USER MOD reduce.3.24.130724 H: found=0, std=0, add=1126, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1122 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 27 THR OG1 : rot 180:sc= -0.543 USER MOD Set 1.2: A 59 ASN : amide:sc= -1.99 K(o=-2.5,f=-3.4!) USER MOD Set 2.1: A 7 SER OG : rot 180:sc= -0.604 USER MOD Set 2.2: A 18 SER OG : rot 180:sc= -0.204 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -115:sc= 0.117 (180deg=0) USER MOD Single : A 4 HIS : no HD1:sc= -0.0454 X(o=-0.045,f=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.156 USER MOD Single : A 8 THR OG1 : rot 63:sc= 0.601 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -60:sc= 1.08 USER MOD Single : A 14 ASN : amide:sc= -0.0812 X(o=-0.081,f=-0.11) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ -160:sc= 1.13 (180deg=0.833) USER MOD Single : A 30 LYS NZ :NH3+ 156:sc= -0.345 (180deg=-1.59!) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -0.556 K(o=-0.56,f=-1.2) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc=-0.000315 X(o=-0.00032,f=-0.038) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 111:sc= 0.572 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -69:sc= -2.61! USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HE2:sc= 0.495 K(o=0.49,f=-1.6!) USER MOD Single : A 72 LYS NZ :NH3+ 147:sc= -1.97 (180deg=-3.98!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -0.208 K(o=-0.21,f=-1.5!) USER MOD Single : A 79 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.00229) USER MOD Single : A 81 TYR OH : rot 131:sc= -0.62 USER MOD Single : A 85 ASN : amide:sc= -0.0945 X(o=-0.094,f=-0.46) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 140:sc= -0.176 USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 98 THR OG1 : rot 95:sc= 1.42 USER MOD Single : A 101 GLN : amide:sc=-0.000902 X(o=-0.0009,f=0) USER MOD Single : A 102 SER OG : rot 84:sc= 0.709 USER MOD Single : A 104 ASN : amide:sc= -0.44 K(o=-0.44,f=-2.4) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 85:sc= 0.889 USER MOD Single : A 110 SER OG : rot 93:sc= 0.507 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 GLN : amide:sc= -6.05! C(o=-6!,f=-7.5!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= -0.648 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 132 GLN : amide:sc= 0.137 K(o=0.14,f=-4.9!) USER MOD Single : A 141 ASN : amide:sc= -0.186 K(o=-0.19,f=-0.94) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.997 -1.069 -2.601 1.00 42.30 N ATOM 2 CA MET A 1 1.955 0.076 -1.699 1.00 1.13 C ATOM 3 C MET A 1 3.272 0.222 -0.943 1.00 63.15 C ATOM 4 O MET A 1 4.109 -0.681 -0.954 1.00 72.33 O ATOM 5 CB MET A 1 0.799 -0.071 -0.707 1.00 40.05 C ATOM 6 CG MET A 1 -0.531 0.432 -1.246 1.00 23.32 C ATOM 7 SD MET A 1 -1.942 -0.433 -0.530 1.00 25.22 S ATOM 8 CE MET A 1 -2.164 0.484 0.993 1.00 61.15 C ATOM 0 H1 MET A 1 1.933 -0.738 -3.585 1.00 42.30 H new ATOM 0 H2 MET A 1 2.890 -1.585 -2.466 1.00 42.30 H new ATOM 0 H3 MET A 1 1.198 -1.702 -2.396 1.00 42.30 H new ATOM 0 HA MET A 1 1.799 0.973 -2.299 1.00 1.13 H new ATOM 0 HB2 MET A 1 0.697 -1.121 -0.433 1.00 40.05 H new ATOM 0 HB3 MET A 1 1.042 0.474 0.205 1.00 40.05 H new ATOM 0 HG2 MET A 1 -0.622 1.499 -1.041 1.00 23.32 H new ATOM 0 HG3 MET A 1 -0.548 0.313 -2.329 1.00 23.32 H new ATOM 0 HE1 MET A 1 -3.003 0.067 1.550 1.00 61.15 H new ATOM 0 HE2 MET A 1 -1.258 0.414 1.595 1.00 61.15 H new ATOM 0 HE3 MET A 1 -2.366 1.530 0.762 1.00 61.15 H new ATOM 18 N VAL A 2 3.451 1.365 -0.289 1.00 34.25 N ATOM 19 CA VAL A 2 4.666 1.628 0.473 1.00 51.23 C ATOM 20 C VAL A 2 4.357 2.398 1.752 1.00 42.44 C ATOM 21 O VAL A 2 3.346 3.092 1.860 1.00 75.35 O ATOM 22 CB VAL A 2 5.688 2.425 -0.360 1.00 12.44 C ATOM 23 CG1 VAL A 2 6.397 1.514 -1.350 1.00 4.24 C ATOM 24 CG2 VAL A 2 5.005 3.579 -1.079 1.00 33.41 C ATOM 0 H VAL A 2 2.770 2.124 -0.272 1.00 34.25 H new ATOM 0 HA VAL A 2 5.095 0.660 0.731 1.00 51.23 H new ATOM 0 HB VAL A 2 6.436 2.840 0.315 1.00 12.44 H new ATOM 0 HG11 VAL A 2 7.115 2.095 -1.929 1.00 4.24 H new ATOM 0 HG12 VAL A 2 6.920 0.726 -0.809 1.00 4.24 H new ATOM 0 HG13 VAL A 2 5.665 1.068 -2.023 1.00 4.24 H new ATOM 0 HG21 VAL A 2 5.742 4.131 -1.663 1.00 33.41 H new ATOM 0 HG22 VAL A 2 4.234 3.189 -1.744 1.00 33.41 H new ATOM 0 HG23 VAL A 2 4.549 4.245 -0.347 1.00 33.41 H new ATOM 34 N PRO A 3 5.249 2.276 2.746 1.00 43.12 N ATOM 35 CA PRO A 3 5.095 2.955 4.036 1.00 34.40 C ATOM 36 C PRO A 3 5.280 4.464 3.923 1.00 25.13 C ATOM 37 O PRO A 3 6.357 4.990 4.207 1.00 62.20 O ATOM 38 CB PRO A 3 6.204 2.342 4.894 1.00 22.23 C ATOM 39 CG PRO A 3 7.233 1.889 3.917 1.00 50.04 C ATOM 40 CD PRO A 3 6.478 1.466 2.687 1.00 51.53 C ATOM 0 HA PRO A 3 4.095 2.822 4.450 1.00 34.40 H new ATOM 0 HB2 PRO A 3 6.615 3.072 5.591 1.00 22.23 H new ATOM 0 HB3 PRO A 3 5.829 1.509 5.489 1.00 22.23 H new ATOM 0 HG2 PRO A 3 7.934 2.692 3.688 1.00 50.04 H new ATOM 0 HG3 PRO A 3 7.817 1.062 4.320 1.00 50.04 H new ATOM 0 HD2 PRO A 3 7.047 1.664 1.778 1.00 51.53 H new ATOM 0 HD3 PRO A 3 6.257 0.399 2.698 1.00 51.53 H new ATOM 48 N HIS A 4 4.225 5.156 3.508 1.00 55.23 N ATOM 49 CA HIS A 4 4.272 6.606 3.359 1.00 54.44 C ATOM 50 C HIS A 4 4.299 7.292 4.721 1.00 0.12 C ATOM 51 O HIS A 4 4.969 8.309 4.903 1.00 0.25 O ATOM 52 CB HIS A 4 3.069 7.097 2.552 1.00 33.41 C ATOM 53 CG HIS A 4 3.416 7.528 1.161 1.00 42.14 C ATOM 54 ND1 HIS A 4 2.781 7.037 0.040 1.00 53.24 N ATOM 55 CD2 HIS A 4 4.338 8.412 0.712 1.00 62.41 C ATOM 56 CE1 HIS A 4 3.298 7.599 -1.038 1.00 70.24 C ATOM 57 NE2 HIS A 4 4.245 8.437 -0.658 1.00 11.31 N ATOM 0 H HIS A 4 3.327 4.736 3.269 1.00 55.23 H new ATOM 0 HA HIS A 4 5.187 6.861 2.825 1.00 54.44 H new ATOM 0 HB2 HIS A 4 2.326 6.301 2.502 1.00 33.41 H new ATOM 0 HB3 HIS A 4 2.606 7.932 3.077 1.00 33.41 H new ATOM 0 HD2 HIS A 4 5.020 8.990 1.318 1.00 62.41 H new ATOM 0 HE1 HIS A 4 2.997 7.406 -2.057 1.00 70.24 H new ATOM 0 HE2 HIS A 4 4.815 9.010 -1.281 1.00 11.31 H new ATOM 65 N THR A 5 3.566 6.729 5.677 1.00 53.13 N ATOM 66 CA THR A 5 3.504 7.287 7.022 1.00 62.13 C ATOM 67 C THR A 5 4.852 7.174 7.726 1.00 54.22 C ATOM 68 O THR A 5 5.310 8.121 8.367 1.00 71.03 O ATOM 69 CB THR A 5 2.432 6.582 7.874 1.00 70.02 C ATOM 70 OG1 THR A 5 1.980 5.397 7.210 1.00 74.24 O ATOM 71 CG2 THR A 5 1.252 7.507 8.132 1.00 71.41 C ATOM 0 H THR A 5 3.007 5.886 5.544 1.00 53.13 H new ATOM 0 HA THR A 5 3.239 8.339 6.916 1.00 62.13 H new ATOM 0 HB THR A 5 2.879 6.313 8.831 1.00 70.02 H new ATOM 0 HG1 THR A 5 1.300 4.954 7.759 1.00 74.24 H new ATOM 0 HG21 THR A 5 0.508 6.988 8.736 1.00 71.41 H new ATOM 0 HG22 THR A 5 1.595 8.395 8.664 1.00 71.41 H new ATOM 0 HG23 THR A 5 0.807 7.802 7.182 1.00 71.41 H new ATOM 79 N LEU A 6 5.483 6.012 7.603 1.00 73.24 N ATOM 80 CA LEU A 6 6.780 5.775 8.227 1.00 13.41 C ATOM 81 C LEU A 6 7.826 6.749 7.694 1.00 22.32 C ATOM 82 O LEU A 6 8.660 7.253 8.447 1.00 74.03 O ATOM 83 CB LEU A 6 7.232 4.335 7.979 1.00 45.51 C ATOM 84 CG LEU A 6 7.964 3.653 9.136 1.00 75.15 C ATOM 85 CD1 LEU A 6 7.023 3.442 10.312 1.00 53.34 C ATOM 86 CD2 LEU A 6 8.559 2.328 8.682 1.00 33.33 C ATOM 0 H LEU A 6 5.117 5.219 7.077 1.00 73.24 H new ATOM 0 HA LEU A 6 6.675 5.935 9.300 1.00 13.41 H new ATOM 0 HB2 LEU A 6 6.355 3.738 7.728 1.00 45.51 H new ATOM 0 HB3 LEU A 6 7.885 4.325 7.106 1.00 45.51 H new ATOM 0 HG LEU A 6 8.777 4.302 9.460 1.00 75.15 H new ATOM 0 HD11 LEU A 6 7.561 2.956 11.126 1.00 53.34 H new ATOM 0 HD12 LEU A 6 6.644 4.406 10.652 1.00 53.34 H new ATOM 0 HD13 LEU A 6 6.188 2.813 10.002 1.00 53.34 H new ATOM 0 HD21 LEU A 6 9.076 1.856 9.517 1.00 33.33 H new ATOM 0 HD22 LEU A 6 7.762 1.672 8.332 1.00 33.33 H new ATOM 0 HD23 LEU A 6 9.266 2.505 7.871 1.00 33.33 H new ATOM 98 N SER A 7 7.775 7.010 6.392 1.00 63.32 N ATOM 99 CA SER A 7 8.720 7.922 5.758 1.00 72.35 C ATOM 100 C SER A 7 8.529 9.346 6.271 1.00 32.54 C ATOM 101 O SER A 7 9.461 10.151 6.267 1.00 34.33 O ATOM 102 CB SER A 7 8.550 7.889 4.237 1.00 25.04 C ATOM 103 OG SER A 7 9.524 8.696 3.598 1.00 25.22 O ATOM 0 H SER A 7 7.090 6.603 5.756 1.00 63.32 H new ATOM 0 HA SER A 7 9.728 7.595 6.012 1.00 72.35 H new ATOM 0 HB2 SER A 7 8.633 6.862 3.881 1.00 25.04 H new ATOM 0 HB3 SER A 7 7.552 8.239 3.972 1.00 25.04 H new ATOM 0 HG SER A 7 9.395 8.657 2.627 1.00 25.22 H new ATOM 109 N THR A 8 7.313 9.650 6.714 1.00 13.01 N ATOM 110 CA THR A 8 6.997 10.976 7.230 1.00 30.11 C ATOM 111 C THR A 8 7.761 11.261 8.518 1.00 43.11 C ATOM 112 O THR A 8 8.046 12.415 8.840 1.00 4.22 O ATOM 113 CB THR A 8 5.488 11.130 7.497 1.00 11.14 C ATOM 114 OG1 THR A 8 4.743 10.753 6.334 1.00 43.23 O ATOM 115 CG2 THR A 8 5.150 12.563 7.880 1.00 53.11 C ATOM 0 H THR A 8 6.531 8.996 6.726 1.00 13.01 H new ATOM 0 HA THR A 8 7.298 11.693 6.466 1.00 30.11 H new ATOM 0 HB THR A 8 5.220 10.476 8.327 1.00 11.14 H new ATOM 0 HG1 THR A 8 4.901 9.806 6.137 1.00 43.23 H new ATOM 0 HG21 THR A 8 4.079 12.648 8.064 1.00 53.11 H new ATOM 0 HG22 THR A 8 5.696 12.837 8.783 1.00 53.11 H new ATOM 0 HG23 THR A 8 5.433 13.233 7.068 1.00 53.11 H new ATOM 123 N LEU A 9 8.091 10.203 9.251 1.00 43.52 N ATOM 124 CA LEU A 9 8.824 10.340 10.505 1.00 44.24 C ATOM 125 C LEU A 9 10.326 10.428 10.251 1.00 51.33 C ATOM 126 O LEU A 9 10.839 9.856 9.289 1.00 54.35 O ATOM 127 CB LEU A 9 8.520 9.159 11.428 1.00 62.14 C ATOM 128 CG LEU A 9 7.041 8.829 11.630 1.00 11.13 C ATOM 129 CD1 LEU A 9 6.816 7.326 11.570 1.00 11.23 C ATOM 130 CD2 LEU A 9 6.546 9.392 12.955 1.00 74.05 C ATOM 0 H LEU A 9 7.863 9.241 8.999 1.00 43.52 H new ATOM 0 HA LEU A 9 8.501 11.263 10.987 1.00 44.24 H new ATOM 0 HB2 LEU A 9 9.018 8.275 11.030 1.00 62.14 H new ATOM 0 HB3 LEU A 9 8.963 9.362 12.403 1.00 62.14 H new ATOM 0 HG LEU A 9 6.471 9.293 10.825 1.00 11.13 H new ATOM 0 HD11 LEU A 9 5.758 7.110 11.716 1.00 11.23 H new ATOM 0 HD12 LEU A 9 7.132 6.949 10.597 1.00 11.23 H new ATOM 0 HD13 LEU A 9 7.397 6.840 12.354 1.00 11.23 H new ATOM 0 HD21 LEU A 9 5.491 9.148 13.083 1.00 74.05 H new ATOM 0 HD22 LEU A 9 7.121 8.957 13.773 1.00 74.05 H new ATOM 0 HD23 LEU A 9 6.671 10.475 12.960 1.00 74.05 H new ATOM 142 N LYS A 10 11.027 11.147 11.121 1.00 33.02 N ATOM 143 CA LYS A 10 12.470 11.308 10.995 1.00 64.23 C ATOM 144 C LYS A 10 13.205 10.465 12.032 1.00 33.33 C ATOM 145 O LYS A 10 12.586 9.871 12.916 1.00 21.13 O ATOM 146 CB LYS A 10 12.856 12.780 11.153 1.00 40.30 C ATOM 147 CG LYS A 10 12.223 13.448 12.361 1.00 2.35 C ATOM 148 CD LYS A 10 13.173 14.441 13.011 1.00 31.31 C ATOM 149 CE LYS A 10 12.599 15.849 13.002 1.00 41.34 C ATOM 150 NZ LYS A 10 13.001 16.604 11.782 1.00 23.23 N ATOM 0 H LYS A 10 10.618 11.628 11.922 1.00 33.02 H new ATOM 0 HA LYS A 10 12.762 10.967 10.002 1.00 64.23 H new ATOM 0 HB2 LYS A 10 13.940 12.856 11.233 1.00 40.30 H new ATOM 0 HB3 LYS A 10 12.564 13.322 10.254 1.00 40.30 H new ATOM 0 HG2 LYS A 10 11.311 13.961 12.058 1.00 2.35 H new ATOM 0 HG3 LYS A 10 11.935 12.689 13.088 1.00 2.35 H new ATOM 0 HD2 LYS A 10 13.374 14.135 14.038 1.00 31.31 H new ATOM 0 HD3 LYS A 10 14.127 14.432 12.484 1.00 31.31 H new ATOM 0 HE2 LYS A 10 11.512 15.798 13.056 1.00 41.34 H new ATOM 0 HE3 LYS A 10 12.937 16.385 13.889 1.00 41.34 H new ATOM 0 HZ1 LYS A 10 12.590 17.559 11.813 1.00 23.23 H new ATOM 0 HZ2 LYS A 10 14.038 16.675 11.743 1.00 23.23 H new ATOM 0 HZ3 LYS A 10 12.656 16.106 10.936 1.00 23.23 H new ATOM 164 N THR A 11 14.529 10.417 11.920 1.00 14.12 N ATOM 165 CA THR A 11 15.347 9.647 12.848 1.00 0.24 C ATOM 166 C THR A 11 16.228 10.561 13.693 1.00 72.11 C ATOM 167 O THR A 11 16.364 11.749 13.403 1.00 61.03 O ATOM 168 CB THR A 11 16.240 8.636 12.105 1.00 40.34 C ATOM 169 OG1 THR A 11 17.098 9.323 11.187 1.00 42.22 O ATOM 170 CG2 THR A 11 15.395 7.619 11.352 1.00 23.04 C ATOM 0 H THR A 11 15.057 10.903 11.195 1.00 14.12 H new ATOM 0 HA THR A 11 14.661 9.105 13.498 1.00 0.24 H new ATOM 0 HB THR A 11 16.845 8.108 12.842 1.00 40.34 H new ATOM 0 HG1 THR A 11 16.554 9.809 10.532 1.00 42.22 H new ATOM 0 HG21 THR A 11 16.047 6.915 10.835 1.00 23.04 H new ATOM 0 HG22 THR A 11 14.763 7.078 12.056 1.00 23.04 H new ATOM 0 HG23 THR A 11 14.768 8.134 10.624 1.00 23.04 H new ATOM 178 N ALA A 12 16.824 9.998 14.739 1.00 44.51 N ATOM 179 CA ALA A 12 17.695 10.763 15.624 1.00 74.40 C ATOM 180 C ALA A 12 18.961 11.206 14.900 1.00 25.30 C ATOM 181 O ALA A 12 19.703 12.057 15.391 1.00 54.52 O ATOM 182 CB ALA A 12 18.048 9.941 16.855 1.00 12.10 C ATOM 0 H ALA A 12 16.720 9.016 14.994 1.00 44.51 H new ATOM 0 HA ALA A 12 17.157 11.657 15.939 1.00 74.40 H new ATOM 0 HB1 ALA A 12 18.699 10.524 17.507 1.00 12.10 H new ATOM 0 HB2 ALA A 12 17.136 9.680 17.392 1.00 12.10 H new ATOM 0 HB3 ALA A 12 18.563 9.030 16.549 1.00 12.10 H new ATOM 188 N ASP A 13 19.204 10.622 13.732 1.00 42.24 N ATOM 189 CA ASP A 13 20.382 10.957 12.940 1.00 51.55 C ATOM 190 C ASP A 13 20.073 12.081 11.955 1.00 74.44 C ATOM 191 O ASP A 13 20.843 12.338 11.031 1.00 52.54 O ATOM 192 CB ASP A 13 20.884 9.725 12.186 1.00 74.13 C ATOM 193 CG ASP A 13 22.309 9.886 11.696 1.00 42.41 C ATOM 194 OD1 ASP A 13 23.056 10.687 12.296 1.00 1.43 O ATOM 195 OD2 ASP A 13 22.678 9.211 10.713 1.00 44.13 O ATOM 0 H ASP A 13 18.601 9.914 13.312 1.00 42.24 H new ATOM 0 HA ASP A 13 21.162 11.299 13.621 1.00 51.55 H new ATOM 0 HB2 ASP A 13 20.824 8.854 12.839 1.00 74.13 H new ATOM 0 HB3 ASP A 13 20.230 9.532 11.335 1.00 74.13 H new ATOM 200 N ASN A 14 18.939 12.744 12.159 1.00 44.43 N ATOM 201 CA ASN A 14 18.527 13.839 11.287 1.00 4.15 C ATOM 202 C ASN A 14 18.307 13.345 9.861 1.00 50.42 C ATOM 203 O ASN A 14 18.550 14.072 8.897 1.00 1.12 O ATOM 204 CB ASN A 14 19.579 14.950 11.298 1.00 50.31 C ATOM 205 CG ASN A 14 19.013 16.286 10.856 1.00 0.11 C ATOM 206 OD1 ASN A 14 18.105 16.827 11.487 1.00 11.31 O ATOM 207 ND2 ASN A 14 19.549 16.824 9.767 1.00 55.24 N ATOM 0 H ASN A 14 18.290 12.543 12.919 1.00 44.43 H new ATOM 0 HA ASN A 14 17.585 14.236 11.664 1.00 4.15 H new ATOM 0 HB2 ASN A 14 19.990 15.047 12.303 1.00 50.31 H new ATOM 0 HB3 ASN A 14 20.404 14.673 10.641 1.00 50.31 H new ATOM 0 HD21 ASN A 14 19.210 17.722 9.422 1.00 55.24 H new ATOM 0 HD22 ASN A 14 20.300 16.340 9.276 1.00 55.24 H new ATOM 214 N ARG A 15 17.845 12.106 9.734 1.00 33.12 N ATOM 215 CA ARG A 15 17.592 11.515 8.426 1.00 71.33 C ATOM 216 C ARG A 15 16.218 10.852 8.385 1.00 61.12 C ATOM 217 O ARG A 15 15.623 10.535 9.415 1.00 4.43 O ATOM 218 CB ARG A 15 18.675 10.489 8.088 1.00 23.31 C ATOM 219 CG ARG A 15 19.850 11.073 7.321 1.00 1.43 C ATOM 220 CD ARG A 15 21.155 10.896 8.081 1.00 22.23 C ATOM 221 NE ARG A 15 22.304 10.813 7.184 1.00 63.12 N ATOM 222 CZ ARG A 15 22.850 11.868 6.589 1.00 21.12 C ATOM 223 NH1 ARG A 15 22.354 13.080 6.796 1.00 21.02 N ATOM 224 NH2 ARG A 15 23.895 11.712 5.786 1.00 74.22 N ATOM 0 H ARG A 15 17.638 11.492 10.521 1.00 33.12 H new ATOM 0 HA ARG A 15 17.613 12.314 7.684 1.00 71.33 H new ATOM 0 HB2 ARG A 15 19.041 10.042 9.012 1.00 23.31 H new ATOM 0 HB3 ARG A 15 18.231 9.686 7.500 1.00 23.31 H new ATOM 0 HG2 ARG A 15 19.926 10.590 6.347 1.00 1.43 H new ATOM 0 HG3 ARG A 15 19.675 12.133 7.138 1.00 1.43 H new ATOM 0 HD2 ARG A 15 21.291 11.732 8.768 1.00 22.23 H new ATOM 0 HD3 ARG A 15 21.102 9.991 8.687 1.00 22.23 H new ATOM 0 HE ARG A 15 22.710 9.895 7.004 1.00 63.12 H new ATOM 0 HH11 ARG A 15 21.551 13.204 7.413 1.00 21.02 H new ATOM 0 HH12 ARG A 15 22.775 13.888 6.338 1.00 21.02 H new ATOM 0 HH21 ARG A 15 24.280 10.781 5.625 1.00 74.22 H new ATOM 0 HH22 ARG A 15 24.313 12.523 5.330 1.00 74.22 H new ATOM 238 N PRO A 16 15.701 10.637 7.166 1.00 33.32 N ATOM 239 CA PRO A 16 14.391 10.010 6.961 1.00 24.15 C ATOM 240 C PRO A 16 14.393 8.530 7.329 1.00 3.14 C ATOM 241 O PRO A 16 15.273 7.778 6.911 1.00 2.13 O ATOM 242 CB PRO A 16 14.144 10.188 5.461 1.00 33.44 C ATOM 243 CG PRO A 16 15.504 10.299 4.863 1.00 33.25 C ATOM 244 CD PRO A 16 16.354 10.988 5.894 1.00 2.32 C ATOM 0 HA PRO A 16 13.621 10.458 7.590 1.00 24.15 H new ATOM 0 HB2 PRO A 16 13.597 9.341 5.047 1.00 33.44 H new ATOM 0 HB3 PRO A 16 13.550 11.080 5.261 1.00 33.44 H new ATOM 0 HG2 PRO A 16 15.905 9.315 4.621 1.00 33.25 H new ATOM 0 HG3 PRO A 16 15.477 10.870 3.935 1.00 33.25 H new ATOM 0 HD2 PRO A 16 17.386 10.638 5.862 1.00 2.32 H new ATOM 0 HD3 PRO A 16 16.378 12.067 5.739 1.00 2.32 H new ATOM 252 N ALA A 17 13.402 8.119 8.114 1.00 64.24 N ATOM 253 CA ALA A 17 13.289 6.728 8.535 1.00 11.24 C ATOM 254 C ALA A 17 13.007 5.815 7.347 1.00 54.30 C ATOM 255 O ALA A 17 13.134 4.595 7.446 1.00 72.14 O ATOM 256 CB ALA A 17 12.198 6.583 9.586 1.00 71.30 C ATOM 0 H ALA A 17 12.667 8.729 8.471 1.00 64.24 H new ATOM 0 HA ALA A 17 14.242 6.427 8.971 1.00 11.24 H new ATOM 0 HB1 ALA A 17 12.124 5.539 9.892 1.00 71.30 H new ATOM 0 HB2 ALA A 17 12.443 7.198 10.452 1.00 71.30 H new ATOM 0 HB3 ALA A 17 11.245 6.907 9.168 1.00 71.30 H new ATOM 262 N SER A 18 12.622 6.415 6.225 1.00 63.55 N ATOM 263 CA SER A 18 12.317 5.655 5.018 1.00 65.51 C ATOM 264 C SER A 18 13.569 4.970 4.476 1.00 11.42 C ATOM 265 O SER A 18 13.521 3.822 4.035 1.00 22.02 O ATOM 266 CB SER A 18 11.721 6.572 3.949 1.00 73.00 C ATOM 267 OG SER A 18 10.740 5.893 3.184 1.00 14.22 O ATOM 0 H SER A 18 12.514 7.424 6.127 1.00 63.55 H new ATOM 0 HA SER A 18 11.587 4.888 5.277 1.00 65.51 H new ATOM 0 HB2 SER A 18 11.276 7.447 4.423 1.00 73.00 H new ATOM 0 HB3 SER A 18 12.513 6.933 3.293 1.00 73.00 H new ATOM 0 HG SER A 18 10.373 6.501 2.509 1.00 14.22 H new ATOM 273 N VAL A 19 14.689 5.685 4.513 1.00 42.03 N ATOM 274 CA VAL A 19 15.955 5.148 4.027 1.00 53.11 C ATOM 275 C VAL A 19 16.337 3.877 4.778 1.00 52.44 C ATOM 276 O VAL A 19 17.075 3.038 4.262 1.00 22.43 O ATOM 277 CB VAL A 19 17.092 6.177 4.169 1.00 63.32 C ATOM 278 CG1 VAL A 19 17.450 6.379 5.633 1.00 15.54 C ATOM 279 CG2 VAL A 19 18.310 5.737 3.370 1.00 2.13 C ATOM 0 H VAL A 19 14.746 6.637 4.874 1.00 42.03 H new ATOM 0 HA VAL A 19 15.816 4.915 2.971 1.00 53.11 H new ATOM 0 HB VAL A 19 16.748 7.131 3.769 1.00 63.32 H new ATOM 0 HG11 VAL A 19 18.255 7.109 5.713 1.00 15.54 H new ATOM 0 HG12 VAL A 19 16.576 6.741 6.175 1.00 15.54 H new ATOM 0 HG13 VAL A 19 17.776 5.431 6.062 1.00 15.54 H new ATOM 0 HG21 VAL A 19 19.104 6.475 3.481 1.00 2.13 H new ATOM 0 HG22 VAL A 19 18.658 4.772 3.738 1.00 2.13 H new ATOM 0 HG23 VAL A 19 18.042 5.648 2.317 1.00 2.13 H new ATOM 289 N TYR A 20 15.829 3.742 5.998 1.00 40.44 N ATOM 290 CA TYR A 20 16.118 2.575 6.821 1.00 25.51 C ATOM 291 C TYR A 20 15.178 1.422 6.482 1.00 63.04 C ATOM 292 O TYR A 20 15.230 0.359 7.102 1.00 44.02 O ATOM 293 CB TYR A 20 15.996 2.927 8.304 1.00 0.34 C ATOM 294 CG TYR A 20 17.226 3.602 8.870 1.00 75.41 C ATOM 295 CD1 TYR A 20 18.430 2.918 8.976 1.00 3.02 C ATOM 296 CD2 TYR A 20 17.182 4.923 9.297 1.00 3.21 C ATOM 297 CE1 TYR A 20 19.556 3.530 9.493 1.00 53.10 C ATOM 298 CE2 TYR A 20 18.303 5.544 9.814 1.00 62.21 C ATOM 299 CZ TYR A 20 19.487 4.843 9.910 1.00 3.02 C ATOM 300 OH TYR A 20 20.606 5.457 10.424 1.00 25.23 O ATOM 0 H TYR A 20 15.215 4.427 6.438 1.00 40.44 H new ATOM 0 HA TYR A 20 17.140 2.260 6.612 1.00 25.51 H new ATOM 0 HB2 TYR A 20 15.136 3.582 8.444 1.00 0.34 H new ATOM 0 HB3 TYR A 20 15.799 2.016 8.870 1.00 0.34 H new ATOM 0 HD1 TYR A 20 18.487 1.890 8.649 1.00 3.02 H new ATOM 0 HD2 TYR A 20 16.256 5.474 9.224 1.00 3.21 H new ATOM 0 HE1 TYR A 20 20.484 2.984 9.570 1.00 53.10 H new ATOM 0 HE2 TYR A 20 18.252 6.572 10.141 1.00 62.21 H new ATOM 0 HH TYR A 20 20.389 6.381 10.669 1.00 25.23 H new ATOM 310 N LEU A 21 14.319 1.640 5.492 1.00 2.11 N ATOM 311 CA LEU A 21 13.366 0.620 5.067 1.00 4.35 C ATOM 312 C LEU A 21 13.727 0.079 3.688 1.00 70.22 C ATOM 313 O LEU A 21 14.598 0.618 3.005 1.00 3.13 O ATOM 314 CB LEU A 21 11.949 1.195 5.048 1.00 50.23 C ATOM 315 CG LEU A 21 11.659 2.300 6.064 1.00 13.11 C ATOM 316 CD1 LEU A 21 10.224 2.787 5.929 1.00 61.44 C ATOM 317 CD2 LEU A 21 11.925 1.807 7.479 1.00 61.12 C ATOM 0 H LEU A 21 14.263 2.514 4.969 1.00 2.11 H new ATOM 0 HA LEU A 21 13.408 -0.202 5.781 1.00 4.35 H new ATOM 0 HB2 LEU A 21 11.750 1.586 4.050 1.00 50.23 H new ATOM 0 HB3 LEU A 21 11.245 0.380 5.217 1.00 50.23 H new ATOM 0 HG LEU A 21 12.326 3.138 5.861 1.00 13.11 H new ATOM 0 HD11 LEU A 21 10.036 3.573 6.660 1.00 61.44 H new ATOM 0 HD12 LEU A 21 10.066 3.180 4.925 1.00 61.44 H new ATOM 0 HD13 LEU A 21 9.540 1.957 6.105 1.00 61.44 H new ATOM 0 HD21 LEU A 21 11.713 2.607 8.189 1.00 61.12 H new ATOM 0 HD22 LEU A 21 11.283 0.952 7.693 1.00 61.12 H new ATOM 0 HD23 LEU A 21 12.969 1.508 7.570 1.00 61.12 H new ATOM 329 N LYS A 22 13.050 -0.990 3.282 1.00 54.32 N ATOM 330 CA LYS A 22 13.295 -1.603 1.982 1.00 30.31 C ATOM 331 C LYS A 22 11.982 -1.972 1.298 1.00 44.10 C ATOM 332 O LYS A 22 11.179 -2.732 1.840 1.00 5.42 O ATOM 333 CB LYS A 22 14.168 -2.850 2.140 1.00 34.54 C ATOM 334 CG LYS A 22 15.442 -2.810 1.316 1.00 44.44 C ATOM 335 CD LYS A 22 16.229 -4.104 1.440 1.00 11.32 C ATOM 336 CE LYS A 22 17.600 -3.987 0.792 1.00 72.44 C ATOM 337 NZ LYS A 22 18.698 -4.127 1.787 1.00 2.34 N ATOM 0 H LYS A 22 12.327 -1.450 3.835 1.00 54.32 H new ATOM 0 HA LYS A 22 13.818 -0.877 1.359 1.00 30.31 H new ATOM 0 HB2 LYS A 22 14.429 -2.969 3.191 1.00 34.54 H new ATOM 0 HB3 LYS A 22 13.588 -3.728 1.854 1.00 34.54 H new ATOM 0 HG2 LYS A 22 15.194 -2.633 0.269 1.00 44.44 H new ATOM 0 HG3 LYS A 22 16.061 -1.974 1.642 1.00 44.44 H new ATOM 0 HD2 LYS A 22 16.344 -4.362 2.493 1.00 11.32 H new ATOM 0 HD3 LYS A 22 15.672 -4.916 0.972 1.00 11.32 H new ATOM 0 HE2 LYS A 22 17.705 -4.754 0.025 1.00 72.44 H new ATOM 0 HE3 LYS A 22 17.684 -3.022 0.292 1.00 72.44 H new ATOM 0 HZ1 LYS A 22 19.616 -4.041 1.306 1.00 2.34 H new ATOM 0 HZ2 LYS A 22 18.613 -3.380 2.505 1.00 2.34 H new ATOM 0 HZ3 LYS A 22 18.634 -5.058 2.246 1.00 2.34 H new ATOM 351 N LYS A 23 11.771 -1.430 0.103 1.00 33.33 N ATOM 352 CA LYS A 23 10.557 -1.704 -0.657 1.00 41.21 C ATOM 353 C LYS A 23 10.599 -3.102 -1.265 1.00 65.20 C ATOM 354 O LYS A 23 10.595 -3.259 -2.486 1.00 54.22 O ATOM 355 CB LYS A 23 10.377 -0.661 -1.763 1.00 3.15 C ATOM 356 CG LYS A 23 11.577 -0.540 -2.686 1.00 5.35 C ATOM 357 CD LYS A 23 12.093 0.888 -2.745 1.00 42.30 C ATOM 358 CE LYS A 23 13.239 1.026 -3.736 1.00 11.31 C ATOM 359 NZ LYS A 23 13.604 2.451 -3.967 1.00 0.53 N ATOM 0 H LYS A 23 12.425 -0.799 -0.360 1.00 33.33 H new ATOM 0 HA LYS A 23 9.710 -1.650 0.027 1.00 41.21 H new ATOM 0 HB2 LYS A 23 9.499 -0.919 -2.355 1.00 3.15 H new ATOM 0 HB3 LYS A 23 10.180 0.309 -1.307 1.00 3.15 H new ATOM 0 HG2 LYS A 23 12.372 -1.201 -2.340 1.00 5.35 H new ATOM 0 HG3 LYS A 23 11.302 -0.870 -3.688 1.00 5.35 H new ATOM 0 HD2 LYS A 23 11.282 1.558 -3.030 1.00 42.30 H new ATOM 0 HD3 LYS A 23 12.428 1.196 -1.755 1.00 42.30 H new ATOM 0 HE2 LYS A 23 14.108 0.484 -3.364 1.00 11.31 H new ATOM 0 HE3 LYS A 23 12.958 0.565 -4.683 1.00 11.31 H new ATOM 0 HZ1 LYS A 23 14.388 2.502 -4.648 1.00 0.53 H new ATOM 0 HZ2 LYS A 23 12.782 2.963 -4.346 1.00 0.53 H new ATOM 0 HZ3 LYS A 23 13.897 2.884 -3.068 1.00 0.53 H new ATOM 373 N ASP A 24 10.640 -4.115 -0.406 1.00 54.40 N ATOM 374 CA ASP A 24 10.680 -5.500 -0.859 1.00 22.32 C ATOM 375 C ASP A 24 10.704 -6.459 0.328 1.00 62.15 C ATOM 376 O ASP A 24 10.174 -7.568 0.255 1.00 55.32 O ATOM 377 CB ASP A 24 11.905 -5.734 -1.744 1.00 61.23 C ATOM 378 CG ASP A 24 13.168 -5.140 -1.154 1.00 5.32 C ATOM 379 OD1 ASP A 24 13.267 -3.896 -1.094 1.00 4.04 O ATOM 380 OD2 ASP A 24 14.058 -5.918 -0.751 1.00 51.11 O ATOM 0 H ASP A 24 10.646 -4.003 0.608 1.00 54.40 H new ATOM 0 HA ASP A 24 9.779 -5.693 -1.441 1.00 22.32 H new ATOM 0 HB2 ASP A 24 12.045 -6.805 -1.890 1.00 61.23 H new ATOM 0 HB3 ASP A 24 11.727 -5.299 -2.727 1.00 61.23 H new ATOM 385 N LYS A 25 11.324 -6.025 1.420 1.00 63.43 N ATOM 386 CA LYS A 25 11.418 -6.844 2.623 1.00 43.13 C ATOM 387 C LYS A 25 10.664 -6.198 3.781 1.00 70.05 C ATOM 388 O LYS A 25 10.541 -4.976 3.868 1.00 74.21 O ATOM 389 CB LYS A 25 12.884 -7.053 3.009 1.00 63.22 C ATOM 390 CG LYS A 25 13.814 -7.192 1.815 1.00 34.44 C ATOM 391 CD LYS A 25 15.015 -8.063 2.143 1.00 42.20 C ATOM 392 CE LYS A 25 16.184 -7.772 1.214 1.00 73.44 C ATOM 393 NZ LYS A 25 17.337 -8.678 1.473 1.00 1.01 N ATOM 0 H LYS A 25 11.769 -5.110 1.497 1.00 63.43 H new ATOM 0 HA LYS A 25 10.963 -7.811 2.410 1.00 43.13 H new ATOM 0 HB2 LYS A 25 13.214 -6.212 3.620 1.00 63.22 H new ATOM 0 HB3 LYS A 25 12.964 -7.947 3.627 1.00 63.22 H new ATOM 0 HG2 LYS A 25 13.268 -7.624 0.976 1.00 34.44 H new ATOM 0 HG3 LYS A 25 14.154 -6.205 1.500 1.00 34.44 H new ATOM 0 HD2 LYS A 25 15.318 -7.892 3.176 1.00 42.20 H new ATOM 0 HD3 LYS A 25 14.737 -9.114 2.062 1.00 42.20 H new ATOM 0 HE2 LYS A 25 15.861 -7.882 0.179 1.00 73.44 H new ATOM 0 HE3 LYS A 25 16.500 -6.737 1.341 1.00 73.44 H new ATOM 0 HZ1 LYS A 25 18.205 -8.255 1.085 1.00 1.01 H new ATOM 0 HZ2 LYS A 25 17.447 -8.816 2.498 1.00 1.01 H new ATOM 0 HZ3 LYS A 25 17.166 -9.597 1.017 1.00 1.01 H new ATOM 407 N PRO A 26 10.148 -7.036 4.692 1.00 11.43 N ATOM 408 CA PRO A 26 9.399 -6.568 5.862 1.00 13.03 C ATOM 409 C PRO A 26 10.290 -5.858 6.876 1.00 50.15 C ATOM 410 O PRO A 26 11.430 -6.262 7.106 1.00 3.22 O ATOM 411 CB PRO A 26 8.833 -7.858 6.460 1.00 75.51 C ATOM 412 CG PRO A 26 9.768 -8.927 6.009 1.00 13.10 C ATOM 413 CD PRO A 26 10.256 -8.504 4.651 1.00 5.44 C ATOM 0 HA PRO A 26 8.637 -5.837 5.592 1.00 13.03 H new ATOM 0 HB2 PRO A 26 8.789 -7.804 7.548 1.00 75.51 H new ATOM 0 HB3 PRO A 26 7.818 -8.045 6.109 1.00 75.51 H new ATOM 0 HG2 PRO A 26 10.599 -9.038 6.705 1.00 13.10 H new ATOM 0 HG3 PRO A 26 9.263 -9.892 5.959 1.00 13.10 H new ATOM 0 HD2 PRO A 26 11.282 -8.827 4.474 1.00 5.44 H new ATOM 0 HD3 PRO A 26 9.646 -8.930 3.854 1.00 5.44 H new ATOM 421 N THR A 27 9.763 -4.797 7.479 1.00 22.15 N ATOM 422 CA THR A 27 10.511 -4.030 8.468 1.00 62.43 C ATOM 423 C THR A 27 9.878 -4.149 9.849 1.00 25.05 C ATOM 424 O THR A 27 8.655 -4.124 9.988 1.00 53.44 O ATOM 425 CB THR A 27 10.593 -2.542 8.079 1.00 23.13 C ATOM 426 OG1 THR A 27 11.014 -2.414 6.717 1.00 45.13 O ATOM 427 CG2 THR A 27 11.562 -1.799 8.987 1.00 53.42 C ATOM 0 H THR A 27 8.821 -4.449 7.300 1.00 22.15 H new ATOM 0 HA THR A 27 11.518 -4.446 8.496 1.00 62.43 H new ATOM 0 HB THR A 27 9.602 -2.103 8.195 1.00 23.13 H new ATOM 0 HG1 THR A 27 11.062 -1.465 6.477 1.00 45.13 H new ATOM 0 HG21 THR A 27 11.604 -0.750 8.694 1.00 53.42 H new ATOM 0 HG22 THR A 27 11.223 -1.874 10.020 1.00 53.42 H new ATOM 0 HG23 THR A 27 12.555 -2.240 8.898 1.00 53.42 H new ATOM 435 N LEU A 28 10.719 -4.278 10.870 1.00 35.14 N ATOM 436 CA LEU A 28 10.241 -4.400 12.243 1.00 0.15 C ATOM 437 C LEU A 28 10.409 -3.085 12.997 1.00 3.53 C ATOM 438 O LEU A 28 11.494 -2.503 13.015 1.00 5.23 O ATOM 439 CB LEU A 28 10.994 -5.517 12.969 1.00 52.51 C ATOM 440 CG LEU A 28 10.157 -6.723 13.396 1.00 12.21 C ATOM 441 CD1 LEU A 28 11.014 -7.726 14.152 1.00 73.41 C ATOM 442 CD2 LEU A 28 8.977 -6.278 14.248 1.00 75.34 C ATOM 0 H LEU A 28 11.734 -4.301 10.773 1.00 35.14 H new ATOM 0 HA LEU A 28 9.180 -4.646 12.211 1.00 0.15 H new ATOM 0 HB2 LEU A 28 11.796 -5.868 12.320 1.00 52.51 H new ATOM 0 HB3 LEU A 28 11.464 -5.094 13.857 1.00 52.51 H new ATOM 0 HG LEU A 28 9.770 -7.209 12.500 1.00 12.21 H new ATOM 0 HD11 LEU A 28 10.402 -8.578 14.448 1.00 73.41 H new ATOM 0 HD12 LEU A 28 11.825 -8.068 13.510 1.00 73.41 H new ATOM 0 HD13 LEU A 28 11.430 -7.252 15.041 1.00 73.41 H new ATOM 0 HD21 LEU A 28 8.392 -7.149 14.543 1.00 75.34 H new ATOM 0 HD22 LEU A 28 9.343 -5.768 15.139 1.00 75.34 H new ATOM 0 HD23 LEU A 28 8.349 -5.597 13.673 1.00 75.34 H new ATOM 454 N ILE A 29 9.330 -2.623 13.620 1.00 51.05 N ATOM 455 CA ILE A 29 9.359 -1.378 14.378 1.00 64.34 C ATOM 456 C ILE A 29 9.171 -1.638 15.868 1.00 23.14 C ATOM 457 O ILE A 29 8.110 -2.085 16.303 1.00 14.12 O ATOM 458 CB ILE A 29 8.271 -0.400 13.897 1.00 60.50 C ATOM 459 CG1 ILE A 29 8.465 -0.076 12.414 1.00 32.13 C ATOM 460 CG2 ILE A 29 8.296 0.872 14.731 1.00 64.22 C ATOM 461 CD1 ILE A 29 7.168 0.012 11.640 1.00 30.44 C ATOM 0 H ILE A 29 8.424 -3.092 13.615 1.00 51.05 H new ATOM 0 HA ILE A 29 10.338 -0.929 14.211 1.00 64.34 H new ATOM 0 HB ILE A 29 7.297 -0.873 14.021 1.00 60.50 H new ATOM 0 HG12 ILE A 29 8.997 0.871 12.324 1.00 32.13 H new ATOM 0 HG13 ILE A 29 9.097 -0.841 11.963 1.00 32.13 H new ATOM 0 HG21 ILE A 29 7.521 1.553 14.379 1.00 64.22 H new ATOM 0 HG22 ILE A 29 8.114 0.625 15.777 1.00 64.22 H new ATOM 0 HG23 ILE A 29 9.271 1.351 14.636 1.00 64.22 H new ATOM 0 HD11 ILE A 29 7.382 0.244 10.597 1.00 30.44 H new ATOM 0 HD12 ILE A 29 6.644 -0.942 11.699 1.00 30.44 H new ATOM 0 HD13 ILE A 29 6.543 0.797 12.066 1.00 30.44 H new ATOM 473 N LYS A 30 10.209 -1.354 16.648 1.00 14.54 N ATOM 474 CA LYS A 30 10.158 -1.553 18.092 1.00 45.31 C ATOM 475 C LYS A 30 10.159 -0.216 18.826 1.00 3.30 C ATOM 476 O LYS A 30 10.886 0.706 18.456 1.00 4.52 O ATOM 477 CB LYS A 30 11.347 -2.400 18.552 1.00 31.01 C ATOM 478 CG LYS A 30 12.600 -1.589 18.833 1.00 51.33 C ATOM 479 CD LYS A 30 12.678 -1.169 20.291 1.00 31.51 C ATOM 480 CE LYS A 30 13.315 -2.252 21.149 1.00 71.01 C ATOM 481 NZ LYS A 30 13.169 -1.965 22.603 1.00 41.02 N ATOM 0 H LYS A 30 11.096 -0.985 16.304 1.00 14.54 H new ATOM 0 HA LYS A 30 9.232 -2.077 18.329 1.00 45.31 H new ATOM 0 HB2 LYS A 30 11.067 -2.944 19.454 1.00 31.01 H new ATOM 0 HB3 LYS A 30 11.570 -3.144 17.787 1.00 31.01 H new ATOM 0 HG2 LYS A 30 13.481 -2.178 18.576 1.00 51.33 H new ATOM 0 HG3 LYS A 30 12.611 -0.704 18.197 1.00 51.33 H new ATOM 0 HD2 LYS A 30 13.256 -0.249 20.375 1.00 31.51 H new ATOM 0 HD3 LYS A 30 11.677 -0.951 20.662 1.00 31.51 H new ATOM 0 HE2 LYS A 30 12.855 -3.214 20.921 1.00 71.01 H new ATOM 0 HE3 LYS A 30 14.373 -2.337 20.900 1.00 71.01 H new ATOM 0 HZ1 LYS A 30 13.229 -2.854 23.140 1.00 41.02 H new ATOM 0 HZ2 LYS A 30 13.929 -1.324 22.908 1.00 41.02 H new ATOM 0 HZ3 LYS A 30 12.247 -1.517 22.777 1.00 41.02 H new ATOM 495 N PHE A 31 9.341 -0.118 19.869 1.00 42.23 N ATOM 496 CA PHE A 31 9.248 1.107 20.655 1.00 23.32 C ATOM 497 C PHE A 31 10.006 0.966 21.972 1.00 44.21 C ATOM 498 O PHE A 31 9.960 -0.080 22.619 1.00 74.25 O ATOM 499 CB PHE A 31 7.783 1.451 20.931 1.00 21.44 C ATOM 500 CG PHE A 31 6.944 1.539 19.689 1.00 53.30 C ATOM 501 CD1 PHE A 31 6.425 0.395 19.104 1.00 11.24 C ATOM 502 CD2 PHE A 31 6.673 2.767 19.106 1.00 30.30 C ATOM 503 CE1 PHE A 31 5.653 0.474 17.961 1.00 51.12 C ATOM 504 CE2 PHE A 31 5.901 2.852 17.962 1.00 22.15 C ATOM 505 CZ PHE A 31 5.390 1.704 17.390 1.00 73.02 C ATOM 0 H PHE A 31 8.733 -0.872 20.189 1.00 42.23 H new ATOM 0 HA PHE A 31 9.701 1.914 20.079 1.00 23.32 H new ATOM 0 HB2 PHE A 31 7.359 0.696 21.593 1.00 21.44 H new ATOM 0 HB3 PHE A 31 7.735 2.403 21.460 1.00 21.44 H new ATOM 0 HD1 PHE A 31 6.626 -0.569 19.547 1.00 11.24 H new ATOM 0 HD2 PHE A 31 7.069 3.668 19.550 1.00 30.30 H new ATOM 0 HE1 PHE A 31 5.255 -0.425 17.514 1.00 51.12 H new ATOM 0 HE2 PHE A 31 5.698 3.815 17.517 1.00 22.15 H new ATOM 0 HZ PHE A 31 4.785 1.768 16.497 1.00 73.02 H new ATOM 515 N TRP A 32 10.704 2.027 22.362 1.00 70.13 N ATOM 516 CA TRP A 32 11.473 2.022 23.601 1.00 10.41 C ATOM 517 C TRP A 32 11.483 3.407 24.240 1.00 20.54 C ATOM 518 O TRP A 32 10.794 4.317 23.782 1.00 34.10 O ATOM 519 CB TRP A 32 12.906 1.560 23.334 1.00 23.24 C ATOM 520 CG TRP A 32 13.603 2.364 22.279 1.00 4.12 C ATOM 521 CD1 TRP A 32 13.306 2.401 20.947 1.00 62.02 C ATOM 522 CD2 TRP A 32 14.716 3.246 22.469 1.00 74.42 C ATOM 523 NE1 TRP A 32 14.167 3.252 20.297 1.00 52.34 N ATOM 524 CE2 TRP A 32 15.040 3.784 21.208 1.00 23.31 C ATOM 525 CE3 TRP A 32 15.467 3.634 23.581 1.00 44.32 C ATOM 526 CZ2 TRP A 32 16.084 4.688 21.032 1.00 63.25 C ATOM 527 CZ3 TRP A 32 16.503 4.531 23.404 1.00 44.42 C ATOM 528 CH2 TRP A 32 16.804 5.051 22.137 1.00 32.25 C ATOM 0 H TRP A 32 10.753 2.901 21.838 1.00 70.13 H new ATOM 0 HA TRP A 32 10.998 1.326 24.292 1.00 10.41 H new ATOM 0 HB2 TRP A 32 13.477 1.617 24.261 1.00 23.24 H new ATOM 0 HB3 TRP A 32 12.892 0.513 23.032 1.00 23.24 H new ATOM 0 HD1 TRP A 32 12.511 1.843 20.474 1.00 62.02 H new ATOM 0 HE1 TRP A 32 14.157 3.455 19.297 1.00 52.34 H new ATOM 0 HE3 TRP A 32 15.242 3.240 24.561 1.00 44.32 H new ATOM 0 HZ2 TRP A 32 16.317 5.089 20.057 1.00 63.25 H new ATOM 0 HZ3 TRP A 32 17.091 4.837 24.256 1.00 44.42 H new ATOM 0 HH2 TRP A 32 17.620 5.751 22.032 1.00 32.25 H new ATOM 539 N ALA A 33 12.269 3.558 25.301 1.00 22.12 N ATOM 540 CA ALA A 33 12.370 4.832 26.002 1.00 41.35 C ATOM 541 C ALA A 33 13.625 4.885 26.867 1.00 53.43 C ATOM 542 O ALA A 33 14.084 3.862 27.375 1.00 53.43 O ATOM 543 CB ALA A 33 11.130 5.067 26.851 1.00 2.15 C ATOM 0 H ALA A 33 12.845 2.814 25.694 1.00 22.12 H new ATOM 0 HA ALA A 33 12.441 5.624 25.257 1.00 41.35 H new ATOM 0 HB1 ALA A 33 11.219 6.022 27.369 1.00 2.15 H new ATOM 0 HB2 ALA A 33 10.248 5.082 26.211 1.00 2.15 H new ATOM 0 HB3 ALA A 33 11.033 4.265 27.583 1.00 2.15 H new ATOM 549 N SER A 34 14.175 6.084 27.030 1.00 43.13 N ATOM 550 CA SER A 34 15.380 6.270 27.830 1.00 61.41 C ATOM 551 C SER A 34 15.128 5.893 29.287 1.00 51.12 C ATOM 552 O SER A 34 16.058 5.572 30.026 1.00 3.32 O ATOM 553 CB SER A 34 15.858 7.720 27.742 1.00 44.14 C ATOM 554 OG SER A 34 15.454 8.460 28.880 1.00 4.54 O ATOM 0 H SER A 34 13.805 6.941 26.619 1.00 43.13 H new ATOM 0 HA SER A 34 16.155 5.615 27.432 1.00 61.41 H new ATOM 0 HB2 SER A 34 16.944 7.743 27.656 1.00 44.14 H new ATOM 0 HB3 SER A 34 15.457 8.184 26.841 1.00 44.14 H new ATOM 0 HG SER A 34 15.773 9.383 28.800 1.00 4.54 H new ATOM 560 N TRP A 35 13.864 5.935 29.691 1.00 13.13 N ATOM 561 CA TRP A 35 13.488 5.599 31.060 1.00 72.31 C ATOM 562 C TRP A 35 13.132 4.121 31.179 1.00 60.10 C ATOM 563 O TRP A 35 12.409 3.718 32.091 1.00 62.43 O ATOM 564 CB TRP A 35 12.306 6.458 31.512 1.00 4.51 C ATOM 565 CG TRP A 35 11.104 6.328 30.627 1.00 51.40 C ATOM 566 CD1 TRP A 35 10.853 7.023 29.478 1.00 31.21 C ATOM 567 CD2 TRP A 35 9.989 5.452 30.820 1.00 34.31 C ATOM 568 NE1 TRP A 35 9.649 6.631 28.945 1.00 34.43 N ATOM 569 CE2 TRP A 35 9.099 5.667 29.749 1.00 0.23 C ATOM 570 CE3 TRP A 35 9.656 4.504 31.792 1.00 54.32 C ATOM 571 CZ2 TRP A 35 7.900 4.970 29.626 1.00 11.54 C ATOM 572 CZ3 TRP A 35 8.465 3.814 31.669 1.00 70.24 C ATOM 573 CH2 TRP A 35 7.599 4.049 30.592 1.00 21.12 C ATOM 0 H TRP A 35 13.082 6.198 29.091 1.00 13.13 H new ATOM 0 HA TRP A 35 14.343 5.801 31.705 1.00 72.31 H new ATOM 0 HB2 TRP A 35 12.031 6.179 32.529 1.00 4.51 H new ATOM 0 HB3 TRP A 35 12.616 7.503 31.541 1.00 4.51 H new ATOM 0 HD1 TRP A 35 11.505 7.771 29.051 1.00 31.21 H new ATOM 0 HE1 TRP A 35 9.232 6.998 28.090 1.00 34.43 H new ATOM 0 HE3 TRP A 35 10.318 4.314 32.624 1.00 54.32 H new ATOM 0 HZ2 TRP A 35 7.231 5.150 28.797 1.00 11.54 H new ATOM 0 HZ3 TRP A 35 8.197 3.081 32.415 1.00 70.24 H new ATOM 0 HH2 TRP A 35 6.676 3.492 30.523 1.00 21.12 H new ATOM 584 N CYS A 36 13.644 3.317 30.253 1.00 72.00 N ATOM 585 CA CYS A 36 13.380 1.883 30.254 1.00 40.21 C ATOM 586 C CYS A 36 14.678 1.091 30.380 1.00 3.33 C ATOM 587 O CYS A 36 15.582 1.197 29.551 1.00 5.23 O ATOM 588 CB CYS A 36 12.645 1.478 28.975 1.00 60.23 C ATOM 589 SG CYS A 36 12.330 -0.311 28.833 1.00 11.22 S ATOM 0 H CYS A 36 14.244 3.634 29.492 1.00 72.00 H new ATOM 0 HA CYS A 36 12.751 1.655 31.115 1.00 40.21 H new ATOM 0 HB2 CYS A 36 11.694 2.008 28.932 1.00 60.23 H new ATOM 0 HB3 CYS A 36 13.230 1.803 28.114 1.00 60.23 H new ATOM 594 N PRO A 37 14.774 0.278 31.442 1.00 21.24 N ATOM 595 CA PRO A 37 15.957 -0.549 31.703 1.00 54.44 C ATOM 596 C PRO A 37 16.103 -1.685 30.696 1.00 53.40 C ATOM 597 O PRO A 37 17.180 -1.899 30.139 1.00 61.42 O ATOM 598 CB PRO A 37 15.698 -1.106 33.104 1.00 22.25 C ATOM 599 CG PRO A 37 14.216 -1.091 33.251 1.00 13.41 C ATOM 600 CD PRO A 37 13.735 0.102 32.471 1.00 60.41 C ATOM 0 HA PRO A 37 16.881 0.023 31.622 1.00 54.44 H new ATOM 0 HB2 PRO A 37 16.096 -2.115 33.208 1.00 22.25 H new ATOM 0 HB3 PRO A 37 16.178 -0.494 33.868 1.00 22.25 H new ATOM 0 HG2 PRO A 37 13.776 -2.012 32.867 1.00 13.41 H new ATOM 0 HG3 PRO A 37 13.928 -1.014 34.300 1.00 13.41 H new ATOM 0 HD2 PRO A 37 12.756 -0.076 32.027 1.00 60.41 H new ATOM 0 HD3 PRO A 37 13.642 0.985 33.103 1.00 60.41 H new ATOM 608 N LEU A 38 15.013 -2.409 30.467 1.00 63.33 N ATOM 609 CA LEU A 38 15.020 -3.524 29.526 1.00 61.31 C ATOM 610 C LEU A 38 15.244 -3.032 28.100 1.00 54.14 C ATOM 611 O LEU A 38 15.523 -3.820 27.196 1.00 75.32 O ATOM 612 CB LEU A 38 13.702 -4.296 29.610 1.00 23.53 C ATOM 613 CG LEU A 38 13.278 -4.750 31.008 1.00 43.32 C ATOM 614 CD1 LEU A 38 11.918 -5.428 30.959 1.00 12.52 C ATOM 615 CD2 LEU A 38 14.321 -5.684 31.605 1.00 73.14 C ATOM 0 H LEU A 38 14.114 -2.244 30.919 1.00 63.33 H new ATOM 0 HA LEU A 38 15.841 -4.189 29.794 1.00 61.31 H new ATOM 0 HB2 LEU A 38 12.911 -3.670 29.197 1.00 23.53 H new ATOM 0 HB3 LEU A 38 13.778 -5.176 28.971 1.00 23.53 H new ATOM 0 HG LEU A 38 13.200 -3.870 31.647 1.00 43.32 H new ATOM 0 HD11 LEU A 38 11.633 -5.744 31.962 1.00 12.52 H new ATOM 0 HD12 LEU A 38 11.176 -4.728 30.574 1.00 12.52 H new ATOM 0 HD13 LEU A 38 11.969 -6.298 30.305 1.00 12.52 H new ATOM 0 HD21 LEU A 38 14.003 -5.997 32.599 1.00 73.14 H new ATOM 0 HD22 LEU A 38 14.432 -6.561 30.967 1.00 73.14 H new ATOM 0 HD23 LEU A 38 15.276 -5.164 31.677 1.00 73.14 H new ATOM 627 N CYS A 39 15.122 -1.723 27.905 1.00 35.11 N ATOM 628 CA CYS A 39 15.312 -1.124 26.590 1.00 74.14 C ATOM 629 C CYS A 39 16.700 -0.502 26.471 1.00 71.14 C ATOM 630 O CYS A 39 17.474 -0.850 25.578 1.00 70.11 O ATOM 631 CB CYS A 39 14.241 -0.062 26.330 1.00 21.32 C ATOM 632 SG CYS A 39 12.556 -0.576 26.795 1.00 62.01 S ATOM 0 H CYS A 39 14.892 -1.057 28.642 1.00 35.11 H new ATOM 0 HA CYS A 39 15.221 -1.912 25.843 1.00 74.14 H new ATOM 0 HB2 CYS A 39 14.499 0.842 26.882 1.00 21.32 H new ATOM 0 HB3 CYS A 39 14.251 0.197 25.271 1.00 21.32 H new ATOM 637 N LEU A 40 17.009 0.420 27.376 1.00 34.52 N ATOM 638 CA LEU A 40 18.304 1.091 27.374 1.00 31.30 C ATOM 639 C LEU A 40 19.443 0.077 27.424 1.00 15.13 C ATOM 640 O LEU A 40 20.466 0.245 26.762 1.00 43.12 O ATOM 641 CB LEU A 40 18.406 2.049 28.562 1.00 31.21 C ATOM 642 CG LEU A 40 19.271 3.292 28.350 1.00 60.43 C ATOM 643 CD1 LEU A 40 18.528 4.323 27.514 1.00 22.33 C ATOM 644 CD2 LEU A 40 19.688 3.886 29.687 1.00 11.20 C ATOM 0 H LEU A 40 16.380 0.720 28.121 1.00 34.52 H new ATOM 0 HA LEU A 40 18.389 1.660 26.448 1.00 31.30 H new ATOM 0 HB2 LEU A 40 17.400 2.372 28.830 1.00 31.21 H new ATOM 0 HB3 LEU A 40 18.801 1.497 29.415 1.00 31.21 H new ATOM 0 HG LEU A 40 20.171 2.997 27.810 1.00 60.43 H new ATOM 0 HD11 LEU A 40 19.159 5.201 27.374 1.00 22.33 H new ATOM 0 HD12 LEU A 40 18.281 3.894 26.543 1.00 22.33 H new ATOM 0 HD13 LEU A 40 17.611 4.614 28.026 1.00 22.33 H new ATOM 0 HD21 LEU A 40 20.303 4.770 29.517 1.00 11.20 H new ATOM 0 HD22 LEU A 40 18.800 4.166 30.254 1.00 11.20 H new ATOM 0 HD23 LEU A 40 20.260 3.149 30.250 1.00 11.20 H new ATOM 656 N SER A 41 19.256 -0.976 28.213 1.00 33.41 N ATOM 657 CA SER A 41 20.268 -2.017 28.351 1.00 31.10 C ATOM 658 C SER A 41 20.259 -2.948 27.142 1.00 15.40 C ATOM 659 O SER A 41 21.151 -3.779 26.979 1.00 41.31 O ATOM 660 CB SER A 41 20.031 -2.822 29.630 1.00 20.03 C ATOM 661 OG SER A 41 21.258 -3.226 30.213 1.00 71.31 O ATOM 0 H SER A 41 18.413 -1.131 28.766 1.00 33.41 H new ATOM 0 HA SER A 41 21.244 -1.535 28.409 1.00 31.10 H new ATOM 0 HB2 SER A 41 19.467 -2.221 30.343 1.00 20.03 H new ATOM 0 HB3 SER A 41 19.426 -3.700 29.404 1.00 20.03 H new ATOM 0 HG SER A 41 21.079 -3.737 31.030 1.00 71.31 H new ATOM 667 N GLU A 42 19.242 -2.801 26.298 1.00 43.53 N ATOM 668 CA GLU A 42 19.116 -3.628 25.104 1.00 70.21 C ATOM 669 C GLU A 42 19.513 -2.846 23.855 1.00 32.11 C ATOM 670 O GLU A 42 19.497 -3.378 22.744 1.00 23.33 O ATOM 671 CB GLU A 42 17.682 -4.143 24.962 1.00 11.24 C ATOM 672 CG GLU A 42 17.481 -5.544 25.515 1.00 52.02 C ATOM 673 CD GLU A 42 17.220 -6.568 24.427 1.00 11.12 C ATOM 674 OE1 GLU A 42 17.703 -6.366 23.293 1.00 33.24 O ATOM 675 OE2 GLU A 42 16.533 -7.572 24.711 1.00 53.53 O ATOM 0 H GLU A 42 18.494 -2.118 26.419 1.00 43.53 H new ATOM 0 HA GLU A 42 19.791 -4.477 25.209 1.00 70.21 H new ATOM 0 HB2 GLU A 42 17.007 -3.459 25.475 1.00 11.24 H new ATOM 0 HB3 GLU A 42 17.404 -4.134 23.908 1.00 11.24 H new ATOM 0 HG2 GLU A 42 18.365 -5.838 26.081 1.00 52.02 H new ATOM 0 HG3 GLU A 42 16.643 -5.539 26.212 1.00 52.02 H new ATOM 682 N LEU A 43 19.867 -1.580 24.045 1.00 24.12 N ATOM 683 CA LEU A 43 20.268 -0.723 22.935 1.00 42.11 C ATOM 684 C LEU A 43 21.313 -1.413 22.064 1.00 72.14 C ATOM 685 O LEU A 43 21.171 -1.482 20.844 1.00 71.14 O ATOM 686 CB LEU A 43 20.822 0.602 23.462 1.00 51.11 C ATOM 687 CG LEU A 43 19.920 1.824 23.284 1.00 3.33 C ATOM 688 CD1 LEU A 43 18.491 1.496 23.686 1.00 73.14 C ATOM 689 CD2 LEU A 43 20.448 2.999 24.096 1.00 73.51 C ATOM 0 H LEU A 43 19.885 -1.124 24.957 1.00 24.12 H new ATOM 0 HA LEU A 43 19.387 -0.525 22.325 1.00 42.11 H new ATOM 0 HB2 LEU A 43 21.038 0.486 24.524 1.00 51.11 H new ATOM 0 HB3 LEU A 43 21.771 0.800 22.964 1.00 51.11 H new ATOM 0 HG LEU A 43 19.924 2.104 22.231 1.00 3.33 H new ATOM 0 HD11 LEU A 43 17.864 2.378 23.553 1.00 73.14 H new ATOM 0 HD12 LEU A 43 18.115 0.685 23.062 1.00 73.14 H new ATOM 0 HD13 LEU A 43 18.468 1.190 24.732 1.00 73.14 H new ATOM 0 HD21 LEU A 43 19.794 3.860 23.958 1.00 73.51 H new ATOM 0 HD22 LEU A 43 20.474 2.729 25.152 1.00 73.51 H new ATOM 0 HD23 LEU A 43 21.454 3.250 23.761 1.00 73.51 H new ATOM 701 N GLY A 44 22.362 -1.925 22.700 1.00 42.01 N ATOM 702 CA GLY A 44 23.414 -2.605 21.968 1.00 64.15 C ATOM 703 C GLY A 44 22.906 -3.819 21.216 1.00 60.40 C ATOM 704 O GLY A 44 23.243 -4.020 20.049 1.00 32.35 O ATOM 0 H GLY A 44 22.502 -1.881 23.709 1.00 42.01 H new ATOM 0 HA2 GLY A 44 23.870 -1.910 21.263 1.00 64.15 H new ATOM 0 HA3 GLY A 44 24.195 -2.913 22.663 1.00 64.15 H new ATOM 708 N GLN A 45 22.095 -4.631 21.886 1.00 33.21 N ATOM 709 CA GLN A 45 21.542 -5.833 21.274 1.00 75.40 C ATOM 710 C GLN A 45 20.843 -5.503 19.959 1.00 13.33 C ATOM 711 O GLN A 45 21.134 -6.098 18.921 1.00 3.13 O ATOM 712 CB GLN A 45 20.560 -6.513 22.230 1.00 13.33 C ATOM 713 CG GLN A 45 19.798 -7.668 21.601 1.00 54.43 C ATOM 714 CD GLN A 45 19.424 -8.738 22.607 1.00 12.22 C ATOM 715 OE1 GLN A 45 18.249 -9.069 22.771 1.00 22.02 O ATOM 716 NE2 GLN A 45 20.424 -9.286 23.288 1.00 13.41 N ATOM 0 H GLN A 45 21.806 -4.478 22.852 1.00 33.21 H new ATOM 0 HA GLN A 45 22.366 -6.515 21.065 1.00 75.40 H new ATOM 0 HB2 GLN A 45 21.107 -6.880 23.099 1.00 13.33 H new ATOM 0 HB3 GLN A 45 19.847 -5.772 22.592 1.00 13.33 H new ATOM 0 HG2 GLN A 45 18.893 -7.286 21.129 1.00 54.43 H new ATOM 0 HG3 GLN A 45 20.406 -8.112 20.813 1.00 54.43 H new ATOM 0 HE21 GLN A 45 21.383 -8.981 23.120 1.00 13.41 H new ATOM 0 HE22 GLN A 45 20.233 -10.012 23.979 1.00 13.41 H new ATOM 725 N THR A 46 19.918 -4.549 20.010 1.00 75.30 N ATOM 726 CA THR A 46 19.176 -4.140 18.824 1.00 73.30 C ATOM 727 C THR A 46 20.110 -3.585 17.756 1.00 42.55 C ATOM 728 O THR A 46 19.898 -3.797 16.562 1.00 5.12 O ATOM 729 CB THR A 46 18.114 -3.078 19.164 1.00 12.33 C ATOM 730 OG1 THR A 46 17.307 -3.525 20.259 1.00 13.23 O ATOM 731 CG2 THR A 46 17.230 -2.791 17.960 1.00 73.11 C ATOM 0 H THR A 46 19.665 -4.045 20.860 1.00 75.30 H new ATOM 0 HA THR A 46 18.678 -5.030 18.440 1.00 73.30 H new ATOM 0 HB THR A 46 18.629 -2.159 19.444 1.00 12.33 H new ATOM 0 HG1 THR A 46 16.635 -2.843 20.470 1.00 13.23 H new ATOM 0 HG21 THR A 46 16.488 -2.038 18.225 1.00 73.11 H new ATOM 0 HG22 THR A 46 17.843 -2.423 17.138 1.00 73.11 H new ATOM 0 HG23 THR A 46 16.724 -3.707 17.653 1.00 73.11 H new ATOM 739 N GLU A 47 21.144 -2.873 18.192 1.00 4.35 N ATOM 740 CA GLU A 47 22.111 -2.286 17.271 1.00 21.55 C ATOM 741 C GLU A 47 22.775 -3.365 16.420 1.00 21.25 C ATOM 742 O GLU A 47 23.139 -3.127 15.269 1.00 70.34 O ATOM 743 CB GLU A 47 23.175 -1.504 18.044 1.00 42.11 C ATOM 744 CG GLU A 47 24.326 -1.023 17.176 1.00 2.25 C ATOM 745 CD GLU A 47 23.916 0.083 16.223 1.00 31.04 C ATOM 746 OE1 GLU A 47 22.936 -0.114 15.474 1.00 1.43 O ATOM 747 OE2 GLU A 47 24.574 1.144 16.226 1.00 1.03 O ATOM 0 H GLU A 47 21.334 -2.688 19.177 1.00 4.35 H new ATOM 0 HA GLU A 47 21.577 -1.603 16.610 1.00 21.55 H new ATOM 0 HB2 GLU A 47 22.706 -0.643 18.521 1.00 42.11 H new ATOM 0 HB3 GLU A 47 23.570 -2.134 18.841 1.00 42.11 H new ATOM 0 HG2 GLU A 47 25.133 -0.666 17.815 1.00 2.25 H new ATOM 0 HG3 GLU A 47 24.720 -1.863 16.604 1.00 2.25 H new ATOM 754 N LYS A 48 22.930 -4.552 16.996 1.00 24.53 N ATOM 755 CA LYS A 48 23.550 -5.669 16.293 1.00 74.51 C ATOM 756 C LYS A 48 22.529 -6.398 15.424 1.00 23.44 C ATOM 757 O LYS A 48 22.877 -6.973 14.393 1.00 74.41 O ATOM 758 CB LYS A 48 24.174 -6.645 17.293 1.00 61.43 C ATOM 759 CG LYS A 48 25.043 -5.970 18.340 1.00 72.41 C ATOM 760 CD LYS A 48 26.381 -6.673 18.491 1.00 25.33 C ATOM 761 CE LYS A 48 27.361 -5.838 19.302 1.00 60.35 C ATOM 762 NZ LYS A 48 28.533 -5.413 18.487 1.00 23.25 N ATOM 0 H LYS A 48 22.635 -4.766 17.949 1.00 24.53 H new ATOM 0 HA LYS A 48 24.333 -5.271 15.647 1.00 74.51 H new ATOM 0 HB2 LYS A 48 23.379 -7.197 17.794 1.00 61.43 H new ATOM 0 HB3 LYS A 48 24.775 -7.374 16.750 1.00 61.43 H new ATOM 0 HG2 LYS A 48 25.207 -4.929 18.062 1.00 72.41 H new ATOM 0 HG3 LYS A 48 24.523 -5.966 19.298 1.00 72.41 H new ATOM 0 HD2 LYS A 48 26.234 -7.637 18.977 1.00 25.33 H new ATOM 0 HD3 LYS A 48 26.801 -6.874 17.505 1.00 25.33 H new ATOM 0 HE2 LYS A 48 26.851 -4.957 19.693 1.00 60.35 H new ATOM 0 HE3 LYS A 48 27.705 -6.414 20.161 1.00 60.35 H new ATOM 0 HZ1 LYS A 48 29.177 -4.846 19.075 1.00 23.25 H new ATOM 0 HZ2 LYS A 48 29.034 -6.254 18.135 1.00 23.25 H new ATOM 0 HZ3 LYS A 48 28.207 -4.842 17.681 1.00 23.25 H new ATOM 776 N TRP A 49 21.271 -6.369 15.848 1.00 71.03 N ATOM 777 CA TRP A 49 20.200 -7.026 15.107 1.00 60.21 C ATOM 778 C TRP A 49 19.999 -6.372 13.745 1.00 43.44 C ATOM 779 O TRP A 49 19.927 -7.054 12.723 1.00 55.41 O ATOM 780 CB TRP A 49 18.896 -6.980 15.906 1.00 45.02 C ATOM 781 CG TRP A 49 18.914 -7.855 17.123 1.00 43.33 C ATOM 782 CD1 TRP A 49 20.003 -8.463 17.679 1.00 62.11 C ATOM 783 CD2 TRP A 49 17.791 -8.220 17.932 1.00 62.00 C ATOM 784 NE1 TRP A 49 19.625 -9.185 18.785 1.00 14.43 N ATOM 785 CE2 TRP A 49 18.273 -9.051 18.962 1.00 31.04 C ATOM 786 CE3 TRP A 49 16.426 -7.924 17.888 1.00 61.41 C ATOM 787 CZ2 TRP A 49 17.436 -9.589 19.937 1.00 44.21 C ATOM 788 CZ3 TRP A 49 15.597 -8.459 18.856 1.00 62.23 C ATOM 789 CH2 TRP A 49 16.104 -9.283 19.869 1.00 3.04 C ATOM 0 H TRP A 49 20.967 -5.898 16.700 1.00 71.03 H new ATOM 0 HA TRP A 49 20.486 -8.066 14.951 1.00 60.21 H new ATOM 0 HB2 TRP A 49 18.700 -5.952 16.210 1.00 45.02 H new ATOM 0 HB3 TRP A 49 18.072 -7.284 15.261 1.00 45.02 H new ATOM 0 HD1 TRP A 49 21.013 -8.387 17.304 1.00 62.11 H new ATOM 0 HE1 TRP A 49 20.249 -9.732 19.378 1.00 14.43 H new ATOM 0 HE3 TRP A 49 16.026 -7.289 17.112 1.00 61.41 H new ATOM 0 HZ2 TRP A 49 17.825 -10.225 20.719 1.00 44.21 H new ATOM 0 HZ3 TRP A 49 14.540 -8.238 18.831 1.00 62.23 H new ATOM 0 HH2 TRP A 49 15.430 -9.685 20.611 1.00 3.04 H new ATOM 800 N ALA A 50 19.911 -5.046 13.737 1.00 14.43 N ATOM 801 CA ALA A 50 19.721 -4.299 12.500 1.00 73.44 C ATOM 802 C ALA A 50 20.897 -4.503 11.550 1.00 14.32 C ATOM 803 O ALA A 50 20.822 -4.154 10.372 1.00 35.33 O ATOM 804 CB ALA A 50 19.531 -2.820 12.799 1.00 4.31 C ATOM 0 H ALA A 50 19.968 -4.467 14.574 1.00 14.43 H new ATOM 0 HA ALA A 50 18.823 -4.676 12.011 1.00 73.44 H new ATOM 0 HB1 ALA A 50 19.390 -2.275 11.865 1.00 4.31 H new ATOM 0 HB2 ALA A 50 18.654 -2.687 13.433 1.00 4.31 H new ATOM 0 HB3 ALA A 50 20.412 -2.437 13.314 1.00 4.31 H new ATOM 810 N GLN A 51 21.981 -5.068 12.071 1.00 10.31 N ATOM 811 CA GLN A 51 23.173 -5.315 11.269 1.00 70.53 C ATOM 812 C GLN A 51 23.434 -6.812 11.129 1.00 1.42 C ATOM 813 O GLN A 51 24.367 -7.227 10.442 1.00 72.54 O ATOM 814 CB GLN A 51 24.388 -4.630 11.897 1.00 72.12 C ATOM 815 CG GLN A 51 24.321 -3.112 11.852 1.00 72.13 C ATOM 816 CD GLN A 51 24.826 -2.544 10.540 1.00 24.31 C ATOM 817 OE1 GLN A 51 25.976 -2.764 10.157 1.00 10.24 O ATOM 818 NE2 GLN A 51 23.968 -1.809 9.843 1.00 71.42 N ATOM 0 H GLN A 51 22.058 -5.363 13.044 1.00 10.31 H new ATOM 0 HA GLN A 51 23.004 -4.899 10.276 1.00 70.53 H new ATOM 0 HB2 GLN A 51 24.480 -4.951 12.935 1.00 72.12 H new ATOM 0 HB3 GLN A 51 25.289 -4.961 11.380 1.00 72.12 H new ATOM 0 HG2 GLN A 51 23.291 -2.793 12.009 1.00 72.13 H new ATOM 0 HG3 GLN A 51 24.910 -2.702 12.672 1.00 72.13 H new ATOM 0 HE21 GLN A 51 23.025 -1.652 10.198 1.00 71.42 H new ATOM 0 HE22 GLN A 51 24.252 -1.401 8.952 1.00 71.42 H new ATOM 827 N ASP A 52 22.605 -7.615 11.786 1.00 60.40 N ATOM 828 CA ASP A 52 22.746 -9.066 11.735 1.00 53.02 C ATOM 829 C ASP A 52 22.509 -9.585 10.320 1.00 64.21 C ATOM 830 O ASP A 52 21.533 -9.216 9.668 1.00 61.41 O ATOM 831 CB ASP A 52 21.767 -9.729 12.705 1.00 71.21 C ATOM 832 CG ASP A 52 22.324 -11.004 13.308 1.00 54.11 C ATOM 833 OD1 ASP A 52 23.002 -11.758 12.579 1.00 24.15 O ATOM 834 OD2 ASP A 52 22.081 -11.247 14.508 1.00 3.04 O ATOM 0 H ASP A 52 21.829 -7.286 12.360 1.00 60.40 H new ATOM 0 HA ASP A 52 23.765 -9.318 12.030 1.00 53.02 H new ATOM 0 HB2 ASP A 52 21.522 -9.029 13.504 1.00 71.21 H new ATOM 0 HB3 ASP A 52 20.838 -9.954 12.182 1.00 71.21 H new ATOM 839 N ALA A 53 23.411 -10.442 9.851 1.00 35.44 N ATOM 840 CA ALA A 53 23.300 -11.013 8.515 1.00 55.23 C ATOM 841 C ALA A 53 21.988 -11.773 8.349 1.00 12.42 C ATOM 842 O ALA A 53 21.395 -11.782 7.270 1.00 2.30 O ATOM 843 CB ALA A 53 24.481 -11.928 8.232 1.00 63.51 C ATOM 0 H ALA A 53 24.227 -10.756 10.377 1.00 35.44 H new ATOM 0 HA ALA A 53 23.308 -10.194 7.796 1.00 55.23 H new ATOM 0 HB1 ALA A 53 24.385 -12.347 7.231 1.00 63.51 H new ATOM 0 HB2 ALA A 53 25.407 -11.358 8.299 1.00 63.51 H new ATOM 0 HB3 ALA A 53 24.499 -12.736 8.963 1.00 63.51 H new ATOM 849 N LYS A 54 21.539 -12.410 9.425 1.00 31.11 N ATOM 850 CA LYS A 54 20.297 -13.173 9.400 1.00 14.03 C ATOM 851 C LYS A 54 19.093 -12.248 9.245 1.00 64.42 C ATOM 852 O LYS A 54 18.071 -12.634 8.678 1.00 72.01 O ATOM 853 CB LYS A 54 20.156 -14.000 10.681 1.00 51.55 C ATOM 854 CG LYS A 54 20.703 -15.411 10.557 1.00 43.15 C ATOM 855 CD LYS A 54 20.366 -16.249 11.778 1.00 73.30 C ATOM 856 CE LYS A 54 21.398 -17.343 12.006 1.00 1.43 C ATOM 857 NZ LYS A 54 20.941 -18.657 11.475 1.00 2.32 N ATOM 0 H LYS A 54 22.017 -12.413 10.326 1.00 31.11 H new ATOM 0 HA LYS A 54 20.330 -13.845 8.542 1.00 14.03 H new ATOM 0 HB2 LYS A 54 20.674 -13.489 11.492 1.00 51.55 H new ATOM 0 HB3 LYS A 54 19.103 -14.051 10.957 1.00 51.55 H new ATOM 0 HG2 LYS A 54 20.292 -15.884 9.665 1.00 43.15 H new ATOM 0 HG3 LYS A 54 21.785 -15.373 10.428 1.00 43.15 H new ATOM 0 HD2 LYS A 54 20.314 -15.607 12.658 1.00 73.30 H new ATOM 0 HD3 LYS A 54 19.381 -16.698 11.652 1.00 73.30 H new ATOM 0 HE2 LYS A 54 22.336 -17.063 11.525 1.00 1.43 H new ATOM 0 HE3 LYS A 54 21.601 -17.434 13.073 1.00 1.43 H new ATOM 0 HZ1 LYS A 54 21.672 -19.375 11.650 1.00 2.32 H new ATOM 0 HZ2 LYS A 54 20.060 -18.937 11.951 1.00 2.32 H new ATOM 0 HZ3 LYS A 54 20.771 -18.578 10.452 1.00 2.32 H new ATOM 871 N PHE A 55 19.223 -11.026 9.750 1.00 32.24 N ATOM 872 CA PHE A 55 18.146 -10.046 9.667 1.00 30.51 C ATOM 873 C PHE A 55 18.083 -9.425 8.275 1.00 10.41 C ATOM 874 O PHE A 55 17.182 -8.642 7.973 1.00 31.12 O ATOM 875 CB PHE A 55 18.341 -8.952 10.718 1.00 21.15 C ATOM 876 CG PHE A 55 17.534 -9.169 11.967 1.00 62.34 C ATOM 877 CD1 PHE A 55 16.150 -9.123 11.929 1.00 11.53 C ATOM 878 CD2 PHE A 55 18.160 -9.421 13.177 1.00 51.21 C ATOM 879 CE1 PHE A 55 15.405 -9.321 13.077 1.00 63.25 C ATOM 880 CE2 PHE A 55 17.420 -9.621 14.327 1.00 4.25 C ATOM 881 CZ PHE A 55 16.041 -9.572 14.277 1.00 42.12 C ATOM 0 H PHE A 55 20.063 -10.690 10.221 1.00 32.24 H new ATOM 0 HA PHE A 55 17.204 -10.560 9.859 1.00 30.51 H new ATOM 0 HB2 PHE A 55 19.397 -8.897 10.982 1.00 21.15 H new ATOM 0 HB3 PHE A 55 18.071 -7.990 10.283 1.00 21.15 H new ATOM 0 HD1 PHE A 55 15.647 -8.930 10.993 1.00 11.53 H new ATOM 0 HD2 PHE A 55 19.238 -9.462 13.222 1.00 51.21 H new ATOM 0 HE1 PHE A 55 14.327 -9.279 13.035 1.00 63.25 H new ATOM 0 HE2 PHE A 55 17.920 -9.816 15.264 1.00 4.25 H new ATOM 0 HZ PHE A 55 15.461 -9.730 15.174 1.00 42.12 H new ATOM 891 N SER A 56 19.047 -9.778 7.431 1.00 22.32 N ATOM 892 CA SER A 56 19.105 -9.252 6.072 1.00 32.25 C ATOM 893 C SER A 56 17.822 -9.572 5.311 1.00 31.12 C ATOM 894 O SER A 56 17.507 -8.933 4.308 1.00 54.23 O ATOM 895 CB SER A 56 20.310 -9.832 5.329 1.00 1.44 C ATOM 896 OG SER A 56 21.524 -9.456 5.956 1.00 43.32 O ATOM 0 H SER A 56 19.799 -10.426 7.664 1.00 22.32 H new ATOM 0 HA SER A 56 19.211 -8.169 6.132 1.00 32.25 H new ATOM 0 HB2 SER A 56 20.234 -10.919 5.299 1.00 1.44 H new ATOM 0 HB3 SER A 56 20.307 -9.483 4.296 1.00 1.44 H new ATOM 0 HG SER A 56 21.941 -10.245 6.360 1.00 43.32 H new ATOM 902 N SER A 57 17.086 -10.567 5.797 1.00 53.25 N ATOM 903 CA SER A 57 15.839 -10.975 5.161 1.00 74.53 C ATOM 904 C SER A 57 14.646 -10.275 5.804 1.00 12.10 C ATOM 905 O SER A 57 13.507 -10.725 5.680 1.00 1.15 O ATOM 906 CB SER A 57 15.666 -12.493 5.256 1.00 1.45 C ATOM 907 OG SER A 57 16.570 -13.164 4.396 1.00 72.01 O ATOM 0 H SER A 57 17.332 -11.105 6.628 1.00 53.25 H new ATOM 0 HA SER A 57 15.885 -10.686 4.111 1.00 74.53 H new ATOM 0 HB2 SER A 57 15.829 -12.817 6.284 1.00 1.45 H new ATOM 0 HB3 SER A 57 14.643 -12.763 4.995 1.00 1.45 H new ATOM 0 HG SER A 57 16.441 -14.132 4.476 1.00 72.01 H new ATOM 913 N ALA A 58 14.917 -9.170 6.491 1.00 34.24 N ATOM 914 CA ALA A 58 13.867 -8.406 7.153 1.00 13.50 C ATOM 915 C ALA A 58 14.442 -7.185 7.865 1.00 74.45 C ATOM 916 O ALA A 58 15.208 -7.315 8.818 1.00 61.21 O ATOM 917 CB ALA A 58 13.113 -9.287 8.138 1.00 52.30 C ATOM 0 H ALA A 58 15.854 -8.784 6.603 1.00 34.24 H new ATOM 0 HA ALA A 58 13.172 -8.056 6.390 1.00 13.50 H new ATOM 0 HB1 ALA A 58 12.332 -8.703 8.625 1.00 52.30 H new ATOM 0 HB2 ALA A 58 12.661 -10.124 7.606 1.00 52.30 H new ATOM 0 HB3 ALA A 58 13.805 -9.666 8.890 1.00 52.30 H new ATOM 923 N ASN A 59 14.066 -6.000 7.394 1.00 65.42 N ATOM 924 CA ASN A 59 14.546 -4.756 7.985 1.00 64.51 C ATOM 925 C ASN A 59 14.160 -4.670 9.458 1.00 3.14 C ATOM 926 O ASN A 59 13.147 -5.229 9.880 1.00 23.51 O ATOM 927 CB ASN A 59 13.980 -3.555 7.226 1.00 15.11 C ATOM 928 CG ASN A 59 14.069 -3.726 5.722 1.00 70.40 C ATOM 929 OD1 ASN A 59 13.114 -3.450 4.997 1.00 54.44 O ATOM 930 ND2 ASN A 59 15.221 -4.185 5.246 1.00 32.44 N ATOM 0 H ASN A 59 13.431 -5.875 6.606 1.00 65.42 H new ATOM 0 HA ASN A 59 15.633 -4.743 7.912 1.00 64.51 H new ATOM 0 HB2 ASN A 59 12.938 -3.407 7.511 1.00 15.11 H new ATOM 0 HB3 ASN A 59 14.522 -2.656 7.519 1.00 15.11 H new ATOM 0 HD21 ASN A 59 15.340 -4.321 4.242 1.00 32.44 H new ATOM 0 HD22 ASN A 59 15.987 -4.401 5.884 1.00 32.44 H new ATOM 937 N LEU A 60 14.974 -3.965 10.237 1.00 54.32 N ATOM 938 CA LEU A 60 14.718 -3.803 11.664 1.00 74.41 C ATOM 939 C LEU A 60 15.121 -2.410 12.135 1.00 21.14 C ATOM 940 O LEU A 60 16.269 -1.997 11.971 1.00 43.35 O ATOM 941 CB LEU A 60 15.478 -4.864 12.462 1.00 71.35 C ATOM 942 CG LEU A 60 14.906 -5.207 13.838 1.00 45.21 C ATOM 943 CD1 LEU A 60 15.626 -6.408 14.431 1.00 62.12 C ATOM 944 CD2 LEU A 60 15.007 -4.009 14.770 1.00 4.54 C ATOM 0 H LEU A 60 15.817 -3.497 9.904 1.00 54.32 H new ATOM 0 HA LEU A 60 13.648 -3.927 11.833 1.00 74.41 H new ATOM 0 HB2 LEU A 60 15.516 -5.778 11.869 1.00 71.35 H new ATOM 0 HB3 LEU A 60 16.506 -4.525 12.592 1.00 71.35 H new ATOM 0 HG LEU A 60 13.853 -5.463 13.720 1.00 45.21 H new ATOM 0 HD11 LEU A 60 15.205 -6.637 15.410 1.00 62.12 H new ATOM 0 HD12 LEU A 60 15.502 -7.268 13.773 1.00 62.12 H new ATOM 0 HD13 LEU A 60 16.687 -6.181 14.536 1.00 62.12 H new ATOM 0 HD21 LEU A 60 14.595 -4.271 15.745 1.00 4.54 H new ATOM 0 HD22 LEU A 60 16.053 -3.723 14.883 1.00 4.54 H new ATOM 0 HD23 LEU A 60 14.445 -3.174 14.351 1.00 4.54 H new ATOM 956 N ILE A 61 14.171 -1.692 12.724 1.00 33.12 N ATOM 957 CA ILE A 61 14.428 -0.347 13.223 1.00 45.24 C ATOM 958 C ILE A 61 13.629 -0.068 14.491 1.00 52.23 C ATOM 959 O ILE A 61 12.623 -0.725 14.761 1.00 12.44 O ATOM 960 CB ILE A 61 14.084 0.720 12.167 1.00 42.31 C ATOM 961 CG1 ILE A 61 12.570 0.791 11.956 1.00 64.30 C ATOM 962 CG2 ILE A 61 14.794 0.416 10.856 1.00 54.42 C ATOM 963 CD1 ILE A 61 12.151 1.819 10.930 1.00 55.45 C ATOM 0 H ILE A 61 13.216 -2.020 12.867 1.00 33.12 H new ATOM 0 HA ILE A 61 15.493 -0.293 13.449 1.00 45.24 H new ATOM 0 HB ILE A 61 14.427 1.690 12.527 1.00 42.31 H new ATOM 0 HG12 ILE A 61 12.208 -0.189 11.645 1.00 64.30 H new ATOM 0 HG13 ILE A 61 12.089 1.021 12.907 1.00 64.30 H new ATOM 0 HG21 ILE A 61 14.541 1.179 10.120 1.00 54.42 H new ATOM 0 HG22 ILE A 61 15.872 0.412 11.018 1.00 54.42 H new ATOM 0 HG23 ILE A 61 14.479 -0.561 10.489 1.00 54.42 H new ATOM 0 HD11 ILE A 61 11.065 1.814 10.832 1.00 55.45 H new ATOM 0 HD12 ILE A 61 12.482 2.807 11.249 1.00 55.45 H new ATOM 0 HD13 ILE A 61 12.603 1.578 9.968 1.00 55.45 H new ATOM 975 N THR A 62 14.082 0.913 15.266 1.00 74.12 N ATOM 976 CA THR A 62 13.409 1.280 16.505 1.00 13.22 C ATOM 977 C THR A 62 12.730 2.639 16.380 1.00 11.44 C ATOM 978 O THR A 62 12.918 3.350 15.393 1.00 4.42 O ATOM 979 CB THR A 62 14.393 1.318 17.689 1.00 23.42 C ATOM 980 OG1 THR A 62 15.316 2.401 17.525 1.00 34.44 O ATOM 981 CG2 THR A 62 15.157 0.007 17.799 1.00 21.45 C ATOM 0 H THR A 62 14.912 1.467 15.057 1.00 74.12 H new ATOM 0 HA THR A 62 12.655 0.516 16.693 1.00 13.22 H new ATOM 0 HB THR A 62 13.820 1.465 18.605 1.00 23.42 H new ATOM 0 HG1 THR A 62 15.913 2.211 16.771 1.00 34.44 H new ATOM 0 HG21 THR A 62 15.846 0.057 18.642 1.00 21.45 H new ATOM 0 HG22 THR A 62 14.454 -0.812 17.953 1.00 21.45 H new ATOM 0 HG23 THR A 62 15.719 -0.165 16.881 1.00 21.45 H new ATOM 989 N VAL A 63 11.939 2.996 17.388 1.00 65.20 N ATOM 990 CA VAL A 63 11.234 4.272 17.392 1.00 73.44 C ATOM 991 C VAL A 63 11.071 4.805 18.810 1.00 13.43 C ATOM 992 O VAL A 63 10.758 4.055 19.734 1.00 13.54 O ATOM 993 CB VAL A 63 9.844 4.146 16.739 1.00 1.13 C ATOM 994 CG1 VAL A 63 9.164 5.505 16.664 1.00 25.24 C ATOM 995 CG2 VAL A 63 9.959 3.521 15.357 1.00 3.50 C ATOM 0 H VAL A 63 11.771 2.419 18.212 1.00 65.20 H new ATOM 0 HA VAL A 63 11.838 4.970 16.812 1.00 73.44 H new ATOM 0 HB VAL A 63 9.229 3.492 17.358 1.00 1.13 H new ATOM 0 HG11 VAL A 63 8.184 5.396 16.200 1.00 25.24 H new ATOM 0 HG12 VAL A 63 9.047 5.909 17.669 1.00 25.24 H new ATOM 0 HG13 VAL A 63 9.774 6.185 16.069 1.00 25.24 H new ATOM 0 HG21 VAL A 63 8.968 3.440 14.911 1.00 3.50 H new ATOM 0 HG22 VAL A 63 10.591 4.146 14.726 1.00 3.50 H new ATOM 0 HG23 VAL A 63 10.401 2.528 15.442 1.00 3.50 H new ATOM 1005 N ALA A 64 11.285 6.107 18.975 1.00 32.42 N ATOM 1006 CA ALA A 64 11.159 6.742 20.281 1.00 0.00 C ATOM 1007 C ALA A 64 10.005 7.739 20.298 1.00 62.14 C ATOM 1008 O ALA A 64 9.426 8.050 19.257 1.00 44.42 O ATOM 1009 CB ALA A 64 12.461 7.432 20.660 1.00 50.33 C ATOM 0 H ALA A 64 11.546 6.742 18.221 1.00 32.42 H new ATOM 0 HA ALA A 64 10.945 5.966 21.016 1.00 0.00 H new ATOM 0 HB1 ALA A 64 12.353 7.902 21.637 1.00 50.33 H new ATOM 0 HB2 ALA A 64 13.265 6.697 20.698 1.00 50.33 H new ATOM 0 HB3 ALA A 64 12.700 8.192 19.916 1.00 50.33 H new ATOM 1015 N SER A 65 9.675 8.236 21.486 1.00 64.44 N ATOM 1016 CA SER A 65 8.587 9.194 21.638 1.00 42.31 C ATOM 1017 C SER A 65 8.996 10.338 22.561 1.00 42.22 C ATOM 1018 O SER A 65 8.678 10.354 23.750 1.00 3.31 O ATOM 1019 CB SER A 65 7.341 8.500 22.190 1.00 73.44 C ATOM 1020 OG SER A 65 7.537 7.099 22.284 1.00 51.35 O ATOM 0 H SER A 65 10.146 7.991 22.357 1.00 64.44 H new ATOM 0 HA SER A 65 8.359 9.606 20.655 1.00 42.31 H new ATOM 0 HB2 SER A 65 7.102 8.904 23.174 1.00 73.44 H new ATOM 0 HB3 SER A 65 6.488 8.709 21.544 1.00 73.44 H new ATOM 0 HG SER A 65 6.727 6.679 22.641 1.00 51.35 H new ATOM 1026 N PRO A 66 9.719 11.320 22.001 1.00 70.42 N ATOM 1027 CA PRO A 66 10.187 12.487 22.754 1.00 23.53 C ATOM 1028 C PRO A 66 9.046 13.418 23.148 1.00 3.31 C ATOM 1029 O PRO A 66 8.277 13.866 22.299 1.00 15.24 O ATOM 1030 CB PRO A 66 11.134 13.185 21.775 1.00 71.33 C ATOM 1031 CG PRO A 66 10.660 12.765 20.426 1.00 24.00 C ATOM 1032 CD PRO A 66 10.134 11.366 20.589 1.00 63.32 C ATOM 0 HA PRO A 66 10.659 12.203 23.695 1.00 23.53 H new ATOM 0 HB2 PRO A 66 11.094 14.268 21.889 1.00 71.33 H new ATOM 0 HB3 PRO A 66 12.168 12.885 21.942 1.00 71.33 H new ATOM 0 HG2 PRO A 66 9.882 13.434 20.060 1.00 24.00 H new ATOM 0 HG3 PRO A 66 11.473 12.794 19.700 1.00 24.00 H new ATOM 0 HD2 PRO A 66 9.298 11.170 19.918 1.00 63.32 H new ATOM 0 HD3 PRO A 66 10.899 10.621 20.371 1.00 63.32 H new ATOM 1040 N GLY A 67 8.944 13.707 24.442 1.00 35.11 N ATOM 1041 CA GLY A 67 7.894 14.585 24.925 1.00 34.53 C ATOM 1042 C GLY A 67 6.583 13.855 25.143 1.00 53.31 C ATOM 1043 O GLY A 67 5.531 14.481 25.276 1.00 33.25 O ATOM 0 H GLY A 67 9.569 13.349 25.164 1.00 35.11 H new ATOM 0 HA2 GLY A 67 8.211 15.044 25.861 1.00 34.53 H new ATOM 0 HA3 GLY A 67 7.742 15.393 24.209 1.00 34.53 H new ATOM 1047 N PHE A 68 6.644 12.528 25.177 1.00 3.21 N ATOM 1048 CA PHE A 68 5.452 11.713 25.377 1.00 22.51 C ATOM 1049 C PHE A 68 5.655 10.724 26.521 1.00 24.33 C ATOM 1050 O PHE A 68 6.759 10.220 26.733 1.00 4.13 O ATOM 1051 CB PHE A 68 5.103 10.958 24.092 1.00 11.43 C ATOM 1052 CG PHE A 68 3.779 10.251 24.153 1.00 1.52 C ATOM 1053 CD1 PHE A 68 2.675 10.867 24.721 1.00 43.44 C ATOM 1054 CD2 PHE A 68 3.639 8.971 23.643 1.00 33.35 C ATOM 1055 CE1 PHE A 68 1.455 10.220 24.778 1.00 65.10 C ATOM 1056 CE2 PHE A 68 2.421 8.318 23.698 1.00 44.54 C ATOM 1057 CZ PHE A 68 1.329 8.943 24.267 1.00 52.24 C ATOM 0 H PHE A 68 7.506 11.994 25.069 1.00 3.21 H new ATOM 0 HA PHE A 68 4.628 12.377 25.636 1.00 22.51 H new ATOM 0 HB2 PHE A 68 5.093 11.661 23.259 1.00 11.43 H new ATOM 0 HB3 PHE A 68 5.886 10.229 23.884 1.00 11.43 H new ATOM 0 HD1 PHE A 68 2.769 11.865 25.124 1.00 43.44 H new ATOM 0 HD2 PHE A 68 4.490 8.477 23.198 1.00 33.35 H new ATOM 0 HE1 PHE A 68 0.602 10.712 25.221 1.00 65.10 H new ATOM 0 HE2 PHE A 68 2.324 7.320 23.296 1.00 44.54 H new ATOM 0 HZ PHE A 68 0.378 8.434 24.312 1.00 52.24 H new ATOM 1067 N LEU A 69 4.583 10.451 27.257 1.00 63.35 N ATOM 1068 CA LEU A 69 4.642 9.522 28.380 1.00 4.54 C ATOM 1069 C LEU A 69 5.573 10.046 29.470 1.00 33.52 C ATOM 1070 O LEU A 69 5.130 10.689 30.423 1.00 65.04 O ATOM 1071 CB LEU A 69 5.115 8.147 27.907 1.00 25.00 C ATOM 1072 CG LEU A 69 4.017 7.127 27.605 1.00 62.14 C ATOM 1073 CD1 LEU A 69 3.478 6.525 28.893 1.00 11.41 C ATOM 1074 CD2 LEU A 69 2.895 7.773 26.805 1.00 62.43 C ATOM 0 H LEU A 69 3.662 10.860 27.096 1.00 63.35 H new ATOM 0 HA LEU A 69 3.639 9.430 28.797 1.00 4.54 H new ATOM 0 HB2 LEU A 69 5.716 8.281 27.007 1.00 25.00 H new ATOM 0 HB3 LEU A 69 5.772 7.729 28.670 1.00 25.00 H new ATOM 0 HG LEU A 69 4.448 6.324 27.006 1.00 62.14 H new ATOM 0 HD11 LEU A 69 2.697 5.801 28.658 1.00 11.41 H new ATOM 0 HD12 LEU A 69 4.286 6.026 29.428 1.00 11.41 H new ATOM 0 HD13 LEU A 69 3.063 7.316 29.518 1.00 11.41 H new ATOM 0 HD21 LEU A 69 2.122 7.033 26.599 1.00 62.43 H new ATOM 0 HD22 LEU A 69 2.466 8.595 27.378 1.00 62.43 H new ATOM 0 HD23 LEU A 69 3.292 8.155 25.864 1.00 62.43 H new ATOM 1086 N HIS A 70 6.864 9.767 29.323 1.00 60.22 N ATOM 1087 CA HIS A 70 7.858 10.212 30.293 1.00 32.35 C ATOM 1088 C HIS A 70 9.239 10.307 29.652 1.00 12.50 C ATOM 1089 O HIS A 70 10.257 10.279 30.343 1.00 52.24 O ATOM 1090 CB HIS A 70 7.901 9.255 31.485 1.00 25.13 C ATOM 1091 CG HIS A 70 7.564 9.908 32.790 1.00 23.03 C ATOM 1092 ND1 HIS A 70 6.345 10.500 33.043 1.00 73.23 N ATOM 1093 CD2 HIS A 70 8.295 10.059 33.920 1.00 70.24 C ATOM 1094 CE1 HIS A 70 6.340 10.988 34.270 1.00 24.13 C ATOM 1095 NE2 HIS A 70 7.512 10.733 34.824 1.00 1.11 N ATOM 0 H HIS A 70 7.246 9.235 28.541 1.00 60.22 H new ATOM 0 HA HIS A 70 7.570 11.204 30.642 1.00 32.35 H new ATOM 0 HB2 HIS A 70 7.205 8.435 31.308 1.00 25.13 H new ATOM 0 HB3 HIS A 70 8.897 8.818 31.554 1.00 25.13 H new ATOM 0 HD1 HIS A 70 5.568 10.553 32.385 1.00 73.23 H new ATOM 0 HD2 HIS A 70 9.306 9.714 34.080 1.00 70.24 H new ATOM 0 HE1 HIS A 70 5.518 11.507 34.740 1.00 24.13 H new ATOM 1103 N GLU A 71 9.264 10.420 28.328 1.00 65.04 N ATOM 1104 CA GLU A 71 10.521 10.518 27.594 1.00 10.02 C ATOM 1105 C GLU A 71 11.023 11.959 27.565 1.00 21.34 C ATOM 1106 O GLU A 71 10.257 12.900 27.772 1.00 31.14 O ATOM 1107 CB GLU A 71 10.345 9.999 26.166 1.00 62.14 C ATOM 1108 CG GLU A 71 10.847 8.578 25.968 1.00 2.51 C ATOM 1109 CD GLU A 71 12.342 8.517 25.719 1.00 13.22 C ATOM 1110 OE1 GLU A 71 13.094 9.180 26.464 1.00 22.31 O ATOM 1111 OE2 GLU A 71 12.759 7.808 24.780 1.00 31.32 O ATOM 0 H GLU A 71 8.430 10.446 27.742 1.00 65.04 H new ATOM 0 HA GLU A 71 11.261 9.904 28.107 1.00 10.02 H new ATOM 0 HB2 GLU A 71 9.289 10.042 25.900 1.00 62.14 H new ATOM 0 HB3 GLU A 71 10.874 10.661 25.480 1.00 62.14 H new ATOM 0 HG2 GLU A 71 10.605 7.985 26.850 1.00 2.51 H new ATOM 0 HG3 GLU A 71 10.323 8.126 25.126 1.00 2.51 H new ATOM 1118 N LYS A 72 12.316 12.123 27.308 1.00 42.23 N ATOM 1119 CA LYS A 72 12.923 13.448 27.251 1.00 60.24 C ATOM 1120 C LYS A 72 12.224 14.322 26.215 1.00 51.42 C ATOM 1121 O LYS A 72 11.481 13.826 25.368 1.00 51.14 O ATOM 1122 CB LYS A 72 14.412 13.335 26.917 1.00 43.11 C ATOM 1123 CG LYS A 72 15.178 12.417 27.854 1.00 72.11 C ATOM 1124 CD LYS A 72 16.489 11.959 27.238 1.00 41.13 C ATOM 1125 CE LYS A 72 17.629 12.904 27.587 1.00 72.12 C ATOM 1126 NZ LYS A 72 17.743 14.021 26.608 1.00 31.33 N ATOM 0 H LYS A 72 12.964 11.355 27.136 1.00 42.23 H new ATOM 0 HA LYS A 72 12.811 13.914 28.230 1.00 60.24 H new ATOM 0 HB2 LYS A 72 14.520 12.970 25.896 1.00 43.11 H new ATOM 0 HB3 LYS A 72 14.859 14.328 26.949 1.00 43.11 H new ATOM 0 HG2 LYS A 72 15.377 12.937 28.791 1.00 72.11 H new ATOM 0 HG3 LYS A 72 14.565 11.548 28.095 1.00 72.11 H new ATOM 0 HD2 LYS A 72 16.726 10.955 27.590 1.00 41.13 H new ATOM 0 HD3 LYS A 72 16.382 11.900 26.155 1.00 41.13 H new ATOM 0 HE2 LYS A 72 17.470 13.311 28.586 1.00 72.12 H new ATOM 0 HE3 LYS A 72 18.566 12.348 27.614 1.00 72.12 H new ATOM 0 HZ1 LYS A 72 18.074 14.878 27.096 1.00 31.33 H new ATOM 0 HZ2 LYS A 72 18.421 13.762 25.863 1.00 31.33 H new ATOM 0 HZ3 LYS A 72 16.813 14.204 26.180 1.00 31.33 H new ATOM 1140 N LYS A 73 12.467 15.627 26.287 1.00 64.40 N ATOM 1141 CA LYS A 73 11.864 16.571 25.354 1.00 32.13 C ATOM 1142 C LYS A 73 12.616 16.581 24.027 1.00 35.41 C ATOM 1143 O LYS A 73 13.804 16.264 23.974 1.00 40.03 O ATOM 1144 CB LYS A 73 11.853 17.978 25.957 1.00 73.34 C ATOM 1145 CG LYS A 73 13.236 18.503 26.302 1.00 73.44 C ATOM 1146 CD LYS A 73 13.244 19.213 27.645 1.00 75.31 C ATOM 1147 CE LYS A 73 13.238 18.222 28.799 1.00 22.00 C ATOM 1148 NZ LYS A 73 13.037 18.899 30.110 1.00 23.11 N ATOM 0 H LYS A 73 13.078 16.055 26.983 1.00 64.40 H new ATOM 0 HA LYS A 73 10.838 16.254 25.167 1.00 32.13 H new ATOM 0 HB2 LYS A 73 11.379 18.662 25.253 1.00 73.34 H new ATOM 0 HB3 LYS A 73 11.240 17.973 26.858 1.00 73.34 H new ATOM 0 HG2 LYS A 73 13.945 17.676 26.323 1.00 73.44 H new ATOM 0 HG3 LYS A 73 13.570 19.190 25.524 1.00 73.44 H new ATOM 0 HD2 LYS A 73 14.126 19.850 27.716 1.00 75.31 H new ATOM 0 HD3 LYS A 73 12.373 19.864 27.719 1.00 75.31 H new ATOM 0 HE2 LYS A 73 12.447 17.489 28.644 1.00 22.00 H new ATOM 0 HE3 LYS A 73 14.181 17.675 28.813 1.00 22.00 H new ATOM 0 HZ1 LYS A 73 13.039 18.190 30.871 1.00 23.11 H new ATOM 0 HZ2 LYS A 73 13.806 19.581 30.270 1.00 23.11 H new ATOM 0 HZ3 LYS A 73 12.126 19.400 30.106 1.00 23.11 H new ATOM 1162 N ASP A 74 11.916 16.947 22.959 1.00 72.21 N ATOM 1163 CA ASP A 74 12.518 17.000 21.632 1.00 41.31 C ATOM 1164 C ASP A 74 13.832 17.774 21.662 1.00 4.24 C ATOM 1165 O ASP A 74 13.973 18.749 22.399 1.00 4.31 O ATOM 1166 CB ASP A 74 11.554 17.647 20.637 1.00 51.55 C ATOM 1167 CG ASP A 74 10.764 18.786 21.252 1.00 21.21 C ATOM 1168 OD1 ASP A 74 11.389 19.684 21.854 1.00 12.25 O ATOM 1169 OD2 ASP A 74 9.521 18.779 21.131 1.00 65.13 O ATOM 0 H ASP A 74 10.931 17.211 22.986 1.00 72.21 H new ATOM 0 HA ASP A 74 12.726 15.979 21.313 1.00 41.31 H new ATOM 0 HB2 ASP A 74 12.116 18.020 19.781 1.00 51.55 H new ATOM 0 HB3 ASP A 74 10.864 16.892 20.261 1.00 51.55 H new ATOM 1174 N GLY A 75 14.793 17.331 20.857 1.00 42.31 N ATOM 1175 CA GLY A 75 16.084 17.993 20.808 1.00 31.00 C ATOM 1176 C GLY A 75 17.074 17.407 21.795 1.00 72.41 C ATOM 1177 O GLY A 75 18.201 17.073 21.430 1.00 61.14 O ATOM 0 H GLY A 75 14.701 16.526 20.238 1.00 42.31 H new ATOM 0 HA2 GLY A 75 16.491 17.914 19.800 1.00 31.00 H new ATOM 0 HA3 GLY A 75 15.953 19.055 21.017 1.00 31.00 H new ATOM 1181 N ASP A 76 16.653 17.282 23.049 1.00 43.02 N ATOM 1182 CA ASP A 76 17.511 16.732 24.092 1.00 44.50 C ATOM 1183 C ASP A 76 17.753 15.243 23.868 1.00 21.01 C ATOM 1184 O ASP A 76 18.897 14.790 23.815 1.00 12.12 O ATOM 1185 CB ASP A 76 16.885 16.959 25.469 1.00 63.11 C ATOM 1186 CG ASP A 76 17.888 17.472 26.484 1.00 60.04 C ATOM 1187 OD1 ASP A 76 18.808 16.710 26.846 1.00 63.45 O ATOM 1188 OD2 ASP A 76 17.752 18.636 26.917 1.00 61.34 O ATOM 0 H ASP A 76 15.723 17.554 23.368 1.00 43.02 H new ATOM 0 HA ASP A 76 18.470 17.247 24.048 1.00 44.50 H new ATOM 0 HB2 ASP A 76 16.066 17.673 25.379 1.00 63.11 H new ATOM 0 HB3 ASP A 76 16.455 16.024 25.828 1.00 63.11 H new ATOM 1193 N PHE A 77 16.669 14.486 23.738 1.00 31.32 N ATOM 1194 CA PHE A 77 16.763 13.047 23.522 1.00 32.43 C ATOM 1195 C PHE A 77 17.760 12.727 22.412 1.00 13.21 C ATOM 1196 O PHE A 77 18.516 11.761 22.503 1.00 23.13 O ATOM 1197 CB PHE A 77 15.389 12.471 23.171 1.00 42.52 C ATOM 1198 CG PHE A 77 15.386 10.977 23.017 1.00 4.41 C ATOM 1199 CD1 PHE A 77 15.357 10.153 24.130 1.00 10.25 C ATOM 1200 CD2 PHE A 77 15.414 10.397 21.759 1.00 14.02 C ATOM 1201 CE1 PHE A 77 15.354 8.778 23.993 1.00 71.13 C ATOM 1202 CE2 PHE A 77 15.410 9.023 21.615 1.00 23.52 C ATOM 1203 CZ PHE A 77 15.382 8.212 22.733 1.00 34.12 C ATOM 0 H PHE A 77 15.715 14.845 23.778 1.00 31.32 H new ATOM 0 HA PHE A 77 17.116 12.589 24.446 1.00 32.43 H new ATOM 0 HB2 PHE A 77 14.678 12.749 23.949 1.00 42.52 H new ATOM 0 HB3 PHE A 77 15.040 12.924 22.243 1.00 42.52 H new ATOM 0 HD1 PHE A 77 15.336 10.591 25.117 1.00 10.25 H new ATOM 0 HD2 PHE A 77 15.439 11.026 20.881 1.00 14.02 H new ATOM 0 HE1 PHE A 77 15.330 8.147 24.869 1.00 71.13 H new ATOM 0 HE2 PHE A 77 15.429 8.583 20.629 1.00 23.52 H new ATOM 0 HZ PHE A 77 15.382 7.138 22.622 1.00 34.12 H new ATOM 1213 N GLN A 78 17.753 13.546 21.365 1.00 33.12 N ATOM 1214 CA GLN A 78 18.655 13.350 20.237 1.00 61.13 C ATOM 1215 C GLN A 78 20.109 13.508 20.669 1.00 62.32 C ATOM 1216 O GLN A 78 20.967 12.703 20.305 1.00 62.00 O ATOM 1217 CB GLN A 78 18.332 14.344 19.120 1.00 70.44 C ATOM 1218 CG GLN A 78 17.509 13.744 17.991 1.00 60.40 C ATOM 1219 CD GLN A 78 16.222 14.504 17.740 1.00 75.43 C ATOM 1220 OE1 GLN A 78 15.659 15.113 18.650 1.00 30.20 O ATOM 1221 NE2 GLN A 78 15.747 14.472 16.500 1.00 64.12 N ATOM 0 H GLN A 78 17.133 14.351 21.275 1.00 33.12 H new ATOM 0 HA GLN A 78 18.514 12.336 19.863 1.00 61.13 H new ATOM 0 HB2 GLN A 78 17.791 15.190 19.543 1.00 70.44 H new ATOM 0 HB3 GLN A 78 19.264 14.734 18.711 1.00 70.44 H new ATOM 0 HG2 GLN A 78 18.104 13.734 17.078 1.00 60.40 H new ATOM 0 HG3 GLN A 78 17.273 12.707 18.230 1.00 60.40 H new ATOM 0 HE21 GLN A 78 16.246 13.955 15.776 1.00 64.12 H new ATOM 0 HE22 GLN A 78 14.883 14.965 16.272 1.00 64.12 H new ATOM 1230 N LYS A 79 20.380 14.550 21.447 1.00 43.01 N ATOM 1231 CA LYS A 79 21.730 14.814 21.930 1.00 3.12 C ATOM 1232 C LYS A 79 22.180 13.732 22.907 1.00 61.03 C ATOM 1233 O LYS A 79 23.321 13.272 22.855 1.00 33.12 O ATOM 1234 CB LYS A 79 21.793 16.185 22.608 1.00 74.05 C ATOM 1235 CG LYS A 79 21.044 17.270 21.854 1.00 52.42 C ATOM 1236 CD LYS A 79 21.998 18.275 21.230 1.00 55.24 C ATOM 1237 CE LYS A 79 22.774 19.041 22.290 1.00 34.55 C ATOM 1238 NZ LYS A 79 24.243 18.833 22.161 1.00 75.20 N ATOM 0 H LYS A 79 19.682 15.226 21.757 1.00 43.01 H new ATOM 0 HA LYS A 79 22.403 14.808 21.072 1.00 3.12 H new ATOM 0 HB2 LYS A 79 21.382 16.103 23.614 1.00 74.05 H new ATOM 0 HB3 LYS A 79 22.837 16.481 22.714 1.00 74.05 H new ATOM 0 HG2 LYS A 79 20.431 16.816 21.075 1.00 52.42 H new ATOM 0 HG3 LYS A 79 20.365 17.785 22.534 1.00 52.42 H new ATOM 0 HD2 LYS A 79 22.695 17.756 20.572 1.00 55.24 H new ATOM 0 HD3 LYS A 79 21.437 18.975 20.612 1.00 55.24 H new ATOM 0 HE2 LYS A 79 22.549 20.104 22.207 1.00 34.55 H new ATOM 0 HE3 LYS A 79 22.448 18.722 23.280 1.00 34.55 H new ATOM 0 HZ1 LYS A 79 24.731 19.302 22.951 1.00 75.20 H new ATOM 0 HZ2 LYS A 79 24.452 17.814 22.180 1.00 75.20 H new ATOM 0 HZ3 LYS A 79 24.573 19.237 21.261 1.00 75.20 H new ATOM 1252 N TRP A 80 21.277 13.330 23.793 1.00 21.34 N ATOM 1253 CA TRP A 80 21.581 12.300 24.781 1.00 45.04 C ATOM 1254 C TRP A 80 21.793 10.948 24.109 1.00 31.40 C ATOM 1255 O TRP A 80 22.708 10.204 24.464 1.00 42.34 O ATOM 1256 CB TRP A 80 20.454 12.202 25.809 1.00 30.34 C ATOM 1257 CG TRP A 80 20.409 10.881 26.516 1.00 35.05 C ATOM 1258 CD1 TRP A 80 21.018 10.562 27.696 1.00 33.43 C ATOM 1259 CD2 TRP A 80 19.718 9.702 26.087 1.00 45.31 C ATOM 1260 NE1 TRP A 80 20.748 9.255 28.026 1.00 11.21 N ATOM 1261 CE2 TRP A 80 19.952 8.706 27.055 1.00 2.55 C ATOM 1262 CE3 TRP A 80 18.924 9.392 24.980 1.00 64.31 C ATOM 1263 CZ2 TRP A 80 19.421 7.424 26.947 1.00 11.13 C ATOM 1264 CZ3 TRP A 80 18.398 8.118 24.874 1.00 41.42 C ATOM 1265 CH2 TRP A 80 18.647 7.148 25.853 1.00 22.40 C ATOM 0 H TRP A 80 20.328 13.701 23.848 1.00 21.34 H new ATOM 0 HA TRP A 80 22.503 12.580 25.290 1.00 45.04 H new ATOM 0 HB2 TRP A 80 20.574 12.996 26.546 1.00 30.34 H new ATOM 0 HB3 TRP A 80 19.500 12.371 25.309 1.00 30.34 H new ATOM 0 HD1 TRP A 80 21.623 11.237 28.283 1.00 33.43 H new ATOM 0 HE1 TRP A 80 21.085 8.772 28.859 1.00 11.21 H new ATOM 0 HE3 TRP A 80 18.725 10.134 24.221 1.00 64.31 H new ATOM 0 HZ2 TRP A 80 19.613 6.674 27.700 1.00 11.13 H new ATOM 0 HZ3 TRP A 80 17.784 7.866 24.022 1.00 41.42 H new ATOM 0 HH2 TRP A 80 18.220 6.162 25.742 1.00 22.40 H new ATOM 1276 N TYR A 81 20.942 10.635 23.138 1.00 30.43 N ATOM 1277 CA TYR A 81 21.035 9.370 22.419 1.00 61.13 C ATOM 1278 C TYR A 81 22.235 9.366 21.477 1.00 41.34 C ATOM 1279 O TYR A 81 22.900 8.345 21.304 1.00 10.23 O ATOM 1280 CB TYR A 81 19.751 9.113 21.628 1.00 1.20 C ATOM 1281 CG TYR A 81 19.933 8.155 20.473 1.00 73.41 C ATOM 1282 CD1 TYR A 81 20.172 6.804 20.696 1.00 2.24 C ATOM 1283 CD2 TYR A 81 19.866 8.599 19.158 1.00 10.13 C ATOM 1284 CE1 TYR A 81 20.339 5.925 19.644 1.00 25.32 C ATOM 1285 CE2 TYR A 81 20.031 7.727 18.100 1.00 35.30 C ATOM 1286 CZ TYR A 81 20.267 6.391 18.348 1.00 63.40 C ATOM 1287 OH TYR A 81 20.433 5.519 17.297 1.00 62.45 O ATOM 0 H TYR A 81 20.180 11.240 22.831 1.00 30.43 H new ATOM 0 HA TYR A 81 21.168 8.574 23.152 1.00 61.13 H new ATOM 0 HB2 TYR A 81 18.992 8.716 22.302 1.00 1.20 H new ATOM 0 HB3 TYR A 81 19.373 10.062 21.246 1.00 1.20 H new ATOM 0 HD1 TYR A 81 20.228 6.435 21.710 1.00 2.24 H new ATOM 0 HD2 TYR A 81 19.682 9.645 18.960 1.00 10.13 H new ATOM 0 HE1 TYR A 81 20.525 4.878 19.835 1.00 25.32 H new ATOM 0 HE2 TYR A 81 19.976 8.089 17.084 1.00 35.30 H new ATOM 0 HH TYR A 81 19.709 5.647 16.649 1.00 62.45 H new ATOM 1297 N ALA A 82 22.506 10.517 20.870 1.00 51.14 N ATOM 1298 CA ALA A 82 23.627 10.649 19.947 1.00 33.10 C ATOM 1299 C ALA A 82 24.958 10.598 20.689 1.00 13.14 C ATOM 1300 O ALA A 82 26.021 10.530 20.074 1.00 73.11 O ATOM 1301 CB ALA A 82 23.510 11.944 19.157 1.00 62.24 C ATOM 0 H ALA A 82 21.965 11.371 21.001 1.00 51.14 H new ATOM 0 HA ALA A 82 23.596 9.809 19.253 1.00 33.10 H new ATOM 0 HB1 ALA A 82 24.353 12.030 18.472 1.00 62.24 H new ATOM 0 HB2 ALA A 82 22.580 11.941 18.589 1.00 62.24 H new ATOM 0 HB3 ALA A 82 23.513 12.791 19.844 1.00 62.24 H new ATOM 1307 N GLY A 83 24.892 10.632 22.017 1.00 54.50 N ATOM 1308 CA GLY A 83 26.099 10.590 22.821 1.00 12.42 C ATOM 1309 C GLY A 83 26.198 9.327 23.653 1.00 14.11 C ATOM 1310 O GLY A 83 26.839 9.316 24.705 1.00 74.21 O ATOM 0 H GLY A 83 24.024 10.688 22.550 1.00 54.50 H new ATOM 0 HA2 GLY A 83 26.969 10.661 22.168 1.00 12.42 H new ATOM 0 HA3 GLY A 83 26.123 11.458 23.480 1.00 12.42 H new ATOM 1314 N LEU A 84 25.561 8.260 23.183 1.00 15.24 N ATOM 1315 CA LEU A 84 25.578 6.985 23.892 1.00 12.32 C ATOM 1316 C LEU A 84 26.694 6.087 23.369 1.00 33.51 C ATOM 1317 O LEU A 84 27.804 6.087 23.899 1.00 70.11 O ATOM 1318 CB LEU A 84 24.228 6.280 23.746 1.00 24.30 C ATOM 1319 CG LEU A 84 23.082 6.844 24.585 1.00 15.22 C ATOM 1320 CD1 LEU A 84 21.750 6.273 24.123 1.00 62.15 C ATOM 1321 CD2 LEU A 84 23.306 6.550 26.061 1.00 11.53 C ATOM 0 H LEU A 84 25.026 8.252 22.314 1.00 15.24 H new ATOM 0 HA LEU A 84 25.763 7.186 24.947 1.00 12.32 H new ATOM 0 HB2 LEU A 84 23.935 6.314 22.697 1.00 24.30 H new ATOM 0 HB3 LEU A 84 24.359 5.230 24.006 1.00 24.30 H new ATOM 0 HG LEU A 84 23.057 7.925 24.450 1.00 15.22 H new ATOM 0 HD11 LEU A 84 20.946 6.686 24.732 1.00 62.15 H new ATOM 0 HD12 LEU A 84 21.585 6.535 23.078 1.00 62.15 H new ATOM 0 HD13 LEU A 84 21.763 5.188 24.227 1.00 62.15 H new ATOM 0 HD21 LEU A 84 22.480 6.959 26.643 1.00 11.53 H new ATOM 0 HD22 LEU A 84 23.358 5.472 26.213 1.00 11.53 H new ATOM 0 HD23 LEU A 84 24.240 7.008 26.386 1.00 11.53 H new ATOM 1333 N ASN A 85 26.391 5.323 22.325 1.00 73.35 N ATOM 1334 CA ASN A 85 27.369 4.420 21.728 1.00 11.22 C ATOM 1335 C ASN A 85 26.726 3.561 20.644 1.00 20.41 C ATOM 1336 O ASN A 85 27.107 2.407 20.444 1.00 4.12 O ATOM 1337 CB ASN A 85 27.990 3.525 22.803 1.00 53.41 C ATOM 1338 CG ASN A 85 29.502 3.632 22.841 1.00 60.41 C ATOM 1339 OD1 ASN A 85 30.150 3.791 21.806 1.00 24.45 O ATOM 1340 ND2 ASN A 85 30.071 3.544 24.037 1.00 23.44 N ATOM 0 H ASN A 85 25.476 5.311 21.874 1.00 73.35 H new ATOM 0 HA ASN A 85 28.152 5.024 21.270 1.00 11.22 H new ATOM 0 HB2 ASN A 85 27.585 3.797 23.777 1.00 53.41 H new ATOM 0 HB3 ASN A 85 27.706 2.489 22.618 1.00 53.41 H new ATOM 0 HD21 ASN A 85 31.085 3.608 24.125 1.00 23.44 H new ATOM 0 HD22 ASN A 85 29.494 3.412 24.868 1.00 23.44 H new ATOM 1347 N TYR A 86 25.750 4.130 19.947 1.00 55.42 N ATOM 1348 CA TYR A 86 25.052 3.416 18.884 1.00 41.30 C ATOM 1349 C TYR A 86 24.683 4.361 17.744 1.00 32.13 C ATOM 1350 O TYR A 86 23.510 4.618 17.472 1.00 11.21 O ATOM 1351 CB TYR A 86 23.792 2.745 19.433 1.00 23.04 C ATOM 1352 CG TYR A 86 23.972 2.159 20.815 1.00 22.34 C ATOM 1353 CD1 TYR A 86 24.497 0.884 20.988 1.00 61.10 C ATOM 1354 CD2 TYR A 86 23.618 2.880 21.949 1.00 41.31 C ATOM 1355 CE1 TYR A 86 24.662 0.344 22.249 1.00 44.22 C ATOM 1356 CE2 TYR A 86 23.781 2.349 23.214 1.00 44.03 C ATOM 1357 CZ TYR A 86 24.303 1.081 23.358 1.00 23.44 C ATOM 1358 OH TYR A 86 24.468 0.547 24.616 1.00 32.01 O ATOM 0 H TYR A 86 25.423 5.084 20.099 1.00 55.42 H new ATOM 0 HA TYR A 86 25.723 2.650 18.495 1.00 41.30 H new ATOM 0 HB2 TYR A 86 22.984 3.476 19.460 1.00 23.04 H new ATOM 0 HB3 TYR A 86 23.484 1.954 18.749 1.00 23.04 H new ATOM 0 HD1 TYR A 86 24.781 0.305 20.122 1.00 61.10 H new ATOM 0 HD2 TYR A 86 23.208 3.873 21.839 1.00 41.31 H new ATOM 0 HE1 TYR A 86 25.070 -0.649 22.366 1.00 44.22 H new ATOM 0 HE2 TYR A 86 23.501 2.924 24.085 1.00 44.03 H new ATOM 0 HH TYR A 86 24.168 1.194 25.288 1.00 32.01 H new ATOM 1368 N PRO A 87 25.708 4.890 17.060 1.00 10.44 N ATOM 1369 CA PRO A 87 25.518 5.814 15.938 1.00 71.11 C ATOM 1370 C PRO A 87 24.929 5.123 14.712 1.00 3.44 C ATOM 1371 O PRO A 87 24.442 5.779 13.791 1.00 11.24 O ATOM 1372 CB PRO A 87 26.936 6.310 15.643 1.00 74.02 C ATOM 1373 CG PRO A 87 27.828 5.224 16.138 1.00 54.32 C ATOM 1374 CD PRO A 87 27.132 4.628 17.330 1.00 74.21 C ATOM 0 HA PRO A 87 24.815 6.611 16.180 1.00 71.11 H new ATOM 0 HB2 PRO A 87 27.080 6.486 14.577 1.00 74.02 H new ATOM 0 HB3 PRO A 87 27.140 7.252 16.152 1.00 74.02 H new ATOM 0 HG2 PRO A 87 27.993 4.472 15.366 1.00 54.32 H new ATOM 0 HG3 PRO A 87 28.806 5.618 16.414 1.00 54.32 H new ATOM 0 HD2 PRO A 87 27.334 3.561 17.421 1.00 74.21 H new ATOM 0 HD3 PRO A 87 27.457 5.094 18.260 1.00 74.21 H new ATOM 1382 N LYS A 88 24.977 3.796 14.707 1.00 21.42 N ATOM 1383 CA LYS A 88 24.447 3.015 13.596 1.00 61.33 C ATOM 1384 C LYS A 88 23.136 2.338 13.983 1.00 60.05 C ATOM 1385 O LYS A 88 22.724 1.358 13.360 1.00 52.42 O ATOM 1386 CB LYS A 88 25.466 1.962 13.154 1.00 71.23 C ATOM 1387 CG LYS A 88 26.056 2.226 11.779 1.00 32.52 C ATOM 1388 CD LYS A 88 27.121 1.202 11.424 1.00 71.33 C ATOM 1389 CE LYS A 88 28.132 1.768 10.438 1.00 14.22 C ATOM 1390 NZ LYS A 88 29.109 0.737 9.992 1.00 3.23 N ATOM 0 H LYS A 88 25.378 3.238 15.461 1.00 21.42 H new ATOM 0 HA LYS A 88 24.253 3.695 12.767 1.00 61.33 H new ATOM 0 HB2 LYS A 88 26.274 1.921 13.885 1.00 71.23 H new ATOM 0 HB3 LYS A 88 24.987 0.983 13.153 1.00 71.23 H new ATOM 0 HG2 LYS A 88 25.263 2.202 11.031 1.00 32.52 H new ATOM 0 HG3 LYS A 88 26.489 3.226 11.753 1.00 32.52 H new ATOM 0 HD2 LYS A 88 27.635 0.881 12.330 1.00 71.33 H new ATOM 0 HD3 LYS A 88 26.649 0.318 10.995 1.00 71.33 H new ATOM 0 HE2 LYS A 88 27.608 2.170 9.571 1.00 14.22 H new ATOM 0 HE3 LYS A 88 28.666 2.598 10.901 1.00 14.22 H new ATOM 0 HZ1 LYS A 88 29.781 1.162 9.321 1.00 3.23 H new ATOM 0 HZ2 LYS A 88 29.628 0.371 10.816 1.00 3.23 H new ATOM 0 HZ3 LYS A 88 28.602 -0.043 9.527 1.00 3.23 H new ATOM 1404 N LEU A 89 22.484 2.867 15.012 1.00 22.53 N ATOM 1405 CA LEU A 89 21.218 2.314 15.481 1.00 10.23 C ATOM 1406 C LEU A 89 20.038 3.091 14.905 1.00 64.31 C ATOM 1407 O LEU A 89 19.886 4.292 15.127 1.00 1.04 O ATOM 1408 CB LEU A 89 21.163 2.340 17.010 1.00 55.23 C ATOM 1409 CG LEU A 89 19.912 1.732 17.646 1.00 3.44 C ATOM 1410 CD1 LEU A 89 19.804 0.254 17.305 1.00 1.41 C ATOM 1411 CD2 LEU A 89 19.930 1.933 19.155 1.00 45.43 C ATOM 0 H LEU A 89 22.811 3.678 15.538 1.00 22.53 H new ATOM 0 HA LEU A 89 21.151 1.281 15.139 1.00 10.23 H new ATOM 0 HB2 LEU A 89 22.035 1.811 17.394 1.00 55.23 H new ATOM 0 HB3 LEU A 89 21.247 3.376 17.339 1.00 55.23 H new ATOM 0 HG LEU A 89 19.038 2.242 17.241 1.00 3.44 H new ATOM 0 HD11 LEU A 89 18.908 -0.161 17.766 1.00 1.41 H new ATOM 0 HD12 LEU A 89 19.744 0.134 16.223 1.00 1.41 H new ATOM 0 HD13 LEU A 89 20.682 -0.271 17.681 1.00 1.41 H new ATOM 0 HD21 LEU A 89 19.033 1.494 19.591 1.00 45.43 H new ATOM 0 HD22 LEU A 89 20.812 1.450 19.576 1.00 45.43 H new ATOM 0 HD23 LEU A 89 19.959 2.999 19.380 1.00 45.43 H new ATOM 1423 N PRO A 90 19.181 2.390 14.148 1.00 64.22 N ATOM 1424 CA PRO A 90 17.999 2.993 13.526 1.00 35.42 C ATOM 1425 C PRO A 90 16.935 3.372 14.551 1.00 42.50 C ATOM 1426 O PRO A 90 16.299 2.506 15.151 1.00 60.12 O ATOM 1427 CB PRO A 90 17.481 1.887 12.603 1.00 74.11 C ATOM 1428 CG PRO A 90 17.976 0.621 13.213 1.00 14.21 C ATOM 1429 CD PRO A 90 19.301 0.955 13.841 1.00 72.54 C ATOM 0 HA PRO A 90 18.240 3.922 13.008 1.00 35.42 H new ATOM 0 HB2 PRO A 90 16.393 1.899 12.543 1.00 74.11 H new ATOM 0 HB3 PRO A 90 17.857 2.011 11.587 1.00 74.11 H new ATOM 0 HG2 PRO A 90 17.274 0.246 13.958 1.00 14.21 H new ATOM 0 HG3 PRO A 90 18.087 -0.158 12.459 1.00 14.21 H new ATOM 0 HD2 PRO A 90 19.480 0.365 14.740 1.00 72.54 H new ATOM 0 HD3 PRO A 90 20.129 0.758 13.161 1.00 72.54 H new ATOM 1437 N VAL A 91 16.747 4.674 14.747 1.00 72.31 N ATOM 1438 CA VAL A 91 15.759 5.168 15.698 1.00 11.43 C ATOM 1439 C VAL A 91 14.924 6.290 15.090 1.00 32.44 C ATOM 1440 O VAL A 91 15.461 7.283 14.601 1.00 41.15 O ATOM 1441 CB VAL A 91 16.429 5.682 16.987 1.00 54.55 C ATOM 1442 CG1 VAL A 91 15.388 6.247 17.941 1.00 14.11 C ATOM 1443 CG2 VAL A 91 17.227 4.571 17.652 1.00 52.24 C ATOM 0 H VAL A 91 17.266 5.405 14.260 1.00 72.31 H new ATOM 0 HA VAL A 91 15.109 4.328 15.945 1.00 11.43 H new ATOM 0 HB VAL A 91 17.118 6.484 16.723 1.00 54.55 H new ATOM 0 HG11 VAL A 91 15.880 6.605 18.846 1.00 14.11 H new ATOM 0 HG12 VAL A 91 14.865 7.074 17.461 1.00 14.11 H new ATOM 0 HG13 VAL A 91 14.672 5.467 18.202 1.00 14.11 H new ATOM 0 HG21 VAL A 91 17.693 4.952 18.561 1.00 52.24 H new ATOM 0 HG22 VAL A 91 16.561 3.746 17.904 1.00 52.24 H new ATOM 0 HG23 VAL A 91 17.999 4.218 16.968 1.00 52.24 H new ATOM 1453 N VAL A 92 13.605 6.124 15.126 1.00 43.13 N ATOM 1454 CA VAL A 92 12.694 7.123 14.580 1.00 45.11 C ATOM 1455 C VAL A 92 12.042 7.937 15.691 1.00 11.53 C ATOM 1456 O VAL A 92 11.393 7.387 16.581 1.00 31.24 O ATOM 1457 CB VAL A 92 11.594 6.470 13.723 1.00 53.32 C ATOM 1458 CG1 VAL A 92 10.801 7.530 12.973 1.00 1.54 C ATOM 1459 CG2 VAL A 92 12.199 5.463 12.757 1.00 74.04 C ATOM 0 H VAL A 92 13.144 5.307 15.527 1.00 43.13 H new ATOM 0 HA VAL A 92 13.289 7.785 13.951 1.00 45.11 H new ATOM 0 HB VAL A 92 10.910 5.939 14.385 1.00 53.32 H new ATOM 0 HG11 VAL A 92 10.028 7.050 12.373 1.00 1.54 H new ATOM 0 HG12 VAL A 92 10.336 8.209 13.687 1.00 1.54 H new ATOM 0 HG13 VAL A 92 11.470 8.091 12.321 1.00 1.54 H new ATOM 0 HG21 VAL A 92 11.407 5.011 12.159 1.00 74.04 H new ATOM 0 HG22 VAL A 92 12.906 5.969 12.100 1.00 74.04 H new ATOM 0 HG23 VAL A 92 12.718 4.686 13.319 1.00 74.04 H new ATOM 1469 N THR A 93 12.218 9.254 15.634 1.00 13.12 N ATOM 1470 CA THR A 93 11.647 10.145 16.636 1.00 52.50 C ATOM 1471 C THR A 93 10.173 10.415 16.356 1.00 32.11 C ATOM 1472 O THR A 93 9.776 10.616 15.208 1.00 33.12 O ATOM 1473 CB THR A 93 12.401 11.487 16.689 1.00 2.41 C ATOM 1474 OG1 THR A 93 12.239 12.190 15.452 1.00 72.00 O ATOM 1475 CG2 THR A 93 13.881 11.266 16.962 1.00 63.33 C ATOM 0 H THR A 93 12.751 9.727 14.904 1.00 13.12 H new ATOM 0 HA THR A 93 11.745 9.642 17.598 1.00 52.50 H new ATOM 0 HB THR A 93 11.982 12.081 17.501 1.00 2.41 H new ATOM 0 HG1 THR A 93 12.112 13.145 15.633 1.00 72.00 H new ATOM 0 HG21 THR A 93 14.393 12.228 16.995 1.00 63.33 H new ATOM 0 HG22 THR A 93 14.003 10.757 17.918 1.00 63.33 H new ATOM 0 HG23 THR A 93 14.310 10.654 16.169 1.00 63.33 H new ATOM 1483 N ASP A 94 9.366 10.418 17.412 1.00 41.34 N ATOM 1484 CA ASP A 94 7.935 10.665 17.279 1.00 10.13 C ATOM 1485 C ASP A 94 7.485 11.773 18.227 1.00 73.41 C ATOM 1486 O ASP A 94 7.155 11.517 19.384 1.00 31.30 O ATOM 1487 CB ASP A 94 7.147 9.385 17.560 1.00 32.23 C ATOM 1488 CG ASP A 94 6.243 8.997 16.407 1.00 72.42 C ATOM 1489 OD1 ASP A 94 5.585 9.894 15.840 1.00 12.41 O ATOM 1490 OD2 ASP A 94 6.194 7.795 16.070 1.00 11.23 O ATOM 0 H ASP A 94 9.678 10.252 18.369 1.00 41.34 H new ATOM 0 HA ASP A 94 7.740 10.985 16.256 1.00 10.13 H new ATOM 0 HB2 ASP A 94 7.843 8.571 17.762 1.00 32.23 H new ATOM 0 HB3 ASP A 94 6.546 9.522 18.459 1.00 32.23 H new ATOM 1495 N ASN A 95 7.475 13.004 17.727 1.00 10.23 N ATOM 1496 CA ASN A 95 7.067 14.151 18.530 1.00 10.41 C ATOM 1497 C ASN A 95 5.634 13.986 19.026 1.00 54.31 C ATOM 1498 O ASN A 95 4.684 14.400 18.362 1.00 63.04 O ATOM 1499 CB ASN A 95 7.191 15.441 17.715 1.00 23.53 C ATOM 1500 CG ASN A 95 7.519 16.642 18.581 1.00 41.04 C ATOM 1501 OD1 ASN A 95 6.748 17.012 19.466 1.00 22.13 O ATOM 1502 ND2 ASN A 95 8.668 17.258 18.327 1.00 71.11 N ATOM 0 H ASN A 95 7.745 13.233 16.770 1.00 10.23 H new ATOM 0 HA ASN A 95 7.728 14.210 19.395 1.00 10.41 H new ATOM 0 HB2 ASN A 95 7.968 15.318 16.960 1.00 23.53 H new ATOM 0 HB3 ASN A 95 6.257 15.623 17.184 1.00 23.53 H new ATOM 0 HD21 ASN A 95 8.942 18.073 18.876 1.00 71.11 H new ATOM 0 HD22 ASN A 95 9.276 16.916 17.583 1.00 71.11 H new ATOM 1509 N GLY A 96 5.485 13.379 20.199 1.00 22.42 N ATOM 1510 CA GLY A 96 4.165 13.170 20.765 1.00 61.23 C ATOM 1511 C GLY A 96 3.708 11.729 20.654 1.00 24.34 C ATOM 1512 O GLY A 96 2.558 11.410 20.952 1.00 11.20 O ATOM 0 H GLY A 96 6.255 13.028 20.768 1.00 22.42 H new ATOM 0 HA2 GLY A 96 4.172 13.466 21.814 1.00 61.23 H new ATOM 0 HA3 GLY A 96 3.449 13.815 20.256 1.00 61.23 H new ATOM 1516 N GLY A 97 4.612 10.854 20.223 1.00 5.13 N ATOM 1517 CA GLY A 97 4.277 9.450 20.080 1.00 35.41 C ATOM 1518 C GLY A 97 3.070 9.230 19.190 1.00 73.04 C ATOM 1519 O GLY A 97 2.078 8.634 19.610 1.00 33.53 O ATOM 0 H GLY A 97 5.571 11.093 19.970 1.00 5.13 H new ATOM 0 HA2 GLY A 97 5.132 8.916 19.666 1.00 35.41 H new ATOM 0 HA3 GLY A 97 4.081 9.024 21.064 1.00 35.41 H new ATOM 1523 N THR A 98 3.152 9.714 17.954 1.00 14.42 N ATOM 1524 CA THR A 98 2.057 9.571 17.003 1.00 60.42 C ATOM 1525 C THR A 98 1.834 8.107 16.638 1.00 1.41 C ATOM 1526 O THR A 98 0.710 7.609 16.693 1.00 34.32 O ATOM 1527 CB THR A 98 2.322 10.374 15.716 1.00 43.04 C ATOM 1528 OG1 THR A 98 3.421 11.270 15.915 1.00 2.33 O ATOM 1529 CG2 THR A 98 1.087 11.161 15.305 1.00 43.50 C ATOM 0 H THR A 98 3.966 10.208 17.589 1.00 14.42 H new ATOM 0 HA THR A 98 1.163 9.962 17.489 1.00 60.42 H new ATOM 0 HB THR A 98 2.567 9.671 14.920 1.00 43.04 H new ATOM 0 HG1 THR A 98 4.248 10.849 15.599 1.00 2.33 H new ATOM 0 HG21 THR A 98 1.299 11.720 14.394 1.00 43.50 H new ATOM 0 HG22 THR A 98 0.261 10.473 15.125 1.00 43.50 H new ATOM 0 HG23 THR A 98 0.816 11.854 16.101 1.00 43.50 H new ATOM 1537 N ILE A 99 2.912 7.424 16.266 1.00 14.44 N ATOM 1538 CA ILE A 99 2.833 6.017 15.895 1.00 53.25 C ATOM 1539 C ILE A 99 2.342 5.167 17.061 1.00 24.15 C ATOM 1540 O ILE A 99 1.328 4.478 16.958 1.00 52.33 O ATOM 1541 CB ILE A 99 4.198 5.482 15.422 1.00 14.51 C ATOM 1542 CG1 ILE A 99 4.668 6.247 14.183 1.00 23.01 C ATOM 1543 CG2 ILE A 99 4.110 3.992 15.130 1.00 61.00 C ATOM 1544 CD1 ILE A 99 3.779 6.047 12.976 1.00 41.22 C ATOM 0 H ILE A 99 3.850 7.822 16.214 1.00 14.44 H new ATOM 0 HA ILE A 99 2.120 5.947 15.073 1.00 53.25 H new ATOM 0 HB ILE A 99 4.927 5.634 16.218 1.00 14.51 H new ATOM 0 HG12 ILE A 99 4.714 7.310 14.418 1.00 23.01 H new ATOM 0 HG13 ILE A 99 5.681 5.932 13.934 1.00 23.01 H new ATOM 0 HG21 ILE A 99 5.082 3.628 14.797 1.00 61.00 H new ATOM 0 HG22 ILE A 99 3.815 3.461 16.035 1.00 61.00 H new ATOM 0 HG23 ILE A 99 3.370 3.817 14.349 1.00 61.00 H new ATOM 0 HD11 ILE A 99 4.173 6.619 12.135 1.00 41.22 H new ATOM 0 HD12 ILE A 99 3.753 4.989 12.715 1.00 41.22 H new ATOM 0 HD13 ILE A 99 2.770 6.389 13.207 1.00 41.22 H new ATOM 1556 N ALA A 100 3.069 5.222 18.173 1.00 63.52 N ATOM 1557 CA ALA A 100 2.706 4.460 19.361 1.00 23.32 C ATOM 1558 C ALA A 100 1.250 4.702 19.745 1.00 24.30 C ATOM 1559 O ALA A 100 0.492 3.757 19.963 1.00 1.44 O ATOM 1560 CB ALA A 100 3.626 4.818 20.519 1.00 10.11 C ATOM 0 H ALA A 100 3.912 5.786 18.275 1.00 63.52 H new ATOM 0 HA ALA A 100 2.823 3.401 19.133 1.00 23.32 H new ATOM 0 HB1 ALA A 100 3.343 4.241 21.400 1.00 10.11 H new ATOM 0 HB2 ALA A 100 4.657 4.587 20.250 1.00 10.11 H new ATOM 0 HB3 ALA A 100 3.538 5.882 20.738 1.00 10.11 H new ATOM 1566 N GLN A 101 0.868 5.972 19.826 1.00 51.02 N ATOM 1567 CA GLN A 101 -0.497 6.337 20.185 1.00 33.21 C ATOM 1568 C GLN A 101 -1.492 5.794 19.165 1.00 53.25 C ATOM 1569 O GLN A 101 -2.565 5.311 19.525 1.00 32.34 O ATOM 1570 CB GLN A 101 -0.631 7.857 20.287 1.00 14.14 C ATOM 1571 CG GLN A 101 -1.911 8.310 20.971 1.00 11.44 C ATOM 1572 CD GLN A 101 -2.880 8.977 20.014 1.00 4.15 C ATOM 1573 OE1 GLN A 101 -3.943 8.435 19.711 1.00 1.13 O ATOM 1574 NE2 GLN A 101 -2.517 10.160 19.533 1.00 45.12 N ATOM 0 H GLN A 101 1.484 6.765 19.648 1.00 51.02 H new ATOM 0 HA GLN A 101 -0.721 5.894 21.155 1.00 33.21 H new ATOM 0 HB2 GLN A 101 0.224 8.253 20.835 1.00 14.14 H new ATOM 0 HB3 GLN A 101 -0.593 8.285 19.285 1.00 14.14 H new ATOM 0 HG2 GLN A 101 -2.396 7.450 21.432 1.00 11.44 H new ATOM 0 HG3 GLN A 101 -1.663 9.004 21.774 1.00 11.44 H new ATOM 0 HE21 GLN A 101 -1.627 10.572 19.811 1.00 45.12 H new ATOM 0 HE22 GLN A 101 -3.129 10.657 18.885 1.00 45.12 H new ATOM 1583 N SER A 102 -1.129 5.878 17.889 1.00 50.33 N ATOM 1584 CA SER A 102 -1.992 5.400 16.815 1.00 22.51 C ATOM 1585 C SER A 102 -1.935 3.879 16.710 1.00 71.50 C ATOM 1586 O SER A 102 -2.653 3.272 15.914 1.00 55.20 O ATOM 1587 CB SER A 102 -1.581 6.030 15.483 1.00 74.22 C ATOM 1588 OG SER A 102 -1.804 7.429 15.491 1.00 52.24 O ATOM 0 H SER A 102 -0.243 6.273 17.574 1.00 50.33 H new ATOM 0 HA SER A 102 -3.016 5.693 17.047 1.00 22.51 H new ATOM 0 HB2 SER A 102 -0.527 5.828 15.291 1.00 74.22 H new ATOM 0 HB3 SER A 102 -2.147 5.573 14.671 1.00 74.22 H new ATOM 0 HG SER A 102 -1.040 7.880 15.908 1.00 52.24 H new ATOM 1594 N LEU A 103 -1.076 3.268 17.519 1.00 72.35 N ATOM 1595 CA LEU A 103 -0.924 1.817 17.518 1.00 32.11 C ATOM 1596 C LEU A 103 -1.298 1.230 18.875 1.00 22.34 C ATOM 1597 O LEU A 103 -1.232 0.018 19.078 1.00 40.12 O ATOM 1598 CB LEU A 103 0.514 1.435 17.163 1.00 51.10 C ATOM 1599 CG LEU A 103 0.819 1.282 15.672 1.00 3.45 C ATOM 1600 CD1 LEU A 103 0.079 2.337 14.865 1.00 13.11 C ATOM 1601 CD2 LEU A 103 2.318 1.372 15.423 1.00 12.12 C ATOM 0 H LEU A 103 -0.474 3.755 18.184 1.00 72.35 H new ATOM 0 HA LEU A 103 -1.598 1.406 16.766 1.00 32.11 H new ATOM 0 HB2 LEU A 103 1.182 2.192 17.574 1.00 51.10 H new ATOM 0 HB3 LEU A 103 0.753 0.495 17.661 1.00 51.10 H new ATOM 0 HG LEU A 103 0.475 0.299 15.349 1.00 3.45 H new ATOM 0 HD11 LEU A 103 0.308 2.213 13.807 1.00 13.11 H new ATOM 0 HD12 LEU A 103 -0.994 2.227 15.019 1.00 13.11 H new ATOM 0 HD13 LEU A 103 0.392 3.329 15.190 1.00 13.11 H new ATOM 0 HD21 LEU A 103 2.517 1.261 14.357 1.00 12.12 H new ATOM 0 HD22 LEU A 103 2.686 2.341 15.762 1.00 12.12 H new ATOM 0 HD23 LEU A 103 2.826 0.579 15.971 1.00 12.12 H new ATOM 1613 N ASN A 104 -1.692 2.098 19.801 1.00 32.35 N ATOM 1614 CA ASN A 104 -2.078 1.665 21.140 1.00 74.25 C ATOM 1615 C ASN A 104 -0.883 1.085 21.890 1.00 11.50 C ATOM 1616 O ASN A 104 -1.043 0.264 22.793 1.00 74.52 O ATOM 1617 CB ASN A 104 -3.197 0.624 21.058 1.00 11.25 C ATOM 1618 CG ASN A 104 -3.903 0.429 22.387 1.00 43.14 C ATOM 1619 OD1 ASN A 104 -3.513 1.010 23.400 1.00 33.51 O ATOM 1620 ND2 ASN A 104 -4.947 -0.392 22.387 1.00 44.31 N ATOM 0 H ASN A 104 -1.753 3.105 19.649 1.00 32.35 H new ATOM 0 HA ASN A 104 -2.439 2.536 21.687 1.00 74.25 H new ATOM 0 HB2 ASN A 104 -3.923 0.933 20.306 1.00 11.25 H new ATOM 0 HB3 ASN A 104 -2.781 -0.328 20.727 1.00 11.25 H new ATOM 0 HD21 ASN A 104 -5.462 -0.563 23.251 1.00 44.31 H new ATOM 0 HD22 ASN A 104 -5.234 -0.852 21.523 1.00 44.31 H new ATOM 1627 N ILE A 105 0.314 1.520 21.511 1.00 52.03 N ATOM 1628 CA ILE A 105 1.536 1.046 22.149 1.00 74.03 C ATOM 1629 C ILE A 105 1.867 1.875 23.385 1.00 65.11 C ATOM 1630 O ILE A 105 2.740 2.743 23.347 1.00 34.21 O ATOM 1631 CB ILE A 105 2.731 1.090 21.179 1.00 50.34 C ATOM 1632 CG1 ILE A 105 2.408 0.313 19.901 1.00 53.43 C ATOM 1633 CG2 ILE A 105 3.976 0.527 21.847 1.00 64.03 C ATOM 1634 CD1 ILE A 105 2.270 -1.177 20.118 1.00 30.22 C ATOM 0 H ILE A 105 0.464 2.200 20.765 1.00 52.03 H new ATOM 0 HA ILE A 105 1.358 0.012 22.445 1.00 74.03 H new ATOM 0 HB ILE A 105 2.924 2.129 20.911 1.00 50.34 H new ATOM 0 HG12 ILE A 105 1.481 0.697 19.476 1.00 53.43 H new ATOM 0 HG13 ILE A 105 3.194 0.494 19.167 1.00 53.43 H new ATOM 0 HG21 ILE A 105 4.812 0.565 21.149 1.00 64.03 H new ATOM 0 HG22 ILE A 105 4.214 1.119 22.731 1.00 64.03 H new ATOM 0 HG23 ILE A 105 3.795 -0.507 22.141 1.00 64.03 H new ATOM 0 HD11 ILE A 105 2.041 -1.663 19.170 1.00 30.22 H new ATOM 0 HD12 ILE A 105 3.204 -1.575 20.514 1.00 30.22 H new ATOM 0 HD13 ILE A 105 1.465 -1.368 20.827 1.00 30.22 H new ATOM 1646 N SER A 106 1.167 1.600 24.481 1.00 60.14 N ATOM 1647 CA SER A 106 1.386 2.322 25.729 1.00 73.53 C ATOM 1648 C SER A 106 2.424 1.612 26.592 1.00 62.41 C ATOM 1649 O SER A 106 3.061 2.225 27.448 1.00 12.25 O ATOM 1650 CB SER A 106 0.072 2.458 26.500 1.00 32.04 C ATOM 1651 OG SER A 106 0.007 3.699 27.182 1.00 22.31 O ATOM 0 H SER A 106 0.444 0.883 24.530 1.00 60.14 H new ATOM 0 HA SER A 106 1.761 3.316 25.485 1.00 73.53 H new ATOM 0 HB2 SER A 106 -0.768 2.374 25.811 1.00 32.04 H new ATOM 0 HB3 SER A 106 -0.020 1.641 27.216 1.00 32.04 H new ATOM 0 HG SER A 106 -0.843 3.762 27.666 1.00 22.31 H new ATOM 1657 N VAL A 107 2.590 0.313 26.360 1.00 52.23 N ATOM 1658 CA VAL A 107 3.551 -0.482 27.114 1.00 3.22 C ATOM 1659 C VAL A 107 4.842 -0.677 26.326 1.00 12.33 C ATOM 1660 O VAL A 107 4.814 -1.024 25.145 1.00 20.04 O ATOM 1661 CB VAL A 107 2.973 -1.862 27.481 1.00 4.43 C ATOM 1662 CG1 VAL A 107 1.883 -1.722 28.533 1.00 42.54 C ATOM 1663 CG2 VAL A 107 2.442 -2.563 26.241 1.00 62.44 C ATOM 0 H VAL A 107 2.071 -0.211 25.655 1.00 52.23 H new ATOM 0 HA VAL A 107 3.767 0.068 28.030 1.00 3.22 H new ATOM 0 HB VAL A 107 3.773 -2.472 27.901 1.00 4.43 H new ATOM 0 HG11 VAL A 107 1.487 -2.707 28.780 1.00 42.54 H new ATOM 0 HG12 VAL A 107 2.300 -1.264 29.430 1.00 42.54 H new ATOM 0 HG13 VAL A 107 1.081 -1.095 28.144 1.00 42.54 H new ATOM 0 HG21 VAL A 107 2.037 -3.536 26.518 1.00 62.44 H new ATOM 0 HG22 VAL A 107 1.655 -1.958 25.790 1.00 62.44 H new ATOM 0 HG23 VAL A 107 3.252 -2.698 25.524 1.00 62.44 H new ATOM 1673 N TYR A 108 5.972 -0.452 26.987 1.00 14.54 N ATOM 1674 CA TYR A 108 7.274 -0.600 26.348 1.00 32.55 C ATOM 1675 C TYR A 108 8.170 -1.539 27.151 1.00 60.04 C ATOM 1676 O TYR A 108 8.027 -1.690 28.364 1.00 12.41 O ATOM 1677 CB TYR A 108 7.950 0.763 26.197 1.00 0.23 C ATOM 1678 CG TYR A 108 7.094 1.788 25.487 1.00 25.04 C ATOM 1679 CD1 TYR A 108 6.895 1.724 24.114 1.00 41.41 C ATOM 1680 CD2 TYR A 108 6.484 2.819 26.191 1.00 45.52 C ATOM 1681 CE1 TYR A 108 6.115 2.659 23.461 1.00 11.14 C ATOM 1682 CE2 TYR A 108 5.701 3.758 25.547 1.00 63.22 C ATOM 1683 CZ TYR A 108 5.520 3.674 24.182 1.00 31.40 C ATOM 1684 OH TYR A 108 4.741 4.606 23.536 1.00 72.21 O ATOM 0 H TYR A 108 6.013 -0.166 27.965 1.00 14.54 H new ATOM 0 HA TYR A 108 7.118 -1.031 25.359 1.00 32.55 H new ATOM 0 HB2 TYR A 108 8.211 1.141 27.185 1.00 0.23 H new ATOM 0 HB3 TYR A 108 8.883 0.638 25.647 1.00 0.23 H new ATOM 0 HD1 TYR A 108 7.358 0.930 23.547 1.00 41.41 H new ATOM 0 HD2 TYR A 108 6.624 2.888 27.260 1.00 45.52 H new ATOM 0 HE1 TYR A 108 5.972 2.596 22.392 1.00 11.14 H new ATOM 0 HE2 TYR A 108 5.233 4.553 26.109 1.00 63.22 H new ATOM 0 HH TYR A 108 3.829 4.260 23.439 1.00 72.21 H new ATOM 1694 N PRO A 109 9.119 -2.186 26.457 1.00 14.11 N ATOM 1695 CA PRO A 109 9.298 -2.015 25.012 1.00 2.03 C ATOM 1696 C PRO A 109 8.156 -2.628 24.210 1.00 55.43 C ATOM 1697 O PRO A 109 7.209 -3.174 24.777 1.00 40.55 O ATOM 1698 CB PRO A 109 10.608 -2.754 24.728 1.00 70.22 C ATOM 1699 CG PRO A 109 10.718 -3.764 25.818 1.00 53.31 C ATOM 1700 CD PRO A 109 10.088 -3.134 27.030 1.00 65.31 C ATOM 0 HA PRO A 109 9.314 -0.964 24.725 1.00 2.03 H new ATOM 0 HB2 PRO A 109 10.589 -3.230 23.748 1.00 70.22 H new ATOM 0 HB3 PRO A 109 11.457 -2.071 24.734 1.00 70.22 H new ATOM 0 HG2 PRO A 109 10.206 -4.688 25.548 1.00 53.31 H new ATOM 0 HG3 PRO A 109 11.760 -4.021 26.009 1.00 53.31 H new ATOM 0 HD2 PRO A 109 9.599 -3.877 27.660 1.00 65.31 H new ATOM 0 HD3 PRO A 109 10.828 -2.627 27.650 1.00 65.31 H new ATOM 1708 N SER A 110 8.251 -2.534 22.887 1.00 15.32 N ATOM 1709 CA SER A 110 7.223 -3.076 22.007 1.00 74.25 C ATOM 1710 C SER A 110 7.805 -3.420 20.639 1.00 50.21 C ATOM 1711 O SER A 110 8.955 -3.095 20.343 1.00 71.43 O ATOM 1712 CB SER A 110 6.076 -2.075 21.849 1.00 64.34 C ATOM 1713 OG SER A 110 5.117 -2.232 22.880 1.00 51.24 O ATOM 0 H SER A 110 9.029 -2.088 22.402 1.00 15.32 H new ATOM 0 HA SER A 110 6.838 -3.990 22.459 1.00 74.25 H new ATOM 0 HB2 SER A 110 6.471 -1.059 21.867 1.00 64.34 H new ATOM 0 HB3 SER A 110 5.598 -2.215 20.879 1.00 64.34 H new ATOM 0 HG SER A 110 5.327 -1.622 23.618 1.00 51.24 H new ATOM 1719 N TRP A 111 7.003 -4.078 19.810 1.00 32.02 N ATOM 1720 CA TRP A 111 7.438 -4.466 18.473 1.00 33.42 C ATOM 1721 C TRP A 111 6.262 -4.484 17.502 1.00 23.32 C ATOM 1722 O TRP A 111 5.105 -4.547 17.916 1.00 70.24 O ATOM 1723 CB TRP A 111 8.105 -5.842 18.511 1.00 31.22 C ATOM 1724 CG TRP A 111 9.477 -5.821 19.115 1.00 54.31 C ATOM 1725 CD1 TRP A 111 9.788 -5.866 20.444 1.00 71.51 C ATOM 1726 CD2 TRP A 111 10.721 -5.746 18.412 1.00 44.05 C ATOM 1727 NE1 TRP A 111 11.151 -5.825 20.609 1.00 44.30 N ATOM 1728 CE2 TRP A 111 11.747 -5.752 19.378 1.00 53.45 C ATOM 1729 CE3 TRP A 111 11.070 -5.677 17.060 1.00 31.10 C ATOM 1730 CZ2 TRP A 111 13.094 -5.689 19.033 1.00 61.54 C ATOM 1731 CZ3 TRP A 111 12.408 -5.615 16.719 1.00 33.34 C ATOM 1732 CH2 TRP A 111 13.407 -5.623 17.702 1.00 14.40 C ATOM 0 H TRP A 111 6.048 -4.354 20.040 1.00 32.02 H new ATOM 0 HA TRP A 111 8.161 -3.729 18.125 1.00 33.42 H new ATOM 0 HB2 TRP A 111 7.476 -6.527 19.080 1.00 31.22 H new ATOM 0 HB3 TRP A 111 8.169 -6.235 17.496 1.00 31.22 H new ATOM 0 HD1 TRP A 111 9.068 -5.925 21.247 1.00 71.51 H new ATOM 0 HE1 TRP A 111 11.640 -5.846 21.504 1.00 44.30 H new ATOM 0 HE3 TRP A 111 10.307 -5.672 16.295 1.00 31.10 H new ATOM 0 HZ2 TRP A 111 13.865 -5.692 19.789 1.00 61.54 H new ATOM 0 HZ3 TRP A 111 12.688 -5.559 15.678 1.00 33.34 H new ATOM 0 HH2 TRP A 111 14.444 -5.576 17.404 1.00 14.40 H new ATOM 1743 N ALA A 112 6.567 -4.429 16.210 1.00 41.12 N ATOM 1744 CA ALA A 112 5.535 -4.441 15.180 1.00 22.24 C ATOM 1745 C ALA A 112 6.133 -4.726 13.807 1.00 42.21 C ATOM 1746 O ALA A 112 6.896 -3.920 13.271 1.00 31.34 O ATOM 1747 CB ALA A 112 4.786 -3.117 15.168 1.00 3.20 C ATOM 0 H ALA A 112 7.520 -4.376 15.851 1.00 41.12 H new ATOM 0 HA ALA A 112 4.832 -5.241 15.414 1.00 22.24 H new ATOM 0 HB1 ALA A 112 4.019 -3.140 14.394 1.00 3.20 H new ATOM 0 HB2 ALA A 112 4.318 -2.955 16.139 1.00 3.20 H new ATOM 0 HB3 ALA A 112 5.484 -2.306 14.962 1.00 3.20 H new ATOM 1753 N LEU A 113 5.784 -5.876 13.241 1.00 14.15 N ATOM 1754 CA LEU A 113 6.287 -6.268 11.929 1.00 12.54 C ATOM 1755 C LEU A 113 5.467 -5.622 10.817 1.00 42.42 C ATOM 1756 O LEU A 113 4.239 -5.565 10.890 1.00 63.30 O ATOM 1757 CB LEU A 113 6.256 -7.790 11.783 1.00 10.11 C ATOM 1758 CG LEU A 113 7.312 -8.397 10.858 1.00 13.24 C ATOM 1759 CD1 LEU A 113 7.379 -9.905 11.043 1.00 44.13 C ATOM 1760 CD2 LEU A 113 7.014 -8.048 9.407 1.00 10.14 C ATOM 0 H LEU A 113 5.154 -6.554 13.670 1.00 14.15 H new ATOM 0 HA LEU A 113 7.317 -5.922 11.844 1.00 12.54 H new ATOM 0 HB2 LEU A 113 6.371 -8.232 12.773 1.00 10.11 H new ATOM 0 HB3 LEU A 113 5.271 -8.080 11.417 1.00 10.11 H new ATOM 0 HG LEU A 113 8.283 -7.976 11.120 1.00 13.24 H new ATOM 0 HD11 LEU A 113 8.136 -10.320 10.377 1.00 44.13 H new ATOM 0 HD12 LEU A 113 7.640 -10.134 12.076 1.00 44.13 H new ATOM 0 HD13 LEU A 113 6.409 -10.344 10.809 1.00 44.13 H new ATOM 0 HD21 LEU A 113 7.775 -8.488 8.763 1.00 10.14 H new ATOM 0 HD22 LEU A 113 6.035 -8.441 9.132 1.00 10.14 H new ATOM 0 HD23 LEU A 113 7.018 -6.965 9.285 1.00 10.14 H new ATOM 1772 N ILE A 114 6.154 -5.138 9.788 1.00 42.24 N ATOM 1773 CA ILE A 114 5.489 -4.499 8.658 1.00 23.35 C ATOM 1774 C ILE A 114 5.880 -5.164 7.343 1.00 41.22 C ATOM 1775 O ILE A 114 6.976 -4.947 6.827 1.00 21.55 O ATOM 1776 CB ILE A 114 5.826 -2.998 8.582 1.00 31.34 C ATOM 1777 CG1 ILE A 114 5.454 -2.303 9.893 1.00 14.24 C ATOM 1778 CG2 ILE A 114 5.103 -2.352 7.410 1.00 61.32 C ATOM 1779 CD1 ILE A 114 3.969 -2.314 10.183 1.00 30.21 C ATOM 0 H ILE A 114 7.171 -5.176 9.713 1.00 42.24 H new ATOM 0 HA ILE A 114 4.417 -4.614 8.816 1.00 23.35 H new ATOM 0 HB ILE A 114 6.899 -2.889 8.426 1.00 31.34 H new ATOM 0 HG12 ILE A 114 5.980 -2.789 10.715 1.00 14.24 H new ATOM 0 HG13 ILE A 114 5.802 -1.270 9.859 1.00 14.24 H new ATOM 0 HG21 ILE A 114 5.351 -1.291 7.369 1.00 61.32 H new ATOM 0 HG22 ILE A 114 5.412 -2.833 6.482 1.00 61.32 H new ATOM 0 HG23 ILE A 114 4.027 -2.468 7.538 1.00 61.32 H new ATOM 0 HD11 ILE A 114 3.779 -1.804 11.127 1.00 30.21 H new ATOM 0 HD12 ILE A 114 3.438 -1.802 9.381 1.00 30.21 H new ATOM 0 HD13 ILE A 114 3.619 -3.344 10.250 1.00 30.21 H new ATOM 1791 N GLY A 115 4.974 -5.973 6.803 1.00 61.42 N ATOM 1792 CA GLY A 115 5.242 -6.656 5.550 1.00 31.15 C ATOM 1793 C GLY A 115 5.834 -5.734 4.503 1.00 61.52 C ATOM 1794 O GLY A 115 5.678 -4.515 4.577 1.00 31.52 O ATOM 0 H GLY A 115 4.059 -6.168 7.210 1.00 61.42 H new ATOM 0 HA2 GLY A 115 5.928 -7.484 5.730 1.00 31.15 H new ATOM 0 HA3 GLY A 115 4.316 -7.086 5.169 1.00 31.15 H new ATOM 1798 N LYS A 116 6.518 -6.317 3.524 1.00 40.44 N ATOM 1799 CA LYS A 116 7.137 -5.540 2.456 1.00 70.53 C ATOM 1800 C LYS A 116 6.123 -4.606 1.804 1.00 74.32 C ATOM 1801 O LYS A 116 6.456 -3.487 1.414 1.00 62.22 O ATOM 1802 CB LYS A 116 7.738 -6.473 1.402 1.00 71.33 C ATOM 1803 CG LYS A 116 6.700 -7.280 0.641 1.00 40.24 C ATOM 1804 CD LYS A 116 6.319 -6.606 -0.667 1.00 12.33 C ATOM 1805 CE LYS A 116 6.552 -7.525 -1.856 1.00 54.42 C ATOM 1806 NZ LYS A 116 6.597 -6.770 -3.139 1.00 70.14 N ATOM 0 H LYS A 116 6.658 -7.325 3.448 1.00 40.44 H new ATOM 0 HA LYS A 116 7.931 -4.936 2.894 1.00 70.53 H new ATOM 0 HB2 LYS A 116 8.317 -5.881 0.693 1.00 71.33 H new ATOM 0 HB3 LYS A 116 8.433 -7.157 1.889 1.00 71.33 H new ATOM 0 HG2 LYS A 116 7.091 -8.277 0.437 1.00 40.24 H new ATOM 0 HG3 LYS A 116 5.811 -7.406 1.259 1.00 40.24 H new ATOM 0 HD2 LYS A 116 5.270 -6.311 -0.634 1.00 12.33 H new ATOM 0 HD3 LYS A 116 6.903 -5.694 -0.791 1.00 12.33 H new ATOM 0 HE2 LYS A 116 7.489 -8.065 -1.719 1.00 54.42 H new ATOM 0 HE3 LYS A 116 5.758 -8.270 -1.901 1.00 54.42 H new ATOM 0 HZ1 LYS A 116 6.757 -7.431 -3.925 1.00 70.14 H new ATOM 0 HZ2 LYS A 116 5.694 -6.274 -3.282 1.00 70.14 H new ATOM 0 HZ3 LYS A 116 7.371 -6.076 -3.107 1.00 70.14 H new ATOM 1820 N ASP A 117 4.884 -5.072 1.690 1.00 33.33 N ATOM 1821 CA ASP A 117 3.820 -4.277 1.088 1.00 31.11 C ATOM 1822 C ASP A 117 3.635 -2.961 1.836 1.00 5.43 C ATOM 1823 O ASP A 117 3.073 -2.005 1.303 1.00 63.11 O ATOM 1824 CB ASP A 117 2.508 -5.063 1.082 1.00 13.11 C ATOM 1825 CG ASP A 117 1.320 -4.204 0.694 1.00 3.24 C ATOM 1826 OD1 ASP A 117 1.055 -4.070 -0.519 1.00 2.12 O ATOM 1827 OD2 ASP A 117 0.655 -3.666 1.604 1.00 24.02 O ATOM 0 H ASP A 117 4.592 -5.997 2.007 1.00 33.33 H new ATOM 0 HA ASP A 117 4.105 -4.053 0.060 1.00 31.11 H new ATOM 0 HB2 ASP A 117 2.591 -5.898 0.386 1.00 13.11 H new ATOM 0 HB3 ASP A 117 2.338 -5.488 2.071 1.00 13.11 H new ATOM 1832 N GLY A 118 4.112 -2.919 3.077 1.00 44.42 N ATOM 1833 CA GLY A 118 3.989 -1.715 3.879 1.00 61.43 C ATOM 1834 C GLY A 118 2.755 -1.729 4.759 1.00 62.20 C ATOM 1835 O GLY A 118 2.073 -0.714 4.899 1.00 0.12 O ATOM 0 H GLY A 118 4.581 -3.697 3.541 1.00 44.42 H new ATOM 0 HA2 GLY A 118 4.876 -1.606 4.503 1.00 61.43 H new ATOM 0 HA3 GLY A 118 3.953 -0.846 3.222 1.00 61.43 H new ATOM 1839 N ASP A 119 2.467 -2.882 5.352 1.00 34.21 N ATOM 1840 CA ASP A 119 1.306 -3.024 6.223 1.00 34.41 C ATOM 1841 C ASP A 119 1.659 -3.823 7.474 1.00 60.54 C ATOM 1842 O ASP A 119 2.564 -4.658 7.455 1.00 43.41 O ATOM 1843 CB ASP A 119 0.160 -3.706 5.474 1.00 72.51 C ATOM 1844 CG ASP A 119 -1.131 -3.709 6.269 1.00 52.24 C ATOM 1845 OD1 ASP A 119 -1.563 -2.620 6.702 1.00 34.13 O ATOM 1846 OD2 ASP A 119 -1.710 -4.799 6.456 1.00 20.22 O ATOM 0 H ASP A 119 3.021 -3.732 5.246 1.00 34.21 H new ATOM 0 HA ASP A 119 0.988 -2.027 6.528 1.00 34.41 H new ATOM 0 HB2 ASP A 119 -0.003 -3.197 4.524 1.00 72.51 H new ATOM 0 HB3 ASP A 119 0.442 -4.733 5.241 1.00 72.51 H new ATOM 1851 N VAL A 120 0.939 -3.562 8.560 1.00 2.21 N ATOM 1852 CA VAL A 120 1.176 -4.256 9.820 1.00 65.21 C ATOM 1853 C VAL A 120 0.704 -5.704 9.747 1.00 14.31 C ATOM 1854 O VAL A 120 -0.439 -5.975 9.380 1.00 33.34 O ATOM 1855 CB VAL A 120 0.464 -3.553 10.991 1.00 64.40 C ATOM 1856 CG1 VAL A 120 -1.034 -3.483 10.740 1.00 12.10 C ATOM 1857 CG2 VAL A 120 0.761 -4.268 12.301 1.00 70.34 C ATOM 0 H VAL A 120 0.186 -2.875 8.593 1.00 2.21 H new ATOM 0 HA VAL A 120 2.252 -4.236 9.995 1.00 65.21 H new ATOM 0 HB VAL A 120 0.843 -2.534 11.066 1.00 64.40 H new ATOM 0 HG11 VAL A 120 -1.520 -2.983 11.578 1.00 12.10 H new ATOM 0 HG12 VAL A 120 -1.224 -2.924 9.824 1.00 12.10 H new ATOM 0 HG13 VAL A 120 -1.433 -4.492 10.638 1.00 12.10 H new ATOM 0 HG21 VAL A 120 0.250 -3.758 13.118 1.00 70.34 H new ATOM 0 HG22 VAL A 120 0.410 -5.298 12.241 1.00 70.34 H new ATOM 0 HG23 VAL A 120 1.835 -4.260 12.484 1.00 70.34 H new ATOM 1867 N GLN A 121 1.591 -6.629 10.099 1.00 13.33 N ATOM 1868 CA GLN A 121 1.263 -8.049 10.073 1.00 24.44 C ATOM 1869 C GLN A 121 1.385 -8.661 11.465 1.00 32.41 C ATOM 1870 O GLN A 121 0.671 -9.606 11.803 1.00 41.03 O ATOM 1871 CB GLN A 121 2.180 -8.788 9.097 1.00 44.22 C ATOM 1872 CG GLN A 121 3.615 -8.910 9.584 1.00 44.25 C ATOM 1873 CD GLN A 121 4.497 -9.675 8.616 1.00 33.33 C ATOM 1874 OE1 GLN A 121 5.129 -10.665 8.985 1.00 21.31 O ATOM 1875 NE2 GLN A 121 4.543 -9.220 7.370 1.00 52.12 N ATOM 0 H GLN A 121 2.541 -6.421 10.405 1.00 13.33 H new ATOM 0 HA GLN A 121 0.230 -8.152 9.739 1.00 24.44 H new ATOM 0 HB2 GLN A 121 1.779 -9.786 8.920 1.00 44.22 H new ATOM 0 HB3 GLN A 121 2.173 -8.267 8.140 1.00 44.22 H new ATOM 0 HG2 GLN A 121 4.029 -7.913 9.737 1.00 44.25 H new ATOM 0 HG3 GLN A 121 3.625 -9.411 10.552 1.00 44.25 H new ATOM 0 HE21 GLN A 121 4.003 -8.396 7.108 1.00 52.12 H new ATOM 0 HE22 GLN A 121 5.119 -9.695 6.675 1.00 52.12 H new ATOM 1884 N ARG A 122 2.293 -8.117 12.268 1.00 21.22 N ATOM 1885 CA ARG A 122 2.509 -8.611 13.623 1.00 53.10 C ATOM 1886 C ARG A 122 2.721 -7.455 14.596 1.00 51.53 C ATOM 1887 O ARG A 122 3.285 -6.421 14.233 1.00 35.44 O ATOM 1888 CB ARG A 122 3.715 -9.551 13.660 1.00 4.51 C ATOM 1889 CG ARG A 122 3.569 -10.765 12.758 1.00 22.45 C ATOM 1890 CD ARG A 122 3.494 -12.052 13.565 1.00 33.13 C ATOM 1891 NE ARG A 122 2.183 -12.688 13.460 1.00 63.34 N ATOM 1892 CZ ARG A 122 1.130 -12.327 14.184 1.00 2.31 C ATOM 1893 NH1 ARG A 122 1.233 -11.338 15.062 1.00 61.41 N ATOM 1894 NH2 ARG A 122 -0.029 -12.954 14.031 1.00 50.12 N ATOM 0 H ARG A 122 2.891 -7.334 12.004 1.00 21.22 H new ATOM 0 HA ARG A 122 1.619 -9.161 13.928 1.00 53.10 H new ATOM 0 HB2 ARG A 122 4.606 -8.996 13.367 1.00 4.51 H new ATOM 0 HB3 ARG A 122 3.872 -9.887 14.685 1.00 4.51 H new ATOM 0 HG2 ARG A 122 2.670 -10.662 12.150 1.00 22.45 H new ATOM 0 HG3 ARG A 122 4.414 -10.813 12.071 1.00 22.45 H new ATOM 0 HD2 ARG A 122 4.261 -12.743 13.217 1.00 33.13 H new ATOM 0 HD3 ARG A 122 3.710 -11.837 14.612 1.00 33.13 H new ATOM 0 HE ARG A 122 2.070 -13.452 12.793 1.00 63.34 H new ATOM 0 HH11 ARG A 122 2.122 -10.853 15.182 1.00 61.41 H new ATOM 0 HH12 ARG A 122 0.423 -11.062 15.617 1.00 61.41 H new ATOM 0 HH21 ARG A 122 -0.112 -13.715 13.356 1.00 50.12 H new ATOM 0 HH22 ARG A 122 -0.837 -12.676 14.588 1.00 50.12 H new ATOM 1908 N ILE A 123 2.265 -7.636 15.831 1.00 44.14 N ATOM 1909 CA ILE A 123 2.406 -6.608 16.855 1.00 70.32 C ATOM 1910 C ILE A 123 2.581 -7.229 18.236 1.00 20.44 C ATOM 1911 O ILE A 123 1.723 -7.976 18.707 1.00 74.24 O ATOM 1912 CB ILE A 123 1.188 -5.667 16.878 1.00 14.53 C ATOM 1913 CG1 ILE A 123 1.206 -4.743 15.659 1.00 51.23 C ATOM 1914 CG2 ILE A 123 1.171 -4.854 18.165 1.00 72.24 C ATOM 1915 CD1 ILE A 123 -0.063 -3.936 15.493 1.00 4.40 C ATOM 0 H ILE A 123 1.795 -8.484 16.147 1.00 44.14 H new ATOM 0 HA ILE A 123 3.296 -6.031 16.603 1.00 70.32 H new ATOM 0 HB ILE A 123 0.281 -6.270 16.840 1.00 14.53 H new ATOM 0 HG12 ILE A 123 2.052 -4.061 15.743 1.00 51.23 H new ATOM 0 HG13 ILE A 123 1.366 -5.341 14.762 1.00 51.23 H new ATOM 0 HG21 ILE A 123 0.304 -4.193 18.167 1.00 72.24 H new ATOM 0 HG22 ILE A 123 1.116 -5.528 19.020 1.00 72.24 H new ATOM 0 HG23 ILE A 123 2.081 -4.258 18.231 1.00 72.24 H new ATOM 0 HD11 ILE A 123 0.021 -3.304 14.609 1.00 4.40 H new ATOM 0 HD12 ILE A 123 -0.911 -4.611 15.377 1.00 4.40 H new ATOM 0 HD13 ILE A 123 -0.214 -3.311 16.373 1.00 4.40 H new ATOM 1927 N VAL A 124 3.699 -6.914 18.884 1.00 75.34 N ATOM 1928 CA VAL A 124 3.986 -7.439 20.213 1.00 32.03 C ATOM 1929 C VAL A 124 4.230 -6.310 21.208 1.00 24.34 C ATOM 1930 O VAL A 124 4.782 -5.267 20.858 1.00 54.33 O ATOM 1931 CB VAL A 124 5.213 -8.369 20.197 1.00 64.04 C ATOM 1932 CG1 VAL A 124 5.574 -8.802 21.609 1.00 25.52 C ATOM 1933 CG2 VAL A 124 4.954 -9.577 19.309 1.00 21.12 C ATOM 0 H VAL A 124 4.420 -6.298 18.509 1.00 75.34 H new ATOM 0 HA VAL A 124 3.111 -8.011 20.523 1.00 32.03 H new ATOM 0 HB VAL A 124 6.059 -7.819 19.785 1.00 64.04 H new ATOM 0 HG11 VAL A 124 6.443 -9.459 21.577 1.00 25.52 H new ATOM 0 HG12 VAL A 124 5.805 -7.923 22.211 1.00 25.52 H new ATOM 0 HG13 VAL A 124 4.733 -9.335 22.052 1.00 25.52 H new ATOM 0 HG21 VAL A 124 5.832 -10.224 19.309 1.00 21.12 H new ATOM 0 HG22 VAL A 124 4.095 -10.130 19.689 1.00 21.12 H new ATOM 0 HG23 VAL A 124 4.749 -9.244 18.292 1.00 21.12 H new ATOM 1943 N LYS A 125 3.817 -6.526 22.453 1.00 64.23 N ATOM 1944 CA LYS A 125 3.993 -5.528 23.501 1.00 35.55 C ATOM 1945 C LYS A 125 5.003 -6.003 24.541 1.00 64.05 C ATOM 1946 O LYS A 125 4.638 -6.350 25.663 1.00 61.43 O ATOM 1947 CB LYS A 125 2.653 -5.229 24.178 1.00 53.24 C ATOM 1948 CG LYS A 125 1.861 -4.126 23.497 1.00 41.23 C ATOM 1949 CD LYS A 125 0.471 -3.986 24.094 1.00 21.55 C ATOM 1950 CE LYS A 125 -0.572 -4.709 23.255 1.00 3.40 C ATOM 1951 NZ LYS A 125 -1.788 -5.041 24.047 1.00 52.20 N ATOM 0 H LYS A 125 3.358 -7.384 22.760 1.00 64.23 H new ATOM 0 HA LYS A 125 4.373 -4.617 23.040 1.00 35.55 H new ATOM 0 HB2 LYS A 125 2.053 -6.139 24.195 1.00 53.24 H new ATOM 0 HB3 LYS A 125 2.834 -4.948 25.215 1.00 53.24 H new ATOM 0 HG2 LYS A 125 2.396 -3.181 23.593 1.00 41.23 H new ATOM 0 HG3 LYS A 125 1.780 -4.340 22.431 1.00 41.23 H new ATOM 0 HD2 LYS A 125 0.467 -4.388 25.107 1.00 21.55 H new ATOM 0 HD3 LYS A 125 0.211 -2.930 24.169 1.00 21.55 H new ATOM 0 HE2 LYS A 125 -0.851 -4.085 22.406 1.00 3.40 H new ATOM 0 HE3 LYS A 125 -0.141 -5.625 22.850 1.00 3.40 H new ATOM 0 HZ1 LYS A 125 -2.474 -5.533 23.440 1.00 52.20 H new ATOM 0 HZ2 LYS A 125 -1.526 -5.657 24.843 1.00 52.20 H new ATOM 0 HZ3 LYS A 125 -2.214 -4.165 24.412 1.00 52.20 H new ATOM 1965 N GLY A 126 6.277 -6.014 24.159 1.00 41.30 N ATOM 1966 CA GLY A 126 7.321 -6.446 25.070 1.00 52.10 C ATOM 1967 C GLY A 126 8.704 -6.341 24.459 1.00 50.32 C ATOM 1968 O GLY A 126 8.938 -5.517 23.575 1.00 63.04 O ATOM 0 H GLY A 126 6.604 -5.731 23.235 1.00 41.30 H new ATOM 0 HA2 GLY A 126 7.281 -5.842 25.976 1.00 52.10 H new ATOM 0 HA3 GLY A 126 7.136 -7.478 25.367 1.00 52.10 H new ATOM 1972 N SER A 127 9.623 -7.176 24.932 1.00 44.11 N ATOM 1973 CA SER A 127 10.993 -7.170 24.430 1.00 15.51 C ATOM 1974 C SER A 127 11.410 -8.564 23.972 1.00 53.31 C ATOM 1975 O SER A 127 11.966 -9.343 24.746 1.00 13.14 O ATOM 1976 CB SER A 127 11.952 -6.667 25.511 1.00 71.22 C ATOM 1977 OG SER A 127 11.272 -6.447 26.734 1.00 33.13 O ATOM 0 H SER A 127 9.444 -7.866 25.662 1.00 44.11 H new ATOM 0 HA SER A 127 11.037 -6.497 23.573 1.00 15.51 H new ATOM 0 HB2 SER A 127 12.750 -7.394 25.661 1.00 71.22 H new ATOM 0 HB3 SER A 127 12.423 -5.741 25.181 1.00 71.22 H new ATOM 0 HG SER A 127 11.907 -6.128 27.409 1.00 33.13 H new ATOM 1983 N ILE A 128 11.137 -8.870 22.708 1.00 30.31 N ATOM 1984 CA ILE A 128 11.484 -10.169 22.146 1.00 65.43 C ATOM 1985 C ILE A 128 12.991 -10.400 22.184 1.00 44.43 C ATOM 1986 O ILE A 128 13.774 -9.451 22.198 1.00 42.35 O ATOM 1987 CB ILE A 128 10.992 -10.304 20.692 1.00 5.45 C ATOM 1988 CG1 ILE A 128 11.412 -9.081 19.874 1.00 14.52 C ATOM 1989 CG2 ILE A 128 9.481 -10.478 20.659 1.00 45.32 C ATOM 1990 CD1 ILE A 128 12.065 -9.431 18.555 1.00 13.25 C ATOM 0 H ILE A 128 10.677 -8.236 22.054 1.00 30.31 H new ATOM 0 HA ILE A 128 10.988 -10.920 22.760 1.00 65.43 H new ATOM 0 HB ILE A 128 11.449 -11.188 20.249 1.00 5.45 H new ATOM 0 HG12 ILE A 128 10.535 -8.463 19.683 1.00 14.52 H new ATOM 0 HG13 ILE A 128 12.103 -8.479 20.464 1.00 14.52 H new ATOM 0 HG21 ILE A 128 9.148 -10.572 19.625 1.00 45.32 H new ATOM 0 HG22 ILE A 128 9.206 -11.376 21.212 1.00 45.32 H new ATOM 0 HG23 ILE A 128 9.005 -9.611 21.116 1.00 45.32 H new ATOM 0 HD11 ILE A 128 12.336 -8.516 18.029 1.00 13.25 H new ATOM 0 HD12 ILE A 128 12.961 -10.023 18.739 1.00 13.25 H new ATOM 0 HD13 ILE A 128 11.368 -10.007 17.946 1.00 13.25 H new ATOM 2002 N ASN A 129 13.391 -11.667 22.199 1.00 73.24 N ATOM 2003 CA ASN A 129 14.805 -12.023 22.233 1.00 13.25 C ATOM 2004 C ASN A 129 15.315 -12.360 20.836 1.00 64.10 C ATOM 2005 O ASN A 129 14.560 -12.332 19.865 1.00 13.23 O ATOM 2006 CB ASN A 129 15.030 -13.210 23.172 1.00 63.24 C ATOM 2007 CG ASN A 129 15.154 -12.786 24.622 1.00 4.31 C ATOM 2008 OD1 ASN A 129 14.357 -11.990 25.118 1.00 52.41 O ATOM 2009 ND2 ASN A 129 16.159 -13.317 25.310 1.00 15.40 N ATOM 0 H ASN A 129 12.756 -12.465 22.188 1.00 73.24 H new ATOM 0 HA ASN A 129 15.362 -11.163 22.605 1.00 13.25 H new ATOM 0 HB2 ASN A 129 14.202 -13.911 23.071 1.00 63.24 H new ATOM 0 HB3 ASN A 129 15.934 -13.740 22.873 1.00 63.24 H new ATOM 0 HD21 ASN A 129 16.294 -13.069 26.290 1.00 15.40 H new ATOM 0 HD22 ASN A 129 16.796 -13.973 24.858 1.00 15.40 H new ATOM 2016 N GLU A 130 16.602 -12.680 20.743 1.00 5.33 N ATOM 2017 CA GLU A 130 17.214 -13.022 19.464 1.00 34.34 C ATOM 2018 C GLU A 130 16.438 -14.139 18.772 1.00 35.35 C ATOM 2019 O GLU A 130 15.741 -13.906 17.785 1.00 64.12 O ATOM 2020 CB GLU A 130 18.669 -13.448 19.667 1.00 3.42 C ATOM 2021 CG GLU A 130 19.676 -12.470 19.085 1.00 11.41 C ATOM 2022 CD GLU A 130 20.747 -12.073 20.082 1.00 4.31 C ATOM 2023 OE1 GLU A 130 21.741 -12.819 20.213 1.00 15.50 O ATOM 2024 OE2 GLU A 130 20.593 -11.017 20.731 1.00 31.21 O ATOM 0 H GLU A 130 17.241 -12.710 21.538 1.00 5.33 H new ATOM 0 HA GLU A 130 17.188 -12.136 18.829 1.00 34.34 H new ATOM 0 HB2 GLU A 130 18.860 -13.561 20.734 1.00 3.42 H new ATOM 0 HB3 GLU A 130 18.820 -14.426 19.210 1.00 3.42 H new ATOM 0 HG2 GLU A 130 20.147 -12.917 18.210 1.00 11.41 H new ATOM 0 HG3 GLU A 130 19.153 -11.576 18.744 1.00 11.41 H new ATOM 2031 N ALA A 131 16.564 -15.353 19.299 1.00 73.14 N ATOM 2032 CA ALA A 131 15.874 -16.506 18.733 1.00 31.14 C ATOM 2033 C ALA A 131 14.391 -16.215 18.534 1.00 55.23 C ATOM 2034 O ALA A 131 13.762 -16.747 17.619 1.00 24.42 O ATOM 2035 CB ALA A 131 16.059 -17.723 19.628 1.00 1.32 C ATOM 0 H ALA A 131 17.137 -15.563 20.116 1.00 73.14 H new ATOM 0 HA ALA A 131 16.311 -16.716 17.757 1.00 31.14 H new ATOM 0 HB1 ALA A 131 15.539 -18.577 19.194 1.00 1.32 H new ATOM 0 HB2 ALA A 131 17.121 -17.952 19.716 1.00 1.32 H new ATOM 0 HB3 ALA A 131 15.650 -17.513 20.616 1.00 1.32 H new ATOM 2041 N GLN A 132 13.837 -15.367 19.395 1.00 24.33 N ATOM 2042 CA GLN A 132 12.427 -15.007 19.313 1.00 32.21 C ATOM 2043 C GLN A 132 12.139 -14.222 18.038 1.00 72.03 C ATOM 2044 O GLN A 132 11.256 -14.584 17.260 1.00 22.14 O ATOM 2045 CB GLN A 132 12.017 -14.185 20.536 1.00 54.10 C ATOM 2046 CG GLN A 132 10.955 -14.856 21.392 1.00 54.21 C ATOM 2047 CD GLN A 132 11.022 -14.430 22.845 1.00 31.34 C ATOM 2048 OE1 GLN A 132 11.194 -13.250 23.151 1.00 30.15 O ATOM 2049 NE2 GLN A 132 10.886 -15.392 23.751 1.00 60.00 N ATOM 0 H GLN A 132 14.344 -14.917 20.157 1.00 24.33 H new ATOM 0 HA GLN A 132 11.844 -15.927 19.291 1.00 32.21 H new ATOM 0 HB2 GLN A 132 12.899 -13.995 21.148 1.00 54.10 H new ATOM 0 HB3 GLN A 132 11.645 -13.216 20.204 1.00 54.10 H new ATOM 0 HG2 GLN A 132 9.969 -14.619 20.993 1.00 54.21 H new ATOM 0 HG3 GLN A 132 11.073 -15.938 21.329 1.00 54.21 H new ATOM 0 HE21 GLN A 132 10.745 -16.357 23.453 1.00 60.00 H new ATOM 0 HE22 GLN A 132 10.922 -15.165 24.745 1.00 60.00 H new ATOM 2058 N ALA A 133 12.889 -13.145 17.830 1.00 63.15 N ATOM 2059 CA ALA A 133 12.716 -12.310 16.648 1.00 54.23 C ATOM 2060 C ALA A 133 12.739 -13.149 15.374 1.00 2.44 C ATOM 2061 O ALA A 133 11.903 -12.973 14.487 1.00 11.13 O ATOM 2062 CB ALA A 133 13.794 -11.238 16.596 1.00 50.20 C ATOM 0 H ALA A 133 13.623 -12.830 18.465 1.00 63.15 H new ATOM 0 HA ALA A 133 11.742 -11.826 16.715 1.00 54.23 H new ATOM 0 HB1 ALA A 133 13.652 -10.622 15.708 1.00 50.20 H new ATOM 0 HB2 ALA A 133 13.728 -10.612 17.486 1.00 50.20 H new ATOM 0 HB3 ALA A 133 14.775 -11.711 16.557 1.00 50.20 H new ATOM 2068 N LEU A 134 13.702 -14.060 15.290 1.00 41.23 N ATOM 2069 CA LEU A 134 13.835 -14.926 14.124 1.00 62.24 C ATOM 2070 C LEU A 134 12.542 -15.691 13.863 1.00 34.31 C ATOM 2071 O LEU A 134 11.998 -15.654 12.760 1.00 41.23 O ATOM 2072 CB LEU A 134 14.991 -15.908 14.323 1.00 71.44 C ATOM 2073 CG LEU A 134 16.377 -15.287 14.501 1.00 74.04 C ATOM 2074 CD1 LEU A 134 17.349 -16.306 15.074 1.00 32.13 C ATOM 2075 CD2 LEU A 134 16.891 -14.743 13.176 1.00 64.22 C ATOM 0 H LEU A 134 14.402 -14.218 16.015 1.00 41.23 H new ATOM 0 HA LEU A 134 14.045 -14.298 13.258 1.00 62.24 H new ATOM 0 HB2 LEU A 134 14.774 -16.520 15.198 1.00 71.44 H new ATOM 0 HB3 LEU A 134 15.023 -16.579 13.465 1.00 71.44 H new ATOM 0 HG LEU A 134 16.295 -14.458 15.204 1.00 74.04 H new ATOM 0 HD11 LEU A 134 18.330 -15.846 15.194 1.00 32.13 H new ATOM 0 HD12 LEU A 134 16.988 -16.648 16.044 1.00 32.13 H new ATOM 0 HD13 LEU A 134 17.427 -17.156 14.396 1.00 32.13 H new ATOM 0 HD21 LEU A 134 17.878 -14.305 13.321 1.00 64.22 H new ATOM 0 HD22 LEU A 134 16.957 -15.554 12.451 1.00 64.22 H new ATOM 0 HD23 LEU A 134 16.206 -13.980 12.806 1.00 64.22 H new ATOM 2087 N ALA A 135 12.053 -16.383 14.887 1.00 20.23 N ATOM 2088 CA ALA A 135 10.821 -17.153 14.771 1.00 60.45 C ATOM 2089 C ALA A 135 9.616 -16.237 14.588 1.00 70.05 C ATOM 2090 O ALA A 135 8.566 -16.664 14.105 1.00 1.10 O ATOM 2091 CB ALA A 135 10.633 -18.037 15.995 1.00 62.44 C ATOM 0 H ALA A 135 12.492 -16.426 15.807 1.00 20.23 H new ATOM 0 HA ALA A 135 10.900 -17.787 13.888 1.00 60.45 H new ATOM 0 HB1 ALA A 135 9.709 -18.606 15.894 1.00 62.44 H new ATOM 0 HB2 ALA A 135 11.475 -18.724 16.080 1.00 62.44 H new ATOM 0 HB3 ALA A 135 10.580 -17.415 16.888 1.00 62.44 H new ATOM 2097 N LEU A 136 9.773 -14.976 14.976 1.00 70.40 N ATOM 2098 CA LEU A 136 8.697 -13.999 14.855 1.00 33.04 C ATOM 2099 C LEU A 136 8.599 -13.470 13.428 1.00 73.31 C ATOM 2100 O LEU A 136 7.531 -13.045 12.985 1.00 22.31 O ATOM 2101 CB LEU A 136 8.923 -12.839 15.827 1.00 64.15 C ATOM 2102 CG LEU A 136 7.845 -11.756 15.842 1.00 54.45 C ATOM 2103 CD1 LEU A 136 7.796 -11.069 17.198 1.00 64.04 C ATOM 2104 CD2 LEU A 136 8.093 -10.740 14.736 1.00 43.01 C ATOM 0 H LEU A 136 10.635 -14.606 15.377 1.00 70.40 H new ATOM 0 HA LEU A 136 7.759 -14.496 15.103 1.00 33.04 H new ATOM 0 HB2 LEU A 136 9.013 -13.247 16.834 1.00 64.15 H new ATOM 0 HB3 LEU A 136 9.877 -12.370 15.586 1.00 64.15 H new ATOM 0 HG LEU A 136 6.880 -12.230 15.663 1.00 54.45 H new ATOM 0 HD11 LEU A 136 7.022 -10.301 17.189 1.00 64.04 H new ATOM 0 HD12 LEU A 136 7.569 -11.804 17.970 1.00 64.04 H new ATOM 0 HD13 LEU A 136 8.762 -10.609 17.408 1.00 64.04 H new ATOM 0 HD21 LEU A 136 7.315 -9.977 14.762 1.00 43.01 H new ATOM 0 HD22 LEU A 136 9.066 -10.272 14.883 1.00 43.01 H new ATOM 0 HD23 LEU A 136 8.075 -11.243 13.769 1.00 43.01 H new ATOM 2116 N ILE A 137 9.718 -13.502 12.713 1.00 41.22 N ATOM 2117 CA ILE A 137 9.757 -13.029 11.334 1.00 31.15 C ATOM 2118 C ILE A 137 9.359 -14.135 10.363 1.00 43.24 C ATOM 2119 O ILE A 137 8.437 -13.971 9.564 1.00 41.13 O ATOM 2120 CB ILE A 137 11.156 -12.508 10.957 1.00 23.22 C ATOM 2121 CG1 ILE A 137 11.563 -11.359 11.882 1.00 23.42 C ATOM 2122 CG2 ILE A 137 11.180 -12.059 9.504 1.00 63.22 C ATOM 2123 CD1 ILE A 137 13.013 -11.414 12.311 1.00 12.53 C ATOM 0 H ILE A 137 10.610 -13.850 13.065 1.00 41.22 H new ATOM 0 HA ILE A 137 9.042 -12.210 11.260 1.00 31.15 H new ATOM 0 HB ILE A 137 11.874 -13.319 11.078 1.00 23.22 H new ATOM 0 HG12 ILE A 137 11.378 -10.412 11.375 1.00 23.42 H new ATOM 0 HG13 ILE A 137 10.929 -11.375 12.769 1.00 23.42 H new ATOM 0 HG21 ILE A 137 12.176 -11.693 9.253 1.00 63.22 H new ATOM 0 HG22 ILE A 137 10.929 -12.901 8.859 1.00 63.22 H new ATOM 0 HG23 ILE A 137 10.453 -11.260 9.358 1.00 63.22 H new ATOM 0 HD11 ILE A 137 13.231 -10.570 12.965 1.00 12.53 H new ATOM 0 HD12 ILE A 137 13.199 -12.345 12.846 1.00 12.53 H new ATOM 0 HD13 ILE A 137 13.655 -11.367 11.431 1.00 12.53 H new ATOM 2135 N ARG A 138 10.060 -15.262 10.438 1.00 0.50 N ATOM 2136 CA ARG A 138 9.780 -16.395 9.565 1.00 31.33 C ATOM 2137 C ARG A 138 8.329 -16.846 9.708 1.00 51.41 C ATOM 2138 O ARG A 138 7.693 -17.244 8.732 1.00 43.34 O ATOM 2139 CB ARG A 138 10.720 -17.558 9.887 1.00 30.42 C ATOM 2140 CG ARG A 138 10.812 -17.875 11.371 1.00 11.40 C ATOM 2141 CD ARG A 138 10.459 -19.326 11.654 1.00 24.52 C ATOM 2142 NE ARG A 138 11.250 -20.250 10.845 1.00 41.44 N ATOM 2143 CZ ARG A 138 11.020 -21.556 10.784 1.00 75.43 C ATOM 2144 NH1 ARG A 138 10.026 -22.091 11.481 1.00 43.23 N ATOM 2145 NH2 ARG A 138 11.783 -22.331 10.024 1.00 71.32 N ATOM 0 H ARG A 138 10.826 -15.414 11.094 1.00 0.50 H new ATOM 0 HA ARG A 138 9.944 -16.078 8.535 1.00 31.33 H new ATOM 0 HB2 ARG A 138 10.380 -18.447 9.355 1.00 30.42 H new ATOM 0 HB3 ARG A 138 11.716 -17.323 9.512 1.00 30.42 H new ATOM 0 HG2 ARG A 138 11.822 -17.669 11.726 1.00 11.40 H new ATOM 0 HG3 ARG A 138 10.140 -17.221 11.926 1.00 11.40 H new ATOM 0 HD2 ARG A 138 10.621 -19.539 12.711 1.00 24.52 H new ATOM 0 HD3 ARG A 138 9.399 -19.487 11.456 1.00 24.52 H new ATOM 0 HE ARG A 138 12.022 -19.871 10.297 1.00 41.44 H new ATOM 0 HH11 ARG A 138 9.436 -21.499 12.066 1.00 43.23 H new ATOM 0 HH12 ARG A 138 9.851 -23.095 11.432 1.00 43.23 H new ATOM 0 HH21 ARG A 138 12.548 -21.923 9.486 1.00 71.32 H new ATOM 0 HH22 ARG A 138 11.605 -23.334 9.978 1.00 71.32 H new ATOM 2159 N ASP A 139 7.812 -16.780 10.930 1.00 61.21 N ATOM 2160 CA ASP A 139 6.436 -17.180 11.201 1.00 61.45 C ATOM 2161 C ASP A 139 5.473 -16.026 10.942 1.00 4.43 C ATOM 2162 O ASP A 139 5.519 -14.987 11.602 1.00 24.44 O ATOM 2163 CB ASP A 139 6.298 -17.663 12.645 1.00 14.23 C ATOM 2164 CG ASP A 139 5.063 -18.518 12.854 1.00 2.24 C ATOM 2165 OD1 ASP A 139 4.000 -18.172 12.297 1.00 64.54 O ATOM 2166 OD2 ASP A 139 5.160 -19.533 13.575 1.00 2.21 O ATOM 0 H ASP A 139 8.325 -16.453 11.749 1.00 61.21 H new ATOM 0 HA ASP A 139 6.182 -17.998 10.527 1.00 61.45 H new ATOM 0 HB2 ASP A 139 7.184 -18.236 12.920 1.00 14.23 H new ATOM 0 HB3 ASP A 139 6.257 -16.801 13.311 1.00 14.23 H new ATOM 2171 N PRO A 140 4.581 -16.208 9.958 1.00 15.11 N ATOM 2172 CA PRO A 140 3.590 -15.192 9.589 1.00 2.15 C ATOM 2173 C PRO A 140 2.520 -15.010 10.660 1.00 32.42 C ATOM 2174 O PRO A 140 1.976 -13.920 10.829 1.00 42.31 O ATOM 2175 CB PRO A 140 2.972 -15.749 8.304 1.00 3.35 C ATOM 2176 CG PRO A 140 3.171 -17.222 8.396 1.00 31.32 C ATOM 2177 CD PRO A 140 4.468 -17.420 9.130 1.00 65.31 C ATOM 0 HA PRO A 140 4.041 -14.207 9.469 1.00 2.15 H new ATOM 0 HB2 PRO A 140 1.914 -15.496 8.231 1.00 3.35 H new ATOM 0 HB3 PRO A 140 3.459 -15.338 7.420 1.00 3.35 H new ATOM 0 HG2 PRO A 140 2.345 -17.695 8.928 1.00 31.32 H new ATOM 0 HG3 PRO A 140 3.211 -17.673 7.404 1.00 31.32 H new ATOM 0 HD2 PRO A 140 4.450 -18.323 9.740 1.00 65.31 H new ATOM 0 HD3 PRO A 140 5.308 -17.516 8.442 1.00 65.31 H new ATOM 2185 N ASN A 141 2.222 -16.086 11.381 1.00 23.44 N ATOM 2186 CA ASN A 141 1.216 -16.045 12.436 1.00 21.13 C ATOM 2187 C ASN A 141 1.873 -15.999 13.813 1.00 54.32 C ATOM 2188 O ASN A 141 1.244 -16.316 14.822 1.00 3.43 O ATOM 2189 CB ASN A 141 0.295 -17.263 12.339 1.00 11.21 C ATOM 2190 CG ASN A 141 -0.347 -17.395 10.971 1.00 3.43 C ATOM 2191 OD1 ASN A 141 0.221 -18.002 10.063 1.00 12.31 O ATOM 2192 ND2 ASN A 141 -1.536 -16.824 10.819 1.00 73.53 N ATOM 0 H ASN A 141 2.663 -16.997 11.254 1.00 23.44 H new ATOM 0 HA ASN A 141 0.625 -15.139 12.304 1.00 21.13 H new ATOM 0 HB2 ASN A 141 0.866 -18.165 12.558 1.00 11.21 H new ATOM 0 HB3 ASN A 141 -0.484 -17.187 13.097 1.00 11.21 H new ATOM 0 HD21 ASN A 141 -2.017 -16.878 9.921 1.00 73.53 H new ATOM 0 HD22 ASN A 141 -1.969 -16.331 11.600 1.00 73.53 H new ATOM 2199 N ALA A 142 3.140 -15.601 13.845 1.00 43.05 N ATOM 2200 CA ALA A 142 3.881 -15.510 15.096 1.00 23.34 C ATOM 2201 C ALA A 142 3.108 -14.704 16.135 1.00 64.13 C ATOM 2202 O ALA A 142 3.026 -13.479 16.048 1.00 42.23 O ATOM 2203 CB ALA A 142 5.250 -14.890 14.856 1.00 71.41 C ATOM 0 H ALA A 142 3.675 -15.336 13.018 1.00 43.05 H new ATOM 0 HA ALA A 142 4.015 -16.520 15.484 1.00 23.34 H new ATOM 0 HB1 ALA A 142 5.792 -14.828 15.800 1.00 71.41 H new ATOM 0 HB2 ALA A 142 5.811 -15.508 14.155 1.00 71.41 H new ATOM 0 HB3 ALA A 142 5.129 -13.889 14.441 1.00 71.41 H new ATOM 2209 N ASP A 143 2.543 -15.399 17.115 1.00 30.24 N ATOM 2210 CA ASP A 143 1.776 -14.748 18.171 1.00 5.51 C ATOM 2211 C ASP A 143 2.234 -15.222 19.547 1.00 73.42 C ATOM 2212 O ASP A 143 2.289 -16.424 19.814 1.00 1.51 O ATOM 2213 CB ASP A 143 0.283 -15.025 17.992 1.00 21.43 C ATOM 2214 CG ASP A 143 -0.302 -14.298 16.798 1.00 71.13 C ATOM 2215 OD1 ASP A 143 -0.324 -13.050 16.816 1.00 44.22 O ATOM 2216 OD2 ASP A 143 -0.739 -14.977 15.845 1.00 73.21 O ATOM 0 H ASP A 143 2.601 -16.414 17.201 1.00 30.24 H new ATOM 0 HA ASP A 143 1.948 -13.674 18.101 1.00 5.51 H new ATOM 0 HB2 ASP A 143 0.127 -16.097 17.873 1.00 21.43 H new ATOM 0 HB3 ASP A 143 -0.250 -14.724 18.894 1.00 21.43 H new ATOM 2221 N LEU A 144 2.561 -14.273 20.416 1.00 43.30 N ATOM 2222 CA LEU A 144 3.015 -14.593 21.765 1.00 61.42 C ATOM 2223 C LEU A 144 1.884 -15.198 22.591 1.00 50.24 C ATOM 2224 O LEU A 144 1.547 -16.371 22.435 1.00 32.33 O ATOM 2225 CB LEU A 144 3.552 -13.339 22.455 1.00 11.54 C ATOM 2226 CG LEU A 144 5.054 -13.320 22.741 1.00 60.01 C ATOM 2227 CD1 LEU A 144 5.840 -13.130 21.453 1.00 52.32 C ATOM 2228 CD2 LEU A 144 5.393 -12.225 23.741 1.00 3.25 C ATOM 0 H LEU A 144 2.520 -13.275 20.211 1.00 43.30 H new ATOM 0 HA LEU A 144 3.816 -15.328 21.687 1.00 61.42 H new ATOM 0 HB2 LEU A 144 3.310 -12.476 21.835 1.00 11.54 H new ATOM 0 HB3 LEU A 144 3.021 -13.213 23.399 1.00 11.54 H new ATOM 0 HG LEU A 144 5.334 -14.280 23.175 1.00 60.01 H new ATOM 0 HD11 LEU A 144 6.907 -13.119 21.676 1.00 52.32 H new ATOM 0 HD12 LEU A 144 5.621 -13.950 20.769 1.00 52.32 H new ATOM 0 HD13 LEU A 144 5.556 -12.185 20.990 1.00 52.32 H new ATOM 0 HD21 LEU A 144 6.466 -12.227 23.932 1.00 3.25 H new ATOM 0 HD22 LEU A 144 5.098 -11.257 23.335 1.00 3.25 H new ATOM 0 HD23 LEU A 144 4.858 -12.405 24.673 1.00 3.25 H new TER 2240 LEU A 144