USER MOD reduce.3.24.130724 H: found=0, std=0, add=1319, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1324 hydrogens (29 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 94 HIS : no HE2:sc= 0.491 K(o=-0.5,f=-5.4!) USER MOD Set 1.2: A 137 TYR OH : rot -24:sc= -0.992 USER MOD Set 2.1: A 86 ASN : amide:sc= -0.203 X(o=-0.35,f=-0.3) USER MOD Set 2.2: A 89 SER OG : rot 170:sc= -0.148 USER MOD Set 3.1: A 87 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 124 THR OG1 : rot -147:sc= 0.79 USER MOD Set 4.1: A 16 LYS NZ :NH3+ -124:sc= -0.104 (180deg=-1.96!) USER MOD Set 4.2: A 58 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 1 MET CE :methyl -132:sc= -0.191 (180deg=-1.55) USER MOD Set 5.2: A 43 GLN : amide:sc= 0 X(o=-0.19,f=-0.61) USER MOD Single : A 1 MET N :NH3+ -115:sc= 1.41 (180deg=-0.411) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 141:sc= 0.233 (180deg=0) USER MOD Single : A 20 THR OG1 : rot 74:sc= 0.00269 USER MOD Single : A 22 GLN : amide:sc= -1.19 K(o=-1.2,f=-3.9!) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 ASN : amide:sc= -2.46! C(o=-2.5!,f=-2.8!) USER MOD Single : A 27 HIS : no HD1:sc= -0.678 K(o=-0.68,f=-2.2) USER MOD Single : A 32 TYR OH : rot -113:sc= 1.69 USER MOD Single : A 35 SER OG : rot -49:sc= 0.33 USER MOD Single : A 39 SER OG : rot 49:sc= 0.38 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ -167:sc= 0.193 (180deg=0.132) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 18:sc= -1.23 USER MOD Single : A 61 GLN : amide:sc= -0.407 X(o=-0.41,f=-0.15) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl 151:sc= -13! (180deg=-17.4!) USER MOD Single : A 70 GLN : amide:sc= -1.91 K(o=-1.9,f=-7.6!) USER MOD Single : A 71 TYR OH : rot 150:sc= -0.458 USER MOD Single : A 72 MET CE :methyl -172:sc= -0.108 (180deg=-0.249) USER MOD Single : A 74 THR OG1 : rot 90:sc= -2.19! USER MOD Single : A 80 CYS SG : rot -176:sc= -0.489 USER MOD Single : A 85 ASN : amide:sc= -0.638 K(o=-0.64,f=-7.8!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -1 X(o=-1,f=-0.58) USER MOD Single : A 96 TYR OH : rot -84:sc= 1.17 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 LYS NZ :NH3+ 155:sc= 1.09 (180deg=0.712) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 48:sc= 1.2 USER MOD Single : A 111 MET CE :methyl -159:sc= -4.5! (180deg=-6.48!) USER MOD Single : A 116 ASN : amide:sc= -3.6! C(o=-3.6!,f=-12!) USER MOD Single : A 117 LYS NZ :NH3+ 157:sc= 0.988 (180deg=0.172!) USER MOD Single : A 118 CYS SG : rot -39:sc= -0.0335 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -0.0548 X(o=-0.055,f=0) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc= -0.086 USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 145 SER OG : rot -140:sc= 0.333 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 153:sc= -1.38 USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 THR OG1 : rot 66:sc= -0.114 USER MOD Single : A 165 GLN : amide:sc= -0.112 X(o=-0.11,f=0) USER MOD Single : A 166 HIS : no HE2:sc= 0 X(o=0,f=-0.098) USER MOD Single : A 201 GNP O2' : rot 170:sc= 0.376 USER MOD Single : A 201 GNP O3' : rot 137:sc= 0.0962 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.375 -0.714 23.323 1.00 52.12 N ATOM 2 CA MET A 1 -2.982 -0.296 22.032 1.00 25.14 C ATOM 3 C MET A 1 -3.333 -1.505 21.172 1.00 4.14 C ATOM 4 O MET A 1 -3.088 -2.647 21.560 1.00 22.11 O ATOM 5 CB MET A 1 -1.987 0.603 21.296 1.00 2.12 C ATOM 6 CG MET A 1 -0.613 -0.024 21.122 1.00 31.23 C ATOM 7 SD MET A 1 0.455 0.237 22.551 1.00 40.34 S ATOM 8 CE MET A 1 0.689 2.011 22.479 1.00 52.34 C ATOM 0 H1 MET A 1 -3.004 -0.443 24.106 1.00 52.12 H new ATOM 0 H2 MET A 1 -2.242 -1.745 23.326 1.00 52.12 H new ATOM 0 H3 MET A 1 -1.454 -0.246 23.441 1.00 52.12 H new ATOM 0 HA MET A 1 -3.906 0.247 22.229 1.00 25.14 H new ATOM 0 HB2 MET A 1 -2.391 0.851 20.314 1.00 2.12 H new ATOM 0 HB3 MET A 1 -1.883 1.540 21.843 1.00 2.12 H new ATOM 0 HG2 MET A 1 -0.726 -1.094 20.948 1.00 31.23 H new ATOM 0 HG3 MET A 1 -0.136 0.395 20.236 1.00 31.23 H new ATOM 0 HE1 MET A 1 1.749 2.243 22.583 1.00 52.34 H new ATOM 0 HE2 MET A 1 0.327 2.387 21.522 1.00 52.34 H new ATOM 0 HE3 MET A 1 0.133 2.484 23.288 1.00 52.34 H new ATOM 18 N THR A 2 -3.909 -1.247 20.002 1.00 60.14 N ATOM 19 CA THR A 2 -4.292 -2.315 19.088 1.00 63.04 C ATOM 20 C THR A 2 -3.215 -2.529 18.026 1.00 55.23 C ATOM 21 O THR A 2 -2.510 -1.594 17.645 1.00 53.05 O ATOM 22 CB THR A 2 -5.651 -1.997 18.441 1.00 74.25 C ATOM 23 OG1 THR A 2 -6.600 -2.998 18.760 1.00 71.13 O ATOM 24 CG2 THR A 2 -5.612 -1.876 16.929 1.00 12.03 C ATOM 0 H THR A 2 -4.120 -0.308 19.665 1.00 60.14 H new ATOM 0 HA THR A 2 -4.390 -3.241 19.654 1.00 63.04 H new ATOM 0 HB THR A 2 -5.929 -1.025 18.849 1.00 74.25 H new ATOM 0 HG1 THR A 2 -7.459 -2.779 18.342 1.00 71.13 H new ATOM 0 HG21 THR A 2 -6.611 -1.651 16.556 1.00 12.03 H new ATOM 0 HG22 THR A 2 -4.930 -1.074 16.646 1.00 12.03 H new ATOM 0 HG23 THR A 2 -5.267 -2.816 16.498 1.00 12.03 H new ATOM 32 N GLU A 3 -3.095 -3.764 17.553 1.00 4.11 N ATOM 33 CA GLU A 3 -2.106 -4.101 16.537 1.00 41.23 C ATOM 34 C GLU A 3 -2.762 -4.248 15.167 1.00 31.50 C ATOM 35 O GLU A 3 -3.497 -5.204 14.920 1.00 4.24 O ATOM 36 CB GLU A 3 -1.380 -5.396 16.913 1.00 34.03 C ATOM 37 CG GLU A 3 0.062 -5.182 17.343 1.00 21.23 C ATOM 38 CD GLU A 3 0.779 -6.484 17.645 1.00 24.53 C ATOM 39 OE1 GLU A 3 0.854 -7.344 16.742 1.00 5.21 O ATOM 40 OE2 GLU A 3 1.265 -6.644 18.785 1.00 30.21 O ATOM 0 H GLU A 3 -3.671 -4.549 17.857 1.00 4.11 H new ATOM 0 HA GLU A 3 -1.381 -3.289 16.486 1.00 41.23 H new ATOM 0 HB2 GLU A 3 -1.923 -5.885 17.722 1.00 34.03 H new ATOM 0 HB3 GLU A 3 -1.399 -6.074 16.060 1.00 34.03 H new ATOM 0 HG2 GLU A 3 0.597 -4.651 16.556 1.00 21.23 H new ATOM 0 HG3 GLU A 3 0.083 -4.546 18.228 1.00 21.23 H new ATOM 47 N TYR A 4 -2.491 -3.296 14.281 1.00 11.34 N ATOM 48 CA TYR A 4 -3.054 -3.322 12.936 1.00 73.30 C ATOM 49 C TYR A 4 -2.061 -3.924 11.947 1.00 3.32 C ATOM 50 O TYR A 4 -0.901 -3.517 11.892 1.00 44.23 O ATOM 51 CB TYR A 4 -3.443 -1.910 12.493 1.00 13.32 C ATOM 52 CG TYR A 4 -4.774 -1.447 13.041 1.00 71.40 C ATOM 53 CD1 TYR A 4 -5.928 -2.192 12.835 1.00 23.34 C ATOM 54 CD2 TYR A 4 -4.877 -0.265 13.765 1.00 41.13 C ATOM 55 CE1 TYR A 4 -7.147 -1.772 13.333 1.00 63.22 C ATOM 56 CE2 TYR A 4 -6.092 0.161 14.268 1.00 2.23 C ATOM 57 CZ TYR A 4 -7.223 -0.596 14.049 1.00 23.02 C ATOM 58 OH TYR A 4 -8.435 -0.175 14.548 1.00 40.25 O ATOM 0 H TYR A 4 -1.885 -2.497 14.470 1.00 11.34 H new ATOM 0 HA TYR A 4 -3.948 -3.945 12.954 1.00 73.30 H new ATOM 0 HB2 TYR A 4 -2.667 -1.213 12.809 1.00 13.32 H new ATOM 0 HB3 TYR A 4 -3.477 -1.877 11.404 1.00 13.32 H new ATOM 0 HD1 TYR A 4 -5.872 -3.115 12.276 1.00 23.34 H new ATOM 0 HD2 TYR A 4 -3.993 0.331 13.937 1.00 41.13 H new ATOM 0 HE1 TYR A 4 -8.035 -2.362 13.162 1.00 63.22 H new ATOM 0 HE2 TYR A 4 -6.155 1.082 14.829 1.00 2.23 H new ATOM 0 HH TYR A 4 -8.315 0.671 15.028 1.00 40.25 H new ATOM 68 N LYS A 5 -2.525 -4.896 11.169 1.00 70.45 N ATOM 69 CA LYS A 5 -1.679 -5.557 10.183 1.00 51.44 C ATOM 70 C LYS A 5 -2.036 -5.109 8.768 1.00 15.32 C ATOM 71 O LYS A 5 -2.929 -5.672 8.135 1.00 15.33 O ATOM 72 CB LYS A 5 -1.821 -7.078 10.302 1.00 73.21 C ATOM 73 CG LYS A 5 -0.653 -7.749 11.006 1.00 60.11 C ATOM 74 CD LYS A 5 0.404 -8.205 10.016 1.00 53.44 C ATOM 75 CE LYS A 5 0.999 -9.544 10.417 1.00 43.24 C ATOM 76 NZ LYS A 5 2.021 -9.400 11.492 1.00 60.10 N ATOM 0 H LYS A 5 -3.483 -5.244 11.203 1.00 70.45 H new ATOM 0 HA LYS A 5 -0.644 -5.277 10.380 1.00 51.44 H new ATOM 0 HB2 LYS A 5 -2.739 -7.307 10.843 1.00 73.21 H new ATOM 0 HB3 LYS A 5 -1.925 -7.503 9.304 1.00 73.21 H new ATOM 0 HG2 LYS A 5 -0.209 -7.055 11.720 1.00 60.11 H new ATOM 0 HG3 LYS A 5 -1.013 -8.605 11.576 1.00 60.11 H new ATOM 0 HD2 LYS A 5 -0.036 -8.284 9.022 1.00 53.44 H new ATOM 0 HD3 LYS A 5 1.195 -7.457 9.956 1.00 53.44 H new ATOM 0 HE2 LYS A 5 0.204 -10.207 10.759 1.00 43.24 H new ATOM 0 HE3 LYS A 5 1.453 -10.015 9.545 1.00 43.24 H new ATOM 0 HZ1 LYS A 5 1.930 -10.188 12.165 1.00 60.10 H new ATOM 0 HZ2 LYS A 5 2.972 -9.412 11.071 1.00 60.10 H new ATOM 0 HZ3 LYS A 5 1.875 -8.499 11.991 1.00 60.10 H new ATOM 90 N LEU A 6 -1.333 -4.093 8.276 1.00 12.13 N ATOM 91 CA LEU A 6 -1.578 -3.572 6.936 1.00 4.34 C ATOM 92 C LEU A 6 -0.545 -4.100 5.947 1.00 13.21 C ATOM 93 O LEU A 6 0.657 -4.067 6.212 1.00 64.31 O ATOM 94 CB LEU A 6 -1.551 -2.043 6.950 1.00 3.32 C ATOM 95 CG LEU A 6 -2.368 -1.396 8.069 1.00 12.14 C ATOM 96 CD1 LEU A 6 -2.218 0.116 8.031 1.00 70.30 C ATOM 97 CD2 LEU A 6 -3.833 -1.796 7.957 1.00 4.14 C ATOM 0 H LEU A 6 -0.590 -3.615 8.785 1.00 12.13 H new ATOM 0 HA LEU A 6 -2.564 -3.910 6.617 1.00 4.34 H new ATOM 0 HB2 LEU A 6 -0.516 -1.713 7.038 1.00 3.32 H new ATOM 0 HB3 LEU A 6 -1.921 -1.679 5.992 1.00 3.32 H new ATOM 0 HG LEU A 6 -1.988 -1.752 9.027 1.00 12.14 H new ATOM 0 HD11 LEU A 6 -2.806 0.560 8.834 1.00 70.30 H new ATOM 0 HD12 LEU A 6 -1.169 0.381 8.160 1.00 70.30 H new ATOM 0 HD13 LEU A 6 -2.572 0.493 7.071 1.00 70.30 H new ATOM 0 HD21 LEU A 6 -4.401 -1.327 8.761 1.00 4.14 H new ATOM 0 HD22 LEU A 6 -4.227 -1.468 6.995 1.00 4.14 H new ATOM 0 HD23 LEU A 6 -3.921 -2.880 8.035 1.00 4.14 H new ATOM 109 N VAL A 7 -1.020 -4.586 4.804 1.00 53.13 N ATOM 110 CA VAL A 7 -0.136 -5.119 3.776 1.00 73.24 C ATOM 111 C VAL A 7 -0.081 -4.197 2.563 1.00 12.43 C ATOM 112 O VAL A 7 -1.103 -3.674 2.118 1.00 35.13 O ATOM 113 CB VAL A 7 -0.577 -6.524 3.324 1.00 41.43 C ATOM 114 CG1 VAL A 7 -0.703 -7.456 4.520 1.00 10.53 C ATOM 115 CG2 VAL A 7 -1.887 -6.452 2.555 1.00 51.24 C ATOM 0 H VAL A 7 -2.012 -4.621 4.568 1.00 53.13 H new ATOM 0 HA VAL A 7 0.857 -5.187 4.220 1.00 73.24 H new ATOM 0 HB VAL A 7 0.186 -6.926 2.658 1.00 41.43 H new ATOM 0 HG11 VAL A 7 -1.015 -8.444 4.180 1.00 10.53 H new ATOM 0 HG12 VAL A 7 0.260 -7.534 5.024 1.00 10.53 H new ATOM 0 HG13 VAL A 7 -1.444 -7.060 5.214 1.00 10.53 H new ATOM 0 HG21 VAL A 7 -2.182 -7.454 2.244 1.00 51.24 H new ATOM 0 HG22 VAL A 7 -2.661 -6.028 3.194 1.00 51.24 H new ATOM 0 HG23 VAL A 7 -1.758 -5.822 1.675 1.00 51.24 H new ATOM 125 N VAL A 8 1.120 -4.000 2.037 1.00 10.30 N ATOM 126 CA VAL A 8 1.324 -3.145 0.887 1.00 33.30 C ATOM 127 C VAL A 8 1.831 -3.943 -0.311 1.00 32.13 C ATOM 128 O VAL A 8 2.861 -4.612 -0.230 1.00 60.11 O ATOM 129 CB VAL A 8 2.336 -2.039 1.214 1.00 3.32 C ATOM 130 CG1 VAL A 8 2.408 -1.041 0.081 1.00 65.45 C ATOM 131 CG2 VAL A 8 1.974 -1.354 2.523 1.00 0.25 C ATOM 0 H VAL A 8 1.973 -4.428 2.397 1.00 10.30 H new ATOM 0 HA VAL A 8 0.361 -2.701 0.635 1.00 33.30 H new ATOM 0 HB VAL A 8 3.321 -2.491 1.332 1.00 3.32 H new ATOM 0 HG11 VAL A 8 3.130 -0.262 0.327 1.00 65.45 H new ATOM 0 HG12 VAL A 8 2.719 -1.549 -0.832 1.00 65.45 H new ATOM 0 HG13 VAL A 8 1.427 -0.591 -0.071 1.00 65.45 H new ATOM 0 HG21 VAL A 8 2.703 -0.573 2.738 1.00 0.25 H new ATOM 0 HG22 VAL A 8 0.981 -0.911 2.440 1.00 0.25 H new ATOM 0 HG23 VAL A 8 1.978 -2.086 3.330 1.00 0.25 H new ATOM 141 N VAL A 9 1.105 -3.866 -1.421 1.00 33.01 N ATOM 142 CA VAL A 9 1.487 -4.580 -2.633 1.00 2.44 C ATOM 143 C VAL A 9 2.092 -3.628 -3.660 1.00 75.25 C ATOM 144 O VAL A 9 1.984 -2.409 -3.529 1.00 53.32 O ATOM 145 CB VAL A 9 0.283 -5.303 -3.266 1.00 11.34 C ATOM 146 CG1 VAL A 9 -0.220 -6.407 -2.349 1.00 13.53 C ATOM 147 CG2 VAL A 9 -0.829 -4.314 -3.582 1.00 20.14 C ATOM 0 H VAL A 9 0.250 -3.317 -1.506 1.00 33.01 H new ATOM 0 HA VAL A 9 2.231 -5.321 -2.342 1.00 2.44 H new ATOM 0 HB VAL A 9 0.608 -5.759 -4.201 1.00 11.34 H new ATOM 0 HG11 VAL A 9 -1.071 -6.906 -2.813 1.00 13.53 H new ATOM 0 HG12 VAL A 9 0.577 -7.131 -2.180 1.00 13.53 H new ATOM 0 HG13 VAL A 9 -0.528 -5.976 -1.396 1.00 13.53 H new ATOM 0 HG21 VAL A 9 -1.671 -4.843 -4.028 1.00 20.14 H new ATOM 0 HG22 VAL A 9 -1.154 -3.826 -2.663 1.00 20.14 H new ATOM 0 HG23 VAL A 9 -0.460 -3.563 -4.281 1.00 20.14 H new ATOM 157 N GLY A 10 2.731 -4.192 -4.680 1.00 41.51 N ATOM 158 CA GLY A 10 3.344 -3.376 -5.711 1.00 11.05 C ATOM 159 C GLY A 10 3.770 -4.188 -6.918 1.00 33.50 C ATOM 160 O GLY A 10 3.771 -5.418 -6.878 1.00 74.11 O ATOM 0 H GLY A 10 2.835 -5.198 -4.811 1.00 41.51 H new ATOM 0 HA2 GLY A 10 2.641 -2.605 -6.026 1.00 11.05 H new ATOM 0 HA3 GLY A 10 4.213 -2.865 -5.296 1.00 11.05 H new ATOM 164 N ALA A 11 4.132 -3.498 -7.995 1.00 1.54 N ATOM 165 CA ALA A 11 4.561 -4.163 -9.220 1.00 0.44 C ATOM 166 C ALA A 11 6.083 -4.230 -9.309 1.00 34.05 C ATOM 167 O ALA A 11 6.648 -4.267 -10.402 1.00 65.04 O ATOM 168 CB ALA A 11 3.991 -3.446 -10.434 1.00 31.51 C ATOM 0 H ALA A 11 4.137 -2.479 -8.044 1.00 1.54 H new ATOM 0 HA ALA A 11 4.181 -5.185 -9.201 1.00 0.44 H new ATOM 0 HB1 ALA A 11 4.318 -3.952 -11.342 1.00 31.51 H new ATOM 0 HB2 ALA A 11 2.902 -3.457 -10.385 1.00 31.51 H new ATOM 0 HB3 ALA A 11 4.343 -2.415 -10.446 1.00 31.51 H new ATOM 174 N GLY A 12 6.741 -4.245 -8.154 1.00 32.11 N ATOM 175 CA GLY A 12 8.191 -4.307 -8.128 1.00 11.52 C ATOM 176 C GLY A 12 8.844 -3.043 -8.661 1.00 2.11 C ATOM 177 O GLY A 12 10.052 -3.015 -8.896 1.00 62.53 O ATOM 0 H GLY A 12 6.296 -4.215 -7.236 1.00 32.11 H new ATOM 0 HA2 GLY A 12 8.524 -4.479 -7.105 1.00 11.52 H new ATOM 0 HA3 GLY A 12 8.524 -5.160 -8.719 1.00 11.52 H new ATOM 181 N GLY A 13 8.045 -1.996 -8.849 1.00 23.40 N ATOM 182 CA GLY A 13 8.572 -0.741 -9.354 1.00 23.33 C ATOM 183 C GLY A 13 7.586 0.399 -9.197 1.00 64.40 C ATOM 184 O GLY A 13 7.559 1.324 -10.009 1.00 43.15 O ATOM 0 H GLY A 13 7.043 -1.995 -8.661 1.00 23.40 H new ATOM 0 HA2 GLY A 13 9.494 -0.497 -8.826 1.00 23.33 H new ATOM 0 HA3 GLY A 13 8.829 -0.854 -10.407 1.00 23.33 H new ATOM 188 N VAL A 14 6.773 0.330 -8.148 1.00 3.14 N ATOM 189 CA VAL A 14 5.777 1.360 -7.881 1.00 2.22 C ATOM 190 C VAL A 14 6.187 2.232 -6.698 1.00 62.21 C ATOM 191 O VAL A 14 5.732 3.368 -6.566 1.00 4.32 O ATOM 192 CB VAL A 14 4.396 0.739 -7.592 1.00 53.32 C ATOM 193 CG1 VAL A 14 3.781 0.186 -8.869 1.00 52.53 C ATOM 194 CG2 VAL A 14 4.510 -0.347 -6.533 1.00 15.45 C ATOM 0 H VAL A 14 6.785 -0.430 -7.468 1.00 3.14 H new ATOM 0 HA VAL A 14 5.712 1.978 -8.777 1.00 2.22 H new ATOM 0 HB VAL A 14 3.740 1.520 -7.209 1.00 53.32 H new ATOM 0 HG11 VAL A 14 2.807 -0.248 -8.645 1.00 52.53 H new ATOM 0 HG12 VAL A 14 3.662 0.991 -9.594 1.00 52.53 H new ATOM 0 HG13 VAL A 14 4.434 -0.582 -9.284 1.00 52.53 H new ATOM 0 HG21 VAL A 14 3.525 -0.774 -6.342 1.00 15.45 H new ATOM 0 HG22 VAL A 14 5.183 -1.129 -6.885 1.00 15.45 H new ATOM 0 HG23 VAL A 14 4.904 0.083 -5.612 1.00 15.45 H new ATOM 204 N GLY A 15 7.048 1.694 -5.839 1.00 23.54 N ATOM 205 CA GLY A 15 7.501 2.440 -4.680 1.00 10.22 C ATOM 206 C GLY A 15 6.688 2.129 -3.439 1.00 44.20 C ATOM 207 O GLY A 15 6.571 2.962 -2.541 1.00 65.15 O ATOM 0 H GLY A 15 7.439 0.756 -5.925 1.00 23.54 H new ATOM 0 HA2 GLY A 15 8.550 2.211 -4.491 1.00 10.22 H new ATOM 0 HA3 GLY A 15 7.441 3.507 -4.892 1.00 10.22 H new ATOM 211 N LYS A 16 6.125 0.925 -3.390 1.00 23.12 N ATOM 212 CA LYS A 16 5.317 0.505 -2.251 1.00 34.50 C ATOM 213 C LYS A 16 6.158 0.451 -0.980 1.00 44.11 C ATOM 214 O LYS A 16 5.659 0.705 0.117 1.00 14.43 O ATOM 215 CB LYS A 16 4.691 -0.864 -2.521 1.00 34.20 C ATOM 216 CG LYS A 16 5.690 -1.908 -2.996 1.00 10.13 C ATOM 217 CD LYS A 16 5.334 -3.293 -2.482 1.00 71.23 C ATOM 218 CE LYS A 16 5.881 -4.382 -3.391 1.00 25.02 C ATOM 219 NZ LYS A 16 5.055 -5.621 -3.340 1.00 35.00 N ATOM 0 H LYS A 16 6.214 0.224 -4.126 1.00 23.12 H new ATOM 0 HA LYS A 16 4.523 1.238 -2.109 1.00 34.50 H new ATOM 0 HB2 LYS A 16 4.211 -1.221 -1.610 1.00 34.20 H new ATOM 0 HB3 LYS A 16 3.908 -0.755 -3.272 1.00 34.20 H new ATOM 0 HG2 LYS A 16 5.716 -1.919 -4.086 1.00 10.13 H new ATOM 0 HG3 LYS A 16 6.690 -1.638 -2.656 1.00 10.13 H new ATOM 0 HD2 LYS A 16 5.733 -3.423 -1.476 1.00 71.23 H new ATOM 0 HD3 LYS A 16 4.251 -3.388 -2.410 1.00 71.23 H new ATOM 0 HE2 LYS A 16 5.918 -4.013 -4.416 1.00 25.02 H new ATOM 0 HE3 LYS A 16 6.905 -4.617 -3.099 1.00 25.02 H new ATOM 0 HZ1 LYS A 16 5.656 -6.428 -3.079 1.00 35.00 H new ATOM 0 HZ2 LYS A 16 4.301 -5.507 -2.632 1.00 35.00 H new ATOM 0 HZ3 LYS A 16 4.630 -5.794 -4.273 1.00 35.00 H new ATOM 233 N SER A 17 7.435 0.118 -1.135 1.00 20.31 N ATOM 234 CA SER A 17 8.345 0.031 0.001 1.00 21.33 C ATOM 235 C SER A 17 8.762 1.421 0.471 1.00 0.13 C ATOM 236 O SER A 17 8.793 1.697 1.670 1.00 31.20 O ATOM 237 CB SER A 17 9.584 -0.785 -0.372 1.00 2.30 C ATOM 238 OG SER A 17 10.110 -0.372 -1.621 1.00 61.22 O ATOM 0 H SER A 17 7.863 -0.096 -2.036 1.00 20.31 H new ATOM 0 HA SER A 17 7.821 -0.468 0.816 1.00 21.33 H new ATOM 0 HB2 SER A 17 10.344 -0.672 0.401 1.00 2.30 H new ATOM 0 HB3 SER A 17 9.327 -1.843 -0.414 1.00 2.30 H new ATOM 244 N ALA A 18 9.080 2.292 -0.482 1.00 2.31 N ATOM 245 CA ALA A 18 9.494 3.655 -0.166 1.00 11.31 C ATOM 246 C ALA A 18 8.448 4.365 0.687 1.00 11.44 C ATOM 247 O ALA A 18 8.784 5.172 1.554 1.00 15.24 O ATOM 248 CB ALA A 18 9.753 4.436 -1.446 1.00 21.32 C ATOM 0 H ALA A 18 9.059 2.078 -1.479 1.00 2.31 H new ATOM 0 HA ALA A 18 10.418 3.603 0.410 1.00 11.31 H new ATOM 0 HB1 ALA A 18 10.061 5.451 -1.197 1.00 21.32 H new ATOM 0 HB2 ALA A 18 10.542 3.947 -2.017 1.00 21.32 H new ATOM 0 HB3 ALA A 18 8.841 4.470 -2.042 1.00 21.32 H new ATOM 254 N LEU A 19 7.180 4.059 0.438 1.00 44.13 N ATOM 255 CA LEU A 19 6.086 4.668 1.185 1.00 21.04 C ATOM 256 C LEU A 19 6.106 4.213 2.641 1.00 41.14 C ATOM 257 O LEU A 19 5.793 4.985 3.548 1.00 22.22 O ATOM 258 CB LEU A 19 4.743 4.309 0.546 1.00 12.31 C ATOM 259 CG LEU A 19 4.408 5.074 -0.735 1.00 55.52 C ATOM 260 CD1 LEU A 19 3.181 4.477 -1.407 1.00 34.31 C ATOM 261 CD2 LEU A 19 4.186 6.548 -0.431 1.00 44.51 C ATOM 0 H LEU A 19 6.884 3.393 -0.275 1.00 44.13 H new ATOM 0 HA LEU A 19 6.216 5.750 1.157 1.00 21.04 H new ATOM 0 HB2 LEU A 19 4.737 3.242 0.325 1.00 12.31 H new ATOM 0 HB3 LEU A 19 3.952 4.488 1.275 1.00 12.31 H new ATOM 0 HG LEU A 19 5.251 4.986 -1.420 1.00 55.52 H new ATOM 0 HD11 LEU A 19 2.957 5.034 -2.317 1.00 34.31 H new ATOM 0 HD12 LEU A 19 3.375 3.434 -1.658 1.00 34.31 H new ATOM 0 HD13 LEU A 19 2.330 4.534 -0.728 1.00 34.31 H new ATOM 0 HD21 LEU A 19 3.949 7.078 -1.353 1.00 44.51 H new ATOM 0 HD22 LEU A 19 3.359 6.654 0.272 1.00 44.51 H new ATOM 0 HD23 LEU A 19 5.091 6.969 0.007 1.00 44.51 H new ATOM 273 N THR A 20 6.475 2.955 2.856 1.00 52.51 N ATOM 274 CA THR A 20 6.534 2.395 4.201 1.00 70.24 C ATOM 275 C THR A 20 7.692 2.994 4.994 1.00 15.43 C ATOM 276 O THR A 20 7.494 3.540 6.080 1.00 32.41 O ATOM 277 CB THR A 20 6.678 0.873 4.135 1.00 2.21 C ATOM 278 OG1 THR A 20 5.586 0.296 3.441 1.00 55.40 O ATOM 279 CG2 THR A 20 6.752 0.217 5.497 1.00 42.24 C ATOM 0 H THR A 20 6.738 2.304 2.116 1.00 52.51 H new ATOM 0 HA THR A 20 5.604 2.645 4.711 1.00 70.24 H new ATOM 0 HB THR A 20 7.618 0.696 3.613 1.00 2.21 H new ATOM 0 HG1 THR A 20 5.676 0.476 2.482 1.00 55.40 H new ATOM 0 HG21 THR A 20 6.853 -0.862 5.376 1.00 42.24 H new ATOM 0 HG22 THR A 20 7.614 0.604 6.041 1.00 42.24 H new ATOM 0 HG23 THR A 20 5.842 0.436 6.056 1.00 42.24 H new ATOM 287 N ILE A 21 8.899 2.889 4.447 1.00 71.10 N ATOM 288 CA ILE A 21 10.081 3.416 5.098 1.00 64.14 C ATOM 289 C ILE A 21 9.972 4.927 5.288 1.00 61.32 C ATOM 290 O ILE A 21 10.517 5.483 6.241 1.00 30.21 O ATOM 291 CB ILE A 21 11.342 3.077 4.278 1.00 54.04 C ATOM 292 CG1 ILE A 21 11.685 1.593 4.424 1.00 62.21 C ATOM 293 CG2 ILE A 21 12.513 3.936 4.710 1.00 63.12 C ATOM 294 CD1 ILE A 21 10.853 0.689 3.540 1.00 72.31 C ATOM 0 H ILE A 21 9.079 2.440 3.549 1.00 71.10 H new ATOM 0 HA ILE A 21 10.161 2.950 6.080 1.00 64.14 H new ATOM 0 HB ILE A 21 11.136 3.288 3.229 1.00 54.04 H new ATOM 0 HG12 ILE A 21 12.739 1.447 4.188 1.00 62.21 H new ATOM 0 HG13 ILE A 21 11.547 1.297 5.464 1.00 62.21 H new ATOM 0 HG21 ILE A 21 13.391 3.679 4.118 1.00 63.12 H new ATOM 0 HG22 ILE A 21 12.268 4.987 4.559 1.00 63.12 H new ATOM 0 HG23 ILE A 21 12.723 3.761 5.765 1.00 63.12 H new ATOM 0 HD11 ILE A 21 11.151 -0.348 3.697 1.00 72.31 H new ATOM 0 HD12 ILE A 21 9.799 0.805 3.791 1.00 72.31 H new ATOM 0 HD13 ILE A 21 11.009 0.958 2.495 1.00 72.31 H new ATOM 306 N GLN A 22 9.263 5.586 4.378 1.00 14.20 N ATOM 307 CA GLN A 22 9.084 7.031 4.454 1.00 70.20 C ATOM 308 C GLN A 22 8.391 7.419 5.757 1.00 22.34 C ATOM 309 O GLN A 22 8.821 8.339 6.453 1.00 45.05 O ATOM 310 CB GLN A 22 8.271 7.531 3.257 1.00 13.54 C ATOM 311 CG GLN A 22 9.124 8.127 2.150 1.00 13.44 C ATOM 312 CD GLN A 22 10.036 9.232 2.646 1.00 33.01 C ATOM 313 OE1 GLN A 22 9.731 9.910 3.627 1.00 23.01 O ATOM 314 NE2 GLN A 22 11.163 9.418 1.969 1.00 74.24 N ATOM 0 H GLN A 22 8.804 5.144 3.581 1.00 14.20 H new ATOM 0 HA GLN A 22 10.068 7.499 4.431 1.00 70.20 H new ATOM 0 HB2 GLN A 22 7.690 6.703 2.851 1.00 13.54 H new ATOM 0 HB3 GLN A 22 7.559 8.282 3.600 1.00 13.54 H new ATOM 0 HG2 GLN A 22 9.727 7.340 1.697 1.00 13.44 H new ATOM 0 HG3 GLN A 22 8.475 8.521 1.368 1.00 13.44 H new ATOM 0 HE21 GLN A 22 11.375 8.832 1.161 1.00 74.24 H new ATOM 0 HE22 GLN A 22 11.816 10.147 2.257 1.00 74.24 H new ATOM 323 N LEU A 23 7.317 6.707 6.080 1.00 24.21 N ATOM 324 CA LEU A 23 6.559 6.966 7.299 1.00 22.34 C ATOM 325 C LEU A 23 7.279 6.411 8.529 1.00 31.35 C ATOM 326 O LEU A 23 6.901 6.707 9.663 1.00 13.10 O ATOM 327 CB LEU A 23 5.162 6.350 7.189 1.00 4.42 C ATOM 328 CG LEU A 23 4.249 6.584 8.393 1.00 73.13 C ATOM 329 CD1 LEU A 23 3.952 8.066 8.559 1.00 3.42 C ATOM 330 CD2 LEU A 23 2.958 5.793 8.241 1.00 23.51 C ATOM 0 H LEU A 23 6.950 5.943 5.512 1.00 24.21 H new ATOM 0 HA LEU A 23 6.470 8.046 7.417 1.00 22.34 H new ATOM 0 HB2 LEU A 23 4.675 6.752 6.301 1.00 4.42 H new ATOM 0 HB3 LEU A 23 5.267 5.276 7.037 1.00 4.42 H new ATOM 0 HG LEU A 23 4.763 6.237 9.289 1.00 73.13 H new ATOM 0 HD11 LEU A 23 3.301 8.212 9.421 1.00 3.42 H new ATOM 0 HD12 LEU A 23 4.885 8.609 8.712 1.00 3.42 H new ATOM 0 HD13 LEU A 23 3.457 8.441 7.663 1.00 3.42 H new ATOM 0 HD21 LEU A 23 2.319 5.970 9.106 1.00 23.51 H new ATOM 0 HD22 LEU A 23 2.441 6.112 7.336 1.00 23.51 H new ATOM 0 HD23 LEU A 23 3.189 4.730 8.172 1.00 23.51 H new ATOM 342 N ILE A 24 8.313 5.602 8.303 1.00 10.31 N ATOM 343 CA ILE A 24 9.071 5.009 9.399 1.00 32.54 C ATOM 344 C ILE A 24 10.407 5.722 9.604 1.00 44.55 C ATOM 345 O ILE A 24 10.591 6.443 10.585 1.00 5.01 O ATOM 346 CB ILE A 24 9.327 3.506 9.151 1.00 41.30 C ATOM 347 CG1 ILE A 24 7.998 2.760 9.007 1.00 70.24 C ATOM 348 CG2 ILE A 24 10.158 2.906 10.278 1.00 21.31 C ATOM 349 CD1 ILE A 24 7.229 2.636 10.305 1.00 73.41 C ATOM 0 H ILE A 24 8.643 5.344 7.373 1.00 10.31 H new ATOM 0 HA ILE A 24 8.468 5.125 10.300 1.00 32.54 H new ATOM 0 HB ILE A 24 9.889 3.400 8.223 1.00 41.30 H new ATOM 0 HG12 ILE A 24 7.378 3.277 8.275 1.00 70.24 H new ATOM 0 HG13 ILE A 24 8.192 1.763 8.612 1.00 70.24 H new ATOM 0 HG21 ILE A 24 10.326 1.847 10.082 1.00 21.31 H new ATOM 0 HG22 ILE A 24 11.117 3.421 10.337 1.00 21.31 H new ATOM 0 HG23 ILE A 24 9.626 3.021 11.223 1.00 21.31 H new ATOM 0 HD11 ILE A 24 6.299 2.097 10.127 1.00 73.41 H new ATOM 0 HD12 ILE A 24 7.830 2.092 11.033 1.00 73.41 H new ATOM 0 HD13 ILE A 24 7.004 3.630 10.691 1.00 73.41 H new ATOM 361 N GLN A 25 11.338 5.510 8.679 1.00 75.33 N ATOM 362 CA GLN A 25 12.658 6.127 8.766 1.00 63.31 C ATOM 363 C GLN A 25 12.707 7.454 8.011 1.00 34.41 C ATOM 364 O GLN A 25 13.659 8.221 8.160 1.00 5.00 O ATOM 365 CB GLN A 25 13.725 5.178 8.214 1.00 52.33 C ATOM 366 CG GLN A 25 13.507 3.723 8.597 1.00 12.31 C ATOM 367 CD GLN A 25 14.698 2.848 8.260 1.00 34.11 C ATOM 368 OE1 GLN A 25 15.793 3.038 8.790 1.00 33.20 O ATOM 369 NE2 GLN A 25 14.490 1.881 7.374 1.00 34.00 N ATOM 0 H GLN A 25 11.203 4.916 7.861 1.00 75.33 H new ATOM 0 HA GLN A 25 12.860 6.327 9.818 1.00 63.31 H new ATOM 0 HB2 GLN A 25 13.744 5.259 7.127 1.00 52.33 H new ATOM 0 HB3 GLN A 25 14.703 5.497 8.574 1.00 52.33 H new ATOM 0 HG2 GLN A 25 13.304 3.659 9.666 1.00 12.31 H new ATOM 0 HG3 GLN A 25 12.624 3.344 8.082 1.00 12.31 H new ATOM 0 HE21 GLN A 25 13.566 1.759 6.959 1.00 34.00 H new ATOM 0 HE22 GLN A 25 15.254 1.260 7.108 1.00 34.00 H new ATOM 378 N ASN A 26 11.684 7.718 7.197 1.00 31.34 N ATOM 379 CA ASN A 26 11.614 8.952 6.414 1.00 1.45 C ATOM 380 C ASN A 26 12.961 9.282 5.775 1.00 71.12 C ATOM 381 O ASN A 26 13.306 10.450 5.597 1.00 15.23 O ATOM 382 CB ASN A 26 11.146 10.119 7.289 1.00 60.02 C ATOM 383 CG ASN A 26 12.013 10.312 8.518 1.00 44.42 C ATOM 384 OD1 ASN A 26 11.720 9.780 9.589 1.00 62.54 O ATOM 385 ND2 ASN A 26 13.087 11.078 8.370 1.00 2.32 N ATOM 0 H ASN A 26 10.890 7.092 7.063 1.00 31.34 H new ATOM 0 HA ASN A 26 10.889 8.796 5.615 1.00 1.45 H new ATOM 0 HB2 ASN A 26 11.150 11.035 6.699 1.00 60.02 H new ATOM 0 HB3 ASN A 26 10.116 9.945 7.600 1.00 60.02 H new ATOM 0 HD21 ASN A 26 13.707 11.245 9.162 1.00 2.32 H new ATOM 0 HD22 ASN A 26 13.292 11.499 7.464 1.00 2.32 H new ATOM 392 N HIS A 27 13.717 8.243 5.434 1.00 43.32 N ATOM 393 CA HIS A 27 15.027 8.418 4.817 1.00 24.23 C ATOM 394 C HIS A 27 15.036 7.902 3.376 1.00 4.53 C ATOM 395 O HIS A 27 15.975 8.159 2.623 1.00 41.14 O ATOM 396 CB HIS A 27 16.102 7.707 5.651 1.00 60.31 C ATOM 397 CG HIS A 27 16.378 6.293 5.232 1.00 2.53 C ATOM 398 ND1 HIS A 27 15.384 5.362 5.017 1.00 14.02 N ATOM 399 CD2 HIS A 27 17.548 5.655 4.987 1.00 3.41 C ATOM 400 CE1 HIS A 27 15.930 4.212 4.660 1.00 33.15 C ATOM 401 NE2 HIS A 27 17.241 4.364 4.634 1.00 31.35 N ATOM 0 H HIS A 27 13.444 7.270 5.575 1.00 43.32 H new ATOM 0 HA HIS A 27 15.250 9.485 4.788 1.00 24.23 H new ATOM 0 HB2 HIS A 27 17.028 8.278 5.590 1.00 60.31 H new ATOM 0 HB3 HIS A 27 15.794 7.710 6.697 1.00 60.31 H new ATOM 0 HD2 HIS A 27 18.537 6.082 5.056 1.00 3.41 H new ATOM 0 HE1 HIS A 27 15.395 3.303 4.429 1.00 33.15 H new ATOM 0 HE2 HIS A 27 17.917 3.640 4.391 1.00 31.35 H new ATOM 410 N PHE A 28 13.988 7.169 3.002 1.00 45.14 N ATOM 411 CA PHE A 28 13.877 6.614 1.655 1.00 63.42 C ATOM 412 C PHE A 28 14.801 5.412 1.488 1.00 10.00 C ATOM 413 O PHE A 28 16.003 5.502 1.738 1.00 63.10 O ATOM 414 CB PHE A 28 14.206 7.677 0.602 1.00 14.20 C ATOM 415 CG PHE A 28 13.514 7.455 -0.713 1.00 71.14 C ATOM 416 CD1 PHE A 28 13.623 6.242 -1.372 1.00 21.03 C ATOM 417 CD2 PHE A 28 12.755 8.461 -1.289 1.00 13.41 C ATOM 418 CE1 PHE A 28 12.988 6.035 -2.581 1.00 73.40 C ATOM 419 CE2 PHE A 28 12.118 8.260 -2.498 1.00 34.33 C ATOM 420 CZ PHE A 28 12.234 7.045 -3.145 1.00 52.32 C ATOM 0 H PHE A 28 13.203 6.946 3.614 1.00 45.14 H new ATOM 0 HA PHE A 28 12.848 6.286 1.511 1.00 63.42 H new ATOM 0 HB2 PHE A 28 13.928 8.658 0.988 1.00 14.20 H new ATOM 0 HB3 PHE A 28 15.283 7.693 0.438 1.00 14.20 H new ATOM 0 HD1 PHE A 28 14.211 5.449 -0.936 1.00 21.03 H new ATOM 0 HD2 PHE A 28 12.660 9.413 -0.787 1.00 13.41 H new ATOM 0 HE1 PHE A 28 13.081 5.084 -3.085 1.00 73.40 H new ATOM 0 HE2 PHE A 28 11.530 9.052 -2.937 1.00 34.33 H new ATOM 0 HZ PHE A 28 11.736 6.885 -4.090 1.00 52.32 H new ATOM 430 N VAL A 29 14.232 4.287 1.064 1.00 33.02 N ATOM 431 CA VAL A 29 15.005 3.067 0.864 1.00 13.30 C ATOM 432 C VAL A 29 16.205 3.317 -0.045 1.00 33.03 C ATOM 433 O VAL A 29 16.139 4.118 -0.978 1.00 53.43 O ATOM 434 CB VAL A 29 14.130 1.938 0.275 1.00 23.01 C ATOM 435 CG1 VAL A 29 14.987 0.812 -0.291 1.00 11.33 C ATOM 436 CG2 VAL A 29 13.182 1.404 1.335 1.00 30.25 C ATOM 0 H VAL A 29 13.238 4.196 0.853 1.00 33.02 H new ATOM 0 HA VAL A 29 15.367 2.752 1.843 1.00 13.30 H new ATOM 0 HB VAL A 29 13.545 2.355 -0.545 1.00 23.01 H new ATOM 0 HG11 VAL A 29 14.342 0.033 -0.698 1.00 11.33 H new ATOM 0 HG12 VAL A 29 15.626 1.204 -1.082 1.00 11.33 H new ATOM 0 HG13 VAL A 29 15.607 0.393 0.502 1.00 11.33 H new ATOM 0 HG21 VAL A 29 12.570 0.609 0.909 1.00 30.25 H new ATOM 0 HG22 VAL A 29 13.758 1.010 2.173 1.00 30.25 H new ATOM 0 HG23 VAL A 29 12.537 2.210 1.685 1.00 30.25 H new ATOM 446 N ASP A 30 17.298 2.619 0.240 1.00 43.54 N ATOM 447 CA ASP A 30 18.526 2.747 -0.537 1.00 30.43 C ATOM 448 C ASP A 30 19.628 1.878 0.060 1.00 5.30 C ATOM 449 O ASP A 30 20.428 1.286 -0.665 1.00 74.53 O ATOM 450 CB ASP A 30 18.984 4.208 -0.581 1.00 44.11 C ATOM 451 CG ASP A 30 19.667 4.560 -1.888 1.00 14.23 C ATOM 452 OD1 ASP A 30 18.980 4.576 -2.931 1.00 12.05 O ATOM 453 OD2 ASP A 30 20.889 4.818 -1.868 1.00 20.31 O ATOM 0 H ASP A 30 17.359 1.953 1.010 1.00 43.54 H new ATOM 0 HA ASP A 30 18.322 2.411 -1.554 1.00 30.43 H new ATOM 0 HB2 ASP A 30 18.123 4.860 -0.437 1.00 44.11 H new ATOM 0 HB3 ASP A 30 19.669 4.396 0.246 1.00 44.11 H new ATOM 458 N GLU A 31 19.661 1.805 1.388 1.00 62.54 N ATOM 459 CA GLU A 31 20.662 1.008 2.087 1.00 70.44 C ATOM 460 C GLU A 31 20.005 0.107 3.128 1.00 61.20 C ATOM 461 O GLU A 31 20.033 0.400 4.323 1.00 22.41 O ATOM 462 CB GLU A 31 21.691 1.918 2.760 1.00 52.04 C ATOM 463 CG GLU A 31 21.068 3.020 3.602 1.00 33.31 C ATOM 464 CD GLU A 31 21.887 3.346 4.835 1.00 33.15 C ATOM 465 OE1 GLU A 31 21.692 2.677 5.872 1.00 40.24 O ATOM 466 OE2 GLU A 31 22.724 4.271 4.764 1.00 34.52 O ATOM 0 H GLU A 31 19.005 2.289 2.001 1.00 62.54 H new ATOM 0 HA GLU A 31 21.169 0.380 1.354 1.00 70.44 H new ATOM 0 HB2 GLU A 31 22.341 1.313 3.392 1.00 52.04 H new ATOM 0 HB3 GLU A 31 22.321 2.369 1.994 1.00 52.04 H new ATOM 0 HG2 GLU A 31 20.959 3.919 2.995 1.00 33.31 H new ATOM 0 HG3 GLU A 31 20.066 2.717 3.906 1.00 33.31 H new ATOM 473 N TYR A 32 19.413 -0.990 2.666 1.00 72.35 N ATOM 474 CA TYR A 32 18.747 -1.931 3.559 1.00 42.24 C ATOM 475 C TYR A 32 19.013 -3.372 3.132 1.00 70.33 C ATOM 476 O TYR A 32 19.642 -3.619 2.103 1.00 11.23 O ATOM 477 CB TYR A 32 17.239 -1.658 3.591 1.00 73.11 C ATOM 478 CG TYR A 32 16.510 -2.088 2.336 1.00 11.04 C ATOM 479 CD1 TYR A 32 16.823 -1.531 1.102 1.00 54.53 C ATOM 480 CD2 TYR A 32 15.510 -3.051 2.386 1.00 52.55 C ATOM 481 CE1 TYR A 32 16.159 -1.922 -0.046 1.00 61.12 C ATOM 482 CE2 TYR A 32 14.843 -3.448 1.243 1.00 21.43 C ATOM 483 CZ TYR A 32 15.171 -2.881 0.030 1.00 55.14 C ATOM 484 OH TYR A 32 14.508 -3.273 -1.110 1.00 44.20 O ATOM 0 H TYR A 32 19.381 -1.249 1.680 1.00 72.35 H new ATOM 0 HA TYR A 32 19.153 -1.792 4.561 1.00 42.24 H new ATOM 0 HB2 TYR A 32 16.804 -2.175 4.447 1.00 73.11 H new ATOM 0 HB3 TYR A 32 17.076 -0.591 3.746 1.00 73.11 H new ATOM 0 HD1 TYR A 32 17.597 -0.781 1.039 1.00 54.53 H new ATOM 0 HD2 TYR A 32 15.250 -3.497 3.335 1.00 52.55 H new ATOM 0 HE1 TYR A 32 16.413 -1.479 -0.997 1.00 61.12 H new ATOM 0 HE2 TYR A 32 14.069 -4.199 1.300 1.00 21.43 H new ATOM 0 HH TYR A 32 13.571 -2.992 -1.056 1.00 44.20 H new ATOM 494 N ASP A 33 18.526 -4.317 3.928 1.00 42.41 N ATOM 495 CA ASP A 33 18.707 -5.734 3.634 1.00 54.42 C ATOM 496 C ASP A 33 17.395 -6.361 3.169 1.00 32.02 C ATOM 497 O ASP A 33 16.588 -6.810 3.984 1.00 31.41 O ATOM 498 CB ASP A 33 19.224 -6.468 4.867 1.00 51.25 C ATOM 499 CG ASP A 33 20.716 -6.286 5.066 1.00 72.12 C ATOM 500 OD1 ASP A 33 21.124 -5.208 5.547 1.00 62.23 O ATOM 501 OD2 ASP A 33 21.477 -7.221 4.739 1.00 61.31 O ATOM 0 H ASP A 33 18.002 -4.128 4.783 1.00 42.41 H new ATOM 0 HA ASP A 33 19.440 -5.825 2.832 1.00 54.42 H new ATOM 0 HB2 ASP A 33 18.696 -6.107 5.749 1.00 51.25 H new ATOM 0 HB3 ASP A 33 19.000 -7.531 4.774 1.00 51.25 H new ATOM 506 N PRO A 34 17.163 -6.396 1.847 1.00 52.54 N ATOM 507 CA PRO A 34 15.943 -6.966 1.275 1.00 13.23 C ATOM 508 C PRO A 34 15.940 -8.489 1.316 1.00 72.53 C ATOM 509 O PRO A 34 16.894 -9.110 1.786 1.00 31.51 O ATOM 510 CB PRO A 34 15.962 -6.465 -0.169 1.00 63.01 C ATOM 511 CG PRO A 34 17.404 -6.257 -0.483 1.00 34.43 C ATOM 512 CD PRO A 34 18.074 -5.878 0.811 1.00 10.31 C ATOM 0 HA PRO A 34 15.053 -6.669 1.830 1.00 13.23 H new ATOM 0 HB2 PRO A 34 15.511 -7.191 -0.845 1.00 63.01 H new ATOM 0 HB3 PRO A 34 15.397 -5.539 -0.273 1.00 63.01 H new ATOM 0 HG2 PRO A 34 17.845 -7.164 -0.897 1.00 34.43 H new ATOM 0 HG3 PRO A 34 17.529 -5.472 -1.229 1.00 34.43 H new ATOM 0 HD2 PRO A 34 19.066 -6.323 0.893 1.00 10.31 H new ATOM 0 HD3 PRO A 34 18.201 -4.799 0.894 1.00 10.31 H new ATOM 520 N SER A 35 14.860 -9.088 0.823 1.00 20.21 N ATOM 521 CA SER A 35 14.726 -10.542 0.805 1.00 32.11 C ATOM 522 C SER A 35 14.560 -11.100 2.218 1.00 11.11 C ATOM 523 O SER A 35 14.661 -12.308 2.431 1.00 52.25 O ATOM 524 CB SER A 35 15.942 -11.183 0.131 1.00 35.32 C ATOM 525 OG SER A 35 15.685 -12.536 -0.203 1.00 14.42 O ATOM 0 H SER A 35 14.063 -8.588 0.430 1.00 20.21 H new ATOM 0 HA SER A 35 13.831 -10.786 0.233 1.00 32.11 H new ATOM 0 HB2 SER A 35 16.199 -10.625 -0.770 1.00 35.32 H new ATOM 0 HB3 SER A 35 16.803 -11.127 0.797 1.00 35.32 H new ATOM 0 HG SER A 35 15.303 -12.998 0.573 1.00 14.42 H new ATOM 531 N ILE A 36 14.307 -10.216 3.181 1.00 60.23 N ATOM 532 CA ILE A 36 14.129 -10.631 4.569 1.00 42.41 C ATOM 533 C ILE A 36 12.827 -10.088 5.161 1.00 65.42 C ATOM 534 O ILE A 36 12.480 -10.398 6.301 1.00 71.41 O ATOM 535 CB ILE A 36 15.326 -10.197 5.443 1.00 14.33 C ATOM 536 CG1 ILE A 36 15.205 -8.728 5.839 1.00 2.20 C ATOM 537 CG2 ILE A 36 16.636 -10.444 4.710 1.00 64.52 C ATOM 538 CD1 ILE A 36 14.411 -8.524 7.107 1.00 20.01 C ATOM 0 H ILE A 36 14.221 -9.212 3.026 1.00 60.23 H new ATOM 0 HA ILE A 36 14.075 -11.720 4.567 1.00 42.41 H new ATOM 0 HB ILE A 36 15.318 -10.796 6.353 1.00 14.33 H new ATOM 0 HG12 ILE A 36 16.203 -8.309 5.970 1.00 2.20 H new ATOM 0 HG13 ILE A 36 14.731 -8.176 5.027 1.00 2.20 H new ATOM 0 HG21 ILE A 36 17.470 -10.133 5.340 1.00 64.52 H new ATOM 0 HG22 ILE A 36 16.730 -11.506 4.481 1.00 64.52 H new ATOM 0 HG23 ILE A 36 16.648 -9.871 3.783 1.00 64.52 H new ATOM 0 HD11 ILE A 36 14.360 -7.460 7.337 1.00 20.01 H new ATOM 0 HD12 ILE A 36 13.403 -8.915 6.972 1.00 20.01 H new ATOM 0 HD13 ILE A 36 14.897 -9.050 7.929 1.00 20.01 H new ATOM 550 N GLU A 37 12.105 -9.281 4.385 1.00 24.51 N ATOM 551 CA GLU A 37 10.844 -8.708 4.843 1.00 4.41 C ATOM 552 C GLU A 37 11.031 -7.952 6.156 1.00 12.54 C ATOM 553 O GLU A 37 10.520 -8.361 7.199 1.00 1.41 O ATOM 554 CB GLU A 37 9.799 -9.812 5.018 1.00 60.51 C ATOM 555 CG GLU A 37 9.117 -10.214 3.720 1.00 43.13 C ATOM 556 CD GLU A 37 9.129 -11.713 3.495 1.00 5.45 C ATOM 557 OE1 GLU A 37 9.093 -12.464 4.493 1.00 3.15 O ATOM 558 OE2 GLU A 37 9.176 -12.137 2.321 1.00 0.22 O ATOM 0 H GLU A 37 12.372 -9.011 3.439 1.00 24.51 H new ATOM 0 HA GLU A 37 10.497 -8.001 4.089 1.00 4.41 H new ATOM 0 HB2 GLU A 37 10.278 -10.689 5.454 1.00 60.51 H new ATOM 0 HB3 GLU A 37 9.043 -9.476 5.727 1.00 60.51 H new ATOM 0 HG2 GLU A 37 8.086 -9.860 3.731 1.00 43.13 H new ATOM 0 HG3 GLU A 37 9.614 -9.721 2.885 1.00 43.13 H new ATOM 565 N ASP A 38 11.768 -6.847 6.098 1.00 64.44 N ATOM 566 CA ASP A 38 12.023 -6.036 7.282 1.00 64.31 C ATOM 567 C ASP A 38 10.868 -5.072 7.542 1.00 1.45 C ATOM 568 O ASP A 38 11.047 -3.854 7.531 1.00 70.20 O ATOM 569 CB ASP A 38 13.333 -5.260 7.122 1.00 25.34 C ATOM 570 CG ASP A 38 14.112 -5.163 8.420 1.00 14.22 C ATOM 571 OD1 ASP A 38 13.529 -5.454 9.486 1.00 4.10 O ATOM 572 OD2 ASP A 38 15.305 -4.796 8.371 1.00 54.25 O ATOM 0 H ASP A 38 12.199 -6.493 5.244 1.00 64.44 H new ATOM 0 HA ASP A 38 12.110 -6.704 8.139 1.00 64.31 H new ATOM 0 HB2 ASP A 38 13.950 -5.747 6.367 1.00 25.34 H new ATOM 0 HB3 ASP A 38 13.115 -4.256 6.757 1.00 25.34 H new ATOM 577 N SER A 39 9.683 -5.626 7.778 1.00 50.13 N ATOM 578 CA SER A 39 8.499 -4.816 8.043 1.00 72.34 C ATOM 579 C SER A 39 8.725 -3.902 9.243 1.00 52.03 C ATOM 580 O SER A 39 9.623 -4.134 10.052 1.00 53.13 O ATOM 581 CB SER A 39 7.286 -5.714 8.291 1.00 32.21 C ATOM 582 OG SER A 39 6.199 -4.972 8.816 1.00 63.54 O ATOM 0 H SER A 39 9.517 -6.632 7.791 1.00 50.13 H new ATOM 0 HA SER A 39 8.309 -4.196 7.167 1.00 72.34 H new ATOM 0 HB2 SER A 39 6.987 -6.192 7.358 1.00 32.21 H new ATOM 0 HB3 SER A 39 7.555 -6.510 8.985 1.00 32.21 H new ATOM 0 HG SER A 39 6.054 -4.172 8.269 1.00 63.54 H new ATOM 588 N TYR A 40 7.908 -2.859 9.350 1.00 2.12 N ATOM 589 CA TYR A 40 8.025 -1.908 10.450 1.00 54.13 C ATOM 590 C TYR A 40 6.667 -1.653 11.098 1.00 44.40 C ATOM 591 O TYR A 40 5.630 -2.036 10.558 1.00 34.53 O ATOM 592 CB TYR A 40 8.620 -0.591 9.952 1.00 20.42 C ATOM 593 CG TYR A 40 9.701 -0.778 8.914 1.00 34.41 C ATOM 594 CD1 TYR A 40 9.375 -0.997 7.583 1.00 54.13 C ATOM 595 CD2 TYR A 40 11.043 -0.746 9.266 1.00 5.33 C ATOM 596 CE1 TYR A 40 10.357 -1.177 6.629 1.00 72.33 C ATOM 597 CE2 TYR A 40 12.032 -0.925 8.319 1.00 20.24 C ATOM 598 CZ TYR A 40 11.684 -1.140 7.002 1.00 72.21 C ATOM 599 OH TYR A 40 12.667 -1.319 6.055 1.00 52.24 O ATOM 0 H TYR A 40 7.159 -2.651 8.690 1.00 2.12 H new ATOM 0 HA TYR A 40 8.689 -2.339 11.199 1.00 54.13 H new ATOM 0 HB2 TYR A 40 7.824 0.023 9.531 1.00 20.42 H new ATOM 0 HB3 TYR A 40 9.031 -0.043 10.800 1.00 20.42 H new ATOM 0 HD1 TYR A 40 8.336 -1.027 7.288 1.00 54.13 H new ATOM 0 HD2 TYR A 40 11.318 -0.578 10.297 1.00 5.33 H new ATOM 0 HE1 TYR A 40 10.087 -1.346 5.597 1.00 72.33 H new ATOM 0 HE2 TYR A 40 13.072 -0.897 8.608 1.00 20.24 H new ATOM 0 HH TYR A 40 13.547 -1.263 6.482 1.00 52.24 H new ATOM 609 N ARG A 41 6.681 -1.002 12.257 1.00 14.04 N ATOM 610 CA ARG A 41 5.448 -0.695 12.973 1.00 20.45 C ATOM 611 C ARG A 41 5.557 0.644 13.698 1.00 11.14 C ATOM 612 O ARG A 41 6.371 0.806 14.607 1.00 63.23 O ATOM 613 CB ARG A 41 5.119 -1.809 13.970 1.00 2.55 C ATOM 614 CG ARG A 41 6.104 -1.909 15.124 1.00 32.44 C ATOM 615 CD ARG A 41 6.103 -3.300 15.737 1.00 1.20 C ATOM 616 NE ARG A 41 6.839 -3.343 16.999 1.00 23.42 N ATOM 617 CZ ARG A 41 8.168 -3.340 17.083 1.00 1.12 C ATOM 618 NH1 ARG A 41 8.909 -3.292 15.983 1.00 51.14 N ATOM 619 NH2 ARG A 41 8.757 -3.384 18.271 1.00 14.11 N ATOM 0 H ARG A 41 7.530 -0.678 12.719 1.00 14.04 H new ATOM 0 HA ARG A 41 4.642 -0.625 12.243 1.00 20.45 H new ATOM 0 HB2 ARG A 41 4.119 -1.642 14.371 1.00 2.55 H new ATOM 0 HB3 ARG A 41 5.095 -2.762 13.441 1.00 2.55 H new ATOM 0 HG2 ARG A 41 7.106 -1.667 14.771 1.00 32.44 H new ATOM 0 HG3 ARG A 41 5.848 -1.174 15.887 1.00 32.44 H new ATOM 0 HD2 ARG A 41 5.075 -3.621 15.906 1.00 1.20 H new ATOM 0 HD3 ARG A 41 6.546 -4.006 15.035 1.00 1.20 H new ATOM 0 HE ARG A 41 6.303 -3.377 17.866 1.00 23.42 H new ATOM 0 HH11 ARG A 41 8.461 -3.257 15.067 1.00 51.14 H new ATOM 0 HH12 ARG A 41 9.927 -3.290 16.053 1.00 51.14 H new ATOM 0 HH21 ARG A 41 8.192 -3.420 19.119 1.00 14.11 H new ATOM 0 HH22 ARG A 41 9.775 -3.382 18.336 1.00 14.11 H new ATOM 633 N LYS A 42 4.731 1.600 13.287 1.00 34.40 N ATOM 634 CA LYS A 42 4.732 2.926 13.894 1.00 42.21 C ATOM 635 C LYS A 42 3.494 3.131 14.760 1.00 52.20 C ATOM 636 O LYS A 42 2.372 2.863 14.329 1.00 73.53 O ATOM 637 CB LYS A 42 4.794 4.003 12.811 1.00 30.13 C ATOM 638 CG LYS A 42 5.070 5.396 13.353 1.00 2.51 C ATOM 639 CD LYS A 42 5.693 6.292 12.296 1.00 35.22 C ATOM 640 CE LYS A 42 6.697 7.257 12.906 1.00 72.34 C ATOM 641 NZ LYS A 42 6.790 8.524 12.130 1.00 23.55 N ATOM 0 H LYS A 42 4.052 1.481 12.535 1.00 34.40 H new ATOM 0 HA LYS A 42 5.614 3.006 14.530 1.00 42.21 H new ATOM 0 HB2 LYS A 42 5.572 3.741 12.094 1.00 30.13 H new ATOM 0 HB3 LYS A 42 3.849 4.014 12.267 1.00 30.13 H new ATOM 0 HG2 LYS A 42 4.140 5.841 13.706 1.00 2.51 H new ATOM 0 HG3 LYS A 42 5.737 5.328 14.212 1.00 2.51 H new ATOM 0 HD2 LYS A 42 6.187 5.679 11.543 1.00 35.22 H new ATOM 0 HD3 LYS A 42 4.910 6.854 11.786 1.00 35.22 H new ATOM 0 HE2 LYS A 42 6.408 7.480 13.933 1.00 72.34 H new ATOM 0 HE3 LYS A 42 7.678 6.783 12.947 1.00 72.34 H new ATOM 0 HZ1 LYS A 42 7.627 9.059 12.438 1.00 23.55 H new ATOM 0 HZ2 LYS A 42 6.872 8.305 11.117 1.00 23.55 H new ATOM 0 HZ3 LYS A 42 5.936 9.094 12.293 1.00 23.55 H new ATOM 655 N GLN A 43 3.704 3.611 15.981 1.00 30.21 N ATOM 656 CA GLN A 43 2.604 3.856 16.906 1.00 14.54 C ATOM 657 C GLN A 43 2.040 5.260 16.717 1.00 34.00 C ATOM 658 O GLN A 43 2.750 6.251 16.881 1.00 44.12 O ATOM 659 CB GLN A 43 3.072 3.672 18.350 1.00 71.44 C ATOM 660 CG GLN A 43 1.949 3.763 19.371 1.00 4.53 C ATOM 661 CD GLN A 43 2.389 4.420 20.665 1.00 23.23 C ATOM 662 OE1 GLN A 43 3.321 3.958 21.324 1.00 24.42 O ATOM 663 NE2 GLN A 43 1.717 5.503 21.036 1.00 71.13 N ATOM 0 H GLN A 43 4.626 3.838 16.353 1.00 30.21 H new ATOM 0 HA GLN A 43 1.815 3.134 16.694 1.00 14.54 H new ATOM 0 HB2 GLN A 43 3.559 2.702 18.444 1.00 71.44 H new ATOM 0 HB3 GLN A 43 3.822 4.429 18.579 1.00 71.44 H new ATOM 0 HG2 GLN A 43 1.120 4.328 18.945 1.00 4.53 H new ATOM 0 HG3 GLN A 43 1.575 2.762 19.585 1.00 4.53 H new ATOM 0 HE21 GLN A 43 0.951 5.851 20.459 1.00 71.13 H new ATOM 0 HE22 GLN A 43 1.966 5.987 21.898 1.00 71.13 H new ATOM 672 N VAL A 44 0.759 5.335 16.372 1.00 1.54 N ATOM 673 CA VAL A 44 0.099 6.618 16.160 1.00 22.13 C ATOM 674 C VAL A 44 -1.295 6.631 16.778 1.00 11.23 C ATOM 675 O VAL A 44 -1.729 5.646 17.377 1.00 53.14 O ATOM 676 CB VAL A 44 -0.011 6.953 14.660 1.00 14.20 C ATOM 677 CG1 VAL A 44 1.369 7.040 14.028 1.00 24.43 C ATOM 678 CG2 VAL A 44 -0.868 5.922 13.940 1.00 71.41 C ATOM 0 H VAL A 44 0.157 4.523 16.233 1.00 1.54 H new ATOM 0 HA VAL A 44 0.715 7.373 16.648 1.00 22.13 H new ATOM 0 HB VAL A 44 -0.494 7.925 14.562 1.00 14.20 H new ATOM 0 HG11 VAL A 44 1.270 7.277 12.969 1.00 24.43 H new ATOM 0 HG12 VAL A 44 1.947 7.821 14.522 1.00 24.43 H new ATOM 0 HG13 VAL A 44 1.881 6.084 14.139 1.00 24.43 H new ATOM 0 HG21 VAL A 44 -0.933 6.177 12.882 1.00 71.41 H new ATOM 0 HG22 VAL A 44 -0.418 4.935 14.048 1.00 71.41 H new ATOM 0 HG23 VAL A 44 -1.868 5.914 14.373 1.00 71.41 H new ATOM 688 N VAL A 45 -1.991 7.752 16.629 1.00 71.43 N ATOM 689 CA VAL A 45 -3.337 7.895 17.171 1.00 72.13 C ATOM 690 C VAL A 45 -4.314 8.372 16.100 1.00 45.53 C ATOM 691 O VAL A 45 -4.341 9.552 15.751 1.00 13.34 O ATOM 692 CB VAL A 45 -3.360 8.877 18.356 1.00 52.21 C ATOM 693 CG1 VAL A 45 -2.851 10.241 17.925 1.00 43.12 C ATOM 694 CG2 VAL A 45 -4.761 8.978 18.946 1.00 11.04 C ATOM 0 H VAL A 45 -1.645 8.576 16.137 1.00 71.43 H new ATOM 0 HA VAL A 45 -3.647 6.910 17.522 1.00 72.13 H new ATOM 0 HB VAL A 45 -2.697 8.496 19.133 1.00 52.21 H new ATOM 0 HG11 VAL A 45 -2.874 10.923 18.775 1.00 43.12 H new ATOM 0 HG12 VAL A 45 -1.828 10.149 17.561 1.00 43.12 H new ATOM 0 HG13 VAL A 45 -3.485 10.631 17.129 1.00 43.12 H new ATOM 0 HG21 VAL A 45 -4.754 9.677 19.782 1.00 11.04 H new ATOM 0 HG22 VAL A 45 -5.453 9.333 18.182 1.00 11.04 H new ATOM 0 HG23 VAL A 45 -5.080 7.996 19.297 1.00 11.04 H new ATOM 704 N ILE A 46 -5.115 7.446 15.584 1.00 71.12 N ATOM 705 CA ILE A 46 -6.096 7.771 14.555 1.00 52.43 C ATOM 706 C ILE A 46 -7.518 7.645 15.093 1.00 15.21 C ATOM 707 O ILE A 46 -7.849 6.679 15.780 1.00 21.02 O ATOM 708 CB ILE A 46 -5.939 6.862 13.318 1.00 44.11 C ATOM 709 CG1 ILE A 46 -4.498 6.908 12.808 1.00 30.02 C ATOM 710 CG2 ILE A 46 -6.907 7.280 12.220 1.00 60.31 C ATOM 711 CD1 ILE A 46 -4.096 5.677 12.026 1.00 13.13 C ATOM 0 H ILE A 46 -5.104 6.465 15.861 1.00 71.12 H new ATOM 0 HA ILE A 46 -5.914 8.804 14.259 1.00 52.43 H new ATOM 0 HB ILE A 46 -6.174 5.838 13.608 1.00 44.11 H new ATOM 0 HG12 ILE A 46 -4.372 7.787 12.176 1.00 30.02 H new ATOM 0 HG13 ILE A 46 -3.824 7.026 13.657 1.00 30.02 H new ATOM 0 HG21 ILE A 46 -6.781 6.627 11.356 1.00 60.31 H new ATOM 0 HG22 ILE A 46 -7.930 7.202 12.588 1.00 60.31 H new ATOM 0 HG23 ILE A 46 -6.704 8.311 11.929 1.00 60.31 H new ATOM 0 HD11 ILE A 46 -3.062 5.778 11.695 1.00 13.13 H new ATOM 0 HD12 ILE A 46 -4.189 4.796 12.661 1.00 13.13 H new ATOM 0 HD13 ILE A 46 -4.746 5.569 11.158 1.00 13.13 H new ATOM 723 N ASP A 47 -8.354 8.630 14.778 1.00 14.21 N ATOM 724 CA ASP A 47 -9.741 8.632 15.231 1.00 64.51 C ATOM 725 C ASP A 47 -9.815 8.722 16.752 1.00 51.22 C ATOM 726 O ASP A 47 -10.738 8.192 17.371 1.00 53.05 O ATOM 727 CB ASP A 47 -10.463 7.372 14.747 1.00 31.42 C ATOM 728 CG ASP A 47 -11.926 7.626 14.441 1.00 42.11 C ATOM 729 OD1 ASP A 47 -12.710 7.802 15.398 1.00 3.22 O ATOM 730 OD2 ASP A 47 -12.288 7.651 13.246 1.00 0.52 O ATOM 0 H ASP A 47 -8.095 9.437 14.211 1.00 14.21 H new ATOM 0 HA ASP A 47 -10.233 9.507 14.807 1.00 64.51 H new ATOM 0 HB2 ASP A 47 -9.968 6.994 13.853 1.00 31.42 H new ATOM 0 HB3 ASP A 47 -10.383 6.596 15.508 1.00 31.42 H new ATOM 735 N GLY A 48 -8.838 9.397 17.348 1.00 65.12 N ATOM 736 CA GLY A 48 -8.811 9.546 18.791 1.00 35.13 C ATOM 737 C GLY A 48 -8.609 8.225 19.507 1.00 43.34 C ATOM 738 O GLY A 48 -9.124 8.023 20.607 1.00 24.34 O ATOM 0 H GLY A 48 -8.064 9.844 16.857 1.00 65.12 H new ATOM 0 HA2 GLY A 48 -8.010 10.232 19.067 1.00 35.13 H new ATOM 0 HA3 GLY A 48 -9.746 9.997 19.124 1.00 35.13 H new ATOM 742 N GLU A 49 -7.858 7.324 18.882 1.00 75.23 N ATOM 743 CA GLU A 49 -7.590 6.015 19.467 1.00 15.13 C ATOM 744 C GLU A 49 -6.178 5.545 19.128 1.00 14.04 C ATOM 745 O GLU A 49 -5.889 5.189 17.985 1.00 61.33 O ATOM 746 CB GLU A 49 -8.614 4.993 18.969 1.00 71.33 C ATOM 747 CG GLU A 49 -8.407 3.597 19.536 1.00 64.11 C ATOM 748 CD GLU A 49 -9.668 3.023 20.153 1.00 13.54 C ATOM 749 OE1 GLU A 49 -10.726 3.065 19.489 1.00 20.34 O ATOM 750 OE2 GLU A 49 -9.598 2.532 21.299 1.00 2.44 O ATOM 0 H GLU A 49 -7.425 7.476 17.971 1.00 75.23 H new ATOM 0 HA GLU A 49 -7.672 6.105 20.550 1.00 15.13 H new ATOM 0 HB2 GLU A 49 -9.615 5.337 19.230 1.00 71.33 H new ATOM 0 HB3 GLU A 49 -8.567 4.945 17.881 1.00 71.33 H new ATOM 0 HG2 GLU A 49 -8.062 2.934 18.742 1.00 64.11 H new ATOM 0 HG3 GLU A 49 -7.620 3.628 20.290 1.00 64.11 H new ATOM 757 N THR A 50 -5.304 5.546 20.128 1.00 74.53 N ATOM 758 CA THR A 50 -3.923 5.119 19.936 1.00 71.42 C ATOM 759 C THR A 50 -3.865 3.668 19.469 1.00 20.21 C ATOM 760 O THR A 50 -4.334 2.763 20.160 1.00 34.20 O ATOM 761 CB THR A 50 -3.130 5.282 21.235 1.00 20.01 C ATOM 762 OG1 THR A 50 -3.166 6.627 21.678 1.00 45.14 O ATOM 763 CG2 THR A 50 -1.677 4.882 21.105 1.00 41.52 C ATOM 0 H THR A 50 -5.527 5.838 21.080 1.00 74.53 H new ATOM 0 HA THR A 50 -3.477 5.749 19.166 1.00 71.42 H new ATOM 0 HB THR A 50 -3.610 4.616 21.951 1.00 20.01 H new ATOM 0 HG1 THR A 50 -2.655 6.711 22.510 1.00 45.14 H new ATOM 0 HG21 THR A 50 -1.174 5.022 22.062 1.00 41.52 H new ATOM 0 HG22 THR A 50 -1.613 3.834 20.812 1.00 41.52 H new ATOM 0 HG23 THR A 50 -1.196 5.501 20.348 1.00 41.52 H new ATOM 771 N CYS A 51 -3.286 3.453 18.292 1.00 33.05 N ATOM 772 CA CYS A 51 -3.167 2.112 17.733 1.00 31.44 C ATOM 773 C CYS A 51 -1.858 1.956 16.965 1.00 65.10 C ATOM 774 O CYS A 51 -1.342 2.919 16.397 1.00 25.10 O ATOM 775 CB CYS A 51 -4.350 1.815 16.810 1.00 0.13 C ATOM 776 SG CYS A 51 -5.872 1.375 17.682 1.00 1.44 S ATOM 0 H CYS A 51 -2.892 4.190 17.707 1.00 33.05 H new ATOM 0 HA CYS A 51 -3.170 1.400 18.559 1.00 31.44 H new ATOM 0 HB2 CYS A 51 -4.540 2.689 16.187 1.00 0.13 H new ATOM 0 HB3 CYS A 51 -4.079 0.999 16.140 1.00 0.13 H new ATOM 0 HG CYS A 51 -5.788 1.758 18.921 1.00 1.44 H new ATOM 782 N LEU A 52 -1.326 0.738 16.952 1.00 11.50 N ATOM 783 CA LEU A 52 -0.077 0.455 16.254 1.00 31.04 C ATOM 784 C LEU A 52 -0.323 0.252 14.763 1.00 30.14 C ATOM 785 O LEU A 52 -1.356 -0.283 14.362 1.00 63.10 O ATOM 786 CB LEU A 52 0.595 -0.786 16.849 1.00 13.04 C ATOM 787 CG LEU A 52 1.978 -0.547 17.455 1.00 74.43 C ATOM 788 CD1 LEU A 52 2.922 0.040 16.417 1.00 34.43 C ATOM 789 CD2 LEU A 52 1.878 0.369 18.665 1.00 22.31 C ATOM 0 H LEU A 52 -1.741 -0.069 17.417 1.00 11.50 H new ATOM 0 HA LEU A 52 0.585 1.312 16.381 1.00 31.04 H new ATOM 0 HB2 LEU A 52 -0.056 -1.198 17.620 1.00 13.04 H new ATOM 0 HB3 LEU A 52 0.683 -1.542 16.069 1.00 13.04 H new ATOM 0 HG LEU A 52 2.381 -1.506 17.781 1.00 74.43 H new ATOM 0 HD11 LEU A 52 3.901 0.203 16.867 1.00 34.43 H new ATOM 0 HD12 LEU A 52 3.018 -0.652 15.580 1.00 34.43 H new ATOM 0 HD13 LEU A 52 2.524 0.990 16.059 1.00 34.43 H new ATOM 0 HD21 LEU A 52 2.872 0.528 19.084 1.00 22.31 H new ATOM 0 HD22 LEU A 52 1.454 1.326 18.362 1.00 22.31 H new ATOM 0 HD23 LEU A 52 1.237 -0.090 19.417 1.00 22.31 H new ATOM 801 N LEU A 53 0.634 0.680 13.946 1.00 30.45 N ATOM 802 CA LEU A 53 0.521 0.542 12.499 1.00 24.40 C ATOM 803 C LEU A 53 1.662 -0.302 11.945 1.00 2.21 C ATOM 804 O LEU A 53 2.674 0.230 11.488 1.00 65.42 O ATOM 805 CB LEU A 53 0.522 1.918 11.830 1.00 3.12 C ATOM 806 CG LEU A 53 -0.724 2.769 12.085 1.00 23.13 C ATOM 807 CD1 LEU A 53 -0.707 4.011 11.209 1.00 20.43 C ATOM 808 CD2 LEU A 53 -1.988 1.959 11.837 1.00 54.32 C ATOM 0 H LEU A 53 1.496 1.125 14.261 1.00 30.45 H new ATOM 0 HA LEU A 53 -0.422 0.040 12.281 1.00 24.40 H new ATOM 0 HB2 LEU A 53 1.396 2.471 12.174 1.00 3.12 H new ATOM 0 HB3 LEU A 53 0.635 1.781 10.755 1.00 3.12 H new ATOM 0 HG LEU A 53 -0.718 3.082 13.129 1.00 23.13 H new ATOM 0 HD11 LEU A 53 -1.600 4.605 11.403 1.00 20.43 H new ATOM 0 HD12 LEU A 53 0.179 4.604 11.435 1.00 20.43 H new ATOM 0 HD13 LEU A 53 -0.688 3.716 10.160 1.00 20.43 H new ATOM 0 HD21 LEU A 53 -2.862 2.583 12.024 1.00 54.32 H new ATOM 0 HD22 LEU A 53 -2.002 1.615 10.803 1.00 54.32 H new ATOM 0 HD23 LEU A 53 -2.006 1.099 12.506 1.00 54.32 H new ATOM 820 N ASP A 54 1.493 -1.619 11.990 1.00 2.11 N ATOM 821 CA ASP A 54 2.511 -2.537 11.492 1.00 22.11 C ATOM 822 C ASP A 54 2.495 -2.593 9.969 1.00 33.44 C ATOM 823 O ASP A 54 1.787 -3.406 9.375 1.00 11.14 O ATOM 824 CB ASP A 54 2.292 -3.938 12.069 1.00 61.41 C ATOM 825 CG ASP A 54 2.827 -4.071 13.481 1.00 61.13 C ATOM 826 OD1 ASP A 54 2.192 -3.528 14.410 1.00 2.01 O ATOM 827 OD2 ASP A 54 3.881 -4.716 13.659 1.00 13.20 O ATOM 0 H ASP A 54 0.661 -2.075 12.366 1.00 2.11 H new ATOM 0 HA ASP A 54 3.485 -2.168 11.813 1.00 22.11 H new ATOM 0 HB2 ASP A 54 1.226 -4.168 12.064 1.00 61.41 H new ATOM 0 HB3 ASP A 54 2.780 -4.672 11.428 1.00 61.41 H new ATOM 832 N ILE A 55 3.285 -1.728 9.342 1.00 71.04 N ATOM 833 CA ILE A 55 3.364 -1.685 7.887 1.00 73.25 C ATOM 834 C ILE A 55 4.243 -2.812 7.360 1.00 62.35 C ATOM 835 O ILE A 55 5.445 -2.850 7.624 1.00 41.41 O ATOM 836 CB ILE A 55 3.918 -0.337 7.388 1.00 63.03 C ATOM 837 CG1 ILE A 55 3.215 0.822 8.095 1.00 10.23 C ATOM 838 CG2 ILE A 55 3.752 -0.223 5.880 1.00 12.45 C ATOM 839 CD1 ILE A 55 1.710 0.809 7.930 1.00 11.15 C ATOM 0 H ILE A 55 3.879 -1.049 9.818 1.00 71.04 H new ATOM 0 HA ILE A 55 2.349 -1.807 7.509 1.00 73.25 H new ATOM 0 HB ILE A 55 4.981 -0.289 7.623 1.00 63.03 H new ATOM 0 HG12 ILE A 55 3.456 0.788 9.157 1.00 10.23 H new ATOM 0 HG13 ILE A 55 3.606 1.763 7.709 1.00 10.23 H new ATOM 0 HG21 ILE A 55 4.148 0.735 5.542 1.00 12.45 H new ATOM 0 HG22 ILE A 55 4.295 -1.033 5.392 1.00 12.45 H new ATOM 0 HG23 ILE A 55 2.694 -0.289 5.624 1.00 12.45 H new ATOM 0 HD11 ILE A 55 1.279 1.660 8.458 1.00 11.15 H new ATOM 0 HD12 ILE A 55 1.459 0.874 6.871 1.00 11.15 H new ATOM 0 HD13 ILE A 55 1.307 -0.116 8.342 1.00 11.15 H new ATOM 851 N LEU A 56 3.634 -3.732 6.624 1.00 72.42 N ATOM 852 CA LEU A 56 4.355 -4.866 6.069 1.00 51.13 C ATOM 853 C LEU A 56 4.732 -4.615 4.610 1.00 42.44 C ATOM 854 O LEU A 56 3.867 -4.383 3.765 1.00 72.21 O ATOM 855 CB LEU A 56 3.495 -6.125 6.197 1.00 14.11 C ATOM 856 CG LEU A 56 3.901 -7.296 5.302 1.00 25.33 C ATOM 857 CD1 LEU A 56 4.116 -8.550 6.132 1.00 62.50 C ATOM 858 CD2 LEU A 56 2.845 -7.530 4.235 1.00 71.03 C ATOM 0 H LEU A 56 2.640 -3.714 6.398 1.00 72.42 H new ATOM 0 HA LEU A 56 5.281 -5.005 6.628 1.00 51.13 H new ATOM 0 HB2 LEU A 56 3.522 -6.458 7.235 1.00 14.11 H new ATOM 0 HB3 LEU A 56 2.461 -5.861 5.973 1.00 14.11 H new ATOM 0 HG LEU A 56 4.842 -7.051 4.809 1.00 25.33 H new ATOM 0 HD11 LEU A 56 4.404 -9.374 5.479 1.00 62.50 H new ATOM 0 HD12 LEU A 56 4.906 -8.372 6.862 1.00 62.50 H new ATOM 0 HD13 LEU A 56 3.192 -8.805 6.651 1.00 62.50 H new ATOM 0 HD21 LEU A 56 3.145 -8.366 3.604 1.00 71.03 H new ATOM 0 HD22 LEU A 56 1.891 -7.758 4.711 1.00 71.03 H new ATOM 0 HD23 LEU A 56 2.740 -6.633 3.624 1.00 71.03 H new ATOM 870 N ASP A 57 6.029 -4.667 4.323 1.00 72.32 N ATOM 871 CA ASP A 57 6.524 -4.451 2.968 1.00 64.45 C ATOM 872 C ASP A 57 7.003 -5.762 2.353 1.00 54.05 C ATOM 873 O ASP A 57 8.096 -6.239 2.658 1.00 52.33 O ATOM 874 CB ASP A 57 7.661 -3.427 2.977 1.00 24.24 C ATOM 875 CG ASP A 57 8.195 -3.139 1.587 1.00 14.15 C ATOM 876 OD1 ASP A 57 7.385 -2.798 0.699 1.00 54.11 O ATOM 877 OD2 ASP A 57 9.422 -3.254 1.386 1.00 34.33 O ATOM 0 H ASP A 57 6.757 -4.857 5.012 1.00 72.32 H new ATOM 0 HA ASP A 57 5.705 -4.065 2.361 1.00 64.45 H new ATOM 0 HB2 ASP A 57 7.306 -2.499 3.426 1.00 24.24 H new ATOM 0 HB3 ASP A 57 8.472 -3.795 3.605 1.00 24.24 H new ATOM 882 N THR A 58 6.176 -6.341 1.488 1.00 10.52 N ATOM 883 CA THR A 58 6.513 -7.600 0.832 1.00 43.33 C ATOM 884 C THR A 58 7.465 -7.371 -0.337 1.00 31.11 C ATOM 885 O THR A 58 7.940 -6.257 -0.556 1.00 63.32 O ATOM 886 CB THR A 58 5.244 -8.300 0.341 1.00 71.40 C ATOM 887 OG1 THR A 58 4.745 -7.674 -0.828 1.00 21.31 O ATOM 888 CG2 THR A 58 4.131 -8.311 1.367 1.00 74.24 C ATOM 0 H THR A 58 5.268 -5.959 1.225 1.00 10.52 H new ATOM 0 HA THR A 58 7.012 -8.236 1.563 1.00 43.33 H new ATOM 0 HB THR A 58 5.542 -9.329 0.141 1.00 71.40 H new ATOM 0 HG1 THR A 58 3.935 -8.137 -1.127 1.00 21.31 H new ATOM 0 HG21 THR A 58 3.261 -8.822 0.955 1.00 74.24 H new ATOM 0 HG22 THR A 58 4.467 -8.832 2.263 1.00 74.24 H new ATOM 0 HG23 THR A 58 3.862 -7.286 1.623 1.00 74.24 H new ATOM 896 N ALA A 59 7.739 -8.436 -1.085 1.00 52.44 N ATOM 897 CA ALA A 59 8.634 -8.357 -2.233 1.00 51.54 C ATOM 898 C ALA A 59 7.890 -8.648 -3.532 1.00 64.11 C ATOM 899 O ALA A 59 7.098 -9.587 -3.608 1.00 73.20 O ATOM 900 CB ALA A 59 9.796 -9.325 -2.062 1.00 63.51 C ATOM 0 H ALA A 59 7.353 -9.365 -0.916 1.00 52.44 H new ATOM 0 HA ALA A 59 9.024 -7.341 -2.288 1.00 51.54 H new ATOM 0 HB1 ALA A 59 10.457 -9.256 -2.926 1.00 63.51 H new ATOM 0 HB2 ALA A 59 10.351 -9.071 -1.159 1.00 63.51 H new ATOM 0 HB3 ALA A 59 9.413 -10.342 -1.978 1.00 63.51 H new ATOM 906 N GLY A 60 8.149 -7.837 -4.552 1.00 61.25 N ATOM 907 CA GLY A 60 7.495 -8.026 -5.834 1.00 54.10 C ATOM 908 C GLY A 60 8.288 -8.918 -6.772 1.00 52.44 C ATOM 909 O GLY A 60 7.995 -8.987 -7.965 1.00 62.55 O ATOM 0 H GLY A 60 8.800 -7.052 -4.514 1.00 61.25 H new ATOM 0 HA2 GLY A 60 6.509 -8.461 -5.673 1.00 54.10 H new ATOM 0 HA3 GLY A 60 7.342 -7.055 -6.306 1.00 54.10 H new ATOM 913 N GLN A 61 9.295 -9.601 -6.234 1.00 41.14 N ATOM 914 CA GLN A 61 10.129 -10.489 -7.034 1.00 32.32 C ATOM 915 C GLN A 61 10.643 -11.655 -6.195 1.00 24.22 C ATOM 916 O GLN A 61 10.187 -11.873 -5.072 1.00 32.40 O ATOM 917 CB GLN A 61 11.306 -9.712 -7.629 1.00 24.33 C ATOM 918 CG GLN A 61 12.314 -9.241 -6.593 1.00 40.23 C ATOM 919 CD GLN A 61 13.154 -8.078 -7.083 1.00 63.13 C ATOM 920 OE1 GLN A 61 14.094 -8.259 -7.857 1.00 64.34 O ATOM 921 NE2 GLN A 61 12.818 -6.875 -6.633 1.00 20.31 N ATOM 0 H GLN A 61 9.552 -9.556 -5.248 1.00 41.14 H new ATOM 0 HA GLN A 61 9.520 -10.891 -7.844 1.00 32.32 H new ATOM 0 HB2 GLN A 61 11.815 -10.343 -8.358 1.00 24.33 H new ATOM 0 HB3 GLN A 61 10.922 -8.847 -8.169 1.00 24.33 H new ATOM 0 HG2 GLN A 61 11.786 -8.946 -5.686 1.00 40.23 H new ATOM 0 HG3 GLN A 61 12.969 -10.070 -6.326 1.00 40.23 H new ATOM 0 HE21 GLN A 61 12.031 -6.772 -5.992 1.00 20.31 H new ATOM 0 HE22 GLN A 61 13.347 -6.054 -6.928 1.00 20.31 H new ATOM 930 N GLU A 62 11.596 -12.403 -6.745 1.00 2.51 N ATOM 931 CA GLU A 62 12.174 -13.546 -6.046 1.00 74.31 C ATOM 932 C GLU A 62 11.130 -14.638 -5.815 1.00 2.22 C ATOM 933 O GLU A 62 11.334 -15.538 -4.999 1.00 4.01 O ATOM 934 CB GLU A 62 12.768 -13.102 -4.706 1.00 70.23 C ATOM 935 CG GLU A 62 14.287 -13.036 -4.705 1.00 4.11 C ATOM 936 CD GLU A 62 14.911 -13.970 -3.686 1.00 52.15 C ATOM 937 OE1 GLU A 62 14.279 -14.995 -3.355 1.00 75.13 O ATOM 938 OE2 GLU A 62 16.032 -13.676 -3.219 1.00 54.13 O ATOM 0 H GLU A 62 11.984 -12.237 -7.674 1.00 2.51 H new ATOM 0 HA GLU A 62 12.966 -13.957 -6.672 1.00 74.31 H new ATOM 0 HB2 GLU A 62 12.370 -12.120 -4.449 1.00 70.23 H new ATOM 0 HB3 GLU A 62 12.442 -13.792 -3.927 1.00 70.23 H new ATOM 0 HG2 GLU A 62 14.658 -13.288 -5.698 1.00 4.11 H new ATOM 0 HG3 GLU A 62 14.602 -12.014 -4.496 1.00 4.11 H new ATOM 945 N GLU A 63 10.011 -14.555 -6.533 1.00 14.13 N ATOM 946 CA GLU A 63 8.938 -15.537 -6.401 1.00 13.33 C ATOM 947 C GLU A 63 8.619 -15.811 -4.935 1.00 24.04 C ATOM 948 O GLU A 63 9.217 -16.688 -4.311 1.00 71.40 O ATOM 949 CB GLU A 63 9.316 -16.840 -7.103 1.00 31.33 C ATOM 950 CG GLU A 63 8.785 -16.941 -8.523 1.00 24.33 C ATOM 951 CD GLU A 63 9.404 -18.087 -9.298 1.00 41.41 C ATOM 952 OE1 GLU A 63 9.439 -19.215 -8.762 1.00 12.14 O ATOM 953 OE2 GLU A 63 9.854 -17.857 -10.439 1.00 44.23 O ATOM 0 H GLU A 63 9.825 -13.817 -7.212 1.00 14.13 H new ATOM 0 HA GLU A 63 8.048 -15.122 -6.875 1.00 13.33 H new ATOM 0 HB2 GLU A 63 10.402 -16.931 -7.123 1.00 31.33 H new ATOM 0 HB3 GLU A 63 8.936 -17.680 -6.521 1.00 31.33 H new ATOM 0 HG2 GLU A 63 7.703 -17.070 -8.494 1.00 24.33 H new ATOM 0 HG3 GLU A 63 8.981 -16.006 -9.047 1.00 24.33 H new ATOM 960 N TYR A 64 7.674 -15.055 -4.396 1.00 15.43 N ATOM 961 CA TYR A 64 7.270 -15.210 -3.005 1.00 14.43 C ATOM 962 C TYR A 64 5.750 -15.193 -2.879 1.00 13.00 C ATOM 963 O TYR A 64 5.207 -14.785 -1.852 1.00 54.24 O ATOM 964 CB TYR A 64 7.886 -14.102 -2.146 1.00 20.45 C ATOM 965 CG TYR A 64 9.036 -14.568 -1.278 1.00 10.41 C ATOM 966 CD1 TYR A 64 9.001 -15.807 -0.647 1.00 22.34 C ATOM 967 CD2 TYR A 64 10.154 -13.767 -1.087 1.00 42.55 C ATOM 968 CE1 TYR A 64 10.048 -16.233 0.147 1.00 45.34 C ATOM 969 CE2 TYR A 64 11.206 -14.187 -0.294 1.00 74.51 C ATOM 970 CZ TYR A 64 11.148 -15.420 0.321 1.00 73.13 C ATOM 971 OH TYR A 64 12.192 -15.840 1.113 1.00 21.44 O ATOM 0 H TYR A 64 7.171 -14.326 -4.902 1.00 15.43 H new ATOM 0 HA TYR A 64 7.633 -16.174 -2.648 1.00 14.43 H new ATOM 0 HB2 TYR A 64 8.237 -13.302 -2.798 1.00 20.45 H new ATOM 0 HB3 TYR A 64 7.111 -13.677 -1.508 1.00 20.45 H new ATOM 0 HD1 TYR A 64 8.141 -16.447 -0.780 1.00 22.34 H new ATOM 0 HD2 TYR A 64 10.203 -12.800 -1.566 1.00 42.55 H new ATOM 0 HE1 TYR A 64 10.005 -17.198 0.629 1.00 45.34 H new ATOM 0 HE2 TYR A 64 12.069 -13.552 -0.157 1.00 74.51 H new ATOM 0 HH TYR A 64 12.888 -15.150 1.130 1.00 21.44 H new ATOM 981 N SER A 65 5.067 -15.647 -3.927 1.00 75.20 N ATOM 982 CA SER A 65 3.610 -15.690 -3.926 1.00 33.43 C ATOM 983 C SER A 65 3.106 -16.495 -2.734 1.00 2.23 C ATOM 984 O SER A 65 2.048 -16.205 -2.175 1.00 30.41 O ATOM 985 CB SER A 65 3.092 -16.302 -5.229 1.00 35.30 C ATOM 986 OG SER A 65 3.545 -17.636 -5.382 1.00 10.44 O ATOM 0 H SER A 65 5.499 -15.989 -4.785 1.00 75.20 H new ATOM 0 HA SER A 65 3.235 -14.670 -3.846 1.00 33.43 H new ATOM 0 HB2 SER A 65 2.002 -16.282 -5.236 1.00 35.30 H new ATOM 0 HB3 SER A 65 3.427 -15.702 -6.075 1.00 35.30 H new ATOM 0 HG SER A 65 3.199 -18.005 -6.221 1.00 10.44 H new ATOM 992 N ALA A 66 3.882 -17.501 -2.343 1.00 64.34 N ATOM 993 CA ALA A 66 3.532 -18.346 -1.209 1.00 22.22 C ATOM 994 C ALA A 66 3.362 -17.508 0.053 1.00 40.43 C ATOM 995 O ALA A 66 2.611 -17.870 0.958 1.00 53.54 O ATOM 996 CB ALA A 66 4.599 -19.410 -0.999 1.00 43.21 C ATOM 0 H ALA A 66 4.760 -17.751 -2.797 1.00 64.34 H new ATOM 0 HA ALA A 66 2.583 -18.838 -1.423 1.00 22.22 H new ATOM 0 HB1 ALA A 66 4.327 -20.036 -0.149 1.00 43.21 H new ATOM 0 HB2 ALA A 66 4.678 -20.028 -1.894 1.00 43.21 H new ATOM 0 HB3 ALA A 66 5.558 -18.930 -0.804 1.00 43.21 H new ATOM 1002 N MET A 67 4.066 -16.381 0.099 1.00 62.54 N ATOM 1003 CA MET A 67 3.999 -15.480 1.241 1.00 10.11 C ATOM 1004 C MET A 67 2.804 -14.542 1.117 1.00 14.42 C ATOM 1005 O MET A 67 2.196 -14.155 2.115 1.00 72.53 O ATOM 1006 CB MET A 67 5.284 -14.656 1.346 1.00 4.03 C ATOM 1007 CG MET A 67 6.557 -15.448 1.100 1.00 43.53 C ATOM 1008 SD MET A 67 7.148 -16.294 2.575 1.00 30.02 S ATOM 1009 CE MET A 67 5.912 -17.577 2.743 1.00 21.41 C ATOM 0 H MET A 67 4.691 -16.071 -0.645 1.00 62.54 H new ATOM 0 HA MET A 67 3.884 -16.084 2.141 1.00 10.11 H new ATOM 0 HB2 MET A 67 5.236 -13.836 0.629 1.00 4.03 H new ATOM 0 HB3 MET A 67 5.335 -14.209 2.339 1.00 4.03 H new ATOM 0 HG2 MET A 67 6.377 -16.181 0.314 1.00 43.53 H new ATOM 0 HG3 MET A 67 7.334 -14.775 0.737 1.00 43.53 H new ATOM 0 HE1 MET A 67 6.355 -18.448 3.227 1.00 21.41 H new ATOM 0 HE2 MET A 67 5.084 -17.208 3.348 1.00 21.41 H new ATOM 0 HE3 MET A 67 5.543 -17.858 1.757 1.00 21.41 H new ATOM 1019 N ARG A 68 2.482 -14.173 -0.118 1.00 4.13 N ATOM 1020 CA ARG A 68 1.369 -13.270 -0.387 1.00 33.15 C ATOM 1021 C ARG A 68 0.067 -13.801 0.205 1.00 14.23 C ATOM 1022 O ARG A 68 -0.582 -13.124 1.003 1.00 44.30 O ATOM 1023 CB ARG A 68 1.212 -13.062 -1.894 1.00 51.51 C ATOM 1024 CG ARG A 68 1.108 -11.602 -2.301 1.00 45.34 C ATOM 1025 CD ARG A 68 1.840 -11.335 -3.606 1.00 73.32 C ATOM 1026 NE ARG A 68 2.214 -9.930 -3.750 1.00 23.31 N ATOM 1027 CZ ARG A 68 2.958 -9.461 -4.748 1.00 31.35 C ATOM 1028 NH1 ARG A 68 3.412 -10.280 -5.689 1.00 61.51 N ATOM 1029 NH2 ARG A 68 3.250 -8.169 -4.807 1.00 21.32 N ATOM 0 H ARG A 68 2.978 -14.487 -0.952 1.00 4.13 H new ATOM 0 HA ARG A 68 1.591 -12.314 0.088 1.00 33.15 H new ATOM 0 HB2 ARG A 68 2.063 -13.513 -2.405 1.00 51.51 H new ATOM 0 HB3 ARG A 68 0.321 -13.589 -2.234 1.00 51.51 H new ATOM 0 HG2 ARG A 68 0.059 -11.327 -2.408 1.00 45.34 H new ATOM 0 HG3 ARG A 68 1.524 -10.973 -1.514 1.00 45.34 H new ATOM 0 HD2 ARG A 68 2.736 -11.954 -3.652 1.00 73.32 H new ATOM 0 HD3 ARG A 68 1.206 -11.628 -4.443 1.00 73.32 H new ATOM 0 HE ARG A 68 1.886 -9.271 -3.044 1.00 23.31 H new ATOM 0 HH11 ARG A 68 3.191 -11.275 -5.649 1.00 61.51 H new ATOM 0 HH12 ARG A 68 3.982 -9.914 -6.452 1.00 61.51 H new ATOM 0 HH21 ARG A 68 2.904 -7.535 -4.087 1.00 21.32 H new ATOM 0 HH22 ARG A 68 3.821 -7.810 -5.572 1.00 21.32 H new ATOM 1043 N ASP A 69 -0.312 -15.016 -0.189 1.00 51.13 N ATOM 1044 CA ASP A 69 -1.540 -15.634 0.308 1.00 51.43 C ATOM 1045 C ASP A 69 -1.636 -15.502 1.825 1.00 72.25 C ATOM 1046 O ASP A 69 -2.728 -15.417 2.385 1.00 55.14 O ATOM 1047 CB ASP A 69 -1.594 -17.109 -0.095 1.00 0.13 C ATOM 1048 CG ASP A 69 -2.421 -17.333 -1.346 1.00 21.43 C ATOM 1049 OD1 ASP A 69 -2.027 -16.824 -2.416 1.00 34.55 O ATOM 1050 OD2 ASP A 69 -3.463 -18.016 -1.255 1.00 50.11 O ATOM 0 H ASP A 69 0.212 -15.590 -0.849 1.00 51.13 H new ATOM 0 HA ASP A 69 -2.388 -15.114 -0.139 1.00 51.43 H new ATOM 0 HB2 ASP A 69 -0.581 -17.475 -0.261 1.00 0.13 H new ATOM 0 HB3 ASP A 69 -2.013 -17.692 0.725 1.00 0.13 H new ATOM 1055 N GLN A 70 -0.481 -15.473 2.481 1.00 71.34 N ATOM 1056 CA GLN A 70 -0.428 -15.337 3.929 1.00 42.44 C ATOM 1057 C GLN A 70 -0.624 -13.877 4.328 1.00 34.43 C ATOM 1058 O GLN A 70 -1.376 -13.571 5.250 1.00 53.12 O ATOM 1059 CB GLN A 70 0.914 -15.861 4.459 1.00 44.44 C ATOM 1060 CG GLN A 70 1.178 -15.536 5.923 1.00 1.14 C ATOM 1061 CD GLN A 70 0.385 -16.415 6.871 1.00 62.51 C ATOM 1062 OE1 GLN A 70 -0.751 -16.792 6.584 1.00 51.03 O ATOM 1063 NE2 GLN A 70 0.985 -16.747 8.008 1.00 12.02 N ATOM 0 H GLN A 70 0.432 -15.542 2.031 1.00 71.34 H new ATOM 0 HA GLN A 70 -1.231 -15.928 4.369 1.00 42.44 H new ATOM 0 HB2 GLN A 70 0.946 -16.943 4.327 1.00 44.44 H new ATOM 0 HB3 GLN A 70 1.719 -15.442 3.855 1.00 44.44 H new ATOM 0 HG2 GLN A 70 2.242 -15.652 6.130 1.00 1.14 H new ATOM 0 HG3 GLN A 70 0.929 -14.491 6.109 1.00 1.14 H new ATOM 0 HE21 GLN A 70 1.928 -16.411 8.204 1.00 12.02 H new ATOM 0 HE22 GLN A 70 0.503 -17.338 8.685 1.00 12.02 H new ATOM 1072 N TYR A 71 0.059 -12.983 3.622 1.00 21.34 N ATOM 1073 CA TYR A 71 -0.035 -11.553 3.897 1.00 13.42 C ATOM 1074 C TYR A 71 -1.477 -11.074 3.821 1.00 24.31 C ATOM 1075 O TYR A 71 -1.874 -10.155 4.537 1.00 1.22 O ATOM 1076 CB TYR A 71 0.862 -10.781 2.931 1.00 33.34 C ATOM 1077 CG TYR A 71 2.316 -11.083 3.182 1.00 73.13 C ATOM 1078 CD1 TYR A 71 2.854 -10.900 4.442 1.00 53.10 C ATOM 1079 CD2 TYR A 71 3.137 -11.590 2.188 1.00 25.22 C ATOM 1080 CE1 TYR A 71 4.169 -11.209 4.711 1.00 22.30 C ATOM 1081 CE2 TYR A 71 4.457 -11.899 2.447 1.00 71.34 C ATOM 1082 CZ TYR A 71 4.969 -11.708 3.710 1.00 63.32 C ATOM 1083 OH TYR A 71 6.285 -12.015 3.970 1.00 33.14 O ATOM 0 H TYR A 71 0.685 -13.223 2.853 1.00 21.34 H new ATOM 0 HA TYR A 71 0.311 -11.366 4.914 1.00 13.42 H new ATOM 0 HB2 TYR A 71 0.605 -11.042 1.904 1.00 33.34 H new ATOM 0 HB3 TYR A 71 0.685 -9.711 3.042 1.00 33.34 H new ATOM 0 HD1 TYR A 71 2.231 -10.507 5.231 1.00 53.10 H new ATOM 0 HD2 TYR A 71 2.739 -11.746 1.196 1.00 25.22 H new ATOM 0 HE1 TYR A 71 4.570 -11.060 5.703 1.00 22.30 H new ATOM 0 HE2 TYR A 71 5.086 -12.290 1.661 1.00 71.34 H new ATOM 0 HH TYR A 71 6.571 -12.749 3.387 1.00 33.14 H new ATOM 1093 N MET A 72 -2.265 -11.719 2.972 1.00 5.32 N ATOM 1094 CA MET A 72 -3.671 -11.372 2.834 1.00 24.14 C ATOM 1095 C MET A 72 -4.449 -11.874 4.046 1.00 31.55 C ATOM 1096 O MET A 72 -5.349 -11.201 4.548 1.00 30.44 O ATOM 1097 CB MET A 72 -4.244 -11.971 1.548 1.00 4.31 C ATOM 1098 CG MET A 72 -3.364 -11.742 0.328 1.00 73.35 C ATOM 1099 SD MET A 72 -4.279 -11.096 -1.085 1.00 21.23 S ATOM 1100 CE MET A 72 -2.987 -10.198 -1.940 1.00 53.12 C ATOM 0 H MET A 72 -1.955 -12.483 2.371 1.00 5.32 H new ATOM 0 HA MET A 72 -3.764 -10.287 2.779 1.00 24.14 H new ATOM 0 HB2 MET A 72 -4.386 -13.043 1.688 1.00 4.31 H new ATOM 0 HB3 MET A 72 -5.228 -11.540 1.363 1.00 4.31 H new ATOM 0 HG2 MET A 72 -2.566 -11.046 0.587 1.00 73.35 H new ATOM 0 HG3 MET A 72 -2.888 -12.682 0.048 1.00 73.35 H new ATOM 0 HE1 MET A 72 -3.423 -9.624 -2.758 1.00 53.12 H new ATOM 0 HE2 MET A 72 -2.493 -9.520 -1.244 1.00 53.12 H new ATOM 0 HE3 MET A 72 -2.257 -10.902 -2.339 1.00 53.12 H new ATOM 1110 N ARG A 73 -4.081 -13.065 4.514 1.00 2.15 N ATOM 1111 CA ARG A 73 -4.726 -13.674 5.672 1.00 63.32 C ATOM 1112 C ARG A 73 -4.161 -13.114 6.979 1.00 22.31 C ATOM 1113 O ARG A 73 -4.807 -13.192 8.024 1.00 50.33 O ATOM 1114 CB ARG A 73 -4.547 -15.191 5.635 1.00 1.55 C ATOM 1115 CG ARG A 73 -5.122 -15.834 4.386 1.00 72.14 C ATOM 1116 CD ARG A 73 -4.921 -17.338 4.393 1.00 22.01 C ATOM 1117 NE ARG A 73 -3.557 -17.711 4.757 1.00 23.12 N ATOM 1118 CZ ARG A 73 -3.207 -18.927 5.170 1.00 32.40 C ATOM 1119 NH1 ARG A 73 -4.117 -19.887 5.276 1.00 62.21 N ATOM 1120 NH2 ARG A 73 -1.943 -19.184 5.478 1.00 53.23 N ATOM 0 H ARG A 73 -3.335 -13.629 4.106 1.00 2.15 H new ATOM 0 HA ARG A 73 -5.789 -13.434 5.631 1.00 63.32 H new ATOM 0 HB2 ARG A 73 -3.485 -15.426 5.700 1.00 1.55 H new ATOM 0 HB3 ARG A 73 -5.024 -15.628 6.512 1.00 1.55 H new ATOM 0 HG2 ARG A 73 -6.186 -15.608 4.316 1.00 72.14 H new ATOM 0 HG3 ARG A 73 -4.647 -15.406 3.503 1.00 72.14 H new ATOM 0 HD2 ARG A 73 -5.620 -17.793 5.095 1.00 22.01 H new ATOM 0 HD3 ARG A 73 -5.154 -17.739 3.406 1.00 22.01 H new ATOM 0 HE ARG A 73 -2.830 -16.998 4.691 1.00 23.12 H new ATOM 0 HH11 ARG A 73 -5.091 -19.695 5.040 1.00 62.21 H new ATOM 0 HH12 ARG A 73 -3.843 -20.817 5.593 1.00 62.21 H new ATOM 0 HH21 ARG A 73 -1.239 -18.450 5.398 1.00 53.23 H new ATOM 0 HH22 ARG A 73 -1.675 -20.116 5.795 1.00 53.23 H new ATOM 1134 N THR A 74 -2.957 -12.547 6.913 1.00 54.22 N ATOM 1135 CA THR A 74 -2.314 -11.972 8.090 1.00 33.11 C ATOM 1136 C THR A 74 -2.522 -10.459 8.135 1.00 11.53 C ATOM 1137 O THR A 74 -2.033 -9.784 9.042 1.00 11.14 O ATOM 1138 CB THR A 74 -0.810 -12.273 8.090 1.00 42.12 C ATOM 1139 OG1 THR A 74 -0.182 -11.682 6.969 1.00 33.42 O ATOM 1140 CG2 THR A 74 -0.477 -13.752 8.074 1.00 23.51 C ATOM 0 H THR A 74 -2.409 -12.474 6.056 1.00 54.22 H new ATOM 0 HA THR A 74 -2.771 -12.425 8.970 1.00 33.11 H new ATOM 0 HB THR A 74 -0.441 -11.852 9.025 1.00 42.12 H new ATOM 0 HG1 THR A 74 0.116 -10.777 7.200 1.00 33.42 H new ATOM 0 HG21 THR A 74 0.605 -13.881 8.075 1.00 23.51 H new ATOM 0 HG22 THR A 74 -0.900 -14.230 8.957 1.00 23.51 H new ATOM 0 HG23 THR A 74 -0.896 -14.210 7.178 1.00 23.51 H new ATOM 1148 N GLY A 75 -3.235 -9.929 7.142 1.00 51.04 N ATOM 1149 CA GLY A 75 -3.473 -8.502 7.083 1.00 34.41 C ATOM 1150 C GLY A 75 -4.933 -8.131 7.245 1.00 1.31 C ATOM 1151 O GLY A 75 -5.824 -8.892 6.867 1.00 12.31 O ATOM 0 H GLY A 75 -3.650 -10.465 6.380 1.00 51.04 H new ATOM 0 HA2 GLY A 75 -2.892 -8.011 7.864 1.00 34.41 H new ATOM 0 HA3 GLY A 75 -3.112 -8.120 6.128 1.00 34.41 H new ATOM 1155 N GLU A 76 -5.174 -6.949 7.802 1.00 20.50 N ATOM 1156 CA GLU A 76 -6.531 -6.459 8.010 1.00 1.43 C ATOM 1157 C GLU A 76 -6.965 -5.573 6.846 1.00 74.22 C ATOM 1158 O GLU A 76 -8.157 -5.348 6.635 1.00 34.10 O ATOM 1159 CB GLU A 76 -6.618 -5.676 9.322 1.00 62.21 C ATOM 1160 CG GLU A 76 -6.205 -6.483 10.543 1.00 14.14 C ATOM 1161 CD GLU A 76 -7.206 -6.376 11.677 1.00 33.54 C ATOM 1162 OE1 GLU A 76 -7.526 -5.239 12.081 1.00 75.12 O ATOM 1163 OE2 GLU A 76 -7.670 -7.431 12.160 1.00 43.15 O ATOM 0 H GLU A 76 -4.444 -6.311 8.118 1.00 20.50 H new ATOM 0 HA GLU A 76 -7.200 -7.317 8.065 1.00 1.43 H new ATOM 0 HB2 GLU A 76 -5.984 -4.792 9.250 1.00 62.21 H new ATOM 0 HB3 GLU A 76 -7.641 -5.325 9.458 1.00 62.21 H new ATOM 0 HG2 GLU A 76 -6.091 -7.530 10.261 1.00 14.14 H new ATOM 0 HG3 GLU A 76 -5.231 -6.139 10.889 1.00 14.14 H new ATOM 1170 N GLY A 77 -5.986 -5.076 6.093 1.00 22.42 N ATOM 1171 CA GLY A 77 -6.277 -4.222 4.959 1.00 11.31 C ATOM 1172 C GLY A 77 -5.274 -4.397 3.835 1.00 32.11 C ATOM 1173 O GLY A 77 -4.326 -5.172 3.957 1.00 34.13 O ATOM 0 H GLY A 77 -4.994 -5.252 6.251 1.00 22.42 H new ATOM 0 HA2 GLY A 77 -7.278 -4.443 4.588 1.00 11.31 H new ATOM 0 HA3 GLY A 77 -6.280 -3.181 5.282 1.00 11.31 H new ATOM 1177 N PHE A 78 -5.482 -3.678 2.737 1.00 3.14 N ATOM 1178 CA PHE A 78 -4.586 -3.765 1.591 1.00 53.13 C ATOM 1179 C PHE A 78 -4.408 -2.403 0.930 1.00 61.33 C ATOM 1180 O PHE A 78 -5.379 -1.688 0.686 1.00 34.41 O ATOM 1181 CB PHE A 78 -5.125 -4.773 0.575 1.00 5.05 C ATOM 1182 CG PHE A 78 -5.285 -6.157 1.136 1.00 74.24 C ATOM 1183 CD1 PHE A 78 -6.352 -6.463 1.964 1.00 13.24 C ATOM 1184 CD2 PHE A 78 -4.366 -7.150 0.838 1.00 3.03 C ATOM 1185 CE1 PHE A 78 -6.501 -7.734 2.485 1.00 33.42 C ATOM 1186 CE2 PHE A 78 -4.509 -8.423 1.356 1.00 41.33 C ATOM 1187 CZ PHE A 78 -5.578 -8.715 2.180 1.00 62.45 C ATOM 0 H PHE A 78 -6.261 -3.031 2.617 1.00 3.14 H new ATOM 0 HA PHE A 78 -3.613 -4.102 1.948 1.00 53.13 H new ATOM 0 HB2 PHE A 78 -6.090 -4.425 0.205 1.00 5.05 H new ATOM 0 HB3 PHE A 78 -4.451 -4.811 -0.281 1.00 5.05 H new ATOM 0 HD1 PHE A 78 -7.076 -5.699 2.205 1.00 13.24 H new ATOM 0 HD2 PHE A 78 -3.529 -6.927 0.194 1.00 3.03 H new ATOM 0 HE1 PHE A 78 -7.338 -7.960 3.130 1.00 33.42 H new ATOM 0 HE2 PHE A 78 -3.786 -9.189 1.117 1.00 41.33 H new ATOM 0 HZ PHE A 78 -5.692 -9.709 2.585 1.00 62.45 H new ATOM 1197 N LEU A 79 -3.159 -2.052 0.641 1.00 62.14 N ATOM 1198 CA LEU A 79 -2.851 -0.777 0.004 1.00 13.51 C ATOM 1199 C LEU A 79 -2.243 -0.996 -1.378 1.00 62.21 C ATOM 1200 O LEU A 79 -1.231 -1.682 -1.520 1.00 51.22 O ATOM 1201 CB LEU A 79 -1.889 0.037 0.875 1.00 34.13 C ATOM 1202 CG LEU A 79 -2.324 1.480 1.142 1.00 32.45 C ATOM 1203 CD1 LEU A 79 -3.094 1.572 2.450 1.00 24.33 C ATOM 1204 CD2 LEU A 79 -1.116 2.405 1.167 1.00 25.02 C ATOM 0 H LEU A 79 -2.344 -2.633 0.838 1.00 62.14 H new ATOM 0 HA LEU A 79 -3.782 -0.221 -0.110 1.00 13.51 H new ATOM 0 HB2 LEU A 79 -1.768 -0.473 1.831 1.00 34.13 H new ATOM 0 HB3 LEU A 79 -0.911 0.051 0.395 1.00 34.13 H new ATOM 0 HG LEU A 79 -2.983 1.796 0.333 1.00 32.45 H new ATOM 0 HD11 LEU A 79 -3.395 2.605 2.623 1.00 24.33 H new ATOM 0 HD12 LEU A 79 -3.980 0.940 2.396 1.00 24.33 H new ATOM 0 HD13 LEU A 79 -2.459 1.237 3.270 1.00 24.33 H new ATOM 0 HD21 LEU A 79 -1.444 3.427 1.358 1.00 25.02 H new ATOM 0 HD22 LEU A 79 -0.433 2.090 1.956 1.00 25.02 H new ATOM 0 HD23 LEU A 79 -0.605 2.362 0.205 1.00 25.02 H new ATOM 1216 N CYS A 80 -2.867 -0.409 -2.394 1.00 23.44 N ATOM 1217 CA CYS A 80 -2.386 -0.541 -3.765 1.00 71.55 C ATOM 1218 C CYS A 80 -1.531 0.658 -4.160 1.00 34.51 C ATOM 1219 O CYS A 80 -2.015 1.789 -4.213 1.00 61.34 O ATOM 1220 CB CYS A 80 -3.564 -0.683 -4.731 1.00 10.01 C ATOM 1221 SG CYS A 80 -4.439 -2.260 -4.601 1.00 50.21 S ATOM 0 H CYS A 80 -3.706 0.162 -2.294 1.00 23.44 H new ATOM 0 HA CYS A 80 -1.769 -1.438 -3.821 1.00 71.55 H new ATOM 0 HB2 CYS A 80 -4.269 0.128 -4.549 1.00 10.01 H new ATOM 0 HB3 CYS A 80 -3.200 -0.565 -5.751 1.00 10.01 H new ATOM 0 HG CYS A 80 -5.365 -2.319 -5.512 1.00 50.21 H new ATOM 1227 N VAL A 81 -0.256 0.404 -4.437 1.00 43.24 N ATOM 1228 CA VAL A 81 0.668 1.462 -4.827 1.00 64.44 C ATOM 1229 C VAL A 81 1.028 1.362 -6.306 1.00 21.55 C ATOM 1230 O VAL A 81 1.624 0.379 -6.746 1.00 31.25 O ATOM 1231 CB VAL A 81 1.962 1.413 -3.990 1.00 74.40 C ATOM 1232 CG1 VAL A 81 2.888 2.562 -4.362 1.00 43.30 C ATOM 1233 CG2 VAL A 81 1.638 1.443 -2.504 1.00 12.32 C ATOM 0 H VAL A 81 0.161 -0.526 -4.398 1.00 43.24 H new ATOM 0 HA VAL A 81 0.160 2.409 -4.644 1.00 64.44 H new ATOM 0 HB VAL A 81 2.477 0.478 -4.210 1.00 74.40 H new ATOM 0 HG11 VAL A 81 3.795 2.508 -3.759 1.00 43.30 H new ATOM 0 HG12 VAL A 81 3.149 2.492 -5.418 1.00 43.30 H new ATOM 0 HG13 VAL A 81 2.384 3.510 -4.175 1.00 43.30 H new ATOM 0 HG21 VAL A 81 2.563 1.408 -1.929 1.00 12.32 H new ATOM 0 HG22 VAL A 81 1.099 2.360 -2.268 1.00 12.32 H new ATOM 0 HG23 VAL A 81 1.019 0.583 -2.249 1.00 12.32 H new ATOM 1243 N PHE A 82 0.667 2.389 -7.067 1.00 63.05 N ATOM 1244 CA PHE A 82 0.957 2.421 -8.494 1.00 25.24 C ATOM 1245 C PHE A 82 1.527 3.779 -8.895 1.00 63.24 C ATOM 1246 O PHE A 82 1.090 4.817 -8.398 1.00 42.10 O ATOM 1247 CB PHE A 82 -0.309 2.103 -9.305 1.00 73.35 C ATOM 1248 CG PHE A 82 -1.106 3.314 -9.710 1.00 21.33 C ATOM 1249 CD1 PHE A 82 -1.652 4.154 -8.752 1.00 62.13 C ATOM 1250 CD2 PHE A 82 -1.305 3.612 -11.049 1.00 50.42 C ATOM 1251 CE1 PHE A 82 -2.380 5.268 -9.122 1.00 12.32 C ATOM 1252 CE2 PHE A 82 -2.033 4.725 -11.425 1.00 34.34 C ATOM 1253 CZ PHE A 82 -2.572 5.554 -10.460 1.00 13.50 C ATOM 0 H PHE A 82 0.173 3.210 -6.719 1.00 63.05 H new ATOM 0 HA PHE A 82 1.706 1.659 -8.712 1.00 25.24 H new ATOM 0 HB2 PHE A 82 -0.023 1.554 -10.202 1.00 73.35 H new ATOM 0 HB3 PHE A 82 -0.947 1.443 -8.717 1.00 73.35 H new ATOM 0 HD1 PHE A 82 -1.507 3.935 -7.704 1.00 62.13 H new ATOM 0 HD2 PHE A 82 -0.886 2.967 -11.807 1.00 50.42 H new ATOM 0 HE1 PHE A 82 -2.799 5.915 -8.366 1.00 12.32 H new ATOM 0 HE2 PHE A 82 -2.180 4.946 -12.472 1.00 34.34 H new ATOM 0 HZ PHE A 82 -3.142 6.424 -10.751 1.00 13.50 H new ATOM 1263 N ALA A 83 2.504 3.764 -9.795 1.00 5.33 N ATOM 1264 CA ALA A 83 3.131 4.996 -10.257 1.00 32.32 C ATOM 1265 C ALA A 83 2.353 5.606 -11.417 1.00 70.22 C ATOM 1266 O ALA A 83 2.136 4.958 -12.442 1.00 23.14 O ATOM 1267 CB ALA A 83 4.573 4.732 -10.667 1.00 65.02 C ATOM 0 H ALA A 83 2.878 2.915 -10.218 1.00 5.33 H new ATOM 0 HA ALA A 83 3.123 5.710 -9.433 1.00 32.32 H new ATOM 0 HB1 ALA A 83 5.030 5.660 -11.010 1.00 65.02 H new ATOM 0 HB2 ALA A 83 5.130 4.348 -9.812 1.00 65.02 H new ATOM 0 HB3 ALA A 83 4.594 3.998 -11.473 1.00 65.02 H new ATOM 1273 N ILE A 84 1.938 6.857 -11.251 1.00 73.43 N ATOM 1274 CA ILE A 84 1.187 7.556 -12.287 1.00 74.30 C ATOM 1275 C ILE A 84 1.988 7.642 -13.583 1.00 61.33 C ATOM 1276 O ILE A 84 1.424 7.830 -14.661 1.00 23.43 O ATOM 1277 CB ILE A 84 0.800 8.978 -11.839 1.00 10.42 C ATOM 1278 CG1 ILE A 84 2.015 9.705 -11.262 1.00 53.42 C ATOM 1279 CG2 ILE A 84 -0.326 8.923 -10.818 1.00 52.44 C ATOM 1280 CD1 ILE A 84 1.999 11.199 -11.505 1.00 12.55 C ATOM 0 H ILE A 84 2.109 7.407 -10.409 1.00 73.43 H new ATOM 0 HA ILE A 84 0.278 6.980 -12.462 1.00 74.30 H new ATOM 0 HB ILE A 84 0.449 9.533 -12.709 1.00 10.42 H new ATOM 0 HG12 ILE A 84 2.063 9.520 -10.189 1.00 53.42 H new ATOM 0 HG13 ILE A 84 2.921 9.284 -11.698 1.00 53.42 H new ATOM 0 HG21 ILE A 84 -0.588 9.935 -10.511 1.00 52.44 H new ATOM 0 HG22 ILE A 84 -1.197 8.441 -11.262 1.00 52.44 H new ATOM 0 HG23 ILE A 84 -0.001 8.353 -9.948 1.00 52.44 H new ATOM 0 HD11 ILE A 84 2.891 11.648 -11.068 1.00 12.55 H new ATOM 0 HD12 ILE A 84 1.983 11.393 -12.577 1.00 12.55 H new ATOM 0 HD13 ILE A 84 1.111 11.633 -11.045 1.00 12.55 H new ATOM 1292 N ASN A 85 3.307 7.504 -13.472 1.00 22.45 N ATOM 1293 CA ASN A 85 4.184 7.565 -14.637 1.00 62.10 C ATOM 1294 C ASN A 85 4.138 6.254 -15.414 1.00 74.32 C ATOM 1295 O ASN A 85 4.228 6.244 -16.642 1.00 31.13 O ATOM 1296 CB ASN A 85 5.625 7.867 -14.213 1.00 32.11 C ATOM 1297 CG ASN A 85 5.705 8.752 -12.982 1.00 0.12 C ATOM 1298 OD1 ASN A 85 6.221 8.343 -11.942 1.00 13.44 O ATOM 1299 ND2 ASN A 85 5.188 9.970 -13.093 1.00 31.41 N ATOM 0 H ASN A 85 3.791 7.349 -12.588 1.00 22.45 H new ATOM 0 HA ASN A 85 3.831 8.369 -15.282 1.00 62.10 H new ATOM 0 HB2 ASN A 85 6.144 6.929 -14.015 1.00 32.11 H new ATOM 0 HB3 ASN A 85 6.147 8.352 -15.038 1.00 32.11 H new ATOM 0 HD21 ASN A 85 5.209 10.607 -12.297 1.00 31.41 H new ATOM 0 HD22 ASN A 85 4.770 10.268 -13.974 1.00 31.41 H new ATOM 1306 N ASN A 86 3.997 5.149 -14.689 1.00 53.15 N ATOM 1307 CA ASN A 86 3.939 3.830 -15.308 1.00 74.22 C ATOM 1308 C ASN A 86 2.496 3.352 -15.433 1.00 41.25 C ATOM 1309 O ASN A 86 1.822 3.112 -14.431 1.00 22.52 O ATOM 1310 CB ASN A 86 4.753 2.824 -14.492 1.00 5.31 C ATOM 1311 CG ASN A 86 5.593 1.914 -15.367 1.00 24.12 C ATOM 1312 OD1 ASN A 86 6.342 2.378 -16.226 1.00 73.20 O ATOM 1313 ND2 ASN A 86 5.471 0.609 -15.153 1.00 75.30 N ATOM 0 H ASN A 86 3.921 5.141 -13.672 1.00 53.15 H new ATOM 0 HA ASN A 86 4.366 3.906 -16.308 1.00 74.22 H new ATOM 0 HB2 ASN A 86 5.403 3.362 -13.802 1.00 5.31 H new ATOM 0 HB3 ASN A 86 4.077 2.219 -13.887 1.00 5.31 H new ATOM 0 HD21 ASN A 86 6.011 -0.052 -15.712 1.00 75.30 H new ATOM 0 HD22 ASN A 86 4.838 0.268 -14.430 1.00 75.30 H new ATOM 1320 N THR A 87 2.027 3.216 -16.669 1.00 52.21 N ATOM 1321 CA THR A 87 0.663 2.766 -16.921 1.00 70.51 C ATOM 1322 C THR A 87 0.511 1.281 -16.609 1.00 4.41 C ATOM 1323 O THR A 87 -0.575 0.820 -16.255 1.00 1.52 O ATOM 1324 CB THR A 87 0.272 3.034 -18.374 1.00 32.35 C ATOM 1325 OG1 THR A 87 0.562 4.373 -18.733 1.00 23.54 O ATOM 1326 CG2 THR A 87 -1.196 2.791 -18.651 1.00 33.02 C ATOM 0 H THR A 87 2.570 3.411 -17.510 1.00 52.21 H new ATOM 0 HA THR A 87 -0.001 3.327 -16.264 1.00 70.51 H new ATOM 0 HB THR A 87 0.859 2.332 -18.966 1.00 32.35 H new ATOM 0 HG1 THR A 87 0.306 4.524 -19.667 1.00 23.54 H new ATOM 0 HG21 THR A 87 -1.408 2.999 -19.700 1.00 33.02 H new ATOM 0 HG22 THR A 87 -1.441 1.752 -18.431 1.00 33.02 H new ATOM 0 HG23 THR A 87 -1.798 3.447 -18.022 1.00 33.02 H new ATOM 1334 N LYS A 88 1.604 0.535 -16.740 1.00 74.24 N ATOM 1335 CA LYS A 88 1.590 -0.893 -16.471 1.00 4.31 C ATOM 1336 C LYS A 88 1.209 -1.161 -15.016 1.00 54.33 C ATOM 1337 O LYS A 88 0.469 -2.099 -14.721 1.00 52.22 O ATOM 1338 CB LYS A 88 2.963 -1.494 -16.787 1.00 63.14 C ATOM 1339 CG LYS A 88 3.178 -2.875 -16.196 1.00 25.11 C ATOM 1340 CD LYS A 88 3.823 -3.821 -17.195 1.00 64.34 C ATOM 1341 CE LYS A 88 5.268 -3.438 -17.471 1.00 22.20 C ATOM 1342 NZ LYS A 88 5.943 -4.424 -18.360 1.00 43.54 N ATOM 0 H LYS A 88 2.511 0.900 -17.032 1.00 74.24 H new ATOM 0 HA LYS A 88 0.843 -1.365 -17.109 1.00 4.31 H new ATOM 0 HB2 LYS A 88 3.085 -1.549 -17.869 1.00 63.14 H new ATOM 0 HB3 LYS A 88 3.737 -0.824 -16.413 1.00 63.14 H new ATOM 0 HG2 LYS A 88 3.808 -2.797 -15.310 1.00 25.11 H new ATOM 0 HG3 LYS A 88 2.221 -3.285 -15.872 1.00 25.11 H new ATOM 0 HD2 LYS A 88 3.783 -4.840 -16.811 1.00 64.34 H new ATOM 0 HD3 LYS A 88 3.258 -3.809 -18.127 1.00 64.34 H new ATOM 0 HE2 LYS A 88 5.300 -2.451 -17.933 1.00 22.20 H new ATOM 0 HE3 LYS A 88 5.811 -3.367 -16.529 1.00 22.20 H new ATOM 0 HZ1 LYS A 88 6.926 -4.127 -18.524 1.00 43.54 H new ATOM 0 HZ2 LYS A 88 5.935 -5.361 -17.909 1.00 43.54 H new ATOM 0 HZ3 LYS A 88 5.440 -4.473 -19.269 1.00 43.54 H new ATOM 1356 N SER A 89 1.717 -0.328 -14.114 1.00 60.01 N ATOM 1357 CA SER A 89 1.426 -0.473 -12.693 1.00 40.43 C ATOM 1358 C SER A 89 -0.062 -0.279 -12.425 1.00 32.25 C ATOM 1359 O SER A 89 -0.623 -0.881 -11.510 1.00 1.32 O ATOM 1360 CB SER A 89 2.239 0.534 -11.877 1.00 72.01 C ATOM 1361 OG SER A 89 3.610 0.488 -12.230 1.00 3.14 O ATOM 0 H SER A 89 2.332 0.454 -14.342 1.00 60.01 H new ATOM 0 HA SER A 89 1.706 -1.482 -12.390 1.00 40.43 H new ATOM 0 HB2 SER A 89 1.851 1.539 -12.043 1.00 72.01 H new ATOM 0 HB3 SER A 89 2.127 0.321 -10.814 1.00 72.01 H new ATOM 0 HG SER A 89 4.079 1.243 -11.818 1.00 3.14 H new ATOM 1367 N PHE A 90 -0.697 0.565 -13.233 1.00 61.25 N ATOM 1368 CA PHE A 90 -2.122 0.839 -13.086 1.00 24.30 C ATOM 1369 C PHE A 90 -2.942 -0.426 -13.317 1.00 42.40 C ATOM 1370 O PHE A 90 -3.886 -0.709 -12.579 1.00 0.02 O ATOM 1371 CB PHE A 90 -2.556 1.928 -14.068 1.00 44.42 C ATOM 1372 CG PHE A 90 -3.999 2.322 -13.928 1.00 22.12 C ATOM 1373 CD1 PHE A 90 -4.557 2.525 -12.676 1.00 65.55 C ATOM 1374 CD2 PHE A 90 -4.797 2.488 -15.049 1.00 42.41 C ATOM 1375 CE1 PHE A 90 -5.884 2.887 -12.544 1.00 14.51 C ATOM 1376 CE2 PHE A 90 -6.125 2.850 -14.923 1.00 32.43 C ATOM 1377 CZ PHE A 90 -6.669 3.050 -13.669 1.00 42.44 C ATOM 0 H PHE A 90 -0.247 1.071 -13.996 1.00 61.25 H new ATOM 0 HA PHE A 90 -2.299 1.186 -12.068 1.00 24.30 H new ATOM 0 HB2 PHE A 90 -1.931 2.809 -13.920 1.00 44.42 H new ATOM 0 HB3 PHE A 90 -2.380 1.579 -15.086 1.00 44.42 H new ATOM 0 HD1 PHE A 90 -3.948 2.399 -11.793 1.00 65.55 H new ATOM 0 HD2 PHE A 90 -4.377 2.333 -16.032 1.00 42.41 H new ATOM 0 HE1 PHE A 90 -6.307 3.042 -11.562 1.00 14.51 H new ATOM 0 HE2 PHE A 90 -6.737 2.976 -15.804 1.00 32.43 H new ATOM 0 HZ PHE A 90 -7.706 3.333 -13.568 1.00 42.44 H new ATOM 1387 N GLU A 91 -2.574 -1.182 -14.346 1.00 5.13 N ATOM 1388 CA GLU A 91 -3.273 -2.419 -14.676 1.00 32.20 C ATOM 1389 C GLU A 91 -3.065 -3.470 -13.588 1.00 50.35 C ATOM 1390 O GLU A 91 -3.907 -4.345 -13.390 1.00 3.20 O ATOM 1391 CB GLU A 91 -2.789 -2.958 -16.023 1.00 12.50 C ATOM 1392 CG GLU A 91 -2.702 -1.896 -17.107 1.00 34.30 C ATOM 1393 CD GLU A 91 -2.970 -2.454 -18.491 1.00 11.22 C ATOM 1394 OE1 GLU A 91 -4.151 -2.505 -18.893 1.00 14.51 O ATOM 1395 OE2 GLU A 91 -1.998 -2.841 -19.174 1.00 22.41 O ATOM 0 H GLU A 91 -1.795 -0.960 -14.966 1.00 5.13 H new ATOM 0 HA GLU A 91 -4.338 -2.199 -14.742 1.00 32.20 H new ATOM 0 HB2 GLU A 91 -1.807 -3.412 -15.892 1.00 12.50 H new ATOM 0 HB3 GLU A 91 -3.464 -3.748 -16.353 1.00 12.50 H new ATOM 0 HG2 GLU A 91 -3.420 -1.104 -16.893 1.00 34.30 H new ATOM 0 HG3 GLU A 91 -1.711 -1.442 -17.088 1.00 34.30 H new ATOM 1402 N ASP A 92 -1.939 -3.377 -12.886 1.00 75.21 N ATOM 1403 CA ASP A 92 -1.624 -4.321 -11.819 1.00 62.31 C ATOM 1404 C ASP A 92 -2.557 -4.128 -10.628 1.00 25.25 C ATOM 1405 O ASP A 92 -2.927 -5.089 -9.953 1.00 13.24 O ATOM 1406 CB ASP A 92 -0.167 -4.155 -11.380 1.00 71.22 C ATOM 1407 CG ASP A 92 0.653 -5.410 -11.606 1.00 0.13 C ATOM 1408 OD1 ASP A 92 0.131 -6.515 -11.349 1.00 13.12 O ATOM 1409 OD2 ASP A 92 1.818 -5.288 -12.041 1.00 52.53 O ATOM 0 H ASP A 92 -1.231 -2.659 -13.037 1.00 75.21 H new ATOM 0 HA ASP A 92 -1.766 -5.331 -12.204 1.00 62.31 H new ATOM 0 HB2 ASP A 92 0.283 -3.327 -11.929 1.00 71.22 H new ATOM 0 HB3 ASP A 92 -0.137 -3.891 -10.323 1.00 71.22 H new ATOM 1414 N ILE A 93 -2.938 -2.880 -10.376 1.00 13.14 N ATOM 1415 CA ILE A 93 -3.832 -2.566 -9.268 1.00 20.43 C ATOM 1416 C ILE A 93 -5.174 -3.274 -9.435 1.00 44.24 C ATOM 1417 O ILE A 93 -5.872 -3.540 -8.457 1.00 64.40 O ATOM 1418 CB ILE A 93 -4.070 -1.045 -9.149 1.00 12.21 C ATOM 1419 CG1 ILE A 93 -2.747 -0.302 -8.991 1.00 30.24 C ATOM 1420 CG2 ILE A 93 -4.979 -0.730 -7.977 1.00 54.31 C ATOM 1421 CD1 ILE A 93 -1.862 -0.857 -7.895 1.00 64.12 C ATOM 0 H ILE A 93 -2.642 -2.071 -10.923 1.00 13.14 H new ATOM 0 HA ILE A 93 -3.349 -2.918 -8.357 1.00 20.43 H new ATOM 0 HB ILE A 93 -4.554 -0.712 -10.067 1.00 12.21 H new ATOM 0 HG12 ILE A 93 -2.205 -0.339 -9.936 1.00 30.24 H new ATOM 0 HG13 ILE A 93 -2.953 0.748 -8.782 1.00 30.24 H new ATOM 0 HG21 ILE A 93 -5.131 0.347 -7.914 1.00 54.31 H new ATOM 0 HG22 ILE A 93 -5.940 -1.225 -8.118 1.00 54.31 H new ATOM 0 HG23 ILE A 93 -4.520 -1.086 -7.055 1.00 54.31 H new ATOM 0 HD11 ILE A 93 -0.940 -0.277 -7.843 1.00 64.12 H new ATOM 0 HD12 ILE A 93 -2.384 -0.795 -6.940 1.00 64.12 H new ATOM 0 HD13 ILE A 93 -1.624 -1.898 -8.112 1.00 64.12 H new ATOM 1433 N HIS A 94 -5.527 -3.576 -10.681 1.00 2.21 N ATOM 1434 CA HIS A 94 -6.784 -4.254 -10.977 1.00 54.30 C ATOM 1435 C HIS A 94 -6.681 -5.746 -10.668 1.00 12.22 C ATOM 1436 O HIS A 94 -7.481 -6.289 -9.906 1.00 23.15 O ATOM 1437 CB HIS A 94 -7.161 -4.044 -12.448 1.00 34.30 C ATOM 1438 CG HIS A 94 -8.294 -4.907 -12.914 1.00 23.02 C ATOM 1439 ND1 HIS A 94 -9.618 -4.612 -12.667 1.00 42.40 N ATOM 1440 CD2 HIS A 94 -8.293 -6.066 -13.615 1.00 70.11 C ATOM 1441 CE1 HIS A 94 -10.382 -5.552 -13.194 1.00 52.41 C ATOM 1442 NE2 HIS A 94 -9.602 -6.445 -13.775 1.00 63.21 N ATOM 0 H HIS A 94 -4.960 -3.362 -11.501 1.00 2.21 H new ATOM 0 HA HIS A 94 -7.563 -3.826 -10.345 1.00 54.30 H new ATOM 0 HB2 HIS A 94 -7.428 -2.998 -12.599 1.00 34.30 H new ATOM 0 HB3 HIS A 94 -6.287 -4.242 -13.069 1.00 34.30 H new ATOM 0 HD1 HIS A 94 -9.955 -3.795 -12.157 1.00 42.40 H new ATOM 0 HD2 HIS A 94 -7.424 -6.593 -13.980 1.00 70.11 H new ATOM 0 HE1 HIS A 94 -11.461 -5.585 -13.156 1.00 52.41 H new ATOM 1451 N GLN A 95 -5.693 -6.404 -11.266 1.00 73.34 N ATOM 1452 CA GLN A 95 -5.489 -7.833 -11.056 1.00 71.41 C ATOM 1453 C GLN A 95 -5.062 -8.120 -9.620 1.00 63.34 C ATOM 1454 O GLN A 95 -5.328 -9.198 -9.089 1.00 64.51 O ATOM 1455 CB GLN A 95 -4.440 -8.370 -12.033 1.00 11.24 C ATOM 1456 CG GLN A 95 -3.143 -7.579 -12.029 1.00 52.43 C ATOM 1457 CD GLN A 95 -1.918 -8.467 -11.918 1.00 11.22 C ATOM 1458 OE1 GLN A 95 -1.429 -8.997 -12.915 1.00 32.32 O ATOM 1459 NE2 GLN A 95 -1.417 -8.633 -10.699 1.00 63.45 N ATOM 0 H GLN A 95 -5.021 -5.971 -11.900 1.00 73.34 H new ATOM 0 HA GLN A 95 -6.437 -8.339 -11.239 1.00 71.41 H new ATOM 0 HB2 GLN A 95 -4.223 -9.409 -11.785 1.00 11.24 H new ATOM 0 HB3 GLN A 95 -4.857 -8.363 -13.040 1.00 11.24 H new ATOM 0 HG2 GLN A 95 -3.078 -6.990 -12.944 1.00 52.43 H new ATOM 0 HG3 GLN A 95 -3.154 -6.875 -11.197 1.00 52.43 H new ATOM 0 HE21 GLN A 95 -1.855 -8.174 -9.901 1.00 63.45 H new ATOM 0 HE22 GLN A 95 -0.594 -9.220 -10.561 1.00 63.45 H new ATOM 1468 N TYR A 96 -4.400 -7.151 -8.996 1.00 21.22 N ATOM 1469 CA TYR A 96 -3.939 -7.306 -7.621 1.00 21.22 C ATOM 1470 C TYR A 96 -5.118 -7.437 -6.662 1.00 3.23 C ATOM 1471 O TYR A 96 -5.068 -8.207 -5.703 1.00 3.33 O ATOM 1472 CB TYR A 96 -3.062 -6.120 -7.217 1.00 44.33 C ATOM 1473 CG TYR A 96 -1.594 -6.326 -7.517 1.00 43.34 C ATOM 1474 CD1 TYR A 96 -0.948 -7.500 -7.147 1.00 23.42 C ATOM 1475 CD2 TYR A 96 -0.855 -5.350 -8.173 1.00 63.11 C ATOM 1476 CE1 TYR A 96 0.392 -7.694 -7.422 1.00 52.31 C ATOM 1477 CE2 TYR A 96 0.486 -5.538 -8.453 1.00 51.42 C ATOM 1478 CZ TYR A 96 1.104 -6.711 -8.075 1.00 73.21 C ATOM 1479 OH TYR A 96 2.438 -6.902 -8.351 1.00 11.44 O ATOM 0 H TYR A 96 -4.171 -6.252 -9.420 1.00 21.22 H new ATOM 0 HA TYR A 96 -3.347 -8.220 -7.564 1.00 21.22 H new ATOM 0 HB2 TYR A 96 -3.409 -5.227 -7.737 1.00 44.33 H new ATOM 0 HB3 TYR A 96 -3.184 -5.935 -6.150 1.00 44.33 H new ATOM 0 HD1 TYR A 96 -1.503 -8.273 -6.636 1.00 23.42 H new ATOM 0 HD2 TYR A 96 -1.336 -4.429 -8.469 1.00 63.11 H new ATOM 0 HE1 TYR A 96 0.879 -8.612 -7.127 1.00 52.31 H new ATOM 0 HE2 TYR A 96 1.046 -4.770 -8.965 1.00 51.42 H new ATOM 0 HH TYR A 96 2.972 -6.661 -7.566 1.00 11.44 H new ATOM 1489 N ARG A 97 -6.180 -6.682 -6.929 1.00 2.11 N ATOM 1490 CA ARG A 97 -7.373 -6.719 -6.090 1.00 22.44 C ATOM 1491 C ARG A 97 -8.037 -8.092 -6.157 1.00 1.42 C ATOM 1492 O ARG A 97 -8.601 -8.568 -5.172 1.00 15.32 O ATOM 1493 CB ARG A 97 -8.362 -5.630 -6.523 1.00 53.15 C ATOM 1494 CG ARG A 97 -9.758 -5.798 -5.938 1.00 10.42 C ATOM 1495 CD ARG A 97 -10.323 -4.478 -5.437 1.00 74.34 C ATOM 1496 NE ARG A 97 -11.739 -4.332 -5.770 1.00 14.32 N ATOM 1497 CZ ARG A 97 -12.602 -3.607 -5.060 1.00 43.13 C ATOM 1498 NH1 ARG A 97 -12.199 -2.948 -3.980 1.00 74.03 N ATOM 1499 NH2 ARG A 97 -13.872 -3.539 -5.433 1.00 44.21 N ATOM 0 H ARG A 97 -6.239 -6.038 -7.718 1.00 2.11 H new ATOM 0 HA ARG A 97 -7.073 -6.532 -5.059 1.00 22.44 H new ATOM 0 HB2 ARG A 97 -7.969 -4.657 -6.227 1.00 53.15 H new ATOM 0 HB3 ARG A 97 -8.432 -5.628 -7.611 1.00 53.15 H new ATOM 0 HG2 ARG A 97 -10.422 -6.213 -6.696 1.00 10.42 H new ATOM 0 HG3 ARG A 97 -9.724 -6.514 -5.117 1.00 10.42 H new ATOM 0 HD2 ARG A 97 -10.195 -4.415 -4.356 1.00 74.34 H new ATOM 0 HD3 ARG A 97 -9.760 -3.653 -5.873 1.00 74.34 H new ATOM 0 HE ARG A 97 -12.088 -4.815 -6.598 1.00 14.32 H new ATOM 0 HH11 ARG A 97 -11.223 -2.995 -3.689 1.00 74.03 H new ATOM 0 HH12 ARG A 97 -12.866 -2.395 -3.442 1.00 74.03 H new ATOM 0 HH21 ARG A 97 -14.187 -4.041 -6.263 1.00 44.21 H new ATOM 0 HH22 ARG A 97 -14.534 -2.984 -4.890 1.00 44.21 H new ATOM 1513 N GLU A 98 -7.968 -8.722 -7.326 1.00 34.43 N ATOM 1514 CA GLU A 98 -8.565 -10.038 -7.523 1.00 20.13 C ATOM 1515 C GLU A 98 -8.008 -11.046 -6.522 1.00 20.02 C ATOM 1516 O GLU A 98 -8.703 -11.975 -6.109 1.00 3.21 O ATOM 1517 CB GLU A 98 -8.313 -10.528 -8.950 1.00 32.12 C ATOM 1518 CG GLU A 98 -9.155 -9.814 -9.995 1.00 24.12 C ATOM 1519 CD GLU A 98 -10.482 -10.503 -10.244 1.00 13.24 C ATOM 1520 OE1 GLU A 98 -11.402 -10.336 -9.415 1.00 40.22 O ATOM 1521 OE2 GLU A 98 -10.602 -11.209 -11.267 1.00 11.30 O ATOM 0 H GLU A 98 -7.504 -8.342 -8.151 1.00 34.43 H new ATOM 0 HA GLU A 98 -9.639 -9.948 -7.361 1.00 20.13 H new ATOM 0 HB2 GLU A 98 -7.259 -10.393 -9.191 1.00 32.12 H new ATOM 0 HB3 GLU A 98 -8.517 -11.598 -9.000 1.00 32.12 H new ATOM 0 HG2 GLU A 98 -9.337 -8.789 -9.671 1.00 24.12 H new ATOM 0 HG3 GLU A 98 -8.597 -9.759 -10.930 1.00 24.12 H new ATOM 1528 N GLN A 99 -6.751 -10.856 -6.134 1.00 1.32 N ATOM 1529 CA GLN A 99 -6.103 -11.749 -5.180 1.00 14.41 C ATOM 1530 C GLN A 99 -6.703 -11.582 -3.787 1.00 74.12 C ATOM 1531 O GLN A 99 -6.891 -12.557 -3.060 1.00 23.11 O ATOM 1532 CB GLN A 99 -4.596 -11.479 -5.140 1.00 5.04 C ATOM 1533 CG GLN A 99 -3.762 -12.605 -5.728 1.00 63.03 C ATOM 1534 CD GLN A 99 -3.256 -13.568 -4.672 1.00 25.02 C ATOM 1535 OE1 GLN A 99 -4.039 -14.261 -4.022 1.00 43.31 O ATOM 1536 NE2 GLN A 99 -1.941 -13.616 -4.496 1.00 42.14 N ATOM 0 H GLN A 99 -6.161 -10.092 -6.465 1.00 1.32 H new ATOM 0 HA GLN A 99 -6.270 -12.776 -5.506 1.00 14.41 H new ATOM 0 HB2 GLN A 99 -4.385 -10.559 -5.685 1.00 5.04 H new ATOM 0 HB3 GLN A 99 -4.292 -11.314 -4.106 1.00 5.04 H new ATOM 0 HG2 GLN A 99 -4.359 -13.152 -6.457 1.00 63.03 H new ATOM 0 HG3 GLN A 99 -2.913 -12.181 -6.265 1.00 63.03 H new ATOM 0 HE21 GLN A 99 -1.329 -13.023 -5.057 1.00 42.14 H new ATOM 0 HE22 GLN A 99 -1.542 -14.245 -3.799 1.00 42.14 H new ATOM 1545 N ILE A 100 -7.001 -10.339 -3.422 1.00 41.11 N ATOM 1546 CA ILE A 100 -7.580 -10.044 -2.117 1.00 23.22 C ATOM 1547 C ILE A 100 -9.016 -10.552 -2.027 1.00 23.24 C ATOM 1548 O ILE A 100 -9.404 -11.173 -1.038 1.00 21.32 O ATOM 1549 CB ILE A 100 -7.560 -8.531 -1.822 1.00 24.32 C ATOM 1550 CG1 ILE A 100 -6.146 -7.975 -2.003 1.00 32.13 C ATOM 1551 CG2 ILE A 100 -8.067 -8.256 -0.414 1.00 43.13 C ATOM 1552 CD1 ILE A 100 -6.092 -6.463 -2.041 1.00 70.12 C ATOM 0 H ILE A 100 -6.851 -9.520 -4.012 1.00 41.11 H new ATOM 0 HA ILE A 100 -6.969 -10.558 -1.375 1.00 23.22 H new ATOM 0 HB ILE A 100 -8.222 -8.030 -2.528 1.00 24.32 H new ATOM 0 HG12 ILE A 100 -5.516 -8.333 -1.188 1.00 32.13 H new ATOM 0 HG13 ILE A 100 -5.725 -8.369 -2.928 1.00 32.13 H new ATOM 0 HG21 ILE A 100 -8.046 -7.183 -0.223 1.00 43.13 H new ATOM 0 HG22 ILE A 100 -9.089 -8.622 -0.317 1.00 43.13 H new ATOM 0 HG23 ILE A 100 -7.429 -8.766 0.308 1.00 43.13 H new ATOM 0 HD11 ILE A 100 -5.059 -6.139 -2.171 1.00 70.12 H new ATOM 0 HD12 ILE A 100 -6.695 -6.098 -2.873 1.00 70.12 H new ATOM 0 HD13 ILE A 100 -6.483 -6.061 -1.106 1.00 70.12 H new ATOM 1564 N LYS A 101 -9.800 -10.284 -3.067 1.00 44.13 N ATOM 1565 CA LYS A 101 -11.193 -10.715 -3.106 1.00 15.14 C ATOM 1566 C LYS A 101 -11.304 -12.222 -2.892 1.00 12.24 C ATOM 1567 O LYS A 101 -12.316 -12.716 -2.396 1.00 31.30 O ATOM 1568 CB LYS A 101 -11.830 -10.328 -4.443 1.00 22.02 C ATOM 1569 CG LYS A 101 -12.350 -8.900 -4.478 1.00 74.44 C ATOM 1570 CD LYS A 101 -13.135 -8.621 -5.750 1.00 65.42 C ATOM 1571 CE LYS A 101 -12.324 -7.797 -6.737 1.00 14.43 C ATOM 1572 NZ LYS A 101 -12.657 -8.134 -8.148 1.00 43.15 N ATOM 0 H LYS A 101 -9.494 -9.771 -3.894 1.00 44.13 H new ATOM 0 HA LYS A 101 -11.726 -10.213 -2.298 1.00 15.14 H new ATOM 0 HB2 LYS A 101 -11.095 -10.458 -5.237 1.00 22.02 H new ATOM 0 HB3 LYS A 101 -12.653 -11.011 -4.655 1.00 22.02 H new ATOM 0 HG2 LYS A 101 -12.986 -8.723 -3.611 1.00 74.44 H new ATOM 0 HG3 LYS A 101 -11.513 -8.206 -4.407 1.00 74.44 H new ATOM 0 HD2 LYS A 101 -13.425 -9.564 -6.214 1.00 65.42 H new ATOM 0 HD3 LYS A 101 -14.055 -8.091 -5.502 1.00 65.42 H new ATOM 0 HE2 LYS A 101 -12.510 -6.737 -6.564 1.00 14.43 H new ATOM 0 HE3 LYS A 101 -11.261 -7.967 -6.564 1.00 14.43 H new ATOM 0 HZ1 LYS A 101 -12.439 -7.322 -8.760 1.00 43.15 H new ATOM 0 HZ2 LYS A 101 -12.096 -8.956 -8.450 1.00 43.15 H new ATOM 0 HZ3 LYS A 101 -13.669 -8.360 -8.221 1.00 43.15 H new ATOM 1586 N ARG A 102 -10.253 -12.946 -3.268 1.00 73.42 N ATOM 1587 CA ARG A 102 -10.230 -14.396 -3.114 1.00 5.10 C ATOM 1588 C ARG A 102 -10.015 -14.785 -1.654 1.00 71.43 C ATOM 1589 O ARG A 102 -10.833 -15.489 -1.062 1.00 72.01 O ATOM 1590 CB ARG A 102 -9.128 -15.004 -3.985 1.00 3.05 C ATOM 1591 CG ARG A 102 -9.085 -16.522 -3.940 1.00 13.42 C ATOM 1592 CD ARG A 102 -8.388 -17.096 -5.162 1.00 14.23 C ATOM 1593 NE ARG A 102 -8.284 -18.552 -5.098 1.00 24.03 N ATOM 1594 CZ ARG A 102 -9.316 -19.377 -5.260 1.00 44.30 C ATOM 1595 NH1 ARG A 102 -10.530 -18.894 -5.495 1.00 21.14 N ATOM 1596 NH2 ARG A 102 -9.135 -20.689 -5.187 1.00 71.13 N ATOM 0 H ARG A 102 -9.408 -12.552 -3.681 1.00 73.42 H new ATOM 0 HA ARG A 102 -11.195 -14.787 -3.436 1.00 5.10 H new ATOM 0 HB2 ARG A 102 -9.273 -14.683 -5.017 1.00 3.05 H new ATOM 0 HB3 ARG A 102 -8.164 -14.612 -3.662 1.00 3.05 H new ATOM 0 HG2 ARG A 102 -8.566 -16.846 -3.038 1.00 13.42 H new ATOM 0 HG3 ARG A 102 -10.100 -16.914 -3.881 1.00 13.42 H new ATOM 0 HD2 ARG A 102 -8.936 -16.811 -6.060 1.00 14.23 H new ATOM 0 HD3 ARG A 102 -7.391 -16.664 -5.247 1.00 14.23 H new ATOM 0 HE ARG A 102 -7.367 -18.960 -4.919 1.00 24.03 H new ATOM 0 HH11 ARG A 102 -10.676 -17.886 -5.552 1.00 21.14 H new ATOM 0 HH12 ARG A 102 -11.317 -19.531 -5.618 1.00 21.14 H new ATOM 0 HH21 ARG A 102 -8.205 -21.066 -5.007 1.00 71.13 H new ATOM 0 HH22 ARG A 102 -9.926 -21.321 -5.311 1.00 71.13 H new ATOM 1610 N VAL A 103 -8.909 -14.320 -1.078 1.00 75.24 N ATOM 1611 CA VAL A 103 -8.589 -14.618 0.312 1.00 15.42 C ATOM 1612 C VAL A 103 -9.664 -14.076 1.248 1.00 64.31 C ATOM 1613 O VAL A 103 -10.215 -14.810 2.069 1.00 0.40 O ATOM 1614 CB VAL A 103 -7.225 -14.025 0.715 1.00 51.14 C ATOM 1615 CG1 VAL A 103 -6.841 -14.476 2.115 1.00 22.54 C ATOM 1616 CG2 VAL A 103 -6.151 -14.416 -0.290 1.00 65.42 C ATOM 0 H VAL A 103 -8.221 -13.736 -1.553 1.00 75.24 H new ATOM 0 HA VAL A 103 -8.544 -15.703 0.402 1.00 15.42 H new ATOM 0 HB VAL A 103 -7.310 -12.938 0.716 1.00 51.14 H new ATOM 0 HG11 VAL A 103 -5.875 -14.048 2.383 1.00 22.54 H new ATOM 0 HG12 VAL A 103 -7.596 -14.140 2.825 1.00 22.54 H new ATOM 0 HG13 VAL A 103 -6.776 -15.564 2.142 1.00 22.54 H new ATOM 0 HG21 VAL A 103 -5.196 -13.987 0.013 1.00 65.42 H new ATOM 0 HG22 VAL A 103 -6.066 -15.502 -0.327 1.00 65.42 H new ATOM 0 HG23 VAL A 103 -6.421 -14.039 -1.276 1.00 65.42 H new ATOM 1626 N LYS A 104 -9.957 -12.786 1.119 1.00 21.24 N ATOM 1627 CA LYS A 104 -10.966 -12.143 1.953 1.00 73.34 C ATOM 1628 C LYS A 104 -12.350 -12.727 1.684 1.00 44.21 C ATOM 1629 O LYS A 104 -13.213 -12.731 2.562 1.00 63.14 O ATOM 1630 CB LYS A 104 -10.982 -10.634 1.699 1.00 5.22 C ATOM 1631 CG LYS A 104 -9.643 -9.960 1.946 1.00 44.41 C ATOM 1632 CD LYS A 104 -9.281 -9.964 3.423 1.00 73.10 C ATOM 1633 CE LYS A 104 -9.782 -8.711 4.125 1.00 52.21 C ATOM 1634 NZ LYS A 104 -10.773 -9.031 5.190 1.00 24.24 N ATOM 0 H LYS A 104 -9.510 -12.165 0.445 1.00 21.24 H new ATOM 0 HA LYS A 104 -10.709 -12.328 2.996 1.00 73.34 H new ATOM 0 HB2 LYS A 104 -11.287 -10.451 0.669 1.00 5.22 H new ATOM 0 HB3 LYS A 104 -11.734 -10.174 2.340 1.00 5.22 H new ATOM 0 HG2 LYS A 104 -8.866 -10.473 1.379 1.00 44.41 H new ATOM 0 HG3 LYS A 104 -9.679 -8.933 1.582 1.00 44.41 H new ATOM 0 HD2 LYS A 104 -9.709 -10.845 3.901 1.00 73.10 H new ATOM 0 HD3 LYS A 104 -8.199 -10.036 3.533 1.00 73.10 H new ATOM 0 HE2 LYS A 104 -8.938 -8.178 4.563 1.00 52.21 H new ATOM 0 HE3 LYS A 104 -10.237 -8.043 3.394 1.00 52.21 H new ATOM 0 HZ1 LYS A 104 -11.090 -8.151 5.645 1.00 24.24 H new ATOM 0 HZ2 LYS A 104 -11.590 -9.517 4.769 1.00 24.24 H new ATOM 0 HZ3 LYS A 104 -10.331 -9.648 5.901 1.00 24.24 H new ATOM 1648 N ASP A 105 -12.556 -13.221 0.466 1.00 53.13 N ATOM 1649 CA ASP A 105 -13.836 -13.807 0.084 1.00 43.10 C ATOM 1650 C ASP A 105 -14.949 -12.763 0.127 1.00 32.24 C ATOM 1651 O ASP A 105 -16.023 -13.007 0.677 1.00 72.43 O ATOM 1652 CB ASP A 105 -14.180 -14.979 1.006 1.00 2.34 C ATOM 1653 CG ASP A 105 -15.394 -15.754 0.530 1.00 33.53 C ATOM 1654 OD1 ASP A 105 -15.250 -16.568 -0.406 1.00 53.43 O ATOM 1655 OD2 ASP A 105 -16.489 -15.547 1.095 1.00 62.15 O ATOM 0 H ASP A 105 -11.853 -13.227 -0.273 1.00 53.13 H new ATOM 0 HA ASP A 105 -13.749 -14.173 -0.939 1.00 43.10 H new ATOM 0 HB2 ASP A 105 -13.325 -15.652 1.068 1.00 2.34 H new ATOM 0 HB3 ASP A 105 -14.364 -14.604 2.013 1.00 2.34 H new ATOM 1660 N SER A 106 -14.682 -11.600 -0.457 1.00 42.14 N ATOM 1661 CA SER A 106 -15.660 -10.517 -0.487 1.00 33.40 C ATOM 1662 C SER A 106 -15.168 -9.363 -1.355 1.00 64.21 C ATOM 1663 O SER A 106 -13.983 -9.031 -1.350 1.00 5.15 O ATOM 1664 CB SER A 106 -15.942 -10.019 0.932 1.00 73.43 C ATOM 1665 OG SER A 106 -17.062 -10.681 1.492 1.00 35.34 O ATOM 0 H SER A 106 -13.797 -11.382 -0.916 1.00 42.14 H new ATOM 0 HA SER A 106 -16.582 -10.905 -0.919 1.00 33.40 H new ATOM 0 HB2 SER A 106 -15.066 -10.185 1.560 1.00 73.43 H new ATOM 0 HB3 SER A 106 -16.122 -8.944 0.914 1.00 73.43 H new ATOM 0 HG SER A 106 -16.978 -11.646 1.346 1.00 35.34 H new ATOM 1671 N ASP A 107 -16.086 -8.756 -2.100 1.00 42.33 N ATOM 1672 CA ASP A 107 -15.746 -7.640 -2.974 1.00 73.15 C ATOM 1673 C ASP A 107 -15.512 -6.367 -2.166 1.00 13.34 C ATOM 1674 O ASP A 107 -14.651 -5.554 -2.504 1.00 12.33 O ATOM 1675 CB ASP A 107 -16.858 -7.409 -3.999 1.00 21.21 C ATOM 1676 CG ASP A 107 -18.178 -7.044 -3.350 1.00 54.41 C ATOM 1677 OD1 ASP A 107 -18.772 -7.915 -2.680 1.00 25.25 O ATOM 1678 OD2 ASP A 107 -18.618 -5.886 -3.510 1.00 30.33 O ATOM 0 H ASP A 107 -17.071 -9.019 -2.116 1.00 42.33 H new ATOM 0 HA ASP A 107 -14.824 -7.891 -3.499 1.00 73.15 H new ATOM 0 HB2 ASP A 107 -16.560 -6.613 -4.681 1.00 21.21 H new ATOM 0 HB3 ASP A 107 -16.988 -8.310 -4.598 1.00 21.21 H new ATOM 1683 N ASP A 108 -16.284 -6.200 -1.097 1.00 62.43 N ATOM 1684 CA ASP A 108 -16.161 -5.025 -0.241 1.00 30.03 C ATOM 1685 C ASP A 108 -15.165 -5.275 0.886 1.00 32.15 C ATOM 1686 O ASP A 108 -15.546 -5.666 1.990 1.00 41.24 O ATOM 1687 CB ASP A 108 -17.524 -4.648 0.342 1.00 50.12 C ATOM 1688 CG ASP A 108 -18.615 -4.614 -0.710 1.00 35.24 C ATOM 1689 OD1 ASP A 108 -18.496 -3.815 -1.663 1.00 63.43 O ATOM 1690 OD2 ASP A 108 -19.589 -5.386 -0.582 1.00 1.43 O ATOM 0 H ASP A 108 -17.001 -6.863 -0.803 1.00 62.43 H new ATOM 0 HA ASP A 108 -15.793 -4.199 -0.850 1.00 30.03 H new ATOM 0 HB2 ASP A 108 -17.794 -5.364 1.118 1.00 50.12 H new ATOM 0 HB3 ASP A 108 -17.454 -3.671 0.820 1.00 50.12 H new ATOM 1695 N VAL A 109 -13.887 -5.046 0.602 1.00 12.33 N ATOM 1696 CA VAL A 109 -12.837 -5.246 1.593 1.00 43.12 C ATOM 1697 C VAL A 109 -12.109 -3.938 1.895 1.00 61.30 C ATOM 1698 O VAL A 109 -12.055 -3.040 1.054 1.00 14.43 O ATOM 1699 CB VAL A 109 -11.814 -6.300 1.124 1.00 14.11 C ATOM 1700 CG1 VAL A 109 -12.502 -7.629 0.852 1.00 5.25 C ATOM 1701 CG2 VAL A 109 -11.070 -5.816 -0.112 1.00 0.35 C ATOM 0 H VAL A 109 -13.554 -4.722 -0.306 1.00 12.33 H new ATOM 0 HA VAL A 109 -13.322 -5.604 2.501 1.00 43.12 H new ATOM 0 HB VAL A 109 -11.086 -6.449 1.922 1.00 14.11 H new ATOM 0 HG11 VAL A 109 -11.764 -8.360 0.522 1.00 5.25 H new ATOM 0 HG12 VAL A 109 -12.982 -7.984 1.764 1.00 5.25 H new ATOM 0 HG13 VAL A 109 -13.254 -7.497 0.074 1.00 5.25 H new ATOM 0 HG21 VAL A 109 -10.353 -6.575 -0.426 1.00 0.35 H new ATOM 0 HG22 VAL A 109 -11.782 -5.634 -0.917 1.00 0.35 H new ATOM 0 HG23 VAL A 109 -10.541 -4.892 0.120 1.00 0.35 H new ATOM 1711 N PRO A 110 -11.537 -3.814 3.104 1.00 33.33 N ATOM 1712 CA PRO A 110 -10.810 -2.608 3.514 1.00 4.44 C ATOM 1713 C PRO A 110 -9.476 -2.461 2.791 1.00 10.41 C ATOM 1714 O PRO A 110 -8.533 -3.209 3.048 1.00 51.32 O ATOM 1715 CB PRO A 110 -10.586 -2.822 5.012 1.00 50.15 C ATOM 1716 CG PRO A 110 -10.590 -4.301 5.187 1.00 24.32 C ATOM 1717 CD PRO A 110 -11.555 -4.838 4.166 1.00 73.53 C ATOM 0 HA PRO A 110 -11.362 -1.699 3.277 1.00 4.44 H new ATOM 0 HB2 PRO A 110 -9.641 -2.387 5.337 1.00 50.15 H new ATOM 0 HB3 PRO A 110 -11.373 -2.351 5.601 1.00 50.15 H new ATOM 0 HG2 PRO A 110 -9.593 -4.714 5.036 1.00 24.32 H new ATOM 0 HG3 PRO A 110 -10.899 -4.573 6.196 1.00 24.32 H new ATOM 0 HD2 PRO A 110 -11.241 -5.812 3.790 1.00 73.53 H new ATOM 0 HD3 PRO A 110 -12.553 -4.965 4.585 1.00 73.53 H new ATOM 1725 N MET A 111 -9.403 -1.490 1.887 1.00 55.22 N ATOM 1726 CA MET A 111 -8.184 -1.240 1.127 1.00 34.13 C ATOM 1727 C MET A 111 -8.190 0.168 0.541 1.00 51.45 C ATOM 1728 O MET A 111 -9.205 0.863 0.581 1.00 34.32 O ATOM 1729 CB MET A 111 -8.033 -2.273 0.008 1.00 64.32 C ATOM 1730 CG MET A 111 -9.246 -2.367 -0.902 1.00 43.30 C ATOM 1731 SD MET A 111 -8.827 -2.945 -2.558 1.00 42.43 S ATOM 1732 CE MET A 111 -8.793 -4.717 -2.299 1.00 63.40 C ATOM 0 H MET A 111 -10.175 -0.862 1.663 1.00 55.22 H new ATOM 0 HA MET A 111 -7.336 -1.328 1.807 1.00 34.13 H new ATOM 0 HB2 MET A 111 -7.158 -2.021 -0.592 1.00 64.32 H new ATOM 0 HB3 MET A 111 -7.845 -3.251 0.451 1.00 64.32 H new ATOM 0 HG2 MET A 111 -9.976 -3.044 -0.459 1.00 43.30 H new ATOM 0 HG3 MET A 111 -9.720 -1.388 -0.972 1.00 43.30 H new ATOM 0 HE1 MET A 111 -8.205 -5.189 -3.086 1.00 63.40 H new ATOM 0 HE2 MET A 111 -8.344 -4.935 -1.330 1.00 63.40 H new ATOM 0 HE3 MET A 111 -9.810 -5.108 -2.323 1.00 63.40 H new ATOM 1742 N VAL A 112 -7.049 0.586 0.003 1.00 63.15 N ATOM 1743 CA VAL A 112 -6.925 1.912 -0.585 1.00 50.44 C ATOM 1744 C VAL A 112 -5.958 1.909 -1.763 1.00 25.43 C ATOM 1745 O VAL A 112 -5.003 1.133 -1.795 1.00 11.54 O ATOM 1746 CB VAL A 112 -6.439 2.935 0.455 1.00 64.14 C ATOM 1747 CG1 VAL A 112 -6.480 4.342 -0.119 1.00 45.22 C ATOM 1748 CG2 VAL A 112 -7.275 2.840 1.721 1.00 71.22 C ATOM 0 H VAL A 112 -6.198 0.025 -0.037 1.00 63.15 H new ATOM 0 HA VAL A 112 -7.917 2.196 -0.937 1.00 50.44 H new ATOM 0 HB VAL A 112 -5.405 2.706 0.711 1.00 64.14 H new ATOM 0 HG11 VAL A 112 -6.132 5.052 0.632 1.00 45.22 H new ATOM 0 HG12 VAL A 112 -5.835 4.396 -0.996 1.00 45.22 H new ATOM 0 HG13 VAL A 112 -7.502 4.588 -0.405 1.00 45.22 H new ATOM 0 HG21 VAL A 112 -6.919 3.570 2.448 1.00 71.22 H new ATOM 0 HG22 VAL A 112 -8.319 3.044 1.484 1.00 71.22 H new ATOM 0 HG23 VAL A 112 -7.187 1.838 2.141 1.00 71.22 H new ATOM 1758 N LEU A 113 -6.210 2.789 -2.726 1.00 33.41 N ATOM 1759 CA LEU A 113 -5.361 2.896 -3.904 1.00 41.42 C ATOM 1760 C LEU A 113 -4.556 4.192 -3.869 1.00 13.34 C ATOM 1761 O LEU A 113 -5.083 5.269 -4.147 1.00 73.21 O ATOM 1762 CB LEU A 113 -6.208 2.837 -5.179 1.00 24.13 C ATOM 1763 CG LEU A 113 -5.447 3.088 -6.485 1.00 20.13 C ATOM 1764 CD1 LEU A 113 -4.090 2.400 -6.461 1.00 44.52 C ATOM 1765 CD2 LEU A 113 -6.264 2.610 -7.676 1.00 5.31 C ATOM 0 H LEU A 113 -6.996 3.439 -2.713 1.00 33.41 H new ATOM 0 HA LEU A 113 -4.667 2.055 -3.904 1.00 41.42 H new ATOM 0 HB2 LEU A 113 -6.680 1.856 -5.236 1.00 24.13 H new ATOM 0 HB3 LEU A 113 -7.009 3.572 -5.098 1.00 24.13 H new ATOM 0 HG LEU A 113 -5.283 4.161 -6.583 1.00 20.13 H new ATOM 0 HD11 LEU A 113 -3.568 2.592 -7.398 1.00 44.52 H new ATOM 0 HD12 LEU A 113 -3.500 2.788 -5.631 1.00 44.52 H new ATOM 0 HD13 LEU A 113 -4.229 1.326 -6.337 1.00 44.52 H new ATOM 0 HD21 LEU A 113 -5.709 2.796 -8.596 1.00 5.31 H new ATOM 0 HD22 LEU A 113 -6.458 1.542 -7.579 1.00 5.31 H new ATOM 0 HD23 LEU A 113 -7.211 3.150 -7.708 1.00 5.31 H new ATOM 1777 N VAL A 114 -3.278 4.081 -3.521 1.00 15.21 N ATOM 1778 CA VAL A 114 -2.403 5.245 -3.445 1.00 11.24 C ATOM 1779 C VAL A 114 -1.669 5.473 -4.762 1.00 70.24 C ATOM 1780 O VAL A 114 -1.301 4.523 -5.452 1.00 63.40 O ATOM 1781 CB VAL A 114 -1.368 5.097 -2.314 1.00 21.42 C ATOM 1782 CG1 VAL A 114 -0.627 6.406 -2.094 1.00 54.12 C ATOM 1783 CG2 VAL A 114 -2.040 4.633 -1.030 1.00 73.24 C ATOM 0 H VAL A 114 -2.826 3.197 -3.287 1.00 15.21 H new ATOM 0 HA VAL A 114 -3.041 6.104 -3.236 1.00 11.24 H new ATOM 0 HB VAL A 114 -0.641 4.340 -2.609 1.00 21.42 H new ATOM 0 HG11 VAL A 114 0.100 6.282 -1.291 1.00 54.12 H new ATOM 0 HG12 VAL A 114 -0.110 6.690 -3.011 1.00 54.12 H new ATOM 0 HG13 VAL A 114 -1.339 7.186 -1.822 1.00 54.12 H new ATOM 0 HG21 VAL A 114 -1.292 4.534 -0.243 1.00 73.24 H new ATOM 0 HG22 VAL A 114 -2.791 5.363 -0.728 1.00 73.24 H new ATOM 0 HG23 VAL A 114 -2.519 3.668 -1.198 1.00 73.24 H new ATOM 1793 N GLY A 115 -1.457 6.741 -5.101 1.00 42.12 N ATOM 1794 CA GLY A 115 -0.765 7.076 -6.332 1.00 41.01 C ATOM 1795 C GLY A 115 0.570 7.748 -6.079 1.00 43.45 C ATOM 1796 O GLY A 115 0.652 8.975 -6.007 1.00 73.01 O ATOM 0 H GLY A 115 -1.753 7.543 -4.544 1.00 42.12 H new ATOM 0 HA2 GLY A 115 -0.607 6.169 -6.916 1.00 41.01 H new ATOM 0 HA3 GLY A 115 -1.393 7.735 -6.931 1.00 41.01 H new ATOM 1800 N ASN A 116 1.618 6.943 -5.941 1.00 62.41 N ATOM 1801 CA ASN A 116 2.957 7.464 -5.692 1.00 74.11 C ATOM 1802 C ASN A 116 3.476 8.238 -6.899 1.00 1.42 C ATOM 1803 O ASN A 116 2.845 8.254 -7.957 1.00 43.35 O ATOM 1804 CB ASN A 116 3.915 6.321 -5.354 1.00 54.35 C ATOM 1805 CG ASN A 116 4.967 6.724 -4.340 1.00 12.31 C ATOM 1806 OD1 ASN A 116 5.039 7.883 -3.930 1.00 4.34 O ATOM 1807 ND2 ASN A 116 5.790 5.766 -3.930 1.00 21.33 N ATOM 0 H ASN A 116 1.566 5.926 -5.997 1.00 62.41 H new ATOM 0 HA ASN A 116 2.901 8.147 -4.844 1.00 74.11 H new ATOM 0 HB2 ASN A 116 3.345 5.477 -4.965 1.00 54.35 H new ATOM 0 HB3 ASN A 116 4.406 5.981 -6.266 1.00 54.35 H new ATOM 0 HD21 ASN A 116 6.519 5.977 -3.248 1.00 21.33 H new ATOM 0 HD22 ASN A 116 5.693 4.819 -4.297 1.00 21.33 H new ATOM 1814 N LYS A 117 4.630 8.876 -6.735 1.00 13.02 N ATOM 1815 CA LYS A 117 5.237 9.651 -7.811 1.00 62.33 C ATOM 1816 C LYS A 117 4.299 10.760 -8.281 1.00 14.32 C ATOM 1817 O LYS A 117 3.884 10.789 -9.440 1.00 42.25 O ATOM 1818 CB LYS A 117 5.597 8.736 -8.983 1.00 34.15 C ATOM 1819 CG LYS A 117 6.953 8.065 -8.836 1.00 63.54 C ATOM 1820 CD LYS A 117 6.840 6.730 -8.118 1.00 13.12 C ATOM 1821 CE LYS A 117 7.953 5.780 -8.530 1.00 64.43 C ATOM 1822 NZ LYS A 117 7.977 4.552 -7.688 1.00 64.55 N ATOM 0 H LYS A 117 5.164 8.872 -5.866 1.00 13.02 H new ATOM 0 HA LYS A 117 6.147 10.112 -7.426 1.00 62.33 H new ATOM 0 HB2 LYS A 117 4.830 7.968 -9.083 1.00 34.15 H new ATOM 0 HB3 LYS A 117 5.587 9.318 -9.904 1.00 34.15 H new ATOM 0 HG2 LYS A 117 7.393 7.913 -9.821 1.00 63.54 H new ATOM 0 HG3 LYS A 117 7.626 8.720 -8.284 1.00 63.54 H new ATOM 0 HD2 LYS A 117 6.878 6.891 -7.041 1.00 13.12 H new ATOM 0 HD3 LYS A 117 5.873 6.277 -8.339 1.00 13.12 H new ATOM 0 HE2 LYS A 117 7.823 5.500 -9.575 1.00 64.43 H new ATOM 0 HE3 LYS A 117 8.913 6.291 -8.454 1.00 64.43 H new ATOM 0 HZ1 LYS A 117 8.451 3.785 -8.206 1.00 64.55 H new ATOM 0 HZ2 LYS A 117 8.494 4.745 -6.807 1.00 64.55 H new ATOM 0 HZ3 LYS A 117 7.003 4.267 -7.462 1.00 64.55 H new ATOM 1836 N CYS A 118 3.970 11.673 -7.373 1.00 75.42 N ATOM 1837 CA CYS A 118 3.083 12.786 -7.693 1.00 73.31 C ATOM 1838 C CYS A 118 3.868 14.083 -7.895 1.00 73.35 C ATOM 1839 O CYS A 118 3.285 15.130 -8.173 1.00 44.54 O ATOM 1840 CB CYS A 118 2.048 12.973 -6.583 1.00 34.10 C ATOM 1841 SG CYS A 118 0.608 13.952 -7.072 1.00 62.14 S ATOM 0 H CYS A 118 4.304 11.664 -6.409 1.00 75.42 H new ATOM 0 HA CYS A 118 2.573 12.548 -8.626 1.00 73.31 H new ATOM 0 HB2 CYS A 118 1.710 11.993 -6.247 1.00 34.10 H new ATOM 0 HB3 CYS A 118 2.528 13.454 -5.731 1.00 34.10 H new ATOM 0 HG CYS A 118 0.990 14.939 -7.827 1.00 62.14 H new ATOM 1847 N ASP A 119 5.190 14.009 -7.754 1.00 63.05 N ATOM 1848 CA ASP A 119 6.042 15.181 -7.923 1.00 43.42 C ATOM 1849 C ASP A 119 6.739 15.156 -9.281 1.00 14.03 C ATOM 1850 O ASP A 119 7.055 16.203 -9.846 1.00 3.31 O ATOM 1851 CB ASP A 119 7.081 15.245 -6.801 1.00 14.34 C ATOM 1852 CG ASP A 119 8.013 16.435 -6.939 1.00 40.53 C ATOM 1853 OD1 ASP A 119 7.511 17.568 -7.088 1.00 51.41 O ATOM 1854 OD2 ASP A 119 9.245 16.231 -6.898 1.00 35.55 O ATOM 0 H ASP A 119 5.692 13.151 -7.524 1.00 63.05 H new ATOM 0 HA ASP A 119 5.412 16.069 -7.877 1.00 43.42 H new ATOM 0 HB2 ASP A 119 6.570 15.297 -5.840 1.00 14.34 H new ATOM 0 HB3 ASP A 119 7.668 14.326 -6.801 1.00 14.34 H new ATOM 1859 N LEU A 120 6.979 13.954 -9.798 1.00 34.24 N ATOM 1860 CA LEU A 120 7.641 13.794 -11.089 1.00 72.33 C ATOM 1861 C LEU A 120 6.909 14.571 -12.180 1.00 42.23 C ATOM 1862 O LEU A 120 5.695 14.763 -12.110 1.00 51.22 O ATOM 1863 CB LEU A 120 7.719 12.314 -11.464 1.00 34.33 C ATOM 1864 CG LEU A 120 8.803 11.520 -10.733 1.00 64.43 C ATOM 1865 CD1 LEU A 120 8.848 10.087 -11.239 1.00 71.12 C ATOM 1866 CD2 LEU A 120 10.158 12.190 -10.903 1.00 62.54 C ATOM 0 H LEU A 120 6.725 13.077 -9.343 1.00 34.24 H new ATOM 0 HA LEU A 120 8.651 14.194 -11.002 1.00 72.33 H new ATOM 0 HB2 LEU A 120 6.753 11.852 -11.263 1.00 34.33 H new ATOM 0 HB3 LEU A 120 7.893 12.235 -12.537 1.00 34.33 H new ATOM 0 HG LEU A 120 8.559 11.500 -9.671 1.00 64.43 H new ATOM 0 HD11 LEU A 120 9.625 9.538 -10.707 1.00 71.12 H new ATOM 0 HD12 LEU A 120 7.883 9.610 -11.066 1.00 71.12 H new ATOM 0 HD13 LEU A 120 9.068 10.085 -12.307 1.00 71.12 H new ATOM 0 HD21 LEU A 120 10.918 11.612 -10.377 1.00 62.54 H new ATOM 0 HD22 LEU A 120 10.409 12.240 -11.963 1.00 62.54 H new ATOM 0 HD23 LEU A 120 10.119 13.199 -10.492 1.00 62.54 H new ATOM 1878 N ALA A 121 7.656 15.018 -13.184 1.00 12.22 N ATOM 1879 CA ALA A 121 7.079 15.777 -14.288 1.00 52.03 C ATOM 1880 C ALA A 121 6.793 14.879 -15.487 1.00 50.42 C ATOM 1881 O ALA A 121 6.926 15.301 -16.636 1.00 42.23 O ATOM 1882 CB ALA A 121 8.009 16.913 -14.687 1.00 3.01 C ATOM 0 H ALA A 121 8.662 14.868 -13.256 1.00 12.22 H new ATOM 0 HA ALA A 121 6.131 16.196 -13.951 1.00 52.03 H new ATOM 0 HB1 ALA A 121 7.567 17.472 -15.512 1.00 3.01 H new ATOM 0 HB2 ALA A 121 8.157 17.578 -13.836 1.00 3.01 H new ATOM 0 HB3 ALA A 121 8.970 16.504 -14.999 1.00 3.01 H new ATOM 1888 N ALA A 122 6.398 13.640 -15.213 1.00 31.13 N ATOM 1889 CA ALA A 122 6.093 12.684 -16.269 1.00 73.30 C ATOM 1890 C ALA A 122 4.914 11.797 -15.882 1.00 32.50 C ATOM 1891 O ALA A 122 5.083 10.612 -15.595 1.00 4.40 O ATOM 1892 CB ALA A 122 7.316 11.836 -16.579 1.00 53.32 C ATOM 0 H ALA A 122 6.282 13.275 -14.268 1.00 31.13 H new ATOM 0 HA ALA A 122 5.815 13.242 -17.163 1.00 73.30 H new ATOM 0 HB1 ALA A 122 7.075 11.125 -17.370 1.00 53.32 H new ATOM 0 HB2 ALA A 122 8.132 12.480 -16.906 1.00 53.32 H new ATOM 0 HB3 ALA A 122 7.619 11.293 -15.684 1.00 53.32 H new ATOM 1898 N ARG A 123 3.719 12.379 -15.874 1.00 10.14 N ATOM 1899 CA ARG A 123 2.513 11.644 -15.520 1.00 13.14 C ATOM 1900 C ARG A 123 1.814 11.116 -16.771 1.00 51.02 C ATOM 1901 O ARG A 123 1.250 11.883 -17.551 1.00 45.10 O ATOM 1902 CB ARG A 123 1.568 12.546 -14.716 1.00 30.41 C ATOM 1903 CG ARG A 123 0.135 12.041 -14.646 1.00 62.24 C ATOM 1904 CD ARG A 123 -0.741 12.715 -15.689 1.00 55.21 C ATOM 1905 NE ARG A 123 -1.654 13.687 -15.094 1.00 35.24 N ATOM 1906 CZ ARG A 123 -2.710 14.196 -15.724 1.00 33.22 C ATOM 1907 NH1 ARG A 123 -2.991 13.827 -16.968 1.00 63.42 N ATOM 1908 NH2 ARG A 123 -3.488 15.076 -15.109 1.00 25.24 N ATOM 0 H ARG A 123 3.561 13.359 -16.109 1.00 10.14 H new ATOM 0 HA ARG A 123 2.794 10.789 -14.904 1.00 13.14 H new ATOM 0 HB2 ARG A 123 1.956 12.648 -13.702 1.00 30.41 H new ATOM 0 HB3 ARG A 123 1.569 13.542 -15.159 1.00 30.41 H new ATOM 0 HG2 ARG A 123 0.120 10.962 -14.798 1.00 62.24 H new ATOM 0 HG3 ARG A 123 -0.270 12.228 -13.652 1.00 62.24 H new ATOM 0 HD2 ARG A 123 -0.110 13.214 -16.424 1.00 55.21 H new ATOM 0 HD3 ARG A 123 -1.316 11.958 -16.223 1.00 55.21 H new ATOM 0 HE ARG A 123 -1.472 13.994 -14.139 1.00 35.24 H new ATOM 0 HH11 ARG A 123 -2.396 13.150 -17.446 1.00 63.42 H new ATOM 0 HH12 ARG A 123 -3.802 14.220 -17.446 1.00 63.42 H new ATOM 0 HH21 ARG A 123 -3.277 15.363 -14.153 1.00 25.24 H new ATOM 0 HH22 ARG A 123 -4.297 15.466 -15.592 1.00 25.24 H new ATOM 1922 N THR A 124 1.854 9.800 -16.953 1.00 42.23 N ATOM 1923 CA THR A 124 1.222 9.168 -18.105 1.00 74.31 C ATOM 1924 C THR A 124 -0.260 8.930 -17.842 1.00 41.32 C ATOM 1925 O THR A 124 -1.117 9.386 -18.599 1.00 12.22 O ATOM 1926 CB THR A 124 1.914 7.844 -18.433 1.00 71.41 C ATOM 1927 OG1 THR A 124 1.764 6.923 -17.367 1.00 25.33 O ATOM 1928 CG2 THR A 124 3.394 7.993 -18.706 1.00 72.33 C ATOM 0 H THR A 124 2.317 9.151 -16.317 1.00 42.23 H new ATOM 0 HA THR A 124 1.321 9.839 -18.958 1.00 74.31 H new ATOM 0 HB THR A 124 1.429 7.482 -19.340 1.00 71.41 H new ATOM 0 HG1 THR A 124 2.562 6.357 -17.309 1.00 25.33 H new ATOM 0 HG21 THR A 124 3.822 7.016 -18.932 1.00 72.33 H new ATOM 0 HG22 THR A 124 3.542 8.659 -19.556 1.00 72.33 H new ATOM 0 HG23 THR A 124 3.886 8.411 -17.828 1.00 72.33 H new ATOM 1936 N VAL A 125 -0.555 8.217 -16.761 1.00 51.25 N ATOM 1937 CA VAL A 125 -1.931 7.920 -16.391 1.00 73.44 C ATOM 1938 C VAL A 125 -2.576 9.112 -15.693 1.00 64.20 C ATOM 1939 O VAL A 125 -2.286 9.395 -14.530 1.00 24.23 O ATOM 1940 CB VAL A 125 -2.004 6.691 -15.465 1.00 43.00 C ATOM 1941 CG1 VAL A 125 -3.449 6.324 -15.174 1.00 63.11 C ATOM 1942 CG2 VAL A 125 -1.261 5.514 -16.080 1.00 61.34 C ATOM 0 H VAL A 125 0.144 7.833 -16.125 1.00 51.25 H new ATOM 0 HA VAL A 125 -2.474 7.705 -17.311 1.00 73.44 H new ATOM 0 HB VAL A 125 -1.522 6.943 -14.521 1.00 43.00 H new ATOM 0 HG11 VAL A 125 -3.478 5.454 -14.518 1.00 63.11 H new ATOM 0 HG12 VAL A 125 -3.946 7.163 -14.686 1.00 63.11 H new ATOM 0 HG13 VAL A 125 -3.961 6.092 -16.108 1.00 63.11 H new ATOM 0 HG21 VAL A 125 -1.323 4.655 -15.412 1.00 61.34 H new ATOM 0 HG22 VAL A 125 -1.711 5.261 -17.040 1.00 61.34 H new ATOM 0 HG23 VAL A 125 -0.215 5.782 -16.230 1.00 61.34 H new ATOM 1952 N GLU A 126 -3.451 9.810 -16.410 1.00 33.31 N ATOM 1953 CA GLU A 126 -4.137 10.975 -15.859 1.00 34.35 C ATOM 1954 C GLU A 126 -4.890 10.612 -14.583 1.00 14.14 C ATOM 1955 O GLU A 126 -5.169 9.441 -14.325 1.00 75.52 O ATOM 1956 CB GLU A 126 -5.105 11.559 -16.888 1.00 43.20 C ATOM 1957 CG GLU A 126 -5.934 10.509 -17.608 1.00 0.11 C ATOM 1958 CD GLU A 126 -7.135 11.101 -18.319 1.00 31.10 C ATOM 1959 OE1 GLU A 126 -7.107 12.312 -18.625 1.00 12.05 O ATOM 1960 OE2 GLU A 126 -8.104 10.354 -18.570 1.00 35.21 O ATOM 0 H GLU A 126 -3.702 9.590 -17.374 1.00 33.31 H new ATOM 0 HA GLU A 126 -3.384 11.724 -15.614 1.00 34.35 H new ATOM 0 HB2 GLU A 126 -5.775 12.259 -16.388 1.00 43.20 H new ATOM 0 HB3 GLU A 126 -4.539 12.130 -17.624 1.00 43.20 H new ATOM 0 HG2 GLU A 126 -5.307 9.990 -18.333 1.00 0.11 H new ATOM 0 HG3 GLU A 126 -6.273 9.763 -16.889 1.00 0.11 H new ATOM 1967 N SER A 127 -5.215 11.626 -13.788 1.00 71.41 N ATOM 1968 CA SER A 127 -5.935 11.419 -12.536 1.00 61.02 C ATOM 1969 C SER A 127 -7.328 10.851 -12.793 1.00 41.33 C ATOM 1970 O SER A 127 -7.808 9.998 -12.046 1.00 33.51 O ATOM 1971 CB SER A 127 -6.043 12.734 -11.763 1.00 0.14 C ATOM 1972 OG SER A 127 -4.770 13.171 -11.317 1.00 71.12 O ATOM 0 H SER A 127 -4.991 12.601 -13.989 1.00 71.41 H new ATOM 0 HA SER A 127 -5.375 10.699 -11.940 1.00 61.02 H new ATOM 0 HB2 SER A 127 -6.490 13.498 -12.399 1.00 0.14 H new ATOM 0 HB3 SER A 127 -6.706 12.603 -10.908 1.00 0.14 H new ATOM 0 HG SER A 127 -4.867 14.014 -10.827 1.00 71.12 H new ATOM 1978 N ARG A 128 -7.972 11.330 -13.852 1.00 42.44 N ATOM 1979 CA ARG A 128 -9.311 10.871 -14.208 1.00 32.30 C ATOM 1980 C ARG A 128 -9.338 9.355 -14.392 1.00 71.24 C ATOM 1981 O ARG A 128 -10.228 8.674 -13.883 1.00 22.13 O ATOM 1982 CB ARG A 128 -9.784 11.567 -15.489 1.00 12.34 C ATOM 1983 CG ARG A 128 -11.082 11.010 -16.053 1.00 34.55 C ATOM 1984 CD ARG A 128 -12.184 10.987 -15.006 1.00 43.53 C ATOM 1985 NE ARG A 128 -13.355 10.242 -15.463 1.00 51.34 N ATOM 1986 CZ ARG A 128 -14.373 9.905 -14.674 1.00 34.21 C ATOM 1987 NH1 ARG A 128 -14.369 10.242 -13.391 1.00 22.44 N ATOM 1988 NH2 ARG A 128 -15.399 9.227 -15.171 1.00 65.51 N ATOM 0 H ARG A 128 -7.588 12.037 -14.480 1.00 42.44 H new ATOM 0 HA ARG A 128 -9.988 11.127 -13.393 1.00 32.30 H new ATOM 0 HB2 ARG A 128 -9.915 12.630 -15.286 1.00 12.34 H new ATOM 0 HB3 ARG A 128 -9.004 11.481 -16.246 1.00 12.34 H new ATOM 0 HG2 ARG A 128 -11.399 11.615 -16.902 1.00 34.55 H new ATOM 0 HG3 ARG A 128 -10.913 10.000 -16.426 1.00 34.55 H new ATOM 0 HD2 ARG A 128 -11.804 10.538 -14.088 1.00 43.53 H new ATOM 0 HD3 ARG A 128 -12.476 12.009 -14.764 1.00 43.53 H new ATOM 0 HE ARG A 128 -13.395 9.964 -16.444 1.00 51.34 H new ATOM 0 HH11 ARG A 128 -13.582 10.763 -13.003 1.00 22.44 H new ATOM 0 HH12 ARG A 128 -15.152 9.980 -12.793 1.00 22.44 H new ATOM 0 HH21 ARG A 128 -15.407 8.964 -16.157 1.00 65.51 H new ATOM 0 HH22 ARG A 128 -16.180 8.968 -14.568 1.00 65.51 H new ATOM 2002 N GLN A 129 -8.359 8.835 -15.125 1.00 3.24 N ATOM 2003 CA GLN A 129 -8.272 7.402 -15.378 1.00 24.50 C ATOM 2004 C GLN A 129 -8.075 6.629 -14.077 1.00 1.34 C ATOM 2005 O GLN A 129 -8.676 5.575 -13.873 1.00 22.43 O ATOM 2006 CB GLN A 129 -7.122 7.103 -16.341 1.00 31.23 C ATOM 2007 CG GLN A 129 -7.316 5.826 -17.142 1.00 41.32 C ATOM 2008 CD GLN A 129 -6.308 5.684 -18.265 1.00 63.20 C ATOM 2009 OE1 GLN A 129 -6.447 6.300 -19.322 1.00 53.50 O ATOM 2010 NE2 GLN A 129 -5.284 4.868 -18.042 1.00 34.32 N ATOM 0 H GLN A 129 -7.615 9.385 -15.554 1.00 3.24 H new ATOM 0 HA GLN A 129 -9.210 7.081 -15.831 1.00 24.50 H new ATOM 0 HB2 GLN A 129 -7.009 7.940 -17.030 1.00 31.23 H new ATOM 0 HB3 GLN A 129 -6.194 7.029 -15.774 1.00 31.23 H new ATOM 0 HG2 GLN A 129 -7.235 4.967 -16.475 1.00 41.32 H new ATOM 0 HG3 GLN A 129 -8.323 5.812 -17.559 1.00 41.32 H new ATOM 0 HE21 GLN A 129 -5.208 4.377 -17.151 1.00 34.32 H new ATOM 0 HE22 GLN A 129 -4.574 4.732 -18.762 1.00 34.32 H new ATOM 2019 N ALA A 130 -7.227 7.160 -13.202 1.00 72.32 N ATOM 2020 CA ALA A 130 -6.950 6.519 -11.922 1.00 30.32 C ATOM 2021 C ALA A 130 -8.178 6.540 -11.018 1.00 43.52 C ATOM 2022 O ALA A 130 -8.501 5.543 -10.370 1.00 74.04 O ATOM 2023 CB ALA A 130 -5.776 7.201 -11.235 1.00 11.14 C ATOM 0 H ALA A 130 -6.720 8.032 -13.356 1.00 72.32 H new ATOM 0 HA ALA A 130 -6.692 5.478 -12.114 1.00 30.32 H new ATOM 0 HB1 ALA A 130 -5.579 6.713 -10.280 1.00 11.14 H new ATOM 0 HB2 ALA A 130 -4.892 7.129 -11.868 1.00 11.14 H new ATOM 0 HB3 ALA A 130 -6.015 8.251 -11.063 1.00 11.14 H new ATOM 2029 N GLN A 131 -8.858 7.681 -10.977 1.00 71.53 N ATOM 2030 CA GLN A 131 -10.051 7.831 -10.152 1.00 71.33 C ATOM 2031 C GLN A 131 -11.209 7.012 -10.711 1.00 40.23 C ATOM 2032 O GLN A 131 -12.071 6.546 -9.965 1.00 61.22 O ATOM 2033 CB GLN A 131 -10.451 9.306 -10.062 1.00 44.22 C ATOM 2034 CG GLN A 131 -9.859 10.023 -8.859 1.00 43.04 C ATOM 2035 CD GLN A 131 -10.913 10.701 -8.006 1.00 12.15 C ATOM 2036 OE1 GLN A 131 -11.116 11.912 -8.095 1.00 11.14 O ATOM 2037 NE2 GLN A 131 -11.591 9.921 -7.173 1.00 24.25 N ATOM 0 H GLN A 131 -8.603 8.515 -11.506 1.00 71.53 H new ATOM 0 HA GLN A 131 -9.819 7.461 -9.153 1.00 71.33 H new ATOM 0 HB2 GLN A 131 -10.134 9.816 -10.971 1.00 44.22 H new ATOM 0 HB3 GLN A 131 -11.538 9.377 -10.019 1.00 44.22 H new ATOM 0 HG2 GLN A 131 -9.309 9.307 -8.249 1.00 43.04 H new ATOM 0 HG3 GLN A 131 -9.141 10.768 -9.202 1.00 43.04 H new ATOM 0 HE21 GLN A 131 -11.390 8.922 -7.132 1.00 24.25 H new ATOM 0 HE22 GLN A 131 -12.313 10.321 -6.574 1.00 24.25 H new ATOM 2046 N ASP A 132 -11.225 6.839 -12.029 1.00 63.22 N ATOM 2047 CA ASP A 132 -12.279 6.076 -12.687 1.00 44.11 C ATOM 2048 C ASP A 132 -12.302 4.634 -12.188 1.00 45.32 C ATOM 2049 O ASP A 132 -13.367 4.030 -12.057 1.00 0.25 O ATOM 2050 CB ASP A 132 -12.084 6.099 -14.204 1.00 12.25 C ATOM 2051 CG ASP A 132 -13.326 5.660 -14.955 1.00 23.24 C ATOM 2052 OD1 ASP A 132 -14.415 5.640 -14.344 1.00 44.24 O ATOM 2053 OD2 ASP A 132 -13.209 5.336 -16.156 1.00 65.02 O ATOM 0 H ASP A 132 -10.520 7.217 -12.662 1.00 63.22 H new ATOM 0 HA ASP A 132 -13.234 6.541 -12.443 1.00 44.11 H new ATOM 0 HB2 ASP A 132 -11.811 7.107 -14.517 1.00 12.25 H new ATOM 0 HB3 ASP A 132 -11.252 5.446 -14.470 1.00 12.25 H new ATOM 2058 N LEU A 133 -11.122 4.088 -11.912 1.00 74.52 N ATOM 2059 CA LEU A 133 -11.009 2.717 -11.429 1.00 24.03 C ATOM 2060 C LEU A 133 -11.279 2.641 -9.930 1.00 15.43 C ATOM 2061 O LEU A 133 -12.095 1.838 -9.477 1.00 44.34 O ATOM 2062 CB LEU A 133 -9.618 2.159 -11.737 1.00 64.03 C ATOM 2063 CG LEU A 133 -9.343 0.761 -11.177 1.00 1.11 C ATOM 2064 CD1 LEU A 133 -10.270 -0.261 -11.817 1.00 74.30 C ATOM 2065 CD2 LEU A 133 -7.887 0.379 -11.395 1.00 3.33 C ATOM 0 H LEU A 133 -10.231 4.574 -12.015 1.00 74.52 H new ATOM 0 HA LEU A 133 -11.758 2.115 -11.944 1.00 24.03 H new ATOM 0 HB2 LEU A 133 -9.485 2.133 -12.819 1.00 64.03 H new ATOM 0 HB3 LEU A 133 -8.871 2.846 -11.340 1.00 64.03 H new ATOM 0 HG LEU A 133 -9.537 0.772 -10.104 1.00 1.11 H new ATOM 0 HD11 LEU A 133 -10.061 -1.249 -11.407 1.00 74.30 H new ATOM 0 HD12 LEU A 133 -11.306 0.006 -11.608 1.00 74.30 H new ATOM 0 HD13 LEU A 133 -10.109 -0.274 -12.895 1.00 74.30 H new ATOM 0 HD21 LEU A 133 -7.708 -0.618 -10.991 1.00 3.33 H new ATOM 0 HD22 LEU A 133 -7.666 0.383 -12.462 1.00 3.33 H new ATOM 0 HD23 LEU A 133 -7.243 1.097 -10.888 1.00 3.33 H new ATOM 2077 N ALA A 134 -10.589 3.479 -9.163 1.00 61.04 N ATOM 2078 CA ALA A 134 -10.756 3.501 -7.715 1.00 1.32 C ATOM 2079 C ALA A 134 -12.201 3.803 -7.333 1.00 55.01 C ATOM 2080 O ALA A 134 -12.699 3.319 -6.317 1.00 24.43 O ATOM 2081 CB ALA A 134 -9.817 4.521 -7.087 1.00 2.22 C ATOM 0 H ALA A 134 -9.910 4.151 -9.520 1.00 61.04 H new ATOM 0 HA ALA A 134 -10.505 2.512 -7.332 1.00 1.32 H new ATOM 0 HB1 ALA A 134 -9.954 4.525 -6.006 1.00 2.22 H new ATOM 0 HB2 ALA A 134 -8.785 4.258 -7.321 1.00 2.22 H new ATOM 0 HB3 ALA A 134 -10.038 5.512 -7.484 1.00 2.22 H new ATOM 2087 N ARG A 135 -12.870 4.605 -8.155 1.00 54.12 N ATOM 2088 CA ARG A 135 -14.259 4.970 -7.904 1.00 21.35 C ATOM 2089 C ARG A 135 -15.176 3.764 -8.079 1.00 54.01 C ATOM 2090 O ARG A 135 -16.201 3.648 -7.408 1.00 3.42 O ATOM 2091 CB ARG A 135 -14.692 6.097 -8.845 1.00 25.04 C ATOM 2092 CG ARG A 135 -16.127 6.551 -8.628 1.00 3.24 C ATOM 2093 CD ARG A 135 -16.312 8.011 -9.005 1.00 41.10 C ATOM 2094 NE ARG A 135 -17.577 8.241 -9.698 1.00 32.52 N ATOM 2095 CZ ARG A 135 -17.819 7.851 -10.948 1.00 54.34 C ATOM 2096 NH1 ARG A 135 -16.884 7.215 -11.645 1.00 3.02 N ATOM 2097 NH2 ARG A 135 -18.998 8.098 -11.504 1.00 31.24 N ATOM 0 H ARG A 135 -12.473 5.014 -9.000 1.00 54.12 H new ATOM 0 HA ARG A 135 -14.337 5.318 -6.874 1.00 21.35 H new ATOM 0 HB2 ARG A 135 -14.025 6.949 -8.710 1.00 25.04 H new ATOM 0 HB3 ARG A 135 -14.577 5.763 -9.876 1.00 25.04 H new ATOM 0 HG2 ARG A 135 -16.799 5.933 -9.223 1.00 3.24 H new ATOM 0 HG3 ARG A 135 -16.401 6.406 -7.583 1.00 3.24 H new ATOM 0 HD2 ARG A 135 -16.275 8.625 -8.105 1.00 41.10 H new ATOM 0 HD3 ARG A 135 -15.487 8.328 -9.642 1.00 41.10 H new ATOM 0 HE ARG A 135 -18.318 8.729 -9.195 1.00 32.52 H new ATOM 0 HH11 ARG A 135 -15.975 7.023 -11.223 1.00 3.02 H new ATOM 0 HH12 ARG A 135 -17.075 6.918 -12.602 1.00 3.02 H new ATOM 0 HH21 ARG A 135 -19.719 8.587 -10.974 1.00 31.24 H new ATOM 0 HH22 ARG A 135 -19.183 7.799 -12.462 1.00 31.24 H new ATOM 2111 N SER A 136 -14.799 2.865 -8.983 1.00 2.04 N ATOM 2112 CA SER A 136 -15.587 1.666 -9.242 1.00 2.51 C ATOM 2113 C SER A 136 -15.469 0.685 -8.081 1.00 0.33 C ATOM 2114 O SER A 136 -16.450 0.061 -7.677 1.00 13.41 O ATOM 2115 CB SER A 136 -15.129 0.999 -10.540 1.00 71.45 C ATOM 2116 OG SER A 136 -15.585 -0.341 -10.616 1.00 44.23 O ATOM 0 H SER A 136 -13.953 2.944 -9.548 1.00 2.04 H new ATOM 0 HA SER A 136 -16.632 1.959 -9.345 1.00 2.51 H new ATOM 0 HB2 SER A 136 -15.505 1.563 -11.394 1.00 71.45 H new ATOM 0 HB3 SER A 136 -14.041 1.020 -10.598 1.00 71.45 H new ATOM 0 HG SER A 136 -15.280 -0.743 -11.456 1.00 44.23 H new ATOM 2122 N TYR A 137 -14.259 0.557 -7.547 1.00 15.33 N ATOM 2123 CA TYR A 137 -14.007 -0.343 -6.429 1.00 30.11 C ATOM 2124 C TYR A 137 -14.706 0.147 -5.164 1.00 4.53 C ATOM 2125 O TYR A 137 -14.966 -0.631 -4.246 1.00 42.22 O ATOM 2126 CB TYR A 137 -12.502 -0.466 -6.178 1.00 42.13 C ATOM 2127 CG TYR A 137 -11.759 -1.204 -7.269 1.00 62.33 C ATOM 2128 CD1 TYR A 137 -12.300 -2.338 -7.862 1.00 32.33 C ATOM 2129 CD2 TYR A 137 -10.515 -0.766 -7.704 1.00 70.11 C ATOM 2130 CE1 TYR A 137 -11.622 -3.014 -8.857 1.00 74.40 C ATOM 2131 CE2 TYR A 137 -9.831 -1.437 -8.699 1.00 3.04 C ATOM 2132 CZ TYR A 137 -10.388 -2.560 -9.273 1.00 13.42 C ATOM 2133 OH TYR A 137 -9.710 -3.233 -10.264 1.00 11.33 O ATOM 0 H TYR A 137 -13.437 1.066 -7.871 1.00 15.33 H new ATOM 0 HA TYR A 137 -14.409 -1.323 -6.687 1.00 30.11 H new ATOM 0 HB2 TYR A 137 -12.078 0.533 -6.074 1.00 42.13 H new ATOM 0 HB3 TYR A 137 -12.342 -0.980 -5.230 1.00 42.13 H new ATOM 0 HD1 TYR A 137 -13.266 -2.697 -7.540 1.00 32.33 H new ATOM 0 HD2 TYR A 137 -10.075 0.113 -7.257 1.00 70.11 H new ATOM 0 HE1 TYR A 137 -12.056 -3.894 -9.307 1.00 74.40 H new ATOM 0 HE2 TYR A 137 -8.864 -1.084 -9.026 1.00 3.04 H new ATOM 0 HH TYR A 137 -10.014 -4.164 -10.294 1.00 11.33 H new ATOM 2143 N GLY A 138 -15.007 1.442 -5.121 1.00 4.42 N ATOM 2144 CA GLY A 138 -15.669 2.011 -3.962 1.00 20.22 C ATOM 2145 C GLY A 138 -14.693 2.378 -2.860 1.00 72.02 C ATOM 2146 O GLY A 138 -15.089 2.562 -1.709 1.00 52.14 O ATOM 0 H GLY A 138 -14.804 2.106 -5.868 1.00 4.42 H new ATOM 0 HA2 GLY A 138 -16.223 2.900 -4.264 1.00 20.22 H new ATOM 0 HA3 GLY A 138 -16.397 1.297 -3.576 1.00 20.22 H new ATOM 2150 N ILE A 139 -13.414 2.483 -3.211 1.00 63.13 N ATOM 2151 CA ILE A 139 -12.382 2.828 -2.241 1.00 63.43 C ATOM 2152 C ILE A 139 -11.823 4.225 -2.494 1.00 12.23 C ATOM 2153 O ILE A 139 -11.905 4.743 -3.608 1.00 33.23 O ATOM 2154 CB ILE A 139 -11.229 1.818 -2.259 1.00 33.00 C ATOM 2155 CG1 ILE A 139 -10.865 1.449 -3.692 1.00 64.42 C ATOM 2156 CG2 ILE A 139 -11.603 0.577 -1.464 1.00 45.31 C ATOM 2157 CD1 ILE A 139 -9.661 0.551 -3.772 1.00 14.21 C ATOM 0 H ILE A 139 -13.069 2.334 -4.159 1.00 63.13 H new ATOM 0 HA ILE A 139 -12.859 2.805 -1.261 1.00 63.43 H new ATOM 0 HB ILE A 139 -10.357 2.277 -1.793 1.00 33.00 H new ATOM 0 HG12 ILE A 139 -11.714 0.954 -4.162 1.00 64.42 H new ATOM 0 HG13 ILE A 139 -10.673 2.359 -4.260 1.00 64.42 H new ATOM 0 HG21 ILE A 139 -10.775 -0.132 -1.485 1.00 45.31 H new ATOM 0 HG22 ILE A 139 -11.815 0.856 -0.432 1.00 45.31 H new ATOM 0 HG23 ILE A 139 -12.487 0.116 -1.904 1.00 45.31 H new ATOM 0 HD11 ILE A 139 -9.448 0.321 -4.816 1.00 14.21 H new ATOM 0 HD12 ILE A 139 -8.802 1.054 -3.328 1.00 14.21 H new ATOM 0 HD13 ILE A 139 -9.860 -0.373 -3.230 1.00 14.21 H new ATOM 2169 N PRO A 140 -11.244 4.855 -1.458 1.00 23.21 N ATOM 2170 CA PRO A 140 -10.668 6.198 -1.572 1.00 52.55 C ATOM 2171 C PRO A 140 -9.386 6.208 -2.399 1.00 3.31 C ATOM 2172 O PRO A 140 -8.663 5.213 -2.453 1.00 54.01 O ATOM 2173 CB PRO A 140 -10.372 6.583 -0.122 1.00 32.15 C ATOM 2174 CG PRO A 140 -10.187 5.285 0.585 1.00 54.02 C ATOM 2175 CD PRO A 140 -11.106 4.307 -0.095 1.00 3.43 C ATOM 0 HA PRO A 140 -11.341 6.889 -2.080 1.00 52.55 H new ATOM 0 HB2 PRO A 140 -9.478 7.203 -0.052 1.00 32.15 H new ATOM 0 HB3 PRO A 140 -11.192 7.156 0.311 1.00 32.15 H new ATOM 0 HG2 PRO A 140 -9.151 4.953 0.525 1.00 54.02 H new ATOM 0 HG3 PRO A 140 -10.431 5.379 1.643 1.00 54.02 H new ATOM 0 HD2 PRO A 140 -10.684 3.302 -0.107 1.00 3.43 H new ATOM 0 HD3 PRO A 140 -12.069 4.243 0.411 1.00 3.43 H new ATOM 2183 N TYR A 141 -9.113 7.338 -3.043 1.00 50.32 N ATOM 2184 CA TYR A 141 -7.919 7.479 -3.869 1.00 42.22 C ATOM 2185 C TYR A 141 -7.070 8.659 -3.400 1.00 55.32 C ATOM 2186 O TYR A 141 -7.515 9.806 -3.424 1.00 63.01 O ATOM 2187 CB TYR A 141 -8.312 7.659 -5.340 1.00 3.20 C ATOM 2188 CG TYR A 141 -7.159 8.048 -6.239 1.00 42.30 C ATOM 2189 CD1 TYR A 141 -6.072 7.202 -6.412 1.00 65.51 C ATOM 2190 CD2 TYR A 141 -7.159 9.264 -6.912 1.00 71.23 C ATOM 2191 CE1 TYR A 141 -5.017 7.555 -7.231 1.00 41.11 C ATOM 2192 CE2 TYR A 141 -6.107 9.624 -7.732 1.00 52.32 C ATOM 2193 CZ TYR A 141 -5.039 8.767 -7.888 1.00 61.31 C ATOM 2194 OH TYR A 141 -3.989 9.123 -8.704 1.00 61.10 O ATOM 0 H TYR A 141 -9.703 8.170 -3.009 1.00 50.32 H new ATOM 0 HA TYR A 141 -7.325 6.571 -3.770 1.00 42.22 H new ATOM 0 HB2 TYR A 141 -8.748 6.729 -5.706 1.00 3.20 H new ATOM 0 HB3 TYR A 141 -9.087 8.423 -5.408 1.00 3.20 H new ATOM 0 HD1 TYR A 141 -6.051 6.252 -5.898 1.00 65.51 H new ATOM 0 HD2 TYR A 141 -7.994 9.938 -6.792 1.00 71.23 H new ATOM 0 HE1 TYR A 141 -4.179 6.885 -7.356 1.00 41.11 H new ATOM 0 HE2 TYR A 141 -6.121 10.572 -8.248 1.00 52.32 H new ATOM 0 HH TYR A 141 -4.161 10.006 -9.092 1.00 61.10 H new ATOM 2204 N ILE A 142 -5.844 8.367 -2.975 1.00 71.33 N ATOM 2205 CA ILE A 142 -4.931 9.396 -2.503 1.00 3.10 C ATOM 2206 C ILE A 142 -3.651 9.412 -3.335 1.00 43.14 C ATOM 2207 O ILE A 142 -3.163 8.366 -3.762 1.00 51.14 O ATOM 2208 CB ILE A 142 -4.569 9.177 -1.022 1.00 33.20 C ATOM 2209 CG1 ILE A 142 -5.837 9.105 -0.170 1.00 72.43 C ATOM 2210 CG2 ILE A 142 -3.656 10.287 -0.528 1.00 12.41 C ATOM 2211 CD1 ILE A 142 -6.393 7.705 -0.031 1.00 11.31 C ATOM 0 H ILE A 142 -5.462 7.422 -2.949 1.00 71.33 H new ATOM 0 HA ILE A 142 -5.440 10.354 -2.608 1.00 3.10 H new ATOM 0 HB ILE A 142 -4.037 8.230 -0.931 1.00 33.20 H new ATOM 0 HG12 ILE A 142 -5.621 9.502 0.822 1.00 72.43 H new ATOM 0 HG13 ILE A 142 -6.599 9.748 -0.612 1.00 72.43 H new ATOM 0 HG21 ILE A 142 -3.410 10.117 0.520 1.00 12.41 H new ATOM 0 HG22 ILE A 142 -2.740 10.295 -1.119 1.00 12.41 H new ATOM 0 HG23 ILE A 142 -4.162 11.247 -0.630 1.00 12.41 H new ATOM 0 HD11 ILE A 142 -7.291 7.730 0.586 1.00 11.31 H new ATOM 0 HD12 ILE A 142 -6.641 7.312 -1.017 1.00 11.31 H new ATOM 0 HD13 ILE A 142 -5.648 7.063 0.439 1.00 11.31 H new ATOM 2223 N GLU A 143 -3.111 10.606 -3.560 1.00 30.21 N ATOM 2224 CA GLU A 143 -1.887 10.758 -4.339 1.00 71.20 C ATOM 2225 C GLU A 143 -0.740 11.246 -3.459 1.00 30.34 C ATOM 2226 O GLU A 143 -0.896 12.196 -2.692 1.00 70.00 O ATOM 2227 CB GLU A 143 -2.111 11.736 -5.494 1.00 44.13 C ATOM 2228 CG GLU A 143 -3.354 11.434 -6.316 1.00 43.31 C ATOM 2229 CD GLU A 143 -3.597 12.460 -7.404 1.00 50.02 C ATOM 2230 OE1 GLU A 143 -3.068 12.279 -8.521 1.00 40.02 O ATOM 2231 OE2 GLU A 143 -4.318 13.446 -7.141 1.00 61.55 O ATOM 0 H GLU A 143 -3.502 11.482 -3.214 1.00 30.21 H new ATOM 0 HA GLU A 143 -1.620 9.782 -4.745 1.00 71.20 H new ATOM 0 HB2 GLU A 143 -2.188 12.747 -5.093 1.00 44.13 H new ATOM 0 HB3 GLU A 143 -1.240 11.718 -6.149 1.00 44.13 H new ATOM 0 HG2 GLU A 143 -3.255 10.447 -6.768 1.00 43.31 H new ATOM 0 HG3 GLU A 143 -4.221 11.397 -5.656 1.00 43.31 H new ATOM 2238 N THR A 144 0.410 10.589 -3.573 1.00 23.44 N ATOM 2239 CA THR A 144 1.580 10.958 -2.785 1.00 4.22 C ATOM 2240 C THR A 144 2.864 10.764 -3.585 1.00 73.35 C ATOM 2241 O THR A 144 2.828 10.377 -4.753 1.00 22.21 O ATOM 2242 CB THR A 144 1.637 10.130 -1.500 1.00 74.52 C ATOM 2243 OG1 THR A 144 2.022 8.796 -1.780 1.00 31.52 O ATOM 2244 CG2 THR A 144 0.318 10.081 -0.761 1.00 33.44 C ATOM 0 H THR A 144 0.556 9.800 -4.202 1.00 23.44 H new ATOM 0 HA THR A 144 1.492 12.013 -2.527 1.00 4.22 H new ATOM 0 HB THR A 144 2.371 10.629 -0.867 1.00 74.52 H new ATOM 0 HG1 THR A 144 2.054 8.283 -0.946 1.00 31.52 H new ATOM 0 HG21 THR A 144 0.428 9.478 0.140 1.00 33.44 H new ATOM 0 HG22 THR A 144 0.017 11.092 -0.487 1.00 33.44 H new ATOM 0 HG23 THR A 144 -0.443 9.638 -1.403 1.00 33.44 H new ATOM 2252 N SER A 145 3.998 11.036 -2.947 1.00 65.32 N ATOM 2253 CA SER A 145 5.296 10.892 -3.597 1.00 1.13 C ATOM 2254 C SER A 145 6.362 10.456 -2.596 1.00 1.25 C ATOM 2255 O SER A 145 6.592 11.123 -1.588 1.00 41.43 O ATOM 2256 CB SER A 145 5.706 12.208 -4.261 1.00 63.42 C ATOM 2257 OG SER A 145 6.175 11.989 -5.580 1.00 60.43 O ATOM 0 H SER A 145 4.044 11.357 -1.980 1.00 65.32 H new ATOM 0 HA SER A 145 5.208 10.121 -4.362 1.00 1.13 H new ATOM 0 HB2 SER A 145 4.855 12.889 -4.283 1.00 63.42 H new ATOM 0 HB3 SER A 145 6.485 12.690 -3.670 1.00 63.42 H new ATOM 0 HG SER A 145 6.947 12.567 -5.753 1.00 60.43 H new ATOM 2263 N ALA A 146 7.009 9.331 -2.883 1.00 14.33 N ATOM 2264 CA ALA A 146 8.051 8.802 -2.011 1.00 41.13 C ATOM 2265 C ALA A 146 9.263 9.729 -1.964 1.00 34.32 C ATOM 2266 O ALA A 146 10.066 9.666 -1.033 1.00 25.41 O ATOM 2267 CB ALA A 146 8.467 7.413 -2.475 1.00 43.21 C ATOM 0 H ALA A 146 6.829 8.768 -3.714 1.00 14.33 H new ATOM 0 HA ALA A 146 7.643 8.735 -1.002 1.00 41.13 H new ATOM 0 HB1 ALA A 146 9.246 7.028 -1.817 1.00 43.21 H new ATOM 0 HB2 ALA A 146 7.605 6.747 -2.447 1.00 43.21 H new ATOM 0 HB3 ALA A 146 8.849 7.469 -3.494 1.00 43.21 H new ATOM 2273 N LYS A 147 9.395 10.585 -2.973 1.00 35.33 N ATOM 2274 CA LYS A 147 10.516 11.517 -3.042 1.00 34.22 C ATOM 2275 C LYS A 147 10.230 12.786 -2.244 1.00 34.24 C ATOM 2276 O LYS A 147 10.886 13.059 -1.238 1.00 23.34 O ATOM 2277 CB LYS A 147 10.816 11.875 -4.498 1.00 70.23 C ATOM 2278 CG LYS A 147 12.300 12.017 -4.797 1.00 60.01 C ATOM 2279 CD LYS A 147 13.030 10.694 -4.633 1.00 0.10 C ATOM 2280 CE LYS A 147 14.432 10.756 -5.218 1.00 14.43 C ATOM 2281 NZ LYS A 147 15.293 9.649 -4.719 1.00 30.12 N ATOM 0 H LYS A 147 8.741 10.653 -3.753 1.00 35.33 H new ATOM 0 HA LYS A 147 11.386 11.028 -2.604 1.00 34.22 H new ATOM 0 HB2 LYS A 147 10.395 11.106 -5.146 1.00 70.23 H new ATOM 0 HB3 LYS A 147 10.313 12.810 -4.744 1.00 70.23 H new ATOM 0 HG2 LYS A 147 12.434 12.384 -5.815 1.00 60.01 H new ATOM 0 HG3 LYS A 147 12.737 12.760 -4.130 1.00 60.01 H new ATOM 0 HD2 LYS A 147 13.087 10.437 -3.575 1.00 0.10 H new ATOM 0 HD3 LYS A 147 12.464 9.902 -5.123 1.00 0.10 H new ATOM 0 HE2 LYS A 147 14.374 10.708 -6.305 1.00 14.43 H new ATOM 0 HE3 LYS A 147 14.889 11.713 -4.965 1.00 14.43 H new ATOM 0 HZ1 LYS A 147 16.240 9.728 -5.142 1.00 30.12 H new ATOM 0 HZ2 LYS A 147 15.370 9.709 -3.684 1.00 30.12 H new ATOM 0 HZ3 LYS A 147 14.871 8.736 -4.982 1.00 30.12 H new ATOM 2295 N THR A 148 9.252 13.561 -2.700 1.00 41.32 N ATOM 2296 CA THR A 148 8.886 14.805 -2.030 1.00 14.05 C ATOM 2297 C THR A 148 8.192 14.532 -0.698 1.00 44.14 C ATOM 2298 O THR A 148 8.188 15.381 0.194 1.00 72.13 O ATOM 2299 CB THR A 148 7.976 15.647 -2.926 1.00 24.01 C ATOM 2300 OG1 THR A 148 6.979 14.842 -3.533 1.00 65.24 O ATOM 2301 CG2 THR A 148 8.723 16.369 -4.027 1.00 43.33 C ATOM 0 H THR A 148 8.698 13.350 -3.530 1.00 41.32 H new ATOM 0 HA THR A 148 9.804 15.358 -1.832 1.00 14.05 H new ATOM 0 HB THR A 148 7.529 16.390 -2.266 1.00 24.01 H new ATOM 0 HG1 THR A 148 6.190 15.390 -3.728 1.00 65.24 H new ATOM 0 HG21 THR A 148 8.019 16.947 -4.625 1.00 43.33 H new ATOM 0 HG22 THR A 148 9.461 17.039 -3.587 1.00 43.33 H new ATOM 0 HG23 THR A 148 9.227 15.641 -4.663 1.00 43.33 H new ATOM 2309 N ARG A 149 7.601 13.348 -0.568 1.00 20.21 N ATOM 2310 CA ARG A 149 6.902 12.974 0.656 1.00 32.40 C ATOM 2311 C ARG A 149 5.702 13.887 0.893 1.00 24.01 C ATOM 2312 O ARG A 149 5.671 14.658 1.853 1.00 72.25 O ATOM 2313 CB ARG A 149 7.854 13.035 1.853 1.00 43.44 C ATOM 2314 CG ARG A 149 7.630 11.925 2.867 1.00 34.20 C ATOM 2315 CD ARG A 149 6.419 12.204 3.743 1.00 73.05 C ATOM 2316 NE ARG A 149 6.797 12.753 5.043 1.00 52.41 N ATOM 2317 CZ ARG A 149 7.367 12.040 6.012 1.00 3.20 C ATOM 2318 NH1 ARG A 149 7.628 10.751 5.831 1.00 4.13 N ATOM 2319 NH2 ARG A 149 7.678 12.617 7.165 1.00 62.11 N ATOM 0 H ARG A 149 7.592 12.632 -1.295 1.00 20.21 H new ATOM 0 HA ARG A 149 6.542 11.951 0.544 1.00 32.40 H new ATOM 0 HB2 ARG A 149 8.881 12.984 1.492 1.00 43.44 H new ATOM 0 HB3 ARG A 149 7.738 13.998 2.350 1.00 43.44 H new ATOM 0 HG2 ARG A 149 7.492 10.978 2.346 1.00 34.20 H new ATOM 0 HG3 ARG A 149 8.516 11.819 3.493 1.00 34.20 H new ATOM 0 HD2 ARG A 149 5.757 12.903 3.233 1.00 73.05 H new ATOM 0 HD3 ARG A 149 5.857 11.281 3.889 1.00 73.05 H new ATOM 0 HE ARG A 149 6.613 13.741 5.219 1.00 52.41 H new ATOM 0 HH11 ARG A 149 7.392 10.302 4.946 1.00 4.13 H new ATOM 0 HH12 ARG A 149 8.065 10.209 6.577 1.00 4.13 H new ATOM 0 HH21 ARG A 149 7.480 13.607 7.309 1.00 62.11 H new ATOM 0 HH22 ARG A 149 8.115 12.071 7.907 1.00 62.11 H new ATOM 2333 N GLN A 150 4.714 13.795 0.008 1.00 15.45 N ATOM 2334 CA GLN A 150 3.511 14.612 0.115 1.00 41.53 C ATOM 2335 C GLN A 150 2.274 13.738 0.297 1.00 34.34 C ATOM 2336 O GLN A 150 1.974 12.887 -0.539 1.00 43.44 O ATOM 2337 CB GLN A 150 3.355 15.489 -1.131 1.00 2.33 C ATOM 2338 CG GLN A 150 2.111 16.364 -1.109 1.00 51.23 C ATOM 2339 CD GLN A 150 2.429 17.836 -1.270 1.00 12.34 C ATOM 2340 OE1 GLN A 150 2.371 18.605 -0.310 1.00 21.22 O ATOM 2341 NE2 GLN A 150 2.767 18.237 -2.489 1.00 31.55 N ATOM 0 H GLN A 150 4.723 13.162 -0.792 1.00 15.45 H new ATOM 0 HA GLN A 150 3.611 15.252 0.991 1.00 41.53 H new ATOM 0 HB2 GLN A 150 4.235 16.125 -1.230 1.00 2.33 H new ATOM 0 HB3 GLN A 150 3.324 14.850 -2.013 1.00 2.33 H new ATOM 0 HG2 GLN A 150 1.438 16.052 -1.908 1.00 51.23 H new ATOM 0 HG3 GLN A 150 1.581 16.212 -0.169 1.00 51.23 H new ATOM 0 HE21 GLN A 150 2.802 17.565 -3.256 1.00 31.55 H new ATOM 0 HE22 GLN A 150 2.992 19.217 -2.659 1.00 31.55 H new ATOM 2350 N GLY A 151 1.559 13.957 1.395 1.00 42.14 N ATOM 2351 CA GLY A 151 0.362 13.183 1.668 1.00 74.25 C ATOM 2352 C GLY A 151 0.648 11.704 1.850 1.00 33.40 C ATOM 2353 O GLY A 151 -0.265 10.880 1.788 1.00 62.40 O ATOM 0 H GLY A 151 1.787 14.657 2.101 1.00 42.14 H new ATOM 0 HA2 GLY A 151 -0.118 13.569 2.567 1.00 74.25 H new ATOM 0 HA3 GLY A 151 -0.345 13.314 0.849 1.00 74.25 H new ATOM 2357 N VAL A 152 1.914 11.363 2.078 1.00 71.34 N ATOM 2358 CA VAL A 152 2.308 9.973 2.271 1.00 62.30 C ATOM 2359 C VAL A 152 1.527 9.336 3.416 1.00 71.34 C ATOM 2360 O VAL A 152 0.881 8.302 3.243 1.00 72.41 O ATOM 2361 CB VAL A 152 3.816 9.854 2.563 1.00 43.32 C ATOM 2362 CG1 VAL A 152 4.237 8.394 2.626 1.00 35.43 C ATOM 2363 CG2 VAL A 152 4.623 10.604 1.513 1.00 42.31 C ATOM 0 H VAL A 152 2.683 12.031 2.133 1.00 71.34 H new ATOM 0 HA VAL A 152 2.082 9.446 1.344 1.00 62.30 H new ATOM 0 HB VAL A 152 4.015 10.306 3.535 1.00 43.32 H new ATOM 0 HG11 VAL A 152 5.305 8.332 2.833 1.00 35.43 H new ATOM 0 HG12 VAL A 152 3.684 7.890 3.418 1.00 35.43 H new ATOM 0 HG13 VAL A 152 4.024 7.912 1.672 1.00 35.43 H new ATOM 0 HG21 VAL A 152 5.686 10.509 1.735 1.00 42.31 H new ATOM 0 HG22 VAL A 152 4.419 10.183 0.528 1.00 42.31 H new ATOM 0 HG23 VAL A 152 4.343 11.657 1.523 1.00 42.31 H new ATOM 2373 N GLU A 153 1.589 9.963 4.585 1.00 23.14 N ATOM 2374 CA GLU A 153 0.886 9.462 5.760 1.00 34.31 C ATOM 2375 C GLU A 153 -0.620 9.434 5.519 1.00 74.03 C ATOM 2376 O GLU A 153 -1.336 8.612 6.092 1.00 33.40 O ATOM 2377 CB GLU A 153 1.203 10.329 6.980 1.00 54.21 C ATOM 2378 CG GLU A 153 2.672 10.700 7.100 1.00 72.24 C ATOM 2379 CD GLU A 153 2.961 12.104 6.606 1.00 71.44 C ATOM 2380 OE1 GLU A 153 2.249 12.570 5.691 1.00 61.44 O ATOM 2381 OE2 GLU A 153 3.900 12.737 7.133 1.00 5.40 O ATOM 0 H GLU A 153 2.119 10.820 4.744 1.00 23.14 H new ATOM 0 HA GLU A 153 1.226 8.444 5.950 1.00 34.31 H new ATOM 0 HB2 GLU A 153 0.610 11.242 6.930 1.00 54.21 H new ATOM 0 HB3 GLU A 153 0.896 9.798 7.881 1.00 54.21 H new ATOM 0 HG2 GLU A 153 2.981 10.615 8.142 1.00 72.24 H new ATOM 0 HG3 GLU A 153 3.270 9.988 6.531 1.00 72.24 H new ATOM 2388 N ASP A 154 -1.095 10.338 4.667 1.00 73.14 N ATOM 2389 CA ASP A 154 -2.515 10.419 4.348 1.00 72.51 C ATOM 2390 C ASP A 154 -3.006 9.123 3.709 1.00 2.23 C ATOM 2391 O ASP A 154 -3.987 8.531 4.158 1.00 34.45 O ATOM 2392 CB ASP A 154 -2.781 11.598 3.409 1.00 33.32 C ATOM 2393 CG ASP A 154 -3.871 12.516 3.926 1.00 44.34 C ATOM 2394 OD1 ASP A 154 -5.061 12.171 3.769 1.00 75.24 O ATOM 2395 OD2 ASP A 154 -3.535 13.580 4.487 1.00 4.14 O ATOM 0 H ASP A 154 -0.516 11.025 4.185 1.00 73.14 H new ATOM 0 HA ASP A 154 -3.062 10.573 5.278 1.00 72.51 H new ATOM 0 HB2 ASP A 154 -1.862 12.169 3.278 1.00 33.32 H new ATOM 0 HB3 ASP A 154 -3.064 11.220 2.427 1.00 33.32 H new ATOM 2400 N ALA A 155 -2.318 8.690 2.657 1.00 32.22 N ATOM 2401 CA ALA A 155 -2.683 7.466 1.951 1.00 63.41 C ATOM 2402 C ALA A 155 -2.771 6.278 2.905 1.00 71.43 C ATOM 2403 O ALA A 155 -3.636 5.414 2.758 1.00 0.44 O ATOM 2404 CB ALA A 155 -1.681 7.183 0.842 1.00 73.21 C ATOM 0 H ALA A 155 -1.503 9.169 2.274 1.00 32.22 H new ATOM 0 HA ALA A 155 -3.669 7.612 1.511 1.00 63.41 H new ATOM 0 HB1 ALA A 155 -1.963 6.268 0.322 1.00 73.21 H new ATOM 0 HB2 ALA A 155 -1.675 8.014 0.137 1.00 73.21 H new ATOM 0 HB3 ALA A 155 -0.686 7.064 1.272 1.00 73.21 H new ATOM 2410 N PHE A 156 -1.871 6.238 3.882 1.00 42.12 N ATOM 2411 CA PHE A 156 -1.848 5.153 4.856 1.00 14.52 C ATOM 2412 C PHE A 156 -3.011 5.273 5.836 1.00 41.35 C ATOM 2413 O PHE A 156 -3.745 4.311 6.065 1.00 65.23 O ATOM 2414 CB PHE A 156 -0.522 5.151 5.617 1.00 11.53 C ATOM 2415 CG PHE A 156 0.607 4.529 4.847 1.00 1.14 C ATOM 2416 CD1 PHE A 156 0.575 3.185 4.513 1.00 51.32 C ATOM 2417 CD2 PHE A 156 1.697 5.288 4.455 1.00 52.41 C ATOM 2418 CE1 PHE A 156 1.610 2.608 3.802 1.00 20.13 C ATOM 2419 CE2 PHE A 156 2.736 4.717 3.744 1.00 64.32 C ATOM 2420 CZ PHE A 156 2.692 3.376 3.417 1.00 34.32 C ATOM 0 H PHE A 156 -1.148 6.944 4.020 1.00 42.12 H new ATOM 0 HA PHE A 156 -1.950 4.212 4.315 1.00 14.52 H new ATOM 0 HB2 PHE A 156 -0.256 6.177 5.872 1.00 11.53 H new ATOM 0 HB3 PHE A 156 -0.651 4.613 6.556 1.00 11.53 H new ATOM 0 HD1 PHE A 156 -0.269 2.581 4.812 1.00 51.32 H new ATOM 0 HD2 PHE A 156 1.736 6.337 4.707 1.00 52.41 H new ATOM 0 HE1 PHE A 156 1.573 1.559 3.548 1.00 20.13 H new ATOM 0 HE2 PHE A 156 3.581 5.319 3.445 1.00 64.32 H new ATOM 0 HZ PHE A 156 3.502 2.928 2.861 1.00 34.32 H new ATOM 2430 N TYR A 157 -3.174 6.459 6.412 1.00 53.53 N ATOM 2431 CA TYR A 157 -4.248 6.706 7.368 1.00 22.12 C ATOM 2432 C TYR A 157 -5.609 6.380 6.758 1.00 61.31 C ATOM 2433 O TYR A 157 -6.544 6.012 7.468 1.00 43.04 O ATOM 2434 CB TYR A 157 -4.216 8.162 7.836 1.00 30.52 C ATOM 2435 CG TYR A 157 -2.990 8.506 8.652 1.00 0.23 C ATOM 2436 CD1 TYR A 157 -2.511 7.634 9.622 1.00 51.43 C ATOM 2437 CD2 TYR A 157 -2.311 9.701 8.451 1.00 32.12 C ATOM 2438 CE1 TYR A 157 -1.390 7.944 10.369 1.00 70.42 C ATOM 2439 CE2 TYR A 157 -1.189 10.018 9.194 1.00 62.23 C ATOM 2440 CZ TYR A 157 -0.733 9.136 10.151 1.00 45.32 C ATOM 2441 OH TYR A 157 0.383 9.448 10.893 1.00 52.42 O ATOM 0 H TYR A 157 -2.576 7.265 6.233 1.00 53.53 H new ATOM 0 HA TYR A 157 -4.094 6.053 8.227 1.00 22.12 H new ATOM 0 HB2 TYR A 157 -4.259 8.816 6.965 1.00 30.52 H new ATOM 0 HB3 TYR A 157 -5.107 8.364 8.431 1.00 30.52 H new ATOM 0 HD1 TYR A 157 -3.023 6.699 9.795 1.00 51.43 H new ATOM 0 HD2 TYR A 157 -2.665 10.394 7.702 1.00 32.12 H new ATOM 0 HE1 TYR A 157 -1.031 7.256 11.120 1.00 70.42 H new ATOM 0 HE2 TYR A 157 -0.672 10.951 9.026 1.00 62.23 H new ATOM 0 HH TYR A 157 0.727 10.322 10.615 1.00 52.42 H new ATOM 2451 N THR A 158 -5.713 6.514 5.438 1.00 3.15 N ATOM 2452 CA THR A 158 -6.959 6.228 4.738 1.00 32.10 C ATOM 2453 C THR A 158 -7.400 4.789 4.983 1.00 62.14 C ATOM 2454 O THR A 158 -8.577 4.521 5.223 1.00 34.41 O ATOM 2455 CB THR A 158 -6.791 6.476 3.239 1.00 73.12 C ATOM 2456 OG1 THR A 158 -5.959 7.597 3.005 1.00 53.00 O ATOM 2457 CG2 THR A 158 -8.101 6.721 2.526 1.00 4.13 C ATOM 0 H THR A 158 -4.950 6.818 4.834 1.00 3.15 H new ATOM 0 HA THR A 158 -7.729 6.895 5.125 1.00 32.10 H new ATOM 0 HB THR A 158 -6.343 5.564 2.843 1.00 73.12 H new ATOM 0 HG1 THR A 158 -5.052 7.402 3.320 1.00 53.00 H new ATOM 0 HG21 THR A 158 -7.912 6.890 1.466 1.00 4.13 H new ATOM 0 HG22 THR A 158 -8.748 5.852 2.645 1.00 4.13 H new ATOM 0 HG23 THR A 158 -8.589 7.598 2.952 1.00 4.13 H new ATOM 2465 N LEU A 159 -6.445 3.865 4.925 1.00 64.41 N ATOM 2466 CA LEU A 159 -6.734 2.453 5.146 1.00 54.30 C ATOM 2467 C LEU A 159 -7.307 2.234 6.542 1.00 12.02 C ATOM 2468 O LEU A 159 -8.313 1.544 6.711 1.00 0.15 O ATOM 2469 CB LEU A 159 -5.465 1.616 4.963 1.00 12.24 C ATOM 2470 CG LEU A 159 -5.644 0.111 5.175 1.00 74.42 C ATOM 2471 CD1 LEU A 159 -6.768 -0.421 4.301 1.00 73.20 C ATOM 2472 CD2 LEU A 159 -4.345 -0.625 4.882 1.00 40.10 C ATOM 0 H LEU A 159 -5.465 4.069 4.727 1.00 64.41 H new ATOM 0 HA LEU A 159 -7.475 2.136 4.412 1.00 54.30 H new ATOM 0 HB2 LEU A 159 -5.081 1.782 3.957 1.00 12.24 H new ATOM 0 HB3 LEU A 159 -4.707 1.977 5.658 1.00 12.24 H new ATOM 0 HG LEU A 159 -5.910 -0.061 6.218 1.00 74.42 H new ATOM 0 HD11 LEU A 159 -6.881 -1.493 4.465 1.00 73.20 H new ATOM 0 HD12 LEU A 159 -7.699 0.085 4.557 1.00 73.20 H new ATOM 0 HD13 LEU A 159 -6.532 -0.237 3.253 1.00 73.20 H new ATOM 0 HD21 LEU A 159 -4.489 -1.694 5.038 1.00 40.10 H new ATOM 0 HD22 LEU A 159 -4.050 -0.445 3.848 1.00 40.10 H new ATOM 0 HD23 LEU A 159 -3.563 -0.264 5.550 1.00 40.10 H new ATOM 2484 N VAL A 160 -6.660 2.831 7.540 1.00 52.21 N ATOM 2485 CA VAL A 160 -7.101 2.712 8.926 1.00 21.45 C ATOM 2486 C VAL A 160 -8.587 3.035 9.061 1.00 45.42 C ATOM 2487 O VAL A 160 -9.335 2.306 9.712 1.00 25.11 O ATOM 2488 CB VAL A 160 -6.299 3.650 9.848 1.00 54.33 C ATOM 2489 CG1 VAL A 160 -6.675 3.424 11.305 1.00 32.21 C ATOM 2490 CG2 VAL A 160 -4.803 3.458 9.640 1.00 44.03 C ATOM 0 H VAL A 160 -5.826 3.404 7.413 1.00 52.21 H new ATOM 0 HA VAL A 160 -6.929 1.679 9.227 1.00 21.45 H new ATOM 0 HB VAL A 160 -6.549 4.679 9.589 1.00 54.33 H new ATOM 0 HG11 VAL A 160 -6.097 4.097 11.939 1.00 32.21 H new ATOM 0 HG12 VAL A 160 -7.738 3.622 11.441 1.00 32.21 H new ATOM 0 HG13 VAL A 160 -6.460 2.392 11.580 1.00 32.21 H new ATOM 0 HG21 VAL A 160 -4.255 4.130 10.300 1.00 44.03 H new ATOM 0 HG22 VAL A 160 -4.534 2.426 9.867 1.00 44.03 H new ATOM 0 HG23 VAL A 160 -4.548 3.680 8.604 1.00 44.03 H new ATOM 2500 N ARG A 161 -9.006 4.132 8.439 1.00 61.41 N ATOM 2501 CA ARG A 161 -10.402 4.552 8.488 1.00 11.15 C ATOM 2502 C ARG A 161 -11.299 3.526 7.803 1.00 54.24 C ATOM 2503 O ARG A 161 -12.414 3.263 8.253 1.00 33.45 O ATOM 2504 CB ARG A 161 -10.568 5.922 7.825 1.00 42.31 C ATOM 2505 CG ARG A 161 -11.220 6.958 8.726 1.00 71.35 C ATOM 2506 CD ARG A 161 -10.660 8.349 8.474 1.00 71.14 C ATOM 2507 NE ARG A 161 -10.460 9.092 9.716 1.00 2.43 N ATOM 2508 CZ ARG A 161 -11.438 9.701 10.382 1.00 52.20 C ATOM 2509 NH1 ARG A 161 -12.685 9.658 9.930 1.00 13.52 N ATOM 2510 NH2 ARG A 161 -11.169 10.355 11.504 1.00 42.15 N ATOM 0 H ARG A 161 -8.399 4.746 7.895 1.00 61.41 H new ATOM 0 HA ARG A 161 -10.700 4.627 9.534 1.00 11.15 H new ATOM 0 HB2 ARG A 161 -9.589 6.287 7.514 1.00 42.31 H new ATOM 0 HB3 ARG A 161 -11.168 5.809 6.922 1.00 42.31 H new ATOM 0 HG2 ARG A 161 -12.297 6.962 8.557 1.00 71.35 H new ATOM 0 HG3 ARG A 161 -11.062 6.685 9.769 1.00 71.35 H new ATOM 0 HD2 ARG A 161 -9.711 8.267 7.944 1.00 71.14 H new ATOM 0 HD3 ARG A 161 -11.340 8.902 7.826 1.00 71.14 H new ATOM 0 HE ARG A 161 -9.515 9.147 10.095 1.00 2.43 H new ATOM 0 HH11 ARG A 161 -12.898 9.156 9.068 1.00 13.52 H new ATOM 0 HH12 ARG A 161 -13.430 10.127 10.445 1.00 13.52 H new ATOM 0 HH21 ARG A 161 -10.212 10.391 11.856 1.00 42.15 H new ATOM 0 HH22 ARG A 161 -11.919 10.822 12.014 1.00 42.15 H new ATOM 2524 N GLU A 162 -10.804 2.949 6.712 1.00 1.23 N ATOM 2525 CA GLU A 162 -11.560 1.950 5.966 1.00 31.42 C ATOM 2526 C GLU A 162 -11.759 0.688 6.800 1.00 43.02 C ATOM 2527 O GLU A 162 -12.870 0.168 6.903 1.00 34.22 O ATOM 2528 CB GLU A 162 -10.840 1.607 4.659 1.00 71.34 C ATOM 2529 CG GLU A 162 -11.744 1.647 3.438 1.00 2.12 C ATOM 2530 CD GLU A 162 -12.458 2.976 3.284 1.00 50.24 C ATOM 2531 OE1 GLU A 162 -11.891 4.006 3.705 1.00 31.13 O ATOM 2532 OE2 GLU A 162 -13.583 2.986 2.742 1.00 13.34 O ATOM 0 H GLU A 162 -9.883 3.156 6.326 1.00 1.23 H new ATOM 0 HA GLU A 162 -12.539 2.368 5.733 1.00 31.42 H new ATOM 0 HB2 GLU A 162 -10.016 2.306 4.514 1.00 71.34 H new ATOM 0 HB3 GLU A 162 -10.403 0.612 4.745 1.00 71.34 H new ATOM 0 HG2 GLU A 162 -11.151 1.452 2.545 1.00 2.12 H new ATOM 0 HG3 GLU A 162 -12.482 0.848 3.511 1.00 2.12 H new ATOM 2539 N ILE A 163 -10.674 0.202 7.395 1.00 12.25 N ATOM 2540 CA ILE A 163 -10.724 -0.991 8.220 1.00 53.31 C ATOM 2541 C ILE A 163 -11.632 -0.785 9.429 1.00 50.12 C ATOM 2542 O ILE A 163 -12.506 -1.604 9.710 1.00 52.13 O ATOM 2543 CB ILE A 163 -9.319 -1.377 8.696 1.00 73.32 C ATOM 2544 CG1 ILE A 163 -8.417 -1.614 7.492 1.00 5.54 C ATOM 2545 CG2 ILE A 163 -9.374 -2.614 9.574 1.00 15.20 C ATOM 2546 CD1 ILE A 163 -6.955 -1.652 7.844 1.00 15.43 C ATOM 0 H ILE A 163 -9.747 0.621 7.318 1.00 12.25 H new ATOM 0 HA ILE A 163 -11.131 -1.797 7.609 1.00 53.31 H new ATOM 0 HB ILE A 163 -8.909 -0.560 9.290 1.00 73.32 H new ATOM 0 HG12 ILE A 163 -8.694 -2.556 7.018 1.00 5.54 H new ATOM 0 HG13 ILE A 163 -8.587 -0.826 6.758 1.00 5.54 H new ATOM 0 HG21 ILE A 163 -8.367 -2.872 9.902 1.00 15.20 H new ATOM 0 HG22 ILE A 163 -9.999 -2.415 10.444 1.00 15.20 H new ATOM 0 HG23 ILE A 163 -9.795 -3.444 9.007 1.00 15.20 H new ATOM 0 HD11 ILE A 163 -6.368 -1.824 6.942 1.00 15.43 H new ATOM 0 HD12 ILE A 163 -6.664 -0.701 8.291 1.00 15.43 H new ATOM 0 HD13 ILE A 163 -6.773 -2.458 8.555 1.00 15.43 H new ATOM 2558 N ARG A 164 -11.412 0.316 10.141 1.00 65.13 N ATOM 2559 CA ARG A 164 -12.204 0.638 11.323 1.00 31.12 C ATOM 2560 C ARG A 164 -13.698 0.603 11.013 1.00 65.02 C ATOM 2561 O ARG A 164 -14.488 0.045 11.775 1.00 42.04 O ATOM 2562 CB ARG A 164 -11.816 2.017 11.858 1.00 43.21 C ATOM 2563 CG ARG A 164 -10.683 1.979 12.870 1.00 34.32 C ATOM 2564 CD ARG A 164 -10.305 3.375 13.335 1.00 72.41 C ATOM 2565 NE ARG A 164 -11.428 4.066 13.963 1.00 54.23 N ATOM 2566 CZ ARG A 164 -11.916 3.751 15.161 1.00 33.30 C ATOM 2567 NH1 ARG A 164 -11.382 2.760 15.864 1.00 10.34 N ATOM 2568 NH2 ARG A 164 -12.941 4.430 15.658 1.00 25.03 N ATOM 0 H ARG A 164 -10.690 1.002 9.919 1.00 65.13 H new ATOM 0 HA ARG A 164 -11.995 -0.115 12.083 1.00 31.12 H new ATOM 0 HB2 ARG A 164 -11.525 2.653 11.022 1.00 43.21 H new ATOM 0 HB3 ARG A 164 -12.689 2.478 12.320 1.00 43.21 H new ATOM 0 HG2 ARG A 164 -10.980 1.377 13.728 1.00 34.32 H new ATOM 0 HG3 ARG A 164 -9.813 1.494 12.426 1.00 34.32 H new ATOM 0 HD2 ARG A 164 -9.478 3.310 14.042 1.00 72.41 H new ATOM 0 HD3 ARG A 164 -9.951 3.957 12.484 1.00 72.41 H new ATOM 0 HE ARG A 164 -11.864 4.835 13.454 1.00 54.23 H new ATOM 0 HH11 ARG A 164 -10.593 2.235 15.487 1.00 10.34 H new ATOM 0 HH12 ARG A 164 -11.761 2.524 16.781 1.00 10.34 H new ATOM 0 HH21 ARG A 164 -13.355 5.193 15.122 1.00 25.03 H new ATOM 0 HH22 ARG A 164 -13.315 4.189 16.576 1.00 25.03 H new ATOM 2582 N GLN A 165 -14.080 1.201 9.889 1.00 22.41 N ATOM 2583 CA GLN A 165 -15.479 1.235 9.479 1.00 61.44 C ATOM 2584 C GLN A 165 -15.898 -0.085 8.837 1.00 54.11 C ATOM 2585 O GLN A 165 -17.078 -0.435 8.831 1.00 40.04 O ATOM 2586 CB GLN A 165 -15.723 2.393 8.516 1.00 4.50 C ATOM 2587 CG GLN A 165 -15.115 2.162 7.155 1.00 10.02 C ATOM 2588 CD GLN A 165 -15.352 3.314 6.199 1.00 65.21 C ATOM 2589 OE1 GLN A 165 -15.840 3.121 5.085 1.00 75.14 O ATOM 2590 NE2 GLN A 165 -15.006 4.521 6.630 1.00 43.42 N ATOM 0 H GLN A 165 -13.441 1.668 9.246 1.00 22.41 H new ATOM 0 HA GLN A 165 -16.087 1.384 10.371 1.00 61.44 H new ATOM 0 HB2 GLN A 165 -16.796 2.549 8.407 1.00 4.50 H new ATOM 0 HB3 GLN A 165 -15.310 3.307 8.943 1.00 4.50 H new ATOM 0 HG2 GLN A 165 -14.042 2.002 7.264 1.00 10.02 H new ATOM 0 HG3 GLN A 165 -15.531 1.250 6.727 1.00 10.02 H new ATOM 0 HE21 GLN A 165 -14.605 4.635 7.561 1.00 43.42 H new ATOM 0 HE22 GLN A 165 -15.141 5.335 6.030 1.00 43.42 H new ATOM 2599 N HIS A 166 -14.925 -0.814 8.296 1.00 1.34 N ATOM 2600 CA HIS A 166 -15.198 -2.094 7.653 1.00 22.34 C ATOM 2601 C HIS A 166 -14.471 -3.228 8.369 1.00 2.30 C ATOM 2602 O HIS A 166 -15.126 -3.949 9.152 1.00 21.23 O ATOM 2603 CB HIS A 166 -14.779 -2.050 6.182 1.00 65.20 C ATOM 2604 CG HIS A 166 -15.816 -2.594 5.249 1.00 71.30 C ATOM 2605 ND1 HIS A 166 -16.472 -3.788 5.466 1.00 24.21 N ATOM 2606 CD2 HIS A 166 -16.314 -2.099 4.091 1.00 33.04 C ATOM 2607 CE1 HIS A 166 -17.326 -4.004 4.481 1.00 34.40 C ATOM 2608 NE2 HIS A 166 -17.250 -2.994 3.635 1.00 51.50 N ATOM 2609 OXT HIS A 166 -13.253 -3.387 8.141 1.00 42.50 O ATOM 0 H HIS A 166 -13.943 -0.540 8.291 1.00 1.34 H new ATOM 0 HA HIS A 166 -16.270 -2.281 7.711 1.00 22.34 H new ATOM 0 HB2 HIS A 166 -14.558 -1.019 5.906 1.00 65.20 H new ATOM 0 HB3 HIS A 166 -13.857 -2.617 6.058 1.00 65.20 H new ATOM 0 HD1 HIS A 166 -16.321 -4.407 6.262 1.00 24.21 H new ATOM 0 HD2 HIS A 166 -16.028 -1.173 3.615 1.00 33.04 H new ATOM 0 HE1 HIS A 166 -17.976 -4.861 4.385 1.00 34.40 H new TER 2618 HIS A 166 HETATM 2619 PG GNP A 201 11.964 -3.046 -5.661 1.00 41.33 P HETATM 2620 O1G GNP A 201 13.170 -2.436 -4.785 1.00 73.51 O HETATM 2621 O2G GNP A 201 10.767 -3.331 -4.623 1.00 55.33 O HETATM 2622 O3G GNP A 201 12.361 -4.249 -6.425 1.00 3.10 O HETATM 2623 N3B GNP A 201 11.451 -1.837 -6.612 1.00 74.15 N HETATM 2624 PB GNP A 201 11.827 -0.415 -5.929 1.00 71.32 P HETATM 2625 O1B GNP A 201 11.144 0.646 -6.703 1.00 34.03 O HETATM 2626 O2B GNP A 201 11.562 -0.507 -4.476 1.00 33.42 O HETATM 2627 O3A GNP A 201 13.414 -0.317 -6.177 1.00 2.44 O HETATM 2628 PA GNP A 201 13.982 -0.095 -7.668 1.00 4.43 P HETATM 2629 O1A GNP A 201 12.900 -0.396 -8.631 1.00 31.12 O HETATM 2630 O2A GNP A 201 15.250 -0.850 -7.775 1.00 62.24 O HETATM 2631 O5' GNP A 201 14.301 1.482 -7.706 1.00 41.01 O HETATM 2632 C5' GNP A 201 13.247 2.429 -7.893 1.00 34.20 C HETATM 2633 C4' GNP A 201 13.813 3.833 -8.116 1.00 32.51 C HETATM 2634 O4' GNP A 201 12.717 4.767 -8.162 1.00 54.55 O HETATM 2635 C3' GNP A 201 14.647 4.236 -6.899 1.00 62.01 C HETATM 2636 O3' GNP A 201 15.520 5.320 -7.226 1.00 52.44 O HETATM 2637 C2' GNP A 201 13.533 4.706 -5.967 1.00 12.43 C HETATM 2638 O2' GNP A 201 14.080 5.518 -4.925 1.00 23.13 O HETATM 2639 C1' GNP A 201 12.799 5.583 -6.980 1.00 31.45 C HETATM 2640 N9 GNP A 201 11.460 5.975 -6.485 1.00 54.31 N HETATM 2641 C8 GNP A 201 10.630 5.205 -5.785 1.00 72.10 C HETATM 2642 N7 GNP A 201 9.521 5.886 -5.510 1.00 20.20 N HETATM 2643 C5 GNP A 201 9.642 7.100 -6.038 1.00 21.42 C HETATM 2644 C6 GNP A 201 8.808 8.211 -6.062 1.00 42.15 C HETATM 2645 O6 GNP A 201 7.705 8.180 -5.518 1.00 3.30 O HETATM 2646 N1 GNP A 201 9.247 9.366 -6.720 1.00 73.11 N HETATM 2647 C2 GNP A 201 10.506 9.368 -7.332 1.00 42.05 C HETATM 2648 N2 GNP A 201 10.933 10.460 -7.960 1.00 10.23 N HETATM 2649 N3 GNP A 201 11.282 8.276 -7.287 1.00 61.21 N HETATM 2650 C4 GNP A 201 10.881 7.159 -6.662 1.00 34.41 C HETATM 0 HO3' GNP A 201 15.509 5.979 -6.501 1.00 52.44 H new HETATM 0 HO2' GNP A 201 13.352 5.943 -4.425 1.00 23.13 H new HETATM 0 HNB3 GNP A 201 10.967 -1.953 -7.502 1.00 74.15 H new HETATM 0 HN22 GNP A 201 11.850 10.466 -8.407 1.00 10.23 H new HETATM 0 HN21 GNP A 201 10.344 11.292 -7.994 1.00 10.23 H new HETATM 0 H5'2 GNP A 201 12.593 2.430 -7.021 1.00 34.20 H new HETATM 0 H5'1 GNP A 201 12.637 2.137 -8.748 1.00 34.20 H new HETATM 0 HN1 GNP A 201 8.656 10.197 -6.753 1.00 73.11 H new HETATM 0 H8 GNP A 201 10.828 4.176 -5.484 1.00 72.10 H new HETATM 0 H4' GNP A 201 14.403 3.839 -9.033 1.00 32.51 H new HETATM 0 H3' GNP A 201 15.293 3.456 -6.497 1.00 62.01 H new HETATM 0 H2' GNP A 201 12.949 3.935 -5.464 1.00 12.43 H new HETATM 0 H1' GNP A 201 13.316 6.524 -7.169 1.00 31.45 H new HETATM 2664 MG MG A 202 10.577 -2.006 -3.022 1.00 22.42 MG HETATM 2665 C13 KOB A 203 4.872 -12.780 7.793 1.00 21.44 C HETATM 2666 C12 KOB A 203 4.942 -11.631 8.573 1.00 55.51 C HETATM 2667 C11 KOB A 203 3.895 -10.716 8.554 1.00 71.31 C HETATM 2668 F11 KOB A 203 3.964 -9.604 9.313 1.00 75.13 F HETATM 2669 C10 KOB A 203 2.779 -10.944 7.758 1.00 3.21 C HETATM 2670 C9 KOB A 203 2.712 -12.094 6.979 1.00 53.55 C HETATM 2671 C8 KOB A 203 3.758 -13.009 6.995 1.00 44.02 C HETATM 2672 N8 KOB A 203 3.657 -14.097 6.235 1.00 15.21 N HETATM 2673 C7 KOB A 203 4.601 -15.034 6.198 1.00 41.00 C HETATM 2674 S7 KOB A 203 6.060 -14.916 7.156 1.00 55.31 S HETATM 2675 N7 KOB A 203 4.413 -16.082 5.403 1.00 3.35 N HETATM 2676 N6 KOB A 203 5.243 -16.987 5.344 1.00 40.45 N HETATM 2677 C6 KOB A 203 4.799 -18.239 5.371 1.00 13.13 C HETATM 2678 C5 KOB A 203 3.427 -18.452 5.440 1.00 54.41 C HETATM 2679 C4 KOB A 203 2.928 -19.749 5.446 1.00 41.43 C HETATM 2680 C3 KOB A 203 3.805 -20.826 5.381 1.00 11.23 C HETATM 2681 N3 KOB A 203 3.329 -22.067 5.387 1.00 31.54 N HETATM 2682 O3B KOB A 203 1.927 -22.291 5.459 1.00 12.11 O HETATM 2683 O3A KOB A 203 4.222 -23.170 5.321 1.00 71.33 O HETATM 2684 C2 KOB A 203 5.178 -20.614 5.310 1.00 64.23 C HETATM 2685 C1 KOB A 203 5.676 -19.316 5.307 1.00 23.11 C HETATM 2686 N1 KOB A 203 6.988 -19.109 5.239 1.00 1.10 N HETATM 2687 O1B KOB A 203 7.501 -17.783 5.232 1.00 73.34 O HETATM 2688 O1A KOB A 203 7.879 -20.214 5.173 1.00 13.54 O HETATM 0 HE2 KOB A 203 5.816 -11.448 9.198 1.00 55.51 H new HETATM 0 HE1 KOB A 203 1.960 -10.225 7.744 1.00 3.21 H new HETATM 0 HD2 KOB A 203 5.690 -13.500 7.808 1.00 21.44 H new HETATM 0 HD1 KOB A 203 1.838 -12.278 6.355 1.00 53.55 H new HETATM 0 HAD KOB A 203 2.824 -14.217 5.659 1.00 15.21 H new HETATM 0 HAC KOB A 203 3.568 -16.136 4.834 1.00 3.35 H new HETATM 0 HAB KOB A 203 6.240 -16.783 5.277 1.00 40.45 H new HETATM 0 H5 KOB A 203 2.744 -17.604 5.489 1.00 54.41 H new HETATM 0 H4 KOB A 203 1.853 -19.921 5.501 1.00 41.43 H new HETATM 0 H2 KOB A 203 5.861 -21.462 5.257 1.00 64.23 H new HETATM 2699 O HOH A 301 8.452 -1.760 -3.852 1.00 72.20 O HETATM 2702 O HOH A 302 12.709 -2.120 -2.361 1.00 2.11 O HETATM 2705 O HOH A 303 9.707 -3.551 -1.648 1.00 12.50 O