USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 817 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 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot -66:sc= 0.598 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 HIS : no HD1:sc= -0.179 K(o=-0.18,f=-2.9!) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.0495 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 60 SER OG : rot 180:sc= -0.0403 USER MOD Single : A 65 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 VAL N :NH3+ -178:sc= 0 (180deg=-0.00344) USER MOD Single : B 3 SER OG : rot 180:sc= 0 USER MOD Single : B 7 SER OG : rot 180:sc= 0 USER MOD Single : B 8 SER OG : rot 163:sc= 0.1 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.019 -25.745 -7.455 1.00 0.00 N ATOM 2 CA GLY A 1 -13.252 -26.252 -6.279 1.00 0.00 C ATOM 3 C GLY A 1 -11.865 -25.630 -6.167 1.00 0.00 C ATOM 4 O GLY A 1 -10.918 -26.096 -6.859 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.953 -26.201 -7.483 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.138 -24.715 -7.374 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.500 -25.966 -8.329 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -13.813 -26.044 -5.368 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.155 -27.335 -6.354 1.00 0.00 H new ATOM 10 N ALA A 2 -11.758 -24.543 -5.251 1.00 0.00 N ATOM 11 CA ALA A 2 -10.494 -23.729 -4.947 1.00 0.00 C ATOM 12 C ALA A 2 -9.896 -24.022 -3.505 1.00 0.00 C ATOM 13 O ALA A 2 -10.632 -23.953 -2.457 1.00 0.00 O ATOM 14 CB ALA A 2 -10.745 -22.192 -5.184 1.00 0.00 C ATOM 0 H ALA A 2 -12.561 -24.221 -4.711 1.00 0.00 H new ATOM 0 HA ALA A 2 -9.730 -24.057 -5.651 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -9.834 -21.636 -4.962 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -11.027 -22.025 -6.224 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -11.548 -21.849 -4.531 1.00 0.00 H new ATOM 20 N MET A 3 -8.533 -24.409 -3.502 1.00 0.00 N ATOM 21 CA MET A 3 -7.657 -24.730 -2.241 1.00 0.00 C ATOM 22 C MET A 3 -6.461 -23.654 -1.917 1.00 0.00 C ATOM 23 O MET A 3 -5.668 -23.823 -0.930 1.00 0.00 O ATOM 24 CB MET A 3 -7.226 -26.322 -2.139 1.00 0.00 C ATOM 25 CG MET A 3 -6.405 -26.976 -3.322 1.00 0.00 C ATOM 26 SD MET A 3 -6.048 -28.721 -3.043 1.00 0.00 S ATOM 27 CE MET A 3 -5.133 -29.121 -4.532 1.00 0.00 C ATOM 0 H MET A 3 -8.007 -24.509 -4.370 1.00 0.00 H new ATOM 0 HA MET A 3 -8.326 -24.570 -1.396 1.00 0.00 H new ATOM 0 HB2 MET A 3 -6.643 -26.446 -1.227 1.00 0.00 H new ATOM 0 HB3 MET A 3 -8.140 -26.902 -2.014 1.00 0.00 H new ATOM 0 HG2 MET A 3 -6.966 -26.868 -4.250 1.00 0.00 H new ATOM 0 HG3 MET A 3 -5.468 -26.434 -3.451 1.00 0.00 H new ATOM 0 HE1 MET A 3 -4.841 -30.171 -4.508 1.00 0.00 H new ATOM 0 HE2 MET A 3 -5.760 -28.938 -5.405 1.00 0.00 H new ATOM 0 HE3 MET A 3 -4.241 -28.497 -4.589 1.00 0.00 H new ATOM 37 N GLU A 4 -6.458 -22.520 -2.740 1.00 0.00 N ATOM 38 CA GLU A 4 -5.464 -21.349 -2.760 1.00 0.00 C ATOM 39 C GLU A 4 -6.123 -19.913 -2.476 1.00 0.00 C ATOM 40 O GLU A 4 -7.365 -19.733 -2.659 1.00 0.00 O ATOM 41 CB GLU A 4 -4.449 -21.381 -4.053 1.00 0.00 C ATOM 42 CG GLU A 4 -5.054 -21.476 -5.513 1.00 0.00 C ATOM 43 CD GLU A 4 -4.010 -21.513 -6.651 1.00 0.00 C ATOM 44 OE1 GLU A 4 -3.632 -20.423 -7.160 1.00 0.00 O ATOM 45 OE2 GLU A 4 -3.594 -22.633 -7.054 1.00 0.00 O ATOM 0 H GLU A 4 -7.187 -22.393 -3.443 1.00 0.00 H new ATOM 0 HA GLU A 4 -4.824 -21.513 -1.893 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -3.837 -20.480 -4.011 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -3.778 -22.230 -3.921 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -5.671 -22.372 -5.577 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.714 -20.623 -5.673 1.00 0.00 H new ATOM 52 N MET A 5 -5.221 -18.892 -2.039 1.00 0.00 N ATOM 53 CA MET A 5 -5.557 -17.409 -1.727 1.00 0.00 C ATOM 54 C MET A 5 -5.858 -16.486 -3.049 1.00 0.00 C ATOM 55 O MET A 5 -5.463 -16.875 -4.190 1.00 0.00 O ATOM 56 CB MET A 5 -4.529 -16.754 -0.621 1.00 0.00 C ATOM 57 CG MET A 5 -2.998 -16.644 -0.949 1.00 0.00 C ATOM 58 SD MET A 5 -2.030 -16.024 0.443 1.00 0.00 S ATOM 59 CE MET A 5 -0.380 -16.042 -0.252 1.00 0.00 C ATOM 0 H MET A 5 -4.231 -19.092 -1.896 1.00 0.00 H new ATOM 0 HA MET A 5 -6.528 -17.417 -1.232 1.00 0.00 H new ATOM 0 HB2 MET A 5 -4.887 -15.749 -0.399 1.00 0.00 H new ATOM 0 HB3 MET A 5 -4.624 -17.336 0.296 1.00 0.00 H new ATOM 0 HG2 MET A 5 -2.622 -17.625 -1.240 1.00 0.00 H new ATOM 0 HG3 MET A 5 -2.861 -15.983 -1.805 1.00 0.00 H new ATOM 0 HE1 MET A 5 0.332 -15.684 0.492 1.00 0.00 H new ATOM 0 HE2 MET A 5 -0.119 -17.059 -0.544 1.00 0.00 H new ATOM 0 HE3 MET A 5 -0.347 -15.394 -1.127 1.00 0.00 H new ATOM 69 N GLU A 6 -6.530 -15.259 -2.814 1.00 0.00 N ATOM 70 CA GLU A 6 -7.092 -14.312 -3.899 1.00 0.00 C ATOM 71 C GLU A 6 -6.473 -12.868 -3.878 1.00 0.00 C ATOM 72 O GLU A 6 -6.505 -12.175 -2.834 1.00 0.00 O ATOM 73 CB GLU A 6 -8.735 -14.344 -4.083 1.00 0.00 C ATOM 74 CG GLU A 6 -9.687 -14.068 -2.825 1.00 0.00 C ATOM 75 CD GLU A 6 -11.192 -14.030 -3.173 1.00 0.00 C ATOM 76 OE1 GLU A 6 -11.844 -15.108 -3.174 1.00 0.00 O ATOM 77 OE2 GLU A 6 -11.723 -12.915 -3.424 1.00 0.00 O ATOM 0 H GLU A 6 -6.692 -14.908 -1.870 1.00 0.00 H new ATOM 0 HA GLU A 6 -6.729 -14.753 -4.827 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -8.990 -13.612 -4.849 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -8.998 -15.325 -4.479 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -9.517 -14.842 -2.077 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -9.405 -13.118 -2.371 1.00 0.00 H new ATOM 84 N TYR A 7 -5.899 -12.464 -5.095 1.00 0.00 N ATOM 85 CA TYR A 7 -5.190 -11.124 -5.378 1.00 0.00 C ATOM 86 C TYR A 7 -6.089 -10.127 -6.203 1.00 0.00 C ATOM 87 O TYR A 7 -6.856 -10.562 -7.139 1.00 0.00 O ATOM 88 CB TYR A 7 -3.781 -11.367 -6.127 1.00 0.00 C ATOM 89 CG TYR A 7 -2.651 -12.211 -5.400 1.00 0.00 C ATOM 90 CD1 TYR A 7 -2.657 -13.627 -5.378 1.00 0.00 C ATOM 91 CD2 TYR A 7 -1.591 -11.571 -4.789 1.00 0.00 C ATOM 92 CE1 TYR A 7 -1.650 -14.343 -4.774 1.00 0.00 C ATOM 93 CE2 TYR A 7 -0.562 -12.291 -4.174 1.00 0.00 C ATOM 94 CZ TYR A 7 -0.598 -13.675 -4.176 1.00 0.00 C ATOM 95 OH TYR A 7 0.413 -14.388 -3.569 1.00 0.00 O ATOM 0 H TYR A 7 -5.917 -13.068 -5.917 1.00 0.00 H new ATOM 0 HA TYR A 7 -5.001 -10.659 -4.411 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -3.995 -11.856 -7.077 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -3.361 -10.389 -6.360 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -3.472 -14.158 -5.847 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -1.556 -10.492 -4.786 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -1.681 -15.423 -4.767 1.00 0.00 H new ATOM 0 HE2 TYR A 7 0.257 -11.770 -3.700 1.00 0.00 H new ATOM 0 HH TYR A 7 1.075 -13.767 -3.199 1.00 0.00 H new ATOM 105 N GLU A 8 -5.979 -8.756 -5.818 1.00 0.00 N ATOM 106 CA GLU A 8 -6.831 -7.610 -6.412 1.00 0.00 C ATOM 107 C GLU A 8 -5.922 -6.400 -6.927 1.00 0.00 C ATOM 108 O GLU A 8 -4.999 -5.926 -6.198 1.00 0.00 O ATOM 109 CB GLU A 8 -8.006 -7.140 -5.337 1.00 0.00 C ATOM 110 CG GLU A 8 -9.297 -6.313 -5.852 1.00 0.00 C ATOM 111 CD GLU A 8 -10.350 -7.109 -6.692 1.00 0.00 C ATOM 112 OE1 GLU A 8 -11.296 -7.674 -6.088 1.00 0.00 O ATOM 113 OE2 GLU A 8 -10.222 -7.139 -7.942 1.00 0.00 O ATOM 0 H GLU A 8 -5.317 -8.437 -5.111 1.00 0.00 H new ATOM 0 HA GLU A 8 -7.345 -7.983 -7.298 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -8.374 -8.041 -4.847 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -7.520 -6.536 -4.571 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -9.802 -5.894 -4.982 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -8.946 -5.474 -6.452 1.00 0.00 H new ATOM 120 N GLU A 9 -6.227 -5.947 -8.244 1.00 0.00 N ATOM 121 CA GLU A 9 -5.609 -4.738 -8.953 1.00 0.00 C ATOM 122 C GLU A 9 -6.593 -3.470 -8.992 1.00 0.00 C ATOM 123 O GLU A 9 -7.674 -3.520 -9.678 1.00 0.00 O ATOM 124 CB GLU A 9 -4.906 -5.096 -10.391 1.00 0.00 C ATOM 125 CG GLU A 9 -5.762 -5.799 -11.563 1.00 0.00 C ATOM 126 CD GLU A 9 -4.967 -6.073 -12.857 1.00 0.00 C ATOM 127 OE1 GLU A 9 -4.945 -5.187 -13.753 1.00 0.00 O ATOM 128 OE2 GLU A 9 -4.391 -7.186 -12.985 1.00 0.00 O ATOM 0 H GLU A 9 -6.913 -6.426 -8.827 1.00 0.00 H new ATOM 0 HA GLU A 9 -4.771 -4.428 -8.328 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -4.508 -4.166 -10.796 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -4.054 -5.743 -10.181 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -6.160 -6.742 -11.189 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -6.616 -5.165 -11.803 1.00 0.00 H new ATOM 135 N ILE A 10 -6.207 -2.365 -8.188 1.00 0.00 N ATOM 136 CA ILE A 10 -7.033 -1.047 -8.033 1.00 0.00 C ATOM 137 C ILE A 10 -6.245 0.221 -8.747 1.00 0.00 C ATOM 138 O ILE A 10 -4.984 0.269 -8.750 1.00 0.00 O ATOM 139 CB ILE A 10 -7.465 -0.787 -6.386 1.00 0.00 C ATOM 140 CG1 ILE A 10 -8.296 -2.032 -5.744 1.00 0.00 C ATOM 141 CG2 ILE A 10 -8.257 0.588 -6.089 1.00 0.00 C ATOM 142 CD1 ILE A 10 -7.989 -2.355 -4.238 1.00 0.00 C ATOM 0 H ILE A 10 -5.343 -2.360 -7.645 1.00 0.00 H new ATOM 0 HA ILE A 10 -7.979 -1.140 -8.567 1.00 0.00 H new ATOM 0 HB ILE A 10 -6.494 -0.705 -5.897 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -9.361 -1.822 -5.841 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -8.092 -2.924 -6.336 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -8.482 0.656 -5.025 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -7.638 1.435 -6.383 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -9.186 0.603 -6.658 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -8.597 -3.200 -3.916 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -6.934 -2.604 -4.127 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -8.223 -1.485 -3.624 1.00 0.00 H new ATOM 154 N THR A 11 -7.094 1.204 -9.345 1.00 0.00 N ATOM 155 CA THR A 11 -6.664 2.564 -9.955 1.00 0.00 C ATOM 156 C THR A 11 -7.311 3.820 -9.244 1.00 0.00 C ATOM 157 O THR A 11 -8.571 3.896 -9.063 1.00 0.00 O ATOM 158 CB THR A 11 -6.812 2.712 -11.564 1.00 0.00 C ATOM 159 OG1 THR A 11 -7.820 1.860 -12.143 1.00 0.00 O ATOM 160 CG2 THR A 11 -5.471 2.602 -12.301 1.00 0.00 C ATOM 0 H THR A 11 -8.102 1.061 -9.411 1.00 0.00 H new ATOM 0 HA THR A 11 -5.594 2.552 -9.750 1.00 0.00 H new ATOM 0 HB THR A 11 -7.171 3.730 -11.712 1.00 0.00 H new ATOM 0 HG1 THR A 11 -7.853 2.004 -13.112 1.00 0.00 H new ATOM 0 HG21 THR A 11 -5.635 2.709 -13.373 1.00 0.00 H new ATOM 0 HG22 THR A 11 -4.801 3.389 -11.956 1.00 0.00 H new ATOM 0 HG23 THR A 11 -5.023 1.629 -12.098 1.00 0.00 H new ATOM 168 N LEU A 12 -6.365 4.783 -8.814 1.00 0.00 N ATOM 169 CA LEU A 12 -6.650 6.162 -8.193 1.00 0.00 C ATOM 170 C LEU A 12 -5.910 7.362 -8.951 1.00 0.00 C ATOM 171 O LEU A 12 -4.997 7.117 -9.779 1.00 0.00 O ATOM 172 CB LEU A 12 -6.302 6.184 -6.567 1.00 0.00 C ATOM 173 CG LEU A 12 -7.356 5.758 -5.401 1.00 0.00 C ATOM 174 CD1 LEU A 12 -8.686 6.550 -5.356 1.00 0.00 C ATOM 175 CD2 LEU A 12 -7.588 4.254 -5.259 1.00 0.00 C ATOM 0 H LEU A 12 -5.364 4.607 -8.896 1.00 0.00 H new ATOM 0 HA LEU A 12 -7.720 6.328 -8.319 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -5.428 5.546 -6.435 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -5.990 7.203 -6.337 1.00 0.00 H new ATOM 0 HG LEU A 12 -6.812 6.074 -4.511 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -9.304 6.177 -4.540 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -8.475 7.607 -5.197 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -9.217 6.424 -6.300 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -8.304 4.070 -4.458 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -7.980 3.856 -6.195 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -6.645 3.761 -5.023 1.00 0.00 H new ATOM 187 N GLU A 13 -6.384 8.690 -8.655 1.00 0.00 N ATOM 188 CA GLU A 13 -5.779 10.020 -9.159 1.00 0.00 C ATOM 189 C GLU A 13 -4.786 10.652 -8.052 1.00 0.00 C ATOM 190 O GLU A 13 -5.099 10.631 -6.819 1.00 0.00 O ATOM 191 CB GLU A 13 -6.915 11.100 -9.602 1.00 0.00 C ATOM 192 CG GLU A 13 -7.948 10.769 -10.774 1.00 0.00 C ATOM 193 CD GLU A 13 -9.154 9.836 -10.416 1.00 0.00 C ATOM 194 OE1 GLU A 13 -10.217 10.363 -9.995 1.00 0.00 O ATOM 195 OE2 GLU A 13 -9.027 8.596 -10.582 1.00 0.00 O ATOM 0 H GLU A 13 -7.197 8.842 -8.058 1.00 0.00 H new ATOM 0 HA GLU A 13 -5.204 9.785 -10.055 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -7.503 11.329 -8.713 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -6.394 12.015 -9.884 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -8.348 11.711 -11.149 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -7.395 10.309 -11.593 1.00 0.00 H new ATOM 202 N ARG A 14 -3.583 11.232 -8.558 1.00 0.00 N ATOM 203 CA ARG A 14 -2.364 11.741 -7.766 1.00 0.00 C ATOM 204 C ARG A 14 -2.521 13.224 -7.136 1.00 0.00 C ATOM 205 O ARG A 14 -2.679 14.232 -7.892 1.00 0.00 O ATOM 206 CB ARG A 14 -1.055 11.539 -8.760 1.00 0.00 C ATOM 207 CG ARG A 14 0.450 11.911 -8.325 1.00 0.00 C ATOM 208 CD ARG A 14 0.988 13.288 -8.873 1.00 0.00 C ATOM 209 NE ARG A 14 0.480 14.537 -8.136 1.00 0.00 N ATOM 210 CZ ARG A 14 0.836 15.899 -8.307 1.00 0.00 C ATOM 211 NH1 ARG A 14 1.766 16.348 -9.210 1.00 0.00 N ATOM 212 NH2 ARG A 14 0.233 16.802 -7.542 1.00 0.00 N ATOM 0 H ARG A 14 -3.449 11.354 -9.562 1.00 0.00 H new ATOM 0 HA ARG A 14 -2.241 11.158 -6.853 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -1.043 10.486 -9.043 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -1.264 12.110 -9.665 1.00 0.00 H new ATOM 0 HG2 ARG A 14 0.503 11.926 -7.236 1.00 0.00 H new ATOM 0 HG3 ARG A 14 1.116 11.118 -8.665 1.00 0.00 H new ATOM 0 HD2 ARG A 14 2.077 13.277 -8.826 1.00 0.00 H new ATOM 0 HD3 ARG A 14 0.715 13.372 -9.925 1.00 0.00 H new ATOM 0 HE ARG A 14 -0.219 14.360 -7.415 1.00 0.00 H new ATOM 0 HH11 ARG A 14 2.252 15.685 -9.814 1.00 0.00 H new ATOM 0 HH12 ARG A 14 1.971 17.345 -9.278 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -0.463 16.507 -6.857 1.00 0.00 H new ATOM 0 HH22 ARG A 14 0.466 17.790 -7.639 1.00 0.00 H new ATOM 226 N GLY A 15 -2.562 13.260 -5.702 1.00 0.00 N ATOM 227 CA GLY A 15 -2.306 14.512 -4.812 1.00 0.00 C ATOM 228 C GLY A 15 -3.388 15.619 -4.748 1.00 0.00 C ATOM 229 O GLY A 15 -4.060 15.773 -3.701 1.00 0.00 O ATOM 0 H GLY A 15 -2.771 12.428 -5.150 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -2.131 14.163 -3.794 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -1.380 14.975 -5.153 1.00 0.00 H new ATOM 233 N ASN A 16 -3.526 16.400 -5.932 1.00 0.00 N ATOM 234 CA ASN A 16 -4.515 17.587 -6.209 1.00 0.00 C ATOM 235 C ASN A 16 -6.107 17.244 -6.140 1.00 0.00 C ATOM 236 O ASN A 16 -6.948 18.178 -5.929 1.00 0.00 O ATOM 237 CB ASN A 16 -4.082 18.452 -7.531 1.00 0.00 C ATOM 238 CG ASN A 16 -3.951 17.696 -8.915 1.00 0.00 C ATOM 239 OD1 ASN A 16 -2.882 17.182 -9.256 1.00 0.00 O ATOM 240 ND2 ASN A 16 -5.037 17.667 -9.693 1.00 0.00 N ATOM 0 H ASN A 16 -2.936 16.216 -6.743 1.00 0.00 H new ATOM 0 HA ASN A 16 -4.394 18.234 -5.341 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -4.811 19.252 -7.658 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -3.123 18.925 -7.319 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -5.000 17.209 -10.603 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -5.903 18.103 -9.376 1.00 0.00 H new ATOM 247 N SER A 17 -6.453 15.856 -6.283 1.00 0.00 N ATOM 248 CA SER A 17 -7.850 15.252 -6.150 1.00 0.00 C ATOM 249 C SER A 17 -8.220 14.789 -4.647 1.00 0.00 C ATOM 250 O SER A 17 -9.462 14.726 -4.321 1.00 0.00 O ATOM 251 CB SER A 17 -8.051 14.071 -7.176 1.00 0.00 C ATOM 252 OG SER A 17 -8.012 14.524 -8.530 1.00 0.00 O ATOM 0 H SER A 17 -5.748 15.150 -6.494 1.00 0.00 H new ATOM 0 HA SER A 17 -8.549 16.053 -6.391 1.00 0.00 H new ATOM 0 HB2 SER A 17 -7.275 13.322 -7.022 1.00 0.00 H new ATOM 0 HB3 SER A 17 -9.007 13.584 -6.985 1.00 0.00 H new ATOM 0 HG SER A 17 -8.139 13.762 -9.134 1.00 0.00 H new ATOM 258 N GLY A 18 -7.115 14.499 -3.709 1.00 0.00 N ATOM 259 CA GLY A 18 -7.338 14.278 -2.243 1.00 0.00 C ATOM 260 C GLY A 18 -7.244 12.837 -1.746 1.00 0.00 C ATOM 261 O GLY A 18 -8.272 12.311 -1.248 1.00 0.00 O ATOM 0 H GLY A 18 -6.138 14.431 -3.994 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -6.610 14.876 -1.694 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.325 14.663 -1.987 1.00 0.00 H new ATOM 265 N LEU A 19 -5.974 12.176 -1.891 1.00 0.00 N ATOM 266 CA LEU A 19 -5.630 10.733 -1.424 1.00 0.00 C ATOM 267 C LEU A 19 -5.707 10.524 0.165 1.00 0.00 C ATOM 268 O LEU A 19 -4.927 11.167 0.954 1.00 0.00 O ATOM 269 CB LEU A 19 -4.241 10.190 -2.074 1.00 0.00 C ATOM 270 CG LEU A 19 -4.185 9.776 -3.595 1.00 0.00 C ATOM 271 CD1 LEU A 19 -2.766 9.888 -4.079 1.00 0.00 C ATOM 272 CD2 LEU A 19 -4.608 8.321 -3.808 1.00 0.00 C ATOM 0 H LEU A 19 -5.179 12.638 -2.333 1.00 0.00 H new ATOM 0 HA LEU A 19 -6.426 10.102 -1.819 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.489 10.964 -1.922 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.929 9.323 -1.491 1.00 0.00 H new ATOM 0 HG LEU A 19 -4.864 10.436 -4.136 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.717 9.604 -5.130 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.423 10.916 -3.965 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.129 9.225 -3.494 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.555 8.078 -4.869 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.941 7.663 -3.251 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -5.630 8.184 -3.455 1.00 0.00 H new ATOM 284 N GLY A 20 -6.719 9.619 0.571 1.00 0.00 N ATOM 285 CA GLY A 20 -7.181 9.384 1.964 1.00 0.00 C ATOM 286 C GLY A 20 -6.821 8.023 2.568 1.00 0.00 C ATOM 287 O GLY A 20 -7.728 7.217 2.887 1.00 0.00 O ATOM 0 H GLY A 20 -7.220 9.041 -0.104 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -6.764 10.164 2.601 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -8.265 9.496 1.991 1.00 0.00 H new ATOM 291 N PHE A 21 -5.427 7.790 2.706 1.00 0.00 N ATOM 292 CA PHE A 21 -4.705 6.664 3.444 1.00 0.00 C ATOM 293 C PHE A 21 -3.191 7.147 3.782 1.00 0.00 C ATOM 294 O PHE A 21 -2.756 8.241 3.278 1.00 0.00 O ATOM 295 CB PHE A 21 -4.764 5.195 2.629 1.00 0.00 C ATOM 296 CG PHE A 21 -3.965 4.956 1.256 1.00 0.00 C ATOM 297 CD1 PHE A 21 -4.414 5.477 0.026 1.00 0.00 C ATOM 298 CD2 PHE A 21 -2.820 4.156 1.244 1.00 0.00 C ATOM 299 CE1 PHE A 21 -3.739 5.208 -1.162 1.00 0.00 C ATOM 300 CE2 PHE A 21 -2.142 3.893 0.054 1.00 0.00 C ATOM 301 CZ PHE A 21 -2.604 4.418 -1.143 1.00 0.00 C ATOM 0 H PHE A 21 -4.758 8.428 2.275 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.227 6.466 4.380 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.423 4.432 3.329 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.815 4.991 2.422 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -5.298 6.097 0.004 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -2.455 3.735 2.169 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -4.101 5.615 -2.095 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -1.254 3.278 0.065 1.00 0.00 H new ATOM 0 HZ PHE A 21 -2.077 4.210 -2.062 1.00 0.00 H new ATOM 311 N SER A 22 -2.418 6.367 4.710 1.00 0.00 N ATOM 312 CA SER A 22 -0.912 6.512 4.912 1.00 0.00 C ATOM 313 C SER A 22 -0.214 5.099 4.933 1.00 0.00 C ATOM 314 O SER A 22 -0.818 4.089 5.449 1.00 0.00 O ATOM 315 CB SER A 22 -0.528 7.382 6.169 1.00 0.00 C ATOM 316 OG SER A 22 -0.998 8.720 6.086 1.00 0.00 O ATOM 0 H SER A 22 -2.835 5.652 5.306 1.00 0.00 H new ATOM 0 HA SER A 22 -0.533 7.068 4.054 1.00 0.00 H new ATOM 0 HB2 SER A 22 -0.936 6.915 7.065 1.00 0.00 H new ATOM 0 HB3 SER A 22 0.556 7.390 6.280 1.00 0.00 H new ATOM 0 HG SER A 22 -0.536 9.185 5.358 1.00 0.00 H new ATOM 322 N ILE A 23 1.100 5.035 4.372 1.00 0.00 N ATOM 323 CA ILE A 23 1.943 3.731 4.191 1.00 0.00 C ATOM 324 C ILE A 23 3.317 3.598 4.918 1.00 0.00 C ATOM 325 O ILE A 23 4.228 4.451 4.769 1.00 0.00 O ATOM 326 CB ILE A 23 1.944 3.037 2.713 1.00 0.00 C ATOM 327 CG1 ILE A 23 1.984 3.990 1.385 1.00 0.00 C ATOM 328 CG2 ILE A 23 0.733 2.159 2.682 1.00 0.00 C ATOM 329 CD1 ILE A 23 3.247 4.870 1.067 1.00 0.00 C ATOM 0 H ILE A 23 1.589 5.867 4.042 1.00 0.00 H new ATOM 0 HA ILE A 23 1.291 3.113 4.808 1.00 0.00 H new ATOM 0 HB ILE A 23 2.902 2.524 2.625 1.00 0.00 H new ATOM 0 HG12 ILE A 23 1.817 3.345 0.522 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.130 4.665 1.449 1.00 0.00 H new ATOM 0 HG21 ILE A 23 0.670 1.660 1.715 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.805 1.412 3.472 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.160 2.765 2.836 1.00 0.00 H new ATOM 0 HD11 ILE A 23 3.079 5.429 0.146 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.421 5.566 1.887 1.00 0.00 H new ATOM 0 HD13 ILE A 23 4.118 4.226 0.946 1.00 0.00 H new ATOM 341 N ALA A 24 3.410 2.404 5.712 1.00 0.00 N ATOM 342 CA ALA A 24 4.574 1.999 6.591 1.00 0.00 C ATOM 343 C ALA A 24 5.401 0.815 5.934 1.00 0.00 C ATOM 344 O ALA A 24 4.856 -0.308 5.695 1.00 0.00 O ATOM 345 CB ALA A 24 4.054 1.659 8.046 1.00 0.00 C ATOM 0 H ALA A 24 2.655 1.718 5.733 1.00 0.00 H new ATOM 0 HA ALA A 24 5.268 2.834 6.681 1.00 0.00 H new ATOM 0 HB1 ALA A 24 4.896 1.368 8.674 1.00 0.00 H new ATOM 0 HB2 ALA A 24 3.568 2.536 8.473 1.00 0.00 H new ATOM 0 HB3 ALA A 24 3.339 0.838 7.994 1.00 0.00 H new ATOM 351 N GLY A 25 6.728 1.129 5.648 1.00 0.00 N ATOM 352 CA GLY A 25 7.710 0.210 4.949 1.00 0.00 C ATOM 353 C GLY A 25 9.176 0.666 5.037 1.00 0.00 C ATOM 354 O GLY A 25 9.442 1.886 5.327 1.00 0.00 O ATOM 0 H GLY A 25 7.139 2.028 5.899 1.00 0.00 H new ATOM 0 HA2 GLY A 25 7.626 -0.788 5.380 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.429 0.129 3.899 1.00 0.00 H new ATOM 358 N GLY A 26 10.141 -0.330 4.744 1.00 0.00 N ATOM 359 CA GLY A 26 11.622 -0.075 4.951 1.00 0.00 C ATOM 360 C GLY A 26 12.612 -1.220 4.701 1.00 0.00 C ATOM 361 O GLY A 26 12.333 -2.400 5.046 1.00 0.00 O ATOM 0 H GLY A 26 9.916 -1.258 4.385 1.00 0.00 H new ATOM 0 HA2 GLY A 26 11.907 0.755 4.304 1.00 0.00 H new ATOM 0 HA3 GLY A 26 11.758 0.260 5.979 1.00 0.00 H new ATOM 365 N THR A 27 13.799 -0.816 4.053 1.00 0.00 N ATOM 366 CA THR A 27 15.119 -1.642 3.961 1.00 0.00 C ATOM 367 C THR A 27 16.237 -1.160 4.990 1.00 0.00 C ATOM 368 O THR A 27 16.926 -2.027 5.606 1.00 0.00 O ATOM 369 CB THR A 27 15.754 -1.845 2.490 1.00 0.00 C ATOM 370 OG1 THR A 27 15.734 -0.654 1.682 1.00 0.00 O ATOM 371 CG2 THR A 27 15.176 -3.052 1.747 1.00 0.00 C ATOM 0 H THR A 27 13.872 0.085 3.581 1.00 0.00 H new ATOM 0 HA THR A 27 14.770 -2.633 4.251 1.00 0.00 H new ATOM 0 HB THR A 27 16.806 -2.066 2.672 1.00 0.00 H new ATOM 0 HG1 THR A 27 16.133 -0.845 0.808 1.00 0.00 H new ATOM 0 HG21 THR A 27 15.644 -3.133 0.766 1.00 0.00 H new ATOM 0 HG22 THR A 27 15.372 -3.959 2.319 1.00 0.00 H new ATOM 0 HG23 THR A 27 14.100 -2.924 1.627 1.00 0.00 H new ATOM 379 N ASP A 28 16.363 0.256 5.168 1.00 0.00 N ATOM 380 CA ASP A 28 17.330 0.964 6.134 1.00 0.00 C ATOM 381 C ASP A 28 16.606 1.541 7.447 1.00 0.00 C ATOM 382 O ASP A 28 17.221 1.508 8.557 1.00 0.00 O ATOM 383 CB ASP A 28 18.226 2.093 5.411 1.00 0.00 C ATOM 384 CG ASP A 28 19.300 1.567 4.417 1.00 0.00 C ATOM 385 OD1 ASP A 28 20.448 1.310 4.856 1.00 0.00 O ATOM 386 OD2 ASP A 28 18.986 1.435 3.209 1.00 0.00 O ATOM 0 H ASP A 28 15.792 0.915 4.640 1.00 0.00 H new ATOM 0 HA ASP A 28 18.012 0.183 6.471 1.00 0.00 H new ATOM 0 HB2 ASP A 28 17.561 2.770 4.874 1.00 0.00 H new ATOM 0 HB3 ASP A 28 18.726 2.681 6.180 1.00 0.00 H new ATOM 391 N ASN A 29 15.256 2.030 7.280 1.00 0.00 N ATOM 392 CA ASN A 29 14.362 2.637 8.357 1.00 0.00 C ATOM 393 C ASN A 29 13.249 1.571 8.932 1.00 0.00 C ATOM 394 O ASN A 29 12.421 1.068 8.103 1.00 0.00 O ATOM 395 CB ASN A 29 13.680 4.029 7.905 1.00 0.00 C ATOM 396 CG ASN A 29 14.643 5.247 7.752 1.00 0.00 C ATOM 397 OD1 ASN A 29 14.893 5.981 8.715 1.00 0.00 O ATOM 398 ND2 ASN A 29 15.147 5.472 6.532 1.00 0.00 N ATOM 0 H ASN A 29 14.790 1.996 6.373 1.00 0.00 H new ATOM 0 HA ASN A 29 15.029 2.876 9.185 1.00 0.00 H new ATOM 0 HB2 ASN A 29 13.174 3.870 6.953 1.00 0.00 H new ATOM 0 HB3 ASN A 29 12.913 4.288 8.634 1.00 0.00 H new ATOM 0 HD21 ASN A 29 15.760 6.272 6.373 1.00 0.00 H new ATOM 0 HD22 ASN A 29 14.918 4.844 5.762 1.00 0.00 H new ATOM 405 N PRO A 30 13.236 1.145 10.415 1.00 0.00 N ATOM 406 CA PRO A 30 12.157 0.198 11.029 1.00 0.00 C ATOM 407 C PRO A 30 10.678 0.814 11.275 1.00 0.00 C ATOM 408 O PRO A 30 10.519 2.068 11.447 1.00 0.00 O ATOM 409 CB PRO A 30 12.787 -0.267 12.403 1.00 0.00 C ATOM 410 CG PRO A 30 14.156 0.383 12.550 1.00 0.00 C ATOM 411 CD PRO A 30 14.288 1.477 11.510 1.00 0.00 C ATOM 0 HA PRO A 30 11.954 -0.596 10.310 1.00 0.00 H new ATOM 0 HB2 PRO A 30 12.140 0.019 13.233 1.00 0.00 H new ATOM 0 HB3 PRO A 30 12.878 -1.353 12.430 1.00 0.00 H new ATOM 0 HG2 PRO A 30 14.272 0.798 13.551 1.00 0.00 H new ATOM 0 HG3 PRO A 30 14.943 -0.360 12.419 1.00 0.00 H new ATOM 0 HD2 PRO A 30 14.102 2.458 11.948 1.00 0.00 H new ATOM 0 HD3 PRO A 30 15.294 1.501 11.092 1.00 0.00 H new ATOM 419 N HIS A 31 9.625 -0.146 11.227 1.00 0.00 N ATOM 420 CA HIS A 31 8.198 0.071 11.637 1.00 0.00 C ATOM 421 C HIS A 31 7.940 -0.436 13.157 1.00 0.00 C ATOM 422 O HIS A 31 7.729 0.409 14.030 1.00 0.00 O ATOM 423 CB HIS A 31 7.146 -0.537 10.495 1.00 0.00 C ATOM 424 CG HIS A 31 5.594 -0.635 10.856 1.00 0.00 C ATOM 425 ND1 HIS A 31 4.820 0.448 11.260 1.00 0.00 N ATOM 426 CD2 HIS A 31 4.773 -1.714 10.961 1.00 0.00 C ATOM 427 CE1 HIS A 31 3.609 0.035 11.594 1.00 0.00 C ATOM 428 NE2 HIS A 31 3.555 -1.268 11.421 1.00 0.00 N ATOM 0 H HIS A 31 9.787 -1.095 10.891 1.00 0.00 H new ATOM 0 HA HIS A 31 7.988 1.140 11.665 1.00 0.00 H new ATOM 0 HB2 HIS A 31 7.239 0.078 9.600 1.00 0.00 H new ATOM 0 HB3 HIS A 31 7.488 -1.538 10.231 1.00 0.00 H new ATOM 0 HD2 HIS A 31 5.030 -2.736 10.726 1.00 0.00 H new ATOM 0 HE1 HIS A 31 2.803 0.660 11.948 1.00 0.00 H new ATOM 0 HE2 HIS A 31 2.740 -1.855 11.599 1.00 0.00 H new ATOM 437 N ILE A 32 8.102 -1.815 13.397 1.00 0.00 N ATOM 438 CA ILE A 32 7.639 -2.593 14.610 1.00 0.00 C ATOM 439 C ILE A 32 8.887 -3.258 15.485 1.00 0.00 C ATOM 440 O ILE A 32 8.649 -3.939 16.530 1.00 0.00 O ATOM 441 CB ILE A 32 6.392 -3.670 14.098 1.00 0.00 C ATOM 442 CG1 ILE A 32 5.445 -4.155 15.224 1.00 0.00 C ATOM 443 CG2 ILE A 32 6.787 -4.885 13.149 1.00 0.00 C ATOM 444 CD1 ILE A 32 4.237 -3.229 15.542 1.00 0.00 C ATOM 0 H ILE A 32 8.574 -2.415 12.721 1.00 0.00 H new ATOM 0 HA ILE A 32 7.204 -1.928 15.356 1.00 0.00 H new ATOM 0 HB ILE A 32 5.847 -2.984 13.450 1.00 0.00 H new ATOM 0 HG12 ILE A 32 5.062 -5.138 14.952 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.030 -4.282 16.135 1.00 0.00 H new ATOM 0 HG21 ILE A 32 5.897 -5.469 12.916 1.00 0.00 H new ATOM 0 HG22 ILE A 32 7.220 -4.500 12.226 1.00 0.00 H new ATOM 0 HG23 ILE A 32 7.515 -5.520 13.654 1.00 0.00 H new ATOM 0 HD11 ILE A 32 3.644 -3.667 16.345 1.00 0.00 H new ATOM 0 HD12 ILE A 32 4.601 -2.250 15.853 1.00 0.00 H new ATOM 0 HD13 ILE A 32 3.618 -3.120 14.652 1.00 0.00 H new ATOM 456 N GLY A 33 10.163 -2.946 15.006 1.00 0.00 N ATOM 457 CA GLY A 33 11.485 -3.476 15.500 1.00 0.00 C ATOM 458 C GLY A 33 12.180 -4.406 14.491 1.00 0.00 C ATOM 459 O GLY A 33 12.344 -5.615 14.762 1.00 0.00 O ATOM 0 H GLY A 33 10.287 -2.291 14.234 1.00 0.00 H new ATOM 0 HA2 GLY A 33 12.144 -2.637 15.725 1.00 0.00 H new ATOM 0 HA3 GLY A 33 11.327 -4.016 16.433 1.00 0.00 H new ATOM 463 N ASP A 34 12.598 -3.771 13.269 1.00 0.00 N ATOM 464 CA ASP A 34 13.287 -4.367 12.002 1.00 0.00 C ATOM 465 C ASP A 34 12.376 -5.330 11.115 1.00 0.00 C ATOM 466 O ASP A 34 12.429 -6.610 11.212 1.00 0.00 O ATOM 467 CB ASP A 34 14.829 -4.833 12.184 1.00 0.00 C ATOM 468 CG ASP A 34 15.851 -3.683 12.361 1.00 0.00 C ATOM 469 OD1 ASP A 34 16.105 -3.280 13.523 1.00 0.00 O ATOM 470 OD2 ASP A 34 16.402 -3.209 11.337 1.00 0.00 O ATOM 0 H ASP A 34 12.448 -2.769 13.149 1.00 0.00 H new ATOM 0 HA ASP A 34 13.393 -3.488 11.367 1.00 0.00 H new ATOM 0 HB2 ASP A 34 14.893 -5.490 13.051 1.00 0.00 H new ATOM 0 HB3 ASP A 34 15.118 -5.423 11.314 1.00 0.00 H new ATOM 475 N ASP A 35 11.434 -4.617 10.337 1.00 0.00 N ATOM 476 CA ASP A 35 10.414 -5.207 9.362 1.00 0.00 C ATOM 477 C ASP A 35 10.863 -4.930 7.771 1.00 0.00 C ATOM 478 O ASP A 35 11.026 -3.724 7.400 1.00 0.00 O ATOM 479 CB ASP A 35 8.944 -4.630 9.731 1.00 0.00 C ATOM 480 CG ASP A 35 7.714 -5.414 9.161 1.00 0.00 C ATOM 481 OD1 ASP A 35 7.240 -6.360 9.836 1.00 0.00 O ATOM 482 OD2 ASP A 35 7.241 -5.062 8.054 1.00 0.00 O ATOM 0 H ASP A 35 11.373 -3.600 10.381 1.00 0.00 H new ATOM 0 HA ASP A 35 10.380 -6.292 9.463 1.00 0.00 H new ATOM 0 HB2 ASP A 35 8.854 -4.599 10.817 1.00 0.00 H new ATOM 0 HB3 ASP A 35 8.884 -3.601 9.377 1.00 0.00 H new ATOM 487 N PRO A 36 11.117 -6.103 6.793 1.00 0.00 N ATOM 488 CA PRO A 36 11.491 -5.918 5.282 1.00 0.00 C ATOM 489 C PRO A 36 10.305 -5.485 4.225 1.00 0.00 C ATOM 490 O PRO A 36 10.615 -4.820 3.192 1.00 0.00 O ATOM 491 CB PRO A 36 12.126 -7.320 4.891 1.00 0.00 C ATOM 492 CG PRO A 36 12.280 -8.102 6.179 1.00 0.00 C ATOM 493 CD PRO A 36 11.180 -7.625 7.096 1.00 0.00 C ATOM 0 HA PRO A 36 12.147 -5.052 5.193 1.00 0.00 H new ATOM 0 HB2 PRO A 36 11.485 -7.853 4.189 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.091 -7.185 4.402 1.00 0.00 H new ATOM 0 HG2 PRO A 36 12.197 -9.173 5.996 1.00 0.00 H new ATOM 0 HG3 PRO A 36 13.260 -7.930 6.624 1.00 0.00 H new ATOM 0 HD2 PRO A 36 10.232 -8.120 6.883 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.413 -7.820 8.143 1.00 0.00 H new ATOM 501 N SER A 37 8.957 -5.852 4.567 1.00 0.00 N ATOM 502 CA SER A 37 7.685 -5.654 3.696 1.00 0.00 C ATOM 503 C SER A 37 6.900 -4.278 3.967 1.00 0.00 C ATOM 504 O SER A 37 6.955 -3.727 5.114 1.00 0.00 O ATOM 505 CB SER A 37 6.720 -6.906 3.857 1.00 0.00 C ATOM 506 OG SER A 37 7.307 -8.106 3.351 1.00 0.00 O ATOM 0 H SER A 37 8.740 -6.293 5.461 1.00 0.00 H new ATOM 0 HA SER A 37 8.030 -5.580 2.665 1.00 0.00 H new ATOM 0 HB2 SER A 37 6.473 -7.040 4.910 1.00 0.00 H new ATOM 0 HB3 SER A 37 5.784 -6.712 3.333 1.00 0.00 H new ATOM 0 HG SER A 37 6.682 -8.851 3.471 1.00 0.00 H new ATOM 512 N ILE A 38 6.159 -3.738 2.843 1.00 0.00 N ATOM 513 CA ILE A 38 5.325 -2.429 2.842 1.00 0.00 C ATOM 514 C ILE A 38 3.757 -2.812 3.125 1.00 0.00 C ATOM 515 O ILE A 38 3.072 -3.457 2.290 1.00 0.00 O ATOM 516 CB ILE A 38 5.564 -1.439 1.443 1.00 0.00 C ATOM 517 CG1 ILE A 38 7.099 -1.450 0.713 1.00 0.00 C ATOM 518 CG2 ILE A 38 5.027 0.056 1.590 1.00 0.00 C ATOM 519 CD1 ILE A 38 8.438 -1.223 1.520 1.00 0.00 C ATOM 0 H ILE A 38 6.140 -4.209 1.939 1.00 0.00 H new ATOM 0 HA ILE A 38 5.682 -1.788 3.648 1.00 0.00 H new ATOM 0 HB ILE A 38 4.925 -1.974 0.740 1.00 0.00 H new ATOM 0 HG12 ILE A 38 7.198 -2.415 0.215 1.00 0.00 H new ATOM 0 HG13 ILE A 38 7.076 -0.689 -0.068 1.00 0.00 H new ATOM 0 HG21 ILE A 38 5.218 0.604 0.667 1.00 0.00 H new ATOM 0 HG22 ILE A 38 3.955 0.040 1.787 1.00 0.00 H new ATOM 0 HG23 ILE A 38 5.540 0.547 2.417 1.00 0.00 H new ATOM 0 HD11 ILE A 38 9.287 -1.275 0.838 1.00 0.00 H new ATOM 0 HD12 ILE A 38 8.414 -0.243 1.996 1.00 0.00 H new ATOM 0 HD13 ILE A 38 8.538 -1.995 2.283 1.00 0.00 H new ATOM 531 N PHE A 39 3.293 -2.361 4.377 1.00 0.00 N ATOM 532 CA PHE A 39 1.979 -2.671 5.116 1.00 0.00 C ATOM 533 C PHE A 39 1.149 -1.332 5.447 1.00 0.00 C ATOM 534 O PHE A 39 1.763 -0.204 5.637 1.00 0.00 O ATOM 535 CB PHE A 39 2.427 -3.571 6.450 1.00 0.00 C ATOM 536 CG PHE A 39 1.482 -3.927 7.691 1.00 0.00 C ATOM 537 CD1 PHE A 39 0.321 -4.711 7.583 1.00 0.00 C ATOM 538 CD2 PHE A 39 1.862 -3.504 8.968 1.00 0.00 C ATOM 539 CE1 PHE A 39 -0.425 -5.039 8.712 1.00 0.00 C ATOM 540 CE2 PHE A 39 1.116 -3.828 10.094 1.00 0.00 C ATOM 541 CZ PHE A 39 -0.026 -4.597 9.964 1.00 0.00 C ATOM 0 H PHE A 39 3.871 -1.728 4.930 1.00 0.00 H new ATOM 0 HA PHE A 39 1.277 -3.243 4.509 1.00 0.00 H new ATOM 0 HB2 PHE A 39 2.777 -4.527 6.059 1.00 0.00 H new ATOM 0 HB3 PHE A 39 3.294 -3.063 6.873 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.003 -5.063 6.613 1.00 0.00 H new ATOM 0 HD2 PHE A 39 2.757 -2.911 9.082 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -1.317 -5.640 8.612 1.00 0.00 H new ATOM 0 HE2 PHE A 39 1.427 -3.480 11.068 1.00 0.00 H new ATOM 0 HZ PHE A 39 -0.607 -4.853 10.838 1.00 0.00 H new ATOM 551 N ILE A 40 -0.293 -1.491 5.493 1.00 0.00 N ATOM 552 CA ILE A 40 -1.303 -0.393 5.886 1.00 0.00 C ATOM 553 C ILE A 40 -1.539 -0.401 7.471 1.00 0.00 C ATOM 554 O ILE A 40 -1.625 -1.488 8.127 1.00 0.00 O ATOM 555 CB ILE A 40 -2.800 -0.468 5.080 1.00 0.00 C ATOM 556 CG1 ILE A 40 -2.847 -1.193 3.593 1.00 0.00 C ATOM 557 CG2 ILE A 40 -3.585 0.931 5.047 1.00 0.00 C ATOM 558 CD1 ILE A 40 -1.995 -0.606 2.435 1.00 0.00 C ATOM 0 H ILE A 40 -0.746 -2.374 5.259 1.00 0.00 H new ATOM 0 HA ILE A 40 -0.845 0.543 5.565 1.00 0.00 H new ATOM 0 HB ILE A 40 -3.328 -1.165 5.730 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -2.548 -2.233 3.726 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -3.886 -1.200 3.264 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -4.529 0.806 4.517 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -3.782 1.262 6.067 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -2.978 1.677 4.534 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -2.145 -1.202 1.535 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -2.300 0.423 2.244 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -0.941 -0.626 2.712 1.00 0.00 H new ATOM 570 N THR A 41 -1.668 0.876 7.999 1.00 0.00 N ATOM 571 CA THR A 41 -1.859 1.273 9.491 1.00 0.00 C ATOM 572 C THR A 41 -2.773 2.543 9.694 1.00 0.00 C ATOM 573 O THR A 41 -3.447 2.642 10.776 1.00 0.00 O ATOM 574 CB THR A 41 -0.508 1.347 10.413 1.00 0.00 C ATOM 575 OG1 THR A 41 0.597 1.926 9.719 1.00 0.00 O ATOM 576 CG2 THR A 41 -0.104 -0.022 10.984 1.00 0.00 C ATOM 0 H THR A 41 -1.644 1.697 7.394 1.00 0.00 H new ATOM 0 HA THR A 41 -2.395 0.407 9.880 1.00 0.00 H new ATOM 0 HB THR A 41 -0.768 1.999 11.247 1.00 0.00 H new ATOM 0 HG1 THR A 41 1.378 1.950 10.310 1.00 0.00 H new ATOM 0 HG21 THR A 41 0.798 0.087 11.587 1.00 0.00 H new ATOM 0 HG22 THR A 41 -0.911 -0.410 11.605 1.00 0.00 H new ATOM 0 HG23 THR A 41 0.088 -0.715 10.165 1.00 0.00 H new ATOM 584 N LYS A 42 -2.837 3.518 8.603 1.00 0.00 N ATOM 585 CA LYS A 42 -3.701 4.740 8.609 1.00 0.00 C ATOM 586 C LYS A 42 -4.705 4.780 7.392 1.00 0.00 C ATOM 587 O LYS A 42 -4.309 4.588 6.202 1.00 0.00 O ATOM 588 CB LYS A 42 -2.790 6.106 8.856 1.00 0.00 C ATOM 589 CG LYS A 42 -3.385 7.628 8.834 1.00 0.00 C ATOM 590 CD LYS A 42 -4.588 7.911 9.746 1.00 0.00 C ATOM 591 CE LYS A 42 -4.859 9.391 9.830 1.00 0.00 C ATOM 592 NZ LYS A 42 -6.018 9.705 10.712 1.00 0.00 N ATOM 0 H LYS A 42 -2.284 3.424 7.751 1.00 0.00 H new ATOM 0 HA LYS A 42 -4.372 4.697 9.467 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -2.315 5.981 9.829 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.997 6.080 8.108 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -2.582 8.312 9.109 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.671 7.867 7.810 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -5.469 7.396 9.363 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -4.395 7.515 10.743 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -3.971 9.900 10.206 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -5.050 9.780 8.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -6.165 10.734 10.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -6.872 9.242 10.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -5.827 9.358 11.674 1.00 0.00 H new ATOM 606 N ILE A 43 -6.038 4.988 7.794 1.00 0.00 N ATOM 607 CA ILE A 43 -7.232 5.223 6.915 1.00 0.00 C ATOM 608 C ILE A 43 -7.971 6.561 7.422 1.00 0.00 C ATOM 609 O ILE A 43 -8.355 6.667 8.632 1.00 0.00 O ATOM 610 CB ILE A 43 -8.270 3.822 6.787 1.00 0.00 C ATOM 611 CG1 ILE A 43 -7.563 2.467 6.137 1.00 0.00 C ATOM 612 CG2 ILE A 43 -9.746 4.033 6.176 1.00 0.00 C ATOM 613 CD1 ILE A 43 -6.869 2.537 4.692 1.00 0.00 C ATOM 0 H ILE A 43 -6.293 4.992 8.782 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.912 5.381 5.885 1.00 0.00 H new ATOM 0 HB ILE A 43 -8.428 3.644 7.851 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -6.806 2.126 6.844 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -8.329 1.692 6.091 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -10.272 3.079 6.159 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -10.298 4.741 6.794 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -9.667 4.423 5.161 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -6.463 1.558 4.435 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -7.609 2.830 3.947 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -6.063 3.270 4.711 1.00 0.00 H new ATOM 625 N ILE A 44 -8.141 7.554 6.433 1.00 0.00 N ATOM 626 CA ILE A 44 -8.963 8.860 6.570 1.00 0.00 C ATOM 627 C ILE A 44 -10.608 8.553 6.405 1.00 0.00 C ATOM 628 O ILE A 44 -10.978 7.862 5.417 1.00 0.00 O ATOM 629 CB ILE A 44 -8.349 10.137 5.565 1.00 0.00 C ATOM 630 CG1 ILE A 44 -6.905 10.689 5.966 1.00 0.00 C ATOM 631 CG2 ILE A 44 -9.260 11.401 5.348 1.00 0.00 C ATOM 632 CD1 ILE A 44 -5.705 9.865 5.542 1.00 0.00 C ATOM 0 H ILE A 44 -7.708 7.468 5.513 1.00 0.00 H new ATOM 0 HA ILE A 44 -8.838 9.244 7.582 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.311 9.578 4.630 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -6.796 11.687 5.543 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -6.874 10.797 7.050 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.747 12.112 4.701 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -10.198 11.098 4.883 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -9.467 11.870 6.310 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -4.791 10.354 5.878 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -5.770 8.872 5.987 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -5.690 9.776 4.456 1.00 0.00 H new ATOM 644 N PRO A 45 -11.614 9.108 7.423 1.00 0.00 N ATOM 645 CA PRO A 45 -13.164 8.888 7.341 1.00 0.00 C ATOM 646 C PRO A 45 -13.958 9.574 6.083 1.00 0.00 C ATOM 647 O PRO A 45 -15.069 9.070 5.705 1.00 0.00 O ATOM 648 CB PRO A 45 -13.681 9.427 8.736 1.00 0.00 C ATOM 649 CG PRO A 45 -12.462 9.534 9.622 1.00 0.00 C ATOM 650 CD PRO A 45 -11.319 9.915 8.713 1.00 0.00 C ATOM 0 HA PRO A 45 -13.371 7.836 7.147 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -14.167 10.396 8.623 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -14.418 8.749 9.167 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -12.609 10.284 10.399 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -12.261 8.588 10.126 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -11.296 10.988 8.521 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -10.354 9.648 9.144 1.00 0.00 H new ATOM 658 N GLY A 46 -13.315 10.688 5.459 1.00 0.00 N ATOM 659 CA GLY A 46 -13.854 11.437 4.271 1.00 0.00 C ATOM 660 C GLY A 46 -12.850 11.666 3.100 1.00 0.00 C ATOM 661 O GLY A 46 -12.816 12.803 2.555 1.00 0.00 O ATOM 0 H GLY A 46 -12.423 11.057 5.789 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -14.716 10.894 3.884 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -14.214 12.408 4.611 1.00 0.00 H new ATOM 665 N GLY A 47 -12.015 10.555 2.729 1.00 0.00 N ATOM 666 CA GLY A 47 -11.074 10.521 1.533 1.00 0.00 C ATOM 667 C GLY A 47 -11.637 9.790 0.257 1.00 0.00 C ATOM 668 O GLY A 47 -12.812 9.310 0.249 1.00 0.00 O ATOM 0 H GLY A 47 -12.000 9.687 3.265 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.819 11.546 1.262 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -10.148 10.031 1.834 1.00 0.00 H new ATOM 672 N ALA A 48 -10.735 9.726 -0.833 1.00 0.00 N ATOM 673 CA ALA A 48 -10.979 9.125 -2.225 1.00 0.00 C ATOM 674 C ALA A 48 -10.831 7.530 -2.330 1.00 0.00 C ATOM 675 O ALA A 48 -11.624 6.906 -3.057 1.00 0.00 O ATOM 676 CB ALA A 48 -10.115 9.871 -3.294 1.00 0.00 C ATOM 0 H ALA A 48 -9.792 10.107 -0.752 1.00 0.00 H new ATOM 0 HA ALA A 48 -12.036 9.290 -2.432 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -10.297 9.436 -4.277 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -10.386 10.927 -3.309 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.059 9.771 -3.043 1.00 0.00 H new ATOM 682 N ALA A 49 -9.791 6.895 -1.550 1.00 0.00 N ATOM 683 CA ALA A 49 -9.481 5.372 -1.485 1.00 0.00 C ATOM 684 C ALA A 49 -10.430 4.503 -0.504 1.00 0.00 C ATOM 685 O ALA A 49 -10.599 3.248 -0.724 1.00 0.00 O ATOM 686 CB ALA A 49 -7.991 5.160 -1.171 1.00 0.00 C ATOM 0 H ALA A 49 -9.161 7.440 -0.961 1.00 0.00 H new ATOM 0 HA ALA A 49 -9.717 4.981 -2.475 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -7.777 4.092 -1.126 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -7.386 5.619 -1.953 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -7.753 5.618 -0.211 1.00 0.00 H new ATOM 692 N ALA A 50 -11.087 5.232 0.558 1.00 0.00 N ATOM 693 CA ALA A 50 -12.073 4.678 1.591 1.00 0.00 C ATOM 694 C ALA A 50 -13.598 4.644 1.067 1.00 0.00 C ATOM 695 O ALA A 50 -14.302 3.618 1.295 1.00 0.00 O ATOM 696 CB ALA A 50 -11.932 5.463 2.950 1.00 0.00 C ATOM 0 H ALA A 50 -10.921 6.229 0.692 1.00 0.00 H new ATOM 0 HA ALA A 50 -11.809 3.634 1.761 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -12.637 5.061 3.677 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -10.916 5.353 3.330 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -12.144 6.519 2.784 1.00 0.00 H new ATOM 702 N GLN A 51 -14.065 5.804 0.334 1.00 0.00 N ATOM 703 CA GLN A 51 -15.454 6.009 -0.294 1.00 0.00 C ATOM 704 C GLN A 51 -15.582 5.524 -1.826 1.00 0.00 C ATOM 705 O GLN A 51 -16.452 4.656 -2.106 1.00 0.00 O ATOM 706 CB GLN A 51 -15.999 7.517 -0.122 1.00 0.00 C ATOM 707 CG GLN A 51 -16.153 8.058 1.350 1.00 0.00 C ATOM 708 CD GLN A 51 -16.953 9.387 1.489 1.00 0.00 C ATOM 709 OE1 GLN A 51 -18.186 9.376 1.643 1.00 0.00 O ATOM 710 NE2 GLN A 51 -16.246 10.535 1.484 1.00 0.00 N ATOM 0 H GLN A 51 -13.458 6.609 0.180 1.00 0.00 H new ATOM 0 HA GLN A 51 -16.098 5.345 0.283 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -15.325 8.184 -0.659 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -16.971 7.584 -0.611 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -16.644 7.293 1.951 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -15.159 8.206 1.771 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -15.234 10.510 1.355 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -16.723 11.428 1.609 1.00 0.00 H new ATOM 719 N ASP A 52 -14.667 6.101 -2.806 1.00 0.00 N ATOM 720 CA ASP A 52 -14.709 5.885 -4.329 1.00 0.00 C ATOM 721 C ASP A 52 -13.849 4.664 -4.936 1.00 0.00 C ATOM 722 O ASP A 52 -14.324 4.027 -5.931 1.00 0.00 O ATOM 723 CB ASP A 52 -14.399 7.252 -5.087 1.00 0.00 C ATOM 724 CG ASP A 52 -15.567 8.276 -5.149 1.00 0.00 C ATOM 725 OD1 ASP A 52 -15.673 9.121 -4.226 1.00 0.00 O ATOM 726 OD2 ASP A 52 -16.351 8.232 -6.128 1.00 0.00 O ATOM 0 H ASP A 52 -13.903 6.716 -2.525 1.00 0.00 H new ATOM 0 HA ASP A 52 -15.732 5.559 -4.515 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -13.549 7.730 -4.600 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -14.093 7.018 -6.107 1.00 0.00 H new ATOM 731 N GLY A 53 -12.612 4.319 -4.283 1.00 0.00 N ATOM 732 CA GLY A 53 -11.590 3.276 -4.790 1.00 0.00 C ATOM 733 C GLY A 53 -11.835 1.777 -4.407 1.00 0.00 C ATOM 734 O GLY A 53 -11.748 0.900 -5.293 1.00 0.00 O ATOM 0 H GLY A 53 -12.322 4.759 -3.410 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -11.552 3.343 -5.877 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.606 3.561 -4.418 1.00 0.00 H new ATOM 738 N ARG A 54 -12.152 1.512 -3.034 1.00 0.00 N ATOM 739 CA ARG A 54 -12.439 0.150 -2.296 1.00 0.00 C ATOM 740 C ARG A 54 -11.176 -0.626 -1.702 1.00 0.00 C ATOM 741 O ARG A 54 -10.851 -1.820 -2.069 1.00 0.00 O ATOM 742 CB ARG A 54 -13.625 -0.791 -2.872 1.00 0.00 C ATOM 743 CG ARG A 54 -15.064 -0.312 -2.601 1.00 0.00 C ATOM 744 CD ARG A 54 -16.098 -1.306 -3.133 1.00 0.00 C ATOM 745 NE ARG A 54 -17.525 -0.872 -2.828 1.00 0.00 N ATOM 746 CZ ARG A 54 -18.754 -1.551 -3.059 1.00 0.00 C ATOM 747 NH1 ARG A 54 -18.856 -2.790 -3.643 1.00 0.00 N ATOM 748 NH2 ARG A 54 -19.877 -0.951 -2.687 1.00 0.00 N ATOM 0 H ARG A 54 -12.217 2.289 -2.377 1.00 0.00 H new ATOM 0 HA ARG A 54 -12.916 0.550 -1.401 1.00 0.00 H new ATOM 0 HB2 ARG A 54 -13.493 -0.888 -3.950 1.00 0.00 H new ATOM 0 HB3 ARG A 54 -13.509 -1.788 -2.446 1.00 0.00 H new ATOM 0 HG2 ARG A 54 -15.207 -0.176 -1.529 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -15.219 0.660 -3.069 1.00 0.00 H new ATOM 0 HD2 ARG A 54 -15.975 -1.413 -4.211 1.00 0.00 H new ATOM 0 HD3 ARG A 54 -15.917 -2.287 -2.693 1.00 0.00 H new ATOM 0 HE ARG A 54 -17.614 0.046 -2.391 1.00 0.00 H new ATOM 0 HH11 ARG A 54 -18.015 -3.283 -3.942 1.00 0.00 H new ATOM 0 HH12 ARG A 54 -19.773 -3.217 -3.777 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -19.843 -0.030 -2.250 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -20.775 -1.410 -2.838 1.00 0.00 H new ATOM 762 N LEU A 55 -10.373 0.190 -0.869 1.00 0.00 N ATOM 763 CA LEU A 55 -9.228 -0.232 -0.009 1.00 0.00 C ATOM 764 C LEU A 55 -9.584 -0.102 1.548 1.00 0.00 C ATOM 765 O LEU A 55 -10.119 0.957 2.030 1.00 0.00 O ATOM 766 CB LEU A 55 -7.904 0.603 -0.465 1.00 0.00 C ATOM 767 CG LEU A 55 -6.527 0.524 0.310 1.00 0.00 C ATOM 768 CD1 LEU A 55 -5.505 -0.383 -0.360 1.00 0.00 C ATOM 769 CD2 LEU A 55 -6.024 1.909 0.429 1.00 0.00 C ATOM 0 H LEU A 55 -10.542 1.194 -0.801 1.00 0.00 H new ATOM 0 HA LEU A 55 -9.014 -1.292 -0.149 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -7.696 0.315 -1.495 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -8.191 1.654 -0.480 1.00 0.00 H new ATOM 0 HG LEU A 55 -6.690 0.074 1.289 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -4.585 -0.390 0.225 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -5.903 -1.396 -0.422 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -5.294 -0.014 -1.364 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.072 1.906 0.959 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.884 2.332 -0.566 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.745 2.512 0.982 1.00 0.00 H new ATOM 781 N ARG A 56 -9.282 -1.250 2.265 1.00 0.00 N ATOM 782 CA ARG A 56 -9.280 -1.431 3.780 1.00 0.00 C ATOM 783 C ARG A 56 -7.787 -1.639 4.313 1.00 0.00 C ATOM 784 O ARG A 56 -6.887 -2.132 3.564 1.00 0.00 O ATOM 785 CB ARG A 56 -10.262 -2.623 4.264 1.00 0.00 C ATOM 786 CG ARG A 56 -11.757 -2.357 4.219 1.00 0.00 C ATOM 787 CD ARG A 56 -12.442 -3.574 4.747 1.00 0.00 C ATOM 788 NE ARG A 56 -13.950 -3.416 4.874 1.00 0.00 N ATOM 789 CZ ARG A 56 -14.933 -4.359 5.287 1.00 0.00 C ATOM 790 NH1 ARG A 56 -14.658 -5.655 5.649 1.00 0.00 N ATOM 791 NH2 ARG A 56 -16.200 -3.965 5.323 1.00 0.00 N ATOM 0 H ARG A 56 -9.022 -2.112 1.785 1.00 0.00 H new ATOM 0 HA ARG A 56 -9.678 -0.517 4.221 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -10.057 -3.499 3.649 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -9.997 -2.883 5.289 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -12.010 -1.483 4.819 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -12.079 -2.147 3.199 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -12.227 -4.416 4.089 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -12.027 -3.819 5.725 1.00 0.00 H new ATOM 0 HE ARG A 56 -14.311 -2.495 4.626 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -13.697 -5.996 5.632 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -15.415 -6.276 5.935 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -16.445 -3.011 5.059 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -16.929 -4.617 5.614 1.00 0.00 H new ATOM 805 N VAL A 57 -7.549 -1.273 5.656 1.00 0.00 N ATOM 806 CA VAL A 57 -6.224 -1.377 6.487 1.00 0.00 C ATOM 807 C VAL A 57 -5.527 -2.873 6.549 1.00 0.00 C ATOM 808 O VAL A 57 -4.283 -3.006 6.731 1.00 0.00 O ATOM 809 CB VAL A 57 -6.495 -0.690 7.938 1.00 0.00 C ATOM 810 CG1 VAL A 57 -7.320 -1.389 9.031 1.00 0.00 C ATOM 811 CG2 VAL A 57 -5.447 0.232 8.428 1.00 0.00 C ATOM 0 H VAL A 57 -8.302 -0.880 6.220 1.00 0.00 H new ATOM 0 HA VAL A 57 -5.445 -0.826 5.961 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.317 -0.075 7.571 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -7.372 -0.750 9.913 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -8.328 -1.579 8.661 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -6.847 -2.335 9.295 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -5.737 0.628 9.401 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -4.504 -0.306 8.521 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -5.328 1.055 7.723 1.00 0.00 H new ATOM 821 N ASN A 58 -6.446 -3.902 6.408 1.00 0.00 N ATOM 822 CA ASN A 58 -6.208 -5.352 6.373 1.00 0.00 C ATOM 823 C ASN A 58 -5.978 -5.958 4.851 1.00 0.00 C ATOM 824 O ASN A 58 -5.858 -7.218 4.689 1.00 0.00 O ATOM 825 CB ASN A 58 -7.329 -6.091 7.326 1.00 0.00 C ATOM 826 CG ASN A 58 -8.875 -6.088 6.905 1.00 0.00 C ATOM 827 OD1 ASN A 58 -9.249 -6.098 5.717 1.00 0.00 O ATOM 828 ND2 ASN A 58 -9.743 -6.071 7.911 1.00 0.00 N ATOM 0 H ASN A 58 -7.440 -3.693 6.311 1.00 0.00 H new ATOM 0 HA ASN A 58 -5.238 -5.588 6.811 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -7.026 -7.132 7.433 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -7.263 -5.636 8.314 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -10.745 -6.066 7.720 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -9.407 -6.063 8.874 1.00 0.00 H new ATOM 835 N ASP A 59 -5.840 -4.978 3.736 1.00 0.00 N ATOM 836 CA ASP A 59 -5.624 -5.379 2.245 1.00 0.00 C ATOM 837 C ASP A 59 -4.118 -5.649 1.816 1.00 0.00 C ATOM 838 O ASP A 59 -3.867 -6.554 0.937 1.00 0.00 O ATOM 839 CB ASP A 59 -6.365 -4.409 1.228 1.00 0.00 C ATOM 840 CG ASP A 59 -7.851 -4.745 0.958 1.00 0.00 C ATOM 841 OD1 ASP A 59 -8.718 -4.356 1.764 1.00 0.00 O ATOM 842 OD2 ASP A 59 -8.131 -5.390 -0.076 1.00 0.00 O ATOM 0 H ASP A 59 -5.879 -3.969 3.881 1.00 0.00 H new ATOM 0 HA ASP A 59 -6.104 -6.356 2.180 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -6.304 -3.391 1.612 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -5.828 -4.425 0.280 1.00 0.00 H new ATOM 847 N SER A 60 -3.068 -4.833 2.467 1.00 0.00 N ATOM 848 CA SER A 60 -1.492 -4.913 2.299 1.00 0.00 C ATOM 849 C SER A 60 -0.944 -5.029 0.808 1.00 0.00 C ATOM 850 O SER A 60 -1.236 -6.047 0.086 1.00 0.00 O ATOM 851 CB SER A 60 -0.822 -5.984 3.265 1.00 0.00 C ATOM 852 OG SER A 60 -1.051 -5.683 4.630 1.00 0.00 O ATOM 0 H SER A 60 -3.326 -4.099 3.127 1.00 0.00 H new ATOM 0 HA SER A 60 -1.168 -3.922 2.616 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.219 -6.974 3.040 1.00 0.00 H new ATOM 0 HB3 SER A 60 0.251 -6.021 3.077 1.00 0.00 H new ATOM 0 HG SER A 60 -0.625 -6.364 5.191 1.00 0.00 H new ATOM 858 N ILE A 61 -0.118 -3.976 0.371 1.00 0.00 N ATOM 859 CA ILE A 61 0.439 -3.829 -1.073 1.00 0.00 C ATOM 860 C ILE A 61 1.804 -4.692 -1.241 1.00 0.00 C ATOM 861 O ILE A 61 2.759 -4.552 -0.418 1.00 0.00 O ATOM 862 CB ILE A 61 0.636 -2.208 -1.606 1.00 0.00 C ATOM 863 CG1 ILE A 61 -0.634 -1.246 -1.211 1.00 0.00 C ATOM 864 CG2 ILE A 61 0.809 -2.174 -3.212 1.00 0.00 C ATOM 865 CD1 ILE A 61 -0.386 0.311 -1.067 1.00 0.00 C ATOM 0 H ILE A 61 0.177 -3.221 0.990 1.00 0.00 H new ATOM 0 HA ILE A 61 -0.327 -4.236 -1.733 1.00 0.00 H new ATOM 0 HB ILE A 61 1.524 -1.826 -1.102 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.407 -1.390 -1.966 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -1.041 -1.606 -0.266 1.00 0.00 H new ATOM 0 HG21 ILE A 61 0.933 -1.143 -3.543 1.00 0.00 H new ATOM 0 HG22 ILE A 61 1.687 -2.755 -3.496 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -0.076 -2.602 -3.682 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -1.321 0.805 -0.803 1.00 0.00 H new ATOM 0 HD12 ILE A 61 0.353 0.491 -0.286 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -0.019 0.710 -2.013 1.00 0.00 H new ATOM 877 N LEU A 62 1.803 -5.588 -2.357 1.00 0.00 N ATOM 878 CA LEU A 62 3.019 -6.352 -2.858 1.00 0.00 C ATOM 879 C LEU A 62 3.762 -5.602 -4.003 1.00 0.00 C ATOM 880 O LEU A 62 5.022 -5.575 -4.001 1.00 0.00 O ATOM 881 CB LEU A 62 2.740 -7.928 -3.211 1.00 0.00 C ATOM 882 CG LEU A 62 1.676 -8.394 -4.310 1.00 0.00 C ATOM 883 CD1 LEU A 62 2.038 -9.756 -4.785 1.00 0.00 C ATOM 884 CD2 LEU A 62 0.267 -8.462 -3.757 1.00 0.00 C ATOM 0 H LEU A 62 0.963 -5.777 -2.904 1.00 0.00 H new ATOM 0 HA LEU A 62 3.696 -6.383 -2.004 1.00 0.00 H new ATOM 0 HB2 LEU A 62 3.699 -8.354 -3.507 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.452 -8.409 -2.276 1.00 0.00 H new ATOM 0 HG LEU A 62 1.699 -7.659 -5.115 1.00 0.00 H new ATOM 0 HD11 LEU A 62 1.318 -10.083 -5.535 1.00 0.00 H new ATOM 0 HD12 LEU A 62 3.035 -9.735 -5.224 1.00 0.00 H new ATOM 0 HD13 LEU A 62 2.026 -10.450 -3.944 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.417 -8.783 -4.543 1.00 0.00 H new ATOM 0 HD22 LEU A 62 0.234 -9.175 -2.933 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -0.031 -7.477 -3.397 1.00 0.00 H new ATOM 896 N PHE A 63 2.926 -5.000 -5.020 1.00 0.00 N ATOM 897 CA PHE A 63 3.467 -4.258 -6.259 1.00 0.00 C ATOM 898 C PHE A 63 2.752 -2.912 -6.545 1.00 0.00 C ATOM 899 O PHE A 63 1.517 -2.838 -6.495 1.00 0.00 O ATOM 900 CB PHE A 63 3.498 -5.232 -7.589 1.00 0.00 C ATOM 901 CG PHE A 63 4.557 -6.412 -7.557 1.00 0.00 C ATOM 902 CD1 PHE A 63 4.304 -7.612 -6.880 1.00 0.00 C ATOM 903 CD2 PHE A 63 5.764 -6.279 -8.191 1.00 0.00 C ATOM 904 CE1 PHE A 63 5.226 -8.625 -6.833 1.00 0.00 C ATOM 905 CE2 PHE A 63 6.704 -7.267 -8.152 1.00 0.00 C ATOM 906 CZ PHE A 63 6.449 -8.456 -7.468 1.00 0.00 C ATOM 0 H PHE A 63 1.907 -5.028 -4.982 1.00 0.00 H new ATOM 0 HA PHE A 63 4.496 -3.993 -6.015 1.00 0.00 H new ATOM 0 HB2 PHE A 63 2.506 -5.663 -7.723 1.00 0.00 H new ATOM 0 HB3 PHE A 63 3.698 -4.614 -8.464 1.00 0.00 H new ATOM 0 HD1 PHE A 63 3.355 -7.743 -6.381 1.00 0.00 H new ATOM 0 HD2 PHE A 63 5.977 -5.370 -8.735 1.00 0.00 H new ATOM 0 HE1 PHE A 63 5.004 -9.543 -6.309 1.00 0.00 H new ATOM 0 HE2 PHE A 63 7.650 -7.128 -8.653 1.00 0.00 H new ATOM 0 HZ PHE A 63 7.195 -9.236 -7.433 1.00 0.00 H new ATOM 916 N VAL A 64 3.589 -1.805 -6.808 1.00 0.00 N ATOM 917 CA VAL A 64 3.104 -0.427 -7.246 1.00 0.00 C ATOM 918 C VAL A 64 3.590 -0.034 -8.628 1.00 0.00 C ATOM 919 O VAL A 64 4.712 -0.249 -8.941 1.00 0.00 O ATOM 920 CB VAL A 64 3.069 0.833 -6.187 1.00 0.00 C ATOM 921 CG1 VAL A 64 1.898 0.796 -5.249 1.00 0.00 C ATOM 922 CG2 VAL A 64 4.386 1.238 -5.435 1.00 0.00 C ATOM 0 H VAL A 64 4.604 -1.857 -6.719 1.00 0.00 H new ATOM 0 HA VAL A 64 2.035 -0.636 -7.279 1.00 0.00 H new ATOM 0 HB VAL A 64 2.946 1.652 -6.896 1.00 0.00 H new ATOM 0 HG11 VAL A 64 1.940 1.656 -4.581 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.971 0.827 -5.822 1.00 0.00 H new ATOM 0 HG13 VAL A 64 1.931 -0.122 -4.662 1.00 0.00 H new ATOM 0 HG21 VAL A 64 4.185 2.085 -4.779 1.00 0.00 H new ATOM 0 HG22 VAL A 64 4.740 0.395 -4.842 1.00 0.00 H new ATOM 0 HG23 VAL A 64 5.149 1.516 -6.162 1.00 0.00 H new ATOM 932 N ASN A 65 2.633 0.565 -9.489 1.00 0.00 N ATOM 933 CA ASN A 65 2.817 1.084 -10.941 1.00 0.00 C ATOM 934 C ASN A 65 2.987 -0.138 -12.012 1.00 0.00 C ATOM 935 O ASN A 65 2.035 -0.493 -12.731 1.00 0.00 O ATOM 936 CB ASN A 65 3.972 2.300 -11.073 1.00 0.00 C ATOM 937 CG ASN A 65 3.425 3.730 -11.076 1.00 0.00 C ATOM 938 OD1 ASN A 65 3.258 4.345 -10.022 1.00 0.00 O ATOM 939 ND2 ASN A 65 3.169 4.273 -12.272 1.00 0.00 N ATOM 0 H ASN A 65 1.673 0.703 -9.172 1.00 0.00 H new ATOM 0 HA ASN A 65 1.888 1.581 -11.219 1.00 0.00 H new ATOM 0 HB2 ASN A 65 4.676 2.200 -10.246 1.00 0.00 H new ATOM 0 HB3 ASN A 65 4.536 2.143 -11.992 1.00 0.00 H new ATOM 0 HD21 ASN A 65 2.822 5.230 -12.334 1.00 0.00 H new ATOM 0 HD22 ASN A 65 3.321 3.730 -13.122 1.00 0.00 H new ATOM 946 N GLU A 66 4.275 -0.724 -12.027 1.00 0.00 N ATOM 947 CA GLU A 66 4.844 -1.990 -12.713 1.00 0.00 C ATOM 948 C GLU A 66 6.093 -2.558 -11.812 1.00 0.00 C ATOM 949 O GLU A 66 6.724 -3.618 -12.161 1.00 0.00 O ATOM 950 CB GLU A 66 5.337 -1.726 -14.251 1.00 0.00 C ATOM 951 CG GLU A 66 4.215 -1.578 -15.344 1.00 0.00 C ATOM 952 CD GLU A 66 4.741 -1.329 -16.779 1.00 0.00 C ATOM 953 OE1 GLU A 66 4.907 -0.139 -17.165 1.00 0.00 O ATOM 954 OE2 GLU A 66 4.955 -2.323 -17.526 1.00 0.00 O ATOM 0 H GLU A 66 5.019 -0.267 -11.499 1.00 0.00 H new ATOM 0 HA GLU A 66 4.040 -2.723 -12.773 1.00 0.00 H new ATOM 0 HB2 GLU A 66 5.943 -0.820 -14.262 1.00 0.00 H new ATOM 0 HB3 GLU A 66 5.989 -2.549 -14.544 1.00 0.00 H new ATOM 0 HG2 GLU A 66 3.607 -2.483 -15.346 1.00 0.00 H new ATOM 0 HG3 GLU A 66 3.559 -0.754 -15.063 1.00 0.00 H new ATOM 961 N VAL A 67 6.338 -1.867 -10.555 1.00 0.00 N ATOM 962 CA VAL A 67 7.538 -1.996 -9.641 1.00 0.00 C ATOM 963 C VAL A 67 7.328 -2.906 -8.380 1.00 0.00 C ATOM 964 O VAL A 67 6.187 -2.969 -7.801 1.00 0.00 O ATOM 965 CB VAL A 67 8.319 -0.546 -9.249 1.00 0.00 C ATOM 966 CG1 VAL A 67 8.831 0.188 -10.431 1.00 0.00 C ATOM 967 CG2 VAL A 67 7.616 0.445 -8.229 1.00 0.00 C ATOM 0 H VAL A 67 5.659 -1.201 -10.186 1.00 0.00 H new ATOM 0 HA VAL A 67 8.232 -2.536 -10.285 1.00 0.00 H new ATOM 0 HB VAL A 67 9.155 -0.940 -8.672 1.00 0.00 H new ATOM 0 HG11 VAL A 67 9.319 1.107 -10.105 1.00 0.00 H new ATOM 0 HG12 VAL A 67 9.549 -0.436 -10.964 1.00 0.00 H new ATOM 0 HG13 VAL A 67 8.002 0.433 -11.094 1.00 0.00 H new ATOM 0 HG21 VAL A 67 8.244 1.324 -8.085 1.00 0.00 H new ATOM 0 HG22 VAL A 67 6.649 0.751 -8.627 1.00 0.00 H new ATOM 0 HG23 VAL A 67 7.472 -0.059 -7.273 1.00 0.00 H new ATOM 977 N ASP A 68 8.546 -3.419 -7.880 1.00 0.00 N ATOM 978 CA ASP A 68 8.735 -4.328 -6.743 1.00 0.00 C ATOM 979 C ASP A 68 8.816 -3.616 -5.334 1.00 0.00 C ATOM 980 O ASP A 68 9.888 -3.071 -4.938 1.00 0.00 O ATOM 981 CB ASP A 68 9.834 -5.525 -6.992 1.00 0.00 C ATOM 982 CG ASP A 68 11.306 -5.115 -7.385 1.00 0.00 C ATOM 983 OD1 ASP A 68 11.587 -4.992 -8.599 1.00 0.00 O ATOM 984 OD2 ASP A 68 12.141 -4.936 -6.469 1.00 0.00 O ATOM 0 H ASP A 68 9.436 -3.169 -8.312 1.00 0.00 H new ATOM 0 HA ASP A 68 7.792 -4.873 -6.688 1.00 0.00 H new ATOM 0 HB2 ASP A 68 9.887 -6.123 -6.082 1.00 0.00 H new ATOM 0 HB3 ASP A 68 9.448 -6.174 -7.778 1.00 0.00 H new ATOM 989 N VAL A 69 7.588 -3.583 -4.645 1.00 0.00 N ATOM 990 CA VAL A 69 7.411 -3.149 -3.160 1.00 0.00 C ATOM 991 C VAL A 69 7.448 -4.368 -2.096 1.00 0.00 C ATOM 992 O VAL A 69 6.736 -4.400 -1.034 1.00 0.00 O ATOM 993 CB VAL A 69 6.360 -1.929 -2.817 1.00 0.00 C ATOM 994 CG1 VAL A 69 6.895 -0.580 -3.137 1.00 0.00 C ATOM 995 CG2 VAL A 69 4.921 -2.079 -3.277 1.00 0.00 C ATOM 0 H VAL A 69 6.708 -3.849 -5.087 1.00 0.00 H new ATOM 0 HA VAL A 69 8.343 -2.609 -2.997 1.00 0.00 H new ATOM 0 HB VAL A 69 6.285 -2.030 -1.734 1.00 0.00 H new ATOM 0 HG11 VAL A 69 6.151 0.176 -2.886 1.00 0.00 H new ATOM 0 HG12 VAL A 69 7.802 -0.402 -2.559 1.00 0.00 H new ATOM 0 HG13 VAL A 69 7.125 -0.523 -4.201 1.00 0.00 H new ATOM 0 HG21 VAL A 69 4.350 -1.199 -2.980 1.00 0.00 H new ATOM 0 HG22 VAL A 69 4.894 -2.179 -4.362 1.00 0.00 H new ATOM 0 HG23 VAL A 69 4.484 -2.967 -2.820 1.00 0.00 H new ATOM 1005 N ARG A 70 8.312 -5.394 -2.509 1.00 0.00 N ATOM 1006 CA ARG A 70 8.782 -6.607 -1.699 1.00 0.00 C ATOM 1007 C ARG A 70 10.015 -6.272 -0.734 1.00 0.00 C ATOM 1008 O ARG A 70 10.055 -6.809 0.414 1.00 0.00 O ATOM 1009 CB ARG A 70 9.100 -7.878 -2.619 1.00 0.00 C ATOM 1010 CG ARG A 70 7.882 -8.670 -3.160 1.00 0.00 C ATOM 1011 CD ARG A 70 8.330 -9.894 -3.964 1.00 0.00 C ATOM 1012 NE ARG A 70 7.157 -10.721 -4.470 1.00 0.00 N ATOM 1013 CZ ARG A 70 7.151 -11.969 -5.152 1.00 0.00 C ATOM 1014 NH1 ARG A 70 8.282 -12.674 -5.486 1.00 0.00 N ATOM 1015 NH2 ARG A 70 5.978 -12.492 -5.489 1.00 0.00 N ATOM 0 H ARG A 70 8.711 -5.394 -3.448 1.00 0.00 H new ATOM 0 HA ARG A 70 7.938 -6.871 -1.061 1.00 0.00 H new ATOM 0 HB2 ARG A 70 9.692 -7.542 -3.470 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.725 -8.564 -2.047 1.00 0.00 H new ATOM 0 HG2 ARG A 70 7.253 -8.988 -2.328 1.00 0.00 H new ATOM 0 HG3 ARG A 70 7.273 -8.021 -3.790 1.00 0.00 H new ATOM 0 HD2 ARG A 70 8.932 -9.567 -4.812 1.00 0.00 H new ATOM 0 HD3 ARG A 70 8.969 -10.520 -3.341 1.00 0.00 H new ATOM 0 HE ARG A 70 6.236 -10.320 -4.293 1.00 0.00 H new ATOM 0 HH11 ARG A 70 9.202 -12.307 -5.244 1.00 0.00 H new ATOM 0 HH12 ARG A 70 8.201 -13.565 -5.976 1.00 0.00 H new ATOM 0 HH21 ARG A 70 5.115 -12.000 -5.258 1.00 0.00 H new ATOM 0 HH22 ARG A 70 5.940 -13.386 -5.979 1.00 0.00 H new ATOM 1029 N GLU A 71 11.031 -5.296 -1.225 1.00 0.00 N ATOM 1030 CA GLU A 71 12.241 -4.823 -0.534 1.00 0.00 C ATOM 1031 C GLU A 71 12.736 -3.435 -1.144 1.00 0.00 C ATOM 1032 O GLU A 71 13.470 -3.386 -2.198 1.00 0.00 O ATOM 1033 CB GLU A 71 13.423 -5.952 -0.336 1.00 0.00 C ATOM 1034 CG GLU A 71 14.249 -6.610 -1.563 1.00 0.00 C ATOM 1035 CD GLU A 71 13.470 -7.582 -2.503 1.00 0.00 C ATOM 1036 OE1 GLU A 71 13.450 -8.806 -2.220 1.00 0.00 O ATOM 1037 OE2 GLU A 71 12.906 -7.108 -3.522 1.00 0.00 O ATOM 0 H GLU A 71 10.936 -4.865 -2.145 1.00 0.00 H new ATOM 0 HA GLU A 71 11.950 -4.630 0.499 1.00 0.00 H new ATOM 0 HB2 GLU A 71 14.164 -5.506 0.328 1.00 0.00 H new ATOM 0 HB3 GLU A 71 12.967 -6.781 0.206 1.00 0.00 H new ATOM 0 HG2 GLU A 71 14.652 -5.801 -2.172 1.00 0.00 H new ATOM 0 HG3 GLU A 71 15.099 -7.150 -1.147 1.00 0.00 H new ATOM 1044 N VAL A 72 12.216 -2.309 -0.503 1.00 0.00 N ATOM 1045 CA VAL A 72 12.571 -0.832 -0.788 1.00 0.00 C ATOM 1046 C VAL A 72 12.608 -0.002 0.592 1.00 0.00 C ATOM 1047 O VAL A 72 12.033 -0.460 1.601 1.00 0.00 O ATOM 1048 CB VAL A 72 11.612 -0.041 -1.993 1.00 0.00 C ATOM 1049 CG1 VAL A 72 11.610 -0.667 -3.384 1.00 0.00 C ATOM 1050 CG2 VAL A 72 10.166 0.439 -1.598 1.00 0.00 C ATOM 0 H VAL A 72 11.525 -2.397 0.242 1.00 0.00 H new ATOM 0 HA VAL A 72 13.563 -0.854 -1.238 1.00 0.00 H new ATOM 0 HB VAL A 72 12.206 0.871 -2.050 1.00 0.00 H new ATOM 0 HG11 VAL A 72 10.974 -0.080 -4.046 1.00 0.00 H new ATOM 0 HG12 VAL A 72 12.626 -0.683 -3.777 1.00 0.00 H new ATOM 0 HG13 VAL A 72 11.229 -1.686 -3.324 1.00 0.00 H new ATOM 0 HG21 VAL A 72 9.693 0.914 -2.457 1.00 0.00 H new ATOM 0 HG22 VAL A 72 9.571 -0.419 -1.285 1.00 0.00 H new ATOM 0 HG23 VAL A 72 10.231 1.154 -0.778 1.00 0.00 H new ATOM 1060 N THR A 73 13.213 1.282 0.537 1.00 0.00 N ATOM 1061 CA THR A 73 13.140 2.374 1.648 1.00 0.00 C ATOM 1062 C THR A 73 11.714 3.128 1.653 1.00 0.00 C ATOM 1063 O THR A 73 10.980 3.086 0.629 1.00 0.00 O ATOM 1064 CB THR A 73 14.354 3.457 1.595 1.00 0.00 C ATOM 1065 OG1 THR A 73 14.735 3.851 0.264 1.00 0.00 O ATOM 1066 CG2 THR A 73 15.571 3.037 2.404 1.00 0.00 C ATOM 0 H THR A 73 13.759 1.584 -0.270 1.00 0.00 H new ATOM 0 HA THR A 73 13.255 1.828 2.584 1.00 0.00 H new ATOM 0 HB THR A 73 13.931 4.341 2.072 1.00 0.00 H new ATOM 0 HG1 THR A 73 15.466 4.502 0.312 1.00 0.00 H new ATOM 0 HG21 THR A 73 16.342 3.803 2.325 1.00 0.00 H new ATOM 0 HG22 THR A 73 15.288 2.913 3.449 1.00 0.00 H new ATOM 0 HG23 THR A 73 15.957 2.093 2.018 1.00 0.00 H new ATOM 1074 N HIS A 74 11.329 3.779 2.866 1.00 0.00 N ATOM 1075 CA HIS A 74 10.031 4.634 3.153 1.00 0.00 C ATOM 1076 C HIS A 74 9.759 5.776 1.989 1.00 0.00 C ATOM 1077 O HIS A 74 8.727 5.669 1.204 1.00 0.00 O ATOM 1078 CB HIS A 74 10.176 5.219 4.670 1.00 0.00 C ATOM 1079 CG HIS A 74 8.929 5.831 5.416 1.00 0.00 C ATOM 1080 ND1 HIS A 74 8.804 7.190 5.691 1.00 0.00 N ATOM 1081 CD2 HIS A 74 7.842 5.241 6.021 1.00 0.00 C ATOM 1082 CE1 HIS A 74 7.709 7.404 6.430 1.00 0.00 C ATOM 1083 NE2 HIS A 74 7.115 6.241 6.636 1.00 0.00 N ATOM 0 H HIS A 74 11.924 3.725 3.693 1.00 0.00 H new ATOM 0 HA HIS A 74 9.131 4.021 3.100 1.00 0.00 H new ATOM 0 HB2 HIS A 74 10.557 4.409 5.292 1.00 0.00 H new ATOM 0 HB3 HIS A 74 10.946 5.990 4.645 1.00 0.00 H new ATOM 0 HD2 HIS A 74 7.602 4.188 6.016 1.00 0.00 H new ATOM 0 HE1 HIS A 74 7.369 8.362 6.795 1.00 0.00 H new ATOM 0 HE2 HIS A 74 6.254 6.104 7.166 1.00 0.00 H new ATOM 1092 N SER A 75 10.870 6.683 1.736 1.00 0.00 N ATOM 1093 CA SER A 75 10.934 7.794 0.654 1.00 0.00 C ATOM 1094 C SER A 75 10.815 7.231 -0.849 1.00 0.00 C ATOM 1095 O SER A 75 10.087 7.818 -1.646 1.00 0.00 O ATOM 1096 CB SER A 75 12.206 8.707 0.838 1.00 0.00 C ATOM 1097 OG SER A 75 12.177 9.428 2.069 1.00 0.00 O ATOM 0 H SER A 75 11.726 6.640 2.289 1.00 0.00 H new ATOM 0 HA SER A 75 10.051 8.415 0.807 1.00 0.00 H new ATOM 0 HB2 SER A 75 13.103 8.089 0.802 1.00 0.00 H new ATOM 0 HB3 SER A 75 12.270 9.411 0.008 1.00 0.00 H new ATOM 0 HG SER A 75 12.984 9.980 2.144 1.00 0.00 H new ATOM 1103 N ALA A 76 11.425 5.929 -1.100 1.00 0.00 N ATOM 1104 CA ALA A 76 11.372 5.085 -2.392 1.00 0.00 C ATOM 1105 C ALA A 76 9.920 4.430 -2.707 1.00 0.00 C ATOM 1106 O ALA A 76 9.605 4.147 -3.909 1.00 0.00 O ATOM 1107 CB ALA A 76 12.462 3.998 -2.324 1.00 0.00 C ATOM 0 H ALA A 76 11.968 5.462 -0.374 1.00 0.00 H new ATOM 0 HA ALA A 76 11.557 5.765 -3.223 1.00 0.00 H new ATOM 0 HB1 ALA A 76 12.433 3.396 -3.232 1.00 0.00 H new ATOM 0 HB2 ALA A 76 13.441 4.469 -2.232 1.00 0.00 H new ATOM 0 HB3 ALA A 76 12.285 3.359 -1.459 1.00 0.00 H new ATOM 1113 N ALA A 77 9.020 4.260 -1.569 1.00 0.00 N ATOM 1114 CA ALA A 77 7.574 3.750 -1.616 1.00 0.00 C ATOM 1115 C ALA A 77 6.500 4.930 -1.803 1.00 0.00 C ATOM 1116 O ALA A 77 5.433 4.710 -2.448 1.00 0.00 O ATOM 1117 CB ALA A 77 7.276 2.896 -0.362 1.00 0.00 C ATOM 0 H ALA A 77 9.317 4.483 -0.619 1.00 0.00 H new ATOM 0 HA ALA A 77 7.475 3.122 -2.501 1.00 0.00 H new ATOM 0 HB1 ALA A 77 6.248 2.537 -0.402 1.00 0.00 H new ATOM 0 HB2 ALA A 77 7.956 2.045 -0.331 1.00 0.00 H new ATOM 0 HB3 ALA A 77 7.414 3.503 0.533 1.00 0.00 H new ATOM 1123 N VAL A 78 6.856 6.209 -1.242 1.00 0.00 N ATOM 1124 CA VAL A 78 6.060 7.570 -1.381 1.00 0.00 C ATOM 1125 C VAL A 78 6.327 8.254 -2.861 1.00 0.00 C ATOM 1126 O VAL A 78 5.370 8.695 -3.483 1.00 0.00 O ATOM 1127 CB VAL A 78 6.382 8.599 -0.061 1.00 0.00 C ATOM 1128 CG1 VAL A 78 5.655 9.968 -0.058 1.00 0.00 C ATOM 1129 CG2 VAL A 78 5.946 7.974 1.246 1.00 0.00 C ATOM 0 H VAL A 78 7.702 6.321 -0.683 1.00 0.00 H new ATOM 0 HA VAL A 78 4.989 7.372 -1.339 1.00 0.00 H new ATOM 0 HB VAL A 78 7.456 8.751 -0.165 1.00 0.00 H new ATOM 0 HG11 VAL A 78 5.941 10.530 0.831 1.00 0.00 H new ATOM 0 HG12 VAL A 78 5.935 10.530 -0.949 1.00 0.00 H new ATOM 0 HG13 VAL A 78 4.577 9.807 -0.054 1.00 0.00 H new ATOM 0 HG21 VAL A 78 6.166 8.657 2.067 1.00 0.00 H new ATOM 0 HG22 VAL A 78 4.874 7.777 1.215 1.00 0.00 H new ATOM 0 HG23 VAL A 78 6.483 7.038 1.399 1.00 0.00 H new ATOM 1139 N GLU A 79 7.665 8.225 -3.373 1.00 0.00 N ATOM 1140 CA GLU A 79 8.208 8.769 -4.774 1.00 0.00 C ATOM 1141 C GLU A 79 7.612 8.059 -6.064 1.00 0.00 C ATOM 1142 O GLU A 79 7.566 8.669 -7.146 1.00 0.00 O ATOM 1143 CB GLU A 79 9.776 8.777 -4.857 1.00 0.00 C ATOM 1144 CG GLU A 79 10.473 9.919 -4.066 1.00 0.00 C ATOM 1145 CD GLU A 79 12.014 9.973 -4.204 1.00 0.00 C ATOM 1146 OE1 GLU A 79 12.720 9.331 -3.376 1.00 0.00 O ATOM 1147 OE2 GLU A 79 12.515 10.684 -5.119 1.00 0.00 O ATOM 0 H GLU A 79 8.419 7.817 -2.821 1.00 0.00 H new ATOM 0 HA GLU A 79 7.837 9.794 -4.789 1.00 0.00 H new ATOM 0 HB2 GLU A 79 10.149 7.821 -4.489 1.00 0.00 H new ATOM 0 HB3 GLU A 79 10.068 8.851 -5.904 1.00 0.00 H new ATOM 0 HG2 GLU A 79 10.061 10.872 -4.397 1.00 0.00 H new ATOM 0 HG3 GLU A 79 10.222 9.813 -3.010 1.00 0.00 H new ATOM 1154 N ALA A 80 7.108 6.733 -5.885 1.00 0.00 N ATOM 1155 CA ALA A 80 6.269 5.940 -6.881 1.00 0.00 C ATOM 1156 C ALA A 80 4.749 6.511 -6.978 1.00 0.00 C ATOM 1157 O ALA A 80 4.116 6.444 -8.068 1.00 0.00 O ATOM 1158 CB ALA A 80 6.309 4.446 -6.478 1.00 0.00 C ATOM 0 H ALA A 80 7.289 6.206 -5.031 1.00 0.00 H new ATOM 0 HA ALA A 80 6.689 6.050 -7.881 1.00 0.00 H new ATOM 0 HB1 ALA A 80 5.713 3.864 -7.181 1.00 0.00 H new ATOM 0 HB2 ALA A 80 7.340 4.092 -6.496 1.00 0.00 H new ATOM 0 HB3 ALA A 80 5.902 4.329 -5.474 1.00 0.00 H new ATOM 1164 N LEU A 81 4.240 7.131 -5.766 1.00 0.00 N ATOM 1165 CA LEU A 81 2.872 7.757 -5.541 1.00 0.00 C ATOM 1166 C LEU A 81 2.769 9.332 -5.766 1.00 0.00 C ATOM 1167 O LEU A 81 1.656 9.849 -6.036 1.00 0.00 O ATOM 1168 CB LEU A 81 2.228 7.249 -4.141 1.00 0.00 C ATOM 1169 CG LEU A 81 2.278 5.667 -3.697 1.00 0.00 C ATOM 1170 CD1 LEU A 81 1.452 5.402 -2.515 1.00 0.00 C ATOM 1171 CD2 LEU A 81 1.973 4.611 -4.796 1.00 0.00 C ATOM 0 H LEU A 81 4.818 7.187 -4.927 1.00 0.00 H new ATOM 0 HA LEU A 81 2.251 7.383 -6.355 1.00 0.00 H new ATOM 0 HB2 LEU A 81 2.711 7.817 -3.346 1.00 0.00 H new ATOM 0 HB3 LEU A 81 1.178 7.543 -4.150 1.00 0.00 H new ATOM 0 HG LEU A 81 3.335 5.530 -3.468 1.00 0.00 H new ATOM 0 HD11 LEU A 81 1.515 4.345 -2.257 1.00 0.00 H new ATOM 0 HD12 LEU A 81 1.811 6.002 -1.678 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.416 5.662 -2.730 1.00 0.00 H new ATOM 0 HD21 LEU A 81 2.040 3.611 -4.368 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.968 4.772 -5.186 1.00 0.00 H new ATOM 0 HD23 LEU A 81 2.696 4.709 -5.605 1.00 0.00 H new ATOM 1183 N LYS A 82 3.967 10.070 -5.593 1.00 0.00 N ATOM 1184 CA LYS A 82 4.180 11.583 -5.852 1.00 0.00 C ATOM 1185 C LYS A 82 4.656 11.918 -7.349 1.00 0.00 C ATOM 1186 O LYS A 82 4.224 12.966 -7.909 1.00 0.00 O ATOM 1187 CB LYS A 82 5.181 12.279 -4.802 1.00 0.00 C ATOM 1188 CG LYS A 82 4.768 12.310 -3.248 1.00 0.00 C ATOM 1189 CD LYS A 82 5.587 13.327 -2.299 1.00 0.00 C ATOM 1190 CE LYS A 82 7.111 13.002 -1.986 1.00 0.00 C ATOM 1191 NZ LYS A 82 7.725 14.032 -1.103 1.00 0.00 N ATOM 0 H LYS A 82 4.821 9.619 -5.265 1.00 0.00 H new ATOM 0 HA LYS A 82 3.187 12.009 -5.709 1.00 0.00 H new ATOM 0 HB2 LYS A 82 6.144 11.774 -4.878 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.335 13.309 -5.124 1.00 0.00 H new ATOM 0 HG2 LYS A 82 3.709 12.562 -3.182 1.00 0.00 H new ATOM 0 HG3 LYS A 82 4.882 11.303 -2.846 1.00 0.00 H new ATOM 0 HD2 LYS A 82 5.545 14.316 -2.756 1.00 0.00 H new ATOM 0 HD3 LYS A 82 5.059 13.393 -1.348 1.00 0.00 H new ATOM 0 HE2 LYS A 82 7.184 12.024 -1.510 1.00 0.00 H new ATOM 0 HE3 LYS A 82 7.670 12.944 -2.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 8.719 13.786 -0.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 7.678 14.961 -1.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 7.207 14.070 -0.202 1.00 0.00 H new ATOM 1205 N GLU A 83 5.561 10.989 -7.974 1.00 0.00 N ATOM 1206 CA GLU A 83 6.208 11.184 -9.421 1.00 0.00 C ATOM 1207 C GLU A 83 5.475 10.616 -10.697 1.00 0.00 C ATOM 1208 O GLU A 83 5.772 11.110 -11.857 1.00 0.00 O ATOM 1209 CB GLU A 83 7.707 10.834 -9.456 1.00 0.00 C ATOM 1210 CG GLU A 83 8.564 11.898 -8.790 1.00 0.00 C ATOM 1211 CD GLU A 83 10.101 11.696 -8.884 1.00 0.00 C ATOM 1212 OE1 GLU A 83 10.685 11.045 -7.974 1.00 0.00 O ATOM 1213 OE2 GLU A 83 10.722 12.218 -9.852 1.00 0.00 O ATOM 0 H GLU A 83 5.855 10.124 -7.520 1.00 0.00 H new ATOM 0 HA GLU A 83 6.051 12.257 -9.533 1.00 0.00 H new ATOM 0 HB2 GLU A 83 7.866 9.878 -8.957 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.025 10.710 -10.491 1.00 0.00 H new ATOM 0 HG2 GLU A 83 8.317 12.863 -9.232 1.00 0.00 H new ATOM 0 HG3 GLU A 83 8.289 11.950 -7.737 1.00 0.00 H new ATOM 1220 N ALA A 84 4.452 9.636 -10.510 1.00 0.00 N ATOM 1221 CA ALA A 84 3.617 8.936 -11.682 1.00 0.00 C ATOM 1222 C ALA A 84 2.850 9.937 -12.727 1.00 0.00 C ATOM 1223 O ALA A 84 2.558 9.541 -13.909 1.00 0.00 O ATOM 1224 CB ALA A 84 2.709 7.824 -11.137 1.00 0.00 C ATOM 0 H ALA A 84 4.179 9.308 -9.583 1.00 0.00 H new ATOM 0 HA ALA A 84 4.376 8.478 -12.316 1.00 0.00 H new ATOM 0 HB1 ALA A 84 2.156 7.370 -11.959 1.00 0.00 H new ATOM 0 HB2 ALA A 84 3.318 7.065 -10.646 1.00 0.00 H new ATOM 0 HB3 ALA A 84 2.007 8.247 -10.418 1.00 0.00 H new ATOM 1230 N GLY A 85 2.591 11.240 -12.215 1.00 0.00 N ATOM 1231 CA GLY A 85 2.203 12.445 -13.030 1.00 0.00 C ATOM 1232 C GLY A 85 0.806 13.041 -12.896 1.00 0.00 C ATOM 1233 O GLY A 85 0.685 14.289 -12.964 1.00 0.00 O ATOM 0 H GLY A 85 2.655 11.448 -11.219 1.00 0.00 H new ATOM 0 HA2 GLY A 85 2.916 13.236 -12.798 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.345 12.186 -14.079 1.00 0.00 H new ATOM 1237 N SER A 86 -0.273 12.139 -12.668 1.00 0.00 N ATOM 1238 CA SER A 86 -1.816 12.455 -12.597 1.00 0.00 C ATOM 1239 C SER A 86 -2.644 11.157 -12.201 1.00 0.00 C ATOM 1240 O SER A 86 -3.723 11.299 -11.561 1.00 0.00 O ATOM 1241 CB SER A 86 -2.378 13.086 -13.981 1.00 0.00 C ATOM 1242 OG SER A 86 -3.722 13.599 -13.901 1.00 0.00 O ATOM 0 H SER A 86 -0.094 11.145 -12.524 1.00 0.00 H new ATOM 0 HA SER A 86 -1.949 13.207 -11.819 1.00 0.00 H new ATOM 0 HB2 SER A 86 -1.713 13.891 -14.295 1.00 0.00 H new ATOM 0 HB3 SER A 86 -2.340 12.321 -14.756 1.00 0.00 H new ATOM 0 HG SER A 86 -3.986 13.962 -14.772 1.00 0.00 H new ATOM 1248 N ILE A 87 -2.111 9.887 -12.620 1.00 0.00 N ATOM 1249 CA ILE A 87 -2.735 8.522 -12.335 1.00 0.00 C ATOM 1250 C ILE A 87 -1.648 7.586 -11.649 1.00 0.00 C ATOM 1251 O ILE A 87 -0.512 7.400 -12.174 1.00 0.00 O ATOM 1252 CB ILE A 87 -3.538 7.802 -13.691 1.00 0.00 C ATOM 1253 CG1 ILE A 87 -4.645 8.782 -14.471 1.00 0.00 C ATOM 1254 CG2 ILE A 87 -4.147 6.326 -13.453 1.00 0.00 C ATOM 1255 CD1 ILE A 87 -5.918 9.395 -13.707 1.00 0.00 C ATOM 0 H ILE A 87 -1.246 9.816 -13.156 1.00 0.00 H new ATOM 0 HA ILE A 87 -3.556 8.667 -11.633 1.00 0.00 H new ATOM 0 HB ILE A 87 -2.695 7.674 -14.370 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -4.087 9.624 -14.880 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -5.029 8.213 -15.317 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -4.625 5.978 -14.369 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -3.344 5.641 -13.179 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -4.884 6.361 -12.650 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.502 10.000 -14.401 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -6.537 8.584 -13.322 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -5.580 10.018 -12.879 1.00 0.00 H new ATOM 1267 N VAL A 88 -2.121 6.984 -10.493 1.00 0.00 N ATOM 1268 CA VAL A 88 -1.377 6.025 -9.560 1.00 0.00 C ATOM 1269 C VAL A 88 -2.141 4.637 -9.382 1.00 0.00 C ATOM 1270 O VAL A 88 -3.349 4.615 -8.976 1.00 0.00 O ATOM 1271 CB VAL A 88 -0.803 6.659 -8.108 1.00 0.00 C ATOM 1272 CG1 VAL A 88 0.315 7.682 -8.307 1.00 0.00 C ATOM 1273 CG2 VAL A 88 -1.858 7.265 -7.092 1.00 0.00 C ATOM 0 H VAL A 88 -3.072 7.158 -10.167 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.451 5.829 -10.100 1.00 0.00 H new ATOM 0 HB VAL A 88 -0.433 5.749 -7.635 1.00 0.00 H new ATOM 0 HG11 VAL A 88 0.644 8.055 -7.337 1.00 0.00 H new ATOM 0 HG12 VAL A 88 1.154 7.209 -8.817 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -0.055 8.512 -8.909 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -1.340 7.633 -6.206 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -2.391 8.088 -7.569 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -2.569 6.492 -6.801 1.00 0.00 H new ATOM 1283 N ARG A 89 -1.385 3.506 -9.714 1.00 0.00 N ATOM 1284 CA ARG A 89 -1.858 2.038 -9.644 1.00 0.00 C ATOM 1285 C ARG A 89 -1.152 1.164 -8.532 1.00 0.00 C ATOM 1286 O ARG A 89 0.081 1.143 -8.435 1.00 0.00 O ATOM 1287 CB ARG A 89 -2.048 1.283 -11.099 1.00 0.00 C ATOM 1288 CG ARG A 89 -0.929 1.296 -12.159 1.00 0.00 C ATOM 1289 CD ARG A 89 -1.438 0.548 -13.358 1.00 0.00 C ATOM 1290 NE ARG A 89 -0.449 0.505 -14.514 1.00 0.00 N ATOM 1291 CZ ARG A 89 -0.576 -0.095 -15.798 1.00 0.00 C ATOM 1292 NH1 ARG A 89 -1.692 -0.771 -16.229 1.00 0.00 N ATOM 1293 NH2 ARG A 89 0.445 0.005 -16.638 1.00 0.00 N ATOM 0 H ARG A 89 -0.422 3.585 -10.041 1.00 0.00 H new ATOM 0 HA ARG A 89 -2.883 2.134 -9.285 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -2.274 0.238 -10.888 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -2.934 1.712 -11.567 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -0.667 2.319 -12.428 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -0.025 0.827 -11.769 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -1.683 -0.472 -13.062 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -2.363 1.012 -13.699 1.00 0.00 H new ATOM 0 HE ARG A 89 0.439 0.977 -14.343 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -2.499 -0.867 -15.613 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -1.713 -1.177 -17.165 1.00 0.00 H new ATOM 0 HH21 ARG A 89 1.290 0.501 -16.356 1.00 0.00 H new ATOM 0 HH22 ARG A 89 0.385 -0.414 -17.566 1.00 0.00 H new ATOM 1307 N LEU A 90 -2.032 0.540 -7.641 1.00 0.00 N ATOM 1308 CA LEU A 90 -1.696 -0.408 -6.498 1.00 0.00 C ATOM 1309 C LEU A 90 -2.221 -1.898 -6.734 1.00 0.00 C ATOM 1310 O LEU A 90 -3.371 -2.105 -7.245 1.00 0.00 O ATOM 1311 CB LEU A 90 -2.199 0.236 -5.029 1.00 0.00 C ATOM 1312 CG LEU A 90 -3.725 0.634 -4.640 1.00 0.00 C ATOM 1313 CD1 LEU A 90 -4.499 1.614 -5.493 1.00 0.00 C ATOM 1314 CD2 LEU A 90 -4.516 -0.522 -4.145 1.00 0.00 C ATOM 0 H LEU A 90 -3.038 0.696 -7.710 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.610 -0.501 -6.467 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -1.876 -0.475 -4.269 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -1.612 1.143 -4.887 1.00 0.00 H new ATOM 0 HG LEU A 90 -3.538 1.304 -3.800 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -5.496 1.752 -5.075 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -3.977 2.571 -5.512 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -4.582 1.226 -6.508 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -5.526 -0.194 -3.901 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -4.560 -1.290 -4.917 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -4.042 -0.932 -3.253 1.00 0.00 H new ATOM 1326 N TYR A 91 -1.317 -2.916 -6.338 1.00 0.00 N ATOM 1327 CA TYR A 91 -1.568 -4.412 -6.357 1.00 0.00 C ATOM 1328 C TYR A 91 -1.448 -5.009 -4.907 1.00 0.00 C ATOM 1329 O TYR A 91 -0.289 -5.110 -4.322 1.00 0.00 O ATOM 1330 CB TYR A 91 -0.608 -5.180 -7.447 1.00 0.00 C ATOM 1331 CG TYR A 91 -0.958 -6.678 -7.875 1.00 0.00 C ATOM 1332 CD1 TYR A 91 -2.219 -7.044 -8.391 1.00 0.00 C ATOM 1333 CD2 TYR A 91 -0.016 -7.679 -7.722 1.00 0.00 C ATOM 1334 CE1 TYR A 91 -2.515 -8.316 -8.724 1.00 0.00 C ATOM 1335 CE2 TYR A 91 -0.294 -8.981 -8.066 1.00 0.00 C ATOM 1336 CZ TYR A 91 -1.550 -9.305 -8.567 1.00 0.00 C ATOM 1337 OH TYR A 91 -1.829 -10.605 -8.926 1.00 0.00 O ATOM 0 H TYR A 91 -0.383 -2.691 -5.994 1.00 0.00 H new ATOM 0 HA TYR A 91 -2.591 -4.584 -6.693 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -0.592 -4.575 -8.354 1.00 0.00 H new ATOM 0 HB3 TYR A 91 0.406 -5.182 -7.047 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -2.971 -6.280 -8.523 1.00 0.00 H new ATOM 0 HD2 TYR A 91 0.958 -7.433 -7.324 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -3.493 -8.565 -9.109 1.00 0.00 H new ATOM 0 HE2 TYR A 91 0.458 -9.747 -7.948 1.00 0.00 H new ATOM 0 HH TYR A 91 -1.046 -11.168 -8.752 1.00 0.00 H new ATOM 1347 N VAL A 92 -2.681 -5.443 -4.398 1.00 0.00 N ATOM 1348 CA VAL A 92 -2.956 -5.982 -2.951 1.00 0.00 C ATOM 1349 C VAL A 92 -3.202 -7.613 -2.848 1.00 0.00 C ATOM 1350 O VAL A 92 -3.597 -8.273 -3.867 1.00 0.00 O ATOM 1351 CB VAL A 92 -4.165 -5.111 -2.141 1.00 0.00 C ATOM 1352 CG1 VAL A 92 -3.846 -3.612 -1.965 1.00 0.00 C ATOM 1353 CG2 VAL A 92 -5.605 -5.301 -2.743 1.00 0.00 C ATOM 0 H VAL A 92 -3.525 -5.435 -4.971 1.00 0.00 H new ATOM 0 HA VAL A 92 -2.017 -5.805 -2.427 1.00 0.00 H new ATOM 0 HB VAL A 92 -4.170 -5.560 -1.148 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -4.667 -3.125 -1.439 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -2.928 -3.501 -1.388 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -3.718 -3.150 -2.944 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.320 -4.712 -2.169 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -5.612 -4.969 -3.781 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -5.883 -6.354 -2.697 1.00 0.00 H new ATOM 1363 N MET A 93 -3.026 -8.153 -1.539 1.00 0.00 N ATOM 1364 CA MET A 93 -3.138 -9.650 -1.111 1.00 0.00 C ATOM 1365 C MET A 93 -4.235 -9.903 0.031 1.00 0.00 C ATOM 1366 O MET A 93 -4.107 -9.390 1.181 1.00 0.00 O ATOM 1367 CB MET A 93 -1.650 -10.377 -0.859 1.00 0.00 C ATOM 1368 CG MET A 93 -0.662 -9.892 0.294 1.00 0.00 C ATOM 1369 SD MET A 93 -1.130 -10.444 1.957 1.00 0.00 S ATOM 1370 CE MET A 93 0.260 -9.857 2.921 1.00 0.00 C ATOM 0 H MET A 93 -2.800 -7.550 -0.748 1.00 0.00 H new ATOM 0 HA MET A 93 -3.541 -10.186 -1.970 1.00 0.00 H new ATOM 0 HB2 MET A 93 -1.842 -11.436 -0.685 1.00 0.00 H new ATOM 0 HB3 MET A 93 -1.100 -10.303 -1.797 1.00 0.00 H new ATOM 0 HG2 MET A 93 0.342 -10.254 0.073 1.00 0.00 H new ATOM 0 HG3 MET A 93 -0.617 -8.803 0.284 1.00 0.00 H new ATOM 0 HE1 MET A 93 0.115 -10.123 3.968 1.00 0.00 H new ATOM 0 HE2 MET A 93 1.178 -10.317 2.554 1.00 0.00 H new ATOM 0 HE3 MET A 93 0.335 -8.773 2.829 1.00 0.00 H new ATOM 1380 N ARG A 94 -5.325 -10.712 -0.364 1.00 0.00 N ATOM 1381 CA ARG A 94 -6.549 -11.108 0.473 1.00 0.00 C ATOM 1382 C ARG A 94 -6.616 -12.682 0.708 1.00 0.00 C ATOM 1383 O ARG A 94 -6.116 -13.494 -0.136 1.00 0.00 O ATOM 1384 CB ARG A 94 -7.942 -10.558 -0.163 1.00 0.00 C ATOM 1385 CG ARG A 94 -8.214 -9.013 -0.062 1.00 0.00 C ATOM 1386 CD ARG A 94 -9.588 -8.570 -0.664 1.00 0.00 C ATOM 1387 NE ARG A 94 -10.823 -8.926 0.198 1.00 0.00 N ATOM 1388 CZ ARG A 94 -12.194 -8.646 -0.025 1.00 0.00 C ATOM 1389 NH1 ARG A 94 -12.675 -7.969 -1.116 1.00 0.00 N ATOM 1390 NH2 ARG A 94 -13.072 -9.065 0.878 1.00 0.00 N ATOM 0 H ARG A 94 -5.367 -11.112 -1.301 1.00 0.00 H new ATOM 0 HA ARG A 94 -6.425 -10.626 1.443 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -7.967 -10.838 -1.216 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -8.766 -11.079 0.325 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -8.175 -8.715 0.986 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -7.414 -8.479 -0.576 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -9.570 -7.491 -0.818 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -9.703 -9.030 -1.645 1.00 0.00 H new ATOM 0 HE ARG A 94 -10.619 -9.439 1.056 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -12.031 -7.632 -1.832 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -13.677 -7.803 -1.212 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -12.752 -9.573 1.703 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -14.066 -8.879 0.747 1.00 0.00 H new ATOM 1404 N ARG A 95 -7.259 -13.068 1.903 1.00 0.00 N ATOM 1405 CA ARG A 95 -7.501 -14.485 2.434 1.00 0.00 C ATOM 1406 C ARG A 95 -8.861 -15.133 1.819 1.00 0.00 C ATOM 1407 O ARG A 95 -9.914 -14.435 1.680 1.00 0.00 O ATOM 1408 CB ARG A 95 -7.492 -14.426 4.083 1.00 0.00 C ATOM 1409 CG ARG A 95 -7.350 -15.767 4.963 1.00 0.00 C ATOM 1410 CD ARG A 95 -5.904 -16.349 5.053 1.00 0.00 C ATOM 1411 NE ARG A 95 -5.843 -17.604 5.912 1.00 0.00 N ATOM 1412 CZ ARG A 95 -4.737 -18.435 6.232 1.00 0.00 C ATOM 1413 NH1 ARG A 95 -3.457 -18.229 5.779 1.00 0.00 N ATOM 1414 NH2 ARG A 95 -4.951 -19.481 7.020 1.00 0.00 N ATOM 0 H ARG A 95 -7.634 -12.365 2.540 1.00 0.00 H new ATOM 0 HA ARG A 95 -6.703 -15.152 2.108 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -6.675 -13.766 4.374 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -8.418 -13.940 4.390 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -7.705 -15.560 5.972 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -8.007 -16.529 4.544 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -5.543 -16.579 4.050 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -5.235 -15.594 5.467 1.00 0.00 H new ATOM 0 HE ARG A 95 -6.732 -17.892 6.320 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -3.253 -17.436 5.171 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -2.711 -18.869 6.051 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -5.888 -19.668 7.376 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -4.178 -20.098 7.269 1.00 0.00 H new ATOM 1428 N LYS A 96 -8.747 -16.494 1.461 1.00 0.00 N ATOM 1429 CA LYS A 96 -9.831 -17.447 0.840 1.00 0.00 C ATOM 1430 C LYS A 96 -11.276 -17.612 1.675 1.00 0.00 C ATOM 1431 O LYS A 96 -11.203 -17.824 2.919 1.00 0.00 O ATOM 1432 CB LYS A 96 -9.211 -18.881 0.356 1.00 0.00 C ATOM 1433 CG LYS A 96 -8.350 -19.724 1.388 1.00 0.00 C ATOM 1434 CD LYS A 96 -7.958 -21.120 0.834 1.00 0.00 C ATOM 1435 CE LYS A 96 -7.113 -21.993 1.826 1.00 0.00 C ATOM 1436 NZ LYS A 96 -7.901 -22.594 2.981 1.00 0.00 N ATOM 0 H LYS A 96 -7.865 -16.987 1.599 1.00 0.00 H new ATOM 0 HA LYS A 96 -10.140 -16.898 -0.050 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -10.041 -19.507 0.029 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -8.589 -18.694 -0.519 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -7.446 -19.170 1.640 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -8.915 -19.849 2.311 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -8.867 -21.663 0.574 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -7.391 -20.986 -0.088 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -6.643 -22.802 1.266 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -6.310 -21.379 2.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -7.263 -23.153 3.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -8.328 -21.831 3.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -8.651 -23.209 2.606 1.00 0.00 H new ATOM 1450 N PRO A 97 -12.645 -17.490 0.960 1.00 0.00 N ATOM 1451 CA PRO A 97 -14.034 -17.612 1.669 1.00 0.00 C ATOM 1452 C PRO A 97 -14.442 -19.030 2.457 1.00 0.00 C ATOM 1453 O PRO A 97 -15.042 -18.881 3.556 1.00 0.00 O ATOM 1454 CB PRO A 97 -15.065 -17.270 0.537 1.00 0.00 C ATOM 1455 CG PRO A 97 -14.288 -16.509 -0.491 1.00 0.00 C ATOM 1456 CD PRO A 97 -12.928 -17.152 -0.531 1.00 0.00 C ATOM 0 HA PRO A 97 -14.018 -16.940 2.527 1.00 0.00 H new ATOM 0 HB2 PRO A 97 -15.497 -18.176 0.112 1.00 0.00 H new ATOM 0 HB3 PRO A 97 -15.892 -16.675 0.925 1.00 0.00 H new ATOM 0 HG2 PRO A 97 -14.774 -16.559 -1.465 1.00 0.00 H new ATOM 0 HG3 PRO A 97 -14.215 -15.454 -0.225 1.00 0.00 H new ATOM 0 HD2 PRO A 97 -12.925 -18.047 -1.153 1.00 0.00 H new ATOM 0 HD3 PRO A 97 -12.176 -16.477 -0.940 1.00 0.00 H new ATOM 1464 N PRO A 98 -14.114 -20.468 1.927 1.00 0.00 N ATOM 1465 CA PRO A 98 -14.542 -21.789 2.662 1.00 0.00 C ATOM 1466 C PRO A 98 -13.927 -22.058 4.143 1.00 0.00 C ATOM 1467 O PRO A 98 -12.701 -21.805 4.393 1.00 0.00 O ATOM 1468 CB PRO A 98 -14.141 -22.924 1.641 1.00 0.00 C ATOM 1469 CG PRO A 98 -14.001 -22.238 0.315 1.00 0.00 C ATOM 1470 CD PRO A 98 -13.405 -20.888 0.615 1.00 0.00 C ATOM 0 HA PRO A 98 -15.604 -21.738 2.901 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -13.208 -23.405 1.935 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -14.902 -23.703 1.601 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -13.359 -22.809 -0.355 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -14.968 -22.138 -0.178 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -12.324 -20.945 0.743 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -13.594 -20.177 -0.190 1.00 0.00 H new ATOM 1478 N ALA A 99 -14.874 -22.537 5.103 1.00 0.00 N ATOM 1479 CA ALA A 99 -14.602 -22.875 6.567 1.00 0.00 C ATOM 1480 C ALA A 99 -14.653 -24.435 6.859 1.00 0.00 C ATOM 1481 O ALA A 99 -13.575 -25.000 7.148 1.00 0.00 O ATOM 1482 CB ALA A 99 -15.516 -22.033 7.538 1.00 0.00 C ATOM 1483 OXT ALA A 99 -15.752 -25.079 6.727 1.00 0.00 O ATOM 0 H ALA A 99 -15.850 -22.692 4.852 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.574 -22.579 6.774 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -15.294 -22.301 8.571 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.323 -20.971 7.389 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -16.564 -22.245 7.326 1.00 0.00 H new TER 1489 ALA A 99 ATOM 1490 N VAL B 1 3.126 1.448 18.798 1.00 0.00 N ATOM 1491 CA VAL B 1 4.338 1.424 17.915 1.00 0.00 C ATOM 1492 C VAL B 1 5.540 2.305 18.537 1.00 0.00 C ATOM 1493 O VAL B 1 5.353 3.517 18.868 1.00 0.00 O ATOM 1494 CB VAL B 1 3.935 1.658 16.309 1.00 0.00 C ATOM 1495 CG1 VAL B 1 3.535 3.095 15.793 1.00 0.00 C ATOM 1496 CG2 VAL B 1 4.827 0.880 15.316 1.00 0.00 C ATOM 0 H1 VAL B 1 2.385 0.845 18.387 1.00 0.00 H new ATOM 0 H2 VAL B 1 3.377 1.092 19.742 1.00 0.00 H new ATOM 0 H3 VAL B 1 2.774 2.423 18.878 1.00 0.00 H new ATOM 0 HA VAL B 1 4.772 0.424 17.896 1.00 0.00 H new ATOM 0 HB VAL B 1 2.950 1.192 16.325 1.00 0.00 H new ATOM 0 HG11 VAL B 1 3.308 3.049 14.728 1.00 0.00 H new ATOM 0 HG12 VAL B 1 2.658 3.446 16.336 1.00 0.00 H new ATOM 0 HG13 VAL B 1 4.363 3.784 15.958 1.00 0.00 H new ATOM 0 HG21 VAL B 1 4.501 1.085 14.296 1.00 0.00 H new ATOM 0 HG22 VAL B 1 5.864 1.194 15.436 1.00 0.00 H new ATOM 0 HG23 VAL B 1 4.746 -0.189 15.515 1.00 0.00 H new ATOM 1508 N VAL B 2 6.753 1.614 18.642 1.00 0.00 N ATOM 1509 CA VAL B 2 8.038 2.103 19.333 1.00 0.00 C ATOM 1510 C VAL B 2 9.232 2.666 18.316 1.00 0.00 C ATOM 1511 O VAL B 2 10.174 3.349 18.821 1.00 0.00 O ATOM 1512 CB VAL B 2 8.538 0.965 20.495 1.00 0.00 C ATOM 1513 CG1 VAL B 2 9.105 -0.424 19.996 1.00 0.00 C ATOM 1514 CG2 VAL B 2 9.363 1.544 21.688 1.00 0.00 C ATOM 0 H VAL B 2 6.868 0.683 18.241 1.00 0.00 H new ATOM 0 HA VAL B 2 7.790 3.021 19.866 1.00 0.00 H new ATOM 0 HB VAL B 2 7.555 0.698 20.884 1.00 0.00 H new ATOM 0 HG11 VAL B 2 9.379 -1.035 20.856 1.00 0.00 H new ATOM 0 HG12 VAL B 2 8.342 -0.940 19.412 1.00 0.00 H new ATOM 0 HG13 VAL B 2 9.985 -0.256 19.375 1.00 0.00 H new ATOM 0 HG21 VAL B 2 9.632 0.737 22.370 1.00 0.00 H new ATOM 0 HG22 VAL B 2 10.270 2.015 21.309 1.00 0.00 H new ATOM 0 HG23 VAL B 2 8.764 2.284 22.219 1.00 0.00 H new ATOM 1524 N SER B 3 9.111 2.402 16.903 1.00 0.00 N ATOM 1525 CA SER B 3 10.228 2.694 15.852 1.00 0.00 C ATOM 1526 C SER B 3 9.807 3.721 14.707 1.00 0.00 C ATOM 1527 O SER B 3 10.701 4.362 14.057 1.00 0.00 O ATOM 1528 CB SER B 3 10.760 1.337 15.233 1.00 0.00 C ATOM 1529 OG SER B 3 11.411 0.523 16.206 1.00 0.00 O ATOM 0 H SER B 3 8.270 1.999 16.491 1.00 0.00 H new ATOM 0 HA SER B 3 11.031 3.193 16.395 1.00 0.00 H new ATOM 0 HB2 SER B 3 9.926 0.785 14.799 1.00 0.00 H new ATOM 0 HB3 SER B 3 11.454 1.557 14.422 1.00 0.00 H new ATOM 0 HG SER B 3 11.723 -0.305 15.784 1.00 0.00 H new ATOM 1535 N GLU B 4 8.403 3.923 14.552 1.00 0.00 N ATOM 1536 CA GLU B 4 7.687 4.676 13.461 1.00 0.00 C ATOM 1537 C GLU B 4 6.912 6.000 14.007 1.00 0.00 C ATOM 1538 O GLU B 4 6.541 6.093 15.221 1.00 0.00 O ATOM 1539 CB GLU B 4 6.687 3.571 12.785 1.00 0.00 C ATOM 1540 CG GLU B 4 5.931 3.834 11.449 1.00 0.00 C ATOM 1541 CD GLU B 4 6.784 3.961 10.133 1.00 0.00 C ATOM 1542 OE1 GLU B 4 7.066 2.918 9.490 1.00 0.00 O ATOM 1543 OE2 GLU B 4 7.139 5.106 9.759 1.00 0.00 O ATOM 0 H GLU B 4 7.745 3.536 15.229 1.00 0.00 H new ATOM 0 HA GLU B 4 8.381 5.087 12.728 1.00 0.00 H new ATOM 0 HB2 GLU B 4 7.276 2.666 12.637 1.00 0.00 H new ATOM 0 HB3 GLU B 4 5.928 3.338 13.532 1.00 0.00 H new ATOM 0 HG2 GLU B 4 5.214 3.026 11.306 1.00 0.00 H new ATOM 0 HG3 GLU B 4 5.357 4.753 11.565 1.00 0.00 H new ATOM 1550 N ARG B 5 6.707 7.003 13.013 1.00 0.00 N ATOM 1551 CA ARG B 5 5.881 8.288 13.150 1.00 0.00 C ATOM 1552 C ARG B 5 4.441 8.199 12.416 1.00 0.00 C ATOM 1553 O ARG B 5 3.424 8.657 12.990 1.00 0.00 O ATOM 1554 CB ARG B 5 6.736 9.677 12.794 1.00 0.00 C ATOM 1555 CG ARG B 5 7.364 9.971 11.325 1.00 0.00 C ATOM 1556 CD ARG B 5 8.652 9.170 10.964 1.00 0.00 C ATOM 1557 NE ARG B 5 9.215 9.573 9.609 1.00 0.00 N ATOM 1558 CZ ARG B 5 10.388 9.127 8.942 1.00 0.00 C ATOM 1559 NH1 ARG B 5 11.260 8.194 9.448 1.00 0.00 N ATOM 1560 NH2 ARG B 5 10.664 9.645 7.751 1.00 0.00 N ATOM 0 H ARG B 5 7.127 6.920 12.087 1.00 0.00 H new ATOM 0 HA ARG B 5 5.655 8.373 14.213 1.00 0.00 H new ATOM 0 HB2 ARG B 5 6.077 10.514 13.023 1.00 0.00 H new ATOM 0 HB3 ARG B 5 7.565 9.721 13.500 1.00 0.00 H new ATOM 0 HG2 ARG B 5 6.603 9.755 10.575 1.00 0.00 H new ATOM 0 HG3 ARG B 5 7.589 11.035 11.253 1.00 0.00 H new ATOM 0 HD2 ARG B 5 9.407 9.333 11.733 1.00 0.00 H new ATOM 0 HD3 ARG B 5 8.426 8.104 10.960 1.00 0.00 H new ATOM 0 HE ARG B 5 8.667 10.269 9.103 1.00 0.00 H new ATOM 0 HH11 ARG B 5 11.084 7.773 10.360 1.00 0.00 H new ATOM 0 HH12 ARG B 5 12.084 7.922 8.911 1.00 0.00 H new ATOM 0 HH21 ARG B 5 10.042 10.342 7.341 1.00 0.00 H new ATOM 0 HH22 ARG B 5 11.498 9.346 7.246 1.00 0.00 H new ATOM 1574 N ILE B 6 4.416 7.550 11.108 1.00 0.00 N ATOM 1575 CA ILE B 6 3.200 7.271 10.140 1.00 0.00 C ATOM 1576 C ILE B 6 2.335 8.581 9.681 1.00 0.00 C ATOM 1577 O ILE B 6 1.210 8.838 10.195 1.00 0.00 O ATOM 1578 CB ILE B 6 2.352 5.770 10.436 1.00 0.00 C ATOM 1579 CG1 ILE B 6 1.256 5.253 9.350 1.00 0.00 C ATOM 1580 CG2 ILE B 6 1.708 5.640 11.850 1.00 0.00 C ATOM 1581 CD1 ILE B 6 1.728 4.796 7.962 1.00 0.00 C ATOM 0 H ILE B 6 5.284 7.201 10.701 1.00 0.00 H new ATOM 0 HA ILE B 6 3.666 7.043 9.181 1.00 0.00 H new ATOM 0 HB ILE B 6 3.216 5.114 10.335 1.00 0.00 H new ATOM 0 HG12 ILE B 6 0.715 4.422 9.802 1.00 0.00 H new ATOM 0 HG13 ILE B 6 0.537 6.059 9.202 1.00 0.00 H new ATOM 0 HG21 ILE B 6 1.207 4.676 11.934 1.00 0.00 H new ATOM 0 HG22 ILE B 6 2.484 5.713 12.612 1.00 0.00 H new ATOM 0 HG23 ILE B 6 0.982 6.440 11.994 1.00 0.00 H new ATOM 0 HD11 ILE B 6 0.868 4.485 7.369 1.00 0.00 H new ATOM 0 HD12 ILE B 6 2.236 5.620 7.461 1.00 0.00 H new ATOM 0 HD13 ILE B 6 2.416 3.958 8.070 1.00 0.00 H new ATOM 1593 N SER B 7 3.013 9.402 8.746 1.00 0.00 N ATOM 1594 CA SER B 7 2.508 10.731 8.103 1.00 0.00 C ATOM 1595 C SER B 7 2.575 10.728 6.458 1.00 0.00 C ATOM 1596 O SER B 7 2.486 11.819 5.782 1.00 0.00 O ATOM 1597 CB SER B 7 3.310 11.978 8.735 1.00 0.00 C ATOM 1598 OG SER B 7 3.045 12.137 10.128 1.00 0.00 O ATOM 0 H SER B 7 3.944 9.154 8.411 1.00 0.00 H new ATOM 0 HA SER B 7 1.449 10.829 8.342 1.00 0.00 H new ATOM 0 HB2 SER B 7 4.380 11.834 8.584 1.00 0.00 H new ATOM 0 HB3 SER B 7 3.034 12.891 8.207 1.00 0.00 H new ATOM 0 HG SER B 7 3.552 12.902 10.472 1.00 0.00 H new ATOM 1604 N SER B 8 2.582 9.436 5.831 1.00 0.00 N ATOM 1605 CA SER B 8 2.746 9.109 4.314 1.00 0.00 C ATOM 1606 C SER B 8 1.394 9.357 3.393 1.00 0.00 C ATOM 1607 O SER B 8 0.442 10.035 3.871 1.00 0.00 O ATOM 1608 CB SER B 8 3.355 7.644 4.172 1.00 0.00 C ATOM 1609 OG SER B 8 4.646 7.534 4.762 1.00 0.00 O ATOM 0 H SER B 8 2.471 8.587 6.385 1.00 0.00 H new ATOM 0 HA SER B 8 3.443 9.833 3.892 1.00 0.00 H new ATOM 0 HB2 SER B 8 2.682 6.926 4.641 1.00 0.00 H new ATOM 0 HB3 SER B 8 3.417 7.380 3.116 1.00 0.00 H new ATOM 0 HG SER B 8 4.861 6.589 4.904 1.00 0.00 H new ATOM 1615 N VAL B 9 1.382 8.828 2.051 1.00 0.00 N ATOM 1616 CA VAL B 9 0.265 9.020 0.989 1.00 0.00 C ATOM 1617 C VAL B 9 -0.421 7.596 0.679 1.00 0.00 C ATOM 1618 O VAL B 9 0.278 6.658 0.298 1.00 0.00 O ATOM 1619 CB VAL B 9 0.780 9.827 -0.446 1.00 0.00 C ATOM 1620 CG1 VAL B 9 -0.396 10.440 -1.281 1.00 0.00 C ATOM 1621 CG2 VAL B 9 1.771 11.012 -0.213 1.00 0.00 C ATOM 1622 OXT VAL B 9 -1.650 7.517 0.767 1.00 0.00 O ATOM 0 H VAL B 9 2.153 8.262 1.697 1.00 0.00 H new ATOM 0 HA VAL B 9 -0.476 9.696 1.415 1.00 0.00 H new ATOM 0 HB VAL B 9 1.274 9.015 -0.980 1.00 0.00 H new ATOM 0 HG11 VAL B 9 0.005 10.931 -2.168 1.00 0.00 H new ATOM 0 HG12 VAL B 9 -1.080 9.647 -1.583 1.00 0.00 H new ATOM 0 HG13 VAL B 9 -0.932 11.169 -0.674 1.00 0.00 H new ATOM 0 HG21 VAL B 9 2.038 11.457 -1.172 1.00 0.00 H new ATOM 0 HG22 VAL B 9 1.297 11.765 0.417 1.00 0.00 H new ATOM 0 HG23 VAL B 9 2.671 10.642 0.279 1.00 0.00 H new TER 1632 VAL B 9