USER MOD reduce.3.24.130724 H: found=0, std=0, add=1144, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1143 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 147 SER OG : rot 180:sc= -0.0723 USER MOD Set 1.2: A 149 ASN : amide:sc= -0.787 X(o=-0.86,f=-1) USER MOD Set 2.1: A 100 MET CE :methyl -131:sc= -6.32! (180deg=-8.13!) USER MOD Set 2.2: A 108 ASN : amide:sc= -0.678 K(o=-7,f=-14!) USER MOD Set 3.1: A 63 GLN : amide:sc= -1.02 K(o=-1.4,f=-0.38) USER MOD Set 3.2: A 111 GLN : amide:sc= -0.354 K(o=-1.4,f=-0.38) USER MOD Single : A 3 ASN : amide:sc= -1.13 K(o=-1.1,f=-9.4!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -152:sc= -3.41 USER MOD Single : A 28 LYS NZ :NH3+ 160:sc= 0.0236 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ -165:sc= -0.0469 (180deg=-0.361) USER MOD Single : A 32 THR OG1 : rot 140:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -1.54 K(o=-1.5,f=-5!) USER MOD Single : A 40 SER OG : rot -113:sc= 1.32 USER MOD Single : A 41 THR OG1 : rot -84:sc= -0.0387 USER MOD Single : A 44 LYS NZ :NH3+ -140:sc= 2.37 (180deg=0.0858) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 152:sc= 0.472 (180deg=-0.1) USER MOD Single : A 51 SER OG : rot -160:sc= -0.921 USER MOD Single : A 52 CYS SG : rot 180:sc= 0.0425 USER MOD Single : A 54 HIS : no HD1:sc= -0.173 X(o=-0.17,f=-0.015) USER MOD Single : A 61 MET CE :methyl 142:sc= -4.39! (180deg=-5.09!) USER MOD Single : A 62 CYS SG : rot 180:sc= -0.0343 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 ASN : amide:sc= -1.45 K(o=-1.4,f=-8.8!) USER MOD Single : A 91 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.0532) USER MOD Single : A 92 HIS : no HE2:sc= -0.537 K(o=-0.54,f=-5!) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot -170:sc= -4.35! USER MOD Single : A 102 ASN : amide:sc= -3! C(o=-3!,f=-2.1!) USER MOD Single : A 106 ASN : amide:sc= 1.06 K(o=1.1,f=-5.3!) USER MOD Single : A 107 THR OG1 : rot -79:sc= -3.63! USER MOD Single : A 110 SER OG : rot 64:sc= 0.417 USER MOD Single : A 115 CYS SG : rot 21:sc= -2.51! USER MOD Single : A 116 THR OG1 : rot 180:sc= 0.0237 USER MOD Single : A 118 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.064) USER MOD Single : A 119 THR OG1 : rot 52:sc= -2.73! USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 HIS : no HE2:sc= -2.89 X(o=-2.9,f=-3.3) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 137 ASN : amide:sc= -0.0955 X(o=-0.095,f=-0.017) USER MOD Single : A 142 MET CE :methyl -175:sc= 0 (180deg=-0.0574) USER MOD Single : A 151 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0116) USER MOD Single : A 152 THR OG1 : rot 106:sc= 1.04 USER MOD Single : A 153 SER OG : rot 180:sc= -0.198 USER MOD Single : A 154 LYS NZ :NH3+ 179:sc= 1.37 (180deg=1.32) USER MOD Single : A 155 LYS NZ :NH3+ 165:sc= -0.0546 (180deg=-0.185) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 161 CYS SG : rot 180:sc= -1.63 USER MOD Single : A 163 GLN : amide:sc= -0.995 K(o=-0.99,f=-4.8!) USER MOD ----------------------------------------------------------------- ATOM 18 N VAL A 2 3.645 2.036 -1.412 1.00 55.42 N ATOM 19 CA VAL A 2 4.260 3.260 -0.913 1.00 54.41 C ATOM 20 C VAL A 2 3.276 4.424 -0.950 1.00 13.41 C ATOM 21 O VAL A 2 2.611 4.657 -1.959 1.00 20.43 O ATOM 22 CB VAL A 2 5.510 3.634 -1.731 1.00 25.24 C ATOM 23 CG1 VAL A 2 5.939 5.062 -1.429 1.00 24.54 C ATOM 24 CG2 VAL A 2 6.642 2.657 -1.448 1.00 41.31 C ATOM 0 HA VAL A 2 4.554 3.068 0.119 1.00 54.41 H new ATOM 0 HB VAL A 2 5.262 3.572 -2.791 1.00 25.24 H new ATOM 0 HG11 VAL A 2 6.824 5.308 -2.016 1.00 24.54 H new ATOM 0 HG12 VAL A 2 5.131 5.747 -1.686 1.00 24.54 H new ATOM 0 HG13 VAL A 2 6.170 5.156 -0.368 1.00 24.54 H new ATOM 0 HG21 VAL A 2 7.518 2.935 -2.034 1.00 41.31 H new ATOM 0 HG22 VAL A 2 6.891 2.686 -0.387 1.00 41.31 H new ATOM 0 HG23 VAL A 2 6.329 1.649 -1.720 1.00 41.31 H new ATOM 34 N ASN A 3 3.189 5.154 0.158 1.00 72.23 N ATOM 35 CA ASN A 3 2.285 6.295 0.252 1.00 25.14 C ATOM 36 C ASN A 3 3.054 7.608 0.135 1.00 34.13 C ATOM 37 O ASN A 3 4.232 7.700 0.481 1.00 35.24 O ATOM 38 CB ASN A 3 1.518 6.256 1.576 1.00 44.23 C ATOM 39 CG ASN A 3 0.211 5.497 1.464 1.00 74.52 C ATOM 40 OD1 ASN A 3 -0.581 5.732 0.551 1.00 63.05 O ATOM 41 ND2 ASN A 3 -0.022 4.579 2.396 1.00 53.45 N ATOM 0 H ASN A 3 3.733 4.976 1.002 1.00 72.23 H new ATOM 0 HA ASN A 3 1.575 6.235 -0.573 1.00 25.14 H new ATOM 0 HB2 ASN A 3 2.141 5.791 2.340 1.00 44.23 H new ATOM 0 HB3 ASN A 3 1.316 7.275 1.906 1.00 44.23 H new ATOM 0 HD21 ASN A 3 -0.885 4.036 2.373 1.00 53.45 H new ATOM 0 HD22 ASN A 3 0.662 4.417 3.135 1.00 53.45 H new ATOM 48 N PRO A 4 2.372 8.650 -0.364 1.00 31.32 N ATOM 49 CA PRO A 4 2.970 9.977 -0.537 1.00 74.02 C ATOM 50 C PRO A 4 3.243 10.668 0.794 1.00 12.03 C ATOM 51 O PRO A 4 2.502 10.491 1.762 1.00 54.12 O ATOM 52 CB PRO A 4 1.908 10.743 -1.329 1.00 54.55 C ATOM 53 CG PRO A 4 0.624 10.063 -1.000 1.00 22.34 C ATOM 54 CD PRO A 4 0.965 8.612 -0.797 1.00 10.21 C ATOM 0 HA PRO A 4 3.939 9.926 -1.034 1.00 74.02 H new ATOM 0 HB2 PRO A 4 1.883 11.795 -1.043 1.00 54.55 H new ATOM 0 HB3 PRO A 4 2.111 10.708 -2.399 1.00 54.55 H new ATOM 0 HG2 PRO A 4 0.176 10.488 -0.102 1.00 22.34 H new ATOM 0 HG3 PRO A 4 -0.100 10.185 -1.806 1.00 22.34 H new ATOM 0 HD2 PRO A 4 0.325 8.150 -0.045 1.00 10.21 H new ATOM 0 HD3 PRO A 4 0.842 8.038 -1.715 1.00 10.21 H new ATOM 62 N THR A 5 4.312 11.457 0.838 1.00 52.30 N ATOM 63 CA THR A 5 4.683 12.175 2.051 1.00 22.40 C ATOM 64 C THR A 5 4.977 13.641 1.755 1.00 70.23 C ATOM 65 O THR A 5 5.571 13.970 0.728 1.00 42.20 O ATOM 66 CB THR A 5 5.916 11.541 2.723 1.00 42.41 C ATOM 67 OG1 THR A 5 5.516 10.435 3.538 1.00 35.24 O ATOM 68 CG2 THR A 5 6.654 12.564 3.574 1.00 52.22 C ATOM 0 H THR A 5 4.936 11.615 0.047 1.00 52.30 H new ATOM 0 HA THR A 5 3.833 12.109 2.730 1.00 22.40 H new ATOM 0 HB THR A 5 6.588 11.190 1.940 1.00 42.41 H new ATOM 0 HG1 THR A 5 6.306 10.037 3.960 1.00 35.24 H new ATOM 0 HG21 THR A 5 7.521 12.094 4.038 1.00 52.22 H new ATOM 0 HG22 THR A 5 6.984 13.391 2.945 1.00 52.22 H new ATOM 0 HG23 THR A 5 5.987 12.941 4.349 1.00 52.22 H new ATOM 76 N VAL A 6 4.558 14.519 2.661 1.00 74.54 N ATOM 77 CA VAL A 6 4.778 15.950 2.497 1.00 54.51 C ATOM 78 C VAL A 6 5.257 16.585 3.797 1.00 1.14 C ATOM 79 O VAL A 6 4.836 16.192 4.885 1.00 35.42 O ATOM 80 CB VAL A 6 3.495 16.666 2.032 1.00 62.23 C ATOM 81 CG1 VAL A 6 2.648 15.739 1.173 1.00 44.23 C ATOM 82 CG2 VAL A 6 2.703 17.169 3.229 1.00 54.35 C ATOM 0 H VAL A 6 4.064 14.264 3.516 1.00 74.54 H new ATOM 0 HA VAL A 6 5.547 16.066 1.734 1.00 54.51 H new ATOM 0 HB VAL A 6 3.778 17.526 1.425 1.00 62.23 H new ATOM 0 HG11 VAL A 6 1.746 16.262 0.854 1.00 44.23 H new ATOM 0 HG12 VAL A 6 3.219 15.432 0.297 1.00 44.23 H new ATOM 0 HG13 VAL A 6 2.371 14.858 1.752 1.00 44.23 H new ATOM 0 HG21 VAL A 6 1.800 17.672 2.883 1.00 54.35 H new ATOM 0 HG22 VAL A 6 2.428 16.326 3.864 1.00 54.35 H new ATOM 0 HG23 VAL A 6 3.312 17.870 3.800 1.00 54.35 H new ATOM 92 N PHE A 7 6.141 17.570 3.678 1.00 41.10 N ATOM 93 CA PHE A 7 6.679 18.260 4.845 1.00 42.04 C ATOM 94 C PHE A 7 6.002 19.614 5.036 1.00 20.11 C ATOM 95 O PHE A 7 5.333 20.119 4.135 1.00 75.13 O ATOM 96 CB PHE A 7 8.191 18.449 4.699 1.00 13.15 C ATOM 97 CG PHE A 7 8.568 19.572 3.776 1.00 4.24 C ATOM 98 CD1 PHE A 7 8.700 20.866 4.256 1.00 64.45 C ATOM 99 CD2 PHE A 7 8.792 19.334 2.430 1.00 41.41 C ATOM 100 CE1 PHE A 7 9.047 21.901 3.408 1.00 21.20 C ATOM 101 CE2 PHE A 7 9.139 20.366 1.578 1.00 65.34 C ATOM 102 CZ PHE A 7 9.268 21.650 2.068 1.00 41.42 C ATOM 0 H PHE A 7 6.500 17.908 2.785 1.00 41.10 H new ATOM 0 HA PHE A 7 6.479 17.647 5.724 1.00 42.04 H new ATOM 0 HB2 PHE A 7 8.622 18.637 5.682 1.00 13.15 H new ATOM 0 HB3 PHE A 7 8.631 17.523 4.330 1.00 13.15 H new ATOM 0 HD1 PHE A 7 8.530 21.067 5.303 1.00 64.45 H new ATOM 0 HD2 PHE A 7 8.694 18.331 2.042 1.00 41.41 H new ATOM 0 HE1 PHE A 7 9.145 22.905 3.793 1.00 21.20 H new ATOM 0 HE2 PHE A 7 9.309 20.168 0.530 1.00 65.34 H new ATOM 0 HZ PHE A 7 9.541 22.457 1.405 1.00 41.42 H new ATOM 112 N PHE A 8 6.181 20.196 6.217 1.00 13.32 N ATOM 113 CA PHE A 8 5.586 21.491 6.529 1.00 63.10 C ATOM 114 C PHE A 8 6.488 22.293 7.463 1.00 31.52 C ATOM 115 O PHE A 8 6.399 22.171 8.685 1.00 31.41 O ATOM 116 CB PHE A 8 4.209 21.303 7.168 1.00 30.33 C ATOM 117 CG PHE A 8 3.079 21.340 6.180 1.00 70.55 C ATOM 118 CD1 PHE A 8 2.789 20.233 5.398 1.00 51.05 C ATOM 119 CD2 PHE A 8 2.306 22.480 6.032 1.00 5.34 C ATOM 120 CE1 PHE A 8 1.750 20.265 4.486 1.00 22.34 C ATOM 121 CE2 PHE A 8 1.266 22.518 5.123 1.00 21.31 C ATOM 122 CZ PHE A 8 0.987 21.408 4.350 1.00 61.11 C ATOM 0 H PHE A 8 6.733 19.792 6.974 1.00 13.32 H new ATOM 0 HA PHE A 8 5.473 22.045 5.597 1.00 63.10 H new ATOM 0 HB2 PHE A 8 4.189 20.349 7.695 1.00 30.33 H new ATOM 0 HB3 PHE A 8 4.054 22.082 7.914 1.00 30.33 H new ATOM 0 HD1 PHE A 8 3.381 19.336 5.502 1.00 51.05 H new ATOM 0 HD2 PHE A 8 2.519 23.350 6.635 1.00 5.34 H new ATOM 0 HE1 PHE A 8 1.535 19.397 3.881 1.00 22.34 H new ATOM 0 HE2 PHE A 8 0.672 23.414 5.017 1.00 21.31 H new ATOM 0 HZ PHE A 8 0.173 21.434 3.640 1.00 61.11 H new ATOM 132 N ASP A 9 7.356 23.111 6.879 1.00 14.53 N ATOM 133 CA ASP A 9 8.274 23.934 7.658 1.00 11.12 C ATOM 134 C ASP A 9 7.514 24.792 8.666 1.00 62.45 C ATOM 135 O ASP A 9 6.942 25.823 8.311 1.00 72.53 O ATOM 136 CB ASP A 9 9.103 24.826 6.733 1.00 1.20 C ATOM 137 CG ASP A 9 10.533 24.984 7.210 1.00 4.12 C ATOM 138 OD1 ASP A 9 11.282 23.985 7.181 1.00 13.03 O ATOM 139 OD2 ASP A 9 10.904 26.107 7.613 1.00 23.43 O ATOM 0 H ASP A 9 7.443 23.222 5.869 1.00 14.53 H new ATOM 0 HA ASP A 9 8.943 23.270 8.205 1.00 11.12 H new ATOM 0 HB2 ASP A 9 9.103 24.403 5.729 1.00 1.20 H new ATOM 0 HB3 ASP A 9 8.635 25.808 6.665 1.00 1.20 H new ATOM 144 N ILE A 10 7.513 24.358 9.922 1.00 53.25 N ATOM 145 CA ILE A 10 6.823 25.086 10.980 1.00 44.35 C ATOM 146 C ILE A 10 7.679 26.234 11.504 1.00 10.42 C ATOM 147 O ILE A 10 8.775 26.019 12.020 1.00 44.40 O ATOM 148 CB ILE A 10 6.453 24.159 12.152 1.00 5.12 C ATOM 149 CG1 ILE A 10 5.560 23.016 11.665 1.00 1.32 C ATOM 150 CG2 ILE A 10 5.760 24.948 13.253 1.00 5.11 C ATOM 151 CD1 ILE A 10 4.243 23.484 11.086 1.00 22.41 C ATOM 0 H ILE A 10 7.982 23.507 10.232 1.00 53.25 H new ATOM 0 HA ILE A 10 5.909 25.487 10.543 1.00 44.35 H new ATOM 0 HB ILE A 10 7.369 23.731 12.560 1.00 5.12 H new ATOM 0 HG12 ILE A 10 6.097 22.443 10.909 1.00 1.32 H new ATOM 0 HG13 ILE A 10 5.362 22.340 12.497 1.00 1.32 H new ATOM 0 HG21 ILE A 10 5.505 24.279 14.075 1.00 5.11 H new ATOM 0 HG22 ILE A 10 6.427 25.730 13.616 1.00 5.11 H new ATOM 0 HG23 ILE A 10 4.851 25.402 12.858 1.00 5.11 H new ATOM 0 HD11 ILE A 10 3.661 22.621 10.761 1.00 22.41 H new ATOM 0 HD12 ILE A 10 3.686 24.032 11.846 1.00 22.41 H new ATOM 0 HD13 ILE A 10 4.432 24.136 10.233 1.00 22.41 H new ATOM 163 N ALA A 11 7.169 27.454 11.370 1.00 10.33 N ATOM 164 CA ALA A 11 7.884 28.636 11.834 1.00 3.53 C ATOM 165 C ALA A 11 7.233 29.217 13.085 1.00 31.41 C ATOM 166 O ALA A 11 6.055 28.979 13.351 1.00 55.24 O ATOM 167 CB ALA A 11 7.942 29.684 10.733 1.00 45.43 C ATOM 0 H ALA A 11 6.263 27.649 10.944 1.00 10.33 H new ATOM 0 HA ALA A 11 8.900 28.337 12.091 1.00 3.53 H new ATOM 0 HB1 ALA A 11 8.479 30.561 11.094 1.00 45.43 H new ATOM 0 HB2 ALA A 11 8.459 29.273 9.866 1.00 45.43 H new ATOM 0 HB3 ALA A 11 6.929 29.970 10.449 1.00 45.43 H new ATOM 173 N VAL A 12 8.008 29.978 13.851 1.00 14.03 N ATOM 174 CA VAL A 12 7.506 30.592 15.075 1.00 54.55 C ATOM 175 C VAL A 12 7.984 32.034 15.201 1.00 11.55 C ATOM 176 O VAL A 12 9.091 32.293 15.675 1.00 35.22 O ATOM 177 CB VAL A 12 7.949 29.804 16.321 1.00 0.44 C ATOM 178 CG1 VAL A 12 7.328 30.398 17.577 1.00 70.51 C ATOM 179 CG2 VAL A 12 7.584 28.334 16.180 1.00 44.44 C ATOM 0 H VAL A 12 8.986 30.184 13.646 1.00 14.03 H new ATOM 0 HA VAL A 12 6.418 30.577 15.014 1.00 54.55 H new ATOM 0 HB VAL A 12 9.033 29.878 16.410 1.00 0.44 H new ATOM 0 HG11 VAL A 12 7.652 29.828 18.448 1.00 70.51 H new ATOM 0 HG12 VAL A 12 7.645 31.435 17.684 1.00 70.51 H new ATOM 0 HG13 VAL A 12 6.241 30.356 17.500 1.00 70.51 H new ATOM 0 HG21 VAL A 12 7.905 27.792 17.070 1.00 44.44 H new ATOM 0 HG22 VAL A 12 6.504 28.237 16.065 1.00 44.44 H new ATOM 0 HG23 VAL A 12 8.081 27.918 15.304 1.00 44.44 H new ATOM 189 N ASP A 13 7.143 32.970 14.776 1.00 51.43 N ATOM 190 CA ASP A 13 7.479 34.388 14.843 1.00 73.00 C ATOM 191 C ASP A 13 8.651 34.713 13.922 1.00 55.10 C ATOM 192 O ASP A 13 9.446 35.608 14.205 1.00 54.33 O ATOM 193 CB ASP A 13 7.818 34.786 16.280 1.00 31.13 C ATOM 194 CG ASP A 13 6.987 35.957 16.768 1.00 24.32 C ATOM 195 OD1 ASP A 13 6.588 36.792 15.930 1.00 72.55 O ATOM 196 OD2 ASP A 13 6.736 36.038 17.989 1.00 63.44 O ATOM 0 H ASP A 13 6.223 32.773 14.381 1.00 51.43 H new ATOM 0 HA ASP A 13 6.611 34.958 14.511 1.00 73.00 H new ATOM 0 HB2 ASP A 13 7.658 33.932 16.938 1.00 31.13 H new ATOM 0 HB3 ASP A 13 8.875 35.043 16.343 1.00 31.13 H new ATOM 201 N GLY A 14 8.751 33.978 12.818 1.00 3.25 N ATOM 202 CA GLY A 14 9.829 34.203 11.873 1.00 25.35 C ATOM 203 C GLY A 14 10.940 33.180 12.007 1.00 20.31 C ATOM 204 O GLY A 14 11.702 32.956 11.067 1.00 33.41 O ATOM 0 H GLY A 14 8.105 33.231 12.562 1.00 3.25 H new ATOM 0 HA2 GLY A 14 9.431 34.172 10.859 1.00 25.35 H new ATOM 0 HA3 GLY A 14 10.239 35.202 12.025 1.00 25.35 H new ATOM 208 N GLU A 15 11.033 32.559 13.179 1.00 0.11 N ATOM 209 CA GLU A 15 12.061 31.556 13.432 1.00 10.31 C ATOM 210 C GLU A 15 11.528 30.151 13.166 1.00 52.53 C ATOM 211 O GLU A 15 10.619 29.667 13.840 1.00 54.02 O ATOM 212 CB GLU A 15 12.561 31.659 14.875 1.00 72.14 C ATOM 213 CG GLU A 15 12.946 30.320 15.482 1.00 15.31 C ATOM 214 CD GLU A 15 13.980 30.455 16.583 1.00 61.15 C ATOM 215 OE1 GLU A 15 14.340 31.601 16.923 1.00 53.23 O ATOM 216 OE2 GLU A 15 14.430 29.413 17.104 1.00 71.23 O ATOM 0 H GLU A 15 10.410 32.733 13.967 1.00 0.11 H new ATOM 0 HA GLU A 15 12.892 31.745 12.752 1.00 10.31 H new ATOM 0 HB2 GLU A 15 13.424 32.324 14.905 1.00 72.14 H new ATOM 0 HB3 GLU A 15 11.785 32.117 15.488 1.00 72.14 H new ATOM 0 HG2 GLU A 15 12.055 29.837 15.883 1.00 15.31 H new ATOM 0 HG3 GLU A 15 13.337 29.669 14.700 1.00 15.31 H new ATOM 223 N PRO A 16 12.106 29.481 12.158 1.00 21.12 N ATOM 224 CA PRO A 16 11.706 28.123 11.779 1.00 71.33 C ATOM 225 C PRO A 16 12.103 27.087 12.826 1.00 51.55 C ATOM 226 O PRO A 16 13.276 26.968 13.182 1.00 40.13 O ATOM 227 CB PRO A 16 12.466 27.881 10.472 1.00 22.13 C ATOM 228 CG PRO A 16 13.649 28.783 10.550 1.00 25.52 C ATOM 229 CD PRO A 16 13.195 29.997 11.312 1.00 25.33 C ATOM 0 HA PRO A 16 10.624 28.029 11.683 1.00 71.33 H new ATOM 0 HB2 PRO A 16 12.769 26.838 10.377 1.00 22.13 H new ATOM 0 HB3 PRO A 16 11.847 28.113 9.605 1.00 22.13 H new ATOM 0 HG2 PRO A 16 14.481 28.293 11.056 1.00 25.52 H new ATOM 0 HG3 PRO A 16 13.998 29.055 9.554 1.00 25.52 H new ATOM 0 HD2 PRO A 16 14.002 30.421 11.910 1.00 25.33 H new ATOM 0 HD3 PRO A 16 12.846 30.784 10.643 1.00 25.33 H new ATOM 237 N LEU A 17 11.119 26.341 13.315 1.00 64.41 N ATOM 238 CA LEU A 17 11.366 25.314 14.321 1.00 4.05 C ATOM 239 C LEU A 17 12.196 24.173 13.743 1.00 64.42 C ATOM 240 O LEU A 17 13.083 23.637 14.407 1.00 13.21 O ATOM 241 CB LEU A 17 10.042 24.773 14.863 1.00 53.24 C ATOM 242 CG LEU A 17 9.404 25.574 15.998 1.00 32.24 C ATOM 243 CD1 LEU A 17 7.926 25.238 16.124 1.00 52.15 C ATOM 244 CD2 LEU A 17 10.126 25.306 17.311 1.00 43.23 C ATOM 0 H LEU A 17 10.143 26.428 13.032 1.00 64.41 H new ATOM 0 HA LEU A 17 11.927 25.769 15.138 1.00 4.05 H new ATOM 0 HB2 LEU A 17 9.330 24.718 14.039 1.00 53.24 H new ATOM 0 HB3 LEU A 17 10.205 23.753 15.212 1.00 53.24 H new ATOM 0 HG LEU A 17 9.496 26.635 15.764 1.00 32.24 H new ATOM 0 HD11 LEU A 17 7.489 25.818 16.937 1.00 52.15 H new ATOM 0 HD12 LEU A 17 7.417 25.480 15.191 1.00 52.15 H new ATOM 0 HD13 LEU A 17 7.811 24.175 16.334 1.00 52.15 H new ATOM 0 HD21 LEU A 17 9.659 25.884 18.108 1.00 43.23 H new ATOM 0 HD22 LEU A 17 10.065 24.244 17.550 1.00 43.23 H new ATOM 0 HD23 LEU A 17 11.172 25.597 17.217 1.00 43.23 H new ATOM 256 N GLY A 18 11.904 23.806 12.499 1.00 54.24 N ATOM 257 CA GLY A 18 12.633 22.732 11.850 1.00 1.05 C ATOM 258 C GLY A 18 11.841 22.086 10.732 1.00 73.34 C ATOM 259 O GLY A 18 11.291 22.775 9.873 1.00 52.42 O ATOM 0 H GLY A 18 11.175 24.234 11.929 1.00 54.24 H new ATOM 0 HA2 GLY A 18 13.569 23.122 11.449 1.00 1.05 H new ATOM 0 HA3 GLY A 18 12.894 21.976 12.590 1.00 1.05 H new ATOM 263 N ARG A 19 11.783 20.758 10.740 1.00 61.02 N ATOM 264 CA ARG A 19 11.055 20.018 9.716 1.00 13.51 C ATOM 265 C ARG A 19 9.937 19.186 10.338 1.00 25.11 C ATOM 266 O ARG A 19 10.127 18.548 11.374 1.00 63.34 O ATOM 267 CB ARG A 19 12.008 19.111 8.937 1.00 62.22 C ATOM 268 CG ARG A 19 11.496 18.730 7.557 1.00 14.14 C ATOM 269 CD ARG A 19 11.485 17.222 7.364 1.00 61.22 C ATOM 270 NE ARG A 19 12.697 16.746 6.703 1.00 44.55 N ATOM 271 CZ ARG A 19 12.982 16.987 5.428 1.00 52.55 C ATOM 272 NH1 ARG A 19 12.145 17.695 4.681 1.00 63.24 N ATOM 273 NH2 ARG A 19 14.105 16.521 4.897 1.00 2.04 N ATOM 0 H ARG A 19 12.232 20.172 11.444 1.00 61.02 H new ATOM 0 HA ARG A 19 10.610 20.739 9.030 1.00 13.51 H new ATOM 0 HB2 ARG A 19 12.970 19.613 8.832 1.00 62.22 H new ATOM 0 HB3 ARG A 19 12.184 18.203 9.513 1.00 62.22 H new ATOM 0 HG2 ARG A 19 10.488 19.123 7.420 1.00 14.14 H new ATOM 0 HG3 ARG A 19 12.124 19.191 6.795 1.00 14.14 H new ATOM 0 HD2 ARG A 19 11.385 16.733 8.333 1.00 61.22 H new ATOM 0 HD3 ARG A 19 10.614 16.939 6.773 1.00 61.22 H new ATOM 0 HE ARG A 19 13.361 16.198 7.250 1.00 44.55 H new ATOM 0 HH11 ARG A 19 11.281 18.055 5.085 1.00 63.24 H new ATOM 0 HH12 ARG A 19 12.366 17.879 3.702 1.00 63.24 H new ATOM 0 HH21 ARG A 19 14.752 15.976 5.468 1.00 2.04 H new ATOM 0 HH22 ARG A 19 14.322 16.707 3.918 1.00 2.04 H new ATOM 287 N VAL A 20 8.772 19.198 9.699 1.00 33.25 N ATOM 288 CA VAL A 20 7.624 18.444 10.189 1.00 31.23 C ATOM 289 C VAL A 20 6.777 17.921 9.035 1.00 73.22 C ATOM 290 O VAL A 20 5.968 18.652 8.463 1.00 2.35 O ATOM 291 CB VAL A 20 6.740 19.304 11.112 1.00 71.21 C ATOM 292 CG1 VAL A 20 6.210 18.473 12.271 1.00 61.34 C ATOM 293 CG2 VAL A 20 7.516 20.509 11.621 1.00 52.24 C ATOM 0 H VAL A 20 8.598 19.721 8.841 1.00 33.25 H new ATOM 0 HA VAL A 20 8.018 17.602 10.757 1.00 31.23 H new ATOM 0 HB VAL A 20 5.888 19.666 10.536 1.00 71.21 H new ATOM 0 HG11 VAL A 20 5.588 19.098 12.912 1.00 61.34 H new ATOM 0 HG12 VAL A 20 5.616 17.645 11.884 1.00 61.34 H new ATOM 0 HG13 VAL A 20 7.046 18.080 12.849 1.00 61.34 H new ATOM 0 HG21 VAL A 20 6.876 21.105 12.271 1.00 52.24 H new ATOM 0 HG22 VAL A 20 8.388 20.170 12.181 1.00 52.24 H new ATOM 0 HG23 VAL A 20 7.841 21.116 10.776 1.00 52.24 H new ATOM 303 N SER A 21 6.967 16.650 8.697 1.00 64.45 N ATOM 304 CA SER A 21 6.223 16.028 7.607 1.00 11.44 C ATOM 305 C SER A 21 5.191 15.043 8.147 1.00 20.14 C ATOM 306 O SER A 21 5.150 14.764 9.346 1.00 54.11 O ATOM 307 CB SER A 21 7.179 15.311 6.652 1.00 13.21 C ATOM 308 OG SER A 21 6.584 14.140 6.119 1.00 1.44 O ATOM 0 H SER A 21 7.630 16.030 9.162 1.00 64.45 H new ATOM 0 HA SER A 21 5.700 16.814 7.062 1.00 11.44 H new ATOM 0 HB2 SER A 21 7.459 15.982 5.840 1.00 13.21 H new ATOM 0 HB3 SER A 21 8.096 15.049 7.179 1.00 13.21 H new ATOM 0 HG SER A 21 7.283 13.489 5.898 1.00 1.44 H new ATOM 314 N PHE A 22 4.359 14.518 7.254 1.00 51.41 N ATOM 315 CA PHE A 22 3.325 13.564 7.639 1.00 5.42 C ATOM 316 C PHE A 22 3.097 12.535 6.537 1.00 64.35 C ATOM 317 O PHE A 22 2.998 12.882 5.360 1.00 2.13 O ATOM 318 CB PHE A 22 2.017 14.295 7.949 1.00 22.11 C ATOM 319 CG PHE A 22 2.219 15.670 8.520 1.00 72.52 C ATOM 320 CD1 PHE A 22 2.541 16.736 7.696 1.00 65.31 C ATOM 321 CD2 PHE A 22 2.086 15.895 9.880 1.00 1.34 C ATOM 322 CE1 PHE A 22 2.727 18.002 8.218 1.00 43.12 C ATOM 323 CE2 PHE A 22 2.270 17.159 10.408 1.00 43.40 C ATOM 324 CZ PHE A 22 2.593 18.214 9.576 1.00 75.21 C ATOM 0 H PHE A 22 4.380 14.737 6.258 1.00 51.41 H new ATOM 0 HA PHE A 22 3.662 13.042 8.534 1.00 5.42 H new ATOM 0 HB2 PHE A 22 1.428 14.373 7.035 1.00 22.11 H new ATOM 0 HB3 PHE A 22 1.436 13.700 8.653 1.00 22.11 H new ATOM 0 HD1 PHE A 22 2.648 16.576 6.633 1.00 65.31 H new ATOM 0 HD2 PHE A 22 1.836 15.074 10.535 1.00 1.34 H new ATOM 0 HE1 PHE A 22 2.977 18.825 7.565 1.00 43.12 H new ATOM 0 HE2 PHE A 22 2.161 17.322 11.470 1.00 43.40 H new ATOM 0 HZ PHE A 22 2.740 19.202 9.987 1.00 75.21 H new ATOM 334 N GLU A 23 3.016 11.267 6.927 1.00 71.51 N ATOM 335 CA GLU A 23 2.801 10.186 5.971 1.00 1.24 C ATOM 336 C GLU A 23 1.316 10.024 5.658 1.00 24.25 C ATOM 337 O GLU A 23 0.576 9.395 6.415 1.00 32.44 O ATOM 338 CB GLU A 23 3.365 8.873 6.518 1.00 60.25 C ATOM 339 CG GLU A 23 2.904 7.646 5.748 1.00 5.12 C ATOM 340 CD GLU A 23 3.516 6.363 6.276 1.00 64.11 C ATOM 341 OE1 GLU A 23 4.532 6.442 6.998 1.00 12.32 O ATOM 342 OE2 GLU A 23 2.979 5.279 5.966 1.00 32.11 O ATOM 0 H GLU A 23 3.096 10.963 7.897 1.00 71.51 H new ATOM 0 HA GLU A 23 3.323 10.441 5.049 1.00 1.24 H new ATOM 0 HB2 GLU A 23 4.454 8.918 6.496 1.00 60.25 H new ATOM 0 HB3 GLU A 23 3.071 8.768 7.562 1.00 60.25 H new ATOM 0 HG2 GLU A 23 1.818 7.575 5.801 1.00 5.12 H new ATOM 0 HG3 GLU A 23 3.165 7.763 4.696 1.00 5.12 H new ATOM 349 N LEU A 24 0.888 10.596 4.539 1.00 50.02 N ATOM 350 CA LEU A 24 -0.508 10.516 4.124 1.00 15.05 C ATOM 351 C LEU A 24 -0.806 9.171 3.470 1.00 72.20 C ATOM 352 O LEU A 24 -0.261 8.848 2.414 1.00 23.15 O ATOM 353 CB LEU A 24 -0.839 11.652 3.155 1.00 52.10 C ATOM 354 CG LEU A 24 -0.523 13.066 3.644 1.00 24.34 C ATOM 355 CD1 LEU A 24 -0.096 13.950 2.483 1.00 61.31 C ATOM 356 CD2 LEU A 24 -1.725 13.665 4.359 1.00 32.51 C ATOM 0 H LEU A 24 1.488 11.121 3.902 1.00 50.02 H new ATOM 0 HA LEU A 24 -1.131 10.612 5.013 1.00 15.05 H new ATOM 0 HB2 LEU A 24 -0.295 11.480 2.226 1.00 52.10 H new ATOM 0 HB3 LEU A 24 -1.901 11.601 2.916 1.00 52.10 H new ATOM 0 HG LEU A 24 0.303 13.008 4.352 1.00 24.34 H new ATOM 0 HD11 LEU A 24 0.125 14.952 2.851 1.00 61.31 H new ATOM 0 HD12 LEU A 24 0.795 13.531 2.015 1.00 61.31 H new ATOM 0 HD13 LEU A 24 -0.901 14.002 1.750 1.00 61.31 H new ATOM 0 HD21 LEU A 24 -1.481 14.671 4.700 1.00 32.51 H new ATOM 0 HD22 LEU A 24 -2.571 13.709 3.674 1.00 32.51 H new ATOM 0 HD23 LEU A 24 -1.985 13.044 5.217 1.00 32.51 H new ATOM 368 N PHE A 25 -1.676 8.391 4.102 1.00 34.44 N ATOM 369 CA PHE A 25 -2.048 7.080 3.581 1.00 11.50 C ATOM 370 C PHE A 25 -3.011 7.216 2.405 1.00 12.23 C ATOM 371 O PHE A 25 -4.166 6.798 2.484 1.00 50.33 O ATOM 372 CB PHE A 25 -2.687 6.232 4.683 1.00 43.13 C ATOM 373 CG PHE A 25 -1.749 5.910 5.811 1.00 62.13 C ATOM 374 CD1 PHE A 25 -1.608 6.778 6.882 1.00 73.52 C ATOM 375 CD2 PHE A 25 -1.007 4.739 5.800 1.00 53.42 C ATOM 376 CE1 PHE A 25 -0.746 6.484 7.922 1.00 74.13 C ATOM 377 CE2 PHE A 25 -0.144 4.440 6.837 1.00 53.30 C ATOM 378 CZ PHE A 25 -0.013 5.314 7.899 1.00 43.14 C ATOM 0 H PHE A 25 -2.137 8.644 4.976 1.00 34.44 H new ATOM 0 HA PHE A 25 -1.142 6.585 3.231 1.00 11.50 H new ATOM 0 HB2 PHE A 25 -3.553 6.761 5.081 1.00 43.13 H new ATOM 0 HB3 PHE A 25 -3.053 5.302 4.249 1.00 43.13 H new ATOM 0 HD1 PHE A 25 -2.178 7.695 6.904 1.00 73.52 H new ATOM 0 HD2 PHE A 25 -1.105 4.053 4.972 1.00 53.42 H new ATOM 0 HE1 PHE A 25 -0.646 7.168 8.751 1.00 74.13 H new ATOM 0 HE2 PHE A 25 0.428 3.524 6.817 1.00 53.30 H new ATOM 0 HZ PHE A 25 0.662 5.082 8.710 1.00 43.14 H new ATOM 388 N ALA A 26 -2.527 7.804 1.316 1.00 1.12 N ATOM 389 CA ALA A 26 -3.343 7.994 0.124 1.00 50.24 C ATOM 390 C ALA A 26 -3.919 6.669 -0.364 1.00 42.24 C ATOM 391 O ALA A 26 -4.927 6.642 -1.070 1.00 34.01 O ATOM 392 CB ALA A 26 -2.524 8.653 -0.977 1.00 14.34 C ATOM 0 H ALA A 26 -1.573 8.157 1.235 1.00 1.12 H new ATOM 0 HA ALA A 26 -4.175 8.648 0.384 1.00 50.24 H new ATOM 0 HB1 ALA A 26 -3.146 8.789 -1.862 1.00 14.34 H new ATOM 0 HB2 ALA A 26 -2.166 9.623 -0.633 1.00 14.34 H new ATOM 0 HB3 ALA A 26 -1.673 8.019 -1.226 1.00 14.34 H new ATOM 398 N ASP A 27 -3.272 5.573 0.015 1.00 64.21 N ATOM 399 CA ASP A 27 -3.720 4.244 -0.384 1.00 61.31 C ATOM 400 C ASP A 27 -5.066 3.910 0.252 1.00 3.41 C ATOM 401 O ASP A 27 -5.907 3.250 -0.358 1.00 62.01 O ATOM 402 CB ASP A 27 -2.681 3.192 0.010 1.00 52.33 C ATOM 403 CG ASP A 27 -3.254 1.789 0.020 1.00 23.43 C ATOM 404 OD1 ASP A 27 -4.061 1.471 -0.878 1.00 31.24 O ATOM 405 OD2 ASP A 27 -2.895 1.008 0.927 1.00 70.10 O ATOM 0 H ASP A 27 -2.435 5.578 0.598 1.00 64.21 H new ATOM 0 HA ASP A 27 -3.839 4.238 -1.467 1.00 61.31 H new ATOM 0 HB2 ASP A 27 -1.843 3.234 -0.686 1.00 52.33 H new ATOM 0 HB3 ASP A 27 -2.286 3.427 0.998 1.00 52.33 H new ATOM 410 N LYS A 28 -5.263 4.371 1.483 1.00 62.22 N ATOM 411 CA LYS A 28 -6.506 4.123 2.203 1.00 21.52 C ATOM 412 C LYS A 28 -7.429 5.334 2.129 1.00 52.52 C ATOM 413 O LYS A 28 -8.652 5.200 2.177 1.00 61.10 O ATOM 414 CB LYS A 28 -6.212 3.781 3.666 1.00 74.33 C ATOM 415 CG LYS A 28 -6.038 2.293 3.920 1.00 55.35 C ATOM 416 CD LYS A 28 -4.665 1.810 3.484 1.00 12.11 C ATOM 417 CE LYS A 28 -4.669 0.320 3.179 1.00 55.00 C ATOM 418 NZ LYS A 28 -3.406 -0.339 3.613 1.00 52.44 N ATOM 0 H LYS A 28 -4.577 4.919 2.003 1.00 62.22 H new ATOM 0 HA LYS A 28 -7.007 3.278 1.732 1.00 21.52 H new ATOM 0 HB2 LYS A 28 -5.307 4.302 3.977 1.00 74.33 H new ATOM 0 HB3 LYS A 28 -7.025 4.155 4.288 1.00 74.33 H new ATOM 0 HG2 LYS A 28 -6.178 2.085 4.981 1.00 55.35 H new ATOM 0 HG3 LYS A 28 -6.807 1.739 3.382 1.00 55.35 H new ATOM 0 HD2 LYS A 28 -4.348 2.363 2.600 1.00 12.11 H new ATOM 0 HD3 LYS A 28 -3.938 2.020 4.269 1.00 12.11 H new ATOM 0 HE2 LYS A 28 -5.515 -0.151 3.680 1.00 55.00 H new ATOM 0 HE3 LYS A 28 -4.808 0.169 2.109 1.00 55.00 H new ATOM 0 HZ1 LYS A 28 -3.563 -1.363 3.708 1.00 52.44 H new ATOM 0 HZ2 LYS A 28 -2.664 -0.167 2.905 1.00 52.44 H new ATOM 0 HZ3 LYS A 28 -3.108 0.052 4.529 1.00 52.44 H new ATOM 432 N VAL A 29 -6.836 6.518 2.010 1.00 51.22 N ATOM 433 CA VAL A 29 -7.606 7.754 1.926 1.00 24.20 C ATOM 434 C VAL A 29 -7.054 8.672 0.842 1.00 44.43 C ATOM 435 O VAL A 29 -6.530 9.752 1.116 1.00 43.44 O ATOM 436 CB VAL A 29 -7.607 8.507 3.270 1.00 65.43 C ATOM 437 CG1 VAL A 29 -8.877 8.205 4.050 1.00 22.22 C ATOM 438 CG2 VAL A 29 -6.373 8.146 4.083 1.00 23.41 C ATOM 0 H VAL A 29 -5.825 6.647 1.970 1.00 51.22 H new ATOM 0 HA VAL A 29 -8.629 7.474 1.675 1.00 24.20 H new ATOM 0 HB VAL A 29 -7.580 9.578 3.067 1.00 65.43 H new ATOM 0 HG11 VAL A 29 -8.860 8.746 4.996 1.00 22.22 H new ATOM 0 HG12 VAL A 29 -9.744 8.518 3.469 1.00 22.22 H new ATOM 0 HG13 VAL A 29 -8.938 7.134 4.245 1.00 22.22 H new ATOM 0 HG21 VAL A 29 -6.390 8.687 5.029 1.00 23.41 H new ATOM 0 HG22 VAL A 29 -6.367 7.074 4.278 1.00 23.41 H new ATOM 0 HG23 VAL A 29 -5.477 8.419 3.525 1.00 23.41 H new ATOM 448 N PRO A 30 -7.173 8.236 -0.421 1.00 31.31 N ATOM 449 CA PRO A 30 -6.693 9.004 -1.573 1.00 42.31 C ATOM 450 C PRO A 30 -7.527 10.256 -1.823 1.00 70.04 C ATOM 451 O PRO A 30 -6.999 11.301 -2.202 1.00 43.55 O ATOM 452 CB PRO A 30 -6.838 8.023 -2.739 1.00 44.21 C ATOM 453 CG PRO A 30 -7.914 7.086 -2.314 1.00 32.42 C ATOM 454 CD PRO A 30 -7.787 6.958 -0.821 1.00 3.30 C ATOM 0 HA PRO A 30 -5.675 9.365 -1.426 1.00 42.31 H new ATOM 0 HB2 PRO A 30 -7.105 8.540 -3.661 1.00 44.21 H new ATOM 0 HB3 PRO A 30 -5.904 7.494 -2.929 1.00 44.21 H new ATOM 0 HG2 PRO A 30 -8.896 7.469 -2.591 1.00 32.42 H new ATOM 0 HG3 PRO A 30 -7.801 6.117 -2.800 1.00 32.42 H new ATOM 0 HD2 PRO A 30 -8.757 6.812 -0.346 1.00 3.30 H new ATOM 0 HD3 PRO A 30 -7.164 6.108 -0.542 1.00 3.30 H new ATOM 462 N LYS A 31 -8.833 10.143 -1.609 1.00 14.43 N ATOM 463 CA LYS A 31 -9.742 11.266 -1.809 1.00 42.20 C ATOM 464 C LYS A 31 -9.422 12.403 -0.844 1.00 52.40 C ATOM 465 O LYS A 31 -9.498 13.578 -1.205 1.00 43.42 O ATOM 466 CB LYS A 31 -11.192 10.815 -1.620 1.00 51.54 C ATOM 467 CG LYS A 31 -12.041 10.958 -2.872 1.00 22.40 C ATOM 468 CD LYS A 31 -11.573 10.020 -3.973 1.00 3.25 C ATOM 469 CE LYS A 31 -12.415 10.173 -5.230 1.00 65.02 C ATOM 470 NZ LYS A 31 -13.868 10.012 -4.948 1.00 22.22 N ATOM 0 H LYS A 31 -9.287 9.284 -1.297 1.00 14.43 H new ATOM 0 HA LYS A 31 -9.611 11.630 -2.828 1.00 42.20 H new ATOM 0 HB2 LYS A 31 -11.201 9.772 -1.302 1.00 51.54 H new ATOM 0 HB3 LYS A 31 -11.643 11.397 -0.817 1.00 51.54 H new ATOM 0 HG2 LYS A 31 -13.083 10.748 -2.632 1.00 22.40 H new ATOM 0 HG3 LYS A 31 -11.997 11.988 -3.227 1.00 22.40 H new ATOM 0 HD2 LYS A 31 -10.528 10.224 -4.207 1.00 3.25 H new ATOM 0 HD3 LYS A 31 -11.626 8.990 -3.622 1.00 3.25 H new ATOM 0 HE2 LYS A 31 -12.237 11.155 -5.669 1.00 65.02 H new ATOM 0 HE3 LYS A 31 -12.104 9.433 -5.967 1.00 65.02 H new ATOM 0 HZ1 LYS A 31 -14.381 9.869 -5.841 1.00 22.22 H new ATOM 0 HZ2 LYS A 31 -14.012 9.188 -4.330 1.00 22.22 H new ATOM 0 HZ3 LYS A 31 -14.227 10.866 -4.476 1.00 22.22 H new ATOM 484 N THR A 32 -9.063 12.047 0.386 1.00 53.24 N ATOM 485 CA THR A 32 -8.732 13.037 1.402 1.00 1.42 C ATOM 486 C THR A 32 -7.267 13.449 1.312 1.00 22.42 C ATOM 487 O THR A 32 -6.933 14.626 1.445 1.00 75.34 O ATOM 488 CB THR A 32 -9.018 12.505 2.819 1.00 1.31 C ATOM 489 OG1 THR A 32 -10.295 11.859 2.851 1.00 31.40 O ATOM 490 CG2 THR A 32 -8.990 13.635 3.837 1.00 14.33 C ATOM 0 H THR A 32 -8.994 11.080 0.702 1.00 53.24 H new ATOM 0 HA THR A 32 -9.363 13.906 1.214 1.00 1.42 H new ATOM 0 HB THR A 32 -8.241 11.786 3.077 1.00 1.31 H new ATOM 0 HG1 THR A 32 -10.239 11.051 3.402 1.00 31.40 H new ATOM 0 HG21 THR A 32 -9.195 13.235 4.830 1.00 14.33 H new ATOM 0 HG22 THR A 32 -8.007 14.106 3.831 1.00 14.33 H new ATOM 0 HG23 THR A 32 -9.748 14.375 3.580 1.00 14.33 H new ATOM 498 N ALA A 33 -6.395 12.471 1.086 1.00 75.14 N ATOM 499 CA ALA A 33 -4.966 12.732 0.975 1.00 2.32 C ATOM 500 C ALA A 33 -4.654 13.568 -0.262 1.00 14.34 C ATOM 501 O ALA A 33 -3.878 14.521 -0.198 1.00 14.00 O ATOM 502 CB ALA A 33 -4.191 11.423 0.938 1.00 13.24 C ATOM 0 H ALA A 33 -6.654 11.491 0.976 1.00 75.14 H new ATOM 0 HA ALA A 33 -4.657 13.300 1.853 1.00 2.32 H new ATOM 0 HB1 ALA A 33 -3.125 11.634 0.855 1.00 13.24 H new ATOM 0 HB2 ALA A 33 -4.380 10.862 1.853 1.00 13.24 H new ATOM 0 HB3 ALA A 33 -4.512 10.834 0.079 1.00 13.24 H new ATOM 508 N GLU A 34 -5.264 13.204 -1.385 1.00 54.23 N ATOM 509 CA GLU A 34 -5.050 13.921 -2.637 1.00 2.01 C ATOM 510 C GLU A 34 -5.217 15.425 -2.438 1.00 72.22 C ATOM 511 O GLU A 34 -4.588 16.226 -3.127 1.00 40.25 O ATOM 512 CB GLU A 34 -6.024 13.425 -3.708 1.00 10.53 C ATOM 513 CG GLU A 34 -5.916 14.178 -5.024 1.00 33.45 C ATOM 514 CD GLU A 34 -7.000 13.787 -6.009 1.00 55.11 C ATOM 515 OE1 GLU A 34 -8.191 13.997 -5.694 1.00 62.15 O ATOM 516 OE2 GLU A 34 -6.659 13.272 -7.094 1.00 73.01 O ATOM 0 H GLU A 34 -5.910 12.418 -1.454 1.00 54.23 H new ATOM 0 HA GLU A 34 -4.030 13.727 -2.967 1.00 2.01 H new ATOM 0 HB2 GLU A 34 -5.843 12.366 -3.889 1.00 10.53 H new ATOM 0 HB3 GLU A 34 -7.043 13.514 -3.330 1.00 10.53 H new ATOM 0 HG2 GLU A 34 -5.974 15.249 -4.831 1.00 33.45 H new ATOM 0 HG3 GLU A 34 -4.939 13.987 -5.469 1.00 33.45 H new ATOM 523 N ASN A 35 -6.071 15.799 -1.491 1.00 2.12 N ATOM 524 CA ASN A 35 -6.323 17.206 -1.201 1.00 44.24 C ATOM 525 C ASN A 35 -5.088 17.866 -0.595 1.00 41.21 C ATOM 526 O ASN A 35 -4.451 18.711 -1.224 1.00 4.52 O ATOM 527 CB ASN A 35 -7.511 17.348 -0.248 1.00 25.44 C ATOM 528 CG ASN A 35 -7.684 18.769 0.253 1.00 73.42 C ATOM 529 OD1 ASN A 35 -8.192 19.633 -0.462 1.00 62.43 O ATOM 530 ND2 ASN A 35 -7.262 19.017 1.487 1.00 31.32 N ATOM 0 H ASN A 35 -6.600 15.148 -0.911 1.00 2.12 H new ATOM 0 HA ASN A 35 -6.558 17.708 -2.140 1.00 44.24 H new ATOM 0 HB2 ASN A 35 -8.421 17.032 -0.757 1.00 25.44 H new ATOM 0 HB3 ASN A 35 -7.373 16.680 0.602 1.00 25.44 H new ATOM 0 HD21 ASN A 35 -7.353 19.955 1.878 1.00 31.32 H new ATOM 0 HD22 ASN A 35 -6.847 18.270 2.044 1.00 31.32 H new ATOM 537 N PHE A 36 -4.756 17.474 0.630 1.00 24.13 N ATOM 538 CA PHE A 36 -3.597 18.027 1.322 1.00 14.35 C ATOM 539 C PHE A 36 -2.332 17.860 0.486 1.00 75.43 C ATOM 540 O PHE A 36 -1.376 18.622 0.627 1.00 14.21 O ATOM 541 CB PHE A 36 -3.417 17.349 2.682 1.00 61.31 C ATOM 542 CG PHE A 36 -2.746 18.222 3.703 1.00 22.23 C ATOM 543 CD1 PHE A 36 -3.155 19.532 3.890 1.00 1.30 C ATOM 544 CD2 PHE A 36 -1.705 17.732 4.476 1.00 13.13 C ATOM 545 CE1 PHE A 36 -2.540 20.338 4.829 1.00 3.44 C ATOM 546 CE2 PHE A 36 -1.087 18.533 5.417 1.00 3.24 C ATOM 547 CZ PHE A 36 -1.503 19.838 5.593 1.00 15.33 C ATOM 0 H PHE A 36 -5.273 16.776 1.164 1.00 24.13 H new ATOM 0 HA PHE A 36 -3.771 19.092 1.475 1.00 14.35 H new ATOM 0 HB2 PHE A 36 -4.393 17.046 3.060 1.00 61.31 H new ATOM 0 HB3 PHE A 36 -2.830 16.440 2.551 1.00 61.31 H new ATOM 0 HD1 PHE A 36 -3.964 19.928 3.295 1.00 1.30 H new ATOM 0 HD2 PHE A 36 -1.373 16.713 4.341 1.00 13.13 H new ATOM 0 HE1 PHE A 36 -2.869 21.357 4.966 1.00 3.44 H new ATOM 0 HE2 PHE A 36 -0.279 18.139 6.015 1.00 3.24 H new ATOM 0 HZ PHE A 36 -1.019 20.466 6.326 1.00 15.33 H new ATOM 557 N ARG A 37 -2.335 16.856 -0.385 1.00 71.13 N ATOM 558 CA ARG A 37 -1.188 16.586 -1.244 1.00 0.23 C ATOM 559 C ARG A 37 -1.153 17.552 -2.424 1.00 53.33 C ATOM 560 O ARG A 37 -0.159 18.244 -2.644 1.00 74.33 O ATOM 561 CB ARG A 37 -1.232 15.144 -1.752 1.00 54.12 C ATOM 562 CG ARG A 37 0.141 14.548 -2.013 1.00 61.30 C ATOM 563 CD ARG A 37 0.207 13.876 -3.376 1.00 3.31 C ATOM 564 NE ARG A 37 -0.168 14.787 -4.454 1.00 15.43 N ATOM 565 CZ ARG A 37 -0.482 14.385 -5.680 1.00 41.12 C ATOM 566 NH1 ARG A 37 -0.465 13.094 -5.983 1.00 11.33 N ATOM 567 NH2 ARG A 37 -0.814 15.275 -6.607 1.00 65.11 N ATOM 0 H ARG A 37 -3.119 16.216 -0.514 1.00 71.13 H new ATOM 0 HA ARG A 37 -0.283 16.728 -0.654 1.00 0.23 H new ATOM 0 HB2 ARG A 37 -1.754 14.526 -1.021 1.00 54.12 H new ATOM 0 HB3 ARG A 37 -1.815 15.110 -2.673 1.00 54.12 H new ATOM 0 HG2 ARG A 37 0.896 15.332 -1.956 1.00 61.30 H new ATOM 0 HG3 ARG A 37 0.377 13.821 -1.236 1.00 61.30 H new ATOM 0 HD2 ARG A 37 1.218 13.506 -3.549 1.00 3.31 H new ATOM 0 HD3 ARG A 37 -0.455 13.010 -3.386 1.00 3.31 H new ATOM 0 HE ARG A 37 -0.190 15.787 -4.254 1.00 15.43 H new ATOM 0 HH11 ARG A 37 -0.210 12.407 -5.273 1.00 11.33 H new ATOM 0 HH12 ARG A 37 -0.707 12.788 -6.926 1.00 11.33 H new ATOM 0 HH21 ARG A 37 -0.828 16.269 -6.378 1.00 65.11 H new ATOM 0 HH22 ARG A 37 -1.055 14.965 -7.548 1.00 65.11 H new ATOM 581 N ALA A 38 -2.245 17.594 -3.181 1.00 33.53 N ATOM 582 CA ALA A 38 -2.340 18.475 -4.337 1.00 54.35 C ATOM 583 C ALA A 38 -1.957 19.905 -3.971 1.00 63.10 C ATOM 584 O ALA A 38 -1.369 20.627 -4.778 1.00 13.23 O ATOM 585 CB ALA A 38 -3.747 18.436 -4.917 1.00 2.34 C ATOM 0 H ALA A 38 -3.076 17.027 -3.013 1.00 33.53 H new ATOM 0 HA ALA A 38 -1.638 18.120 -5.091 1.00 54.35 H new ATOM 0 HB1 ALA A 38 -3.803 19.099 -5.780 1.00 2.34 H new ATOM 0 HB2 ALA A 38 -3.985 17.418 -5.225 1.00 2.34 H new ATOM 0 HB3 ALA A 38 -4.461 18.763 -4.161 1.00 2.34 H new ATOM 591 N LEU A 39 -2.292 20.308 -2.751 1.00 14.23 N ATOM 592 CA LEU A 39 -1.983 21.653 -2.277 1.00 53.02 C ATOM 593 C LEU A 39 -0.505 21.780 -1.926 1.00 5.13 C ATOM 594 O LEU A 39 0.221 22.571 -2.528 1.00 1.42 O ATOM 595 CB LEU A 39 -2.840 21.995 -1.057 1.00 55.02 C ATOM 596 CG LEU A 39 -4.341 22.141 -1.311 1.00 33.41 C ATOM 597 CD1 LEU A 39 -5.125 21.897 -0.031 1.00 32.42 C ATOM 598 CD2 LEU A 39 -4.655 23.518 -1.877 1.00 35.14 C ATOM 0 H LEU A 39 -2.778 19.723 -2.071 1.00 14.23 H new ATOM 0 HA LEU A 39 -2.209 22.355 -3.080 1.00 53.02 H new ATOM 0 HB2 LEU A 39 -2.693 21.219 -0.306 1.00 55.02 H new ATOM 0 HB3 LEU A 39 -2.472 22.927 -0.629 1.00 55.02 H new ATOM 0 HG LEU A 39 -4.640 21.392 -2.044 1.00 33.41 H new ATOM 0 HD11 LEU A 39 -6.191 22.005 -0.231 1.00 32.42 H new ATOM 0 HD12 LEU A 39 -4.924 20.889 0.332 1.00 32.42 H new ATOM 0 HD13 LEU A 39 -4.822 22.622 0.725 1.00 32.42 H new ATOM 0 HD21 LEU A 39 -5.728 23.604 -2.051 1.00 35.14 H new ATOM 0 HD22 LEU A 39 -4.340 24.283 -1.168 1.00 35.14 H new ATOM 0 HD23 LEU A 39 -4.122 23.655 -2.818 1.00 35.14 H new ATOM 610 N SER A 40 -0.064 20.994 -0.949 1.00 31.14 N ATOM 611 CA SER A 40 1.328 21.020 -0.516 1.00 21.53 C ATOM 612 C SER A 40 2.270 20.855 -1.705 1.00 32.03 C ATOM 613 O SER A 40 3.361 21.424 -1.732 1.00 5.54 O ATOM 614 CB SER A 40 1.586 19.914 0.510 1.00 13.22 C ATOM 615 OG SER A 40 0.917 20.184 1.730 1.00 53.32 O ATOM 0 H SER A 40 -0.651 20.331 -0.442 1.00 31.14 H new ATOM 0 HA SER A 40 1.521 21.988 -0.053 1.00 21.53 H new ATOM 0 HB2 SER A 40 1.249 18.957 0.111 1.00 13.22 H new ATOM 0 HB3 SER A 40 2.657 19.824 0.691 1.00 13.22 H new ATOM 0 HG SER A 40 1.577 20.365 2.432 1.00 53.32 H new ATOM 621 N THR A 41 1.839 20.071 -2.688 1.00 65.05 N ATOM 622 CA THR A 41 2.643 19.829 -3.880 1.00 51.22 C ATOM 623 C THR A 41 2.601 21.026 -4.823 1.00 45.13 C ATOM 624 O THR A 41 3.570 21.308 -5.527 1.00 5.32 O ATOM 625 CB THR A 41 2.162 18.577 -4.637 1.00 62.31 C ATOM 626 OG1 THR A 41 0.785 18.723 -5.002 1.00 3.11 O ATOM 627 CG2 THR A 41 2.336 17.329 -3.784 1.00 44.14 C ATOM 0 H THR A 41 0.938 19.593 -2.682 1.00 65.05 H new ATOM 0 HA THR A 41 3.668 19.670 -3.544 1.00 51.22 H new ATOM 0 HB THR A 41 2.766 18.470 -5.538 1.00 62.31 H new ATOM 0 HG1 THR A 41 0.217 18.465 -4.246 1.00 3.11 H new ATOM 0 HG21 THR A 41 1.990 16.457 -4.339 1.00 44.14 H new ATOM 0 HG22 THR A 41 3.389 17.204 -3.533 1.00 44.14 H new ATOM 0 HG23 THR A 41 1.754 17.430 -2.868 1.00 44.14 H new ATOM 635 N GLY A 42 1.472 21.728 -4.832 1.00 42.13 N ATOM 636 CA GLY A 42 1.326 22.887 -5.693 1.00 3.41 C ATOM 637 C GLY A 42 0.569 22.572 -6.967 1.00 72.34 C ATOM 638 O GLY A 42 0.113 23.477 -7.666 1.00 20.52 O ATOM 0 H GLY A 42 0.656 21.515 -4.258 1.00 42.13 H new ATOM 0 HA2 GLY A 42 0.805 23.675 -5.150 1.00 3.41 H new ATOM 0 HA3 GLY A 42 2.313 23.274 -5.947 1.00 3.41 H new ATOM 642 N GLU A 43 0.436 21.284 -7.272 1.00 12.54 N ATOM 643 CA GLU A 43 -0.270 20.853 -8.473 1.00 3.03 C ATOM 644 C GLU A 43 -1.715 21.343 -8.460 1.00 60.51 C ATOM 645 O GLU A 43 -2.373 21.397 -9.499 1.00 54.11 O ATOM 646 CB GLU A 43 -0.237 19.328 -8.590 1.00 32.21 C ATOM 647 CG GLU A 43 -1.115 18.620 -7.571 1.00 42.20 C ATOM 648 CD GLU A 43 -1.976 17.539 -8.194 1.00 30.31 C ATOM 649 OE1 GLU A 43 -1.487 16.844 -9.109 1.00 54.12 O ATOM 650 OE2 GLU A 43 -3.139 17.387 -7.765 1.00 52.20 O ATOM 0 H GLU A 43 0.808 20.522 -6.704 1.00 12.54 H new ATOM 0 HA GLU A 43 0.234 21.287 -9.336 1.00 3.03 H new ATOM 0 HB2 GLU A 43 -0.555 19.042 -9.592 1.00 32.21 H new ATOM 0 HB3 GLU A 43 0.791 18.985 -8.472 1.00 32.21 H new ATOM 0 HG2 GLU A 43 -0.485 18.178 -6.799 1.00 42.20 H new ATOM 0 HG3 GLU A 43 -1.756 19.351 -7.079 1.00 42.20 H new ATOM 657 N LYS A 44 -2.203 21.697 -7.276 1.00 41.23 N ATOM 658 CA LYS A 44 -3.569 22.183 -7.126 1.00 15.02 C ATOM 659 C LYS A 44 -3.857 23.312 -8.110 1.00 41.31 C ATOM 660 O LYS A 44 -4.996 23.505 -8.533 1.00 41.12 O ATOM 661 CB LYS A 44 -3.805 22.668 -5.694 1.00 14.13 C ATOM 662 CG LYS A 44 -4.363 24.079 -5.613 1.00 71.43 C ATOM 663 CD LYS A 44 -5.825 24.077 -5.199 1.00 0.41 C ATOM 664 CE LYS A 44 -6.685 23.310 -6.191 1.00 20.40 C ATOM 665 NZ LYS A 44 -7.289 24.208 -7.213 1.00 41.33 N ATOM 0 H LYS A 44 -1.672 21.656 -6.406 1.00 41.23 H new ATOM 0 HA LYS A 44 -4.247 21.357 -7.340 1.00 15.02 H new ATOM 0 HB2 LYS A 44 -4.494 21.985 -5.197 1.00 14.13 H new ATOM 0 HB3 LYS A 44 -2.864 22.627 -5.146 1.00 14.13 H new ATOM 0 HG2 LYS A 44 -3.782 24.661 -4.897 1.00 71.43 H new ATOM 0 HG3 LYS A 44 -4.259 24.569 -6.581 1.00 71.43 H new ATOM 0 HD2 LYS A 44 -5.923 23.630 -4.210 1.00 0.41 H new ATOM 0 HD3 LYS A 44 -6.184 25.103 -5.123 1.00 0.41 H new ATOM 0 HE2 LYS A 44 -6.079 22.552 -6.687 1.00 20.40 H new ATOM 0 HE3 LYS A 44 -7.476 22.785 -5.656 1.00 20.40 H new ATOM 0 HZ1 LYS A 44 -8.268 23.911 -7.401 1.00 41.33 H new ATOM 0 HZ2 LYS A 44 -7.286 25.187 -6.861 1.00 41.33 H new ATOM 0 HZ3 LYS A 44 -6.736 24.155 -8.092 1.00 41.33 H new ATOM 679 N GLY A 45 -2.815 24.056 -8.472 1.00 35.31 N ATOM 680 CA GLY A 45 -2.977 25.155 -9.405 1.00 14.42 C ATOM 681 C GLY A 45 -2.482 26.472 -8.840 1.00 54.23 C ATOM 682 O GLY A 45 -2.113 27.377 -9.589 1.00 15.41 O ATOM 0 H GLY A 45 -1.862 23.917 -8.135 1.00 35.31 H new ATOM 0 HA2 GLY A 45 -2.435 24.931 -10.324 1.00 14.42 H new ATOM 0 HA3 GLY A 45 -4.030 25.250 -9.671 1.00 14.42 H new ATOM 686 N PHE A 46 -2.476 26.581 -7.516 1.00 4.21 N ATOM 687 CA PHE A 46 -2.025 27.798 -6.851 1.00 42.43 C ATOM 688 C PHE A 46 -1.605 27.509 -5.413 1.00 43.22 C ATOM 689 O PHE A 46 -0.541 27.938 -4.967 1.00 72.34 O ATOM 690 CB PHE A 46 -3.132 28.854 -6.869 1.00 11.33 C ATOM 691 CG PHE A 46 -4.506 28.285 -6.659 1.00 52.24 C ATOM 692 CD1 PHE A 46 -5.240 27.800 -7.730 1.00 22.42 C ATOM 693 CD2 PHE A 46 -5.065 28.237 -5.392 1.00 63.43 C ATOM 694 CE1 PHE A 46 -6.505 27.275 -7.541 1.00 25.13 C ATOM 695 CE2 PHE A 46 -6.329 27.713 -5.197 1.00 64.30 C ATOM 696 CZ PHE A 46 -7.050 27.232 -6.273 1.00 1.54 C ATOM 0 H PHE A 46 -2.778 25.841 -6.882 1.00 4.21 H new ATOM 0 HA PHE A 46 -1.160 28.179 -7.393 1.00 42.43 H new ATOM 0 HB2 PHE A 46 -2.931 29.593 -6.093 1.00 11.33 H new ATOM 0 HB3 PHE A 46 -3.107 29.379 -7.824 1.00 11.33 H new ATOM 0 HD1 PHE A 46 -4.819 27.833 -8.724 1.00 22.42 H new ATOM 0 HD2 PHE A 46 -4.507 28.613 -4.547 1.00 63.43 H new ATOM 0 HE1 PHE A 46 -7.066 26.899 -8.384 1.00 25.13 H new ATOM 0 HE2 PHE A 46 -6.753 27.680 -4.204 1.00 64.30 H new ATOM 0 HZ PHE A 46 -8.038 26.823 -6.123 1.00 1.54 H new ATOM 706 N GLY A 47 -2.450 26.779 -4.692 1.00 24.25 N ATOM 707 CA GLY A 47 -2.150 26.445 -3.311 1.00 43.04 C ATOM 708 C GLY A 47 -2.002 27.674 -2.437 1.00 13.04 C ATOM 709 O GLY A 47 -2.684 28.678 -2.644 1.00 75.21 O ATOM 0 H GLY A 47 -3.337 26.413 -5.039 1.00 24.25 H new ATOM 0 HA2 GLY A 47 -2.944 25.813 -2.913 1.00 43.04 H new ATOM 0 HA3 GLY A 47 -1.229 25.863 -3.273 1.00 43.04 H new ATOM 713 N TYR A 48 -1.111 27.596 -1.455 1.00 21.21 N ATOM 714 CA TYR A 48 -0.879 28.709 -0.542 1.00 52.24 C ATOM 715 C TYR A 48 0.195 28.359 0.483 1.00 71.21 C ATOM 716 O TYR A 48 -0.096 27.789 1.535 1.00 63.43 O ATOM 717 CB TYR A 48 -2.177 29.089 0.172 1.00 53.10 C ATOM 718 CG TYR A 48 -2.412 30.581 0.248 1.00 32.22 C ATOM 719 CD1 TYR A 48 -3.018 31.263 -0.799 1.00 55.13 C ATOM 720 CD2 TYR A 48 -2.029 31.308 1.369 1.00 63.25 C ATOM 721 CE1 TYR A 48 -3.234 32.626 -0.734 1.00 73.02 C ATOM 722 CE2 TYR A 48 -2.242 32.671 1.443 1.00 21.20 C ATOM 723 CZ TYR A 48 -2.845 33.325 0.389 1.00 5.30 C ATOM 724 OH TYR A 48 -3.059 34.683 0.458 1.00 30.24 O ATOM 0 H TYR A 48 -0.537 26.773 -1.271 1.00 21.21 H new ATOM 0 HA TYR A 48 -0.532 29.560 -1.128 1.00 52.24 H new ATOM 0 HB2 TYR A 48 -3.016 28.623 -0.345 1.00 53.10 H new ATOM 0 HB3 TYR A 48 -2.159 28.681 1.182 1.00 53.10 H new ATOM 0 HD1 TYR A 48 -3.326 30.718 -1.679 1.00 55.13 H new ATOM 0 HD2 TYR A 48 -1.557 30.799 2.196 1.00 63.25 H new ATOM 0 HE1 TYR A 48 -3.705 33.141 -1.558 1.00 73.02 H new ATOM 0 HE2 TYR A 48 -1.938 33.221 2.321 1.00 21.20 H new ATOM 0 HH TYR A 48 -2.728 35.023 1.315 1.00 30.24 H new ATOM 734 N LYS A 49 1.439 28.705 0.169 1.00 74.13 N ATOM 735 CA LYS A 49 2.558 28.430 1.061 1.00 5.21 C ATOM 736 C LYS A 49 2.650 29.484 2.160 1.00 14.20 C ATOM 737 O LYS A 49 3.385 30.463 2.036 1.00 72.34 O ATOM 738 CB LYS A 49 3.868 28.387 0.271 1.00 4.31 C ATOM 739 CG LYS A 49 4.440 26.989 0.117 1.00 61.43 C ATOM 740 CD LYS A 49 3.843 26.272 -1.083 1.00 25.31 C ATOM 741 CE LYS A 49 3.995 24.763 -0.962 1.00 74.03 C ATOM 742 NZ LYS A 49 2.693 24.060 -1.131 1.00 72.15 N ATOM 0 H LYS A 49 1.697 29.177 -0.698 1.00 74.13 H new ATOM 0 HA LYS A 49 2.389 27.459 1.526 1.00 5.21 H new ATOM 0 HB2 LYS A 49 3.700 28.813 -0.718 1.00 4.31 H new ATOM 0 HB3 LYS A 49 4.604 29.019 0.769 1.00 4.31 H new ATOM 0 HG2 LYS A 49 5.523 27.048 0.005 1.00 61.43 H new ATOM 0 HG3 LYS A 49 4.244 26.413 1.021 1.00 61.43 H new ATOM 0 HD2 LYS A 49 2.787 26.527 -1.172 1.00 25.31 H new ATOM 0 HD3 LYS A 49 4.332 26.616 -1.994 1.00 25.31 H new ATOM 0 HE2 LYS A 49 4.700 24.407 -1.713 1.00 74.03 H new ATOM 0 HE3 LYS A 49 4.417 24.517 0.013 1.00 74.03 H new ATOM 0 HZ1 LYS A 49 2.860 23.106 -1.510 1.00 72.15 H new ATOM 0 HZ2 LYS A 49 2.215 23.988 -0.210 1.00 72.15 H new ATOM 0 HZ3 LYS A 49 2.093 24.595 -1.791 1.00 72.15 H new ATOM 756 N GLY A 50 1.898 29.276 3.237 1.00 1.42 N ATOM 757 CA GLY A 50 1.910 30.216 4.343 1.00 42.53 C ATOM 758 C GLY A 50 0.937 29.834 5.440 1.00 21.40 C ATOM 759 O GLY A 50 1.345 29.502 6.553 1.00 62.31 O ATOM 0 H GLY A 50 1.281 28.474 3.363 1.00 1.42 H new ATOM 0 HA2 GLY A 50 2.917 30.271 4.758 1.00 42.53 H new ATOM 0 HA3 GLY A 50 1.663 31.211 3.973 1.00 42.53 H new ATOM 763 N SER A 51 -0.354 29.881 5.127 1.00 1.01 N ATOM 764 CA SER A 51 -1.388 29.542 6.097 1.00 75.40 C ATOM 765 C SER A 51 -1.156 30.271 7.417 1.00 53.13 C ATOM 766 O SER A 51 -0.351 31.200 7.492 1.00 52.23 O ATOM 767 CB SER A 51 -1.418 28.031 6.335 1.00 73.42 C ATOM 768 OG SER A 51 -1.149 27.321 5.138 1.00 35.43 O ATOM 0 H SER A 51 -0.709 30.151 4.209 1.00 1.01 H new ATOM 0 HA SER A 51 -2.349 29.858 5.691 1.00 75.40 H new ATOM 0 HB2 SER A 51 -0.682 27.764 7.093 1.00 73.42 H new ATOM 0 HB3 SER A 51 -2.394 27.740 6.723 1.00 73.42 H new ATOM 0 HG SER A 51 -1.476 26.401 5.223 1.00 35.43 H new ATOM 774 N CYS A 52 -1.867 29.844 8.454 1.00 21.34 N ATOM 775 CA CYS A 52 -1.740 30.456 9.772 1.00 0.02 C ATOM 776 C CYS A 52 -2.248 29.515 10.860 1.00 44.10 C ATOM 777 O CYS A 52 -3.172 28.733 10.637 1.00 20.03 O ATOM 778 CB CYS A 52 -2.512 31.775 9.821 1.00 0.30 C ATOM 779 SG CYS A 52 -1.646 33.106 10.686 1.00 64.02 S ATOM 0 H CYS A 52 -2.537 29.077 8.408 1.00 21.34 H new ATOM 0 HA CYS A 52 -0.684 30.654 9.953 1.00 0.02 H new ATOM 0 HB2 CYS A 52 -2.725 32.097 8.802 1.00 0.30 H new ATOM 0 HB3 CYS A 52 -3.472 31.604 10.308 1.00 0.30 H new ATOM 0 HG CYS A 52 -2.378 34.180 10.672 1.00 64.02 H new ATOM 785 N PHE A 53 -1.636 29.595 12.037 1.00 1.20 N ATOM 786 CA PHE A 53 -2.024 28.749 13.159 1.00 21.14 C ATOM 787 C PHE A 53 -2.272 29.586 14.411 1.00 23.42 C ATOM 788 O PHE A 53 -1.380 30.288 14.889 1.00 61.21 O ATOM 789 CB PHE A 53 -0.941 27.705 13.436 1.00 24.55 C ATOM 790 CG PHE A 53 -0.783 26.697 12.333 1.00 3.53 C ATOM 791 CD1 PHE A 53 -0.345 27.088 11.078 1.00 2.22 C ATOM 792 CD2 PHE A 53 -1.072 25.360 12.552 1.00 43.14 C ATOM 793 CE1 PHE A 53 -0.199 26.164 10.061 1.00 35.43 C ATOM 794 CE2 PHE A 53 -0.928 24.431 11.539 1.00 61.25 C ATOM 795 CZ PHE A 53 -0.490 24.833 10.292 1.00 11.20 C ATOM 0 H PHE A 53 -0.869 30.237 12.238 1.00 1.20 H new ATOM 0 HA PHE A 53 -2.951 28.240 12.894 1.00 21.14 H new ATOM 0 HB2 PHE A 53 0.011 28.213 13.592 1.00 24.55 H new ATOM 0 HB3 PHE A 53 -1.179 27.183 14.363 1.00 24.55 H new ATOM 0 HD1 PHE A 53 -0.115 28.127 10.893 1.00 2.22 H new ATOM 0 HD2 PHE A 53 -1.414 25.040 13.525 1.00 43.14 H new ATOM 0 HE1 PHE A 53 0.142 26.482 9.087 1.00 35.43 H new ATOM 0 HE2 PHE A 53 -1.158 23.392 11.722 1.00 61.25 H new ATOM 0 HZ PHE A 53 -0.375 24.109 9.499 1.00 11.20 H new ATOM 805 N HIS A 54 -3.490 29.506 14.938 1.00 63.33 N ATOM 806 CA HIS A 54 -3.856 30.255 16.134 1.00 10.22 C ATOM 807 C HIS A 54 -4.818 29.452 17.005 1.00 4.10 C ATOM 808 O HIS A 54 -5.797 29.989 17.523 1.00 4.24 O ATOM 809 CB HIS A 54 -4.492 31.591 15.750 1.00 53.32 C ATOM 810 CG HIS A 54 -4.267 32.674 16.759 1.00 3.52 C ATOM 811 ND1 HIS A 54 -5.245 33.573 17.131 1.00 62.34 N ATOM 812 CD2 HIS A 54 -3.167 33.000 17.478 1.00 43.04 C ATOM 813 CE1 HIS A 54 -4.756 34.405 18.032 1.00 3.03 C ATOM 814 NE2 HIS A 54 -3.496 34.079 18.261 1.00 73.31 N ATOM 0 H HIS A 54 -4.240 28.930 14.555 1.00 63.33 H new ATOM 0 HA HIS A 54 -2.948 30.445 16.706 1.00 10.22 H new ATOM 0 HB2 HIS A 54 -4.090 31.912 14.789 1.00 53.32 H new ATOM 0 HB3 HIS A 54 -5.564 31.448 15.616 1.00 53.32 H new ATOM 0 HD2 HIS A 54 -2.209 32.503 17.442 1.00 43.04 H new ATOM 0 HE1 HIS A 54 -5.294 35.215 18.502 1.00 3.03 H new ATOM 0 HE2 HIS A 54 -2.870 34.552 18.913 1.00 73.31 H new ATOM 822 N ARG A 55 -4.532 28.164 17.160 1.00 21.55 N ATOM 823 CA ARG A 55 -5.372 27.287 17.967 1.00 75.54 C ATOM 824 C ARG A 55 -4.627 26.007 18.334 1.00 35.51 C ATOM 825 O ARG A 55 -4.915 24.934 17.801 1.00 15.51 O ATOM 826 CB ARG A 55 -6.658 26.942 17.212 1.00 12.44 C ATOM 827 CG ARG A 55 -7.592 26.026 17.987 1.00 42.33 C ATOM 828 CD ARG A 55 -8.566 26.819 18.844 1.00 4.32 C ATOM 829 NE ARG A 55 -8.107 28.187 19.071 1.00 41.22 N ATOM 830 CZ ARG A 55 -8.685 29.255 18.532 1.00 31.12 C ATOM 831 NH1 ARG A 55 -9.739 29.114 17.740 1.00 21.41 N ATOM 832 NH2 ARG A 55 -8.209 30.467 18.786 1.00 54.41 N ATOM 0 H ARG A 55 -3.725 27.704 16.738 1.00 21.55 H new ATOM 0 HA ARG A 55 -5.628 27.815 18.886 1.00 75.54 H new ATOM 0 HB2 ARG A 55 -7.186 27.864 16.970 1.00 12.44 H new ATOM 0 HB3 ARG A 55 -6.398 26.466 16.267 1.00 12.44 H new ATOM 0 HG2 ARG A 55 -8.147 25.397 17.291 1.00 42.33 H new ATOM 0 HG3 ARG A 55 -7.007 25.360 18.621 1.00 42.33 H new ATOM 0 HD2 ARG A 55 -9.542 26.840 18.359 1.00 4.32 H new ATOM 0 HD3 ARG A 55 -8.697 26.317 19.803 1.00 4.32 H new ATOM 0 HE ARG A 55 -7.299 28.330 19.676 1.00 41.22 H new ATOM 0 HH11 ARG A 55 -10.108 28.184 17.543 1.00 21.41 H new ATOM 0 HH12 ARG A 55 -10.181 29.936 17.328 1.00 21.41 H new ATOM 0 HH21 ARG A 55 -7.399 30.579 19.395 1.00 54.41 H new ATOM 0 HH22 ARG A 55 -8.653 31.286 18.372 1.00 54.41 H new ATOM 846 N ILE A 56 -3.669 26.127 19.247 1.00 53.14 N ATOM 847 CA ILE A 56 -2.884 24.980 19.685 1.00 0.11 C ATOM 848 C ILE A 56 -3.182 24.633 21.140 1.00 54.32 C ATOM 849 O ILE A 56 -2.868 25.402 22.049 1.00 41.23 O ATOM 850 CB ILE A 56 -1.374 25.239 19.530 1.00 2.43 C ATOM 851 CG1 ILE A 56 -0.922 24.913 18.105 1.00 5.05 C ATOM 852 CG2 ILE A 56 -0.589 24.418 20.542 1.00 1.12 C ATOM 853 CD1 ILE A 56 0.251 25.746 17.638 1.00 3.20 C ATOM 0 H ILE A 56 -3.418 27.007 19.698 1.00 53.14 H new ATOM 0 HA ILE A 56 -3.168 24.142 19.048 1.00 0.11 H new ATOM 0 HB ILE A 56 -1.180 26.295 19.720 1.00 2.43 H new ATOM 0 HG12 ILE A 56 -0.653 23.858 18.050 1.00 5.05 H new ATOM 0 HG13 ILE A 56 -1.759 25.064 17.423 1.00 5.05 H new ATOM 0 HG21 ILE A 56 0.477 24.612 20.420 1.00 1.12 H new ATOM 0 HG22 ILE A 56 -0.895 24.695 21.551 1.00 1.12 H new ATOM 0 HG23 ILE A 56 -0.786 23.358 20.381 1.00 1.12 H new ATOM 0 HD11 ILE A 56 0.517 25.461 16.620 1.00 3.20 H new ATOM 0 HD12 ILE A 56 -0.020 26.801 17.660 1.00 3.20 H new ATOM 0 HD13 ILE A 56 1.103 25.577 18.297 1.00 3.20 H new ATOM 865 N ILE A 57 -3.789 23.470 21.353 1.00 51.55 N ATOM 866 CA ILE A 57 -4.127 23.020 22.697 1.00 10.51 C ATOM 867 C ILE A 57 -3.171 21.930 23.168 1.00 33.51 C ATOM 868 O ILE A 57 -3.270 20.769 22.770 1.00 60.24 O ATOM 869 CB ILE A 57 -5.570 22.488 22.766 1.00 34.14 C ATOM 870 CG1 ILE A 57 -6.550 23.536 22.235 1.00 51.20 C ATOM 871 CG2 ILE A 57 -5.924 22.100 24.194 1.00 10.45 C ATOM 872 CD1 ILE A 57 -7.873 22.955 21.786 1.00 24.14 C ATOM 0 H ILE A 57 -4.057 22.823 20.612 1.00 51.55 H new ATOM 0 HA ILE A 57 -4.037 23.886 23.352 1.00 10.51 H new ATOM 0 HB ILE A 57 -5.643 21.599 22.139 1.00 34.14 H new ATOM 0 HG12 ILE A 57 -6.733 24.277 23.013 1.00 51.20 H new ATOM 0 HG13 ILE A 57 -6.090 24.060 21.397 1.00 51.20 H new ATOM 0 HG21 ILE A 57 -6.947 21.726 24.226 1.00 10.45 H new ATOM 0 HG22 ILE A 57 -5.242 21.323 24.539 1.00 10.45 H new ATOM 0 HG23 ILE A 57 -5.836 22.973 24.841 1.00 10.45 H new ATOM 0 HD11 ILE A 57 -8.517 23.755 21.422 1.00 24.14 H new ATOM 0 HD12 ILE A 57 -7.701 22.235 20.986 1.00 24.14 H new ATOM 0 HD13 ILE A 57 -8.355 22.455 22.626 1.00 24.14 H new ATOM 884 N PRO A 58 -2.224 22.308 24.039 1.00 41.33 N ATOM 885 CA PRO A 58 -1.233 21.376 24.585 1.00 11.54 C ATOM 886 C PRO A 58 -1.853 20.370 25.548 1.00 34.31 C ATOM 887 O PRO A 58 -1.925 20.610 26.752 1.00 4.34 O ATOM 888 CB PRO A 58 -0.256 22.292 25.326 1.00 4.41 C ATOM 889 CG PRO A 58 -1.057 23.499 25.675 1.00 71.13 C ATOM 890 CD PRO A 58 -2.047 23.675 24.557 1.00 54.31 C ATOM 0 HA PRO A 58 -0.767 20.774 23.805 1.00 11.54 H new ATOM 0 HB2 PRO A 58 0.140 21.808 26.219 1.00 4.41 H new ATOM 0 HB3 PRO A 58 0.597 22.551 24.699 1.00 4.41 H new ATOM 0 HG2 PRO A 58 -1.566 23.367 26.630 1.00 71.13 H new ATOM 0 HG3 PRO A 58 -0.418 24.377 25.773 1.00 71.13 H new ATOM 0 HD2 PRO A 58 -2.987 24.094 24.915 1.00 54.31 H new ATOM 0 HD3 PRO A 58 -1.670 24.350 23.789 1.00 54.31 H new ATOM 898 N GLY A 59 -2.301 19.240 25.008 1.00 31.15 N ATOM 899 CA GLY A 59 -2.909 18.213 25.835 1.00 53.35 C ATOM 900 C GLY A 59 -4.038 17.491 25.125 1.00 4.30 C ATOM 901 O GLY A 59 -4.421 16.388 25.516 1.00 51.45 O ATOM 0 H GLY A 59 -2.254 19.018 24.014 1.00 31.15 H new ATOM 0 HA2 GLY A 59 -2.148 17.490 26.130 1.00 53.35 H new ATOM 0 HA3 GLY A 59 -3.290 18.666 26.750 1.00 53.35 H new ATOM 905 N PHE A 60 -4.572 18.115 24.080 1.00 33.43 N ATOM 906 CA PHE A 60 -5.666 17.525 23.316 1.00 3.51 C ATOM 907 C PHE A 60 -5.317 17.457 21.832 1.00 21.32 C ATOM 908 O PHE A 60 -5.385 16.393 21.216 1.00 12.44 O ATOM 909 CB PHE A 60 -6.948 18.336 23.513 1.00 54.00 C ATOM 910 CG PHE A 60 -8.090 17.528 24.059 1.00 34.32 C ATOM 911 CD1 PHE A 60 -7.909 16.700 25.155 1.00 24.50 C ATOM 912 CD2 PHE A 60 -9.346 17.596 23.477 1.00 63.35 C ATOM 913 CE1 PHE A 60 -8.957 15.955 25.660 1.00 34.45 C ATOM 914 CE2 PHE A 60 -10.398 16.854 23.978 1.00 73.52 C ATOM 915 CZ PHE A 60 -10.204 16.031 25.070 1.00 3.03 C ATOM 0 H PHE A 60 -4.266 19.028 23.743 1.00 33.43 H new ATOM 0 HA PHE A 60 -5.826 16.510 23.681 1.00 3.51 H new ATOM 0 HB2 PHE A 60 -6.743 19.165 24.190 1.00 54.00 H new ATOM 0 HB3 PHE A 60 -7.244 18.770 22.558 1.00 54.00 H new ATOM 0 HD1 PHE A 60 -6.936 16.636 25.620 1.00 24.50 H new ATOM 0 HD2 PHE A 60 -9.504 18.236 22.622 1.00 63.35 H new ATOM 0 HE1 PHE A 60 -8.802 15.314 26.515 1.00 34.45 H new ATOM 0 HE2 PHE A 60 -11.372 16.917 23.516 1.00 73.52 H new ATOM 0 HZ PHE A 60 -11.025 15.448 25.462 1.00 3.03 H new ATOM 925 N MET A 61 -4.943 18.599 21.265 1.00 55.03 N ATOM 926 CA MET A 61 -4.583 18.669 19.853 1.00 33.23 C ATOM 927 C MET A 61 -4.355 20.114 19.421 1.00 25.24 C ATOM 928 O MET A 61 -4.630 21.048 20.176 1.00 61.24 O ATOM 929 CB MET A 61 -5.678 18.035 18.994 1.00 73.54 C ATOM 930 CG MET A 61 -7.083 18.460 19.388 1.00 34.30 C ATOM 931 SD MET A 61 -7.919 19.388 18.087 1.00 31.44 S ATOM 932 CE MET A 61 -7.542 21.069 18.575 1.00 4.20 C ATOM 0 H MET A 61 -4.881 19.488 21.761 1.00 55.03 H new ATOM 0 HA MET A 61 -3.655 18.116 19.713 1.00 33.23 H new ATOM 0 HB2 MET A 61 -5.507 18.298 17.950 1.00 73.54 H new ATOM 0 HB3 MET A 61 -5.602 16.950 19.066 1.00 73.54 H new ATOM 0 HG2 MET A 61 -7.671 17.575 19.633 1.00 34.30 H new ATOM 0 HG3 MET A 61 -7.034 19.070 20.290 1.00 34.30 H new ATOM 0 HE1 MET A 61 -7.354 21.672 17.687 1.00 4.20 H new ATOM 0 HE2 MET A 61 -8.386 21.486 19.125 1.00 4.20 H new ATOM 0 HE3 MET A 61 -6.657 21.073 19.211 1.00 4.20 H new ATOM 942 N CYS A 62 -3.850 20.290 18.205 1.00 2.15 N ATOM 943 CA CYS A 62 -3.583 21.622 17.674 1.00 11.11 C ATOM 944 C CYS A 62 -4.539 21.953 16.533 1.00 42.44 C ATOM 945 O CYS A 62 -5.646 21.420 16.463 1.00 2.24 O ATOM 946 CB CYS A 62 -2.136 21.720 17.189 1.00 72.24 C ATOM 947 SG CYS A 62 -0.930 20.972 18.309 1.00 44.42 S ATOM 0 H CYS A 62 -3.617 19.528 17.569 1.00 2.15 H new ATOM 0 HA CYS A 62 -3.739 22.344 18.475 1.00 11.11 H new ATOM 0 HB2 CYS A 62 -2.058 21.239 16.214 1.00 72.24 H new ATOM 0 HB3 CYS A 62 -1.882 22.770 17.048 1.00 72.24 H new ATOM 0 HG CYS A 62 0.264 21.103 17.812 1.00 44.42 H new ATOM 953 N GLN A 63 -4.103 22.838 15.641 1.00 34.20 N ATOM 954 CA GLN A 63 -4.922 23.242 14.504 1.00 61.10 C ATOM 955 C GLN A 63 -4.101 23.253 13.219 1.00 42.31 C ATOM 956 O GLN A 63 -2.871 23.250 13.256 1.00 31.40 O ATOM 957 CB GLN A 63 -5.526 24.626 14.750 1.00 70.54 C ATOM 958 CG GLN A 63 -6.649 24.979 13.788 1.00 70.53 C ATOM 959 CD GLN A 63 -7.733 23.919 13.742 1.00 43.41 C ATOM 960 OE1 GLN A 63 -8.222 23.470 14.779 1.00 64.33 O ATOM 961 NE2 GLN A 63 -8.115 23.515 12.536 1.00 25.42 N ATOM 0 H GLN A 63 -3.189 23.288 15.684 1.00 34.20 H new ATOM 0 HA GLN A 63 -5.728 22.517 14.392 1.00 61.10 H new ATOM 0 HB2 GLN A 63 -5.905 24.672 15.771 1.00 70.54 H new ATOM 0 HB3 GLN A 63 -4.740 25.376 14.668 1.00 70.54 H new ATOM 0 HG2 GLN A 63 -7.090 25.931 14.083 1.00 70.53 H new ATOM 0 HG3 GLN A 63 -6.237 25.115 12.788 1.00 70.53 H new ATOM 0 HE21 GLN A 63 -7.682 23.915 11.703 1.00 25.42 H new ATOM 0 HE22 GLN A 63 -8.841 22.805 12.442 1.00 25.42 H new ATOM 970 N GLY A 64 -4.790 23.267 12.082 1.00 70.12 N ATOM 971 CA GLY A 64 -4.108 23.278 10.801 1.00 41.00 C ATOM 972 C GLY A 64 -4.145 24.640 10.136 1.00 21.23 C ATOM 973 O GLY A 64 -3.405 25.545 10.518 1.00 1.34 O ATOM 0 H GLY A 64 -5.808 23.271 12.025 1.00 70.12 H new ATOM 0 HA2 GLY A 64 -3.071 22.974 10.942 1.00 41.00 H new ATOM 0 HA3 GLY A 64 -4.568 22.542 10.141 1.00 41.00 H new ATOM 1153 N ILE A 78 -9.690 21.936 -2.889 1.00 23.22 N ATOM 1154 CA ILE A 78 -9.401 21.533 -4.260 1.00 11.04 C ATOM 1155 C ILE A 78 -10.553 20.726 -4.849 1.00 43.05 C ATOM 1156 O ILE A 78 -10.349 19.880 -5.721 1.00 54.40 O ATOM 1157 CB ILE A 78 -8.109 20.698 -4.341 1.00 14.20 C ATOM 1158 CG1 ILE A 78 -8.350 19.292 -3.789 1.00 62.41 C ATOM 1159 CG2 ILE A 78 -6.985 21.386 -3.581 1.00 53.40 C ATOM 1160 CD1 ILE A 78 -7.487 18.232 -4.438 1.00 52.24 C ATOM 0 HA ILE A 78 -9.269 22.448 -4.837 1.00 11.04 H new ATOM 0 HB ILE A 78 -7.814 20.612 -5.387 1.00 14.20 H new ATOM 0 HG12 ILE A 78 -8.162 19.295 -2.715 1.00 62.41 H new ATOM 0 HG13 ILE A 78 -9.399 19.031 -3.928 1.00 62.41 H new ATOM 0 HG21 ILE A 78 -6.079 20.784 -3.648 1.00 53.40 H new ATOM 0 HG22 ILE A 78 -6.800 22.369 -4.015 1.00 53.40 H new ATOM 0 HG23 ILE A 78 -7.269 21.499 -2.535 1.00 53.40 H new ATOM 0 HD11 ILE A 78 -7.711 17.260 -3.998 1.00 52.24 H new ATOM 0 HD12 ILE A 78 -7.692 18.201 -5.508 1.00 52.24 H new ATOM 0 HD13 ILE A 78 -6.436 18.470 -4.276 1.00 52.24 H new ATOM 1172 N TYR A 79 -11.762 20.994 -4.370 1.00 10.00 N ATOM 1173 CA TYR A 79 -12.947 20.292 -4.849 1.00 50.52 C ATOM 1174 C TYR A 79 -14.214 20.885 -4.240 1.00 33.50 C ATOM 1175 O TYR A 79 -14.985 20.187 -3.582 1.00 72.15 O ATOM 1176 CB TYR A 79 -12.854 18.803 -4.514 1.00 12.04 C ATOM 1177 CG TYR A 79 -12.349 17.955 -5.659 1.00 32.43 C ATOM 1178 CD1 TYR A 79 -12.982 17.974 -6.896 1.00 4.15 C ATOM 1179 CD2 TYR A 79 -11.239 17.134 -5.504 1.00 5.02 C ATOM 1180 CE1 TYR A 79 -12.524 17.200 -7.944 1.00 50.01 C ATOM 1181 CE2 TYR A 79 -10.773 16.358 -6.547 1.00 60.43 C ATOM 1182 CZ TYR A 79 -11.419 16.394 -7.765 1.00 74.32 C ATOM 1183 OH TYR A 79 -10.960 15.622 -8.808 1.00 5.12 O ATOM 0 H TYR A 79 -11.948 21.692 -3.650 1.00 10.00 H new ATOM 0 HA TYR A 79 -12.996 20.411 -5.931 1.00 50.52 H new ATOM 0 HB2 TYR A 79 -12.193 18.673 -3.657 1.00 12.04 H new ATOM 0 HB3 TYR A 79 -13.839 18.444 -4.214 1.00 12.04 H new ATOM 0 HD1 TYR A 79 -13.847 18.605 -7.040 1.00 4.15 H new ATOM 0 HD2 TYR A 79 -10.732 17.102 -4.551 1.00 5.02 H new ATOM 0 HE1 TYR A 79 -13.028 17.226 -8.899 1.00 50.01 H new ATOM 0 HE2 TYR A 79 -9.908 15.727 -6.410 1.00 60.43 H new ATOM 0 HH TYR A 79 -10.174 15.114 -8.518 1.00 5.12 H new ATOM 1193 N GLY A 80 -14.423 22.178 -4.465 1.00 2.40 N ATOM 1194 CA GLY A 80 -15.597 22.844 -3.933 1.00 13.02 C ATOM 1195 C GLY A 80 -15.506 23.074 -2.437 1.00 61.33 C ATOM 1196 O GLY A 80 -14.416 23.052 -1.866 1.00 14.34 O ATOM 0 H GLY A 80 -13.800 22.777 -5.007 1.00 2.40 H new ATOM 0 HA2 GLY A 80 -15.727 23.801 -4.437 1.00 13.02 H new ATOM 0 HA3 GLY A 80 -16.481 22.245 -4.152 1.00 13.02 H new ATOM 1200 N GLU A 81 -16.653 23.296 -1.803 1.00 22.42 N ATOM 1201 CA GLU A 81 -16.696 23.533 -0.365 1.00 30.13 C ATOM 1202 C GLU A 81 -15.939 22.444 0.389 1.00 22.44 C ATOM 1203 O GLU A 81 -15.221 22.722 1.351 1.00 73.45 O ATOM 1204 CB GLU A 81 -18.146 23.592 0.122 1.00 64.34 C ATOM 1205 CG GLU A 81 -19.043 24.463 -0.742 1.00 65.40 C ATOM 1206 CD GLU A 81 -19.815 25.486 0.067 1.00 53.44 C ATOM 1207 OE1 GLU A 81 -20.324 25.127 1.149 1.00 3.41 O ATOM 1208 OE2 GLU A 81 -19.911 26.647 -0.384 1.00 12.42 O ATOM 0 H GLU A 81 -17.564 23.317 -2.262 1.00 22.42 H new ATOM 0 HA GLU A 81 -16.214 24.490 -0.166 1.00 30.13 H new ATOM 0 HB2 GLU A 81 -18.553 22.581 0.150 1.00 64.34 H new ATOM 0 HB3 GLU A 81 -18.162 23.970 1.144 1.00 64.34 H new ATOM 0 HG2 GLU A 81 -18.436 24.977 -1.487 1.00 65.40 H new ATOM 0 HG3 GLU A 81 -19.745 23.830 -1.285 1.00 65.40 H new ATOM 1215 N LYS A 82 -16.104 21.202 -0.053 1.00 35.31 N ATOM 1216 CA LYS A 82 -15.437 20.069 0.578 1.00 74.12 C ATOM 1217 C LYS A 82 -15.922 18.751 -0.019 1.00 1.25 C ATOM 1218 O LYS A 82 -16.729 18.739 -0.948 1.00 60.42 O ATOM 1219 CB LYS A 82 -15.687 20.080 2.088 1.00 61.13 C ATOM 1220 CG LYS A 82 -17.105 20.470 2.467 1.00 31.50 C ATOM 1221 CD LYS A 82 -18.119 19.470 1.936 1.00 40.23 C ATOM 1222 CE LYS A 82 -18.925 20.052 0.785 1.00 40.53 C ATOM 1223 NZ LYS A 82 -20.059 19.168 0.398 1.00 64.41 N ATOM 0 H LYS A 82 -16.695 20.954 -0.847 1.00 35.31 H new ATOM 0 HA LYS A 82 -14.367 20.160 0.393 1.00 74.12 H new ATOM 0 HB2 LYS A 82 -15.471 19.090 2.491 1.00 61.13 H new ATOM 0 HB3 LYS A 82 -14.990 20.774 2.558 1.00 61.13 H new ATOM 0 HG2 LYS A 82 -17.188 20.533 3.552 1.00 31.50 H new ATOM 0 HG3 LYS A 82 -17.329 21.461 2.072 1.00 31.50 H new ATOM 0 HD2 LYS A 82 -17.603 18.570 1.602 1.00 40.23 H new ATOM 0 HD3 LYS A 82 -18.793 19.172 2.739 1.00 40.23 H new ATOM 0 HE2 LYS A 82 -19.309 21.032 1.070 1.00 40.53 H new ATOM 0 HE3 LYS A 82 -18.273 20.203 -0.075 1.00 40.53 H new ATOM 0 HZ1 LYS A 82 -20.583 19.600 -0.389 1.00 64.41 H new ATOM 0 HZ2 LYS A 82 -19.691 18.241 0.102 1.00 64.41 H new ATOM 0 HZ3 LYS A 82 -20.696 19.044 1.211 1.00 64.41 H new ATOM 1237 N PHE A 83 -15.425 17.644 0.523 1.00 72.11 N ATOM 1238 CA PHE A 83 -15.808 16.321 0.044 1.00 31.33 C ATOM 1239 C PHE A 83 -16.801 15.664 0.998 1.00 32.45 C ATOM 1240 O PHE A 83 -17.373 16.323 1.866 1.00 41.11 O ATOM 1241 CB PHE A 83 -14.571 15.434 -0.112 1.00 50.03 C ATOM 1242 CG PHE A 83 -13.294 16.209 -0.265 1.00 5.01 C ATOM 1243 CD1 PHE A 83 -12.626 16.695 0.848 1.00 44.15 C ATOM 1244 CD2 PHE A 83 -12.760 16.451 -1.521 1.00 32.14 C ATOM 1245 CE1 PHE A 83 -11.450 17.409 0.710 1.00 53.23 C ATOM 1246 CE2 PHE A 83 -11.585 17.164 -1.665 1.00 1.14 C ATOM 1247 CZ PHE A 83 -10.929 17.643 -0.548 1.00 23.13 C ATOM 0 H PHE A 83 -14.757 17.637 1.294 1.00 72.11 H new ATOM 0 HA PHE A 83 -16.287 16.439 -0.928 1.00 31.33 H new ATOM 0 HB2 PHE A 83 -14.489 14.782 0.758 1.00 50.03 H new ATOM 0 HB3 PHE A 83 -14.703 14.790 -0.982 1.00 50.03 H new ATOM 0 HD1 PHE A 83 -13.028 16.514 1.834 1.00 44.15 H new ATOM 0 HD2 PHE A 83 -13.268 16.078 -2.398 1.00 32.14 H new ATOM 0 HE1 PHE A 83 -10.939 17.783 1.585 1.00 53.23 H new ATOM 0 HE2 PHE A 83 -11.180 17.346 -2.650 1.00 1.14 H new ATOM 0 HZ PHE A 83 -10.010 18.200 -0.658 1.00 23.13 H new ATOM 1257 N GLU A 84 -17.001 14.360 0.830 1.00 3.11 N ATOM 1258 CA GLU A 84 -17.926 13.614 1.675 1.00 4.13 C ATOM 1259 C GLU A 84 -17.182 12.581 2.516 1.00 65.50 C ATOM 1260 O GLU A 84 -16.020 12.271 2.253 1.00 65.45 O ATOM 1261 CB GLU A 84 -18.988 12.922 0.819 1.00 34.14 C ATOM 1262 CG GLU A 84 -18.435 11.811 -0.057 1.00 51.15 C ATOM 1263 CD GLU A 84 -18.501 12.147 -1.535 1.00 24.32 C ATOM 1264 OE1 GLU A 84 -19.512 12.742 -1.963 1.00 62.31 O ATOM 1265 OE2 GLU A 84 -17.542 11.814 -2.262 1.00 42.43 O ATOM 0 H GLU A 84 -16.535 13.799 0.117 1.00 3.11 H new ATOM 0 HA GLU A 84 -18.415 14.320 2.347 1.00 4.13 H new ATOM 0 HB2 GLU A 84 -19.757 12.509 1.472 1.00 34.14 H new ATOM 0 HB3 GLU A 84 -19.473 13.665 0.186 1.00 34.14 H new ATOM 0 HG2 GLU A 84 -17.400 11.615 0.221 1.00 51.15 H new ATOM 0 HG3 GLU A 84 -18.994 10.894 0.129 1.00 51.15 H new ATOM 1272 N ASP A 85 -17.859 12.052 3.529 1.00 74.44 N ATOM 1273 CA ASP A 85 -17.264 11.053 4.408 1.00 20.44 C ATOM 1274 C ASP A 85 -16.656 9.910 3.601 1.00 52.24 C ATOM 1275 O ASP A 85 -17.356 9.222 2.859 1.00 60.23 O ATOM 1276 CB ASP A 85 -18.313 10.506 5.378 1.00 2.34 C ATOM 1277 CG ASP A 85 -17.833 9.271 6.115 1.00 43.03 C ATOM 1278 OD1 ASP A 85 -16.631 9.209 6.448 1.00 50.11 O ATOM 1279 OD2 ASP A 85 -18.659 8.366 6.357 1.00 64.22 O ATOM 0 H ASP A 85 -18.821 12.299 3.762 1.00 74.44 H new ATOM 0 HA ASP A 85 -16.469 11.535 4.977 1.00 20.44 H new ATOM 0 HB2 ASP A 85 -18.573 11.279 6.101 1.00 2.34 H new ATOM 0 HB3 ASP A 85 -19.223 10.266 4.827 1.00 2.34 H new ATOM 1284 N GLU A 86 -15.350 9.716 3.750 1.00 5.10 N ATOM 1285 CA GLU A 86 -14.648 8.658 3.032 1.00 11.23 C ATOM 1286 C GLU A 86 -14.609 7.375 3.857 1.00 25.02 C ATOM 1287 O GLU A 86 -15.253 6.385 3.515 1.00 62.52 O ATOM 1288 CB GLU A 86 -13.224 9.101 2.690 1.00 52.34 C ATOM 1289 CG GLU A 86 -12.651 8.412 1.463 1.00 50.23 C ATOM 1290 CD GLU A 86 -11.168 8.124 1.595 1.00 72.01 C ATOM 1291 OE1 GLU A 86 -10.817 7.094 2.208 1.00 0.35 O ATOM 1292 OE2 GLU A 86 -10.359 8.927 1.086 1.00 53.34 O ATOM 0 H GLU A 86 -14.756 10.277 4.361 1.00 5.10 H new ATOM 0 HA GLU A 86 -15.190 8.459 2.108 1.00 11.23 H new ATOM 0 HB2 GLU A 86 -13.217 10.179 2.528 1.00 52.34 H new ATOM 0 HB3 GLU A 86 -12.576 8.903 3.544 1.00 52.34 H new ATOM 0 HG2 GLU A 86 -13.185 7.477 1.293 1.00 50.23 H new ATOM 0 HG3 GLU A 86 -12.819 9.039 0.587 1.00 50.23 H new ATOM 1299 N ASN A 87 -13.846 7.402 4.946 1.00 74.52 N ATOM 1300 CA ASN A 87 -13.721 6.241 5.820 1.00 71.44 C ATOM 1301 C ASN A 87 -12.844 6.560 7.027 1.00 53.35 C ATOM 1302 O ASN A 87 -12.304 7.661 7.141 1.00 62.42 O ATOM 1303 CB ASN A 87 -13.134 5.057 5.048 1.00 34.32 C ATOM 1304 CG ASN A 87 -11.784 5.377 4.437 1.00 22.34 C ATOM 1305 OD1 ASN A 87 -11.055 6.237 4.931 1.00 11.51 O ATOM 1306 ND2 ASN A 87 -11.444 4.683 3.357 1.00 1.30 N ATOM 0 H ASN A 87 -13.306 8.214 5.244 1.00 74.52 H new ATOM 0 HA ASN A 87 -14.717 5.977 6.177 1.00 71.44 H new ATOM 0 HB2 ASN A 87 -13.033 4.204 5.719 1.00 34.32 H new ATOM 0 HB3 ASN A 87 -13.826 4.762 4.259 1.00 34.32 H new ATOM 0 HD21 ASN A 87 -10.547 4.854 2.903 1.00 1.30 H new ATOM 0 HD22 ASN A 87 -12.080 3.979 2.982 1.00 1.30 H new ATOM 1313 N PHE A 88 -12.707 5.591 7.925 1.00 73.42 N ATOM 1314 CA PHE A 88 -11.896 5.768 9.124 1.00 54.22 C ATOM 1315 C PHE A 88 -10.999 4.556 9.358 1.00 51.41 C ATOM 1316 O PHE A 88 -10.771 4.151 10.498 1.00 33.20 O ATOM 1317 CB PHE A 88 -12.793 5.996 10.342 1.00 11.15 C ATOM 1318 CG PHE A 88 -14.232 6.246 9.990 1.00 64.11 C ATOM 1319 CD1 PHE A 88 -15.095 5.188 9.757 1.00 35.35 C ATOM 1320 CD2 PHE A 88 -14.720 7.539 9.891 1.00 32.35 C ATOM 1321 CE1 PHE A 88 -16.419 5.415 9.432 1.00 33.01 C ATOM 1322 CE2 PHE A 88 -16.043 7.772 9.567 1.00 53.11 C ATOM 1323 CZ PHE A 88 -16.894 6.709 9.338 1.00 72.41 C ATOM 0 H PHE A 88 -13.147 4.674 7.845 1.00 73.42 H new ATOM 0 HA PHE A 88 -11.263 6.643 8.979 1.00 54.22 H new ATOM 0 HB2 PHE A 88 -12.733 5.125 10.995 1.00 11.15 H new ATOM 0 HB3 PHE A 88 -12.413 6.846 10.909 1.00 11.15 H new ATOM 0 HD1 PHE A 88 -14.729 4.174 9.830 1.00 35.35 H new ATOM 0 HD2 PHE A 88 -14.059 8.374 10.069 1.00 32.35 H new ATOM 0 HE1 PHE A 88 -17.082 4.582 9.252 1.00 33.01 H new ATOM 0 HE2 PHE A 88 -16.411 8.785 9.493 1.00 53.11 H new ATOM 0 HZ PHE A 88 -17.929 6.889 9.086 1.00 72.41 H new ATOM 1333 N ILE A 89 -10.494 3.983 8.271 1.00 44.30 N ATOM 1334 CA ILE A 89 -9.621 2.819 8.357 1.00 33.25 C ATOM 1335 C ILE A 89 -8.521 3.032 9.392 1.00 60.24 C ATOM 1336 O ILE A 89 -8.091 2.091 10.060 1.00 34.41 O ATOM 1337 CB ILE A 89 -8.976 2.496 6.997 1.00 40.52 C ATOM 1338 CG1 ILE A 89 -10.045 2.427 5.904 1.00 32.34 C ATOM 1339 CG2 ILE A 89 -8.203 1.188 7.074 1.00 54.14 C ATOM 1340 CD1 ILE A 89 -9.654 1.556 4.731 1.00 33.31 C ATOM 0 H ILE A 89 -10.674 4.306 7.320 1.00 44.30 H new ATOM 0 HA ILE A 89 -10.245 1.979 8.661 1.00 33.25 H new ATOM 0 HB ILE A 89 -8.277 3.293 6.745 1.00 40.52 H new ATOM 0 HG12 ILE A 89 -10.971 2.047 6.336 1.00 32.34 H new ATOM 0 HG13 ILE A 89 -10.251 3.435 5.545 1.00 32.34 H new ATOM 0 HG21 ILE A 89 -7.753 0.974 6.105 1.00 54.14 H new ATOM 0 HG22 ILE A 89 -7.420 1.272 7.827 1.00 54.14 H new ATOM 0 HG23 ILE A 89 -8.882 0.380 7.346 1.00 54.14 H new ATOM 0 HD11 ILE A 89 -10.458 1.554 3.995 1.00 33.31 H new ATOM 0 HD12 ILE A 89 -8.745 1.948 4.274 1.00 33.31 H new ATOM 0 HD13 ILE A 89 -9.476 0.538 5.077 1.00 33.31 H new ATOM 1352 N LEU A 90 -8.070 4.275 9.520 1.00 63.45 N ATOM 1353 CA LEU A 90 -7.020 4.613 10.474 1.00 21.14 C ATOM 1354 C LEU A 90 -7.591 5.378 11.663 1.00 15.54 C ATOM 1355 O LEU A 90 -7.648 6.608 11.655 1.00 3.41 O ATOM 1356 CB LEU A 90 -5.932 5.445 9.793 1.00 71.22 C ATOM 1357 CG LEU A 90 -5.290 4.823 8.552 1.00 31.02 C ATOM 1358 CD1 LEU A 90 -4.555 5.881 7.745 1.00 43.15 C ATOM 1359 CD2 LEU A 90 -4.344 3.699 8.948 1.00 72.51 C ATOM 0 H LEU A 90 -8.415 5.065 8.975 1.00 63.45 H new ATOM 0 HA LEU A 90 -6.583 3.684 10.839 1.00 21.14 H new ATOM 0 HB2 LEU A 90 -6.361 6.407 9.512 1.00 71.22 H new ATOM 0 HB3 LEU A 90 -5.147 5.646 10.522 1.00 71.22 H new ATOM 0 HG LEU A 90 -6.080 4.404 7.929 1.00 31.02 H new ATOM 0 HD11 LEU A 90 -4.105 5.420 6.866 1.00 43.15 H new ATOM 0 HD12 LEU A 90 -5.258 6.652 7.430 1.00 43.15 H new ATOM 0 HD13 LEU A 90 -3.775 6.330 8.359 1.00 43.15 H new ATOM 0 HD21 LEU A 90 -3.896 3.268 8.053 1.00 72.51 H new ATOM 0 HD22 LEU A 90 -3.559 4.094 9.592 1.00 72.51 H new ATOM 0 HD23 LEU A 90 -4.899 2.928 9.483 1.00 72.51 H new ATOM 1371 N LYS A 91 -8.013 4.643 12.687 1.00 41.04 N ATOM 1372 CA LYS A 91 -8.577 5.251 13.886 1.00 51.43 C ATOM 1373 C LYS A 91 -7.475 5.780 14.798 1.00 63.31 C ATOM 1374 O LYS A 91 -6.440 5.136 14.975 1.00 31.45 O ATOM 1375 CB LYS A 91 -9.436 4.236 14.642 1.00 73.41 C ATOM 1376 CG LYS A 91 -10.911 4.299 14.283 1.00 2.30 C ATOM 1377 CD LYS A 91 -11.780 3.738 15.396 1.00 73.25 C ATOM 1378 CE LYS A 91 -11.875 4.701 16.569 1.00 60.11 C ATOM 1379 NZ LYS A 91 -11.192 4.168 17.780 1.00 0.22 N ATOM 0 H LYS A 91 -7.975 3.624 12.710 1.00 41.04 H new ATOM 0 HA LYS A 91 -9.203 6.089 13.578 1.00 51.43 H new ATOM 0 HB2 LYS A 91 -9.063 3.233 14.436 1.00 73.41 H new ATOM 0 HB3 LYS A 91 -9.324 4.404 15.713 1.00 73.41 H new ATOM 0 HG2 LYS A 91 -11.194 5.333 14.085 1.00 2.30 H new ATOM 0 HG3 LYS A 91 -11.087 3.739 13.365 1.00 2.30 H new ATOM 0 HD2 LYS A 91 -12.779 3.533 15.011 1.00 73.25 H new ATOM 0 HD3 LYS A 91 -11.368 2.788 15.736 1.00 73.25 H new ATOM 0 HE2 LYS A 91 -11.430 5.656 16.292 1.00 60.11 H new ATOM 0 HE3 LYS A 91 -12.923 4.892 16.798 1.00 60.11 H new ATOM 0 HZ1 LYS A 91 -10.948 4.954 18.415 1.00 0.22 H new ATOM 0 HZ2 LYS A 91 -11.826 3.508 18.274 1.00 0.22 H new ATOM 0 HZ3 LYS A 91 -10.324 3.669 17.498 1.00 0.22 H new ATOM 1393 N HIS A 92 -7.703 6.955 15.375 1.00 31.05 N ATOM 1394 CA HIS A 92 -6.730 7.569 16.272 1.00 65.44 C ATOM 1395 C HIS A 92 -6.264 6.574 17.331 1.00 13.33 C ATOM 1396 O HIS A 92 -6.966 6.320 18.311 1.00 74.35 O ATOM 1397 CB HIS A 92 -7.331 8.804 16.943 1.00 24.43 C ATOM 1398 CG HIS A 92 -8.809 8.706 17.164 1.00 62.14 C ATOM 1399 ND1 HIS A 92 -9.396 7.689 17.887 1.00 54.25 N ATOM 1400 CD2 HIS A 92 -9.820 9.506 16.753 1.00 41.52 C ATOM 1401 CE1 HIS A 92 -10.705 7.868 17.909 1.00 32.33 C ATOM 1402 NE2 HIS A 92 -10.988 8.964 17.229 1.00 71.10 N ATOM 0 H HIS A 92 -8.553 7.502 15.238 1.00 31.05 H new ATOM 0 HA HIS A 92 -5.867 7.872 15.679 1.00 65.44 H new ATOM 0 HB2 HIS A 92 -6.838 8.962 17.902 1.00 24.43 H new ATOM 0 HB3 HIS A 92 -7.121 9.680 16.329 1.00 24.43 H new ATOM 0 HD1 HIS A 92 -8.898 6.919 18.334 1.00 54.25 H new ATOM 0 HD2 HIS A 92 -9.726 10.404 16.161 1.00 41.52 H new ATOM 0 HE1 HIS A 92 -11.422 7.227 18.400 1.00 32.33 H new ATOM 1410 N THR A 93 -5.076 6.014 17.129 1.00 60.42 N ATOM 1411 CA THR A 93 -4.518 5.046 18.065 1.00 41.00 C ATOM 1412 C THR A 93 -3.244 5.578 18.711 1.00 64.31 C ATOM 1413 O THR A 93 -2.363 4.809 19.095 1.00 72.02 O ATOM 1414 CB THR A 93 -4.208 3.707 17.370 1.00 24.33 C ATOM 1415 OG1 THR A 93 -3.280 3.914 16.299 1.00 31.22 O ATOM 1416 CG2 THR A 93 -5.479 3.070 16.831 1.00 72.53 C ATOM 0 H THR A 93 -4.481 6.214 16.325 1.00 60.42 H new ATOM 0 HA THR A 93 -5.271 4.881 18.836 1.00 41.00 H new ATOM 0 HB THR A 93 -3.768 3.034 18.106 1.00 24.33 H new ATOM 0 HG1 THR A 93 -3.087 3.058 15.863 1.00 31.22 H new ATOM 0 HG21 THR A 93 -5.235 2.126 16.345 1.00 72.53 H new ATOM 0 HG22 THR A 93 -6.171 2.886 17.653 1.00 72.53 H new ATOM 0 HG23 THR A 93 -5.944 3.741 16.108 1.00 72.53 H new ATOM 1424 N GLY A 94 -3.152 6.899 18.828 1.00 1.05 N ATOM 1425 CA GLY A 94 -1.981 7.511 19.429 1.00 31.24 C ATOM 1426 C GLY A 94 -1.697 8.891 18.871 1.00 12.22 C ATOM 1427 O GLY A 94 -2.392 9.379 17.980 1.00 74.33 O ATOM 0 H GLY A 94 -3.867 7.556 18.517 1.00 1.05 H new ATOM 0 HA2 GLY A 94 -2.125 7.581 20.507 1.00 31.24 H new ATOM 0 HA3 GLY A 94 -1.115 6.870 19.264 1.00 31.24 H new ATOM 1431 N PRO A 95 -0.654 9.545 19.403 1.00 42.55 N ATOM 1432 CA PRO A 95 -0.256 10.888 18.968 1.00 75.24 C ATOM 1433 C PRO A 95 0.332 10.891 17.561 1.00 24.10 C ATOM 1434 O PRO A 95 0.545 9.836 16.964 1.00 11.32 O ATOM 1435 CB PRO A 95 0.806 11.293 19.993 1.00 74.02 C ATOM 1436 CG PRO A 95 1.360 10.004 20.494 1.00 52.14 C ATOM 1437 CD PRO A 95 0.219 9.025 20.468 1.00 32.04 C ATOM 0 HA PRO A 95 -1.105 11.570 18.922 1.00 75.24 H new ATOM 0 HB2 PRO A 95 1.583 11.907 19.537 1.00 74.02 H new ATOM 0 HB3 PRO A 95 0.371 11.879 20.803 1.00 74.02 H new ATOM 0 HG2 PRO A 95 2.182 9.662 19.865 1.00 52.14 H new ATOM 0 HG3 PRO A 95 1.756 10.115 21.503 1.00 52.14 H new ATOM 0 HD2 PRO A 95 0.562 8.014 20.248 1.00 32.04 H new ATOM 0 HD3 PRO A 95 -0.298 8.985 21.427 1.00 32.04 H new ATOM 1445 N GLY A 96 0.595 12.084 17.037 1.00 55.35 N ATOM 1446 CA GLY A 96 1.157 12.202 15.704 1.00 71.52 C ATOM 1447 C GLY A 96 0.210 11.705 14.629 1.00 0.32 C ATOM 1448 O GLY A 96 0.645 11.171 13.609 1.00 75.34 O ATOM 0 H GLY A 96 0.429 12.971 17.512 1.00 55.35 H new ATOM 0 HA2 GLY A 96 1.407 13.245 15.510 1.00 71.52 H new ATOM 0 HA3 GLY A 96 2.087 11.636 15.654 1.00 71.52 H new ATOM 1452 N ILE A 97 -1.087 11.880 14.859 1.00 41.52 N ATOM 1453 CA ILE A 97 -2.097 11.446 13.902 1.00 31.32 C ATOM 1454 C ILE A 97 -2.703 12.635 13.164 1.00 20.41 C ATOM 1455 O ILE A 97 -2.998 13.668 13.766 1.00 44.44 O ATOM 1456 CB ILE A 97 -3.224 10.656 14.594 1.00 54.44 C ATOM 1457 CG1 ILE A 97 -2.717 9.283 15.037 1.00 20.22 C ATOM 1458 CG2 ILE A 97 -4.418 10.511 13.661 1.00 23.52 C ATOM 1459 CD1 ILE A 97 -2.179 8.441 13.901 1.00 52.51 C ATOM 0 H ILE A 97 -1.463 12.319 15.699 1.00 41.52 H new ATOM 0 HA ILE A 97 -1.595 10.796 13.186 1.00 31.32 H new ATOM 0 HB ILE A 97 -3.543 11.206 15.479 1.00 54.44 H new ATOM 0 HG12 ILE A 97 -1.933 9.418 15.782 1.00 20.22 H new ATOM 0 HG13 ILE A 97 -3.530 8.744 15.524 1.00 20.22 H new ATOM 0 HG21 ILE A 97 -5.206 9.951 14.163 1.00 23.52 H new ATOM 0 HG22 ILE A 97 -4.791 11.499 13.391 1.00 23.52 H new ATOM 0 HG23 ILE A 97 -4.113 9.979 12.760 1.00 23.52 H new ATOM 0 HD11 ILE A 97 -1.837 7.482 14.289 1.00 52.51 H new ATOM 0 HD12 ILE A 97 -2.967 8.275 13.166 1.00 52.51 H new ATOM 0 HD13 ILE A 97 -1.345 8.959 13.428 1.00 52.51 H new ATOM 1471 N LEU A 98 -2.888 12.481 11.858 1.00 73.33 N ATOM 1472 CA LEU A 98 -3.462 13.541 11.036 1.00 3.11 C ATOM 1473 C LEU A 98 -4.906 13.222 10.665 1.00 33.32 C ATOM 1474 O LEU A 98 -5.261 12.063 10.450 1.00 63.33 O ATOM 1475 CB LEU A 98 -2.629 13.737 9.768 1.00 0.41 C ATOM 1476 CG LEU A 98 -1.980 15.111 9.597 1.00 2.34 C ATOM 1477 CD1 LEU A 98 -1.566 15.330 8.150 1.00 11.24 C ATOM 1478 CD2 LEU A 98 -2.928 16.210 10.055 1.00 73.11 C ATOM 0 H LEU A 98 -2.649 11.632 11.345 1.00 73.33 H new ATOM 0 HA LEU A 98 -3.452 14.463 11.617 1.00 3.11 H new ATOM 0 HB2 LEU A 98 -1.843 12.982 9.753 1.00 0.41 H new ATOM 0 HB3 LEU A 98 -3.268 13.549 8.905 1.00 0.41 H new ATOM 0 HG LEU A 98 -1.085 15.148 10.219 1.00 2.34 H new ATOM 0 HD11 LEU A 98 -1.106 16.313 8.048 1.00 11.24 H new ATOM 0 HD12 LEU A 98 -0.850 14.562 7.856 1.00 11.24 H new ATOM 0 HD13 LEU A 98 -2.445 15.272 7.507 1.00 11.24 H new ATOM 0 HD21 LEU A 98 -2.449 17.181 9.926 1.00 73.11 H new ATOM 0 HD22 LEU A 98 -3.841 16.174 9.461 1.00 73.11 H new ATOM 0 HD23 LEU A 98 -3.174 16.064 11.107 1.00 73.11 H new ATOM 1490 N SER A 99 -5.736 14.258 10.591 1.00 64.24 N ATOM 1491 CA SER A 99 -7.143 14.088 10.247 1.00 65.41 C ATOM 1492 C SER A 99 -7.728 15.385 9.698 1.00 74.23 C ATOM 1493 O SER A 99 -6.996 16.291 9.302 1.00 64.45 O ATOM 1494 CB SER A 99 -7.938 13.635 11.473 1.00 64.50 C ATOM 1495 OG SER A 99 -8.695 12.471 11.188 1.00 12.32 O ATOM 0 H SER A 99 -5.458 15.224 10.765 1.00 64.24 H new ATOM 0 HA SER A 99 -7.213 13.323 9.474 1.00 65.41 H new ATOM 0 HB2 SER A 99 -7.256 13.436 12.299 1.00 64.50 H new ATOM 0 HB3 SER A 99 -8.604 14.436 11.795 1.00 64.50 H new ATOM 0 HG SER A 99 -9.312 12.292 11.928 1.00 12.32 H new ATOM 1501 N MET A 100 -9.055 15.466 9.678 1.00 63.35 N ATOM 1502 CA MET A 100 -9.740 16.652 9.178 1.00 11.11 C ATOM 1503 C MET A 100 -10.671 17.230 10.240 1.00 63.33 C ATOM 1504 O MET A 100 -11.329 16.490 10.970 1.00 72.20 O ATOM 1505 CB MET A 100 -10.535 16.314 7.915 1.00 11.44 C ATOM 1506 CG MET A 100 -11.384 15.061 8.049 1.00 35.12 C ATOM 1507 SD MET A 100 -12.990 15.387 8.803 1.00 24.34 S ATOM 1508 CE MET A 100 -13.953 14.025 8.151 1.00 40.14 C ATOM 0 H MET A 100 -9.676 14.725 10.002 1.00 63.35 H new ATOM 0 HA MET A 100 -8.986 17.401 8.934 1.00 11.11 H new ATOM 0 HB2 MET A 100 -11.181 17.156 7.666 1.00 11.44 H new ATOM 0 HB3 MET A 100 -9.843 16.187 7.083 1.00 11.44 H new ATOM 0 HG2 MET A 100 -11.533 14.620 7.063 1.00 35.12 H new ATOM 0 HG3 MET A 100 -10.848 14.326 8.649 1.00 35.12 H new ATOM 0 HE1 MET A 100 -14.889 14.405 7.741 1.00 40.14 H new ATOM 0 HE2 MET A 100 -13.389 13.524 7.364 1.00 40.14 H new ATOM 0 HE3 MET A 100 -14.168 13.316 8.950 1.00 40.14 H new ATOM 1518 N ALA A 101 -10.720 18.555 10.320 1.00 45.44 N ATOM 1519 CA ALA A 101 -11.571 19.231 11.291 1.00 43.43 C ATOM 1520 C ALA A 101 -12.239 20.456 10.676 1.00 12.41 C ATOM 1521 O ALA A 101 -12.444 21.466 11.348 1.00 2.23 O ATOM 1522 CB ALA A 101 -10.761 19.629 12.516 1.00 21.30 C ATOM 0 H ALA A 101 -10.180 19.182 9.724 1.00 45.44 H new ATOM 0 HA ALA A 101 -12.354 18.537 11.596 1.00 43.43 H new ATOM 0 HB1 ALA A 101 -11.409 20.133 13.233 1.00 21.30 H new ATOM 0 HB2 ALA A 101 -10.335 18.737 12.976 1.00 21.30 H new ATOM 0 HB3 ALA A 101 -9.957 20.302 12.218 1.00 21.30 H new ATOM 1528 N ASN A 102 -12.577 20.360 9.394 1.00 22.12 N ATOM 1529 CA ASN A 102 -13.221 21.461 8.689 1.00 53.55 C ATOM 1530 C ASN A 102 -14.653 21.657 9.177 1.00 33.13 C ATOM 1531 O ASN A 102 -15.247 22.717 8.982 1.00 34.21 O ATOM 1532 CB ASN A 102 -13.216 21.201 7.181 1.00 52.32 C ATOM 1533 CG ASN A 102 -12.988 22.467 6.377 1.00 62.55 C ATOM 1534 OD1 ASN A 102 -13.870 22.919 5.646 1.00 23.13 O ATOM 1535 ND2 ASN A 102 -11.799 23.044 6.507 1.00 31.12 N ATOM 0 H ASN A 102 -12.415 19.531 8.823 1.00 22.12 H new ATOM 0 HA ASN A 102 -12.658 22.371 8.897 1.00 53.55 H new ATOM 0 HB2 ASN A 102 -12.437 20.477 6.942 1.00 52.32 H new ATOM 0 HB3 ASN A 102 -14.166 20.754 6.889 1.00 52.32 H new ATOM 0 HD21 ASN A 102 -11.587 23.897 5.989 1.00 31.12 H new ATOM 0 HD22 ASN A 102 -11.098 22.634 7.124 1.00 31.12 H new ATOM 1542 N ALA A 103 -15.201 20.627 9.814 1.00 11.01 N ATOM 1543 CA ALA A 103 -16.562 20.686 10.333 1.00 2.03 C ATOM 1544 C ALA A 103 -16.975 19.351 10.944 1.00 43.10 C ATOM 1545 O ALA A 103 -17.763 19.306 11.887 1.00 15.30 O ATOM 1546 CB ALA A 103 -17.531 21.086 9.230 1.00 4.24 C ATOM 0 H ALA A 103 -14.723 19.742 9.983 1.00 11.01 H new ATOM 0 HA ALA A 103 -16.592 21.441 11.119 1.00 2.03 H new ATOM 0 HB1 ALA A 103 -18.543 21.126 9.632 1.00 4.24 H new ATOM 0 HB2 ALA A 103 -17.256 22.067 8.842 1.00 4.24 H new ATOM 0 HB3 ALA A 103 -17.489 20.352 8.425 1.00 4.24 H new ATOM 1552 N GLY A 104 -16.436 18.264 10.399 1.00 15.20 N ATOM 1553 CA GLY A 104 -16.762 16.943 10.903 1.00 60.21 C ATOM 1554 C GLY A 104 -17.491 16.095 9.879 1.00 5.11 C ATOM 1555 O GLY A 104 -16.880 15.363 9.100 1.00 22.12 O ATOM 0 H GLY A 104 -15.780 18.275 9.618 1.00 15.20 H new ATOM 0 HA2 GLY A 104 -15.845 16.436 11.204 1.00 60.21 H new ATOM 0 HA3 GLY A 104 -17.380 17.040 11.796 1.00 60.21 H new ATOM 1559 N PRO A 105 -18.829 16.188 9.873 1.00 64.42 N ATOM 1560 CA PRO A 105 -19.670 15.429 8.943 1.00 52.03 C ATOM 1561 C PRO A 105 -19.532 15.918 7.505 1.00 2.10 C ATOM 1562 O PRO A 105 -19.859 17.063 7.195 1.00 61.21 O ATOM 1563 CB PRO A 105 -21.088 15.683 9.460 1.00 74.02 C ATOM 1564 CG PRO A 105 -21.002 16.986 10.177 1.00 75.10 C ATOM 1565 CD PRO A 105 -19.623 17.040 10.773 1.00 50.30 C ATOM 0 HA PRO A 105 -19.395 14.375 8.912 1.00 52.03 H new ATOM 0 HB2 PRO A 105 -21.806 15.728 8.641 1.00 74.02 H new ATOM 0 HB3 PRO A 105 -21.415 14.885 10.127 1.00 74.02 H new ATOM 0 HG2 PRO A 105 -21.165 17.819 9.493 1.00 75.10 H new ATOM 0 HG3 PRO A 105 -21.765 17.056 10.952 1.00 75.10 H new ATOM 0 HD2 PRO A 105 -19.238 18.059 10.804 1.00 50.30 H new ATOM 0 HD3 PRO A 105 -19.612 16.664 11.796 1.00 50.30 H new ATOM 1573 N ASN A 106 -19.045 15.043 6.631 1.00 34.32 N ATOM 1574 CA ASN A 106 -18.864 15.386 5.226 1.00 42.35 C ATOM 1575 C ASN A 106 -18.216 16.760 5.081 1.00 54.24 C ATOM 1576 O ASN A 106 -18.745 17.640 4.400 1.00 31.00 O ATOM 1577 CB ASN A 106 -20.208 15.364 4.496 1.00 55.32 C ATOM 1578 CG ASN A 106 -20.836 13.984 4.482 1.00 32.10 C ATOM 1579 OD1 ASN A 106 -20.160 12.980 4.706 1.00 63.13 O ATOM 1580 ND2 ASN A 106 -22.136 13.928 4.218 1.00 15.03 N ATOM 0 H ASN A 106 -18.769 14.091 6.872 1.00 34.32 H new ATOM 0 HA ASN A 106 -18.204 14.643 4.779 1.00 42.35 H new ATOM 0 HB2 ASN A 106 -20.890 16.066 4.976 1.00 55.32 H new ATOM 0 HB3 ASN A 106 -20.067 15.706 3.471 1.00 55.32 H new ATOM 0 HD21 ASN A 106 -22.613 13.027 4.195 1.00 15.03 H new ATOM 0 HD22 ASN A 106 -22.657 14.786 4.038 1.00 15.03 H new ATOM 1587 N THR A 107 -17.067 16.938 5.725 1.00 32.10 N ATOM 1588 CA THR A 107 -16.347 18.204 5.669 1.00 72.21 C ATOM 1589 C THR A 107 -14.872 18.012 6.000 1.00 3.33 C ATOM 1590 O THR A 107 -14.362 18.587 6.961 1.00 33.25 O ATOM 1591 CB THR A 107 -16.950 19.236 6.640 1.00 10.40 C ATOM 1592 OG1 THR A 107 -17.215 18.622 7.906 1.00 74.21 O ATOM 1593 CG2 THR A 107 -18.235 19.824 6.076 1.00 31.43 C ATOM 0 H THR A 107 -16.615 16.221 6.292 1.00 32.10 H new ATOM 0 HA THR A 107 -16.442 18.577 4.649 1.00 72.21 H new ATOM 0 HB THR A 107 -16.228 20.042 6.772 1.00 10.40 H new ATOM 0 HG1 THR A 107 -18.051 18.113 7.854 1.00 74.21 H new ATOM 0 HG21 THR A 107 -18.642 20.550 6.779 1.00 31.43 H new ATOM 0 HG22 THR A 107 -18.024 20.317 5.127 1.00 31.43 H new ATOM 0 HG23 THR A 107 -18.961 19.027 5.917 1.00 31.43 H new ATOM 1601 N ASN A 108 -14.190 17.202 5.198 1.00 70.44 N ATOM 1602 CA ASN A 108 -12.771 16.935 5.406 1.00 35.32 C ATOM 1603 C ASN A 108 -11.942 18.195 5.181 1.00 0.24 C ATOM 1604 O ASN A 108 -10.895 18.380 5.800 1.00 1.51 O ATOM 1605 CB ASN A 108 -12.297 15.824 4.467 1.00 23.12 C ATOM 1606 CG ASN A 108 -13.341 14.740 4.279 1.00 3.30 C ATOM 1607 OD1 ASN A 108 -14.097 14.425 5.198 1.00 53.52 O ATOM 1608 ND2 ASN A 108 -13.386 14.164 3.084 1.00 61.43 N ATOM 0 H ASN A 108 -14.597 16.718 4.397 1.00 70.44 H new ATOM 0 HA ASN A 108 -12.635 16.612 6.438 1.00 35.32 H new ATOM 0 HB2 ASN A 108 -12.046 16.254 3.498 1.00 23.12 H new ATOM 0 HB3 ASN A 108 -11.384 15.380 4.865 1.00 23.12 H new ATOM 0 HD21 ASN A 108 -14.067 13.428 2.898 1.00 61.43 H new ATOM 0 HD22 ASN A 108 -12.739 14.457 2.352 1.00 61.43 H new ATOM 1615 N GLY A 109 -12.419 19.060 4.291 1.00 2.11 N ATOM 1616 CA GLY A 109 -11.710 20.292 4.001 1.00 45.45 C ATOM 1617 C GLY A 109 -10.209 20.151 4.166 1.00 74.34 C ATOM 1618 O GLY A 109 -9.568 19.388 3.443 1.00 1.01 O ATOM 0 H GLY A 109 -13.284 18.929 3.766 1.00 2.11 H new ATOM 0 HA2 GLY A 109 -11.932 20.604 2.980 1.00 45.45 H new ATOM 0 HA3 GLY A 109 -12.072 21.080 4.661 1.00 45.45 H new ATOM 1622 N SER A 110 -9.648 20.889 5.118 1.00 31.41 N ATOM 1623 CA SER A 110 -8.213 20.846 5.372 1.00 22.21 C ATOM 1624 C SER A 110 -7.875 21.527 6.695 1.00 62.40 C ATOM 1625 O SER A 110 -6.883 22.248 6.798 1.00 62.43 O ATOM 1626 CB SER A 110 -7.451 21.520 4.229 1.00 30.24 C ATOM 1627 OG SER A 110 -7.586 22.929 4.288 1.00 2.30 O ATOM 0 H SER A 110 -10.165 21.524 5.726 1.00 31.41 H new ATOM 0 HA SER A 110 -7.911 19.801 5.434 1.00 22.21 H new ATOM 0 HB2 SER A 110 -6.396 21.250 4.282 1.00 30.24 H new ATOM 0 HB3 SER A 110 -7.826 21.155 3.273 1.00 30.24 H new ATOM 0 HG SER A 110 -7.169 23.263 5.109 1.00 2.30 H new ATOM 1633 N GLN A 111 -8.707 21.291 7.704 1.00 53.40 N ATOM 1634 CA GLN A 111 -8.498 21.882 9.020 1.00 5.24 C ATOM 1635 C GLN A 111 -8.058 20.825 10.028 1.00 72.11 C ATOM 1636 O GLN A 111 -8.631 20.709 11.111 1.00 35.23 O ATOM 1637 CB GLN A 111 -9.777 22.566 9.506 1.00 70.23 C ATOM 1638 CG GLN A 111 -9.982 23.956 8.925 1.00 32.40 C ATOM 1639 CD GLN A 111 -9.462 25.051 9.835 1.00 35.12 C ATOM 1640 OE1 GLN A 111 -10.231 25.702 10.544 1.00 61.31 O ATOM 1641 NE2 GLN A 111 -8.151 25.260 9.821 1.00 53.51 N ATOM 0 H GLN A 111 -9.532 20.695 7.635 1.00 53.40 H new ATOM 0 HA GLN A 111 -7.707 22.627 8.933 1.00 5.24 H new ATOM 0 HB2 GLN A 111 -10.633 21.943 9.247 1.00 70.23 H new ATOM 0 HB3 GLN A 111 -9.751 22.636 10.593 1.00 70.23 H new ATOM 0 HG2 GLN A 111 -9.478 24.020 7.961 1.00 32.40 H new ATOM 0 HG3 GLN A 111 -11.044 24.116 8.741 1.00 32.40 H new ATOM 0 HE21 GLN A 111 -7.551 24.697 9.218 1.00 53.51 H new ATOM 0 HE22 GLN A 111 -7.744 25.984 10.413 1.00 53.51 H new ATOM 1650 N PHE A 112 -7.038 20.055 9.664 1.00 41.34 N ATOM 1651 CA PHE A 112 -6.522 19.006 10.535 1.00 14.12 C ATOM 1652 C PHE A 112 -6.155 19.569 11.905 1.00 31.32 C ATOM 1653 O PHE A 112 -6.358 20.752 12.178 1.00 40.25 O ATOM 1654 CB PHE A 112 -5.300 18.341 9.900 1.00 45.00 C ATOM 1655 CG PHE A 112 -4.071 19.206 9.915 1.00 34.41 C ATOM 1656 CD1 PHE A 112 -3.209 19.189 11.000 1.00 74.33 C ATOM 1657 CD2 PHE A 112 -3.779 20.036 8.845 1.00 73.32 C ATOM 1658 CE1 PHE A 112 -2.078 19.983 11.017 1.00 72.33 C ATOM 1659 CE2 PHE A 112 -2.649 20.832 8.856 1.00 75.51 C ATOM 1660 CZ PHE A 112 -1.799 20.806 9.944 1.00 45.03 C ATOM 0 H PHE A 112 -6.552 20.138 8.771 1.00 41.34 H new ATOM 0 HA PHE A 112 -7.305 18.259 10.666 1.00 14.12 H new ATOM 0 HB2 PHE A 112 -5.087 17.411 10.428 1.00 45.00 H new ATOM 0 HB3 PHE A 112 -5.535 18.076 8.869 1.00 45.00 H new ATOM 0 HD1 PHE A 112 -3.424 18.548 11.842 1.00 74.33 H new ATOM 0 HD2 PHE A 112 -4.442 20.061 7.993 1.00 73.32 H new ATOM 0 HE1 PHE A 112 -1.414 19.960 11.868 1.00 72.33 H new ATOM 0 HE2 PHE A 112 -2.431 21.473 8.015 1.00 75.51 H new ATOM 0 HZ PHE A 112 -0.917 21.429 9.956 1.00 45.03 H new ATOM 1670 N PHE A 113 -5.614 18.712 12.764 1.00 21.45 N ATOM 1671 CA PHE A 113 -5.219 19.121 14.107 1.00 13.42 C ATOM 1672 C PHE A 113 -4.227 18.131 14.709 1.00 63.24 C ATOM 1673 O PHE A 113 -4.619 17.146 15.336 1.00 41.34 O ATOM 1674 CB PHE A 113 -6.449 19.239 15.009 1.00 14.54 C ATOM 1675 CG PHE A 113 -7.503 18.208 14.724 1.00 32.13 C ATOM 1676 CD1 PHE A 113 -7.158 16.972 14.201 1.00 0.05 C ATOM 1677 CD2 PHE A 113 -8.839 18.474 14.980 1.00 62.34 C ATOM 1678 CE1 PHE A 113 -8.126 16.021 13.937 1.00 2.45 C ATOM 1679 CE2 PHE A 113 -9.811 17.527 14.718 1.00 31.31 C ATOM 1680 CZ PHE A 113 -9.454 16.299 14.197 1.00 22.42 C ATOM 0 H PHE A 113 -5.439 17.729 12.554 1.00 21.45 H new ATOM 0 HA PHE A 113 -4.734 20.095 14.035 1.00 13.42 H new ATOM 0 HB2 PHE A 113 -6.136 19.149 16.049 1.00 14.54 H new ATOM 0 HB3 PHE A 113 -6.882 20.232 14.891 1.00 14.54 H new ATOM 0 HD1 PHE A 113 -6.121 16.749 13.997 1.00 0.05 H new ATOM 0 HD2 PHE A 113 -9.124 19.432 15.389 1.00 62.34 H new ATOM 0 HE1 PHE A 113 -7.844 15.062 13.528 1.00 2.45 H new ATOM 0 HE2 PHE A 113 -10.849 17.747 14.921 1.00 31.31 H new ATOM 0 HZ PHE A 113 -10.212 15.557 13.993 1.00 22.42 H new ATOM 1690 N ILE A 114 -2.940 18.399 14.512 1.00 32.40 N ATOM 1691 CA ILE A 114 -1.891 17.532 15.035 1.00 74.21 C ATOM 1692 C ILE A 114 -2.307 16.905 16.362 1.00 42.14 C ATOM 1693 O ILE A 114 -2.324 17.572 17.397 1.00 52.44 O ATOM 1694 CB ILE A 114 -0.572 18.301 15.234 1.00 13.43 C ATOM 1695 CG1 ILE A 114 0.100 18.562 13.885 1.00 42.40 C ATOM 1696 CG2 ILE A 114 0.359 17.527 16.155 1.00 13.03 C ATOM 1697 CD1 ILE A 114 0.455 20.015 13.658 1.00 43.12 C ATOM 0 H ILE A 114 -2.599 19.209 13.994 1.00 32.40 H new ATOM 0 HA ILE A 114 -1.735 16.745 14.297 1.00 74.21 H new ATOM 0 HB ILE A 114 -0.795 19.261 15.699 1.00 13.43 H new ATOM 0 HG12 ILE A 114 1.006 17.960 13.817 1.00 42.40 H new ATOM 0 HG13 ILE A 114 -0.564 18.230 13.087 1.00 42.40 H new ATOM 0 HG21 ILE A 114 1.287 18.084 16.286 1.00 13.03 H new ATOM 0 HG22 ILE A 114 -0.120 17.388 17.124 1.00 13.03 H new ATOM 0 HG23 ILE A 114 0.579 16.554 15.716 1.00 13.03 H new ATOM 0 HD11 ILE A 114 0.928 20.126 12.682 1.00 43.12 H new ATOM 0 HD12 ILE A 114 -0.451 20.621 13.693 1.00 43.12 H new ATOM 0 HD13 ILE A 114 1.144 20.347 14.435 1.00 43.12 H new ATOM 1709 N CYS A 115 -2.639 15.619 16.324 1.00 42.52 N ATOM 1710 CA CYS A 115 -3.053 14.901 17.524 1.00 52.22 C ATOM 1711 C CYS A 115 -1.878 14.712 18.478 1.00 51.45 C ATOM 1712 O CYS A 115 -1.045 13.825 18.287 1.00 14.31 O ATOM 1713 CB CYS A 115 -3.646 13.542 17.150 1.00 32.14 C ATOM 1714 SG CYS A 115 -4.121 12.529 18.570 1.00 33.45 S ATOM 0 H CYS A 115 -2.630 15.053 15.476 1.00 42.52 H new ATOM 0 HA CYS A 115 -3.814 15.495 18.029 1.00 52.22 H new ATOM 0 HB2 CYS A 115 -4.522 13.700 16.521 1.00 32.14 H new ATOM 0 HB3 CYS A 115 -2.919 12.992 16.552 1.00 32.14 H new ATOM 0 HG CYS A 115 -4.289 13.291 19.610 1.00 33.45 H new ATOM 1720 N THR A 116 -1.815 15.554 19.505 1.00 72.01 N ATOM 1721 CA THR A 116 -0.741 15.482 20.487 1.00 1.10 C ATOM 1722 C THR A 116 -1.048 14.446 21.563 1.00 44.44 C ATOM 1723 O THR A 116 -0.368 14.381 22.587 1.00 51.35 O ATOM 1724 CB THR A 116 -0.501 16.848 21.159 1.00 74.44 C ATOM 1725 OG1 THR A 116 -1.752 17.435 21.533 1.00 13.32 O ATOM 1726 CG2 THR A 116 0.246 17.787 20.224 1.00 23.40 C ATOM 0 H THR A 116 -2.496 16.294 19.678 1.00 72.01 H new ATOM 0 HA THR A 116 0.160 15.187 19.949 1.00 1.10 H new ATOM 0 HB THR A 116 0.107 16.689 22.050 1.00 74.44 H new ATOM 0 HG1 THR A 116 -1.592 18.302 21.961 1.00 13.32 H new ATOM 0 HG21 THR A 116 0.404 18.745 20.720 1.00 23.40 H new ATOM 0 HG22 THR A 116 1.210 17.350 19.963 1.00 23.40 H new ATOM 0 HG23 THR A 116 -0.340 17.940 19.318 1.00 23.40 H new ATOM 1734 N ALA A 117 -2.075 13.638 21.323 1.00 23.31 N ATOM 1735 CA ALA A 117 -2.469 12.603 22.271 1.00 73.23 C ATOM 1736 C ALA A 117 -3.711 11.861 21.788 1.00 62.23 C ATOM 1737 O ALA A 117 -4.743 12.471 21.509 1.00 41.52 O ATOM 1738 CB ALA A 117 -2.716 13.211 23.644 1.00 70.45 C ATOM 0 H ALA A 117 -2.649 13.680 20.481 1.00 23.31 H new ATOM 0 HA ALA A 117 -1.653 11.884 22.346 1.00 73.23 H new ATOM 0 HB1 ALA A 117 -3.009 12.427 24.342 1.00 70.45 H new ATOM 0 HB2 ALA A 117 -1.804 13.690 23.999 1.00 70.45 H new ATOM 0 HB3 ALA A 117 -3.512 13.952 23.576 1.00 70.45 H new ATOM 1744 N LYS A 118 -3.604 10.540 21.690 1.00 33.10 N ATOM 1745 CA LYS A 118 -4.718 9.713 21.241 1.00 12.21 C ATOM 1746 C LYS A 118 -6.053 10.344 21.625 1.00 71.40 C ATOM 1747 O LYS A 118 -6.455 10.313 22.789 1.00 62.23 O ATOM 1748 CB LYS A 118 -4.613 8.310 21.842 1.00 33.23 C ATOM 1749 CG LYS A 118 -5.948 7.594 21.953 1.00 54.10 C ATOM 1750 CD LYS A 118 -5.797 6.096 21.746 1.00 52.45 C ATOM 1751 CE LYS A 118 -6.067 5.326 23.029 1.00 70.11 C ATOM 1752 NZ LYS A 118 -5.124 5.710 24.115 1.00 1.43 N ATOM 0 H LYS A 118 -2.757 10.019 21.916 1.00 33.10 H new ATOM 0 HA LYS A 118 -4.670 9.640 20.154 1.00 12.21 H new ATOM 0 HB2 LYS A 118 -3.939 7.711 21.230 1.00 33.23 H new ATOM 0 HB3 LYS A 118 -4.165 8.381 22.833 1.00 33.23 H new ATOM 0 HG2 LYS A 118 -6.383 7.784 22.934 1.00 54.10 H new ATOM 0 HG3 LYS A 118 -6.640 7.996 21.213 1.00 54.10 H new ATOM 0 HD2 LYS A 118 -6.486 5.764 20.969 1.00 52.45 H new ATOM 0 HD3 LYS A 118 -4.789 5.876 21.394 1.00 52.45 H new ATOM 0 HE2 LYS A 118 -7.091 5.511 23.355 1.00 70.11 H new ATOM 0 HE3 LYS A 118 -5.982 4.257 22.836 1.00 70.11 H new ATOM 0 HZ1 LYS A 118 -5.178 5.012 24.884 1.00 1.43 H new ATOM 0 HZ2 LYS A 118 -4.155 5.737 23.739 1.00 1.43 H new ATOM 0 HZ3 LYS A 118 -5.380 6.649 24.481 1.00 1.43 H new ATOM 1766 N THR A 119 -6.738 10.915 20.639 1.00 73.50 N ATOM 1767 CA THR A 119 -8.028 11.552 20.873 1.00 22.35 C ATOM 1768 C THR A 119 -9.167 10.546 20.757 1.00 34.12 C ATOM 1769 O THR A 119 -9.915 10.552 19.780 1.00 50.31 O ATOM 1770 CB THR A 119 -8.273 12.705 19.882 1.00 11.03 C ATOM 1771 OG1 THR A 119 -8.347 12.195 18.546 1.00 14.32 O ATOM 1772 CG2 THR A 119 -7.164 13.742 19.974 1.00 51.32 C ATOM 0 H THR A 119 -6.421 10.949 19.670 1.00 73.50 H new ATOM 0 HA THR A 119 -8.003 11.953 21.886 1.00 22.35 H new ATOM 0 HB THR A 119 -9.218 13.183 20.141 1.00 11.03 H new ATOM 0 HG1 THR A 119 -8.991 11.457 18.513 1.00 14.32 H new ATOM 0 HG21 THR A 119 -7.359 14.547 19.265 1.00 51.32 H new ATOM 0 HG22 THR A 119 -7.130 14.149 20.984 1.00 51.32 H new ATOM 0 HG23 THR A 119 -6.208 13.274 19.739 1.00 51.32 H new ATOM 1780 N GLU A 120 -9.294 9.683 21.761 1.00 40.33 N ATOM 1781 CA GLU A 120 -10.344 8.671 21.769 1.00 4.13 C ATOM 1782 C GLU A 120 -11.715 9.311 21.967 1.00 22.14 C ATOM 1783 O GLU A 120 -12.732 8.771 21.533 1.00 61.15 O ATOM 1784 CB GLU A 120 -10.084 7.644 22.873 1.00 4.13 C ATOM 1785 CG GLU A 120 -11.232 6.671 23.083 1.00 40.54 C ATOM 1786 CD GLU A 120 -11.353 5.661 21.959 1.00 63.24 C ATOM 1787 OE1 GLU A 120 -10.388 5.523 21.178 1.00 52.13 O ATOM 1788 OE2 GLU A 120 -12.413 5.007 21.861 1.00 44.34 O ATOM 0 H GLU A 120 -8.684 9.665 22.578 1.00 40.33 H new ATOM 0 HA GLU A 120 -10.334 8.166 20.803 1.00 4.13 H new ATOM 0 HB2 GLU A 120 -9.183 7.082 22.629 1.00 4.13 H new ATOM 0 HB3 GLU A 120 -9.889 8.170 23.808 1.00 4.13 H new ATOM 0 HG2 GLU A 120 -11.089 6.144 24.026 1.00 40.54 H new ATOM 0 HG3 GLU A 120 -12.165 7.228 23.168 1.00 40.54 H new ATOM 1795 N TRP A 121 -11.733 10.463 22.627 1.00 52.51 N ATOM 1796 CA TRP A 121 -12.979 11.177 22.884 1.00 50.24 C ATOM 1797 C TRP A 121 -13.726 11.454 21.583 1.00 5.34 C ATOM 1798 O TRP A 121 -14.940 11.661 21.585 1.00 2.40 O ATOM 1799 CB TRP A 121 -12.697 12.491 23.614 1.00 21.02 C ATOM 1800 CG TRP A 121 -11.546 13.257 23.036 1.00 51.24 C ATOM 1801 CD1 TRP A 121 -11.586 14.124 21.981 1.00 60.54 C ATOM 1802 CD2 TRP A 121 -10.185 13.224 23.479 1.00 51.02 C ATOM 1803 NE1 TRP A 121 -10.332 14.631 21.741 1.00 24.13 N ATOM 1804 CE2 TRP A 121 -9.455 14.096 22.647 1.00 22.43 C ATOM 1805 CE3 TRP A 121 -9.513 12.545 24.498 1.00 23.13 C ATOM 1806 CZ2 TRP A 121 -8.087 14.303 22.805 1.00 70.50 C ATOM 1807 CZ3 TRP A 121 -8.155 12.751 24.653 1.00 11.13 C ATOM 1808 CH2 TRP A 121 -7.454 13.624 23.811 1.00 11.51 C ATOM 0 H TRP A 121 -10.900 10.923 22.994 1.00 52.51 H new ATOM 0 HA TRP A 121 -13.606 10.547 23.515 1.00 50.24 H new ATOM 0 HB2 TRP A 121 -13.591 13.114 23.583 1.00 21.02 H new ATOM 0 HB3 TRP A 121 -12.492 12.279 24.663 1.00 21.02 H new ATOM 0 HD1 TRP A 121 -12.473 14.374 21.418 1.00 60.54 H new ATOM 0 HE1 TRP A 121 -10.093 15.298 21.007 1.00 24.13 H new ATOM 0 HE3 TRP A 121 -10.045 11.871 25.153 1.00 23.13 H new ATOM 0 HZ2 TRP A 121 -7.545 14.975 22.157 1.00 70.50 H new ATOM 0 HZ3 TRP A 121 -7.625 12.230 25.437 1.00 11.13 H new ATOM 0 HH2 TRP A 121 -6.393 13.764 23.958 1.00 11.51 H new ATOM 1819 N LEU A 122 -12.993 11.457 20.475 1.00 73.10 N ATOM 1820 CA LEU A 122 -13.587 11.709 19.166 1.00 31.54 C ATOM 1821 C LEU A 122 -14.308 10.468 18.648 1.00 11.40 C ATOM 1822 O LEU A 122 -15.496 10.517 18.330 1.00 74.44 O ATOM 1823 CB LEU A 122 -12.510 12.140 18.170 1.00 25.20 C ATOM 1824 CG LEU A 122 -11.772 13.438 18.500 1.00 65.25 C ATOM 1825 CD1 LEU A 122 -10.589 13.632 17.564 1.00 64.44 C ATOM 1826 CD2 LEU A 122 -12.719 14.626 18.417 1.00 31.33 C ATOM 0 H LEU A 122 -11.987 11.288 20.456 1.00 73.10 H new ATOM 0 HA LEU A 122 -14.316 12.512 19.273 1.00 31.54 H new ATOM 0 HB2 LEU A 122 -11.776 11.338 18.090 1.00 25.20 H new ATOM 0 HB3 LEU A 122 -12.973 12.248 17.189 1.00 25.20 H new ATOM 0 HG LEU A 122 -11.395 13.369 19.520 1.00 65.25 H new ATOM 0 HD11 LEU A 122 -10.076 14.561 17.814 1.00 64.44 H new ATOM 0 HD12 LEU A 122 -9.899 12.796 17.672 1.00 64.44 H new ATOM 0 HD13 LEU A 122 -10.944 13.679 16.534 1.00 64.44 H new ATOM 0 HD21 LEU A 122 -12.177 15.541 18.655 1.00 31.33 H new ATOM 0 HD22 LEU A 122 -13.126 14.697 17.408 1.00 31.33 H new ATOM 0 HD23 LEU A 122 -13.534 14.492 19.128 1.00 31.33 H new ATOM 1838 N ASP A 123 -13.582 9.359 18.568 1.00 33.41 N ATOM 1839 CA ASP A 123 -14.153 8.104 18.092 1.00 54.23 C ATOM 1840 C ASP A 123 -14.818 8.292 16.731 1.00 24.52 C ATOM 1841 O ASP A 123 -15.977 8.693 16.645 1.00 12.43 O ATOM 1842 CB ASP A 123 -15.170 7.567 19.100 1.00 71.42 C ATOM 1843 CG ASP A 123 -14.576 6.517 20.018 1.00 5.12 C ATOM 1844 OD1 ASP A 123 -13.818 5.656 19.524 1.00 61.13 O ATOM 1845 OD2 ASP A 123 -14.867 6.557 21.232 1.00 41.53 O ATOM 0 H ASP A 123 -12.597 9.303 18.826 1.00 33.41 H new ATOM 0 HA ASP A 123 -13.343 7.382 17.985 1.00 54.23 H new ATOM 0 HB2 ASP A 123 -15.555 8.393 19.698 1.00 71.42 H new ATOM 0 HB3 ASP A 123 -16.017 7.139 18.564 1.00 71.42 H new ATOM 1850 N GLY A 124 -14.073 7.998 15.669 1.00 12.22 N ATOM 1851 CA GLY A 124 -14.606 8.142 14.327 1.00 32.21 C ATOM 1852 C GLY A 124 -15.391 9.426 14.149 1.00 13.35 C ATOM 1853 O GLY A 124 -16.413 9.449 13.462 1.00 22.15 O ATOM 0 H GLY A 124 -13.111 7.663 15.714 1.00 12.22 H new ATOM 0 HA2 GLY A 124 -13.786 8.119 13.609 1.00 32.21 H new ATOM 0 HA3 GLY A 124 -15.250 7.292 14.102 1.00 32.21 H new ATOM 1857 N LYS A 125 -14.915 10.500 14.771 1.00 32.44 N ATOM 1858 CA LYS A 125 -15.579 11.795 14.680 1.00 63.31 C ATOM 1859 C LYS A 125 -15.088 12.573 13.463 1.00 23.14 C ATOM 1860 O LYS A 125 -15.670 13.591 13.089 1.00 51.32 O ATOM 1861 CB LYS A 125 -15.332 12.608 15.952 1.00 11.25 C ATOM 1862 CG LYS A 125 -16.594 13.218 16.538 1.00 4.43 C ATOM 1863 CD LYS A 125 -17.211 14.237 15.594 1.00 23.24 C ATOM 1864 CE LYS A 125 -18.277 13.605 14.713 1.00 14.31 C ATOM 1865 NZ LYS A 125 -19.534 14.405 14.703 1.00 23.25 N ATOM 0 H LYS A 125 -14.071 10.499 15.344 1.00 32.44 H new ATOM 0 HA LYS A 125 -16.649 11.620 14.570 1.00 63.31 H new ATOM 0 HB2 LYS A 125 -14.868 11.965 16.700 1.00 11.25 H new ATOM 0 HB3 LYS A 125 -14.622 13.405 15.732 1.00 11.25 H new ATOM 0 HG2 LYS A 125 -17.317 12.430 16.747 1.00 4.43 H new ATOM 0 HG3 LYS A 125 -16.360 13.696 17.489 1.00 4.43 H new ATOM 0 HD2 LYS A 125 -17.650 15.051 16.171 1.00 23.24 H new ATOM 0 HD3 LYS A 125 -16.432 14.674 14.969 1.00 23.24 H new ATOM 0 HE2 LYS A 125 -17.898 13.511 13.695 1.00 14.31 H new ATOM 0 HE3 LYS A 125 -18.491 12.597 15.068 1.00 14.31 H new ATOM 0 HZ1 LYS A 125 -20.236 13.941 14.091 1.00 23.25 H new ATOM 0 HZ2 LYS A 125 -19.909 14.474 15.670 1.00 23.25 H new ATOM 0 HZ3 LYS A 125 -19.335 15.359 14.340 1.00 23.25 H new ATOM 1879 N HIS A 126 -14.014 12.086 12.849 1.00 1.41 N ATOM 1880 CA HIS A 126 -13.446 12.736 11.673 1.00 71.21 C ATOM 1881 C HIS A 126 -12.812 11.710 10.739 1.00 73.54 C ATOM 1882 O HIS A 126 -13.071 10.511 10.849 1.00 23.03 O ATOM 1883 CB HIS A 126 -12.405 13.774 12.091 1.00 44.35 C ATOM 1884 CG HIS A 126 -12.861 14.666 13.204 1.00 50.11 C ATOM 1885 ND1 HIS A 126 -13.727 15.722 13.015 1.00 12.33 N ATOM 1886 CD2 HIS A 126 -12.568 14.653 14.525 1.00 2.23 C ATOM 1887 CE1 HIS A 126 -13.946 16.322 14.172 1.00 24.42 C ATOM 1888 NE2 HIS A 126 -13.254 15.692 15.105 1.00 70.12 N ATOM 0 H HIS A 126 -13.520 11.244 13.146 1.00 1.41 H new ATOM 0 HA HIS A 126 -14.254 13.237 11.139 1.00 71.21 H new ATOM 0 HB2 HIS A 126 -11.495 13.260 12.399 1.00 44.35 H new ATOM 0 HB3 HIS A 126 -12.148 14.387 11.227 1.00 44.35 H new ATOM 0 HD1 HIS A 126 -14.135 15.997 12.122 1.00 12.33 H new ATOM 0 HD2 HIS A 126 -11.916 13.955 15.029 1.00 2.23 H new ATOM 0 HE1 HIS A 126 -14.582 17.181 14.328 1.00 24.42 H new ATOM 1896 N VAL A 127 -11.982 12.188 9.818 1.00 44.22 N ATOM 1897 CA VAL A 127 -11.311 11.313 8.864 1.00 24.44 C ATOM 1898 C VAL A 127 -9.796 11.455 8.959 1.00 43.51 C ATOM 1899 O VAL A 127 -9.243 12.521 8.684 1.00 73.44 O ATOM 1900 CB VAL A 127 -11.754 11.611 7.420 1.00 72.01 C ATOM 1901 CG1 VAL A 127 -10.787 10.988 6.425 1.00 51.13 C ATOM 1902 CG2 VAL A 127 -13.171 11.110 7.184 1.00 51.11 C ATOM 0 H VAL A 127 -11.758 13.177 9.712 1.00 44.22 H new ATOM 0 HA VAL A 127 -11.594 10.292 9.119 1.00 24.44 H new ATOM 0 HB VAL A 127 -11.745 12.691 7.271 1.00 72.01 H new ATOM 0 HG11 VAL A 127 -11.117 11.209 5.410 1.00 51.13 H new ATOM 0 HG12 VAL A 127 -9.790 11.399 6.580 1.00 51.13 H new ATOM 0 HG13 VAL A 127 -10.761 9.908 6.571 1.00 51.13 H new ATOM 0 HG21 VAL A 127 -13.468 11.329 6.158 1.00 51.11 H new ATOM 0 HG22 VAL A 127 -13.209 10.034 7.351 1.00 51.11 H new ATOM 0 HG23 VAL A 127 -13.853 11.608 7.873 1.00 51.11 H new ATOM 1912 N VAL A 128 -9.128 10.375 9.350 1.00 71.51 N ATOM 1913 CA VAL A 128 -7.676 10.378 9.479 1.00 1.25 C ATOM 1914 C VAL A 128 -7.006 10.007 8.161 1.00 4.14 C ATOM 1915 O VAL A 128 -7.408 9.054 7.494 1.00 34.24 O ATOM 1916 CB VAL A 128 -7.208 9.401 10.574 1.00 64.21 C ATOM 1917 CG1 VAL A 128 -5.837 8.836 10.234 1.00 21.53 C ATOM 1918 CG2 VAL A 128 -7.188 10.090 11.930 1.00 32.30 C ATOM 0 H VAL A 128 -9.570 9.486 9.583 1.00 71.51 H new ATOM 0 HA VAL A 128 -7.385 11.391 9.758 1.00 1.25 H new ATOM 0 HB VAL A 128 -7.915 8.573 10.624 1.00 64.21 H new ATOM 0 HG11 VAL A 128 -5.522 8.148 11.019 1.00 21.53 H new ATOM 0 HG12 VAL A 128 -5.888 8.304 9.284 1.00 21.53 H new ATOM 0 HG13 VAL A 128 -5.117 9.651 10.156 1.00 21.53 H new ATOM 0 HG21 VAL A 128 -6.855 9.385 12.692 1.00 32.30 H new ATOM 0 HG22 VAL A 128 -6.504 10.938 11.897 1.00 32.30 H new ATOM 0 HG23 VAL A 128 -8.190 10.441 12.174 1.00 32.30 H new ATOM 1928 N PHE A 129 -5.980 10.766 7.791 1.00 2.43 N ATOM 1929 CA PHE A 129 -5.253 10.518 6.552 1.00 63.01 C ATOM 1930 C PHE A 129 -3.848 11.109 6.618 1.00 45.22 C ATOM 1931 O PHE A 129 -3.452 11.896 5.759 1.00 53.14 O ATOM 1932 CB PHE A 129 -6.012 11.110 5.363 1.00 51.12 C ATOM 1933 CG PHE A 129 -6.235 12.592 5.471 1.00 24.43 C ATOM 1934 CD1 PHE A 129 -7.169 13.102 6.358 1.00 51.12 C ATOM 1935 CD2 PHE A 129 -5.510 13.474 4.686 1.00 24.33 C ATOM 1936 CE1 PHE A 129 -7.376 14.465 6.460 1.00 31.24 C ATOM 1937 CE2 PHE A 129 -5.712 14.837 4.785 1.00 40.31 C ATOM 1938 CZ PHE A 129 -6.647 15.333 5.672 1.00 12.41 C ATOM 0 H PHE A 129 -5.633 11.558 8.332 1.00 2.43 H new ATOM 0 HA PHE A 129 -5.169 9.439 6.420 1.00 63.01 H new ATOM 0 HB2 PHE A 129 -5.458 10.900 4.448 1.00 51.12 H new ATOM 0 HB3 PHE A 129 -6.977 10.611 5.273 1.00 51.12 H new ATOM 0 HD1 PHE A 129 -7.742 12.427 6.977 1.00 51.12 H new ATOM 0 HD2 PHE A 129 -4.779 13.092 3.989 1.00 24.33 H new ATOM 0 HE1 PHE A 129 -8.107 14.850 7.155 1.00 31.24 H new ATOM 0 HE2 PHE A 129 -5.139 15.514 4.169 1.00 40.31 H new ATOM 0 HZ PHE A 129 -6.808 16.398 5.749 1.00 12.41 H new ATOM 1948 N GLY A 130 -3.097 10.724 7.646 1.00 72.34 N ATOM 1949 CA GLY A 130 -1.745 11.225 7.806 1.00 2.11 C ATOM 1950 C GLY A 130 -1.149 10.865 9.152 1.00 21.15 C ATOM 1951 O GLY A 130 -1.819 10.273 9.999 1.00 54.32 O ATOM 0 H GLY A 130 -3.401 10.074 8.371 1.00 72.34 H new ATOM 0 HA2 GLY A 130 -1.115 10.821 7.013 1.00 2.11 H new ATOM 0 HA3 GLY A 130 -1.746 12.309 7.691 1.00 2.11 H new ATOM 1955 N LYS A 131 0.116 11.220 9.352 1.00 13.41 N ATOM 1956 CA LYS A 131 0.804 10.931 10.605 1.00 53.13 C ATOM 1957 C LYS A 131 2.231 11.469 10.579 1.00 53.54 C ATOM 1958 O LYS A 131 2.972 11.244 9.622 1.00 4.22 O ATOM 1959 CB LYS A 131 0.821 9.423 10.865 1.00 51.15 C ATOM 1960 CG LYS A 131 1.437 8.618 9.733 1.00 33.03 C ATOM 1961 CD LYS A 131 1.715 7.185 10.156 1.00 44.30 C ATOM 1962 CE LYS A 131 2.870 6.586 9.367 1.00 13.13 C ATOM 1963 NZ LYS A 131 3.656 5.619 10.183 1.00 51.42 N ATOM 0 H LYS A 131 0.686 11.709 8.662 1.00 13.41 H new ATOM 0 HA LYS A 131 0.262 11.427 11.411 1.00 53.13 H new ATOM 0 HB2 LYS A 131 1.376 9.227 11.783 1.00 51.15 H new ATOM 0 HB3 LYS A 131 -0.200 9.080 11.030 1.00 51.15 H new ATOM 0 HG2 LYS A 131 0.765 8.621 8.875 1.00 33.03 H new ATOM 0 HG3 LYS A 131 2.365 9.091 9.412 1.00 33.03 H new ATOM 0 HD2 LYS A 131 1.947 7.157 11.221 1.00 44.30 H new ATOM 0 HD3 LYS A 131 0.820 6.581 10.009 1.00 44.30 H new ATOM 0 HE2 LYS A 131 2.482 6.083 8.481 1.00 13.13 H new ATOM 0 HE3 LYS A 131 3.525 7.385 9.019 1.00 13.13 H new ATOM 0 HZ1 LYS A 131 4.434 5.233 9.610 1.00 51.42 H new ATOM 0 HZ2 LYS A 131 4.047 6.105 11.015 1.00 51.42 H new ATOM 0 HZ3 LYS A 131 3.037 4.843 10.494 1.00 51.42 H new ATOM 1977 N VAL A 132 2.610 12.181 11.636 1.00 75.23 N ATOM 1978 CA VAL A 132 3.949 12.749 11.735 1.00 74.20 C ATOM 1979 C VAL A 132 4.988 11.817 11.122 1.00 73.13 C ATOM 1980 O VAL A 132 5.306 10.768 11.683 1.00 50.32 O ATOM 1981 CB VAL A 132 4.331 13.033 13.200 1.00 73.22 C ATOM 1982 CG1 VAL A 132 5.815 13.348 13.313 1.00 35.23 C ATOM 1983 CG2 VAL A 132 3.491 14.172 13.758 1.00 42.24 C ATOM 0 H VAL A 132 2.008 12.378 12.436 1.00 75.23 H new ATOM 0 HA VAL A 132 3.936 13.688 11.182 1.00 74.20 H new ATOM 0 HB VAL A 132 4.128 12.140 13.791 1.00 73.22 H new ATOM 0 HG11 VAL A 132 6.067 13.546 14.355 1.00 35.23 H new ATOM 0 HG12 VAL A 132 6.396 12.498 12.955 1.00 35.23 H new ATOM 0 HG13 VAL A 132 6.047 14.226 12.710 1.00 35.23 H new ATOM 0 HG21 VAL A 132 3.774 14.359 14.794 1.00 42.24 H new ATOM 0 HG22 VAL A 132 3.660 15.072 13.167 1.00 42.24 H new ATOM 0 HG23 VAL A 132 2.436 13.902 13.713 1.00 42.24 H new ATOM 1993 N LYS A 133 5.515 12.206 9.966 1.00 53.32 N ATOM 1994 CA LYS A 133 6.520 11.408 9.275 1.00 21.30 C ATOM 1995 C LYS A 133 7.861 11.475 10.000 1.00 54.01 C ATOM 1996 O LYS A 133 8.397 10.453 10.427 1.00 40.15 O ATOM 1997 CB LYS A 133 6.683 11.892 7.833 1.00 45.34 C ATOM 1998 CG LYS A 133 6.629 10.775 6.806 1.00 64.53 C ATOM 1999 CD LYS A 133 7.462 9.579 7.238 1.00 10.21 C ATOM 2000 CE LYS A 133 6.585 8.439 7.732 1.00 62.54 C ATOM 2001 NZ LYS A 133 7.253 7.650 8.804 1.00 34.11 N ATOM 0 H LYS A 133 5.262 13.071 9.488 1.00 53.32 H new ATOM 0 HA LYS A 133 6.182 10.372 9.267 1.00 21.30 H new ATOM 0 HB2 LYS A 133 5.899 12.616 7.611 1.00 45.34 H new ATOM 0 HB3 LYS A 133 7.635 12.414 7.740 1.00 45.34 H new ATOM 0 HG2 LYS A 133 5.595 10.465 6.659 1.00 64.53 H new ATOM 0 HG3 LYS A 133 6.991 11.144 5.846 1.00 64.53 H new ATOM 0 HD2 LYS A 133 8.069 9.236 6.401 1.00 10.21 H new ATOM 0 HD3 LYS A 133 8.150 9.880 8.029 1.00 10.21 H new ATOM 0 HE2 LYS A 133 5.645 8.841 8.109 1.00 62.54 H new ATOM 0 HE3 LYS A 133 6.339 7.782 6.898 1.00 62.54 H new ATOM 0 HZ1 LYS A 133 6.623 6.883 9.114 1.00 34.11 H new ATOM 0 HZ2 LYS A 133 8.138 7.245 8.437 1.00 34.11 H new ATOM 0 HZ3 LYS A 133 7.465 8.271 9.611 1.00 34.11 H new ATOM 2015 N GLU A 134 8.394 12.685 10.136 1.00 25.23 N ATOM 2016 CA GLU A 134 9.672 12.884 10.811 1.00 60.44 C ATOM 2017 C GLU A 134 9.754 14.280 11.420 1.00 42.43 C ATOM 2018 O GLU A 134 9.042 15.194 11.004 1.00 21.52 O ATOM 2019 CB GLU A 134 10.829 12.673 9.832 1.00 51.45 C ATOM 2020 CG GLU A 134 11.131 11.211 9.552 1.00 65.12 C ATOM 2021 CD GLU A 134 12.567 10.984 9.120 1.00 43.51 C ATOM 2022 OE1 GLU A 134 13.444 11.768 9.540 1.00 63.14 O ATOM 2023 OE2 GLU A 134 12.813 10.023 8.362 1.00 64.11 O ATOM 0 H GLU A 134 7.962 13.541 9.789 1.00 25.23 H new ATOM 0 HA GLU A 134 9.748 12.151 11.615 1.00 60.44 H new ATOM 0 HB2 GLU A 134 10.594 13.173 8.892 1.00 51.45 H new ATOM 0 HB3 GLU A 134 11.724 13.150 10.232 1.00 51.45 H new ATOM 0 HG2 GLU A 134 10.928 10.624 10.448 1.00 65.12 H new ATOM 0 HG3 GLU A 134 10.460 10.848 8.774 1.00 65.12 H new ATOM 2030 N GLY A 135 10.629 14.438 12.409 1.00 73.01 N ATOM 2031 CA GLY A 135 10.788 15.725 13.060 1.00 30.02 C ATOM 2032 C GLY A 135 9.784 15.938 14.176 1.00 42.42 C ATOM 2033 O GLY A 135 9.377 17.068 14.446 1.00 64.02 O ATOM 0 H GLY A 135 11.230 13.698 12.771 1.00 73.01 H new ATOM 0 HA2 GLY A 135 11.797 15.802 13.464 1.00 30.02 H new ATOM 0 HA3 GLY A 135 10.679 16.519 12.321 1.00 30.02 H new ATOM 2037 N MET A 136 9.383 14.850 14.825 1.00 53.25 N ATOM 2038 CA MET A 136 8.419 14.924 15.917 1.00 44.00 C ATOM 2039 C MET A 136 8.842 15.969 16.945 1.00 62.22 C ATOM 2040 O MET A 136 8.003 16.572 17.611 1.00 14.23 O ATOM 2041 CB MET A 136 8.275 13.558 16.591 1.00 55.22 C ATOM 2042 CG MET A 136 6.831 13.158 16.849 1.00 10.34 C ATOM 2043 SD MET A 136 6.003 14.260 18.012 1.00 32.42 S ATOM 2044 CE MET A 136 4.901 13.114 18.837 1.00 33.24 C ATOM 0 H MET A 136 9.710 13.907 14.614 1.00 53.25 H new ATOM 0 HA MET A 136 7.456 15.219 15.500 1.00 44.00 H new ATOM 0 HB2 MET A 136 8.747 12.801 15.965 1.00 55.22 H new ATOM 0 HB3 MET A 136 8.815 13.570 17.538 1.00 55.22 H new ATOM 0 HG2 MET A 136 6.285 13.155 15.906 1.00 10.34 H new ATOM 0 HG3 MET A 136 6.804 12.140 17.237 1.00 10.34 H new ATOM 0 HE1 MET A 136 4.318 13.647 19.588 1.00 33.24 H new ATOM 0 HE2 MET A 136 4.228 12.666 18.106 1.00 33.24 H new ATOM 0 HE3 MET A 136 5.485 12.331 19.319 1.00 33.24 H new ATOM 2054 N ASN A 137 10.149 16.177 17.068 1.00 62.33 N ATOM 2055 CA ASN A 137 10.683 17.148 18.015 1.00 11.24 C ATOM 2056 C ASN A 137 10.008 18.505 17.841 1.00 2.41 C ATOM 2057 O ASN A 137 9.810 19.240 18.809 1.00 3.31 O ATOM 2058 CB ASN A 137 12.195 17.291 17.834 1.00 24.01 C ATOM 2059 CG ASN A 137 12.892 17.727 19.109 1.00 51.14 C ATOM 2060 OD1 ASN A 137 13.844 17.089 19.559 1.00 54.03 O ATOM 2061 ND2 ASN A 137 12.419 18.820 19.697 1.00 32.40 N ATOM 0 H ASN A 137 10.858 15.686 16.523 1.00 62.33 H new ATOM 0 HA ASN A 137 10.478 16.786 19.022 1.00 11.24 H new ATOM 0 HB2 ASN A 137 12.610 16.339 17.504 1.00 24.01 H new ATOM 0 HB3 ASN A 137 12.397 18.017 17.046 1.00 24.01 H new ATOM 0 HD21 ASN A 137 12.847 19.162 20.557 1.00 32.40 H new ATOM 0 HD22 ASN A 137 11.628 19.317 19.288 1.00 32.40 H new ATOM 2068 N ILE A 138 9.657 18.831 16.602 1.00 61.45 N ATOM 2069 CA ILE A 138 9.003 20.098 16.301 1.00 42.11 C ATOM 2070 C ILE A 138 7.615 20.163 16.929 1.00 2.21 C ATOM 2071 O ILE A 138 7.234 21.177 17.514 1.00 33.24 O ATOM 2072 CB ILE A 138 8.878 20.321 14.782 1.00 30.41 C ATOM 2073 CG1 ILE A 138 10.245 20.181 14.110 1.00 62.03 C ATOM 2074 CG2 ILE A 138 8.278 21.689 14.495 1.00 33.20 C ATOM 2075 CD1 ILE A 138 11.280 21.149 14.638 1.00 42.50 C ATOM 0 H ILE A 138 9.815 18.235 15.790 1.00 61.45 H new ATOM 0 HA ILE A 138 9.628 20.884 16.725 1.00 42.11 H new ATOM 0 HB ILE A 138 8.213 19.561 14.372 1.00 30.41 H new ATOM 0 HG12 ILE A 138 10.607 19.162 14.250 1.00 62.03 H new ATOM 0 HG13 ILE A 138 10.131 20.334 13.037 1.00 62.03 H new ATOM 0 HG21 ILE A 138 8.196 21.832 13.417 1.00 33.20 H new ATOM 0 HG22 ILE A 138 7.288 21.754 14.946 1.00 33.20 H new ATOM 0 HG23 ILE A 138 8.920 22.463 14.916 1.00 33.20 H new ATOM 0 HD11 ILE A 138 12.224 20.993 14.116 1.00 42.50 H new ATOM 0 HD12 ILE A 138 10.939 22.171 14.473 1.00 42.50 H new ATOM 0 HD13 ILE A 138 11.423 20.982 15.706 1.00 42.50 H new ATOM 2087 N VAL A 139 6.864 19.074 16.805 1.00 32.31 N ATOM 2088 CA VAL A 139 5.519 19.005 17.363 1.00 14.22 C ATOM 2089 C VAL A 139 5.549 19.108 18.884 1.00 33.30 C ATOM 2090 O VAL A 139 4.580 19.544 19.505 1.00 4.13 O ATOM 2091 CB VAL A 139 4.810 17.698 16.962 1.00 63.23 C ATOM 2092 CG1 VAL A 139 3.485 17.561 17.696 1.00 23.22 C ATOM 2093 CG2 VAL A 139 4.602 17.646 15.456 1.00 62.23 C ATOM 0 H VAL A 139 7.164 18.227 16.323 1.00 32.31 H new ATOM 0 HA VAL A 139 4.964 19.850 16.955 1.00 14.22 H new ATOM 0 HB VAL A 139 5.444 16.859 17.248 1.00 63.23 H new ATOM 0 HG11 VAL A 139 2.999 16.631 17.399 1.00 23.22 H new ATOM 0 HG12 VAL A 139 3.664 17.550 18.771 1.00 23.22 H new ATOM 0 HG13 VAL A 139 2.841 18.403 17.444 1.00 23.22 H new ATOM 0 HG21 VAL A 139 4.100 16.716 15.190 1.00 62.23 H new ATOM 0 HG22 VAL A 139 3.989 18.492 15.144 1.00 62.23 H new ATOM 0 HG23 VAL A 139 5.568 17.693 14.953 1.00 62.23 H new ATOM 2103 N GLU A 140 6.668 18.703 19.477 1.00 35.10 N ATOM 2104 CA GLU A 140 6.823 18.749 20.926 1.00 1.31 C ATOM 2105 C GLU A 140 7.138 20.167 21.394 1.00 12.14 C ATOM 2106 O GLU A 140 6.772 20.562 22.501 1.00 25.02 O ATOM 2107 CB GLU A 140 7.932 17.795 21.373 1.00 23.31 C ATOM 2108 CG GLU A 140 7.748 16.371 20.875 1.00 15.11 C ATOM 2109 CD GLU A 140 7.275 15.429 21.965 1.00 73.42 C ATOM 2110 OE1 GLU A 140 7.759 15.555 23.109 1.00 12.41 O ATOM 2111 OE2 GLU A 140 6.421 14.565 21.674 1.00 65.32 O ATOM 0 H GLU A 140 7.479 18.340 18.977 1.00 35.10 H new ATOM 0 HA GLU A 140 5.881 18.436 21.377 1.00 1.31 H new ATOM 0 HB2 GLU A 140 8.890 18.174 21.018 1.00 23.31 H new ATOM 0 HB3 GLU A 140 7.976 17.787 22.462 1.00 23.31 H new ATOM 0 HG2 GLU A 140 7.027 16.366 20.058 1.00 15.11 H new ATOM 0 HG3 GLU A 140 8.692 16.007 20.470 1.00 15.11 H new ATOM 2118 N ALA A 141 7.819 20.928 20.543 1.00 32.54 N ATOM 2119 CA ALA A 141 8.182 22.301 20.868 1.00 11.25 C ATOM 2120 C ALA A 141 6.956 23.208 20.867 1.00 11.12 C ATOM 2121 O ALA A 141 6.789 24.043 21.755 1.00 4.34 O ATOM 2122 CB ALA A 141 9.224 22.818 19.888 1.00 60.14 C ATOM 0 H ALA A 141 8.130 20.616 19.623 1.00 32.54 H new ATOM 0 HA ALA A 141 8.607 22.310 21.872 1.00 11.25 H new ATOM 0 HB1 ALA A 141 9.486 23.845 20.143 1.00 60.14 H new ATOM 0 HB2 ALA A 141 10.115 22.193 19.941 1.00 60.14 H new ATOM 0 HB3 ALA A 141 8.819 22.787 18.877 1.00 60.14 H new ATOM 2128 N MET A 142 6.101 23.038 19.864 1.00 41.21 N ATOM 2129 CA MET A 142 4.890 23.842 19.748 1.00 33.12 C ATOM 2130 C MET A 142 4.012 23.683 20.985 1.00 34.13 C ATOM 2131 O MET A 142 3.485 24.662 21.513 1.00 73.14 O ATOM 2132 CB MET A 142 4.105 23.443 18.497 1.00 40.11 C ATOM 2133 CG MET A 142 4.817 23.786 17.198 1.00 13.23 C ATOM 2134 SD MET A 142 3.673 24.207 15.869 1.00 32.25 S ATOM 2135 CE MET A 142 2.766 22.671 15.704 1.00 22.14 C ATOM 0 H MET A 142 6.224 22.351 19.120 1.00 41.21 H new ATOM 0 HA MET A 142 5.185 24.888 19.665 1.00 33.12 H new ATOM 0 HB2 MET A 142 3.914 22.370 18.525 1.00 40.11 H new ATOM 0 HB3 MET A 142 3.135 23.940 18.513 1.00 40.11 H new ATOM 0 HG2 MET A 142 5.493 24.624 17.369 1.00 13.23 H new ATOM 0 HG3 MET A 142 5.430 22.939 16.890 1.00 13.23 H new ATOM 0 HE1 MET A 142 2.080 22.742 14.860 1.00 22.14 H new ATOM 0 HE2 MET A 142 3.465 21.852 15.535 1.00 22.14 H new ATOM 0 HE3 MET A 142 2.200 22.483 16.616 1.00 22.14 H new ATOM 2145 N GLU A 143 3.859 22.444 21.442 1.00 20.13 N ATOM 2146 CA GLU A 143 3.043 22.159 22.617 1.00 64.42 C ATOM 2147 C GLU A 143 3.493 22.999 23.809 1.00 63.33 C ATOM 2148 O GLU A 143 2.705 23.292 24.708 1.00 61.31 O ATOM 2149 CB GLU A 143 3.120 20.672 22.969 1.00 34.42 C ATOM 2150 CG GLU A 143 2.097 20.239 24.006 1.00 20.43 C ATOM 2151 CD GLU A 143 2.569 20.481 25.427 1.00 34.40 C ATOM 2152 OE1 GLU A 143 3.729 20.906 25.603 1.00 23.12 O ATOM 2153 OE2 GLU A 143 1.776 20.244 26.363 1.00 51.52 O ATOM 0 H GLU A 143 4.289 21.622 21.017 1.00 20.13 H new ATOM 0 HA GLU A 143 2.010 22.417 22.382 1.00 64.42 H new ATOM 0 HB2 GLU A 143 2.977 20.085 22.062 1.00 34.42 H new ATOM 0 HB3 GLU A 143 4.120 20.446 23.340 1.00 34.42 H new ATOM 0 HG2 GLU A 143 1.165 20.779 23.840 1.00 20.43 H new ATOM 0 HG3 GLU A 143 1.879 19.179 23.875 1.00 20.43 H new ATOM 2160 N ARG A 144 4.766 23.382 23.808 1.00 12.11 N ATOM 2161 CA ARG A 144 5.322 24.187 24.889 1.00 32.44 C ATOM 2162 C ARG A 144 4.904 25.648 24.750 1.00 24.30 C ATOM 2163 O ARG A 144 4.800 26.371 25.740 1.00 15.55 O ATOM 2164 CB ARG A 144 6.848 24.080 24.900 1.00 32.24 C ATOM 2165 CG ARG A 144 7.552 25.388 24.579 1.00 62.34 C ATOM 2166 CD ARG A 144 7.678 26.271 25.810 1.00 35.32 C ATOM 2167 NE ARG A 144 9.063 26.394 26.257 1.00 54.25 N ATOM 2168 CZ ARG A 144 9.431 27.094 27.324 1.00 42.24 C ATOM 2169 NH1 ARG A 144 8.522 27.730 28.050 1.00 23.20 N ATOM 2170 NH2 ARG A 144 10.712 27.159 27.666 1.00 15.02 N ATOM 0 H ARG A 144 5.431 23.148 23.071 1.00 12.11 H new ATOM 0 HA ARG A 144 4.931 23.804 25.832 1.00 32.44 H new ATOM 0 HB2 ARG A 144 7.173 23.734 25.881 1.00 32.24 H new ATOM 0 HB3 ARG A 144 7.156 23.324 24.177 1.00 32.24 H new ATOM 0 HG2 ARG A 144 8.543 25.179 24.177 1.00 62.34 H new ATOM 0 HG3 ARG A 144 6.999 25.919 23.804 1.00 62.34 H new ATOM 0 HD2 ARG A 144 7.280 27.261 25.588 1.00 35.32 H new ATOM 0 HD3 ARG A 144 7.072 25.857 26.616 1.00 35.32 H new ATOM 0 HE ARG A 144 9.787 25.916 25.720 1.00 54.25 H new ATOM 0 HH11 ARG A 144 7.537 27.682 27.790 1.00 23.20 H new ATOM 0 HH12 ARG A 144 8.808 28.267 28.869 1.00 23.20 H new ATOM 0 HH21 ARG A 144 11.414 26.671 27.109 1.00 15.02 H new ATOM 0 HH22 ARG A 144 10.994 27.697 28.485 1.00 15.02 H new ATOM 2184 N PHE A 145 4.668 26.075 23.514 1.00 21.20 N ATOM 2185 CA PHE A 145 4.264 27.450 23.245 1.00 72.35 C ATOM 2186 C PHE A 145 2.768 27.530 22.955 1.00 33.13 C ATOM 2187 O PHE A 145 2.318 28.376 22.184 1.00 12.31 O ATOM 2188 CB PHE A 145 5.054 28.014 22.062 1.00 22.31 C ATOM 2189 CG PHE A 145 6.543 27.896 22.225 1.00 13.34 C ATOM 2190 CD1 PHE A 145 7.227 28.736 23.089 1.00 14.42 C ATOM 2191 CD2 PHE A 145 7.258 26.946 21.515 1.00 40.04 C ATOM 2192 CE1 PHE A 145 8.596 28.631 23.242 1.00 22.22 C ATOM 2193 CE2 PHE A 145 8.628 26.835 21.664 1.00 54.52 C ATOM 2194 CZ PHE A 145 9.298 27.680 22.528 1.00 73.34 C ATOM 0 H PHE A 145 4.750 25.489 22.683 1.00 21.20 H new ATOM 0 HA PHE A 145 4.477 28.045 24.133 1.00 72.35 H new ATOM 0 HB2 PHE A 145 4.754 27.493 21.153 1.00 22.31 H new ATOM 0 HB3 PHE A 145 4.793 29.064 21.928 1.00 22.31 H new ATOM 0 HD1 PHE A 145 6.683 29.482 23.650 1.00 14.42 H new ATOM 0 HD2 PHE A 145 6.739 26.284 20.837 1.00 40.04 H new ATOM 0 HE1 PHE A 145 9.117 29.292 23.919 1.00 22.22 H new ATOM 0 HE2 PHE A 145 9.174 26.089 21.106 1.00 54.52 H new ATOM 0 HZ PHE A 145 10.368 27.597 22.645 1.00 73.34 H new ATOM 2204 N GLY A 146 2.002 26.641 23.580 1.00 35.22 N ATOM 2205 CA GLY A 146 0.565 26.627 23.377 1.00 33.30 C ATOM 2206 C GLY A 146 -0.205 26.850 24.664 1.00 70.43 C ATOM 2207 O GLY A 146 0.282 26.534 25.749 1.00 21.41 O ATOM 0 H GLY A 146 2.351 25.930 24.223 1.00 35.22 H new ATOM 0 HA2 GLY A 146 0.295 27.400 22.657 1.00 33.30 H new ATOM 0 HA3 GLY A 146 0.272 25.671 22.943 1.00 33.30 H new ATOM 2211 N SER A 147 -1.410 27.397 24.543 1.00 13.13 N ATOM 2212 CA SER A 147 -2.247 27.667 25.707 1.00 42.43 C ATOM 2213 C SER A 147 -3.350 26.622 25.837 1.00 73.00 C ATOM 2214 O SER A 147 -3.889 26.144 24.838 1.00 25.23 O ATOM 2215 CB SER A 147 -2.862 29.065 25.606 1.00 63.44 C ATOM 2216 OG SER A 147 -3.333 29.507 26.867 1.00 72.24 O ATOM 0 H SER A 147 -1.829 27.662 23.652 1.00 13.13 H new ATOM 0 HA SER A 147 -1.618 27.618 26.596 1.00 42.43 H new ATOM 0 HB2 SER A 147 -2.119 29.766 25.226 1.00 63.44 H new ATOM 0 HB3 SER A 147 -3.684 29.053 24.891 1.00 63.44 H new ATOM 0 HG SER A 147 -3.720 30.403 26.776 1.00 72.24 H new ATOM 2222 N ARG A 148 -3.682 26.272 27.075 1.00 22.15 N ATOM 2223 CA ARG A 148 -4.720 25.282 27.338 1.00 41.52 C ATOM 2224 C ARG A 148 -6.105 25.863 27.068 1.00 40.01 C ATOM 2225 O ARG A 148 -6.914 26.015 27.982 1.00 3.43 O ATOM 2226 CB ARG A 148 -4.633 24.793 28.784 1.00 35.35 C ATOM 2227 CG ARG A 148 -3.337 24.068 29.106 1.00 61.54 C ATOM 2228 CD ARG A 148 -3.423 22.590 28.755 1.00 12.31 C ATOM 2229 NE ARG A 148 -4.442 21.900 29.542 1.00 62.24 N ATOM 2230 CZ ARG A 148 -4.308 21.619 30.833 1.00 12.41 C ATOM 2231 NH1 ARG A 148 -3.205 21.969 31.480 1.00 11.12 N ATOM 2232 NH2 ARG A 148 -5.280 20.988 31.480 1.00 3.42 N ATOM 0 H ARG A 148 -3.247 26.659 27.912 1.00 22.15 H new ATOM 0 HA ARG A 148 -4.562 24.438 26.667 1.00 41.52 H new ATOM 0 HB2 ARG A 148 -4.738 25.646 29.454 1.00 35.35 H new ATOM 0 HB3 ARG A 148 -5.472 24.126 28.984 1.00 35.35 H new ATOM 0 HG2 ARG A 148 -2.516 24.527 28.555 1.00 61.54 H new ATOM 0 HG3 ARG A 148 -3.111 24.179 30.166 1.00 61.54 H new ATOM 0 HD2 ARG A 148 -3.649 22.482 27.694 1.00 12.31 H new ATOM 0 HD3 ARG A 148 -2.454 22.120 28.924 1.00 12.31 H new ATOM 0 HE ARG A 148 -5.304 21.619 29.074 1.00 62.24 H new ATOM 0 HH11 ARG A 148 -2.457 22.455 30.986 1.00 11.12 H new ATOM 0 HH12 ARG A 148 -3.105 21.752 32.472 1.00 11.12 H new ATOM 0 HH21 ARG A 148 -6.131 20.719 30.986 1.00 3.42 H new ATOM 0 HH22 ARG A 148 -5.176 20.772 32.472 1.00 3.42 H new ATOM 2246 N ASN A 149 -6.370 26.185 25.806 1.00 12.51 N ATOM 2247 CA ASN A 149 -7.657 26.750 25.416 1.00 41.41 C ATOM 2248 C ASN A 149 -7.740 26.920 23.902 1.00 43.31 C ATOM 2249 O ASN A 149 -8.803 26.756 23.305 1.00 20.35 O ATOM 2250 CB ASN A 149 -7.875 28.099 26.104 1.00 11.24 C ATOM 2251 CG ASN A 149 -7.181 29.237 25.381 1.00 61.23 C ATOM 2252 OD1 ASN A 149 -7.708 29.785 24.412 1.00 20.34 O ATOM 2253 ND2 ASN A 149 -5.991 29.597 25.848 1.00 34.05 N ATOM 0 H ASN A 149 -5.711 26.065 25.037 1.00 12.51 H new ATOM 0 HA ASN A 149 -8.439 26.059 25.730 1.00 41.41 H new ATOM 0 HB2 ASN A 149 -8.944 28.306 26.160 1.00 11.24 H new ATOM 0 HB3 ASN A 149 -7.506 28.045 27.128 1.00 11.24 H new ATOM 0 HD21 ASN A 149 -5.476 30.355 25.401 1.00 34.05 H new ATOM 0 HD22 ASN A 149 -5.592 29.115 26.654 1.00 34.05 H new ATOM 2260 N GLY A 150 -6.608 27.251 23.286 1.00 35.40 N ATOM 2261 CA GLY A 150 -6.574 27.437 21.847 1.00 33.22 C ATOM 2262 C GLY A 150 -5.577 28.497 21.423 1.00 13.14 C ATOM 2263 O GLY A 150 -4.538 28.186 20.842 1.00 61.15 O ATOM 0 H GLY A 150 -5.715 27.393 23.758 1.00 35.40 H new ATOM 0 HA2 GLY A 150 -6.320 26.492 21.367 1.00 33.22 H new ATOM 0 HA3 GLY A 150 -7.568 27.716 21.496 1.00 33.22 H new ATOM 2267 N LYS A 151 -5.894 29.754 21.714 1.00 50.54 N ATOM 2268 CA LYS A 151 -5.019 30.866 21.359 1.00 72.31 C ATOM 2269 C LYS A 151 -3.594 30.612 21.841 1.00 75.11 C ATOM 2270 O LYS A 151 -3.341 29.671 22.594 1.00 4.32 O ATOM 2271 CB LYS A 151 -5.548 32.170 21.960 1.00 22.14 C ATOM 2272 CG LYS A 151 -6.811 32.681 21.289 1.00 4.52 C ATOM 2273 CD LYS A 151 -8.059 32.180 21.994 1.00 34.53 C ATOM 2274 CE LYS A 151 -9.191 33.193 21.913 1.00 3.13 C ATOM 2275 NZ LYS A 151 -9.596 33.460 20.506 1.00 54.14 N ATOM 0 H LYS A 151 -6.751 30.029 22.195 1.00 50.54 H new ATOM 0 HA LYS A 151 -5.006 30.953 20.273 1.00 72.31 H new ATOM 0 HB2 LYS A 151 -5.747 32.017 23.021 1.00 22.14 H new ATOM 0 HB3 LYS A 151 -4.774 32.934 21.888 1.00 22.14 H new ATOM 0 HG2 LYS A 151 -6.807 33.771 21.286 1.00 4.52 H new ATOM 0 HG3 LYS A 151 -6.826 32.359 20.248 1.00 4.52 H new ATOM 0 HD2 LYS A 151 -8.379 31.239 21.545 1.00 34.53 H new ATOM 0 HD3 LYS A 151 -7.829 31.973 23.039 1.00 34.53 H new ATOM 0 HE2 LYS A 151 -10.049 32.824 22.474 1.00 3.13 H new ATOM 0 HE3 LYS A 151 -8.879 34.125 22.384 1.00 3.13 H new ATOM 0 HZ1 LYS A 151 -10.413 34.103 20.496 1.00 54.14 H new ATOM 0 HZ2 LYS A 151 -8.804 33.899 19.994 1.00 54.14 H new ATOM 0 HZ3 LYS A 151 -9.854 32.565 20.043 1.00 54.14 H new ATOM 2289 N THR A 152 -2.667 31.458 21.403 1.00 62.51 N ATOM 2290 CA THR A 152 -1.268 31.325 21.790 1.00 60.01 C ATOM 2291 C THR A 152 -0.518 32.638 21.598 1.00 3.03 C ATOM 2292 O THR A 152 -0.945 33.502 20.833 1.00 12.42 O ATOM 2293 CB THR A 152 -0.563 30.221 20.979 1.00 10.02 C ATOM 2294 OG1 THR A 152 0.855 30.311 21.159 1.00 33.54 O ATOM 2295 CG2 THR A 152 -0.900 30.337 19.500 1.00 23.03 C ATOM 0 H THR A 152 -2.860 32.242 20.780 1.00 62.51 H new ATOM 0 HA THR A 152 -1.256 31.054 22.846 1.00 60.01 H new ATOM 0 HB THR A 152 -0.914 29.255 21.341 1.00 10.02 H new ATOM 0 HG1 THR A 152 1.156 29.590 21.750 1.00 33.54 H new ATOM 0 HG21 THR A 152 -0.391 29.547 18.948 1.00 23.03 H new ATOM 0 HG22 THR A 152 -1.977 30.239 19.363 1.00 23.03 H new ATOM 0 HG23 THR A 152 -0.574 31.308 19.128 1.00 23.03 H new ATOM 2303 N SER A 153 0.604 32.781 22.297 1.00 33.05 N ATOM 2304 CA SER A 153 1.412 33.991 22.206 1.00 24.03 C ATOM 2305 C SER A 153 2.197 34.023 20.898 1.00 75.01 C ATOM 2306 O SER A 153 2.120 34.988 20.137 1.00 12.25 O ATOM 2307 CB SER A 153 2.374 34.078 23.393 1.00 63.52 C ATOM 2308 OG SER A 153 3.267 32.977 23.407 1.00 33.22 O ATOM 0 H SER A 153 0.974 32.074 22.932 1.00 33.05 H new ATOM 0 HA SER A 153 0.740 34.849 22.228 1.00 24.03 H new ATOM 0 HB2 SER A 153 2.939 35.008 23.340 1.00 63.52 H new ATOM 0 HB3 SER A 153 1.807 34.103 24.324 1.00 63.52 H new ATOM 0 HG SER A 153 3.872 33.057 24.174 1.00 33.22 H new ATOM 2314 N LYS A 154 2.952 32.960 20.642 1.00 75.01 N ATOM 2315 CA LYS A 154 3.750 32.863 19.426 1.00 41.02 C ATOM 2316 C LYS A 154 2.863 32.611 18.211 1.00 72.10 C ATOM 2317 O LYS A 154 1.758 32.081 18.335 1.00 43.11 O ATOM 2318 CB LYS A 154 4.783 31.742 19.558 1.00 62.24 C ATOM 2319 CG LYS A 154 6.071 32.178 20.236 1.00 74.53 C ATOM 2320 CD LYS A 154 6.806 30.997 20.848 1.00 74.10 C ATOM 2321 CE LYS A 154 8.313 31.148 20.714 1.00 41.53 C ATOM 2322 NZ LYS A 154 8.958 31.461 22.019 1.00 34.13 N ATOM 0 H LYS A 154 3.028 32.153 21.261 1.00 75.01 H new ATOM 0 HA LYS A 154 4.268 33.812 19.285 1.00 41.02 H new ATOM 0 HB2 LYS A 154 4.345 30.920 20.124 1.00 62.24 H new ATOM 0 HB3 LYS A 154 5.017 31.356 18.566 1.00 62.24 H new ATOM 0 HG2 LYS A 154 6.716 32.673 19.510 1.00 74.53 H new ATOM 0 HG3 LYS A 154 5.845 32.909 21.012 1.00 74.53 H new ATOM 0 HD2 LYS A 154 6.540 30.908 21.901 1.00 74.10 H new ATOM 0 HD3 LYS A 154 6.487 30.076 20.360 1.00 74.10 H new ATOM 0 HE2 LYS A 154 8.736 30.227 20.312 1.00 41.53 H new ATOM 0 HE3 LYS A 154 8.536 31.940 19.999 1.00 41.53 H new ATOM 0 HZ1 LYS A 154 9.987 31.539 21.888 1.00 34.13 H new ATOM 0 HZ2 LYS A 154 8.586 32.361 22.383 1.00 34.13 H new ATOM 0 HZ3 LYS A 154 8.753 30.701 22.699 1.00 34.13 H new ATOM 2336 N LYS A 155 3.353 32.992 17.036 1.00 2.35 N ATOM 2337 CA LYS A 155 2.607 32.805 15.798 1.00 52.40 C ATOM 2338 C LYS A 155 3.244 31.719 14.937 1.00 1.33 C ATOM 2339 O LYS A 155 4.324 31.912 14.378 1.00 61.21 O ATOM 2340 CB LYS A 155 2.541 34.119 15.015 1.00 61.41 C ATOM 2341 CG LYS A 155 2.301 33.928 13.527 1.00 14.23 C ATOM 2342 CD LYS A 155 1.031 33.135 13.265 1.00 42.44 C ATOM 2343 CE LYS A 155 -0.206 33.904 13.701 1.00 34.04 C ATOM 2344 NZ LYS A 155 -0.343 35.195 12.973 1.00 52.43 N ATOM 0 H LYS A 155 4.265 33.433 16.916 1.00 2.35 H new ATOM 0 HA LYS A 155 1.595 32.492 16.056 1.00 52.40 H new ATOM 0 HB2 LYS A 155 1.744 34.738 15.427 1.00 61.41 H new ATOM 0 HB3 LYS A 155 3.474 34.664 15.157 1.00 61.41 H new ATOM 0 HG2 LYS A 155 2.230 34.901 13.041 1.00 14.23 H new ATOM 0 HG3 LYS A 155 3.152 33.411 13.083 1.00 14.23 H new ATOM 0 HD2 LYS A 155 0.960 32.901 12.203 1.00 42.44 H new ATOM 0 HD3 LYS A 155 1.077 32.185 13.798 1.00 42.44 H new ATOM 0 HE2 LYS A 155 -1.092 33.294 13.528 1.00 34.04 H new ATOM 0 HE3 LYS A 155 -0.155 34.095 14.773 1.00 34.04 H new ATOM 0 HZ1 LYS A 155 -1.306 35.566 13.102 1.00 52.43 H new ATOM 0 HZ2 LYS A 155 0.345 35.879 13.348 1.00 52.43 H new ATOM 0 HZ3 LYS A 155 -0.163 35.043 11.960 1.00 52.43 H new ATOM 2358 N ILE A 156 2.569 30.580 14.835 1.00 74.34 N ATOM 2359 CA ILE A 156 3.068 29.465 14.040 1.00 64.13 C ATOM 2360 C ILE A 156 2.557 29.540 12.605 1.00 20.21 C ATOM 2361 O ILE A 156 1.350 29.574 12.365 1.00 74.21 O ATOM 2362 CB ILE A 156 2.659 28.111 14.649 1.00 72.13 C ATOM 2363 CG1 ILE A 156 3.253 27.957 16.050 1.00 24.50 C ATOM 2364 CG2 ILE A 156 3.106 26.969 13.749 1.00 72.51 C ATOM 2365 CD1 ILE A 156 2.251 28.183 17.160 1.00 2.51 C ATOM 0 H ILE A 156 1.675 30.405 15.293 1.00 74.34 H new ATOM 0 HA ILE A 156 4.155 29.540 14.040 1.00 64.13 H new ATOM 0 HB ILE A 156 1.573 28.079 14.731 1.00 72.13 H new ATOM 0 HG12 ILE A 156 3.673 26.956 16.149 1.00 24.50 H new ATOM 0 HG13 ILE A 156 4.076 28.662 16.166 1.00 24.50 H new ATOM 0 HG21 ILE A 156 2.810 26.019 14.193 1.00 72.51 H new ATOM 0 HG22 ILE A 156 2.639 27.073 12.770 1.00 72.51 H new ATOM 0 HG23 ILE A 156 4.190 26.996 13.639 1.00 72.51 H new ATOM 0 HD11 ILE A 156 2.742 28.057 18.125 1.00 2.51 H new ATOM 0 HD12 ILE A 156 1.848 29.193 17.087 1.00 2.51 H new ATOM 0 HD13 ILE A 156 1.439 27.461 17.070 1.00 2.51 H new ATOM 2377 N THR A 157 3.484 29.564 11.652 1.00 22.35 N ATOM 2378 CA THR A 157 3.128 29.634 10.241 1.00 61.30 C ATOM 2379 C THR A 157 3.962 28.661 9.415 1.00 42.53 C ATOM 2380 O THR A 157 5.005 28.185 9.865 1.00 13.31 O ATOM 2381 CB THR A 157 3.318 31.057 9.684 1.00 53.13 C ATOM 2382 OG1 THR A 157 4.040 31.859 10.624 1.00 4.23 O ATOM 2383 CG2 THR A 157 1.974 31.704 9.384 1.00 10.54 C ATOM 0 H THR A 157 4.487 29.536 11.833 1.00 22.35 H new ATOM 0 HA THR A 157 2.076 29.360 10.166 1.00 61.30 H new ATOM 0 HB THR A 157 3.885 30.987 8.756 1.00 53.13 H new ATOM 0 HG1 THR A 157 4.158 32.762 10.261 1.00 4.23 H new ATOM 0 HG21 THR A 157 2.133 32.708 8.992 1.00 10.54 H new ATOM 0 HG22 THR A 157 1.439 31.107 8.646 1.00 10.54 H new ATOM 0 HG23 THR A 157 1.385 31.761 10.300 1.00 10.54 H new ATOM 2391 N ILE A 158 3.498 28.371 8.204 1.00 13.51 N ATOM 2392 CA ILE A 158 4.203 27.457 7.315 1.00 51.04 C ATOM 2393 C ILE A 158 5.098 28.217 6.342 1.00 52.23 C ATOM 2394 O ILE A 158 4.624 29.046 5.565 1.00 3.22 O ATOM 2395 CB ILE A 158 3.221 26.581 6.514 1.00 0.11 C ATOM 2396 CG1 ILE A 158 2.060 26.134 7.405 1.00 70.14 C ATOM 2397 CG2 ILE A 158 3.942 25.376 5.929 1.00 22.25 C ATOM 2398 CD1 ILE A 158 0.967 25.407 6.653 1.00 51.33 C ATOM 0 H ILE A 158 2.637 28.756 7.816 1.00 13.51 H new ATOM 0 HA ILE A 158 4.818 26.816 7.946 1.00 51.04 H new ATOM 0 HB ILE A 158 2.817 27.172 5.692 1.00 0.11 H new ATOM 0 HG12 ILE A 158 2.445 25.483 8.190 1.00 70.14 H new ATOM 0 HG13 ILE A 158 1.632 27.008 7.897 1.00 70.14 H new ATOM 0 HG21 ILE A 158 3.235 24.767 5.366 1.00 22.25 H new ATOM 0 HG22 ILE A 158 4.738 25.715 5.266 1.00 22.25 H new ATOM 0 HG23 ILE A 158 4.371 24.782 6.736 1.00 22.25 H new ATOM 0 HD11 ILE A 158 0.177 25.120 7.347 1.00 51.33 H new ATOM 0 HD12 ILE A 158 0.555 26.063 5.886 1.00 51.33 H new ATOM 0 HD13 ILE A 158 1.380 24.514 6.184 1.00 51.33 H new ATOM 2410 N ALA A 159 6.394 27.927 6.389 1.00 50.43 N ATOM 2411 CA ALA A 159 7.355 28.581 5.509 1.00 62.41 C ATOM 2412 C ALA A 159 7.438 27.870 4.162 1.00 15.41 C ATOM 2413 O ALA A 159 7.360 28.504 3.110 1.00 44.35 O ATOM 2414 CB ALA A 159 8.726 28.628 6.167 1.00 10.14 C ATOM 0 H ALA A 159 6.803 27.244 7.027 1.00 50.43 H new ATOM 0 HA ALA A 159 7.013 29.601 5.332 1.00 62.41 H new ATOM 0 HB1 ALA A 159 9.434 29.119 5.499 1.00 10.14 H new ATOM 0 HB2 ALA A 159 8.662 29.186 7.101 1.00 10.14 H new ATOM 0 HB3 ALA A 159 9.066 27.613 6.373 1.00 10.14 H new ATOM 2420 N ASP A 160 7.595 26.552 4.203 1.00 62.05 N ATOM 2421 CA ASP A 160 7.688 25.755 2.985 1.00 53.24 C ATOM 2422 C ASP A 160 7.054 24.382 3.184 1.00 21.01 C ATOM 2423 O ASP A 160 6.946 23.895 4.310 1.00 10.13 O ATOM 2424 CB ASP A 160 9.149 25.600 2.561 1.00 22.33 C ATOM 2425 CG ASP A 160 9.289 25.041 1.159 1.00 44.32 C ATOM 2426 OD1 ASP A 160 8.312 25.126 0.386 1.00 42.15 O ATOM 2427 OD2 ASP A 160 10.377 24.520 0.834 1.00 13.31 O ATOM 0 H ASP A 160 7.661 26.012 5.066 1.00 62.05 H new ATOM 0 HA ASP A 160 7.143 26.276 2.197 1.00 53.24 H new ATOM 0 HB2 ASP A 160 9.644 26.570 2.613 1.00 22.33 H new ATOM 0 HB3 ASP A 160 9.660 24.942 3.264 1.00 22.33 H new ATOM 2432 N CYS A 161 6.636 23.764 2.085 1.00 25.32 N ATOM 2433 CA CYS A 161 6.011 22.447 2.139 1.00 25.25 C ATOM 2434 C CYS A 161 5.951 21.816 0.752 1.00 13.21 C ATOM 2435 O CYS A 161 5.767 22.508 -0.248 1.00 41.52 O ATOM 2436 CB CYS A 161 4.604 22.551 2.728 1.00 54.44 C ATOM 2437 SG CYS A 161 3.889 24.210 2.642 1.00 3.22 S ATOM 0 H CYS A 161 6.718 24.153 1.146 1.00 25.32 H new ATOM 0 HA CYS A 161 6.619 21.810 2.781 1.00 25.25 H new ATOM 0 HB2 CYS A 161 3.949 21.857 2.201 1.00 54.44 H new ATOM 0 HB3 CYS A 161 4.633 22.233 3.770 1.00 54.44 H new ATOM 0 HG CYS A 161 2.698 24.197 3.163 1.00 3.22 H new ATOM 2443 N GLY A 162 6.108 20.497 0.700 1.00 60.13 N ATOM 2444 CA GLY A 162 6.070 19.795 -0.570 1.00 13.11 C ATOM 2445 C GLY A 162 6.282 18.302 -0.414 1.00 0.31 C ATOM 2446 O GLY A 162 6.610 17.827 0.672 1.00 24.45 O ATOM 0 H GLY A 162 6.261 19.902 1.514 1.00 60.13 H new ATOM 0 HA2 GLY A 162 5.109 19.974 -1.052 1.00 13.11 H new ATOM 0 HA3 GLY A 162 6.837 20.201 -1.229 1.00 13.11 H new ATOM 2450 N GLN A 163 6.093 17.562 -1.502 1.00 15.44 N ATOM 2451 CA GLN A 163 6.263 16.114 -1.479 1.00 42.51 C ATOM 2452 C GLN A 163 7.717 15.742 -1.207 1.00 71.12 C ATOM 2453 O GLN A 163 8.639 16.397 -1.696 1.00 34.11 O ATOM 2454 CB GLN A 163 5.808 15.505 -2.806 1.00 50.44 C ATOM 2455 CG GLN A 163 4.434 14.859 -2.740 1.00 32.15 C ATOM 2456 CD GLN A 163 3.996 14.279 -4.070 1.00 25.50 C ATOM 2457 OE1 GLN A 163 3.619 15.010 -4.986 1.00 1.24 O ATOM 2458 NE2 GLN A 163 4.045 12.956 -4.184 1.00 41.41 N ATOM 0 H GLN A 163 5.822 17.941 -2.409 1.00 15.44 H new ATOM 0 HA GLN A 163 5.647 15.713 -0.674 1.00 42.51 H new ATOM 0 HB2 GLN A 163 5.798 16.284 -3.569 1.00 50.44 H new ATOM 0 HB3 GLN A 163 6.536 14.758 -3.122 1.00 50.44 H new ATOM 0 HG2 GLN A 163 4.444 14.069 -1.989 1.00 32.15 H new ATOM 0 HG3 GLN A 163 3.704 15.600 -2.413 1.00 32.15 H new ATOM 0 HE21 GLN A 163 4.364 12.388 -3.399 1.00 41.41 H new ATOM 0 HE22 GLN A 163 3.764 12.509 -5.056 1.00 41.41 H new ATOM 2467 N LEU A 164 7.916 14.687 -0.425 1.00 34.11 N ATOM 2468 CA LEU A 164 9.258 14.227 -0.087 1.00 61.32 C ATOM 2469 C LEU A 164 9.722 13.144 -1.056 1.00 63.11 C ATOM 2470 O LEU A 164 10.764 13.277 -1.697 1.00 3.11 O ATOM 2471 CB LEU A 164 9.290 13.692 1.346 1.00 40.42 C ATOM 2472 CG LEU A 164 9.223 14.743 2.455 1.00 30.53 C ATOM 2473 CD1 LEU A 164 10.592 15.363 2.686 1.00 51.51 C ATOM 2474 CD2 LEU A 164 8.199 15.815 2.113 1.00 45.40 C ATOM 0 H LEU A 164 7.165 14.134 -0.013 1.00 34.11 H new ATOM 0 HA LEU A 164 9.937 15.076 -0.166 1.00 61.32 H new ATOM 0 HB2 LEU A 164 8.455 13.003 1.474 1.00 40.42 H new ATOM 0 HB3 LEU A 164 10.204 13.113 1.476 1.00 40.42 H new ATOM 0 HG LEU A 164 8.910 14.252 3.376 1.00 30.53 H new ATOM 0 HD11 LEU A 164 10.525 16.108 3.478 1.00 51.51 H new ATOM 0 HD12 LEU A 164 11.299 14.586 2.978 1.00 51.51 H new ATOM 0 HD13 LEU A 164 10.935 15.840 1.768 1.00 51.51 H new ATOM 0 HD21 LEU A 164 8.165 16.554 2.913 1.00 45.40 H new ATOM 0 HD22 LEU A 164 8.481 16.303 1.180 1.00 45.40 H new ATOM 0 HD23 LEU A 164 7.216 15.357 2.000 1.00 45.40 H new ATOM 2486 N GLU A 165 8.940 12.074 -1.159 1.00 23.22 N ATOM 2487 CA GLU A 165 9.272 10.969 -2.051 1.00 54.21 C ATOM 2488 C GLU A 165 9.579 11.478 -3.456 1.00 50.44 C ATOM 2489 O GLU A 165 8.666 11.924 -4.149 1.00 74.14 O ATOM 2490 CB GLU A 165 8.120 9.963 -2.102 1.00 63.40 C ATOM 2491 CG GLU A 165 8.518 8.561 -1.672 1.00 61.40 C ATOM 2492 CD GLU A 165 9.888 8.160 -2.184 1.00 0.10 C ATOM 2493 OE1 GLU A 165 10.021 7.930 -3.404 1.00 75.43 O ATOM 2494 OE2 GLU A 165 10.827 8.077 -1.365 1.00 60.31 O ATOM 0 H GLU A 165 8.073 11.949 -0.636 1.00 23.22 H new ATOM 0 HA GLU A 165 10.161 10.474 -1.660 1.00 54.21 H new ATOM 0 HB2 GLU A 165 7.312 10.315 -1.461 1.00 63.40 H new ATOM 0 HB3 GLU A 165 7.727 9.925 -3.118 1.00 63.40 H new ATOM 0 HG2 GLU A 165 8.510 8.503 -0.584 1.00 61.40 H new ATOM 0 HG3 GLU A 165 7.776 7.850 -2.035 1.00 61.40 H new