USER MOD reduce.3.24.130724 H: found=0, std=0, add=1150, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1152 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 135 LYS NZ :NH3+ -155:sc= -0.581 (180deg=-3.12!) USER MOD Set 1.2: A 141 CYS SG : rot 55:sc= 0.475 USER MOD Set 1.3: A 148 SER OG : rot 26:sc= 0.454 USER MOD Set 2.1: A 93 LYS NZ :NH3+ 139:sc= -1.69! (180deg=-4.2!) USER MOD Set 2.2: A 108 ASN : amide:sc= -1.16 K(o=-2.8,f=-9.2!) USER MOD Set 3.1: A 13 ASN : amide:sc= 1.01 K(o=2.2,f=-7.7!) USER MOD Set 3.2: A 60 LYS NZ :NH3+ -114:sc= 1.2 (180deg=-0.00405) USER MOD Set 4.1: A 30 GLN :FLIP amide:sc= -2.35! C(o=-11!,f=-1.7!) USER MOD Set 4.2: A 136 GLN :FLIP amide:sc= 0.694 F(o=-12,f=-1.7) USER MOD Set 5.1: A 25 ASN :FLIP amide:sc= -3.44! C(o=-6.7!,f=-4.3!) USER MOD Set 5.2: A 29 ASN : amide:sc= -0.0379 K(o=-4.3,f=-5) USER MOD Set 5.3: A 31 SER OG : rot -139:sc= -1.66! USER MOD Set 5.4: A 118 THR OG1 : rot 108:sc= 0.107 USER MOD Set 5.5: A 153 GLN :FLIP amide:sc= 0.758 F(o=-5.5,f=-4.3) USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 171:sc= 1.2 (180deg=1.12) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.0322 X(o=-0.032,f=-0.032) USER MOD Single : A 38 GLN : amide:sc= 0.923 K(o=0.92,f=-0.42) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 40:sc= 0.00916 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 47 ASN : amide:sc= -0.0671 K(o=-0.067,f=-0.64) USER MOD Single : A 53 LYS NZ :NH3+ 169:sc= 0.811 (180deg=0.363) USER MOD Single : A 56 MET CE :methyl -134:sc= -0.555 (180deg=-3.65!) USER MOD Single : A 59 TYR OH : rot 150:sc= 0 USER MOD Single : A 61 SER OG : rot -0:sc= 0.429 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ -163:sc= -0.077 (180deg=-0.382) USER MOD Single : A 67 LYS NZ :NH3+ 160:sc= 0.934 (180deg=0.285) USER MOD Single : A 69 THR OG1 : rot 93:sc= -0.927 USER MOD Single : A 75 SER OG : rot -129:sc= 0.852 USER MOD Single : A 76 LYS NZ :NH3+ -162:sc= -0.0375 (180deg=-0.301) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= 0.164 K(o=0.16,f=-6.7!) USER MOD Single : A 80 TYR OH : rot 15:sc= 0 USER MOD Single : A 82 THR OG1 : rot -50:sc= -1.68! USER MOD Single : A 84 GLN :FLIP amide:sc= -0.551 F(o=-2,f=-0.55) USER MOD Single : A 88 GLN : amide:sc= -0.18 K(o=-0.18,f=-0.91) USER MOD Single : A 95 MET CE :methyl 180:sc=-0.00226 (180deg=-0.00226) USER MOD Single : A 100 LYS NZ :NH3+ -171:sc=-0.00819 (180deg=-0.118) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot -26:sc= 0.0953 USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.314 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 119 LYS NZ :NH3+ -168:sc= 1.2 (180deg=1.1) USER MOD Single : A 120 ASN : amide:sc= -2.27! C(o=-2.3!,f=-5.5!) USER MOD Single : A 121 TYR OH : rot 180:sc= -1.42 USER MOD Single : A 123 THR OG1 : rot -46:sc= 1.17 USER MOD Single : A 124 SER OG : rot 110:sc= 0 USER MOD Single : A 127 HIS : no HD1:sc= -1.17 X(o=-1.2,f=-0.77) USER MOD Single : A 129 ASN :FLIP amide:sc= -0.0503 F(o=-1.2!,f=-0.05) USER MOD Single : A 134 THR OG1 : rot 35:sc= -3.14! USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 154:sc= 1.56 USER MOD Single : A 157 ASN : amide:sc= -4.29! C(o=-4.3!,f=-7.1!) USER MOD Single : A 158 GLN : amide:sc= -0.287 X(o=-0.29,f=-0.45) USER MOD ----------------------------------------------------------------- ATOM 76 N ASN A 13 16.319 -5.916 0.441 1.00 1.23 N ATOM 77 CA ASN A 13 16.118 -7.298 0.114 1.00 1.00 C ATOM 78 C ASN A 13 15.007 -7.930 0.935 1.00 0.86 C ATOM 79 O ASN A 13 14.888 -7.685 2.124 1.00 1.29 O ATOM 80 CB ASN A 13 17.452 -8.006 0.251 1.00 1.76 C ATOM 81 CG ASN A 13 18.070 -7.886 1.635 1.00 2.67 C ATOM 82 OD1 ASN A 13 17.818 -8.706 2.517 1.00 3.27 O ATOM 83 ND2 ASN A 13 18.892 -6.865 1.833 1.00 3.42 N ATOM 0 HA ASN A 13 15.772 -7.395 -0.915 1.00 1.00 H new ATOM 0 HB2 ASN A 13 17.319 -9.061 0.013 1.00 1.76 H new ATOM 0 HB3 ASN A 13 18.146 -7.598 -0.484 1.00 1.76 H new ATOM 0 HD21 ASN A 13 19.340 -6.739 2.741 1.00 3.42 H new ATOM 0 HD22 ASN A 13 19.077 -6.205 1.077 1.00 3.42 H new ATOM 90 N PHE A 14 14.226 -8.772 0.281 1.00 0.97 N ATOM 91 CA PHE A 14 12.953 -9.243 0.802 1.00 1.06 C ATOM 92 C PHE A 14 13.157 -10.020 2.088 1.00 0.93 C ATOM 93 O PHE A 14 13.984 -10.928 2.171 1.00 1.27 O ATOM 94 CB PHE A 14 12.253 -10.122 -0.239 1.00 1.64 C ATOM 95 CG PHE A 14 10.903 -10.627 0.194 1.00 2.26 C ATOM 96 CD1 PHE A 14 9.842 -9.752 0.366 1.00 3.13 C ATOM 97 CD2 PHE A 14 10.694 -11.978 0.426 1.00 2.47 C ATOM 98 CE1 PHE A 14 8.600 -10.215 0.755 1.00 4.16 C ATOM 99 CE2 PHE A 14 9.455 -12.446 0.817 1.00 3.36 C ATOM 100 CZ PHE A 14 8.407 -11.563 0.983 1.00 4.21 C ATOM 0 H PHE A 14 14.460 -9.152 -0.636 1.00 0.97 H new ATOM 0 HA PHE A 14 12.325 -8.378 1.017 1.00 1.06 H new ATOM 0 HB2 PHE A 14 12.138 -9.553 -1.161 1.00 1.64 H new ATOM 0 HB3 PHE A 14 12.892 -10.975 -0.468 1.00 1.64 H new ATOM 0 HD1 PHE A 14 9.988 -8.696 0.194 1.00 3.13 H new ATOM 0 HD2 PHE A 14 11.511 -12.673 0.299 1.00 2.47 H new ATOM 0 HE1 PHE A 14 7.780 -9.523 0.881 1.00 4.16 H new ATOM 0 HE2 PHE A 14 9.306 -13.501 0.993 1.00 3.36 H new ATOM 0 HZ PHE A 14 7.438 -11.926 1.291 1.00 4.21 H new ATOM 110 N MET A 15 12.359 -9.651 3.071 1.00 0.73 N ATOM 111 CA MET A 15 12.578 -10.002 4.455 1.00 0.74 C ATOM 112 C MET A 15 11.796 -11.248 4.811 1.00 0.70 C ATOM 113 O MET A 15 12.359 -12.280 5.172 1.00 0.79 O ATOM 114 CB MET A 15 12.122 -8.843 5.342 1.00 0.84 C ATOM 115 CG MET A 15 12.487 -9.006 6.807 1.00 1.48 C ATOM 116 SD MET A 15 12.026 -7.570 7.794 1.00 2.32 S ATOM 117 CE MET A 15 12.664 -8.040 9.399 1.00 2.91 C ATOM 0 H MET A 15 11.523 -9.086 2.923 1.00 0.73 H new ATOM 0 HA MET A 15 13.639 -10.197 4.612 1.00 0.74 H new ATOM 0 HB2 MET A 15 12.563 -7.918 4.969 1.00 0.84 H new ATOM 0 HB3 MET A 15 11.040 -8.738 5.257 1.00 0.84 H new ATOM 0 HG2 MET A 15 11.992 -9.892 7.206 1.00 1.48 H new ATOM 0 HG3 MET A 15 13.560 -9.174 6.895 1.00 1.48 H new ATOM 0 HE1 MET A 15 12.455 -7.249 10.119 1.00 2.91 H new ATOM 0 HE2 MET A 15 12.185 -8.964 9.725 1.00 2.91 H new ATOM 0 HE3 MET A 15 13.741 -8.194 9.332 1.00 2.91 H new ATOM 127 N ARG A 16 10.492 -11.127 4.697 1.00 0.61 N ATOM 128 CA ARG A 16 9.562 -12.067 5.267 1.00 0.61 C ATOM 129 C ARG A 16 8.232 -12.003 4.522 1.00 0.56 C ATOM 130 O ARG A 16 7.839 -10.945 4.018 1.00 0.52 O ATOM 131 CB ARG A 16 9.325 -11.597 6.685 1.00 0.63 C ATOM 132 CG ARG A 16 8.974 -10.124 6.667 1.00 0.72 C ATOM 133 CD ARG A 16 8.786 -9.529 8.028 1.00 1.06 C ATOM 134 NE ARG A 16 7.707 -10.184 8.763 1.00 1.64 N ATOM 135 CZ ARG A 16 7.485 -10.029 10.064 1.00 2.09 C ATOM 136 NH1 ARG A 16 8.266 -9.239 10.789 1.00 2.43 N ATOM 137 NH2 ARG A 16 6.479 -10.672 10.638 1.00 2.73 N ATOM 0 H ARG A 16 10.044 -10.359 4.197 1.00 0.61 H new ATOM 0 HA ARG A 16 9.949 -13.085 5.213 1.00 0.61 H new ATOM 0 HB2 ARG A 16 8.518 -12.170 7.141 1.00 0.63 H new ATOM 0 HB3 ARG A 16 10.216 -11.764 7.290 1.00 0.63 H new ATOM 0 HG2 ARG A 16 9.763 -9.579 6.149 1.00 0.72 H new ATOM 0 HG3 ARG A 16 8.059 -9.985 6.091 1.00 0.72 H new ATOM 0 HD2 ARG A 16 9.714 -9.614 8.593 1.00 1.06 H new ATOM 0 HD3 ARG A 16 8.567 -8.465 7.933 1.00 1.06 H new ATOM 0 HE ARG A 16 7.083 -10.801 8.243 1.00 1.64 H new ATOM 0 HH11 ARG A 16 9.043 -8.746 10.348 1.00 2.43 H new ATOM 0 HH12 ARG A 16 8.090 -9.125 11.787 1.00 2.43 H new ATOM 0 HH21 ARG A 16 5.880 -11.282 10.082 1.00 2.73 H new ATOM 0 HH22 ARG A 16 6.304 -10.557 11.636 1.00 2.73 H new ATOM 151 N ILE A 17 7.553 -13.132 4.450 1.00 0.62 N ATOM 152 CA ILE A 17 6.263 -13.210 3.781 1.00 0.61 C ATOM 153 C ILE A 17 5.141 -12.722 4.698 1.00 0.57 C ATOM 154 O ILE A 17 4.886 -13.300 5.759 1.00 0.64 O ATOM 155 CB ILE A 17 5.965 -14.646 3.278 1.00 0.73 C ATOM 156 CG1 ILE A 17 4.593 -14.707 2.598 1.00 1.68 C ATOM 157 CG2 ILE A 17 6.050 -15.660 4.411 1.00 1.41 C ATOM 158 CD1 ILE A 17 4.494 -13.853 1.351 1.00 2.26 C ATOM 0 H ILE A 17 7.874 -14.014 4.849 1.00 0.62 H new ATOM 0 HA ILE A 17 6.310 -12.555 2.911 1.00 0.61 H new ATOM 0 HB ILE A 17 6.727 -14.906 2.543 1.00 0.73 H new ATOM 0 HG12 ILE A 17 4.372 -15.742 2.337 1.00 1.68 H new ATOM 0 HG13 ILE A 17 3.831 -14.387 3.308 1.00 1.68 H new ATOM 0 HG21 ILE A 17 5.836 -16.656 4.024 1.00 1.41 H new ATOM 0 HG22 ILE A 17 7.052 -15.645 4.839 1.00 1.41 H new ATOM 0 HG23 ILE A 17 5.323 -15.406 5.182 1.00 1.41 H new ATOM 0 HD11 ILE A 17 3.495 -13.946 0.924 1.00 2.26 H new ATOM 0 HD12 ILE A 17 4.683 -12.811 1.608 1.00 2.26 H new ATOM 0 HD13 ILE A 17 5.233 -14.187 0.622 1.00 2.26 H new ATOM 170 N ILE A 18 4.503 -11.630 4.316 1.00 0.49 N ATOM 171 CA ILE A 18 3.364 -11.118 5.066 1.00 0.48 C ATOM 172 C ILE A 18 2.070 -11.749 4.529 1.00 0.48 C ATOM 173 O ILE A 18 2.002 -12.960 4.322 1.00 0.52 O ATOM 174 CB ILE A 18 3.283 -9.567 5.029 1.00 0.44 C ATOM 175 CG1 ILE A 18 4.678 -8.950 5.179 1.00 0.44 C ATOM 176 CG2 ILE A 18 2.373 -9.043 6.141 1.00 0.50 C ATOM 177 CD1 ILE A 18 5.326 -9.206 6.523 1.00 0.94 C ATOM 0 H ILE A 18 4.751 -11.080 3.494 1.00 0.49 H new ATOM 0 HA ILE A 18 3.496 -11.396 6.112 1.00 0.48 H new ATOM 0 HB ILE A 18 2.865 -9.279 4.064 1.00 0.44 H new ATOM 0 HG12 ILE A 18 5.324 -9.345 4.395 1.00 0.44 H new ATOM 0 HG13 ILE A 18 4.606 -7.874 5.021 1.00 0.44 H new ATOM 0 HG21 ILE A 18 2.332 -7.955 6.095 1.00 0.50 H new ATOM 0 HG22 ILE A 18 1.370 -9.450 6.012 1.00 0.50 H new ATOM 0 HG23 ILE A 18 2.768 -9.351 7.109 1.00 0.50 H new ATOM 0 HD11 ILE A 18 6.309 -8.737 6.548 1.00 0.94 H new ATOM 0 HD12 ILE A 18 4.703 -8.786 7.313 1.00 0.94 H new ATOM 0 HD13 ILE A 18 5.432 -10.280 6.677 1.00 0.94 H new ATOM 189 N LYS A 19 1.059 -10.930 4.300 1.00 0.45 N ATOM 190 CA LYS A 19 -0.263 -11.426 3.901 1.00 0.46 C ATOM 191 C LYS A 19 -0.550 -11.028 2.456 1.00 0.42 C ATOM 192 O LYS A 19 0.018 -10.067 1.961 1.00 0.49 O ATOM 193 CB LYS A 19 -1.343 -10.880 4.861 1.00 0.54 C ATOM 194 CG LYS A 19 -2.782 -11.269 4.517 1.00 1.13 C ATOM 195 CD LYS A 19 -2.991 -12.778 4.487 1.00 1.85 C ATOM 196 CE LYS A 19 -4.420 -13.141 4.075 1.00 2.57 C ATOM 197 NZ LYS A 19 -5.415 -12.831 5.142 1.00 2.68 N ATOM 0 H LYS A 19 1.120 -9.915 4.381 1.00 0.45 H new ATOM 0 HA LYS A 19 -0.279 -12.514 3.962 1.00 0.46 H new ATOM 0 HB2 LYS A 19 -1.120 -11.231 5.869 1.00 0.54 H new ATOM 0 HB3 LYS A 19 -1.273 -9.792 4.879 1.00 0.54 H new ATOM 0 HG2 LYS A 19 -3.458 -10.827 5.248 1.00 1.13 H new ATOM 0 HG3 LYS A 19 -3.045 -10.850 3.546 1.00 1.13 H new ATOM 0 HD2 LYS A 19 -2.285 -13.230 3.790 1.00 1.85 H new ATOM 0 HD3 LYS A 19 -2.779 -13.195 5.471 1.00 1.85 H new ATOM 0 HE2 LYS A 19 -4.683 -12.597 3.168 1.00 2.57 H new ATOM 0 HE3 LYS A 19 -4.467 -14.203 3.835 1.00 2.57 H new ATOM 0 HZ1 LYS A 19 -6.377 -12.950 4.765 1.00 2.68 H new ATOM 0 HZ2 LYS A 19 -5.276 -13.477 5.945 1.00 2.68 H new ATOM 0 HZ3 LYS A 19 -5.287 -11.850 5.462 1.00 2.68 H new ATOM 211 N TYR A 20 -1.450 -11.748 1.799 1.00 0.37 N ATOM 212 CA TYR A 20 -1.781 -11.491 0.408 1.00 0.41 C ATOM 213 C TYR A 20 -3.202 -11.909 0.128 1.00 0.31 C ATOM 214 O TYR A 20 -3.783 -12.686 0.889 1.00 0.33 O ATOM 215 CB TYR A 20 -0.818 -12.232 -0.532 1.00 0.67 C ATOM 216 CG TYR A 20 -0.544 -13.679 -0.167 1.00 1.13 C ATOM 217 CD1 TYR A 20 0.468 -14.005 0.726 1.00 1.45 C ATOM 218 CD2 TYR A 20 -1.276 -14.715 -0.734 1.00 1.34 C ATOM 219 CE1 TYR A 20 0.740 -15.319 1.049 1.00 1.93 C ATOM 220 CE2 TYR A 20 -1.007 -16.036 -0.420 1.00 1.82 C ATOM 221 CZ TYR A 20 0.002 -16.332 0.473 1.00 2.10 C ATOM 222 OH TYR A 20 0.283 -17.646 0.784 1.00 2.59 O ATOM 0 H TYR A 20 -1.968 -12.522 2.215 1.00 0.37 H new ATOM 0 HA TYR A 20 -1.681 -10.421 0.225 1.00 0.41 H new ATOM 0 HB2 TYR A 20 -1.226 -12.200 -1.542 1.00 0.67 H new ATOM 0 HB3 TYR A 20 0.130 -11.694 -0.553 1.00 0.67 H new ATOM 0 HD1 TYR A 20 1.053 -13.216 1.176 1.00 1.45 H new ATOM 0 HD2 TYR A 20 -2.068 -14.486 -1.431 1.00 1.34 H new ATOM 0 HE1 TYR A 20 1.528 -15.553 1.750 1.00 1.93 H new ATOM 0 HE2 TYR A 20 -1.583 -16.830 -0.871 1.00 1.82 H new ATOM 0 HH TYR A 20 -0.328 -18.236 0.295 1.00 2.59 H new ATOM 232 N GLU A 21 -3.756 -11.371 -0.954 1.00 0.33 N ATOM 233 CA GLU A 21 -5.106 -11.706 -1.388 1.00 0.32 C ATOM 234 C GLU A 21 -6.127 -11.367 -0.323 1.00 0.28 C ATOM 235 O GLU A 21 -7.146 -12.043 -0.171 1.00 0.30 O ATOM 236 CB GLU A 21 -5.170 -13.199 -1.721 1.00 0.35 C ATOM 237 CG GLU A 21 -4.285 -13.619 -2.881 1.00 0.98 C ATOM 238 CD GLU A 21 -5.043 -13.729 -4.182 1.00 1.16 C ATOM 239 OE1 GLU A 21 -5.226 -12.694 -4.850 1.00 1.53 O ATOM 240 OE2 GLU A 21 -5.466 -14.846 -4.546 1.00 1.73 O ATOM 0 H GLU A 21 -3.283 -10.693 -1.552 1.00 0.33 H new ATOM 0 HA GLU A 21 -5.344 -11.117 -2.274 1.00 0.32 H new ATOM 0 HB2 GLU A 21 -4.885 -13.769 -0.837 1.00 0.35 H new ATOM 0 HB3 GLU A 21 -6.202 -13.464 -1.952 1.00 0.35 H new ATOM 0 HG2 GLU A 21 -3.477 -12.897 -2.996 1.00 0.98 H new ATOM 0 HG3 GLU A 21 -3.824 -14.580 -2.652 1.00 0.98 H new ATOM 247 N PHE A 22 -5.839 -10.321 0.417 1.00 0.26 N ATOM 248 CA PHE A 22 -6.764 -9.805 1.371 1.00 0.26 C ATOM 249 C PHE A 22 -7.275 -8.510 0.812 1.00 0.24 C ATOM 250 O PHE A 22 -6.609 -7.885 -0.015 1.00 0.27 O ATOM 251 CB PHE A 22 -6.141 -9.653 2.769 1.00 0.32 C ATOM 252 CG PHE A 22 -4.894 -8.812 2.864 1.00 1.08 C ATOM 253 CD1 PHE A 22 -3.797 -9.053 2.055 1.00 1.15 C ATOM 254 CD2 PHE A 22 -4.812 -7.804 3.806 1.00 1.98 C ATOM 255 CE1 PHE A 22 -2.645 -8.302 2.181 1.00 2.05 C ATOM 256 CE2 PHE A 22 -3.666 -7.049 3.935 1.00 2.89 C ATOM 257 CZ PHE A 22 -2.580 -7.300 3.122 1.00 2.92 C ATOM 0 H PHE A 22 -4.956 -9.812 0.367 1.00 0.26 H new ATOM 0 HA PHE A 22 -7.590 -10.500 1.525 1.00 0.26 H new ATOM 0 HB2 PHE A 22 -6.892 -9.224 3.432 1.00 0.32 H new ATOM 0 HB3 PHE A 22 -5.911 -10.648 3.149 1.00 0.32 H new ATOM 0 HD1 PHE A 22 -3.843 -9.839 1.315 1.00 1.15 H new ATOM 0 HD2 PHE A 22 -5.657 -7.605 4.449 1.00 1.98 H new ATOM 0 HE1 PHE A 22 -1.797 -8.501 1.542 1.00 2.05 H new ATOM 0 HE2 PHE A 22 -3.618 -6.261 4.672 1.00 2.89 H new ATOM 0 HZ PHE A 22 -1.680 -6.711 3.224 1.00 2.92 H new ATOM 267 N ILE A 23 -8.410 -8.085 1.265 1.00 0.22 N ATOM 268 CA ILE A 23 -9.062 -6.964 0.658 1.00 0.21 C ATOM 269 C ILE A 23 -8.736 -5.751 1.452 1.00 0.19 C ATOM 270 O ILE A 23 -8.695 -5.777 2.676 1.00 0.22 O ATOM 271 CB ILE A 23 -10.593 -7.114 0.620 1.00 0.28 C ATOM 272 CG1 ILE A 23 -10.985 -8.437 -0.035 1.00 0.36 C ATOM 273 CG2 ILE A 23 -11.228 -5.943 -0.122 1.00 0.36 C ATOM 274 CD1 ILE A 23 -10.469 -8.579 -1.450 1.00 0.84 C ATOM 0 H ILE A 23 -8.908 -8.496 2.055 1.00 0.22 H new ATOM 0 HA ILE A 23 -8.709 -6.893 -0.371 1.00 0.21 H new ATOM 0 HB ILE A 23 -10.963 -7.113 1.645 1.00 0.28 H new ATOM 0 HG12 ILE A 23 -10.603 -9.261 0.568 1.00 0.36 H new ATOM 0 HG13 ILE A 23 -12.072 -8.524 -0.041 1.00 0.36 H new ATOM 0 HG21 ILE A 23 -12.311 -6.067 -0.138 1.00 0.36 H new ATOM 0 HG22 ILE A 23 -10.977 -5.012 0.385 1.00 0.36 H new ATOM 0 HG23 ILE A 23 -10.851 -5.912 -1.144 1.00 0.36 H new ATOM 0 HD11 ILE A 23 -10.783 -9.540 -1.857 1.00 0.84 H new ATOM 0 HD12 ILE A 23 -10.872 -7.775 -2.067 1.00 0.84 H new ATOM 0 HD13 ILE A 23 -9.380 -8.524 -1.448 1.00 0.84 H new ATOM 286 N LEU A 24 -8.492 -4.698 0.749 1.00 0.18 N ATOM 287 CA LEU A 24 -8.100 -3.476 1.386 1.00 0.19 C ATOM 288 C LEU A 24 -9.291 -2.566 1.538 1.00 0.20 C ATOM 289 O LEU A 24 -9.941 -2.224 0.559 1.00 0.23 O ATOM 290 CB LEU A 24 -7.022 -2.795 0.556 1.00 0.23 C ATOM 291 CG LEU A 24 -6.320 -1.659 1.263 1.00 0.53 C ATOM 292 CD1 LEU A 24 -4.958 -1.398 0.631 1.00 1.32 C ATOM 293 CD2 LEU A 24 -7.168 -0.392 1.235 1.00 1.41 C ATOM 0 H LEU A 24 -8.556 -4.653 -0.268 1.00 0.18 H new ATOM 0 HA LEU A 24 -7.704 -3.697 2.377 1.00 0.19 H new ATOM 0 HB2 LEU A 24 -6.281 -3.539 0.263 1.00 0.23 H new ATOM 0 HB3 LEU A 24 -7.472 -2.415 -0.361 1.00 0.23 H new ATOM 0 HG LEU A 24 -6.173 -1.948 2.304 1.00 0.53 H new ATOM 0 HD11 LEU A 24 -4.466 -0.577 1.152 1.00 1.32 H new ATOM 0 HD12 LEU A 24 -4.344 -2.295 0.707 1.00 1.32 H new ATOM 0 HD13 LEU A 24 -5.088 -1.135 -0.419 1.00 1.32 H new ATOM 0 HD21 LEU A 24 -6.640 0.410 1.750 1.00 1.41 H new ATOM 0 HD22 LEU A 24 -7.352 -0.100 0.201 1.00 1.41 H new ATOM 0 HD23 LEU A 24 -8.119 -0.580 1.734 1.00 1.41 H new ATOM 305 N ASN A 25 -9.568 -2.179 2.772 1.00 0.19 N ATOM 306 CA ASN A 25 -10.634 -1.254 3.056 1.00 0.19 C ATOM 307 C ASN A 25 -10.105 -0.238 4.052 1.00 0.18 C ATOM 308 O ASN A 25 -9.363 -0.612 4.931 1.00 0.22 O ATOM 309 CB ASN A 25 -11.801 -2.060 3.627 1.00 0.29 C ATOM 310 CG ASN A 25 -13.024 -1.243 3.957 1.00 0.92 C ATOM 311 OD1 ASN A 25 -13.171 -0.885 5.218 1.00 1.74 O flip ATOM 312 ND2 ASN A 25 -13.855 -0.978 3.089 1.00 1.72 N flip ATOM 0 H ASN A 25 -9.059 -2.499 3.596 1.00 0.19 H new ATOM 0 HA ASN A 25 -10.981 -0.722 2.170 1.00 0.19 H new ATOM 0 HB2 ASN A 25 -12.078 -2.832 2.909 1.00 0.29 H new ATOM 0 HB3 ASN A 25 -11.466 -2.570 4.530 1.00 0.29 H new ATOM 0 HD21 ASN A 25 -13.699 -1.275 2.126 1.00 1.72 H new ATOM 0 HD22 ASN A 25 -14.700 -0.461 3.333 1.00 1.72 H new ATOM 319 N ASP A 26 -10.466 1.022 3.938 1.00 0.16 N ATOM 320 CA ASP A 26 -9.990 2.003 4.893 1.00 0.17 C ATOM 321 C ASP A 26 -10.953 2.148 6.048 1.00 0.18 C ATOM 322 O ASP A 26 -11.938 1.434 6.146 1.00 0.20 O ATOM 323 CB ASP A 26 -9.824 3.350 4.168 1.00 0.19 C ATOM 324 CG ASP A 26 -10.922 3.617 3.164 1.00 0.40 C ATOM 325 OD1 ASP A 26 -12.067 3.871 3.557 1.00 0.66 O ATOM 326 OD2 ASP A 26 -10.636 3.598 1.981 1.00 1.04 O ATOM 0 H ASP A 26 -11.077 1.388 3.208 1.00 0.16 H new ATOM 0 HA ASP A 26 -9.034 1.675 5.300 1.00 0.17 H new ATOM 0 HB2 ASP A 26 -9.809 4.154 4.904 1.00 0.19 H new ATOM 0 HB3 ASP A 26 -8.861 3.366 3.658 1.00 0.19 H new ATOM 331 N ALA A 27 -10.601 3.017 6.965 1.00 0.21 N ATOM 332 CA ALA A 27 -11.459 3.330 8.115 1.00 0.25 C ATOM 333 C ALA A 27 -12.655 4.129 7.656 1.00 0.24 C ATOM 334 O ALA A 27 -13.652 4.264 8.366 1.00 0.28 O ATOM 335 CB ALA A 27 -10.710 4.080 9.198 1.00 0.32 C ATOM 0 H ALA A 27 -9.720 3.532 6.949 1.00 0.21 H new ATOM 0 HA ALA A 27 -11.792 2.387 8.548 1.00 0.25 H new ATOM 0 HB1 ALA A 27 -11.384 4.290 10.028 1.00 0.32 H new ATOM 0 HB2 ALA A 27 -9.877 3.472 9.552 1.00 0.32 H new ATOM 0 HB3 ALA A 27 -10.329 5.018 8.794 1.00 0.32 H new ATOM 341 N LEU A 28 -12.527 4.676 6.463 1.00 0.21 N ATOM 342 CA LEU A 28 -13.661 5.279 5.781 1.00 0.24 C ATOM 343 C LEU A 28 -14.529 4.157 5.270 1.00 0.23 C ATOM 344 O LEU A 28 -15.722 4.307 4.999 1.00 0.29 O ATOM 345 CB LEU A 28 -13.201 6.121 4.595 1.00 0.25 C ATOM 346 CG LEU A 28 -12.363 7.331 4.928 1.00 0.31 C ATOM 347 CD1 LEU A 28 -11.990 8.084 3.662 1.00 0.48 C ATOM 348 CD2 LEU A 28 -13.104 8.232 5.904 1.00 0.48 C ATOM 0 H LEU A 28 -11.650 4.717 5.944 1.00 0.21 H new ATOM 0 HA LEU A 28 -14.201 5.927 6.472 1.00 0.24 H new ATOM 0 HB2 LEU A 28 -12.630 5.482 3.921 1.00 0.25 H new ATOM 0 HB3 LEU A 28 -14.083 6.454 4.047 1.00 0.25 H new ATOM 0 HG LEU A 28 -11.441 7.000 5.405 1.00 0.31 H new ATOM 0 HD11 LEU A 28 -11.386 8.954 3.921 1.00 0.48 H new ATOM 0 HD12 LEU A 28 -11.420 7.429 3.004 1.00 0.48 H new ATOM 0 HD13 LEU A 28 -12.897 8.411 3.152 1.00 0.48 H new ATOM 0 HD21 LEU A 28 -12.488 9.101 6.136 1.00 0.48 H new ATOM 0 HD22 LEU A 28 -14.042 8.561 5.456 1.00 0.48 H new ATOM 0 HD23 LEU A 28 -13.314 7.681 6.821 1.00 0.48 H new ATOM 360 N ASN A 29 -13.853 3.033 5.157 1.00 0.20 N ATOM 361 CA ASN A 29 -14.356 1.810 4.601 1.00 0.23 C ATOM 362 C ASN A 29 -14.665 1.992 3.140 1.00 0.24 C ATOM 363 O ASN A 29 -15.825 2.109 2.754 1.00 0.28 O ATOM 364 CB ASN A 29 -15.617 1.320 5.309 1.00 0.29 C ATOM 365 CG ASN A 29 -15.467 1.195 6.813 1.00 0.60 C ATOM 366 OD1 ASN A 29 -15.076 0.146 7.317 1.00 1.32 O ATOM 367 ND2 ASN A 29 -15.803 2.248 7.539 1.00 1.30 N ATOM 0 H ASN A 29 -12.886 2.952 5.470 1.00 0.20 H new ATOM 0 HA ASN A 29 -13.576 1.062 4.739 1.00 0.23 H new ATOM 0 HB2 ASN A 29 -16.435 2.007 5.091 1.00 0.29 H new ATOM 0 HB3 ASN A 29 -15.898 0.350 4.900 1.00 0.29 H new ATOM 0 HD21 ASN A 29 -15.742 2.207 8.556 1.00 1.30 H new ATOM 0 HD22 ASN A 29 -16.123 3.102 7.082 1.00 1.30 H new ATOM 374 N GLN A 30 -13.631 2.018 2.327 1.00 0.23 N ATOM 375 CA GLN A 30 -13.795 1.839 0.919 1.00 0.24 C ATOM 376 C GLN A 30 -12.777 0.835 0.475 1.00 0.22 C ATOM 377 O GLN A 30 -11.579 1.088 0.546 1.00 0.28 O ATOM 378 CB GLN A 30 -13.598 3.149 0.155 1.00 0.36 C ATOM 379 CG GLN A 30 -14.850 3.996 0.002 1.00 0.98 C ATOM 380 CD GLN A 30 -15.254 4.675 1.280 1.00 1.41 C ATOM 381 OE1 GLN A 30 -14.280 4.962 2.117 1.00 2.21 O flip ATOM 382 NE2 GLN A 30 -16.431 4.936 1.517 1.00 1.84 N flip ATOM 0 H GLN A 30 -12.667 2.163 2.629 1.00 0.23 H new ATOM 0 HA GLN A 30 -14.809 1.497 0.711 1.00 0.24 H new ATOM 0 HB2 GLN A 30 -12.838 3.740 0.666 1.00 0.36 H new ATOM 0 HB3 GLN A 30 -13.209 2.919 -0.837 1.00 0.36 H new ATOM 0 HG2 GLN A 30 -14.681 4.750 -0.767 1.00 0.98 H new ATOM 0 HG3 GLN A 30 -15.669 3.366 -0.344 1.00 0.98 H new ATOM 0 HE21 GLN A 30 -17.153 4.695 0.838 1.00 1.84 H new ATOM 0 HE22 GLN A 30 -16.686 5.394 2.392 1.00 1.84 H new ATOM 391 N SER A 31 -13.228 -0.309 0.028 1.00 0.23 N ATOM 392 CA SER A 31 -12.304 -1.262 -0.471 1.00 0.26 C ATOM 393 C SER A 31 -11.714 -0.683 -1.747 1.00 0.21 C ATOM 394 O SER A 31 -12.434 -0.372 -2.694 1.00 0.21 O ATOM 395 CB SER A 31 -13.022 -2.582 -0.700 1.00 0.36 C ATOM 396 OG SER A 31 -13.802 -2.922 0.434 1.00 1.23 O ATOM 0 H SER A 31 -14.209 -0.588 0.004 1.00 0.23 H new ATOM 0 HA SER A 31 -11.495 -1.465 0.231 1.00 0.26 H new ATOM 0 HB2 SER A 31 -13.661 -2.508 -1.580 1.00 0.36 H new ATOM 0 HB3 SER A 31 -12.295 -3.369 -0.899 1.00 0.36 H new ATOM 0 HG SER A 31 -13.720 -3.882 0.612 1.00 1.23 H new ATOM 402 N ILE A 32 -10.408 -0.523 -1.757 1.00 0.21 N ATOM 403 CA ILE A 32 -9.754 0.196 -2.829 1.00 0.20 C ATOM 404 C ILE A 32 -9.720 -0.634 -4.130 1.00 0.21 C ATOM 405 O ILE A 32 -9.007 -1.628 -4.233 1.00 0.24 O ATOM 406 CB ILE A 32 -8.330 0.660 -2.434 1.00 0.24 C ATOM 407 CG1 ILE A 32 -7.725 1.530 -3.536 1.00 1.11 C ATOM 408 CG2 ILE A 32 -7.424 -0.526 -2.130 1.00 1.23 C ATOM 409 CD1 ILE A 32 -6.391 2.136 -3.156 1.00 1.72 C ATOM 0 H ILE A 32 -9.780 -0.880 -1.037 1.00 0.21 H new ATOM 0 HA ILE A 32 -10.349 1.090 -3.015 1.00 0.20 H new ATOM 0 HB ILE A 32 -8.413 1.256 -1.525 1.00 0.24 H new ATOM 0 HG12 ILE A 32 -7.600 0.929 -4.436 1.00 1.11 H new ATOM 0 HG13 ILE A 32 -8.423 2.330 -3.782 1.00 1.11 H new ATOM 0 HG21 ILE A 32 -6.432 -0.166 -1.856 1.00 1.23 H new ATOM 0 HG22 ILE A 32 -7.842 -1.101 -1.304 1.00 1.23 H new ATOM 0 HG23 ILE A 32 -7.348 -1.162 -3.012 1.00 1.23 H new ATOM 0 HD11 ILE A 32 -6.018 2.741 -3.982 1.00 1.72 H new ATOM 0 HD12 ILE A 32 -6.515 2.764 -2.273 1.00 1.72 H new ATOM 0 HD13 ILE A 32 -5.679 1.340 -2.938 1.00 1.72 H new ATOM 421 N ILE A 33 -10.551 -0.268 -5.096 1.00 0.21 N ATOM 422 CA ILE A 33 -10.661 -1.035 -6.343 1.00 0.24 C ATOM 423 C ILE A 33 -9.839 -0.372 -7.459 1.00 0.24 C ATOM 424 O ILE A 33 -9.571 0.830 -7.420 1.00 0.24 O ATOM 425 CB ILE A 33 -12.133 -1.120 -6.820 1.00 0.28 C ATOM 426 CG1 ILE A 33 -13.079 -1.361 -5.642 1.00 0.80 C ATOM 427 CG2 ILE A 33 -12.298 -2.225 -7.856 1.00 0.77 C ATOM 428 CD1 ILE A 33 -14.544 -1.373 -6.028 1.00 0.91 C ATOM 0 H ILE A 33 -11.159 0.550 -5.047 1.00 0.21 H new ATOM 0 HA ILE A 33 -10.282 -2.036 -6.137 1.00 0.24 H new ATOM 0 HB ILE A 33 -12.390 -0.165 -7.279 1.00 0.28 H new ATOM 0 HG12 ILE A 33 -12.828 -2.313 -5.175 1.00 0.80 H new ATOM 0 HG13 ILE A 33 -12.916 -0.586 -4.893 1.00 0.80 H new ATOM 0 HG21 ILE A 33 -13.338 -2.269 -8.179 1.00 0.77 H new ATOM 0 HG22 ILE A 33 -11.660 -2.017 -8.715 1.00 0.77 H new ATOM 0 HG23 ILE A 33 -12.014 -3.181 -7.417 1.00 0.77 H new ATOM 0 HD11 ILE A 33 -15.153 -1.549 -5.141 1.00 0.91 H new ATOM 0 HD12 ILE A 33 -14.812 -0.412 -6.467 1.00 0.91 H new ATOM 0 HD13 ILE A 33 -14.723 -2.166 -6.754 1.00 0.91 H new ATOM 440 N ARG A 34 -9.439 -1.160 -8.450 1.00 0.31 N ATOM 441 CA ARG A 34 -8.730 -0.638 -9.611 1.00 0.35 C ATOM 442 C ARG A 34 -9.712 0.044 -10.555 1.00 0.36 C ATOM 443 O ARG A 34 -10.588 -0.604 -11.127 1.00 0.42 O ATOM 444 CB ARG A 34 -7.988 -1.785 -10.320 1.00 0.48 C ATOM 445 CG ARG A 34 -7.181 -1.376 -11.551 1.00 1.04 C ATOM 446 CD ARG A 34 -8.034 -1.344 -12.815 1.00 1.16 C ATOM 447 NE ARG A 34 -8.666 -2.639 -13.091 1.00 1.48 N ATOM 448 CZ ARG A 34 -9.882 -2.779 -13.628 1.00 1.79 C ATOM 449 NH1 ARG A 34 -10.591 -1.710 -13.968 1.00 2.09 N ATOM 450 NH2 ARG A 34 -10.380 -3.994 -13.842 1.00 2.47 N ATOM 0 H ARG A 34 -9.595 -2.168 -8.472 1.00 0.31 H new ATOM 0 HA ARG A 34 -7.997 0.102 -9.291 1.00 0.35 H new ATOM 0 HB2 ARG A 34 -7.315 -2.258 -9.605 1.00 0.48 H new ATOM 0 HB3 ARG A 34 -8.717 -2.539 -10.617 1.00 0.48 H new ATOM 0 HG2 ARG A 34 -6.743 -0.392 -11.385 1.00 1.04 H new ATOM 0 HG3 ARG A 34 -6.355 -2.073 -11.690 1.00 1.04 H new ATOM 0 HD2 ARG A 34 -8.805 -0.580 -12.712 1.00 1.16 H new ATOM 0 HD3 ARG A 34 -7.413 -1.057 -13.663 1.00 1.16 H new ATOM 0 HE ARG A 34 -8.145 -3.485 -12.859 1.00 1.48 H new ATOM 0 HH11 ARG A 34 -10.208 -0.776 -13.820 1.00 2.09 H new ATOM 0 HH12 ARG A 34 -11.518 -1.822 -14.377 1.00 2.09 H new ATOM 0 HH21 ARG A 34 -9.834 -4.820 -13.596 1.00 2.47 H new ATOM 0 HH22 ARG A 34 -11.308 -4.100 -14.252 1.00 2.47 H new ATOM 464 N ALA A 35 -9.573 1.356 -10.704 1.00 0.37 N ATOM 465 CA ALA A 35 -10.411 2.107 -11.626 1.00 0.46 C ATOM 466 C ALA A 35 -9.708 2.207 -12.963 1.00 0.53 C ATOM 467 O ALA A 35 -10.314 2.077 -14.026 1.00 0.63 O ATOM 468 CB ALA A 35 -10.705 3.494 -11.072 1.00 0.54 C ATOM 0 H ALA A 35 -8.889 1.919 -10.199 1.00 0.37 H new ATOM 0 HA ALA A 35 -11.362 1.590 -11.755 1.00 0.46 H new ATOM 0 HB1 ALA A 35 -11.333 4.041 -11.775 1.00 0.54 H new ATOM 0 HB2 ALA A 35 -11.224 3.402 -10.118 1.00 0.54 H new ATOM 0 HB3 ALA A 35 -9.769 4.033 -10.926 1.00 0.54 H new ATOM 474 N ASN A 36 -8.409 2.405 -12.872 1.00 0.53 N ATOM 475 CA ASN A 36 -7.536 2.527 -14.023 1.00 0.66 C ATOM 476 C ASN A 36 -6.223 1.851 -13.673 1.00 0.65 C ATOM 477 O ASN A 36 -5.950 1.602 -12.500 1.00 0.55 O ATOM 478 CB ASN A 36 -7.284 4.006 -14.361 1.00 0.76 C ATOM 479 CG ASN A 36 -8.539 4.762 -14.771 1.00 1.43 C ATOM 480 OD1 ASN A 36 -9.275 5.278 -13.926 1.00 2.25 O ATOM 481 ND2 ASN A 36 -8.772 4.864 -16.070 1.00 1.93 N ATOM 0 H ASN A 36 -7.921 2.487 -11.980 1.00 0.53 H new ATOM 0 HA ASN A 36 -7.997 2.060 -14.893 1.00 0.66 H new ATOM 0 HB2 ASN A 36 -6.841 4.497 -13.494 1.00 0.76 H new ATOM 0 HB3 ASN A 36 -6.554 4.066 -15.169 1.00 0.76 H new ATOM 0 HD21 ASN A 36 -9.584 5.384 -16.403 1.00 1.93 H new ATOM 0 HD22 ASN A 36 -8.140 4.423 -16.738 1.00 1.93 H new ATOM 488 N ASP A 37 -5.419 1.540 -14.671 1.00 0.81 N ATOM 489 CA ASP A 37 -4.125 0.903 -14.428 1.00 0.88 C ATOM 490 C ASP A 37 -3.111 1.909 -13.883 1.00 0.79 C ATOM 491 O ASP A 37 -1.977 1.554 -13.570 1.00 0.88 O ATOM 492 CB ASP A 37 -3.592 0.236 -15.704 1.00 1.10 C ATOM 493 CG ASP A 37 -3.147 1.227 -16.765 1.00 1.76 C ATOM 494 OD1 ASP A 37 -3.991 2.015 -17.247 1.00 2.10 O ATOM 495 OD2 ASP A 37 -1.956 1.206 -17.137 1.00 2.51 O ATOM 0 H ASP A 37 -5.630 1.714 -15.654 1.00 0.81 H new ATOM 0 HA ASP A 37 -4.273 0.129 -13.675 1.00 0.88 H new ATOM 0 HB2 ASP A 37 -2.752 -0.408 -15.444 1.00 1.10 H new ATOM 0 HB3 ASP A 37 -4.368 -0.406 -16.120 1.00 1.10 H new ATOM 500 N GLN A 38 -3.521 3.168 -13.790 1.00 0.68 N ATOM 501 CA GLN A 38 -2.677 4.220 -13.237 1.00 0.60 C ATOM 502 C GLN A 38 -3.362 4.911 -12.067 1.00 0.44 C ATOM 503 O GLN A 38 -2.709 5.552 -11.246 1.00 0.39 O ATOM 504 CB GLN A 38 -2.300 5.242 -14.310 1.00 0.71 C ATOM 505 CG GLN A 38 -1.237 4.736 -15.270 1.00 1.53 C ATOM 506 CD GLN A 38 0.077 4.452 -14.568 1.00 2.01 C ATOM 507 OE1 GLN A 38 0.939 5.323 -14.465 1.00 2.57 O ATOM 508 NE2 GLN A 38 0.233 3.237 -14.069 1.00 2.58 N ATOM 0 H GLN A 38 -4.441 3.487 -14.093 1.00 0.68 H new ATOM 0 HA GLN A 38 -1.763 3.752 -12.872 1.00 0.60 H new ATOM 0 HB2 GLN A 38 -3.192 5.512 -14.875 1.00 0.71 H new ATOM 0 HB3 GLN A 38 -1.941 6.151 -13.827 1.00 0.71 H new ATOM 0 HG2 GLN A 38 -1.591 3.827 -15.756 1.00 1.53 H new ATOM 0 HG3 GLN A 38 -1.076 5.475 -16.054 1.00 1.53 H new ATOM 0 HE21 GLN A 38 -0.507 2.543 -14.176 1.00 2.58 H new ATOM 0 HE22 GLN A 38 1.093 2.994 -13.577 1.00 2.58 H new ATOM 517 N TYR A 39 -4.682 4.777 -11.996 1.00 0.43 N ATOM 518 CA TYR A 39 -5.459 5.429 -10.955 1.00 0.41 C ATOM 519 C TYR A 39 -6.268 4.402 -10.177 1.00 0.34 C ATOM 520 O TYR A 39 -6.929 3.545 -10.762 1.00 0.36 O ATOM 521 CB TYR A 39 -6.404 6.477 -11.547 1.00 0.64 C ATOM 522 CG TYR A 39 -5.720 7.717 -12.083 1.00 0.92 C ATOM 523 CD1 TYR A 39 -5.148 8.646 -11.224 1.00 1.50 C ATOM 524 CD2 TYR A 39 -5.634 7.947 -13.450 1.00 1.31 C ATOM 525 CE1 TYR A 39 -4.505 9.767 -11.714 1.00 2.23 C ATOM 526 CE2 TYR A 39 -4.995 9.067 -13.947 1.00 1.97 C ATOM 527 CZ TYR A 39 -4.493 10.016 -13.059 1.00 2.39 C ATOM 528 OH TYR A 39 -3.789 11.089 -13.567 1.00 3.17 O ATOM 0 H TYR A 39 -5.234 4.221 -12.649 1.00 0.43 H new ATOM 0 HA TYR A 39 -4.761 5.928 -10.283 1.00 0.41 H new ATOM 0 HB2 TYR A 39 -6.975 6.017 -12.353 1.00 0.64 H new ATOM 0 HB3 TYR A 39 -7.119 6.776 -10.780 1.00 0.64 H new ATOM 0 HD1 TYR A 39 -5.206 8.490 -10.157 1.00 1.50 H new ATOM 0 HD2 TYR A 39 -6.074 7.239 -14.136 1.00 1.31 H new ATOM 0 HE1 TYR A 39 -4.012 10.447 -11.035 1.00 2.23 H new ATOM 0 HE2 TYR A 39 -4.886 9.205 -15.013 1.00 1.97 H new ATOM 0 HH TYR A 39 -3.890 11.114 -14.541 1.00 3.17 H new ATOM 538 N LEU A 40 -6.235 4.501 -8.866 1.00 0.31 N ATOM 539 CA LEU A 40 -6.972 3.582 -8.018 1.00 0.28 C ATOM 540 C LEU A 40 -7.934 4.351 -7.137 1.00 0.25 C ATOM 541 O LEU A 40 -7.566 5.355 -6.533 1.00 0.29 O ATOM 542 CB LEU A 40 -6.013 2.756 -7.162 1.00 0.30 C ATOM 543 CG LEU A 40 -6.247 1.249 -7.219 1.00 0.51 C ATOM 544 CD1 LEU A 40 -5.952 0.726 -8.613 1.00 1.21 C ATOM 545 CD2 LEU A 40 -5.388 0.527 -6.195 1.00 1.31 C ATOM 0 H LEU A 40 -5.705 5.210 -8.360 1.00 0.31 H new ATOM 0 HA LEU A 40 -7.540 2.900 -8.651 1.00 0.28 H new ATOM 0 HB2 LEU A 40 -4.992 2.964 -7.481 1.00 0.30 H new ATOM 0 HB3 LEU A 40 -6.097 3.084 -6.126 1.00 0.30 H new ATOM 0 HG LEU A 40 -7.293 1.057 -6.982 1.00 0.51 H new ATOM 0 HD11 LEU A 40 -6.122 -0.350 -8.641 1.00 1.21 H new ATOM 0 HD12 LEU A 40 -6.608 1.216 -9.332 1.00 1.21 H new ATOM 0 HD13 LEU A 40 -4.913 0.936 -8.868 1.00 1.21 H new ATOM 0 HD21 LEU A 40 -5.573 -0.545 -6.256 1.00 1.31 H new ATOM 0 HD22 LEU A 40 -4.336 0.725 -6.398 1.00 1.31 H new ATOM 0 HD23 LEU A 40 -5.638 0.882 -5.195 1.00 1.31 H new ATOM 557 N THR A 41 -9.165 3.879 -7.069 1.00 0.24 N ATOM 558 CA THR A 41 -10.186 4.554 -6.305 1.00 0.22 C ATOM 559 C THR A 41 -10.837 3.561 -5.355 1.00 0.19 C ATOM 560 O THR A 41 -11.117 2.414 -5.709 1.00 0.21 O ATOM 561 CB THR A 41 -11.240 5.215 -7.229 1.00 0.27 C ATOM 562 OG1 THR A 41 -12.046 6.137 -6.486 1.00 1.36 O ATOM 563 CG2 THR A 41 -12.139 4.181 -7.893 1.00 1.28 C ATOM 0 H THR A 41 -9.478 3.028 -7.537 1.00 0.24 H new ATOM 0 HA THR A 41 -9.724 5.355 -5.727 1.00 0.22 H new ATOM 0 HB THR A 41 -10.696 5.746 -8.010 1.00 0.27 H new ATOM 0 HG1 THR A 41 -11.480 6.635 -5.860 1.00 1.36 H new ATOM 0 HG21 THR A 41 -12.864 4.686 -8.532 1.00 1.28 H new ATOM 0 HG22 THR A 41 -11.532 3.505 -8.496 1.00 1.28 H new ATOM 0 HG23 THR A 41 -12.665 3.611 -7.127 1.00 1.28 H new ATOM 571 N ALA A 42 -11.040 4.000 -4.143 1.00 0.19 N ATOM 572 CA ALA A 42 -11.609 3.165 -3.110 1.00 0.20 C ATOM 573 C ALA A 42 -13.130 3.284 -3.083 1.00 0.20 C ATOM 574 O ALA A 42 -13.685 4.370 -3.265 1.00 0.27 O ATOM 575 CB ALA A 42 -11.003 3.528 -1.765 1.00 0.26 C ATOM 0 H ALA A 42 -10.817 4.948 -3.839 1.00 0.19 H new ATOM 0 HA ALA A 42 -11.371 2.124 -3.329 1.00 0.20 H new ATOM 0 HB1 ALA A 42 -11.435 2.896 -0.989 1.00 0.26 H new ATOM 0 HB2 ALA A 42 -9.924 3.375 -1.799 1.00 0.26 H new ATOM 0 HB3 ALA A 42 -11.215 4.574 -1.541 1.00 0.26 H new ATOM 581 N ALA A 43 -13.792 2.154 -2.876 1.00 0.20 N ATOM 582 CA ALA A 43 -15.254 2.109 -2.789 1.00 0.29 C ATOM 583 C ALA A 43 -15.693 0.987 -1.850 1.00 0.35 C ATOM 584 O ALA A 43 -15.183 -0.128 -1.936 1.00 0.40 O ATOM 585 CB ALA A 43 -15.855 1.914 -4.173 1.00 0.38 C ATOM 0 H ALA A 43 -13.340 1.247 -2.764 1.00 0.20 H new ATOM 0 HA ALA A 43 -15.613 3.056 -2.386 1.00 0.29 H new ATOM 0 HB1 ALA A 43 -16.942 1.882 -4.096 1.00 0.38 H new ATOM 0 HB2 ALA A 43 -15.561 2.742 -4.817 1.00 0.38 H new ATOM 0 HB3 ALA A 43 -15.493 0.978 -4.598 1.00 0.38 H new ATOM 591 N ALA A 44 -16.638 1.278 -0.951 1.00 0.63 N ATOM 592 CA ALA A 44 -17.021 0.324 0.082 1.00 0.65 C ATOM 593 C ALA A 44 -17.643 -0.936 -0.500 1.00 0.46 C ATOM 594 O ALA A 44 -18.688 -0.894 -1.149 1.00 0.79 O ATOM 595 CB ALA A 44 -17.997 0.969 1.051 1.00 1.13 C ATOM 0 H ALA A 44 -17.146 2.162 -0.921 1.00 0.63 H new ATOM 0 HA ALA A 44 -16.110 0.034 0.606 1.00 0.65 H new ATOM 0 HB1 ALA A 44 -18.277 0.248 1.819 1.00 1.13 H new ATOM 0 HB2 ALA A 44 -17.527 1.834 1.519 1.00 1.13 H new ATOM 0 HB3 ALA A 44 -18.888 1.289 0.511 1.00 1.13 H new ATOM 601 N LEU A 45 -16.981 -2.049 -0.258 1.00 0.47 N ATOM 602 CA LEU A 45 -17.499 -3.359 -0.562 1.00 0.66 C ATOM 603 C LEU A 45 -18.428 -3.866 0.524 1.00 0.62 C ATOM 604 O LEU A 45 -18.367 -3.430 1.674 1.00 0.88 O ATOM 605 CB LEU A 45 -16.374 -4.356 -0.826 1.00 1.23 C ATOM 606 CG LEU A 45 -16.096 -4.595 -2.309 1.00 2.25 C ATOM 607 CD1 LEU A 45 -17.379 -4.990 -3.017 1.00 2.87 C ATOM 608 CD2 LEU A 45 -15.499 -3.356 -2.959 1.00 2.93 C ATOM 0 H LEU A 45 -16.052 -2.064 0.163 1.00 0.47 H new ATOM 0 HA LEU A 45 -18.085 -3.264 -1.476 1.00 0.66 H new ATOM 0 HB2 LEU A 45 -15.463 -3.996 -0.349 1.00 1.23 H new ATOM 0 HB3 LEU A 45 -16.626 -5.306 -0.356 1.00 1.23 H new ATOM 0 HG LEU A 45 -15.372 -5.405 -2.397 1.00 2.25 H new ATOM 0 HD11 LEU A 45 -17.174 -5.159 -4.074 1.00 2.87 H new ATOM 0 HD12 LEU A 45 -17.773 -5.904 -2.573 1.00 2.87 H new ATOM 0 HD13 LEU A 45 -18.113 -4.191 -2.913 1.00 2.87 H new ATOM 0 HD21 LEU A 45 -15.311 -3.554 -4.014 1.00 2.93 H new ATOM 0 HD22 LEU A 45 -16.196 -2.524 -2.864 1.00 2.93 H new ATOM 0 HD23 LEU A 45 -14.561 -3.102 -2.465 1.00 2.93 H new ATOM 620 N HIS A 46 -19.279 -4.793 0.142 1.00 0.61 N ATOM 621 CA HIS A 46 -20.122 -5.503 1.086 1.00 0.80 C ATOM 622 C HIS A 46 -20.052 -6.986 0.737 1.00 0.76 C ATOM 623 O HIS A 46 -20.431 -7.850 1.529 1.00 0.94 O ATOM 624 CB HIS A 46 -21.570 -5.002 1.026 1.00 1.06 C ATOM 625 CG HIS A 46 -22.395 -5.441 2.197 1.00 1.87 C ATOM 626 ND1 HIS A 46 -23.394 -6.387 2.114 1.00 2.69 N ATOM 627 CD2 HIS A 46 -22.354 -5.056 3.495 1.00 2.79 C ATOM 628 CE1 HIS A 46 -23.930 -6.564 3.308 1.00 3.63 C ATOM 629 NE2 HIS A 46 -23.316 -5.770 4.164 1.00 3.71 N ATOM 0 H HIS A 46 -19.408 -5.077 -0.829 1.00 0.61 H new ATOM 0 HA HIS A 46 -19.770 -5.330 2.103 1.00 0.80 H new ATOM 0 HB2 HIS A 46 -21.569 -3.913 0.978 1.00 1.06 H new ATOM 0 HB3 HIS A 46 -22.034 -5.361 0.108 1.00 1.06 H new ATOM 0 HD2 HIS A 46 -21.687 -4.323 3.924 1.00 2.79 H new ATOM 0 HE1 HIS A 46 -24.735 -7.244 3.544 1.00 3.63 H new ATOM 0 HE2 HIS A 46 -23.523 -5.699 5.160 1.00 3.71 H new ATOM 638 N ASN A 47 -19.551 -7.262 -0.465 1.00 0.66 N ATOM 639 CA ASN A 47 -19.104 -8.603 -0.837 1.00 0.71 C ATOM 640 C ASN A 47 -17.695 -8.845 -0.303 1.00 0.76 C ATOM 641 O ASN A 47 -17.172 -9.957 -0.369 1.00 0.88 O ATOM 642 CB ASN A 47 -19.027 -8.692 -2.352 1.00 0.74 C ATOM 643 CG ASN A 47 -18.810 -10.101 -2.865 1.00 1.42 C ATOM 644 OD1 ASN A 47 -19.275 -11.075 -2.272 1.00 2.21 O ATOM 645 ND2 ASN A 47 -18.097 -10.217 -3.974 1.00 1.94 N ATOM 0 H ASN A 47 -19.444 -6.568 -1.204 1.00 0.66 H new ATOM 0 HA ASN A 47 -19.801 -9.334 -0.427 1.00 0.71 H new ATOM 0 HB2 ASN A 47 -19.949 -8.297 -2.778 1.00 0.74 H new ATOM 0 HB3 ASN A 47 -18.215 -8.056 -2.704 1.00 0.74 H new ATOM 0 HD21 ASN A 47 -17.914 -11.140 -4.369 1.00 1.94 H new ATOM 0 HD22 ASN A 47 -17.730 -9.384 -4.434 1.00 1.94 H new ATOM 652 N LEU A 48 -17.115 -7.790 0.264 1.00 0.77 N ATOM 653 CA LEU A 48 -15.739 -7.780 0.739 1.00 0.89 C ATOM 654 C LEU A 48 -14.741 -7.924 -0.423 1.00 0.81 C ATOM 655 O LEU A 48 -14.077 -6.955 -0.788 1.00 0.78 O ATOM 656 CB LEU A 48 -15.564 -8.858 1.807 1.00 1.15 C ATOM 657 CG LEU A 48 -16.479 -8.666 3.024 1.00 1.37 C ATOM 658 CD1 LEU A 48 -16.772 -9.989 3.708 1.00 1.71 C ATOM 659 CD2 LEU A 48 -15.847 -7.695 4.009 1.00 1.66 C ATOM 0 H LEU A 48 -17.599 -6.904 0.408 1.00 0.77 H new ATOM 0 HA LEU A 48 -15.521 -6.815 1.197 1.00 0.89 H new ATOM 0 HB2 LEU A 48 -15.762 -9.834 1.363 1.00 1.15 H new ATOM 0 HB3 LEU A 48 -14.526 -8.864 2.140 1.00 1.15 H new ATOM 0 HG LEU A 48 -17.424 -8.253 2.672 1.00 1.37 H new ATOM 0 HD11 LEU A 48 -17.422 -9.819 4.566 1.00 1.71 H new ATOM 0 HD12 LEU A 48 -17.266 -10.660 3.006 1.00 1.71 H new ATOM 0 HD13 LEU A 48 -15.838 -10.439 4.044 1.00 1.71 H new ATOM 0 HD21 LEU A 48 -16.506 -7.567 4.868 1.00 1.66 H new ATOM 0 HD22 LEU A 48 -14.887 -8.089 4.343 1.00 1.66 H new ATOM 0 HD23 LEU A 48 -15.694 -6.732 3.523 1.00 1.66 H new ATOM 671 N ASP A 49 -14.669 -9.102 -1.032 1.00 0.83 N ATOM 672 CA ASP A 49 -13.731 -9.348 -2.139 1.00 0.83 C ATOM 673 C ASP A 49 -14.318 -8.941 -3.489 1.00 0.75 C ATOM 674 O ASP A 49 -14.971 -9.734 -4.170 1.00 0.83 O ATOM 675 CB ASP A 49 -13.288 -10.812 -2.185 1.00 1.00 C ATOM 676 CG ASP A 49 -12.492 -11.151 -3.437 1.00 1.20 C ATOM 677 OD1 ASP A 49 -11.509 -10.447 -3.733 1.00 1.53 O ATOM 678 OD2 ASP A 49 -12.847 -12.132 -4.129 1.00 1.87 O ATOM 0 H ASP A 49 -15.245 -9.906 -0.784 1.00 0.83 H new ATOM 0 HA ASP A 49 -12.858 -8.724 -1.946 1.00 0.83 H new ATOM 0 HB2 ASP A 49 -12.683 -11.031 -1.305 1.00 1.00 H new ATOM 0 HB3 ASP A 49 -14.167 -11.454 -2.135 1.00 1.00 H new ATOM 683 N GLU A 50 -14.137 -7.686 -3.836 1.00 0.66 N ATOM 684 CA GLU A 50 -14.465 -7.196 -5.169 1.00 0.72 C ATOM 685 C GLU A 50 -13.481 -6.099 -5.540 1.00 0.62 C ATOM 686 O GLU A 50 -13.203 -5.851 -6.714 1.00 0.68 O ATOM 687 CB GLU A 50 -15.904 -6.700 -5.253 1.00 0.94 C ATOM 688 CG GLU A 50 -16.398 -6.526 -6.679 1.00 1.25 C ATOM 689 CD GLU A 50 -17.853 -6.120 -6.747 1.00 1.93 C ATOM 690 OE1 GLU A 50 -18.725 -6.977 -6.498 1.00 2.66 O ATOM 691 OE2 GLU A 50 -18.134 -4.945 -7.063 1.00 2.35 O ATOM 0 H GLU A 50 -13.760 -6.974 -3.210 1.00 0.66 H new ATOM 0 HA GLU A 50 -14.382 -8.018 -5.880 1.00 0.72 H new ATOM 0 HB2 GLU A 50 -16.554 -7.404 -4.734 1.00 0.94 H new ATOM 0 HB3 GLU A 50 -15.984 -5.747 -4.730 1.00 0.94 H new ATOM 0 HG2 GLU A 50 -15.791 -5.772 -7.180 1.00 1.25 H new ATOM 0 HG3 GLU A 50 -16.260 -7.460 -7.224 1.00 1.25 H new ATOM 698 N ALA A 51 -12.945 -5.456 -4.513 1.00 0.52 N ATOM 699 CA ALA A 51 -11.873 -4.497 -4.683 1.00 0.43 C ATOM 700 C ALA A 51 -10.575 -5.255 -4.869 1.00 0.32 C ATOM 701 O ALA A 51 -10.498 -6.437 -4.533 1.00 0.33 O ATOM 702 CB ALA A 51 -11.773 -3.607 -3.466 1.00 0.50 C ATOM 0 H ALA A 51 -13.241 -5.586 -3.546 1.00 0.52 H new ATOM 0 HA ALA A 51 -12.072 -3.873 -5.554 1.00 0.43 H new ATOM 0 HB1 ALA A 51 -10.964 -2.890 -3.605 1.00 0.50 H new ATOM 0 HB2 ALA A 51 -12.712 -3.072 -3.329 1.00 0.50 H new ATOM 0 HB3 ALA A 51 -11.570 -4.216 -2.585 1.00 0.50 H new ATOM 708 N VAL A 52 -9.565 -4.598 -5.410 1.00 0.28 N ATOM 709 CA VAL A 52 -8.331 -5.285 -5.711 1.00 0.26 C ATOM 710 C VAL A 52 -7.597 -5.628 -4.430 1.00 0.22 C ATOM 711 O VAL A 52 -7.350 -4.785 -3.565 1.00 0.23 O ATOM 712 CB VAL A 52 -7.411 -4.486 -6.664 1.00 0.29 C ATOM 713 CG1 VAL A 52 -8.000 -4.456 -8.066 1.00 0.38 C ATOM 714 CG2 VAL A 52 -7.184 -3.072 -6.156 1.00 0.31 C ATOM 0 H VAL A 52 -9.577 -3.606 -5.645 1.00 0.28 H new ATOM 0 HA VAL A 52 -8.600 -6.202 -6.235 1.00 0.26 H new ATOM 0 HB VAL A 52 -6.445 -4.989 -6.697 1.00 0.29 H new ATOM 0 HG11 VAL A 52 -7.342 -3.890 -8.725 1.00 0.38 H new ATOM 0 HG12 VAL A 52 -8.100 -5.475 -8.440 1.00 0.38 H new ATOM 0 HG13 VAL A 52 -8.981 -3.981 -8.038 1.00 0.38 H new ATOM 0 HG21 VAL A 52 -6.534 -2.537 -6.848 1.00 0.31 H new ATOM 0 HG22 VAL A 52 -8.140 -2.554 -6.082 1.00 0.31 H new ATOM 0 HG23 VAL A 52 -6.715 -3.110 -5.173 1.00 0.31 H new ATOM 724 N LYS A 53 -7.272 -6.893 -4.334 1.00 0.22 N ATOM 725 CA LYS A 53 -6.653 -7.458 -3.146 1.00 0.22 C ATOM 726 C LYS A 53 -5.161 -7.498 -3.292 1.00 0.18 C ATOM 727 O LYS A 53 -4.605 -8.015 -4.263 1.00 0.24 O ATOM 728 CB LYS A 53 -7.228 -8.846 -2.831 1.00 0.35 C ATOM 729 CG LYS A 53 -7.439 -9.752 -4.032 1.00 0.78 C ATOM 730 CD LYS A 53 -8.417 -10.864 -3.683 1.00 1.12 C ATOM 731 CE LYS A 53 -8.761 -11.729 -4.883 1.00 1.37 C ATOM 732 NZ LYS A 53 -7.875 -12.916 -4.988 1.00 1.59 N ATOM 0 H LYS A 53 -7.428 -7.571 -5.080 1.00 0.22 H new ATOM 0 HA LYS A 53 -6.885 -6.811 -2.300 1.00 0.22 H new ATOM 0 HB2 LYS A 53 -6.559 -9.348 -2.132 1.00 0.35 H new ATOM 0 HB3 LYS A 53 -8.183 -8.718 -2.322 1.00 0.35 H new ATOM 0 HG2 LYS A 53 -7.821 -9.172 -4.872 1.00 0.78 H new ATOM 0 HG3 LYS A 53 -6.487 -10.180 -4.346 1.00 0.78 H new ATOM 0 HD2 LYS A 53 -7.988 -11.488 -2.899 1.00 1.12 H new ATOM 0 HD3 LYS A 53 -9.330 -10.427 -3.279 1.00 1.12 H new ATOM 0 HE2 LYS A 53 -9.798 -12.057 -4.808 1.00 1.37 H new ATOM 0 HE3 LYS A 53 -8.680 -11.135 -5.793 1.00 1.37 H new ATOM 0 HZ1 LYS A 53 -8.255 -13.571 -5.700 1.00 1.59 H new ATOM 0 HZ2 LYS A 53 -6.921 -12.613 -5.271 1.00 1.59 H new ATOM 0 HZ3 LYS A 53 -7.827 -13.396 -4.067 1.00 1.59 H new ATOM 746 N PHE A 54 -4.528 -6.916 -2.302 1.00 0.18 N ATOM 747 CA PHE A 54 -3.136 -6.624 -2.347 1.00 0.19 C ATOM 748 C PHE A 54 -2.357 -7.639 -1.550 1.00 0.20 C ATOM 749 O PHE A 54 -2.922 -8.499 -0.873 1.00 0.23 O ATOM 750 CB PHE A 54 -2.862 -5.188 -1.863 1.00 0.25 C ATOM 751 CG PHE A 54 -3.155 -4.914 -0.413 1.00 1.22 C ATOM 752 CD1 PHE A 54 -4.397 -5.187 0.135 1.00 1.57 C ATOM 753 CD2 PHE A 54 -2.184 -4.341 0.393 1.00 1.95 C ATOM 754 CE1 PHE A 54 -4.662 -4.901 1.459 1.00 2.60 C ATOM 755 CE2 PHE A 54 -2.443 -4.056 1.719 1.00 2.98 C ATOM 756 CZ PHE A 54 -3.684 -4.333 2.251 1.00 3.31 C ATOM 0 H PHE A 54 -4.982 -6.632 -1.434 1.00 0.18 H new ATOM 0 HA PHE A 54 -2.800 -6.688 -3.382 1.00 0.19 H new ATOM 0 HB2 PHE A 54 -1.814 -4.956 -2.052 1.00 0.25 H new ATOM 0 HB3 PHE A 54 -3.454 -4.502 -2.469 1.00 0.25 H new ATOM 0 HD1 PHE A 54 -5.167 -5.629 -0.480 1.00 1.57 H new ATOM 0 HD2 PHE A 54 -1.213 -4.115 -0.021 1.00 1.95 H new ATOM 0 HE1 PHE A 54 -5.634 -5.121 1.875 1.00 2.60 H new ATOM 0 HE2 PHE A 54 -1.675 -3.617 2.338 1.00 2.98 H new ATOM 0 HZ PHE A 54 -3.891 -4.106 3.286 1.00 3.31 H new ATOM 766 N ASP A 55 -1.067 -7.544 -1.683 1.00 0.21 N ATOM 767 CA ASP A 55 -0.143 -8.404 -0.980 1.00 0.22 C ATOM 768 C ASP A 55 0.999 -7.576 -0.441 1.00 0.23 C ATOM 769 O ASP A 55 1.574 -6.745 -1.149 1.00 0.27 O ATOM 770 CB ASP A 55 0.396 -9.474 -1.937 1.00 0.24 C ATOM 771 CG ASP A 55 1.760 -10.017 -1.535 1.00 1.33 C ATOM 772 OD1 ASP A 55 1.825 -10.804 -0.565 1.00 1.89 O ATOM 773 OD2 ASP A 55 2.769 -9.630 -2.155 1.00 1.93 O ATOM 0 H ASP A 55 -0.614 -6.860 -2.289 1.00 0.21 H new ATOM 0 HA ASP A 55 -0.657 -8.893 -0.153 1.00 0.22 H new ATOM 0 HB2 ASP A 55 -0.315 -10.299 -1.985 1.00 0.24 H new ATOM 0 HB3 ASP A 55 0.463 -9.053 -2.940 1.00 0.24 H new ATOM 778 N MET A 56 1.270 -7.775 0.836 1.00 0.24 N ATOM 779 CA MET A 56 2.328 -7.084 1.514 1.00 0.25 C ATOM 780 C MET A 56 3.452 -8.049 1.790 1.00 0.25 C ATOM 781 O MET A 56 3.225 -9.173 2.231 1.00 0.30 O ATOM 782 CB MET A 56 1.829 -6.491 2.835 1.00 0.33 C ATOM 783 CG MET A 56 0.634 -5.567 2.690 1.00 0.97 C ATOM 784 SD MET A 56 0.160 -4.793 4.253 1.00 1.19 S ATOM 785 CE MET A 56 -0.115 -6.224 5.295 1.00 1.85 C ATOM 0 H MET A 56 0.754 -8.426 1.427 1.00 0.24 H new ATOM 0 HA MET A 56 2.680 -6.270 0.880 1.00 0.25 H new ATOM 0 HB2 MET A 56 1.564 -7.306 3.509 1.00 0.33 H new ATOM 0 HB3 MET A 56 2.645 -5.941 3.304 1.00 0.33 H new ATOM 0 HG2 MET A 56 0.866 -4.791 1.960 1.00 0.97 H new ATOM 0 HG3 MET A 56 -0.212 -6.132 2.297 1.00 0.97 H new ATOM 0 HE1 MET A 56 -1.049 -6.100 5.844 1.00 1.85 H new ATOM 0 HE2 MET A 56 -0.174 -7.119 4.676 1.00 1.85 H new ATOM 0 HE3 MET A 56 0.710 -6.324 6.000 1.00 1.85 H new ATOM 795 N GLY A 57 4.652 -7.619 1.515 1.00 0.26 N ATOM 796 CA GLY A 57 5.806 -8.365 1.904 1.00 0.32 C ATOM 797 C GLY A 57 6.851 -7.404 2.377 1.00 0.31 C ATOM 798 O GLY A 57 7.182 -6.473 1.655 1.00 0.35 O ATOM 0 H GLY A 57 4.852 -6.750 1.020 1.00 0.26 H new ATOM 0 HA2 GLY A 57 5.553 -9.070 2.696 1.00 0.32 H new ATOM 0 HA3 GLY A 57 6.181 -8.950 1.064 1.00 0.32 H new ATOM 802 N ALA A 58 7.393 -7.588 3.550 1.00 0.37 N ATOM 803 CA ALA A 58 8.267 -6.574 4.090 1.00 0.38 C ATOM 804 C ALA A 58 9.652 -6.787 3.544 1.00 0.42 C ATOM 805 O ALA A 58 10.036 -7.907 3.242 1.00 0.61 O ATOM 806 CB ALA A 58 8.273 -6.624 5.610 1.00 0.51 C ATOM 0 H ALA A 58 7.253 -8.408 4.140 1.00 0.37 H new ATOM 0 HA ALA A 58 7.908 -5.588 3.795 1.00 0.38 H new ATOM 0 HB1 ALA A 58 8.938 -5.852 5.997 1.00 0.51 H new ATOM 0 HB2 ALA A 58 7.263 -6.454 5.984 1.00 0.51 H new ATOM 0 HB3 ALA A 58 8.622 -7.602 5.940 1.00 0.51 H new ATOM 812 N TYR A 59 10.386 -5.726 3.340 1.00 0.45 N ATOM 813 CA TYR A 59 11.747 -5.915 2.874 1.00 0.61 C ATOM 814 C TYR A 59 12.745 -5.215 3.762 1.00 0.72 C ATOM 815 O TYR A 59 12.404 -4.313 4.527 1.00 0.81 O ATOM 816 CB TYR A 59 11.952 -5.600 1.382 1.00 0.93 C ATOM 817 CG TYR A 59 11.612 -4.208 0.893 1.00 1.64 C ATOM 818 CD1 TYR A 59 12.542 -3.179 0.943 1.00 2.54 C ATOM 819 CD2 TYR A 59 10.385 -3.949 0.303 1.00 2.01 C ATOM 820 CE1 TYR A 59 12.247 -1.925 0.435 1.00 3.70 C ATOM 821 CE2 TYR A 59 10.086 -2.706 -0.218 1.00 3.08 C ATOM 822 CZ TYR A 59 11.020 -1.698 -0.153 1.00 3.92 C ATOM 823 OH TYR A 59 10.724 -0.460 -0.674 1.00 5.11 O ATOM 0 H TYR A 59 10.089 -4.760 3.479 1.00 0.45 H new ATOM 0 HA TYR A 59 11.939 -6.985 2.954 1.00 0.61 H new ATOM 0 HB2 TYR A 59 12.998 -5.792 1.142 1.00 0.93 H new ATOM 0 HB3 TYR A 59 11.358 -6.310 0.807 1.00 0.93 H new ATOM 0 HD1 TYR A 59 13.511 -3.359 1.385 1.00 2.54 H new ATOM 0 HD2 TYR A 59 9.647 -4.736 0.250 1.00 2.01 H new ATOM 0 HE1 TYR A 59 12.974 -1.129 0.499 1.00 3.70 H new ATOM 0 HE2 TYR A 59 9.124 -2.526 -0.674 1.00 3.08 H new ATOM 0 HH TYR A 59 10.101 -0.561 -1.424 1.00 5.11 H new ATOM 833 N LYS A 60 13.984 -5.637 3.637 1.00 0.92 N ATOM 834 CA LYS A 60 14.931 -5.509 4.718 1.00 1.13 C ATOM 835 C LYS A 60 16.239 -4.858 4.304 1.00 1.50 C ATOM 836 O LYS A 60 16.947 -5.329 3.413 1.00 1.77 O ATOM 837 CB LYS A 60 15.244 -6.926 5.196 1.00 1.30 C ATOM 838 CG LYS A 60 16.074 -6.999 6.469 1.00 1.66 C ATOM 839 CD LYS A 60 16.229 -8.436 6.957 1.00 2.14 C ATOM 840 CE LYS A 60 16.705 -9.377 5.855 1.00 2.79 C ATOM 841 NZ LYS A 60 18.032 -8.994 5.300 1.00 3.47 N ATOM 0 H LYS A 60 14.358 -6.073 2.794 1.00 0.92 H new ATOM 0 HA LYS A 60 14.488 -4.874 5.485 1.00 1.13 H new ATOM 0 HB2 LYS A 60 14.305 -7.455 5.360 1.00 1.30 H new ATOM 0 HB3 LYS A 60 15.773 -7.454 4.403 1.00 1.30 H new ATOM 0 HG2 LYS A 60 17.058 -6.568 6.287 1.00 1.66 H new ATOM 0 HG3 LYS A 60 15.602 -6.399 7.247 1.00 1.66 H new ATOM 0 HD2 LYS A 60 16.939 -8.461 7.784 1.00 2.14 H new ATOM 0 HD3 LYS A 60 15.274 -8.790 7.346 1.00 2.14 H new ATOM 0 HE2 LYS A 60 16.761 -10.392 6.249 1.00 2.79 H new ATOM 0 HE3 LYS A 60 15.970 -9.388 5.051 1.00 2.79 H new ATOM 0 HZ1 LYS A 60 17.922 -8.702 4.308 1.00 3.47 H new ATOM 0 HZ2 LYS A 60 18.424 -8.205 5.852 1.00 3.47 H new ATOM 0 HZ3 LYS A 60 18.678 -9.807 5.352 1.00 3.47 H new ATOM 855 N SER A 61 16.512 -3.744 4.946 1.00 1.67 N ATOM 856 CA SER A 61 17.842 -3.194 5.077 1.00 2.15 C ATOM 857 C SER A 61 17.901 -2.535 6.443 1.00 2.02 C ATOM 858 O SER A 61 16.857 -2.183 6.979 1.00 1.72 O ATOM 859 CB SER A 61 18.118 -2.178 3.969 1.00 2.67 C ATOM 860 OG SER A 61 18.009 -2.786 2.697 1.00 3.06 O ATOM 0 H SER A 61 15.795 -3.181 5.404 1.00 1.67 H new ATOM 0 HA SER A 61 18.601 -3.971 4.986 1.00 2.15 H new ATOM 0 HB2 SER A 61 17.413 -1.350 4.044 1.00 2.67 H new ATOM 0 HB3 SER A 61 19.116 -1.759 4.093 1.00 2.67 H new ATOM 0 HG SER A 61 17.786 -3.734 2.806 1.00 3.06 H new ATOM 866 N SER A 62 19.071 -2.358 7.026 1.00 2.37 N ATOM 867 CA SER A 62 19.135 -1.533 8.220 1.00 2.25 C ATOM 868 C SER A 62 19.407 -0.089 7.811 1.00 2.37 C ATOM 869 O SER A 62 20.246 0.595 8.397 1.00 2.59 O ATOM 870 CB SER A 62 20.236 -2.043 9.157 1.00 2.65 C ATOM 871 OG SER A 62 20.062 -3.420 9.449 1.00 2.99 O ATOM 0 H SER A 62 19.956 -2.755 6.711 1.00 2.37 H new ATOM 0 HA SER A 62 18.186 -1.584 8.753 1.00 2.25 H new ATOM 0 HB2 SER A 62 21.211 -1.886 8.696 1.00 2.65 H new ATOM 0 HB3 SER A 62 20.225 -1.468 10.083 1.00 2.65 H new ATOM 0 HG SER A 62 20.778 -3.721 10.047 1.00 2.99 H new ATOM 877 N LYS A 63 18.698 0.359 6.776 1.00 2.37 N ATOM 878 CA LYS A 63 18.830 1.722 6.294 1.00 2.64 C ATOM 879 C LYS A 63 17.472 2.432 6.242 1.00 2.48 C ATOM 880 O LYS A 63 17.247 3.279 5.376 1.00 2.87 O ATOM 881 CB LYS A 63 19.483 1.692 4.905 1.00 3.20 C ATOM 882 CG LYS A 63 19.969 3.044 4.403 1.00 3.62 C ATOM 883 CD LYS A 63 20.497 2.941 2.983 1.00 4.18 C ATOM 884 CE LYS A 63 20.889 4.301 2.427 1.00 4.77 C ATOM 885 NZ LYS A 63 19.743 5.249 2.407 1.00 5.27 N ATOM 0 H LYS A 63 18.026 -0.208 6.258 1.00 2.37 H new ATOM 0 HA LYS A 63 19.457 2.286 6.984 1.00 2.64 H new ATOM 0 HB2 LYS A 63 20.328 1.004 4.930 1.00 3.20 H new ATOM 0 HB3 LYS A 63 18.766 1.290 4.190 1.00 3.20 H new ATOM 0 HG2 LYS A 63 19.152 3.764 4.439 1.00 3.62 H new ATOM 0 HG3 LYS A 63 20.754 3.419 5.060 1.00 3.62 H new ATOM 0 HD2 LYS A 63 21.362 2.277 2.964 1.00 4.18 H new ATOM 0 HD3 LYS A 63 19.736 2.492 2.344 1.00 4.18 H new ATOM 0 HE2 LYS A 63 21.695 4.720 3.030 1.00 4.77 H new ATOM 0 HE3 LYS A 63 21.277 4.180 1.416 1.00 4.77 H new ATOM 0 HZ1 LYS A 63 19.961 6.044 1.773 1.00 5.27 H new ATOM 0 HZ2 LYS A 63 18.892 4.758 2.066 1.00 5.27 H new ATOM 0 HZ3 LYS A 63 19.573 5.609 3.368 1.00 5.27 H new ATOM 899 N ASP A 64 16.550 2.093 7.136 1.00 2.02 N ATOM 900 CA ASP A 64 15.274 2.806 7.160 1.00 2.02 C ATOM 901 C ASP A 64 15.441 4.095 7.963 1.00 2.36 C ATOM 902 O ASP A 64 16.343 4.889 7.693 1.00 2.81 O ATOM 903 CB ASP A 64 14.187 1.933 7.788 1.00 1.53 C ATOM 904 CG ASP A 64 14.144 0.522 7.223 1.00 1.63 C ATOM 905 OD1 ASP A 64 13.460 0.294 6.200 1.00 1.88 O ATOM 906 OD2 ASP A 64 14.794 -0.368 7.814 1.00 1.89 O ATOM 0 H ASP A 64 16.653 1.355 7.833 1.00 2.02 H new ATOM 0 HA ASP A 64 14.973 3.044 6.140 1.00 2.02 H new ATOM 0 HB2 ASP A 64 14.350 1.881 8.864 1.00 1.53 H new ATOM 0 HB3 ASP A 64 13.217 2.407 7.636 1.00 1.53 H new ATOM 911 N ASP A 65 14.586 4.308 8.960 1.00 2.27 N ATOM 912 CA ASP A 65 14.926 5.174 10.086 1.00 2.65 C ATOM 913 C ASP A 65 14.679 4.417 11.384 1.00 2.35 C ATOM 914 O ASP A 65 15.581 3.836 11.988 1.00 2.28 O ATOM 915 CB ASP A 65 14.105 6.471 10.095 1.00 3.22 C ATOM 916 CG ASP A 65 14.125 7.222 8.782 1.00 3.59 C ATOM 917 OD1 ASP A 65 15.214 7.613 8.321 1.00 4.06 O ATOM 918 OD2 ASP A 65 13.037 7.446 8.216 1.00 3.75 O ATOM 0 H ASP A 65 13.655 3.894 9.011 1.00 2.27 H new ATOM 0 HA ASP A 65 15.976 5.451 9.987 1.00 2.65 H new ATOM 0 HB2 ASP A 65 13.072 6.233 10.350 1.00 3.22 H new ATOM 0 HB3 ASP A 65 14.485 7.124 10.881 1.00 3.22 H new ATOM 923 N ALA A 66 13.404 4.431 11.779 1.00 2.40 N ATOM 924 CA ALA A 66 12.889 3.684 12.918 1.00 2.34 C ATOM 925 C ALA A 66 11.637 2.919 12.502 1.00 2.24 C ATOM 926 O ALA A 66 10.821 2.528 13.334 1.00 2.63 O ATOM 927 CB ALA A 66 12.584 4.616 14.076 1.00 2.98 C ATOM 0 H ALA A 66 12.687 4.977 11.301 1.00 2.40 H new ATOM 0 HA ALA A 66 13.647 2.974 13.249 1.00 2.34 H new ATOM 0 HB1 ALA A 66 12.200 4.038 14.917 1.00 2.98 H new ATOM 0 HB2 ALA A 66 13.495 5.133 14.377 1.00 2.98 H new ATOM 0 HB3 ALA A 66 11.837 5.347 13.767 1.00 2.98 H new ATOM 933 N LYS A 67 11.498 2.710 11.205 1.00 1.96 N ATOM 934 CA LYS A 67 10.238 2.269 10.613 1.00 1.89 C ATOM 935 C LYS A 67 10.524 1.290 9.489 1.00 1.44 C ATOM 936 O LYS A 67 11.514 1.424 8.788 1.00 1.95 O ATOM 937 CB LYS A 67 9.426 3.467 10.085 1.00 2.82 C ATOM 938 CG LYS A 67 10.081 4.222 8.937 1.00 3.45 C ATOM 939 CD LYS A 67 10.971 5.353 9.418 1.00 4.32 C ATOM 940 CE LYS A 67 10.165 6.570 9.857 1.00 5.01 C ATOM 941 NZ LYS A 67 11.040 7.741 10.127 1.00 5.31 N ATOM 0 H LYS A 67 12.251 2.840 10.530 1.00 1.96 H new ATOM 0 HA LYS A 67 9.643 1.776 11.382 1.00 1.89 H new ATOM 0 HB2 LYS A 67 8.449 3.111 9.757 1.00 2.82 H new ATOM 0 HB3 LYS A 67 9.253 4.162 10.907 1.00 2.82 H new ATOM 0 HG2 LYS A 67 10.672 3.528 8.340 1.00 3.45 H new ATOM 0 HG3 LYS A 67 9.307 4.625 8.284 1.00 3.45 H new ATOM 0 HD2 LYS A 67 11.582 5.004 10.250 1.00 4.32 H new ATOM 0 HD3 LYS A 67 11.655 5.640 8.619 1.00 4.32 H new ATOM 0 HE2 LYS A 67 9.442 6.827 9.082 1.00 5.01 H new ATOM 0 HE3 LYS A 67 9.597 6.326 10.755 1.00 5.01 H new ATOM 0 HZ1 LYS A 67 10.475 8.613 10.089 1.00 5.31 H new ATOM 0 HZ2 LYS A 67 11.466 7.646 11.071 1.00 5.31 H new ATOM 0 HZ3 LYS A 67 11.792 7.785 9.410 1.00 5.31 H new ATOM 955 N ILE A 68 9.655 0.309 9.342 1.00 0.88 N ATOM 956 CA ILE A 68 9.935 -0.864 8.544 1.00 0.76 C ATOM 957 C ILE A 68 9.168 -0.813 7.263 1.00 0.43 C ATOM 958 O ILE A 68 8.054 -0.272 7.200 1.00 0.37 O ATOM 959 CB ILE A 68 9.618 -2.209 9.241 1.00 0.97 C ATOM 960 CG1 ILE A 68 8.177 -2.267 9.782 1.00 1.07 C ATOM 961 CG2 ILE A 68 10.622 -2.490 10.349 1.00 1.51 C ATOM 962 CD1 ILE A 68 7.932 -1.458 11.042 1.00 1.66 C ATOM 0 H ILE A 68 8.732 0.305 9.775 1.00 0.88 H new ATOM 0 HA ILE A 68 11.011 -0.836 8.373 1.00 0.76 H new ATOM 0 HB ILE A 68 9.703 -2.988 8.483 1.00 0.97 H new ATOM 0 HG12 ILE A 68 7.499 -1.915 9.005 1.00 1.07 H new ATOM 0 HG13 ILE A 68 7.921 -3.308 9.981 1.00 1.07 H new ATOM 0 HG21 ILE A 68 10.381 -3.440 10.826 1.00 1.51 H new ATOM 0 HG22 ILE A 68 11.626 -2.540 9.927 1.00 1.51 H new ATOM 0 HG23 ILE A 68 10.580 -1.691 11.089 1.00 1.51 H new ATOM 0 HD11 ILE A 68 6.890 -1.562 11.344 1.00 1.66 H new ATOM 0 HD12 ILE A 68 8.579 -1.822 11.840 1.00 1.66 H new ATOM 0 HD13 ILE A 68 8.150 -0.408 10.848 1.00 1.66 H new ATOM 974 N THR A 69 9.746 -1.415 6.262 1.00 0.47 N ATOM 975 CA THR A 69 9.256 -1.273 4.936 1.00 0.38 C ATOM 976 C THR A 69 8.596 -2.559 4.479 1.00 0.34 C ATOM 977 O THR A 69 9.135 -3.647 4.653 1.00 0.46 O ATOM 978 CB THR A 69 10.414 -0.939 3.996 1.00 0.55 C ATOM 979 OG1 THR A 69 11.063 0.267 4.418 1.00 1.50 O ATOM 980 CG2 THR A 69 9.904 -0.782 2.589 1.00 1.23 C ATOM 0 H THR A 69 10.567 -2.014 6.350 1.00 0.47 H new ATOM 0 HA THR A 69 8.521 -0.469 4.917 1.00 0.38 H new ATOM 0 HB THR A 69 11.136 -1.755 4.025 1.00 0.55 H new ATOM 0 HG1 THR A 69 11.813 0.045 5.009 1.00 1.50 H new ATOM 0 HG21 THR A 69 10.735 -0.544 1.925 1.00 1.23 H new ATOM 0 HG22 THR A 69 9.436 -1.712 2.266 1.00 1.23 H new ATOM 0 HG23 THR A 69 9.171 0.024 2.556 1.00 1.23 H new ATOM 988 N VAL A 70 7.425 -2.418 3.897 1.00 0.27 N ATOM 989 CA VAL A 70 6.685 -3.541 3.366 1.00 0.28 C ATOM 990 C VAL A 70 6.291 -3.198 1.933 1.00 0.26 C ATOM 991 O VAL A 70 6.343 -2.026 1.546 1.00 0.29 O ATOM 992 CB VAL A 70 5.427 -3.841 4.214 1.00 0.33 C ATOM 993 CG1 VAL A 70 4.869 -5.221 3.912 1.00 0.98 C ATOM 994 CG2 VAL A 70 5.729 -3.707 5.697 1.00 1.06 C ATOM 0 H VAL A 70 6.958 -1.519 3.779 1.00 0.27 H new ATOM 0 HA VAL A 70 7.306 -4.436 3.393 1.00 0.28 H new ATOM 0 HB VAL A 70 4.669 -3.105 3.945 1.00 0.33 H new ATOM 0 HG11 VAL A 70 3.986 -5.399 4.525 1.00 0.98 H new ATOM 0 HG12 VAL A 70 4.597 -5.281 2.858 1.00 0.98 H new ATOM 0 HG13 VAL A 70 5.623 -5.975 4.135 1.00 0.98 H new ATOM 0 HG21 VAL A 70 4.829 -3.923 6.273 1.00 1.06 H new ATOM 0 HG22 VAL A 70 6.514 -4.411 5.974 1.00 1.06 H new ATOM 0 HG23 VAL A 70 6.061 -2.691 5.910 1.00 1.06 H new ATOM 1004 N ILE A 71 5.912 -4.202 1.162 1.00 0.25 N ATOM 1005 CA ILE A 71 5.594 -4.031 -0.245 1.00 0.28 C ATOM 1006 C ILE A 71 4.096 -4.051 -0.448 1.00 0.28 C ATOM 1007 O ILE A 71 3.425 -4.935 0.065 1.00 0.33 O ATOM 1008 CB ILE A 71 6.225 -5.172 -1.080 1.00 0.39 C ATOM 1009 CG1 ILE A 71 7.727 -4.944 -1.242 1.00 1.29 C ATOM 1010 CG2 ILE A 71 5.543 -5.315 -2.435 1.00 1.34 C ATOM 1011 CD1 ILE A 71 8.441 -6.057 -1.978 1.00 2.12 C ATOM 0 H ILE A 71 5.816 -5.161 1.495 1.00 0.25 H new ATOM 0 HA ILE A 71 5.997 -3.072 -0.571 1.00 0.28 H new ATOM 0 HB ILE A 71 6.074 -6.108 -0.542 1.00 0.39 H new ATOM 0 HG12 ILE A 71 7.887 -4.008 -1.776 1.00 1.29 H new ATOM 0 HG13 ILE A 71 8.175 -4.828 -0.255 1.00 1.29 H new ATOM 0 HG21 ILE A 71 6.011 -6.125 -2.994 1.00 1.34 H new ATOM 0 HG22 ILE A 71 4.486 -5.539 -2.289 1.00 1.34 H new ATOM 0 HG23 ILE A 71 5.643 -4.384 -2.993 1.00 1.34 H new ATOM 0 HD11 ILE A 71 9.503 -5.821 -2.052 1.00 2.12 H new ATOM 0 HD12 ILE A 71 8.314 -6.993 -1.434 1.00 2.12 H new ATOM 0 HD13 ILE A 71 8.021 -6.159 -2.979 1.00 2.12 H new ATOM 1023 N LEU A 72 3.559 -3.072 -1.157 1.00 0.28 N ATOM 1024 CA LEU A 72 2.156 -3.144 -1.529 1.00 0.29 C ATOM 1025 C LEU A 72 2.038 -3.513 -2.995 1.00 0.27 C ATOM 1026 O LEU A 72 2.464 -2.770 -3.878 1.00 0.30 O ATOM 1027 CB LEU A 72 1.414 -1.834 -1.235 1.00 0.33 C ATOM 1028 CG LEU A 72 -0.125 -1.931 -1.257 1.00 0.37 C ATOM 1029 CD1 LEU A 72 -0.736 -0.783 -0.468 1.00 0.79 C ATOM 1030 CD2 LEU A 72 -0.666 -1.923 -2.681 1.00 0.88 C ATOM 0 H LEU A 72 4.055 -2.241 -1.479 1.00 0.28 H new ATOM 0 HA LEU A 72 1.684 -3.916 -0.922 1.00 0.29 H new ATOM 0 HB2 LEU A 72 1.725 -1.471 -0.255 1.00 0.33 H new ATOM 0 HB3 LEU A 72 1.725 -1.087 -1.965 1.00 0.33 H new ATOM 0 HG LEU A 72 -0.403 -2.878 -0.794 1.00 0.37 H new ATOM 0 HD11 LEU A 72 -1.823 -0.863 -0.491 1.00 0.79 H new ATOM 0 HD12 LEU A 72 -0.391 -0.827 0.565 1.00 0.79 H new ATOM 0 HD13 LEU A 72 -0.433 0.165 -0.911 1.00 0.79 H new ATOM 0 HD21 LEU A 72 -1.754 -1.993 -2.657 1.00 0.88 H new ATOM 0 HD22 LEU A 72 -0.372 -0.998 -3.177 1.00 0.88 H new ATOM 0 HD23 LEU A 72 -0.260 -2.773 -3.229 1.00 0.88 H new ATOM 1042 N ARG A 73 1.450 -4.662 -3.235 1.00 0.24 N ATOM 1043 CA ARG A 73 1.221 -5.149 -4.578 1.00 0.24 C ATOM 1044 C ARG A 73 -0.225 -5.552 -4.710 1.00 0.21 C ATOM 1045 O ARG A 73 -0.801 -6.016 -3.758 1.00 0.24 O ATOM 1046 CB ARG A 73 2.110 -6.369 -4.833 1.00 0.28 C ATOM 1047 CG ARG A 73 1.340 -7.646 -5.165 1.00 0.43 C ATOM 1048 CD ARG A 73 2.256 -8.858 -5.135 1.00 0.58 C ATOM 1049 NE ARG A 73 1.657 -10.034 -5.763 1.00 0.91 N ATOM 1050 CZ ARG A 73 1.752 -11.270 -5.274 1.00 1.04 C ATOM 1051 NH1 ARG A 73 2.334 -11.490 -4.101 1.00 1.27 N ATOM 1052 NH2 ARG A 73 1.248 -12.285 -5.956 1.00 1.67 N ATOM 0 H ARG A 73 1.115 -5.288 -2.503 1.00 0.24 H new ATOM 0 HA ARG A 73 1.458 -4.368 -5.301 1.00 0.24 H new ATOM 0 HB2 ARG A 73 2.790 -6.144 -5.655 1.00 0.28 H new ATOM 0 HB3 ARG A 73 2.725 -6.548 -3.951 1.00 0.28 H new ATOM 0 HG2 ARG A 73 0.528 -7.782 -4.450 1.00 0.43 H new ATOM 0 HG3 ARG A 73 0.885 -7.554 -6.151 1.00 0.43 H new ATOM 0 HD2 ARG A 73 3.189 -8.616 -5.643 1.00 0.58 H new ATOM 0 HD3 ARG A 73 2.508 -9.092 -4.101 1.00 0.58 H new ATOM 0 HE ARG A 73 1.134 -9.900 -6.629 1.00 0.91 H new ATOM 0 HH11 ARG A 73 2.713 -10.709 -3.565 1.00 1.27 H new ATOM 0 HH12 ARG A 73 2.402 -12.440 -3.735 1.00 1.27 H new ATOM 0 HH21 ARG A 73 0.789 -12.120 -6.852 1.00 1.67 H new ATOM 0 HH22 ARG A 73 1.318 -13.233 -5.586 1.00 1.67 H new ATOM 1066 N ILE A 74 -0.826 -5.365 -5.854 1.00 0.22 N ATOM 1067 CA ILE A 74 -2.084 -6.005 -6.116 1.00 0.24 C ATOM 1068 C ILE A 74 -1.799 -7.415 -6.619 1.00 0.27 C ATOM 1069 O ILE A 74 -1.055 -7.598 -7.569 1.00 0.30 O ATOM 1070 CB ILE A 74 -2.884 -5.222 -7.157 1.00 0.31 C ATOM 1071 CG1 ILE A 74 -3.078 -3.769 -6.708 1.00 1.14 C ATOM 1072 CG2 ILE A 74 -4.227 -5.886 -7.430 1.00 1.30 C ATOM 1073 CD1 ILE A 74 -3.761 -3.627 -5.363 1.00 1.81 C ATOM 0 H ILE A 74 -0.469 -4.782 -6.611 1.00 0.22 H new ATOM 0 HA ILE A 74 -2.679 -6.041 -5.203 1.00 0.24 H new ATOM 0 HB ILE A 74 -2.316 -5.221 -8.087 1.00 0.31 H new ATOM 0 HG12 ILE A 74 -2.105 -3.280 -6.664 1.00 1.14 H new ATOM 0 HG13 ILE A 74 -3.665 -3.242 -7.460 1.00 1.14 H new ATOM 0 HG21 ILE A 74 -4.774 -5.307 -8.174 1.00 1.30 H new ATOM 0 HG22 ILE A 74 -4.064 -6.897 -7.804 1.00 1.30 H new ATOM 0 HG23 ILE A 74 -4.805 -5.930 -6.507 1.00 1.30 H new ATOM 0 HD11 ILE A 74 -3.862 -2.570 -5.116 1.00 1.81 H new ATOM 0 HD12 ILE A 74 -4.749 -4.085 -5.407 1.00 1.81 H new ATOM 0 HD13 ILE A 74 -3.164 -4.123 -4.598 1.00 1.81 H new ATOM 1085 N SER A 75 -2.309 -8.405 -5.918 1.00 0.30 N ATOM 1086 CA SER A 75 -2.175 -9.798 -6.327 1.00 0.38 C ATOM 1087 C SER A 75 -2.636 -10.017 -7.774 1.00 0.44 C ATOM 1088 O SER A 75 -2.194 -10.951 -8.445 1.00 0.50 O ATOM 1089 CB SER A 75 -2.961 -10.690 -5.370 1.00 0.47 C ATOM 1090 OG SER A 75 -2.796 -12.060 -5.679 1.00 1.16 O ATOM 0 H SER A 75 -2.828 -8.274 -5.050 1.00 0.30 H new ATOM 0 HA SER A 75 -1.119 -10.064 -6.286 1.00 0.38 H new ATOM 0 HB2 SER A 75 -2.632 -10.505 -4.347 1.00 0.47 H new ATOM 0 HB3 SER A 75 -4.019 -10.431 -5.417 1.00 0.47 H new ATOM 0 HG SER A 75 -3.675 -12.489 -5.741 1.00 1.16 H new ATOM 1096 N LYS A 76 -3.520 -9.145 -8.248 1.00 0.45 N ATOM 1097 CA LYS A 76 -4.211 -9.358 -9.511 1.00 0.54 C ATOM 1098 C LYS A 76 -3.363 -8.950 -10.718 1.00 0.55 C ATOM 1099 O LYS A 76 -3.060 -9.773 -11.584 1.00 0.61 O ATOM 1100 CB LYS A 76 -5.464 -8.491 -9.468 1.00 0.60 C ATOM 1101 CG LYS A 76 -6.406 -8.650 -10.651 1.00 1.21 C ATOM 1102 CD LYS A 76 -6.947 -10.068 -10.743 1.00 1.70 C ATOM 1103 CE LYS A 76 -8.128 -10.158 -11.696 1.00 2.16 C ATOM 1104 NZ LYS A 76 -9.321 -9.436 -11.176 1.00 2.51 N ATOM 0 H LYS A 76 -3.775 -8.280 -7.772 1.00 0.45 H new ATOM 0 HA LYS A 76 -4.434 -10.419 -9.627 1.00 0.54 H new ATOM 0 HB2 LYS A 76 -6.013 -8.720 -8.554 1.00 0.60 H new ATOM 0 HB3 LYS A 76 -5.161 -7.446 -9.404 1.00 0.60 H new ATOM 0 HG2 LYS A 76 -7.235 -7.948 -10.555 1.00 1.21 H new ATOM 0 HG3 LYS A 76 -5.881 -8.399 -11.573 1.00 1.21 H new ATOM 0 HD2 LYS A 76 -6.156 -10.738 -11.079 1.00 1.70 H new ATOM 0 HD3 LYS A 76 -7.252 -10.406 -9.753 1.00 1.70 H new ATOM 0 HE2 LYS A 76 -7.846 -9.742 -12.663 1.00 2.16 H new ATOM 0 HE3 LYS A 76 -8.382 -11.205 -11.861 1.00 2.16 H new ATOM 0 HZ1 LYS A 76 -10.171 -9.763 -11.678 1.00 2.51 H new ATOM 0 HZ2 LYS A 76 -9.425 -9.626 -10.159 1.00 2.51 H new ATOM 0 HZ3 LYS A 76 -9.201 -8.414 -11.327 1.00 2.51 H new ATOM 1118 N THR A 77 -3.003 -7.680 -10.776 1.00 0.51 N ATOM 1119 CA THR A 77 -2.029 -7.185 -11.743 1.00 0.53 C ATOM 1120 C THR A 77 -0.832 -6.650 -10.969 1.00 0.47 C ATOM 1121 O THR A 77 -0.948 -6.431 -9.774 1.00 0.46 O ATOM 1122 CB THR A 77 -2.652 -6.086 -12.628 1.00 0.62 C ATOM 1123 OG1 THR A 77 -3.988 -6.469 -12.991 1.00 1.45 O ATOM 1124 CG2 THR A 77 -1.834 -5.874 -13.894 1.00 1.29 C ATOM 0 H THR A 77 -3.375 -6.960 -10.156 1.00 0.51 H new ATOM 0 HA THR A 77 -1.712 -7.990 -12.406 1.00 0.53 H new ATOM 0 HB THR A 77 -2.664 -5.155 -12.062 1.00 0.62 H new ATOM 0 HG1 THR A 77 -4.387 -5.772 -13.552 1.00 1.45 H new ATOM 0 HG21 THR A 77 -2.296 -5.094 -14.499 1.00 1.29 H new ATOM 0 HG22 THR A 77 -0.821 -5.574 -13.627 1.00 1.29 H new ATOM 0 HG23 THR A 77 -1.799 -6.802 -14.464 1.00 1.29 H new ATOM 1132 N GLN A 78 0.283 -6.340 -11.615 1.00 0.50 N ATOM 1133 CA GLN A 78 1.432 -5.914 -10.838 1.00 0.49 C ATOM 1134 C GLN A 78 1.523 -4.398 -10.856 1.00 0.46 C ATOM 1135 O GLN A 78 2.419 -3.800 -11.458 1.00 0.48 O ATOM 1136 CB GLN A 78 2.733 -6.516 -11.398 1.00 0.59 C ATOM 1137 CG GLN A 78 2.679 -8.019 -11.651 1.00 1.49 C ATOM 1138 CD GLN A 78 2.179 -8.371 -13.045 1.00 2.14 C ATOM 1139 OE1 GLN A 78 1.402 -7.632 -13.653 1.00 2.69 O ATOM 1140 NE2 GLN A 78 2.621 -9.501 -13.565 1.00 2.90 N ATOM 0 H GLN A 78 0.414 -6.373 -12.626 1.00 0.50 H new ATOM 0 HA GLN A 78 1.305 -6.266 -9.814 1.00 0.49 H new ATOM 0 HB2 GLN A 78 2.978 -6.012 -12.333 1.00 0.59 H new ATOM 0 HB3 GLN A 78 3.544 -6.307 -10.701 1.00 0.59 H new ATOM 0 HG2 GLN A 78 3.674 -8.441 -11.511 1.00 1.49 H new ATOM 0 HG3 GLN A 78 2.028 -8.483 -10.910 1.00 1.49 H new ATOM 0 HE21 GLN A 78 3.264 -10.089 -13.035 1.00 2.90 H new ATOM 0 HE22 GLN A 78 2.320 -9.786 -14.497 1.00 2.90 H new ATOM 1149 N LEU A 79 0.579 -3.803 -10.145 1.00 0.46 N ATOM 1150 CA LEU A 79 0.572 -2.383 -9.850 1.00 0.45 C ATOM 1151 C LEU A 79 1.076 -2.186 -8.439 1.00 0.42 C ATOM 1152 O LEU A 79 0.435 -2.602 -7.471 1.00 0.54 O ATOM 1153 CB LEU A 79 -0.840 -1.799 -10.003 1.00 0.59 C ATOM 1154 CG LEU A 79 -1.285 -1.471 -11.439 1.00 0.95 C ATOM 1155 CD1 LEU A 79 -1.109 -2.655 -12.374 1.00 1.95 C ATOM 1156 CD2 LEU A 79 -2.738 -1.029 -11.446 1.00 1.61 C ATOM 0 H LEU A 79 -0.217 -4.304 -9.751 1.00 0.46 H new ATOM 0 HA LEU A 79 1.220 -1.860 -10.553 1.00 0.45 H new ATOM 0 HB2 LEU A 79 -1.552 -2.506 -9.576 1.00 0.59 H new ATOM 0 HB3 LEU A 79 -0.901 -0.887 -9.408 1.00 0.59 H new ATOM 0 HG LEU A 79 -0.649 -0.662 -11.800 1.00 0.95 H new ATOM 0 HD11 LEU A 79 -1.436 -2.379 -13.377 1.00 1.95 H new ATOM 0 HD12 LEU A 79 -0.058 -2.944 -12.401 1.00 1.95 H new ATOM 0 HD13 LEU A 79 -1.707 -3.493 -12.016 1.00 1.95 H new ATOM 0 HD21 LEU A 79 -3.043 -0.799 -12.467 1.00 1.61 H new ATOM 0 HD22 LEU A 79 -3.364 -1.830 -11.052 1.00 1.61 H new ATOM 0 HD23 LEU A 79 -2.851 -0.141 -10.825 1.00 1.61 H new ATOM 1168 N TYR A 80 2.229 -1.585 -8.334 1.00 0.34 N ATOM 1169 CA TYR A 80 2.867 -1.357 -7.062 1.00 0.38 C ATOM 1170 C TYR A 80 2.750 0.115 -6.703 1.00 0.34 C ATOM 1171 O TYR A 80 2.533 0.954 -7.566 1.00 0.45 O ATOM 1172 CB TYR A 80 4.327 -1.829 -7.116 1.00 0.60 C ATOM 1173 CG TYR A 80 4.486 -3.346 -7.143 1.00 1.27 C ATOM 1174 CD1 TYR A 80 3.527 -4.155 -7.739 1.00 2.27 C ATOM 1175 CD2 TYR A 80 5.600 -3.969 -6.588 1.00 1.56 C ATOM 1176 CE1 TYR A 80 3.672 -5.531 -7.785 1.00 3.30 C ATOM 1177 CE2 TYR A 80 5.752 -5.340 -6.625 1.00 2.49 C ATOM 1178 CZ TYR A 80 4.765 -6.122 -7.156 1.00 3.33 C ATOM 1179 OH TYR A 80 4.942 -7.487 -7.273 1.00 4.39 O ATOM 0 H TYR A 80 2.758 -1.236 -9.133 1.00 0.34 H new ATOM 0 HA TYR A 80 2.372 -1.934 -6.280 1.00 0.38 H new ATOM 0 HB2 TYR A 80 4.802 -1.408 -8.002 1.00 0.60 H new ATOM 0 HB3 TYR A 80 4.859 -1.433 -6.251 1.00 0.60 H new ATOM 0 HD1 TYR A 80 2.650 -3.701 -8.176 1.00 2.27 H new ATOM 0 HD2 TYR A 80 6.363 -3.366 -6.118 1.00 1.56 H new ATOM 0 HE1 TYR A 80 2.945 -6.139 -8.303 1.00 3.30 H new ATOM 0 HE2 TYR A 80 6.650 -5.795 -6.235 1.00 2.49 H new ATOM 0 HH TYR A 80 4.378 -7.829 -7.998 1.00 4.39 H new ATOM 1189 N VAL A 81 2.842 0.414 -5.434 1.00 0.32 N ATOM 1190 CA VAL A 81 2.623 1.771 -4.938 1.00 0.32 C ATOM 1191 C VAL A 81 3.877 2.635 -5.016 1.00 0.32 C ATOM 1192 O VAL A 81 4.919 2.252 -4.498 1.00 0.36 O ATOM 1193 CB VAL A 81 2.099 1.765 -3.487 1.00 0.36 C ATOM 1194 CG1 VAL A 81 2.007 3.180 -2.932 1.00 0.46 C ATOM 1195 CG2 VAL A 81 0.746 1.085 -3.424 1.00 0.38 C ATOM 0 H VAL A 81 3.069 -0.265 -4.708 1.00 0.32 H new ATOM 0 HA VAL A 81 1.869 2.207 -5.593 1.00 0.32 H new ATOM 0 HB VAL A 81 2.805 1.207 -2.872 1.00 0.36 H new ATOM 0 HG11 VAL A 81 1.635 3.146 -1.908 1.00 0.46 H new ATOM 0 HG12 VAL A 81 2.995 3.640 -2.944 1.00 0.46 H new ATOM 0 HG13 VAL A 81 1.325 3.768 -3.546 1.00 0.46 H new ATOM 0 HG21 VAL A 81 0.386 1.086 -2.395 1.00 0.38 H new ATOM 0 HG22 VAL A 81 0.039 1.622 -4.057 1.00 0.38 H new ATOM 0 HG23 VAL A 81 0.839 0.057 -3.775 1.00 0.38 H new ATOM 1205 N THR A 82 3.790 3.767 -5.717 1.00 0.32 N ATOM 1206 CA THR A 82 4.782 4.788 -5.613 1.00 0.32 C ATOM 1207 C THR A 82 4.336 5.819 -4.611 1.00 0.31 C ATOM 1208 O THR A 82 3.146 6.111 -4.478 1.00 0.32 O ATOM 1209 CB THR A 82 4.971 5.561 -6.917 1.00 0.32 C ATOM 1210 OG1 THR A 82 3.748 6.146 -7.324 1.00 1.22 O ATOM 1211 CG2 THR A 82 5.527 4.718 -8.032 1.00 1.37 C ATOM 0 H THR A 82 3.029 3.982 -6.362 1.00 0.32 H new ATOM 0 HA THR A 82 5.706 4.281 -5.335 1.00 0.32 H new ATOM 0 HB THR A 82 5.706 6.338 -6.709 1.00 0.32 H new ATOM 0 HG1 THR A 82 3.042 5.467 -7.315 1.00 1.22 H new ATOM 0 HG21 THR A 82 5.637 5.327 -8.929 1.00 1.37 H new ATOM 0 HG22 THR A 82 6.500 4.324 -7.740 1.00 1.37 H new ATOM 0 HG23 THR A 82 4.847 3.891 -8.236 1.00 1.37 H new ATOM 1219 N ALA A 83 5.291 6.358 -3.911 1.00 0.33 N ATOM 1220 CA ALA A 83 5.013 7.457 -3.009 1.00 0.32 C ATOM 1221 C ALA A 83 5.453 8.769 -3.641 1.00 0.27 C ATOM 1222 O ALA A 83 6.631 8.959 -3.942 1.00 0.31 O ATOM 1223 CB ALA A 83 5.696 7.239 -1.666 1.00 0.41 C ATOM 0 H ALA A 83 6.267 6.063 -3.941 1.00 0.33 H new ATOM 0 HA ALA A 83 3.939 7.503 -2.829 1.00 0.32 H new ATOM 0 HB1 ALA A 83 5.474 8.076 -1.005 1.00 0.41 H new ATOM 0 HB2 ALA A 83 5.330 6.315 -1.218 1.00 0.41 H new ATOM 0 HB3 ALA A 83 6.774 7.169 -1.813 1.00 0.41 H new ATOM 1229 N GLN A 84 4.498 9.666 -3.854 1.00 0.25 N ATOM 1230 CA GLN A 84 4.769 10.925 -4.535 1.00 0.26 C ATOM 1231 C GLN A 84 5.101 12.023 -3.524 1.00 0.25 C ATOM 1232 O GLN A 84 6.118 11.938 -2.843 1.00 0.28 O ATOM 1233 CB GLN A 84 3.598 11.322 -5.445 1.00 0.33 C ATOM 1234 CG GLN A 84 3.913 12.474 -6.394 1.00 0.77 C ATOM 1235 CD GLN A 84 5.223 12.277 -7.138 1.00 1.32 C ATOM 1236 OE1 GLN A 84 5.162 11.629 -8.290 1.00 2.05 O flip ATOM 1237 NE2 GLN A 84 6.283 12.708 -6.681 1.00 2.02 N flip ATOM 0 H GLN A 84 3.528 9.544 -3.564 1.00 0.25 H new ATOM 0 HA GLN A 84 5.642 10.791 -5.174 1.00 0.26 H new ATOM 0 HB2 GLN A 84 3.296 10.454 -6.031 1.00 0.33 H new ATOM 0 HB3 GLN A 84 2.746 11.599 -4.824 1.00 0.33 H new ATOM 0 HG2 GLN A 84 3.102 12.578 -7.115 1.00 0.77 H new ATOM 0 HG3 GLN A 84 3.957 13.404 -5.828 1.00 0.77 H new ATOM 0 HE21 GLN A 84 6.290 13.203 -5.789 1.00 2.02 H new ATOM 0 HE22 GLN A 84 7.153 12.570 -7.195 1.00 2.02 H new ATOM 1246 N ASP A 85 4.273 13.064 -3.445 1.00 0.24 N ATOM 1247 CA ASP A 85 4.544 14.179 -2.536 1.00 0.28 C ATOM 1248 C ASP A 85 3.264 14.794 -1.973 1.00 0.26 C ATOM 1249 O ASP A 85 2.514 15.437 -2.707 1.00 0.27 O ATOM 1250 CB ASP A 85 5.366 15.252 -3.253 1.00 0.34 C ATOM 1251 CG ASP A 85 5.613 16.472 -2.388 1.00 0.44 C ATOM 1252 OD1 ASP A 85 6.443 16.389 -1.458 1.00 0.53 O ATOM 1253 OD2 ASP A 85 4.970 17.520 -2.627 1.00 0.56 O ATOM 0 H ASP A 85 3.418 13.160 -3.993 1.00 0.24 H new ATOM 0 HA ASP A 85 5.111 13.780 -1.695 1.00 0.28 H new ATOM 0 HB2 ASP A 85 6.323 14.828 -3.558 1.00 0.34 H new ATOM 0 HB3 ASP A 85 4.847 15.555 -4.162 1.00 0.34 H new ATOM 1258 N GLU A 86 3.026 14.582 -0.672 1.00 0.27 N ATOM 1259 CA GLU A 86 1.895 15.195 0.043 1.00 0.29 C ATOM 1260 C GLU A 86 0.599 14.914 -0.715 1.00 0.22 C ATOM 1261 O GLU A 86 0.466 13.824 -1.222 1.00 0.19 O ATOM 1262 CB GLU A 86 2.196 16.686 0.213 1.00 0.40 C ATOM 1263 CG GLU A 86 1.155 17.523 0.946 1.00 0.51 C ATOM 1264 CD GLU A 86 1.249 17.390 2.444 1.00 0.78 C ATOM 1265 OE1 GLU A 86 2.352 17.578 2.994 1.00 1.04 O ATOM 1266 OE2 GLU A 86 0.221 17.090 3.084 1.00 1.62 O ATOM 0 H GLU A 86 3.608 13.984 -0.086 1.00 0.27 H new ATOM 0 HA GLU A 86 1.762 14.768 1.037 1.00 0.29 H new ATOM 0 HB2 GLU A 86 3.143 16.782 0.744 1.00 0.40 H new ATOM 0 HB3 GLU A 86 2.341 17.117 -0.777 1.00 0.40 H new ATOM 0 HG2 GLU A 86 1.278 18.570 0.670 1.00 0.51 H new ATOM 0 HG3 GLU A 86 0.159 17.222 0.621 1.00 0.51 H new ATOM 1273 N ASP A 87 -0.319 15.867 -0.868 1.00 0.22 N ATOM 1274 CA ASP A 87 -1.569 15.565 -1.552 1.00 0.20 C ATOM 1275 C ASP A 87 -1.323 15.448 -3.043 1.00 0.23 C ATOM 1276 O ASP A 87 -1.560 16.372 -3.822 1.00 0.30 O ATOM 1277 CB ASP A 87 -2.670 16.588 -1.262 1.00 0.28 C ATOM 1278 CG ASP A 87 -4.057 16.030 -1.568 1.00 0.33 C ATOM 1279 OD1 ASP A 87 -4.407 15.886 -2.761 1.00 0.61 O ATOM 1280 OD2 ASP A 87 -4.806 15.727 -0.614 1.00 0.56 O ATOM 0 H ASP A 87 -0.224 16.827 -0.537 1.00 0.22 H new ATOM 0 HA ASP A 87 -1.929 14.612 -1.164 1.00 0.20 H new ATOM 0 HB2 ASP A 87 -2.621 16.887 -0.215 1.00 0.28 H new ATOM 0 HB3 ASP A 87 -2.499 17.485 -1.858 1.00 0.28 H new ATOM 1285 N GLN A 88 -0.806 14.293 -3.396 1.00 0.19 N ATOM 1286 CA GLN A 88 -0.647 13.855 -4.762 1.00 0.24 C ATOM 1287 C GLN A 88 -0.814 12.364 -4.722 1.00 0.21 C ATOM 1288 O GLN A 88 -0.066 11.688 -4.020 1.00 0.19 O ATOM 1289 CB GLN A 88 0.740 14.208 -5.315 1.00 0.32 C ATOM 1290 CG GLN A 88 0.923 15.677 -5.652 1.00 1.03 C ATOM 1291 CD GLN A 88 0.023 16.129 -6.783 1.00 1.28 C ATOM 1292 OE1 GLN A 88 -0.333 15.345 -7.663 1.00 1.89 O ATOM 1293 NE2 GLN A 88 -0.348 17.397 -6.769 1.00 1.93 N ATOM 0 H GLN A 88 -0.473 13.610 -2.715 1.00 0.19 H new ATOM 0 HA GLN A 88 -1.372 14.344 -5.413 1.00 0.24 H new ATOM 0 HB2 GLN A 88 1.494 13.918 -4.583 1.00 0.32 H new ATOM 0 HB3 GLN A 88 0.922 13.616 -6.212 1.00 0.32 H new ATOM 0 HG2 GLN A 88 0.718 16.278 -4.766 1.00 1.03 H new ATOM 0 HG3 GLN A 88 1.963 15.857 -5.925 1.00 1.03 H new ATOM 0 HE21 GLN A 88 -0.030 18.013 -6.021 1.00 1.93 H new ATOM 0 HE22 GLN A 88 -0.952 17.760 -7.506 1.00 1.93 H new ATOM 1302 N PRO A 89 -1.789 11.825 -5.443 1.00 0.24 N ATOM 1303 CA PRO A 89 -2.184 10.442 -5.250 1.00 0.24 C ATOM 1304 C PRO A 89 -1.036 9.499 -5.531 1.00 0.21 C ATOM 1305 O PRO A 89 -0.176 9.782 -6.367 1.00 0.22 O ATOM 1306 CB PRO A 89 -3.316 10.238 -6.267 1.00 0.33 C ATOM 1307 CG PRO A 89 -3.170 11.350 -7.252 1.00 0.58 C ATOM 1308 CD PRO A 89 -2.567 12.497 -6.494 1.00 0.33 C ATOM 0 HA PRO A 89 -2.491 10.237 -4.225 1.00 0.24 H new ATOM 0 HB2 PRO A 89 -3.235 9.267 -6.756 1.00 0.33 H new ATOM 0 HB3 PRO A 89 -4.291 10.269 -5.781 1.00 0.33 H new ATOM 0 HG2 PRO A 89 -2.531 11.053 -8.084 1.00 0.58 H new ATOM 0 HG3 PRO A 89 -4.136 11.626 -7.675 1.00 0.58 H new ATOM 0 HD2 PRO A 89 -1.935 13.115 -7.132 1.00 0.33 H new ATOM 0 HD3 PRO A 89 -3.332 13.151 -6.075 1.00 0.33 H new ATOM 1316 N VAL A 90 -1.019 8.390 -4.813 1.00 0.23 N ATOM 1317 CA VAL A 90 -0.024 7.372 -5.039 1.00 0.24 C ATOM 1318 C VAL A 90 -0.160 6.855 -6.462 1.00 0.24 C ATOM 1319 O VAL A 90 -1.254 6.537 -6.937 1.00 0.28 O ATOM 1320 CB VAL A 90 -0.120 6.211 -4.017 1.00 0.36 C ATOM 1321 CG1 VAL A 90 -0.218 6.762 -2.604 1.00 1.31 C ATOM 1322 CG2 VAL A 90 -1.286 5.280 -4.312 1.00 1.10 C ATOM 0 H VAL A 90 -1.685 8.177 -4.070 1.00 0.23 H new ATOM 0 HA VAL A 90 0.960 7.820 -4.899 1.00 0.24 H new ATOM 0 HB VAL A 90 0.791 5.619 -4.107 1.00 0.36 H new ATOM 0 HG11 VAL A 90 -0.285 5.936 -1.895 1.00 1.31 H new ATOM 0 HG12 VAL A 90 0.667 7.358 -2.384 1.00 1.31 H new ATOM 0 HG13 VAL A 90 -1.107 7.387 -2.518 1.00 1.31 H new ATOM 0 HG21 VAL A 90 -1.312 4.483 -3.569 1.00 1.10 H new ATOM 0 HG22 VAL A 90 -2.219 5.842 -4.274 1.00 1.10 H new ATOM 0 HG23 VAL A 90 -1.164 4.847 -5.305 1.00 1.10 H new ATOM 1332 N LEU A 91 0.956 6.820 -7.148 1.00 0.22 N ATOM 1333 CA LEU A 91 0.970 6.545 -8.573 1.00 0.24 C ATOM 1334 C LEU A 91 1.265 5.074 -8.781 1.00 0.26 C ATOM 1335 O LEU A 91 2.002 4.473 -8.008 1.00 0.33 O ATOM 1336 CB LEU A 91 2.008 7.417 -9.288 1.00 0.30 C ATOM 1337 CG LEU A 91 1.892 8.927 -9.036 1.00 0.31 C ATOM 1338 CD1 LEU A 91 2.973 9.670 -9.801 1.00 0.42 C ATOM 1339 CD2 LEU A 91 0.515 9.432 -9.442 1.00 0.34 C ATOM 0 H LEU A 91 1.878 6.980 -6.742 1.00 0.22 H new ATOM 0 HA LEU A 91 -0.004 6.785 -9.000 1.00 0.24 H new ATOM 0 HB2 LEU A 91 3.002 7.091 -8.983 1.00 0.30 H new ATOM 0 HB3 LEU A 91 1.929 7.239 -10.360 1.00 0.30 H new ATOM 0 HG LEU A 91 2.026 9.112 -7.970 1.00 0.31 H new ATOM 0 HD11 LEU A 91 2.881 10.740 -9.615 1.00 0.42 H new ATOM 0 HD12 LEU A 91 3.954 9.327 -9.470 1.00 0.42 H new ATOM 0 HD13 LEU A 91 2.862 9.477 -10.868 1.00 0.42 H new ATOM 0 HD21 LEU A 91 0.451 10.504 -9.256 1.00 0.34 H new ATOM 0 HD22 LEU A 91 0.354 9.237 -10.502 1.00 0.34 H new ATOM 0 HD23 LEU A 91 -0.248 8.917 -8.859 1.00 0.34 H new ATOM 1351 N LEU A 92 0.689 4.465 -9.787 1.00 0.27 N ATOM 1352 CA LEU A 92 0.766 3.028 -9.876 1.00 0.28 C ATOM 1353 C LEU A 92 1.955 2.625 -10.731 1.00 0.29 C ATOM 1354 O LEU A 92 1.944 2.709 -11.957 1.00 0.31 O ATOM 1355 CB LEU A 92 -0.539 2.452 -10.432 1.00 0.32 C ATOM 1356 CG LEU A 92 -1.771 2.715 -9.559 1.00 0.76 C ATOM 1357 CD1 LEU A 92 -3.008 2.080 -10.168 1.00 1.15 C ATOM 1358 CD2 LEU A 92 -1.547 2.200 -8.144 1.00 1.30 C ATOM 0 H LEU A 92 0.175 4.926 -10.537 1.00 0.27 H new ATOM 0 HA LEU A 92 0.908 2.617 -8.876 1.00 0.28 H new ATOM 0 HB2 LEU A 92 -0.714 2.872 -11.422 1.00 0.32 H new ATOM 0 HB3 LEU A 92 -0.422 1.376 -10.559 1.00 0.32 H new ATOM 0 HG LEU A 92 -1.929 3.792 -9.511 1.00 0.76 H new ATOM 0 HD11 LEU A 92 -3.870 2.279 -9.532 1.00 1.15 H new ATOM 0 HD12 LEU A 92 -3.183 2.501 -11.158 1.00 1.15 H new ATOM 0 HD13 LEU A 92 -2.860 1.003 -10.252 1.00 1.15 H new ATOM 0 HD21 LEU A 92 -2.433 2.397 -7.541 1.00 1.30 H new ATOM 0 HD22 LEU A 92 -1.358 1.127 -8.173 1.00 1.30 H new ATOM 0 HD23 LEU A 92 -0.689 2.707 -7.704 1.00 1.30 H new ATOM 1370 N LYS A 93 2.993 2.202 -10.016 1.00 0.31 N ATOM 1371 CA LYS A 93 4.258 1.818 -10.593 1.00 0.37 C ATOM 1372 C LYS A 93 4.210 0.337 -10.910 1.00 0.38 C ATOM 1373 O LYS A 93 4.000 -0.490 -10.030 1.00 0.39 O ATOM 1374 CB LYS A 93 5.439 2.078 -9.617 1.00 0.46 C ATOM 1375 CG LYS A 93 5.402 1.305 -8.308 1.00 1.29 C ATOM 1376 CD LYS A 93 6.741 1.324 -7.579 1.00 2.11 C ATOM 1377 CE LYS A 93 7.869 0.667 -8.372 1.00 2.85 C ATOM 1378 NZ LYS A 93 8.468 1.577 -9.389 1.00 3.26 N ATOM 0 H LYS A 93 2.968 2.118 -9.000 1.00 0.31 H new ATOM 0 HA LYS A 93 4.421 2.414 -11.491 1.00 0.37 H new ATOM 0 HB2 LYS A 93 6.370 1.839 -10.132 1.00 0.46 H new ATOM 0 HB3 LYS A 93 5.467 3.143 -9.387 1.00 0.46 H new ATOM 0 HG2 LYS A 93 4.634 1.729 -7.661 1.00 1.29 H new ATOM 0 HG3 LYS A 93 5.116 0.272 -8.508 1.00 1.29 H new ATOM 0 HD2 LYS A 93 7.013 2.357 -7.360 1.00 2.11 H new ATOM 0 HD3 LYS A 93 6.633 0.813 -6.622 1.00 2.11 H new ATOM 0 HE2 LYS A 93 8.647 0.338 -7.683 1.00 2.85 H new ATOM 0 HE3 LYS A 93 7.486 -0.224 -8.870 1.00 2.85 H new ATOM 0 HZ1 LYS A 93 9.501 1.459 -9.395 1.00 3.26 H new ATOM 0 HZ2 LYS A 93 8.088 1.345 -10.329 1.00 3.26 H new ATOM 0 HZ3 LYS A 93 8.233 2.563 -9.154 1.00 3.26 H new ATOM 1392 N GLU A 94 4.390 -0.021 -12.160 1.00 0.43 N ATOM 1393 CA GLU A 94 4.229 -1.404 -12.519 1.00 0.47 C ATOM 1394 C GLU A 94 5.579 -2.078 -12.473 1.00 0.52 C ATOM 1395 O GLU A 94 6.354 -2.077 -13.434 1.00 0.62 O ATOM 1396 CB GLU A 94 3.616 -1.529 -13.913 1.00 0.56 C ATOM 1397 CG GLU A 94 2.260 -0.858 -14.047 1.00 1.38 C ATOM 1398 CD GLU A 94 1.750 -0.882 -15.471 1.00 1.76 C ATOM 1399 OE1 GLU A 94 2.057 0.058 -16.233 1.00 2.05 O ATOM 1400 OE2 GLU A 94 1.053 -1.847 -15.845 1.00 2.33 O ATOM 0 H GLU A 94 4.641 0.608 -12.923 1.00 0.43 H new ATOM 0 HA GLU A 94 3.554 -1.888 -11.813 1.00 0.47 H new ATOM 0 HB2 GLU A 94 4.300 -1.094 -14.641 1.00 0.56 H new ATOM 0 HB3 GLU A 94 3.515 -2.585 -14.162 1.00 0.56 H new ATOM 0 HG2 GLU A 94 1.543 -1.359 -13.397 1.00 1.38 H new ATOM 0 HG3 GLU A 94 2.332 0.175 -13.706 1.00 1.38 H new ATOM 1407 N MET A 95 5.832 -2.646 -11.312 1.00 0.50 N ATOM 1408 CA MET A 95 7.033 -3.399 -11.046 1.00 0.59 C ATOM 1409 C MET A 95 6.621 -4.836 -10.773 1.00 0.66 C ATOM 1410 O MET A 95 5.953 -5.113 -9.784 1.00 0.65 O ATOM 1411 CB MET A 95 7.805 -2.774 -9.861 1.00 0.60 C ATOM 1412 CG MET A 95 8.926 -3.653 -9.325 1.00 1.21 C ATOM 1413 SD MET A 95 10.242 -3.916 -10.531 1.00 1.67 S ATOM 1414 CE MET A 95 11.316 -5.029 -9.624 1.00 2.39 C ATOM 0 H MET A 95 5.196 -2.595 -10.516 1.00 0.50 H new ATOM 0 HA MET A 95 7.711 -3.377 -11.900 1.00 0.59 H new ATOM 0 HB2 MET A 95 8.224 -1.819 -10.176 1.00 0.60 H new ATOM 0 HB3 MET A 95 7.104 -2.563 -9.054 1.00 0.60 H new ATOM 0 HG2 MET A 95 9.346 -3.194 -8.430 1.00 1.21 H new ATOM 0 HG3 MET A 95 8.515 -4.617 -9.026 1.00 1.21 H new ATOM 0 HE1 MET A 95 12.179 -5.284 -10.240 1.00 2.39 H new ATOM 0 HE2 MET A 95 11.654 -4.543 -8.709 1.00 2.39 H new ATOM 0 HE3 MET A 95 10.769 -5.937 -9.371 1.00 2.39 H new ATOM 1424 N PRO A 96 7.000 -5.766 -11.650 1.00 0.82 N ATOM 1425 CA PRO A 96 6.477 -7.124 -11.629 1.00 0.95 C ATOM 1426 C PRO A 96 7.177 -8.034 -10.626 1.00 0.93 C ATOM 1427 O PRO A 96 8.405 -8.164 -10.642 1.00 0.98 O ATOM 1428 CB PRO A 96 6.710 -7.624 -13.062 1.00 1.19 C ATOM 1429 CG PRO A 96 7.459 -6.539 -13.781 1.00 1.26 C ATOM 1430 CD PRO A 96 7.960 -5.583 -12.736 1.00 0.99 C ATOM 0 HA PRO A 96 5.433 -7.135 -11.317 1.00 0.95 H new ATOM 0 HB2 PRO A 96 7.281 -8.552 -13.060 1.00 1.19 H new ATOM 0 HB3 PRO A 96 5.762 -7.834 -13.558 1.00 1.19 H new ATOM 0 HG2 PRO A 96 8.289 -6.956 -14.351 1.00 1.26 H new ATOM 0 HG3 PRO A 96 6.809 -6.028 -14.491 1.00 1.26 H new ATOM 0 HD2 PRO A 96 8.977 -5.821 -12.423 1.00 0.99 H new ATOM 0 HD3 PRO A 96 7.971 -4.555 -13.099 1.00 0.99 H new ATOM 1438 N GLU A 97 6.366 -8.663 -9.766 1.00 0.98 N ATOM 1439 CA GLU A 97 6.824 -9.676 -8.827 1.00 1.06 C ATOM 1440 C GLU A 97 7.707 -9.094 -7.723 1.00 0.90 C ATOM 1441 O GLU A 97 8.444 -8.127 -7.923 1.00 0.88 O ATOM 1442 CB GLU A 97 7.521 -10.811 -9.567 1.00 1.32 C ATOM 1443 CG GLU A 97 6.612 -11.495 -10.577 1.00 1.84 C ATOM 1444 CD GLU A 97 7.211 -12.754 -11.158 1.00 2.42 C ATOM 1445 OE1 GLU A 97 7.121 -13.814 -10.499 1.00 2.74 O ATOM 1446 OE2 GLU A 97 7.760 -12.698 -12.274 1.00 3.15 O ATOM 0 H GLU A 97 5.365 -8.476 -9.708 1.00 0.98 H new ATOM 0 HA GLU A 97 5.944 -10.081 -8.328 1.00 1.06 H new ATOM 0 HB2 GLU A 97 8.399 -10.420 -10.080 1.00 1.32 H new ATOM 0 HB3 GLU A 97 7.875 -11.547 -8.845 1.00 1.32 H new ATOM 0 HG2 GLU A 97 5.664 -11.739 -10.097 1.00 1.84 H new ATOM 0 HG3 GLU A 97 6.389 -10.799 -11.386 1.00 1.84 H new ATOM 1453 N ILE A 98 7.596 -9.694 -6.546 1.00 1.08 N ATOM 1454 CA ILE A 98 8.256 -9.197 -5.350 1.00 1.17 C ATOM 1455 C ILE A 98 9.769 -9.348 -5.466 1.00 1.10 C ATOM 1456 O ILE A 98 10.286 -10.455 -5.626 1.00 1.29 O ATOM 1457 CB ILE A 98 7.768 -9.969 -4.101 1.00 1.61 C ATOM 1458 CG1 ILE A 98 6.243 -9.882 -3.973 1.00 2.25 C ATOM 1459 CG2 ILE A 98 8.440 -9.444 -2.842 1.00 2.35 C ATOM 1460 CD1 ILE A 98 5.715 -8.468 -3.869 1.00 3.20 C ATOM 0 H ILE A 98 7.045 -10.539 -6.395 1.00 1.08 H new ATOM 0 HA ILE A 98 8.006 -8.141 -5.247 1.00 1.17 H new ATOM 0 HB ILE A 98 8.044 -11.016 -4.222 1.00 1.61 H new ATOM 0 HG12 ILE A 98 5.788 -10.367 -4.837 1.00 2.25 H new ATOM 0 HG13 ILE A 98 5.930 -10.442 -3.092 1.00 2.25 H new ATOM 0 HG21 ILE A 98 8.081 -10.003 -1.978 1.00 2.35 H new ATOM 0 HG22 ILE A 98 9.520 -9.565 -2.929 1.00 2.35 H new ATOM 0 HG23 ILE A 98 8.202 -8.388 -2.716 1.00 2.35 H new ATOM 0 HD11 ILE A 98 4.629 -8.491 -3.782 1.00 3.20 H new ATOM 0 HD12 ILE A 98 6.140 -7.985 -2.989 1.00 3.20 H new ATOM 0 HD13 ILE A 98 5.995 -7.908 -4.761 1.00 3.20 H new ATOM 1472 N PRO A 99 10.494 -8.225 -5.398 1.00 1.08 N ATOM 1473 CA PRO A 99 11.946 -8.202 -5.524 1.00 1.14 C ATOM 1474 C PRO A 99 12.654 -8.657 -4.252 1.00 1.08 C ATOM 1475 O PRO A 99 12.201 -8.399 -3.138 1.00 1.15 O ATOM 1476 CB PRO A 99 12.268 -6.726 -5.814 1.00 1.38 C ATOM 1477 CG PRO A 99 10.948 -6.035 -5.956 1.00 1.61 C ATOM 1478 CD PRO A 99 9.956 -6.876 -5.212 1.00 1.28 C ATOM 0 HA PRO A 99 12.288 -8.886 -6.300 1.00 1.14 H new ATOM 0 HB2 PRO A 99 12.852 -6.288 -5.005 1.00 1.38 H new ATOM 0 HB3 PRO A 99 12.860 -6.627 -6.724 1.00 1.38 H new ATOM 0 HG2 PRO A 99 10.990 -5.026 -5.545 1.00 1.61 H new ATOM 0 HG3 PRO A 99 10.669 -5.940 -7.005 1.00 1.61 H new ATOM 0 HD2 PRO A 99 9.899 -6.602 -4.159 1.00 1.28 H new ATOM 0 HD3 PRO A 99 8.951 -6.778 -5.622 1.00 1.28 H new ATOM 1486 N LYS A 100 13.773 -9.328 -4.445 1.00 1.10 N ATOM 1487 CA LYS A 100 14.603 -9.808 -3.355 1.00 1.07 C ATOM 1488 C LYS A 100 15.842 -8.934 -3.252 1.00 1.03 C ATOM 1489 O LYS A 100 16.518 -8.921 -2.239 1.00 0.99 O ATOM 1490 CB LYS A 100 14.973 -11.276 -3.573 1.00 1.15 C ATOM 1491 CG LYS A 100 15.608 -11.941 -2.364 1.00 1.99 C ATOM 1492 CD LYS A 100 15.800 -13.431 -2.593 1.00 2.34 C ATOM 1493 CE LYS A 100 16.398 -14.112 -1.375 1.00 3.09 C ATOM 1494 NZ LYS A 100 17.777 -13.634 -1.098 1.00 3.70 N ATOM 0 H LYS A 100 14.135 -9.558 -5.370 1.00 1.10 H new ATOM 0 HA LYS A 100 14.051 -9.747 -2.417 1.00 1.07 H new ATOM 0 HB2 LYS A 100 14.075 -11.829 -3.849 1.00 1.15 H new ATOM 0 HB3 LYS A 100 15.661 -11.345 -4.416 1.00 1.15 H new ATOM 0 HG2 LYS A 100 16.571 -11.476 -2.154 1.00 1.99 H new ATOM 0 HG3 LYS A 100 14.980 -11.783 -1.487 1.00 1.99 H new ATOM 0 HD2 LYS A 100 14.840 -13.889 -2.832 1.00 2.34 H new ATOM 0 HD3 LYS A 100 16.451 -13.586 -3.453 1.00 2.34 H new ATOM 0 HE2 LYS A 100 15.767 -13.924 -0.507 1.00 3.09 H new ATOM 0 HE3 LYS A 100 16.412 -15.191 -1.532 1.00 3.09 H new ATOM 0 HZ1 LYS A 100 18.207 -14.225 -0.359 1.00 3.70 H new ATOM 0 HZ2 LYS A 100 18.347 -13.696 -1.966 1.00 3.70 H new ATOM 0 HZ3 LYS A 100 17.744 -12.646 -0.775 1.00 3.70 H new ATOM 1508 N THR A 101 16.155 -8.243 -4.333 1.00 1.10 N ATOM 1509 CA THR A 101 17.187 -7.237 -4.322 1.00 1.11 C ATOM 1510 C THR A 101 16.633 -5.933 -4.892 1.00 1.16 C ATOM 1511 O THR A 101 16.349 -5.809 -6.085 1.00 1.30 O ATOM 1512 CB THR A 101 18.419 -7.712 -5.122 1.00 1.30 C ATOM 1513 OG1 THR A 101 19.396 -6.667 -5.224 1.00 1.73 O ATOM 1514 CG2 THR A 101 18.037 -8.192 -6.516 1.00 1.92 C ATOM 0 H THR A 101 15.700 -8.367 -5.237 1.00 1.10 H new ATOM 0 HA THR A 101 17.508 -7.064 -3.295 1.00 1.11 H new ATOM 0 HB THR A 101 18.848 -8.553 -4.576 1.00 1.30 H new ATOM 0 HG1 THR A 101 20.169 -6.990 -5.733 1.00 1.73 H new ATOM 0 HG21 THR A 101 18.932 -8.518 -7.047 1.00 1.92 H new ATOM 0 HG22 THR A 101 17.339 -9.026 -6.435 1.00 1.92 H new ATOM 0 HG23 THR A 101 17.566 -7.377 -7.065 1.00 1.92 H new ATOM 1522 N ILE A 102 16.446 -4.971 -4.008 1.00 1.14 N ATOM 1523 CA ILE A 102 15.876 -3.674 -4.389 1.00 1.18 C ATOM 1524 C ILE A 102 16.928 -2.578 -4.469 1.00 1.22 C ATOM 1525 O ILE A 102 17.637 -2.311 -3.506 1.00 1.37 O ATOM 1526 CB ILE A 102 14.731 -3.250 -3.453 1.00 1.31 C ATOM 1527 CG1 ILE A 102 13.537 -4.189 -3.647 1.00 2.08 C ATOM 1528 CG2 ILE A 102 14.328 -1.803 -3.704 1.00 1.98 C ATOM 1529 CD1 ILE A 102 12.340 -3.852 -2.787 1.00 2.69 C ATOM 0 H ILE A 102 16.678 -5.055 -3.018 1.00 1.14 H new ATOM 0 HA ILE A 102 15.464 -3.811 -5.389 1.00 1.18 H new ATOM 0 HB ILE A 102 15.075 -3.320 -2.421 1.00 1.31 H new ATOM 0 HG12 ILE A 102 13.236 -4.165 -4.694 1.00 2.08 H new ATOM 0 HG13 ILE A 102 13.852 -5.209 -3.429 1.00 2.08 H new ATOM 0 HG21 ILE A 102 13.517 -1.529 -3.029 1.00 1.98 H new ATOM 0 HG22 ILE A 102 15.183 -1.151 -3.527 1.00 1.98 H new ATOM 0 HG23 ILE A 102 13.995 -1.692 -4.736 1.00 1.98 H new ATOM 0 HD11 ILE A 102 11.538 -4.564 -2.984 1.00 2.69 H new ATOM 0 HD12 ILE A 102 12.621 -3.905 -1.735 1.00 2.69 H new ATOM 0 HD13 ILE A 102 11.996 -2.844 -3.021 1.00 2.69 H new ATOM 1541 N THR A 103 17.000 -1.926 -5.612 1.00 1.15 N ATOM 1542 CA THR A 103 18.008 -0.917 -5.851 1.00 1.20 C ATOM 1543 C THR A 103 17.354 0.377 -6.320 1.00 1.08 C ATOM 1544 O THR A 103 16.506 0.364 -7.207 1.00 1.05 O ATOM 1545 CB THR A 103 19.087 -1.380 -6.862 1.00 1.39 C ATOM 1546 OG1 THR A 103 20.088 -0.361 -7.015 1.00 1.58 O ATOM 1547 CG2 THR A 103 18.477 -1.712 -8.219 1.00 1.57 C ATOM 0 H THR A 103 16.365 -2.080 -6.395 1.00 1.15 H new ATOM 0 HA THR A 103 18.520 -0.742 -4.905 1.00 1.20 H new ATOM 0 HB THR A 103 19.546 -2.287 -6.467 1.00 1.39 H new ATOM 0 HG1 THR A 103 20.767 -0.663 -7.654 1.00 1.58 H new ATOM 0 HG21 THR A 103 19.263 -2.033 -8.903 1.00 1.57 H new ATOM 0 HG22 THR A 103 17.747 -2.513 -8.104 1.00 1.57 H new ATOM 0 HG23 THR A 103 17.984 -0.828 -8.623 1.00 1.57 H new ATOM 1555 N GLY A 104 17.797 1.475 -5.710 1.00 1.08 N ATOM 1556 CA GLY A 104 17.201 2.808 -5.843 1.00 1.03 C ATOM 1557 C GLY A 104 15.720 2.880 -6.205 1.00 0.92 C ATOM 1558 O GLY A 104 14.907 3.098 -5.324 1.00 0.84 O ATOM 0 H GLY A 104 18.606 1.464 -5.089 1.00 1.08 H new ATOM 0 HA2 GLY A 104 17.344 3.337 -4.901 1.00 1.03 H new ATOM 0 HA3 GLY A 104 17.761 3.353 -6.603 1.00 1.03 H new ATOM 1562 N SER A 105 15.374 2.697 -7.471 1.00 0.96 N ATOM 1563 CA SER A 105 14.076 3.119 -8.013 1.00 0.92 C ATOM 1564 C SER A 105 12.855 2.395 -7.407 1.00 0.81 C ATOM 1565 O SER A 105 11.736 2.893 -7.524 1.00 0.77 O ATOM 1566 CB SER A 105 14.075 2.956 -9.537 1.00 1.05 C ATOM 1567 OG SER A 105 12.975 3.630 -10.132 1.00 1.47 O ATOM 0 H SER A 105 15.982 2.251 -8.158 1.00 0.96 H new ATOM 0 HA SER A 105 13.964 4.166 -7.731 1.00 0.92 H new ATOM 0 HB2 SER A 105 15.007 3.346 -9.946 1.00 1.05 H new ATOM 0 HB3 SER A 105 14.034 1.897 -9.791 1.00 1.05 H new ATOM 0 HG SER A 105 12.242 3.694 -9.485 1.00 1.47 H new ATOM 1573 N GLU A 106 13.036 1.244 -6.768 1.00 0.79 N ATOM 1574 CA GLU A 106 11.896 0.510 -6.207 1.00 0.72 C ATOM 1575 C GLU A 106 11.460 1.111 -4.863 1.00 0.56 C ATOM 1576 O GLU A 106 10.575 0.588 -4.191 1.00 0.51 O ATOM 1577 CB GLU A 106 12.205 -0.981 -6.054 1.00 0.82 C ATOM 1578 CG GLU A 106 12.227 -1.757 -7.367 1.00 1.28 C ATOM 1579 CD GLU A 106 13.370 -1.359 -8.278 1.00 1.74 C ATOM 1580 OE1 GLU A 106 14.515 -1.772 -8.004 1.00 2.39 O ATOM 1581 OE2 GLU A 106 13.126 -0.640 -9.273 1.00 2.11 O ATOM 0 H GLU A 106 13.943 0.801 -6.624 1.00 0.79 H new ATOM 0 HA GLU A 106 11.070 0.608 -6.912 1.00 0.72 H new ATOM 0 HB2 GLU A 106 13.173 -1.091 -5.565 1.00 0.82 H new ATOM 0 HB3 GLU A 106 11.462 -1.428 -5.394 1.00 0.82 H new ATOM 0 HG2 GLU A 106 12.298 -2.823 -7.150 1.00 1.28 H new ATOM 0 HG3 GLU A 106 11.283 -1.601 -7.890 1.00 1.28 H new ATOM 1588 N THR A 107 12.085 2.225 -4.503 1.00 0.55 N ATOM 1589 CA THR A 107 11.859 2.914 -3.253 1.00 0.49 C ATOM 1590 C THR A 107 10.480 3.562 -3.243 1.00 0.37 C ATOM 1591 O THR A 107 10.058 4.119 -2.238 1.00 0.38 O ATOM 1592 CB THR A 107 12.941 3.993 -3.006 1.00 0.62 C ATOM 1593 OG1 THR A 107 12.808 4.542 -1.690 1.00 1.41 O ATOM 1594 CG2 THR A 107 12.840 5.113 -4.033 1.00 1.27 C ATOM 0 H THR A 107 12.781 2.681 -5.093 1.00 0.55 H new ATOM 0 HA THR A 107 11.916 2.175 -2.453 1.00 0.49 H new ATOM 0 HB THR A 107 13.915 3.514 -3.103 1.00 0.62 H new ATOM 0 HG1 THR A 107 13.500 5.222 -1.548 1.00 1.41 H new ATOM 0 HG21 THR A 107 13.611 5.858 -3.836 1.00 1.27 H new ATOM 0 HG22 THR A 107 12.978 4.703 -5.033 1.00 1.27 H new ATOM 0 HG23 THR A 107 11.858 5.581 -3.965 1.00 1.27 H new ATOM 1602 N ASN A 108 9.798 3.527 -4.384 1.00 0.34 N ATOM 1603 CA ASN A 108 8.441 4.009 -4.457 1.00 0.29 C ATOM 1604 C ASN A 108 7.581 3.159 -3.549 1.00 0.25 C ATOM 1605 O ASN A 108 6.664 3.639 -2.887 1.00 0.27 O ATOM 1606 CB ASN A 108 7.944 3.875 -5.898 1.00 0.40 C ATOM 1607 CG ASN A 108 8.805 4.625 -6.902 1.00 0.58 C ATOM 1608 OD1 ASN A 108 8.989 4.165 -8.026 1.00 1.39 O ATOM 1609 ND2 ASN A 108 9.307 5.791 -6.519 1.00 1.22 N ATOM 0 H ASN A 108 10.170 3.169 -5.264 1.00 0.34 H new ATOM 0 HA ASN A 108 8.391 5.053 -4.149 1.00 0.29 H new ATOM 0 HB2 ASN A 108 7.917 2.820 -6.169 1.00 0.40 H new ATOM 0 HB3 ASN A 108 6.921 4.246 -5.958 1.00 0.40 H new ATOM 0 HD21 ASN A 108 9.870 6.342 -7.167 1.00 1.22 H new ATOM 0 HD22 ASN A 108 9.130 6.137 -5.576 1.00 1.22 H new ATOM 1616 N LEU A 109 7.951 1.896 -3.511 1.00 0.25 N ATOM 1617 CA LEU A 109 7.186 0.862 -2.859 1.00 0.26 C ATOM 1618 C LEU A 109 7.582 0.619 -1.395 1.00 0.21 C ATOM 1619 O LEU A 109 7.541 -0.523 -0.932 1.00 0.23 O ATOM 1620 CB LEU A 109 7.401 -0.411 -3.669 1.00 0.41 C ATOM 1621 CG LEU A 109 6.566 -1.614 -3.275 1.00 0.54 C ATOM 1622 CD1 LEU A 109 5.106 -1.364 -3.590 1.00 0.83 C ATOM 1623 CD2 LEU A 109 7.090 -2.841 -3.992 1.00 0.95 C ATOM 0 H LEU A 109 8.810 1.556 -3.942 1.00 0.25 H new ATOM 0 HA LEU A 109 6.142 1.173 -2.825 1.00 0.26 H new ATOM 0 HB2 LEU A 109 7.202 -0.186 -4.717 1.00 0.41 H new ATOM 0 HB3 LEU A 109 8.453 -0.688 -3.597 1.00 0.41 H new ATOM 0 HG LEU A 109 6.643 -1.783 -2.201 1.00 0.54 H new ATOM 0 HD11 LEU A 109 4.517 -2.235 -3.302 1.00 0.83 H new ATOM 0 HD12 LEU A 109 4.758 -0.492 -3.036 1.00 0.83 H new ATOM 0 HD13 LEU A 109 4.990 -1.184 -4.659 1.00 0.83 H new ATOM 0 HD21 LEU A 109 6.493 -3.709 -3.712 1.00 0.95 H new ATOM 0 HD22 LEU A 109 7.025 -2.688 -5.069 1.00 0.95 H new ATOM 0 HD23 LEU A 109 8.130 -3.010 -3.711 1.00 0.95 H new ATOM 1635 N LEU A 110 7.943 1.643 -0.639 1.00 0.20 N ATOM 1636 CA LEU A 110 8.092 1.440 0.787 1.00 0.21 C ATOM 1637 C LEU A 110 6.882 1.977 1.552 1.00 0.23 C ATOM 1638 O LEU A 110 6.362 3.048 1.238 1.00 0.31 O ATOM 1639 CB LEU A 110 9.404 2.064 1.297 1.00 0.28 C ATOM 1640 CG LEU A 110 9.969 3.251 0.507 1.00 0.81 C ATOM 1641 CD1 LEU A 110 9.058 4.466 0.619 1.00 1.71 C ATOM 1642 CD2 LEU A 110 11.364 3.582 1.010 1.00 1.64 C ATOM 0 H LEU A 110 8.131 2.588 -0.974 1.00 0.20 H new ATOM 0 HA LEU A 110 8.143 0.367 0.970 1.00 0.21 H new ATOM 0 HB2 LEU A 110 9.247 2.387 2.326 1.00 0.28 H new ATOM 0 HB3 LEU A 110 10.163 1.282 1.321 1.00 0.28 H new ATOM 0 HG LEU A 110 10.025 2.974 -0.546 1.00 0.81 H new ATOM 0 HD11 LEU A 110 9.483 5.293 0.050 1.00 1.71 H new ATOM 0 HD12 LEU A 110 8.073 4.220 0.222 1.00 1.71 H new ATOM 0 HD13 LEU A 110 8.965 4.756 1.666 1.00 1.71 H new ATOM 0 HD21 LEU A 110 11.763 4.426 0.447 1.00 1.64 H new ATOM 0 HD22 LEU A 110 11.317 3.841 2.068 1.00 1.64 H new ATOM 0 HD23 LEU A 110 12.014 2.717 0.877 1.00 1.64 H new ATOM 1654 N PHE A 111 6.438 1.231 2.561 1.00 0.22 N ATOM 1655 CA PHE A 111 5.342 1.690 3.415 1.00 0.25 C ATOM 1656 C PHE A 111 5.506 1.209 4.855 1.00 0.23 C ATOM 1657 O PHE A 111 5.766 0.031 5.111 1.00 0.27 O ATOM 1658 CB PHE A 111 3.946 1.361 2.843 1.00 0.42 C ATOM 1659 CG PHE A 111 3.481 -0.067 2.949 1.00 0.91 C ATOM 1660 CD1 PHE A 111 3.123 -0.598 4.173 1.00 1.64 C ATOM 1661 CD2 PHE A 111 3.449 -0.890 1.834 1.00 1.18 C ATOM 1662 CE1 PHE A 111 2.735 -1.918 4.280 1.00 2.38 C ATOM 1663 CE2 PHE A 111 3.055 -2.207 1.936 1.00 1.90 C ATOM 1664 CZ PHE A 111 2.549 -2.675 3.128 1.00 2.46 C ATOM 0 H PHE A 111 6.815 0.315 2.807 1.00 0.22 H new ATOM 0 HA PHE A 111 5.404 2.778 3.429 1.00 0.25 H new ATOM 0 HB2 PHE A 111 3.216 1.993 3.348 1.00 0.42 H new ATOM 0 HB3 PHE A 111 3.937 1.643 1.790 1.00 0.42 H new ATOM 0 HD1 PHE A 111 3.147 0.026 5.054 1.00 1.64 H new ATOM 0 HD2 PHE A 111 3.737 -0.494 0.872 1.00 1.18 H new ATOM 0 HE1 PHE A 111 2.577 -2.361 5.252 1.00 2.38 H new ATOM 0 HE2 PHE A 111 3.143 -2.868 1.086 1.00 1.90 H new ATOM 0 HZ PHE A 111 2.017 -3.614 3.168 1.00 2.46 H new ATOM 1674 N PHE A 112 5.430 2.156 5.771 1.00 0.21 N ATOM 1675 CA PHE A 112 5.589 1.897 7.204 1.00 0.25 C ATOM 1676 C PHE A 112 4.266 1.466 7.791 1.00 0.25 C ATOM 1677 O PHE A 112 3.346 2.275 7.930 1.00 0.26 O ATOM 1678 CB PHE A 112 6.113 3.129 7.954 1.00 0.30 C ATOM 1679 CG PHE A 112 6.005 3.025 9.455 1.00 0.57 C ATOM 1680 CD1 PHE A 112 6.503 1.922 10.132 1.00 0.79 C ATOM 1681 CD2 PHE A 112 5.389 4.031 10.187 1.00 0.95 C ATOM 1682 CE1 PHE A 112 6.392 1.825 11.506 1.00 1.21 C ATOM 1683 CE2 PHE A 112 5.273 3.937 11.561 1.00 1.43 C ATOM 1684 CZ PHE A 112 5.776 2.833 12.222 1.00 1.50 C ATOM 0 H PHE A 112 5.255 3.136 5.548 1.00 0.21 H new ATOM 0 HA PHE A 112 6.326 1.102 7.319 1.00 0.25 H new ATOM 0 HB2 PHE A 112 7.157 3.288 7.685 1.00 0.30 H new ATOM 0 HB3 PHE A 112 5.560 4.007 7.620 1.00 0.30 H new ATOM 0 HD1 PHE A 112 6.984 1.129 9.579 1.00 0.79 H new ATOM 0 HD2 PHE A 112 4.996 4.898 9.677 1.00 0.95 H new ATOM 0 HE1 PHE A 112 6.787 0.961 12.020 1.00 1.21 H new ATOM 0 HE2 PHE A 112 4.789 4.726 12.118 1.00 1.43 H new ATOM 0 HZ PHE A 112 5.688 2.758 13.296 1.00 1.50 H new ATOM 1694 N TRP A 113 4.161 0.198 8.117 1.00 0.31 N ATOM 1695 CA TRP A 113 2.864 -0.347 8.498 1.00 0.35 C ATOM 1696 C TRP A 113 2.661 -0.323 10.017 1.00 0.33 C ATOM 1697 O TRP A 113 3.292 -1.061 10.775 1.00 0.37 O ATOM 1698 CB TRP A 113 2.667 -1.761 7.922 1.00 0.48 C ATOM 1699 CG TRP A 113 3.511 -2.834 8.550 1.00 1.08 C ATOM 1700 CD1 TRP A 113 4.864 -2.828 8.729 1.00 2.30 C ATOM 1701 CD2 TRP A 113 3.044 -4.084 9.068 1.00 1.17 C ATOM 1702 NE1 TRP A 113 5.265 -3.995 9.333 1.00 3.02 N ATOM 1703 CE2 TRP A 113 4.167 -4.782 9.550 1.00 2.29 C ATOM 1704 CE3 TRP A 113 1.785 -4.679 9.172 1.00 1.12 C ATOM 1705 CZ2 TRP A 113 4.066 -6.044 10.128 1.00 2.67 C ATOM 1706 CZ3 TRP A 113 1.687 -5.932 9.746 1.00 1.47 C ATOM 1707 CH2 TRP A 113 2.822 -6.602 10.217 1.00 2.02 C ATOM 0 H TRP A 113 4.934 -0.468 8.129 1.00 0.31 H new ATOM 0 HA TRP A 113 2.098 0.297 8.065 1.00 0.35 H new ATOM 0 HB2 TRP A 113 1.618 -2.037 8.031 1.00 0.48 H new ATOM 0 HB3 TRP A 113 2.880 -1.733 6.853 1.00 0.48 H new ATOM 0 HD1 TRP A 113 5.523 -2.023 8.438 1.00 2.30 H new ATOM 0 HE1 TRP A 113 6.225 -4.236 9.580 1.00 3.02 H new ATOM 0 HE3 TRP A 113 0.904 -4.169 8.810 1.00 1.12 H new ATOM 0 HZ2 TRP A 113 4.940 -6.564 10.493 1.00 2.67 H new ATOM 0 HZ3 TRP A 113 0.719 -6.402 9.833 1.00 1.47 H new ATOM 0 HH2 TRP A 113 2.712 -7.581 10.660 1.00 2.02 H new ATOM 1718 N GLU A 114 1.793 0.578 10.447 1.00 0.32 N ATOM 1719 CA GLU A 114 1.392 0.680 11.842 1.00 0.37 C ATOM 1720 C GLU A 114 -0.012 0.100 12.000 1.00 0.39 C ATOM 1721 O GLU A 114 -0.980 0.678 11.505 1.00 0.42 O ATOM 1722 CB GLU A 114 1.433 2.143 12.299 1.00 0.43 C ATOM 1723 CG GLU A 114 1.777 2.334 13.771 1.00 0.96 C ATOM 1724 CD GLU A 114 0.710 1.818 14.716 1.00 1.50 C ATOM 1725 OE1 GLU A 114 0.741 0.619 15.055 1.00 2.32 O ATOM 1726 OE2 GLU A 114 -0.158 2.614 15.136 1.00 1.90 O ATOM 0 H GLU A 114 1.345 1.262 9.837 1.00 0.32 H new ATOM 0 HA GLU A 114 2.084 0.115 12.467 1.00 0.37 H new ATOM 0 HB2 GLU A 114 2.165 2.679 11.695 1.00 0.43 H new ATOM 0 HB3 GLU A 114 0.463 2.599 12.103 1.00 0.43 H new ATOM 0 HG2 GLU A 114 2.717 1.825 13.985 1.00 0.96 H new ATOM 0 HG3 GLU A 114 1.938 3.395 13.963 1.00 0.96 H new ATOM 1733 N THR A 115 -0.128 -1.035 12.676 1.00 0.47 N ATOM 1734 CA THR A 115 -1.405 -1.730 12.771 1.00 0.49 C ATOM 1735 C THR A 115 -2.101 -1.397 14.089 1.00 0.52 C ATOM 1736 O THR A 115 -1.562 -1.631 15.174 1.00 0.64 O ATOM 1737 CB THR A 115 -1.210 -3.255 12.659 1.00 0.67 C ATOM 1738 OG1 THR A 115 -0.414 -3.555 11.503 1.00 1.38 O ATOM 1739 CG2 THR A 115 -2.550 -3.969 12.554 1.00 1.39 C ATOM 0 H THR A 115 0.642 -1.492 13.164 1.00 0.47 H new ATOM 0 HA THR A 115 -2.030 -1.394 11.943 1.00 0.49 H new ATOM 0 HB THR A 115 -0.703 -3.604 13.558 1.00 0.67 H new ATOM 0 HG1 THR A 115 -0.290 -4.525 11.434 1.00 1.38 H new ATOM 0 HG21 THR A 115 -2.385 -5.044 12.476 1.00 1.39 H new ATOM 0 HG22 THR A 115 -3.146 -3.757 13.442 1.00 1.39 H new ATOM 0 HG23 THR A 115 -3.081 -3.618 11.669 1.00 1.39 H new ATOM 1747 N HIS A 116 -3.308 -0.857 13.981 1.00 0.47 N ATOM 1748 CA HIS A 116 -4.021 -0.335 15.132 1.00 0.56 C ATOM 1749 C HIS A 116 -5.435 -0.910 15.176 1.00 0.56 C ATOM 1750 O HIS A 116 -6.346 -0.403 14.519 1.00 0.55 O ATOM 1751 CB HIS A 116 -4.067 1.193 15.020 1.00 0.66 C ATOM 1752 CG HIS A 116 -4.292 1.909 16.312 1.00 1.29 C ATOM 1753 ND1 HIS A 116 -3.283 2.549 16.993 1.00 1.88 N ATOM 1754 CD2 HIS A 116 -5.419 2.121 17.027 1.00 2.27 C ATOM 1755 CE1 HIS A 116 -3.779 3.125 18.067 1.00 2.63 C ATOM 1756 NE2 HIS A 116 -5.075 2.884 18.114 1.00 2.89 N ATOM 0 H HIS A 116 -3.814 -0.770 13.100 1.00 0.47 H new ATOM 0 HA HIS A 116 -3.511 -0.621 16.052 1.00 0.56 H new ATOM 0 HB2 HIS A 116 -3.129 1.540 14.587 1.00 0.66 H new ATOM 0 HB3 HIS A 116 -4.860 1.469 14.325 1.00 0.66 H new ATOM 0 HD2 HIS A 116 -6.407 1.757 16.787 1.00 2.27 H new ATOM 0 HE1 HIS A 116 -3.218 3.699 18.790 1.00 2.63 H new ATOM 0 HE2 HIS A 116 -5.715 3.211 18.838 1.00 2.89 H new ATOM 1765 N GLY A 117 -5.609 -1.956 15.969 1.00 0.64 N ATOM 1766 CA GLY A 117 -6.894 -2.621 16.074 1.00 0.71 C ATOM 1767 C GLY A 117 -7.215 -3.450 14.846 1.00 0.69 C ATOM 1768 O GLY A 117 -6.631 -4.513 14.630 1.00 0.74 O ATOM 0 H GLY A 117 -4.874 -2.361 16.549 1.00 0.64 H new ATOM 0 HA2 GLY A 117 -6.897 -3.264 16.954 1.00 0.71 H new ATOM 0 HA3 GLY A 117 -7.675 -1.875 16.221 1.00 0.71 H new ATOM 1772 N THR A 118 -8.131 -2.949 14.032 1.00 0.66 N ATOM 1773 CA THR A 118 -8.506 -3.608 12.791 1.00 0.69 C ATOM 1774 C THR A 118 -7.884 -2.887 11.601 1.00 0.56 C ATOM 1775 O THR A 118 -7.386 -3.509 10.664 1.00 0.57 O ATOM 1776 CB THR A 118 -10.038 -3.643 12.630 1.00 0.81 C ATOM 1777 OG1 THR A 118 -10.583 -2.330 12.846 1.00 1.60 O ATOM 1778 CG2 THR A 118 -10.665 -4.625 13.610 1.00 1.39 C ATOM 0 H THR A 118 -8.633 -2.079 14.211 1.00 0.66 H new ATOM 0 HA THR A 118 -8.134 -4.632 12.827 1.00 0.69 H new ATOM 0 HB THR A 118 -10.268 -3.971 11.616 1.00 0.81 H new ATOM 0 HG1 THR A 118 -10.885 -1.957 11.992 1.00 1.60 H new ATOM 0 HG21 THR A 118 -11.747 -4.631 13.477 1.00 1.39 H new ATOM 0 HG22 THR A 118 -10.271 -5.624 13.426 1.00 1.39 H new ATOM 0 HG23 THR A 118 -10.427 -4.323 14.630 1.00 1.39 H new ATOM 1786 N LYS A 119 -7.923 -1.567 11.663 1.00 0.50 N ATOM 1787 CA LYS A 119 -7.334 -0.715 10.642 1.00 0.41 C ATOM 1788 C LYS A 119 -5.816 -0.602 10.866 1.00 0.35 C ATOM 1789 O LYS A 119 -5.290 -1.008 11.905 1.00 0.40 O ATOM 1790 CB LYS A 119 -7.952 0.681 10.714 1.00 0.46 C ATOM 1791 CG LYS A 119 -7.571 1.444 11.970 1.00 0.98 C ATOM 1792 CD LYS A 119 -7.832 2.926 11.808 1.00 1.36 C ATOM 1793 CE LYS A 119 -6.992 3.744 12.770 1.00 1.79 C ATOM 1794 NZ LYS A 119 -6.876 5.158 12.330 1.00 2.49 N ATOM 0 H LYS A 119 -8.365 -1.053 12.425 1.00 0.50 H new ATOM 0 HA LYS A 119 -7.528 -1.154 9.663 1.00 0.41 H new ATOM 0 HB2 LYS A 119 -7.640 1.254 9.841 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -9.037 0.593 10.666 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -8.140 1.062 12.818 1.00 0.98 H new ATOM 0 HG3 LYS A 119 -6.517 1.280 12.193 1.00 0.98 H new ATOM 0 HD2 LYS A 119 -7.611 3.226 10.784 1.00 1.36 H new ATOM 0 HD3 LYS A 119 -8.889 3.132 11.979 1.00 1.36 H new ATOM 0 HE2 LYS A 119 -7.437 3.707 13.764 1.00 1.79 H new ATOM 0 HE3 LYS A 119 -5.998 3.305 12.850 1.00 1.79 H new ATOM 0 HZ1 LYS A 119 -6.140 5.636 12.888 1.00 2.49 H new ATOM 0 HZ2 LYS A 119 -6.621 5.188 11.322 1.00 2.49 H new ATOM 0 HZ3 LYS A 119 -7.786 5.641 12.472 1.00 2.49 H new ATOM 1808 N ASN A 120 -5.133 -0.047 9.888 1.00 0.30 N ATOM 1809 CA ASN A 120 -3.696 0.225 9.966 1.00 0.28 C ATOM 1810 C ASN A 120 -3.322 1.299 8.941 1.00 0.28 C ATOM 1811 O ASN A 120 -3.981 1.409 7.913 1.00 0.32 O ATOM 1812 CB ASN A 120 -2.875 -1.058 9.729 1.00 0.36 C ATOM 1813 CG ASN A 120 -3.066 -1.673 8.350 1.00 1.26 C ATOM 1814 OD1 ASN A 120 -4.125 -1.567 7.738 1.00 2.08 O ATOM 1815 ND2 ASN A 120 -2.036 -2.344 7.859 1.00 2.07 N ATOM 0 H ASN A 120 -5.555 0.235 9.003 1.00 0.30 H new ATOM 0 HA ASN A 120 -3.463 0.587 10.967 1.00 0.28 H new ATOM 0 HB2 ASN A 120 -1.818 -0.831 9.871 1.00 0.36 H new ATOM 0 HB3 ASN A 120 -3.147 -1.795 10.484 1.00 0.36 H new ATOM 0 HD21 ASN A 120 -2.108 -2.792 6.946 1.00 2.07 H new ATOM 0 HD22 ASN A 120 -1.170 -2.413 8.394 1.00 2.07 H new ATOM 1822 N TYR A 121 -2.300 2.113 9.224 1.00 0.31 N ATOM 1823 CA TYR A 121 -1.872 3.144 8.268 1.00 0.37 C ATOM 1824 C TYR A 121 -0.480 2.862 7.695 1.00 0.30 C ATOM 1825 O TYR A 121 0.285 2.080 8.267 1.00 0.34 O ATOM 1826 CB TYR A 121 -1.953 4.554 8.878 1.00 0.66 C ATOM 1827 CG TYR A 121 -1.080 4.826 10.085 1.00 1.06 C ATOM 1828 CD1 TYR A 121 0.276 5.091 9.939 1.00 1.41 C ATOM 1829 CD2 TYR A 121 -1.599 4.764 11.370 1.00 1.46 C ATOM 1830 CE1 TYR A 121 1.088 5.285 11.042 1.00 2.01 C ATOM 1831 CE2 TYR A 121 -0.799 4.965 12.476 1.00 1.98 C ATOM 1832 CZ TYR A 121 0.501 5.432 12.292 1.00 2.23 C ATOM 1833 OH TYR A 121 1.350 5.404 13.412 1.00 2.84 O ATOM 0 H TYR A 121 -1.761 2.082 10.090 1.00 0.31 H new ATOM 0 HA TYR A 121 -2.573 3.106 7.434 1.00 0.37 H new ATOM 0 HB2 TYR A 121 -1.695 5.275 8.102 1.00 0.66 H new ATOM 0 HB3 TYR A 121 -2.989 4.744 9.158 1.00 0.66 H new ATOM 0 HD1 TYR A 121 0.703 5.146 8.949 1.00 1.41 H new ATOM 0 HD2 TYR A 121 -2.650 4.554 11.507 1.00 1.46 H new ATOM 0 HE1 TYR A 121 2.162 5.322 10.933 1.00 2.01 H new ATOM 0 HE2 TYR A 121 -1.174 4.764 13.468 1.00 1.98 H new ATOM 0 HH TYR A 121 0.819 5.518 14.228 1.00 2.84 H new ATOM 1843 N PHE A 122 -0.148 3.518 6.569 1.00 0.30 N ATOM 1844 CA PHE A 122 1.100 3.284 5.866 1.00 0.29 C ATOM 1845 C PHE A 122 1.841 4.603 5.673 1.00 0.26 C ATOM 1846 O PHE A 122 1.506 5.382 4.785 1.00 0.32 O ATOM 1847 CB PHE A 122 0.848 2.656 4.483 1.00 0.34 C ATOM 1848 CG PHE A 122 0.200 1.291 4.497 1.00 1.05 C ATOM 1849 CD1 PHE A 122 0.186 0.509 5.642 1.00 1.45 C ATOM 1850 CD2 PHE A 122 -0.397 0.794 3.349 1.00 1.56 C ATOM 1851 CE1 PHE A 122 -0.410 -0.737 5.640 1.00 2.18 C ATOM 1852 CE2 PHE A 122 -0.993 -0.453 3.342 1.00 2.27 C ATOM 1853 CZ PHE A 122 -1.001 -1.218 4.489 1.00 2.54 C ATOM 0 H PHE A 122 -0.744 4.221 6.132 1.00 0.30 H new ATOM 0 HA PHE A 122 1.697 2.597 6.466 1.00 0.29 H new ATOM 0 HB2 PHE A 122 0.218 3.332 3.906 1.00 0.34 H new ATOM 0 HB3 PHE A 122 1.800 2.582 3.958 1.00 0.34 H new ATOM 0 HD1 PHE A 122 0.647 0.879 6.546 1.00 1.45 H new ATOM 0 HD2 PHE A 122 -0.396 1.389 2.448 1.00 1.56 H new ATOM 0 HE1 PHE A 122 -0.414 -1.335 6.539 1.00 2.18 H new ATOM 0 HE2 PHE A 122 -1.452 -0.828 2.439 1.00 2.27 H new ATOM 0 HZ PHE A 122 -1.469 -2.191 4.487 1.00 2.54 H new ATOM 1863 N THR A 123 2.834 4.854 6.500 1.00 0.22 N ATOM 1864 CA THR A 123 3.638 6.047 6.390 1.00 0.22 C ATOM 1865 C THR A 123 4.801 5.747 5.469 1.00 0.20 C ATOM 1866 O THR A 123 5.373 4.675 5.543 1.00 0.19 O ATOM 1867 CB THR A 123 4.176 6.439 7.778 1.00 0.24 C ATOM 1868 OG1 THR A 123 3.100 6.490 8.723 1.00 0.32 O ATOM 1869 CG2 THR A 123 4.875 7.786 7.735 1.00 0.33 C ATOM 0 H THR A 123 3.104 4.236 7.265 1.00 0.22 H new ATOM 0 HA THR A 123 3.040 6.869 5.996 1.00 0.22 H new ATOM 0 HB THR A 123 4.900 5.683 8.084 1.00 0.24 H new ATOM 0 HG1 THR A 123 2.344 6.976 8.332 1.00 0.32 H new ATOM 0 HG21 THR A 123 5.244 8.036 8.730 1.00 0.33 H new ATOM 0 HG22 THR A 123 5.712 7.740 7.038 1.00 0.33 H new ATOM 0 HG23 THR A 123 4.171 8.551 7.406 1.00 0.33 H new ATOM 1877 N SER A 124 5.150 6.652 4.580 1.00 0.21 N ATOM 1878 CA SER A 124 6.211 6.344 3.649 1.00 0.23 C ATOM 1879 C SER A 124 7.524 6.324 4.412 1.00 0.29 C ATOM 1880 O SER A 124 7.877 7.281 5.097 1.00 0.34 O ATOM 1881 CB SER A 124 6.253 7.361 2.509 1.00 0.26 C ATOM 1882 OG SER A 124 7.262 7.039 1.566 1.00 1.17 O ATOM 0 H SER A 124 4.731 7.577 4.483 1.00 0.21 H new ATOM 0 HA SER A 124 6.033 5.368 3.197 1.00 0.23 H new ATOM 0 HB2 SER A 124 5.284 7.392 2.011 1.00 0.26 H new ATOM 0 HB3 SER A 124 6.435 8.356 2.914 1.00 0.26 H new ATOM 0 HG SER A 124 6.846 6.739 0.731 1.00 1.17 H new ATOM 1888 N VAL A 125 8.226 5.204 4.305 1.00 0.33 N ATOM 1889 CA VAL A 125 9.417 4.975 5.098 1.00 0.43 C ATOM 1890 C VAL A 125 10.573 5.827 4.582 1.00 0.53 C ATOM 1891 O VAL A 125 11.491 6.172 5.331 1.00 0.65 O ATOM 1892 CB VAL A 125 9.777 3.463 5.096 1.00 0.48 C ATOM 1893 CG1 VAL A 125 11.241 3.228 5.442 1.00 0.81 C ATOM 1894 CG2 VAL A 125 8.892 2.715 6.073 1.00 0.47 C ATOM 0 H VAL A 125 7.987 4.440 3.673 1.00 0.33 H new ATOM 0 HA VAL A 125 9.223 5.273 6.128 1.00 0.43 H new ATOM 0 HB VAL A 125 9.608 3.087 4.087 1.00 0.48 H new ATOM 0 HG11 VAL A 125 11.451 2.158 5.430 1.00 0.81 H new ATOM 0 HG12 VAL A 125 11.873 3.730 4.710 1.00 0.81 H new ATOM 0 HG13 VAL A 125 11.449 3.627 6.435 1.00 0.81 H new ATOM 0 HG21 VAL A 125 9.153 1.657 6.063 1.00 0.47 H new ATOM 0 HG22 VAL A 125 9.038 3.116 7.076 1.00 0.47 H new ATOM 0 HG23 VAL A 125 7.848 2.834 5.783 1.00 0.47 H new ATOM 1904 N ALA A 126 10.507 6.202 3.312 1.00 0.53 N ATOM 1905 CA ALA A 126 11.473 7.141 2.765 1.00 0.63 C ATOM 1906 C ALA A 126 11.196 8.552 3.273 1.00 0.63 C ATOM 1907 O ALA A 126 12.102 9.250 3.728 1.00 0.72 O ATOM 1908 CB ALA A 126 11.448 7.113 1.243 1.00 0.68 C ATOM 0 H ALA A 126 9.804 5.875 2.649 1.00 0.53 H new ATOM 0 HA ALA A 126 12.466 6.840 3.099 1.00 0.63 H new ATOM 0 HB1 ALA A 126 12.178 7.823 0.854 1.00 0.68 H new ATOM 0 HB2 ALA A 126 11.695 6.110 0.893 1.00 0.68 H new ATOM 0 HB3 ALA A 126 10.453 7.386 0.890 1.00 0.68 H new ATOM 1914 N HIS A 127 9.931 8.960 3.211 1.00 0.56 N ATOM 1915 CA HIS A 127 9.528 10.287 3.647 1.00 0.58 C ATOM 1916 C HIS A 127 8.110 10.222 4.221 1.00 0.47 C ATOM 1917 O HIS A 127 7.160 10.000 3.484 1.00 0.44 O ATOM 1918 CB HIS A 127 9.591 11.258 2.454 1.00 0.72 C ATOM 1919 CG HIS A 127 9.609 12.709 2.828 1.00 1.15 C ATOM 1920 ND1 HIS A 127 8.755 13.644 2.276 1.00 1.70 N ATOM 1921 CD2 HIS A 127 10.418 13.396 3.670 1.00 1.99 C ATOM 1922 CE1 HIS A 127 9.041 14.839 2.763 1.00 2.29 C ATOM 1923 NE2 HIS A 127 10.043 14.715 3.610 1.00 2.47 N ATOM 0 H HIS A 127 9.166 8.384 2.860 1.00 0.56 H new ATOM 0 HA HIS A 127 10.203 10.647 4.424 1.00 0.58 H new ATOM 0 HB2 HIS A 127 10.484 11.036 1.869 1.00 0.72 H new ATOM 0 HB3 HIS A 127 8.733 11.074 1.808 1.00 0.72 H new ATOM 0 HD2 HIS A 127 11.211 12.983 4.276 1.00 1.99 H new ATOM 0 HE1 HIS A 127 8.539 15.761 2.510 1.00 2.29 H new ATOM 0 HE2 HIS A 127 10.471 15.477 4.136 1.00 2.47 H new ATOM 1932 N PRO A 128 7.953 10.434 5.534 1.00 0.47 N ATOM 1933 CA PRO A 128 6.652 10.390 6.228 1.00 0.43 C ATOM 1934 C PRO A 128 5.605 11.332 5.636 1.00 0.40 C ATOM 1935 O PRO A 128 4.412 11.046 5.698 1.00 0.39 O ATOM 1936 CB PRO A 128 6.957 10.783 7.660 1.00 0.53 C ATOM 1937 CG PRO A 128 8.332 11.359 7.640 1.00 0.79 C ATOM 1938 CD PRO A 128 9.043 10.726 6.475 1.00 0.60 C ATOM 0 HA PRO A 128 6.215 9.396 6.133 1.00 0.43 H new ATOM 0 HB2 PRO A 128 6.234 11.511 8.028 1.00 0.53 H new ATOM 0 HB3 PRO A 128 6.905 9.919 8.322 1.00 0.53 H new ATOM 0 HG2 PRO A 128 8.297 12.443 7.531 1.00 0.79 H new ATOM 0 HG3 PRO A 128 8.854 11.149 8.574 1.00 0.79 H new ATOM 0 HD2 PRO A 128 9.781 11.400 6.040 1.00 0.60 H new ATOM 0 HD3 PRO A 128 9.573 9.821 6.771 1.00 0.60 H new ATOM 1946 N ASN A 129 6.039 12.503 5.161 1.00 0.44 N ATOM 1947 CA ASN A 129 5.118 13.491 4.609 1.00 0.47 C ATOM 1948 C ASN A 129 4.486 12.976 3.328 1.00 0.39 C ATOM 1949 O ASN A 129 3.681 13.646 2.690 1.00 0.44 O ATOM 1950 CB ASN A 129 5.835 14.800 4.324 1.00 0.57 C ATOM 1951 CG ASN A 129 6.217 15.560 5.583 1.00 1.07 C ATOM 1952 OD1 ASN A 129 5.387 15.481 6.616 1.00 1.84 O flip ATOM 1953 ND2 ASN A 129 7.250 16.227 5.624 1.00 1.44 N flip ATOM 0 H ASN A 129 7.019 12.786 5.149 1.00 0.44 H new ATOM 0 HA ASN A 129 4.338 13.667 5.350 1.00 0.47 H new ATOM 0 HB2 ASN A 129 6.735 14.595 3.744 1.00 0.57 H new ATOM 0 HB3 ASN A 129 5.195 15.431 3.707 1.00 0.57 H new ATOM 0 HD21 ASN A 129 7.865 16.265 4.811 1.00 1.44 H new ATOM 0 HD22 ASN A 129 7.491 16.742 6.471 1.00 1.44 H new ATOM 1960 N LEU A 130 4.923 11.814 2.919 1.00 0.32 N ATOM 1961 CA LEU A 130 4.158 11.011 2.007 1.00 0.26 C ATOM 1962 C LEU A 130 3.409 10.013 2.873 1.00 0.24 C ATOM 1963 O LEU A 130 4.009 9.349 3.719 1.00 0.26 O ATOM 1964 CB LEU A 130 5.087 10.283 1.032 1.00 0.30 C ATOM 1965 CG LEU A 130 6.369 11.039 0.660 1.00 0.58 C ATOM 1966 CD1 LEU A 130 7.211 10.222 -0.305 1.00 1.38 C ATOM 1967 CD2 LEU A 130 6.043 12.402 0.072 1.00 1.28 C ATOM 0 H LEU A 130 5.811 11.402 3.206 1.00 0.32 H new ATOM 0 HA LEU A 130 3.477 11.615 1.408 1.00 0.26 H new ATOM 0 HB2 LEU A 130 5.364 9.323 1.468 1.00 0.30 H new ATOM 0 HB3 LEU A 130 4.532 10.070 0.118 1.00 0.30 H new ATOM 0 HG LEU A 130 6.948 11.195 1.570 1.00 0.58 H new ATOM 0 HD11 LEU A 130 8.116 10.775 -0.557 1.00 1.38 H new ATOM 0 HD12 LEU A 130 7.483 9.275 0.161 1.00 1.38 H new ATOM 0 HD13 LEU A 130 6.639 10.029 -1.213 1.00 1.38 H new ATOM 0 HD21 LEU A 130 6.968 12.919 -0.184 1.00 1.28 H new ATOM 0 HD22 LEU A 130 5.438 12.276 -0.826 1.00 1.28 H new ATOM 0 HD23 LEU A 130 5.489 12.991 0.803 1.00 1.28 H new ATOM 1979 N PHE A 131 2.142 9.848 2.633 1.00 0.23 N ATOM 1980 CA PHE A 131 1.336 8.999 3.488 1.00 0.27 C ATOM 1981 C PHE A 131 0.237 8.384 2.636 1.00 0.26 C ATOM 1982 O PHE A 131 -0.418 9.090 1.867 1.00 0.26 O ATOM 1983 CB PHE A 131 0.799 9.878 4.633 1.00 0.42 C ATOM 1984 CG PHE A 131 0.284 9.175 5.851 1.00 0.36 C ATOM 1985 CD1 PHE A 131 0.897 8.011 6.288 1.00 0.63 C ATOM 1986 CD2 PHE A 131 -0.821 9.641 6.533 1.00 0.65 C ATOM 1987 CE1 PHE A 131 0.417 7.327 7.385 1.00 0.97 C ATOM 1988 CE2 PHE A 131 -1.303 8.964 7.635 1.00 0.96 C ATOM 1989 CZ PHE A 131 -0.654 7.943 8.153 1.00 1.05 C ATOM 0 H PHE A 131 1.638 10.283 1.860 1.00 0.23 H new ATOM 0 HA PHE A 131 1.899 8.178 3.932 1.00 0.27 H new ATOM 0 HB2 PHE A 131 1.597 10.552 4.944 1.00 0.42 H new ATOM 0 HB3 PHE A 131 -0.005 10.497 4.235 1.00 0.42 H new ATOM 0 HD1 PHE A 131 1.762 7.635 5.762 1.00 0.63 H new ATOM 0 HD2 PHE A 131 -1.313 10.543 6.202 1.00 0.65 H new ATOM 0 HE1 PHE A 131 0.823 6.366 7.665 1.00 0.97 H new ATOM 0 HE2 PHE A 131 -2.234 9.279 8.082 1.00 0.96 H new ATOM 0 HZ PHE A 131 -0.912 7.568 9.132 1.00 1.05 H new ATOM 1999 N ILE A 132 0.018 7.089 2.804 1.00 0.28 N ATOM 2000 CA ILE A 132 -0.713 6.305 1.821 1.00 0.27 C ATOM 2001 C ILE A 132 -2.211 6.327 2.117 1.00 0.25 C ATOM 2002 O ILE A 132 -2.724 5.547 2.896 1.00 0.32 O ATOM 2003 CB ILE A 132 -0.154 4.853 1.809 1.00 0.34 C ATOM 2004 CG1 ILE A 132 1.331 4.859 1.418 1.00 0.87 C ATOM 2005 CG2 ILE A 132 -0.950 3.960 0.863 1.00 0.80 C ATOM 2006 CD1 ILE A 132 1.611 5.456 0.056 1.00 1.39 C ATOM 0 H ILE A 132 0.337 6.558 3.614 1.00 0.28 H new ATOM 0 HA ILE A 132 -0.576 6.741 0.831 1.00 0.27 H new ATOM 0 HB ILE A 132 -0.254 4.445 2.815 1.00 0.34 H new ATOM 0 HG12 ILE A 132 1.891 5.417 2.169 1.00 0.87 H new ATOM 0 HG13 ILE A 132 1.704 3.835 1.437 1.00 0.87 H new ATOM 0 HG21 ILE A 132 -0.534 2.953 0.878 1.00 0.80 H new ATOM 0 HG22 ILE A 132 -1.991 3.928 1.183 1.00 0.80 H new ATOM 0 HG23 ILE A 132 -0.894 4.361 -0.149 1.00 0.80 H new ATOM 0 HD11 ILE A 132 2.682 5.422 -0.143 1.00 1.39 H new ATOM 0 HD12 ILE A 132 1.082 4.885 -0.707 1.00 1.39 H new ATOM 0 HD13 ILE A 132 1.271 6.491 0.036 1.00 1.39 H new ATOM 2018 N ALA A 133 -2.905 7.176 1.403 1.00 0.22 N ATOM 2019 CA ALA A 133 -4.278 7.537 1.739 1.00 0.23 C ATOM 2020 C ALA A 133 -5.337 6.723 1.023 1.00 0.23 C ATOM 2021 O ALA A 133 -5.126 6.250 -0.076 1.00 0.26 O ATOM 2022 CB ALA A 133 -4.486 8.983 1.398 1.00 0.25 C ATOM 0 H ALA A 133 -2.544 7.642 0.571 1.00 0.22 H new ATOM 0 HA ALA A 133 -4.397 7.332 2.803 1.00 0.23 H new ATOM 0 HB1 ALA A 133 -5.508 9.271 1.643 1.00 0.25 H new ATOM 0 HB2 ALA A 133 -3.789 9.596 1.970 1.00 0.25 H new ATOM 0 HB3 ALA A 133 -4.312 9.134 0.333 1.00 0.25 H new ATOM 2028 N THR A 134 -6.497 6.614 1.644 1.00 0.23 N ATOM 2029 CA THR A 134 -7.674 6.072 0.996 1.00 0.25 C ATOM 2030 C THR A 134 -8.839 7.036 1.177 1.00 0.26 C ATOM 2031 O THR A 134 -9.093 7.541 2.271 1.00 0.31 O ATOM 2032 CB THR A 134 -8.016 4.681 1.508 1.00 0.31 C ATOM 2033 OG1 THR A 134 -7.798 4.670 2.890 1.00 0.96 O ATOM 2034 CG2 THR A 134 -7.170 3.617 0.829 1.00 1.01 C ATOM 0 H THR A 134 -6.648 6.899 2.612 1.00 0.23 H new ATOM 0 HA THR A 134 -7.465 5.963 -0.068 1.00 0.25 H new ATOM 0 HB THR A 134 -9.057 4.452 1.281 1.00 0.31 H new ATOM 0 HG1 THR A 134 -8.034 5.544 3.265 1.00 0.96 H new ATOM 0 HG21 THR A 134 -7.440 2.635 1.218 1.00 1.01 H new ATOM 0 HG22 THR A 134 -7.347 3.643 -0.246 1.00 1.01 H new ATOM 0 HG23 THR A 134 -6.116 3.809 1.028 1.00 1.01 H new ATOM 2042 N LYS A 135 -9.480 7.321 0.083 1.00 0.28 N ATOM 2043 CA LYS A 135 -10.552 8.308 0.008 1.00 0.31 C ATOM 2044 C LYS A 135 -11.892 7.592 -0.180 1.00 0.40 C ATOM 2045 O LYS A 135 -11.942 6.514 -0.768 1.00 0.47 O ATOM 2046 CB LYS A 135 -10.305 9.270 -1.167 1.00 0.35 C ATOM 2047 CG LYS A 135 -10.042 10.730 -0.781 1.00 0.69 C ATOM 2048 CD LYS A 135 -8.570 11.015 -0.480 1.00 0.76 C ATOM 2049 CE LYS A 135 -8.277 12.519 -0.530 1.00 0.89 C ATOM 2050 NZ LYS A 135 -6.849 12.843 -0.224 1.00 0.63 N ATOM 0 H LYS A 135 -9.279 6.872 -0.810 1.00 0.28 H new ATOM 0 HA LYS A 135 -10.574 8.883 0.934 1.00 0.31 H new ATOM 0 HB2 LYS A 135 -9.453 8.905 -1.740 1.00 0.35 H new ATOM 0 HB3 LYS A 135 -11.171 9.238 -1.828 1.00 0.35 H new ATOM 0 HG2 LYS A 135 -10.373 11.379 -1.592 1.00 0.69 H new ATOM 0 HG3 LYS A 135 -10.641 10.982 0.094 1.00 0.69 H new ATOM 0 HD2 LYS A 135 -8.315 10.624 0.505 1.00 0.76 H new ATOM 0 HD3 LYS A 135 -7.941 10.495 -1.202 1.00 0.76 H new ATOM 0 HE2 LYS A 135 -8.527 12.900 -1.520 1.00 0.89 H new ATOM 0 HE3 LYS A 135 -8.922 13.034 0.182 1.00 0.89 H new ATOM 0 HZ1 LYS A 135 -6.784 13.814 0.142 1.00 0.63 H new ATOM 0 HZ2 LYS A 135 -6.488 12.179 0.491 1.00 0.63 H new ATOM 0 HZ3 LYS A 135 -6.281 12.761 -1.091 1.00 0.63 H new ATOM 2064 N GLN A 136 -12.974 8.197 0.306 1.00 0.49 N ATOM 2065 CA GLN A 136 -14.317 7.630 0.136 1.00 0.63 C ATOM 2066 C GLN A 136 -14.833 7.801 -1.284 1.00 0.58 C ATOM 2067 O GLN A 136 -15.658 7.019 -1.753 1.00 0.69 O ATOM 2068 CB GLN A 136 -15.332 8.282 1.080 1.00 0.82 C ATOM 2069 CG GLN A 136 -14.984 8.160 2.543 1.00 1.05 C ATOM 2070 CD GLN A 136 -16.203 7.993 3.419 1.00 1.14 C ATOM 2071 OE1 GLN A 136 -16.589 6.750 3.650 1.00 1.75 O flip ATOM 2072 NE2 GLN A 136 -16.787 8.967 3.887 1.00 1.20 N flip ATOM 0 H GLN A 136 -12.951 9.078 0.820 1.00 0.49 H new ATOM 0 HA GLN A 136 -14.217 6.570 0.368 1.00 0.63 H new ATOM 0 HB2 GLN A 136 -15.421 9.338 0.826 1.00 0.82 H new ATOM 0 HB3 GLN A 136 -16.310 7.830 0.912 1.00 0.82 H new ATOM 0 HG2 GLN A 136 -14.320 7.307 2.685 1.00 1.05 H new ATOM 0 HG3 GLN A 136 -14.435 9.047 2.857 1.00 1.05 H new ATOM 0 HE21 GLN A 136 -16.453 9.909 3.682 1.00 1.20 H new ATOM 0 HE22 GLN A 136 -17.606 8.834 4.481 1.00 1.20 H new ATOM 2081 N ASP A 137 -14.371 8.834 -1.953 1.00 0.48 N ATOM 2082 CA ASP A 137 -14.917 9.194 -3.255 1.00 0.52 C ATOM 2083 C ASP A 137 -13.815 9.332 -4.289 1.00 0.47 C ATOM 2084 O ASP A 137 -13.987 8.973 -5.455 1.00 0.56 O ATOM 2085 CB ASP A 137 -15.686 10.512 -3.133 1.00 0.63 C ATOM 2086 CG ASP A 137 -16.248 10.998 -4.455 1.00 1.34 C ATOM 2087 OD1 ASP A 137 -15.516 11.683 -5.198 1.00 2.21 O ATOM 2088 OD2 ASP A 137 -17.411 10.678 -4.770 1.00 1.43 O ATOM 0 H ASP A 137 -13.621 9.442 -1.623 1.00 0.48 H new ATOM 0 HA ASP A 137 -15.590 8.402 -3.583 1.00 0.52 H new ATOM 0 HB2 ASP A 137 -16.503 10.385 -2.423 1.00 0.63 H new ATOM 0 HB3 ASP A 137 -15.024 11.275 -2.724 1.00 0.63 H new ATOM 2093 N TYR A 138 -12.679 9.833 -3.845 1.00 0.39 N ATOM 2094 CA TYR A 138 -11.584 10.145 -4.742 1.00 0.38 C ATOM 2095 C TYR A 138 -10.568 9.021 -4.782 1.00 0.32 C ATOM 2096 O TYR A 138 -10.728 8.003 -4.115 1.00 0.31 O ATOM 2097 CB TYR A 138 -10.907 11.454 -4.340 1.00 0.44 C ATOM 2098 CG TYR A 138 -11.811 12.657 -4.454 1.00 0.82 C ATOM 2099 CD1 TYR A 138 -12.232 13.119 -5.692 1.00 0.99 C ATOM 2100 CD2 TYR A 138 -12.237 13.336 -3.318 1.00 1.41 C ATOM 2101 CE1 TYR A 138 -13.056 14.223 -5.797 1.00 1.45 C ATOM 2102 CE2 TYR A 138 -13.059 14.439 -3.415 1.00 1.98 C ATOM 2103 CZ TYR A 138 -13.486 14.863 -4.671 1.00 1.94 C ATOM 2104 OH TYR A 138 -14.294 15.977 -4.758 1.00 2.50 O ATOM 0 H TYR A 138 -12.490 10.034 -2.863 1.00 0.39 H new ATOM 0 HA TYR A 138 -12.002 10.262 -5.742 1.00 0.38 H new ATOM 0 HB2 TYR A 138 -10.554 11.371 -3.312 1.00 0.44 H new ATOM 0 HB3 TYR A 138 -10.029 11.608 -4.968 1.00 0.44 H new ATOM 0 HD1 TYR A 138 -11.911 12.608 -6.588 1.00 0.99 H new ATOM 0 HD2 TYR A 138 -11.919 12.994 -2.344 1.00 1.41 H new ATOM 0 HE1 TYR A 138 -13.360 14.579 -6.770 1.00 1.45 H new ATOM 0 HE2 TYR A 138 -13.368 14.969 -2.526 1.00 1.98 H new ATOM 0 HH TYR A 138 -14.503 16.301 -3.857 1.00 2.50 H new ATOM 2114 N TRP A 139 -9.519 9.233 -5.550 1.00 0.34 N ATOM 2115 CA TRP A 139 -8.455 8.259 -5.692 1.00 0.33 C ATOM 2116 C TRP A 139 -7.609 8.174 -4.428 1.00 0.30 C ATOM 2117 O TRP A 139 -7.678 9.034 -3.545 1.00 0.32 O ATOM 2118 CB TRP A 139 -7.567 8.609 -6.888 1.00 0.40 C ATOM 2119 CG TRP A 139 -8.304 8.616 -8.190 1.00 1.19 C ATOM 2120 CD1 TRP A 139 -8.754 7.530 -8.885 1.00 2.40 C ATOM 2121 CD2 TRP A 139 -8.672 9.765 -8.955 1.00 1.47 C ATOM 2122 NE1 TRP A 139 -9.387 7.936 -10.033 1.00 3.09 N ATOM 2123 CE2 TRP A 139 -9.349 9.305 -10.099 1.00 2.48 C ATOM 2124 CE3 TRP A 139 -8.500 11.142 -8.781 1.00 1.75 C ATOM 2125 CZ2 TRP A 139 -9.848 10.169 -11.066 1.00 2.99 C ATOM 2126 CZ3 TRP A 139 -8.997 11.999 -9.742 1.00 2.37 C ATOM 2127 CH2 TRP A 139 -9.665 11.510 -10.871 1.00 2.74 C ATOM 0 H TRP A 139 -9.380 10.085 -6.093 1.00 0.34 H new ATOM 0 HA TRP A 139 -8.917 7.286 -5.860 1.00 0.33 H new ATOM 0 HB2 TRP A 139 -7.121 9.590 -6.726 1.00 0.40 H new ATOM 0 HB3 TRP A 139 -6.748 7.892 -6.946 1.00 0.40 H new ATOM 0 HD1 TRP A 139 -8.630 6.502 -8.576 1.00 2.40 H new ATOM 0 HE1 TRP A 139 -9.816 7.320 -10.724 1.00 3.09 H new ATOM 0 HE3 TRP A 139 -7.988 11.527 -7.912 1.00 1.75 H new ATOM 0 HZ2 TRP A 139 -10.361 9.795 -11.939 1.00 2.99 H new ATOM 0 HZ3 TRP A 139 -8.868 13.064 -9.621 1.00 2.37 H new ATOM 0 HH2 TRP A 139 -10.044 12.207 -11.604 1.00 2.74 H new ATOM 2138 N VAL A 140 -6.832 7.109 -4.351 1.00 0.30 N ATOM 2139 CA VAL A 140 -5.896 6.896 -3.259 1.00 0.33 C ATOM 2140 C VAL A 140 -4.789 7.952 -3.320 1.00 0.30 C ATOM 2141 O VAL A 140 -3.908 7.900 -4.175 1.00 0.32 O ATOM 2142 CB VAL A 140 -5.291 5.464 -3.369 1.00 0.44 C ATOM 2143 CG1 VAL A 140 -4.902 5.149 -4.808 1.00 1.58 C ATOM 2144 CG2 VAL A 140 -4.081 5.283 -2.469 1.00 1.28 C ATOM 0 H VAL A 140 -6.831 6.363 -5.047 1.00 0.30 H new ATOM 0 HA VAL A 140 -6.414 6.988 -2.304 1.00 0.33 H new ATOM 0 HB VAL A 140 -6.066 4.772 -3.040 1.00 0.44 H new ATOM 0 HG11 VAL A 140 -4.482 4.144 -4.860 1.00 1.58 H new ATOM 0 HG12 VAL A 140 -5.785 5.207 -5.445 1.00 1.58 H new ATOM 0 HG13 VAL A 140 -4.160 5.870 -5.151 1.00 1.58 H new ATOM 0 HG21 VAL A 140 -3.694 4.270 -2.579 1.00 1.28 H new ATOM 0 HG22 VAL A 140 -3.309 5.999 -2.749 1.00 1.28 H new ATOM 0 HG23 VAL A 140 -4.371 5.449 -1.432 1.00 1.28 H new ATOM 2154 N CYS A 141 -4.855 8.937 -2.425 1.00 0.30 N ATOM 2155 CA CYS A 141 -3.921 10.052 -2.483 1.00 0.26 C ATOM 2156 C CYS A 141 -2.799 9.920 -1.461 1.00 0.25 C ATOM 2157 O CYS A 141 -2.510 8.838 -0.955 1.00 0.29 O ATOM 2158 CB CYS A 141 -4.661 11.372 -2.228 1.00 0.33 C ATOM 2159 SG CYS A 141 -5.865 11.838 -3.492 1.00 1.21 S ATOM 0 H CYS A 141 -5.534 8.983 -1.665 1.00 0.30 H new ATOM 0 HA CYS A 141 -3.481 10.043 -3.480 1.00 0.26 H new ATOM 0 HB2 CYS A 141 -5.174 11.303 -1.269 1.00 0.33 H new ATOM 0 HB3 CYS A 141 -3.925 12.171 -2.139 1.00 0.33 H new ATOM 0 HG CYS A 141 -6.710 10.865 -3.666 1.00 1.21 H new ATOM 2165 N LEU A 142 -2.171 11.048 -1.188 1.00 0.21 N ATOM 2166 CA LEU A 142 -1.050 11.145 -0.289 1.00 0.23 C ATOM 2167 C LEU A 142 -1.214 12.426 0.505 1.00 0.24 C ATOM 2168 O LEU A 142 -2.000 13.286 0.111 1.00 0.23 O ATOM 2169 CB LEU A 142 0.205 11.127 -1.171 1.00 0.21 C ATOM 2170 CG LEU A 142 1.510 10.700 -0.536 1.00 0.22 C ATOM 2171 CD1 LEU A 142 1.562 9.192 -0.382 1.00 0.23 C ATOM 2172 CD2 LEU A 142 2.677 11.173 -1.371 1.00 0.25 C ATOM 0 H LEU A 142 -2.438 11.942 -1.599 1.00 0.21 H new ATOM 0 HA LEU A 142 -0.977 10.329 0.430 1.00 0.23 H new ATOM 0 HB2 LEU A 142 0.011 10.465 -2.015 1.00 0.21 H new ATOM 0 HB3 LEU A 142 0.343 12.129 -1.577 1.00 0.21 H new ATOM 0 HG LEU A 142 1.574 11.153 0.453 1.00 0.22 H new ATOM 0 HD11 LEU A 142 2.508 8.906 0.077 1.00 0.23 H new ATOM 0 HD12 LEU A 142 0.738 8.862 0.251 1.00 0.23 H new ATOM 0 HD13 LEU A 142 1.477 8.723 -1.362 1.00 0.23 H new ATOM 0 HD21 LEU A 142 3.610 10.859 -0.903 1.00 0.25 H new ATOM 0 HD22 LEU A 142 2.609 10.741 -2.369 1.00 0.25 H new ATOM 0 HD23 LEU A 142 2.655 12.260 -1.444 1.00 0.25 H new ATOM 2184 N ALA A 143 -0.557 12.521 1.644 1.00 0.34 N ATOM 2185 CA ALA A 143 -0.385 13.789 2.332 1.00 0.33 C ATOM 2186 C ALA A 143 0.697 13.642 3.387 1.00 0.60 C ATOM 2187 O ALA A 143 1.050 12.531 3.749 1.00 0.91 O ATOM 2188 CB ALA A 143 -1.696 14.240 2.967 1.00 0.38 C ATOM 0 H ALA A 143 -0.128 11.726 2.118 1.00 0.34 H new ATOM 0 HA ALA A 143 -0.085 14.550 1.612 1.00 0.33 H new ATOM 0 HB1 ALA A 143 -1.545 15.191 3.477 1.00 0.38 H new ATOM 0 HB2 ALA A 143 -2.453 14.360 2.192 1.00 0.38 H new ATOM 0 HB3 ALA A 143 -2.028 13.492 3.686 1.00 0.38 H new ATOM 2194 N GLY A 144 1.232 14.748 3.871 1.00 0.63 N ATOM 2195 CA GLY A 144 2.163 14.678 4.983 1.00 0.93 C ATOM 2196 C GLY A 144 1.436 14.879 6.275 1.00 0.93 C ATOM 2197 O GLY A 144 1.969 15.387 7.257 1.00 1.13 O ATOM 0 H GLY A 144 1.044 15.687 3.521 1.00 0.63 H new ATOM 0 HA2 GLY A 144 2.666 13.711 4.986 1.00 0.93 H new ATOM 0 HA3 GLY A 144 2.936 15.439 4.869 1.00 0.93 H new ATOM 2236 N SER A 148 -6.526 12.927 4.314 1.00 0.49 N ATOM 2237 CA SER A 148 -6.532 11.628 3.726 1.00 0.43 C ATOM 2238 C SER A 148 -6.678 10.563 4.796 1.00 0.37 C ATOM 2239 O SER A 148 -6.000 10.611 5.818 1.00 0.37 O ATOM 2240 CB SER A 148 -5.238 11.450 2.957 1.00 0.57 C ATOM 2241 OG SER A 148 -5.155 12.370 1.878 1.00 0.64 O ATOM 0 HA SER A 148 -7.379 11.526 3.047 1.00 0.43 H new ATOM 0 HB2 SER A 148 -4.390 11.593 3.627 1.00 0.57 H new ATOM 0 HB3 SER A 148 -5.175 10.431 2.576 1.00 0.57 H new ATOM 0 HG SER A 148 -5.700 13.160 2.079 1.00 0.64 H new ATOM 2247 N ILE A 149 -7.547 9.611 4.569 1.00 0.37 N ATOM 2248 CA ILE A 149 -7.701 8.508 5.486 1.00 0.32 C ATOM 2249 C ILE A 149 -6.785 7.386 5.084 1.00 0.26 C ATOM 2250 O ILE A 149 -7.074 6.640 4.182 1.00 0.29 O ATOM 2251 CB ILE A 149 -9.152 8.025 5.602 1.00 0.35 C ATOM 2252 CG1 ILE A 149 -9.995 9.081 6.335 1.00 0.57 C ATOM 2253 CG2 ILE A 149 -9.229 6.697 6.339 1.00 0.56 C ATOM 2254 CD1 ILE A 149 -10.207 10.369 5.569 1.00 1.21 C ATOM 0 H ILE A 149 -8.161 9.577 3.755 1.00 0.37 H new ATOM 0 HA ILE A 149 -7.425 8.864 6.479 1.00 0.32 H new ATOM 0 HB ILE A 149 -9.546 7.879 4.596 1.00 0.35 H new ATOM 0 HG12 ILE A 149 -10.968 8.650 6.569 1.00 0.57 H new ATOM 0 HG13 ILE A 149 -9.513 9.315 7.284 1.00 0.57 H new ATOM 0 HG21 ILE A 149 -10.269 6.378 6.407 1.00 0.56 H new ATOM 0 HG22 ILE A 149 -8.654 5.946 5.797 1.00 0.56 H new ATOM 0 HG23 ILE A 149 -8.819 6.813 7.342 1.00 0.56 H new ATOM 0 HD11 ILE A 149 -10.812 11.052 6.165 1.00 1.21 H new ATOM 0 HD12 ILE A 149 -9.242 10.830 5.358 1.00 1.21 H new ATOM 0 HD13 ILE A 149 -10.720 10.154 4.631 1.00 1.21 H new ATOM 2266 N THR A 150 -5.664 7.315 5.740 1.00 0.24 N ATOM 2267 CA THR A 150 -4.625 6.377 5.406 1.00 0.25 C ATOM 2268 C THR A 150 -4.909 5.122 6.201 1.00 0.26 C ATOM 2269 O THR A 150 -4.049 4.473 6.745 1.00 0.34 O ATOM 2270 CB THR A 150 -3.243 6.985 5.791 1.00 0.28 C ATOM 2271 OG1 THR A 150 -3.050 8.223 5.088 1.00 0.53 O ATOM 2272 CG2 THR A 150 -2.071 6.055 5.508 1.00 0.69 C ATOM 0 H THR A 150 -5.440 7.914 6.534 1.00 0.24 H new ATOM 0 HA THR A 150 -4.601 6.152 4.340 1.00 0.25 H new ATOM 0 HB THR A 150 -3.263 7.148 6.869 1.00 0.28 H new ATOM 0 HG1 THR A 150 -2.443 8.798 5.599 1.00 0.53 H new ATOM 0 HG21 THR A 150 -1.141 6.543 5.800 1.00 0.69 H new ATOM 0 HG22 THR A 150 -2.192 5.133 6.077 1.00 0.69 H new ATOM 0 HG23 THR A 150 -2.040 5.822 4.444 1.00 0.69 H new ATOM 2280 N ASP A 151 -6.165 4.808 6.306 1.00 0.25 N ATOM 2281 CA ASP A 151 -6.561 3.683 7.027 1.00 0.25 C ATOM 2282 C ASP A 151 -6.766 2.560 6.077 1.00 0.26 C ATOM 2283 O ASP A 151 -7.149 2.736 4.942 1.00 0.27 O ATOM 2284 CB ASP A 151 -7.773 3.991 7.848 1.00 0.29 C ATOM 2285 CG ASP A 151 -7.453 4.910 9.018 1.00 0.79 C ATOM 2286 OD1 ASP A 151 -6.458 4.658 9.731 1.00 1.25 O ATOM 2287 OD2 ASP A 151 -8.195 5.890 9.238 1.00 1.07 O ATOM 0 H ASP A 151 -6.929 5.338 5.886 1.00 0.25 H new ATOM 0 HA ASP A 151 -5.788 3.384 7.735 1.00 0.25 H new ATOM 0 HB2 ASP A 151 -8.529 4.458 7.217 1.00 0.29 H new ATOM 0 HB3 ASP A 151 -8.201 3.062 8.224 1.00 0.29 H new ATOM 2292 N PHE A 152 -6.450 1.433 6.529 1.00 0.27 N ATOM 2293 CA PHE A 152 -6.656 0.236 5.808 1.00 0.27 C ATOM 2294 C PHE A 152 -7.149 -0.800 6.785 1.00 0.28 C ATOM 2295 O PHE A 152 -7.124 -0.574 7.979 1.00 0.30 O ATOM 2296 CB PHE A 152 -5.352 -0.207 5.179 1.00 0.30 C ATOM 2297 CG PHE A 152 -4.677 0.835 4.336 1.00 1.46 C ATOM 2298 CD1 PHE A 152 -5.045 1.011 3.013 1.00 2.12 C ATOM 2299 CD2 PHE A 152 -3.681 1.630 4.855 1.00 2.11 C ATOM 2300 CE1 PHE A 152 -4.429 1.963 2.233 1.00 3.35 C ATOM 2301 CE2 PHE A 152 -3.061 2.585 4.081 1.00 3.33 C ATOM 2302 CZ PHE A 152 -3.425 2.761 2.790 1.00 3.93 C ATOM 0 H PHE A 152 -6.023 1.295 7.445 1.00 0.27 H new ATOM 0 HA PHE A 152 -7.385 0.378 5.011 1.00 0.27 H new ATOM 0 HB2 PHE A 152 -4.668 -0.513 5.971 1.00 0.30 H new ATOM 0 HB3 PHE A 152 -5.541 -1.086 4.563 1.00 0.30 H new ATOM 0 HD1 PHE A 152 -5.824 0.395 2.589 1.00 2.12 H new ATOM 0 HD2 PHE A 152 -3.381 1.503 5.885 1.00 2.11 H new ATOM 0 HE1 PHE A 152 -4.718 2.092 1.201 1.00 3.35 H new ATOM 0 HE2 PHE A 152 -2.280 3.197 4.507 1.00 3.33 H new ATOM 0 HZ PHE A 152 -2.941 3.517 2.190 1.00 3.93 H new ATOM 2312 N GLN A 153 -7.580 -1.914 6.272 1.00 0.30 N ATOM 2313 CA GLN A 153 -8.237 -2.952 7.043 1.00 0.33 C ATOM 2314 C GLN A 153 -8.119 -4.238 6.268 1.00 0.38 C ATOM 2315 O GLN A 153 -8.142 -4.211 5.035 1.00 0.44 O ATOM 2316 CB GLN A 153 -9.726 -2.657 7.282 1.00 0.44 C ATOM 2317 CG GLN A 153 -10.033 -1.314 7.919 1.00 0.70 C ATOM 2318 CD GLN A 153 -11.392 -1.285 8.585 1.00 0.63 C ATOM 2319 OE1 GLN A 153 -11.438 -1.630 9.862 1.00 1.27 O flip ATOM 2320 NE2 GLN A 153 -12.393 -0.959 7.959 1.00 1.20 N flip ATOM 0 H GLN A 153 -7.487 -2.141 5.282 1.00 0.30 H new ATOM 0 HA GLN A 153 -7.757 -3.011 8.020 1.00 0.33 H new ATOM 0 HB2 GLN A 153 -10.247 -2.714 6.326 1.00 0.44 H new ATOM 0 HB3 GLN A 153 -10.137 -3.443 7.916 1.00 0.44 H new ATOM 0 HG2 GLN A 153 -9.265 -1.082 8.657 1.00 0.70 H new ATOM 0 HG3 GLN A 153 -9.989 -0.536 7.157 1.00 0.70 H new ATOM 0 HE21 GLN A 153 -12.317 -0.699 6.975 1.00 1.20 H new ATOM 0 HE22 GLN A 153 -13.302 -0.947 8.421 1.00 1.20 H new ATOM 2329 N ILE A 154 -7.977 -5.354 6.951 1.00 0.43 N ATOM 2330 CA ILE A 154 -7.854 -6.607 6.254 1.00 0.45 C ATOM 2331 C ILE A 154 -9.239 -7.217 6.144 1.00 0.44 C ATOM 2332 O ILE A 154 -9.870 -7.578 7.142 1.00 0.49 O ATOM 2333 CB ILE A 154 -6.914 -7.600 6.993 1.00 0.56 C ATOM 2334 CG1 ILE A 154 -5.465 -7.094 7.026 1.00 1.14 C ATOM 2335 CG2 ILE A 154 -6.969 -8.975 6.343 1.00 1.53 C ATOM 2336 CD1 ILE A 154 -5.211 -5.969 8.009 1.00 1.63 C ATOM 0 H ILE A 154 -7.945 -5.416 7.969 1.00 0.43 H new ATOM 0 HA ILE A 154 -7.419 -6.419 5.273 1.00 0.45 H new ATOM 0 HB ILE A 154 -7.268 -7.676 8.021 1.00 0.56 H new ATOM 0 HG12 ILE A 154 -4.808 -7.929 7.272 1.00 1.14 H new ATOM 0 HG13 ILE A 154 -5.190 -6.755 6.027 1.00 1.14 H new ATOM 0 HG21 ILE A 154 -6.304 -9.656 6.875 1.00 1.53 H new ATOM 0 HG22 ILE A 154 -7.989 -9.357 6.385 1.00 1.53 H new ATOM 0 HG23 ILE A 154 -6.653 -8.898 5.303 1.00 1.53 H new ATOM 0 HD11 ILE A 154 -4.162 -5.676 7.964 1.00 1.63 H new ATOM 0 HD12 ILE A 154 -5.838 -5.114 7.754 1.00 1.63 H new ATOM 0 HD13 ILE A 154 -5.450 -6.306 9.018 1.00 1.63 H new ATOM 2348 N LEU A 155 -9.711 -7.293 4.912 1.00 0.43 N ATOM 2349 CA LEU A 155 -11.041 -7.801 4.626 1.00 0.44 C ATOM 2350 C LEU A 155 -10.965 -9.158 3.940 1.00 0.57 C ATOM 2351 O LEU A 155 -10.416 -9.282 2.855 1.00 0.67 O ATOM 2352 CB LEU A 155 -11.830 -6.837 3.718 1.00 0.53 C ATOM 2353 CG LEU A 155 -12.197 -5.450 4.287 1.00 0.46 C ATOM 2354 CD1 LEU A 155 -13.425 -4.920 3.566 1.00 0.82 C ATOM 2355 CD2 LEU A 155 -12.447 -5.520 5.785 1.00 0.73 C ATOM 0 H LEU A 155 -9.186 -7.006 4.086 1.00 0.43 H new ATOM 0 HA LEU A 155 -11.556 -7.896 5.582 1.00 0.44 H new ATOM 0 HB2 LEU A 155 -11.249 -6.683 2.809 1.00 0.53 H new ATOM 0 HB3 LEU A 155 -12.755 -7.334 3.425 1.00 0.53 H new ATOM 0 HG LEU A 155 -11.360 -4.771 4.125 1.00 0.46 H new ATOM 0 HD11 LEU A 155 -13.687 -3.940 3.966 1.00 0.82 H new ATOM 0 HD12 LEU A 155 -13.212 -4.832 2.501 1.00 0.82 H new ATOM 0 HD13 LEU A 155 -14.258 -5.607 3.714 1.00 0.82 H new ATOM 0 HD21 LEU A 155 -12.703 -4.528 6.158 1.00 0.73 H new ATOM 0 HD22 LEU A 155 -13.270 -6.207 5.985 1.00 0.73 H new ATOM 0 HD23 LEU A 155 -11.547 -5.875 6.288 1.00 0.73 H new ATOM 2367 N GLU A 156 -11.491 -10.176 4.576 1.00 0.67 N ATOM 2368 CA GLU A 156 -11.691 -11.449 3.917 1.00 0.89 C ATOM 2369 C GLU A 156 -13.051 -11.426 3.231 1.00 0.99 C ATOM 2370 O GLU A 156 -13.905 -10.636 3.605 1.00 0.90 O ATOM 2371 CB GLU A 156 -11.608 -12.585 4.931 1.00 1.04 C ATOM 2372 CG GLU A 156 -10.313 -13.385 4.860 1.00 1.58 C ATOM 2373 CD GLU A 156 -9.081 -12.568 5.204 1.00 2.05 C ATOM 2374 OE1 GLU A 156 -9.099 -11.869 6.239 1.00 2.57 O ATOM 2375 OE2 GLU A 156 -8.083 -12.635 4.448 1.00 2.53 O ATOM 0 H GLU A 156 -11.790 -10.150 5.551 1.00 0.67 H new ATOM 0 HA GLU A 156 -10.913 -11.615 3.172 1.00 0.89 H new ATOM 0 HB2 GLU A 156 -11.713 -12.172 5.934 1.00 1.04 H new ATOM 0 HB3 GLU A 156 -12.449 -13.260 4.775 1.00 1.04 H new ATOM 0 HG2 GLU A 156 -10.380 -14.232 5.542 1.00 1.58 H new ATOM 0 HG3 GLU A 156 -10.201 -13.793 3.855 1.00 1.58 H new ATOM 2382 N ASN A 157 -13.249 -12.283 2.239 1.00 1.23 N ATOM 2383 CA ASN A 157 -14.485 -12.280 1.445 1.00 1.41 C ATOM 2384 C ASN A 157 -15.564 -13.098 2.149 1.00 1.66 C ATOM 2385 O ASN A 157 -15.245 -13.949 2.978 1.00 1.82 O ATOM 2386 CB ASN A 157 -14.189 -12.876 0.060 1.00 1.68 C ATOM 2387 CG ASN A 157 -15.426 -13.086 -0.801 1.00 2.14 C ATOM 2388 OD1 ASN A 157 -15.917 -12.167 -1.449 1.00 2.67 O ATOM 2389 ND2 ASN A 157 -15.918 -14.310 -0.841 1.00 2.44 N ATOM 0 H ASN A 157 -12.572 -12.993 1.959 1.00 1.23 H new ATOM 0 HA ASN A 157 -14.846 -11.258 1.334 1.00 1.41 H new ATOM 0 HB2 ASN A 157 -13.499 -12.217 -0.468 1.00 1.68 H new ATOM 0 HB3 ASN A 157 -13.682 -13.832 0.188 1.00 1.68 H new ATOM 0 HD21 ASN A 157 -16.730 -14.514 -1.423 1.00 2.44 H new ATOM 0 HD22 ASN A 157 -15.486 -15.052 -0.290 1.00 2.44 H new ATOM 2396 N GLN A 158 -16.827 -12.854 1.823 1.00 1.77 N ATOM 2397 CA GLN A 158 -17.923 -13.468 2.559 1.00 2.06 C ATOM 2398 C GLN A 158 -18.004 -14.968 2.282 1.00 2.49 C ATOM 2399 O GLN A 158 -17.957 -15.782 3.208 1.00 2.73 O ATOM 2400 CB GLN A 158 -19.246 -12.787 2.204 1.00 2.08 C ATOM 2401 CG GLN A 158 -20.406 -13.202 3.097 1.00 2.54 C ATOM 2402 CD GLN A 158 -20.117 -12.963 4.567 1.00 2.68 C ATOM 2403 OE1 GLN A 158 -19.613 -13.844 5.269 1.00 3.15 O ATOM 2404 NE2 GLN A 158 -20.425 -11.770 5.043 1.00 2.98 N ATOM 0 H GLN A 158 -17.116 -12.241 1.061 1.00 1.77 H new ATOM 0 HA GLN A 158 -17.732 -13.335 3.624 1.00 2.06 H new ATOM 0 HB2 GLN A 158 -19.117 -11.707 2.269 1.00 2.08 H new ATOM 0 HB3 GLN A 158 -19.496 -13.016 1.168 1.00 2.08 H new ATOM 0 HG2 GLN A 158 -21.299 -12.647 2.810 1.00 2.54 H new ATOM 0 HG3 GLN A 158 -20.623 -14.258 2.939 1.00 2.54 H new ATOM 0 HE21 GLN A 158 -20.840 -11.068 4.430 1.00 2.98 H new ATOM 0 HE22 GLN A 158 -20.247 -11.551 6.023 1.00 2.98 H new ATOM 2413 N ALA A 159 -18.085 -15.328 1.012 1.00 2.67 N ATOM 2414 CA ALA A 159 -18.140 -16.724 0.618 1.00 3.14 C ATOM 2415 C ALA A 159 -17.115 -16.996 -0.472 1.00 3.38 C ATOM 2416 O ALA A 159 -17.489 -17.020 -1.662 1.00 3.55 O ATOM 2417 CB ALA A 159 -19.540 -17.095 0.152 1.00 3.37 C ATOM 2418 OXT ALA A 159 -15.923 -17.133 -0.134 1.00 3.78 O ATOM 0 H ALA A 159 -18.114 -14.669 0.234 1.00 2.67 H new ATOM 0 HA ALA A 159 -17.901 -17.344 1.482 1.00 3.14 H new ATOM 0 HB1 ALA A 159 -19.560 -18.145 -0.139 1.00 3.37 H new ATOM 0 HB2 ALA A 159 -20.249 -16.929 0.963 1.00 3.37 H new ATOM 0 HB3 ALA A 159 -19.815 -16.477 -0.702 1.00 3.37 H new