USER MOD reduce.3.24.130724 H: found=0, std=0, add=1007, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1001 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 111 HIS : no HD1:sc= -3.4! K(o=-3.6!,f=-1.5) USER MOD Set 1.2: A 114 TYR OH : rot 180:sc= -0.187 USER MOD Set 2.1: A 50 MET CE :methyl -117:sc= -1.17 (180deg=-0.542) USER MOD Set 2.2: A 101 HIS : no HD1:sc= -0.646 K(o=-1.8,f=-4.1) USER MOD Single : A 1 GLY N :NH3+ -109:sc= 0.0645 (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= -0.216 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 11 ASN : amide:sc= -2.09! K(o=-2.1!,f=-0.09) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.389 X(o=-0.39,f=-0.46) USER MOD Single : A 19 GLN : amide:sc= -0.411 K(o=-0.41,f=-2.4!) USER MOD Single : A 21 GLN : amide:sc= 0.127 X(o=0.13,f=0) USER MOD Single : A 23 THR OG1 : rot 77:sc= 1.12 USER MOD Single : A 25 SER OG : rot 86:sc= 0.198 USER MOD Single : A 27 ASN : amide:sc= -0.389 X(o=-0.39,f=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.0305 USER MOD Single : A 36 SER OG : rot 66:sc= 0.21 USER MOD Single : A 37 CYS SG : rot 180:sc= -0.0977 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 CYS SG : rot -82:sc= -1.06 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 MET CE :methyl 149:sc= -0.328 (180deg=-1.26) USER MOD Single : A 44 LYS NZ :NH3+ 172:sc= -1.91! (180deg=-2.27!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 HIS : no HD1:sc= -0.39 X(o=-0.39,f=0.02) USER MOD Single : A 51 ASN : amide:sc= -0.132 K(o=-0.13,f=-1.2!) USER MOD Single : A 53 ASN : amide:sc= -1.94! C(o=-1.9!,f=-0.97!) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.0859 K(o=-0.086,f=-2.3!) USER MOD Single : A 67 GLN : amide:sc= -0.317 X(o=-0.32,f=-0.14) USER MOD Single : A 69 GLN : amide:sc= -0.0511 X(o=-0.051,f=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl 178:sc= -1.58 (180deg=-1.6) USER MOD Single : A 76 THR OG1 : rot -64:sc= 1.01 USER MOD Single : A 80 THR OG1 : rot -152:sc= -1.9 USER MOD Single : A 87 ASN : amide:sc= -0.301 K(o=-0.3,f=1.1) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 71:sc= 0.895 USER MOD Single : A 98 HIS : no HD1:sc= -0.919 K(o=-0.92,f=-2.8!) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 116 LYS NZ :NH3+ 158:sc= -0.107 (180deg=-0.525) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc=0.000664 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 19.617 3.115 -18.544 1.00 0.00 N ATOM 2 CA GLY A 1 18.630 2.490 -17.683 1.00 0.00 C ATOM 3 C GLY A 1 17.883 1.368 -18.375 1.00 0.00 C ATOM 4 O GLY A 1 17.933 1.242 -19.599 1.00 0.00 O ATOM 0 H1 GLY A 1 20.572 2.858 -18.221 1.00 0.00 H new ATOM 0 H2 GLY A 1 19.482 2.787 -19.522 1.00 0.00 H new ATOM 0 H3 GLY A 1 19.505 4.148 -18.507 1.00 0.00 H new ATOM 0 HA2 GLY A 1 19.124 2.099 -16.794 1.00 0.00 H new ATOM 0 HA3 GLY A 1 17.917 3.243 -17.346 1.00 0.00 H new ATOM 8 N SER A 2 17.188 0.550 -17.592 1.00 0.00 N ATOM 9 CA SER A 2 16.430 -0.571 -18.137 1.00 0.00 C ATOM 10 C SER A 2 15.311 -0.984 -17.186 1.00 0.00 C ATOM 11 O SER A 2 15.469 -0.938 -15.966 1.00 0.00 O ATOM 12 CB SER A 2 17.357 -1.760 -18.400 1.00 0.00 C ATOM 13 OG SER A 2 17.869 -2.285 -17.187 1.00 0.00 O ATOM 0 H SER A 2 17.134 0.642 -16.578 1.00 0.00 H new ATOM 0 HA SER A 2 15.983 -0.252 -19.079 1.00 0.00 H new ATOM 0 HB2 SER A 2 16.813 -2.538 -18.936 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.181 -1.448 -19.042 1.00 0.00 H new ATOM 0 HG SER A 2 18.457 -3.045 -17.382 1.00 0.00 H new ATOM 19 N SER A 3 14.179 -1.388 -17.754 1.00 0.00 N ATOM 20 CA SER A 3 13.031 -1.806 -16.959 1.00 0.00 C ATOM 21 C SER A 3 12.444 -3.108 -17.495 1.00 0.00 C ATOM 22 O SER A 3 12.718 -3.507 -18.626 1.00 0.00 O ATOM 23 CB SER A 3 11.961 -0.713 -16.956 1.00 0.00 C ATOM 24 OG SER A 3 12.399 0.428 -16.240 1.00 0.00 O ATOM 0 H SER A 3 14.033 -1.435 -18.762 1.00 0.00 H new ATOM 0 HA SER A 3 13.370 -1.975 -15.937 1.00 0.00 H new ATOM 0 HB2 SER A 3 11.721 -0.432 -17.981 1.00 0.00 H new ATOM 0 HB3 SER A 3 11.045 -1.098 -16.508 1.00 0.00 H new ATOM 0 HG SER A 3 11.698 1.112 -16.254 1.00 0.00 H new ATOM 30 N GLY A 4 11.632 -3.767 -16.673 1.00 0.00 N ATOM 31 CA GLY A 4 11.018 -5.017 -17.081 1.00 0.00 C ATOM 32 C GLY A 4 12.033 -6.127 -17.269 1.00 0.00 C ATOM 33 O GLY A 4 13.236 -5.873 -17.332 1.00 0.00 O ATOM 0 H GLY A 4 11.389 -3.457 -15.732 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.287 -5.321 -16.332 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.475 -4.864 -18.013 1.00 0.00 H new ATOM 37 N SER A 5 11.548 -7.361 -17.356 1.00 0.00 N ATOM 38 CA SER A 5 12.422 -8.515 -17.532 1.00 0.00 C ATOM 39 C SER A 5 11.667 -9.675 -18.176 1.00 0.00 C ATOM 40 O SER A 5 10.469 -9.850 -17.955 1.00 0.00 O ATOM 41 CB SER A 5 13.000 -8.954 -16.186 1.00 0.00 C ATOM 42 OG SER A 5 13.716 -7.897 -15.570 1.00 0.00 O ATOM 0 H SER A 5 10.555 -7.588 -17.308 1.00 0.00 H new ATOM 0 HA SER A 5 13.239 -8.223 -18.192 1.00 0.00 H new ATOM 0 HB2 SER A 5 12.194 -9.282 -15.530 1.00 0.00 H new ATOM 0 HB3 SER A 5 13.661 -9.809 -16.332 1.00 0.00 H new ATOM 0 HG SER A 5 14.074 -8.202 -14.710 1.00 0.00 H new ATOM 48 N SER A 6 12.378 -10.464 -18.975 1.00 0.00 N ATOM 49 CA SER A 6 11.777 -11.605 -19.655 1.00 0.00 C ATOM 50 C SER A 6 11.969 -12.884 -18.846 1.00 0.00 C ATOM 51 O SER A 6 12.973 -13.580 -18.994 1.00 0.00 O ATOM 52 CB SER A 6 12.385 -11.774 -21.049 1.00 0.00 C ATOM 53 OG SER A 6 11.816 -10.857 -21.968 1.00 0.00 O ATOM 0 H SER A 6 13.371 -10.334 -19.167 1.00 0.00 H new ATOM 0 HA SER A 6 10.708 -11.415 -19.753 1.00 0.00 H new ATOM 0 HB2 SER A 6 13.463 -11.623 -21.000 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.222 -12.793 -21.399 1.00 0.00 H new ATOM 0 HG SER A 6 12.222 -10.984 -22.851 1.00 0.00 H new ATOM 59 N GLY A 7 10.999 -13.186 -17.989 1.00 0.00 N ATOM 60 CA GLY A 7 11.080 -14.380 -17.167 1.00 0.00 C ATOM 61 C GLY A 7 11.311 -14.062 -15.703 1.00 0.00 C ATOM 62 O GLY A 7 11.135 -12.922 -15.273 1.00 0.00 O ATOM 0 H GLY A 7 10.158 -12.626 -17.849 1.00 0.00 H new ATOM 0 HA2 GLY A 7 10.158 -14.952 -17.270 1.00 0.00 H new ATOM 0 HA3 GLY A 7 11.890 -15.013 -17.530 1.00 0.00 H new ATOM 66 N SER A 8 11.704 -15.073 -14.935 1.00 0.00 N ATOM 67 CA SER A 8 11.954 -14.896 -13.509 1.00 0.00 C ATOM 68 C SER A 8 13.103 -15.787 -13.045 1.00 0.00 C ATOM 69 O SER A 8 13.312 -16.878 -13.576 1.00 0.00 O ATOM 70 CB SER A 8 10.692 -15.213 -12.706 1.00 0.00 C ATOM 71 OG SER A 8 10.275 -16.551 -12.916 1.00 0.00 O ATOM 0 H SER A 8 11.856 -16.022 -15.276 1.00 0.00 H new ATOM 0 HA SER A 8 12.232 -13.856 -13.340 1.00 0.00 H new ATOM 0 HB2 SER A 8 10.882 -15.051 -11.645 1.00 0.00 H new ATOM 0 HB3 SER A 8 9.893 -14.530 -12.995 1.00 0.00 H new ATOM 0 HG SER A 8 9.467 -16.728 -12.390 1.00 0.00 H new ATOM 77 N LEU A 9 13.845 -15.313 -12.050 1.00 0.00 N ATOM 78 CA LEU A 9 14.974 -16.066 -11.512 1.00 0.00 C ATOM 79 C LEU A 9 15.038 -15.939 -9.994 1.00 0.00 C ATOM 80 O LEU A 9 14.432 -15.041 -9.410 1.00 0.00 O ATOM 81 CB LEU A 9 16.282 -15.573 -12.133 1.00 0.00 C ATOM 82 CG LEU A 9 16.350 -15.591 -13.660 1.00 0.00 C ATOM 83 CD1 LEU A 9 15.850 -14.273 -14.232 1.00 0.00 C ATOM 84 CD2 LEU A 9 17.770 -15.873 -14.128 1.00 0.00 C ATOM 0 H LEU A 9 13.686 -14.412 -11.600 1.00 0.00 H new ATOM 0 HA LEU A 9 14.833 -17.117 -11.764 1.00 0.00 H new ATOM 0 HB2 LEU A 9 16.460 -14.553 -11.794 1.00 0.00 H new ATOM 0 HB3 LEU A 9 17.097 -16.184 -11.746 1.00 0.00 H new ATOM 0 HG LEU A 9 15.704 -16.390 -14.024 1.00 0.00 H new ATOM 0 HD11 LEU A 9 15.906 -14.304 -15.320 1.00 0.00 H new ATOM 0 HD12 LEU A 9 14.816 -14.112 -13.926 1.00 0.00 H new ATOM 0 HD13 LEU A 9 16.469 -13.457 -13.860 1.00 0.00 H new ATOM 0 HD21 LEU A 9 17.799 -15.882 -15.218 1.00 0.00 H new ATOM 0 HD22 LEU A 9 18.437 -15.097 -13.754 1.00 0.00 H new ATOM 0 HD23 LEU A 9 18.092 -16.843 -13.748 1.00 0.00 H new ATOM 96 N GLU A 10 15.778 -16.844 -9.361 1.00 0.00 N ATOM 97 CA GLU A 10 15.922 -16.832 -7.910 1.00 0.00 C ATOM 98 C GLU A 10 17.292 -16.296 -7.504 1.00 0.00 C ATOM 99 O GLU A 10 18.297 -16.572 -8.158 1.00 0.00 O ATOM 100 CB GLU A 10 15.725 -18.240 -7.344 1.00 0.00 C ATOM 101 CG GLU A 10 14.281 -18.711 -7.373 1.00 0.00 C ATOM 102 CD GLU A 10 13.312 -17.654 -6.880 1.00 0.00 C ATOM 103 OE1 GLU A 10 12.958 -16.758 -7.675 1.00 0.00 O ATOM 104 OE2 GLU A 10 12.910 -17.722 -5.700 1.00 0.00 O ATOM 0 H GLU A 10 16.286 -17.594 -9.830 1.00 0.00 H new ATOM 0 HA GLU A 10 15.157 -16.173 -7.500 1.00 0.00 H new ATOM 0 HB2 GLU A 10 16.338 -18.940 -7.912 1.00 0.00 H new ATOM 0 HB3 GLU A 10 16.085 -18.263 -6.315 1.00 0.00 H new ATOM 0 HG2 GLU A 10 14.016 -18.995 -8.391 1.00 0.00 H new ATOM 0 HG3 GLU A 10 14.182 -19.605 -6.757 1.00 0.00 H new ATOM 111 N ASN A 11 17.323 -15.528 -6.419 1.00 0.00 N ATOM 112 CA ASN A 11 18.569 -14.952 -5.926 1.00 0.00 C ATOM 113 C ASN A 11 18.363 -14.299 -4.562 1.00 0.00 C ATOM 114 O ASN A 11 17.237 -14.192 -4.076 1.00 0.00 O ATOM 115 CB ASN A 11 19.108 -13.922 -6.921 1.00 0.00 C ATOM 116 CG ASN A 11 18.056 -12.911 -7.333 1.00 0.00 C ATOM 117 OD1 ASN A 11 18.057 -11.772 -6.866 1.00 0.00 O ATOM 118 ND2 ASN A 11 17.151 -13.324 -8.213 1.00 0.00 N ATOM 0 H ASN A 11 16.500 -15.290 -5.865 1.00 0.00 H new ATOM 0 HA ASN A 11 19.296 -15.757 -5.818 1.00 0.00 H new ATOM 0 HB2 ASN A 11 19.955 -13.400 -6.476 1.00 0.00 H new ATOM 0 HB3 ASN A 11 19.480 -14.437 -7.807 1.00 0.00 H new ATOM 0 HD21 ASN A 11 16.419 -12.688 -8.528 1.00 0.00 H new ATOM 0 HD22 ASN A 11 17.188 -14.277 -8.574 1.00 0.00 H new ATOM 125 N LEU A 12 19.459 -13.865 -3.950 1.00 0.00 N ATOM 126 CA LEU A 12 19.400 -13.221 -2.642 1.00 0.00 C ATOM 127 C LEU A 12 19.326 -11.705 -2.784 1.00 0.00 C ATOM 128 O LEU A 12 20.170 -11.090 -3.435 1.00 0.00 O ATOM 129 CB LEU A 12 20.622 -13.608 -1.806 1.00 0.00 C ATOM 130 CG LEU A 12 21.054 -12.598 -0.742 1.00 0.00 C ATOM 131 CD1 LEU A 12 20.122 -12.657 0.459 1.00 0.00 C ATOM 132 CD2 LEU A 12 22.492 -12.854 -0.316 1.00 0.00 C ATOM 0 H LEU A 12 20.399 -13.947 -4.338 1.00 0.00 H new ATOM 0 HA LEU A 12 18.498 -13.564 -2.136 1.00 0.00 H new ATOM 0 HB2 LEU A 12 20.414 -14.558 -1.314 1.00 0.00 H new ATOM 0 HB3 LEU A 12 21.461 -13.776 -2.481 1.00 0.00 H new ATOM 0 HG LEU A 12 20.996 -11.598 -1.173 1.00 0.00 H new ATOM 0 HD11 LEU A 12 20.445 -11.932 1.206 1.00 0.00 H new ATOM 0 HD12 LEU A 12 19.105 -12.424 0.142 1.00 0.00 H new ATOM 0 HD13 LEU A 12 20.147 -13.658 0.890 1.00 0.00 H new ATOM 0 HD21 LEU A 12 22.782 -12.126 0.441 1.00 0.00 H new ATOM 0 HD22 LEU A 12 22.576 -13.860 0.096 1.00 0.00 H new ATOM 0 HD23 LEU A 12 23.150 -12.760 -1.180 1.00 0.00 H new ATOM 144 N ALA A 13 18.311 -11.107 -2.169 1.00 0.00 N ATOM 145 CA ALA A 13 18.128 -9.662 -2.223 1.00 0.00 C ATOM 146 C ALA A 13 16.967 -9.222 -1.339 1.00 0.00 C ATOM 147 O ALA A 13 15.801 -9.410 -1.687 1.00 0.00 O ATOM 148 CB ALA A 13 17.902 -9.212 -3.659 1.00 0.00 C ATOM 0 H ALA A 13 17.602 -11.602 -1.627 1.00 0.00 H new ATOM 0 HA ALA A 13 19.036 -9.191 -1.845 1.00 0.00 H new ATOM 0 HB1 ALA A 13 17.767 -8.131 -3.684 1.00 0.00 H new ATOM 0 HB2 ALA A 13 18.766 -9.484 -4.266 1.00 0.00 H new ATOM 0 HB3 ALA A 13 17.011 -9.698 -4.057 1.00 0.00 H new ATOM 154 N THR A 14 17.292 -8.633 -0.192 1.00 0.00 N ATOM 155 CA THR A 14 16.275 -8.168 0.743 1.00 0.00 C ATOM 156 C THR A 14 15.975 -6.688 0.537 1.00 0.00 C ATOM 157 O THR A 14 15.797 -5.941 1.499 1.00 0.00 O ATOM 158 CB THR A 14 16.710 -8.393 2.204 1.00 0.00 C ATOM 159 OG1 THR A 14 17.185 -9.733 2.372 1.00 0.00 O ATOM 160 CG2 THR A 14 15.554 -8.135 3.158 1.00 0.00 C ATOM 0 H THR A 14 18.252 -8.467 0.111 1.00 0.00 H new ATOM 0 HA THR A 14 15.375 -8.750 0.546 1.00 0.00 H new ATOM 0 HB THR A 14 17.513 -7.692 2.434 1.00 0.00 H new ATOM 0 HG1 THR A 14 17.461 -9.868 3.303 1.00 0.00 H new ATOM 0 HG21 THR A 14 15.885 -8.300 4.183 1.00 0.00 H new ATOM 0 HG22 THR A 14 15.214 -7.105 3.048 1.00 0.00 H new ATOM 0 HG23 THR A 14 14.733 -8.815 2.928 1.00 0.00 H new ATOM 168 N ALA A 15 15.919 -6.270 -0.724 1.00 0.00 N ATOM 169 CA ALA A 15 15.637 -4.879 -1.056 1.00 0.00 C ATOM 170 C ALA A 15 14.375 -4.392 -0.353 1.00 0.00 C ATOM 171 O ALA A 15 13.572 -5.178 0.149 1.00 0.00 O ATOM 172 CB ALA A 15 15.503 -4.713 -2.562 1.00 0.00 C ATOM 0 H ALA A 15 16.065 -6.875 -1.532 1.00 0.00 H new ATOM 0 HA ALA A 15 16.472 -4.271 -0.708 1.00 0.00 H new ATOM 0 HB1 ALA A 15 15.292 -3.669 -2.796 1.00 0.00 H new ATOM 0 HB2 ALA A 15 16.433 -5.013 -3.045 1.00 0.00 H new ATOM 0 HB3 ALA A 15 14.687 -5.338 -2.926 1.00 0.00 H new ATOM 178 N PRO A 16 14.194 -3.063 -0.314 1.00 0.00 N ATOM 179 CA PRO A 16 13.031 -2.441 0.326 1.00 0.00 C ATOM 180 C PRO A 16 11.741 -2.693 -0.447 1.00 0.00 C ATOM 181 O PRO A 16 10.712 -3.033 0.136 1.00 0.00 O ATOM 182 CB PRO A 16 13.377 -0.950 0.319 1.00 0.00 C ATOM 183 CG PRO A 16 14.324 -0.787 -0.820 1.00 0.00 C ATOM 184 CD PRO A 16 15.111 -2.066 -0.891 1.00 0.00 C ATOM 0 HA PRO A 16 12.849 -2.845 1.322 1.00 0.00 H new ATOM 0 HB2 PRO A 16 12.486 -0.337 0.184 1.00 0.00 H new ATOM 0 HB3 PRO A 16 13.834 -0.645 1.261 1.00 0.00 H new ATOM 0 HG2 PRO A 16 13.787 -0.607 -1.751 1.00 0.00 H new ATOM 0 HG3 PRO A 16 14.982 0.068 -0.661 1.00 0.00 H new ATOM 0 HD2 PRO A 16 15.381 -2.315 -1.917 1.00 0.00 H new ATOM 0 HD3 PRO A 16 16.040 -1.999 -0.324 1.00 0.00 H new ATOM 192 N VAL A 17 11.803 -2.523 -1.764 1.00 0.00 N ATOM 193 CA VAL A 17 10.640 -2.733 -2.618 1.00 0.00 C ATOM 194 C VAL A 17 9.957 -4.059 -2.300 1.00 0.00 C ATOM 195 O VAL A 17 8.734 -4.128 -2.191 1.00 0.00 O ATOM 196 CB VAL A 17 11.026 -2.712 -4.109 1.00 0.00 C ATOM 197 CG1 VAL A 17 11.970 -3.860 -4.432 1.00 0.00 C ATOM 198 CG2 VAL A 17 9.782 -2.770 -4.982 1.00 0.00 C ATOM 0 H VAL A 17 12.647 -2.240 -2.263 1.00 0.00 H new ATOM 0 HA VAL A 17 9.949 -1.914 -2.418 1.00 0.00 H new ATOM 0 HB VAL A 17 11.545 -1.777 -4.320 1.00 0.00 H new ATOM 0 HG11 VAL A 17 12.232 -3.829 -5.490 1.00 0.00 H new ATOM 0 HG12 VAL A 17 12.875 -3.767 -3.831 1.00 0.00 H new ATOM 0 HG13 VAL A 17 11.481 -4.808 -4.207 1.00 0.00 H new ATOM 0 HG21 VAL A 17 10.073 -2.754 -6.032 1.00 0.00 H new ATOM 0 HG22 VAL A 17 9.232 -3.687 -4.772 1.00 0.00 H new ATOM 0 HG23 VAL A 17 9.147 -1.910 -4.769 1.00 0.00 H new ATOM 208 N ASN A 18 10.758 -5.110 -2.152 1.00 0.00 N ATOM 209 CA ASN A 18 10.231 -6.435 -1.846 1.00 0.00 C ATOM 210 C ASN A 18 9.306 -6.386 -0.634 1.00 0.00 C ATOM 211 O ASN A 18 8.196 -6.917 -0.667 1.00 0.00 O ATOM 212 CB ASN A 18 11.377 -7.415 -1.588 1.00 0.00 C ATOM 213 CG ASN A 18 12.378 -7.447 -2.727 1.00 0.00 C ATOM 214 OD1 ASN A 18 12.010 -7.335 -3.896 1.00 0.00 O ATOM 215 ND2 ASN A 18 13.653 -7.600 -2.388 1.00 0.00 N ATOM 0 H ASN A 18 11.773 -5.070 -2.239 1.00 0.00 H new ATOM 0 HA ASN A 18 9.656 -6.778 -2.706 1.00 0.00 H new ATOM 0 HB2 ASN A 18 11.888 -7.137 -0.666 1.00 0.00 H new ATOM 0 HB3 ASN A 18 10.970 -8.415 -1.438 1.00 0.00 H new ATOM 0 HD21 ASN A 18 14.373 -7.629 -3.110 1.00 0.00 H new ATOM 0 HD22 ASN A 18 13.912 -7.689 -1.406 1.00 0.00 H new ATOM 222 N GLN A 19 9.771 -5.745 0.433 1.00 0.00 N ATOM 223 CA GLN A 19 8.985 -5.628 1.655 1.00 0.00 C ATOM 224 C GLN A 19 7.614 -5.026 1.365 1.00 0.00 C ATOM 225 O GLN A 19 6.618 -5.399 1.987 1.00 0.00 O ATOM 226 CB GLN A 19 9.725 -4.768 2.682 1.00 0.00 C ATOM 227 CG GLN A 19 11.104 -5.299 3.039 1.00 0.00 C ATOM 228 CD GLN A 19 11.685 -4.631 4.270 1.00 0.00 C ATOM 229 OE1 GLN A 19 10.954 -4.115 5.114 1.00 0.00 O ATOM 230 NE2 GLN A 19 13.009 -4.639 4.378 1.00 0.00 N ATOM 0 H GLN A 19 10.687 -5.299 0.476 1.00 0.00 H new ATOM 0 HA GLN A 19 8.844 -6.629 2.063 1.00 0.00 H new ATOM 0 HB2 GLN A 19 9.825 -3.755 2.291 1.00 0.00 H new ATOM 0 HB3 GLN A 19 9.124 -4.702 3.589 1.00 0.00 H new ATOM 0 HG2 GLN A 19 11.043 -6.374 3.208 1.00 0.00 H new ATOM 0 HG3 GLN A 19 11.777 -5.147 2.196 1.00 0.00 H new ATOM 0 HE21 GLN A 19 13.577 -5.079 3.654 1.00 0.00 H new ATOM 0 HE22 GLN A 19 13.457 -4.206 5.185 1.00 0.00 H new ATOM 239 N ILE A 20 7.570 -4.095 0.419 1.00 0.00 N ATOM 240 CA ILE A 20 6.321 -3.443 0.046 1.00 0.00 C ATOM 241 C ILE A 20 5.453 -4.363 -0.807 1.00 0.00 C ATOM 242 O ILE A 20 4.244 -4.457 -0.601 1.00 0.00 O ATOM 243 CB ILE A 20 6.577 -2.135 -0.727 1.00 0.00 C ATOM 244 CG1 ILE A 20 7.379 -1.157 0.134 1.00 0.00 C ATOM 245 CG2 ILE A 20 5.259 -1.510 -1.160 1.00 0.00 C ATOM 246 CD1 ILE A 20 8.191 -0.169 -0.673 1.00 0.00 C ATOM 0 H ILE A 20 8.385 -3.775 -0.104 1.00 0.00 H new ATOM 0 HA ILE A 20 5.798 -3.211 0.974 1.00 0.00 H new ATOM 0 HB ILE A 20 7.159 -2.365 -1.620 1.00 0.00 H new ATOM 0 HG12 ILE A 20 6.694 -0.609 0.781 1.00 0.00 H new ATOM 0 HG13 ILE A 20 8.049 -1.721 0.783 1.00 0.00 H new ATOM 0 HG21 ILE A 20 5.456 -0.587 -1.705 1.00 0.00 H new ATOM 0 HG22 ILE A 20 4.722 -2.205 -1.805 1.00 0.00 H new ATOM 0 HG23 ILE A 20 4.654 -1.290 -0.280 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.734 0.493 0.002 1.00 0.00 H new ATOM 0 HD12 ILE A 20 8.900 -0.708 -1.301 1.00 0.00 H new ATOM 0 HD13 ILE A 20 7.525 0.421 -1.302 1.00 0.00 H new ATOM 258 N GLN A 21 6.081 -5.040 -1.763 1.00 0.00 N ATOM 259 CA GLN A 21 5.366 -5.954 -2.646 1.00 0.00 C ATOM 260 C GLN A 21 4.665 -7.047 -1.846 1.00 0.00 C ATOM 261 O GLN A 21 3.532 -7.420 -2.148 1.00 0.00 O ATOM 262 CB GLN A 21 6.330 -6.582 -3.653 1.00 0.00 C ATOM 263 CG GLN A 21 7.097 -5.561 -4.479 1.00 0.00 C ATOM 264 CD GLN A 21 7.545 -6.112 -5.819 1.00 0.00 C ATOM 265 OE1 GLN A 21 8.134 -7.191 -5.893 1.00 0.00 O ATOM 266 NE2 GLN A 21 7.267 -5.373 -6.886 1.00 0.00 N ATOM 0 H GLN A 21 7.082 -4.973 -1.946 1.00 0.00 H new ATOM 0 HA GLN A 21 4.611 -5.382 -3.185 1.00 0.00 H new ATOM 0 HB2 GLN A 21 7.041 -7.213 -3.119 1.00 0.00 H new ATOM 0 HB3 GLN A 21 5.769 -7.232 -4.324 1.00 0.00 H new ATOM 0 HG2 GLN A 21 6.469 -4.685 -4.642 1.00 0.00 H new ATOM 0 HG3 GLN A 21 7.970 -5.227 -3.918 1.00 0.00 H new ATOM 0 HE21 GLN A 21 6.777 -4.485 -6.778 1.00 0.00 H new ATOM 0 HE22 GLN A 21 7.543 -5.693 -7.814 1.00 0.00 H new ATOM 275 N GLU A 22 5.347 -7.557 -0.825 1.00 0.00 N ATOM 276 CA GLU A 22 4.789 -8.609 0.017 1.00 0.00 C ATOM 277 C GLU A 22 3.674 -8.062 0.903 1.00 0.00 C ATOM 278 O GLU A 22 2.643 -8.708 1.094 1.00 0.00 O ATOM 279 CB GLU A 22 5.884 -9.233 0.884 1.00 0.00 C ATOM 280 CG GLU A 22 6.458 -8.281 1.920 1.00 0.00 C ATOM 281 CD GLU A 22 7.411 -8.967 2.879 1.00 0.00 C ATOM 282 OE1 GLU A 22 8.494 -9.399 2.432 1.00 0.00 O ATOM 283 OE2 GLU A 22 7.073 -9.071 4.077 1.00 0.00 O ATOM 0 H GLU A 22 6.286 -7.259 -0.561 1.00 0.00 H new ATOM 0 HA GLU A 22 4.369 -9.376 -0.634 1.00 0.00 H new ATOM 0 HB2 GLU A 22 5.479 -10.108 1.392 1.00 0.00 H new ATOM 0 HB3 GLU A 22 6.690 -9.584 0.239 1.00 0.00 H new ATOM 0 HG2 GLU A 22 6.981 -7.470 1.413 1.00 0.00 H new ATOM 0 HG3 GLU A 22 5.642 -7.830 2.485 1.00 0.00 H new ATOM 290 N THR A 23 3.887 -6.865 1.442 1.00 0.00 N ATOM 291 CA THR A 23 2.902 -6.231 2.309 1.00 0.00 C ATOM 292 C THR A 23 1.560 -6.083 1.600 1.00 0.00 C ATOM 293 O THR A 23 0.521 -6.476 2.131 1.00 0.00 O ATOM 294 CB THR A 23 3.377 -4.843 2.779 1.00 0.00 C ATOM 295 OG1 THR A 23 4.650 -4.955 3.425 1.00 0.00 O ATOM 296 CG2 THR A 23 2.370 -4.221 3.735 1.00 0.00 C ATOM 0 H THR A 23 4.733 -6.316 1.293 1.00 0.00 H new ATOM 0 HA THR A 23 2.782 -6.879 3.177 1.00 0.00 H new ATOM 0 HB THR A 23 3.469 -4.199 1.905 1.00 0.00 H new ATOM 0 HG1 THR A 23 5.351 -5.068 2.749 1.00 0.00 H new ATOM 0 HG21 THR A 23 2.727 -3.242 4.053 1.00 0.00 H new ATOM 0 HG22 THR A 23 1.410 -4.111 3.231 1.00 0.00 H new ATOM 0 HG23 THR A 23 2.250 -4.864 4.607 1.00 0.00 H new ATOM 304 N ILE A 24 1.590 -5.515 0.399 1.00 0.00 N ATOM 305 CA ILE A 24 0.376 -5.317 -0.382 1.00 0.00 C ATOM 306 C ILE A 24 -0.322 -6.644 -0.659 1.00 0.00 C ATOM 307 O ILE A 24 -1.550 -6.728 -0.635 1.00 0.00 O ATOM 308 CB ILE A 24 0.676 -4.619 -1.722 1.00 0.00 C ATOM 309 CG1 ILE A 24 1.692 -5.429 -2.528 1.00 0.00 C ATOM 310 CG2 ILE A 24 1.189 -3.207 -1.479 1.00 0.00 C ATOM 311 CD1 ILE A 24 1.897 -4.913 -3.935 1.00 0.00 C ATOM 0 H ILE A 24 2.442 -5.184 -0.054 1.00 0.00 H new ATOM 0 HA ILE A 24 -0.280 -4.680 0.211 1.00 0.00 H new ATOM 0 HB ILE A 24 -0.248 -4.556 -2.297 1.00 0.00 H new ATOM 0 HG12 ILE A 24 2.648 -5.422 -2.004 1.00 0.00 H new ATOM 0 HG13 ILE A 24 1.362 -6.467 -2.575 1.00 0.00 H new ATOM 0 HG21 ILE A 24 1.397 -2.726 -2.435 1.00 0.00 H new ATOM 0 HG22 ILE A 24 0.435 -2.633 -0.940 1.00 0.00 H new ATOM 0 HG23 ILE A 24 2.104 -3.249 -0.887 1.00 0.00 H new ATOM 0 HD11 ILE A 24 2.630 -5.535 -4.448 1.00 0.00 H new ATOM 0 HD12 ILE A 24 0.951 -4.946 -4.476 1.00 0.00 H new ATOM 0 HD13 ILE A 24 2.257 -3.885 -3.897 1.00 0.00 H new ATOM 323 N SER A 25 0.469 -7.680 -0.920 1.00 0.00 N ATOM 324 CA SER A 25 -0.072 -9.004 -1.203 1.00 0.00 C ATOM 325 C SER A 25 -0.709 -9.608 0.045 1.00 0.00 C ATOM 326 O SER A 25 -1.825 -10.126 -0.003 1.00 0.00 O ATOM 327 CB SER A 25 1.030 -9.927 -1.726 1.00 0.00 C ATOM 328 OG SER A 25 1.443 -9.543 -3.026 1.00 0.00 O ATOM 0 H SER A 25 1.487 -7.628 -0.941 1.00 0.00 H new ATOM 0 HA SER A 25 -0.841 -8.900 -1.968 1.00 0.00 H new ATOM 0 HB2 SER A 25 1.883 -9.901 -1.048 1.00 0.00 H new ATOM 0 HB3 SER A 25 0.669 -10.955 -1.745 1.00 0.00 H new ATOM 0 HG SER A 25 2.130 -8.848 -2.959 1.00 0.00 H new ATOM 334 N ASP A 26 0.009 -9.539 1.160 1.00 0.00 N ATOM 335 CA ASP A 26 -0.485 -10.079 2.422 1.00 0.00 C ATOM 336 C ASP A 26 -1.675 -9.271 2.930 1.00 0.00 C ATOM 337 O ASP A 26 -2.781 -9.792 3.060 1.00 0.00 O ATOM 338 CB ASP A 26 0.629 -10.083 3.470 1.00 0.00 C ATOM 339 CG ASP A 26 1.476 -11.339 3.410 1.00 0.00 C ATOM 340 OD1 ASP A 26 0.907 -12.426 3.179 1.00 0.00 O ATOM 341 OD2 ASP A 26 2.706 -11.236 3.596 1.00 0.00 O ATOM 0 H ASP A 26 0.935 -9.115 1.216 1.00 0.00 H new ATOM 0 HA ASP A 26 -0.813 -11.104 2.247 1.00 0.00 H new ATOM 0 HB2 ASP A 26 1.266 -9.211 3.322 1.00 0.00 H new ATOM 0 HB3 ASP A 26 0.190 -9.992 4.463 1.00 0.00 H new ATOM 346 N ASN A 27 -1.438 -7.994 3.216 1.00 0.00 N ATOM 347 CA ASN A 27 -2.490 -7.114 3.711 1.00 0.00 C ATOM 348 C ASN A 27 -3.503 -6.805 2.613 1.00 0.00 C ATOM 349 O ASN A 27 -3.315 -7.183 1.456 1.00 0.00 O ATOM 350 CB ASN A 27 -1.887 -5.814 4.245 1.00 0.00 C ATOM 351 CG ASN A 27 -1.114 -6.021 5.534 1.00 0.00 C ATOM 352 OD1 ASN A 27 -1.570 -5.640 6.612 1.00 0.00 O ATOM 353 ND2 ASN A 27 0.062 -6.627 5.427 1.00 0.00 N ATOM 0 H ASN A 27 -0.527 -7.546 3.113 1.00 0.00 H new ATOM 0 HA ASN A 27 -3.006 -7.627 4.522 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -1.224 -5.388 3.492 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -2.684 -5.090 4.415 1.00 0.00 H new ATOM 0 HD21 ASN A 27 0.627 -6.794 6.259 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.400 -6.926 4.512 1.00 0.00 H new ATOM 360 N CYS A 28 -4.576 -6.115 2.982 1.00 0.00 N ATOM 361 CA CYS A 28 -5.619 -5.753 2.030 1.00 0.00 C ATOM 362 C CYS A 28 -5.370 -4.363 1.452 1.00 0.00 C ATOM 363 O CYS A 28 -5.390 -4.171 0.236 1.00 0.00 O ATOM 364 CB CYS A 28 -6.992 -5.800 2.703 1.00 0.00 C ATOM 365 SG CYS A 28 -7.360 -7.379 3.534 1.00 0.00 S ATOM 0 H CYS A 28 -4.746 -5.795 3.935 1.00 0.00 H new ATOM 0 HA CYS A 28 -5.597 -6.475 1.214 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -7.054 -4.994 3.434 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -7.759 -5.609 1.953 1.00 0.00 H new ATOM 370 N VAL A 29 -5.136 -3.395 2.333 1.00 0.00 N ATOM 371 CA VAL A 29 -4.882 -2.023 1.912 1.00 0.00 C ATOM 372 C VAL A 29 -3.679 -1.438 2.643 1.00 0.00 C ATOM 373 O VAL A 29 -3.614 -1.459 3.872 1.00 0.00 O ATOM 374 CB VAL A 29 -6.107 -1.123 2.161 1.00 0.00 C ATOM 375 CG1 VAL A 29 -5.821 0.304 1.719 1.00 0.00 C ATOM 376 CG2 VAL A 29 -7.329 -1.677 1.443 1.00 0.00 C ATOM 0 H VAL A 29 -5.117 -3.536 3.343 1.00 0.00 H new ATOM 0 HA VAL A 29 -4.675 -2.054 0.842 1.00 0.00 H new ATOM 0 HB VAL A 29 -6.316 -1.111 3.231 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.698 0.925 1.903 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.974 0.697 2.282 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.585 0.315 0.655 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -8.185 -1.029 1.630 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -7.133 -1.720 0.372 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -7.545 -2.679 1.813 1.00 0.00 H new ATOM 386 N VAL A 30 -2.726 -0.914 1.878 1.00 0.00 N ATOM 387 CA VAL A 30 -1.524 -0.321 2.452 1.00 0.00 C ATOM 388 C VAL A 30 -1.345 1.119 1.984 1.00 0.00 C ATOM 389 O VAL A 30 -1.075 1.372 0.810 1.00 0.00 O ATOM 390 CB VAL A 30 -0.267 -1.129 2.081 1.00 0.00 C ATOM 391 CG1 VAL A 30 0.972 -0.506 2.705 1.00 0.00 C ATOM 392 CG2 VAL A 30 -0.419 -2.580 2.514 1.00 0.00 C ATOM 0 H VAL A 30 -2.763 -0.888 0.859 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.650 -0.336 3.535 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.149 -1.107 0.998 1.00 0.00 H new ATOM 0 HG11 VAL A 30 1.850 -1.091 2.432 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.088 0.515 2.341 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.867 -0.495 3.790 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.479 -3.136 2.244 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.562 -2.624 3.594 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.282 -3.020 2.015 1.00 0.00 H new ATOM 402 N ILE A 31 -1.497 2.059 2.911 1.00 0.00 N ATOM 403 CA ILE A 31 -1.351 3.474 2.594 1.00 0.00 C ATOM 404 C ILE A 31 0.039 3.980 2.965 1.00 0.00 C ATOM 405 O ILE A 31 0.494 3.804 4.096 1.00 0.00 O ATOM 406 CB ILE A 31 -2.406 4.327 3.323 1.00 0.00 C ATOM 407 CG1 ILE A 31 -3.810 3.780 3.054 1.00 0.00 C ATOM 408 CG2 ILE A 31 -2.305 5.781 2.888 1.00 0.00 C ATOM 409 CD1 ILE A 31 -4.819 4.157 4.116 1.00 0.00 C ATOM 0 H ILE A 31 -1.721 1.866 3.887 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.496 3.572 1.518 1.00 0.00 H new ATOM 0 HB ILE A 31 -2.216 4.276 4.395 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -4.156 4.149 2.088 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.760 2.694 2.981 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -3.057 6.371 3.412 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -1.313 6.164 3.126 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -2.473 5.852 1.813 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.791 3.736 3.860 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -4.496 3.765 5.080 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -4.898 5.243 4.174 1.00 0.00 H new ATOM 421 N PHE A 32 0.709 4.610 2.006 1.00 0.00 N ATOM 422 CA PHE A 32 2.048 5.142 2.231 1.00 0.00 C ATOM 423 C PHE A 32 2.031 6.668 2.247 1.00 0.00 C ATOM 424 O PHE A 32 1.730 7.306 1.239 1.00 0.00 O ATOM 425 CB PHE A 32 3.008 4.642 1.149 1.00 0.00 C ATOM 426 CG PHE A 32 3.305 3.173 1.243 1.00 0.00 C ATOM 427 CD1 PHE A 32 4.103 2.678 2.262 1.00 0.00 C ATOM 428 CD2 PHE A 32 2.787 2.287 0.312 1.00 0.00 C ATOM 429 CE1 PHE A 32 4.378 1.326 2.351 1.00 0.00 C ATOM 430 CE2 PHE A 32 3.058 0.935 0.397 1.00 0.00 C ATOM 431 CZ PHE A 32 3.856 0.454 1.417 1.00 0.00 C ATOM 0 H PHE A 32 0.347 4.765 1.065 1.00 0.00 H new ATOM 0 HA PHE A 32 2.393 4.790 3.203 1.00 0.00 H new ATOM 0 HB2 PHE A 32 2.581 4.856 0.169 1.00 0.00 H new ATOM 0 HB3 PHE A 32 3.943 5.199 1.218 1.00 0.00 H new ATOM 0 HD1 PHE A 32 4.515 3.356 2.995 1.00 0.00 H new ATOM 0 HD2 PHE A 32 2.164 2.658 -0.489 1.00 0.00 H new ATOM 0 HE1 PHE A 32 5.001 0.953 3.151 1.00 0.00 H new ATOM 0 HE2 PHE A 32 2.646 0.254 -0.334 1.00 0.00 H new ATOM 0 HZ PHE A 32 4.071 -0.602 1.483 1.00 0.00 H new ATOM 441 N SER A 33 2.356 7.245 3.399 1.00 0.00 N ATOM 442 CA SER A 33 2.374 8.696 3.549 1.00 0.00 C ATOM 443 C SER A 33 3.694 9.163 4.155 1.00 0.00 C ATOM 444 O SER A 33 4.342 8.429 4.902 1.00 0.00 O ATOM 445 CB SER A 33 1.207 9.154 4.425 1.00 0.00 C ATOM 446 OG SER A 33 1.487 8.944 5.799 1.00 0.00 O ATOM 0 H SER A 33 2.610 6.731 4.242 1.00 0.00 H new ATOM 0 HA SER A 33 2.271 9.140 2.559 1.00 0.00 H new ATOM 0 HB2 SER A 33 1.009 10.211 4.249 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.304 8.610 4.147 1.00 0.00 H new ATOM 0 HG SER A 33 0.726 9.246 6.338 1.00 0.00 H new ATOM 452 N LYS A 34 4.087 10.389 3.828 1.00 0.00 N ATOM 453 CA LYS A 34 5.328 10.957 4.340 1.00 0.00 C ATOM 454 C LYS A 34 5.052 12.200 5.181 1.00 0.00 C ATOM 455 O LYS A 34 5.840 13.145 5.189 1.00 0.00 O ATOM 456 CB LYS A 34 6.266 11.310 3.184 1.00 0.00 C ATOM 457 CG LYS A 34 5.727 12.399 2.273 1.00 0.00 C ATOM 458 CD LYS A 34 6.849 13.144 1.570 1.00 0.00 C ATOM 459 CE LYS A 34 6.344 13.876 0.336 1.00 0.00 C ATOM 460 NZ LYS A 34 7.276 14.958 -0.087 1.00 0.00 N ATOM 0 H LYS A 34 3.563 11.009 3.210 1.00 0.00 H new ATOM 0 HA LYS A 34 5.806 10.210 4.973 1.00 0.00 H new ATOM 0 HB2 LYS A 34 7.225 11.630 3.591 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.454 10.414 2.593 1.00 0.00 H new ATOM 0 HG2 LYS A 34 5.061 11.958 1.531 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.132 13.102 2.857 1.00 0.00 H new ATOM 0 HD2 LYS A 34 7.301 13.858 2.259 1.00 0.00 H new ATOM 0 HD3 LYS A 34 7.630 12.440 1.283 1.00 0.00 H new ATOM 0 HE2 LYS A 34 6.217 13.166 -0.481 1.00 0.00 H new ATOM 0 HE3 LYS A 34 5.362 14.302 0.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 6.896 15.433 -0.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 7.378 15.649 0.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.206 14.548 -0.309 1.00 0.00 H new ATOM 474 N THR A 35 3.927 12.191 5.890 1.00 0.00 N ATOM 475 CA THR A 35 3.547 13.316 6.735 1.00 0.00 C ATOM 476 C THR A 35 4.006 14.638 6.129 1.00 0.00 C ATOM 477 O THR A 35 4.580 15.481 6.818 1.00 0.00 O ATOM 478 CB THR A 35 4.138 13.181 8.151 1.00 0.00 C ATOM 479 OG1 THR A 35 5.557 13.004 8.074 1.00 0.00 O ATOM 480 CG2 THR A 35 3.515 12.005 8.887 1.00 0.00 C ATOM 0 H THR A 35 3.263 11.417 5.895 1.00 0.00 H new ATOM 0 HA THR A 35 2.459 13.308 6.802 1.00 0.00 H new ATOM 0 HB THR A 35 3.915 14.094 8.703 1.00 0.00 H new ATOM 0 HG1 THR A 35 5.926 12.921 8.978 1.00 0.00 H new ATOM 0 HG21 THR A 35 3.948 11.929 9.885 1.00 0.00 H new ATOM 0 HG22 THR A 35 2.439 12.156 8.969 1.00 0.00 H new ATOM 0 HG23 THR A 35 3.711 11.085 8.336 1.00 0.00 H new ATOM 488 N SER A 36 3.749 14.812 4.837 1.00 0.00 N ATOM 489 CA SER A 36 4.138 16.031 4.137 1.00 0.00 C ATOM 490 C SER A 36 2.956 16.621 3.374 1.00 0.00 C ATOM 491 O SER A 36 2.711 17.827 3.424 1.00 0.00 O ATOM 492 CB SER A 36 5.291 15.744 3.173 1.00 0.00 C ATOM 493 OG SER A 36 6.397 15.178 3.854 1.00 0.00 O ATOM 0 H SER A 36 3.273 14.124 4.253 1.00 0.00 H new ATOM 0 HA SER A 36 4.467 16.758 4.880 1.00 0.00 H new ATOM 0 HB2 SER A 36 4.954 15.063 2.391 1.00 0.00 H new ATOM 0 HB3 SER A 36 5.597 16.668 2.682 1.00 0.00 H new ATOM 0 HG SER A 36 6.153 14.293 4.196 1.00 0.00 H new ATOM 499 N CYS A 37 2.228 15.762 2.669 1.00 0.00 N ATOM 500 CA CYS A 37 1.072 16.197 1.893 1.00 0.00 C ATOM 501 C CYS A 37 -0.213 16.045 2.701 1.00 0.00 C ATOM 502 O CYS A 37 -0.479 14.985 3.268 1.00 0.00 O ATOM 503 CB CYS A 37 0.971 15.395 0.595 1.00 0.00 C ATOM 504 SG CYS A 37 0.093 16.249 -0.734 1.00 0.00 S ATOM 0 H CYS A 37 2.418 14.761 2.619 1.00 0.00 H new ATOM 0 HA CYS A 37 1.204 17.251 1.650 1.00 0.00 H new ATOM 0 HB2 CYS A 37 1.976 15.150 0.253 1.00 0.00 H new ATOM 0 HB3 CYS A 37 0.466 14.451 0.802 1.00 0.00 H new ATOM 0 HG CYS A 37 0.061 15.492 -1.790 1.00 0.00 H new ATOM 510 N SER A 38 -1.005 17.111 2.750 1.00 0.00 N ATOM 511 CA SER A 38 -2.260 17.097 3.493 1.00 0.00 C ATOM 512 C SER A 38 -2.998 15.778 3.289 1.00 0.00 C ATOM 513 O SER A 38 -3.374 15.108 4.252 1.00 0.00 O ATOM 514 CB SER A 38 -3.148 18.264 3.057 1.00 0.00 C ATOM 515 OG SER A 38 -4.472 18.105 3.537 1.00 0.00 O ATOM 0 H SER A 38 -0.800 17.995 2.284 1.00 0.00 H new ATOM 0 HA SER A 38 -2.027 17.203 4.553 1.00 0.00 H new ATOM 0 HB2 SER A 38 -2.733 19.200 3.430 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.158 18.331 1.969 1.00 0.00 H new ATOM 0 HG SER A 38 -5.019 18.864 3.246 1.00 0.00 H new ATOM 521 N TYR A 39 -3.202 15.410 2.029 1.00 0.00 N ATOM 522 CA TYR A 39 -3.897 14.172 1.697 1.00 0.00 C ATOM 523 C TYR A 39 -3.567 13.075 2.704 1.00 0.00 C ATOM 524 O TYR A 39 -4.425 12.267 3.063 1.00 0.00 O ATOM 525 CB TYR A 39 -3.522 13.715 0.286 1.00 0.00 C ATOM 526 CG TYR A 39 -4.141 14.556 -0.807 1.00 0.00 C ATOM 527 CD1 TYR A 39 -5.520 14.618 -0.967 1.00 0.00 C ATOM 528 CD2 TYR A 39 -3.346 15.289 -1.680 1.00 0.00 C ATOM 529 CE1 TYR A 39 -6.089 15.385 -1.966 1.00 0.00 C ATOM 530 CE2 TYR A 39 -3.907 16.059 -2.681 1.00 0.00 C ATOM 531 CZ TYR A 39 -5.278 16.104 -2.819 1.00 0.00 C ATOM 532 OH TYR A 39 -5.842 16.869 -3.814 1.00 0.00 O ATOM 0 H TYR A 39 -2.896 15.952 1.221 1.00 0.00 H new ATOM 0 HA TYR A 39 -4.969 14.365 1.736 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -2.437 13.739 0.181 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -3.832 12.678 0.155 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -6.158 14.057 -0.300 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -2.272 15.256 -1.574 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -7.163 15.421 -2.078 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -3.275 16.622 -3.351 1.00 0.00 H new ATOM 0 HH TYR A 39 -5.134 17.313 -4.326 1.00 0.00 H new ATOM 542 N CYS A 40 -2.318 13.053 3.157 1.00 0.00 N ATOM 543 CA CYS A 40 -1.872 12.055 4.123 1.00 0.00 C ATOM 544 C CYS A 40 -2.995 11.695 5.090 1.00 0.00 C ATOM 545 O CYS A 40 -3.217 10.522 5.393 1.00 0.00 O ATOM 546 CB CYS A 40 -0.660 12.573 4.899 1.00 0.00 C ATOM 547 SG CYS A 40 -0.985 14.068 5.863 1.00 0.00 S ATOM 0 H CYS A 40 -1.596 13.715 2.871 1.00 0.00 H new ATOM 0 HA CYS A 40 -1.587 11.157 3.576 1.00 0.00 H new ATOM 0 HB2 CYS A 40 -0.310 11.789 5.571 1.00 0.00 H new ATOM 0 HB3 CYS A 40 0.149 12.775 4.196 1.00 0.00 H new ATOM 0 HG CYS A 40 -0.912 15.109 5.087 1.00 0.00 H new ATOM 553 N THR A 41 -3.702 12.713 5.574 1.00 0.00 N ATOM 554 CA THR A 41 -4.800 12.504 6.509 1.00 0.00 C ATOM 555 C THR A 41 -6.042 11.987 5.792 1.00 0.00 C ATOM 556 O THR A 41 -6.696 11.056 6.259 1.00 0.00 O ATOM 557 CB THR A 41 -5.155 13.804 7.256 1.00 0.00 C ATOM 558 OG1 THR A 41 -6.047 13.517 8.339 1.00 0.00 O ATOM 559 CG2 THR A 41 -5.799 14.810 6.315 1.00 0.00 C ATOM 0 H THR A 41 -3.533 13.690 5.333 1.00 0.00 H new ATOM 0 HA THR A 41 -4.465 11.759 7.230 1.00 0.00 H new ATOM 0 HB THR A 41 -4.234 14.236 7.648 1.00 0.00 H new ATOM 0 HG1 THR A 41 -6.267 14.348 8.810 1.00 0.00 H new ATOM 0 HG21 THR A 41 -6.041 15.720 6.865 1.00 0.00 H new ATOM 0 HG22 THR A 41 -5.107 15.048 5.507 1.00 0.00 H new ATOM 0 HG23 THR A 41 -6.712 14.385 5.897 1.00 0.00 H new ATOM 567 N MET A 42 -6.360 12.598 4.656 1.00 0.00 N ATOM 568 CA MET A 42 -7.524 12.197 3.873 1.00 0.00 C ATOM 569 C MET A 42 -7.649 10.677 3.825 1.00 0.00 C ATOM 570 O MET A 42 -8.718 10.125 4.085 1.00 0.00 O ATOM 571 CB MET A 42 -7.429 12.758 2.453 1.00 0.00 C ATOM 572 CG MET A 42 -8.059 14.132 2.299 1.00 0.00 C ATOM 573 SD MET A 42 -8.556 14.482 0.602 1.00 0.00 S ATOM 574 CE MET A 42 -9.793 13.213 0.342 1.00 0.00 C ATOM 0 H MET A 42 -5.829 13.372 4.257 1.00 0.00 H new ATOM 0 HA MET A 42 -8.413 12.602 4.356 1.00 0.00 H new ATOM 0 HB2 MET A 42 -6.380 12.814 2.163 1.00 0.00 H new ATOM 0 HB3 MET A 42 -7.914 12.066 1.765 1.00 0.00 H new ATOM 0 HG2 MET A 42 -8.930 14.203 2.951 1.00 0.00 H new ATOM 0 HG3 MET A 42 -7.351 14.891 2.630 1.00 0.00 H new ATOM 0 HE1 MET A 42 -10.549 13.579 -0.353 1.00 0.00 H new ATOM 0 HE2 MET A 42 -9.320 12.323 -0.072 1.00 0.00 H new ATOM 0 HE3 MET A 42 -10.264 12.964 1.293 1.00 0.00 H new ATOM 584 N ALA A 43 -6.551 10.008 3.490 1.00 0.00 N ATOM 585 CA ALA A 43 -6.538 8.553 3.409 1.00 0.00 C ATOM 586 C ALA A 43 -6.934 7.926 4.742 1.00 0.00 C ATOM 587 O ALA A 43 -7.888 7.151 4.817 1.00 0.00 O ATOM 588 CB ALA A 43 -5.165 8.060 2.979 1.00 0.00 C ATOM 0 H ALA A 43 -5.659 10.451 3.270 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.271 8.249 2.662 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.170 6.971 2.923 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.920 8.473 2.000 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.419 8.382 3.705 1.00 0.00 H new ATOM 594 N LYS A 44 -6.195 8.264 5.793 1.00 0.00 N ATOM 595 CA LYS A 44 -6.468 7.735 7.124 1.00 0.00 C ATOM 596 C LYS A 44 -7.929 7.952 7.506 1.00 0.00 C ATOM 597 O LYS A 44 -8.638 7.006 7.850 1.00 0.00 O ATOM 598 CB LYS A 44 -5.556 8.401 8.156 1.00 0.00 C ATOM 599 CG LYS A 44 -4.076 8.237 7.856 1.00 0.00 C ATOM 600 CD LYS A 44 -3.247 9.317 8.532 1.00 0.00 C ATOM 601 CE LYS A 44 -1.777 8.931 8.598 1.00 0.00 C ATOM 602 NZ LYS A 44 -1.522 7.895 9.637 1.00 0.00 N ATOM 0 H LYS A 44 -5.401 8.903 5.749 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.269 6.663 7.110 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -5.793 9.464 8.205 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.767 7.982 9.140 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -3.742 7.256 8.194 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -3.916 8.275 6.779 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -3.354 10.254 7.986 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -3.625 9.490 9.540 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -1.456 8.557 7.626 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -1.178 9.816 8.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -0.540 7.561 9.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -1.676 8.304 10.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -2.172 7.095 9.496 1.00 0.00 H new ATOM 616 N LYS A 45 -8.373 9.202 7.442 1.00 0.00 N ATOM 617 CA LYS A 45 -9.751 9.543 7.778 1.00 0.00 C ATOM 618 C LYS A 45 -10.732 8.750 6.921 1.00 0.00 C ATOM 619 O LYS A 45 -11.708 8.196 7.429 1.00 0.00 O ATOM 620 CB LYS A 45 -9.987 11.043 7.587 1.00 0.00 C ATOM 621 CG LYS A 45 -9.663 11.871 8.818 1.00 0.00 C ATOM 622 CD LYS A 45 -9.965 13.344 8.595 1.00 0.00 C ATOM 623 CE LYS A 45 -9.964 14.118 9.905 1.00 0.00 C ATOM 624 NZ LYS A 45 -11.255 13.976 10.634 1.00 0.00 N ATOM 0 H LYS A 45 -7.799 9.997 7.160 1.00 0.00 H new ATOM 0 HA LYS A 45 -9.919 9.285 8.824 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -9.380 11.395 6.753 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -11.029 11.206 7.314 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -10.241 11.505 9.666 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -8.610 11.749 9.073 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -9.224 13.770 7.919 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -10.936 13.448 8.110 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -9.149 13.763 10.536 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -9.775 15.172 9.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -11.214 14.518 11.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -12.030 14.338 10.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -11.424 12.973 10.849 1.00 0.00 H new ATOM 638 N LEU A 46 -10.467 8.698 5.621 1.00 0.00 N ATOM 639 CA LEU A 46 -11.327 7.970 4.693 1.00 0.00 C ATOM 640 C LEU A 46 -11.620 6.565 5.211 1.00 0.00 C ATOM 641 O LEU A 46 -12.770 6.221 5.486 1.00 0.00 O ATOM 642 CB LEU A 46 -10.671 7.891 3.314 1.00 0.00 C ATOM 643 CG LEU A 46 -11.282 6.887 2.336 1.00 0.00 C ATOM 644 CD1 LEU A 46 -12.625 7.385 1.828 1.00 0.00 C ATOM 645 CD2 LEU A 46 -10.333 6.628 1.175 1.00 0.00 C ATOM 0 H LEU A 46 -9.664 9.151 5.185 1.00 0.00 H new ATOM 0 HA LEU A 46 -12.270 8.511 4.609 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -10.709 8.881 2.859 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -9.618 7.642 3.448 1.00 0.00 H new ATOM 0 HG LEU A 46 -11.443 5.947 2.864 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -13.044 6.657 1.133 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -13.306 7.518 2.669 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -12.490 8.338 1.317 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -10.784 5.911 0.489 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -10.139 7.562 0.648 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -9.394 6.225 1.555 1.00 0.00 H new ATOM 657 N PHE A 47 -10.573 5.758 5.342 1.00 0.00 N ATOM 658 CA PHE A 47 -10.717 4.391 5.828 1.00 0.00 C ATOM 659 C PHE A 47 -11.265 4.375 7.252 1.00 0.00 C ATOM 660 O PHE A 47 -12.200 3.636 7.562 1.00 0.00 O ATOM 661 CB PHE A 47 -9.372 3.665 5.778 1.00 0.00 C ATOM 662 CG PHE A 47 -8.938 3.301 4.387 1.00 0.00 C ATOM 663 CD1 PHE A 47 -9.393 2.139 3.786 1.00 0.00 C ATOM 664 CD2 PHE A 47 -8.074 4.122 3.680 1.00 0.00 C ATOM 665 CE1 PHE A 47 -8.996 1.802 2.506 1.00 0.00 C ATOM 666 CE2 PHE A 47 -7.673 3.790 2.399 1.00 0.00 C ATOM 667 CZ PHE A 47 -8.134 2.628 1.812 1.00 0.00 C ATOM 0 H PHE A 47 -9.615 6.027 5.118 1.00 0.00 H new ATOM 0 HA PHE A 47 -11.425 3.874 5.180 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -8.610 4.297 6.234 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -9.435 2.758 6.379 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -10.066 1.488 4.324 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -7.710 5.031 4.135 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -9.360 0.894 2.049 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -7.000 4.439 1.858 1.00 0.00 H new ATOM 0 HZ PHE A 47 -7.821 2.366 0.812 1.00 0.00 H new ATOM 677 N HIS A 48 -10.674 5.195 8.116 1.00 0.00 N ATOM 678 CA HIS A 48 -11.102 5.276 9.508 1.00 0.00 C ATOM 679 C HIS A 48 -12.620 5.392 9.604 1.00 0.00 C ATOM 680 O HIS A 48 -13.266 4.636 10.331 1.00 0.00 O ATOM 681 CB HIS A 48 -10.443 6.470 10.198 1.00 0.00 C ATOM 682 CG HIS A 48 -10.474 6.391 11.693 1.00 0.00 C ATOM 683 ND1 HIS A 48 -9.584 7.066 12.501 1.00 0.00 N ATOM 684 CD2 HIS A 48 -11.297 5.713 12.526 1.00 0.00 C ATOM 685 CE1 HIS A 48 -9.856 6.804 13.767 1.00 0.00 C ATOM 686 NE2 HIS A 48 -10.892 5.986 13.810 1.00 0.00 N ATOM 0 H HIS A 48 -9.898 5.812 7.877 1.00 0.00 H new ATOM 0 HA HIS A 48 -10.793 4.360 10.011 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -9.407 6.543 9.868 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -10.944 7.384 9.880 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -12.119 5.076 12.236 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -9.322 7.193 14.621 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -11.321 5.617 14.658 1.00 0.00 H new ATOM 694 N ASP A 49 -13.183 6.343 8.868 1.00 0.00 N ATOM 695 CA ASP A 49 -14.626 6.559 8.870 1.00 0.00 C ATOM 696 C ASP A 49 -15.360 5.328 8.346 1.00 0.00 C ATOM 697 O ASP A 49 -16.450 4.998 8.812 1.00 0.00 O ATOM 698 CB ASP A 49 -14.982 7.780 8.020 1.00 0.00 C ATOM 699 CG ASP A 49 -16.284 8.426 8.452 1.00 0.00 C ATOM 700 OD1 ASP A 49 -16.483 8.602 9.673 1.00 0.00 O ATOM 701 OD2 ASP A 49 -17.103 8.756 7.570 1.00 0.00 O ATOM 0 H ASP A 49 -12.663 6.977 8.262 1.00 0.00 H new ATOM 0 HA ASP A 49 -14.940 6.738 9.898 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -14.177 8.512 8.086 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -15.057 7.482 6.974 1.00 0.00 H new ATOM 706 N MET A 50 -14.755 4.654 7.373 1.00 0.00 N ATOM 707 CA MET A 50 -15.351 3.459 6.786 1.00 0.00 C ATOM 708 C MET A 50 -15.165 2.253 7.702 1.00 0.00 C ATOM 709 O MET A 50 -15.782 1.208 7.499 1.00 0.00 O ATOM 710 CB MET A 50 -14.732 3.175 5.417 1.00 0.00 C ATOM 711 CG MET A 50 -14.848 4.337 4.444 1.00 0.00 C ATOM 712 SD MET A 50 -13.486 4.394 3.264 1.00 0.00 S ATOM 713 CE MET A 50 -13.552 2.735 2.591 1.00 0.00 C ATOM 0 H MET A 50 -13.853 4.915 6.975 1.00 0.00 H new ATOM 0 HA MET A 50 -16.419 3.638 6.663 1.00 0.00 H new ATOM 0 HB2 MET A 50 -13.679 2.926 5.548 1.00 0.00 H new ATOM 0 HB3 MET A 50 -15.215 2.299 4.984 1.00 0.00 H new ATOM 0 HG2 MET A 50 -15.790 4.259 3.902 1.00 0.00 H new ATOM 0 HG3 MET A 50 -14.879 5.272 5.003 1.00 0.00 H new ATOM 0 HE1 MET A 50 -12.627 2.209 2.828 1.00 0.00 H new ATOM 0 HE2 MET A 50 -14.396 2.199 3.026 1.00 0.00 H new ATOM 0 HE3 MET A 50 -13.673 2.786 1.509 1.00 0.00 H new ATOM 723 N ASN A 51 -14.312 2.406 8.709 1.00 0.00 N ATOM 724 CA ASN A 51 -14.045 1.328 9.655 1.00 0.00 C ATOM 725 C ASN A 51 -13.435 0.122 8.947 1.00 0.00 C ATOM 726 O ASN A 51 -13.682 -1.023 9.325 1.00 0.00 O ATOM 727 CB ASN A 51 -15.334 0.917 10.368 1.00 0.00 C ATOM 728 CG ASN A 51 -15.928 2.047 11.187 1.00 0.00 C ATOM 729 OD1 ASN A 51 -15.434 3.175 11.159 1.00 0.00 O ATOM 730 ND2 ASN A 51 -16.992 1.749 11.923 1.00 0.00 N ATOM 0 H ASN A 51 -13.794 3.265 8.891 1.00 0.00 H new ATOM 0 HA ASN A 51 -13.331 1.694 10.393 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -16.064 0.584 9.630 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -15.130 0.068 11.020 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -17.434 2.468 12.496 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -17.368 0.801 11.916 1.00 0.00 H new ATOM 737 N VAL A 52 -12.637 0.388 7.918 1.00 0.00 N ATOM 738 CA VAL A 52 -11.990 -0.675 7.158 1.00 0.00 C ATOM 739 C VAL A 52 -10.523 -0.817 7.551 1.00 0.00 C ATOM 740 O VAL A 52 -9.676 -0.036 7.118 1.00 0.00 O ATOM 741 CB VAL A 52 -12.081 -0.417 5.642 1.00 0.00 C ATOM 742 CG1 VAL A 52 -11.320 -1.485 4.872 1.00 0.00 C ATOM 743 CG2 VAL A 52 -13.535 -0.362 5.198 1.00 0.00 C ATOM 0 H VAL A 52 -12.423 1.330 7.591 1.00 0.00 H new ATOM 0 HA VAL A 52 -12.518 -1.599 7.394 1.00 0.00 H new ATOM 0 HB VAL A 52 -11.622 0.548 5.427 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -11.396 -1.286 3.803 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -10.272 -1.471 5.170 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -11.747 -2.464 5.090 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -13.581 -0.179 4.124 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -14.021 -1.311 5.426 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -14.046 0.443 5.725 1.00 0.00 H new ATOM 753 N ASN A 53 -10.231 -1.819 8.373 1.00 0.00 N ATOM 754 CA ASN A 53 -8.866 -2.064 8.824 1.00 0.00 C ATOM 755 C ASN A 53 -7.861 -1.729 7.726 1.00 0.00 C ATOM 756 O ASN A 53 -7.772 -2.429 6.717 1.00 0.00 O ATOM 757 CB ASN A 53 -8.702 -3.524 9.253 1.00 0.00 C ATOM 758 CG ASN A 53 -8.645 -4.470 8.069 1.00 0.00 C ATOM 759 OD1 ASN A 53 -7.675 -5.209 7.897 1.00 0.00 O ATOM 760 ND2 ASN A 53 -9.687 -4.452 7.246 1.00 0.00 N ATOM 0 H ASN A 53 -10.921 -2.474 8.740 1.00 0.00 H new ATOM 0 HA ASN A 53 -8.672 -1.417 9.679 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -7.790 -3.627 9.841 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -9.533 -3.805 9.900 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -9.705 -5.067 6.432 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -10.469 -3.823 7.427 1.00 0.00 H new ATOM 767 N TYR A 54 -7.107 -0.654 7.930 1.00 0.00 N ATOM 768 CA TYR A 54 -6.110 -0.225 6.957 1.00 0.00 C ATOM 769 C TYR A 54 -4.706 -0.284 7.553 1.00 0.00 C ATOM 770 O TYR A 54 -4.536 -0.515 8.750 1.00 0.00 O ATOM 771 CB TYR A 54 -6.413 1.196 6.478 1.00 0.00 C ATOM 772 CG TYR A 54 -6.211 2.250 7.543 1.00 0.00 C ATOM 773 CD1 TYR A 54 -7.128 2.407 8.575 1.00 0.00 C ATOM 774 CD2 TYR A 54 -5.105 3.090 7.516 1.00 0.00 C ATOM 775 CE1 TYR A 54 -6.948 3.369 9.550 1.00 0.00 C ATOM 776 CE2 TYR A 54 -4.916 4.054 8.487 1.00 0.00 C ATOM 777 CZ TYR A 54 -5.841 4.190 9.502 1.00 0.00 C ATOM 778 OH TYR A 54 -5.657 5.150 10.471 1.00 0.00 O ATOM 0 H TYR A 54 -7.168 -0.064 8.760 1.00 0.00 H new ATOM 0 HA TYR A 54 -6.153 -0.905 6.107 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -5.775 1.427 5.625 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -7.444 1.240 6.126 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -7.996 1.766 8.616 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.380 2.988 6.722 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -7.670 3.478 10.346 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -4.049 4.698 8.452 1.00 0.00 H new ATOM 0 HH TYR A 54 -4.828 5.642 10.291 1.00 0.00 H new ATOM 788 N LYS A 55 -3.703 -0.072 6.709 1.00 0.00 N ATOM 789 CA LYS A 55 -2.313 -0.098 7.149 1.00 0.00 C ATOM 790 C LYS A 55 -1.540 1.088 6.581 1.00 0.00 C ATOM 791 O LYS A 55 -1.205 1.114 5.396 1.00 0.00 O ATOM 792 CB LYS A 55 -1.646 -1.407 6.722 1.00 0.00 C ATOM 793 CG LYS A 55 -0.134 -1.396 6.870 1.00 0.00 C ATOM 794 CD LYS A 55 0.283 -1.343 8.330 1.00 0.00 C ATOM 795 CE LYS A 55 1.657 -1.961 8.540 1.00 0.00 C ATOM 796 NZ LYS A 55 1.790 -2.570 9.892 1.00 0.00 N ATOM 0 H LYS A 55 -3.827 0.120 5.715 1.00 0.00 H new ATOM 0 HA LYS A 55 -2.301 -0.029 8.237 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -2.055 -2.224 7.316 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -1.899 -1.612 5.682 1.00 0.00 H new ATOM 0 HG2 LYS A 55 0.285 -2.288 6.403 1.00 0.00 H new ATOM 0 HG3 LYS A 55 0.278 -0.536 6.342 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.293 -0.307 8.669 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -0.451 -1.871 8.939 1.00 0.00 H new ATOM 0 HE2 LYS A 55 1.833 -2.722 7.780 1.00 0.00 H new ATOM 0 HE3 LYS A 55 2.423 -1.197 8.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 2.740 -2.980 9.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 1.647 -1.839 10.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 1.076 -3.317 10.008 1.00 0.00 H new ATOM 810 N VAL A 56 -1.257 2.068 7.434 1.00 0.00 N ATOM 811 CA VAL A 56 -0.521 3.255 7.017 1.00 0.00 C ATOM 812 C VAL A 56 0.951 3.152 7.401 1.00 0.00 C ATOM 813 O VAL A 56 1.291 2.635 8.466 1.00 0.00 O ATOM 814 CB VAL A 56 -1.115 4.532 7.641 1.00 0.00 C ATOM 815 CG1 VAL A 56 -0.526 4.775 9.022 1.00 0.00 C ATOM 816 CG2 VAL A 56 -0.878 5.729 6.733 1.00 0.00 C ATOM 0 H VAL A 56 -1.526 2.063 8.418 1.00 0.00 H new ATOM 0 HA VAL A 56 -0.607 3.316 5.932 1.00 0.00 H new ATOM 0 HB VAL A 56 -2.191 4.396 7.750 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -0.957 5.681 9.447 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -0.753 3.927 9.669 1.00 0.00 H new ATOM 0 HG13 VAL A 56 0.555 4.891 8.941 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -1.304 6.622 7.190 1.00 0.00 H new ATOM 0 HG22 VAL A 56 0.193 5.871 6.590 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -1.353 5.553 5.768 1.00 0.00 H new ATOM 826 N VAL A 57 1.821 3.648 6.527 1.00 0.00 N ATOM 827 CA VAL A 57 3.257 3.613 6.775 1.00 0.00 C ATOM 828 C VAL A 57 3.882 4.990 6.580 1.00 0.00 C ATOM 829 O VAL A 57 3.916 5.515 5.468 1.00 0.00 O ATOM 830 CB VAL A 57 3.963 2.606 5.848 1.00 0.00 C ATOM 831 CG1 VAL A 57 5.451 2.549 6.155 1.00 0.00 C ATOM 832 CG2 VAL A 57 3.330 1.229 5.978 1.00 0.00 C ATOM 0 H VAL A 57 1.556 4.079 5.641 1.00 0.00 H new ATOM 0 HA VAL A 57 3.391 3.299 7.810 1.00 0.00 H new ATOM 0 HB VAL A 57 3.842 2.941 4.818 1.00 0.00 H new ATOM 0 HG11 VAL A 57 5.933 1.832 5.490 1.00 0.00 H new ATOM 0 HG12 VAL A 57 5.891 3.535 6.006 1.00 0.00 H new ATOM 0 HG13 VAL A 57 5.597 2.239 7.190 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.841 0.530 5.316 1.00 0.00 H new ATOM 0 HG22 VAL A 57 3.418 0.884 7.008 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.277 1.285 5.703 1.00 0.00 H new ATOM 842 N GLU A 58 4.375 5.570 7.670 1.00 0.00 N ATOM 843 CA GLU A 58 4.998 6.887 7.619 1.00 0.00 C ATOM 844 C GLU A 58 6.445 6.786 7.145 1.00 0.00 C ATOM 845 O GLU A 58 7.339 6.427 7.913 1.00 0.00 O ATOM 846 CB GLU A 58 4.946 7.555 8.995 1.00 0.00 C ATOM 847 CG GLU A 58 3.545 7.646 9.574 1.00 0.00 C ATOM 848 CD GLU A 58 3.179 6.434 10.409 1.00 0.00 C ATOM 849 OE1 GLU A 58 3.582 6.384 11.590 1.00 0.00 O ATOM 850 OE2 GLU A 58 2.490 5.535 9.882 1.00 0.00 O ATOM 0 H GLU A 58 4.355 5.148 8.599 1.00 0.00 H new ATOM 0 HA GLU A 58 4.442 7.496 6.907 1.00 0.00 H new ATOM 0 HB2 GLU A 58 5.580 6.997 9.685 1.00 0.00 H new ATOM 0 HB3 GLU A 58 5.364 8.559 8.918 1.00 0.00 H new ATOM 0 HG2 GLU A 58 3.467 8.543 10.189 1.00 0.00 H new ATOM 0 HG3 GLU A 58 2.826 7.753 8.762 1.00 0.00 H new ATOM 857 N LEU A 59 6.669 7.104 5.875 1.00 0.00 N ATOM 858 CA LEU A 59 8.007 7.050 5.297 1.00 0.00 C ATOM 859 C LEU A 59 8.893 8.152 5.868 1.00 0.00 C ATOM 860 O LEU A 59 10.001 7.891 6.337 1.00 0.00 O ATOM 861 CB LEU A 59 7.932 7.178 3.774 1.00 0.00 C ATOM 862 CG LEU A 59 7.126 6.100 3.049 1.00 0.00 C ATOM 863 CD1 LEU A 59 6.971 6.450 1.577 1.00 0.00 C ATOM 864 CD2 LEU A 59 7.790 4.740 3.208 1.00 0.00 C ATOM 0 H LEU A 59 5.941 7.402 5.226 1.00 0.00 H new ATOM 0 HA LEU A 59 8.447 6.086 5.554 1.00 0.00 H new ATOM 0 HB2 LEU A 59 7.502 8.150 3.532 1.00 0.00 H new ATOM 0 HB3 LEU A 59 8.948 7.172 3.378 1.00 0.00 H new ATOM 0 HG LEU A 59 6.134 6.052 3.497 1.00 0.00 H new ATOM 0 HD11 LEU A 59 6.395 5.672 1.077 1.00 0.00 H new ATOM 0 HD12 LEU A 59 6.452 7.404 1.482 1.00 0.00 H new ATOM 0 HD13 LEU A 59 7.956 6.526 1.115 1.00 0.00 H new ATOM 0 HD21 LEU A 59 7.203 3.985 2.686 1.00 0.00 H new ATOM 0 HD22 LEU A 59 8.795 4.774 2.786 1.00 0.00 H new ATOM 0 HD23 LEU A 59 7.849 4.485 4.266 1.00 0.00 H new ATOM 876 N ASP A 60 8.396 9.383 5.828 1.00 0.00 N ATOM 877 CA ASP A 60 9.141 10.525 6.345 1.00 0.00 C ATOM 878 C ASP A 60 9.739 10.210 7.712 1.00 0.00 C ATOM 879 O ASP A 60 10.917 10.470 7.962 1.00 0.00 O ATOM 880 CB ASP A 60 8.233 11.752 6.442 1.00 0.00 C ATOM 881 CG ASP A 60 8.967 12.978 6.949 1.00 0.00 C ATOM 882 OD1 ASP A 60 10.109 13.212 6.502 1.00 0.00 O ATOM 883 OD2 ASP A 60 8.401 13.702 7.794 1.00 0.00 O ATOM 0 H ASP A 60 7.481 9.616 5.443 1.00 0.00 H new ATOM 0 HA ASP A 60 9.955 10.739 5.653 1.00 0.00 H new ATOM 0 HB2 ASP A 60 7.810 11.966 5.460 1.00 0.00 H new ATOM 0 HB3 ASP A 60 7.398 11.531 7.107 1.00 0.00 H new ATOM 888 N LEU A 61 8.920 9.650 8.596 1.00 0.00 N ATOM 889 CA LEU A 61 9.368 9.300 9.939 1.00 0.00 C ATOM 890 C LEU A 61 10.312 8.103 9.904 1.00 0.00 C ATOM 891 O LEU A 61 11.316 8.069 10.618 1.00 0.00 O ATOM 892 CB LEU A 61 8.166 8.990 10.834 1.00 0.00 C ATOM 893 CG LEU A 61 6.984 9.954 10.728 1.00 0.00 C ATOM 894 CD1 LEU A 61 5.829 9.481 11.597 1.00 0.00 C ATOM 895 CD2 LEU A 61 7.407 11.362 11.121 1.00 0.00 C ATOM 0 H LEU A 61 7.942 9.429 8.407 1.00 0.00 H new ATOM 0 HA LEU A 61 9.909 10.153 10.349 1.00 0.00 H new ATOM 0 HB2 LEU A 61 7.813 7.986 10.599 1.00 0.00 H new ATOM 0 HB3 LEU A 61 8.504 8.974 11.870 1.00 0.00 H new ATOM 0 HG LEU A 61 6.648 9.973 9.691 1.00 0.00 H new ATOM 0 HD11 LEU A 61 4.997 10.180 11.508 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.509 8.492 11.270 1.00 0.00 H new ATOM 0 HD13 LEU A 61 6.152 9.432 12.637 1.00 0.00 H new ATOM 0 HD21 LEU A 61 6.553 12.035 11.040 1.00 0.00 H new ATOM 0 HD22 LEU A 61 7.770 11.359 12.149 1.00 0.00 H new ATOM 0 HD23 LEU A 61 8.201 11.702 10.457 1.00 0.00 H new ATOM 907 N LEU A 62 9.987 7.124 9.068 1.00 0.00 N ATOM 908 CA LEU A 62 10.807 5.925 8.937 1.00 0.00 C ATOM 909 C LEU A 62 12.270 6.289 8.703 1.00 0.00 C ATOM 910 O LEU A 62 12.584 7.115 7.847 1.00 0.00 O ATOM 911 CB LEU A 62 10.296 5.056 7.787 1.00 0.00 C ATOM 912 CG LEU A 62 9.207 4.043 8.144 1.00 0.00 C ATOM 913 CD1 LEU A 62 8.649 3.394 6.887 1.00 0.00 C ATOM 914 CD2 LEU A 62 9.751 2.987 9.095 1.00 0.00 C ATOM 0 H LEU A 62 9.161 7.137 8.470 1.00 0.00 H new ATOM 0 HA LEU A 62 10.736 5.363 9.868 1.00 0.00 H new ATOM 0 HB2 LEU A 62 9.912 5.712 7.005 1.00 0.00 H new ATOM 0 HB3 LEU A 62 11.142 4.515 7.363 1.00 0.00 H new ATOM 0 HG LEU A 62 8.397 4.572 8.646 1.00 0.00 H new ATOM 0 HD11 LEU A 62 7.876 2.676 7.161 1.00 0.00 H new ATOM 0 HD12 LEU A 62 8.221 4.161 6.241 1.00 0.00 H new ATOM 0 HD13 LEU A 62 9.450 2.879 6.357 1.00 0.00 H new ATOM 0 HD21 LEU A 62 8.962 2.275 9.338 1.00 0.00 H new ATOM 0 HD22 LEU A 62 10.580 2.462 8.620 1.00 0.00 H new ATOM 0 HD23 LEU A 62 10.101 3.466 10.009 1.00 0.00 H new ATOM 926 N GLU A 63 13.160 5.665 9.469 1.00 0.00 N ATOM 927 CA GLU A 63 14.589 5.923 9.343 1.00 0.00 C ATOM 928 C GLU A 63 15.062 5.678 7.913 1.00 0.00 C ATOM 929 O GLU A 63 15.933 6.385 7.406 1.00 0.00 O ATOM 930 CB GLU A 63 15.377 5.038 10.311 1.00 0.00 C ATOM 931 CG GLU A 63 15.261 3.553 10.010 1.00 0.00 C ATOM 932 CD GLU A 63 15.704 2.686 11.172 1.00 0.00 C ATOM 933 OE1 GLU A 63 15.127 2.828 12.271 1.00 0.00 O ATOM 934 OE2 GLU A 63 16.627 1.866 10.984 1.00 0.00 O ATOM 0 H GLU A 63 12.916 4.978 10.182 1.00 0.00 H new ATOM 0 HA GLU A 63 14.767 6.969 9.592 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.428 5.326 10.279 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.026 5.223 11.326 1.00 0.00 H new ATOM 0 HG2 GLU A 63 14.227 3.317 9.759 1.00 0.00 H new ATOM 0 HG3 GLU A 63 15.864 3.316 9.134 1.00 0.00 H new ATOM 941 N TYR A 64 14.483 4.671 7.269 1.00 0.00 N ATOM 942 CA TYR A 64 14.846 4.330 5.898 1.00 0.00 C ATOM 943 C TYR A 64 13.790 4.825 4.915 1.00 0.00 C ATOM 944 O TYR A 64 13.449 4.137 3.954 1.00 0.00 O ATOM 945 CB TYR A 64 15.023 2.817 5.757 1.00 0.00 C ATOM 946 CG TYR A 64 13.988 2.014 6.512 1.00 0.00 C ATOM 947 CD1 TYR A 64 12.702 1.853 6.009 1.00 0.00 C ATOM 948 CD2 TYR A 64 14.295 1.417 7.728 1.00 0.00 C ATOM 949 CE1 TYR A 64 11.754 1.121 6.696 1.00 0.00 C ATOM 950 CE2 TYR A 64 13.353 0.682 8.421 1.00 0.00 C ATOM 951 CZ TYR A 64 12.084 0.536 7.901 1.00 0.00 C ATOM 952 OH TYR A 64 11.142 -0.194 8.588 1.00 0.00 O ATOM 0 H TYR A 64 13.760 4.076 7.674 1.00 0.00 H new ATOM 0 HA TYR A 64 15.790 4.823 5.666 1.00 0.00 H new ATOM 0 HB2 TYR A 64 14.978 2.551 4.701 1.00 0.00 H new ATOM 0 HB3 TYR A 64 16.016 2.541 6.113 1.00 0.00 H new ATOM 0 HD1 TYR A 64 12.440 2.308 5.065 1.00 0.00 H new ATOM 0 HD2 TYR A 64 15.287 1.529 8.139 1.00 0.00 H new ATOM 0 HE1 TYR A 64 10.759 1.007 6.292 1.00 0.00 H new ATOM 0 HE2 TYR A 64 13.609 0.224 9.365 1.00 0.00 H new ATOM 0 HH TYR A 64 11.536 -0.539 9.416 1.00 0.00 H new ATOM 962 N GLY A 65 13.275 6.025 5.164 1.00 0.00 N ATOM 963 CA GLY A 65 12.263 6.593 4.292 1.00 0.00 C ATOM 964 C GLY A 65 12.737 6.719 2.858 1.00 0.00 C ATOM 965 O GLY A 65 12.057 6.279 1.932 1.00 0.00 O ATOM 0 H GLY A 65 13.540 6.614 5.954 1.00 0.00 H new ATOM 0 HA2 GLY A 65 11.370 5.969 4.323 1.00 0.00 H new ATOM 0 HA3 GLY A 65 11.977 7.577 4.665 1.00 0.00 H new ATOM 969 N ASN A 66 13.906 7.324 2.674 1.00 0.00 N ATOM 970 CA ASN A 66 14.469 7.509 1.341 1.00 0.00 C ATOM 971 C ASN A 66 14.423 6.207 0.546 1.00 0.00 C ATOM 972 O ASN A 66 14.215 6.218 -0.667 1.00 0.00 O ATOM 973 CB ASN A 66 15.912 8.008 1.439 1.00 0.00 C ATOM 974 CG ASN A 66 15.997 9.434 1.950 1.00 0.00 C ATOM 975 OD1 ASN A 66 15.125 9.893 2.688 1.00 0.00 O ATOM 976 ND2 ASN A 66 17.050 10.141 1.558 1.00 0.00 N ATOM 0 H ASN A 66 14.482 7.694 3.430 1.00 0.00 H new ATOM 0 HA ASN A 66 13.868 8.254 0.820 1.00 0.00 H new ATOM 0 HB2 ASN A 66 16.476 7.353 2.103 1.00 0.00 H new ATOM 0 HB3 ASN A 66 16.382 7.948 0.457 1.00 0.00 H new ATOM 0 HD21 ASN A 66 17.161 11.106 1.869 1.00 0.00 H new ATOM 0 HD22 ASN A 66 17.748 9.719 0.946 1.00 0.00 H new ATOM 983 N GLN A 67 14.617 5.090 1.238 1.00 0.00 N ATOM 984 CA GLN A 67 14.597 3.781 0.596 1.00 0.00 C ATOM 985 C GLN A 67 13.206 3.459 0.059 1.00 0.00 C ATOM 986 O GLN A 67 12.982 3.462 -1.152 1.00 0.00 O ATOM 987 CB GLN A 67 15.038 2.698 1.584 1.00 0.00 C ATOM 988 CG GLN A 67 16.547 2.540 1.678 1.00 0.00 C ATOM 989 CD GLN A 67 17.136 1.836 0.472 1.00 0.00 C ATOM 990 OE1 GLN A 67 17.538 2.477 -0.500 1.00 0.00 O ATOM 991 NE2 GLN A 67 17.192 0.511 0.528 1.00 0.00 N ATOM 0 H GLN A 67 14.790 5.065 2.243 1.00 0.00 H new ATOM 0 HA GLN A 67 15.294 3.805 -0.242 1.00 0.00 H new ATOM 0 HB2 GLN A 67 14.644 2.936 2.572 1.00 0.00 H new ATOM 0 HB3 GLN A 67 14.599 1.746 1.287 1.00 0.00 H new ATOM 0 HG2 GLN A 67 17.006 3.523 1.780 1.00 0.00 H new ATOM 0 HG3 GLN A 67 16.794 1.978 2.579 1.00 0.00 H new ATOM 0 HE21 GLN A 67 16.847 0.020 1.353 1.00 0.00 H new ATOM 0 HE22 GLN A 67 17.580 -0.017 -0.254 1.00 0.00 H new ATOM 1000 N PHE A 68 12.276 3.182 0.966 1.00 0.00 N ATOM 1001 CA PHE A 68 10.907 2.857 0.583 1.00 0.00 C ATOM 1002 C PHE A 68 10.300 3.971 -0.265 1.00 0.00 C ATOM 1003 O PHE A 68 9.364 3.742 -1.029 1.00 0.00 O ATOM 1004 CB PHE A 68 10.049 2.622 1.827 1.00 0.00 C ATOM 1005 CG PHE A 68 10.229 1.259 2.432 1.00 0.00 C ATOM 1006 CD1 PHE A 68 11.492 0.796 2.765 1.00 0.00 C ATOM 1007 CD2 PHE A 68 9.136 0.441 2.667 1.00 0.00 C ATOM 1008 CE1 PHE A 68 11.662 -0.457 3.322 1.00 0.00 C ATOM 1009 CE2 PHE A 68 9.300 -0.814 3.224 1.00 0.00 C ATOM 1010 CZ PHE A 68 10.564 -1.264 3.551 1.00 0.00 C ATOM 0 H PHE A 68 12.445 3.176 1.972 1.00 0.00 H new ATOM 0 HA PHE A 68 10.930 1.944 -0.012 1.00 0.00 H new ATOM 0 HB2 PHE A 68 10.293 3.377 2.574 1.00 0.00 H new ATOM 0 HB3 PHE A 68 9.000 2.759 1.566 1.00 0.00 H new ATOM 0 HD1 PHE A 68 12.354 1.422 2.587 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.145 0.787 2.412 1.00 0.00 H new ATOM 0 HE1 PHE A 68 12.652 -0.805 3.578 1.00 0.00 H new ATOM 0 HE2 PHE A 68 8.440 -1.442 3.403 1.00 0.00 H new ATOM 0 HZ PHE A 68 10.694 -2.244 3.985 1.00 0.00 H new ATOM 1020 N GLN A 69 10.842 5.176 -0.122 1.00 0.00 N ATOM 1021 CA GLN A 69 10.353 6.327 -0.874 1.00 0.00 C ATOM 1022 C GLN A 69 10.538 6.116 -2.373 1.00 0.00 C ATOM 1023 O GLN A 69 9.624 6.357 -3.161 1.00 0.00 O ATOM 1024 CB GLN A 69 11.080 7.598 -0.431 1.00 0.00 C ATOM 1025 CG GLN A 69 10.364 8.355 0.675 1.00 0.00 C ATOM 1026 CD GLN A 69 10.734 9.825 0.710 1.00 0.00 C ATOM 1027 OE1 GLN A 69 10.022 10.670 0.166 1.00 0.00 O ATOM 1028 NE2 GLN A 69 11.853 10.138 1.352 1.00 0.00 N ATOM 0 H GLN A 69 11.619 5.381 0.506 1.00 0.00 H new ATOM 0 HA GLN A 69 9.288 6.437 -0.670 1.00 0.00 H new ATOM 0 HB2 GLN A 69 12.081 7.334 -0.090 1.00 0.00 H new ATOM 0 HB3 GLN A 69 11.200 8.256 -1.291 1.00 0.00 H new ATOM 0 HG2 GLN A 69 9.287 8.258 0.538 1.00 0.00 H new ATOM 0 HG3 GLN A 69 10.605 7.901 1.636 1.00 0.00 H new ATOM 0 HE21 GLN A 69 12.413 9.405 1.788 1.00 0.00 H new ATOM 0 HE22 GLN A 69 12.153 11.111 1.409 1.00 0.00 H new ATOM 1037 N ASP A 70 11.727 5.666 -2.760 1.00 0.00 N ATOM 1038 CA ASP A 70 12.032 5.422 -4.165 1.00 0.00 C ATOM 1039 C ASP A 70 11.210 4.256 -4.705 1.00 0.00 C ATOM 1040 O ASP A 70 10.520 4.386 -5.716 1.00 0.00 O ATOM 1041 CB ASP A 70 13.524 5.136 -4.342 1.00 0.00 C ATOM 1042 CG ASP A 70 13.909 4.957 -5.798 1.00 0.00 C ATOM 1043 OD1 ASP A 70 13.530 5.815 -6.622 1.00 0.00 O ATOM 1044 OD2 ASP A 70 14.591 3.959 -6.112 1.00 0.00 O ATOM 0 H ASP A 70 12.495 5.463 -2.120 1.00 0.00 H new ATOM 0 HA ASP A 70 11.772 6.318 -4.729 1.00 0.00 H new ATOM 0 HB2 ASP A 70 14.102 5.955 -3.914 1.00 0.00 H new ATOM 0 HB3 ASP A 70 13.787 4.236 -3.786 1.00 0.00 H new ATOM 1049 N ALA A 71 11.288 3.118 -4.024 1.00 0.00 N ATOM 1050 CA ALA A 71 10.551 1.929 -4.435 1.00 0.00 C ATOM 1051 C ALA A 71 9.144 2.289 -4.898 1.00 0.00 C ATOM 1052 O ALA A 71 8.724 1.912 -5.993 1.00 0.00 O ATOM 1053 CB ALA A 71 10.492 0.924 -3.294 1.00 0.00 C ATOM 0 H ALA A 71 11.854 2.994 -3.185 1.00 0.00 H new ATOM 0 HA ALA A 71 11.078 1.477 -5.276 1.00 0.00 H new ATOM 0 HB1 ALA A 71 9.939 0.041 -3.615 1.00 0.00 H new ATOM 0 HB2 ALA A 71 11.504 0.635 -3.011 1.00 0.00 H new ATOM 0 HB3 ALA A 71 9.991 1.375 -2.438 1.00 0.00 H new ATOM 1059 N LEU A 72 8.418 3.020 -4.059 1.00 0.00 N ATOM 1060 CA LEU A 72 7.056 3.430 -4.382 1.00 0.00 C ATOM 1061 C LEU A 72 7.020 4.213 -5.691 1.00 0.00 C ATOM 1062 O LEU A 72 6.169 3.971 -6.547 1.00 0.00 O ATOM 1063 CB LEU A 72 6.477 4.280 -3.250 1.00 0.00 C ATOM 1064 CG LEU A 72 5.952 3.513 -2.036 1.00 0.00 C ATOM 1065 CD1 LEU A 72 5.698 4.461 -0.874 1.00 0.00 C ATOM 1066 CD2 LEU A 72 4.683 2.753 -2.393 1.00 0.00 C ATOM 0 H LEU A 72 8.750 3.341 -3.150 1.00 0.00 H new ATOM 0 HA LEU A 72 6.450 2.532 -4.500 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.248 4.972 -2.912 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.663 4.882 -3.654 1.00 0.00 H new ATOM 0 HG LEU A 72 6.710 2.792 -1.731 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.325 3.897 -0.019 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.628 4.960 -0.601 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.959 5.206 -1.167 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.324 2.213 -1.517 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.919 3.456 -2.725 1.00 0.00 H new ATOM 0 HD23 LEU A 72 4.896 2.045 -3.194 1.00 0.00 H new ATOM 1078 N TYR A 73 7.950 5.150 -5.840 1.00 0.00 N ATOM 1079 CA TYR A 73 8.024 5.968 -7.044 1.00 0.00 C ATOM 1080 C TYR A 73 8.098 5.095 -8.293 1.00 0.00 C ATOM 1081 O TYR A 73 7.617 5.474 -9.360 1.00 0.00 O ATOM 1082 CB TYR A 73 9.240 6.894 -6.983 1.00 0.00 C ATOM 1083 CG TYR A 73 9.604 7.504 -8.317 1.00 0.00 C ATOM 1084 CD1 TYR A 73 10.437 6.834 -9.205 1.00 0.00 C ATOM 1085 CD2 TYR A 73 9.118 8.751 -8.690 1.00 0.00 C ATOM 1086 CE1 TYR A 73 10.774 7.387 -10.425 1.00 0.00 C ATOM 1087 CE2 TYR A 73 9.448 9.311 -9.909 1.00 0.00 C ATOM 1088 CZ TYR A 73 10.276 8.626 -10.773 1.00 0.00 C ATOM 1089 OH TYR A 73 10.609 9.182 -11.987 1.00 0.00 O ATOM 0 H TYR A 73 8.663 5.362 -5.142 1.00 0.00 H new ATOM 0 HA TYR A 73 7.118 6.572 -7.098 1.00 0.00 H new ATOM 0 HB2 TYR A 73 9.042 7.694 -6.269 1.00 0.00 H new ATOM 0 HB3 TYR A 73 10.094 6.333 -6.604 1.00 0.00 H new ATOM 0 HD1 TYR A 73 10.828 5.864 -8.936 1.00 0.00 H new ATOM 0 HD2 TYR A 73 8.471 9.292 -8.015 1.00 0.00 H new ATOM 0 HE1 TYR A 73 11.423 6.853 -11.103 1.00 0.00 H new ATOM 0 HE2 TYR A 73 9.059 10.280 -10.184 1.00 0.00 H new ATOM 0 HH TYR A 73 10.175 10.056 -12.077 1.00 0.00 H new ATOM 1099 N LYS A 74 8.706 3.922 -8.150 1.00 0.00 N ATOM 1100 CA LYS A 74 8.843 2.991 -9.264 1.00 0.00 C ATOM 1101 C LYS A 74 7.553 2.208 -9.481 1.00 0.00 C ATOM 1102 O LYS A 74 7.042 2.132 -10.599 1.00 0.00 O ATOM 1103 CB LYS A 74 10.002 2.024 -9.007 1.00 0.00 C ATOM 1104 CG LYS A 74 11.333 2.717 -8.778 1.00 0.00 C ATOM 1105 CD LYS A 74 12.326 1.802 -8.081 1.00 0.00 C ATOM 1106 CE LYS A 74 13.150 1.007 -9.083 1.00 0.00 C ATOM 1107 NZ LYS A 74 14.480 0.629 -8.531 1.00 0.00 N ATOM 0 H LYS A 74 9.112 3.594 -7.274 1.00 0.00 H new ATOM 0 HA LYS A 74 9.052 3.569 -10.164 1.00 0.00 H new ATOM 0 HB2 LYS A 74 9.767 1.411 -8.137 1.00 0.00 H new ATOM 0 HB3 LYS A 74 10.095 1.348 -9.857 1.00 0.00 H new ATOM 0 HG2 LYS A 74 11.745 3.041 -9.734 1.00 0.00 H new ATOM 0 HG3 LYS A 74 11.179 3.613 -8.177 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.990 2.395 -7.452 1.00 0.00 H new ATOM 0 HD3 LYS A 74 11.791 1.117 -7.423 1.00 0.00 H new ATOM 0 HE2 LYS A 74 12.606 0.107 -9.368 1.00 0.00 H new ATOM 0 HE3 LYS A 74 13.287 1.597 -9.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 15.011 0.089 -9.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 15.010 1.489 -8.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 14.350 0.045 -7.680 1.00 0.00 H new ATOM 1121 N MET A 75 7.029 1.628 -8.406 1.00 0.00 N ATOM 1122 CA MET A 75 5.796 0.853 -8.480 1.00 0.00 C ATOM 1123 C MET A 75 4.604 1.756 -8.779 1.00 0.00 C ATOM 1124 O MET A 75 3.559 1.292 -9.238 1.00 0.00 O ATOM 1125 CB MET A 75 5.563 0.099 -7.170 1.00 0.00 C ATOM 1126 CG MET A 75 6.774 -0.692 -6.700 1.00 0.00 C ATOM 1127 SD MET A 75 6.323 -2.135 -5.718 1.00 0.00 S ATOM 1128 CE MET A 75 5.321 -1.377 -4.442 1.00 0.00 C ATOM 0 H MET A 75 7.439 1.680 -7.474 1.00 0.00 H new ATOM 0 HA MET A 75 5.897 0.133 -9.292 1.00 0.00 H new ATOM 0 HB2 MET A 75 5.282 0.812 -6.395 1.00 0.00 H new ATOM 0 HB3 MET A 75 4.721 -0.582 -7.297 1.00 0.00 H new ATOM 0 HG2 MET A 75 7.352 -1.013 -7.567 1.00 0.00 H new ATOM 0 HG3 MET A 75 7.420 -0.043 -6.109 1.00 0.00 H new ATOM 0 HE1 MET A 75 4.937 -2.148 -3.774 1.00 0.00 H new ATOM 0 HE2 MET A 75 5.928 -0.673 -3.872 1.00 0.00 H new ATOM 0 HE3 MET A 75 4.487 -0.847 -4.901 1.00 0.00 H new ATOM 1138 N THR A 76 4.766 3.049 -8.517 1.00 0.00 N ATOM 1139 CA THR A 76 3.703 4.017 -8.757 1.00 0.00 C ATOM 1140 C THR A 76 3.956 4.806 -10.036 1.00 0.00 C ATOM 1141 O THR A 76 3.028 5.102 -10.788 1.00 0.00 O ATOM 1142 CB THR A 76 3.563 5.001 -7.580 1.00 0.00 C ATOM 1143 OG1 THR A 76 4.687 5.887 -7.546 1.00 0.00 O ATOM 1144 CG2 THR A 76 3.460 4.253 -6.259 1.00 0.00 C ATOM 0 H THR A 76 5.624 3.450 -8.138 1.00 0.00 H new ATOM 0 HA THR A 76 2.777 3.450 -8.860 1.00 0.00 H new ATOM 0 HB THR A 76 2.650 5.579 -7.724 1.00 0.00 H new ATOM 0 HG1 THR A 76 5.503 5.374 -7.370 1.00 0.00 H new ATOM 0 HG21 THR A 76 3.362 4.968 -5.442 1.00 0.00 H new ATOM 0 HG22 THR A 76 2.587 3.601 -6.277 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.358 3.653 -6.110 1.00 0.00 H new ATOM 1152 N GLY A 77 5.219 5.143 -10.279 1.00 0.00 N ATOM 1153 CA GLY A 77 5.571 5.894 -11.469 1.00 0.00 C ATOM 1154 C GLY A 77 5.911 7.340 -11.163 1.00 0.00 C ATOM 1155 O GLY A 77 6.735 7.947 -11.846 1.00 0.00 O ATOM 0 H GLY A 77 6.005 4.909 -9.672 1.00 0.00 H new ATOM 0 HA2 GLY A 77 6.423 5.419 -11.956 1.00 0.00 H new ATOM 0 HA3 GLY A 77 4.741 5.861 -12.175 1.00 0.00 H new ATOM 1159 N GLU A 78 5.274 7.891 -10.135 1.00 0.00 N ATOM 1160 CA GLU A 78 5.513 9.275 -9.743 1.00 0.00 C ATOM 1161 C GLU A 78 5.930 9.361 -8.278 1.00 0.00 C ATOM 1162 O GLU A 78 5.940 8.358 -7.564 1.00 0.00 O ATOM 1163 CB GLU A 78 4.258 10.119 -9.978 1.00 0.00 C ATOM 1164 CG GLU A 78 3.039 9.621 -9.219 1.00 0.00 C ATOM 1165 CD GLU A 78 1.737 9.966 -9.915 1.00 0.00 C ATOM 1166 OE1 GLU A 78 1.219 11.080 -9.685 1.00 0.00 O ATOM 1167 OE2 GLU A 78 1.236 9.125 -10.689 1.00 0.00 O ATOM 0 H GLU A 78 4.589 7.401 -9.559 1.00 0.00 H new ATOM 0 HA GLU A 78 6.325 9.665 -10.357 1.00 0.00 H new ATOM 0 HB2 GLU A 78 4.463 11.149 -9.685 1.00 0.00 H new ATOM 0 HB3 GLU A 78 4.032 10.130 -11.044 1.00 0.00 H new ATOM 0 HG2 GLU A 78 3.107 8.540 -9.099 1.00 0.00 H new ATOM 0 HG3 GLU A 78 3.037 10.053 -8.218 1.00 0.00 H new ATOM 1174 N ARG A 79 6.275 10.567 -7.837 1.00 0.00 N ATOM 1175 CA ARG A 79 6.695 10.784 -6.458 1.00 0.00 C ATOM 1176 C ARG A 79 5.606 11.499 -5.664 1.00 0.00 C ATOM 1177 O ARG A 79 5.880 12.446 -4.926 1.00 0.00 O ATOM 1178 CB ARG A 79 7.988 11.600 -6.419 1.00 0.00 C ATOM 1179 CG ARG A 79 7.874 12.955 -7.098 1.00 0.00 C ATOM 1180 CD ARG A 79 8.961 13.908 -6.627 1.00 0.00 C ATOM 1181 NE ARG A 79 9.149 15.024 -7.550 1.00 0.00 N ATOM 1182 CZ ARG A 79 9.919 14.963 -8.630 1.00 0.00 C ATOM 1183 NH1 ARG A 79 10.571 13.845 -8.921 1.00 0.00 N ATOM 1184 NH2 ARG A 79 10.040 16.021 -9.422 1.00 0.00 N ATOM 0 H ARG A 79 6.272 11.408 -8.415 1.00 0.00 H new ATOM 0 HA ARG A 79 6.874 9.810 -6.002 1.00 0.00 H new ATOM 0 HB2 ARG A 79 8.283 11.747 -5.380 1.00 0.00 H new ATOM 0 HB3 ARG A 79 8.783 11.029 -6.898 1.00 0.00 H new ATOM 0 HG2 ARG A 79 7.943 12.829 -8.178 1.00 0.00 H new ATOM 0 HG3 ARG A 79 6.895 13.386 -6.889 1.00 0.00 H new ATOM 0 HD2 ARG A 79 8.703 14.293 -5.641 1.00 0.00 H new ATOM 0 HD3 ARG A 79 9.899 13.363 -6.521 1.00 0.00 H new ATOM 0 HE ARG A 79 8.662 15.899 -7.354 1.00 0.00 H new ATOM 0 HH11 ARG A 79 10.481 13.030 -8.315 1.00 0.00 H new ATOM 0 HH12 ARG A 79 11.162 13.801 -9.751 1.00 0.00 H new ATOM 0 HH21 ARG A 79 9.541 16.883 -9.201 1.00 0.00 H new ATOM 0 HH22 ARG A 79 10.632 15.972 -10.251 1.00 0.00 H new ATOM 1198 N THR A 80 4.368 11.040 -5.820 1.00 0.00 N ATOM 1199 CA THR A 80 3.237 11.635 -5.120 1.00 0.00 C ATOM 1200 C THR A 80 2.919 10.872 -3.840 1.00 0.00 C ATOM 1201 O THR A 80 3.386 9.750 -3.642 1.00 0.00 O ATOM 1202 CB THR A 80 1.981 11.670 -6.010 1.00 0.00 C ATOM 1203 OG1 THR A 80 1.655 10.347 -6.450 1.00 0.00 O ATOM 1204 CG2 THR A 80 2.196 12.573 -7.216 1.00 0.00 C ATOM 0 H THR A 80 4.123 10.257 -6.426 1.00 0.00 H new ATOM 0 HA THR A 80 3.523 12.656 -4.868 1.00 0.00 H new ATOM 0 HB THR A 80 1.156 12.070 -5.420 1.00 0.00 H new ATOM 0 HG1 THR A 80 1.188 10.394 -7.311 1.00 0.00 H new ATOM 0 HG21 THR A 80 1.295 12.581 -7.829 1.00 0.00 H new ATOM 0 HG22 THR A 80 2.414 13.586 -6.878 1.00 0.00 H new ATOM 0 HG23 THR A 80 3.033 12.199 -7.806 1.00 0.00 H new ATOM 1212 N VAL A 81 2.119 11.485 -2.973 1.00 0.00 N ATOM 1213 CA VAL A 81 1.737 10.862 -1.712 1.00 0.00 C ATOM 1214 C VAL A 81 0.550 11.582 -1.081 1.00 0.00 C ATOM 1215 O VAL A 81 0.302 12.761 -1.332 1.00 0.00 O ATOM 1216 CB VAL A 81 2.908 10.852 -0.712 1.00 0.00 C ATOM 1217 CG1 VAL A 81 3.872 9.719 -1.029 1.00 0.00 C ATOM 1218 CG2 VAL A 81 3.627 12.193 -0.722 1.00 0.00 C ATOM 0 H VAL A 81 1.723 12.413 -3.121 1.00 0.00 H new ATOM 0 HA VAL A 81 1.456 9.834 -1.940 1.00 0.00 H new ATOM 0 HB VAL A 81 2.508 10.687 0.288 1.00 0.00 H new ATOM 0 HG11 VAL A 81 4.693 9.728 -0.312 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.346 8.766 -0.967 1.00 0.00 H new ATOM 0 HG13 VAL A 81 4.269 9.850 -2.036 1.00 0.00 H new ATOM 0 HG21 VAL A 81 4.452 12.169 -0.010 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.016 12.390 -1.721 1.00 0.00 H new ATOM 0 HG23 VAL A 81 2.929 12.982 -0.442 1.00 0.00 H new ATOM 1228 N PRO A 82 -0.203 10.856 -0.241 1.00 0.00 N ATOM 1229 CA PRO A 82 0.082 9.451 0.065 1.00 0.00 C ATOM 1230 C PRO A 82 -0.186 8.534 -1.122 1.00 0.00 C ATOM 1231 O PRO A 82 -0.573 8.991 -2.198 1.00 0.00 O ATOM 1232 CB PRO A 82 -0.881 9.136 1.213 1.00 0.00 C ATOM 1233 CG PRO A 82 -2.003 10.101 1.042 1.00 0.00 C ATOM 1234 CD PRO A 82 -1.391 11.352 0.475 1.00 0.00 C ATOM 0 HA PRO A 82 1.131 9.293 0.315 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -1.234 8.106 1.162 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -0.396 9.260 2.181 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.763 9.700 0.372 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -2.492 10.303 1.995 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.078 11.867 -0.196 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -1.121 12.059 1.260 1.00 0.00 H new ATOM 1242 N ARG A 83 0.020 7.236 -0.920 1.00 0.00 N ATOM 1243 CA ARG A 83 -0.198 6.254 -1.975 1.00 0.00 C ATOM 1244 C ARG A 83 -0.898 5.014 -1.427 1.00 0.00 C ATOM 1245 O ARG A 83 -0.361 4.316 -0.566 1.00 0.00 O ATOM 1246 CB ARG A 83 1.133 5.860 -2.619 1.00 0.00 C ATOM 1247 CG ARG A 83 1.888 7.033 -3.223 1.00 0.00 C ATOM 1248 CD ARG A 83 1.111 7.666 -4.366 1.00 0.00 C ATOM 1249 NE ARG A 83 1.012 6.776 -5.520 1.00 0.00 N ATOM 1250 CZ ARG A 83 0.496 7.142 -6.688 1.00 0.00 C ATOM 1251 NH1 ARG A 83 0.035 8.374 -6.856 1.00 0.00 N ATOM 1252 NH2 ARG A 83 0.440 6.275 -7.691 1.00 0.00 N ATOM 0 H ARG A 83 0.338 6.841 -0.035 1.00 0.00 H new ATOM 0 HA ARG A 83 -0.839 6.707 -2.732 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.762 5.381 -1.869 1.00 0.00 H new ATOM 0 HB3 ARG A 83 0.946 5.120 -3.397 1.00 0.00 H new ATOM 0 HG2 ARG A 83 2.078 7.780 -2.453 1.00 0.00 H new ATOM 0 HG3 ARG A 83 2.859 6.695 -3.585 1.00 0.00 H new ATOM 0 HD2 ARG A 83 0.110 7.927 -4.023 1.00 0.00 H new ATOM 0 HD3 ARG A 83 1.598 8.594 -4.665 1.00 0.00 H new ATOM 0 HE ARG A 83 1.358 5.821 -5.424 1.00 0.00 H new ATOM 0 HH11 ARG A 83 0.076 9.043 -6.087 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -0.361 8.652 -7.754 1.00 0.00 H new ATOM 0 HH21 ARG A 83 0.793 5.326 -7.565 1.00 0.00 H new ATOM 0 HH22 ARG A 83 0.044 6.557 -8.587 1.00 0.00 H new ATOM 1266 N ILE A 84 -2.097 4.746 -1.931 1.00 0.00 N ATOM 1267 CA ILE A 84 -2.869 3.590 -1.492 1.00 0.00 C ATOM 1268 C ILE A 84 -2.745 2.437 -2.483 1.00 0.00 C ATOM 1269 O ILE A 84 -2.759 2.644 -3.697 1.00 0.00 O ATOM 1270 CB ILE A 84 -4.358 3.941 -1.316 1.00 0.00 C ATOM 1271 CG1 ILE A 84 -4.517 5.103 -0.332 1.00 0.00 C ATOM 1272 CG2 ILE A 84 -5.136 2.725 -0.837 1.00 0.00 C ATOM 1273 CD1 ILE A 84 -4.500 6.462 -0.995 1.00 0.00 C ATOM 0 H ILE A 84 -2.555 5.313 -2.644 1.00 0.00 H new ATOM 0 HA ILE A 84 -2.459 3.285 -0.529 1.00 0.00 H new ATOM 0 HB ILE A 84 -4.760 4.248 -2.281 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -5.455 4.984 0.210 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -3.715 5.057 0.405 1.00 0.00 H new ATOM 0 HG21 ILE A 84 -6.187 2.989 -0.717 1.00 0.00 H new ATOM 0 HG22 ILE A 84 -5.045 1.923 -1.569 1.00 0.00 H new ATOM 0 HG23 ILE A 84 -4.735 2.390 0.120 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -4.617 7.238 -0.238 1.00 0.00 H new ATOM 0 HD12 ILE A 84 -3.552 6.602 -1.514 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -5.319 6.528 -1.712 1.00 0.00 H new ATOM 1285 N PHE A 85 -2.624 1.223 -1.957 1.00 0.00 N ATOM 1286 CA PHE A 85 -2.498 0.036 -2.795 1.00 0.00 C ATOM 1287 C PHE A 85 -3.404 -1.084 -2.292 1.00 0.00 C ATOM 1288 O PHE A 85 -3.249 -1.566 -1.170 1.00 0.00 O ATOM 1289 CB PHE A 85 -1.045 -0.442 -2.824 1.00 0.00 C ATOM 1290 CG PHE A 85 -0.185 0.313 -3.797 1.00 0.00 C ATOM 1291 CD1 PHE A 85 0.027 1.673 -3.644 1.00 0.00 C ATOM 1292 CD2 PHE A 85 0.412 -0.339 -4.864 1.00 0.00 C ATOM 1293 CE1 PHE A 85 0.817 2.370 -4.539 1.00 0.00 C ATOM 1294 CE2 PHE A 85 1.204 0.353 -5.762 1.00 0.00 C ATOM 1295 CZ PHE A 85 1.408 1.709 -5.598 1.00 0.00 C ATOM 0 H PHE A 85 -2.611 1.035 -0.955 1.00 0.00 H new ATOM 0 HA PHE A 85 -2.806 0.302 -3.806 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -0.619 -0.346 -1.825 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -1.024 -1.501 -3.079 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -0.430 2.195 -2.816 1.00 0.00 H new ATOM 0 HD2 PHE A 85 0.257 -1.400 -4.996 1.00 0.00 H new ATOM 0 HE1 PHE A 85 0.972 3.431 -4.410 1.00 0.00 H new ATOM 0 HE2 PHE A 85 1.662 -0.166 -6.591 1.00 0.00 H new ATOM 0 HZ PHE A 85 2.028 2.251 -6.296 1.00 0.00 H new ATOM 1305 N VAL A 86 -4.351 -1.493 -3.130 1.00 0.00 N ATOM 1306 CA VAL A 86 -5.282 -2.556 -2.772 1.00 0.00 C ATOM 1307 C VAL A 86 -4.987 -3.832 -3.552 1.00 0.00 C ATOM 1308 O VAL A 86 -4.782 -3.796 -4.765 1.00 0.00 O ATOM 1309 CB VAL A 86 -6.741 -2.135 -3.031 1.00 0.00 C ATOM 1310 CG1 VAL A 86 -7.694 -3.269 -2.685 1.00 0.00 C ATOM 1311 CG2 VAL A 86 -7.082 -0.881 -2.240 1.00 0.00 C ATOM 0 H VAL A 86 -4.494 -1.104 -4.062 1.00 0.00 H new ATOM 0 HA VAL A 86 -5.150 -2.746 -1.707 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.853 -1.910 -4.092 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -8.720 -2.953 -2.874 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -7.463 -4.139 -3.300 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -7.583 -3.529 -1.632 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -8.116 -0.598 -2.435 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -6.954 -1.076 -1.175 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -6.421 -0.069 -2.542 1.00 0.00 H new ATOM 1321 N ASN A 87 -4.966 -4.958 -2.848 1.00 0.00 N ATOM 1322 CA ASN A 87 -4.695 -6.247 -3.475 1.00 0.00 C ATOM 1323 C ASN A 87 -3.517 -6.146 -4.438 1.00 0.00 C ATOM 1324 O ASN A 87 -3.587 -6.615 -5.573 1.00 0.00 O ATOM 1325 CB ASN A 87 -5.935 -6.746 -4.219 1.00 0.00 C ATOM 1326 CG ASN A 87 -5.907 -8.245 -4.451 1.00 0.00 C ATOM 1327 OD1 ASN A 87 -5.060 -8.754 -5.185 1.00 0.00 O ATOM 1328 ND2 ASN A 87 -6.835 -8.958 -3.823 1.00 0.00 N ATOM 0 H ASN A 87 -5.133 -5.005 -1.843 1.00 0.00 H new ATOM 0 HA ASN A 87 -4.440 -6.959 -2.690 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -6.827 -6.486 -3.648 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -6.010 -6.234 -5.178 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -6.866 -9.971 -3.940 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -7.517 -8.493 -3.224 1.00 0.00 H new ATOM 1335 N GLY A 88 -2.432 -5.531 -3.976 1.00 0.00 N ATOM 1336 CA GLY A 88 -1.253 -5.380 -4.808 1.00 0.00 C ATOM 1337 C GLY A 88 -1.531 -4.583 -6.068 1.00 0.00 C ATOM 1338 O GLY A 88 -0.945 -4.844 -7.119 1.00 0.00 O ATOM 0 H GLY A 88 -2.349 -5.135 -3.040 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -0.468 -4.886 -4.235 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -0.876 -6.366 -5.081 1.00 0.00 H new ATOM 1342 N THR A 89 -2.430 -3.609 -5.964 1.00 0.00 N ATOM 1343 CA THR A 89 -2.787 -2.774 -7.104 1.00 0.00 C ATOM 1344 C THR A 89 -3.040 -1.334 -6.673 1.00 0.00 C ATOM 1345 O THR A 89 -3.586 -1.084 -5.598 1.00 0.00 O ATOM 1346 CB THR A 89 -4.039 -3.310 -7.823 1.00 0.00 C ATOM 1347 OG1 THR A 89 -3.791 -4.629 -8.321 1.00 0.00 O ATOM 1348 CG2 THR A 89 -4.437 -2.395 -8.972 1.00 0.00 C ATOM 0 H THR A 89 -2.924 -3.379 -5.102 1.00 0.00 H new ATOM 0 HA THR A 89 -1.942 -2.801 -7.792 1.00 0.00 H new ATOM 0 HB THR A 89 -4.858 -3.342 -7.104 1.00 0.00 H new ATOM 0 HG1 THR A 89 -4.592 -4.963 -8.775 1.00 0.00 H new ATOM 0 HG21 THR A 89 -5.324 -2.794 -9.465 1.00 0.00 H new ATOM 0 HG22 THR A 89 -4.654 -1.399 -8.586 1.00 0.00 H new ATOM 0 HG23 THR A 89 -3.619 -2.335 -9.690 1.00 0.00 H new ATOM 1356 N PHE A 90 -2.640 -0.389 -7.517 1.00 0.00 N ATOM 1357 CA PHE A 90 -2.824 1.027 -7.223 1.00 0.00 C ATOM 1358 C PHE A 90 -4.154 1.530 -7.775 1.00 0.00 C ATOM 1359 O PHE A 90 -4.224 2.027 -8.899 1.00 0.00 O ATOM 1360 CB PHE A 90 -1.673 1.846 -7.812 1.00 0.00 C ATOM 1361 CG PHE A 90 -1.851 3.329 -7.656 1.00 0.00 C ATOM 1362 CD1 PHE A 90 -1.469 3.967 -6.486 1.00 0.00 C ATOM 1363 CD2 PHE A 90 -2.400 4.086 -8.678 1.00 0.00 C ATOM 1364 CE1 PHE A 90 -1.631 5.331 -6.339 1.00 0.00 C ATOM 1365 CE2 PHE A 90 -2.564 5.451 -8.537 1.00 0.00 C ATOM 1366 CZ PHE A 90 -2.180 6.074 -7.366 1.00 0.00 C ATOM 0 H PHE A 90 -2.186 -0.578 -8.411 1.00 0.00 H new ATOM 0 HA PHE A 90 -2.831 1.149 -6.140 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.742 1.547 -7.331 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -1.574 1.609 -8.871 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.040 3.391 -5.680 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.703 3.604 -9.596 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -1.329 5.816 -5.422 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -2.992 6.030 -9.342 1.00 0.00 H new ATOM 0 HZ PHE A 90 -2.309 7.140 -7.253 1.00 0.00 H new ATOM 1376 N ILE A 91 -5.208 1.396 -6.976 1.00 0.00 N ATOM 1377 CA ILE A 91 -6.536 1.836 -7.384 1.00 0.00 C ATOM 1378 C ILE A 91 -6.567 3.342 -7.622 1.00 0.00 C ATOM 1379 O ILE A 91 -7.415 3.847 -8.356 1.00 0.00 O ATOM 1380 CB ILE A 91 -7.598 1.473 -6.329 1.00 0.00 C ATOM 1381 CG1 ILE A 91 -7.410 2.324 -5.071 1.00 0.00 C ATOM 1382 CG2 ILE A 91 -7.522 -0.008 -5.989 1.00 0.00 C ATOM 1383 CD1 ILE A 91 -6.129 2.025 -4.325 1.00 0.00 C ATOM 0 H ILE A 91 -5.167 0.986 -6.043 1.00 0.00 H new ATOM 0 HA ILE A 91 -6.768 1.318 -8.315 1.00 0.00 H new ATOM 0 HB ILE A 91 -8.585 1.681 -6.742 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -7.421 3.378 -5.350 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -8.256 2.162 -4.403 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -8.279 -0.249 -5.242 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -7.699 -0.597 -6.889 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -6.534 -0.240 -5.592 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -6.063 2.665 -3.445 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -6.124 0.980 -4.015 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -5.276 2.214 -4.977 1.00 0.00 H new ATOM 1395 N GLY A 92 -5.634 4.054 -6.998 1.00 0.00 N ATOM 1396 CA GLY A 92 -5.570 5.495 -7.157 1.00 0.00 C ATOM 1397 C GLY A 92 -5.147 6.200 -5.883 1.00 0.00 C ATOM 1398 O GLY A 92 -5.149 5.606 -4.806 1.00 0.00 O ATOM 0 H GLY A 92 -4.921 3.659 -6.385 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.868 5.739 -7.954 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -6.546 5.867 -7.468 1.00 0.00 H new ATOM 1402 N GLY A 93 -4.782 7.473 -6.007 1.00 0.00 N ATOM 1403 CA GLY A 93 -4.357 8.238 -4.849 1.00 0.00 C ATOM 1404 C GLY A 93 -5.482 8.460 -3.857 1.00 0.00 C ATOM 1405 O GLY A 93 -6.570 7.905 -4.007 1.00 0.00 O ATOM 0 H GLY A 93 -4.773 7.987 -6.888 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -3.537 7.717 -4.354 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -3.970 9.203 -5.177 1.00 0.00 H new ATOM 1409 N ALA A 94 -5.219 9.273 -2.839 1.00 0.00 N ATOM 1410 CA ALA A 94 -6.217 9.567 -1.819 1.00 0.00 C ATOM 1411 C ALA A 94 -7.547 9.964 -2.450 1.00 0.00 C ATOM 1412 O ALA A 94 -8.574 9.327 -2.213 1.00 0.00 O ATOM 1413 CB ALA A 94 -5.719 10.669 -0.896 1.00 0.00 C ATOM 0 H ALA A 94 -4.323 9.740 -2.699 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.379 8.662 -1.233 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -6.475 10.879 -0.139 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -4.798 10.348 -0.410 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.528 11.571 -1.477 1.00 0.00 H new ATOM 1419 N THR A 95 -7.523 11.021 -3.256 1.00 0.00 N ATOM 1420 CA THR A 95 -8.727 11.504 -3.920 1.00 0.00 C ATOM 1421 C THR A 95 -9.437 10.376 -4.660 1.00 0.00 C ATOM 1422 O THR A 95 -10.600 10.079 -4.389 1.00 0.00 O ATOM 1423 CB THR A 95 -8.404 12.634 -4.917 1.00 0.00 C ATOM 1424 OG1 THR A 95 -7.570 13.616 -4.291 1.00 0.00 O ATOM 1425 CG2 THR A 95 -9.679 13.291 -5.421 1.00 0.00 C ATOM 0 H THR A 95 -6.682 11.559 -3.465 1.00 0.00 H new ATOM 0 HA THR A 95 -9.383 11.893 -3.141 1.00 0.00 H new ATOM 0 HB THR A 95 -7.878 12.200 -5.767 1.00 0.00 H new ATOM 0 HG1 THR A 95 -7.368 14.330 -4.931 1.00 0.00 H new ATOM 0 HG21 THR A 95 -9.426 14.085 -6.123 1.00 0.00 H new ATOM 0 HG22 THR A 95 -10.298 12.547 -5.922 1.00 0.00 H new ATOM 0 HG23 THR A 95 -10.228 13.712 -4.579 1.00 0.00 H new ATOM 1433 N ASP A 96 -8.729 9.751 -5.594 1.00 0.00 N ATOM 1434 CA ASP A 96 -9.292 8.654 -6.373 1.00 0.00 C ATOM 1435 C ASP A 96 -9.891 7.590 -5.458 1.00 0.00 C ATOM 1436 O ASP A 96 -11.098 7.349 -5.475 1.00 0.00 O ATOM 1437 CB ASP A 96 -8.218 8.031 -7.266 1.00 0.00 C ATOM 1438 CG ASP A 96 -8.031 8.791 -8.564 1.00 0.00 C ATOM 1439 OD1 ASP A 96 -7.820 10.020 -8.505 1.00 0.00 O ATOM 1440 OD2 ASP A 96 -8.097 8.157 -9.638 1.00 0.00 O ATOM 0 H ASP A 96 -7.765 9.985 -5.830 1.00 0.00 H new ATOM 0 HA ASP A 96 -10.087 9.057 -7.001 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -7.272 8.003 -6.725 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -8.489 6.999 -7.489 1.00 0.00 H new ATOM 1445 N THR A 97 -9.038 6.955 -4.660 1.00 0.00 N ATOM 1446 CA THR A 97 -9.482 5.915 -3.740 1.00 0.00 C ATOM 1447 C THR A 97 -10.780 6.313 -3.046 1.00 0.00 C ATOM 1448 O THR A 97 -11.683 5.493 -2.880 1.00 0.00 O ATOM 1449 CB THR A 97 -8.413 5.616 -2.672 1.00 0.00 C ATOM 1450 OG1 THR A 97 -7.156 5.341 -3.301 1.00 0.00 O ATOM 1451 CG2 THR A 97 -8.825 4.431 -1.811 1.00 0.00 C ATOM 0 H THR A 97 -8.036 7.143 -4.632 1.00 0.00 H new ATOM 0 HA THR A 97 -9.651 5.018 -4.335 1.00 0.00 H new ATOM 0 HB THR A 97 -8.315 6.493 -2.032 1.00 0.00 H new ATOM 0 HG1 THR A 97 -6.796 6.167 -3.687 1.00 0.00 H new ATOM 0 HG21 THR A 97 -8.055 4.239 -1.064 1.00 0.00 H new ATOM 0 HG22 THR A 97 -9.767 4.655 -1.311 1.00 0.00 H new ATOM 0 HG23 THR A 97 -8.948 3.550 -2.440 1.00 0.00 H new ATOM 1459 N HIS A 98 -10.866 7.576 -2.642 1.00 0.00 N ATOM 1460 CA HIS A 98 -12.056 8.083 -1.966 1.00 0.00 C ATOM 1461 C HIS A 98 -13.282 7.969 -2.867 1.00 0.00 C ATOM 1462 O HIS A 98 -14.332 7.485 -2.444 1.00 0.00 O ATOM 1463 CB HIS A 98 -11.849 9.539 -1.548 1.00 0.00 C ATOM 1464 CG HIS A 98 -13.035 10.138 -0.858 1.00 0.00 C ATOM 1465 ND1 HIS A 98 -14.022 9.380 -0.263 1.00 0.00 N ATOM 1466 CD2 HIS A 98 -13.390 11.430 -0.667 1.00 0.00 C ATOM 1467 CE1 HIS A 98 -14.932 10.180 0.262 1.00 0.00 C ATOM 1468 NE2 HIS A 98 -14.572 11.430 0.031 1.00 0.00 N ATOM 0 H HIS A 98 -10.127 8.267 -2.770 1.00 0.00 H new ATOM 0 HA HIS A 98 -12.224 7.478 -1.075 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -10.985 9.599 -0.886 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -11.615 10.132 -2.432 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -12.844 12.300 -1.002 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -15.820 9.866 0.791 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -15.088 12.260 0.324 1.00 0.00 H new ATOM 1476 N ARG A 99 -13.142 8.419 -4.109 1.00 0.00 N ATOM 1477 CA ARG A 99 -14.239 8.370 -5.068 1.00 0.00 C ATOM 1478 C ARG A 99 -14.711 6.934 -5.280 1.00 0.00 C ATOM 1479 O ARG A 99 -15.906 6.646 -5.207 1.00 0.00 O ATOM 1480 CB ARG A 99 -13.805 8.978 -6.403 1.00 0.00 C ATOM 1481 CG ARG A 99 -14.967 9.411 -7.281 1.00 0.00 C ATOM 1482 CD ARG A 99 -14.564 9.480 -8.746 1.00 0.00 C ATOM 1483 NE ARG A 99 -15.696 9.801 -9.611 1.00 0.00 N ATOM 1484 CZ ARG A 99 -15.749 9.484 -10.900 1.00 0.00 C ATOM 1485 NH1 ARG A 99 -14.739 8.841 -11.470 1.00 0.00 N ATOM 1486 NH2 ARG A 99 -16.814 9.810 -11.622 1.00 0.00 N ATOM 0 H ARG A 99 -12.279 8.822 -4.475 1.00 0.00 H new ATOM 0 HA ARG A 99 -15.068 8.951 -4.665 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -13.166 9.840 -6.210 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -13.202 8.250 -6.946 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -15.794 8.711 -7.163 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -15.326 10.387 -6.955 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -13.786 10.233 -8.873 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -14.136 8.525 -9.049 1.00 0.00 H new ATOM 0 HE ARG A 99 -16.489 10.296 -9.203 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -13.919 8.589 -10.919 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -14.782 8.599 -12.460 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -17.593 10.305 -11.187 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -16.853 9.566 -12.612 1.00 0.00 H new ATOM 1500 N LEU A 100 -13.766 6.039 -5.544 1.00 0.00 N ATOM 1501 CA LEU A 100 -14.084 4.633 -5.767 1.00 0.00 C ATOM 1502 C LEU A 100 -15.115 4.141 -4.756 1.00 0.00 C ATOM 1503 O LEU A 100 -16.175 3.637 -5.129 1.00 0.00 O ATOM 1504 CB LEU A 100 -12.817 3.782 -5.676 1.00 0.00 C ATOM 1505 CG LEU A 100 -11.707 4.122 -6.671 1.00 0.00 C ATOM 1506 CD1 LEU A 100 -10.467 3.286 -6.395 1.00 0.00 C ATOM 1507 CD2 LEU A 100 -12.187 3.911 -8.099 1.00 0.00 C ATOM 0 H LEU A 100 -12.773 6.262 -5.609 1.00 0.00 H new ATOM 0 HA LEU A 100 -14.508 4.536 -6.767 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -12.414 3.873 -4.667 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -13.094 2.737 -5.815 1.00 0.00 H new ATOM 0 HG LEU A 100 -11.446 5.173 -6.548 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -9.688 3.542 -7.113 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -10.110 3.487 -5.385 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -10.713 2.228 -6.489 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -11.384 4.158 -8.793 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -12.477 2.869 -8.235 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -13.045 4.555 -8.293 1.00 0.00 H new ATOM 1519 N HIS A 101 -14.798 4.293 -3.474 1.00 0.00 N ATOM 1520 CA HIS A 101 -15.698 3.866 -2.408 1.00 0.00 C ATOM 1521 C HIS A 101 -17.125 4.330 -2.684 1.00 0.00 C ATOM 1522 O HIS A 101 -18.066 3.539 -2.636 1.00 0.00 O ATOM 1523 CB HIS A 101 -15.222 4.413 -1.062 1.00 0.00 C ATOM 1524 CG HIS A 101 -15.934 3.815 0.113 1.00 0.00 C ATOM 1525 ND1 HIS A 101 -15.999 2.456 0.341 1.00 0.00 N ATOM 1526 CD2 HIS A 101 -16.613 4.398 1.128 1.00 0.00 C ATOM 1527 CE1 HIS A 101 -16.689 2.231 1.445 1.00 0.00 C ATOM 1528 NE2 HIS A 101 -17.072 3.393 1.942 1.00 0.00 N ATOM 0 H HIS A 101 -13.925 4.708 -3.148 1.00 0.00 H new ATOM 0 HA HIS A 101 -15.690 2.777 -2.372 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -14.153 4.228 -0.961 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -15.361 5.494 -1.049 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -16.765 5.458 1.271 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -16.903 1.261 1.869 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -17.620 3.522 2.793 1.00 0.00 H new ATOM 1536 N LYS A 102 -17.278 5.618 -2.972 1.00 0.00 N ATOM 1537 CA LYS A 102 -18.589 6.189 -3.256 1.00 0.00 C ATOM 1538 C LYS A 102 -19.307 5.390 -4.339 1.00 0.00 C ATOM 1539 O LYS A 102 -20.364 4.810 -4.096 1.00 0.00 O ATOM 1540 CB LYS A 102 -18.449 7.649 -3.692 1.00 0.00 C ATOM 1541 CG LYS A 102 -17.663 8.504 -2.713 1.00 0.00 C ATOM 1542 CD LYS A 102 -18.009 9.976 -2.855 1.00 0.00 C ATOM 1543 CE LYS A 102 -17.325 10.596 -4.064 1.00 0.00 C ATOM 1544 NZ LYS A 102 -18.053 11.798 -4.557 1.00 0.00 N ATOM 0 H LYS A 102 -16.509 6.287 -3.015 1.00 0.00 H new ATOM 0 HA LYS A 102 -19.183 6.145 -2.343 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -17.960 7.683 -4.665 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -19.443 8.078 -3.820 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -17.872 8.177 -1.694 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -16.595 8.363 -2.881 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -19.089 10.089 -2.949 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -17.710 10.510 -1.953 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -16.304 10.872 -3.802 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -17.260 9.857 -4.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -17.556 12.191 -5.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -19.020 11.530 -4.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -18.093 12.513 -3.803 1.00 0.00 H new ATOM 1558 N GLU A 103 -18.724 5.365 -5.533 1.00 0.00 N ATOM 1559 CA GLU A 103 -19.309 4.637 -6.653 1.00 0.00 C ATOM 1560 C GLU A 103 -19.388 3.143 -6.348 1.00 0.00 C ATOM 1561 O GLU A 103 -20.188 2.420 -6.939 1.00 0.00 O ATOM 1562 CB GLU A 103 -18.490 4.866 -7.924 1.00 0.00 C ATOM 1563 CG GLU A 103 -18.736 6.219 -8.571 1.00 0.00 C ATOM 1564 CD GLU A 103 -19.859 6.183 -9.589 1.00 0.00 C ATOM 1565 OE1 GLU A 103 -20.947 5.668 -9.256 1.00 0.00 O ATOM 1566 OE2 GLU A 103 -19.650 6.670 -10.720 1.00 0.00 O ATOM 0 H GLU A 103 -17.848 5.840 -5.750 1.00 0.00 H new ATOM 0 HA GLU A 103 -20.320 5.013 -6.809 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -17.431 4.774 -7.685 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -18.724 4.081 -8.643 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -18.975 6.949 -7.798 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -17.821 6.557 -9.057 1.00 0.00 H new ATOM 1573 N GLY A 104 -18.550 2.689 -5.421 1.00 0.00 N ATOM 1574 CA GLY A 104 -18.540 1.285 -5.054 1.00 0.00 C ATOM 1575 C GLY A 104 -17.485 0.497 -5.805 1.00 0.00 C ATOM 1576 O GLY A 104 -17.772 -0.556 -6.373 1.00 0.00 O ATOM 0 H GLY A 104 -17.878 3.268 -4.918 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -18.363 1.194 -3.982 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -19.521 0.854 -5.253 1.00 0.00 H new ATOM 1580 N LYS A 105 -16.259 1.009 -5.809 1.00 0.00 N ATOM 1581 CA LYS A 105 -15.155 0.348 -6.496 1.00 0.00 C ATOM 1582 C LYS A 105 -14.013 0.052 -5.530 1.00 0.00 C ATOM 1583 O LYS A 105 -13.035 -0.604 -5.891 1.00 0.00 O ATOM 1584 CB LYS A 105 -14.650 1.219 -7.648 1.00 0.00 C ATOM 1585 CG LYS A 105 -15.611 1.292 -8.822 1.00 0.00 C ATOM 1586 CD LYS A 105 -15.404 2.560 -9.634 1.00 0.00 C ATOM 1587 CE LYS A 105 -16.333 2.610 -10.837 1.00 0.00 C ATOM 1588 NZ LYS A 105 -15.740 1.934 -12.024 1.00 0.00 N ATOM 0 H LYS A 105 -16.004 1.880 -5.344 1.00 0.00 H new ATOM 0 HA LYS A 105 -15.522 -0.597 -6.897 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -14.466 2.227 -7.277 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -13.694 0.828 -7.996 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -15.471 0.422 -9.463 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -16.637 1.257 -8.456 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -15.579 3.431 -9.002 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -14.369 2.613 -9.970 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -17.281 2.135 -10.584 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -16.553 3.649 -11.083 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -16.404 1.990 -12.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -14.848 2.403 -12.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -15.553 0.936 -11.798 1.00 0.00 H new ATOM 1602 N LEU A 106 -14.144 0.536 -4.300 1.00 0.00 N ATOM 1603 CA LEU A 106 -13.122 0.322 -3.280 1.00 0.00 C ATOM 1604 C LEU A 106 -13.492 -0.851 -2.378 1.00 0.00 C ATOM 1605 O LEU A 106 -12.707 -1.783 -2.200 1.00 0.00 O ATOM 1606 CB LEU A 106 -12.937 1.587 -2.441 1.00 0.00 C ATOM 1607 CG LEU A 106 -11.679 1.640 -1.575 1.00 0.00 C ATOM 1608 CD1 LEU A 106 -11.585 2.974 -0.850 1.00 0.00 C ATOM 1609 CD2 LEU A 106 -11.668 0.489 -0.579 1.00 0.00 C ATOM 0 H LEU A 106 -14.947 1.079 -3.984 1.00 0.00 H new ATOM 0 HA LEU A 106 -12.184 0.088 -3.784 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -12.928 2.446 -3.112 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -13.806 1.699 -1.792 1.00 0.00 H new ATOM 0 HG LEU A 106 -10.810 1.541 -2.225 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -10.683 2.993 -0.238 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -11.546 3.783 -1.580 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -12.459 3.104 -0.212 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -10.765 0.543 0.029 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -12.544 0.557 0.066 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -11.687 -0.458 -1.118 1.00 0.00 H new ATOM 1621 N LEU A 107 -14.692 -0.799 -1.811 1.00 0.00 N ATOM 1622 CA LEU A 107 -15.168 -1.859 -0.928 1.00 0.00 C ATOM 1623 C LEU A 107 -15.093 -3.217 -1.618 1.00 0.00 C ATOM 1624 O LEU A 107 -14.660 -4.212 -1.037 1.00 0.00 O ATOM 1625 CB LEU A 107 -16.606 -1.576 -0.488 1.00 0.00 C ATOM 1626 CG LEU A 107 -17.018 -2.151 0.867 1.00 0.00 C ATOM 1627 CD1 LEU A 107 -17.417 -3.612 0.728 1.00 0.00 C ATOM 1628 CD2 LEU A 107 -15.891 -1.997 1.877 1.00 0.00 C ATOM 0 H LEU A 107 -15.353 -0.034 -1.947 1.00 0.00 H new ATOM 0 HA LEU A 107 -14.524 -1.883 -0.049 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -16.751 -0.496 -0.461 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -17.281 -1.969 -1.248 1.00 0.00 H new ATOM 0 HG LEU A 107 -17.882 -1.593 1.229 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -17.707 -4.004 1.703 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -18.257 -3.696 0.038 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -16.573 -4.185 0.343 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -16.202 -2.412 2.836 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -15.008 -2.528 1.521 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -15.654 -0.940 1.999 1.00 0.00 H new ATOM 1640 N PRO A 108 -15.522 -3.261 -2.887 1.00 0.00 N ATOM 1641 CA PRO A 108 -15.511 -4.491 -3.685 1.00 0.00 C ATOM 1642 C PRO A 108 -14.176 -5.223 -3.602 1.00 0.00 C ATOM 1643 O PRO A 108 -14.126 -6.453 -3.662 1.00 0.00 O ATOM 1644 CB PRO A 108 -15.760 -3.992 -5.110 1.00 0.00 C ATOM 1645 CG PRO A 108 -16.503 -2.712 -4.939 1.00 0.00 C ATOM 1646 CD PRO A 108 -16.052 -2.113 -3.643 1.00 0.00 C ATOM 0 HA PRO A 108 -16.252 -5.210 -3.336 1.00 0.00 H new ATOM 0 HB2 PRO A 108 -14.823 -3.837 -5.645 1.00 0.00 H new ATOM 0 HB3 PRO A 108 -16.340 -4.713 -5.686 1.00 0.00 H new ATOM 0 HG2 PRO A 108 -16.300 -2.034 -5.768 1.00 0.00 H new ATOM 0 HG3 PRO A 108 -17.578 -2.889 -4.928 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -15.289 -1.351 -3.799 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -16.877 -1.634 -3.116 1.00 0.00 H new ATOM 1654 N LEU A 109 -13.097 -4.461 -3.464 1.00 0.00 N ATOM 1655 CA LEU A 109 -11.760 -5.038 -3.373 1.00 0.00 C ATOM 1656 C LEU A 109 -11.427 -5.417 -1.933 1.00 0.00 C ATOM 1657 O LEU A 109 -10.741 -6.408 -1.684 1.00 0.00 O ATOM 1658 CB LEU A 109 -10.720 -4.051 -3.906 1.00 0.00 C ATOM 1659 CG LEU A 109 -10.986 -3.483 -5.300 1.00 0.00 C ATOM 1660 CD1 LEU A 109 -10.231 -2.178 -5.498 1.00 0.00 C ATOM 1661 CD2 LEU A 109 -10.600 -4.493 -6.371 1.00 0.00 C ATOM 0 H LEU A 109 -13.121 -3.443 -3.413 1.00 0.00 H new ATOM 0 HA LEU A 109 -11.739 -5.942 -3.981 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.645 -3.220 -3.205 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -9.750 -4.547 -3.917 1.00 0.00 H new ATOM 0 HG LEU A 109 -12.053 -3.279 -5.390 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -10.433 -1.789 -6.496 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -10.557 -1.452 -4.753 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -9.161 -2.356 -5.387 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -10.796 -4.071 -7.357 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -9.540 -4.730 -6.282 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -11.187 -5.402 -6.242 1.00 0.00 H new ATOM 1673 N VAL A 110 -11.920 -4.622 -0.989 1.00 0.00 N ATOM 1674 CA VAL A 110 -11.679 -4.875 0.426 1.00 0.00 C ATOM 1675 C VAL A 110 -12.153 -6.268 0.824 1.00 0.00 C ATOM 1676 O VAL A 110 -11.365 -7.099 1.275 1.00 0.00 O ATOM 1677 CB VAL A 110 -12.385 -3.832 1.312 1.00 0.00 C ATOM 1678 CG1 VAL A 110 -12.188 -4.159 2.784 1.00 0.00 C ATOM 1679 CG2 VAL A 110 -11.877 -2.433 0.996 1.00 0.00 C ATOM 0 H VAL A 110 -12.489 -3.797 -1.179 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.602 -4.803 0.581 1.00 0.00 H new ATOM 0 HB VAL A 110 -13.453 -3.863 1.098 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -12.694 -3.411 3.394 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -12.605 -5.143 2.997 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -11.123 -4.158 3.018 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -12.387 -1.709 1.631 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.804 -2.385 1.180 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -12.076 -2.201 -0.050 1.00 0.00 H new ATOM 1689 N HIS A 111 -13.448 -6.517 0.654 1.00 0.00 N ATOM 1690 CA HIS A 111 -14.029 -7.811 0.995 1.00 0.00 C ATOM 1691 C HIS A 111 -13.259 -8.945 0.324 1.00 0.00 C ATOM 1692 O HIS A 111 -12.837 -9.895 0.983 1.00 0.00 O ATOM 1693 CB HIS A 111 -15.499 -7.860 0.578 1.00 0.00 C ATOM 1694 CG HIS A 111 -16.420 -7.189 1.550 1.00 0.00 C ATOM 1695 ND1 HIS A 111 -17.669 -6.721 1.202 1.00 0.00 N ATOM 1696 CD2 HIS A 111 -16.268 -6.911 2.865 1.00 0.00 C ATOM 1697 CE1 HIS A 111 -18.245 -6.182 2.262 1.00 0.00 C ATOM 1698 NE2 HIS A 111 -17.416 -6.284 3.284 1.00 0.00 N ATOM 0 H HIS A 111 -14.114 -5.840 0.282 1.00 0.00 H new ATOM 0 HA HIS A 111 -13.962 -7.939 2.075 1.00 0.00 H new ATOM 0 HB2 HIS A 111 -15.607 -7.387 -0.398 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -15.801 -8.901 0.463 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -15.405 -7.139 3.472 1.00 0.00 H new ATOM 0 HE1 HIS A 111 -19.227 -5.734 2.288 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -17.598 -5.951 4.231 1.00 0.00 H new ATOM 1706 N GLN A 112 -13.082 -8.839 -0.989 1.00 0.00 N ATOM 1707 CA GLN A 112 -12.365 -9.856 -1.748 1.00 0.00 C ATOM 1708 C GLN A 112 -11.136 -10.339 -0.985 1.00 0.00 C ATOM 1709 O GLN A 112 -10.897 -11.541 -0.869 1.00 0.00 O ATOM 1710 CB GLN A 112 -11.949 -9.306 -3.113 1.00 0.00 C ATOM 1711 CG GLN A 112 -13.102 -9.182 -4.096 1.00 0.00 C ATOM 1712 CD GLN A 112 -13.435 -10.497 -4.774 1.00 0.00 C ATOM 1713 OE1 GLN A 112 -14.455 -11.120 -4.479 1.00 0.00 O ATOM 1714 NE2 GLN A 112 -12.573 -10.926 -5.688 1.00 0.00 N ATOM 0 H GLN A 112 -13.425 -8.059 -1.549 1.00 0.00 H new ATOM 0 HA GLN A 112 -13.035 -10.703 -1.895 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -11.492 -8.326 -2.977 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -11.186 -9.957 -3.541 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -13.984 -8.815 -3.571 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -12.850 -8.440 -4.854 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -11.740 -10.377 -5.901 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -12.744 -11.805 -6.177 1.00 0.00 H new ATOM 1723 N CYS A 113 -10.359 -9.394 -0.467 1.00 0.00 N ATOM 1724 CA CYS A 113 -9.153 -9.722 0.285 1.00 0.00 C ATOM 1725 C CYS A 113 -9.403 -10.894 1.230 1.00 0.00 C ATOM 1726 O CYS A 113 -8.567 -11.788 1.361 1.00 0.00 O ATOM 1727 CB CYS A 113 -8.675 -8.505 1.079 1.00 0.00 C ATOM 1728 SG CYS A 113 -7.183 -8.808 2.078 1.00 0.00 S ATOM 0 H CYS A 113 -10.543 -8.394 -0.554 1.00 0.00 H new ATOM 0 HA CYS A 113 -8.379 -10.010 -0.426 1.00 0.00 H new ATOM 0 HB2 CYS A 113 -8.475 -7.688 0.386 1.00 0.00 H new ATOM 0 HB3 CYS A 113 -9.479 -8.175 1.737 1.00 0.00 H new ATOM 1733 N TYR A 114 -10.558 -10.882 1.885 1.00 0.00 N ATOM 1734 CA TYR A 114 -10.918 -11.942 2.820 1.00 0.00 C ATOM 1735 C TYR A 114 -12.331 -12.450 2.550 1.00 0.00 C ATOM 1736 O TYR A 114 -13.277 -12.091 3.252 1.00 0.00 O ATOM 1737 CB TYR A 114 -10.811 -11.438 4.260 1.00 0.00 C ATOM 1738 CG TYR A 114 -11.828 -10.375 4.607 1.00 0.00 C ATOM 1739 CD1 TYR A 114 -11.821 -9.143 3.963 1.00 0.00 C ATOM 1740 CD2 TYR A 114 -12.795 -10.600 5.578 1.00 0.00 C ATOM 1741 CE1 TYR A 114 -12.748 -8.168 4.277 1.00 0.00 C ATOM 1742 CE2 TYR A 114 -13.727 -9.631 5.898 1.00 0.00 C ATOM 1743 CZ TYR A 114 -13.699 -8.417 5.244 1.00 0.00 C ATOM 1744 OH TYR A 114 -14.624 -7.449 5.560 1.00 0.00 O ATOM 0 H TYR A 114 -11.261 -10.150 1.786 1.00 0.00 H new ATOM 0 HA TYR A 114 -10.222 -12.769 2.679 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -10.932 -12.281 4.941 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -9.810 -11.038 4.423 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -11.078 -8.945 3.204 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -12.819 -11.549 6.092 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -12.728 -7.216 3.768 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -14.473 -9.823 6.655 1.00 0.00 H new ATOM 0 HH TYR A 114 -15.223 -7.785 6.260 1.00 0.00 H new ATOM 1754 N LEU A 115 -12.467 -13.287 1.528 1.00 0.00 N ATOM 1755 CA LEU A 115 -13.764 -13.846 1.164 1.00 0.00 C ATOM 1756 C LEU A 115 -13.670 -15.356 0.966 1.00 0.00 C ATOM 1757 O LEU A 115 -14.518 -16.110 1.445 1.00 0.00 O ATOM 1758 CB LEU A 115 -14.286 -13.185 -0.113 1.00 0.00 C ATOM 1759 CG LEU A 115 -15.140 -11.932 0.081 1.00 0.00 C ATOM 1760 CD1 LEU A 115 -15.481 -11.305 -1.262 1.00 0.00 C ATOM 1761 CD2 LEU A 115 -16.408 -12.265 0.854 1.00 0.00 C ATOM 0 H LEU A 115 -11.695 -13.594 0.936 1.00 0.00 H new ATOM 0 HA LEU A 115 -14.459 -13.647 1.980 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -13.432 -12.925 -0.739 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -14.874 -13.919 -0.664 1.00 0.00 H new ATOM 0 HG LEU A 115 -14.565 -11.210 0.660 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -16.089 -10.414 -1.104 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -14.562 -11.029 -1.779 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -16.037 -12.021 -1.867 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -17.004 -11.361 0.983 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -16.987 -13.005 0.302 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -16.143 -12.667 1.832 1.00 0.00 H new ATOM 1773 N LYS A 116 -12.632 -15.792 0.260 1.00 0.00 N ATOM 1774 CA LYS A 116 -12.424 -17.211 0.002 1.00 0.00 C ATOM 1775 C LYS A 116 -11.869 -17.914 1.237 1.00 0.00 C ATOM 1776 O LYS A 116 -12.339 -18.985 1.619 1.00 0.00 O ATOM 1777 CB LYS A 116 -11.468 -17.401 -1.178 1.00 0.00 C ATOM 1778 CG LYS A 116 -11.557 -18.776 -1.818 1.00 0.00 C ATOM 1779 CD LYS A 116 -10.820 -18.822 -3.146 1.00 0.00 C ATOM 1780 CE LYS A 116 -9.316 -18.925 -2.945 1.00 0.00 C ATOM 1781 NZ LYS A 116 -8.931 -20.199 -2.277 1.00 0.00 N ATOM 0 H LYS A 116 -11.921 -15.182 -0.144 1.00 0.00 H new ATOM 0 HA LYS A 116 -13.389 -17.655 -0.244 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -11.681 -16.644 -1.933 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -10.446 -17.233 -0.838 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -11.137 -19.521 -1.142 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -12.603 -19.039 -1.972 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -11.170 -19.675 -3.728 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -11.051 -17.926 -3.723 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -8.815 -18.856 -3.911 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -8.971 -18.082 -2.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -7.934 -20.412 -2.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -9.059 -20.105 -1.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -9.531 -20.972 -2.631 1.00 0.00 H new ATOM 1795 N LYS A 117 -10.866 -17.302 1.859 1.00 0.00 N ATOM 1796 CA LYS A 117 -10.249 -17.867 3.053 1.00 0.00 C ATOM 1797 C LYS A 117 -11.308 -18.303 4.060 1.00 0.00 C ATOM 1798 O LYS A 117 -12.483 -17.960 3.927 1.00 0.00 O ATOM 1799 CB LYS A 117 -9.309 -16.845 3.698 1.00 0.00 C ATOM 1800 CG LYS A 117 -8.405 -17.438 4.765 1.00 0.00 C ATOM 1801 CD LYS A 117 -7.315 -16.463 5.178 1.00 0.00 C ATOM 1802 CE LYS A 117 -6.131 -16.516 4.224 1.00 0.00 C ATOM 1803 NZ LYS A 117 -5.246 -17.680 4.502 1.00 0.00 N ATOM 0 H LYS A 117 -10.464 -16.415 1.556 1.00 0.00 H new ATOM 0 HA LYS A 117 -9.675 -18.744 2.754 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -8.692 -16.391 2.922 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -9.904 -16.046 4.141 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -9.000 -17.710 5.637 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -7.951 -18.355 4.390 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -7.720 -15.451 5.202 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -6.980 -16.696 6.189 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -6.494 -16.573 3.198 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -5.556 -15.594 4.308 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -4.452 -17.680 3.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -4.879 -17.613 5.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -5.788 -18.561 4.397 1.00 0.00 H new ATOM 1817 N SER A 118 -10.886 -19.061 5.066 1.00 0.00 N ATOM 1818 CA SER A 118 -11.799 -19.547 6.094 1.00 0.00 C ATOM 1819 C SER A 118 -11.761 -18.645 7.324 1.00 0.00 C ATOM 1820 O SER A 118 -10.793 -17.918 7.547 1.00 0.00 O ATOM 1821 CB SER A 118 -11.442 -20.981 6.488 1.00 0.00 C ATOM 1822 OG SER A 118 -10.129 -21.053 7.015 1.00 0.00 O ATOM 0 H SER A 118 -9.917 -19.352 5.192 1.00 0.00 H new ATOM 0 HA SER A 118 -12.809 -19.532 5.684 1.00 0.00 H new ATOM 0 HB2 SER A 118 -12.155 -21.346 7.227 1.00 0.00 H new ATOM 0 HB3 SER A 118 -11.524 -21.632 5.617 1.00 0.00 H new ATOM 0 HG SER A 118 -9.926 -21.980 7.261 1.00 0.00 H new ATOM 1828 N LYS A 119 -12.823 -18.698 8.122 1.00 0.00 N ATOM 1829 CA LYS A 119 -12.913 -17.889 9.331 1.00 0.00 C ATOM 1830 C LYS A 119 -11.800 -18.247 10.311 1.00 0.00 C ATOM 1831 O LYS A 119 -11.676 -19.399 10.728 1.00 0.00 O ATOM 1832 CB LYS A 119 -14.277 -18.082 9.998 1.00 0.00 C ATOM 1833 CG LYS A 119 -14.460 -17.255 11.259 1.00 0.00 C ATOM 1834 CD LYS A 119 -15.688 -17.692 12.040 1.00 0.00 C ATOM 1835 CE LYS A 119 -15.701 -17.095 13.438 1.00 0.00 C ATOM 1836 NZ LYS A 119 -17.027 -17.256 14.098 1.00 0.00 N ATOM 0 H LYS A 119 -13.634 -19.293 7.952 1.00 0.00 H new ATOM 0 HA LYS A 119 -12.799 -16.843 9.047 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -15.060 -17.822 9.286 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -14.406 -19.136 10.243 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -13.575 -17.349 11.888 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -14.552 -16.202 10.994 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -16.588 -17.388 11.505 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -15.709 -18.780 12.108 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -14.933 -17.574 14.045 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -15.449 -16.036 13.383 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -16.995 -16.836 15.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -17.757 -16.777 13.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -17.256 -18.268 14.174 1.00 0.00 H new ATOM 1850 N ARG A 120 -10.995 -17.255 10.674 1.00 0.00 N ATOM 1851 CA ARG A 120 -9.893 -17.466 11.605 1.00 0.00 C ATOM 1852 C ARG A 120 -10.348 -17.247 13.045 1.00 0.00 C ATOM 1853 O ARG A 120 -10.287 -16.132 13.564 1.00 0.00 O ATOM 1854 CB ARG A 120 -8.732 -16.526 11.277 1.00 0.00 C ATOM 1855 CG ARG A 120 -7.607 -16.569 12.297 1.00 0.00 C ATOM 1856 CD ARG A 120 -6.608 -15.444 12.072 1.00 0.00 C ATOM 1857 NE ARG A 120 -5.634 -15.776 11.035 1.00 0.00 N ATOM 1858 CZ ARG A 120 -4.976 -14.866 10.327 1.00 0.00 C ATOM 1859 NH1 ARG A 120 -5.185 -13.575 10.542 1.00 0.00 N ATOM 1860 NH2 ARG A 120 -4.105 -15.246 9.400 1.00 0.00 N ATOM 0 H ARG A 120 -11.085 -16.296 10.338 1.00 0.00 H new ATOM 0 HA ARG A 120 -9.556 -18.497 11.501 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -8.332 -16.785 10.297 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -9.110 -15.506 11.208 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -8.022 -16.493 13.302 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -7.095 -17.529 12.236 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -7.142 -14.536 11.791 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -6.086 -15.231 13.005 1.00 0.00 H new ATOM 0 HE ARG A 120 -5.449 -16.761 10.845 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -5.853 -13.278 11.253 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -4.678 -12.878 9.996 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -3.941 -16.238 9.231 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -3.600 -14.546 8.857 1.00 0.00 H new ATOM 1874 N LYS A 121 -10.805 -18.318 13.685 1.00 0.00 N ATOM 1875 CA LYS A 121 -11.270 -18.244 15.065 1.00 0.00 C ATOM 1876 C LYS A 121 -10.159 -17.756 15.988 1.00 0.00 C ATOM 1877 O LYS A 121 -8.986 -17.756 15.616 1.00 0.00 O ATOM 1878 CB LYS A 121 -11.770 -19.614 15.530 1.00 0.00 C ATOM 1879 CG LYS A 121 -12.433 -19.588 16.896 1.00 0.00 C ATOM 1880 CD LYS A 121 -13.448 -20.709 17.045 1.00 0.00 C ATOM 1881 CE LYS A 121 -13.759 -20.989 18.507 1.00 0.00 C ATOM 1882 NZ LYS A 121 -14.792 -20.060 19.042 1.00 0.00 N ATOM 0 H LYS A 121 -10.863 -19.248 13.270 1.00 0.00 H new ATOM 0 HA LYS A 121 -12.093 -17.530 15.107 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -12.480 -20.000 14.798 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -10.930 -20.308 15.556 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -11.673 -19.679 17.672 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -12.926 -18.627 17.044 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -14.366 -20.442 16.521 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -13.064 -21.614 16.574 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -14.105 -22.017 18.614 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -12.847 -20.896 19.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -14.976 -20.283 20.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -14.452 -19.080 18.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -15.671 -20.166 18.496 1.00 0.00 H new ATOM 1896 N GLU A 122 -10.536 -17.344 17.195 1.00 0.00 N ATOM 1897 CA GLU A 122 -9.569 -16.854 18.170 1.00 0.00 C ATOM 1898 C GLU A 122 -9.845 -17.442 19.551 1.00 0.00 C ATOM 1899 O GLU A 122 -10.966 -17.855 19.850 1.00 0.00 O ATOM 1900 CB GLU A 122 -9.608 -15.326 18.237 1.00 0.00 C ATOM 1901 CG GLU A 122 -10.848 -14.778 18.922 1.00 0.00 C ATOM 1902 CD GLU A 122 -12.132 -15.314 18.320 1.00 0.00 C ATOM 1903 OE1 GLU A 122 -12.550 -14.804 17.261 1.00 0.00 O ATOM 1904 OE2 GLU A 122 -12.719 -16.246 18.910 1.00 0.00 O ATOM 0 H GLU A 122 -11.503 -17.340 17.520 1.00 0.00 H new ATOM 0 HA GLU A 122 -8.576 -17.171 17.850 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -8.724 -14.971 18.767 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -9.555 -14.925 17.225 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -10.815 -15.031 19.982 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -10.845 -13.690 18.854 1.00 0.00 H new ATOM 1911 N PHE A 123 -8.815 -17.476 20.390 1.00 0.00 N ATOM 1912 CA PHE A 123 -8.945 -18.015 21.739 1.00 0.00 C ATOM 1913 C PHE A 123 -8.478 -16.998 22.777 1.00 0.00 C ATOM 1914 O PHE A 123 -7.989 -15.923 22.431 1.00 0.00 O ATOM 1915 CB PHE A 123 -8.137 -19.307 21.875 1.00 0.00 C ATOM 1916 CG PHE A 123 -6.652 -19.099 21.782 1.00 0.00 C ATOM 1917 CD1 PHE A 123 -5.951 -18.534 22.835 1.00 0.00 C ATOM 1918 CD2 PHE A 123 -5.958 -19.468 20.641 1.00 0.00 C ATOM 1919 CE1 PHE A 123 -4.585 -18.341 22.752 1.00 0.00 C ATOM 1920 CE2 PHE A 123 -4.592 -19.278 20.553 1.00 0.00 C ATOM 1921 CZ PHE A 123 -3.905 -18.713 21.609 1.00 0.00 C ATOM 0 H PHE A 123 -7.881 -17.137 20.160 1.00 0.00 H new ATOM 0 HA PHE A 123 -9.998 -18.233 21.917 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -8.371 -19.773 22.832 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -8.448 -20.004 21.096 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -6.478 -18.241 23.731 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -6.490 -19.909 19.811 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -4.050 -17.900 23.580 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -4.062 -19.571 19.659 1.00 0.00 H new ATOM 0 HZ PHE A 123 -2.838 -18.562 21.541 1.00 0.00 H new ATOM 1931 N GLN A 124 -8.634 -17.347 24.050 1.00 0.00 N ATOM 1932 CA GLN A 124 -8.231 -16.465 25.139 1.00 0.00 C ATOM 1933 C GLN A 124 -7.018 -17.027 25.873 1.00 0.00 C ATOM 1934 O GLN A 124 -6.808 -18.240 25.908 1.00 0.00 O ATOM 1935 CB GLN A 124 -9.389 -16.267 26.118 1.00 0.00 C ATOM 1936 CG GLN A 124 -9.679 -17.490 26.973 1.00 0.00 C ATOM 1937 CD GLN A 124 -10.585 -17.179 28.148 1.00 0.00 C ATOM 1938 OE1 GLN A 124 -11.791 -17.424 28.100 1.00 0.00 O ATOM 1939 NE2 GLN A 124 -10.007 -16.636 29.213 1.00 0.00 N ATOM 0 H GLN A 124 -9.036 -18.234 24.353 1.00 0.00 H new ATOM 0 HA GLN A 124 -7.959 -15.500 24.711 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -9.162 -15.424 26.770 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.286 -16.005 25.558 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -10.143 -18.259 26.355 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -8.740 -17.901 27.342 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -9.004 -16.450 29.210 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -10.566 -16.405 30.034 1.00 0.00 H new ATOM 1948 N SER A 125 -6.223 -16.138 26.459 1.00 0.00 N ATOM 1949 CA SER A 125 -5.028 -16.545 27.190 1.00 0.00 C ATOM 1950 C SER A 125 -5.265 -16.484 28.696 1.00 0.00 C ATOM 1951 O SER A 125 -6.268 -15.940 29.156 1.00 0.00 O ATOM 1952 CB SER A 125 -3.845 -15.652 26.812 1.00 0.00 C ATOM 1953 OG SER A 125 -3.290 -16.040 25.567 1.00 0.00 O ATOM 0 H SER A 125 -6.384 -15.131 26.442 1.00 0.00 H new ATOM 0 HA SER A 125 -4.798 -17.575 26.917 1.00 0.00 H new ATOM 0 HB2 SER A 125 -4.171 -14.613 26.760 1.00 0.00 H new ATOM 0 HB3 SER A 125 -3.081 -15.708 27.587 1.00 0.00 H new ATOM 0 HG SER A 125 -2.537 -15.453 25.347 1.00 0.00 H new ATOM 1959 N GLY A 126 -4.334 -17.048 29.458 1.00 0.00 N ATOM 1960 CA GLY A 126 -4.459 -17.048 30.904 1.00 0.00 C ATOM 1961 C GLY A 126 -3.786 -15.851 31.545 1.00 0.00 C ATOM 1962 O GLY A 126 -3.784 -14.747 30.998 1.00 0.00 O ATOM 0 H GLY A 126 -3.495 -17.505 29.100 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -5.515 -17.055 31.174 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -4.022 -17.963 31.303 1.00 0.00 H new ATOM 1966 N PRO A 127 -3.199 -16.062 32.732 1.00 0.00 N ATOM 1967 CA PRO A 127 -2.509 -15.002 33.474 1.00 0.00 C ATOM 1968 C PRO A 127 -1.212 -14.571 32.798 1.00 0.00 C ATOM 1969 O PRO A 127 -0.413 -15.408 32.378 1.00 0.00 O ATOM 1970 CB PRO A 127 -2.217 -15.650 34.829 1.00 0.00 C ATOM 1971 CG PRO A 127 -2.173 -17.112 34.549 1.00 0.00 C ATOM 1972 CD PRO A 127 -3.162 -17.351 33.442 1.00 0.00 C ATOM 0 HA PRO A 127 -3.109 -14.094 33.541 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -1.271 -15.297 35.241 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -2.991 -15.410 35.558 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -1.171 -17.422 34.251 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -2.434 -17.688 35.437 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -2.843 -18.161 32.787 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -4.143 -17.623 33.832 1.00 0.00 H new ATOM 1980 N SER A 128 -1.008 -13.262 32.698 1.00 0.00 N ATOM 1981 CA SER A 128 0.192 -12.720 32.071 1.00 0.00 C ATOM 1982 C SER A 128 0.731 -11.533 32.863 1.00 0.00 C ATOM 1983 O SER A 128 0.108 -11.078 33.822 1.00 0.00 O ATOM 1984 CB SER A 128 -0.107 -12.294 30.632 1.00 0.00 C ATOM 1985 OG SER A 128 1.081 -12.230 29.862 1.00 0.00 O ATOM 0 H SER A 128 -1.658 -12.556 33.043 1.00 0.00 H new ATOM 0 HA SER A 128 0.951 -13.502 32.061 1.00 0.00 H new ATOM 0 HB2 SER A 128 -0.801 -13.000 30.177 1.00 0.00 H new ATOM 0 HB3 SER A 128 -0.597 -11.320 30.632 1.00 0.00 H new ATOM 0 HG SER A 128 0.863 -11.957 28.946 1.00 0.00 H new ATOM 1991 N SER A 129 1.895 -11.037 32.455 1.00 0.00 N ATOM 1992 CA SER A 129 2.521 -9.905 33.128 1.00 0.00 C ATOM 1993 C SER A 129 2.452 -8.651 32.262 1.00 0.00 C ATOM 1994 O SER A 129 2.606 -8.716 31.043 1.00 0.00 O ATOM 1995 CB SER A 129 3.979 -10.227 33.463 1.00 0.00 C ATOM 1996 OG SER A 129 4.630 -9.107 34.038 1.00 0.00 O ATOM 0 H SER A 129 2.423 -11.401 31.662 1.00 0.00 H new ATOM 0 HA SER A 129 1.975 -9.717 34.053 1.00 0.00 H new ATOM 0 HB2 SER A 129 4.019 -11.069 34.154 1.00 0.00 H new ATOM 0 HB3 SER A 129 4.504 -10.532 32.558 1.00 0.00 H new ATOM 0 HG SER A 129 5.559 -9.339 34.244 1.00 0.00 H new ATOM 2002 N GLY A 130 2.219 -7.509 32.902 1.00 0.00 N ATOM 2003 CA GLY A 130 2.133 -6.256 32.175 1.00 0.00 C ATOM 2004 C GLY A 130 2.764 -5.104 32.930 1.00 0.00 C ATOM 2005 O GLY A 130 2.094 -4.123 33.253 1.00 0.00 O ATOM 0 H GLY A 130 2.088 -7.429 33.910 1.00 0.00 H new ATOM 0 HA2 GLY A 130 2.625 -6.366 31.208 1.00 0.00 H new ATOM 0 HA3 GLY A 130 1.086 -6.026 31.976 1.00 0.00 H new TER 2009 GLY A 130