USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 839 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 101 THR OG1 : rot 180:sc= 0.331 USER MOD Set 1.2: A 106 THR OG1 : rot -152:sc= 0.357 USER MOD Set 2.1: A 97 THR OG1 : rot -140:sc= 0.891 USER MOD Set 2.2: A 112 LYS NZ :NH3+ 156:sc= 1.9 (180deg=0.991) USER MOD Set 3.1: A 71 SER OG : rot 70:sc= 2.27 USER MOD Set 3.2: A 86 THR OG1 : rot 33:sc= 0.318 USER MOD Set 4.1: A 74 ASN : amide:sc= 0.726 X(o=1.4,f=1.1) USER MOD Set 4.2: A 89 SER OG : rot 175:sc= 0.652 USER MOD Set 5.1: A 73 TYR OH : rot 30:sc= 1.24 USER MOD Set 5.2: A 83 THR OG1 : rot 120:sc= 1.02 USER MOD Set 6.1: A 57 ASN : amide:sc= 0.788 K(o=2.8,f=0.87) USER MOD Set 6.2: A 72 GLN : amide:sc= 1.41 K(o=2.8,f=0.43) USER MOD Set 6.3: A 87 SER OG : rot 150:sc= 0.637 USER MOD Set 7.1: A 49 LYS NZ :NH3+ -161:sc= 1.77 (180deg=1.09) USER MOD Set 7.2: A 64 TYR OH : rot 180:sc= 0.146 USER MOD Set 8.1: A 42 GLN : amide:sc= 0.349 K(o=0.68,f=-0.16) USER MOD Set 8.2: A 44 SER OG : rot 180:sc= 0.33 USER MOD Set 9.1: A 23 THR OG1 : rot 74:sc= 0.709 USER MOD Set 9.2: A 39 THR OG1 : rot 180:sc= 0 USER MOD Set10.1: A 14 ASN : amide:sc= 1.05 K(o=2.9,f=0.58) USER MOD Set10.2: A 29 ASN : amide:sc= 1.85 K(o=2.9,f=-0.59) USER MOD Set11.1: A 12 THR OG1 : rot -82:sc= 1.98 USER MOD Set11.2: A 15 SER OG : rot 112:sc= 1.85 USER MOD Set12.1: A 8 ASN : amide:sc= 0.674 K(o=2.5,f=0.68) USER MOD Set12.2: A 24 ASN : amide:sc= 1.58 K(o=2.5,f=0.21) USER MOD Set12.3: A 26 TYR OH : rot 180:sc= 0.248 USER MOD Set13.1: A 6 ASN : amide:sc= 1.63 K(o=2.3,f=-11!) USER MOD Set13.2: A 9 SER OG : rot 87:sc= 0.667 USER MOD Single : A 1 ASP N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 156:sc= 0.589 USER MOD Single : A 7 THR OG1 : rot 77:sc= 0.814 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 16 GLN : amide:sc= 1.13 K(o=1.1,f=-0.13) USER MOD Single : A 19 LYS NZ :NH3+ -177:sc= 1.23 (180deg=1.2) USER MOD Single : A 20 SER OG : rot 145:sc= 1.28 USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 78:sc= 1.95 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.539 USER MOD Single : A 36 SER OG : rot 79:sc= 1.48 USER MOD Single : A 41 SER OG : rot 62:sc= 1.71 USER MOD Single : A 43 TYR OH : rot 174:sc= -0.604 USER MOD Single : A 47 ASN : amide:sc= -0.0104 K(o=-0.01,f=-1.7!) USER MOD Single : A 50 LYS NZ :NH3+ 165:sc= 0.974 (180deg=0.556) USER MOD Single : A 51 SER OG : rot 62:sc= 1.62 USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.0289 USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 64:sc= 1.65 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 THR OG1 : rot 73:sc= 1.39 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 59:sc= 1.76 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot -18:sc= 1.06 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 121 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 7.719 -14.358 -2.699 1.00 0.00 N ATOM 2 CA ASP A 1 6.589 -13.458 -2.382 1.00 0.00 C ATOM 3 C ASP A 1 7.000 -12.457 -1.306 1.00 0.00 C ATOM 4 O ASP A 1 7.482 -12.854 -0.244 1.00 0.00 O ATOM 5 CB ASP A 1 5.350 -14.241 -1.925 1.00 0.00 C ATOM 6 CG ASP A 1 4.229 -13.271 -1.529 1.00 0.00 C ATOM 7 OD1 ASP A 1 3.782 -12.482 -2.391 1.00 0.00 O ATOM 8 OD2 ASP A 1 3.779 -13.300 -0.362 1.00 0.00 O ATOM 0 H1 ASP A 1 7.428 -15.035 -3.433 1.00 0.00 H new ATOM 0 H2 ASP A 1 8.523 -13.797 -3.045 1.00 0.00 H new ATOM 0 H3 ASP A 1 8.001 -14.876 -1.842 1.00 0.00 H new ATOM 0 HA ASP A 1 6.327 -12.923 -3.295 1.00 0.00 H new ATOM 0 HB2 ASP A 1 5.008 -14.896 -2.726 1.00 0.00 H new ATOM 0 HB3 ASP A 1 5.605 -14.879 -1.079 1.00 0.00 H new ATOM 15 N GLY A 2 6.832 -11.160 -1.566 1.00 0.00 N ATOM 16 CA GLY A 2 7.185 -10.081 -0.653 1.00 0.00 C ATOM 17 C GLY A 2 6.959 -8.735 -1.339 1.00 0.00 C ATOM 18 O GLY A 2 6.494 -8.689 -2.483 1.00 0.00 O ATOM 0 H GLY A 2 6.435 -10.825 -2.444 1.00 0.00 H new ATOM 0 HA2 GLY A 2 6.581 -10.145 0.252 1.00 0.00 H new ATOM 0 HA3 GLY A 2 8.227 -10.175 -0.349 1.00 0.00 H new ATOM 22 N THR A 3 7.308 -7.649 -0.656 1.00 0.00 N ATOM 23 CA THR A 3 7.224 -6.281 -1.157 1.00 0.00 C ATOM 24 C THR A 3 8.465 -5.574 -0.619 1.00 0.00 C ATOM 25 O THR A 3 8.682 -5.531 0.592 1.00 0.00 O ATOM 26 CB THR A 3 5.900 -5.613 -0.719 1.00 0.00 C ATOM 27 OG1 THR A 3 5.582 -5.905 0.633 1.00 0.00 O ATOM 28 CG2 THR A 3 4.718 -6.073 -1.577 1.00 0.00 C ATOM 0 H THR A 3 7.670 -7.699 0.296 1.00 0.00 H new ATOM 0 HA THR A 3 7.208 -6.234 -2.246 1.00 0.00 H new ATOM 0 HB THR A 3 6.060 -4.542 -0.843 1.00 0.00 H new ATOM 0 HG1 THR A 3 4.998 -5.204 0.990 1.00 0.00 H new ATOM 0 HG21 THR A 3 3.807 -5.580 -1.236 1.00 0.00 H new ATOM 0 HG22 THR A 3 4.903 -5.814 -2.620 1.00 0.00 H new ATOM 0 HG23 THR A 3 4.601 -7.153 -1.487 1.00 0.00 H new ATOM 36 N CYS A 4 9.332 -5.076 -1.502 1.00 0.00 N ATOM 37 CA CYS A 4 10.642 -4.590 -1.103 1.00 0.00 C ATOM 38 C CYS A 4 11.043 -3.462 -2.045 1.00 0.00 C ATOM 39 O CYS A 4 11.173 -3.679 -3.253 1.00 0.00 O ATOM 40 CB CYS A 4 11.616 -5.776 -1.164 1.00 0.00 C ATOM 41 SG CYS A 4 13.095 -5.675 -0.129 1.00 0.00 S ATOM 0 H CYS A 4 9.144 -5.001 -2.502 1.00 0.00 H new ATOM 0 HA CYS A 4 10.646 -4.192 -0.088 1.00 0.00 H new ATOM 0 HB2 CYS A 4 11.070 -6.678 -0.888 1.00 0.00 H new ATOM 0 HB3 CYS A 4 11.934 -5.901 -2.199 1.00 0.00 H new ATOM 46 N VAL A 5 11.227 -2.258 -1.505 1.00 0.00 N ATOM 47 CA VAL A 5 11.755 -1.111 -2.237 1.00 0.00 C ATOM 48 C VAL A 5 13.276 -1.309 -2.281 1.00 0.00 C ATOM 49 O VAL A 5 14.024 -0.717 -1.500 1.00 0.00 O ATOM 50 CB VAL A 5 11.284 0.213 -1.588 1.00 0.00 C ATOM 51 CG1 VAL A 5 11.690 1.427 -2.437 1.00 0.00 C ATOM 52 CG2 VAL A 5 9.755 0.247 -1.408 1.00 0.00 C ATOM 0 H VAL A 5 11.009 -2.050 -0.530 1.00 0.00 H new ATOM 0 HA VAL A 5 11.382 -1.043 -3.259 1.00 0.00 H new ATOM 0 HB VAL A 5 11.768 0.262 -0.613 1.00 0.00 H new ATOM 0 HG11 VAL A 5 11.344 2.341 -1.954 1.00 0.00 H new ATOM 0 HG12 VAL A 5 12.775 1.456 -2.535 1.00 0.00 H new ATOM 0 HG13 VAL A 5 11.239 1.347 -3.426 1.00 0.00 H new ATOM 0 HG21 VAL A 5 9.464 1.192 -0.950 1.00 0.00 H new ATOM 0 HG22 VAL A 5 9.272 0.151 -2.380 1.00 0.00 H new ATOM 0 HG23 VAL A 5 9.446 -0.578 -0.766 1.00 0.00 H new ATOM 62 N ASN A 6 13.725 -2.247 -3.118 1.00 0.00 N ATOM 63 CA ASN A 6 15.117 -2.668 -3.176 1.00 0.00 C ATOM 64 C ASN A 6 15.869 -1.844 -4.218 1.00 0.00 C ATOM 65 O ASN A 6 15.458 -1.783 -5.380 1.00 0.00 O ATOM 66 CB ASN A 6 15.217 -4.165 -3.511 1.00 0.00 C ATOM 67 CG ASN A 6 16.669 -4.620 -3.508 1.00 0.00 C ATOM 68 OD1 ASN A 6 17.528 -3.955 -2.935 1.00 0.00 O ATOM 69 ND2 ASN A 6 16.985 -5.739 -4.138 1.00 0.00 N ATOM 0 H ASN A 6 13.122 -2.737 -3.779 1.00 0.00 H new ATOM 0 HA ASN A 6 15.570 -2.504 -2.198 1.00 0.00 H new ATOM 0 HB2 ASN A 6 14.647 -4.744 -2.784 1.00 0.00 H new ATOM 0 HB3 ASN A 6 14.773 -4.355 -4.488 1.00 0.00 H new ATOM 0 HD21 ASN A 6 17.953 -6.060 -4.152 1.00 0.00 H new ATOM 0 HD22 ASN A 6 16.261 -6.281 -4.609 1.00 0.00 H new ATOM 76 N THR A 7 16.974 -1.229 -3.805 1.00 0.00 N ATOM 77 CA THR A 7 17.838 -0.427 -4.660 1.00 0.00 C ATOM 78 C THR A 7 18.783 -1.345 -5.459 1.00 0.00 C ATOM 79 O THR A 7 18.795 -1.288 -6.690 1.00 0.00 O ATOM 80 CB THR A 7 18.613 0.580 -3.783 1.00 0.00 C ATOM 81 OG1 THR A 7 17.752 1.217 -2.855 1.00 0.00 O ATOM 82 CG2 THR A 7 19.306 1.660 -4.614 1.00 0.00 C ATOM 0 H THR A 7 17.300 -1.277 -2.840 1.00 0.00 H new ATOM 0 HA THR A 7 17.245 0.134 -5.383 1.00 0.00 H new ATOM 0 HB THR A 7 19.370 -0.001 -3.256 1.00 0.00 H new ATOM 0 HG1 THR A 7 17.554 0.603 -2.118 1.00 0.00 H new ATOM 0 HG21 THR A 7 19.837 2.344 -3.952 1.00 0.00 H new ATOM 0 HG22 THR A 7 20.015 1.194 -5.298 1.00 0.00 H new ATOM 0 HG23 THR A 7 18.561 2.214 -5.185 1.00 0.00 H new ATOM 90 N ASN A 8 19.566 -2.195 -4.772 1.00 0.00 N ATOM 91 CA ASN A 8 20.593 -3.062 -5.377 1.00 0.00 C ATOM 92 C ASN A 8 20.983 -4.239 -4.459 1.00 0.00 C ATOM 93 O ASN A 8 22.017 -4.879 -4.649 1.00 0.00 O ATOM 94 CB ASN A 8 21.846 -2.224 -5.714 1.00 0.00 C ATOM 95 CG ASN A 8 22.796 -2.965 -6.658 1.00 0.00 C ATOM 96 OD1 ASN A 8 22.399 -3.402 -7.735 1.00 0.00 O ATOM 97 ND2 ASN A 8 24.063 -3.103 -6.306 1.00 0.00 N ATOM 0 H ASN A 8 19.501 -2.301 -3.760 1.00 0.00 H new ATOM 0 HA ASN A 8 20.169 -3.487 -6.287 1.00 0.00 H new ATOM 0 HB2 ASN A 8 21.540 -1.284 -6.172 1.00 0.00 H new ATOM 0 HB3 ASN A 8 22.373 -1.973 -4.793 1.00 0.00 H new ATOM 0 HD21 ASN A 8 24.717 -3.575 -6.930 1.00 0.00 H new ATOM 0 HD22 ASN A 8 24.386 -2.738 -5.410 1.00 0.00 H new ATOM 104 N SER A 9 20.212 -4.475 -3.399 1.00 0.00 N ATOM 105 CA SER A 9 20.526 -5.431 -2.344 1.00 0.00 C ATOM 106 C SER A 9 20.338 -6.865 -2.824 1.00 0.00 C ATOM 107 O SER A 9 19.572 -7.124 -3.759 1.00 0.00 O ATOM 108 CB SER A 9 19.615 -5.173 -1.139 1.00 0.00 C ATOM 109 OG SER A 9 19.560 -3.777 -0.887 1.00 0.00 O ATOM 0 H SER A 9 19.327 -3.991 -3.248 1.00 0.00 H new ATOM 0 HA SER A 9 21.571 -5.300 -2.062 1.00 0.00 H new ATOM 0 HB2 SER A 9 18.615 -5.559 -1.335 1.00 0.00 H new ATOM 0 HB3 SER A 9 19.994 -5.698 -0.262 1.00 0.00 H new ATOM 0 HG SER A 9 18.852 -3.374 -1.432 1.00 0.00 H new ATOM 115 N GLN A 10 20.985 -7.794 -2.122 1.00 0.00 N ATOM 116 CA GLN A 10 20.791 -9.221 -2.268 1.00 0.00 C ATOM 117 C GLN A 10 19.808 -9.651 -1.184 1.00 0.00 C ATOM 118 O GLN A 10 19.979 -9.319 -0.008 1.00 0.00 O ATOM 119 CB GLN A 10 22.159 -9.920 -2.169 1.00 0.00 C ATOM 120 CG GLN A 10 22.137 -11.323 -1.541 1.00 0.00 C ATOM 121 CD GLN A 10 23.514 -11.994 -1.526 1.00 0.00 C ATOM 122 OE1 GLN A 10 24.269 -11.947 -2.495 1.00 0.00 O ATOM 123 NE2 GLN A 10 23.882 -12.628 -0.423 1.00 0.00 N ATOM 0 H GLN A 10 21.680 -7.558 -1.414 1.00 0.00 H new ATOM 0 HA GLN A 10 20.373 -9.497 -3.236 1.00 0.00 H new ATOM 0 HB2 GLN A 10 22.583 -9.995 -3.170 1.00 0.00 H new ATOM 0 HB3 GLN A 10 22.829 -9.289 -1.585 1.00 0.00 H new ATOM 0 HG2 GLN A 10 21.762 -11.252 -0.520 1.00 0.00 H new ATOM 0 HG3 GLN A 10 21.439 -11.951 -2.094 1.00 0.00 H new ATOM 0 HE21 GLN A 10 23.252 -12.664 0.379 1.00 0.00 H new ATOM 0 HE22 GLN A 10 24.795 -13.080 -0.375 1.00 0.00 H new ATOM 132 N ILE A 11 18.831 -10.454 -1.592 1.00 0.00 N ATOM 133 CA ILE A 11 17.867 -11.128 -0.734 1.00 0.00 C ATOM 134 C ILE A 11 17.858 -12.566 -1.246 1.00 0.00 C ATOM 135 O ILE A 11 17.524 -12.810 -2.409 1.00 0.00 O ATOM 136 CB ILE A 11 16.474 -10.443 -0.757 1.00 0.00 C ATOM 137 CG1 ILE A 11 16.541 -8.926 -0.453 1.00 0.00 C ATOM 138 CG2 ILE A 11 15.547 -11.106 0.283 1.00 0.00 C ATOM 139 CD1 ILE A 11 16.571 -8.047 -1.708 1.00 0.00 C ATOM 0 H ILE A 11 18.684 -10.662 -2.580 1.00 0.00 H new ATOM 0 HA ILE A 11 18.138 -11.085 0.321 1.00 0.00 H new ATOM 0 HB ILE A 11 16.086 -10.567 -1.768 1.00 0.00 H new ATOM 0 HG12 ILE A 11 15.680 -8.648 0.154 1.00 0.00 H new ATOM 0 HG13 ILE A 11 17.430 -8.723 0.143 1.00 0.00 H new ATOM 0 HG21 ILE A 11 14.571 -10.621 0.262 1.00 0.00 H new ATOM 0 HG22 ILE A 11 15.432 -12.164 0.046 1.00 0.00 H new ATOM 0 HG23 ILE A 11 15.982 -11.002 1.277 1.00 0.00 H new ATOM 0 HD11 ILE A 11 16.618 -6.998 -1.416 1.00 0.00 H new ATOM 0 HD12 ILE A 11 17.447 -8.297 -2.306 1.00 0.00 H new ATOM 0 HD13 ILE A 11 15.669 -8.220 -2.295 1.00 0.00 H new ATOM 151 N THR A 12 18.341 -13.491 -0.418 1.00 0.00 N ATOM 152 CA THR A 12 18.536 -14.885 -0.820 1.00 0.00 C ATOM 153 C THR A 12 17.193 -15.617 -0.992 1.00 0.00 C ATOM 154 O THR A 12 16.131 -15.109 -0.619 1.00 0.00 O ATOM 155 CB THR A 12 19.493 -15.591 0.163 1.00 0.00 C ATOM 156 OG1 THR A 12 19.202 -15.241 1.499 1.00 0.00 O ATOM 157 CG2 THR A 12 20.952 -15.215 -0.107 1.00 0.00 C ATOM 0 H THR A 12 18.608 -13.297 0.547 1.00 0.00 H new ATOM 0 HA THR A 12 19.009 -14.908 -1.802 1.00 0.00 H new ATOM 0 HB THR A 12 19.350 -16.661 0.013 1.00 0.00 H new ATOM 0 HG1 THR A 12 19.623 -14.382 1.711 1.00 0.00 H new ATOM 0 HG21 THR A 12 21.598 -15.730 0.604 1.00 0.00 H new ATOM 0 HG22 THR A 12 21.222 -15.509 -1.121 1.00 0.00 H new ATOM 0 HG23 THR A 12 21.077 -14.138 0.004 1.00 0.00 H new ATOM 165 N ALA A 13 17.245 -16.831 -1.557 1.00 0.00 N ATOM 166 CA ALA A 13 16.080 -17.636 -1.922 1.00 0.00 C ATOM 167 C ALA A 13 15.132 -17.925 -0.751 1.00 0.00 C ATOM 168 O ALA A 13 13.941 -18.149 -0.981 1.00 0.00 O ATOM 169 CB ALA A 13 16.571 -18.963 -2.508 1.00 0.00 C ATOM 0 H ALA A 13 18.128 -17.291 -1.778 1.00 0.00 H new ATOM 0 HA ALA A 13 15.507 -17.057 -2.646 1.00 0.00 H new ATOM 0 HB1 ALA A 13 15.714 -19.577 -2.786 1.00 0.00 H new ATOM 0 HB2 ALA A 13 17.180 -18.768 -3.391 1.00 0.00 H new ATOM 0 HB3 ALA A 13 17.169 -19.490 -1.764 1.00 0.00 H new ATOM 175 N ASN A 14 15.641 -17.923 0.485 1.00 0.00 N ATOM 176 CA ASN A 14 14.861 -18.177 1.701 1.00 0.00 C ATOM 177 C ASN A 14 14.945 -16.982 2.658 1.00 0.00 C ATOM 178 O ASN A 14 14.959 -17.139 3.881 1.00 0.00 O ATOM 179 CB ASN A 14 15.273 -19.509 2.347 1.00 0.00 C ATOM 180 CG ASN A 14 14.226 -19.970 3.364 1.00 0.00 C ATOM 181 OD1 ASN A 14 13.046 -20.092 3.046 1.00 0.00 O ATOM 182 ND2 ASN A 14 14.617 -20.260 4.592 1.00 0.00 N ATOM 0 H ASN A 14 16.627 -17.741 0.672 1.00 0.00 H new ATOM 0 HA ASN A 14 13.809 -18.283 1.436 1.00 0.00 H new ATOM 0 HB2 ASN A 14 15.396 -20.269 1.576 1.00 0.00 H new ATOM 0 HB3 ASN A 14 16.239 -19.396 2.839 1.00 0.00 H new ATOM 0 HD21 ASN A 14 13.938 -20.586 5.280 1.00 0.00 H new ATOM 0 HD22 ASN A 14 15.598 -20.157 4.853 1.00 0.00 H new ATOM 189 N SER A 15 15.009 -15.781 2.086 1.00 0.00 N ATOM 190 CA SER A 15 14.950 -14.506 2.784 1.00 0.00 C ATOM 191 C SER A 15 13.777 -13.693 2.236 1.00 0.00 C ATOM 192 O SER A 15 13.253 -14.019 1.165 1.00 0.00 O ATOM 193 CB SER A 15 16.264 -13.767 2.567 1.00 0.00 C ATOM 194 OG SER A 15 17.318 -14.453 3.201 1.00 0.00 O ATOM 0 H SER A 15 15.108 -15.669 1.077 1.00 0.00 H new ATOM 0 HA SER A 15 14.802 -14.659 3.853 1.00 0.00 H new ATOM 0 HB2 SER A 15 16.468 -13.678 1.500 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.190 -12.754 2.963 1.00 0.00 H new ATOM 0 HG SER A 15 17.925 -14.819 2.524 1.00 0.00 H new ATOM 200 N GLN A 16 13.336 -12.651 2.953 1.00 0.00 N ATOM 201 CA GLN A 16 12.117 -11.942 2.590 1.00 0.00 C ATOM 202 C GLN A 16 12.148 -10.520 3.141 1.00 0.00 C ATOM 203 O GLN A 16 12.686 -10.277 4.225 1.00 0.00 O ATOM 204 CB GLN A 16 10.918 -12.714 3.185 1.00 0.00 C ATOM 205 CG GLN A 16 9.549 -12.251 2.657 1.00 0.00 C ATOM 206 CD GLN A 16 8.385 -13.012 3.303 1.00 0.00 C ATOM 207 OE1 GLN A 16 8.349 -13.238 4.510 1.00 0.00 O ATOM 208 NE2 GLN A 16 7.400 -13.422 2.523 1.00 0.00 N ATOM 0 H GLN A 16 13.807 -12.287 3.782 1.00 0.00 H new ATOM 0 HA GLN A 16 12.028 -11.883 1.505 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.039 -13.775 2.968 1.00 0.00 H new ATOM 0 HB3 GLN A 16 10.932 -12.607 4.270 1.00 0.00 H new ATOM 0 HG2 GLN A 16 9.432 -11.184 2.847 1.00 0.00 H new ATOM 0 HG3 GLN A 16 9.514 -12.389 1.576 1.00 0.00 H new ATOM 0 HE21 GLN A 16 7.431 -13.234 1.521 1.00 0.00 H new ATOM 0 HE22 GLN A 16 6.609 -13.927 2.923 1.00 0.00 H new ATOM 217 N CYS A 17 11.518 -9.602 2.412 1.00 0.00 N ATOM 218 CA CYS A 17 11.223 -8.255 2.866 1.00 0.00 C ATOM 219 C CYS A 17 9.776 -7.941 2.486 1.00 0.00 C ATOM 220 O CYS A 17 9.273 -8.434 1.473 1.00 0.00 O ATOM 221 CB CYS A 17 12.221 -7.204 2.350 1.00 0.00 C ATOM 222 SG CYS A 17 13.077 -7.505 0.778 1.00 0.00 S ATOM 0 H CYS A 17 11.191 -9.785 1.463 1.00 0.00 H new ATOM 0 HA CYS A 17 11.337 -8.208 3.949 1.00 0.00 H new ATOM 0 HB2 CYS A 17 11.686 -6.259 2.258 1.00 0.00 H new ATOM 0 HB3 CYS A 17 12.982 -7.067 3.118 1.00 0.00 H new ATOM 227 N VAL A 18 9.096 -7.172 3.340 1.00 0.00 N ATOM 228 CA VAL A 18 7.671 -6.875 3.229 1.00 0.00 C ATOM 229 C VAL A 18 7.504 -5.423 3.679 1.00 0.00 C ATOM 230 O VAL A 18 7.826 -5.089 4.821 1.00 0.00 O ATOM 231 CB VAL A 18 6.828 -7.872 4.064 1.00 0.00 C ATOM 232 CG1 VAL A 18 5.325 -7.612 3.899 1.00 0.00 C ATOM 233 CG2 VAL A 18 7.085 -9.338 3.675 1.00 0.00 C ATOM 0 H VAL A 18 9.535 -6.729 4.147 1.00 0.00 H new ATOM 0 HA VAL A 18 7.308 -6.990 2.208 1.00 0.00 H new ATOM 0 HB VAL A 18 7.137 -7.711 5.097 1.00 0.00 H new ATOM 0 HG11 VAL A 18 4.764 -8.329 4.498 1.00 0.00 H new ATOM 0 HG12 VAL A 18 5.092 -6.600 4.231 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.050 -7.722 2.850 1.00 0.00 H new ATOM 0 HG21 VAL A 18 6.468 -9.992 4.292 1.00 0.00 H new ATOM 0 HG22 VAL A 18 6.832 -9.485 2.625 1.00 0.00 H new ATOM 0 HG23 VAL A 18 8.137 -9.577 3.832 1.00 0.00 H new ATOM 243 N LYS A 19 7.060 -4.557 2.766 1.00 0.00 N ATOM 244 CA LYS A 19 6.994 -3.089 2.851 1.00 0.00 C ATOM 245 C LYS A 19 8.358 -2.396 2.998 1.00 0.00 C ATOM 246 O LYS A 19 8.445 -1.195 2.744 1.00 0.00 O ATOM 247 CB LYS A 19 6.041 -2.620 3.966 1.00 0.00 C ATOM 248 CG LYS A 19 4.673 -3.317 3.981 1.00 0.00 C ATOM 249 CD LYS A 19 3.737 -2.784 5.077 1.00 0.00 C ATOM 250 CE LYS A 19 4.208 -3.260 6.459 1.00 0.00 C ATOM 251 NZ LYS A 19 3.415 -2.690 7.573 1.00 0.00 N ATOM 0 H LYS A 19 6.706 -4.889 1.869 1.00 0.00 H new ATOM 0 HA LYS A 19 6.596 -2.782 1.884 1.00 0.00 H new ATOM 0 HB2 LYS A 19 6.525 -2.780 4.929 1.00 0.00 H new ATOM 0 HB3 LYS A 19 5.885 -1.546 3.863 1.00 0.00 H new ATOM 0 HG2 LYS A 19 4.196 -3.188 3.010 1.00 0.00 H new ATOM 0 HG3 LYS A 19 4.819 -4.388 4.125 1.00 0.00 H new ATOM 0 HD2 LYS A 19 3.716 -1.695 5.048 1.00 0.00 H new ATOM 0 HD3 LYS A 19 2.719 -3.128 4.894 1.00 0.00 H new ATOM 0 HE2 LYS A 19 4.151 -4.348 6.500 1.00 0.00 H new ATOM 0 HE3 LYS A 19 5.256 -2.990 6.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 3.812 -3.008 8.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 3.447 -1.652 7.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 2.428 -3.010 7.496 1.00 0.00 H new ATOM 265 N SER A 20 9.398 -3.104 3.432 1.00 0.00 N ATOM 266 CA SER A 20 10.707 -2.551 3.741 1.00 0.00 C ATOM 267 C SER A 20 11.408 -1.932 2.529 1.00 0.00 C ATOM 268 O SER A 20 11.075 -2.212 1.374 1.00 0.00 O ATOM 269 CB SER A 20 11.558 -3.664 4.355 1.00 0.00 C ATOM 270 OG SER A 20 10.865 -4.242 5.447 1.00 0.00 O ATOM 0 H SER A 20 9.347 -4.112 3.582 1.00 0.00 H new ATOM 0 HA SER A 20 10.574 -1.729 4.445 1.00 0.00 H new ATOM 0 HB2 SER A 20 11.776 -4.425 3.606 1.00 0.00 H new ATOM 0 HB3 SER A 20 12.515 -3.262 4.689 1.00 0.00 H new ATOM 0 HG SER A 20 11.063 -5.201 5.490 1.00 0.00 H new ATOM 276 N THR A 21 12.436 -1.138 2.813 1.00 0.00 N ATOM 277 CA THR A 21 13.338 -0.542 1.834 1.00 0.00 C ATOM 278 C THR A 21 14.712 -1.194 2.024 1.00 0.00 C ATOM 279 O THR A 21 15.059 -1.579 3.143 1.00 0.00 O ATOM 280 CB THR A 21 13.348 0.982 2.061 1.00 0.00 C ATOM 281 OG1 THR A 21 12.030 1.494 1.969 1.00 0.00 O ATOM 282 CG2 THR A 21 14.213 1.749 1.055 1.00 0.00 C ATOM 0 H THR A 21 12.673 -0.882 3.772 1.00 0.00 H new ATOM 0 HA THR A 21 13.027 -0.712 0.803 1.00 0.00 H new ATOM 0 HB THR A 21 13.773 1.127 3.054 1.00 0.00 H new ATOM 0 HG1 THR A 21 12.044 2.463 2.116 1.00 0.00 H new ATOM 0 HG21 THR A 21 14.171 2.815 1.278 1.00 0.00 H new ATOM 0 HG22 THR A 21 15.245 1.404 1.125 1.00 0.00 H new ATOM 0 HG23 THR A 21 13.839 1.574 0.046 1.00 0.00 H new ATOM 290 N ALA A 22 15.504 -1.336 0.958 1.00 0.00 N ATOM 291 CA ALA A 22 16.819 -1.951 1.046 1.00 0.00 C ATOM 292 C ALA A 22 17.792 -1.207 0.142 1.00 0.00 C ATOM 293 O ALA A 22 17.488 -0.955 -1.028 1.00 0.00 O ATOM 294 CB ALA A 22 16.714 -3.441 0.692 1.00 0.00 C ATOM 0 H ALA A 22 15.249 -1.029 0.019 1.00 0.00 H new ATOM 0 HA ALA A 22 17.203 -1.883 2.064 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.700 -3.901 0.758 1.00 0.00 H new ATOM 0 HB2 ALA A 22 16.036 -3.934 1.389 1.00 0.00 H new ATOM 0 HB3 ALA A 22 16.331 -3.548 -0.323 1.00 0.00 H new ATOM 300 N THR A 23 18.970 -0.886 0.674 1.00 0.00 N ATOM 301 CA THR A 23 19.927 0.007 0.029 1.00 0.00 C ATOM 302 C THR A 23 21.307 -0.668 -0.020 1.00 0.00 C ATOM 303 O THR A 23 22.173 -0.418 0.822 1.00 0.00 O ATOM 304 CB THR A 23 19.904 1.400 0.711 1.00 0.00 C ATOM 305 OG1 THR A 23 18.646 1.688 1.301 1.00 0.00 O ATOM 306 CG2 THR A 23 20.242 2.515 -0.282 1.00 0.00 C ATOM 0 H THR A 23 19.289 -1.243 1.575 1.00 0.00 H new ATOM 0 HA THR A 23 19.650 0.194 -1.008 1.00 0.00 H new ATOM 0 HB THR A 23 20.662 1.361 1.494 1.00 0.00 H new ATOM 0 HG1 THR A 23 18.539 1.158 2.118 1.00 0.00 H new ATOM 0 HG21 THR A 23 20.217 3.477 0.229 1.00 0.00 H new ATOM 0 HG22 THR A 23 21.238 2.348 -0.692 1.00 0.00 H new ATOM 0 HG23 THR A 23 19.512 2.515 -1.091 1.00 0.00 H new ATOM 314 N ASN A 24 21.497 -1.551 -1.009 1.00 0.00 N ATOM 315 CA ASN A 24 22.699 -2.365 -1.217 1.00 0.00 C ATOM 316 C ASN A 24 23.075 -3.142 0.052 1.00 0.00 C ATOM 317 O ASN A 24 24.150 -2.956 0.625 1.00 0.00 O ATOM 318 CB ASN A 24 23.847 -1.534 -1.819 1.00 0.00 C ATOM 319 CG ASN A 24 24.912 -2.435 -2.444 1.00 0.00 C ATOM 320 OD1 ASN A 24 24.986 -2.557 -3.663 1.00 0.00 O ATOM 321 ND2 ASN A 24 25.730 -3.096 -1.645 1.00 0.00 N ATOM 0 H ASN A 24 20.784 -1.724 -1.717 1.00 0.00 H new ATOM 0 HA ASN A 24 22.478 -3.127 -1.965 1.00 0.00 H new ATOM 0 HB2 ASN A 24 23.451 -0.856 -2.575 1.00 0.00 H new ATOM 0 HB3 ASN A 24 24.299 -0.917 -1.042 1.00 0.00 H new ATOM 0 HD21 ASN A 24 26.436 -3.718 -2.039 1.00 0.00 H new ATOM 0 HD22 ASN A 24 25.656 -2.984 -0.634 1.00 0.00 H new ATOM 328 N CYS A 25 22.159 -3.988 0.513 1.00 0.00 N ATOM 329 CA CYS A 25 22.321 -4.835 1.688 1.00 0.00 C ATOM 330 C CYS A 25 22.525 -6.281 1.238 1.00 0.00 C ATOM 331 O CYS A 25 22.380 -6.593 0.053 1.00 0.00 O ATOM 332 CB CYS A 25 21.064 -4.735 2.562 1.00 0.00 C ATOM 333 SG CYS A 25 20.396 -3.067 2.755 1.00 0.00 S ATOM 0 H CYS A 25 21.252 -4.106 0.062 1.00 0.00 H new ATOM 0 HA CYS A 25 23.187 -4.509 2.265 1.00 0.00 H new ATOM 0 HB2 CYS A 25 20.290 -5.372 2.133 1.00 0.00 H new ATOM 0 HB3 CYS A 25 21.294 -5.134 3.550 1.00 0.00 H new ATOM 338 N TYR A 26 22.796 -7.174 2.185 1.00 0.00 N ATOM 339 CA TYR A 26 23.030 -8.585 1.922 1.00 0.00 C ATOM 340 C TYR A 26 22.276 -9.359 2.997 1.00 0.00 C ATOM 341 O TYR A 26 22.546 -9.193 4.188 1.00 0.00 O ATOM 342 CB TYR A 26 24.542 -8.858 1.935 1.00 0.00 C ATOM 343 CG TYR A 26 25.319 -8.049 0.908 1.00 0.00 C ATOM 344 CD1 TYR A 26 25.829 -6.779 1.250 1.00 0.00 C ATOM 345 CD2 TYR A 26 25.483 -8.534 -0.404 1.00 0.00 C ATOM 346 CE1 TYR A 26 26.473 -5.988 0.282 1.00 0.00 C ATOM 347 CE2 TYR A 26 26.129 -7.750 -1.377 1.00 0.00 C ATOM 348 CZ TYR A 26 26.620 -6.466 -1.039 1.00 0.00 C ATOM 349 OH TYR A 26 27.230 -5.683 -1.975 1.00 0.00 O ATOM 0 H TYR A 26 22.860 -6.930 3.173 1.00 0.00 H new ATOM 0 HA TYR A 26 22.670 -8.897 0.942 1.00 0.00 H new ATOM 0 HB2 TYR A 26 24.933 -8.639 2.928 1.00 0.00 H new ATOM 0 HB3 TYR A 26 24.712 -9.919 1.753 1.00 0.00 H new ATOM 0 HD1 TYR A 26 25.724 -6.412 2.260 1.00 0.00 H new ATOM 0 HD2 TYR A 26 25.111 -9.514 -0.665 1.00 0.00 H new ATOM 0 HE1 TYR A 26 26.856 -5.014 0.549 1.00 0.00 H new ATOM 0 HE2 TYR A 26 26.250 -8.128 -2.382 1.00 0.00 H new ATOM 0 HH TYR A 26 27.253 -6.156 -2.833 1.00 0.00 H new ATOM 359 N ILE A 27 21.295 -10.158 2.580 1.00 0.00 N ATOM 360 CA ILE A 27 20.334 -10.804 3.462 1.00 0.00 C ATOM 361 C ILE A 27 20.439 -12.305 3.179 1.00 0.00 C ATOM 362 O ILE A 27 20.109 -12.754 2.076 1.00 0.00 O ATOM 363 CB ILE A 27 18.925 -10.199 3.212 1.00 0.00 C ATOM 364 CG1 ILE A 27 18.915 -8.662 3.403 1.00 0.00 C ATOM 365 CG2 ILE A 27 17.865 -10.855 4.106 1.00 0.00 C ATOM 366 CD1 ILE A 27 17.539 -7.992 3.289 1.00 0.00 C ATOM 0 H ILE A 27 21.146 -10.377 1.595 1.00 0.00 H new ATOM 0 HA ILE A 27 20.532 -10.640 4.521 1.00 0.00 H new ATOM 0 HB ILE A 27 18.674 -10.409 2.172 1.00 0.00 H new ATOM 0 HG12 ILE A 27 19.332 -8.432 4.384 1.00 0.00 H new ATOM 0 HG13 ILE A 27 19.579 -8.217 2.662 1.00 0.00 H new ATOM 0 HG21 ILE A 27 16.892 -10.408 3.905 1.00 0.00 H new ATOM 0 HG22 ILE A 27 17.823 -11.924 3.897 1.00 0.00 H new ATOM 0 HG23 ILE A 27 18.126 -10.700 5.153 1.00 0.00 H new ATOM 0 HD11 ILE A 27 17.644 -6.917 3.439 1.00 0.00 H new ATOM 0 HD12 ILE A 27 17.123 -8.182 2.300 1.00 0.00 H new ATOM 0 HD13 ILE A 27 16.871 -8.400 4.048 1.00 0.00 H new ATOM 378 N ASP A 28 20.925 -13.070 4.159 1.00 0.00 N ATOM 379 CA ASP A 28 21.213 -14.498 4.065 1.00 0.00 C ATOM 380 C ASP A 28 20.331 -15.236 5.066 1.00 0.00 C ATOM 381 O ASP A 28 20.461 -15.022 6.272 1.00 0.00 O ATOM 382 CB ASP A 28 22.695 -14.760 4.357 1.00 0.00 C ATOM 383 CG ASP A 28 22.969 -16.268 4.476 1.00 0.00 C ATOM 384 OD1 ASP A 28 22.692 -17.013 3.510 1.00 0.00 O ATOM 385 OD2 ASP A 28 23.498 -16.714 5.519 1.00 0.00 O ATOM 0 H ASP A 28 21.137 -12.690 5.082 1.00 0.00 H new ATOM 0 HA ASP A 28 21.002 -14.855 3.057 1.00 0.00 H new ATOM 0 HB2 ASP A 28 23.308 -14.336 3.561 1.00 0.00 H new ATOM 0 HB3 ASP A 28 22.982 -14.259 5.282 1.00 0.00 H new ATOM 390 N ASN A 29 19.421 -16.078 4.571 1.00 0.00 N ATOM 391 CA ASN A 29 18.390 -16.783 5.343 1.00 0.00 C ATOM 392 C ASN A 29 17.699 -15.890 6.395 1.00 0.00 C ATOM 393 O ASN A 29 17.441 -16.336 7.516 1.00 0.00 O ATOM 394 CB ASN A 29 18.981 -18.067 5.960 1.00 0.00 C ATOM 395 CG ASN A 29 17.885 -19.073 6.300 1.00 0.00 C ATOM 396 OD1 ASN A 29 17.224 -19.583 5.401 1.00 0.00 O ATOM 397 ND2 ASN A 29 17.667 -19.430 7.555 1.00 0.00 N ATOM 0 H ASN A 29 19.379 -16.298 3.576 1.00 0.00 H new ATOM 0 HA ASN A 29 17.596 -17.065 4.651 1.00 0.00 H new ATOM 0 HB2 ASN A 29 19.687 -18.517 5.262 1.00 0.00 H new ATOM 0 HB3 ASN A 29 19.540 -17.816 6.862 1.00 0.00 H new ATOM 0 HD21 ASN A 29 16.953 -20.126 7.771 1.00 0.00 H new ATOM 0 HD22 ASN A 29 18.213 -19.010 8.307 1.00 0.00 H new ATOM 404 N SER A 30 17.433 -14.622 6.068 1.00 0.00 N ATOM 405 CA SER A 30 16.992 -13.608 7.020 1.00 0.00 C ATOM 406 C SER A 30 15.742 -12.867 6.546 1.00 0.00 C ATOM 407 O SER A 30 15.367 -12.916 5.374 1.00 0.00 O ATOM 408 CB SER A 30 18.138 -12.620 7.271 1.00 0.00 C ATOM 409 OG SER A 30 19.246 -13.249 7.868 1.00 0.00 O ATOM 0 H SER A 30 17.521 -14.269 5.115 1.00 0.00 H new ATOM 0 HA SER A 30 16.723 -14.112 7.948 1.00 0.00 H new ATOM 0 HB2 SER A 30 18.441 -12.167 6.327 1.00 0.00 H new ATOM 0 HB3 SER A 30 17.788 -11.812 7.914 1.00 0.00 H new ATOM 0 HG SER A 30 19.745 -13.748 7.188 1.00 0.00 H new ATOM 415 N GLN A 31 15.092 -12.153 7.462 1.00 0.00 N ATOM 416 CA GLN A 31 13.837 -11.459 7.211 1.00 0.00 C ATOM 417 C GLN A 31 13.994 -10.002 7.629 1.00 0.00 C ATOM 418 O GLN A 31 14.495 -9.719 8.718 1.00 0.00 O ATOM 419 CB GLN A 31 12.705 -12.146 7.988 1.00 0.00 C ATOM 420 CG GLN A 31 12.364 -13.538 7.435 1.00 0.00 C ATOM 421 CD GLN A 31 11.267 -14.203 8.268 1.00 0.00 C ATOM 422 OE1 GLN A 31 10.080 -13.926 8.107 1.00 0.00 O ATOM 423 NE2 GLN A 31 11.629 -15.091 9.182 1.00 0.00 N ATOM 0 H GLN A 31 15.432 -12.040 8.417 1.00 0.00 H new ATOM 0 HA GLN A 31 13.584 -11.495 6.151 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.992 -12.236 9.036 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.814 -11.518 7.955 1.00 0.00 H new ATOM 0 HG2 GLN A 31 12.037 -13.452 6.399 1.00 0.00 H new ATOM 0 HG3 GLN A 31 13.257 -14.163 7.437 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.615 -15.317 9.311 1.00 0.00 H new ATOM 0 HE22 GLN A 31 10.921 -15.549 9.757 1.00 0.00 H new ATOM 432 N LEU A 32 13.548 -9.090 6.763 1.00 0.00 N ATOM 433 CA LEU A 32 13.604 -7.640 6.955 1.00 0.00 C ATOM 434 C LEU A 32 12.213 -7.119 6.607 1.00 0.00 C ATOM 435 O LEU A 32 11.970 -6.698 5.478 1.00 0.00 O ATOM 436 CB LEU A 32 14.717 -7.064 6.054 1.00 0.00 C ATOM 437 CG LEU A 32 14.889 -5.534 6.138 1.00 0.00 C ATOM 438 CD1 LEU A 32 15.465 -5.105 7.492 1.00 0.00 C ATOM 439 CD2 LEU A 32 15.819 -5.046 5.025 1.00 0.00 C ATOM 0 H LEU A 32 13.121 -9.352 5.874 1.00 0.00 H new ATOM 0 HA LEU A 32 13.851 -7.342 7.974 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.662 -7.537 6.320 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.505 -7.336 5.020 1.00 0.00 H new ATOM 0 HG LEU A 32 13.901 -5.088 6.023 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.572 -4.021 7.515 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.792 -5.420 8.290 1.00 0.00 H new ATOM 0 HD13 LEU A 32 16.441 -5.569 7.636 1.00 0.00 H new ATOM 0 HD21 LEU A 32 15.933 -3.964 5.094 1.00 0.00 H new ATOM 0 HD22 LEU A 32 16.794 -5.521 5.131 1.00 0.00 H new ATOM 0 HD23 LEU A 32 15.393 -5.305 4.056 1.00 0.00 H new ATOM 451 N VAL A 33 11.283 -7.139 7.557 1.00 0.00 N ATOM 452 CA VAL A 33 9.862 -6.915 7.286 1.00 0.00 C ATOM 453 C VAL A 33 9.267 -5.727 8.050 1.00 0.00 C ATOM 454 O VAL A 33 9.947 -5.065 8.840 1.00 0.00 O ATOM 455 CB VAL A 33 9.113 -8.250 7.540 1.00 0.00 C ATOM 456 CG1 VAL A 33 9.618 -9.364 6.606 1.00 0.00 C ATOM 457 CG2 VAL A 33 9.220 -8.743 8.993 1.00 0.00 C ATOM 0 H VAL A 33 11.492 -7.311 8.540 1.00 0.00 H new ATOM 0 HA VAL A 33 9.739 -6.622 6.243 1.00 0.00 H new ATOM 0 HB VAL A 33 8.066 -8.031 7.333 1.00 0.00 H new ATOM 0 HG11 VAL A 33 9.072 -10.285 6.810 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.458 -9.070 5.569 1.00 0.00 H new ATOM 0 HG13 VAL A 33 10.682 -9.527 6.776 1.00 0.00 H new ATOM 0 HG21 VAL A 33 8.674 -9.680 9.100 1.00 0.00 H new ATOM 0 HG22 VAL A 33 10.268 -8.902 9.247 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.794 -7.996 9.663 1.00 0.00 H new ATOM 467 N ASP A 34 7.973 -5.488 7.818 1.00 0.00 N ATOM 468 CA ASP A 34 7.144 -4.471 8.458 1.00 0.00 C ATOM 469 C ASP A 34 7.738 -3.070 8.302 1.00 0.00 C ATOM 470 O ASP A 34 7.950 -2.352 9.274 1.00 0.00 O ATOM 471 CB ASP A 34 6.815 -4.863 9.906 1.00 0.00 C ATOM 472 CG ASP A 34 5.737 -3.978 10.538 1.00 0.00 C ATOM 473 OD1 ASP A 34 4.883 -3.416 9.810 1.00 0.00 O ATOM 474 OD2 ASP A 34 5.707 -3.889 11.790 1.00 0.00 O ATOM 0 H ASP A 34 7.447 -6.035 7.136 1.00 0.00 H new ATOM 0 HA ASP A 34 6.187 -4.425 7.939 1.00 0.00 H new ATOM 0 HB2 ASP A 34 6.484 -5.901 9.929 1.00 0.00 H new ATOM 0 HB3 ASP A 34 7.723 -4.805 10.507 1.00 0.00 H new ATOM 479 N THR A 35 8.036 -2.690 7.058 1.00 0.00 N ATOM 480 CA THR A 35 8.558 -1.380 6.713 1.00 0.00 C ATOM 481 C THR A 35 9.884 -1.045 7.433 1.00 0.00 C ATOM 482 O THR A 35 10.095 0.080 7.897 1.00 0.00 O ATOM 483 CB THR A 35 7.448 -0.325 6.875 1.00 0.00 C ATOM 484 OG1 THR A 35 6.150 -0.843 6.628 1.00 0.00 O ATOM 485 CG2 THR A 35 7.655 0.809 5.874 1.00 0.00 C ATOM 0 H THR A 35 7.916 -3.302 6.251 1.00 0.00 H new ATOM 0 HA THR A 35 8.847 -1.379 5.662 1.00 0.00 H new ATOM 0 HB THR A 35 7.512 0.015 7.909 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.486 -0.132 6.747 1.00 0.00 H new ATOM 0 HG21 THR A 35 6.865 1.550 5.996 1.00 0.00 H new ATOM 0 HG22 THR A 35 8.623 1.278 6.050 1.00 0.00 H new ATOM 0 HG23 THR A 35 7.624 0.410 4.860 1.00 0.00 H new ATOM 493 N SER A 36 10.790 -2.021 7.545 1.00 0.00 N ATOM 494 CA SER A 36 12.153 -1.778 7.991 1.00 0.00 C ATOM 495 C SER A 36 12.940 -1.077 6.877 1.00 0.00 C ATOM 496 O SER A 36 12.465 -0.933 5.746 1.00 0.00 O ATOM 497 CB SER A 36 12.835 -3.108 8.324 1.00 0.00 C ATOM 498 OG SER A 36 12.223 -3.747 9.420 1.00 0.00 O ATOM 0 H SER A 36 10.593 -2.998 7.328 1.00 0.00 H new ATOM 0 HA SER A 36 12.130 -1.148 8.880 1.00 0.00 H new ATOM 0 HB2 SER A 36 12.799 -3.763 7.454 1.00 0.00 H new ATOM 0 HB3 SER A 36 13.887 -2.932 8.547 1.00 0.00 H new ATOM 0 HG SER A 36 11.406 -4.198 9.121 1.00 0.00 H new ATOM 504 N ILE A 37 14.173 -0.668 7.171 1.00 0.00 N ATOM 505 CA ILE A 37 15.105 -0.202 6.155 1.00 0.00 C ATOM 506 C ILE A 37 16.514 -0.667 6.499 1.00 0.00 C ATOM 507 O ILE A 37 16.876 -0.728 7.677 1.00 0.00 O ATOM 508 CB ILE A 37 14.996 1.321 5.919 1.00 0.00 C ATOM 509 CG1 ILE A 37 15.914 1.786 4.765 1.00 0.00 C ATOM 510 CG2 ILE A 37 15.218 2.158 7.181 1.00 0.00 C ATOM 511 CD1 ILE A 37 15.601 3.194 4.242 1.00 0.00 C ATOM 0 H ILE A 37 14.550 -0.652 8.119 1.00 0.00 H new ATOM 0 HA ILE A 37 14.839 -0.649 5.197 1.00 0.00 H new ATOM 0 HB ILE A 37 13.962 1.498 5.624 1.00 0.00 H new ATOM 0 HG12 ILE A 37 16.949 1.759 5.105 1.00 0.00 H new ATOM 0 HG13 ILE A 37 15.831 1.077 3.941 1.00 0.00 H new ATOM 0 HG21 ILE A 37 15.126 3.216 6.937 1.00 0.00 H new ATOM 0 HG22 ILE A 37 14.472 1.892 7.930 1.00 0.00 H new ATOM 0 HG23 ILE A 37 16.215 1.962 7.577 1.00 0.00 H new ATOM 0 HD11 ILE A 37 16.289 3.444 3.435 1.00 0.00 H new ATOM 0 HD12 ILE A 37 14.577 3.224 3.868 1.00 0.00 H new ATOM 0 HD13 ILE A 37 15.713 3.916 5.051 1.00 0.00 H new ATOM 523 N CYS A 38 17.310 -0.952 5.468 1.00 0.00 N ATOM 524 CA CYS A 38 18.714 -1.283 5.597 1.00 0.00 C ATOM 525 C CYS A 38 19.495 -0.450 4.588 1.00 0.00 C ATOM 526 O CYS A 38 18.972 -0.097 3.524 1.00 0.00 O ATOM 527 CB CYS A 38 18.905 -2.785 5.373 1.00 0.00 C ATOM 528 SG CYS A 38 18.631 -3.401 3.698 1.00 0.00 S ATOM 0 H CYS A 38 16.981 -0.957 4.502 1.00 0.00 H new ATOM 0 HA CYS A 38 19.084 -1.054 6.596 1.00 0.00 H new ATOM 0 HB2 CYS A 38 19.921 -3.046 5.669 1.00 0.00 H new ATOM 0 HB3 CYS A 38 18.231 -3.317 6.045 1.00 0.00 H new ATOM 533 N THR A 39 20.761 -0.187 4.895 1.00 0.00 N ATOM 534 CA THR A 39 21.715 0.452 4.012 1.00 0.00 C ATOM 535 C THR A 39 23.056 -0.203 4.310 1.00 0.00 C ATOM 536 O THR A 39 23.445 -0.259 5.477 1.00 0.00 O ATOM 537 CB THR A 39 21.735 1.973 4.275 1.00 0.00 C ATOM 538 OG1 THR A 39 20.467 2.548 4.030 1.00 0.00 O ATOM 539 CG2 THR A 39 22.756 2.717 3.406 1.00 0.00 C ATOM 0 H THR A 39 21.161 -0.425 5.803 1.00 0.00 H new ATOM 0 HA THR A 39 21.461 0.329 2.959 1.00 0.00 H new ATOM 0 HB THR A 39 22.016 2.080 5.323 1.00 0.00 H new ATOM 0 HG1 THR A 39 20.505 3.511 4.205 1.00 0.00 H new ATOM 0 HG21 THR A 39 22.723 3.782 3.637 1.00 0.00 H new ATOM 0 HG22 THR A 39 23.756 2.333 3.609 1.00 0.00 H new ATOM 0 HG23 THR A 39 22.516 2.566 2.353 1.00 0.00 H new ATOM 547 N ARG A 40 23.747 -0.714 3.287 1.00 0.00 N ATOM 548 CA ARG A 40 25.089 -1.310 3.376 1.00 0.00 C ATOM 549 C ARG A 40 25.253 -2.298 4.546 1.00 0.00 C ATOM 550 O ARG A 40 26.311 -2.335 5.174 1.00 0.00 O ATOM 551 CB ARG A 40 26.159 -0.199 3.383 1.00 0.00 C ATOM 552 CG ARG A 40 26.132 0.699 2.133 1.00 0.00 C ATOM 553 CD ARG A 40 27.315 1.681 2.092 1.00 0.00 C ATOM 554 NE ARG A 40 27.298 2.641 3.216 1.00 0.00 N ATOM 555 CZ ARG A 40 27.981 2.546 4.367 1.00 0.00 C ATOM 556 NH1 ARG A 40 28.798 1.521 4.600 1.00 0.00 N ATOM 557 NH2 ARG A 40 27.834 3.479 5.302 1.00 0.00 N ATOM 0 H ARG A 40 23.376 -0.726 2.337 1.00 0.00 H new ATOM 0 HA ARG A 40 25.231 -1.922 2.485 1.00 0.00 H new ATOM 0 HB2 ARG A 40 26.019 0.422 4.268 1.00 0.00 H new ATOM 0 HB3 ARG A 40 27.144 -0.657 3.468 1.00 0.00 H new ATOM 0 HG2 ARG A 40 26.150 0.075 1.240 1.00 0.00 H new ATOM 0 HG3 ARG A 40 25.197 1.259 2.111 1.00 0.00 H new ATOM 0 HD2 ARG A 40 28.249 1.120 2.113 1.00 0.00 H new ATOM 0 HD3 ARG A 40 27.294 2.230 1.150 1.00 0.00 H new ATOM 0 HE ARG A 40 26.704 3.463 3.105 1.00 0.00 H new ATOM 0 HH11 ARG A 40 28.913 0.791 3.897 1.00 0.00 H new ATOM 0 HH12 ARG A 40 29.309 1.466 5.481 1.00 0.00 H new ATOM 0 HH21 ARG A 40 27.203 4.265 5.144 1.00 0.00 H new ATOM 0 HH22 ARG A 40 28.352 3.409 6.178 1.00 0.00 H new ATOM 571 N SER A 41 24.212 -3.072 4.865 1.00 0.00 N ATOM 572 CA SER A 41 24.178 -3.919 6.056 1.00 0.00 C ATOM 573 C SER A 41 24.099 -5.396 5.682 1.00 0.00 C ATOM 574 O SER A 41 23.668 -5.754 4.581 1.00 0.00 O ATOM 575 CB SER A 41 23.004 -3.500 6.945 1.00 0.00 C ATOM 576 OG SER A 41 23.204 -2.173 7.396 1.00 0.00 O ATOM 0 H SER A 41 23.365 -3.127 4.299 1.00 0.00 H new ATOM 0 HA SER A 41 25.105 -3.785 6.614 1.00 0.00 H new ATOM 0 HB2 SER A 41 22.069 -3.569 6.388 1.00 0.00 H new ATOM 0 HB3 SER A 41 22.919 -4.176 7.796 1.00 0.00 H new ATOM 0 HG SER A 41 23.230 -1.566 6.627 1.00 0.00 H new ATOM 582 N GLN A 42 24.503 -6.242 6.627 1.00 0.00 N ATOM 583 CA GLN A 42 24.550 -7.693 6.505 1.00 0.00 C ATOM 584 C GLN A 42 23.558 -8.273 7.509 1.00 0.00 C ATOM 585 O GLN A 42 23.522 -7.838 8.663 1.00 0.00 O ATOM 586 CB GLN A 42 25.986 -8.176 6.792 1.00 0.00 C ATOM 587 CG GLN A 42 26.168 -9.707 6.833 1.00 0.00 C ATOM 588 CD GLN A 42 25.894 -10.388 5.490 1.00 0.00 C ATOM 589 OE1 GLN A 42 26.471 -10.027 4.469 1.00 0.00 O ATOM 590 NE2 GLN A 42 25.026 -11.385 5.450 1.00 0.00 N ATOM 0 H GLN A 42 24.821 -5.917 7.540 1.00 0.00 H new ATOM 0 HA GLN A 42 24.281 -8.021 5.501 1.00 0.00 H new ATOM 0 HB2 GLN A 42 26.649 -7.768 6.029 1.00 0.00 H new ATOM 0 HB3 GLN A 42 26.307 -7.762 7.748 1.00 0.00 H new ATOM 0 HG2 GLN A 42 27.186 -9.936 7.147 1.00 0.00 H new ATOM 0 HG3 GLN A 42 25.500 -10.125 7.587 1.00 0.00 H new ATOM 0 HE21 GLN A 42 24.549 -11.681 6.302 1.00 0.00 H new ATOM 0 HE22 GLN A 42 24.833 -11.858 4.567 1.00 0.00 H new ATOM 599 N TYR A 43 22.808 -9.288 7.090 1.00 0.00 N ATOM 600 CA TYR A 43 21.854 -10.009 7.915 1.00 0.00 C ATOM 601 C TYR A 43 22.063 -11.484 7.624 1.00 0.00 C ATOM 602 O TYR A 43 22.104 -11.867 6.452 1.00 0.00 O ATOM 603 CB TYR A 43 20.417 -9.598 7.573 1.00 0.00 C ATOM 604 CG TYR A 43 20.150 -8.113 7.687 1.00 0.00 C ATOM 605 CD1 TYR A 43 20.470 -7.257 6.616 1.00 0.00 C ATOM 606 CD2 TYR A 43 19.606 -7.585 8.872 1.00 0.00 C ATOM 607 CE1 TYR A 43 20.230 -5.879 6.716 1.00 0.00 C ATOM 608 CE2 TYR A 43 19.383 -6.204 8.984 1.00 0.00 C ATOM 609 CZ TYR A 43 19.682 -5.351 7.905 1.00 0.00 C ATOM 610 OH TYR A 43 19.441 -4.021 8.018 1.00 0.00 O ATOM 0 H TYR A 43 22.852 -9.640 6.134 1.00 0.00 H new ATOM 0 HA TYR A 43 22.008 -9.786 8.971 1.00 0.00 H new ATOM 0 HB2 TYR A 43 20.192 -9.919 6.556 1.00 0.00 H new ATOM 0 HB3 TYR A 43 19.732 -10.130 8.234 1.00 0.00 H new ATOM 0 HD1 TYR A 43 20.902 -7.663 5.714 1.00 0.00 H new ATOM 0 HD2 TYR A 43 19.360 -8.241 9.694 1.00 0.00 H new ATOM 0 HE1 TYR A 43 20.463 -5.226 5.888 1.00 0.00 H new ATOM 0 HE2 TYR A 43 18.981 -5.795 9.899 1.00 0.00 H new ATOM 0 HH TYR A 43 18.976 -3.843 8.862 1.00 0.00 H new ATOM 620 N SER A 44 22.211 -12.291 8.669 1.00 0.00 N ATOM 621 CA SER A 44 22.590 -13.683 8.550 1.00 0.00 C ATOM 622 C SER A 44 21.795 -14.483 9.583 1.00 0.00 C ATOM 623 O SER A 44 21.958 -14.292 10.790 1.00 0.00 O ATOM 624 CB SER A 44 24.102 -13.813 8.775 1.00 0.00 C ATOM 625 OG SER A 44 24.838 -12.955 7.910 1.00 0.00 O ATOM 0 H SER A 44 22.068 -11.987 9.632 1.00 0.00 H new ATOM 0 HA SER A 44 22.366 -14.072 7.557 1.00 0.00 H new ATOM 0 HB2 SER A 44 24.338 -13.574 9.812 1.00 0.00 H new ATOM 0 HB3 SER A 44 24.407 -14.846 8.609 1.00 0.00 H new ATOM 0 HG SER A 44 25.797 -13.062 8.081 1.00 0.00 H new ATOM 631 N ASP A 45 20.932 -15.375 9.097 1.00 0.00 N ATOM 632 CA ASP A 45 19.973 -16.172 9.864 1.00 0.00 C ATOM 633 C ASP A 45 19.222 -15.369 10.945 1.00 0.00 C ATOM 634 O ASP A 45 19.051 -15.829 12.075 1.00 0.00 O ATOM 635 CB ASP A 45 20.653 -17.446 10.391 1.00 0.00 C ATOM 636 CG ASP A 45 19.617 -18.475 10.869 1.00 0.00 C ATOM 637 OD1 ASP A 45 18.673 -18.768 10.101 1.00 0.00 O ATOM 638 OD2 ASP A 45 19.782 -19.055 11.967 1.00 0.00 O ATOM 0 H ASP A 45 20.880 -15.573 8.098 1.00 0.00 H new ATOM 0 HA ASP A 45 19.177 -16.480 9.186 1.00 0.00 H new ATOM 0 HB2 ASP A 45 21.268 -17.884 9.605 1.00 0.00 H new ATOM 0 HB3 ASP A 45 21.321 -17.191 11.213 1.00 0.00 H new ATOM 643 N ALA A 46 18.797 -14.144 10.614 1.00 0.00 N ATOM 644 CA ALA A 46 18.261 -13.154 11.546 1.00 0.00 C ATOM 645 C ALA A 46 16.864 -12.676 11.127 1.00 0.00 C ATOM 646 O ALA A 46 16.435 -12.889 9.992 1.00 0.00 O ATOM 647 CB ALA A 46 19.240 -11.973 11.604 1.00 0.00 C ATOM 0 H ALA A 46 18.819 -13.806 9.652 1.00 0.00 H new ATOM 0 HA ALA A 46 18.155 -13.609 12.531 1.00 0.00 H new ATOM 0 HB1 ALA A 46 18.861 -11.220 12.294 1.00 0.00 H new ATOM 0 HB2 ALA A 46 20.213 -12.324 11.948 1.00 0.00 H new ATOM 0 HB3 ALA A 46 19.342 -11.536 10.611 1.00 0.00 H new ATOM 653 N ASN A 47 16.158 -11.979 12.020 1.00 0.00 N ATOM 654 CA ASN A 47 14.844 -11.398 11.739 1.00 0.00 C ATOM 655 C ASN A 47 14.791 -9.975 12.264 1.00 0.00 C ATOM 656 O ASN A 47 15.264 -9.689 13.361 1.00 0.00 O ATOM 657 CB ASN A 47 13.722 -12.225 12.373 1.00 0.00 C ATOM 658 CG ASN A 47 12.361 -11.539 12.251 1.00 0.00 C ATOM 659 OD1 ASN A 47 11.957 -11.127 11.170 1.00 0.00 O ATOM 660 ND2 ASN A 47 11.633 -11.388 13.345 1.00 0.00 N ATOM 0 H ASN A 47 16.487 -11.800 12.969 1.00 0.00 H new ATOM 0 HA ASN A 47 14.697 -11.399 10.659 1.00 0.00 H new ATOM 0 HB2 ASN A 47 13.678 -13.203 11.894 1.00 0.00 H new ATOM 0 HB3 ASN A 47 13.948 -12.395 13.426 1.00 0.00 H new ATOM 0 HD21 ASN A 47 10.726 -10.925 13.294 1.00 0.00 H new ATOM 0 HD22 ASN A 47 11.979 -11.735 14.240 1.00 0.00 H new ATOM 667 N VAL A 48 14.203 -9.094 11.473 1.00 0.00 N ATOM 668 CA VAL A 48 14.178 -7.662 11.703 1.00 0.00 C ATOM 669 C VAL A 48 12.784 -7.163 11.336 1.00 0.00 C ATOM 670 O VAL A 48 12.256 -7.521 10.278 1.00 0.00 O ATOM 671 CB VAL A 48 15.294 -6.988 10.876 1.00 0.00 C ATOM 672 CG1 VAL A 48 15.350 -5.475 11.135 1.00 0.00 C ATOM 673 CG2 VAL A 48 16.674 -7.599 11.175 1.00 0.00 C ATOM 0 H VAL A 48 13.712 -9.368 10.622 1.00 0.00 H new ATOM 0 HA VAL A 48 14.372 -7.413 12.746 1.00 0.00 H new ATOM 0 HB VAL A 48 15.049 -7.164 9.829 1.00 0.00 H new ATOM 0 HG11 VAL A 48 16.147 -5.033 10.537 1.00 0.00 H new ATOM 0 HG12 VAL A 48 14.397 -5.023 10.861 1.00 0.00 H new ATOM 0 HG13 VAL A 48 15.546 -5.294 12.192 1.00 0.00 H new ATOM 0 HG21 VAL A 48 17.432 -7.098 10.573 1.00 0.00 H new ATOM 0 HG22 VAL A 48 16.907 -7.472 12.232 1.00 0.00 H new ATOM 0 HG23 VAL A 48 16.662 -8.661 10.932 1.00 0.00 H new ATOM 683 N LYS A 49 12.193 -6.339 12.206 1.00 0.00 N ATOM 684 CA LYS A 49 10.829 -5.849 12.057 1.00 0.00 C ATOM 685 C LYS A 49 10.820 -4.354 12.354 1.00 0.00 C ATOM 686 O LYS A 49 11.347 -3.927 13.386 1.00 0.00 O ATOM 687 CB LYS A 49 9.912 -6.663 12.992 1.00 0.00 C ATOM 688 CG LYS A 49 8.414 -6.406 12.758 1.00 0.00 C ATOM 689 CD LYS A 49 7.547 -7.261 13.700 1.00 0.00 C ATOM 690 CE LYS A 49 6.039 -7.182 13.400 1.00 0.00 C ATOM 691 NZ LYS A 49 5.420 -5.864 13.699 1.00 0.00 N ATOM 0 H LYS A 49 12.659 -5.991 13.044 1.00 0.00 H new ATOM 0 HA LYS A 49 10.452 -5.980 11.043 1.00 0.00 H new ATOM 0 HB2 LYS A 49 10.116 -7.725 12.854 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.156 -6.423 14.027 1.00 0.00 H new ATOM 0 HG2 LYS A 49 8.195 -5.350 12.916 1.00 0.00 H new ATOM 0 HG3 LYS A 49 8.161 -6.632 11.722 1.00 0.00 H new ATOM 0 HD2 LYS A 49 7.868 -8.300 13.630 1.00 0.00 H new ATOM 0 HD3 LYS A 49 7.721 -6.942 14.728 1.00 0.00 H new ATOM 0 HE2 LYS A 49 5.878 -7.415 12.347 1.00 0.00 H new ATOM 0 HE3 LYS A 49 5.525 -7.950 13.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 4.389 -5.975 13.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 5.802 -5.496 14.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 5.635 -5.197 12.930 1.00 0.00 H new ATOM 705 N LYS A 50 10.209 -3.567 11.467 1.00 0.00 N ATOM 706 CA LYS A 50 10.086 -2.109 11.526 1.00 0.00 C ATOM 707 C LYS A 50 11.310 -1.415 12.138 1.00 0.00 C ATOM 708 O LYS A 50 11.170 -0.646 13.088 1.00 0.00 O ATOM 709 CB LYS A 50 8.758 -1.774 12.233 1.00 0.00 C ATOM 710 CG LYS A 50 8.290 -0.320 12.038 1.00 0.00 C ATOM 711 CD LYS A 50 6.836 -0.167 12.500 1.00 0.00 C ATOM 712 CE LYS A 50 5.872 -0.587 11.380 1.00 0.00 C ATOM 713 NZ LYS A 50 4.677 -1.300 11.887 1.00 0.00 N ATOM 0 H LYS A 50 9.759 -3.954 10.637 1.00 0.00 H new ATOM 0 HA LYS A 50 10.061 -1.705 10.514 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.983 -2.446 11.864 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.868 -1.969 13.300 1.00 0.00 H new ATOM 0 HG2 LYS A 50 8.932 0.356 12.603 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.377 -0.039 10.988 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.663 -0.778 13.386 1.00 0.00 H new ATOM 0 HD3 LYS A 50 6.645 0.868 12.784 1.00 0.00 H new ATOM 0 HE2 LYS A 50 5.554 0.299 10.830 1.00 0.00 H new ATOM 0 HE3 LYS A 50 6.400 -1.229 10.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 3.952 -1.335 11.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.940 -2.269 12.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 4.299 -0.798 12.716 1.00 0.00 H new ATOM 727 N SER A 51 12.515 -1.695 11.644 1.00 0.00 N ATOM 728 CA SER A 51 13.748 -1.174 12.228 1.00 0.00 C ATOM 729 C SER A 51 14.529 -0.416 11.159 1.00 0.00 C ATOM 730 O SER A 51 14.344 -0.656 9.967 1.00 0.00 O ATOM 731 CB SER A 51 14.534 -2.327 12.851 1.00 0.00 C ATOM 732 OG SER A 51 13.806 -2.877 13.939 1.00 0.00 O ATOM 0 H SER A 51 12.663 -2.289 10.828 1.00 0.00 H new ATOM 0 HA SER A 51 13.538 -0.464 13.028 1.00 0.00 H new ATOM 0 HB2 SER A 51 14.722 -3.096 12.102 1.00 0.00 H new ATOM 0 HB3 SER A 51 15.506 -1.972 13.195 1.00 0.00 H new ATOM 0 HG SER A 51 12.952 -3.232 13.615 1.00 0.00 H new ATOM 738 N VAL A 52 15.393 0.506 11.574 1.00 0.00 N ATOM 739 CA VAL A 52 16.055 1.466 10.697 1.00 0.00 C ATOM 740 C VAL A 52 17.550 1.246 10.870 1.00 0.00 C ATOM 741 O VAL A 52 18.085 1.541 11.939 1.00 0.00 O ATOM 742 CB VAL A 52 15.594 2.895 11.077 1.00 0.00 C ATOM 743 CG1 VAL A 52 16.290 3.983 10.247 1.00 0.00 C ATOM 744 CG2 VAL A 52 14.070 3.064 10.926 1.00 0.00 C ATOM 0 H VAL A 52 15.658 0.608 12.554 1.00 0.00 H new ATOM 0 HA VAL A 52 15.801 1.335 9.645 1.00 0.00 H new ATOM 0 HB VAL A 52 15.876 3.018 12.123 1.00 0.00 H new ATOM 0 HG11 VAL A 52 15.928 4.964 10.556 1.00 0.00 H new ATOM 0 HG12 VAL A 52 17.367 3.927 10.404 1.00 0.00 H new ATOM 0 HG13 VAL A 52 16.069 3.832 9.190 1.00 0.00 H new ATOM 0 HG21 VAL A 52 13.787 4.080 11.202 1.00 0.00 H new ATOM 0 HG22 VAL A 52 13.784 2.876 9.891 1.00 0.00 H new ATOM 0 HG23 VAL A 52 13.559 2.355 11.578 1.00 0.00 H new ATOM 754 N THR A 53 18.240 0.721 9.857 1.00 0.00 N ATOM 755 CA THR A 53 19.594 0.278 10.027 1.00 0.00 C ATOM 756 C THR A 53 20.476 0.856 8.916 1.00 0.00 C ATOM 757 O THR A 53 20.077 0.889 7.750 1.00 0.00 O ATOM 758 CB THR A 53 19.472 -1.249 10.037 1.00 0.00 C ATOM 759 OG1 THR A 53 18.960 -1.717 11.270 1.00 0.00 O ATOM 760 CG2 THR A 53 20.806 -1.882 9.756 1.00 0.00 C ATOM 0 H THR A 53 17.869 0.599 8.915 1.00 0.00 H new ATOM 0 HA THR A 53 20.082 0.617 10.941 1.00 0.00 H new ATOM 0 HB THR A 53 18.771 -1.533 9.252 1.00 0.00 H new ATOM 0 HG1 THR A 53 18.892 -2.694 11.246 1.00 0.00 H new ATOM 0 HG21 THR A 53 20.703 -2.967 9.766 1.00 0.00 H new ATOM 0 HG22 THR A 53 21.162 -1.561 8.777 1.00 0.00 H new ATOM 0 HG23 THR A 53 21.521 -1.578 10.520 1.00 0.00 H new ATOM 768 N THR A 54 21.691 1.268 9.284 1.00 0.00 N ATOM 769 CA THR A 54 22.737 1.690 8.367 1.00 0.00 C ATOM 770 C THR A 54 24.052 1.060 8.838 1.00 0.00 C ATOM 771 O THR A 54 24.426 1.196 10.004 1.00 0.00 O ATOM 772 CB THR A 54 22.816 3.230 8.343 1.00 0.00 C ATOM 773 OG1 THR A 54 21.568 3.797 7.987 1.00 0.00 O ATOM 774 CG2 THR A 54 23.862 3.750 7.349 1.00 0.00 C ATOM 0 H THR A 54 21.977 1.316 10.262 1.00 0.00 H new ATOM 0 HA THR A 54 22.528 1.362 7.349 1.00 0.00 H new ATOM 0 HB THR A 54 23.102 3.526 9.352 1.00 0.00 H new ATOM 0 HG1 THR A 54 21.643 4.774 7.980 1.00 0.00 H new ATOM 0 HG21 THR A 54 23.876 4.840 7.372 1.00 0.00 H new ATOM 0 HG22 THR A 54 24.846 3.368 7.623 1.00 0.00 H new ATOM 0 HG23 THR A 54 23.609 3.412 6.344 1.00 0.00 H new ATOM 782 N ASP A 55 24.756 0.418 7.903 1.00 0.00 N ATOM 783 CA ASP A 55 26.042 -0.253 8.066 1.00 0.00 C ATOM 784 C ASP A 55 26.126 -1.068 9.363 1.00 0.00 C ATOM 785 O ASP A 55 26.862 -0.714 10.287 1.00 0.00 O ATOM 786 CB ASP A 55 27.182 0.758 7.882 1.00 0.00 C ATOM 787 CG ASP A 55 28.564 0.115 7.661 1.00 0.00 C ATOM 788 OD1 ASP A 55 28.762 -1.103 7.866 1.00 0.00 O ATOM 789 OD2 ASP A 55 29.471 0.857 7.215 1.00 0.00 O ATOM 0 H ASP A 55 24.415 0.350 6.944 1.00 0.00 H new ATOM 0 HA ASP A 55 26.149 -1.003 7.282 1.00 0.00 H new ATOM 0 HB2 ASP A 55 26.951 1.399 7.031 1.00 0.00 H new ATOM 0 HB3 ASP A 55 27.229 1.401 8.761 1.00 0.00 H new ATOM 794 N CYS A 56 25.338 -2.146 9.450 1.00 0.00 N ATOM 795 CA CYS A 56 25.325 -3.041 10.599 1.00 0.00 C ATOM 796 C CYS A 56 25.500 -4.494 10.154 1.00 0.00 C ATOM 797 O CYS A 56 25.374 -4.808 8.969 1.00 0.00 O ATOM 798 CB CYS A 56 24.037 -2.869 11.420 1.00 0.00 C ATOM 799 SG CYS A 56 23.908 -1.333 12.378 1.00 0.00 S ATOM 0 H CYS A 56 24.687 -2.419 8.714 1.00 0.00 H new ATOM 0 HA CYS A 56 26.166 -2.778 11.241 1.00 0.00 H new ATOM 0 HB2 CYS A 56 23.186 -2.924 10.741 1.00 0.00 H new ATOM 0 HB3 CYS A 56 23.951 -3.711 12.107 1.00 0.00 H new ATOM 804 N ASN A 57 25.771 -5.387 11.109 1.00 0.00 N ATOM 805 CA ASN A 57 26.017 -6.804 10.869 1.00 0.00 C ATOM 806 C ASN A 57 25.173 -7.544 11.890 1.00 0.00 C ATOM 807 O ASN A 57 25.428 -7.425 13.086 1.00 0.00 O ATOM 808 CB ASN A 57 27.512 -7.111 11.043 1.00 0.00 C ATOM 809 CG ASN A 57 27.808 -8.607 11.069 1.00 0.00 C ATOM 810 OD1 ASN A 57 27.105 -9.412 10.465 1.00 0.00 O ATOM 811 ND2 ASN A 57 28.860 -9.007 11.766 1.00 0.00 N ATOM 0 H ASN A 57 25.826 -5.134 12.096 1.00 0.00 H new ATOM 0 HA ASN A 57 25.752 -7.107 9.856 1.00 0.00 H new ATOM 0 HB2 ASN A 57 28.070 -6.649 10.229 1.00 0.00 H new ATOM 0 HB3 ASN A 57 27.866 -6.659 11.970 1.00 0.00 H new ATOM 0 HD21 ASN A 57 29.098 -9.998 11.807 1.00 0.00 H new ATOM 0 HD22 ASN A 57 29.433 -8.324 12.262 1.00 0.00 H new ATOM 818 N ILE A 58 24.148 -8.255 11.434 1.00 0.00 N ATOM 819 CA ILE A 58 23.117 -8.825 12.283 1.00 0.00 C ATOM 820 C ILE A 58 23.199 -10.340 12.109 1.00 0.00 C ATOM 821 O ILE A 58 22.829 -10.848 11.050 1.00 0.00 O ATOM 822 CB ILE A 58 21.737 -8.243 11.885 1.00 0.00 C ATOM 823 CG1 ILE A 58 21.735 -6.707 11.704 1.00 0.00 C ATOM 824 CG2 ILE A 58 20.651 -8.672 12.886 1.00 0.00 C ATOM 825 CD1 ILE A 58 22.029 -5.868 12.947 1.00 0.00 C ATOM 0 H ILE A 58 24.011 -8.453 10.443 1.00 0.00 H new ATOM 0 HA ILE A 58 23.257 -8.578 13.335 1.00 0.00 H new ATOM 0 HB ILE A 58 21.510 -8.663 10.905 1.00 0.00 H new ATOM 0 HG12 ILE A 58 22.471 -6.454 10.941 1.00 0.00 H new ATOM 0 HG13 ILE A 58 20.760 -6.411 11.317 1.00 0.00 H new ATOM 0 HG21 ILE A 58 19.692 -8.251 12.585 1.00 0.00 H new ATOM 0 HG22 ILE A 58 20.581 -9.760 12.903 1.00 0.00 H new ATOM 0 HG23 ILE A 58 20.910 -8.310 13.881 1.00 0.00 H new ATOM 0 HD11 ILE A 58 21.998 -4.810 12.687 1.00 0.00 H new ATOM 0 HD12 ILE A 58 21.281 -6.076 13.712 1.00 0.00 H new ATOM 0 HD13 ILE A 58 23.018 -6.119 13.330 1.00 0.00 H new ATOM 837 N ASP A 59 23.692 -11.069 13.111 1.00 0.00 N ATOM 838 CA ASP A 59 23.895 -12.511 13.014 1.00 0.00 C ATOM 839 C ASP A 59 23.044 -13.200 14.069 1.00 0.00 C ATOM 840 O ASP A 59 23.105 -12.829 15.243 1.00 0.00 O ATOM 841 CB ASP A 59 25.377 -12.846 13.204 1.00 0.00 C ATOM 842 CG ASP A 59 25.605 -14.364 13.123 1.00 0.00 C ATOM 843 OD1 ASP A 59 25.506 -14.926 12.011 1.00 0.00 O ATOM 844 OD2 ASP A 59 25.920 -14.989 14.158 1.00 0.00 O ATOM 0 H ASP A 59 23.961 -10.674 14.012 1.00 0.00 H new ATOM 0 HA ASP A 59 23.595 -12.864 12.027 1.00 0.00 H new ATOM 0 HB2 ASP A 59 25.970 -12.343 12.440 1.00 0.00 H new ATOM 0 HB3 ASP A 59 25.719 -12.473 14.169 1.00 0.00 H new ATOM 849 N LYS A 60 22.235 -14.181 13.655 1.00 0.00 N ATOM 850 CA LYS A 60 21.391 -15.018 14.518 1.00 0.00 C ATOM 851 C LYS A 60 20.582 -14.218 15.553 1.00 0.00 C ATOM 852 O LYS A 60 20.369 -14.694 16.670 1.00 0.00 O ATOM 853 CB LYS A 60 22.241 -16.145 15.142 1.00 0.00 C ATOM 854 CG LYS A 60 22.819 -17.099 14.085 1.00 0.00 C ATOM 855 CD LYS A 60 23.659 -18.206 14.737 1.00 0.00 C ATOM 856 CE LYS A 60 24.225 -19.136 13.655 1.00 0.00 C ATOM 857 NZ LYS A 60 25.051 -20.228 14.228 1.00 0.00 N ATOM 0 H LYS A 60 22.146 -14.425 12.669 1.00 0.00 H new ATOM 0 HA LYS A 60 20.626 -15.477 13.893 1.00 0.00 H new ATOM 0 HB2 LYS A 60 23.057 -15.705 15.715 1.00 0.00 H new ATOM 0 HB3 LYS A 60 21.629 -16.712 15.843 1.00 0.00 H new ATOM 0 HG2 LYS A 60 22.007 -17.545 13.511 1.00 0.00 H new ATOM 0 HG3 LYS A 60 23.435 -16.538 13.382 1.00 0.00 H new ATOM 0 HD2 LYS A 60 24.473 -17.766 15.313 1.00 0.00 H new ATOM 0 HD3 LYS A 60 23.046 -18.776 15.435 1.00 0.00 H new ATOM 0 HE2 LYS A 60 23.403 -19.567 13.083 1.00 0.00 H new ATOM 0 HE3 LYS A 60 24.828 -18.554 12.958 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 25.411 -20.830 13.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 25.851 -19.820 14.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 24.470 -20.801 14.873 1.00 0.00 H new ATOM 871 N SER A 61 20.136 -13.009 15.205 1.00 0.00 N ATOM 872 CA SER A 61 19.504 -12.082 16.139 1.00 0.00 C ATOM 873 C SER A 61 18.074 -11.753 15.709 1.00 0.00 C ATOM 874 O SER A 61 17.681 -12.004 14.566 1.00 0.00 O ATOM 875 CB SER A 61 20.362 -10.816 16.266 1.00 0.00 C ATOM 876 OG SER A 61 21.646 -11.132 16.772 1.00 0.00 O ATOM 0 H SER A 61 20.206 -12.644 14.255 1.00 0.00 H new ATOM 0 HA SER A 61 19.438 -12.555 17.119 1.00 0.00 H new ATOM 0 HB2 SER A 61 20.457 -10.336 15.292 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.870 -10.102 16.927 1.00 0.00 H new ATOM 0 HG SER A 61 22.115 -11.710 16.135 1.00 0.00 H new ATOM 882 N GLN A 62 17.305 -11.164 16.625 1.00 0.00 N ATOM 883 CA GLN A 62 15.936 -10.723 16.414 1.00 0.00 C ATOM 884 C GLN A 62 15.861 -9.251 16.813 1.00 0.00 C ATOM 885 O GLN A 62 16.355 -8.867 17.875 1.00 0.00 O ATOM 886 CB GLN A 62 14.958 -11.589 17.219 1.00 0.00 C ATOM 887 CG GLN A 62 14.895 -13.027 16.681 1.00 0.00 C ATOM 888 CD GLN A 62 13.818 -13.841 17.400 1.00 0.00 C ATOM 889 OE1 GLN A 62 12.669 -13.897 16.970 1.00 0.00 O ATOM 890 NE2 GLN A 62 14.153 -14.479 18.511 1.00 0.00 N ATOM 0 H GLN A 62 17.637 -10.976 17.571 1.00 0.00 H new ATOM 0 HA GLN A 62 15.649 -10.831 15.368 1.00 0.00 H new ATOM 0 HB2 GLN A 62 15.263 -11.605 18.265 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.964 -11.144 17.184 1.00 0.00 H new ATOM 0 HG2 GLN A 62 14.687 -13.009 15.611 1.00 0.00 H new ATOM 0 HG3 GLN A 62 15.864 -13.509 16.809 1.00 0.00 H new ATOM 0 HE21 GLN A 62 15.110 -14.427 18.860 1.00 0.00 H new ATOM 0 HE22 GLN A 62 13.454 -15.023 19.017 1.00 0.00 H new ATOM 899 N VAL A 63 15.251 -8.427 15.966 1.00 0.00 N ATOM 900 CA VAL A 63 15.283 -6.976 16.077 1.00 0.00 C ATOM 901 C VAL A 63 13.868 -6.451 15.829 1.00 0.00 C ATOM 902 O VAL A 63 13.232 -6.864 14.856 1.00 0.00 O ATOM 903 CB VAL A 63 16.282 -6.427 15.034 1.00 0.00 C ATOM 904 CG1 VAL A 63 16.449 -4.911 15.153 1.00 0.00 C ATOM 905 CG2 VAL A 63 17.668 -7.087 15.112 1.00 0.00 C ATOM 0 H VAL A 63 14.710 -8.758 15.167 1.00 0.00 H new ATOM 0 HA VAL A 63 15.608 -6.653 17.066 1.00 0.00 H new ATOM 0 HB VAL A 63 15.844 -6.675 14.067 1.00 0.00 H new ATOM 0 HG11 VAL A 63 17.159 -4.563 14.403 1.00 0.00 H new ATOM 0 HG12 VAL A 63 15.486 -4.425 14.994 1.00 0.00 H new ATOM 0 HG13 VAL A 63 16.821 -4.663 16.147 1.00 0.00 H new ATOM 0 HG21 VAL A 63 18.320 -6.655 14.353 1.00 0.00 H new ATOM 0 HG22 VAL A 63 18.098 -6.916 16.099 1.00 0.00 H new ATOM 0 HG23 VAL A 63 17.571 -8.159 14.940 1.00 0.00 H new ATOM 915 N TYR A 64 13.380 -5.531 16.667 1.00 0.00 N ATOM 916 CA TYR A 64 12.073 -4.907 16.471 1.00 0.00 C ATOM 917 C TYR A 64 12.141 -3.427 16.843 1.00 0.00 C ATOM 918 O TYR A 64 12.703 -3.101 17.889 1.00 0.00 O ATOM 919 CB TYR A 64 11.026 -5.655 17.321 1.00 0.00 C ATOM 920 CG TYR A 64 9.557 -5.286 17.134 1.00 0.00 C ATOM 921 CD1 TYR A 64 9.083 -4.674 15.955 1.00 0.00 C ATOM 922 CD2 TYR A 64 8.632 -5.630 18.141 1.00 0.00 C ATOM 923 CE1 TYR A 64 7.717 -4.407 15.779 1.00 0.00 C ATOM 924 CE2 TYR A 64 7.256 -5.387 17.966 1.00 0.00 C ATOM 925 CZ TYR A 64 6.793 -4.783 16.775 1.00 0.00 C ATOM 926 OH TYR A 64 5.463 -4.602 16.537 1.00 0.00 O ATOM 0 H TYR A 64 13.878 -5.201 17.494 1.00 0.00 H new ATOM 0 HA TYR A 64 11.780 -4.971 15.423 1.00 0.00 H new ATOM 0 HB2 TYR A 64 11.131 -6.721 17.119 1.00 0.00 H new ATOM 0 HB3 TYR A 64 11.278 -5.503 18.371 1.00 0.00 H new ATOM 0 HD1 TYR A 64 9.782 -4.407 15.176 1.00 0.00 H new ATOM 0 HD2 TYR A 64 8.982 -6.085 19.056 1.00 0.00 H new ATOM 0 HE1 TYR A 64 7.374 -3.914 14.882 1.00 0.00 H new ATOM 0 HE2 TYR A 64 6.556 -5.662 18.741 1.00 0.00 H new ATOM 0 HH TYR A 64 4.947 -4.908 17.312 1.00 0.00 H new ATOM 936 N LEU A 65 11.548 -2.533 16.038 1.00 0.00 N ATOM 937 CA LEU A 65 11.398 -1.097 16.343 1.00 0.00 C ATOM 938 C LEU A 65 12.720 -0.413 16.741 1.00 0.00 C ATOM 939 O LEU A 65 12.715 0.582 17.468 1.00 0.00 O ATOM 940 CB LEU A 65 10.274 -0.898 17.389 1.00 0.00 C ATOM 941 CG LEU A 65 8.858 -1.079 16.813 1.00 0.00 C ATOM 942 CD1 LEU A 65 7.847 -1.281 17.947 1.00 0.00 C ATOM 943 CD2 LEU A 65 8.428 0.124 15.960 1.00 0.00 C ATOM 0 H LEU A 65 11.149 -2.791 15.135 1.00 0.00 H new ATOM 0 HA LEU A 65 11.103 -0.591 15.424 1.00 0.00 H new ATOM 0 HB2 LEU A 65 10.419 -1.606 18.205 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.359 0.101 17.816 1.00 0.00 H new ATOM 0 HG LEU A 65 8.881 -1.961 16.172 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.849 -1.408 17.527 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.115 -2.169 18.520 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.857 -0.410 18.602 1.00 0.00 H new ATOM 0 HD21 LEU A 65 7.423 -0.045 15.573 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.434 1.025 16.573 1.00 0.00 H new ATOM 0 HD23 LEU A 65 9.121 0.246 15.128 1.00 0.00 H new ATOM 955 N THR A 66 13.857 -0.922 16.272 1.00 0.00 N ATOM 956 CA THR A 66 15.180 -0.526 16.736 1.00 0.00 C ATOM 957 C THR A 66 15.907 0.273 15.647 1.00 0.00 C ATOM 958 O THR A 66 15.559 0.207 14.465 1.00 0.00 O ATOM 959 CB THR A 66 15.880 -1.818 17.202 1.00 0.00 C ATOM 960 OG1 THR A 66 15.255 -2.248 18.401 1.00 0.00 O ATOM 961 CG2 THR A 66 17.381 -1.745 17.481 1.00 0.00 C ATOM 0 H THR A 66 13.882 -1.636 15.544 1.00 0.00 H new ATOM 0 HA THR A 66 15.157 0.161 17.582 1.00 0.00 H new ATOM 0 HB THR A 66 15.778 -2.498 16.356 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.367 -2.608 18.196 1.00 0.00 H new ATOM 0 HG21 THR A 66 17.740 -2.724 17.800 1.00 0.00 H new ATOM 0 HG22 THR A 66 17.905 -1.444 16.574 1.00 0.00 H new ATOM 0 HG23 THR A 66 17.570 -1.015 18.268 1.00 0.00 H new ATOM 969 N THR A 67 16.920 1.043 16.044 1.00 0.00 N ATOM 970 CA THR A 67 17.724 1.868 15.156 1.00 0.00 C ATOM 971 C THR A 67 19.184 1.435 15.317 1.00 0.00 C ATOM 972 O THR A 67 19.680 1.365 16.443 1.00 0.00 O ATOM 973 CB THR A 67 17.492 3.354 15.484 1.00 0.00 C ATOM 974 OG1 THR A 67 16.108 3.660 15.463 1.00 0.00 O ATOM 975 CG2 THR A 67 18.190 4.278 14.480 1.00 0.00 C ATOM 0 H THR A 67 17.208 1.109 17.020 1.00 0.00 H new ATOM 0 HA THR A 67 17.443 1.738 14.111 1.00 0.00 H new ATOM 0 HB THR A 67 17.909 3.519 16.478 1.00 0.00 H new ATOM 0 HG1 THR A 67 15.979 4.608 15.675 1.00 0.00 H new ATOM 0 HG21 THR A 67 18.000 5.317 14.749 1.00 0.00 H new ATOM 0 HG22 THR A 67 19.263 4.089 14.497 1.00 0.00 H new ATOM 0 HG23 THR A 67 17.804 4.086 13.479 1.00 0.00 H new ATOM 983 N CYS A 68 19.869 1.144 14.209 1.00 0.00 N ATOM 984 CA CYS A 68 21.208 0.567 14.208 1.00 0.00 C ATOM 985 C CYS A 68 22.107 1.415 13.317 1.00 0.00 C ATOM 986 O CYS A 68 21.783 1.628 12.147 1.00 0.00 O ATOM 987 CB CYS A 68 21.142 -0.882 13.702 1.00 0.00 C ATOM 988 SG CYS A 68 22.663 -1.842 13.919 1.00 0.00 S ATOM 0 H CYS A 68 19.499 1.307 13.273 1.00 0.00 H new ATOM 0 HA CYS A 68 21.618 0.557 15.218 1.00 0.00 H new ATOM 0 HB2 CYS A 68 20.331 -1.394 14.219 1.00 0.00 H new ATOM 0 HB3 CYS A 68 20.887 -0.869 12.642 1.00 0.00 H new ATOM 993 N THR A 69 23.241 1.865 13.851 1.00 0.00 N ATOM 994 CA THR A 69 24.236 2.622 13.106 1.00 0.00 C ATOM 995 C THR A 69 25.608 2.061 13.474 1.00 0.00 C ATOM 996 O THR A 69 25.974 2.066 14.654 1.00 0.00 O ATOM 997 CB THR A 69 24.116 4.120 13.452 1.00 0.00 C ATOM 998 OG1 THR A 69 22.776 4.574 13.349 1.00 0.00 O ATOM 999 CG2 THR A 69 24.972 4.984 12.521 1.00 0.00 C ATOM 0 H THR A 69 23.495 1.710 14.827 1.00 0.00 H new ATOM 0 HA THR A 69 24.085 2.530 12.030 1.00 0.00 H new ATOM 0 HB THR A 69 24.466 4.219 14.480 1.00 0.00 H new ATOM 0 HG1 THR A 69 22.735 5.526 13.576 1.00 0.00 H new ATOM 0 HG21 THR A 69 24.862 6.033 12.795 1.00 0.00 H new ATOM 0 HG22 THR A 69 26.018 4.692 12.614 1.00 0.00 H new ATOM 0 HG23 THR A 69 24.646 4.842 11.491 1.00 0.00 H new ATOM 1007 N GLY A 70 26.370 1.575 12.491 1.00 0.00 N ATOM 1008 CA GLY A 70 27.762 1.166 12.689 1.00 0.00 C ATOM 1009 C GLY A 70 27.920 0.139 13.813 1.00 0.00 C ATOM 1010 O GLY A 70 28.883 0.219 14.573 1.00 0.00 O ATOM 0 H GLY A 70 26.038 1.454 11.534 1.00 0.00 H new ATOM 0 HA2 GLY A 70 28.149 0.745 11.761 1.00 0.00 H new ATOM 0 HA3 GLY A 70 28.366 2.044 12.917 1.00 0.00 H new ATOM 1014 N SER A 71 26.965 -0.779 13.962 1.00 0.00 N ATOM 1015 CA SER A 71 26.859 -1.675 15.107 1.00 0.00 C ATOM 1016 C SER A 71 26.717 -3.124 14.641 1.00 0.00 C ATOM 1017 O SER A 71 26.441 -3.390 13.470 1.00 0.00 O ATOM 1018 CB SER A 71 25.670 -1.219 15.963 1.00 0.00 C ATOM 1019 OG SER A 71 25.943 0.040 16.555 1.00 0.00 O ATOM 0 H SER A 71 26.228 -0.921 13.272 1.00 0.00 H new ATOM 0 HA SER A 71 27.764 -1.634 15.713 1.00 0.00 H new ATOM 0 HB2 SER A 71 24.774 -1.152 15.346 1.00 0.00 H new ATOM 0 HB3 SER A 71 25.468 -1.957 16.739 1.00 0.00 H new ATOM 0 HG SER A 71 25.949 0.733 15.862 1.00 0.00 H new ATOM 1025 N GLN A 72 26.912 -4.078 15.546 1.00 0.00 N ATOM 1026 CA GLN A 72 26.849 -5.498 15.237 1.00 0.00 C ATOM 1027 C GLN A 72 25.997 -6.168 16.298 1.00 0.00 C ATOM 1028 O GLN A 72 26.197 -5.910 17.485 1.00 0.00 O ATOM 1029 CB GLN A 72 28.247 -6.135 15.203 1.00 0.00 C ATOM 1030 CG GLN A 72 29.265 -5.393 14.327 1.00 0.00 C ATOM 1031 CD GLN A 72 30.489 -6.272 14.093 1.00 0.00 C ATOM 1032 OE1 GLN A 72 30.542 -7.034 13.128 1.00 0.00 O ATOM 1033 NE2 GLN A 72 31.468 -6.220 14.980 1.00 0.00 N ATOM 0 H GLN A 72 27.120 -3.882 16.525 1.00 0.00 H new ATOM 0 HA GLN A 72 26.413 -5.631 14.247 1.00 0.00 H new ATOM 0 HB2 GLN A 72 28.633 -6.187 16.221 1.00 0.00 H new ATOM 0 HB3 GLN A 72 28.156 -7.160 14.843 1.00 0.00 H new ATOM 0 HG2 GLN A 72 28.810 -5.127 13.373 1.00 0.00 H new ATOM 0 HG3 GLN A 72 29.562 -4.462 14.809 1.00 0.00 H new ATOM 0 HE21 GLN A 72 31.405 -5.581 15.773 1.00 0.00 H new ATOM 0 HE22 GLN A 72 32.287 -6.818 14.872 1.00 0.00 H new ATOM 1042 N TYR A 73 25.083 -7.039 15.886 1.00 0.00 N ATOM 1043 CA TYR A 73 24.241 -7.813 16.788 1.00 0.00 C ATOM 1044 C TYR A 73 24.579 -9.271 16.523 1.00 0.00 C ATOM 1045 O TYR A 73 24.632 -9.674 15.362 1.00 0.00 O ATOM 1046 CB TYR A 73 22.756 -7.566 16.489 1.00 0.00 C ATOM 1047 CG TYR A 73 22.178 -6.169 16.666 1.00 0.00 C ATOM 1048 CD1 TYR A 73 22.879 -5.110 17.280 1.00 0.00 C ATOM 1049 CD2 TYR A 73 20.883 -5.938 16.173 1.00 0.00 C ATOM 1050 CE1 TYR A 73 22.324 -3.821 17.316 1.00 0.00 C ATOM 1051 CE2 TYR A 73 20.317 -4.654 16.205 1.00 0.00 C ATOM 1052 CZ TYR A 73 21.043 -3.583 16.766 1.00 0.00 C ATOM 1053 OH TYR A 73 20.492 -2.342 16.772 1.00 0.00 O ATOM 0 H TYR A 73 24.904 -7.230 14.900 1.00 0.00 H new ATOM 0 HA TYR A 73 24.417 -7.533 17.827 1.00 0.00 H new ATOM 0 HB2 TYR A 73 22.577 -7.865 15.456 1.00 0.00 H new ATOM 0 HB3 TYR A 73 22.179 -8.241 17.121 1.00 0.00 H new ATOM 0 HD1 TYR A 73 23.847 -5.292 17.724 1.00 0.00 H new ATOM 0 HD2 TYR A 73 20.315 -6.760 15.764 1.00 0.00 H new ATOM 0 HE1 TYR A 73 22.877 -3.009 17.765 1.00 0.00 H new ATOM 0 HE2 TYR A 73 19.329 -4.487 15.802 1.00 0.00 H new ATOM 0 HH TYR A 73 21.203 -1.668 16.730 1.00 0.00 H new ATOM 1063 N ASN A 74 24.836 -10.055 17.567 1.00 0.00 N ATOM 1064 CA ASN A 74 25.303 -11.427 17.427 1.00 0.00 C ATOM 1065 C ASN A 74 24.617 -12.308 18.476 1.00 0.00 C ATOM 1066 O ASN A 74 25.003 -12.302 19.647 1.00 0.00 O ATOM 1067 CB ASN A 74 26.832 -11.436 17.593 1.00 0.00 C ATOM 1068 CG ASN A 74 27.390 -12.817 17.922 1.00 0.00 C ATOM 1069 OD1 ASN A 74 27.038 -13.816 17.302 1.00 0.00 O ATOM 1070 ND2 ASN A 74 28.277 -12.899 18.900 1.00 0.00 N ATOM 0 H ASN A 74 24.725 -9.754 18.535 1.00 0.00 H new ATOM 0 HA ASN A 74 25.053 -11.827 16.444 1.00 0.00 H new ATOM 0 HB2 ASN A 74 27.293 -11.074 16.674 1.00 0.00 H new ATOM 0 HB3 ASN A 74 27.110 -10.740 18.385 1.00 0.00 H new ATOM 0 HD21 ASN A 74 28.680 -13.803 19.149 1.00 0.00 H new ATOM 0 HD22 ASN A 74 28.558 -12.059 19.405 1.00 0.00 H new ATOM 1077 N GLY A 75 23.599 -13.063 18.067 1.00 0.00 N ATOM 1078 CA GLY A 75 22.863 -13.965 18.939 1.00 0.00 C ATOM 1079 C GLY A 75 22.040 -13.227 19.994 1.00 0.00 C ATOM 1080 O GLY A 75 22.084 -13.624 21.161 1.00 0.00 O ATOM 0 H GLY A 75 23.260 -13.062 17.105 1.00 0.00 H new ATOM 0 HA2 GLY A 75 22.200 -14.586 18.336 1.00 0.00 H new ATOM 0 HA3 GLY A 75 23.564 -14.636 19.435 1.00 0.00 H new ATOM 1084 N ILE A 76 21.332 -12.145 19.639 1.00 0.00 N ATOM 1085 CA ILE A 76 20.628 -11.303 20.613 1.00 0.00 C ATOM 1086 C ILE A 76 19.164 -11.071 20.217 1.00 0.00 C ATOM 1087 O ILE A 76 18.757 -11.333 19.086 1.00 0.00 O ATOM 1088 CB ILE A 76 21.378 -9.960 20.839 1.00 0.00 C ATOM 1089 CG1 ILE A 76 21.042 -8.898 19.767 1.00 0.00 C ATOM 1090 CG2 ILE A 76 22.906 -10.158 20.937 1.00 0.00 C ATOM 1091 CD1 ILE A 76 21.730 -7.548 19.989 1.00 0.00 C ATOM 0 H ILE A 76 21.232 -11.831 18.674 1.00 0.00 H new ATOM 0 HA ILE A 76 20.618 -11.841 21.561 1.00 0.00 H new ATOM 0 HB ILE A 76 21.020 -9.583 21.797 1.00 0.00 H new ATOM 0 HG12 ILE A 76 21.327 -9.283 18.788 1.00 0.00 H new ATOM 0 HG13 ILE A 76 19.963 -8.745 19.748 1.00 0.00 H new ATOM 0 HG21 ILE A 76 23.388 -9.193 21.095 1.00 0.00 H new ATOM 0 HG22 ILE A 76 23.134 -10.819 21.773 1.00 0.00 H new ATOM 0 HG23 ILE A 76 23.275 -10.602 20.012 1.00 0.00 H new ATOM 0 HD11 ILE A 76 21.443 -6.858 19.195 1.00 0.00 H new ATOM 0 HD12 ILE A 76 21.426 -7.139 20.952 1.00 0.00 H new ATOM 0 HD13 ILE A 76 22.811 -7.684 19.978 1.00 0.00 H new ATOM 1103 N TYR A 77 18.395 -10.498 21.138 1.00 0.00 N ATOM 1104 CA TYR A 77 17.055 -9.982 20.931 1.00 0.00 C ATOM 1105 C TYR A 77 17.110 -8.518 21.366 1.00 0.00 C ATOM 1106 O TYR A 77 17.611 -8.223 22.454 1.00 0.00 O ATOM 1107 CB TYR A 77 16.042 -10.783 21.760 1.00 0.00 C ATOM 1108 CG TYR A 77 14.701 -10.091 21.937 1.00 0.00 C ATOM 1109 CD1 TYR A 77 13.921 -9.746 20.815 1.00 0.00 C ATOM 1110 CD2 TYR A 77 14.248 -9.759 23.230 1.00 0.00 C ATOM 1111 CE1 TYR A 77 12.694 -9.080 20.983 1.00 0.00 C ATOM 1112 CE2 TYR A 77 13.020 -9.097 23.406 1.00 0.00 C ATOM 1113 CZ TYR A 77 12.234 -8.758 22.280 1.00 0.00 C ATOM 1114 OH TYR A 77 11.033 -8.132 22.435 1.00 0.00 O ATOM 0 H TYR A 77 18.712 -10.377 22.100 1.00 0.00 H new ATOM 0 HA TYR A 77 16.734 -10.068 19.893 1.00 0.00 H new ATOM 0 HB2 TYR A 77 15.880 -11.749 21.282 1.00 0.00 H new ATOM 0 HB3 TYR A 77 16.469 -10.982 22.743 1.00 0.00 H new ATOM 0 HD1 TYR A 77 14.267 -9.994 19.822 1.00 0.00 H new ATOM 0 HD2 TYR A 77 14.848 -10.015 24.091 1.00 0.00 H new ATOM 0 HE1 TYR A 77 12.102 -8.814 20.120 1.00 0.00 H new ATOM 0 HE2 TYR A 77 12.677 -8.848 24.399 1.00 0.00 H new ATOM 0 HH TYR A 77 10.863 -7.983 23.388 1.00 0.00 H new ATOM 1124 N ILE A 78 16.629 -7.599 20.530 1.00 0.00 N ATOM 1125 CA ILE A 78 16.679 -6.173 20.819 1.00 0.00 C ATOM 1126 C ILE A 78 15.408 -5.497 20.304 1.00 0.00 C ATOM 1127 O ILE A 78 14.978 -5.732 19.169 1.00 0.00 O ATOM 1128 CB ILE A 78 18.001 -5.564 20.296 1.00 0.00 C ATOM 1129 CG1 ILE A 78 18.035 -4.050 20.588 1.00 0.00 C ATOM 1130 CG2 ILE A 78 18.273 -5.867 18.814 1.00 0.00 C ATOM 1131 CD1 ILE A 78 19.423 -3.420 20.421 1.00 0.00 C ATOM 0 H ILE A 78 16.195 -7.825 19.635 1.00 0.00 H new ATOM 0 HA ILE A 78 16.692 -5.996 21.894 1.00 0.00 H new ATOM 0 HB ILE A 78 18.814 -6.048 20.837 1.00 0.00 H new ATOM 0 HG12 ILE A 78 17.334 -3.545 19.923 1.00 0.00 H new ATOM 0 HG13 ILE A 78 17.688 -3.878 21.607 1.00 0.00 H new ATOM 0 HG21 ILE A 78 19.216 -5.409 18.516 1.00 0.00 H new ATOM 0 HG22 ILE A 78 18.331 -6.946 18.668 1.00 0.00 H new ATOM 0 HG23 ILE A 78 17.465 -5.462 18.205 1.00 0.00 H new ATOM 0 HD11 ILE A 78 19.368 -2.354 20.643 1.00 0.00 H new ATOM 0 HD12 ILE A 78 20.124 -3.898 21.105 1.00 0.00 H new ATOM 0 HD13 ILE A 78 19.765 -3.560 19.396 1.00 0.00 H new ATOM 1143 N ARG A 79 14.779 -4.680 21.155 1.00 0.00 N ATOM 1144 CA ARG A 79 13.463 -4.131 20.906 1.00 0.00 C ATOM 1145 C ARG A 79 13.444 -2.659 21.298 1.00 0.00 C ATOM 1146 O ARG A 79 13.925 -2.296 22.374 1.00 0.00 O ATOM 1147 CB ARG A 79 12.477 -5.010 21.687 1.00 0.00 C ATOM 1148 CG ARG A 79 11.021 -4.529 21.651 1.00 0.00 C ATOM 1149 CD ARG A 79 10.615 -3.706 22.883 1.00 0.00 C ATOM 1150 NE ARG A 79 10.750 -4.484 24.126 1.00 0.00 N ATOM 1151 CZ ARG A 79 9.791 -5.095 24.829 1.00 0.00 C ATOM 1152 NH1 ARG A 79 8.514 -5.032 24.464 1.00 0.00 N ATOM 1153 NH2 ARG A 79 10.155 -5.776 25.908 1.00 0.00 N ATOM 0 H ARG A 79 15.183 -4.384 22.044 1.00 0.00 H new ATOM 0 HA ARG A 79 13.178 -4.147 19.854 1.00 0.00 H new ATOM 0 HB2 ARG A 79 12.520 -6.023 21.288 1.00 0.00 H new ATOM 0 HB3 ARG A 79 12.802 -5.062 22.726 1.00 0.00 H new ATOM 0 HG2 ARG A 79 10.868 -3.927 20.755 1.00 0.00 H new ATOM 0 HG3 ARG A 79 10.363 -5.394 21.569 1.00 0.00 H new ATOM 0 HD2 ARG A 79 11.235 -2.812 22.944 1.00 0.00 H new ATOM 0 HD3 ARG A 79 9.583 -3.371 22.773 1.00 0.00 H new ATOM 0 HE ARG A 79 11.696 -4.567 24.498 1.00 0.00 H new ATOM 0 HH11 ARG A 79 8.247 -4.509 23.630 1.00 0.00 H new ATOM 0 HH12 ARG A 79 7.801 -5.507 25.018 1.00 0.00 H new ATOM 0 HH21 ARG A 79 11.138 -5.820 26.176 1.00 0.00 H new ATOM 0 HH22 ARG A 79 9.452 -6.255 26.470 1.00 0.00 H new ATOM 1167 N SER A 80 12.857 -1.819 20.450 1.00 0.00 N ATOM 1168 CA SER A 80 12.616 -0.400 20.700 1.00 0.00 C ATOM 1169 C SER A 80 13.869 0.368 21.162 1.00 0.00 C ATOM 1170 O SER A 80 13.761 1.267 22.000 1.00 0.00 O ATOM 1171 CB SER A 80 11.431 -0.263 21.663 1.00 0.00 C ATOM 1172 OG SER A 80 10.310 -0.985 21.173 1.00 0.00 O ATOM 0 H SER A 80 12.523 -2.119 19.534 1.00 0.00 H new ATOM 0 HA SER A 80 12.360 0.079 19.755 1.00 0.00 H new ATOM 0 HB2 SER A 80 11.710 -0.636 22.648 1.00 0.00 H new ATOM 0 HB3 SER A 80 11.171 0.789 21.782 1.00 0.00 H new ATOM 0 HG SER A 80 9.561 -0.890 21.798 1.00 0.00 H new ATOM 1178 N SER A 81 15.055 0.013 20.655 1.00 0.00 N ATOM 1179 CA SER A 81 16.332 0.515 21.163 1.00 0.00 C ATOM 1180 C SER A 81 17.142 1.228 20.069 1.00 0.00 C ATOM 1181 O SER A 81 16.747 1.240 18.902 1.00 0.00 O ATOM 1182 CB SER A 81 17.101 -0.659 21.776 1.00 0.00 C ATOM 1183 OG SER A 81 16.390 -1.199 22.878 1.00 0.00 O ATOM 0 H SER A 81 15.154 -0.636 19.874 1.00 0.00 H new ATOM 0 HA SER A 81 16.150 1.267 21.931 1.00 0.00 H new ATOM 0 HB2 SER A 81 17.257 -1.431 21.023 1.00 0.00 H new ATOM 0 HB3 SER A 81 18.087 -0.326 22.100 1.00 0.00 H new ATOM 0 HG SER A 81 15.505 -1.498 22.582 1.00 0.00 H new ATOM 1189 N THR A 82 18.279 1.826 20.431 1.00 0.00 N ATOM 1190 CA THR A 82 19.163 2.540 19.517 1.00 0.00 C ATOM 1191 C THR A 82 20.610 2.157 19.841 1.00 0.00 C ATOM 1192 O THR A 82 20.999 2.151 21.011 1.00 0.00 O ATOM 1193 CB THR A 82 18.918 4.055 19.651 1.00 0.00 C ATOM 1194 OG1 THR A 82 17.565 4.375 19.382 1.00 0.00 O ATOM 1195 CG2 THR A 82 19.788 4.882 18.695 1.00 0.00 C ATOM 0 H THR A 82 18.616 1.825 21.394 1.00 0.00 H new ATOM 0 HA THR A 82 18.962 2.267 18.481 1.00 0.00 H new ATOM 0 HB THR A 82 19.180 4.305 20.679 1.00 0.00 H new ATOM 0 HG1 THR A 82 17.433 5.342 19.475 1.00 0.00 H new ATOM 0 HG21 THR A 82 19.574 5.942 18.833 1.00 0.00 H new ATOM 0 HG22 THR A 82 20.841 4.694 18.906 1.00 0.00 H new ATOM 0 HG23 THR A 82 19.568 4.598 17.666 1.00 0.00 H new ATOM 1203 N THR A 83 21.411 1.848 18.822 1.00 0.00 N ATOM 1204 CA THR A 83 22.772 1.355 18.990 1.00 0.00 C ATOM 1205 C THR A 83 23.671 2.079 17.983 1.00 0.00 C ATOM 1206 O THR A 83 23.346 2.127 16.789 1.00 0.00 O ATOM 1207 CB THR A 83 22.773 -0.175 18.809 1.00 0.00 C ATOM 1208 OG1 THR A 83 22.266 -0.525 17.541 1.00 0.00 O ATOM 1209 CG2 THR A 83 21.914 -0.891 19.859 1.00 0.00 C ATOM 0 H THR A 83 21.127 1.935 17.846 1.00 0.00 H new ATOM 0 HA THR A 83 23.160 1.559 19.988 1.00 0.00 H new ATOM 0 HB THR A 83 23.811 -0.489 18.919 1.00 0.00 H new ATOM 0 HG1 THR A 83 22.950 -1.016 17.039 1.00 0.00 H new ATOM 0 HG21 THR A 83 21.949 -1.967 19.686 1.00 0.00 H new ATOM 0 HG22 THR A 83 22.298 -0.671 20.855 1.00 0.00 H new ATOM 0 HG23 THR A 83 20.883 -0.545 19.783 1.00 0.00 H new ATOM 1217 N THR A 84 24.776 2.656 18.456 1.00 0.00 N ATOM 1218 CA THR A 84 25.668 3.485 17.662 1.00 0.00 C ATOM 1219 C THR A 84 27.111 3.080 17.975 1.00 0.00 C ATOM 1220 O THR A 84 27.591 3.285 19.094 1.00 0.00 O ATOM 1221 CB THR A 84 25.404 4.972 17.964 1.00 0.00 C ATOM 1222 OG1 THR A 84 24.019 5.278 17.915 1.00 0.00 O ATOM 1223 CG2 THR A 84 26.118 5.884 16.959 1.00 0.00 C ATOM 0 H THR A 84 25.078 2.554 19.425 1.00 0.00 H new ATOM 0 HA THR A 84 25.491 3.338 16.597 1.00 0.00 H new ATOM 0 HB THR A 84 25.788 5.148 18.969 1.00 0.00 H new ATOM 0 HG1 THR A 84 23.887 6.229 18.113 1.00 0.00 H new ATOM 0 HG21 THR A 84 25.910 6.926 17.202 1.00 0.00 H new ATOM 0 HG22 THR A 84 27.193 5.708 17.007 1.00 0.00 H new ATOM 0 HG23 THR A 84 25.760 5.667 15.953 1.00 0.00 H new ATOM 1231 N GLY A 85 27.829 2.531 16.992 1.00 0.00 N ATOM 1232 CA GLY A 85 29.215 2.122 17.179 1.00 0.00 C ATOM 1233 C GLY A 85 29.335 1.012 18.223 1.00 0.00 C ATOM 1234 O GLY A 85 30.242 1.057 19.052 1.00 0.00 O ATOM 0 H GLY A 85 27.466 2.360 16.054 1.00 0.00 H new ATOM 0 HA2 GLY A 85 29.625 1.776 16.230 1.00 0.00 H new ATOM 0 HA3 GLY A 85 29.810 2.981 17.489 1.00 0.00 H new ATOM 1238 N THR A 86 28.440 0.025 18.212 1.00 0.00 N ATOM 1239 CA THR A 86 28.318 -0.947 19.295 1.00 0.00 C ATOM 1240 C THR A 86 28.264 -2.379 18.773 1.00 0.00 C ATOM 1241 O THR A 86 27.372 -2.717 18.000 1.00 0.00 O ATOM 1242 CB THR A 86 27.044 -0.616 20.110 1.00 0.00 C ATOM 1243 OG1 THR A 86 26.059 0.097 19.383 1.00 0.00 O ATOM 1244 CG2 THR A 86 27.357 0.271 21.305 1.00 0.00 C ATOM 0 H THR A 86 27.778 -0.122 17.450 1.00 0.00 H new ATOM 0 HA THR A 86 29.201 -0.879 19.930 1.00 0.00 H new ATOM 0 HB THR A 86 26.669 -1.599 20.396 1.00 0.00 H new ATOM 0 HG1 THR A 86 26.088 -0.173 18.441 1.00 0.00 H new ATOM 0 HG21 THR A 86 26.438 0.482 21.852 1.00 0.00 H new ATOM 0 HG22 THR A 86 28.062 -0.239 21.962 1.00 0.00 H new ATOM 0 HG23 THR A 86 27.796 1.207 20.959 1.00 0.00 H new ATOM 1252 N SER A 87 29.196 -3.235 19.191 1.00 0.00 N ATOM 1253 CA SER A 87 29.090 -4.669 18.946 1.00 0.00 C ATOM 1254 C SER A 87 28.427 -5.252 20.197 1.00 0.00 C ATOM 1255 O SER A 87 28.790 -4.884 21.318 1.00 0.00 O ATOM 1256 CB SER A 87 30.462 -5.273 18.651 1.00 0.00 C ATOM 1257 OG SER A 87 30.976 -4.720 17.449 1.00 0.00 O ATOM 0 H SER A 87 30.034 -2.957 19.702 1.00 0.00 H new ATOM 0 HA SER A 87 28.492 -4.899 18.065 1.00 0.00 H new ATOM 0 HB2 SER A 87 31.144 -5.072 19.477 1.00 0.00 H new ATOM 0 HB3 SER A 87 30.382 -6.356 18.560 1.00 0.00 H new ATOM 0 HG SER A 87 31.955 -4.699 17.491 1.00 0.00 H new ATOM 1263 N ILE A 88 27.438 -6.125 20.010 1.00 0.00 N ATOM 1264 CA ILE A 88 26.549 -6.603 21.060 1.00 0.00 C ATOM 1265 C ILE A 88 26.379 -8.111 20.869 1.00 0.00 C ATOM 1266 O ILE A 88 25.986 -8.560 19.787 1.00 0.00 O ATOM 1267 CB ILE A 88 25.196 -5.852 20.960 1.00 0.00 C ATOM 1268 CG1 ILE A 88 25.380 -4.313 20.921 1.00 0.00 C ATOM 1269 CG2 ILE A 88 24.267 -6.272 22.108 1.00 0.00 C ATOM 1270 CD1 ILE A 88 24.079 -3.508 20.948 1.00 0.00 C ATOM 0 H ILE A 88 27.230 -6.529 19.097 1.00 0.00 H new ATOM 0 HA ILE A 88 26.956 -6.414 22.053 1.00 0.00 H new ATOM 0 HB ILE A 88 24.732 -6.134 20.015 1.00 0.00 H new ATOM 0 HG12 ILE A 88 25.993 -4.013 21.771 1.00 0.00 H new ATOM 0 HG13 ILE A 88 25.934 -4.051 20.020 1.00 0.00 H new ATOM 0 HG21 ILE A 88 23.321 -5.737 22.025 1.00 0.00 H new ATOM 0 HG22 ILE A 88 24.083 -7.345 22.053 1.00 0.00 H new ATOM 0 HG23 ILE A 88 24.737 -6.033 23.062 1.00 0.00 H new ATOM 0 HD11 ILE A 88 24.309 -2.443 20.918 1.00 0.00 H new ATOM 0 HD12 ILE A 88 23.470 -3.772 20.084 1.00 0.00 H new ATOM 0 HD13 ILE A 88 23.530 -3.734 21.862 1.00 0.00 H new ATOM 1282 N SER A 89 26.668 -8.881 21.918 1.00 0.00 N ATOM 1283 CA SER A 89 26.628 -10.338 21.905 1.00 0.00 C ATOM 1284 C SER A 89 26.026 -10.876 23.207 1.00 0.00 C ATOM 1285 O SER A 89 25.913 -10.148 24.194 1.00 0.00 O ATOM 1286 CB SER A 89 28.050 -10.892 21.719 1.00 0.00 C ATOM 1287 OG SER A 89 28.630 -10.472 20.495 1.00 0.00 O ATOM 0 H SER A 89 26.943 -8.496 22.822 1.00 0.00 H new ATOM 0 HA SER A 89 25.999 -10.662 21.076 1.00 0.00 H new ATOM 0 HB2 SER A 89 28.677 -10.565 22.548 1.00 0.00 H new ATOM 0 HB3 SER A 89 28.021 -11.981 21.751 1.00 0.00 H new ATOM 0 HG SER A 89 29.560 -10.777 20.452 1.00 0.00 H new ATOM 1293 N GLY A 90 25.677 -12.164 23.219 1.00 0.00 N ATOM 1294 CA GLY A 90 25.298 -12.900 24.422 1.00 0.00 C ATOM 1295 C GLY A 90 26.066 -14.224 24.404 1.00 0.00 C ATOM 1296 O GLY A 90 27.140 -14.281 25.007 1.00 0.00 O ATOM 0 H GLY A 90 25.650 -12.734 22.374 1.00 0.00 H new ATOM 0 HA2 GLY A 90 25.541 -12.326 25.316 1.00 0.00 H new ATOM 0 HA3 GLY A 90 24.223 -13.079 24.441 1.00 0.00 H new ATOM 1300 N PRO A 91 25.614 -15.254 23.661 1.00 0.00 N ATOM 1301 CA PRO A 91 24.312 -15.349 23.000 1.00 0.00 C ATOM 1302 C PRO A 91 23.160 -15.374 24.018 1.00 0.00 C ATOM 1303 O PRO A 91 23.374 -15.613 25.209 1.00 0.00 O ATOM 1304 CB PRO A 91 24.339 -16.659 22.198 1.00 0.00 C ATOM 1305 CG PRO A 91 25.824 -16.977 22.049 1.00 0.00 C ATOM 1306 CD PRO A 91 26.416 -16.426 23.342 1.00 0.00 C ATOM 0 HA PRO A 91 24.141 -14.482 22.362 1.00 0.00 H new ATOM 0 HB2 PRO A 91 23.812 -17.457 22.721 1.00 0.00 H new ATOM 0 HB3 PRO A 91 23.858 -16.541 21.227 1.00 0.00 H new ATOM 0 HG2 PRO A 91 26.001 -18.048 21.947 1.00 0.00 H new ATOM 0 HG3 PRO A 91 26.255 -16.498 21.170 1.00 0.00 H new ATOM 0 HD2 PRO A 91 26.369 -17.165 24.142 1.00 0.00 H new ATOM 0 HD3 PRO A 91 27.466 -16.162 23.213 1.00 0.00 H new ATOM 1314 N GLY A 92 21.935 -15.142 23.547 1.00 0.00 N ATOM 1315 CA GLY A 92 20.744 -15.088 24.389 1.00 0.00 C ATOM 1316 C GLY A 92 20.635 -13.748 25.120 1.00 0.00 C ATOM 1317 O GLY A 92 19.941 -13.657 26.134 1.00 0.00 O ATOM 0 H GLY A 92 21.741 -14.985 22.558 1.00 0.00 H new ATOM 0 HA2 GLY A 92 19.856 -15.243 23.776 1.00 0.00 H new ATOM 0 HA3 GLY A 92 20.774 -15.899 25.116 1.00 0.00 H new ATOM 1321 N CYS A 93 21.337 -12.719 24.630 1.00 0.00 N ATOM 1322 CA CYS A 93 21.198 -11.360 25.129 1.00 0.00 C ATOM 1323 C CYS A 93 19.804 -10.847 24.788 1.00 0.00 C ATOM 1324 O CYS A 93 19.267 -11.163 23.725 1.00 0.00 O ATOM 1325 CB CYS A 93 22.296 -10.476 24.517 1.00 0.00 C ATOM 1326 SG CYS A 93 22.008 -8.686 24.590 1.00 0.00 S ATOM 0 H CYS A 93 22.017 -12.813 23.875 1.00 0.00 H new ATOM 0 HA CYS A 93 21.315 -11.335 26.212 1.00 0.00 H new ATOM 0 HB2 CYS A 93 23.235 -10.694 25.025 1.00 0.00 H new ATOM 0 HB3 CYS A 93 22.425 -10.761 23.473 1.00 0.00 H new ATOM 1331 N SER A 94 19.268 -10.004 25.662 1.00 0.00 N ATOM 1332 CA SER A 94 17.962 -9.392 25.535 1.00 0.00 C ATOM 1333 C SER A 94 18.115 -7.920 25.906 1.00 0.00 C ATOM 1334 O SER A 94 18.722 -7.608 26.933 1.00 0.00 O ATOM 1335 CB SER A 94 17.004 -10.115 26.483 1.00 0.00 C ATOM 1336 OG SER A 94 16.746 -11.434 26.027 1.00 0.00 O ATOM 0 H SER A 94 19.756 -9.720 26.512 1.00 0.00 H new ATOM 0 HA SER A 94 17.562 -9.466 24.524 1.00 0.00 H new ATOM 0 HB2 SER A 94 17.432 -10.149 27.485 1.00 0.00 H new ATOM 0 HB3 SER A 94 16.068 -9.560 26.555 1.00 0.00 H new ATOM 0 HG SER A 94 16.133 -11.881 26.647 1.00 0.00 H new ATOM 1342 N ILE A 95 17.582 -7.023 25.075 1.00 0.00 N ATOM 1343 CA ILE A 95 17.661 -5.575 25.235 1.00 0.00 C ATOM 1344 C ILE A 95 16.272 -5.021 24.915 1.00 0.00 C ATOM 1345 O ILE A 95 15.674 -5.383 23.897 1.00 0.00 O ATOM 1346 CB ILE A 95 18.744 -4.990 24.286 1.00 0.00 C ATOM 1347 CG1 ILE A 95 20.158 -5.460 24.684 1.00 0.00 C ATOM 1348 CG2 ILE A 95 18.727 -3.449 24.281 1.00 0.00 C ATOM 1349 CD1 ILE A 95 21.255 -5.117 23.673 1.00 0.00 C ATOM 0 H ILE A 95 17.064 -7.299 24.241 1.00 0.00 H new ATOM 0 HA ILE A 95 17.951 -5.298 26.249 1.00 0.00 H new ATOM 0 HB ILE A 95 18.503 -5.357 23.288 1.00 0.00 H new ATOM 0 HG12 ILE A 95 20.417 -5.015 25.645 1.00 0.00 H new ATOM 0 HG13 ILE A 95 20.140 -6.540 24.827 1.00 0.00 H new ATOM 0 HG21 ILE A 95 19.498 -3.079 23.606 1.00 0.00 H new ATOM 0 HG22 ILE A 95 17.752 -3.097 23.945 1.00 0.00 H new ATOM 0 HG23 ILE A 95 18.919 -3.080 25.288 1.00 0.00 H new ATOM 0 HD11 ILE A 95 22.214 -5.486 24.037 1.00 0.00 H new ATOM 0 HD12 ILE A 95 21.026 -5.584 22.715 1.00 0.00 H new ATOM 0 HD13 ILE A 95 21.307 -4.036 23.546 1.00 0.00 H new ATOM 1361 N SER A 96 15.781 -4.104 25.746 1.00 0.00 N ATOM 1362 CA SER A 96 14.582 -3.336 25.464 1.00 0.00 C ATOM 1363 C SER A 96 14.779 -1.885 25.873 1.00 0.00 C ATOM 1364 O SER A 96 15.333 -1.598 26.939 1.00 0.00 O ATOM 1365 CB SER A 96 13.382 -3.897 26.227 1.00 0.00 C ATOM 1366 OG SER A 96 13.021 -5.186 25.758 1.00 0.00 O ATOM 0 H SER A 96 16.213 -3.875 26.641 1.00 0.00 H new ATOM 0 HA SER A 96 14.392 -3.401 24.393 1.00 0.00 H new ATOM 0 HB2 SER A 96 13.618 -3.949 27.290 1.00 0.00 H new ATOM 0 HB3 SER A 96 12.534 -3.220 26.121 1.00 0.00 H new ATOM 0 HG SER A 96 13.413 -5.333 24.872 1.00 0.00 H new ATOM 1372 N THR A 97 14.244 -0.991 25.042 1.00 0.00 N ATOM 1373 CA THR A 97 14.102 0.428 25.341 1.00 0.00 C ATOM 1374 C THR A 97 15.429 1.123 25.729 1.00 0.00 C ATOM 1375 O THR A 97 15.429 2.066 26.524 1.00 0.00 O ATOM 1376 CB THR A 97 12.945 0.618 26.363 1.00 0.00 C ATOM 1377 OG1 THR A 97 12.211 -0.569 26.665 1.00 0.00 O ATOM 1378 CG2 THR A 97 11.908 1.608 25.842 1.00 0.00 C ATOM 0 H THR A 97 13.889 -1.243 24.120 1.00 0.00 H new ATOM 0 HA THR A 97 13.827 0.952 24.426 1.00 0.00 H new ATOM 0 HB THR A 97 13.458 0.965 27.260 1.00 0.00 H new ATOM 0 HG1 THR A 97 11.257 -0.355 26.733 1.00 0.00 H new ATOM 0 HG21 THR A 97 11.111 1.721 26.577 1.00 0.00 H new ATOM 0 HG22 THR A 97 12.382 2.574 25.669 1.00 0.00 H new ATOM 0 HG23 THR A 97 11.489 1.237 24.907 1.00 0.00 H new ATOM 1386 N CYS A 98 16.566 0.669 25.187 1.00 0.00 N ATOM 1387 CA CYS A 98 17.897 1.169 25.532 1.00 0.00 C ATOM 1388 C CYS A 98 18.466 2.079 24.444 1.00 0.00 C ATOM 1389 O CYS A 98 18.042 2.044 23.291 1.00 0.00 O ATOM 1390 CB CYS A 98 18.855 -0.017 25.719 1.00 0.00 C ATOM 1391 SG CYS A 98 18.567 -1.040 27.183 1.00 0.00 S ATOM 0 H CYS A 98 16.584 -0.070 24.484 1.00 0.00 H new ATOM 0 HA CYS A 98 17.801 1.746 26.452 1.00 0.00 H new ATOM 0 HB2 CYS A 98 18.792 -0.653 24.836 1.00 0.00 H new ATOM 0 HB3 CYS A 98 19.874 0.367 25.762 1.00 0.00 H new ATOM 1396 N THR A 99 19.496 2.840 24.806 1.00 0.00 N ATOM 1397 CA THR A 99 20.333 3.603 23.893 1.00 0.00 C ATOM 1398 C THR A 99 21.758 3.214 24.291 1.00 0.00 C ATOM 1399 O THR A 99 22.051 3.114 25.488 1.00 0.00 O ATOM 1400 CB THR A 99 20.050 5.111 24.010 1.00 0.00 C ATOM 1401 OG1 THR A 99 18.668 5.362 23.821 1.00 0.00 O ATOM 1402 CG2 THR A 99 20.798 5.922 22.947 1.00 0.00 C ATOM 0 H THR A 99 19.778 2.944 25.781 1.00 0.00 H new ATOM 0 HA THR A 99 20.145 3.384 22.842 1.00 0.00 H new ATOM 0 HB THR A 99 20.383 5.412 25.003 1.00 0.00 H new ATOM 0 HG1 THR A 99 18.497 6.324 23.899 1.00 0.00 H new ATOM 0 HG21 THR A 99 20.568 6.981 23.068 1.00 0.00 H new ATOM 0 HG22 THR A 99 21.871 5.769 23.061 1.00 0.00 H new ATOM 0 HG23 THR A 99 20.488 5.595 21.955 1.00 0.00 H new ATOM 1410 N ILE A 100 22.616 2.896 23.322 1.00 0.00 N ATOM 1411 CA ILE A 100 23.952 2.373 23.582 1.00 0.00 C ATOM 1412 C ILE A 100 24.881 3.007 22.545 1.00 0.00 C ATOM 1413 O ILE A 100 24.538 3.074 21.362 1.00 0.00 O ATOM 1414 CB ILE A 100 23.971 0.816 23.532 1.00 0.00 C ATOM 1415 CG1 ILE A 100 22.715 0.149 24.156 1.00 0.00 C ATOM 1416 CG2 ILE A 100 25.229 0.287 24.248 1.00 0.00 C ATOM 1417 CD1 ILE A 100 22.714 -1.383 24.136 1.00 0.00 C ATOM 0 H ILE A 100 22.400 2.995 22.330 1.00 0.00 H new ATOM 0 HA ILE A 100 24.288 2.629 24.587 1.00 0.00 H new ATOM 0 HB ILE A 100 23.976 0.549 22.475 1.00 0.00 H new ATOM 0 HG12 ILE A 100 22.621 0.483 25.189 1.00 0.00 H new ATOM 0 HG13 ILE A 100 21.832 0.504 23.624 1.00 0.00 H new ATOM 0 HG21 ILE A 100 25.238 -0.802 24.211 1.00 0.00 H new ATOM 0 HG22 ILE A 100 26.119 0.674 23.753 1.00 0.00 H new ATOM 0 HG23 ILE A 100 25.221 0.614 25.288 1.00 0.00 H new ATOM 0 HD11 ILE A 100 21.796 -1.752 24.594 1.00 0.00 H new ATOM 0 HD12 ILE A 100 22.772 -1.733 23.106 1.00 0.00 H new ATOM 0 HD13 ILE A 100 23.573 -1.755 24.695 1.00 0.00 H new ATOM 1429 N THR A 101 26.050 3.471 22.987 1.00 0.00 N ATOM 1430 CA THR A 101 26.984 4.243 22.184 1.00 0.00 C ATOM 1431 C THR A 101 28.404 3.776 22.517 1.00 0.00 C ATOM 1432 O THR A 101 28.771 3.720 23.691 1.00 0.00 O ATOM 1433 CB THR A 101 26.795 5.743 22.487 1.00 0.00 C ATOM 1434 OG1 THR A 101 25.428 6.116 22.446 1.00 0.00 O ATOM 1435 CG2 THR A 101 27.549 6.626 21.485 1.00 0.00 C ATOM 0 H THR A 101 26.377 3.313 23.940 1.00 0.00 H new ATOM 0 HA THR A 101 26.805 4.092 21.119 1.00 0.00 H new ATOM 0 HB THR A 101 27.194 5.896 23.490 1.00 0.00 H new ATOM 0 HG1 THR A 101 25.344 7.072 22.644 1.00 0.00 H new ATOM 0 HG21 THR A 101 27.390 7.675 21.733 1.00 0.00 H new ATOM 0 HG22 THR A 101 28.614 6.400 21.530 1.00 0.00 H new ATOM 0 HG23 THR A 101 27.179 6.431 20.478 1.00 0.00 H new ATOM 1443 N ARG A 102 29.210 3.441 21.499 1.00 0.00 N ATOM 1444 CA ARG A 102 30.615 3.014 21.624 1.00 0.00 C ATOM 1445 C ARG A 102 30.861 2.069 22.812 1.00 0.00 C ATOM 1446 O ARG A 102 31.774 2.272 23.611 1.00 0.00 O ATOM 1447 CB ARG A 102 31.550 4.235 21.621 1.00 0.00 C ATOM 1448 CG ARG A 102 31.459 5.022 20.298 1.00 0.00 C ATOM 1449 CD ARG A 102 32.740 5.807 19.964 1.00 0.00 C ATOM 1450 NE ARG A 102 33.919 4.932 19.785 1.00 0.00 N ATOM 1451 CZ ARG A 102 34.127 4.051 18.794 1.00 0.00 C ATOM 1452 NH1 ARG A 102 33.291 3.972 17.763 1.00 0.00 N ATOM 1453 NH2 ARG A 102 35.168 3.229 18.845 1.00 0.00 N ATOM 0 H ARG A 102 28.892 3.460 20.530 1.00 0.00 H new ATOM 0 HA ARG A 102 30.852 2.413 20.746 1.00 0.00 H new ATOM 0 HB2 ARG A 102 31.294 4.891 22.453 1.00 0.00 H new ATOM 0 HB3 ARG A 102 32.577 3.907 21.779 1.00 0.00 H new ATOM 0 HG2 ARG A 102 31.245 4.328 19.485 1.00 0.00 H new ATOM 0 HG3 ARG A 102 30.621 5.716 20.354 1.00 0.00 H new ATOM 0 HD2 ARG A 102 32.580 6.384 19.053 1.00 0.00 H new ATOM 0 HD3 ARG A 102 32.941 6.521 20.762 1.00 0.00 H new ATOM 0 HE ARG A 102 34.652 5.006 20.490 1.00 0.00 H new ATOM 0 HH11 ARG A 102 32.478 4.586 17.717 1.00 0.00 H new ATOM 0 HH12 ARG A 102 33.463 3.297 17.018 1.00 0.00 H new ATOM 0 HH21 ARG A 102 35.809 3.267 19.637 1.00 0.00 H new ATOM 0 HH22 ARG A 102 35.326 2.559 18.092 1.00 0.00 H new ATOM 1467 N GLY A 103 30.034 1.029 22.931 1.00 0.00 N ATOM 1468 CA GLY A 103 30.220 -0.039 23.906 1.00 0.00 C ATOM 1469 C GLY A 103 29.666 0.271 25.296 1.00 0.00 C ATOM 1470 O GLY A 103 29.814 -0.573 26.180 1.00 0.00 O ATOM 0 H GLY A 103 29.208 0.906 22.345 1.00 0.00 H new ATOM 0 HA2 GLY A 103 29.742 -0.944 23.531 1.00 0.00 H new ATOM 0 HA3 GLY A 103 31.285 -0.254 23.992 1.00 0.00 H new ATOM 1474 N VAL A 104 29.023 1.424 25.516 1.00 0.00 N ATOM 1475 CA VAL A 104 28.511 1.820 26.830 1.00 0.00 C ATOM 1476 C VAL A 104 27.054 2.267 26.661 1.00 0.00 C ATOM 1477 O VAL A 104 26.720 2.958 25.697 1.00 0.00 O ATOM 1478 CB VAL A 104 29.409 2.929 27.434 1.00 0.00 C ATOM 1479 CG1 VAL A 104 29.070 3.175 28.913 1.00 0.00 C ATOM 1480 CG2 VAL A 104 30.912 2.596 27.363 1.00 0.00 C ATOM 0 H VAL A 104 28.843 2.110 24.783 1.00 0.00 H new ATOM 0 HA VAL A 104 28.535 0.985 27.530 1.00 0.00 H new ATOM 0 HB VAL A 104 29.208 3.814 26.830 1.00 0.00 H new ATOM 0 HG11 VAL A 104 29.716 3.958 29.309 1.00 0.00 H new ATOM 0 HG12 VAL A 104 28.029 3.485 29.001 1.00 0.00 H new ATOM 0 HG13 VAL A 104 29.224 2.256 29.479 1.00 0.00 H new ATOM 0 HG21 VAL A 104 31.487 3.412 27.802 1.00 0.00 H new ATOM 0 HG22 VAL A 104 31.107 1.677 27.915 1.00 0.00 H new ATOM 0 HG23 VAL A 104 31.207 2.464 26.322 1.00 0.00 H new ATOM 1490 N ALA A 105 26.167 1.856 27.572 1.00 0.00 N ATOM 1491 CA ALA A 105 24.788 2.335 27.579 1.00 0.00 C ATOM 1492 C ALA A 105 24.769 3.847 27.839 1.00 0.00 C ATOM 1493 O ALA A 105 25.607 4.367 28.581 1.00 0.00 O ATOM 1494 CB ALA A 105 23.972 1.578 28.629 1.00 0.00 C ATOM 0 H ALA A 105 26.383 1.191 28.315 1.00 0.00 H new ATOM 0 HA ALA A 105 24.332 2.149 26.607 1.00 0.00 H new ATOM 0 HB1 ALA A 105 22.945 1.944 28.625 1.00 0.00 H new ATOM 0 HB2 ALA A 105 23.979 0.513 28.397 1.00 0.00 H new ATOM 0 HB3 ALA A 105 24.410 1.737 29.614 1.00 0.00 H new ATOM 1500 N THR A 106 23.783 4.540 27.280 1.00 0.00 N ATOM 1501 CA THR A 106 23.610 5.982 27.383 1.00 0.00 C ATOM 1502 C THR A 106 22.145 6.292 27.751 1.00 0.00 C ATOM 1503 O THR A 106 21.293 5.405 27.631 1.00 0.00 O ATOM 1504 CB THR A 106 24.084 6.649 26.072 1.00 0.00 C ATOM 1505 OG1 THR A 106 23.673 5.929 24.921 1.00 0.00 O ATOM 1506 CG2 THR A 106 25.613 6.739 26.017 1.00 0.00 C ATOM 0 H THR A 106 23.055 4.094 26.722 1.00 0.00 H new ATOM 0 HA THR A 106 24.224 6.401 28.180 1.00 0.00 H new ATOM 0 HB THR A 106 23.632 7.641 26.071 1.00 0.00 H new ATOM 0 HG1 THR A 106 24.310 6.085 24.193 1.00 0.00 H new ATOM 0 HG21 THR A 106 25.916 7.213 25.083 1.00 0.00 H new ATOM 0 HG22 THR A 106 25.973 7.331 26.858 1.00 0.00 H new ATOM 0 HG23 THR A 106 26.039 5.737 26.070 1.00 0.00 H new ATOM 1514 N PRO A 107 21.839 7.503 28.265 1.00 0.00 N ATOM 1515 CA PRO A 107 20.526 7.846 28.808 1.00 0.00 C ATOM 1516 C PRO A 107 19.362 7.479 27.878 1.00 0.00 C ATOM 1517 O PRO A 107 19.310 7.930 26.729 1.00 0.00 O ATOM 1518 CB PRO A 107 20.577 9.348 29.107 1.00 0.00 C ATOM 1519 CG PRO A 107 22.049 9.576 29.432 1.00 0.00 C ATOM 1520 CD PRO A 107 22.762 8.612 28.485 1.00 0.00 C ATOM 0 HA PRO A 107 20.327 7.264 29.708 1.00 0.00 H new ATOM 0 HB2 PRO A 107 20.255 9.942 28.252 1.00 0.00 H new ATOM 0 HB3 PRO A 107 19.932 9.616 29.943 1.00 0.00 H new ATOM 0 HG2 PRO A 107 22.346 10.610 29.255 1.00 0.00 H new ATOM 0 HG3 PRO A 107 22.271 9.355 30.476 1.00 0.00 H new ATOM 0 HD2 PRO A 107 23.012 9.103 27.545 1.00 0.00 H new ATOM 0 HD3 PRO A 107 23.698 8.260 28.919 1.00 0.00 H new ATOM 1528 N ALA A 108 18.424 6.677 28.397 1.00 0.00 N ATOM 1529 CA ALA A 108 17.256 6.183 27.661 1.00 0.00 C ATOM 1530 C ALA A 108 15.971 6.127 28.494 1.00 0.00 C ATOM 1531 O ALA A 108 14.905 5.780 27.986 1.00 0.00 O ATOM 1532 CB ALA A 108 17.584 4.779 27.160 1.00 0.00 C ATOM 0 H ALA A 108 18.458 6.347 29.362 1.00 0.00 H new ATOM 0 HA ALA A 108 17.060 6.884 26.849 1.00 0.00 H new ATOM 0 HB1 ALA A 108 16.733 4.382 26.607 1.00 0.00 H new ATOM 0 HB2 ALA A 108 18.455 4.820 26.506 1.00 0.00 H new ATOM 0 HB3 ALA A 108 17.799 4.131 28.009 1.00 0.00 H new ATOM 1538 N ALA A 109 16.104 6.442 29.779 1.00 0.00 N ATOM 1539 CA ALA A 109 15.118 6.429 30.867 1.00 0.00 C ATOM 1540 C ALA A 109 14.396 5.093 31.136 1.00 0.00 C ATOM 1541 O ALA A 109 13.823 4.943 32.218 1.00 0.00 O ATOM 1542 CB ALA A 109 14.122 7.582 30.680 1.00 0.00 C ATOM 0 H ALA A 109 17.012 6.750 30.129 1.00 0.00 H new ATOM 0 HA ALA A 109 15.705 6.569 31.774 1.00 0.00 H new ATOM 0 HB1 ALA A 109 13.393 7.568 31.490 1.00 0.00 H new ATOM 0 HB2 ALA A 109 14.658 8.531 30.691 1.00 0.00 H new ATOM 0 HB3 ALA A 109 13.607 7.467 29.726 1.00 0.00 H new ATOM 1548 N ALA A 110 14.420 4.126 30.212 1.00 0.00 N ATOM 1549 CA ALA A 110 13.676 2.868 30.304 1.00 0.00 C ATOM 1550 C ALA A 110 14.523 1.646 29.915 1.00 0.00 C ATOM 1551 O ALA A 110 13.961 0.572 29.689 1.00 0.00 O ATOM 1552 CB ALA A 110 12.419 2.988 29.429 1.00 0.00 C ATOM 0 H ALA A 110 14.972 4.200 29.358 1.00 0.00 H new ATOM 0 HA ALA A 110 13.393 2.701 31.343 1.00 0.00 H new ATOM 0 HB1 ALA A 110 11.849 2.061 29.482 1.00 0.00 H new ATOM 0 HB2 ALA A 110 11.804 3.814 29.787 1.00 0.00 H new ATOM 0 HB3 ALA A 110 12.711 3.175 28.396 1.00 0.00 H new ATOM 1558 N CYS A 111 15.848 1.789 29.797 1.00 0.00 N ATOM 1559 CA CYS A 111 16.722 0.711 29.339 1.00 0.00 C ATOM 1560 C CYS A 111 16.607 -0.509 30.258 1.00 0.00 C ATOM 1561 O CYS A 111 16.681 -0.380 31.484 1.00 0.00 O ATOM 1562 CB CYS A 111 18.174 1.206 29.265 1.00 0.00 C ATOM 1563 SG CYS A 111 19.411 -0.014 28.733 1.00 0.00 S ATOM 0 H CYS A 111 16.341 2.655 30.017 1.00 0.00 H new ATOM 0 HA CYS A 111 16.408 0.407 28.341 1.00 0.00 H new ATOM 0 HB2 CYS A 111 18.213 2.054 28.581 1.00 0.00 H new ATOM 0 HB3 CYS A 111 18.460 1.577 30.249 1.00 0.00 H new ATOM 1568 N LYS A 112 16.475 -1.692 29.655 1.00 0.00 N ATOM 1569 CA LYS A 112 16.456 -2.992 30.316 1.00 0.00 C ATOM 1570 C LYS A 112 17.352 -3.904 29.484 1.00 0.00 C ATOM 1571 O LYS A 112 17.173 -3.978 28.267 1.00 0.00 O ATOM 1572 CB LYS A 112 15.015 -3.535 30.347 1.00 0.00 C ATOM 1573 CG LYS A 112 14.068 -2.723 31.252 1.00 0.00 C ATOM 1574 CD LYS A 112 12.589 -3.109 31.079 1.00 0.00 C ATOM 1575 CE LYS A 112 12.022 -2.796 29.681 1.00 0.00 C ATOM 1576 NZ LYS A 112 11.958 -1.342 29.386 1.00 0.00 N ATOM 0 H LYS A 112 16.374 -1.770 28.643 1.00 0.00 H new ATOM 0 HA LYS A 112 16.809 -2.930 31.346 1.00 0.00 H new ATOM 0 HB2 LYS A 112 14.617 -3.542 29.332 1.00 0.00 H new ATOM 0 HB3 LYS A 112 15.033 -4.570 30.690 1.00 0.00 H new ATOM 0 HG2 LYS A 112 14.356 -2.869 32.293 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.188 -1.662 31.034 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.476 -4.175 31.276 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.996 -2.583 31.827 1.00 0.00 H new ATOM 0 HE2 LYS A 112 12.639 -3.286 28.928 1.00 0.00 H new ATOM 0 HE3 LYS A 112 11.022 -3.221 29.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 11.969 -1.196 28.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 11.082 -0.946 29.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 12.778 -0.865 29.812 1.00 0.00 H new ATOM 1590 N ILE A 113 18.310 -4.585 30.112 1.00 0.00 N ATOM 1591 CA ILE A 113 19.263 -5.463 29.450 1.00 0.00 C ATOM 1592 C ILE A 113 19.503 -6.698 30.319 1.00 0.00 C ATOM 1593 O ILE A 113 19.544 -6.587 31.550 1.00 0.00 O ATOM 1594 CB ILE A 113 20.547 -4.658 29.143 1.00 0.00 C ATOM 1595 CG1 ILE A 113 21.524 -5.482 28.276 1.00 0.00 C ATOM 1596 CG2 ILE A 113 21.263 -4.115 30.397 1.00 0.00 C ATOM 1597 CD1 ILE A 113 22.581 -4.619 27.570 1.00 0.00 C ATOM 0 H ILE A 113 18.445 -4.537 31.122 1.00 0.00 H new ATOM 0 HA ILE A 113 18.879 -5.828 28.497 1.00 0.00 H new ATOM 0 HB ILE A 113 20.215 -3.784 28.583 1.00 0.00 H new ATOM 0 HG12 ILE A 113 22.026 -6.218 28.905 1.00 0.00 H new ATOM 0 HG13 ILE A 113 20.957 -6.036 27.528 1.00 0.00 H new ATOM 0 HG21 ILE A 113 22.153 -3.563 30.097 1.00 0.00 H new ATOM 0 HG22 ILE A 113 20.591 -3.452 30.941 1.00 0.00 H new ATOM 0 HG23 ILE A 113 21.551 -4.947 31.040 1.00 0.00 H new ATOM 0 HD11 ILE A 113 23.236 -5.258 26.977 1.00 0.00 H new ATOM 0 HD12 ILE A 113 22.087 -3.900 26.916 1.00 0.00 H new ATOM 0 HD13 ILE A 113 23.172 -4.085 28.315 1.00 0.00 H new ATOM 1609 N SER A 114 19.686 -7.857 29.683 1.00 0.00 N ATOM 1610 CA SER A 114 19.935 -9.133 30.345 1.00 0.00 C ATOM 1611 C SER A 114 20.859 -9.986 29.472 1.00 0.00 C ATOM 1612 O SER A 114 20.768 -9.938 28.241 1.00 0.00 O ATOM 1613 CB SER A 114 18.607 -9.878 30.566 1.00 0.00 C ATOM 1614 OG SER A 114 17.650 -9.090 31.262 1.00 0.00 O ATOM 0 H SER A 114 19.664 -7.933 28.666 1.00 0.00 H new ATOM 0 HA SER A 114 20.407 -8.950 31.310 1.00 0.00 H new ATOM 0 HB2 SER A 114 18.196 -10.175 29.601 1.00 0.00 H new ATOM 0 HB3 SER A 114 18.796 -10.793 31.127 1.00 0.00 H new ATOM 0 HG SER A 114 16.824 -9.605 31.377 1.00 0.00 H new ATOM 1620 N GLY A 115 21.714 -10.790 30.117 1.00 0.00 N ATOM 1621 CA GLY A 115 22.530 -11.829 29.492 1.00 0.00 C ATOM 1622 C GLY A 115 23.390 -11.320 28.337 1.00 0.00 C ATOM 1623 O GLY A 115 23.526 -12.026 27.336 1.00 0.00 O ATOM 0 H GLY A 115 21.859 -10.729 31.125 1.00 0.00 H new ATOM 0 HA2 GLY A 115 23.178 -12.274 30.247 1.00 0.00 H new ATOM 0 HA3 GLY A 115 21.877 -12.621 29.126 1.00 0.00 H new ATOM 1627 N CYS A 116 23.941 -10.106 28.447 1.00 0.00 N ATOM 1628 CA CYS A 116 24.591 -9.428 27.331 1.00 0.00 C ATOM 1629 C CYS A 116 26.030 -9.022 27.637 1.00 0.00 C ATOM 1630 O CYS A 116 26.412 -8.854 28.799 1.00 0.00 O ATOM 1631 CB CYS A 116 23.767 -8.191 26.953 1.00 0.00 C ATOM 1632 SG CYS A 116 23.761 -7.852 25.180 1.00 0.00 S ATOM 0 H CYS A 116 23.946 -9.570 29.315 1.00 0.00 H new ATOM 0 HA CYS A 116 24.637 -10.131 26.499 1.00 0.00 H new ATOM 0 HB2 CYS A 116 22.741 -8.329 27.293 1.00 0.00 H new ATOM 0 HB3 CYS A 116 24.164 -7.324 27.480 1.00 0.00 H new ATOM 1637 N SER A 117 26.785 -8.788 26.566 1.00 0.00 N ATOM 1638 CA SER A 117 28.126 -8.230 26.551 1.00 0.00 C ATOM 1639 C SER A 117 28.162 -7.157 25.458 1.00 0.00 C ATOM 1640 O SER A 117 27.507 -7.302 24.419 1.00 0.00 O ATOM 1641 CB SER A 117 29.145 -9.344 26.273 1.00 0.00 C ATOM 1642 OG SER A 117 29.045 -10.387 27.233 1.00 0.00 O ATOM 0 H SER A 117 26.450 -8.999 25.626 1.00 0.00 H new ATOM 0 HA SER A 117 28.383 -7.785 27.512 1.00 0.00 H new ATOM 0 HB2 SER A 117 28.981 -9.749 25.274 1.00 0.00 H new ATOM 0 HB3 SER A 117 30.153 -8.929 26.287 1.00 0.00 H new ATOM 0 HG SER A 117 29.704 -11.083 27.030 1.00 0.00 H new ATOM 1648 N LEU A 118 28.919 -6.082 25.693 1.00 0.00 N ATOM 1649 CA LEU A 118 28.993 -4.907 24.828 1.00 0.00 C ATOM 1650 C LEU A 118 30.463 -4.603 24.548 1.00 0.00 C ATOM 1651 O LEU A 118 31.300 -4.751 25.446 1.00 0.00 O ATOM 1652 CB LEU A 118 28.357 -3.682 25.521 1.00 0.00 C ATOM 1653 CG LEU A 118 26.867 -3.799 25.895 1.00 0.00 C ATOM 1654 CD1 LEU A 118 26.423 -2.553 26.669 1.00 0.00 C ATOM 1655 CD2 LEU A 118 25.982 -3.964 24.658 1.00 0.00 C ATOM 0 H LEU A 118 29.515 -6.005 26.517 1.00 0.00 H new ATOM 0 HA LEU A 118 28.453 -5.110 23.903 1.00 0.00 H new ATOM 0 HB2 LEU A 118 28.921 -3.473 26.430 1.00 0.00 H new ATOM 0 HB3 LEU A 118 28.477 -2.819 24.866 1.00 0.00 H new ATOM 0 HG LEU A 118 26.754 -4.687 26.516 1.00 0.00 H new ATOM 0 HD11 LEU A 118 25.369 -2.643 26.930 1.00 0.00 H new ATOM 0 HD12 LEU A 118 27.015 -2.460 27.579 1.00 0.00 H new ATOM 0 HD13 LEU A 118 26.569 -1.668 26.049 1.00 0.00 H new ATOM 0 HD21 LEU A 118 24.939 -4.043 24.965 1.00 0.00 H new ATOM 0 HD22 LEU A 118 26.104 -3.099 24.005 1.00 0.00 H new ATOM 0 HD23 LEU A 118 26.272 -4.867 24.121 1.00 0.00 H new ATOM 1667 N SER A 119 30.755 -4.109 23.347 1.00 0.00 N ATOM 1668 CA SER A 119 32.081 -3.657 22.939 1.00 0.00 C ATOM 1669 C SER A 119 31.930 -2.425 22.045 1.00 0.00 C ATOM 1670 O SER A 119 30.919 -2.268 21.351 1.00 0.00 O ATOM 1671 CB SER A 119 32.815 -4.779 22.188 1.00 0.00 C ATOM 1672 OG SER A 119 32.888 -5.976 22.950 1.00 0.00 O ATOM 0 H SER A 119 30.056 -4.010 22.611 1.00 0.00 H new ATOM 0 HA SER A 119 32.669 -3.397 23.819 1.00 0.00 H new ATOM 0 HB2 SER A 119 32.303 -4.980 21.247 1.00 0.00 H new ATOM 0 HB3 SER A 119 33.823 -4.448 21.938 1.00 0.00 H new ATOM 0 HG SER A 119 33.361 -6.663 22.435 1.00 0.00 H new ATOM 1678 N ALA A 120 32.931 -1.541 22.072 1.00 0.00 N ATOM 1679 CA ALA A 120 33.019 -0.410 21.157 1.00 0.00 C ATOM 1680 C ALA A 120 33.319 -0.896 19.733 1.00 0.00 C ATOM 1681 O ALA A 120 33.680 -2.058 19.517 1.00 0.00 O ATOM 1682 CB ALA A 120 34.102 0.560 21.646 1.00 0.00 C ATOM 0 H ALA A 120 33.705 -1.594 22.734 1.00 0.00 H new ATOM 0 HA ALA A 120 32.063 0.113 21.136 1.00 0.00 H new ATOM 0 HB1 ALA A 120 34.168 1.406 20.962 1.00 0.00 H new ATOM 0 HB2 ALA A 120 33.846 0.919 22.643 1.00 0.00 H new ATOM 0 HB3 ALA A 120 35.062 0.046 21.681 1.00 0.00 H new ATOM 1688 N MET A 121 33.205 0.016 18.766 1.00 0.00 N ATOM 1689 CA MET A 121 33.379 -0.259 17.347 1.00 0.00 C ATOM 1690 C MET A 121 34.140 0.919 16.751 1.00 0.00 C ATOM 1691 O MET A 121 35.335 1.065 17.082 1.00 0.00 O ATOM 1692 CB MET A 121 31.986 -0.482 16.740 1.00 0.00 C ATOM 1693 CG MET A 121 32.024 -1.050 15.316 1.00 0.00 C ATOM 1694 SD MET A 121 32.772 -2.697 15.169 1.00 0.00 S ATOM 1695 CE MET A 121 32.425 -3.023 13.420 1.00 0.00 C ATOM 1696 OXT MET A 121 33.542 1.797 16.097 1.00 0.00 O ATOM 0 H MET A 121 32.983 0.993 18.959 1.00 0.00 H new ATOM 0 HA MET A 121 33.959 -1.158 17.140 1.00 0.00 H new ATOM 0 HB2 MET A 121 31.424 -1.163 17.380 1.00 0.00 H new ATOM 0 HB3 MET A 121 31.446 0.465 16.731 1.00 0.00 H new ATOM 0 HG2 MET A 121 31.005 -1.094 14.931 1.00 0.00 H new ATOM 0 HG3 MET A 121 32.576 -0.358 14.679 1.00 0.00 H new ATOM 0 HE1 MET A 121 32.817 -4.003 13.148 1.00 0.00 H new ATOM 0 HE2 MET A 121 31.348 -3.004 13.253 1.00 0.00 H new ATOM 0 HE3 MET A 121 32.901 -2.259 12.806 1.00 0.00 H new TER 1706 MET A 121