USER MOD reduce.3.24.130724 H: found=0, std=0, add=768, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 766 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 61 ASN : amide:sc= -1.59! K(o=-1.5!,f=0.5) USER MOD Set 1.2: A 65 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 67 THR OG1 : rot 104:sc= 0.0401 USER MOD Set 2.1: A 36 THR OG1 : rot 180:sc= -0.0749 USER MOD Set 2.2: A 66 CYS SG : rot 23:sc= 0.139 USER MOD Single : A 1 GLY N :NH3+ -131:sc= 0.0653 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= -0.242 K(o=-0.24,f=-3.5!) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 HIS : no HD1:sc= -1.87! K(o=-1.9!,f=-0.87) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 165:sc= -0.516 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 HIS : no HD1:sc= -0.26 X(o=-0.26,f=0) USER MOD Single : A 25 MET CE :methyl 172:sc= 0 (180deg=-0.0427) USER MOD Single : A 27 ASN : amide:sc= -0.0229 X(o=-0.023,f=-0.015) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -166:sc= -0.0223 (180deg=-0.205) USER MOD Single : A 45 SER OG : rot 180:sc=-0.000585 USER MOD Single : A 52 SER OG : rot 160:sc= -0.0201 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 CYS SG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ 164:sc= -0.0125 (180deg=-0.155) USER MOD Single : A 69 SER OG : rot 180:sc= -1.47! USER MOD Single : A 70 TYR OH : rot -123:sc= -5.1! USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 TYR OH : rot -17:sc= 0.448 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 HIS : no HE2:sc= -0.978 X(o=-0.98,f=-0.9) USER MOD Single : A 92 SER OG : rot -110:sc= -0.607 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= -0.0136 USER MOD Single : A 103 SER OG : rot 180:sc= -0.0412 USER MOD Single : A 104 MET CE :methyl -105:sc= -0.354 (180deg=-3.78!) USER MOD Single : A 106 SER OG : rot 34:sc= 0.331 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot -53:sc= 0.0679 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 8.999 -23.079 18.137 1.00 0.00 N ATOM 2 CA GLY A 1 8.184 -24.131 17.557 1.00 0.00 C ATOM 3 C GLY A 1 7.346 -23.640 16.393 1.00 0.00 C ATOM 4 O GLY A 1 7.591 -22.560 15.855 1.00 0.00 O ATOM 0 H1 GLY A 1 9.978 -23.414 18.237 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.981 -22.244 17.517 1.00 0.00 H new ATOM 0 H3 GLY A 1 8.623 -22.824 19.072 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.829 -24.942 17.219 1.00 0.00 H new ATOM 0 HA3 GLY A 1 7.529 -24.543 18.324 1.00 0.00 H new ATOM 8 N SER A 2 6.354 -24.434 16.003 1.00 0.00 N ATOM 9 CA SER A 2 5.481 -24.077 14.892 1.00 0.00 C ATOM 10 C SER A 2 4.019 -24.335 15.245 1.00 0.00 C ATOM 11 O SER A 2 3.714 -24.908 16.291 1.00 0.00 O ATOM 12 CB SER A 2 5.862 -24.870 13.640 1.00 0.00 C ATOM 13 OG SER A 2 5.427 -24.208 12.465 1.00 0.00 O ATOM 0 H SER A 2 6.135 -25.329 16.440 1.00 0.00 H new ATOM 0 HA SER A 2 5.607 -23.013 14.692 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.943 -25.005 13.606 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.418 -25.864 13.686 1.00 0.00 H new ATOM 0 HG SER A 2 5.684 -24.734 11.679 1.00 0.00 H new ATOM 19 N SER A 3 3.120 -23.908 14.365 1.00 0.00 N ATOM 20 CA SER A 3 1.689 -24.088 14.584 1.00 0.00 C ATOM 21 C SER A 3 1.238 -25.468 14.116 1.00 0.00 C ATOM 22 O SER A 3 0.555 -26.190 14.842 1.00 0.00 O ATOM 23 CB SER A 3 0.898 -23.004 13.850 1.00 0.00 C ATOM 24 OG SER A 3 -0.494 -23.261 13.907 1.00 0.00 O ATOM 0 H SER A 3 3.357 -23.435 13.493 1.00 0.00 H new ATOM 0 HA SER A 3 1.497 -24.005 15.654 1.00 0.00 H new ATOM 0 HB2 SER A 3 1.110 -22.031 14.294 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.220 -22.956 12.810 1.00 0.00 H new ATOM 0 HG SER A 3 -0.977 -22.553 13.432 1.00 0.00 H new ATOM 30 N GLY A 4 1.625 -25.829 12.896 1.00 0.00 N ATOM 31 CA GLY A 4 1.252 -27.121 12.351 1.00 0.00 C ATOM 32 C GLY A 4 1.741 -27.313 10.929 1.00 0.00 C ATOM 33 O GLY A 4 2.113 -26.351 10.258 1.00 0.00 O ATOM 0 H GLY A 4 2.190 -25.249 12.276 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.661 -27.910 12.982 1.00 0.00 H new ATOM 0 HA3 GLY A 4 0.167 -27.223 12.376 1.00 0.00 H new ATOM 37 N SER A 5 1.742 -28.560 10.469 1.00 0.00 N ATOM 38 CA SER A 5 2.194 -28.876 9.119 1.00 0.00 C ATOM 39 C SER A 5 1.292 -28.222 8.077 1.00 0.00 C ATOM 40 O SER A 5 1.764 -27.506 7.194 1.00 0.00 O ATOM 41 CB SER A 5 2.219 -30.392 8.909 1.00 0.00 C ATOM 42 OG SER A 5 3.154 -30.752 7.907 1.00 0.00 O ATOM 0 H SER A 5 1.435 -29.368 11.011 1.00 0.00 H new ATOM 0 HA SER A 5 3.203 -28.482 8.999 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.475 -30.888 9.845 1.00 0.00 H new ATOM 0 HB3 SER A 5 1.226 -30.740 8.626 1.00 0.00 H new ATOM 0 HG SER A 5 3.152 -31.725 7.793 1.00 0.00 H new ATOM 48 N SER A 6 -0.008 -28.474 8.186 1.00 0.00 N ATOM 49 CA SER A 6 -0.977 -27.914 7.252 1.00 0.00 C ATOM 50 C SER A 6 -0.677 -26.443 6.975 1.00 0.00 C ATOM 51 O SER A 6 -0.605 -26.019 5.823 1.00 0.00 O ATOM 52 CB SER A 6 -2.395 -28.061 7.805 1.00 0.00 C ATOM 53 OG SER A 6 -2.664 -29.404 8.168 1.00 0.00 O ATOM 0 H SER A 6 -0.415 -29.063 8.913 1.00 0.00 H new ATOM 0 HA SER A 6 -0.902 -28.466 6.315 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.519 -27.414 8.674 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.116 -27.732 7.057 1.00 0.00 H new ATOM 0 HG SER A 6 -3.576 -29.471 8.520 1.00 0.00 H new ATOM 59 N GLY A 7 -0.502 -25.670 8.043 1.00 0.00 N ATOM 60 CA GLY A 7 -0.212 -24.256 7.895 1.00 0.00 C ATOM 61 C GLY A 7 -0.968 -23.402 8.893 1.00 0.00 C ATOM 62 O GLY A 7 -0.377 -22.573 9.585 1.00 0.00 O ATOM 0 H GLY A 7 -0.556 -25.998 9.007 1.00 0.00 H new ATOM 0 HA2 GLY A 7 0.859 -24.093 8.019 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.467 -23.940 6.884 1.00 0.00 H new ATOM 66 N ALA A 8 -2.280 -23.603 8.968 1.00 0.00 N ATOM 67 CA ALA A 8 -3.117 -22.844 9.889 1.00 0.00 C ATOM 68 C ALA A 8 -4.485 -23.498 10.052 1.00 0.00 C ATOM 69 O ALA A 8 -4.923 -24.265 9.194 1.00 0.00 O ATOM 70 CB ALA A 8 -3.269 -21.410 9.406 1.00 0.00 C ATOM 0 H ALA A 8 -2.786 -24.285 8.402 1.00 0.00 H new ATOM 0 HA ALA A 8 -2.628 -22.836 10.863 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -3.897 -20.856 10.104 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -2.287 -20.940 9.348 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -3.732 -21.406 8.419 1.00 0.00 H new ATOM 76 N ILE A 9 -5.156 -23.190 11.157 1.00 0.00 N ATOM 77 CA ILE A 9 -6.474 -23.747 11.431 1.00 0.00 C ATOM 78 C ILE A 9 -7.578 -22.810 10.950 1.00 0.00 C ATOM 79 O ILE A 9 -8.570 -23.249 10.371 1.00 0.00 O ATOM 80 CB ILE A 9 -6.668 -24.022 12.933 1.00 0.00 C ATOM 81 CG1 ILE A 9 -5.550 -24.926 13.457 1.00 0.00 C ATOM 82 CG2 ILE A 9 -8.029 -24.655 13.185 1.00 0.00 C ATOM 83 CD1 ILE A 9 -5.598 -26.332 12.902 1.00 0.00 C ATOM 0 H ILE A 9 -4.808 -22.557 11.877 1.00 0.00 H new ATOM 0 HA ILE A 9 -6.537 -24.689 10.887 1.00 0.00 H new ATOM 0 HB ILE A 9 -6.625 -23.074 13.469 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -4.587 -24.479 13.210 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -5.610 -24.971 14.544 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -8.151 -24.843 14.252 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -8.813 -23.979 12.844 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -8.099 -25.596 12.640 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -4.776 -26.915 13.317 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -6.546 -26.798 13.172 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -5.507 -26.298 11.816 1.00 0.00 H new ATOM 95 N ASN A 10 -7.395 -21.516 11.194 1.00 0.00 N ATOM 96 CA ASN A 10 -8.375 -20.516 10.785 1.00 0.00 C ATOM 97 C ASN A 10 -8.217 -20.172 9.308 1.00 0.00 C ATOM 98 O ASN A 10 -7.265 -20.604 8.657 1.00 0.00 O ATOM 99 CB ASN A 10 -8.228 -19.251 11.634 1.00 0.00 C ATOM 100 CG ASN A 10 -9.496 -18.420 11.656 1.00 0.00 C ATOM 101 OD1 ASN A 10 -9.755 -17.638 10.741 1.00 0.00 O ATOM 102 ND2 ASN A 10 -10.293 -18.585 12.705 1.00 0.00 N ATOM 0 H ASN A 10 -6.578 -21.136 11.672 1.00 0.00 H new ATOM 0 HA ASN A 10 -9.370 -20.934 10.938 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -7.962 -19.530 12.654 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -7.408 -18.648 11.244 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -11.160 -18.052 12.776 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -10.038 -19.245 13.440 1.00 0.00 H new ATOM 109 N SER A 11 -9.157 -19.392 8.783 1.00 0.00 N ATOM 110 CA SER A 11 -9.124 -18.992 7.382 1.00 0.00 C ATOM 111 C SER A 11 -8.058 -17.926 7.145 1.00 0.00 C ATOM 112 O SER A 11 -7.741 -17.141 8.039 1.00 0.00 O ATOM 113 CB SER A 11 -10.493 -18.465 6.947 1.00 0.00 C ATOM 114 OG SER A 11 -11.515 -19.403 7.236 1.00 0.00 O ATOM 0 H SER A 11 -9.951 -19.025 9.308 1.00 0.00 H new ATOM 0 HA SER A 11 -8.874 -19.870 6.786 1.00 0.00 H new ATOM 0 HB2 SER A 11 -10.703 -17.525 7.457 1.00 0.00 H new ATOM 0 HB3 SER A 11 -10.482 -18.252 5.878 1.00 0.00 H new ATOM 0 HG SER A 11 -12.380 -19.042 6.950 1.00 0.00 H new ATOM 120 N ARG A 12 -7.508 -17.907 5.936 1.00 0.00 N ATOM 121 CA ARG A 12 -6.476 -16.939 5.581 1.00 0.00 C ATOM 122 C ARG A 12 -7.081 -15.555 5.364 1.00 0.00 C ATOM 123 O ARG A 12 -7.869 -15.348 4.440 1.00 0.00 O ATOM 124 CB ARG A 12 -5.738 -17.389 4.319 1.00 0.00 C ATOM 125 CG ARG A 12 -4.673 -18.442 4.579 1.00 0.00 C ATOM 126 CD ARG A 12 -5.288 -19.818 4.778 1.00 0.00 C ATOM 127 NE ARG A 12 -5.824 -20.363 3.533 1.00 0.00 N ATOM 128 CZ ARG A 12 -6.070 -21.654 3.342 1.00 0.00 C ATOM 129 NH1 ARG A 12 -5.831 -22.529 4.310 1.00 0.00 N ATOM 130 NH2 ARG A 12 -6.558 -22.073 2.182 1.00 0.00 N ATOM 0 H ARG A 12 -7.759 -18.550 5.185 1.00 0.00 H new ATOM 0 HA ARG A 12 -5.767 -16.881 6.407 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -6.462 -17.785 3.607 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -5.272 -16.521 3.852 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -3.976 -18.471 3.741 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -4.097 -18.168 5.463 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -4.535 -20.498 5.177 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -6.085 -19.755 5.519 1.00 0.00 H new ATOM 0 HE ARG A 12 -6.020 -19.717 2.769 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -5.457 -22.211 5.204 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -6.021 -23.520 4.160 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -6.745 -21.403 1.436 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -6.747 -23.065 2.036 1.00 0.00 H new ATOM 144 N HIS A 13 -6.707 -14.610 6.221 1.00 0.00 N ATOM 145 CA HIS A 13 -7.213 -13.246 6.123 1.00 0.00 C ATOM 146 C HIS A 13 -6.069 -12.256 5.924 1.00 0.00 C ATOM 147 O HIS A 13 -4.940 -12.503 6.349 1.00 0.00 O ATOM 148 CB HIS A 13 -8.006 -12.881 7.378 1.00 0.00 C ATOM 149 CG HIS A 13 -8.796 -11.617 7.241 1.00 0.00 C ATOM 150 ND1 HIS A 13 -9.945 -11.526 6.484 1.00 0.00 N ATOM 151 CD2 HIS A 13 -8.599 -10.387 7.772 1.00 0.00 C ATOM 152 CE1 HIS A 13 -10.419 -10.294 6.553 1.00 0.00 C ATOM 153 NE2 HIS A 13 -9.621 -9.584 7.329 1.00 0.00 N ATOM 0 H HIS A 13 -6.056 -14.764 6.991 1.00 0.00 H new ATOM 0 HA HIS A 13 -7.873 -13.191 5.257 1.00 0.00 H new ATOM 0 HB2 HIS A 13 -8.684 -13.699 7.620 1.00 0.00 H new ATOM 0 HB3 HIS A 13 -7.317 -12.780 8.216 1.00 0.00 H new ATOM 0 HD2 HIS A 13 -7.789 -10.092 8.423 1.00 0.00 H new ATOM 0 HE1 HIS A 13 -11.308 -9.930 6.059 1.00 0.00 H new ATOM 0 HE2 HIS A 13 -9.744 -8.599 7.562 1.00 0.00 H new ATOM 162 N VAL A 14 -6.368 -11.135 5.276 1.00 0.00 N ATOM 163 CA VAL A 14 -5.365 -10.108 5.021 1.00 0.00 C ATOM 164 C VAL A 14 -5.997 -8.721 4.980 1.00 0.00 C ATOM 165 O VAL A 14 -7.034 -8.518 4.349 1.00 0.00 O ATOM 166 CB VAL A 14 -4.626 -10.362 3.694 1.00 0.00 C ATOM 167 CG1 VAL A 14 -3.627 -9.249 3.417 1.00 0.00 C ATOM 168 CG2 VAL A 14 -3.934 -11.716 3.721 1.00 0.00 C ATOM 0 H VAL A 14 -7.297 -10.915 4.918 1.00 0.00 H new ATOM 0 HA VAL A 14 -4.649 -10.154 5.842 1.00 0.00 H new ATOM 0 HB VAL A 14 -5.358 -10.369 2.886 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.115 -9.446 2.475 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -4.153 -8.296 3.352 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -2.897 -9.206 4.225 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -3.417 -11.879 2.776 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -3.213 -11.740 4.538 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -4.676 -12.501 3.869 1.00 0.00 H new ATOM 178 N SER A 15 -5.364 -7.768 5.658 1.00 0.00 N ATOM 179 CA SER A 15 -5.866 -6.400 5.703 1.00 0.00 C ATOM 180 C SER A 15 -4.735 -5.415 5.979 1.00 0.00 C ATOM 181 O SER A 15 -3.878 -5.659 6.828 1.00 0.00 O ATOM 182 CB SER A 15 -6.948 -6.266 6.776 1.00 0.00 C ATOM 183 OG SER A 15 -7.884 -5.258 6.434 1.00 0.00 O ATOM 0 H SER A 15 -4.503 -7.919 6.183 1.00 0.00 H new ATOM 0 HA SER A 15 -6.299 -6.166 4.730 1.00 0.00 H new ATOM 0 HB2 SER A 15 -7.463 -7.219 6.898 1.00 0.00 H new ATOM 0 HB3 SER A 15 -6.487 -6.028 7.734 1.00 0.00 H new ATOM 0 HG SER A 15 -8.566 -5.193 7.135 1.00 0.00 H new ATOM 189 N ALA A 16 -4.739 -4.300 5.255 1.00 0.00 N ATOM 190 CA ALA A 16 -3.715 -3.277 5.423 1.00 0.00 C ATOM 191 C ALA A 16 -4.232 -2.115 6.264 1.00 0.00 C ATOM 192 O ALA A 16 -5.427 -1.816 6.259 1.00 0.00 O ATOM 193 CB ALA A 16 -3.240 -2.778 4.066 1.00 0.00 C ATOM 0 H ALA A 16 -5.440 -4.083 4.547 1.00 0.00 H new ATOM 0 HA ALA A 16 -2.872 -3.725 5.949 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -2.475 -2.014 4.207 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -2.822 -3.610 3.498 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -4.082 -2.352 3.520 1.00 0.00 H new ATOM 199 N TYR A 17 -3.327 -1.463 6.985 1.00 0.00 N ATOM 200 CA TYR A 17 -3.693 -0.336 7.833 1.00 0.00 C ATOM 201 C TYR A 17 -2.495 0.578 8.072 1.00 0.00 C ATOM 202 O TYR A 17 -1.378 0.111 8.292 1.00 0.00 O ATOM 203 CB TYR A 17 -4.243 -0.834 9.171 1.00 0.00 C ATOM 204 CG TYR A 17 -3.181 -1.390 10.093 1.00 0.00 C ATOM 205 CD1 TYR A 17 -2.451 -0.554 10.927 1.00 0.00 C ATOM 206 CD2 TYR A 17 -2.908 -2.752 10.128 1.00 0.00 C ATOM 207 CE1 TYR A 17 -1.479 -1.057 11.771 1.00 0.00 C ATOM 208 CE2 TYR A 17 -1.940 -3.265 10.970 1.00 0.00 C ATOM 209 CZ TYR A 17 -1.228 -2.413 11.789 1.00 0.00 C ATOM 210 OH TYR A 17 -0.261 -2.920 12.627 1.00 0.00 O ATOM 0 H TYR A 17 -2.334 -1.696 6.999 1.00 0.00 H new ATOM 0 HA TYR A 17 -4.467 0.235 7.320 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -4.754 -0.012 9.673 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -4.989 -1.606 8.983 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -2.646 0.508 10.916 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -3.462 -3.421 9.486 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.919 -0.392 12.412 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -1.742 -4.327 10.987 1.00 0.00 H new ATOM 0 HH TYR A 17 -0.367 -3.892 12.699 1.00 0.00 H new ATOM 220 N GLY A 18 -2.737 1.885 8.028 1.00 0.00 N ATOM 221 CA GLY A 18 -1.669 2.844 8.242 1.00 0.00 C ATOM 222 C GLY A 18 -2.006 4.217 7.694 1.00 0.00 C ATOM 223 O GLY A 18 -3.061 4.429 7.096 1.00 0.00 O ATOM 0 H GLY A 18 -3.653 2.296 7.848 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -1.463 2.922 9.310 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -0.757 2.480 7.768 1.00 0.00 H new ATOM 227 N PRO A 19 -1.095 5.180 7.900 1.00 0.00 N ATOM 228 CA PRO A 19 -1.279 6.557 7.431 1.00 0.00 C ATOM 229 C PRO A 19 -1.198 6.668 5.913 1.00 0.00 C ATOM 230 O PRO A 19 -2.005 7.354 5.287 1.00 0.00 O ATOM 231 CB PRO A 19 -0.120 7.312 8.085 1.00 0.00 C ATOM 232 CG PRO A 19 0.925 6.276 8.317 1.00 0.00 C ATOM 233 CD PRO A 19 0.185 4.999 8.605 1.00 0.00 C ATOM 0 HA PRO A 19 -2.262 6.949 7.692 1.00 0.00 H new ATOM 0 HB2 PRO A 19 0.249 8.108 7.438 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.429 7.779 9.020 1.00 0.00 H new ATOM 0 HG2 PRO A 19 1.567 6.166 7.443 1.00 0.00 H new ATOM 0 HG3 PRO A 19 1.569 6.551 9.153 1.00 0.00 H new ATOM 0 HD2 PRO A 19 0.727 4.128 8.236 1.00 0.00 H new ATOM 0 HD3 PRO A 19 0.037 4.853 9.675 1.00 0.00 H new ATOM 241 N GLY A 20 -0.217 5.989 5.325 1.00 0.00 N ATOM 242 CA GLY A 20 -0.050 6.025 3.884 1.00 0.00 C ATOM 243 C GLY A 20 -1.290 5.565 3.144 1.00 0.00 C ATOM 244 O GLY A 20 -1.578 6.039 2.045 1.00 0.00 O ATOM 0 H GLY A 20 0.465 5.415 5.821 1.00 0.00 H new ATOM 0 HA2 GLY A 20 0.197 7.041 3.575 1.00 0.00 H new ATOM 0 HA3 GLY A 20 0.792 5.393 3.603 1.00 0.00 H new ATOM 248 N LEU A 21 -2.027 4.637 3.747 1.00 0.00 N ATOM 249 CA LEU A 21 -3.243 4.111 3.137 1.00 0.00 C ATOM 250 C LEU A 21 -4.392 5.106 3.268 1.00 0.00 C ATOM 251 O LEU A 21 -5.144 5.329 2.320 1.00 0.00 O ATOM 252 CB LEU A 21 -3.629 2.781 3.787 1.00 0.00 C ATOM 253 CG LEU A 21 -2.585 1.667 3.705 1.00 0.00 C ATOM 254 CD1 LEU A 21 -2.821 0.633 4.795 1.00 0.00 C ATOM 255 CD2 LEU A 21 -2.611 1.012 2.331 1.00 0.00 C ATOM 0 H LEU A 21 -1.803 4.234 4.657 1.00 0.00 H new ATOM 0 HA LEU A 21 -3.047 3.947 2.077 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.854 2.965 4.838 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.548 2.425 3.322 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.599 2.107 3.857 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -2.068 -0.152 4.721 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.751 1.112 5.772 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -3.813 0.197 4.675 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -1.862 0.222 2.291 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -3.598 0.586 2.150 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -2.392 1.759 1.568 1.00 0.00 H new ATOM 267 N SER A 22 -4.519 5.703 4.449 1.00 0.00 N ATOM 268 CA SER A 22 -5.577 6.674 4.705 1.00 0.00 C ATOM 269 C SER A 22 -5.369 7.936 3.873 1.00 0.00 C ATOM 270 O SER A 22 -6.313 8.474 3.295 1.00 0.00 O ATOM 271 CB SER A 22 -5.622 7.030 6.192 1.00 0.00 C ATOM 272 OG SER A 22 -6.142 5.958 6.958 1.00 0.00 O ATOM 0 H SER A 22 -3.903 5.531 5.243 1.00 0.00 H new ATOM 0 HA SER A 22 -6.527 6.224 4.418 1.00 0.00 H new ATOM 0 HB2 SER A 22 -4.619 7.277 6.540 1.00 0.00 H new ATOM 0 HB3 SER A 22 -6.238 7.918 6.338 1.00 0.00 H new ATOM 0 HG SER A 22 -6.159 6.210 7.905 1.00 0.00 H new ATOM 278 N HIS A 23 -4.126 8.403 3.819 1.00 0.00 N ATOM 279 CA HIS A 23 -3.792 9.602 3.058 1.00 0.00 C ATOM 280 C HIS A 23 -2.280 9.758 2.927 1.00 0.00 C ATOM 281 O HIS A 23 -1.516 8.920 3.402 1.00 0.00 O ATOM 282 CB HIS A 23 -4.388 10.840 3.729 1.00 0.00 C ATOM 283 CG HIS A 23 -3.726 11.197 5.024 1.00 0.00 C ATOM 284 ND1 HIS A 23 -4.218 10.812 6.253 1.00 0.00 N ATOM 285 CD2 HIS A 23 -2.601 11.907 5.276 1.00 0.00 C ATOM 286 CE1 HIS A 23 -3.427 11.271 7.205 1.00 0.00 C ATOM 287 NE2 HIS A 23 -2.437 11.939 6.639 1.00 0.00 N ATOM 0 H HIS A 23 -3.333 7.970 4.293 1.00 0.00 H new ATOM 0 HA HIS A 23 -4.217 9.499 2.060 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -4.311 11.686 3.046 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -5.450 10.670 3.908 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -1.953 12.363 4.542 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -3.565 11.125 8.266 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -1.675 12.403 7.134 1.00 0.00 H new ATOM 296 N GLY A 24 -1.856 10.838 2.277 1.00 0.00 N ATOM 297 CA GLY A 24 -0.438 11.084 2.094 1.00 0.00 C ATOM 298 C GLY A 24 -0.162 12.418 1.427 1.00 0.00 C ATOM 299 O GLY A 24 -1.037 13.280 1.364 1.00 0.00 O ATOM 0 H GLY A 24 -2.469 11.546 1.874 1.00 0.00 H new ATOM 0 HA2 GLY A 24 0.061 11.056 3.063 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -0.008 10.284 1.491 1.00 0.00 H new ATOM 303 N MET A 25 1.059 12.587 0.930 1.00 0.00 N ATOM 304 CA MET A 25 1.447 13.826 0.265 1.00 0.00 C ATOM 305 C MET A 25 2.423 13.548 -0.874 1.00 0.00 C ATOM 306 O MET A 25 3.173 12.573 -0.839 1.00 0.00 O ATOM 307 CB MET A 25 2.078 14.792 1.269 1.00 0.00 C ATOM 308 CG MET A 25 1.131 15.222 2.377 1.00 0.00 C ATOM 309 SD MET A 25 1.998 15.740 3.870 1.00 0.00 S ATOM 310 CE MET A 25 2.939 17.132 3.250 1.00 0.00 C ATOM 0 H MET A 25 1.796 11.883 0.975 1.00 0.00 H new ATOM 0 HA MET A 25 0.550 14.283 -0.152 1.00 0.00 H new ATOM 0 HB2 MET A 25 2.954 14.320 1.714 1.00 0.00 H new ATOM 0 HB3 MET A 25 2.428 15.677 0.738 1.00 0.00 H new ATOM 0 HG2 MET A 25 0.509 16.043 2.020 1.00 0.00 H new ATOM 0 HG3 MET A 25 0.462 14.396 2.618 1.00 0.00 H new ATOM 0 HE1 MET A 25 3.417 17.648 4.083 1.00 0.00 H new ATOM 0 HE2 MET A 25 3.702 16.776 2.557 1.00 0.00 H new ATOM 0 HE3 MET A 25 2.272 17.821 2.732 1.00 0.00 H new ATOM 320 N VAL A 26 2.408 14.413 -1.884 1.00 0.00 N ATOM 321 CA VAL A 26 3.292 14.261 -3.034 1.00 0.00 C ATOM 322 C VAL A 26 4.756 14.300 -2.609 1.00 0.00 C ATOM 323 O VAL A 26 5.131 15.041 -1.702 1.00 0.00 O ATOM 324 CB VAL A 26 3.044 15.361 -4.082 1.00 0.00 C ATOM 325 CG1 VAL A 26 3.986 15.195 -5.265 1.00 0.00 C ATOM 326 CG2 VAL A 26 1.593 15.342 -4.540 1.00 0.00 C ATOM 0 H VAL A 26 1.794 15.226 -1.929 1.00 0.00 H new ATOM 0 HA VAL A 26 3.070 13.291 -3.478 1.00 0.00 H new ATOM 0 HB VAL A 26 3.244 16.328 -3.622 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.795 15.982 -5.995 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.018 15.262 -4.921 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.820 14.222 -5.728 1.00 0.00 H new ATOM 0 HG21 VAL A 26 1.435 16.126 -5.281 1.00 0.00 H new ATOM 0 HG22 VAL A 26 1.364 14.373 -4.983 1.00 0.00 H new ATOM 0 HG23 VAL A 26 0.939 15.514 -3.685 1.00 0.00 H new ATOM 336 N ASN A 27 5.580 13.495 -3.273 1.00 0.00 N ATOM 337 CA ASN A 27 7.005 13.438 -2.965 1.00 0.00 C ATOM 338 C ASN A 27 7.234 12.916 -1.550 1.00 0.00 C ATOM 339 O ASN A 27 8.196 13.298 -0.883 1.00 0.00 O ATOM 340 CB ASN A 27 7.638 14.822 -3.119 1.00 0.00 C ATOM 341 CG ASN A 27 8.158 15.067 -4.522 1.00 0.00 C ATOM 342 OD1 ASN A 27 9.089 14.400 -4.976 1.00 0.00 O ATOM 343 ND2 ASN A 27 7.559 16.027 -5.217 1.00 0.00 N ATOM 0 H ASN A 27 5.286 12.874 -4.027 1.00 0.00 H new ATOM 0 HA ASN A 27 7.476 12.751 -3.668 1.00 0.00 H new ATOM 0 HB2 ASN A 27 6.901 15.585 -2.869 1.00 0.00 H new ATOM 0 HB3 ASN A 27 8.457 14.925 -2.408 1.00 0.00 H new ATOM 0 HD21 ASN A 27 7.866 16.237 -6.167 1.00 0.00 H new ATOM 0 HD22 ASN A 27 6.791 16.555 -4.801 1.00 0.00 H new ATOM 350 N LYS A 28 6.345 12.039 -1.097 1.00 0.00 N ATOM 351 CA LYS A 28 6.449 11.462 0.238 1.00 0.00 C ATOM 352 C LYS A 28 6.127 9.972 0.214 1.00 0.00 C ATOM 353 O LYS A 28 5.074 9.547 -0.263 1.00 0.00 O ATOM 354 CB LYS A 28 5.505 12.183 1.203 1.00 0.00 C ATOM 355 CG LYS A 28 5.783 13.671 1.329 1.00 0.00 C ATOM 356 CD LYS A 28 7.043 13.937 2.135 1.00 0.00 C ATOM 357 CE LYS A 28 6.831 13.647 3.613 1.00 0.00 C ATOM 358 NZ LYS A 28 8.022 14.014 4.427 1.00 0.00 N ATOM 0 H LYS A 28 5.543 11.712 -1.636 1.00 0.00 H new ATOM 0 HA LYS A 28 7.476 11.588 0.581 1.00 0.00 H new ATOM 0 HB2 LYS A 28 4.478 12.041 0.867 1.00 0.00 H new ATOM 0 HB3 LYS A 28 5.585 11.723 2.188 1.00 0.00 H new ATOM 0 HG2 LYS A 28 5.886 14.108 0.336 1.00 0.00 H new ATOM 0 HG3 LYS A 28 4.935 14.161 1.806 1.00 0.00 H new ATOM 0 HD2 LYS A 28 7.856 13.319 1.755 1.00 0.00 H new ATOM 0 HD3 LYS A 28 7.346 14.976 2.007 1.00 0.00 H new ATOM 0 HE2 LYS A 28 5.962 14.200 3.971 1.00 0.00 H new ATOM 0 HE3 LYS A 28 6.612 12.588 3.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 7.837 13.801 5.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 8.846 13.468 4.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 8.216 15.030 4.319 1.00 0.00 H new ATOM 372 N PRO A 29 7.054 9.157 0.740 1.00 0.00 N ATOM 373 CA PRO A 29 6.889 7.701 0.792 1.00 0.00 C ATOM 374 C PRO A 29 5.810 7.274 1.781 1.00 0.00 C ATOM 375 O PRO A 29 6.063 7.163 2.980 1.00 0.00 O ATOM 376 CB PRO A 29 8.263 7.205 1.251 1.00 0.00 C ATOM 377 CG PRO A 29 8.849 8.352 1.999 1.00 0.00 C ATOM 378 CD PRO A 29 8.332 9.593 1.325 1.00 0.00 C ATOM 0 HA PRO A 29 6.571 7.292 -0.167 1.00 0.00 H new ATOM 0 HB2 PRO A 29 8.174 6.323 1.885 1.00 0.00 H new ATOM 0 HB3 PRO A 29 8.887 6.926 0.402 1.00 0.00 H new ATOM 0 HG2 PRO A 29 8.554 8.326 3.048 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.938 8.319 1.974 1.00 0.00 H new ATOM 0 HD2 PRO A 29 8.191 10.407 2.036 1.00 0.00 H new ATOM 0 HD3 PRO A 29 9.022 9.952 0.561 1.00 0.00 H new ATOM 386 N ALA A 30 4.607 7.035 1.270 1.00 0.00 N ATOM 387 CA ALA A 30 3.490 6.618 2.109 1.00 0.00 C ATOM 388 C ALA A 30 3.736 5.235 2.702 1.00 0.00 C ATOM 389 O ALA A 30 3.669 4.225 1.999 1.00 0.00 O ATOM 390 CB ALA A 30 2.196 6.630 1.309 1.00 0.00 C ATOM 0 H ALA A 30 4.381 7.123 0.279 1.00 0.00 H new ATOM 0 HA ALA A 30 3.401 7.327 2.932 1.00 0.00 H new ATOM 0 HB1 ALA A 30 1.370 6.317 1.948 1.00 0.00 H new ATOM 0 HB2 ALA A 30 2.006 7.638 0.939 1.00 0.00 H new ATOM 0 HB3 ALA A 30 2.283 5.944 0.466 1.00 0.00 H new ATOM 396 N THR A 31 4.021 5.194 3.999 1.00 0.00 N ATOM 397 CA THR A 31 4.278 3.934 4.686 1.00 0.00 C ATOM 398 C THR A 31 3.009 3.391 5.332 1.00 0.00 C ATOM 399 O THR A 31 2.201 4.148 5.871 1.00 0.00 O ATOM 400 CB THR A 31 5.363 4.096 5.768 1.00 0.00 C ATOM 401 OG1 THR A 31 4.875 4.921 6.831 1.00 0.00 O ATOM 402 CG2 THR A 31 6.625 4.709 5.181 1.00 0.00 C ATOM 0 H THR A 31 4.080 6.019 4.596 1.00 0.00 H new ATOM 0 HA THR A 31 4.629 3.229 3.933 1.00 0.00 H new ATOM 0 HB THR A 31 5.606 3.108 6.159 1.00 0.00 H new ATOM 0 HG1 THR A 31 5.570 5.018 7.515 1.00 0.00 H new ATOM 0 HG21 THR A 31 7.377 4.814 5.963 1.00 0.00 H new ATOM 0 HG22 THR A 31 7.010 4.063 4.392 1.00 0.00 H new ATOM 0 HG23 THR A 31 6.394 5.690 4.766 1.00 0.00 H new ATOM 410 N PHE A 32 2.839 2.074 5.276 1.00 0.00 N ATOM 411 CA PHE A 32 1.667 1.429 5.856 1.00 0.00 C ATOM 412 C PHE A 32 1.986 -0.002 6.278 1.00 0.00 C ATOM 413 O PHE A 32 2.985 -0.580 5.850 1.00 0.00 O ATOM 414 CB PHE A 32 0.509 1.431 4.855 1.00 0.00 C ATOM 415 CG PHE A 32 0.812 0.684 3.588 1.00 0.00 C ATOM 416 CD1 PHE A 32 0.535 -0.669 3.483 1.00 0.00 C ATOM 417 CD2 PHE A 32 1.374 1.336 2.501 1.00 0.00 C ATOM 418 CE1 PHE A 32 0.812 -1.360 2.318 1.00 0.00 C ATOM 419 CE2 PHE A 32 1.652 0.651 1.334 1.00 0.00 C ATOM 420 CZ PHE A 32 1.372 -0.699 1.242 1.00 0.00 C ATOM 0 H PHE A 32 3.498 1.433 4.835 1.00 0.00 H new ATOM 0 HA PHE A 32 1.374 1.994 6.741 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -0.369 0.990 5.326 1.00 0.00 H new ATOM 0 HB3 PHE A 32 0.254 2.462 4.608 1.00 0.00 H new ATOM 0 HD1 PHE A 32 0.097 -1.191 4.321 1.00 0.00 H new ATOM 0 HD2 PHE A 32 1.597 2.391 2.567 1.00 0.00 H new ATOM 0 HE1 PHE A 32 0.591 -2.415 2.249 1.00 0.00 H new ATOM 0 HE2 PHE A 32 2.088 1.171 0.494 1.00 0.00 H new ATOM 0 HZ PHE A 32 1.590 -1.236 0.331 1.00 0.00 H new ATOM 430 N THR A 33 1.130 -0.568 7.123 1.00 0.00 N ATOM 431 CA THR A 33 1.321 -1.930 7.605 1.00 0.00 C ATOM 432 C THR A 33 0.357 -2.895 6.925 1.00 0.00 C ATOM 433 O THR A 33 -0.803 -2.560 6.683 1.00 0.00 O ATOM 434 CB THR A 33 1.126 -2.019 9.131 1.00 0.00 C ATOM 435 OG1 THR A 33 2.300 -1.551 9.803 1.00 0.00 O ATOM 436 CG2 THR A 33 0.827 -3.448 9.556 1.00 0.00 C ATOM 0 H THR A 33 0.298 -0.104 7.488 1.00 0.00 H new ATOM 0 HA THR A 33 2.345 -2.210 7.359 1.00 0.00 H new ATOM 0 HB THR A 33 0.278 -1.391 9.404 1.00 0.00 H new ATOM 0 HG1 THR A 33 2.167 -1.609 10.772 1.00 0.00 H new ATOM 0 HG21 THR A 33 0.693 -3.486 10.637 1.00 0.00 H new ATOM 0 HG22 THR A 33 -0.084 -3.790 9.066 1.00 0.00 H new ATOM 0 HG23 THR A 33 1.657 -4.094 9.270 1.00 0.00 H new ATOM 444 N ILE A 34 0.843 -4.093 6.618 1.00 0.00 N ATOM 445 CA ILE A 34 0.023 -5.106 5.967 1.00 0.00 C ATOM 446 C ILE A 34 -0.137 -6.337 6.852 1.00 0.00 C ATOM 447 O ILE A 34 0.833 -7.040 7.138 1.00 0.00 O ATOM 448 CB ILE A 34 0.625 -5.535 4.615 1.00 0.00 C ATOM 449 CG1 ILE A 34 0.767 -4.325 3.689 1.00 0.00 C ATOM 450 CG2 ILE A 34 -0.238 -6.607 3.967 1.00 0.00 C ATOM 451 CD1 ILE A 34 1.477 -4.639 2.391 1.00 0.00 C ATOM 0 H ILE A 34 1.801 -4.385 6.810 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.955 -4.656 5.794 1.00 0.00 H new ATOM 0 HB ILE A 34 1.616 -5.952 4.791 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -0.224 -3.930 3.466 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.313 -3.539 4.212 1.00 0.00 H new ATOM 0 HG21 ILE A 34 0.200 -6.899 3.013 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -0.292 -7.476 4.623 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -1.241 -6.215 3.800 1.00 0.00 H new ATOM 0 HD11 ILE A 34 1.542 -3.736 1.784 1.00 0.00 H new ATOM 0 HD12 ILE A 34 2.481 -5.006 2.605 1.00 0.00 H new ATOM 0 HD13 ILE A 34 0.920 -5.402 1.847 1.00 0.00 H new ATOM 463 N VAL A 35 -1.368 -6.594 7.284 1.00 0.00 N ATOM 464 CA VAL A 35 -1.656 -7.742 8.135 1.00 0.00 C ATOM 465 C VAL A 35 -1.470 -9.050 7.375 1.00 0.00 C ATOM 466 O VAL A 35 -2.335 -9.461 6.600 1.00 0.00 O ATOM 467 CB VAL A 35 -3.092 -7.683 8.689 1.00 0.00 C ATOM 468 CG1 VAL A 35 -3.376 -8.893 9.566 1.00 0.00 C ATOM 469 CG2 VAL A 35 -3.312 -6.391 9.462 1.00 0.00 C ATOM 0 H VAL A 35 -2.182 -6.022 7.058 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.952 -7.705 8.966 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.788 -7.701 7.850 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.395 -8.834 9.948 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -3.261 -9.804 8.978 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -2.676 -8.910 10.401 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -4.332 -6.366 9.846 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -2.609 -6.341 10.294 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.153 -5.540 8.800 1.00 0.00 H new ATOM 479 N THR A 36 -0.334 -9.703 7.601 1.00 0.00 N ATOM 480 CA THR A 36 -0.033 -10.965 6.937 1.00 0.00 C ATOM 481 C THR A 36 0.403 -12.025 7.942 1.00 0.00 C ATOM 482 O THR A 36 1.203 -12.905 7.625 1.00 0.00 O ATOM 483 CB THR A 36 1.073 -10.793 5.878 1.00 0.00 C ATOM 484 OG1 THR A 36 2.232 -10.200 6.472 1.00 0.00 O ATOM 485 CG2 THR A 36 0.588 -9.927 4.725 1.00 0.00 C ATOM 0 H THR A 36 0.393 -9.378 8.239 1.00 0.00 H new ATOM 0 HA THR A 36 -0.950 -11.290 6.445 1.00 0.00 H new ATOM 0 HB THR A 36 1.329 -11.778 5.489 1.00 0.00 H new ATOM 0 HG1 THR A 36 2.931 -10.096 5.793 1.00 0.00 H new ATOM 0 HG21 THR A 36 1.386 -9.820 3.990 1.00 0.00 H new ATOM 0 HG22 THR A 36 -0.277 -10.396 4.256 1.00 0.00 H new ATOM 0 HG23 THR A 36 0.307 -8.944 5.102 1.00 0.00 H new ATOM 493 N LYS A 37 -0.129 -11.936 9.157 1.00 0.00 N ATOM 494 CA LYS A 37 0.203 -12.888 10.209 1.00 0.00 C ATOM 495 C LYS A 37 -0.307 -14.283 9.862 1.00 0.00 C ATOM 496 O LYS A 37 0.328 -15.286 10.188 1.00 0.00 O ATOM 497 CB LYS A 37 -0.393 -12.433 11.543 1.00 0.00 C ATOM 498 CG LYS A 37 -1.908 -12.534 11.599 1.00 0.00 C ATOM 499 CD LYS A 37 -2.358 -13.890 12.115 1.00 0.00 C ATOM 500 CE LYS A 37 -3.859 -13.923 12.361 1.00 0.00 C ATOM 501 NZ LYS A 37 -4.251 -13.062 13.512 1.00 0.00 N ATOM 0 H LYS A 37 -0.792 -11.213 9.437 1.00 0.00 H new ATOM 0 HA LYS A 37 1.289 -12.929 10.298 1.00 0.00 H new ATOM 0 HB2 LYS A 37 0.033 -13.035 12.346 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -0.099 -11.400 11.729 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -2.302 -11.749 12.244 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -2.322 -12.367 10.605 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -2.089 -14.662 11.394 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -1.831 -14.121 13.041 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -4.382 -13.591 11.464 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -4.174 -14.949 12.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -5.225 -13.288 13.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -3.606 -13.234 14.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -4.196 -12.062 13.232 1.00 0.00 H new ATOM 515 N ASP A 38 -1.456 -14.339 9.198 1.00 0.00 N ATOM 516 CA ASP A 38 -2.050 -15.611 8.803 1.00 0.00 C ATOM 517 C ASP A 38 -1.611 -16.003 7.396 1.00 0.00 C ATOM 518 O ASP A 38 -1.190 -17.135 7.159 1.00 0.00 O ATOM 519 CB ASP A 38 -3.576 -15.529 8.871 1.00 0.00 C ATOM 520 CG ASP A 38 -4.226 -16.896 8.959 1.00 0.00 C ATOM 521 OD1 ASP A 38 -3.825 -17.794 8.189 1.00 0.00 O ATOM 522 OD2 ASP A 38 -5.137 -17.067 9.796 1.00 0.00 O ATOM 0 H ASP A 38 -1.995 -13.518 8.922 1.00 0.00 H new ATOM 0 HA ASP A 38 -1.704 -16.376 9.498 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -3.867 -14.935 9.738 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -3.949 -15.009 7.989 1.00 0.00 H new ATOM 527 N ALA A 39 -1.715 -15.060 6.465 1.00 0.00 N ATOM 528 CA ALA A 39 -1.328 -15.306 5.082 1.00 0.00 C ATOM 529 C ALA A 39 -0.101 -16.209 5.007 1.00 0.00 C ATOM 530 O ALA A 39 -0.038 -17.120 4.184 1.00 0.00 O ATOM 531 CB ALA A 39 -1.061 -13.990 4.366 1.00 0.00 C ATOM 0 H ALA A 39 -2.064 -14.119 6.644 1.00 0.00 H new ATOM 0 HA ALA A 39 -2.153 -15.816 4.586 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -0.773 -14.189 3.334 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -1.964 -13.379 4.379 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.255 -13.458 4.871 1.00 0.00 H new ATOM 537 N GLY A 40 0.874 -15.948 5.874 1.00 0.00 N ATOM 538 CA GLY A 40 2.086 -16.745 5.888 1.00 0.00 C ATOM 539 C GLY A 40 2.974 -16.472 4.690 1.00 0.00 C ATOM 540 O GLY A 40 3.770 -15.534 4.702 1.00 0.00 O ATOM 0 H GLY A 40 0.845 -15.199 6.566 1.00 0.00 H new ATOM 0 HA2 GLY A 40 2.642 -16.539 6.803 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.822 -17.802 5.907 1.00 0.00 H new ATOM 544 N GLU A 41 2.839 -17.295 3.655 1.00 0.00 N ATOM 545 CA GLU A 41 3.639 -17.138 2.446 1.00 0.00 C ATOM 546 C GLU A 41 2.889 -17.666 1.226 1.00 0.00 C ATOM 547 O GLU A 41 2.417 -18.802 1.217 1.00 0.00 O ATOM 548 CB GLU A 41 4.975 -17.869 2.593 1.00 0.00 C ATOM 549 CG GLU A 41 4.848 -19.382 2.558 1.00 0.00 C ATOM 550 CD GLU A 41 6.087 -20.084 3.079 1.00 0.00 C ATOM 551 OE1 GLU A 41 6.198 -20.253 4.312 1.00 0.00 O ATOM 552 OE2 GLU A 41 6.946 -20.463 2.256 1.00 0.00 O ATOM 0 H GLU A 41 2.184 -18.076 3.629 1.00 0.00 H new ATOM 0 HA GLU A 41 3.829 -16.074 2.302 1.00 0.00 H new ATOM 0 HB2 GLU A 41 5.644 -17.550 1.793 1.00 0.00 H new ATOM 0 HB3 GLU A 41 5.440 -17.574 3.534 1.00 0.00 H new ATOM 0 HG2 GLU A 41 3.986 -19.684 3.153 1.00 0.00 H new ATOM 0 HG3 GLU A 41 4.657 -19.703 1.534 1.00 0.00 H new ATOM 559 N GLY A 42 2.783 -16.831 0.196 1.00 0.00 N ATOM 560 CA GLY A 42 2.090 -17.230 -1.014 1.00 0.00 C ATOM 561 C GLY A 42 2.480 -16.386 -2.211 1.00 0.00 C ATOM 562 O GLY A 42 3.661 -16.125 -2.437 1.00 0.00 O ATOM 0 H GLY A 42 3.165 -15.885 0.179 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.308 -18.277 -1.225 1.00 0.00 H new ATOM 0 HA3 GLY A 42 1.014 -17.154 -0.855 1.00 0.00 H new ATOM 566 N GLY A 43 1.485 -15.959 -2.983 1.00 0.00 N ATOM 567 CA GLY A 43 1.751 -15.146 -4.155 1.00 0.00 C ATOM 568 C GLY A 43 1.179 -13.748 -4.033 1.00 0.00 C ATOM 569 O GLY A 43 0.498 -13.266 -4.939 1.00 0.00 O ATOM 0 H GLY A 43 0.499 -16.162 -2.817 1.00 0.00 H new ATOM 0 HA2 GLY A 43 2.828 -15.082 -4.312 1.00 0.00 H new ATOM 0 HA3 GLY A 43 1.329 -15.633 -5.034 1.00 0.00 H new ATOM 573 N LEU A 44 1.452 -13.094 -2.909 1.00 0.00 N ATOM 574 CA LEU A 44 0.958 -11.743 -2.670 1.00 0.00 C ATOM 575 C LEU A 44 1.512 -10.769 -3.705 1.00 0.00 C ATOM 576 O LEU A 44 2.722 -10.696 -3.918 1.00 0.00 O ATOM 577 CB LEU A 44 1.339 -11.280 -1.263 1.00 0.00 C ATOM 578 CG LEU A 44 0.850 -9.889 -0.858 1.00 0.00 C ATOM 579 CD1 LEU A 44 -0.562 -9.963 -0.297 1.00 0.00 C ATOM 580 CD2 LEU A 44 1.797 -9.265 0.157 1.00 0.00 C ATOM 0 H LEU A 44 2.013 -13.478 -2.149 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.128 -11.760 -2.759 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.949 -12.003 -0.546 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.425 -11.300 -1.177 1.00 0.00 H new ATOM 0 HG LEU A 44 0.834 -9.257 -1.746 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.894 -8.964 -0.014 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.234 -10.368 -1.054 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.572 -10.611 0.580 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.433 -8.275 0.434 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.845 -9.895 1.045 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.792 -9.177 -0.280 1.00 0.00 H new ATOM 592 N SER A 45 0.618 -10.022 -4.346 1.00 0.00 N ATOM 593 CA SER A 45 1.018 -9.054 -5.360 1.00 0.00 C ATOM 594 C SER A 45 0.883 -7.628 -4.833 1.00 0.00 C ATOM 595 O SER A 45 0.079 -7.357 -3.940 1.00 0.00 O ATOM 596 CB SER A 45 0.170 -9.226 -6.622 1.00 0.00 C ATOM 597 OG SER A 45 0.521 -8.269 -7.606 1.00 0.00 O ATOM 0 H SER A 45 -0.387 -10.069 -4.181 1.00 0.00 H new ATOM 0 HA SER A 45 2.064 -9.234 -5.607 1.00 0.00 H new ATOM 0 HB2 SER A 45 0.307 -10.231 -7.022 1.00 0.00 H new ATOM 0 HB3 SER A 45 -0.886 -9.124 -6.371 1.00 0.00 H new ATOM 0 HG SER A 45 -0.034 -8.401 -8.403 1.00 0.00 H new ATOM 603 N LEU A 46 1.675 -6.720 -5.393 1.00 0.00 N ATOM 604 CA LEU A 46 1.646 -5.321 -4.981 1.00 0.00 C ATOM 605 C LEU A 46 1.716 -4.395 -6.191 1.00 0.00 C ATOM 606 O LEU A 46 2.651 -4.469 -6.987 1.00 0.00 O ATOM 607 CB LEU A 46 2.806 -5.024 -4.029 1.00 0.00 C ATOM 608 CG LEU A 46 2.661 -5.562 -2.605 1.00 0.00 C ATOM 609 CD1 LEU A 46 4.022 -5.670 -1.934 1.00 0.00 C ATOM 610 CD2 LEU A 46 1.732 -4.673 -1.792 1.00 0.00 C ATOM 0 H LEU A 46 2.345 -6.928 -6.133 1.00 0.00 H new ATOM 0 HA LEU A 46 0.704 -5.141 -4.463 1.00 0.00 H new ATOM 0 HB2 LEU A 46 3.718 -5.436 -4.460 1.00 0.00 H new ATOM 0 HB3 LEU A 46 2.938 -3.943 -3.976 1.00 0.00 H new ATOM 0 HG LEU A 46 2.224 -6.559 -2.656 1.00 0.00 H new ATOM 0 HD11 LEU A 46 3.899 -6.055 -0.922 1.00 0.00 H new ATOM 0 HD12 LEU A 46 4.656 -6.348 -2.505 1.00 0.00 H new ATOM 0 HD13 LEU A 46 4.487 -4.685 -1.894 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.640 -5.071 -0.781 1.00 0.00 H new ATOM 0 HD22 LEU A 46 2.140 -3.663 -1.749 1.00 0.00 H new ATOM 0 HD23 LEU A 46 0.749 -4.647 -2.262 1.00 0.00 H new ATOM 622 N ALA A 47 0.721 -3.524 -6.321 1.00 0.00 N ATOM 623 CA ALA A 47 0.672 -2.581 -7.432 1.00 0.00 C ATOM 624 C ALA A 47 -0.117 -1.331 -7.056 1.00 0.00 C ATOM 625 O ALA A 47 -1.210 -1.419 -6.496 1.00 0.00 O ATOM 626 CB ALA A 47 0.063 -3.242 -8.659 1.00 0.00 C ATOM 0 H ALA A 47 -0.062 -3.452 -5.671 1.00 0.00 H new ATOM 0 HA ALA A 47 1.693 -2.279 -7.665 1.00 0.00 H new ATOM 0 HB1 ALA A 47 0.033 -2.526 -9.481 1.00 0.00 H new ATOM 0 HB2 ALA A 47 0.669 -4.101 -8.948 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.950 -3.573 -8.429 1.00 0.00 H new ATOM 632 N VAL A 48 0.445 -0.167 -7.367 1.00 0.00 N ATOM 633 CA VAL A 48 -0.207 1.102 -7.062 1.00 0.00 C ATOM 634 C VAL A 48 -0.683 1.794 -8.334 1.00 0.00 C ATOM 635 O VAL A 48 0.092 1.999 -9.268 1.00 0.00 O ATOM 636 CB VAL A 48 0.738 2.048 -6.299 1.00 0.00 C ATOM 637 CG1 VAL A 48 0.135 3.441 -6.202 1.00 0.00 C ATOM 638 CG2 VAL A 48 1.044 1.494 -4.915 1.00 0.00 C ATOM 0 H VAL A 48 1.350 -0.076 -7.830 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.067 0.874 -6.432 1.00 0.00 H new ATOM 0 HB VAL A 48 1.675 2.121 -6.852 1.00 0.00 H new ATOM 0 HG11 VAL A 48 0.817 4.096 -5.660 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.028 3.837 -7.204 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.816 3.390 -5.673 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.713 2.176 -4.390 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.117 1.390 -4.351 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.521 0.519 -5.011 1.00 0.00 H new ATOM 648 N GLU A 49 -1.962 2.153 -8.362 1.00 0.00 N ATOM 649 CA GLU A 49 -2.542 2.823 -9.521 1.00 0.00 C ATOM 650 C GLU A 49 -3.187 4.146 -9.118 1.00 0.00 C ATOM 651 O GLU A 49 -4.284 4.171 -8.562 1.00 0.00 O ATOM 652 CB GLU A 49 -3.579 1.922 -10.193 1.00 0.00 C ATOM 653 CG GLU A 49 -2.977 0.707 -10.879 1.00 0.00 C ATOM 654 CD GLU A 49 -3.932 0.058 -11.862 1.00 0.00 C ATOM 655 OE1 GLU A 49 -4.269 0.705 -12.876 1.00 0.00 O ATOM 656 OE2 GLU A 49 -4.344 -1.095 -11.617 1.00 0.00 O ATOM 0 H GLU A 49 -2.616 1.992 -7.596 1.00 0.00 H new ATOM 0 HA GLU A 49 -1.739 3.030 -10.228 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -4.297 1.587 -9.444 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.134 2.506 -10.928 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -2.068 1.004 -11.403 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -2.686 -0.024 -10.125 1.00 0.00 H new ATOM 663 N GLY A 50 -2.495 5.246 -9.402 1.00 0.00 N ATOM 664 CA GLY A 50 -3.015 6.558 -9.062 1.00 0.00 C ATOM 665 C GLY A 50 -2.822 7.565 -10.178 1.00 0.00 C ATOM 666 O GLY A 50 -2.778 7.215 -11.358 1.00 0.00 O ATOM 0 H GLY A 50 -1.584 5.252 -9.861 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -4.077 6.476 -8.831 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.520 6.919 -8.161 1.00 0.00 H new ATOM 670 N PRO A 51 -2.704 8.849 -9.808 1.00 0.00 N ATOM 671 CA PRO A 51 -2.513 9.936 -10.773 1.00 0.00 C ATOM 672 C PRO A 51 -1.137 9.896 -11.427 1.00 0.00 C ATOM 673 O PRO A 51 -0.844 10.683 -12.328 1.00 0.00 O ATOM 674 CB PRO A 51 -2.663 11.198 -9.919 1.00 0.00 C ATOM 675 CG PRO A 51 -2.297 10.768 -8.540 1.00 0.00 C ATOM 676 CD PRO A 51 -2.746 9.337 -8.420 1.00 0.00 C ATOM 0 HA PRO A 51 -3.221 9.877 -11.599 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -2.009 11.995 -10.272 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -3.682 11.583 -9.956 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.223 10.855 -8.376 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.785 11.394 -7.793 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -2.085 8.762 -7.772 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -3.749 9.264 -7.999 1.00 0.00 H new ATOM 684 N SER A 52 -0.295 8.975 -10.970 1.00 0.00 N ATOM 685 CA SER A 52 1.052 8.835 -11.509 1.00 0.00 C ATOM 686 C SER A 52 1.755 7.621 -10.908 1.00 0.00 C ATOM 687 O SER A 52 1.662 7.367 -9.707 1.00 0.00 O ATOM 688 CB SER A 52 1.868 10.099 -11.234 1.00 0.00 C ATOM 689 OG SER A 52 2.946 10.220 -12.147 1.00 0.00 O ATOM 0 H SER A 52 -0.522 8.314 -10.227 1.00 0.00 H new ATOM 0 HA SER A 52 0.972 8.690 -12.586 1.00 0.00 H new ATOM 0 HB2 SER A 52 1.224 10.975 -11.309 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.252 10.073 -10.214 1.00 0.00 H new ATOM 0 HG SER A 52 3.250 11.151 -12.173 1.00 0.00 H new ATOM 695 N LYS A 53 2.457 6.874 -11.753 1.00 0.00 N ATOM 696 CA LYS A 53 3.178 5.687 -11.307 1.00 0.00 C ATOM 697 C LYS A 53 3.937 5.964 -10.014 1.00 0.00 C ATOM 698 O LYS A 53 4.705 6.922 -9.927 1.00 0.00 O ATOM 699 CB LYS A 53 4.151 5.219 -12.392 1.00 0.00 C ATOM 700 CG LYS A 53 4.569 3.766 -12.248 1.00 0.00 C ATOM 701 CD LYS A 53 3.656 2.842 -13.037 1.00 0.00 C ATOM 702 CE LYS A 53 3.903 2.959 -14.533 1.00 0.00 C ATOM 703 NZ LYS A 53 3.104 1.968 -15.306 1.00 0.00 N ATOM 0 H LYS A 53 2.542 7.069 -12.751 1.00 0.00 H new ATOM 0 HA LYS A 53 2.448 4.900 -11.117 1.00 0.00 H new ATOM 0 HB2 LYS A 53 3.688 5.360 -13.369 1.00 0.00 H new ATOM 0 HB3 LYS A 53 5.040 5.849 -12.367 1.00 0.00 H new ATOM 0 HG2 LYS A 53 5.596 3.646 -12.593 1.00 0.00 H new ATOM 0 HG3 LYS A 53 4.552 3.484 -11.195 1.00 0.00 H new ATOM 0 HD2 LYS A 53 3.817 1.812 -12.720 1.00 0.00 H new ATOM 0 HD3 LYS A 53 2.616 3.083 -12.819 1.00 0.00 H new ATOM 0 HE2 LYS A 53 3.652 3.966 -14.865 1.00 0.00 H new ATOM 0 HE3 LYS A 53 4.963 2.811 -14.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 3.300 2.080 -16.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 3.362 1.006 -15.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 2.091 2.125 -15.130 1.00 0.00 H new ATOM 717 N ALA A 54 3.718 5.119 -9.012 1.00 0.00 N ATOM 718 CA ALA A 54 4.384 5.272 -7.724 1.00 0.00 C ATOM 719 C ALA A 54 5.102 3.988 -7.322 1.00 0.00 C ATOM 720 O ALA A 54 4.467 2.967 -7.063 1.00 0.00 O ATOM 721 CB ALA A 54 3.380 5.675 -6.655 1.00 0.00 C ATOM 0 H ALA A 54 3.085 4.321 -9.067 1.00 0.00 H new ATOM 0 HA ALA A 54 5.131 6.060 -7.820 1.00 0.00 H new ATOM 0 HB1 ALA A 54 3.891 5.786 -5.699 1.00 0.00 H new ATOM 0 HB2 ALA A 54 2.916 6.622 -6.930 1.00 0.00 H new ATOM 0 HB3 ALA A 54 2.612 4.906 -6.569 1.00 0.00 H new ATOM 727 N GLU A 55 6.430 4.048 -7.273 1.00 0.00 N ATOM 728 CA GLU A 55 7.233 2.889 -6.904 1.00 0.00 C ATOM 729 C GLU A 55 6.773 2.311 -5.569 1.00 0.00 C ATOM 730 O GLU A 55 6.210 3.021 -4.734 1.00 0.00 O ATOM 731 CB GLU A 55 8.713 3.270 -6.825 1.00 0.00 C ATOM 732 CG GLU A 55 9.457 3.095 -8.138 1.00 0.00 C ATOM 733 CD GLU A 55 9.858 1.656 -8.394 1.00 0.00 C ATOM 734 OE1 GLU A 55 10.148 0.938 -7.414 1.00 0.00 O ATOM 735 OE2 GLU A 55 9.883 1.247 -9.574 1.00 0.00 O ATOM 0 H GLU A 55 6.971 4.886 -7.484 1.00 0.00 H new ATOM 0 HA GLU A 55 7.102 2.128 -7.674 1.00 0.00 H new ATOM 0 HB2 GLU A 55 8.796 4.309 -6.506 1.00 0.00 H new ATOM 0 HB3 GLU A 55 9.196 2.662 -6.060 1.00 0.00 H new ATOM 0 HG2 GLU A 55 8.828 3.444 -8.957 1.00 0.00 H new ATOM 0 HG3 GLU A 55 10.349 3.721 -8.132 1.00 0.00 H new ATOM 742 N ILE A 56 7.015 1.019 -5.374 1.00 0.00 N ATOM 743 CA ILE A 56 6.627 0.346 -4.141 1.00 0.00 C ATOM 744 C ILE A 56 7.784 -0.466 -3.570 1.00 0.00 C ATOM 745 O ILE A 56 8.373 -1.299 -4.260 1.00 0.00 O ATOM 746 CB ILE A 56 5.421 -0.585 -4.364 1.00 0.00 C ATOM 747 CG1 ILE A 56 4.363 0.111 -5.223 1.00 0.00 C ATOM 748 CG2 ILE A 56 4.829 -1.014 -3.029 1.00 0.00 C ATOM 749 CD1 ILE A 56 3.408 -0.848 -5.900 1.00 0.00 C ATOM 0 H ILE A 56 7.478 0.417 -6.055 1.00 0.00 H new ATOM 0 HA ILE A 56 6.348 1.124 -3.431 1.00 0.00 H new ATOM 0 HB ILE A 56 5.761 -1.476 -4.892 1.00 0.00 H new ATOM 0 HG12 ILE A 56 3.793 0.798 -4.597 1.00 0.00 H new ATOM 0 HG13 ILE A 56 4.862 0.712 -5.983 1.00 0.00 H new ATOM 0 HG21 ILE A 56 3.977 -1.672 -3.203 1.00 0.00 H new ATOM 0 HG22 ILE A 56 5.585 -1.544 -2.450 1.00 0.00 H new ATOM 0 HG23 ILE A 56 4.500 -0.133 -2.477 1.00 0.00 H new ATOM 0 HD11 ILE A 56 2.686 -0.285 -6.492 1.00 0.00 H new ATOM 0 HD12 ILE A 56 3.967 -1.519 -6.552 1.00 0.00 H new ATOM 0 HD13 ILE A 56 2.882 -1.432 -5.145 1.00 0.00 H new ATOM 761 N THR A 57 8.105 -0.220 -2.304 1.00 0.00 N ATOM 762 CA THR A 57 9.191 -0.928 -1.639 1.00 0.00 C ATOM 763 C THR A 57 8.653 -2.003 -0.700 1.00 0.00 C ATOM 764 O THR A 57 7.659 -1.791 -0.004 1.00 0.00 O ATOM 765 CB THR A 57 10.084 0.037 -0.837 1.00 0.00 C ATOM 766 OG1 THR A 57 10.526 1.108 -1.679 1.00 0.00 O ATOM 767 CG2 THR A 57 11.288 -0.692 -0.261 1.00 0.00 C ATOM 0 H THR A 57 7.628 0.465 -1.718 1.00 0.00 H new ATOM 0 HA THR A 57 9.787 -1.397 -2.421 1.00 0.00 H new ATOM 0 HB THR A 57 9.496 0.441 -0.013 1.00 0.00 H new ATOM 0 HG1 THR A 57 11.092 1.719 -1.162 1.00 0.00 H new ATOM 0 HG21 THR A 57 11.904 0.010 0.301 1.00 0.00 H new ATOM 0 HG22 THR A 57 10.949 -1.488 0.402 1.00 0.00 H new ATOM 0 HG23 THR A 57 11.876 -1.121 -1.072 1.00 0.00 H new ATOM 775 N CYS A 58 9.315 -3.154 -0.686 1.00 0.00 N ATOM 776 CA CYS A 58 8.903 -4.262 0.168 1.00 0.00 C ATOM 777 C CYS A 58 9.974 -4.576 1.207 1.00 0.00 C ATOM 778 O CYS A 58 11.158 -4.678 0.883 1.00 0.00 O ATOM 779 CB CYS A 58 8.614 -5.504 -0.676 1.00 0.00 C ATOM 780 SG CYS A 58 7.901 -6.881 0.255 1.00 0.00 S ATOM 0 H CYS A 58 10.139 -3.345 -1.256 1.00 0.00 H new ATOM 0 HA CYS A 58 7.993 -3.967 0.690 1.00 0.00 H new ATOM 0 HB2 CYS A 58 7.932 -5.232 -1.481 1.00 0.00 H new ATOM 0 HB3 CYS A 58 9.541 -5.837 -1.143 1.00 0.00 H new ATOM 0 HG CYS A 58 7.690 -7.883 -0.546 1.00 0.00 H new ATOM 786 N LYS A 59 9.552 -4.727 2.458 1.00 0.00 N ATOM 787 CA LYS A 59 10.475 -5.029 3.546 1.00 0.00 C ATOM 788 C LYS A 59 10.024 -6.267 4.314 1.00 0.00 C ATOM 789 O LYS A 59 8.828 -6.528 4.443 1.00 0.00 O ATOM 790 CB LYS A 59 10.580 -3.836 4.498 1.00 0.00 C ATOM 791 CG LYS A 59 11.933 -3.719 5.179 1.00 0.00 C ATOM 792 CD LYS A 59 12.968 -3.092 4.260 1.00 0.00 C ATOM 793 CE LYS A 59 14.150 -2.543 5.044 1.00 0.00 C ATOM 794 NZ LYS A 59 15.324 -2.281 4.166 1.00 0.00 N ATOM 0 H LYS A 59 8.576 -4.645 2.744 1.00 0.00 H new ATOM 0 HA LYS A 59 11.455 -5.229 3.113 1.00 0.00 H new ATOM 0 HB2 LYS A 59 10.382 -2.920 3.942 1.00 0.00 H new ATOM 0 HB3 LYS A 59 9.805 -3.920 5.260 1.00 0.00 H new ATOM 0 HG2 LYS A 59 11.836 -3.117 6.083 1.00 0.00 H new ATOM 0 HG3 LYS A 59 12.272 -4.707 5.489 1.00 0.00 H new ATOM 0 HD2 LYS A 59 13.319 -3.836 3.544 1.00 0.00 H new ATOM 0 HD3 LYS A 59 12.507 -2.289 3.685 1.00 0.00 H new ATOM 0 HE2 LYS A 59 13.857 -1.620 5.544 1.00 0.00 H new ATOM 0 HE3 LYS A 59 14.430 -3.252 5.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 16.109 -1.908 4.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 15.620 -3.167 3.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 15.065 -1.585 3.438 1.00 0.00 H new ATOM 808 N ASP A 60 10.989 -7.026 4.822 1.00 0.00 N ATOM 809 CA ASP A 60 10.690 -8.236 5.580 1.00 0.00 C ATOM 810 C ASP A 60 10.830 -7.987 7.079 1.00 0.00 C ATOM 811 O ASP A 60 11.902 -7.624 7.560 1.00 0.00 O ATOM 812 CB ASP A 60 11.618 -9.374 5.151 1.00 0.00 C ATOM 813 CG ASP A 60 11.898 -10.348 6.278 1.00 0.00 C ATOM 814 OD1 ASP A 60 10.947 -10.706 7.002 1.00 0.00 O ATOM 815 OD2 ASP A 60 13.070 -10.753 6.436 1.00 0.00 O ATOM 0 H ASP A 60 11.984 -6.825 4.723 1.00 0.00 H new ATOM 0 HA ASP A 60 9.658 -8.520 5.372 1.00 0.00 H new ATOM 0 HB2 ASP A 60 11.169 -9.910 4.315 1.00 0.00 H new ATOM 0 HB3 ASP A 60 12.559 -8.956 4.793 1.00 0.00 H new ATOM 820 N ASN A 61 9.738 -8.183 7.810 1.00 0.00 N ATOM 821 CA ASN A 61 9.738 -7.979 9.254 1.00 0.00 C ATOM 822 C ASN A 61 10.101 -9.267 9.986 1.00 0.00 C ATOM 823 O ASN A 61 10.800 -9.243 11.000 1.00 0.00 O ATOM 824 CB ASN A 61 8.368 -7.483 9.720 1.00 0.00 C ATOM 825 CG ASN A 61 8.012 -6.131 9.133 1.00 0.00 C ATOM 826 OD1 ASN A 61 8.708 -5.140 9.360 1.00 0.00 O ATOM 827 ND2 ASN A 61 6.923 -6.083 8.374 1.00 0.00 N ATOM 0 H ASN A 61 8.842 -8.483 7.426 1.00 0.00 H new ATOM 0 HA ASN A 61 10.489 -7.225 9.489 1.00 0.00 H new ATOM 0 HB2 ASN A 61 7.606 -8.210 9.438 1.00 0.00 H new ATOM 0 HB3 ASN A 61 8.359 -7.417 10.808 1.00 0.00 H new ATOM 0 HD21 ASN A 61 6.634 -5.200 7.953 1.00 0.00 H new ATOM 0 HD22 ASN A 61 6.376 -6.929 8.213 1.00 0.00 H new ATOM 834 N LYS A 62 9.622 -10.392 9.466 1.00 0.00 N ATOM 835 CA LYS A 62 9.896 -11.691 10.068 1.00 0.00 C ATOM 836 C LYS A 62 9.237 -11.807 11.438 1.00 0.00 C ATOM 837 O LYS A 62 9.761 -12.466 12.336 1.00 0.00 O ATOM 838 CB LYS A 62 11.406 -11.908 10.197 1.00 0.00 C ATOM 839 CG LYS A 62 11.825 -13.362 10.066 1.00 0.00 C ATOM 840 CD LYS A 62 11.839 -14.062 11.415 1.00 0.00 C ATOM 841 CE LYS A 62 12.627 -15.362 11.360 1.00 0.00 C ATOM 842 NZ LYS A 62 14.092 -15.118 11.248 1.00 0.00 N ATOM 0 H LYS A 62 9.042 -10.430 8.628 1.00 0.00 H new ATOM 0 HA LYS A 62 9.478 -12.459 9.418 1.00 0.00 H new ATOM 0 HB2 LYS A 62 11.915 -11.322 9.432 1.00 0.00 H new ATOM 0 HB3 LYS A 62 11.738 -11.529 11.163 1.00 0.00 H new ATOM 0 HG2 LYS A 62 11.141 -13.880 9.394 1.00 0.00 H new ATOM 0 HG3 LYS A 62 12.816 -13.417 9.616 1.00 0.00 H new ATOM 0 HD2 LYS A 62 12.276 -13.402 12.164 1.00 0.00 H new ATOM 0 HD3 LYS A 62 10.816 -14.268 11.730 1.00 0.00 H new ATOM 0 HE2 LYS A 62 12.424 -15.948 12.256 1.00 0.00 H new ATOM 0 HE3 LYS A 62 12.291 -15.954 10.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 14.608 -15.990 11.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 14.323 -14.831 10.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 14.370 -14.363 11.907 1.00 0.00 H new ATOM 856 N ASP A 63 8.084 -11.163 11.591 1.00 0.00 N ATOM 857 CA ASP A 63 7.352 -11.196 12.851 1.00 0.00 C ATOM 858 C ASP A 63 5.886 -11.549 12.619 1.00 0.00 C ATOM 859 O ASP A 63 5.239 -12.153 13.474 1.00 0.00 O ATOM 860 CB ASP A 63 7.457 -9.846 13.563 1.00 0.00 C ATOM 861 CG ASP A 63 8.683 -9.754 14.450 1.00 0.00 C ATOM 862 OD1 ASP A 63 8.698 -10.411 15.512 1.00 0.00 O ATOM 863 OD2 ASP A 63 9.628 -9.024 14.082 1.00 0.00 O ATOM 0 H ASP A 63 7.637 -10.612 10.858 1.00 0.00 H new ATOM 0 HA ASP A 63 7.798 -11.966 13.481 1.00 0.00 H new ATOM 0 HB2 ASP A 63 7.488 -9.048 12.821 1.00 0.00 H new ATOM 0 HB3 ASP A 63 6.563 -9.686 14.166 1.00 0.00 H new ATOM 868 N GLY A 64 5.368 -11.167 11.455 1.00 0.00 N ATOM 869 CA GLY A 64 3.982 -11.451 11.132 1.00 0.00 C ATOM 870 C GLY A 64 3.313 -10.308 10.394 1.00 0.00 C ATOM 871 O GLY A 64 2.110 -10.085 10.536 1.00 0.00 O ATOM 0 H GLY A 64 5.883 -10.666 10.731 1.00 0.00 H new ATOM 0 HA2 GLY A 64 3.932 -12.353 10.521 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.433 -11.657 12.051 1.00 0.00 H new ATOM 875 N THR A 65 4.094 -9.579 9.602 1.00 0.00 N ATOM 876 CA THR A 65 3.572 -8.451 8.841 1.00 0.00 C ATOM 877 C THR A 65 4.492 -8.100 7.678 1.00 0.00 C ATOM 878 O THR A 65 5.492 -8.777 7.439 1.00 0.00 O ATOM 879 CB THR A 65 3.391 -7.208 9.732 1.00 0.00 C ATOM 880 OG1 THR A 65 4.651 -6.820 10.293 1.00 0.00 O ATOM 881 CG2 THR A 65 2.396 -7.482 10.849 1.00 0.00 C ATOM 0 H THR A 65 5.091 -9.750 9.471 1.00 0.00 H new ATOM 0 HA THR A 65 2.600 -8.754 8.452 1.00 0.00 H new ATOM 0 HB THR A 65 3.004 -6.398 9.113 1.00 0.00 H new ATOM 0 HG1 THR A 65 4.528 -6.028 10.857 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.285 -6.589 11.465 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.430 -7.748 10.419 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.758 -8.305 11.465 1.00 0.00 H new ATOM 889 N CYS A 66 4.147 -7.038 6.957 1.00 0.00 N ATOM 890 CA CYS A 66 4.943 -6.596 5.818 1.00 0.00 C ATOM 891 C CYS A 66 4.912 -5.077 5.688 1.00 0.00 C ATOM 892 O CYS A 66 3.843 -4.472 5.596 1.00 0.00 O ATOM 893 CB CYS A 66 4.429 -7.241 4.530 1.00 0.00 C ATOM 894 SG CYS A 66 5.087 -8.896 4.219 1.00 0.00 S ATOM 0 H CYS A 66 3.322 -6.468 7.141 1.00 0.00 H new ATOM 0 HA CYS A 66 5.974 -6.906 5.985 1.00 0.00 H new ATOM 0 HB2 CYS A 66 3.341 -7.296 4.573 1.00 0.00 H new ATOM 0 HB3 CYS A 66 4.682 -6.597 3.688 1.00 0.00 H new ATOM 0 HG CYS A 66 5.473 -9.427 5.341 1.00 0.00 H new ATOM 900 N THR A 67 6.091 -4.464 5.683 1.00 0.00 N ATOM 901 CA THR A 67 6.199 -3.015 5.568 1.00 0.00 C ATOM 902 C THR A 67 6.387 -2.591 4.116 1.00 0.00 C ATOM 903 O THR A 67 7.291 -3.069 3.431 1.00 0.00 O ATOM 904 CB THR A 67 7.372 -2.471 6.406 1.00 0.00 C ATOM 905 OG1 THR A 67 7.174 -2.785 7.789 1.00 0.00 O ATOM 906 CG2 THR A 67 7.504 -0.965 6.237 1.00 0.00 C ATOM 0 H THR A 67 6.985 -4.949 5.757 1.00 0.00 H new ATOM 0 HA THR A 67 5.266 -2.597 5.947 1.00 0.00 H new ATOM 0 HB THR A 67 8.290 -2.943 6.055 1.00 0.00 H new ATOM 0 HG1 THR A 67 7.761 -3.528 8.043 1.00 0.00 H new ATOM 0 HG21 THR A 67 8.338 -0.603 6.838 1.00 0.00 H new ATOM 0 HG22 THR A 67 7.684 -0.731 5.188 1.00 0.00 H new ATOM 0 HG23 THR A 67 6.584 -0.480 6.564 1.00 0.00 H new ATOM 914 N VAL A 68 5.527 -1.690 3.652 1.00 0.00 N ATOM 915 CA VAL A 68 5.599 -1.200 2.280 1.00 0.00 C ATOM 916 C VAL A 68 5.469 0.318 2.232 1.00 0.00 C ATOM 917 O VAL A 68 4.732 0.914 3.017 1.00 0.00 O ATOM 918 CB VAL A 68 4.501 -1.827 1.401 1.00 0.00 C ATOM 919 CG1 VAL A 68 4.697 -1.439 -0.056 1.00 0.00 C ATOM 920 CG2 VAL A 68 4.489 -3.340 1.562 1.00 0.00 C ATOM 0 H VAL A 68 4.772 -1.284 4.206 1.00 0.00 H new ATOM 0 HA VAL A 68 6.575 -1.491 1.891 1.00 0.00 H new ATOM 0 HB VAL A 68 3.535 -1.442 1.727 1.00 0.00 H new ATOM 0 HG11 VAL A 68 3.912 -1.891 -0.662 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.651 -0.354 -0.153 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.669 -1.793 -0.399 1.00 0.00 H new ATOM 0 HG21 VAL A 68 3.707 -3.767 0.934 1.00 0.00 H new ATOM 0 HG22 VAL A 68 5.456 -3.745 1.263 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.296 -3.593 2.604 1.00 0.00 H new ATOM 930 N SER A 69 6.190 0.939 1.303 1.00 0.00 N ATOM 931 CA SER A 69 6.158 2.389 1.154 1.00 0.00 C ATOM 932 C SER A 69 6.138 2.783 -0.320 1.00 0.00 C ATOM 933 O SER A 69 6.972 2.332 -1.106 1.00 0.00 O ATOM 934 CB SER A 69 7.367 3.021 1.846 1.00 0.00 C ATOM 935 OG SER A 69 7.594 2.433 3.115 1.00 0.00 O ATOM 0 H SER A 69 6.803 0.460 0.643 1.00 0.00 H new ATOM 0 HA SER A 69 5.246 2.758 1.623 1.00 0.00 H new ATOM 0 HB2 SER A 69 8.252 2.899 1.222 1.00 0.00 H new ATOM 0 HB3 SER A 69 7.204 4.093 1.962 1.00 0.00 H new ATOM 0 HG SER A 69 8.373 2.853 3.536 1.00 0.00 H new ATOM 941 N TYR A 70 5.179 3.626 -0.688 1.00 0.00 N ATOM 942 CA TYR A 70 5.047 4.079 -2.067 1.00 0.00 C ATOM 943 C TYR A 70 5.236 5.590 -2.164 1.00 0.00 C ATOM 944 O TYR A 70 4.646 6.352 -1.397 1.00 0.00 O ATOM 945 CB TYR A 70 3.678 3.688 -2.626 1.00 0.00 C ATOM 946 CG TYR A 70 2.560 4.605 -2.186 1.00 0.00 C ATOM 947 CD1 TYR A 70 2.450 5.893 -2.695 1.00 0.00 C ATOM 948 CD2 TYR A 70 1.614 4.184 -1.260 1.00 0.00 C ATOM 949 CE1 TYR A 70 1.430 6.734 -2.295 1.00 0.00 C ATOM 950 CE2 TYR A 70 0.589 5.018 -0.855 1.00 0.00 C ATOM 951 CZ TYR A 70 0.502 6.292 -1.376 1.00 0.00 C ATOM 952 OH TYR A 70 -0.516 7.127 -0.974 1.00 0.00 O ATOM 0 H TYR A 70 4.482 4.009 -0.050 1.00 0.00 H new ATOM 0 HA TYR A 70 5.825 3.595 -2.658 1.00 0.00 H new ATOM 0 HB2 TYR A 70 3.727 3.685 -3.715 1.00 0.00 H new ATOM 0 HB3 TYR A 70 3.445 2.670 -2.315 1.00 0.00 H new ATOM 0 HD1 TYR A 70 3.174 6.243 -3.416 1.00 0.00 H new ATOM 0 HD2 TYR A 70 1.681 3.187 -0.849 1.00 0.00 H new ATOM 0 HE1 TYR A 70 1.360 7.733 -2.700 1.00 0.00 H new ATOM 0 HE2 TYR A 70 -0.139 4.674 -0.135 1.00 0.00 H new ATOM 0 HH TYR A 70 -0.491 7.228 0.000 1.00 0.00 H new ATOM 962 N LEU A 71 6.062 6.016 -3.114 1.00 0.00 N ATOM 963 CA LEU A 71 6.329 7.436 -3.314 1.00 0.00 C ATOM 964 C LEU A 71 5.640 7.947 -4.575 1.00 0.00 C ATOM 965 O LEU A 71 6.100 7.728 -5.696 1.00 0.00 O ATOM 966 CB LEU A 71 7.836 7.684 -3.406 1.00 0.00 C ATOM 967 CG LEU A 71 8.261 9.103 -3.783 1.00 0.00 C ATOM 968 CD1 LEU A 71 8.434 9.958 -2.537 1.00 0.00 C ATOM 969 CD2 LEU A 71 9.547 9.076 -4.596 1.00 0.00 C ATOM 0 H LEU A 71 6.558 5.399 -3.757 1.00 0.00 H new ATOM 0 HA LEU A 71 5.929 7.980 -2.458 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.284 7.436 -2.444 1.00 0.00 H new ATOM 0 HB3 LEU A 71 8.253 6.994 -4.140 1.00 0.00 H new ATOM 0 HG LEU A 71 7.476 9.546 -4.396 1.00 0.00 H new ATOM 0 HD11 LEU A 71 8.737 10.965 -2.826 1.00 0.00 H new ATOM 0 HD12 LEU A 71 7.490 10.005 -1.994 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.199 9.518 -1.897 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.835 10.095 -4.856 1.00 0.00 H new ATOM 0 HD22 LEU A 71 10.340 8.614 -4.008 1.00 0.00 H new ATOM 0 HD23 LEU A 71 9.389 8.500 -5.508 1.00 0.00 H new ATOM 981 N PRO A 72 4.511 8.648 -4.391 1.00 0.00 N ATOM 982 CA PRO A 72 3.736 9.208 -5.502 1.00 0.00 C ATOM 983 C PRO A 72 4.457 10.363 -6.187 1.00 0.00 C ATOM 984 O PRO A 72 5.420 10.914 -5.651 1.00 0.00 O ATOM 985 CB PRO A 72 2.454 9.702 -4.827 1.00 0.00 C ATOM 986 CG PRO A 72 2.847 9.964 -3.414 1.00 0.00 C ATOM 987 CD PRO A 72 3.905 8.948 -3.083 1.00 0.00 C ATOM 0 HA PRO A 72 3.563 8.474 -6.289 1.00 0.00 H new ATOM 0 HB2 PRO A 72 2.077 10.605 -5.307 1.00 0.00 H new ATOM 0 HB3 PRO A 72 1.662 8.955 -4.886 1.00 0.00 H new ATOM 0 HG2 PRO A 72 3.230 10.978 -3.297 1.00 0.00 H new ATOM 0 HG3 PRO A 72 1.991 9.867 -2.746 1.00 0.00 H new ATOM 0 HD2 PRO A 72 4.639 9.346 -2.382 1.00 0.00 H new ATOM 0 HD3 PRO A 72 3.477 8.057 -2.625 1.00 0.00 H new ATOM 995 N THR A 73 3.986 10.727 -7.376 1.00 0.00 N ATOM 996 CA THR A 73 4.586 11.817 -8.135 1.00 0.00 C ATOM 997 C THR A 73 3.611 12.977 -8.296 1.00 0.00 C ATOM 998 O THR A 73 4.019 14.119 -8.505 1.00 0.00 O ATOM 999 CB THR A 73 5.042 11.347 -9.529 1.00 0.00 C ATOM 1000 OG1 THR A 73 5.814 10.147 -9.413 1.00 0.00 O ATOM 1001 CG2 THR A 73 5.867 12.422 -10.220 1.00 0.00 C ATOM 0 H THR A 73 3.190 10.282 -7.834 1.00 0.00 H new ATOM 0 HA THR A 73 5.456 12.153 -7.571 1.00 0.00 H new ATOM 0 HB THR A 73 4.154 11.151 -10.130 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.099 9.854 -10.304 1.00 0.00 H new ATOM 0 HG21 THR A 73 6.178 12.067 -11.203 1.00 0.00 H new ATOM 0 HG22 THR A 73 5.267 13.325 -10.333 1.00 0.00 H new ATOM 0 HG23 THR A 73 6.749 12.646 -9.620 1.00 0.00 H new ATOM 1009 N ALA A 74 2.320 12.677 -8.197 1.00 0.00 N ATOM 1010 CA ALA A 74 1.286 13.696 -8.330 1.00 0.00 C ATOM 1011 C ALA A 74 0.180 13.493 -7.300 1.00 0.00 C ATOM 1012 O ALA A 74 -0.121 12.372 -6.890 1.00 0.00 O ATOM 1013 CB ALA A 74 0.708 13.683 -9.737 1.00 0.00 C ATOM 0 H ALA A 74 1.965 11.736 -8.025 1.00 0.00 H new ATOM 0 HA ALA A 74 1.744 14.668 -8.147 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -0.063 14.449 -9.821 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.500 13.885 -10.458 1.00 0.00 H new ATOM 0 HB3 ALA A 74 0.272 12.705 -9.942 1.00 0.00 H new ATOM 1019 N PRO A 75 -0.441 14.602 -6.870 1.00 0.00 N ATOM 1020 CA PRO A 75 -1.524 14.570 -5.882 1.00 0.00 C ATOM 1021 C PRO A 75 -2.801 13.954 -6.442 1.00 0.00 C ATOM 1022 O PRO A 75 -3.179 14.214 -7.583 1.00 0.00 O ATOM 1023 CB PRO A 75 -1.744 16.048 -5.551 1.00 0.00 C ATOM 1024 CG PRO A 75 -1.270 16.782 -6.758 1.00 0.00 C ATOM 1025 CD PRO A 75 -0.134 15.971 -7.316 1.00 0.00 C ATOM 0 HA PRO A 75 -1.269 13.958 -5.017 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -2.795 16.256 -5.349 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.184 16.342 -4.663 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -2.071 16.887 -7.490 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -0.941 17.788 -6.499 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -0.088 16.039 -8.403 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.828 16.312 -6.934 1.00 0.00 H new ATOM 1033 N GLY A 76 -3.463 13.135 -5.630 1.00 0.00 N ATOM 1034 CA GLY A 76 -4.692 12.495 -6.062 1.00 0.00 C ATOM 1035 C GLY A 76 -4.997 11.236 -5.276 1.00 0.00 C ATOM 1036 O GLY A 76 -4.373 10.971 -4.248 1.00 0.00 O ATOM 0 H GLY A 76 -3.170 12.903 -4.681 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -5.520 13.196 -5.955 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -4.617 12.249 -7.121 1.00 0.00 H new ATOM 1040 N ASP A 77 -5.959 10.457 -5.759 1.00 0.00 N ATOM 1041 CA ASP A 77 -6.346 9.219 -5.094 1.00 0.00 C ATOM 1042 C ASP A 77 -5.632 8.022 -5.715 1.00 0.00 C ATOM 1043 O ASP A 77 -5.830 7.709 -6.889 1.00 0.00 O ATOM 1044 CB ASP A 77 -7.861 9.023 -5.176 1.00 0.00 C ATOM 1045 CG ASP A 77 -8.628 10.182 -4.570 1.00 0.00 C ATOM 1046 OD1 ASP A 77 -8.441 10.452 -3.365 1.00 0.00 O ATOM 1047 OD2 ASP A 77 -9.415 10.819 -5.300 1.00 0.00 O ATOM 0 H ASP A 77 -6.485 10.661 -6.609 1.00 0.00 H new ATOM 0 HA ASP A 77 -6.053 9.291 -4.047 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -8.153 8.904 -6.219 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.134 8.102 -4.661 1.00 0.00 H new ATOM 1052 N TYR A 78 -4.801 7.359 -4.920 1.00 0.00 N ATOM 1053 CA TYR A 78 -4.054 6.199 -5.392 1.00 0.00 C ATOM 1054 C TYR A 78 -4.782 4.904 -5.046 1.00 0.00 C ATOM 1055 O TYR A 78 -5.405 4.791 -3.990 1.00 0.00 O ATOM 1056 CB TYR A 78 -2.651 6.186 -4.783 1.00 0.00 C ATOM 1057 CG TYR A 78 -1.697 7.159 -5.439 1.00 0.00 C ATOM 1058 CD1 TYR A 78 -1.746 8.516 -5.145 1.00 0.00 C ATOM 1059 CD2 TYR A 78 -0.746 6.720 -6.352 1.00 0.00 C ATOM 1060 CE1 TYR A 78 -0.876 9.408 -5.743 1.00 0.00 C ATOM 1061 CE2 TYR A 78 0.128 7.604 -6.953 1.00 0.00 C ATOM 1062 CZ TYR A 78 0.059 8.947 -6.646 1.00 0.00 C ATOM 1063 OH TYR A 78 0.927 9.832 -7.243 1.00 0.00 O ATOM 0 H TYR A 78 -4.627 7.605 -3.945 1.00 0.00 H new ATOM 0 HA TYR A 78 -3.971 6.270 -6.477 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -2.723 6.421 -3.721 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -2.240 5.179 -4.860 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -2.476 8.880 -4.437 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -0.689 5.669 -6.596 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -0.928 10.460 -5.505 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.862 7.246 -7.660 1.00 0.00 H new ATOM 0 HH TYR A 78 0.586 10.745 -7.140 1.00 0.00 H new ATOM 1073 N SER A 79 -4.699 3.928 -5.945 1.00 0.00 N ATOM 1074 CA SER A 79 -5.353 2.641 -5.738 1.00 0.00 C ATOM 1075 C SER A 79 -4.322 1.535 -5.529 1.00 0.00 C ATOM 1076 O SER A 79 -3.734 1.031 -6.487 1.00 0.00 O ATOM 1077 CB SER A 79 -6.247 2.301 -6.931 1.00 0.00 C ATOM 1078 OG SER A 79 -7.417 3.101 -6.937 1.00 0.00 O ATOM 0 H SER A 79 -4.186 4.004 -6.823 1.00 0.00 H new ATOM 0 HA SER A 79 -5.969 2.715 -4.842 1.00 0.00 H new ATOM 0 HB2 SER A 79 -5.694 2.453 -7.858 1.00 0.00 H new ATOM 0 HB3 SER A 79 -6.523 1.247 -6.893 1.00 0.00 H new ATOM 0 HG SER A 79 -7.971 2.865 -7.711 1.00 0.00 H new ATOM 1084 N ILE A 80 -4.108 1.164 -4.271 1.00 0.00 N ATOM 1085 CA ILE A 80 -3.150 0.118 -3.937 1.00 0.00 C ATOM 1086 C ILE A 80 -3.773 -1.266 -4.084 1.00 0.00 C ATOM 1087 O ILE A 80 -4.502 -1.726 -3.205 1.00 0.00 O ATOM 1088 CB ILE A 80 -2.619 0.280 -2.500 1.00 0.00 C ATOM 1089 CG1 ILE A 80 -1.934 1.638 -2.336 1.00 0.00 C ATOM 1090 CG2 ILE A 80 -1.658 -0.850 -2.160 1.00 0.00 C ATOM 1091 CD1 ILE A 80 -2.027 2.196 -0.933 1.00 0.00 C ATOM 0 H ILE A 80 -4.585 1.572 -3.467 1.00 0.00 H new ATOM 0 HA ILE A 80 -2.319 0.215 -4.636 1.00 0.00 H new ATOM 0 HB ILE A 80 -3.461 0.234 -1.810 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.884 1.542 -2.611 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -2.382 2.348 -3.031 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -1.291 -0.722 -1.142 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -2.176 -1.805 -2.241 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -0.817 -0.833 -2.853 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -1.520 3.160 -0.890 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -3.075 2.325 -0.661 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -1.553 1.506 -0.235 1.00 0.00 H new ATOM 1103 N ILE A 81 -3.479 -1.925 -5.200 1.00 0.00 N ATOM 1104 CA ILE A 81 -4.007 -3.258 -5.460 1.00 0.00 C ATOM 1105 C ILE A 81 -3.156 -4.329 -4.787 1.00 0.00 C ATOM 1106 O ILE A 81 -1.969 -4.470 -5.082 1.00 0.00 O ATOM 1107 CB ILE A 81 -4.079 -3.550 -6.971 1.00 0.00 C ATOM 1108 CG1 ILE A 81 -4.972 -2.522 -7.669 1.00 0.00 C ATOM 1109 CG2 ILE A 81 -4.595 -4.960 -7.214 1.00 0.00 C ATOM 1110 CD1 ILE A 81 -4.611 -2.295 -9.121 1.00 0.00 C ATOM 0 H ILE A 81 -2.878 -1.557 -5.938 1.00 0.00 H new ATOM 0 HA ILE A 81 -5.014 -3.284 -5.044 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.075 -3.475 -7.389 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -6.009 -2.853 -7.608 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.908 -1.574 -7.134 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -4.640 -5.151 -8.286 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -3.923 -5.679 -6.745 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.592 -5.062 -6.785 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -5.285 -1.555 -9.552 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.585 -1.934 -9.189 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -4.703 -3.232 -9.670 1.00 0.00 H new ATOM 1122 N VAL A 82 -3.770 -5.084 -3.882 1.00 0.00 N ATOM 1123 CA VAL A 82 -3.070 -6.144 -3.168 1.00 0.00 C ATOM 1124 C VAL A 82 -3.821 -7.467 -3.273 1.00 0.00 C ATOM 1125 O VAL A 82 -4.768 -7.716 -2.526 1.00 0.00 O ATOM 1126 CB VAL A 82 -2.881 -5.791 -1.681 1.00 0.00 C ATOM 1127 CG1 VAL A 82 -2.194 -6.930 -0.944 1.00 0.00 C ATOM 1128 CG2 VAL A 82 -2.091 -4.499 -1.537 1.00 0.00 C ATOM 0 H VAL A 82 -4.752 -4.981 -3.626 1.00 0.00 H new ATOM 0 HA VAL A 82 -2.091 -6.247 -3.636 1.00 0.00 H new ATOM 0 HB VAL A 82 -3.864 -5.642 -1.234 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -2.069 -6.662 0.105 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -2.803 -7.831 -1.018 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.217 -7.115 -1.390 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -1.967 -4.264 -0.480 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.111 -4.618 -2.000 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -2.628 -3.687 -2.028 1.00 0.00 H new ATOM 1138 N ARG A 83 -3.393 -8.312 -4.205 1.00 0.00 N ATOM 1139 CA ARG A 83 -4.026 -9.609 -4.409 1.00 0.00 C ATOM 1140 C ARG A 83 -3.229 -10.716 -3.725 1.00 0.00 C ATOM 1141 O ARG A 83 -2.008 -10.626 -3.592 1.00 0.00 O ATOM 1142 CB ARG A 83 -4.155 -9.909 -5.903 1.00 0.00 C ATOM 1143 CG ARG A 83 -4.845 -8.805 -6.688 1.00 0.00 C ATOM 1144 CD ARG A 83 -5.184 -9.253 -8.100 1.00 0.00 C ATOM 1145 NE ARG A 83 -5.209 -8.135 -9.039 1.00 0.00 N ATOM 1146 CZ ARG A 83 -4.120 -7.624 -9.603 1.00 0.00 C ATOM 1147 NH1 ARG A 83 -2.926 -8.130 -9.324 1.00 0.00 N ATOM 1148 NH2 ARG A 83 -4.223 -6.606 -10.447 1.00 0.00 N ATOM 0 H ARG A 83 -2.610 -8.122 -4.831 1.00 0.00 H new ATOM 0 HA ARG A 83 -5.021 -9.573 -3.966 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -3.161 -10.073 -6.319 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -4.711 -10.837 -6.032 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -5.757 -8.505 -6.172 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -4.199 -7.928 -6.729 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -4.452 -9.989 -8.432 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -6.155 -9.748 -8.100 1.00 0.00 H new ATOM 0 HE ARG A 83 -6.112 -7.724 -9.275 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -2.843 -8.913 -8.675 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -2.091 -7.736 -9.758 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -5.139 -6.214 -10.664 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -3.386 -6.215 -10.879 1.00 0.00 H new ATOM 1162 N PHE A 84 -3.927 -11.760 -3.291 1.00 0.00 N ATOM 1163 CA PHE A 84 -3.286 -12.884 -2.620 1.00 0.00 C ATOM 1164 C PHE A 84 -3.767 -14.211 -3.200 1.00 0.00 C ATOM 1165 O PHE A 84 -4.880 -14.656 -2.920 1.00 0.00 O ATOM 1166 CB PHE A 84 -3.571 -12.838 -1.117 1.00 0.00 C ATOM 1167 CG PHE A 84 -2.762 -13.824 -0.323 1.00 0.00 C ATOM 1168 CD1 PHE A 84 -1.399 -13.646 -0.156 1.00 0.00 C ATOM 1169 CD2 PHE A 84 -3.366 -14.928 0.256 1.00 0.00 C ATOM 1170 CE1 PHE A 84 -0.651 -14.551 0.575 1.00 0.00 C ATOM 1171 CE2 PHE A 84 -2.624 -15.836 0.988 1.00 0.00 C ATOM 1172 CZ PHE A 84 -1.265 -15.648 1.147 1.00 0.00 C ATOM 0 H PHE A 84 -4.938 -11.851 -3.392 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.211 -12.806 -2.782 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -3.368 -11.833 -0.747 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.631 -13.031 -0.950 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -0.914 -12.790 -0.602 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -4.428 -15.081 0.134 1.00 0.00 H new ATOM 0 HE1 PHE A 84 0.411 -14.400 0.698 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -3.107 -16.692 1.435 1.00 0.00 H new ATOM 0 HZ PHE A 84 -0.684 -16.357 1.717 1.00 0.00 H new ATOM 1182 N ASP A 85 -2.920 -14.838 -4.009 1.00 0.00 N ATOM 1183 CA ASP A 85 -3.257 -16.114 -4.628 1.00 0.00 C ATOM 1184 C ASP A 85 -4.485 -15.976 -5.523 1.00 0.00 C ATOM 1185 O ASP A 85 -5.414 -16.781 -5.447 1.00 0.00 O ATOM 1186 CB ASP A 85 -3.508 -17.175 -3.556 1.00 0.00 C ATOM 1187 CG ASP A 85 -3.822 -18.535 -4.149 1.00 0.00 C ATOM 1188 OD1 ASP A 85 -3.198 -18.896 -5.169 1.00 0.00 O ATOM 1189 OD2 ASP A 85 -4.692 -19.237 -3.594 1.00 0.00 O ATOM 0 H ASP A 85 -1.995 -14.483 -4.251 1.00 0.00 H new ATOM 0 HA ASP A 85 -2.413 -16.425 -5.244 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -2.630 -17.255 -2.916 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -4.336 -16.858 -2.922 1.00 0.00 H new ATOM 1194 N ASP A 86 -4.482 -14.952 -6.369 1.00 0.00 N ATOM 1195 CA ASP A 86 -5.596 -14.708 -7.278 1.00 0.00 C ATOM 1196 C ASP A 86 -6.869 -14.381 -6.503 1.00 0.00 C ATOM 1197 O ASP A 86 -7.956 -14.843 -6.850 1.00 0.00 O ATOM 1198 CB ASP A 86 -5.827 -15.927 -8.173 1.00 0.00 C ATOM 1199 CG ASP A 86 -4.593 -16.304 -8.968 1.00 0.00 C ATOM 1200 OD1 ASP A 86 -3.474 -16.147 -8.436 1.00 0.00 O ATOM 1201 OD2 ASP A 86 -4.746 -16.754 -10.123 1.00 0.00 O ATOM 0 H ASP A 86 -3.721 -14.277 -6.444 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.343 -13.851 -7.902 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -6.132 -16.773 -7.557 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -6.648 -15.720 -8.859 1.00 0.00 H new ATOM 1206 N LYS A 87 -6.726 -13.582 -5.451 1.00 0.00 N ATOM 1207 CA LYS A 87 -7.863 -13.193 -4.626 1.00 0.00 C ATOM 1208 C LYS A 87 -7.632 -11.825 -3.991 1.00 0.00 C ATOM 1209 O LYS A 87 -6.695 -11.641 -3.214 1.00 0.00 O ATOM 1210 CB LYS A 87 -8.110 -14.238 -3.535 1.00 0.00 C ATOM 1211 CG LYS A 87 -8.458 -15.613 -4.078 1.00 0.00 C ATOM 1212 CD LYS A 87 -9.831 -15.624 -4.731 1.00 0.00 C ATOM 1213 CE LYS A 87 -10.248 -17.032 -5.128 1.00 0.00 C ATOM 1214 NZ LYS A 87 -11.665 -17.083 -5.583 1.00 0.00 N ATOM 0 H LYS A 87 -5.833 -13.191 -5.150 1.00 0.00 H new ATOM 0 HA LYS A 87 -8.742 -13.133 -5.268 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -7.220 -14.317 -2.911 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -8.920 -13.895 -2.892 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.706 -15.919 -4.805 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -8.434 -16.342 -3.268 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -10.566 -15.206 -4.043 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -9.821 -14.984 -5.613 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -9.597 -17.392 -5.925 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -10.115 -17.703 -4.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -11.911 -18.059 -5.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.288 -16.763 -4.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.787 -16.462 -6.408 1.00 0.00 H new ATOM 1228 N HIS A 88 -8.492 -10.869 -4.326 1.00 0.00 N ATOM 1229 CA HIS A 88 -8.382 -9.518 -3.787 1.00 0.00 C ATOM 1230 C HIS A 88 -8.640 -9.511 -2.283 1.00 0.00 C ATOM 1231 O HIS A 88 -9.602 -10.113 -1.806 1.00 0.00 O ATOM 1232 CB HIS A 88 -9.368 -8.584 -4.489 1.00 0.00 C ATOM 1233 CG HIS A 88 -8.764 -7.826 -5.631 1.00 0.00 C ATOM 1234 ND1 HIS A 88 -8.509 -6.471 -5.584 1.00 0.00 N ATOM 1235 CD2 HIS A 88 -8.363 -8.240 -6.856 1.00 0.00 C ATOM 1236 CE1 HIS A 88 -7.978 -6.085 -6.731 1.00 0.00 C ATOM 1237 NE2 HIS A 88 -7.879 -7.140 -7.520 1.00 0.00 N ATOM 0 H HIS A 88 -9.273 -11.005 -4.968 1.00 0.00 H new ATOM 0 HA HIS A 88 -7.367 -9.163 -3.966 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -10.211 -9.169 -4.857 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -9.765 -7.875 -3.762 1.00 0.00 H new ATOM 0 HD1 HIS A 88 -8.700 -5.862 -4.788 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -8.414 -9.248 -7.240 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -7.676 -5.079 -6.981 1.00 0.00 H new ATOM 1246 N ILE A 89 -7.774 -8.828 -1.542 1.00 0.00 N ATOM 1247 CA ILE A 89 -7.908 -8.743 -0.094 1.00 0.00 C ATOM 1248 C ILE A 89 -9.061 -7.824 0.298 1.00 0.00 C ATOM 1249 O ILE A 89 -9.429 -6.904 -0.431 1.00 0.00 O ATOM 1250 CB ILE A 89 -6.613 -8.231 0.563 1.00 0.00 C ATOM 1251 CG1 ILE A 89 -6.344 -6.782 0.152 1.00 0.00 C ATOM 1252 CG2 ILE A 89 -5.439 -9.122 0.183 1.00 0.00 C ATOM 1253 CD1 ILE A 89 -5.339 -6.079 1.037 1.00 0.00 C ATOM 0 H ILE A 89 -6.972 -8.325 -1.921 1.00 0.00 H new ATOM 0 HA ILE A 89 -8.112 -9.752 0.263 1.00 0.00 H new ATOM 0 HB ILE A 89 -6.735 -8.264 1.646 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -5.984 -6.766 -0.877 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -7.282 -6.228 0.170 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -4.530 -8.748 0.655 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -5.631 -10.140 0.521 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -5.314 -9.117 -0.900 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -5.198 -5.057 0.686 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -5.706 -6.063 2.063 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -4.388 -6.610 1.000 1.00 0.00 H new ATOM 1265 N PRO A 90 -9.643 -8.077 1.480 1.00 0.00 N ATOM 1266 CA PRO A 90 -10.761 -7.282 1.997 1.00 0.00 C ATOM 1267 C PRO A 90 -10.334 -5.874 2.398 1.00 0.00 C ATOM 1268 O PRO A 90 -10.022 -5.616 3.560 1.00 0.00 O ATOM 1269 CB PRO A 90 -11.219 -8.072 3.226 1.00 0.00 C ATOM 1270 CG PRO A 90 -10.013 -8.832 3.659 1.00 0.00 C ATOM 1271 CD PRO A 90 -9.255 -9.158 2.402 1.00 0.00 C ATOM 0 HA PRO A 90 -11.541 -7.140 1.249 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -11.572 -7.408 4.015 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -12.043 -8.743 2.981 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -9.402 -8.240 4.340 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -10.295 -9.740 4.191 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -8.179 -9.173 2.574 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -9.528 -10.138 2.010 1.00 0.00 H new ATOM 1279 N GLY A 91 -10.324 -4.965 1.428 1.00 0.00 N ATOM 1280 CA GLY A 91 -9.934 -3.594 1.700 1.00 0.00 C ATOM 1281 C GLY A 91 -9.195 -2.959 0.539 1.00 0.00 C ATOM 1282 O GLY A 91 -8.952 -1.753 0.534 1.00 0.00 O ATOM 0 H GLY A 91 -10.579 -5.154 0.459 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -10.823 -3.005 1.926 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -9.301 -3.569 2.587 1.00 0.00 H new ATOM 1286 N SER A 92 -8.837 -3.774 -0.449 1.00 0.00 N ATOM 1287 CA SER A 92 -8.117 -3.286 -1.619 1.00 0.00 C ATOM 1288 C SER A 92 -8.995 -3.352 -2.864 1.00 0.00 C ATOM 1289 O SER A 92 -9.925 -4.154 -2.957 1.00 0.00 O ATOM 1290 CB SER A 92 -6.841 -4.102 -1.836 1.00 0.00 C ATOM 1291 OG SER A 92 -6.537 -4.216 -3.216 1.00 0.00 O ATOM 0 H SER A 92 -9.034 -4.775 -0.462 1.00 0.00 H new ATOM 0 HA SER A 92 -7.848 -2.245 -1.441 1.00 0.00 H new ATOM 0 HB2 SER A 92 -6.009 -3.628 -1.315 1.00 0.00 H new ATOM 0 HB3 SER A 92 -6.963 -5.095 -1.404 1.00 0.00 H new ATOM 0 HG SER A 92 -6.681 -5.140 -3.508 1.00 0.00 H new ATOM 1297 N PRO A 93 -8.695 -2.489 -3.846 1.00 0.00 N ATOM 1298 CA PRO A 93 -7.591 -1.530 -3.747 1.00 0.00 C ATOM 1299 C PRO A 93 -7.870 -0.428 -2.730 1.00 0.00 C ATOM 1300 O PRO A 93 -8.955 0.153 -2.712 1.00 0.00 O ATOM 1301 CB PRO A 93 -7.501 -0.945 -5.158 1.00 0.00 C ATOM 1302 CG PRO A 93 -8.868 -1.114 -5.726 1.00 0.00 C ATOM 1303 CD PRO A 93 -9.410 -2.383 -5.129 1.00 0.00 C ATOM 0 HA PRO A 93 -6.670 -2.003 -3.408 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -7.210 0.105 -5.133 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -6.756 -1.469 -5.757 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -9.502 -0.263 -5.477 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -8.834 -1.178 -6.814 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -10.489 -2.330 -4.984 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -9.216 -3.243 -5.769 1.00 0.00 H new ATOM 1311 N PHE A 94 -6.884 -0.145 -1.886 1.00 0.00 N ATOM 1312 CA PHE A 94 -7.024 0.888 -0.866 1.00 0.00 C ATOM 1313 C PHE A 94 -6.854 2.278 -1.472 1.00 0.00 C ATOM 1314 O PHE A 94 -5.761 2.654 -1.896 1.00 0.00 O ATOM 1315 CB PHE A 94 -5.997 0.676 0.249 1.00 0.00 C ATOM 1316 CG PHE A 94 -6.350 -0.445 1.184 1.00 0.00 C ATOM 1317 CD1 PHE A 94 -7.127 -0.209 2.307 1.00 0.00 C ATOM 1318 CD2 PHE A 94 -5.906 -1.734 0.940 1.00 0.00 C ATOM 1319 CE1 PHE A 94 -7.453 -1.238 3.170 1.00 0.00 C ATOM 1320 CE2 PHE A 94 -6.229 -2.768 1.799 1.00 0.00 C ATOM 1321 CZ PHE A 94 -7.004 -2.520 2.915 1.00 0.00 C ATOM 0 H PHE A 94 -5.979 -0.616 -1.888 1.00 0.00 H new ATOM 0 HA PHE A 94 -8.027 0.815 -0.446 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -5.024 0.473 -0.198 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -5.898 1.598 0.821 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -7.482 0.791 2.510 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -5.300 -1.934 0.068 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -8.058 -1.041 4.043 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -5.876 -3.769 1.598 1.00 0.00 H new ATOM 0 HZ PHE A 94 -7.259 -3.326 3.587 1.00 0.00 H new ATOM 1331 N THR A 95 -7.944 3.038 -1.510 1.00 0.00 N ATOM 1332 CA THR A 95 -7.918 4.385 -2.065 1.00 0.00 C ATOM 1333 C THR A 95 -7.251 5.363 -1.104 1.00 0.00 C ATOM 1334 O THR A 95 -7.864 5.812 -0.136 1.00 0.00 O ATOM 1335 CB THR A 95 -9.338 4.888 -2.388 1.00 0.00 C ATOM 1336 OG1 THR A 95 -9.976 3.995 -3.308 1.00 0.00 O ATOM 1337 CG2 THR A 95 -9.294 6.289 -2.979 1.00 0.00 C ATOM 0 H THR A 95 -8.856 2.743 -1.163 1.00 0.00 H new ATOM 0 HA THR A 95 -7.340 4.335 -2.988 1.00 0.00 H new ATOM 0 HB THR A 95 -9.909 4.921 -1.460 1.00 0.00 H new ATOM 0 HG1 THR A 95 -10.879 4.320 -3.507 1.00 0.00 H new ATOM 0 HG21 THR A 95 -10.308 6.623 -3.199 1.00 0.00 H new ATOM 0 HG22 THR A 95 -8.834 6.971 -2.264 1.00 0.00 H new ATOM 0 HG23 THR A 95 -8.708 6.278 -3.898 1.00 0.00 H new ATOM 1345 N ALA A 96 -5.992 5.689 -1.378 1.00 0.00 N ATOM 1346 CA ALA A 96 -5.243 6.616 -0.539 1.00 0.00 C ATOM 1347 C ALA A 96 -5.272 8.027 -1.119 1.00 0.00 C ATOM 1348 O ALA A 96 -5.031 8.225 -2.310 1.00 0.00 O ATOM 1349 CB ALA A 96 -3.808 6.139 -0.376 1.00 0.00 C ATOM 0 H ALA A 96 -5.469 5.325 -2.175 1.00 0.00 H new ATOM 0 HA ALA A 96 -5.718 6.645 0.442 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.260 6.841 0.253 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -3.803 5.154 0.090 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.331 6.080 -1.354 1.00 0.00 H new ATOM 1355 N LYS A 97 -5.567 9.005 -0.269 1.00 0.00 N ATOM 1356 CA LYS A 97 -5.627 10.397 -0.696 1.00 0.00 C ATOM 1357 C LYS A 97 -4.261 11.065 -0.568 1.00 0.00 C ATOM 1358 O LYS A 97 -3.693 11.133 0.523 1.00 0.00 O ATOM 1359 CB LYS A 97 -6.660 11.163 0.134 1.00 0.00 C ATOM 1360 CG LYS A 97 -7.286 12.334 -0.603 1.00 0.00 C ATOM 1361 CD LYS A 97 -7.700 13.439 0.354 1.00 0.00 C ATOM 1362 CE LYS A 97 -8.336 14.607 -0.384 1.00 0.00 C ATOM 1363 NZ LYS A 97 -9.739 14.311 -0.787 1.00 0.00 N ATOM 0 H LYS A 97 -5.768 8.859 0.720 1.00 0.00 H new ATOM 0 HA LYS A 97 -5.925 10.416 -1.744 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -7.448 10.476 0.442 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -6.183 11.530 1.043 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -6.576 12.728 -1.330 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -8.157 11.990 -1.161 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -8.404 13.043 1.086 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -6.828 13.788 0.907 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -8.320 15.491 0.253 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -7.746 14.842 -1.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -10.137 15.131 -1.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -9.752 13.483 -1.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -10.309 14.112 0.060 1.00 0.00 H new ATOM 1377 N ILE A 98 -3.740 11.556 -1.687 1.00 0.00 N ATOM 1378 CA ILE A 98 -2.443 12.220 -1.698 1.00 0.00 C ATOM 1379 C ILE A 98 -2.580 13.688 -2.087 1.00 0.00 C ATOM 1380 O ILE A 98 -3.055 14.012 -3.176 1.00 0.00 O ATOM 1381 CB ILE A 98 -1.467 11.531 -2.670 1.00 0.00 C ATOM 1382 CG1 ILE A 98 -1.266 10.067 -2.274 1.00 0.00 C ATOM 1383 CG2 ILE A 98 -0.135 12.267 -2.693 1.00 0.00 C ATOM 1384 CD1 ILE A 98 -0.668 9.891 -0.895 1.00 0.00 C ATOM 0 H ILE A 98 -4.196 11.506 -2.598 1.00 0.00 H new ATOM 0 HA ILE A 98 -2.044 12.151 -0.686 1.00 0.00 H new ATOM 0 HB ILE A 98 -1.894 11.561 -3.672 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -2.227 9.553 -2.313 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -0.617 9.587 -3.007 1.00 0.00 H new ATOM 0 HG21 ILE A 98 0.544 11.768 -3.384 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -0.293 13.295 -3.018 1.00 0.00 H new ATOM 0 HG23 ILE A 98 0.299 12.265 -1.693 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -0.554 8.828 -0.681 1.00 0.00 H new ATOM 0 HD12 ILE A 98 0.308 10.376 -0.857 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -1.326 10.342 -0.153 1.00 0.00 H new ATOM 1396 N THR A 99 -2.158 14.574 -1.191 1.00 0.00 N ATOM 1397 CA THR A 99 -2.232 16.008 -1.440 1.00 0.00 C ATOM 1398 C THR A 99 -0.905 16.545 -1.962 1.00 0.00 C ATOM 1399 O THR A 99 0.138 15.912 -1.802 1.00 0.00 O ATOM 1400 CB THR A 99 -2.620 16.781 -0.165 1.00 0.00 C ATOM 1401 OG1 THR A 99 -1.726 16.444 0.902 1.00 0.00 O ATOM 1402 CG2 THR A 99 -4.050 16.464 0.246 1.00 0.00 C ATOM 0 H THR A 99 -1.761 14.323 -0.285 1.00 0.00 H new ATOM 0 HA THR A 99 -3.003 16.158 -2.195 1.00 0.00 H new ATOM 0 HB THR A 99 -2.548 17.848 -0.377 1.00 0.00 H new ATOM 0 HG1 THR A 99 -1.978 16.940 1.709 1.00 0.00 H new ATOM 0 HG21 THR A 99 -4.301 17.021 1.148 1.00 0.00 H new ATOM 0 HG22 THR A 99 -4.731 16.747 -0.557 1.00 0.00 H new ATOM 0 HG23 THR A 99 -4.144 15.396 0.441 1.00 0.00 H new ATOM 1410 N GLY A 100 -0.950 17.718 -2.586 1.00 0.00 N ATOM 1411 CA GLY A 100 0.257 18.321 -3.122 1.00 0.00 C ATOM 1412 C GLY A 100 0.269 19.829 -2.968 1.00 0.00 C ATOM 1413 O GLY A 100 -0.730 20.495 -3.239 1.00 0.00 O ATOM 0 H GLY A 100 -1.801 18.262 -2.730 1.00 0.00 H new ATOM 0 HA2 GLY A 100 1.126 17.900 -2.615 1.00 0.00 H new ATOM 0 HA3 GLY A 100 0.349 18.066 -4.178 1.00 0.00 H new ATOM 1417 N ASP A 101 1.402 20.368 -2.531 1.00 0.00 N ATOM 1418 CA ASP A 101 1.540 21.807 -2.341 1.00 0.00 C ATOM 1419 C ASP A 101 3.007 22.222 -2.383 1.00 0.00 C ATOM 1420 O ASP A 101 3.901 21.398 -2.191 1.00 0.00 O ATOM 1421 CB ASP A 101 0.915 22.230 -1.010 1.00 0.00 C ATOM 1422 CG ASP A 101 0.404 23.657 -1.038 1.00 0.00 C ATOM 1423 OD1 ASP A 101 -0.580 23.920 -1.761 1.00 0.00 O ATOM 1424 OD2 ASP A 101 0.987 24.510 -0.337 1.00 0.00 O ATOM 0 H ASP A 101 2.238 19.830 -2.302 1.00 0.00 H new ATOM 0 HA ASP A 101 1.016 22.308 -3.155 1.00 0.00 H new ATOM 0 HB2 ASP A 101 0.092 21.557 -0.768 1.00 0.00 H new ATOM 0 HB3 ASP A 101 1.654 22.127 -0.216 1.00 0.00 H new ATOM 1429 N ASP A 102 3.247 23.504 -2.636 1.00 0.00 N ATOM 1430 CA ASP A 102 4.606 24.029 -2.703 1.00 0.00 C ATOM 1431 C ASP A 102 4.878 24.983 -1.544 1.00 0.00 C ATOM 1432 O ASP A 102 3.956 25.409 -0.848 1.00 0.00 O ATOM 1433 CB ASP A 102 4.833 24.747 -4.034 1.00 0.00 C ATOM 1434 CG ASP A 102 4.463 26.216 -3.970 1.00 0.00 C ATOM 1435 OD1 ASP A 102 3.267 26.519 -3.771 1.00 0.00 O ATOM 1436 OD2 ASP A 102 5.368 27.063 -4.118 1.00 0.00 O ATOM 0 H ASP A 102 2.518 24.199 -2.798 1.00 0.00 H new ATOM 0 HA ASP A 102 5.297 23.189 -2.629 1.00 0.00 H new ATOM 0 HB2 ASP A 102 5.880 24.651 -4.321 1.00 0.00 H new ATOM 0 HB3 ASP A 102 4.244 24.260 -4.811 1.00 0.00 H new ATOM 1441 N SER A 103 6.150 25.312 -1.341 1.00 0.00 N ATOM 1442 CA SER A 103 6.544 26.211 -0.263 1.00 0.00 C ATOM 1443 C SER A 103 8.010 26.612 -0.399 1.00 0.00 C ATOM 1444 O SER A 103 8.709 26.152 -1.301 1.00 0.00 O ATOM 1445 CB SER A 103 6.309 25.547 1.095 1.00 0.00 C ATOM 1446 OG SER A 103 6.417 26.488 2.149 1.00 0.00 O ATOM 0 H SER A 103 6.925 24.969 -1.909 1.00 0.00 H new ATOM 0 HA SER A 103 5.931 27.110 -0.331 1.00 0.00 H new ATOM 0 HB2 SER A 103 5.320 25.088 1.113 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.034 24.747 1.242 1.00 0.00 H new ATOM 0 HG SER A 103 6.261 26.039 3.006 1.00 0.00 H new ATOM 1452 N MET A 104 8.467 27.474 0.503 1.00 0.00 N ATOM 1453 CA MET A 104 9.850 27.938 0.485 1.00 0.00 C ATOM 1454 C MET A 104 10.767 26.938 1.182 1.00 0.00 C ATOM 1455 O MET A 104 10.422 26.391 2.230 1.00 0.00 O ATOM 1456 CB MET A 104 9.960 29.306 1.161 1.00 0.00 C ATOM 1457 CG MET A 104 11.388 29.814 1.273 1.00 0.00 C ATOM 1458 SD MET A 104 12.257 29.801 -0.307 1.00 0.00 S ATOM 1459 CE MET A 104 13.944 30.071 0.232 1.00 0.00 C ATOM 0 H MET A 104 7.900 27.865 1.255 1.00 0.00 H new ATOM 0 HA MET A 104 10.164 28.029 -0.555 1.00 0.00 H new ATOM 0 HB2 MET A 104 9.369 30.029 0.599 1.00 0.00 H new ATOM 0 HB3 MET A 104 9.525 29.245 2.159 1.00 0.00 H new ATOM 0 HG2 MET A 104 11.378 30.829 1.669 1.00 0.00 H new ATOM 0 HG3 MET A 104 11.933 29.198 1.988 1.00 0.00 H new ATOM 0 HE1 MET A 104 14.238 31.097 0.009 1.00 0.00 H new ATOM 0 HE2 MET A 104 14.015 29.899 1.306 1.00 0.00 H new ATOM 0 HE3 MET A 104 14.608 29.382 -0.290 1.00 0.00 H new ATOM 1469 N ARG A 105 11.935 26.704 0.594 1.00 0.00 N ATOM 1470 CA ARG A 105 12.901 25.769 1.158 1.00 0.00 C ATOM 1471 C ARG A 105 14.012 26.512 1.893 1.00 0.00 C ATOM 1472 O ARG A 105 14.602 27.452 1.361 1.00 0.00 O ATOM 1473 CB ARG A 105 13.501 24.895 0.055 1.00 0.00 C ATOM 1474 CG ARG A 105 14.517 23.885 0.563 1.00 0.00 C ATOM 1475 CD ARG A 105 15.875 24.529 0.795 1.00 0.00 C ATOM 1476 NE ARG A 105 16.969 23.579 0.615 1.00 0.00 N ATOM 1477 CZ ARG A 105 17.224 22.583 1.457 1.00 0.00 C ATOM 1478 NH1 ARG A 105 16.467 22.409 2.531 1.00 0.00 N ATOM 1479 NH2 ARG A 105 18.239 21.760 1.225 1.00 0.00 N ATOM 0 H ARG A 105 12.236 27.149 -0.273 1.00 0.00 H new ATOM 0 HA ARG A 105 12.378 25.133 1.872 1.00 0.00 H new ATOM 0 HB2 ARG A 105 12.697 24.364 -0.454 1.00 0.00 H new ATOM 0 HB3 ARG A 105 13.978 25.536 -0.686 1.00 0.00 H new ATOM 0 HG2 ARG A 105 14.159 23.443 1.493 1.00 0.00 H new ATOM 0 HG3 ARG A 105 14.616 23.073 -0.158 1.00 0.00 H new ATOM 0 HD2 ARG A 105 16.003 25.364 0.106 1.00 0.00 H new ATOM 0 HD3 ARG A 105 15.914 24.940 1.804 1.00 0.00 H new ATOM 0 HE ARG A 105 17.571 23.686 -0.202 1.00 0.00 H new ATOM 0 HH11 ARG A 105 15.687 23.040 2.713 1.00 0.00 H new ATOM 0 HH12 ARG A 105 16.665 21.644 3.176 1.00 0.00 H new ATOM 0 HH21 ARG A 105 18.824 21.892 0.400 1.00 0.00 H new ATOM 0 HH22 ARG A 105 18.434 20.996 1.872 1.00 0.00 H new ATOM 1493 N SER A 106 14.292 26.085 3.121 1.00 0.00 N ATOM 1494 CA SER A 106 15.329 26.712 3.931 1.00 0.00 C ATOM 1495 C SER A 106 16.578 25.838 3.988 1.00 0.00 C ATOM 1496 O SER A 106 16.511 24.663 4.348 1.00 0.00 O ATOM 1497 CB SER A 106 14.811 26.974 5.347 1.00 0.00 C ATOM 1498 OG SER A 106 14.630 25.760 6.056 1.00 0.00 O ATOM 0 H SER A 106 13.815 25.307 3.576 1.00 0.00 H new ATOM 0 HA SER A 106 15.593 27.662 3.466 1.00 0.00 H new ATOM 0 HB2 SER A 106 15.515 27.611 5.883 1.00 0.00 H new ATOM 0 HB3 SER A 106 13.866 27.515 5.298 1.00 0.00 H new ATOM 0 HG SER A 106 15.317 25.116 5.783 1.00 0.00 H new ATOM 1504 N GLY A 107 17.718 26.421 3.629 1.00 0.00 N ATOM 1505 CA GLY A 107 18.966 25.681 3.645 1.00 0.00 C ATOM 1506 C GLY A 107 20.159 26.550 3.300 1.00 0.00 C ATOM 1507 O GLY A 107 20.232 27.141 2.222 1.00 0.00 O ATOM 0 H GLY A 107 17.799 27.392 3.328 1.00 0.00 H new ATOM 0 HA2 GLY A 107 19.113 25.243 4.632 1.00 0.00 H new ATOM 0 HA3 GLY A 107 18.905 24.855 2.936 1.00 0.00 H new ATOM 1511 N PRO A 108 21.122 26.637 4.230 1.00 0.00 N ATOM 1512 CA PRO A 108 22.334 27.439 4.041 1.00 0.00 C ATOM 1513 C PRO A 108 23.266 26.843 2.992 1.00 0.00 C ATOM 1514 O PRO A 108 23.148 25.670 2.637 1.00 0.00 O ATOM 1515 CB PRO A 108 22.996 27.411 5.421 1.00 0.00 C ATOM 1516 CG PRO A 108 22.498 26.158 6.055 1.00 0.00 C ATOM 1517 CD PRO A 108 21.101 25.959 5.537 1.00 0.00 C ATOM 0 HA PRO A 108 22.107 28.443 3.682 1.00 0.00 H new ATOM 0 HB2 PRO A 108 24.083 27.408 5.339 1.00 0.00 H new ATOM 0 HB3 PRO A 108 22.723 28.288 6.009 1.00 0.00 H new ATOM 0 HG2 PRO A 108 23.134 25.311 5.798 1.00 0.00 H new ATOM 0 HG3 PRO A 108 22.503 26.242 7.142 1.00 0.00 H new ATOM 0 HD2 PRO A 108 20.856 24.902 5.437 1.00 0.00 H new ATOM 0 HD3 PRO A 108 20.359 26.396 6.205 1.00 0.00 H new ATOM 1525 N SER A 109 24.193 27.658 2.499 1.00 0.00 N ATOM 1526 CA SER A 109 25.144 27.212 1.487 1.00 0.00 C ATOM 1527 C SER A 109 26.170 26.256 2.089 1.00 0.00 C ATOM 1528 O SER A 109 27.162 26.684 2.678 1.00 0.00 O ATOM 1529 CB SER A 109 25.855 28.412 0.860 1.00 0.00 C ATOM 1530 OG SER A 109 25.039 29.034 -0.118 1.00 0.00 O ATOM 0 H SER A 109 24.306 28.631 2.784 1.00 0.00 H new ATOM 0 HA SER A 109 24.590 26.682 0.712 1.00 0.00 H new ATOM 0 HB2 SER A 109 26.112 29.133 1.636 1.00 0.00 H new ATOM 0 HB3 SER A 109 26.791 28.087 0.405 1.00 0.00 H new ATOM 0 HG SER A 109 25.515 29.799 -0.503 1.00 0.00 H new ATOM 1536 N SER A 110 25.922 24.959 1.937 1.00 0.00 N ATOM 1537 CA SER A 110 26.821 23.942 2.468 1.00 0.00 C ATOM 1538 C SER A 110 27.184 24.242 3.919 1.00 0.00 C ATOM 1539 O SER A 110 28.335 24.090 4.327 1.00 0.00 O ATOM 1540 CB SER A 110 28.091 23.859 1.619 1.00 0.00 C ATOM 1541 OG SER A 110 28.781 22.643 1.850 1.00 0.00 O ATOM 0 H SER A 110 25.106 24.588 1.450 1.00 0.00 H new ATOM 0 HA SER A 110 26.305 22.982 2.432 1.00 0.00 H new ATOM 0 HB2 SER A 110 27.832 23.939 0.563 1.00 0.00 H new ATOM 0 HB3 SER A 110 28.743 24.701 1.852 1.00 0.00 H new ATOM 0 HG SER A 110 28.937 22.533 2.811 1.00 0.00 H new ATOM 1547 N GLY A 111 26.193 24.671 4.695 1.00 0.00 N ATOM 1548 CA GLY A 111 26.427 24.987 6.092 1.00 0.00 C ATOM 1549 C GLY A 111 27.269 26.235 6.271 1.00 0.00 C ATOM 1550 O GLY A 111 28.452 26.152 6.601 1.00 0.00 O ATOM 0 H GLY A 111 25.232 24.805 4.381 1.00 0.00 H new ATOM 0 HA2 GLY A 111 25.470 25.123 6.596 1.00 0.00 H new ATOM 0 HA3 GLY A 111 26.924 24.145 6.573 1.00 0.00 H new TER 1554 GLY A 111