATOM 0 HB2 LYS A 132 17.841 -2.197 -8.456 1.00 0.00 H new ATOM 0 HB3 LYS A 132 18.084 -2.680 -10.123 1.00 0.00 H new ATOM 0 HG2 LYS A 132 17.893 -5.079 -9.477 1.00 0.00 H new ATOM 0 HG3 LYS A 132 17.707 -4.626 -7.794 1.00 0.00 H new ATOM 0 HD2 LYS A 132 15.620 -3.336 -8.420 1.00 0.00 H new ATOM 0 HD3 LYS A 132 15.790 -3.921 -10.063 1.00 0.00 H new ATOM 0 HE2 LYS A 132 14.183 -5.369 -9.102 1.00 0.00 H new ATOM 0 HE3 LYS A 132 15.661 -6.310 -9.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 15.032 -6.607 -6.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 15.855 -5.140 -6.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 14.164 -5.150 -6.868 1.00 0.00 H new ATOM 2175 N VAL A 133 21.193 -4.885 -9.772 1.00 0.00 N ATOM 2176 CA VAL A 133 21.832 -5.731 -10.836 1.00 0.00 C ATOM 2177 C VAL A 133 21.032 -7.041 -11.160 1.00 0.00 C ATOM 2178 O VAL A 133 20.922 -7.393 -12.337 1.00 0.00 O ATOM 2179 CB VAL A 133 23.366 -5.943 -10.602 1.00 0.00 C ATOM 2180 CG1 VAL A 133 24.150 -4.612 -10.622 1.00 0.00 C ATOM 2181 CG2 VAL A 133 23.756 -6.715 -9.324 1.00 0.00 C ATOM 0 H VAL A 133 21.331 -5.241 -8.826 1.00 0.00 H new ATOM 0 HA VAL A 133 21.770 -5.154 -11.759 1.00 0.00 H new ATOM 0 HB VAL A 133 23.644 -6.573 -11.447 1.00 0.00 H new ATOM 0 HG11 VAL A 133 25.209 -4.811 -10.455 1.00 0.00 H new ATOM 0 HG12 VAL A 133 24.020 -4.127 -11.590 1.00 0.00 H new ATOM 0 HG13 VAL A 133 23.776 -3.957 -9.835 1.00 0.00 H new ATOM 0 HG21 VAL A 133 24.841 -6.801 -9.268 1.00 0.00 H new ATOM 0 HG22 VAL A 133 23.388 -6.179 -8.449 1.00 0.00 H new ATOM 0 HG23 VAL A 133 23.314 -7.711 -9.352 1.00 0.00 H new ATOM 2191 N HIS A 134 20.451 -7.739 -10.160 1.00 0.00 N ATOM 2192 CA HIS A 134 19.402 -8.765 -10.394 1.00 0.00 C ATOM 2193 C HIS A 134 18.037 -8.153 -9.991 1.00 0.00 C ATOM 2194 O HIS A 134 17.200 -7.914 -10.890 1.00 0.00 O ATOM 2195 CB HIS A 134 19.778 -10.050 -9.613 1.00 0.00 C ATOM 2196 CG HIS A 134 18.869 -11.255 -9.849 1.00 0.00 C ATOM 2197 ND1 HIS A 134 19.114 -12.238 -10.783 1.00 0.00 N ATOM 2198 CD2 HIS A 134 17.696 -11.557 -9.134 1.00 0.00 C ATOM 2199 CE1 HIS A 134 18.047 -13.066 -10.544 1.00 0.00 C ATOM 2200 NE2 HIS A 134 17.133 -12.746 -9.573 1.00 0.00 N ATOM 2201 OXT HIS A 134 17.796 -7.913 -8.784 1.00 0.00 O ATOM 0 H HIS A 134 20.690 -7.612 -9.177 1.00 0.00 H new ATOM 0 HA HIS A 134 19.325 -9.057 -11.441 1.00 0.00 H new ATOM 0 HB2 HIS A 134 20.798 -10.329 -9.878 1.00 0.00 H new ATOM 0 HB3 HIS A 134 19.777 -9.820 -8.548 1.00 0.00 H new ATOM 0 HD2 HIS A 134 17.287 -10.943 -8.346 1.00 0.00 H new ATOM 0 HE1 HIS A 134 17.927 -13.971 -11.121 1.00 0.00 H new ATOM 0 HE2 HIS A 134 16.292 -13.235 -9.266 1.00 0.00 H new TER 2209 HIS A 134