USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1071 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 Single : A 3 THR OG1 : rot 140:sc= 0.694 USER MOD Single : A 9 SER OG : rot -43:sc= 0.188 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot -102:sc= 0.203 USER MOD Single : A 28 ASN : amide:sc= -0.0356 X(o=-0.036,f=-0.0064) USER MOD Single : A 30 LYS NZ :NH3+ -113:sc= -0.838 (180deg=-2.35!) USER MOD Single : A 31 THR OG1 : rot 130:sc= 0 USER MOD Single : A 34 THR OG1 : rot -123:sc= -0.166 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00713) USER MOD Single : A 41 LYS NZ :NH3+ 135:sc= 0.0863 (180deg=-0.322) USER MOD Single : A 46 LYS NZ :NH3+ -108:sc= 0.765 (180deg=-0.0272) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -0.103 X(o=-0.1,f=0) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.017 USER MOD Single : A 72 TYR OH : rot -134:sc= 0.0476 USER MOD Single : A 74 GLN : amide:sc= -0.194 X(o=-0.19,f=-0.42) USER MOD Single : A 75 LYS NZ :NH3+ 173:sc= -0.0174 (180deg=-0.086) USER MOD Single : A 84 MET CE :methyl -114:sc= -0.194 (180deg=-1.77) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 89 GLN :FLIP amide:sc= -0.375 F(o=-1.8!,f=-0.37) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 100 LYS NZ :NH3+ -171:sc= -0.0253 (180deg=-0.149) USER MOD Single : A 101 LYS NZ :NH3+ -168:sc= -0.193 (180deg=-0.61!) USER MOD Single : A 109 THR OG1 : rot 150:sc= -0.0229 USER MOD Single : A 111 ASN : amide:sc= -0.0243 X(o=-0.024,f=0) USER MOD Single : A 116 LYS NZ :NH3+ 157:sc= 1.04 (180deg=0.683) USER MOD Single : A 117 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00141) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ -169:sc= 0.307 (180deg=0.145) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 1.232 14.105 0.409 1.00 4.05 N ATOM 21 CA GLY A 2 2.035 12.878 0.371 1.00 4.44 C ATOM 22 C GLY A 2 1.291 11.662 0.922 1.00 40.24 C ATOM 23 O GLY A 2 1.330 11.392 2.123 1.00 12.32 O ATOM 0 HA2 GLY A 2 2.335 12.678 -0.658 1.00 4.44 H new ATOM 0 HA3 GLY A 2 2.948 13.030 0.946 1.00 4.44 H new ATOM 27 N THR A 3 0.603 10.940 0.032 1.00 32.43 N ATOM 28 CA THR A 3 -0.245 9.792 0.387 1.00 61.01 C ATOM 29 C THR A 3 0.394 8.488 -0.143 1.00 21.40 C ATOM 30 O THR A 3 0.438 8.266 -1.352 1.00 13.53 O ATOM 31 CB THR A 3 -1.667 10.023 -0.228 1.00 52.23 C ATOM 32 OG1 THR A 3 -2.208 11.265 0.272 1.00 33.12 O ATOM 33 CG2 THR A 3 -2.644 8.883 0.074 1.00 42.51 C ATOM 0 H THR A 3 0.618 11.137 -0.969 1.00 32.43 H new ATOM 0 HA THR A 3 -0.336 9.698 1.469 1.00 61.01 H new ATOM 0 HB THR A 3 -1.546 10.060 -1.311 1.00 52.23 H new ATOM 0 HG1 THR A 3 -2.672 11.735 -0.452 1.00 33.12 H new ATOM 0 HG21 THR A 3 -3.611 9.103 -0.379 1.00 42.51 H new ATOM 0 HG22 THR A 3 -2.254 7.951 -0.336 1.00 42.51 H new ATOM 0 HG23 THR A 3 -2.763 8.782 1.153 1.00 42.51 H new ATOM 41 N VAL A 4 0.905 7.639 0.773 1.00 33.41 N ATOM 42 CA VAL A 4 1.601 6.383 0.415 1.00 24.41 C ATOM 43 C VAL A 4 0.689 5.180 0.744 1.00 14.44 C ATOM 44 O VAL A 4 0.495 4.839 1.909 1.00 21.43 O ATOM 45 CB VAL A 4 2.985 6.257 1.177 1.00 52.15 C ATOM 46 CG1 VAL A 4 3.767 5.006 0.722 1.00 31.44 C ATOM 47 CG2 VAL A 4 3.843 7.530 0.994 1.00 11.33 C ATOM 0 H VAL A 4 0.848 7.803 1.778 1.00 33.41 H new ATOM 0 HA VAL A 4 1.815 6.394 -0.654 1.00 24.41 H new ATOM 0 HB VAL A 4 2.762 6.147 2.238 1.00 52.15 H new ATOM 0 HG11 VAL A 4 4.711 4.950 1.264 1.00 31.44 H new ATOM 0 HG12 VAL A 4 3.177 4.113 0.928 1.00 31.44 H new ATOM 0 HG13 VAL A 4 3.966 5.071 -0.348 1.00 31.44 H new ATOM 0 HG21 VAL A 4 4.786 7.413 1.528 1.00 11.33 H new ATOM 0 HG22 VAL A 4 4.043 7.684 -0.066 1.00 11.33 H new ATOM 0 HG23 VAL A 4 3.305 8.391 1.391 1.00 11.33 H new ATOM 57 N VAL A 5 0.113 4.560 -0.296 1.00 53.42 N ATOM 58 CA VAL A 5 -0.799 3.409 -0.149 1.00 13.12 C ATOM 59 C VAL A 5 0.010 2.096 -0.229 1.00 50.33 C ATOM 60 O VAL A 5 0.457 1.708 -1.303 1.00 63.32 O ATOM 61 CB VAL A 5 -1.935 3.444 -1.249 1.00 71.15 C ATOM 62 CG1 VAL A 5 -2.948 2.288 -1.066 1.00 54.43 C ATOM 63 CG2 VAL A 5 -2.650 4.818 -1.259 1.00 1.23 C ATOM 0 H VAL A 5 0.264 4.840 -1.265 1.00 53.42 H new ATOM 0 HA VAL A 5 -1.286 3.464 0.825 1.00 13.12 H new ATOM 0 HB VAL A 5 -1.457 3.302 -2.218 1.00 71.15 H new ATOM 0 HG11 VAL A 5 -3.712 2.348 -1.841 1.00 54.43 H new ATOM 0 HG12 VAL A 5 -2.428 1.333 -1.142 1.00 54.43 H new ATOM 0 HG13 VAL A 5 -3.418 2.368 -0.086 1.00 54.43 H new ATOM 0 HG21 VAL A 5 -3.427 4.818 -2.023 1.00 1.23 H new ATOM 0 HG22 VAL A 5 -3.101 5.001 -0.283 1.00 1.23 H new ATOM 0 HG23 VAL A 5 -1.926 5.603 -1.477 1.00 1.23 H new ATOM 73 N ILE A 6 0.203 1.435 0.923 1.00 15.32 N ATOM 74 CA ILE A 6 1.023 0.214 1.037 1.00 31.11 C ATOM 75 C ILE A 6 0.137 -1.034 0.881 1.00 0.20 C ATOM 76 O ILE A 6 -0.609 -1.391 1.794 1.00 75.11 O ATOM 77 CB ILE A 6 1.791 0.183 2.422 1.00 33.31 C ATOM 78 CG1 ILE A 6 2.769 1.392 2.533 1.00 63.11 C ATOM 79 CG2 ILE A 6 2.546 -1.153 2.647 1.00 44.04 C ATOM 80 CD1 ILE A 6 3.804 1.471 1.422 1.00 35.10 C ATOM 0 H ILE A 6 -0.207 1.733 1.808 1.00 15.32 H new ATOM 0 HA ILE A 6 1.765 0.218 0.239 1.00 31.11 H new ATOM 0 HB ILE A 6 1.040 0.262 3.208 1.00 33.31 H new ATOM 0 HG12 ILE A 6 2.188 2.314 2.537 1.00 63.11 H new ATOM 0 HG13 ILE A 6 3.286 1.338 3.491 1.00 63.11 H new ATOM 0 HG21 ILE A 6 3.056 -1.125 3.610 1.00 44.04 H new ATOM 0 HG22 ILE A 6 1.835 -1.979 2.637 1.00 44.04 H new ATOM 0 HG23 ILE A 6 3.278 -1.295 1.852 1.00 44.04 H new ATOM 0 HD11 ILE A 6 4.441 2.341 1.579 1.00 35.10 H new ATOM 0 HD12 ILE A 6 4.415 0.568 1.429 1.00 35.10 H new ATOM 0 HD13 ILE A 6 3.299 1.560 0.460 1.00 35.10 H new ATOM 92 N VAL A 7 0.209 -1.672 -0.293 1.00 64.01 N ATOM 93 CA VAL A 7 -0.498 -2.934 -0.570 1.00 51.44 C ATOM 94 C VAL A 7 0.448 -4.113 -0.272 1.00 33.32 C ATOM 95 O VAL A 7 1.606 -4.101 -0.688 1.00 55.31 O ATOM 96 CB VAL A 7 -1.015 -2.998 -2.057 1.00 53.23 C ATOM 97 CG1 VAL A 7 -1.778 -4.313 -2.342 1.00 1.23 C ATOM 98 CG2 VAL A 7 -1.889 -1.760 -2.381 1.00 44.55 C ATOM 0 H VAL A 7 0.759 -1.330 -1.081 1.00 64.01 H new ATOM 0 HA VAL A 7 -1.375 -2.992 0.074 1.00 51.44 H new ATOM 0 HB VAL A 7 -0.145 -2.985 -2.714 1.00 53.23 H new ATOM 0 HG11 VAL A 7 -2.118 -4.319 -3.377 1.00 1.23 H new ATOM 0 HG12 VAL A 7 -1.116 -5.162 -2.173 1.00 1.23 H new ATOM 0 HG13 VAL A 7 -2.638 -4.386 -1.677 1.00 1.23 H new ATOM 0 HG21 VAL A 7 -2.238 -1.820 -3.412 1.00 44.55 H new ATOM 0 HG22 VAL A 7 -2.747 -1.734 -1.709 1.00 44.55 H new ATOM 0 HG23 VAL A 7 -1.298 -0.853 -2.250 1.00 44.55 H new ATOM 108 N VAL A 8 -0.050 -5.096 0.490 1.00 11.54 N ATOM 109 CA VAL A 8 0.688 -6.306 0.892 1.00 62.44 C ATOM 110 C VAL A 8 -0.146 -7.541 0.506 1.00 21.43 C ATOM 111 O VAL A 8 -1.212 -7.759 1.081 1.00 71.52 O ATOM 112 CB VAL A 8 0.959 -6.308 2.456 1.00 34.12 C ATOM 113 CG1 VAL A 8 1.567 -7.650 2.939 1.00 23.14 C ATOM 114 CG2 VAL A 8 1.849 -5.108 2.865 1.00 62.31 C ATOM 0 H VAL A 8 -1.002 -5.073 0.855 1.00 11.54 H new ATOM 0 HA VAL A 8 1.651 -6.326 0.382 1.00 62.44 H new ATOM 0 HB VAL A 8 -0.005 -6.199 2.952 1.00 34.12 H new ATOM 0 HG11 VAL A 8 1.736 -7.607 4.015 1.00 23.14 H new ATOM 0 HG12 VAL A 8 0.878 -8.464 2.712 1.00 23.14 H new ATOM 0 HG13 VAL A 8 2.515 -7.824 2.430 1.00 23.14 H new ATOM 0 HG21 VAL A 8 2.020 -5.132 3.941 1.00 62.31 H new ATOM 0 HG22 VAL A 8 2.805 -5.170 2.344 1.00 62.31 H new ATOM 0 HG23 VAL A 8 1.350 -4.177 2.598 1.00 62.31 H new ATOM 124 N SER A 9 0.314 -8.303 -0.501 1.00 43.40 N ATOM 125 CA SER A 9 -0.312 -9.578 -0.917 1.00 14.11 C ATOM 126 C SER A 9 0.790 -10.561 -1.328 1.00 52.41 C ATOM 127 O SER A 9 1.741 -10.154 -1.984 1.00 12.44 O ATOM 128 CB SER A 9 -1.291 -9.337 -2.096 1.00 35.22 C ATOM 129 OG SER A 9 -2.279 -8.372 -1.766 1.00 52.10 O ATOM 0 H SER A 9 1.134 -8.054 -1.054 1.00 43.40 H new ATOM 0 HA SER A 9 -0.880 -9.996 -0.086 1.00 14.11 H new ATOM 0 HB2 SER A 9 -0.733 -9.003 -2.971 1.00 35.22 H new ATOM 0 HB3 SER A 9 -1.774 -10.276 -2.366 1.00 35.22 H new ATOM 0 HG SER A 9 -2.611 -8.541 -0.860 1.00 52.10 H new ATOM 135 N ARG A 10 0.684 -11.850 -0.934 1.00 12.25 N ATOM 136 CA ARG A 10 1.716 -12.860 -1.287 1.00 73.51 C ATOM 137 C ARG A 10 1.519 -13.329 -2.742 1.00 14.33 C ATOM 138 O ARG A 10 2.484 -13.601 -3.457 1.00 20.25 O ATOM 139 CB ARG A 10 1.696 -14.076 -0.283 1.00 30.02 C ATOM 140 CG ARG A 10 0.917 -15.336 -0.750 1.00 32.23 C ATOM 141 CD ARG A 10 0.758 -16.395 0.356 1.00 23.51 C ATOM 142 NE ARG A 10 0.203 -17.662 -0.153 1.00 74.50 N ATOM 143 CZ ARG A 10 -0.949 -18.230 0.235 1.00 34.01 C ATOM 144 NH1 ARG A 10 -1.725 -17.655 1.151 1.00 34.21 N ATOM 145 NH2 ARG A 10 -1.299 -19.397 -0.290 1.00 53.01 N ATOM 0 H ARG A 10 -0.091 -12.215 -0.380 1.00 12.25 H new ATOM 0 HA ARG A 10 2.698 -12.394 -1.205 1.00 73.51 H new ATOM 0 HB2 ARG A 10 2.726 -14.367 -0.076 1.00 30.02 H new ATOM 0 HB3 ARG A 10 1.265 -13.736 0.659 1.00 30.02 H new ATOM 0 HG2 ARG A 10 -0.070 -15.036 -1.101 1.00 32.23 H new ATOM 0 HG3 ARG A 10 1.435 -15.782 -1.599 1.00 32.23 H new ATOM 0 HD2 ARG A 10 1.728 -16.585 0.815 1.00 23.51 H new ATOM 0 HD3 ARG A 10 0.107 -16.005 1.138 1.00 23.51 H new ATOM 0 HE ARG A 10 0.744 -18.152 -0.865 1.00 74.50 H new ATOM 0 HH11 ARG A 10 -1.447 -16.768 1.570 1.00 34.21 H new ATOM 0 HH12 ARG A 10 -2.597 -18.102 1.433 1.00 34.21 H new ATOM 0 HH21 ARG A 10 -0.696 -19.848 -0.977 1.00 53.01 H new ATOM 0 HH22 ARG A 10 -2.171 -19.843 -0.006 1.00 53.01 H new ATOM 159 N ASP A 11 0.245 -13.390 -3.160 1.00 53.43 N ATOM 160 CA ASP A 11 -0.177 -13.946 -4.457 1.00 41.50 C ATOM 161 C ASP A 11 -0.059 -12.887 -5.570 1.00 24.11 C ATOM 162 O ASP A 11 -0.714 -11.846 -5.497 1.00 34.42 O ATOM 163 CB ASP A 11 -1.642 -14.453 -4.319 1.00 73.40 C ATOM 164 CG ASP A 11 -2.213 -15.238 -5.518 1.00 75.33 C ATOM 165 OD1 ASP A 11 -3.431 -15.528 -5.502 1.00 33.31 O ATOM 166 OD2 ASP A 11 -1.464 -15.587 -6.462 1.00 31.31 O ATOM 0 H ASP A 11 -0.534 -13.049 -2.597 1.00 53.43 H new ATOM 0 HA ASP A 11 0.473 -14.776 -4.734 1.00 41.50 H new ATOM 0 HB2 ASP A 11 -1.702 -15.088 -3.435 1.00 73.40 H new ATOM 0 HB3 ASP A 11 -2.285 -13.592 -4.137 1.00 73.40 H new ATOM 171 N GLU A 12 0.766 -13.196 -6.602 1.00 65.44 N ATOM 172 CA GLU A 12 1.032 -12.303 -7.762 1.00 25.05 C ATOM 173 C GLU A 12 -0.245 -12.003 -8.554 1.00 34.33 C ATOM 174 O GLU A 12 -0.358 -10.936 -9.168 1.00 54.21 O ATOM 175 CB GLU A 12 2.107 -12.917 -8.703 1.00 1.33 C ATOM 176 CG GLU A 12 3.427 -13.234 -7.990 1.00 45.51 C ATOM 177 CD GLU A 12 4.564 -13.674 -8.927 1.00 54.43 C ATOM 178 OE1 GLU A 12 5.216 -12.795 -9.536 1.00 30.41 O ATOM 179 OE2 GLU A 12 4.828 -14.891 -9.043 1.00 23.24 O ATOM 0 H GLU A 12 1.271 -14.081 -6.654 1.00 65.44 H new ATOM 0 HA GLU A 12 1.409 -11.363 -7.359 1.00 25.05 H new ATOM 0 HB2 GLU A 12 1.713 -13.831 -9.146 1.00 1.33 H new ATOM 0 HB3 GLU A 12 2.302 -12.224 -9.522 1.00 1.33 H new ATOM 0 HG2 GLU A 12 3.749 -12.351 -7.437 1.00 45.51 H new ATOM 0 HG3 GLU A 12 3.250 -14.022 -7.258 1.00 45.51 H new ATOM 186 N ARG A 13 -1.194 -12.959 -8.520 1.00 41.34 N ATOM 187 CA ARG A 13 -2.538 -12.793 -9.094 1.00 0.43 C ATOM 188 C ARG A 13 -3.225 -11.534 -8.534 1.00 51.44 C ATOM 189 O ARG A 13 -3.831 -10.772 -9.284 1.00 22.12 O ATOM 190 CB ARG A 13 -3.399 -14.064 -8.809 1.00 11.21 C ATOM 191 CG ARG A 13 -3.307 -15.187 -9.870 1.00 62.44 C ATOM 192 CD ARG A 13 -4.045 -14.819 -11.174 1.00 73.13 C ATOM 193 NE ARG A 13 -5.442 -14.425 -10.899 1.00 21.01 N ATOM 194 CZ ARG A 13 -6.549 -15.109 -11.246 1.00 20.35 C ATOM 195 NH1 ARG A 13 -6.479 -16.262 -11.909 1.00 0.53 N ATOM 196 NH2 ARG A 13 -7.738 -14.645 -10.878 1.00 60.25 N ATOM 0 H ARG A 13 -1.046 -13.872 -8.090 1.00 41.34 H new ATOM 0 HA ARG A 13 -2.441 -12.667 -10.172 1.00 0.43 H new ATOM 0 HB2 ARG A 13 -3.100 -14.475 -7.845 1.00 11.21 H new ATOM 0 HB3 ARG A 13 -4.442 -13.761 -8.717 1.00 11.21 H new ATOM 0 HG2 ARG A 13 -2.259 -15.389 -10.092 1.00 62.44 H new ATOM 0 HG3 ARG A 13 -3.730 -16.105 -9.462 1.00 62.44 H new ATOM 0 HD2 ARG A 13 -3.524 -14.001 -11.672 1.00 73.13 H new ATOM 0 HD3 ARG A 13 -4.031 -15.669 -11.856 1.00 73.13 H new ATOM 0 HE ARG A 13 -5.582 -13.548 -10.397 1.00 21.01 H new ATOM 0 HH11 ARG A 13 -5.571 -16.648 -12.167 1.00 0.53 H new ATOM 0 HH12 ARG A 13 -7.334 -16.759 -12.159 1.00 0.53 H new ATOM 0 HH21 ARG A 13 -7.804 -13.781 -10.340 1.00 60.25 H new ATOM 0 HH22 ARG A 13 -8.585 -15.153 -11.134 1.00 60.25 H new ATOM 210 N ILE A 14 -3.085 -11.313 -7.218 1.00 15.40 N ATOM 211 CA ILE A 14 -3.716 -10.179 -6.532 1.00 22.13 C ATOM 212 C ILE A 14 -3.018 -8.842 -6.911 1.00 74.24 C ATOM 213 O ILE A 14 -3.701 -7.896 -7.306 1.00 0.12 O ATOM 214 CB ILE A 14 -3.743 -10.398 -4.965 1.00 70.42 C ATOM 215 CG1 ILE A 14 -4.401 -11.779 -4.616 1.00 74.21 C ATOM 216 CG2 ILE A 14 -4.494 -9.243 -4.253 1.00 61.02 C ATOM 217 CD1 ILE A 14 -4.464 -12.107 -3.128 1.00 64.11 C ATOM 0 H ILE A 14 -2.534 -11.913 -6.604 1.00 15.40 H new ATOM 0 HA ILE A 14 -4.751 -10.117 -6.867 1.00 22.13 H new ATOM 0 HB ILE A 14 -2.714 -10.402 -4.607 1.00 70.42 H new ATOM 0 HG12 ILE A 14 -5.414 -11.794 -5.019 1.00 74.21 H new ATOM 0 HG13 ILE A 14 -3.845 -12.568 -5.123 1.00 74.21 H new ATOM 0 HG21 ILE A 14 -4.497 -9.420 -3.177 1.00 61.02 H new ATOM 0 HG22 ILE A 14 -3.993 -8.298 -4.464 1.00 61.02 H new ATOM 0 HG23 ILE A 14 -5.521 -9.198 -4.616 1.00 61.02 H new ATOM 0 HD11 ILE A 14 -4.935 -13.080 -2.990 1.00 64.11 H new ATOM 0 HD12 ILE A 14 -3.454 -12.131 -2.718 1.00 64.11 H new ATOM 0 HD13 ILE A 14 -5.048 -11.345 -2.612 1.00 64.11 H new ATOM 229 N LEU A 15 -1.654 -8.796 -6.859 1.00 5.15 N ATOM 230 CA LEU A 15 -0.873 -7.543 -7.121 1.00 3.32 C ATOM 231 C LEU A 15 -1.143 -6.951 -8.527 1.00 73.53 C ATOM 232 O LEU A 15 -1.288 -5.733 -8.669 1.00 44.24 O ATOM 233 CB LEU A 15 0.673 -7.740 -6.961 1.00 34.35 C ATOM 234 CG LEU A 15 1.243 -7.957 -5.514 1.00 12.30 C ATOM 235 CD1 LEU A 15 0.642 -6.970 -4.482 1.00 62.03 C ATOM 236 CD2 LEU A 15 1.110 -9.416 -5.053 1.00 13.15 C ATOM 0 H LEU A 15 -1.074 -9.606 -6.640 1.00 5.15 H new ATOM 0 HA LEU A 15 -1.224 -6.845 -6.361 1.00 3.32 H new ATOM 0 HB2 LEU A 15 0.965 -8.598 -7.567 1.00 34.35 H new ATOM 0 HB3 LEU A 15 1.167 -6.866 -7.387 1.00 34.35 H new ATOM 0 HG LEU A 15 2.309 -7.735 -5.571 1.00 12.30 H new ATOM 0 HD11 LEU A 15 1.071 -7.165 -3.499 1.00 62.03 H new ATOM 0 HD12 LEU A 15 0.870 -5.947 -4.781 1.00 62.03 H new ATOM 0 HD13 LEU A 15 -0.439 -7.103 -4.439 1.00 62.03 H new ATOM 0 HD21 LEU A 15 1.517 -9.518 -4.047 1.00 13.15 H new ATOM 0 HD22 LEU A 15 0.058 -9.702 -5.049 1.00 13.15 H new ATOM 0 HD23 LEU A 15 1.660 -10.065 -5.735 1.00 13.15 H new ATOM 248 N GLU A 16 -1.171 -7.825 -9.552 1.00 75.14 N ATOM 249 CA GLU A 16 -1.326 -7.410 -10.966 1.00 13.13 C ATOM 250 C GLU A 16 -2.727 -6.823 -11.239 1.00 65.25 C ATOM 251 O GLU A 16 -2.862 -5.859 -12.003 1.00 23.22 O ATOM 252 CB GLU A 16 -1.026 -8.600 -11.922 1.00 2.44 C ATOM 253 CG GLU A 16 -2.005 -9.793 -11.811 1.00 71.40 C ATOM 254 CD GLU A 16 -1.634 -10.971 -12.721 1.00 41.24 C ATOM 255 OE1 GLU A 16 -1.708 -10.810 -13.959 1.00 34.22 O ATOM 256 OE2 GLU A 16 -1.265 -12.060 -12.217 1.00 71.13 O ATOM 0 H GLU A 16 -1.088 -8.834 -9.428 1.00 75.14 H new ATOM 0 HA GLU A 16 -0.601 -6.620 -11.160 1.00 13.13 H new ATOM 0 HB2 GLU A 16 -1.039 -8.234 -12.948 1.00 2.44 H new ATOM 0 HB3 GLU A 16 -0.016 -8.959 -11.724 1.00 2.44 H new ATOM 0 HG2 GLU A 16 -2.032 -10.137 -10.777 1.00 71.40 H new ATOM 0 HG3 GLU A 16 -3.010 -9.453 -12.060 1.00 71.40 H new ATOM 263 N GLU A 17 -3.753 -7.404 -10.593 1.00 14.14 N ATOM 264 CA GLU A 17 -5.143 -6.931 -10.710 1.00 34.33 C ATOM 265 C GLU A 17 -5.296 -5.555 -10.057 1.00 60.40 C ATOM 266 O GLU A 17 -5.913 -4.650 -10.627 1.00 62.22 O ATOM 267 CB GLU A 17 -6.110 -7.940 -10.052 1.00 75.30 C ATOM 268 CG GLU A 17 -6.149 -9.320 -10.726 1.00 51.10 C ATOM 269 CD GLU A 17 -6.603 -9.285 -12.189 1.00 4.33 C ATOM 270 OE1 GLU A 17 -5.769 -9.499 -13.099 1.00 30.42 O ATOM 271 OE2 GLU A 17 -7.797 -9.022 -12.441 1.00 32.11 O ATOM 0 H GLU A 17 -3.643 -8.210 -9.978 1.00 14.14 H new ATOM 0 HA GLU A 17 -5.390 -6.845 -11.768 1.00 34.33 H new ATOM 0 HB2 GLU A 17 -5.825 -8.068 -9.008 1.00 75.30 H new ATOM 0 HB3 GLU A 17 -7.115 -7.518 -10.059 1.00 75.30 H new ATOM 0 HG2 GLU A 17 -5.156 -9.766 -10.675 1.00 51.10 H new ATOM 0 HG3 GLU A 17 -6.820 -9.969 -10.163 1.00 51.10 H new ATOM 278 N LEU A 18 -4.698 -5.416 -8.859 1.00 25.13 N ATOM 279 CA LEU A 18 -4.746 -4.179 -8.063 1.00 25.10 C ATOM 280 C LEU A 18 -3.945 -3.047 -8.731 1.00 2.23 C ATOM 281 O LEU A 18 -4.300 -1.865 -8.596 1.00 33.32 O ATOM 282 CB LEU A 18 -4.227 -4.450 -6.626 1.00 4.44 C ATOM 283 CG LEU A 18 -5.034 -5.492 -5.786 1.00 63.51 C ATOM 284 CD1 LEU A 18 -4.530 -5.551 -4.327 1.00 74.11 C ATOM 285 CD2 LEU A 18 -6.543 -5.212 -5.841 1.00 32.25 C ATOM 0 H LEU A 18 -4.165 -6.164 -8.415 1.00 25.13 H new ATOM 0 HA LEU A 18 -5.784 -3.852 -8.006 1.00 25.10 H new ATOM 0 HB2 LEU A 18 -3.194 -4.791 -6.693 1.00 4.44 H new ATOM 0 HB3 LEU A 18 -4.216 -3.506 -6.082 1.00 4.44 H new ATOM 0 HG LEU A 18 -4.865 -6.471 -6.234 1.00 63.51 H new ATOM 0 HD11 LEU A 18 -5.112 -6.285 -3.770 1.00 74.11 H new ATOM 0 HD12 LEU A 18 -3.479 -5.838 -4.317 1.00 74.11 H new ATOM 0 HD13 LEU A 18 -4.643 -4.571 -3.863 1.00 74.11 H new ATOM 0 HD21 LEU A 18 -7.073 -5.956 -5.246 1.00 32.25 H new ATOM 0 HD22 LEU A 18 -6.743 -4.218 -5.442 1.00 32.25 H new ATOM 0 HD23 LEU A 18 -6.885 -5.263 -6.875 1.00 32.25 H new ATOM 297 N LEU A 19 -2.872 -3.431 -9.451 1.00 70.14 N ATOM 298 CA LEU A 19 -2.043 -2.500 -10.236 1.00 21.14 C ATOM 299 C LEU A 19 -2.901 -1.835 -11.326 1.00 72.52 C ATOM 300 O LEU A 19 -2.883 -0.607 -11.471 1.00 73.50 O ATOM 301 CB LEU A 19 -0.825 -3.252 -10.848 1.00 63.24 C ATOM 302 CG LEU A 19 0.167 -2.403 -11.715 1.00 11.24 C ATOM 303 CD1 LEU A 19 0.785 -1.236 -10.913 1.00 43.35 C ATOM 304 CD2 LEU A 19 1.268 -3.298 -12.324 1.00 63.41 C ATOM 0 H LEU A 19 -2.557 -4.400 -9.503 1.00 70.14 H new ATOM 0 HA LEU A 19 -1.655 -1.717 -9.584 1.00 21.14 H new ATOM 0 HB2 LEU A 19 -0.261 -3.705 -10.033 1.00 63.24 H new ATOM 0 HB3 LEU A 19 -1.204 -4.067 -11.465 1.00 63.24 H new ATOM 0 HG LEU A 19 -0.410 -1.964 -12.529 1.00 11.24 H new ATOM 0 HD11 LEU A 19 1.466 -0.675 -11.553 1.00 43.35 H new ATOM 0 HD12 LEU A 19 -0.008 -0.577 -10.561 1.00 43.35 H new ATOM 0 HD13 LEU A 19 1.334 -1.632 -10.059 1.00 43.35 H new ATOM 0 HD21 LEU A 19 1.945 -2.687 -12.921 1.00 63.41 H new ATOM 0 HD22 LEU A 19 1.828 -3.782 -11.524 1.00 63.41 H new ATOM 0 HD23 LEU A 19 0.810 -4.058 -12.958 1.00 63.41 H new ATOM 316 N GLU A 20 -3.699 -2.666 -12.030 1.00 42.12 N ATOM 317 CA GLU A 20 -4.613 -2.205 -13.091 1.00 51.40 C ATOM 318 C GLU A 20 -5.677 -1.236 -12.551 1.00 72.53 C ATOM 319 O GLU A 20 -6.037 -0.282 -13.240 1.00 34.34 O ATOM 320 CB GLU A 20 -5.298 -3.413 -13.787 1.00 40.33 C ATOM 321 CG GLU A 20 -4.340 -4.322 -14.578 1.00 13.33 C ATOM 322 CD GLU A 20 -3.629 -3.600 -15.739 1.00 44.11 C ATOM 323 OE1 GLU A 20 -2.446 -3.220 -15.593 1.00 31.32 O ATOM 324 OE2 GLU A 20 -4.253 -3.414 -16.808 1.00 33.40 O ATOM 0 H GLU A 20 -3.726 -3.674 -11.877 1.00 42.12 H new ATOM 0 HA GLU A 20 -4.011 -1.665 -13.822 1.00 51.40 H new ATOM 0 HB2 GLU A 20 -5.805 -4.012 -13.031 1.00 40.33 H new ATOM 0 HB3 GLU A 20 -6.065 -3.038 -14.464 1.00 40.33 H new ATOM 0 HG2 GLU A 20 -3.590 -4.726 -13.898 1.00 13.33 H new ATOM 0 HG3 GLU A 20 -4.900 -5.169 -14.975 1.00 13.33 H new ATOM 331 N VAL A 21 -6.152 -1.480 -11.310 1.00 43.05 N ATOM 332 CA VAL A 21 -7.226 -0.675 -10.691 1.00 1.01 C ATOM 333 C VAL A 21 -6.832 0.826 -10.591 1.00 42.04 C ATOM 334 O VAL A 21 -7.638 1.699 -10.943 1.00 53.14 O ATOM 335 CB VAL A 21 -7.651 -1.242 -9.278 1.00 50.05 C ATOM 336 CG1 VAL A 21 -8.752 -0.380 -8.622 1.00 1.15 C ATOM 337 CG2 VAL A 21 -8.122 -2.714 -9.377 1.00 51.44 C ATOM 0 H VAL A 21 -5.806 -2.233 -10.715 1.00 43.05 H new ATOM 0 HA VAL A 21 -8.092 -0.750 -11.348 1.00 1.01 H new ATOM 0 HB VAL A 21 -6.764 -1.202 -8.646 1.00 50.05 H new ATOM 0 HG11 VAL A 21 -9.016 -0.803 -7.653 1.00 1.15 H new ATOM 0 HG12 VAL A 21 -8.385 0.637 -8.486 1.00 1.15 H new ATOM 0 HG13 VAL A 21 -9.633 -0.365 -9.264 1.00 1.15 H new ATOM 0 HG21 VAL A 21 -8.407 -3.072 -8.388 1.00 51.44 H new ATOM 0 HG22 VAL A 21 -8.980 -2.777 -10.047 1.00 51.44 H new ATOM 0 HG23 VAL A 21 -7.311 -3.330 -9.767 1.00 51.44 H new ATOM 347 N VAL A 22 -5.581 1.122 -10.161 1.00 75.32 N ATOM 348 CA VAL A 22 -5.094 2.525 -10.073 1.00 64.04 C ATOM 349 C VAL A 22 -4.946 3.129 -11.486 1.00 20.03 C ATOM 350 O VAL A 22 -5.309 4.275 -11.718 1.00 1.14 O ATOM 351 CB VAL A 22 -3.714 2.677 -9.323 1.00 5.33 C ATOM 352 CG1 VAL A 22 -3.393 4.174 -9.036 1.00 22.00 C ATOM 353 CG2 VAL A 22 -3.678 1.848 -8.030 1.00 62.23 C ATOM 0 H VAL A 22 -4.898 0.421 -9.873 1.00 75.32 H new ATOM 0 HA VAL A 22 -5.845 3.057 -9.490 1.00 64.04 H new ATOM 0 HB VAL A 22 -2.940 2.287 -9.984 1.00 5.33 H new ATOM 0 HG11 VAL A 22 -2.437 4.248 -8.519 1.00 22.00 H new ATOM 0 HG12 VAL A 22 -3.340 4.722 -9.977 1.00 22.00 H new ATOM 0 HG13 VAL A 22 -4.178 4.601 -8.411 1.00 22.00 H new ATOM 0 HG21 VAL A 22 -2.712 1.978 -7.541 1.00 62.23 H new ATOM 0 HG22 VAL A 22 -4.471 2.182 -7.361 1.00 62.23 H new ATOM 0 HG23 VAL A 22 -3.825 0.795 -8.269 1.00 62.23 H new ATOM 363 N LEU A 23 -4.434 2.316 -12.430 1.00 50.41 N ATOM 364 CA LEU A 23 -4.174 2.751 -13.822 1.00 65.35 C ATOM 365 C LEU A 23 -5.490 3.084 -14.573 1.00 42.21 C ATOM 366 O LEU A 23 -5.500 3.921 -15.484 1.00 73.42 O ATOM 367 CB LEU A 23 -3.370 1.658 -14.581 1.00 25.02 C ATOM 368 CG LEU A 23 -2.016 1.220 -13.924 1.00 21.12 C ATOM 369 CD1 LEU A 23 -1.397 0.020 -14.668 1.00 10.34 C ATOM 370 CD2 LEU A 23 -1.012 2.390 -13.830 1.00 31.23 C ATOM 0 H LEU A 23 -4.189 1.342 -12.253 1.00 50.41 H new ATOM 0 HA LEU A 23 -3.582 3.665 -13.784 1.00 65.35 H new ATOM 0 HB2 LEU A 23 -4.002 0.776 -14.685 1.00 25.02 H new ATOM 0 HB3 LEU A 23 -3.162 2.021 -15.587 1.00 25.02 H new ATOM 0 HG LEU A 23 -2.243 0.907 -12.905 1.00 21.12 H new ATOM 0 HD11 LEU A 23 -0.459 -0.261 -14.189 1.00 10.34 H new ATOM 0 HD12 LEU A 23 -2.087 -0.823 -14.636 1.00 10.34 H new ATOM 0 HD13 LEU A 23 -1.207 0.294 -15.706 1.00 10.34 H new ATOM 0 HD21 LEU A 23 -0.088 2.041 -13.369 1.00 31.23 H new ATOM 0 HD22 LEU A 23 -0.798 2.767 -14.830 1.00 31.23 H new ATOM 0 HD23 LEU A 23 -1.440 3.189 -13.225 1.00 31.23 H new ATOM 382 N LYS A 24 -6.596 2.423 -14.168 1.00 53.20 N ATOM 383 CA LYS A 24 -7.950 2.679 -14.710 1.00 53.20 C ATOM 384 C LYS A 24 -8.519 4.014 -14.179 1.00 52.42 C ATOM 385 O LYS A 24 -9.308 4.669 -14.859 1.00 10.54 O ATOM 386 CB LYS A 24 -8.910 1.513 -14.324 1.00 24.10 C ATOM 387 CG LYS A 24 -8.625 0.163 -15.022 1.00 44.24 C ATOM 388 CD LYS A 24 -9.021 0.138 -16.517 1.00 42.54 C ATOM 389 CE LYS A 24 -10.542 0.289 -16.731 1.00 22.22 C ATOM 390 NZ LYS A 24 -10.917 0.141 -18.164 1.00 55.41 N ATOM 0 H LYS A 24 -6.576 1.695 -13.454 1.00 53.20 H new ATOM 0 HA LYS A 24 -7.871 2.744 -15.795 1.00 53.20 H new ATOM 0 HB2 LYS A 24 -8.858 1.364 -13.246 1.00 24.10 H new ATOM 0 HB3 LYS A 24 -9.932 1.814 -14.555 1.00 24.10 H new ATOM 0 HG2 LYS A 24 -7.563 -0.064 -14.933 1.00 44.24 H new ATOM 0 HG3 LYS A 24 -9.165 -0.627 -14.499 1.00 44.24 H new ATOM 0 HD2 LYS A 24 -8.503 0.942 -17.040 1.00 42.54 H new ATOM 0 HD3 LYS A 24 -8.687 -0.799 -16.962 1.00 42.54 H new ATOM 0 HE2 LYS A 24 -11.068 -0.459 -16.139 1.00 22.22 H new ATOM 0 HE3 LYS A 24 -10.864 1.266 -16.370 1.00 22.22 H new ATOM 0 HZ1 LYS A 24 -11.946 0.249 -18.266 1.00 55.41 H new ATOM 0 HZ2 LYS A 24 -10.435 0.871 -18.726 1.00 55.41 H new ATOM 0 HZ3 LYS A 24 -10.632 -0.800 -18.502 1.00 55.41 H new ATOM 404 N SER A 25 -8.119 4.383 -12.951 1.00 41.31 N ATOM 405 CA SER A 25 -8.605 5.584 -12.252 1.00 41.11 C ATOM 406 C SER A 25 -7.708 6.797 -12.565 1.00 33.31 C ATOM 407 O SER A 25 -8.092 7.699 -13.325 1.00 41.53 O ATOM 408 CB SER A 25 -8.637 5.302 -10.722 1.00 54.21 C ATOM 409 OG SER A 25 -8.970 6.456 -9.962 1.00 71.54 O ATOM 0 H SER A 25 -7.440 3.849 -12.409 1.00 41.31 H new ATOM 0 HA SER A 25 -9.612 5.821 -12.597 1.00 41.11 H new ATOM 0 HB2 SER A 25 -9.362 4.514 -10.516 1.00 54.21 H new ATOM 0 HB3 SER A 25 -7.663 4.930 -10.404 1.00 54.21 H new ATOM 0 HG SER A 25 -8.156 6.835 -9.568 1.00 71.54 H new ATOM 415 N ASP A 26 -6.503 6.782 -11.978 1.00 73.11 N ATOM 416 CA ASP A 26 -5.557 7.903 -11.986 1.00 73.44 C ATOM 417 C ASP A 26 -4.098 7.378 -12.042 1.00 20.40 C ATOM 418 O ASP A 26 -3.419 7.256 -11.016 1.00 31.50 O ATOM 419 CB ASP A 26 -5.812 8.817 -10.741 1.00 44.43 C ATOM 420 CG ASP A 26 -5.707 8.114 -9.361 1.00 34.24 C ATOM 421 OD1 ASP A 26 -6.023 6.907 -9.256 1.00 74.53 O ATOM 422 OD2 ASP A 26 -5.357 8.790 -8.372 1.00 1.22 O ATOM 0 H ASP A 26 -6.152 5.969 -11.472 1.00 73.11 H new ATOM 0 HA ASP A 26 -5.712 8.509 -12.879 1.00 73.44 H new ATOM 0 HB2 ASP A 26 -5.098 9.640 -10.765 1.00 44.43 H new ATOM 0 HB3 ASP A 26 -6.806 9.255 -10.831 1.00 44.43 H new ATOM 427 N PRO A 27 -3.583 7.039 -13.269 1.00 0.02 N ATOM 428 CA PRO A 27 -2.170 6.608 -13.453 1.00 34.34 C ATOM 429 C PRO A 27 -1.155 7.770 -13.291 1.00 24.34 C ATOM 430 O PRO A 27 0.053 7.560 -13.420 1.00 10.21 O ATOM 431 CB PRO A 27 -2.171 6.019 -14.886 1.00 43.32 C ATOM 432 CG PRO A 27 -3.267 6.753 -15.600 1.00 44.54 C ATOM 433 CD PRO A 27 -4.338 7.010 -14.557 1.00 5.41 C ATOM 0 HA PRO A 27 -1.849 5.893 -12.696 1.00 34.34 H new ATOM 0 HB2 PRO A 27 -1.209 6.169 -15.376 1.00 43.32 H new ATOM 0 HB3 PRO A 27 -2.357 4.945 -14.872 1.00 43.32 H new ATOM 0 HG2 PRO A 27 -2.900 7.688 -16.023 1.00 44.54 H new ATOM 0 HG3 PRO A 27 -3.660 6.161 -16.427 1.00 44.54 H new ATOM 0 HD2 PRO A 27 -4.855 7.952 -14.739 1.00 5.41 H new ATOM 0 HD3 PRO A 27 -5.095 6.226 -14.559 1.00 5.41 H new ATOM 441 N ASN A 28 -1.672 8.991 -13.022 1.00 75.31 N ATOM 442 CA ASN A 28 -0.855 10.170 -12.648 1.00 12.34 C ATOM 443 C ASN A 28 -0.071 9.891 -11.352 1.00 63.10 C ATOM 444 O ASN A 28 1.076 10.336 -11.190 1.00 1.13 O ATOM 445 CB ASN A 28 -1.752 11.421 -12.439 1.00 70.10 C ATOM 446 CG ASN A 28 -2.617 11.753 -13.653 1.00 74.23 C ATOM 447 OD1 ASN A 28 -2.178 12.441 -14.579 1.00 3.04 O ATOM 448 ND2 ASN A 28 -3.859 11.293 -13.642 1.00 10.31 N ATOM 0 H ASN A 28 -2.672 9.188 -13.058 1.00 75.31 H new ATOM 0 HA ASN A 28 -0.157 10.363 -13.463 1.00 12.34 H new ATOM 0 HB2 ASN A 28 -2.397 11.257 -11.576 1.00 70.10 H new ATOM 0 HB3 ASN A 28 -1.120 12.278 -12.206 1.00 70.10 H new ATOM 0 HD21 ASN A 28 -4.488 11.504 -14.417 1.00 10.31 H new ATOM 0 HD22 ASN A 28 -4.186 10.727 -12.859 1.00 10.31 H new ATOM 455 N VAL A 29 -0.734 9.176 -10.429 1.00 34.53 N ATOM 456 CA VAL A 29 -0.120 8.680 -9.194 1.00 64.14 C ATOM 457 C VAL A 29 0.924 7.609 -9.541 1.00 23.44 C ATOM 458 O VAL A 29 0.641 6.704 -10.341 1.00 71.43 O ATOM 459 CB VAL A 29 -1.213 8.094 -8.224 1.00 52.03 C ATOM 460 CG1 VAL A 29 -0.596 7.440 -6.966 1.00 20.11 C ATOM 461 CG2 VAL A 29 -2.223 9.190 -7.826 1.00 44.15 C ATOM 0 H VAL A 29 -1.718 8.926 -10.523 1.00 34.53 H new ATOM 0 HA VAL A 29 0.370 9.508 -8.682 1.00 64.14 H new ATOM 0 HB VAL A 29 -1.736 7.307 -8.767 1.00 52.03 H new ATOM 0 HG11 VAL A 29 -1.392 7.052 -6.330 1.00 20.11 H new ATOM 0 HG12 VAL A 29 0.060 6.623 -7.265 1.00 20.11 H new ATOM 0 HG13 VAL A 29 -0.021 8.184 -6.414 1.00 20.11 H new ATOM 0 HG21 VAL A 29 -2.972 8.769 -7.155 1.00 44.15 H new ATOM 0 HG22 VAL A 29 -1.699 10.001 -7.321 1.00 44.15 H new ATOM 0 HG23 VAL A 29 -2.713 9.576 -8.720 1.00 44.15 H new ATOM 471 N LYS A 30 2.133 7.737 -8.962 1.00 42.35 N ATOM 472 CA LYS A 30 3.230 6.798 -9.211 1.00 20.41 C ATOM 473 C LYS A 30 2.862 5.414 -8.641 1.00 63.12 C ATOM 474 O LYS A 30 2.566 5.288 -7.459 1.00 2.43 O ATOM 475 CB LYS A 30 4.556 7.331 -8.595 1.00 61.42 C ATOM 476 CG LYS A 30 5.807 6.458 -8.882 1.00 54.51 C ATOM 477 CD LYS A 30 6.052 6.262 -10.396 1.00 24.34 C ATOM 478 CE LYS A 30 7.273 5.380 -10.694 1.00 53.20 C ATOM 479 NZ LYS A 30 7.157 4.025 -10.097 1.00 45.42 N ATOM 0 H LYS A 30 2.370 8.489 -8.315 1.00 42.35 H new ATOM 0 HA LYS A 30 3.385 6.700 -10.285 1.00 20.41 H new ATOM 0 HB2 LYS A 30 4.738 8.336 -8.975 1.00 61.42 H new ATOM 0 HB3 LYS A 30 4.430 7.416 -7.516 1.00 61.42 H new ATOM 0 HG2 LYS A 30 6.683 6.924 -8.432 1.00 54.51 H new ATOM 0 HG3 LYS A 30 5.685 5.485 -8.407 1.00 54.51 H new ATOM 0 HD2 LYS A 30 5.167 5.813 -10.847 1.00 24.34 H new ATOM 0 HD3 LYS A 30 6.190 7.236 -10.866 1.00 24.34 H new ATOM 0 HE2 LYS A 30 7.396 5.288 -11.773 1.00 53.20 H new ATOM 0 HE3 LYS A 30 8.170 5.866 -10.311 1.00 53.20 H new ATOM 0 HZ1 LYS A 30 7.871 3.913 -9.349 1.00 45.42 H new ATOM 0 HZ2 LYS A 30 6.207 3.905 -9.690 1.00 45.42 H new ATOM 0 HZ3 LYS A 30 7.311 3.307 -10.833 1.00 45.42 H new ATOM 493 N THR A 31 2.853 4.393 -9.502 1.00 25.55 N ATOM 494 CA THR A 31 2.508 3.019 -9.114 1.00 73.44 C ATOM 495 C THR A 31 3.749 2.139 -9.235 1.00 75.24 C ATOM 496 O THR A 31 4.489 2.232 -10.219 1.00 31.21 O ATOM 497 CB THR A 31 1.355 2.462 -10.009 1.00 72.44 C ATOM 498 OG1 THR A 31 1.681 2.639 -11.400 1.00 13.11 O ATOM 499 CG2 THR A 31 0.015 3.154 -9.711 1.00 5.22 C ATOM 0 H THR A 31 3.085 4.494 -10.490 1.00 25.55 H new ATOM 0 HA THR A 31 2.159 3.016 -8.081 1.00 73.44 H new ATOM 0 HB THR A 31 1.249 1.401 -9.781 1.00 72.44 H new ATOM 0 HG1 THR A 31 1.554 1.792 -11.876 1.00 13.11 H new ATOM 0 HG21 THR A 31 -0.760 2.738 -10.354 1.00 5.22 H new ATOM 0 HG22 THR A 31 -0.254 2.992 -8.667 1.00 5.22 H new ATOM 0 HG23 THR A 31 0.108 4.223 -9.900 1.00 5.22 H new ATOM 507 N VAL A 32 3.992 1.309 -8.210 1.00 50.52 N ATOM 508 CA VAL A 32 5.179 0.440 -8.124 1.00 61.45 C ATOM 509 C VAL A 32 4.743 -0.957 -7.703 1.00 41.22 C ATOM 510 O VAL A 32 4.116 -1.103 -6.668 1.00 45.23 O ATOM 511 CB VAL A 32 6.230 0.972 -7.065 1.00 0.15 C ATOM 512 CG1 VAL A 32 7.534 0.131 -7.091 1.00 33.31 C ATOM 513 CG2 VAL A 32 6.521 2.473 -7.274 1.00 44.32 C ATOM 0 H VAL A 32 3.366 1.220 -7.410 1.00 50.52 H new ATOM 0 HA VAL A 32 5.653 0.431 -9.105 1.00 61.45 H new ATOM 0 HB VAL A 32 5.789 0.857 -6.075 1.00 0.15 H new ATOM 0 HG11 VAL A 32 8.234 0.522 -6.353 1.00 33.31 H new ATOM 0 HG12 VAL A 32 7.302 -0.908 -6.856 1.00 33.31 H new ATOM 0 HG13 VAL A 32 7.983 0.187 -8.082 1.00 33.31 H new ATOM 0 HG21 VAL A 32 7.246 2.810 -6.533 1.00 44.32 H new ATOM 0 HG22 VAL A 32 6.925 2.629 -8.274 1.00 44.32 H new ATOM 0 HG23 VAL A 32 5.598 3.042 -7.163 1.00 44.32 H new ATOM 523 N ARG A 33 5.072 -1.976 -8.502 1.00 62.21 N ATOM 524 CA ARG A 33 4.867 -3.380 -8.126 1.00 24.13 C ATOM 525 C ARG A 33 6.248 -4.006 -7.899 1.00 75.42 C ATOM 526 O ARG A 33 6.946 -4.375 -8.850 1.00 61.25 O ATOM 527 CB ARG A 33 4.060 -4.134 -9.210 1.00 60.14 C ATOM 528 CG ARG A 33 3.795 -5.617 -8.877 1.00 72.11 C ATOM 529 CD ARG A 33 3.067 -6.346 -10.011 1.00 75.01 C ATOM 530 NE ARG A 33 3.793 -6.238 -11.292 1.00 75.53 N ATOM 531 CZ ARG A 33 3.433 -6.819 -12.446 1.00 43.13 C ATOM 532 NH1 ARG A 33 2.341 -7.591 -12.517 1.00 2.41 N ATOM 533 NH2 ARG A 33 4.169 -6.613 -13.538 1.00 31.31 N ATOM 0 H ARG A 33 5.487 -1.853 -9.426 1.00 62.21 H new ATOM 0 HA ARG A 33 4.279 -3.449 -7.211 1.00 24.13 H new ATOM 0 HB2 ARG A 33 3.105 -3.629 -9.355 1.00 60.14 H new ATOM 0 HB3 ARG A 33 4.598 -4.075 -10.156 1.00 60.14 H new ATOM 0 HG2 ARG A 33 4.742 -6.117 -8.676 1.00 72.11 H new ATOM 0 HG3 ARG A 33 3.201 -5.682 -7.966 1.00 72.11 H new ATOM 0 HD2 ARG A 33 2.948 -7.397 -9.749 1.00 75.01 H new ATOM 0 HD3 ARG A 33 2.066 -5.931 -10.125 1.00 75.01 H new ATOM 0 HE ARG A 33 4.642 -5.673 -11.300 1.00 75.53 H new ATOM 0 HH11 ARG A 33 1.770 -7.744 -11.686 1.00 2.41 H new ATOM 0 HH12 ARG A 33 2.081 -8.026 -13.402 1.00 2.41 H new ATOM 0 HH21 ARG A 33 4.997 -6.019 -13.491 1.00 31.31 H new ATOM 0 HH22 ARG A 33 3.905 -7.050 -14.421 1.00 31.31 H new ATOM 547 N THR A 34 6.658 -4.041 -6.629 1.00 13.22 N ATOM 548 CA THR A 34 7.980 -4.521 -6.199 1.00 75.54 C ATOM 549 C THR A 34 7.840 -5.722 -5.249 1.00 3.54 C ATOM 550 O THR A 34 6.743 -6.047 -4.777 1.00 21.23 O ATOM 551 CB THR A 34 8.783 -3.357 -5.508 1.00 0.04 C ATOM 552 OG1 THR A 34 10.074 -3.813 -5.056 1.00 75.31 O ATOM 553 CG2 THR A 34 8.006 -2.747 -4.329 1.00 64.02 C ATOM 0 H THR A 34 6.072 -3.731 -5.854 1.00 13.22 H new ATOM 0 HA THR A 34 8.533 -4.849 -7.079 1.00 75.54 H new ATOM 0 HB THR A 34 8.924 -2.582 -6.261 1.00 0.04 H new ATOM 0 HG1 THR A 34 10.164 -3.641 -4.095 1.00 75.31 H new ATOM 0 HG21 THR A 34 8.595 -1.947 -3.880 1.00 64.02 H new ATOM 0 HG22 THR A 34 7.059 -2.343 -4.687 1.00 64.02 H new ATOM 0 HG23 THR A 34 7.812 -3.518 -3.583 1.00 64.02 H new ATOM 561 N ASP A 35 8.971 -6.380 -4.998 1.00 61.13 N ATOM 562 CA ASP A 35 9.095 -7.470 -4.019 1.00 60.22 C ATOM 563 C ASP A 35 9.884 -6.969 -2.796 1.00 42.12 C ATOM 564 O ASP A 35 9.645 -7.400 -1.666 1.00 73.24 O ATOM 565 CB ASP A 35 9.816 -8.669 -4.692 1.00 21.35 C ATOM 566 CG ASP A 35 9.972 -9.900 -3.781 1.00 34.45 C ATOM 567 OD1 ASP A 35 8.987 -10.645 -3.603 1.00 24.45 O ATOM 568 OD2 ASP A 35 11.083 -10.159 -3.273 1.00 53.45 O ATOM 0 H ASP A 35 9.847 -6.169 -5.477 1.00 61.13 H new ATOM 0 HA ASP A 35 8.110 -7.795 -3.683 1.00 60.22 H new ATOM 0 HB2 ASP A 35 9.261 -8.959 -5.584 1.00 21.35 H new ATOM 0 HB3 ASP A 35 10.804 -8.347 -5.022 1.00 21.35 H new ATOM 573 N ASP A 36 10.803 -6.022 -3.050 1.00 31.04 N ATOM 574 CA ASP A 36 11.766 -5.520 -2.056 1.00 13.23 C ATOM 575 C ASP A 36 11.231 -4.277 -1.326 1.00 63.52 C ATOM 576 O ASP A 36 10.769 -3.332 -1.975 1.00 74.13 O ATOM 577 CB ASP A 36 13.092 -5.156 -2.764 1.00 32.23 C ATOM 578 CG ASP A 36 13.735 -6.356 -3.475 1.00 25.21 C ATOM 579 OD1 ASP A 36 14.641 -6.991 -2.898 1.00 11.52 O ATOM 580 OD2 ASP A 36 13.325 -6.675 -4.615 1.00 52.42 O ATOM 0 H ASP A 36 10.899 -5.578 -3.963 1.00 31.04 H new ATOM 0 HA ASP A 36 11.928 -6.307 -1.319 1.00 13.23 H new ATOM 0 HB2 ASP A 36 12.905 -4.366 -3.491 1.00 32.23 H new ATOM 0 HB3 ASP A 36 13.792 -4.756 -2.031 1.00 32.23 H new ATOM 585 N LYS A 37 11.338 -4.291 0.022 1.00 15.21 N ATOM 586 CA LYS A 37 11.047 -3.124 0.900 1.00 32.44 C ATOM 587 C LYS A 37 12.021 -1.957 0.641 1.00 54.22 C ATOM 588 O LYS A 37 11.672 -0.782 0.824 1.00 24.22 O ATOM 589 CB LYS A 37 11.096 -3.509 2.414 1.00 52.15 C ATOM 590 CG LYS A 37 12.482 -3.877 3.010 1.00 63.03 C ATOM 591 CD LYS A 37 13.029 -5.244 2.549 1.00 41.22 C ATOM 592 CE LYS A 37 14.423 -5.537 3.124 1.00 21.50 C ATOM 593 NZ LYS A 37 14.973 -6.832 2.646 1.00 51.32 N ATOM 0 H LYS A 37 11.631 -5.119 0.541 1.00 15.21 H new ATOM 0 HA LYS A 37 10.036 -2.802 0.651 1.00 32.44 H new ATOM 0 HB2 LYS A 37 10.693 -2.674 2.988 1.00 52.15 H new ATOM 0 HB3 LYS A 37 10.427 -4.355 2.569 1.00 52.15 H new ATOM 0 HG2 LYS A 37 13.199 -3.102 2.738 1.00 63.03 H new ATOM 0 HG3 LYS A 37 12.409 -3.876 4.098 1.00 63.03 H new ATOM 0 HD2 LYS A 37 12.339 -6.031 2.855 1.00 41.22 H new ATOM 0 HD3 LYS A 37 13.075 -5.266 1.460 1.00 41.22 H new ATOM 0 HE2 LYS A 37 15.104 -4.732 2.847 1.00 21.50 H new ATOM 0 HE3 LYS A 37 14.369 -5.548 4.213 1.00 21.50 H new ATOM 0 HZ1 LYS A 37 15.914 -6.984 3.062 1.00 51.32 H new ATOM 0 HZ2 LYS A 37 14.339 -7.605 2.932 1.00 51.32 H new ATOM 0 HZ3 LYS A 37 15.051 -6.814 1.609 1.00 51.32 H new ATOM 607 N GLU A 38 13.243 -2.321 0.234 1.00 52.05 N ATOM 608 CA GLU A 38 14.327 -1.382 -0.091 1.00 75.33 C ATOM 609 C GLU A 38 13.926 -0.520 -1.293 1.00 25.41 C ATOM 610 O GLU A 38 14.038 0.711 -1.260 1.00 73.33 O ATOM 611 CB GLU A 38 15.604 -2.192 -0.420 1.00 2.15 C ATOM 612 CG GLU A 38 16.010 -3.206 0.668 1.00 61.04 C ATOM 613 CD GLU A 38 16.941 -4.297 0.129 1.00 71.40 C ATOM 614 OE1 GLU A 38 18.153 -4.042 -0.015 1.00 23.41 O ATOM 615 OE2 GLU A 38 16.450 -5.408 -0.174 1.00 51.13 O ATOM 0 H GLU A 38 13.513 -3.298 0.118 1.00 52.05 H new ATOM 0 HA GLU A 38 14.517 -0.726 0.758 1.00 75.33 H new ATOM 0 HB2 GLU A 38 15.450 -2.725 -1.358 1.00 2.15 H new ATOM 0 HB3 GLU A 38 16.429 -1.498 -0.580 1.00 2.15 H new ATOM 0 HG2 GLU A 38 16.505 -2.680 1.485 1.00 61.04 H new ATOM 0 HG3 GLU A 38 15.114 -3.668 1.083 1.00 61.04 H new ATOM 622 N LYS A 39 13.415 -1.214 -2.336 1.00 23.12 N ATOM 623 CA LYS A 39 12.988 -0.596 -3.593 1.00 60.53 C ATOM 624 C LYS A 39 11.785 0.340 -3.363 1.00 24.14 C ATOM 625 O LYS A 39 11.673 1.375 -4.028 1.00 61.22 O ATOM 626 CB LYS A 39 12.666 -1.686 -4.652 1.00 34.41 C ATOM 627 CG LYS A 39 12.314 -1.139 -6.060 1.00 5.23 C ATOM 628 CD LYS A 39 13.478 -0.343 -6.705 1.00 51.24 C ATOM 629 CE LYS A 39 13.067 0.344 -8.018 1.00 41.12 C ATOM 630 NZ LYS A 39 12.574 -0.615 -9.041 1.00 63.41 N ATOM 0 H LYS A 39 13.290 -2.226 -2.319 1.00 23.12 H new ATOM 0 HA LYS A 39 13.807 0.012 -3.977 1.00 60.53 H new ATOM 0 HB2 LYS A 39 13.524 -2.352 -4.740 1.00 34.41 H new ATOM 0 HB3 LYS A 39 11.831 -2.288 -4.292 1.00 34.41 H new ATOM 0 HG2 LYS A 39 12.045 -1.971 -6.711 1.00 5.23 H new ATOM 0 HG3 LYS A 39 11.437 -0.495 -5.986 1.00 5.23 H new ATOM 0 HD2 LYS A 39 13.833 0.410 -6.001 1.00 51.24 H new ATOM 0 HD3 LYS A 39 14.312 -1.018 -6.898 1.00 51.24 H new ATOM 0 HE2 LYS A 39 12.289 1.078 -7.810 1.00 41.12 H new ATOM 0 HE3 LYS A 39 13.921 0.890 -8.420 1.00 41.12 H new ATOM 0 HZ1 LYS A 39 12.328 -0.099 -9.910 1.00 63.41 H new ATOM 0 HZ2 LYS A 39 13.317 -1.311 -9.251 1.00 63.41 H new ATOM 0 HZ3 LYS A 39 11.732 -1.106 -8.679 1.00 63.41 H new ATOM 644 N VAL A 40 10.909 -0.021 -2.394 1.00 51.34 N ATOM 645 CA VAL A 40 9.777 0.834 -1.985 1.00 4.30 C ATOM 646 C VAL A 40 10.286 2.213 -1.531 1.00 45.22 C ATOM 647 O VAL A 40 9.771 3.239 -1.963 1.00 74.33 O ATOM 648 CB VAL A 40 8.935 0.200 -0.816 1.00 72.24 C ATOM 649 CG1 VAL A 40 7.756 1.114 -0.423 1.00 21.52 C ATOM 650 CG2 VAL A 40 8.435 -1.211 -1.177 1.00 65.32 C ATOM 0 H VAL A 40 10.968 -0.901 -1.882 1.00 51.34 H new ATOM 0 HA VAL A 40 9.131 0.932 -2.858 1.00 4.30 H new ATOM 0 HB VAL A 40 9.596 0.106 0.046 1.00 72.24 H new ATOM 0 HG11 VAL A 40 7.191 0.652 0.387 1.00 21.52 H new ATOM 0 HG12 VAL A 40 8.139 2.080 -0.093 1.00 21.52 H new ATOM 0 HG13 VAL A 40 7.104 1.257 -1.285 1.00 21.52 H new ATOM 0 HG21 VAL A 40 7.858 -1.616 -0.346 1.00 65.32 H new ATOM 0 HG22 VAL A 40 7.805 -1.158 -2.065 1.00 65.32 H new ATOM 0 HG23 VAL A 40 9.288 -1.859 -1.376 1.00 65.32 H new ATOM 660 N LYS A 41 11.329 2.202 -0.680 1.00 22.32 N ATOM 661 CA LYS A 41 11.915 3.422 -0.098 1.00 4.31 C ATOM 662 C LYS A 41 12.617 4.283 -1.162 1.00 34.34 C ATOM 663 O LYS A 41 12.660 5.511 -1.024 1.00 31.44 O ATOM 664 CB LYS A 41 12.898 3.056 1.033 1.00 43.43 C ATOM 665 CG LYS A 41 12.255 2.322 2.227 1.00 73.44 C ATOM 666 CD LYS A 41 13.299 1.965 3.307 1.00 73.54 C ATOM 667 CE LYS A 41 12.678 1.293 4.534 1.00 43.12 C ATOM 668 NZ LYS A 41 13.710 0.950 5.554 1.00 73.31 N ATOM 0 H LYS A 41 11.790 1.344 -0.377 1.00 22.32 H new ATOM 0 HA LYS A 41 11.099 4.015 0.316 1.00 4.31 H new ATOM 0 HB2 LYS A 41 13.689 2.429 0.621 1.00 43.43 H new ATOM 0 HB3 LYS A 41 13.371 3.969 1.396 1.00 43.43 H new ATOM 0 HG2 LYS A 41 11.479 2.950 2.665 1.00 73.44 H new ATOM 0 HG3 LYS A 41 11.769 1.412 1.876 1.00 73.44 H new ATOM 0 HD2 LYS A 41 14.049 1.302 2.876 1.00 73.54 H new ATOM 0 HD3 LYS A 41 13.817 2.872 3.619 1.00 73.54 H new ATOM 0 HE2 LYS A 41 11.935 1.957 4.976 1.00 43.12 H new ATOM 0 HE3 LYS A 41 12.154 0.388 4.227 1.00 43.12 H new ATOM 0 HZ1 LYS A 41 13.371 1.227 6.497 1.00 73.31 H new ATOM 0 HZ2 LYS A 41 13.888 -0.074 5.537 1.00 73.31 H new ATOM 0 HZ3 LYS A 41 14.592 1.458 5.340 1.00 73.31 H new ATOM 682 N GLU A 42 13.168 3.632 -2.215 1.00 54.23 N ATOM 683 CA GLU A 42 13.749 4.343 -3.377 1.00 54.42 C ATOM 684 C GLU A 42 12.656 5.167 -4.064 1.00 4.55 C ATOM 685 O GLU A 42 12.836 6.355 -4.359 1.00 14.22 O ATOM 686 CB GLU A 42 14.369 3.355 -4.412 1.00 21.11 C ATOM 687 CG GLU A 42 15.377 2.347 -3.836 1.00 12.42 C ATOM 688 CD GLU A 42 16.486 2.989 -2.986 1.00 1.33 C ATOM 689 OE1 GLU A 42 17.395 3.629 -3.559 1.00 10.12 O ATOM 690 OE2 GLU A 42 16.460 2.848 -1.743 1.00 1.33 O ATOM 0 H GLU A 42 13.222 2.616 -2.282 1.00 54.23 H new ATOM 0 HA GLU A 42 14.545 4.990 -3.009 1.00 54.42 H new ATOM 0 HB2 GLU A 42 13.561 2.802 -4.891 1.00 21.11 H new ATOM 0 HB3 GLU A 42 14.864 3.934 -5.191 1.00 21.11 H new ATOM 0 HG2 GLU A 42 14.840 1.620 -3.226 1.00 12.42 H new ATOM 0 HG3 GLU A 42 15.835 1.797 -4.658 1.00 12.42 H new ATOM 697 N GLU A 43 11.518 4.498 -4.273 1.00 3.13 N ATOM 698 CA GLU A 43 10.346 5.065 -4.937 1.00 44.32 C ATOM 699 C GLU A 43 9.633 6.111 -4.057 1.00 23.45 C ATOM 700 O GLU A 43 9.033 7.055 -4.592 1.00 54.45 O ATOM 701 CB GLU A 43 9.389 3.920 -5.327 1.00 45.42 C ATOM 702 CG GLU A 43 9.984 2.907 -6.333 1.00 63.40 C ATOM 703 CD GLU A 43 10.299 3.507 -7.717 1.00 23.24 C ATOM 704 OE1 GLU A 43 11.409 3.281 -8.251 1.00 20.05 O ATOM 705 OE2 GLU A 43 9.432 4.212 -8.289 1.00 51.21 O ATOM 0 H GLU A 43 11.386 3.530 -3.979 1.00 3.13 H new ATOM 0 HA GLU A 43 10.673 5.590 -5.835 1.00 44.32 H new ATOM 0 HB2 GLU A 43 9.093 3.386 -4.424 1.00 45.42 H new ATOM 0 HB3 GLU A 43 8.483 4.349 -5.755 1.00 45.42 H new ATOM 0 HG2 GLU A 43 10.899 2.489 -5.913 1.00 63.40 H new ATOM 0 HG3 GLU A 43 9.284 2.081 -6.458 1.00 63.40 H new ATOM 712 N ILE A 44 9.706 5.941 -2.712 1.00 22.51 N ATOM 713 CA ILE A 44 9.157 6.919 -1.750 1.00 71.54 C ATOM 714 C ILE A 44 9.899 8.253 -1.917 1.00 41.23 C ATOM 715 O ILE A 44 9.268 9.295 -1.996 1.00 10.14 O ATOM 716 CB ILE A 44 9.220 6.414 -0.239 1.00 40.42 C ATOM 717 CG1 ILE A 44 8.197 5.249 0.000 1.00 25.40 C ATOM 718 CG2 ILE A 44 8.981 7.570 0.773 1.00 22.42 C ATOM 719 CD1 ILE A 44 8.102 4.743 1.437 1.00 42.20 C ATOM 0 H ILE A 44 10.143 5.131 -2.272 1.00 22.51 H new ATOM 0 HA ILE A 44 8.098 7.049 -1.973 1.00 71.54 H new ATOM 0 HB ILE A 44 10.228 6.036 -0.067 1.00 40.42 H new ATOM 0 HG12 ILE A 44 7.209 5.586 -0.314 1.00 25.40 H new ATOM 0 HG13 ILE A 44 8.468 4.413 -0.644 1.00 25.40 H new ATOM 0 HG21 ILE A 44 9.033 7.180 1.790 1.00 22.42 H new ATOM 0 HG22 ILE A 44 9.745 8.335 0.638 1.00 22.42 H new ATOM 0 HG23 ILE A 44 7.997 8.006 0.601 1.00 22.42 H new ATOM 0 HD11 ILE A 44 7.368 3.939 1.492 1.00 42.20 H new ATOM 0 HD12 ILE A 44 9.075 4.368 1.756 1.00 42.20 H new ATOM 0 HD13 ILE A 44 7.796 5.560 2.091 1.00 42.20 H new ATOM 731 N GLU A 45 11.241 8.177 -2.039 1.00 51.31 N ATOM 732 CA GLU A 45 12.102 9.355 -2.259 1.00 53.10 C ATOM 733 C GLU A 45 11.750 10.088 -3.567 1.00 25.34 C ATOM 734 O GLU A 45 11.707 11.319 -3.595 1.00 63.42 O ATOM 735 CB GLU A 45 13.594 8.933 -2.277 1.00 22.32 C ATOM 736 CG GLU A 45 14.143 8.445 -0.927 1.00 14.42 C ATOM 737 CD GLU A 45 14.087 9.530 0.158 1.00 41.34 C ATOM 738 OE1 GLU A 45 15.021 10.356 0.235 1.00 15.02 O ATOM 739 OE2 GLU A 45 13.108 9.567 0.935 1.00 12.50 O ATOM 0 H GLU A 45 11.756 7.298 -1.988 1.00 51.31 H new ATOM 0 HA GLU A 45 11.928 10.045 -1.433 1.00 53.10 H new ATOM 0 HB2 GLU A 45 13.724 8.140 -3.014 1.00 22.32 H new ATOM 0 HB3 GLU A 45 14.193 9.780 -2.612 1.00 22.32 H new ATOM 0 HG2 GLU A 45 13.571 7.577 -0.598 1.00 14.42 H new ATOM 0 HG3 GLU A 45 15.175 8.117 -1.055 1.00 14.42 H new ATOM 746 N LYS A 46 11.495 9.313 -4.633 1.00 63.40 N ATOM 747 CA LYS A 46 11.163 9.852 -5.966 1.00 35.25 C ATOM 748 C LYS A 46 9.842 10.647 -5.925 1.00 14.32 C ATOM 749 O LYS A 46 9.813 11.831 -6.278 1.00 5.13 O ATOM 750 CB LYS A 46 11.090 8.688 -6.989 1.00 22.12 C ATOM 751 CG LYS A 46 12.434 7.945 -7.176 1.00 71.44 C ATOM 752 CD LYS A 46 12.304 6.631 -7.983 1.00 34.21 C ATOM 753 CE LYS A 46 11.781 6.830 -9.415 1.00 31.52 C ATOM 754 NZ LYS A 46 11.595 5.524 -10.115 1.00 64.00 N ATOM 0 H LYS A 46 11.513 8.294 -4.597 1.00 63.40 H new ATOM 0 HA LYS A 46 11.945 10.544 -6.278 1.00 35.25 H new ATOM 0 HB2 LYS A 46 10.332 7.975 -6.663 1.00 22.12 H new ATOM 0 HB3 LYS A 46 10.764 9.081 -7.952 1.00 22.12 H new ATOM 0 HG2 LYS A 46 13.138 8.605 -7.682 1.00 71.44 H new ATOM 0 HG3 LYS A 46 12.856 7.721 -6.196 1.00 71.44 H new ATOM 0 HD2 LYS A 46 13.279 6.145 -8.027 1.00 34.21 H new ATOM 0 HD3 LYS A 46 11.634 5.955 -7.452 1.00 34.21 H new ATOM 0 HE2 LYS A 46 10.833 7.367 -9.386 1.00 31.52 H new ATOM 0 HE3 LYS A 46 12.481 7.449 -9.977 1.00 31.52 H new ATOM 0 HZ1 LYS A 46 12.333 5.410 -10.839 1.00 64.00 H new ATOM 0 HZ2 LYS A 46 11.663 4.748 -9.426 1.00 64.00 H new ATOM 0 HZ3 LYS A 46 10.659 5.503 -10.568 1.00 64.00 H new ATOM 768 N ALA A 47 8.771 9.995 -5.437 1.00 52.41 N ATOM 769 CA ALA A 47 7.415 10.584 -5.365 1.00 1.35 C ATOM 770 C ALA A 47 7.350 11.755 -4.364 1.00 10.03 C ATOM 771 O ALA A 47 6.624 12.734 -4.586 1.00 13.30 O ATOM 772 CB ALA A 47 6.402 9.493 -4.999 1.00 24.13 C ATOM 0 H ALA A 47 8.819 9.041 -5.079 1.00 52.41 H new ATOM 0 HA ALA A 47 7.166 10.993 -6.344 1.00 1.35 H new ATOM 0 HB1 ALA A 47 5.403 9.927 -4.946 1.00 24.13 H new ATOM 0 HB2 ALA A 47 6.418 8.712 -5.759 1.00 24.13 H new ATOM 0 HB3 ALA A 47 6.663 9.064 -4.032 1.00 24.13 H new ATOM 778 N ARG A 48 8.130 11.631 -3.275 1.00 22.44 N ATOM 779 CA ARG A 48 8.307 12.681 -2.249 1.00 71.13 C ATOM 780 C ARG A 48 8.853 13.967 -2.885 1.00 41.04 C ATOM 781 O ARG A 48 8.251 15.035 -2.751 1.00 72.32 O ATOM 782 CB ARG A 48 9.279 12.160 -1.147 1.00 53.31 C ATOM 783 CG ARG A 48 9.855 13.217 -0.177 1.00 11.44 C ATOM 784 CD ARG A 48 10.965 12.643 0.728 1.00 21.21 C ATOM 785 NE ARG A 48 11.747 13.706 1.383 1.00 15.11 N ATOM 786 CZ ARG A 48 12.981 13.560 1.902 1.00 43.43 C ATOM 787 NH1 ARG A 48 13.613 12.387 1.855 1.00 53.44 N ATOM 788 NH2 ARG A 48 13.574 14.593 2.491 1.00 62.33 N ATOM 0 H ARG A 48 8.665 10.785 -3.078 1.00 22.44 H new ATOM 0 HA ARG A 48 7.342 12.913 -1.798 1.00 71.13 H new ATOM 0 HB2 ARG A 48 8.755 11.407 -0.558 1.00 53.31 H new ATOM 0 HB3 ARG A 48 10.113 11.658 -1.638 1.00 53.31 H new ATOM 0 HG2 ARG A 48 10.254 14.053 -0.751 1.00 11.44 H new ATOM 0 HG3 ARG A 48 9.051 13.612 0.445 1.00 11.44 H new ATOM 0 HD2 ARG A 48 10.518 12.001 1.487 1.00 21.21 H new ATOM 0 HD3 ARG A 48 11.630 12.017 0.133 1.00 21.21 H new ATOM 0 HE ARG A 48 11.318 14.629 1.449 1.00 15.11 H new ATOM 0 HH11 ARG A 48 13.162 11.582 1.421 1.00 53.44 H new ATOM 0 HH12 ARG A 48 14.548 12.295 2.253 1.00 53.44 H new ATOM 0 HH21 ARG A 48 13.095 15.491 2.548 1.00 62.33 H new ATOM 0 HH22 ARG A 48 14.509 14.487 2.886 1.00 62.33 H new ATOM 802 N LYS A 49 9.985 13.829 -3.607 1.00 72.32 N ATOM 803 CA LYS A 49 10.685 14.968 -4.235 1.00 43.42 C ATOM 804 C LYS A 49 9.870 15.564 -5.403 1.00 63.14 C ATOM 805 O LYS A 49 9.986 16.758 -5.686 1.00 65.02 O ATOM 806 CB LYS A 49 12.111 14.555 -4.700 1.00 2.20 C ATOM 807 CG LYS A 49 13.084 14.227 -3.535 1.00 62.22 C ATOM 808 CD LYS A 49 14.519 13.878 -4.012 1.00 62.12 C ATOM 809 CE LYS A 49 14.591 12.598 -4.868 1.00 35.14 C ATOM 810 NZ LYS A 49 15.995 12.290 -5.278 1.00 31.05 N ATOM 0 H LYS A 49 10.437 12.929 -3.770 1.00 72.32 H new ATOM 0 HA LYS A 49 10.787 15.747 -3.480 1.00 43.42 H new ATOM 0 HB2 LYS A 49 12.032 13.684 -5.350 1.00 2.20 H new ATOM 0 HB3 LYS A 49 12.535 15.362 -5.298 1.00 2.20 H new ATOM 0 HG2 LYS A 49 13.131 15.081 -2.859 1.00 62.22 H new ATOM 0 HG3 LYS A 49 12.685 13.389 -2.963 1.00 62.22 H new ATOM 0 HD2 LYS A 49 14.914 14.714 -4.589 1.00 62.12 H new ATOM 0 HD3 LYS A 49 15.164 13.759 -3.141 1.00 62.12 H new ATOM 0 HE2 LYS A 49 14.183 11.759 -4.304 1.00 35.14 H new ATOM 0 HE3 LYS A 49 13.970 12.717 -5.756 1.00 35.14 H new ATOM 0 HZ1 LYS A 49 16.007 11.423 -5.852 1.00 31.05 H new ATOM 0 HZ2 LYS A 49 16.375 13.081 -5.837 1.00 31.05 H new ATOM 0 HZ3 LYS A 49 16.582 12.152 -4.431 1.00 31.05 H new ATOM 824 N GLN A 50 9.045 14.727 -6.070 1.00 13.51 N ATOM 825 CA GLN A 50 8.097 15.195 -7.111 1.00 22.51 C ATOM 826 C GLN A 50 6.932 15.971 -6.472 1.00 0.12 C ATOM 827 O GLN A 50 6.364 16.865 -7.102 1.00 42.02 O ATOM 828 CB GLN A 50 7.523 14.004 -7.926 1.00 21.31 C ATOM 829 CG GLN A 50 8.539 13.283 -8.825 1.00 51.31 C ATOM 830 CD GLN A 50 7.904 12.130 -9.596 1.00 41.13 C ATOM 831 OE1 GLN A 50 7.416 12.306 -10.712 1.00 33.31 O ATOM 832 NE2 GLN A 50 7.886 10.949 -8.994 1.00 73.01 N ATOM 0 H GLN A 50 9.015 13.721 -5.907 1.00 13.51 H new ATOM 0 HA GLN A 50 8.651 15.851 -7.783 1.00 22.51 H new ATOM 0 HB2 GLN A 50 7.097 13.280 -7.232 1.00 21.31 H new ATOM 0 HB3 GLN A 50 6.705 14.369 -8.547 1.00 21.31 H new ATOM 0 HG2 GLN A 50 8.970 13.995 -9.528 1.00 51.31 H new ATOM 0 HG3 GLN A 50 9.358 12.903 -8.214 1.00 51.31 H new ATOM 0 HE21 GLN A 50 8.301 10.842 -8.068 1.00 73.01 H new ATOM 0 HE22 GLN A 50 7.457 10.147 -9.456 1.00 73.01 H new ATOM 841 N GLY A 51 6.605 15.624 -5.215 1.00 24.20 N ATOM 842 CA GLY A 51 5.475 16.211 -4.501 1.00 72.33 C ATOM 843 C GLY A 51 4.145 15.636 -4.971 1.00 31.24 C ATOM 844 O GLY A 51 3.228 16.384 -5.335 1.00 52.54 O ATOM 0 H GLY A 51 7.120 14.930 -4.673 1.00 24.20 H new ATOM 0 HA2 GLY A 51 5.590 16.034 -3.432 1.00 72.33 H new ATOM 0 HA3 GLY A 51 5.475 17.291 -4.647 1.00 72.33 H new ATOM 848 N ARG A 52 4.050 14.295 -4.959 1.00 45.40 N ATOM 849 CA ARG A 52 2.852 13.564 -5.408 1.00 64.42 C ATOM 850 C ARG A 52 2.639 12.296 -4.545 1.00 63.53 C ATOM 851 O ARG A 52 3.592 11.812 -3.914 1.00 51.34 O ATOM 852 CB ARG A 52 2.977 13.177 -6.915 1.00 21.00 C ATOM 853 CG ARG A 52 4.078 12.141 -7.250 1.00 60.54 C ATOM 854 CD ARG A 52 4.062 11.737 -8.735 1.00 53.14 C ATOM 855 NE ARG A 52 4.266 12.895 -9.622 1.00 74.43 N ATOM 856 CZ ARG A 52 4.027 12.928 -10.946 1.00 32.04 C ATOM 857 NH1 ARG A 52 3.561 11.860 -11.600 1.00 71.30 N ATOM 858 NH2 ARG A 52 4.251 14.061 -11.610 1.00 13.14 N ATOM 0 H ARG A 52 4.803 13.687 -4.637 1.00 45.40 H new ATOM 0 HA ARG A 52 1.987 14.217 -5.290 1.00 64.42 H new ATOM 0 HB2 ARG A 52 2.018 12.783 -7.251 1.00 21.00 H new ATOM 0 HB3 ARG A 52 3.169 14.083 -7.490 1.00 21.00 H new ATOM 0 HG2 ARG A 52 5.054 12.556 -6.998 1.00 60.54 H new ATOM 0 HG3 ARG A 52 3.940 11.254 -6.632 1.00 60.54 H new ATOM 0 HD2 ARG A 52 4.842 10.998 -8.918 1.00 53.14 H new ATOM 0 HD3 ARG A 52 3.110 11.262 -8.972 1.00 53.14 H new ATOM 0 HE ARG A 52 4.621 13.750 -9.194 1.00 74.43 H new ATOM 0 HH11 ARG A 52 3.378 10.993 -11.095 1.00 71.30 H new ATOM 0 HH12 ARG A 52 3.388 11.912 -12.604 1.00 71.30 H new ATOM 0 HH21 ARG A 52 4.597 14.883 -11.115 1.00 13.14 H new ATOM 0 HH22 ARG A 52 4.076 14.107 -12.614 1.00 13.14 H new ATOM 872 N PRO A 53 1.379 11.756 -4.474 1.00 60.30 N ATOM 873 CA PRO A 53 1.113 10.435 -3.852 1.00 12.44 C ATOM 874 C PRO A 53 1.716 9.254 -4.657 1.00 43.51 C ATOM 875 O PRO A 53 2.076 9.396 -5.840 1.00 73.35 O ATOM 876 CB PRO A 53 -0.438 10.361 -3.815 1.00 14.03 C ATOM 877 CG PRO A 53 -0.896 11.283 -4.903 1.00 3.32 C ATOM 878 CD PRO A 53 0.112 12.412 -4.922 1.00 42.20 C ATOM 0 HA PRO A 53 1.576 10.348 -2.869 1.00 12.44 H new ATOM 0 HB2 PRO A 53 -0.789 9.343 -3.986 1.00 14.03 H new ATOM 0 HB3 PRO A 53 -0.825 10.672 -2.845 1.00 14.03 H new ATOM 0 HG2 PRO A 53 -0.930 10.770 -5.864 1.00 3.32 H new ATOM 0 HG3 PRO A 53 -1.901 11.656 -4.705 1.00 3.32 H new ATOM 0 HD2 PRO A 53 0.213 12.843 -5.918 1.00 42.20 H new ATOM 0 HD3 PRO A 53 -0.179 13.222 -4.253 1.00 42.20 H new ATOM 886 N ILE A 54 1.794 8.085 -4.000 1.00 53.13 N ATOM 887 CA ILE A 54 2.363 6.862 -4.582 1.00 63.52 C ATOM 888 C ILE A 54 1.637 5.624 -4.011 1.00 2.22 C ATOM 889 O ILE A 54 1.350 5.561 -2.815 1.00 61.21 O ATOM 890 CB ILE A 54 3.921 6.794 -4.323 1.00 0.14 C ATOM 891 CG1 ILE A 54 4.566 5.542 -4.990 1.00 52.52 C ATOM 892 CG2 ILE A 54 4.264 6.855 -2.812 1.00 35.03 C ATOM 893 CD1 ILE A 54 6.083 5.530 -4.964 1.00 74.03 C ATOM 0 H ILE A 54 1.461 7.963 -3.044 1.00 53.13 H new ATOM 0 HA ILE A 54 2.214 6.876 -5.662 1.00 63.52 H new ATOM 0 HB ILE A 54 4.351 7.679 -4.792 1.00 0.14 H new ATOM 0 HG12 ILE A 54 4.199 4.648 -4.487 1.00 52.52 H new ATOM 0 HG13 ILE A 54 4.232 5.485 -6.026 1.00 52.52 H new ATOM 0 HG21 ILE A 54 5.345 6.805 -2.682 1.00 35.03 H new ATOM 0 HG22 ILE A 54 3.891 7.789 -2.392 1.00 35.03 H new ATOM 0 HG23 ILE A 54 3.798 6.014 -2.299 1.00 35.03 H new ATOM 0 HD11 ILE A 54 6.448 4.624 -5.449 1.00 74.03 H new ATOM 0 HD12 ILE A 54 6.463 6.403 -5.494 1.00 74.03 H new ATOM 0 HD13 ILE A 54 6.429 5.553 -3.931 1.00 74.03 H new ATOM 905 N VAL A 55 1.302 4.661 -4.890 1.00 5.32 N ATOM 906 CA VAL A 55 0.679 3.384 -4.497 1.00 64.24 C ATOM 907 C VAL A 55 1.691 2.254 -4.749 1.00 23.02 C ATOM 908 O VAL A 55 2.123 2.037 -5.886 1.00 22.04 O ATOM 909 CB VAL A 55 -0.662 3.090 -5.280 1.00 0.04 C ATOM 910 CG1 VAL A 55 -1.345 1.804 -4.754 1.00 53.25 C ATOM 911 CG2 VAL A 55 -1.634 4.289 -5.205 1.00 53.05 C ATOM 0 H VAL A 55 1.456 4.747 -5.895 1.00 5.32 H new ATOM 0 HA VAL A 55 0.414 3.446 -3.441 1.00 64.24 H new ATOM 0 HB VAL A 55 -0.400 2.935 -6.326 1.00 0.04 H new ATOM 0 HG11 VAL A 55 -2.265 1.627 -5.311 1.00 53.25 H new ATOM 0 HG12 VAL A 55 -0.673 0.956 -4.884 1.00 53.25 H new ATOM 0 HG13 VAL A 55 -1.579 1.923 -3.696 1.00 53.25 H new ATOM 0 HG21 VAL A 55 -2.546 4.053 -5.754 1.00 53.05 H new ATOM 0 HG22 VAL A 55 -1.880 4.493 -4.163 1.00 53.05 H new ATOM 0 HG23 VAL A 55 -1.163 5.168 -5.645 1.00 53.05 H new ATOM 921 N ILE A 56 2.082 1.575 -3.671 1.00 14.41 N ATOM 922 CA ILE A 56 3.051 0.475 -3.693 1.00 23.41 C ATOM 923 C ILE A 56 2.302 -0.871 -3.661 1.00 24.21 C ATOM 924 O ILE A 56 1.270 -0.985 -3.007 1.00 73.45 O ATOM 925 CB ILE A 56 4.007 0.575 -2.447 1.00 44.12 C ATOM 926 CG1 ILE A 56 4.733 1.958 -2.404 1.00 20.35 C ATOM 927 CG2 ILE A 56 5.028 -0.584 -2.419 1.00 55.00 C ATOM 928 CD1 ILE A 56 5.752 2.188 -3.512 1.00 14.21 C ATOM 0 H ILE A 56 1.727 1.777 -2.736 1.00 14.41 H new ATOM 0 HA ILE A 56 3.645 0.541 -4.604 1.00 23.41 H new ATOM 0 HB ILE A 56 3.387 0.490 -1.554 1.00 44.12 H new ATOM 0 HG12 ILE A 56 3.982 2.747 -2.453 1.00 20.35 H new ATOM 0 HG13 ILE A 56 5.237 2.057 -1.442 1.00 20.35 H new ATOM 0 HG21 ILE A 56 5.671 -0.481 -1.545 1.00 55.00 H new ATOM 0 HG22 ILE A 56 4.498 -1.535 -2.370 1.00 55.00 H new ATOM 0 HG23 ILE A 56 5.637 -0.554 -3.323 1.00 55.00 H new ATOM 0 HD11 ILE A 56 6.200 3.175 -3.395 1.00 14.21 H new ATOM 0 HD12 ILE A 56 6.530 1.427 -3.455 1.00 14.21 H new ATOM 0 HD13 ILE A 56 5.256 2.127 -4.481 1.00 14.21 H new ATOM 940 N PHE A 57 2.842 -1.869 -4.370 1.00 52.34 N ATOM 941 CA PHE A 57 2.307 -3.236 -4.433 1.00 3.10 C ATOM 942 C PHE A 57 3.442 -4.201 -4.086 1.00 35.41 C ATOM 943 O PHE A 57 4.355 -4.394 -4.891 1.00 2.44 O ATOM 944 CB PHE A 57 1.742 -3.536 -5.853 1.00 14.44 C ATOM 945 CG PHE A 57 0.631 -2.586 -6.282 1.00 4.43 C ATOM 946 CD1 PHE A 57 -0.680 -2.798 -5.866 1.00 44.00 C ATOM 947 CD2 PHE A 57 0.895 -1.472 -7.085 1.00 65.30 C ATOM 948 CE1 PHE A 57 -1.685 -1.928 -6.228 1.00 12.22 C ATOM 949 CE2 PHE A 57 -0.115 -0.605 -7.449 1.00 52.12 C ATOM 950 CZ PHE A 57 -1.404 -0.838 -7.022 1.00 33.13 C ATOM 0 H PHE A 57 3.685 -1.746 -4.931 1.00 52.34 H new ATOM 0 HA PHE A 57 1.487 -3.354 -3.725 1.00 3.10 H new ATOM 0 HB2 PHE A 57 2.555 -3.481 -6.577 1.00 14.44 H new ATOM 0 HB3 PHE A 57 1.363 -4.558 -5.876 1.00 14.44 H new ATOM 0 HD1 PHE A 57 -0.912 -3.655 -5.252 1.00 44.00 H new ATOM 0 HD2 PHE A 57 1.903 -1.288 -7.425 1.00 65.30 H new ATOM 0 HE1 PHE A 57 -2.696 -2.101 -5.888 1.00 12.22 H new ATOM 0 HE2 PHE A 57 0.104 0.253 -8.067 1.00 52.12 H new ATOM 0 HZ PHE A 57 -2.197 -0.164 -7.311 1.00 33.13 H new ATOM 960 N ILE A 58 3.407 -4.763 -2.877 1.00 24.14 N ATOM 961 CA ILE A 58 4.467 -5.650 -2.367 1.00 25.22 C ATOM 962 C ILE A 58 4.008 -7.102 -2.454 1.00 52.23 C ATOM 963 O ILE A 58 2.931 -7.450 -1.943 1.00 33.20 O ATOM 964 CB ILE A 58 4.835 -5.337 -0.869 1.00 3.42 C ATOM 965 CG1 ILE A 58 5.032 -3.811 -0.652 1.00 45.05 C ATOM 966 CG2 ILE A 58 6.109 -6.121 -0.441 1.00 11.00 C ATOM 967 CD1 ILE A 58 4.997 -3.385 0.804 1.00 63.45 C ATOM 0 H ILE A 58 2.642 -4.619 -2.218 1.00 24.14 H new ATOM 0 HA ILE A 58 5.350 -5.480 -2.983 1.00 25.22 H new ATOM 0 HB ILE A 58 4.005 -5.663 -0.243 1.00 3.42 H new ATOM 0 HG12 ILE A 58 5.987 -3.513 -1.084 1.00 45.05 H new ATOM 0 HG13 ILE A 58 4.255 -3.274 -1.196 1.00 45.05 H new ATOM 0 HG21 ILE A 58 6.346 -5.891 0.598 1.00 11.00 H new ATOM 0 HG22 ILE A 58 5.929 -7.191 -0.543 1.00 11.00 H new ATOM 0 HG23 ILE A 58 6.945 -5.831 -1.077 1.00 11.00 H new ATOM 0 HD11 ILE A 58 5.142 -2.307 0.871 1.00 63.45 H new ATOM 0 HD12 ILE A 58 4.032 -3.649 1.237 1.00 63.45 H new ATOM 0 HD13 ILE A 58 5.792 -3.893 1.351 1.00 63.45 H new ATOM 979 N ARG A 59 4.822 -7.941 -3.097 1.00 51.51 N ATOM 980 CA ARG A 59 4.628 -9.385 -3.089 1.00 31.45 C ATOM 981 C ARG A 59 5.291 -9.972 -1.831 1.00 73.43 C ATOM 982 O ARG A 59 6.521 -9.949 -1.719 1.00 65.01 O ATOM 983 CB ARG A 59 5.221 -10.018 -4.368 1.00 61.22 C ATOM 984 CG ARG A 59 5.049 -11.547 -4.445 1.00 43.30 C ATOM 985 CD ARG A 59 5.763 -12.149 -5.655 1.00 61.53 C ATOM 986 NE ARG A 59 7.199 -11.865 -5.646 1.00 22.42 N ATOM 987 CZ ARG A 59 8.064 -12.176 -6.620 1.00 3.44 C ATOM 988 NH1 ARG A 59 7.669 -12.796 -7.734 1.00 73.05 N ATOM 989 NH2 ARG A 59 9.331 -11.850 -6.467 1.00 3.11 N ATOM 0 H ARG A 59 5.632 -7.635 -3.636 1.00 51.51 H new ATOM 0 HA ARG A 59 3.562 -9.610 -3.072 1.00 31.45 H new ATOM 0 HB2 ARG A 59 4.748 -9.565 -5.239 1.00 61.22 H new ATOM 0 HB3 ARG A 59 6.283 -9.778 -4.421 1.00 61.22 H new ATOM 0 HG2 ARG A 59 5.438 -12.001 -3.533 1.00 43.30 H new ATOM 0 HG3 ARG A 59 3.987 -11.789 -4.494 1.00 43.30 H new ATOM 0 HD2 ARG A 59 5.608 -13.228 -5.667 1.00 61.53 H new ATOM 0 HD3 ARG A 59 5.322 -11.753 -6.570 1.00 61.53 H new ATOM 0 HE ARG A 59 7.574 -11.388 -4.826 1.00 22.42 H new ATOM 0 HH11 ARG A 59 6.688 -13.044 -7.859 1.00 73.05 H new ATOM 0 HH12 ARG A 59 8.349 -13.021 -8.461 1.00 73.05 H new ATOM 0 HH21 ARG A 59 9.636 -11.371 -5.620 1.00 3.11 H new ATOM 0 HH22 ARG A 59 10.008 -12.077 -7.196 1.00 3.11 H new ATOM 1003 N GLY A 60 4.453 -10.437 -0.880 1.00 20.24 N ATOM 1004 CA GLY A 60 4.910 -11.149 0.317 1.00 32.03 C ATOM 1005 C GLY A 60 5.693 -10.267 1.286 1.00 51.34 C ATOM 1006 O GLY A 60 6.910 -10.123 1.150 1.00 70.45 O ATOM 0 H GLY A 60 3.440 -10.325 -0.927 1.00 20.24 H new ATOM 0 HA2 GLY A 60 4.046 -11.566 0.834 1.00 32.03 H new ATOM 0 HA3 GLY A 60 5.536 -11.988 0.014 1.00 32.03 H new ATOM 1010 N ALA A 61 4.998 -9.677 2.267 1.00 50.32 N ATOM 1011 CA ALA A 61 5.611 -8.771 3.248 1.00 55.13 C ATOM 1012 C ALA A 61 5.169 -9.162 4.660 1.00 74.05 C ATOM 1013 O ALA A 61 3.997 -9.002 5.010 1.00 62.23 O ATOM 1014 CB ALA A 61 5.229 -7.317 2.936 1.00 44.02 C ATOM 0 H ALA A 61 3.996 -9.814 2.403 1.00 50.32 H new ATOM 0 HA ALA A 61 6.696 -8.856 3.189 1.00 55.13 H new ATOM 0 HB1 ALA A 61 5.689 -6.655 3.669 1.00 44.02 H new ATOM 0 HB2 ALA A 61 5.581 -7.054 1.939 1.00 44.02 H new ATOM 0 HB3 ALA A 61 4.145 -7.208 2.978 1.00 44.02 H new ATOM 1020 N THR A 62 6.112 -9.708 5.450 1.00 25.23 N ATOM 1021 CA THR A 62 5.878 -10.054 6.869 1.00 62.54 C ATOM 1022 C THR A 62 5.843 -8.774 7.732 1.00 3.15 C ATOM 1023 O THR A 62 6.120 -7.681 7.216 1.00 62.50 O ATOM 1024 CB THR A 62 6.979 -11.040 7.401 1.00 75.12 C ATOM 1025 OG1 THR A 62 6.622 -11.532 8.708 1.00 12.33 O ATOM 1026 CG2 THR A 62 8.371 -10.378 7.463 1.00 4.52 C ATOM 0 H THR A 62 7.055 -9.922 5.126 1.00 25.23 H new ATOM 0 HA THR A 62 4.913 -10.556 6.940 1.00 62.54 H new ATOM 0 HB THR A 62 7.033 -11.869 6.696 1.00 75.12 H new ATOM 0 HG1 THR A 62 7.316 -12.147 9.027 1.00 12.33 H new ATOM 0 HG21 THR A 62 9.100 -11.097 7.837 1.00 4.52 H new ATOM 0 HG22 THR A 62 8.663 -10.051 6.465 1.00 4.52 H new ATOM 0 HG23 THR A 62 8.335 -9.518 8.131 1.00 4.52 H new ATOM 1034 N GLU A 63 5.551 -8.930 9.050 1.00 32.10 N ATOM 1035 CA GLU A 63 5.433 -7.801 10.004 1.00 52.30 C ATOM 1036 C GLU A 63 6.669 -6.880 9.937 1.00 54.04 C ATOM 1037 O GLU A 63 6.525 -5.662 9.921 1.00 21.31 O ATOM 1038 CB GLU A 63 5.230 -8.312 11.462 1.00 34.32 C ATOM 1039 CG GLU A 63 3.983 -9.189 11.667 1.00 50.24 C ATOM 1040 CD GLU A 63 3.768 -9.600 13.131 1.00 20.45 C ATOM 1041 OE1 GLU A 63 3.178 -8.809 13.902 1.00 0.55 O ATOM 1042 OE2 GLU A 63 4.206 -10.714 13.524 1.00 54.02 O ATOM 0 H GLU A 63 5.391 -9.842 9.478 1.00 32.10 H new ATOM 0 HA GLU A 63 4.555 -7.225 9.713 1.00 52.30 H new ATOM 0 HB2 GLU A 63 6.111 -8.881 11.759 1.00 34.32 H new ATOM 0 HB3 GLU A 63 5.166 -7.452 12.129 1.00 34.32 H new ATOM 0 HG2 GLU A 63 3.104 -8.648 11.315 1.00 50.24 H new ATOM 0 HG3 GLU A 63 4.072 -10.086 11.054 1.00 50.24 H new ATOM 1049 N GLU A 64 7.862 -7.512 9.817 1.00 40.32 N ATOM 1050 CA GLU A 64 9.172 -6.823 9.760 1.00 54.11 C ATOM 1051 C GLU A 64 9.266 -5.887 8.535 1.00 42.30 C ATOM 1052 O GLU A 64 9.645 -4.724 8.664 1.00 62.51 O ATOM 1053 CB GLU A 64 10.326 -7.863 9.699 1.00 42.43 C ATOM 1054 CG GLU A 64 10.311 -8.912 10.824 1.00 61.40 C ATOM 1055 CD GLU A 64 11.477 -9.911 10.707 1.00 3.43 C ATOM 1056 OE1 GLU A 64 12.552 -9.662 11.299 1.00 71.53 O ATOM 1057 OE2 GLU A 64 11.331 -10.943 10.010 1.00 32.12 O ATOM 0 H GLU A 64 7.941 -8.527 9.756 1.00 40.32 H new ATOM 0 HA GLU A 64 9.265 -6.221 10.664 1.00 54.11 H new ATOM 0 HB2 GLU A 64 10.280 -8.379 8.740 1.00 42.43 H new ATOM 0 HB3 GLU A 64 11.277 -7.331 9.730 1.00 42.43 H new ATOM 0 HG2 GLU A 64 10.363 -8.408 11.789 1.00 61.40 H new ATOM 0 HG3 GLU A 64 9.366 -9.455 10.799 1.00 61.40 H new ATOM 1064 N VAL A 65 8.913 -6.432 7.359 1.00 14.01 N ATOM 1065 CA VAL A 65 8.955 -5.712 6.072 1.00 30.31 C ATOM 1066 C VAL A 65 7.983 -4.515 6.074 1.00 52.30 C ATOM 1067 O VAL A 65 8.366 -3.376 5.727 1.00 54.44 O ATOM 1068 CB VAL A 65 8.617 -6.698 4.886 1.00 64.33 C ATOM 1069 CG1 VAL A 65 8.557 -5.978 3.519 1.00 34.51 C ATOM 1070 CG2 VAL A 65 9.628 -7.868 4.846 1.00 50.14 C ATOM 0 H VAL A 65 8.587 -7.395 7.273 1.00 14.01 H new ATOM 0 HA VAL A 65 9.964 -5.324 5.930 1.00 30.31 H new ATOM 0 HB VAL A 65 7.621 -7.099 5.077 1.00 64.33 H new ATOM 0 HG11 VAL A 65 8.321 -6.700 2.737 1.00 34.51 H new ATOM 0 HG12 VAL A 65 7.785 -5.209 3.547 1.00 34.51 H new ATOM 0 HG13 VAL A 65 9.522 -5.517 3.308 1.00 34.51 H new ATOM 0 HG21 VAL A 65 9.378 -8.537 4.022 1.00 50.14 H new ATOM 0 HG22 VAL A 65 10.634 -7.475 4.702 1.00 50.14 H new ATOM 0 HG23 VAL A 65 9.585 -8.419 5.786 1.00 50.14 H new ATOM 1080 N VAL A 66 6.743 -4.778 6.515 1.00 73.23 N ATOM 1081 CA VAL A 66 5.667 -3.787 6.472 1.00 0.31 C ATOM 1082 C VAL A 66 5.967 -2.619 7.429 1.00 12.41 C ATOM 1083 O VAL A 66 5.931 -1.469 6.998 1.00 3.30 O ATOM 1084 CB VAL A 66 4.261 -4.414 6.787 1.00 71.53 C ATOM 1085 CG1 VAL A 66 3.133 -3.369 6.606 1.00 33.30 C ATOM 1086 CG2 VAL A 66 3.994 -5.654 5.909 1.00 45.11 C ATOM 0 H VAL A 66 6.464 -5.677 6.908 1.00 73.23 H new ATOM 0 HA VAL A 66 5.625 -3.406 5.451 1.00 0.31 H new ATOM 0 HB VAL A 66 4.269 -4.732 7.830 1.00 71.53 H new ATOM 0 HG11 VAL A 66 2.171 -3.830 6.830 1.00 33.30 H new ATOM 0 HG12 VAL A 66 3.301 -2.531 7.283 1.00 33.30 H new ATOM 0 HG13 VAL A 66 3.132 -3.009 5.577 1.00 33.30 H new ATOM 0 HG21 VAL A 66 3.014 -6.066 6.150 1.00 45.11 H new ATOM 0 HG22 VAL A 66 4.019 -5.368 4.858 1.00 45.11 H new ATOM 0 HG23 VAL A 66 4.760 -6.406 6.099 1.00 45.11 H new ATOM 1096 N ARG A 67 6.326 -2.920 8.715 1.00 21.32 N ATOM 1097 CA ARG A 67 6.641 -1.852 9.707 1.00 2.13 C ATOM 1098 C ARG A 67 7.841 -1.015 9.259 1.00 52.01 C ATOM 1099 O ARG A 67 7.903 0.163 9.556 1.00 22.51 O ATOM 1100 CB ARG A 67 6.827 -2.377 11.186 1.00 3.23 C ATOM 1101 CG ARG A 67 7.948 -3.424 11.493 1.00 35.02 C ATOM 1102 CD ARG A 67 9.409 -2.913 11.428 1.00 42.42 C ATOM 1103 NE ARG A 67 9.660 -1.738 12.283 1.00 73.52 N ATOM 1104 CZ ARG A 67 10.659 -0.841 12.104 1.00 63.43 C ATOM 1105 NH1 ARG A 67 11.530 -0.957 11.099 1.00 62.32 N ATOM 1106 NH2 ARG A 67 10.785 0.174 12.949 1.00 4.32 N ATOM 0 H ARG A 67 6.402 -3.870 9.079 1.00 21.32 H new ATOM 0 HA ARG A 67 5.759 -1.212 9.735 1.00 2.13 H new ATOM 0 HB2 ARG A 67 7.007 -1.510 11.821 1.00 3.23 H new ATOM 0 HB3 ARG A 67 5.878 -2.812 11.501 1.00 3.23 H new ATOM 0 HG2 ARG A 67 7.773 -3.829 12.490 1.00 35.02 H new ATOM 0 HG3 ARG A 67 7.844 -4.251 10.790 1.00 35.02 H new ATOM 0 HD2 ARG A 67 10.081 -3.718 11.725 1.00 42.42 H new ATOM 0 HD3 ARG A 67 9.651 -2.660 10.396 1.00 42.42 H new ATOM 0 HE ARG A 67 9.031 -1.589 13.072 1.00 73.52 H new ATOM 0 HH11 ARG A 67 11.452 -1.735 10.444 1.00 62.32 H new ATOM 0 HH12 ARG A 67 12.273 -0.268 10.986 1.00 62.32 H new ATOM 0 HH21 ARG A 67 10.132 0.274 13.726 1.00 4.32 H new ATOM 0 HH22 ARG A 67 11.535 0.854 12.821 1.00 4.32 H new ATOM 1120 N ASP A 68 8.769 -1.652 8.527 1.00 72.32 N ATOM 1121 CA ASP A 68 10.016 -1.030 8.051 1.00 73.34 C ATOM 1122 C ASP A 68 9.730 0.092 7.038 1.00 74.55 C ATOM 1123 O ASP A 68 10.344 1.171 7.080 1.00 3.25 O ATOM 1124 CB ASP A 68 10.899 -2.135 7.435 1.00 63.52 C ATOM 1125 CG ASP A 68 12.241 -1.647 6.895 1.00 53.22 C ATOM 1126 OD1 ASP A 68 12.515 -1.820 5.690 1.00 24.25 O ATOM 1127 OD2 ASP A 68 13.043 -1.104 7.683 1.00 53.10 O ATOM 0 H ASP A 68 8.673 -2.628 8.245 1.00 72.32 H new ATOM 0 HA ASP A 68 10.539 -0.565 8.886 1.00 73.34 H new ATOM 0 HB2 ASP A 68 11.082 -2.899 8.190 1.00 63.52 H new ATOM 0 HB3 ASP A 68 10.348 -2.613 6.625 1.00 63.52 H new ATOM 1132 N ILE A 69 8.786 -0.190 6.135 1.00 43.42 N ATOM 1133 CA ILE A 69 8.315 0.773 5.127 1.00 73.01 C ATOM 1134 C ILE A 69 7.400 1.849 5.748 1.00 40.44 C ATOM 1135 O ILE A 69 7.599 3.055 5.522 1.00 71.43 O ATOM 1136 CB ILE A 69 7.537 0.022 4.003 1.00 62.45 C ATOM 1137 CG1 ILE A 69 8.450 -1.047 3.334 1.00 40.03 C ATOM 1138 CG2 ILE A 69 6.968 1.011 2.964 1.00 24.24 C ATOM 1139 CD1 ILE A 69 7.712 -2.000 2.425 1.00 21.32 C ATOM 0 H ILE A 69 8.323 -1.097 6.080 1.00 43.42 H new ATOM 0 HA ILE A 69 9.191 1.271 4.711 1.00 73.01 H new ATOM 0 HB ILE A 69 6.690 -0.493 4.455 1.00 62.45 H new ATOM 0 HG12 ILE A 69 9.226 -0.540 2.760 1.00 40.03 H new ATOM 0 HG13 ILE A 69 8.953 -1.620 4.113 1.00 40.03 H new ATOM 0 HG21 ILE A 69 6.431 0.459 2.193 1.00 24.24 H new ATOM 0 HG22 ILE A 69 6.286 1.704 3.457 1.00 24.24 H new ATOM 0 HG23 ILE A 69 7.785 1.570 2.508 1.00 24.24 H new ATOM 0 HD11 ILE A 69 8.416 -2.714 1.997 1.00 21.32 H new ATOM 0 HD12 ILE A 69 6.955 -2.536 2.997 1.00 21.32 H new ATOM 0 HD13 ILE A 69 7.232 -1.439 1.623 1.00 21.32 H new ATOM 1151 N VAL A 70 6.386 1.387 6.507 1.00 24.44 N ATOM 1152 CA VAL A 70 5.373 2.256 7.122 1.00 41.12 C ATOM 1153 C VAL A 70 6.044 3.330 7.992 1.00 31.22 C ATOM 1154 O VAL A 70 5.790 4.520 7.793 1.00 24.45 O ATOM 1155 CB VAL A 70 4.320 1.417 7.951 1.00 11.21 C ATOM 1156 CG1 VAL A 70 3.379 2.318 8.780 1.00 25.43 C ATOM 1157 CG2 VAL A 70 3.495 0.499 7.012 1.00 3.32 C ATOM 0 H VAL A 70 6.250 0.397 6.709 1.00 24.44 H new ATOM 0 HA VAL A 70 4.827 2.758 6.324 1.00 41.12 H new ATOM 0 HB VAL A 70 4.882 0.800 8.652 1.00 11.21 H new ATOM 0 HG11 VAL A 70 2.674 1.697 9.332 1.00 25.43 H new ATOM 0 HG12 VAL A 70 3.967 2.910 9.481 1.00 25.43 H new ATOM 0 HG13 VAL A 70 2.831 2.984 8.113 1.00 25.43 H new ATOM 0 HG21 VAL A 70 2.776 -0.071 7.600 1.00 3.32 H new ATOM 0 HG22 VAL A 70 2.964 1.109 6.281 1.00 3.32 H new ATOM 0 HG23 VAL A 70 4.165 -0.187 6.494 1.00 3.32 H new ATOM 1167 N GLU A 71 6.964 2.895 8.887 1.00 64.43 N ATOM 1168 CA GLU A 71 7.688 3.803 9.806 1.00 72.01 C ATOM 1169 C GLU A 71 8.513 4.848 9.036 1.00 21.14 C ATOM 1170 O GLU A 71 8.611 5.993 9.468 1.00 11.44 O ATOM 1171 CB GLU A 71 8.588 3.013 10.810 1.00 15.51 C ATOM 1172 CG GLU A 71 9.885 2.362 10.229 1.00 44.23 C ATOM 1173 CD GLU A 71 11.194 3.060 10.645 1.00 1.24 C ATOM 1174 OE1 GLU A 71 11.905 2.549 11.542 1.00 4.44 O ATOM 1175 OE2 GLU A 71 11.522 4.118 10.074 1.00 14.44 O ATOM 0 H GLU A 71 7.222 1.914 8.991 1.00 64.43 H new ATOM 0 HA GLU A 71 6.933 4.335 10.386 1.00 72.01 H new ATOM 0 HB2 GLU A 71 8.878 3.691 11.613 1.00 15.51 H new ATOM 0 HB3 GLU A 71 7.984 2.225 11.261 1.00 15.51 H new ATOM 0 HG2 GLU A 71 9.927 1.320 10.547 1.00 44.23 H new ATOM 0 HG3 GLU A 71 9.819 2.361 9.141 1.00 44.23 H new ATOM 1182 N TYR A 72 9.072 4.434 7.881 1.00 22.32 N ATOM 1183 CA TYR A 72 9.899 5.294 7.016 1.00 63.32 C ATOM 1184 C TYR A 72 9.066 6.470 6.472 1.00 54.34 C ATOM 1185 O TYR A 72 9.518 7.623 6.457 1.00 3.12 O ATOM 1186 CB TYR A 72 10.477 4.442 5.860 1.00 24.24 C ATOM 1187 CG TYR A 72 11.480 5.167 4.955 1.00 35.30 C ATOM 1188 CD1 TYR A 72 12.823 5.291 5.325 1.00 43.40 C ATOM 1189 CD2 TYR A 72 11.092 5.717 3.727 1.00 41.53 C ATOM 1190 CE1 TYR A 72 13.734 5.932 4.508 1.00 70.24 C ATOM 1191 CE2 TYR A 72 12.002 6.359 2.909 1.00 2.23 C ATOM 1192 CZ TYR A 72 13.321 6.462 3.306 1.00 3.13 C ATOM 1193 OH TYR A 72 14.232 7.103 2.497 1.00 1.44 O ATOM 0 H TYR A 72 8.960 3.486 7.521 1.00 22.32 H new ATOM 0 HA TYR A 72 10.722 5.713 7.595 1.00 63.32 H new ATOM 0 HB2 TYR A 72 10.964 3.564 6.285 1.00 24.24 H new ATOM 0 HB3 TYR A 72 9.651 4.083 5.246 1.00 24.24 H new ATOM 0 HD1 TYR A 72 13.154 4.878 6.267 1.00 43.40 H new ATOM 0 HD2 TYR A 72 10.062 5.638 3.413 1.00 41.53 H new ATOM 0 HE1 TYR A 72 14.767 6.017 4.811 1.00 70.24 H new ATOM 0 HE2 TYR A 72 11.684 6.777 1.966 1.00 2.23 H new ATOM 0 HH TYR A 72 13.847 7.944 2.174 1.00 1.44 H new ATOM 1203 N ALA A 73 7.837 6.157 6.042 1.00 2.24 N ATOM 1204 CA ALA A 73 6.888 7.161 5.544 1.00 24.25 C ATOM 1205 C ALA A 73 6.313 8.010 6.704 1.00 4.03 C ATOM 1206 O ALA A 73 6.029 9.197 6.520 1.00 55.12 O ATOM 1207 CB ALA A 73 5.787 6.471 4.732 1.00 70.23 C ATOM 0 H ALA A 73 7.473 5.204 6.029 1.00 2.24 H new ATOM 0 HA ALA A 73 7.412 7.853 4.884 1.00 24.25 H new ATOM 0 HB1 ALA A 73 5.084 7.218 4.364 1.00 70.23 H new ATOM 0 HB2 ALA A 73 6.233 5.945 3.888 1.00 70.23 H new ATOM 0 HB3 ALA A 73 5.260 5.758 5.366 1.00 70.23 H new ATOM 1213 N GLN A 74 6.181 7.401 7.903 1.00 34.53 N ATOM 1214 CA GLN A 74 5.734 8.109 9.128 1.00 61.33 C ATOM 1215 C GLN A 74 6.756 9.193 9.547 1.00 44.22 C ATOM 1216 O GLN A 74 6.361 10.259 10.026 1.00 74.31 O ATOM 1217 CB GLN A 74 5.507 7.113 10.302 1.00 34.30 C ATOM 1218 CG GLN A 74 4.386 6.073 10.080 1.00 11.22 C ATOM 1219 CD GLN A 74 2.986 6.681 9.972 1.00 30.02 C ATOM 1220 OE1 GLN A 74 2.547 7.063 8.890 1.00 61.04 O ATOM 1221 NE2 GLN A 74 2.271 6.747 11.087 1.00 14.41 N ATOM 0 H GLN A 74 6.379 6.411 8.051 1.00 34.53 H new ATOM 0 HA GLN A 74 4.786 8.594 8.896 1.00 61.33 H new ATOM 0 HB2 GLN A 74 6.440 6.582 10.491 1.00 34.30 H new ATOM 0 HB3 GLN A 74 5.277 7.684 11.201 1.00 34.30 H new ATOM 0 HG2 GLN A 74 4.599 5.513 9.169 1.00 11.22 H new ATOM 0 HG3 GLN A 74 4.398 5.359 10.904 1.00 11.22 H new ATOM 0 HE21 GLN A 74 2.668 6.420 11.968 1.00 14.41 H new ATOM 0 HE22 GLN A 74 1.324 7.124 11.064 1.00 14.41 H new ATOM 1230 N LYS A 75 8.067 8.906 9.327 1.00 3.32 N ATOM 1231 CA LYS A 75 9.182 9.853 9.617 1.00 40.24 C ATOM 1232 C LYS A 75 9.001 11.181 8.860 1.00 41.11 C ATOM 1233 O LYS A 75 9.342 12.254 9.368 1.00 42.02 O ATOM 1234 CB LYS A 75 10.555 9.226 9.225 1.00 61.25 C ATOM 1235 CG LYS A 75 10.966 8.001 10.066 1.00 3.43 C ATOM 1236 CD LYS A 75 12.301 7.357 9.611 1.00 52.03 C ATOM 1237 CE LYS A 75 13.520 8.283 9.759 1.00 2.02 C ATOM 1238 NZ LYS A 75 13.670 8.804 11.144 1.00 43.44 N ATOM 0 H LYS A 75 8.382 8.014 8.945 1.00 3.32 H new ATOM 0 HA LYS A 75 9.165 10.052 10.689 1.00 40.24 H new ATOM 0 HB2 LYS A 75 10.520 8.934 8.175 1.00 61.25 H new ATOM 0 HB3 LYS A 75 11.328 9.989 9.318 1.00 61.25 H new ATOM 0 HG2 LYS A 75 11.054 8.300 11.110 1.00 3.43 H new ATOM 0 HG3 LYS A 75 10.175 7.253 10.014 1.00 3.43 H new ATOM 0 HD2 LYS A 75 12.473 6.451 10.192 1.00 52.03 H new ATOM 0 HD3 LYS A 75 12.211 7.055 8.568 1.00 52.03 H new ATOM 0 HE2 LYS A 75 14.422 7.740 9.478 1.00 2.02 H new ATOM 0 HE3 LYS A 75 13.424 9.120 9.067 1.00 2.02 H new ATOM 0 HZ1 LYS A 75 14.567 9.325 11.224 1.00 43.44 H new ATOM 0 HZ2 LYS A 75 12.878 9.442 11.363 1.00 43.44 H new ATOM 0 HZ3 LYS A 75 13.670 8.010 11.816 1.00 43.44 H new ATOM 1252 N GLU A 76 8.443 11.078 7.646 1.00 50.21 N ATOM 1253 CA GLU A 76 8.271 12.216 6.728 1.00 24.51 C ATOM 1254 C GLU A 76 6.889 12.867 6.865 1.00 54.23 C ATOM 1255 O GLU A 76 6.619 13.886 6.215 1.00 51.34 O ATOM 1256 CB GLU A 76 8.509 11.724 5.281 1.00 64.41 C ATOM 1257 CG GLU A 76 9.903 11.107 5.049 1.00 11.30 C ATOM 1258 CD GLU A 76 11.043 12.087 5.378 1.00 31.21 C ATOM 1259 OE1 GLU A 76 11.429 12.875 4.501 1.00 10.20 O ATOM 1260 OE2 GLU A 76 11.543 12.092 6.519 1.00 72.42 O ATOM 0 H GLU A 76 8.095 10.196 7.269 1.00 50.21 H new ATOM 0 HA GLU A 76 8.999 12.986 6.985 1.00 24.51 H new ATOM 0 HB2 GLU A 76 7.749 10.984 5.030 1.00 64.41 H new ATOM 0 HB3 GLU A 76 8.376 12.562 4.597 1.00 64.41 H new ATOM 0 HG2 GLU A 76 10.008 10.213 5.664 1.00 11.30 H new ATOM 0 HG3 GLU A 76 9.989 10.791 4.009 1.00 11.30 H new ATOM 1267 N GLY A 77 6.031 12.279 7.717 1.00 60.35 N ATOM 1268 CA GLY A 77 4.667 12.765 7.914 1.00 24.34 C ATOM 1269 C GLY A 77 3.756 12.461 6.731 1.00 2.15 C ATOM 1270 O GLY A 77 2.820 13.214 6.455 1.00 61.52 O ATOM 0 H GLY A 77 6.267 11.462 8.280 1.00 60.35 H new ATOM 0 HA2 GLY A 77 4.251 12.311 8.813 1.00 24.34 H new ATOM 0 HA3 GLY A 77 4.690 13.842 8.082 1.00 24.34 H new ATOM 1274 N LEU A 78 4.058 11.360 6.023 1.00 63.42 N ATOM 1275 CA LEU A 78 3.272 10.884 4.876 1.00 73.02 C ATOM 1276 C LEU A 78 2.103 10.026 5.384 1.00 74.34 C ATOM 1277 O LEU A 78 2.302 9.160 6.246 1.00 23.14 O ATOM 1278 CB LEU A 78 4.176 10.063 3.910 1.00 21.22 C ATOM 1279 CG LEU A 78 5.441 10.800 3.358 1.00 24.24 C ATOM 1280 CD1 LEU A 78 6.323 9.856 2.509 1.00 32.11 C ATOM 1281 CD2 LEU A 78 5.059 12.068 2.566 1.00 13.22 C ATOM 0 H LEU A 78 4.863 10.770 6.234 1.00 63.42 H new ATOM 0 HA LEU A 78 2.875 11.737 4.326 1.00 73.02 H new ATOM 0 HB2 LEU A 78 4.503 9.162 4.429 1.00 21.22 H new ATOM 0 HB3 LEU A 78 3.570 9.741 3.063 1.00 21.22 H new ATOM 0 HG LEU A 78 6.030 11.115 4.219 1.00 24.24 H new ATOM 0 HD11 LEU A 78 7.192 10.402 2.142 1.00 32.11 H new ATOM 0 HD12 LEU A 78 6.653 9.017 3.122 1.00 32.11 H new ATOM 0 HD13 LEU A 78 5.746 9.482 1.663 1.00 32.11 H new ATOM 0 HD21 LEU A 78 5.963 12.553 2.198 1.00 13.22 H new ATOM 0 HD22 LEU A 78 4.426 11.793 1.722 1.00 13.22 H new ATOM 0 HD23 LEU A 78 4.518 12.755 3.217 1.00 13.22 H new ATOM 1293 N ARG A 79 0.890 10.284 4.861 1.00 52.01 N ATOM 1294 CA ARG A 79 -0.320 9.545 5.237 1.00 50.22 C ATOM 1295 C ARG A 79 -0.304 8.159 4.566 1.00 51.21 C ATOM 1296 O ARG A 79 -0.456 8.047 3.342 1.00 74.20 O ATOM 1297 CB ARG A 79 -1.581 10.346 4.829 1.00 22.32 C ATOM 1298 CG ARG A 79 -2.919 9.660 5.184 1.00 65.52 C ATOM 1299 CD ARG A 79 -4.140 10.457 4.704 1.00 1.11 C ATOM 1300 NE ARG A 79 -4.097 10.736 3.252 1.00 74.50 N ATOM 1301 CZ ARG A 79 -5.157 11.053 2.493 1.00 44.13 C ATOM 1302 NH1 ARG A 79 -6.382 11.134 3.015 1.00 63.54 N ATOM 1303 NH2 ARG A 79 -4.982 11.300 1.203 1.00 1.52 N ATOM 0 H ARG A 79 0.726 11.012 4.166 1.00 52.01 H new ATOM 0 HA ARG A 79 -0.344 9.408 6.318 1.00 50.22 H new ATOM 0 HB2 ARG A 79 -1.548 11.322 5.313 1.00 22.32 H new ATOM 0 HB3 ARG A 79 -1.552 10.522 3.754 1.00 22.32 H new ATOM 0 HG2 ARG A 79 -2.942 8.665 4.739 1.00 65.52 H new ATOM 0 HG3 ARG A 79 -2.979 9.527 6.264 1.00 65.52 H new ATOM 0 HD2 ARG A 79 -5.048 9.901 4.937 1.00 1.11 H new ATOM 0 HD3 ARG A 79 -4.193 11.399 5.251 1.00 1.11 H new ATOM 0 HE ARG A 79 -3.189 10.683 2.791 1.00 74.50 H new ATOM 0 HH11 ARG A 79 -6.526 10.953 4.009 1.00 63.54 H new ATOM 0 HH12 ARG A 79 -7.175 11.377 2.421 1.00 63.54 H new ATOM 0 HH21 ARG A 79 -4.048 11.248 0.796 1.00 1.52 H new ATOM 0 HH22 ARG A 79 -5.781 11.542 0.617 1.00 1.52 H new ATOM 1317 N VAL A 80 -0.104 7.115 5.382 1.00 71.41 N ATOM 1318 CA VAL A 80 0.066 5.736 4.909 1.00 14.03 C ATOM 1319 C VAL A 80 -1.274 4.976 5.000 1.00 25.21 C ATOM 1320 O VAL A 80 -1.798 4.757 6.095 1.00 31.33 O ATOM 1321 CB VAL A 80 1.182 5.004 5.756 1.00 73.45 C ATOM 1322 CG1 VAL A 80 1.494 3.596 5.209 1.00 25.14 C ATOM 1323 CG2 VAL A 80 2.464 5.857 5.822 1.00 4.15 C ATOM 0 H VAL A 80 -0.055 7.206 6.397 1.00 71.41 H new ATOM 0 HA VAL A 80 0.382 5.754 3.866 1.00 14.03 H new ATOM 0 HB VAL A 80 0.791 4.880 6.766 1.00 73.45 H new ATOM 0 HG11 VAL A 80 2.266 3.131 5.822 1.00 25.14 H new ATOM 0 HG12 VAL A 80 0.591 2.986 5.238 1.00 25.14 H new ATOM 0 HG13 VAL A 80 1.846 3.675 4.180 1.00 25.14 H new ATOM 0 HG21 VAL A 80 3.219 5.334 6.410 1.00 4.15 H new ATOM 0 HG22 VAL A 80 2.842 6.025 4.813 1.00 4.15 H new ATOM 0 HG23 VAL A 80 2.240 6.816 6.290 1.00 4.15 H new ATOM 1333 N LEU A 81 -1.832 4.608 3.832 1.00 21.55 N ATOM 1334 CA LEU A 81 -3.054 3.781 3.731 1.00 23.41 C ATOM 1335 C LEU A 81 -2.609 2.336 3.471 1.00 52.22 C ATOM 1336 O LEU A 81 -2.185 2.018 2.360 1.00 15.05 O ATOM 1337 CB LEU A 81 -3.972 4.268 2.554 1.00 22.42 C ATOM 1338 CG LEU A 81 -4.715 5.641 2.705 1.00 42.25 C ATOM 1339 CD1 LEU A 81 -5.669 5.641 3.908 1.00 53.11 C ATOM 1340 CD2 LEU A 81 -3.739 6.834 2.763 1.00 22.43 C ATOM 0 H LEU A 81 -1.448 4.876 2.926 1.00 21.55 H new ATOM 0 HA LEU A 81 -3.630 3.860 4.653 1.00 23.41 H new ATOM 0 HB2 LEU A 81 -3.359 4.320 1.655 1.00 22.42 H new ATOM 0 HB3 LEU A 81 -4.726 3.500 2.382 1.00 22.42 H new ATOM 0 HG LEU A 81 -5.317 5.768 1.805 1.00 42.25 H new ATOM 0 HD11 LEU A 81 -6.165 6.609 3.979 1.00 53.11 H new ATOM 0 HD12 LEU A 81 -6.417 4.859 3.779 1.00 53.11 H new ATOM 0 HD13 LEU A 81 -5.103 5.455 4.821 1.00 53.11 H new ATOM 0 HD21 LEU A 81 -4.303 7.761 2.868 1.00 22.43 H new ATOM 0 HD22 LEU A 81 -3.072 6.717 3.617 1.00 22.43 H new ATOM 0 HD23 LEU A 81 -3.152 6.868 1.845 1.00 22.43 H new ATOM 1352 N VAL A 82 -2.709 1.453 4.472 1.00 33.42 N ATOM 1353 CA VAL A 82 -2.180 0.084 4.353 1.00 35.23 C ATOM 1354 C VAL A 82 -3.314 -0.894 3.999 1.00 63.32 C ATOM 1355 O VAL A 82 -4.217 -1.135 4.809 1.00 12.11 O ATOM 1356 CB VAL A 82 -1.435 -0.398 5.652 1.00 63.33 C ATOM 1357 CG1 VAL A 82 -0.738 -1.762 5.419 1.00 11.44 C ATOM 1358 CG2 VAL A 82 -0.424 0.661 6.135 1.00 10.53 C ATOM 0 H VAL A 82 -3.148 1.658 5.369 1.00 33.42 H new ATOM 0 HA VAL A 82 -1.442 0.099 3.551 1.00 35.23 H new ATOM 0 HB VAL A 82 -2.182 -0.531 6.435 1.00 63.33 H new ATOM 0 HG11 VAL A 82 -0.231 -2.072 6.333 1.00 11.44 H new ATOM 0 HG12 VAL A 82 -1.483 -2.509 5.146 1.00 11.44 H new ATOM 0 HG13 VAL A 82 -0.009 -1.665 4.614 1.00 11.44 H new ATOM 0 HG21 VAL A 82 0.077 0.302 7.034 1.00 10.53 H new ATOM 0 HG22 VAL A 82 0.316 0.840 5.355 1.00 10.53 H new ATOM 0 HG23 VAL A 82 -0.949 1.590 6.358 1.00 10.53 H new ATOM 1368 N ILE A 83 -3.266 -1.414 2.766 1.00 31.21 N ATOM 1369 CA ILE A 83 -4.154 -2.475 2.277 1.00 12.03 C ATOM 1370 C ILE A 83 -3.424 -3.820 2.441 1.00 52.02 C ATOM 1371 O ILE A 83 -2.462 -4.081 1.725 1.00 35.02 O ATOM 1372 CB ILE A 83 -4.512 -2.261 0.751 1.00 61.04 C ATOM 1373 CG1 ILE A 83 -5.007 -0.812 0.510 1.00 74.24 C ATOM 1374 CG2 ILE A 83 -5.558 -3.290 0.258 1.00 43.23 C ATOM 1375 CD1 ILE A 83 -5.398 -0.492 -0.921 1.00 44.35 C ATOM 0 H ILE A 83 -2.594 -1.101 2.066 1.00 31.21 H new ATOM 0 HA ILE A 83 -5.082 -2.458 2.848 1.00 12.03 H new ATOM 0 HB ILE A 83 -3.603 -2.420 0.171 1.00 61.04 H new ATOM 0 HG12 ILE A 83 -5.866 -0.627 1.155 1.00 74.24 H new ATOM 0 HG13 ILE A 83 -4.222 -0.121 0.818 1.00 74.24 H new ATOM 0 HG21 ILE A 83 -5.777 -3.110 -0.794 1.00 43.23 H new ATOM 0 HG22 ILE A 83 -5.162 -4.298 0.379 1.00 43.23 H new ATOM 0 HG23 ILE A 83 -6.473 -3.187 0.842 1.00 43.23 H new ATOM 0 HD11 ILE A 83 -5.730 0.544 -0.984 1.00 44.35 H new ATOM 0 HD12 ILE A 83 -4.538 -0.638 -1.575 1.00 44.35 H new ATOM 0 HD13 ILE A 83 -6.207 -1.152 -1.233 1.00 44.35 H new ATOM 1387 N MET A 84 -3.839 -4.644 3.403 1.00 72.42 N ATOM 1388 CA MET A 84 -3.295 -6.006 3.573 1.00 11.41 C ATOM 1389 C MET A 84 -4.356 -7.004 3.095 1.00 63.40 C ATOM 1390 O MET A 84 -5.444 -7.092 3.668 1.00 52.31 O ATOM 1391 CB MET A 84 -2.899 -6.237 5.058 1.00 75.43 C ATOM 1392 CG MET A 84 -1.653 -5.453 5.511 1.00 21.05 C ATOM 1393 SD MET A 84 -1.568 -5.233 7.304 1.00 12.44 S ATOM 1394 CE MET A 84 -2.896 -4.055 7.592 1.00 11.43 C ATOM 0 H MET A 84 -4.556 -4.396 4.085 1.00 72.42 H new ATOM 0 HA MET A 84 -2.391 -6.144 2.980 1.00 11.41 H new ATOM 0 HB2 MET A 84 -3.740 -5.959 5.694 1.00 75.43 H new ATOM 0 HB3 MET A 84 -2.721 -7.301 5.213 1.00 75.43 H new ATOM 0 HG2 MET A 84 -0.759 -5.976 5.172 1.00 21.05 H new ATOM 0 HG3 MET A 84 -1.652 -4.475 5.030 1.00 21.05 H new ATOM 0 HE1 MET A 84 -2.476 -3.113 7.944 1.00 11.43 H new ATOM 0 HE2 MET A 84 -3.440 -3.886 6.663 1.00 11.43 H new ATOM 0 HE3 MET A 84 -3.578 -4.452 8.344 1.00 11.43 H new ATOM 1404 N VAL A 85 -4.031 -7.719 2.009 1.00 44.31 N ATOM 1405 CA VAL A 85 -4.920 -8.686 1.348 1.00 41.13 C ATOM 1406 C VAL A 85 -4.150 -9.975 1.096 1.00 61.31 C ATOM 1407 O VAL A 85 -2.988 -9.924 0.701 1.00 53.30 O ATOM 1408 CB VAL A 85 -5.460 -8.154 -0.039 1.00 11.21 C ATOM 1409 CG1 VAL A 85 -6.363 -9.207 -0.738 1.00 55.24 C ATOM 1410 CG2 VAL A 85 -6.200 -6.811 0.126 1.00 32.05 C ATOM 0 H VAL A 85 -3.121 -7.639 1.555 1.00 44.31 H new ATOM 0 HA VAL A 85 -5.773 -8.850 2.007 1.00 41.13 H new ATOM 0 HB VAL A 85 -4.596 -7.982 -0.681 1.00 11.21 H new ATOM 0 HG11 VAL A 85 -6.717 -8.809 -1.689 1.00 55.24 H new ATOM 0 HG12 VAL A 85 -5.790 -10.117 -0.917 1.00 55.24 H new ATOM 0 HG13 VAL A 85 -7.217 -9.435 -0.100 1.00 55.24 H new ATOM 0 HG21 VAL A 85 -6.559 -6.472 -0.846 1.00 32.05 H new ATOM 0 HG22 VAL A 85 -7.046 -6.942 0.800 1.00 32.05 H new ATOM 0 HG23 VAL A 85 -5.518 -6.068 0.540 1.00 32.05 H new ATOM 1420 N ASP A 86 -4.810 -11.109 1.312 1.00 1.42 N ATOM 1421 CA ASP A 86 -4.294 -12.431 0.944 1.00 54.21 C ATOM 1422 C ASP A 86 -5.432 -13.444 1.116 1.00 12.01 C ATOM 1423 O ASP A 86 -6.593 -13.048 1.237 1.00 52.01 O ATOM 1424 CB ASP A 86 -3.033 -12.787 1.797 1.00 11.34 C ATOM 1425 CG ASP A 86 -2.199 -13.907 1.193 1.00 20.32 C ATOM 1426 OD1 ASP A 86 -2.025 -14.957 1.846 1.00 21.44 O ATOM 1427 OD2 ASP A 86 -1.746 -13.749 0.035 1.00 75.42 O ATOM 0 H ASP A 86 -5.729 -11.140 1.753 1.00 1.42 H new ATOM 0 HA ASP A 86 -3.965 -12.446 -0.095 1.00 54.21 H new ATOM 0 HB2 ASP A 86 -2.412 -11.898 1.905 1.00 11.34 H new ATOM 0 HB3 ASP A 86 -3.350 -13.078 2.799 1.00 11.34 H new ATOM 1432 N GLN A 87 -5.121 -14.740 1.056 1.00 54.11 N ATOM 1433 CA GLN A 87 -6.092 -15.812 1.297 1.00 10.11 C ATOM 1434 C GLN A 87 -5.901 -16.413 2.702 1.00 21.31 C ATOM 1435 O GLN A 87 -6.711 -17.230 3.142 1.00 1.40 O ATOM 1436 CB GLN A 87 -5.956 -16.873 0.177 1.00 51.12 C ATOM 1437 CG GLN A 87 -6.210 -16.299 -1.240 1.00 63.13 C ATOM 1438 CD GLN A 87 -6.117 -17.329 -2.368 1.00 23.24 C ATOM 1439 OE1 GLN A 87 -6.406 -18.510 -2.171 1.00 1.53 O ATOM 1440 NE2 GLN A 87 -5.723 -16.887 -3.564 1.00 60.44 N ATOM 0 H GLN A 87 -4.184 -15.079 0.838 1.00 54.11 H new ATOM 0 HA GLN A 87 -7.106 -15.413 1.268 1.00 10.11 H new ATOM 0 HB2 GLN A 87 -4.956 -17.305 0.213 1.00 51.12 H new ATOM 0 HB3 GLN A 87 -6.660 -17.684 0.365 1.00 51.12 H new ATOM 0 HG2 GLN A 87 -7.200 -15.844 -1.262 1.00 63.13 H new ATOM 0 HG3 GLN A 87 -5.489 -15.504 -1.431 1.00 63.13 H new ATOM 0 HE21 GLN A 87 -5.491 -15.902 -3.693 1.00 60.44 H new ATOM 0 HE22 GLN A 87 -5.654 -17.534 -4.349 1.00 60.44 H new ATOM 1449 N ASP A 88 -4.821 -15.992 3.404 1.00 2.53 N ATOM 1450 CA ASP A 88 -4.532 -16.399 4.795 1.00 43.03 C ATOM 1451 C ASP A 88 -4.805 -15.228 5.760 1.00 20.10 C ATOM 1452 O ASP A 88 -3.939 -14.366 5.977 1.00 33.03 O ATOM 1453 CB ASP A 88 -3.069 -16.926 4.931 1.00 44.21 C ATOM 1454 CG ASP A 88 -2.894 -18.380 4.433 1.00 10.55 C ATOM 1455 OD1 ASP A 88 -3.286 -18.685 3.286 1.00 20.31 O ATOM 1456 OD2 ASP A 88 -2.345 -19.222 5.183 1.00 75.22 O ATOM 0 H ASP A 88 -4.124 -15.357 3.016 1.00 2.53 H new ATOM 0 HA ASP A 88 -5.197 -17.220 5.064 1.00 43.03 H new ATOM 0 HB2 ASP A 88 -2.401 -16.274 4.368 1.00 44.21 H new ATOM 0 HB3 ASP A 88 -2.765 -16.868 5.976 1.00 44.21 H new ATOM 1461 N GLN A 89 -6.029 -15.248 6.339 1.00 31.41 N ATOM 1462 CA GLN A 89 -6.545 -14.252 7.313 1.00 33.34 C ATOM 1463 C GLN A 89 -5.566 -14.020 8.484 1.00 62.02 C ATOM 1464 O GLN A 89 -5.491 -12.914 9.029 1.00 24.33 O ATOM 1465 CB GLN A 89 -7.920 -14.749 7.857 1.00 24.03 C ATOM 1466 CG GLN A 89 -8.585 -13.862 8.937 1.00 11.51 C ATOM 1467 CD GLN A 89 -9.049 -12.495 8.430 1.00 42.41 C ATOM 1468 OE1 GLN A 89 -8.160 -11.516 8.421 1.00 22.31 O flip ATOM 1469 NE2 GLN A 89 -10.198 -12.326 8.028 1.00 43.31 N flip ATOM 0 H GLN A 89 -6.708 -15.981 6.135 1.00 31.41 H new ATOM 0 HA GLN A 89 -6.659 -13.298 6.799 1.00 33.34 H new ATOM 0 HB2 GLN A 89 -8.608 -14.841 7.017 1.00 24.03 H new ATOM 0 HB3 GLN A 89 -7.785 -15.749 8.270 1.00 24.03 H new ATOM 0 HG2 GLN A 89 -9.442 -14.394 9.350 1.00 11.51 H new ATOM 0 HG3 GLN A 89 -7.879 -13.713 9.754 1.00 11.51 H new ATOM 0 HE21 GLN A 89 -10.864 -13.099 8.046 1.00 43.31 H new ATOM 0 HE22 GLN A 89 -10.486 -11.413 7.676 1.00 43.31 H new ATOM 1478 N GLU A 90 -4.824 -15.085 8.829 1.00 11.33 N ATOM 1479 CA GLU A 90 -3.837 -15.108 9.923 1.00 71.12 C ATOM 1480 C GLU A 90 -2.804 -13.967 9.805 1.00 13.11 C ATOM 1481 O GLU A 90 -2.624 -13.183 10.744 1.00 62.11 O ATOM 1482 CB GLU A 90 -3.111 -16.472 9.918 1.00 3.11 C ATOM 1483 CG GLU A 90 -4.047 -17.680 10.086 1.00 0.44 C ATOM 1484 CD GLU A 90 -3.337 -19.017 9.839 1.00 24.12 C ATOM 1485 OE1 GLU A 90 -3.468 -19.579 8.729 1.00 1.31 O ATOM 1486 OE2 GLU A 90 -2.618 -19.493 10.747 1.00 14.20 O ATOM 0 H GLU A 90 -4.895 -15.978 8.342 1.00 11.33 H new ATOM 0 HA GLU A 90 -4.372 -14.962 10.861 1.00 71.12 H new ATOM 0 HB2 GLU A 90 -2.564 -16.577 8.981 1.00 3.11 H new ATOM 0 HB3 GLU A 90 -2.374 -16.482 10.721 1.00 3.11 H new ATOM 0 HG2 GLU A 90 -4.463 -17.675 11.093 1.00 0.44 H new ATOM 0 HG3 GLU A 90 -4.884 -17.585 9.395 1.00 0.44 H new ATOM 1493 N GLU A 91 -2.160 -13.888 8.624 1.00 51.34 N ATOM 1494 CA GLU A 91 -1.100 -12.900 8.326 1.00 32.10 C ATOM 1495 C GLU A 91 -1.671 -11.481 8.336 1.00 44.32 C ATOM 1496 O GLU A 91 -1.031 -10.546 8.822 1.00 54.31 O ATOM 1497 CB GLU A 91 -0.455 -13.209 6.950 1.00 3.31 C ATOM 1498 CG GLU A 91 0.185 -14.603 6.869 1.00 61.11 C ATOM 1499 CD GLU A 91 0.792 -14.905 5.493 1.00 74.34 C ATOM 1500 OE1 GLU A 91 1.863 -14.341 5.175 1.00 12.41 O ATOM 1501 OE2 GLU A 91 0.230 -15.737 4.741 1.00 21.34 O ATOM 0 H GLU A 91 -2.361 -14.512 7.843 1.00 51.34 H new ATOM 0 HA GLU A 91 -0.334 -12.969 9.098 1.00 32.10 H new ATOM 0 HB2 GLU A 91 -1.216 -13.122 6.174 1.00 3.31 H new ATOM 0 HB3 GLU A 91 0.305 -12.457 6.737 1.00 3.31 H new ATOM 0 HG2 GLU A 91 0.962 -14.684 7.629 1.00 61.11 H new ATOM 0 HG3 GLU A 91 -0.568 -15.356 7.101 1.00 61.11 H new ATOM 1508 N LEU A 92 -2.899 -11.360 7.808 1.00 44.44 N ATOM 1509 CA LEU A 92 -3.629 -10.089 7.723 1.00 71.44 C ATOM 1510 C LEU A 92 -3.854 -9.487 9.123 1.00 34.54 C ATOM 1511 O LEU A 92 -3.375 -8.392 9.399 1.00 52.04 O ATOM 1512 CB LEU A 92 -4.980 -10.280 6.966 1.00 25.24 C ATOM 1513 CG LEU A 92 -4.895 -10.297 5.406 1.00 22.45 C ATOM 1514 CD1 LEU A 92 -3.973 -11.401 4.881 1.00 54.42 C ATOM 1515 CD2 LEU A 92 -6.293 -10.428 4.795 1.00 21.04 C ATOM 0 H LEU A 92 -3.417 -12.151 7.425 1.00 44.44 H new ATOM 0 HA LEU A 92 -3.022 -9.384 7.155 1.00 71.44 H new ATOM 0 HB2 LEU A 92 -5.429 -11.217 7.296 1.00 25.24 H new ATOM 0 HB3 LEU A 92 -5.657 -9.480 7.264 1.00 25.24 H new ATOM 0 HG LEU A 92 -4.459 -9.346 5.099 1.00 22.45 H new ATOM 0 HD11 LEU A 92 -3.950 -11.368 3.792 1.00 54.42 H new ATOM 0 HD12 LEU A 92 -2.966 -11.250 5.270 1.00 54.42 H new ATOM 0 HD13 LEU A 92 -4.346 -12.372 5.207 1.00 54.42 H new ATOM 0 HD21 LEU A 92 -6.215 -10.438 3.708 1.00 21.04 H new ATOM 0 HD22 LEU A 92 -6.753 -11.356 5.135 1.00 21.04 H new ATOM 0 HD23 LEU A 92 -6.907 -9.583 5.107 1.00 21.04 H new ATOM 1527 N GLU A 93 -4.528 -10.253 10.007 1.00 44.13 N ATOM 1528 CA GLU A 93 -4.885 -9.812 11.376 1.00 25.15 C ATOM 1529 C GLU A 93 -3.641 -9.485 12.213 1.00 55.24 C ATOM 1530 O GLU A 93 -3.674 -8.581 13.043 1.00 14.34 O ATOM 1531 CB GLU A 93 -5.693 -10.913 12.108 1.00 31.30 C ATOM 1532 CG GLU A 93 -7.037 -11.276 11.457 1.00 50.41 C ATOM 1533 CD GLU A 93 -7.730 -12.467 12.143 1.00 23.00 C ATOM 1534 OE1 GLU A 93 -8.853 -12.306 12.678 1.00 52.12 O ATOM 1535 OE2 GLU A 93 -7.145 -13.575 12.149 1.00 1.43 O ATOM 0 H GLU A 93 -4.842 -11.199 9.792 1.00 44.13 H new ATOM 0 HA GLU A 93 -5.487 -8.909 11.269 1.00 25.15 H new ATOM 0 HB2 GLU A 93 -5.081 -11.813 12.167 1.00 31.30 H new ATOM 0 HB3 GLU A 93 -5.879 -10.586 13.131 1.00 31.30 H new ATOM 0 HG2 GLU A 93 -7.697 -10.409 11.490 1.00 50.41 H new ATOM 0 HG3 GLU A 93 -6.874 -11.513 10.406 1.00 50.41 H new ATOM 1542 N ARG A 94 -2.567 -10.249 11.983 1.00 65.21 N ATOM 1543 CA ARG A 94 -1.335 -10.166 12.772 1.00 43.40 C ATOM 1544 C ARG A 94 -0.588 -8.838 12.497 1.00 12.54 C ATOM 1545 O ARG A 94 -0.258 -8.092 13.437 1.00 15.14 O ATOM 1546 CB ARG A 94 -0.458 -11.408 12.458 1.00 34.14 C ATOM 1547 CG ARG A 94 0.832 -11.526 13.289 1.00 42.13 C ATOM 1548 CD ARG A 94 0.586 -11.509 14.807 1.00 33.23 C ATOM 1549 NE ARG A 94 1.850 -11.536 15.563 1.00 4.42 N ATOM 1550 CZ ARG A 94 2.058 -10.945 16.751 1.00 22.34 C ATOM 1551 NH1 ARG A 94 1.096 -10.251 17.349 1.00 40.53 N ATOM 1552 NH2 ARG A 94 3.233 -11.064 17.351 1.00 14.22 N ATOM 0 H ARG A 94 -2.529 -10.946 11.239 1.00 65.21 H new ATOM 0 HA ARG A 94 -1.574 -10.167 13.835 1.00 43.40 H new ATOM 0 HB2 ARG A 94 -1.057 -12.305 12.616 1.00 34.14 H new ATOM 0 HB3 ARG A 94 -0.190 -11.386 11.402 1.00 34.14 H new ATOM 0 HG2 ARG A 94 1.344 -12.451 13.022 1.00 42.13 H new ATOM 0 HG3 ARG A 94 1.500 -10.705 13.028 1.00 42.13 H new ATOM 0 HD2 ARG A 94 0.021 -10.616 15.074 1.00 33.23 H new ATOM 0 HD3 ARG A 94 -0.024 -12.368 15.087 1.00 33.23 H new ATOM 0 HE ARG A 94 2.631 -12.045 15.150 1.00 4.42 H new ATOM 0 HH11 ARG A 94 0.182 -10.160 16.906 1.00 40.53 H new ATOM 0 HH12 ARG A 94 1.272 -9.809 18.251 1.00 40.53 H new ATOM 0 HH21 ARG A 94 3.978 -11.604 16.911 1.00 14.22 H new ATOM 0 HH22 ARG A 94 3.393 -10.616 18.253 1.00 14.22 H new ATOM 1566 N ILE A 95 -0.358 -8.545 11.201 1.00 40.54 N ATOM 1567 CA ILE A 95 0.304 -7.299 10.758 1.00 62.43 C ATOM 1568 C ILE A 95 -0.611 -6.078 11.027 1.00 74.11 C ATOM 1569 O ILE A 95 -0.135 -5.005 11.391 1.00 52.22 O ATOM 1570 CB ILE A 95 0.698 -7.371 9.230 1.00 73.42 C ATOM 1571 CG1 ILE A 95 1.551 -8.649 8.932 1.00 14.12 C ATOM 1572 CG2 ILE A 95 1.470 -6.098 8.799 1.00 34.34 C ATOM 1573 CD1 ILE A 95 1.857 -8.884 7.462 1.00 35.11 C ATOM 0 H ILE A 95 -0.624 -9.162 10.434 1.00 40.54 H new ATOM 0 HA ILE A 95 1.222 -7.183 11.333 1.00 62.43 H new ATOM 0 HB ILE A 95 -0.224 -7.429 8.651 1.00 73.42 H new ATOM 0 HG12 ILE A 95 2.492 -8.575 9.477 1.00 14.12 H new ATOM 0 HG13 ILE A 95 1.024 -9.519 9.322 1.00 14.12 H new ATOM 0 HG21 ILE A 95 1.731 -6.171 7.743 1.00 34.34 H new ATOM 0 HG22 ILE A 95 0.843 -5.221 8.959 1.00 34.34 H new ATOM 0 HG23 ILE A 95 2.380 -6.006 9.392 1.00 34.34 H new ATOM 0 HD11 ILE A 95 2.452 -9.791 7.355 1.00 35.11 H new ATOM 0 HD12 ILE A 95 0.924 -8.994 6.909 1.00 35.11 H new ATOM 0 HD13 ILE A 95 2.415 -8.035 7.066 1.00 35.11 H new ATOM 1585 N TYR A 96 -1.931 -6.280 10.872 1.00 44.24 N ATOM 1586 CA TYR A 96 -2.965 -5.250 11.139 1.00 12.22 C ATOM 1587 C TYR A 96 -2.912 -4.775 12.597 1.00 74.31 C ATOM 1588 O TYR A 96 -2.865 -3.575 12.868 1.00 20.03 O ATOM 1589 CB TYR A 96 -4.355 -5.857 10.818 1.00 2.21 C ATOM 1590 CG TYR A 96 -5.596 -5.010 11.143 1.00 71.04 C ATOM 1591 CD1 TYR A 96 -6.097 -4.066 10.241 1.00 62.30 C ATOM 1592 CD2 TYR A 96 -6.303 -5.200 12.337 1.00 45.30 C ATOM 1593 CE1 TYR A 96 -7.247 -3.344 10.525 1.00 64.54 C ATOM 1594 CE2 TYR A 96 -7.441 -4.476 12.625 1.00 5.25 C ATOM 1595 CZ TYR A 96 -7.915 -3.555 11.716 1.00 54.31 C ATOM 1596 OH TYR A 96 -9.061 -2.844 12.002 1.00 40.42 O ATOM 0 H TYR A 96 -2.319 -7.168 10.555 1.00 44.24 H new ATOM 0 HA TYR A 96 -2.780 -4.381 10.508 1.00 12.22 H new ATOM 0 HB2 TYR A 96 -4.380 -6.094 9.754 1.00 2.21 H new ATOM 0 HB3 TYR A 96 -4.442 -6.800 11.357 1.00 2.21 H new ATOM 0 HD1 TYR A 96 -5.580 -3.896 9.308 1.00 62.30 H new ATOM 0 HD2 TYR A 96 -5.949 -5.931 13.049 1.00 45.30 H new ATOM 0 HE1 TYR A 96 -7.619 -2.619 9.817 1.00 64.54 H new ATOM 0 HE2 TYR A 96 -7.959 -4.630 13.560 1.00 5.25 H new ATOM 0 HH TYR A 96 -9.404 -3.116 12.879 1.00 40.42 H new ATOM 1606 N GLU A 97 -2.907 -5.755 13.513 1.00 51.22 N ATOM 1607 CA GLU A 97 -2.908 -5.532 14.972 1.00 34.32 C ATOM 1608 C GLU A 97 -1.599 -4.824 15.392 1.00 73.30 C ATOM 1609 O GLU A 97 -1.599 -3.979 16.296 1.00 75.35 O ATOM 1610 CB GLU A 97 -3.083 -6.919 15.669 1.00 61.23 C ATOM 1611 CG GLU A 97 -3.691 -6.922 17.095 1.00 62.04 C ATOM 1612 CD GLU A 97 -2.718 -6.496 18.208 1.00 61.14 C ATOM 1613 OE1 GLU A 97 -1.847 -7.313 18.596 1.00 41.23 O ATOM 1614 OE2 GLU A 97 -2.813 -5.351 18.709 1.00 3.22 O ATOM 0 H GLU A 97 -2.902 -6.743 13.259 1.00 51.22 H new ATOM 0 HA GLU A 97 -3.730 -4.883 15.275 1.00 34.32 H new ATOM 0 HB2 GLU A 97 -3.712 -7.541 15.032 1.00 61.23 H new ATOM 0 HB3 GLU A 97 -2.106 -7.399 15.717 1.00 61.23 H new ATOM 0 HG2 GLU A 97 -4.553 -6.255 17.109 1.00 62.04 H new ATOM 0 HG3 GLU A 97 -4.059 -7.924 17.316 1.00 62.04 H new ATOM 1621 N GLN A 98 -0.499 -5.179 14.696 1.00 41.44 N ATOM 1622 CA GLN A 98 0.823 -4.550 14.861 1.00 32.12 C ATOM 1623 C GLN A 98 0.771 -3.036 14.526 1.00 3.21 C ATOM 1624 O GLN A 98 1.075 -2.198 15.381 1.00 0.32 O ATOM 1625 CB GLN A 98 1.861 -5.300 13.962 1.00 52.04 C ATOM 1626 CG GLN A 98 3.281 -4.693 13.936 1.00 34.12 C ATOM 1627 CD GLN A 98 3.971 -4.677 15.299 1.00 52.24 C ATOM 1628 OE1 GLN A 98 3.779 -5.561 16.131 1.00 31.53 O ATOM 1629 NE2 GLN A 98 4.768 -3.657 15.542 1.00 4.43 N ATOM 0 H GLN A 98 -0.507 -5.920 13.995 1.00 41.44 H new ATOM 0 HA GLN A 98 1.132 -4.630 15.903 1.00 32.12 H new ATOM 0 HB2 GLN A 98 1.933 -6.332 14.304 1.00 52.04 H new ATOM 0 HB3 GLN A 98 1.478 -5.328 12.942 1.00 52.04 H new ATOM 0 HG2 GLN A 98 3.895 -5.259 13.235 1.00 34.12 H new ATOM 0 HG3 GLN A 98 3.223 -3.673 13.557 1.00 34.12 H new ATOM 0 HE21 GLN A 98 4.908 -2.938 14.832 1.00 4.43 H new ATOM 0 HE22 GLN A 98 5.245 -3.586 16.441 1.00 4.43 H new ATOM 1638 N LEU A 99 0.333 -2.704 13.295 1.00 54.30 N ATOM 1639 CA LEU A 99 0.330 -1.315 12.763 1.00 50.30 C ATOM 1640 C LEU A 99 -0.740 -0.430 13.449 1.00 13.30 C ATOM 1641 O LEU A 99 -0.634 0.811 13.454 1.00 51.44 O ATOM 1642 CB LEU A 99 0.065 -1.344 11.238 1.00 21.23 C ATOM 1643 CG LEU A 99 1.006 -2.231 10.366 1.00 5.55 C ATOM 1644 CD1 LEU A 99 0.509 -2.277 8.905 1.00 45.30 C ATOM 1645 CD2 LEU A 99 2.469 -1.760 10.444 1.00 72.53 C ATOM 0 H LEU A 99 -0.031 -3.391 12.634 1.00 54.30 H new ATOM 0 HA LEU A 99 1.308 -0.882 12.973 1.00 50.30 H new ATOM 0 HB2 LEU A 99 -0.959 -1.682 11.080 1.00 21.23 H new ATOM 0 HB3 LEU A 99 0.125 -0.321 10.866 1.00 21.23 H new ATOM 0 HG LEU A 99 0.976 -3.243 10.769 1.00 5.55 H new ATOM 0 HD11 LEU A 99 1.178 -2.901 8.312 1.00 45.30 H new ATOM 0 HD12 LEU A 99 -0.497 -2.695 8.876 1.00 45.30 H new ATOM 0 HD13 LEU A 99 0.494 -1.268 8.494 1.00 45.30 H new ATOM 0 HD21 LEU A 99 3.092 -2.404 9.823 1.00 72.53 H new ATOM 0 HD22 LEU A 99 2.540 -0.733 10.087 1.00 72.53 H new ATOM 0 HD23 LEU A 99 2.813 -1.810 11.477 1.00 72.53 H new ATOM 1657 N LYS A 100 -1.777 -1.097 13.996 1.00 42.14 N ATOM 1658 CA LYS A 100 -2.895 -0.460 14.730 1.00 72.14 C ATOM 1659 C LYS A 100 -2.341 0.314 15.952 1.00 11.14 C ATOM 1660 O LYS A 100 -2.798 1.423 16.258 1.00 1.42 O ATOM 1661 CB LYS A 100 -3.914 -1.579 15.156 1.00 21.31 C ATOM 1662 CG LYS A 100 -5.378 -1.139 15.440 1.00 22.31 C ATOM 1663 CD LYS A 100 -5.563 -0.343 16.752 1.00 45.24 C ATOM 1664 CE LYS A 100 -7.032 0.042 17.005 1.00 73.33 C ATOM 1665 NZ LYS A 100 -7.618 0.810 15.871 1.00 63.12 N ATOM 0 H LYS A 100 -1.864 -2.112 13.940 1.00 42.14 H new ATOM 0 HA LYS A 100 -3.415 0.259 14.098 1.00 72.14 H new ATOM 0 HB2 LYS A 100 -3.935 -2.333 14.369 1.00 21.31 H new ATOM 0 HB3 LYS A 100 -3.527 -2.064 16.052 1.00 21.31 H new ATOM 0 HG2 LYS A 100 -5.729 -0.530 14.607 1.00 22.31 H new ATOM 0 HG3 LYS A 100 -6.011 -2.026 15.475 1.00 22.31 H new ATOM 0 HD2 LYS A 100 -5.197 -0.938 17.589 1.00 45.24 H new ATOM 0 HD3 LYS A 100 -4.955 0.561 16.714 1.00 45.24 H new ATOM 0 HE2 LYS A 100 -7.619 -0.861 17.171 1.00 73.33 H new ATOM 0 HE3 LYS A 100 -7.098 0.637 17.916 1.00 73.33 H new ATOM 0 HZ1 LYS A 100 -8.551 1.177 16.146 1.00 63.12 H new ATOM 0 HZ2 LYS A 100 -6.991 1.604 15.629 1.00 63.12 H new ATOM 0 HZ3 LYS A 100 -7.721 0.186 15.046 1.00 63.12 H new ATOM 1679 N LYS A 101 -1.326 -0.287 16.606 1.00 14.21 N ATOM 1680 CA LYS A 101 -0.669 0.276 17.806 1.00 53.14 C ATOM 1681 C LYS A 101 -0.028 1.653 17.526 1.00 14.34 C ATOM 1682 O LYS A 101 0.012 2.513 18.415 1.00 60.40 O ATOM 1683 CB LYS A 101 0.420 -0.693 18.336 1.00 2.43 C ATOM 1684 CG LYS A 101 -0.089 -2.101 18.714 1.00 44.41 C ATOM 1685 CD LYS A 101 1.055 -3.011 19.215 1.00 24.01 C ATOM 1686 CE LYS A 101 0.598 -4.447 19.493 1.00 22.10 C ATOM 1687 NZ LYS A 101 0.083 -5.112 18.268 1.00 31.04 N ATOM 0 H LYS A 101 -0.936 -1.183 16.315 1.00 14.21 H new ATOM 0 HA LYS A 101 -1.447 0.407 18.558 1.00 53.14 H new ATOM 0 HB2 LYS A 101 1.195 -0.795 17.577 1.00 2.43 H new ATOM 0 HB3 LYS A 101 0.889 -0.245 19.212 1.00 2.43 H new ATOM 0 HG2 LYS A 101 -0.851 -2.016 19.489 1.00 44.41 H new ATOM 0 HG3 LYS A 101 -0.565 -2.560 17.847 1.00 44.41 H new ATOM 0 HD2 LYS A 101 1.852 -3.026 18.472 1.00 24.01 H new ATOM 0 HD3 LYS A 101 1.477 -2.587 20.126 1.00 24.01 H new ATOM 0 HE2 LYS A 101 1.432 -5.022 19.895 1.00 22.10 H new ATOM 0 HE3 LYS A 101 -0.180 -4.439 20.256 1.00 22.10 H new ATOM 0 HZ1 LYS A 101 -0.400 -5.995 18.529 1.00 31.04 H new ATOM 0 HZ2 LYS A 101 -0.588 -4.480 17.786 1.00 31.04 H new ATOM 0 HZ3 LYS A 101 0.876 -5.326 17.630 1.00 31.04 H new ATOM 1701 N ASP A 102 0.479 1.846 16.290 1.00 1.32 N ATOM 1702 CA ASP A 102 1.141 3.105 15.881 1.00 54.51 C ATOM 1703 C ASP A 102 0.095 4.196 15.583 1.00 5.34 C ATOM 1704 O ASP A 102 0.359 5.391 15.771 1.00 31.52 O ATOM 1705 CB ASP A 102 2.036 2.873 14.628 1.00 4.22 C ATOM 1706 CG ASP A 102 2.957 4.076 14.333 1.00 30.32 C ATOM 1707 OD1 ASP A 102 2.612 4.939 13.495 1.00 74.11 O ATOM 1708 OD2 ASP A 102 4.033 4.173 14.960 1.00 13.32 O ATOM 0 H ASP A 102 0.442 1.142 15.553 1.00 1.32 H new ATOM 0 HA ASP A 102 1.771 3.438 16.706 1.00 54.51 H new ATOM 0 HB2 ASP A 102 2.644 1.981 14.779 1.00 4.22 H new ATOM 0 HB3 ASP A 102 1.402 2.683 13.762 1.00 4.22 H new ATOM 1713 N GLY A 103 -1.104 3.762 15.156 1.00 33.13 N ATOM 1714 CA GLY A 103 -2.175 4.680 14.762 1.00 63.15 C ATOM 1715 C GLY A 103 -2.102 5.057 13.291 1.00 55.12 C ATOM 1716 O GLY A 103 -2.413 6.192 12.911 1.00 23.34 O ATOM 0 H GLY A 103 -1.351 2.776 15.077 1.00 33.13 H new ATOM 0 HA2 GLY A 103 -3.140 4.218 14.969 1.00 63.15 H new ATOM 0 HA3 GLY A 103 -2.118 5.583 15.369 1.00 63.15 H new ATOM 1720 N VAL A 104 -1.662 4.098 12.469 1.00 34.23 N ATOM 1721 CA VAL A 104 -1.662 4.213 10.998 1.00 20.50 C ATOM 1722 C VAL A 104 -3.061 3.833 10.475 1.00 74.43 C ATOM 1723 O VAL A 104 -3.751 3.018 11.110 1.00 50.12 O ATOM 1724 CB VAL A 104 -0.567 3.262 10.377 1.00 42.43 C ATOM 1725 CG1 VAL A 104 -0.473 3.402 8.840 1.00 31.03 C ATOM 1726 CG2 VAL A 104 0.802 3.508 11.044 1.00 61.23 C ATOM 0 H VAL A 104 -1.291 3.209 12.805 1.00 34.23 H new ATOM 0 HA VAL A 104 -1.426 5.237 10.707 1.00 20.50 H new ATOM 0 HB VAL A 104 -0.873 2.236 10.579 1.00 42.43 H new ATOM 0 HG11 VAL A 104 0.294 2.728 8.459 1.00 31.03 H new ATOM 0 HG12 VAL A 104 -1.434 3.148 8.392 1.00 31.03 H new ATOM 0 HG13 VAL A 104 -0.213 4.429 8.583 1.00 31.03 H new ATOM 0 HG21 VAL A 104 1.546 2.844 10.604 1.00 61.23 H new ATOM 0 HG22 VAL A 104 1.102 4.544 10.887 1.00 61.23 H new ATOM 0 HG23 VAL A 104 0.727 3.310 12.113 1.00 61.23 H new ATOM 1736 N ASP A 105 -3.497 4.423 9.340 1.00 73.02 N ATOM 1737 CA ASP A 105 -4.791 4.066 8.736 1.00 72.34 C ATOM 1738 C ASP A 105 -4.614 2.718 8.014 1.00 54.23 C ATOM 1739 O ASP A 105 -4.010 2.648 6.936 1.00 61.31 O ATOM 1740 CB ASP A 105 -5.257 5.177 7.761 1.00 61.02 C ATOM 1741 CG ASP A 105 -6.744 5.069 7.356 1.00 42.13 C ATOM 1742 OD1 ASP A 105 -7.555 5.919 7.790 1.00 2.55 O ATOM 1743 OD2 ASP A 105 -7.112 4.149 6.589 1.00 30.21 O ATOM 0 H ASP A 105 -2.977 5.139 8.833 1.00 73.02 H new ATOM 0 HA ASP A 105 -5.562 3.973 9.501 1.00 72.34 H new ATOM 0 HB2 ASP A 105 -5.086 6.149 8.224 1.00 61.02 H new ATOM 0 HB3 ASP A 105 -4.642 5.140 6.862 1.00 61.02 H new ATOM 1748 N VAL A 106 -5.126 1.645 8.638 1.00 61.43 N ATOM 1749 CA VAL A 106 -4.893 0.257 8.193 1.00 32.20 C ATOM 1750 C VAL A 106 -6.215 -0.489 7.997 1.00 51.31 C ATOM 1751 O VAL A 106 -7.223 -0.187 8.657 1.00 75.04 O ATOM 1752 CB VAL A 106 -3.974 -0.528 9.213 1.00 5.53 C ATOM 1753 CG1 VAL A 106 -2.572 0.108 9.303 1.00 3.34 C ATOM 1754 CG2 VAL A 106 -4.614 -0.628 10.620 1.00 0.41 C ATOM 0 H VAL A 106 -5.715 1.713 9.468 1.00 61.43 H new ATOM 0 HA VAL A 106 -4.377 0.308 7.234 1.00 32.20 H new ATOM 0 HB VAL A 106 -3.872 -1.542 8.827 1.00 5.53 H new ATOM 0 HG11 VAL A 106 -1.963 -0.453 10.012 1.00 3.34 H new ATOM 0 HG12 VAL A 106 -2.099 0.086 8.321 1.00 3.34 H new ATOM 0 HG13 VAL A 106 -2.662 1.141 9.640 1.00 3.34 H new ATOM 0 HG21 VAL A 106 -3.946 -1.175 11.285 1.00 0.41 H new ATOM 0 HG22 VAL A 106 -4.780 0.374 11.016 1.00 0.41 H new ATOM 0 HG23 VAL A 106 -5.567 -1.153 10.550 1.00 0.41 H new ATOM 1764 N ARG A 107 -6.194 -1.464 7.079 1.00 12.13 N ATOM 1765 CA ARG A 107 -7.356 -2.297 6.759 1.00 60.43 C ATOM 1766 C ARG A 107 -6.907 -3.657 6.215 1.00 0.45 C ATOM 1767 O ARG A 107 -5.808 -3.784 5.651 1.00 33.11 O ATOM 1768 CB ARG A 107 -8.266 -1.585 5.730 1.00 33.42 C ATOM 1769 CG ARG A 107 -7.654 -1.400 4.314 1.00 34.23 C ATOM 1770 CD ARG A 107 -8.635 -0.725 3.346 1.00 63.14 C ATOM 1771 NE ARG A 107 -9.931 -1.415 3.314 1.00 33.31 N ATOM 1772 CZ ARG A 107 -11.084 -0.883 2.891 1.00 45.02 C ATOM 1773 NH1 ARG A 107 -11.141 0.359 2.429 1.00 13.13 N ATOM 1774 NH2 ARG A 107 -12.193 -1.590 2.983 1.00 13.20 N ATOM 0 H ARG A 107 -5.363 -1.697 6.535 1.00 12.13 H new ATOM 0 HA ARG A 107 -7.925 -2.458 7.675 1.00 60.43 H new ATOM 0 HB2 ARG A 107 -9.192 -2.152 5.636 1.00 33.42 H new ATOM 0 HB3 ARG A 107 -8.532 -0.604 6.123 1.00 33.42 H new ATOM 0 HG2 ARG A 107 -6.747 -0.800 4.387 1.00 34.23 H new ATOM 0 HG3 ARG A 107 -7.363 -2.372 3.915 1.00 34.23 H new ATOM 0 HD2 ARG A 107 -8.783 0.313 3.644 1.00 63.14 H new ATOM 0 HD3 ARG A 107 -8.206 -0.711 2.344 1.00 63.14 H new ATOM 0 HE ARG A 107 -9.954 -2.381 3.642 1.00 33.31 H new ATOM 0 HH11 ARG A 107 -10.296 0.928 2.391 1.00 13.13 H new ATOM 0 HH12 ARG A 107 -12.030 0.745 2.112 1.00 13.13 H new ATOM 0 HH21 ARG A 107 -12.166 -2.532 3.373 1.00 13.20 H new ATOM 0 HH22 ARG A 107 -13.078 -1.195 2.664 1.00 13.20 H new ATOM 1788 N VAL A 108 -7.766 -4.671 6.393 1.00 5.33 N ATOM 1789 CA VAL A 108 -7.525 -6.035 5.904 1.00 12.14 C ATOM 1790 C VAL A 108 -8.785 -6.602 5.231 1.00 70.33 C ATOM 1791 O VAL A 108 -9.905 -6.405 5.719 1.00 54.24 O ATOM 1792 CB VAL A 108 -7.057 -7.000 7.064 1.00 11.23 C ATOM 1793 CG1 VAL A 108 -5.624 -6.670 7.514 1.00 52.12 C ATOM 1794 CG2 VAL A 108 -8.024 -6.966 8.275 1.00 31.13 C ATOM 0 H VAL A 108 -8.654 -4.566 6.884 1.00 5.33 H new ATOM 0 HA VAL A 108 -6.722 -5.975 5.169 1.00 12.14 H new ATOM 0 HB VAL A 108 -7.071 -8.012 6.659 1.00 11.23 H new ATOM 0 HG11 VAL A 108 -5.328 -7.350 8.313 1.00 52.12 H new ATOM 0 HG12 VAL A 108 -4.943 -6.783 6.671 1.00 52.12 H new ATOM 0 HG13 VAL A 108 -5.584 -5.643 7.878 1.00 52.12 H new ATOM 0 HG21 VAL A 108 -7.663 -7.644 9.048 1.00 31.13 H new ATOM 0 HG22 VAL A 108 -8.071 -5.953 8.674 1.00 31.13 H new ATOM 0 HG23 VAL A 108 -9.019 -7.277 7.955 1.00 31.13 H new ATOM 1804 N THR A 109 -8.595 -7.291 4.094 1.00 73.23 N ATOM 1805 CA THR A 109 -9.661 -8.067 3.447 1.00 23.31 C ATOM 1806 C THR A 109 -9.035 -9.277 2.773 1.00 11.14 C ATOM 1807 O THR A 109 -7.919 -9.195 2.252 1.00 75.21 O ATOM 1808 CB THR A 109 -10.498 -7.232 2.404 1.00 15.31 C ATOM 1809 OG1 THR A 109 -11.780 -7.847 2.216 1.00 11.40 O ATOM 1810 CG2 THR A 109 -9.813 -7.072 1.026 1.00 22.12 C ATOM 0 H THR A 109 -7.703 -7.325 3.601 1.00 73.23 H new ATOM 0 HA THR A 109 -10.367 -8.372 4.220 1.00 23.31 H new ATOM 0 HB THR A 109 -10.591 -6.231 2.826 1.00 15.31 H new ATOM 0 HG1 THR A 109 -12.443 -7.160 1.994 1.00 11.40 H new ATOM 0 HG21 THR A 109 -10.454 -6.486 0.367 1.00 22.12 H new ATOM 0 HG22 THR A 109 -8.858 -6.562 1.152 1.00 22.12 H new ATOM 0 HG23 THR A 109 -9.644 -8.055 0.587 1.00 22.12 H new ATOM 1818 N ASP A 110 -9.714 -10.413 2.843 1.00 44.35 N ATOM 1819 CA ASP A 110 -9.320 -11.592 2.076 1.00 13.24 C ATOM 1820 C ASP A 110 -9.971 -11.551 0.687 1.00 65.11 C ATOM 1821 O ASP A 110 -11.053 -10.979 0.505 1.00 65.44 O ATOM 1822 CB ASP A 110 -9.664 -12.905 2.818 1.00 64.01 C ATOM 1823 CG ASP A 110 -8.807 -13.103 4.078 1.00 2.13 C ATOM 1824 OD1 ASP A 110 -9.216 -12.628 5.157 1.00 5.42 O ATOM 1825 OD2 ASP A 110 -7.728 -13.736 3.999 1.00 3.44 O ATOM 0 H ASP A 110 -10.542 -10.546 3.423 1.00 44.35 H new ATOM 0 HA ASP A 110 -8.237 -11.574 1.958 1.00 13.24 H new ATOM 0 HB2 ASP A 110 -10.718 -12.898 3.095 1.00 64.01 H new ATOM 0 HB3 ASP A 110 -9.517 -13.750 2.145 1.00 64.01 H new ATOM 1830 N ASN A 111 -9.230 -12.119 -0.275 1.00 62.44 N ATOM 1831 CA ASN A 111 -9.663 -12.438 -1.668 1.00 43.03 C ATOM 1832 C ASN A 111 -9.312 -11.307 -2.654 1.00 12.03 C ATOM 1833 O ASN A 111 -9.375 -10.119 -2.317 1.00 54.23 O ATOM 1834 CB ASN A 111 -11.173 -12.843 -1.803 1.00 72.11 C ATOM 1835 CG ASN A 111 -11.509 -14.167 -1.116 1.00 63.45 C ATOM 1836 OD1 ASN A 111 -11.384 -15.240 -1.713 1.00 3.42 O ATOM 1837 ND2 ASN A 111 -11.945 -14.107 0.137 1.00 24.11 N ATOM 0 H ASN A 111 -8.260 -12.387 -0.107 1.00 62.44 H new ATOM 0 HA ASN A 111 -9.090 -13.326 -1.935 1.00 43.03 H new ATOM 0 HB2 ASN A 111 -11.793 -12.054 -1.378 1.00 72.11 H new ATOM 0 HB3 ASN A 111 -11.429 -12.915 -2.860 1.00 72.11 H new ATOM 0 HD21 ASN A 111 -12.188 -14.964 0.634 1.00 24.11 H new ATOM 0 HD22 ASN A 111 -12.037 -13.204 0.602 1.00 24.11 H new ATOM 1844 N GLU A 112 -8.961 -11.730 -3.883 1.00 0.11 N ATOM 1845 CA GLU A 112 -8.480 -10.862 -4.972 1.00 24.32 C ATOM 1846 C GLU A 112 -9.561 -9.877 -5.440 1.00 12.31 C ATOM 1847 O GLU A 112 -9.329 -8.662 -5.464 1.00 20.44 O ATOM 1848 CB GLU A 112 -8.032 -11.755 -6.154 1.00 73.33 C ATOM 1849 CG GLU A 112 -7.554 -10.995 -7.409 1.00 14.05 C ATOM 1850 CD GLU A 112 -7.421 -11.901 -8.642 1.00 43.53 C ATOM 1851 OE1 GLU A 112 -6.399 -12.588 -8.775 1.00 0.23 O ATOM 1852 OE2 GLU A 112 -8.351 -11.933 -9.481 1.00 33.41 O ATOM 0 H GLU A 112 -9.006 -12.713 -4.152 1.00 0.11 H new ATOM 0 HA GLU A 112 -7.644 -10.270 -4.600 1.00 24.32 H new ATOM 0 HB2 GLU A 112 -7.225 -12.404 -5.813 1.00 73.33 H new ATOM 0 HB3 GLU A 112 -8.863 -12.401 -6.435 1.00 73.33 H new ATOM 0 HG2 GLU A 112 -8.256 -10.191 -7.630 1.00 14.05 H new ATOM 0 HG3 GLU A 112 -6.591 -10.530 -7.201 1.00 14.05 H new ATOM 1859 N ASP A 113 -10.745 -10.422 -5.796 1.00 10.43 N ATOM 1860 CA ASP A 113 -11.864 -9.627 -6.342 1.00 34.13 C ATOM 1861 C ASP A 113 -12.283 -8.542 -5.345 1.00 14.42 C ATOM 1862 O ASP A 113 -12.373 -7.372 -5.704 1.00 45.15 O ATOM 1863 CB ASP A 113 -13.086 -10.523 -6.691 1.00 73.51 C ATOM 1864 CG ASP A 113 -12.881 -11.386 -7.946 1.00 52.52 C ATOM 1865 OD1 ASP A 113 -12.563 -12.585 -7.823 1.00 43.35 O ATOM 1866 OD2 ASP A 113 -13.045 -10.853 -9.065 1.00 44.24 O ATOM 0 H ASP A 113 -10.950 -11.418 -5.713 1.00 10.43 H new ATOM 0 HA ASP A 113 -11.515 -9.158 -7.262 1.00 34.13 H new ATOM 0 HB2 ASP A 113 -13.301 -11.175 -5.844 1.00 73.51 H new ATOM 0 HB3 ASP A 113 -13.961 -9.889 -6.836 1.00 73.51 H new ATOM 1871 N GLU A 114 -12.487 -8.967 -4.090 1.00 62.02 N ATOM 1872 CA GLU A 114 -12.882 -8.095 -2.971 1.00 62.22 C ATOM 1873 C GLU A 114 -11.890 -6.913 -2.803 1.00 21.53 C ATOM 1874 O GLU A 114 -12.301 -5.744 -2.654 1.00 63.50 O ATOM 1875 CB GLU A 114 -12.958 -8.971 -1.696 1.00 24.22 C ATOM 1876 CG GLU A 114 -13.366 -8.248 -0.398 1.00 52.14 C ATOM 1877 CD GLU A 114 -14.729 -7.546 -0.477 1.00 3.14 C ATOM 1878 OE1 GLU A 114 -15.763 -8.245 -0.516 1.00 42.44 O ATOM 1879 OE2 GLU A 114 -14.779 -6.298 -0.489 1.00 73.23 O ATOM 0 H GLU A 114 -12.381 -9.944 -3.818 1.00 62.02 H new ATOM 0 HA GLU A 114 -13.856 -7.645 -3.166 1.00 62.22 H new ATOM 0 HB2 GLU A 114 -13.668 -9.778 -1.876 1.00 24.22 H new ATOM 0 HB3 GLU A 114 -11.983 -9.433 -1.539 1.00 24.22 H new ATOM 0 HG2 GLU A 114 -13.388 -8.971 0.417 1.00 52.14 H new ATOM 0 HG3 GLU A 114 -12.603 -7.511 -0.150 1.00 52.14 H new ATOM 1886 N ALA A 115 -10.588 -7.240 -2.916 1.00 22.35 N ATOM 1887 CA ALA A 115 -9.493 -6.265 -2.830 1.00 24.03 C ATOM 1888 C ALA A 115 -9.574 -5.191 -3.920 1.00 51.02 C ATOM 1889 O ALA A 115 -9.181 -4.057 -3.686 1.00 15.04 O ATOM 1890 CB ALA A 115 -8.153 -6.988 -2.924 1.00 62.12 C ATOM 0 H ALA A 115 -10.268 -8.196 -3.071 1.00 22.35 H new ATOM 0 HA ALA A 115 -9.585 -5.760 -1.869 1.00 24.03 H new ATOM 0 HB1 ALA A 115 -7.343 -6.262 -2.860 1.00 62.12 H new ATOM 0 HB2 ALA A 115 -8.066 -7.702 -2.105 1.00 62.12 H new ATOM 0 HB3 ALA A 115 -8.091 -7.518 -3.875 1.00 62.12 H new ATOM 1896 N LYS A 116 -10.078 -5.571 -5.110 1.00 23.51 N ATOM 1897 CA LYS A 116 -10.166 -4.671 -6.281 1.00 53.33 C ATOM 1898 C LYS A 116 -11.225 -3.572 -6.080 1.00 62.15 C ATOM 1899 O LYS A 116 -11.066 -2.453 -6.597 1.00 51.42 O ATOM 1900 CB LYS A 116 -10.446 -5.499 -7.564 1.00 50.14 C ATOM 1901 CG LYS A 116 -9.338 -6.533 -7.884 1.00 11.25 C ATOM 1902 CD LYS A 116 -9.706 -7.493 -9.041 1.00 52.34 C ATOM 1903 CE LYS A 116 -9.837 -6.780 -10.396 1.00 0.01 C ATOM 1904 NZ LYS A 116 -10.182 -7.731 -11.485 1.00 73.24 N ATOM 0 H LYS A 116 -10.436 -6.509 -5.289 1.00 23.51 H new ATOM 0 HA LYS A 116 -9.208 -4.164 -6.394 1.00 53.33 H new ATOM 0 HB2 LYS A 116 -11.397 -6.020 -7.451 1.00 50.14 H new ATOM 0 HB3 LYS A 116 -10.553 -4.820 -8.410 1.00 50.14 H new ATOM 0 HG2 LYS A 116 -8.420 -6.003 -8.140 1.00 11.25 H new ATOM 0 HG3 LYS A 116 -9.129 -7.119 -6.989 1.00 11.25 H new ATOM 0 HD2 LYS A 116 -8.945 -8.269 -9.118 1.00 52.34 H new ATOM 0 HD3 LYS A 116 -10.647 -7.991 -8.807 1.00 52.34 H new ATOM 0 HE2 LYS A 116 -10.605 -6.009 -10.329 1.00 0.01 H new ATOM 0 HE3 LYS A 116 -8.900 -6.277 -10.635 1.00 0.01 H new ATOM 0 HZ1 LYS A 116 -10.635 -7.215 -12.266 1.00 73.24 H new ATOM 0 HZ2 LYS A 116 -9.316 -8.192 -11.831 1.00 73.24 H new ATOM 0 HZ3 LYS A 116 -10.837 -8.452 -11.121 1.00 73.24 H new ATOM 1918 N LYS A 117 -12.295 -3.887 -5.311 1.00 12.43 N ATOM 1919 CA LYS A 117 -13.298 -2.881 -4.909 1.00 74.15 C ATOM 1920 C LYS A 117 -12.658 -1.935 -3.875 1.00 24.24 C ATOM 1921 O LYS A 117 -12.792 -0.716 -3.975 1.00 72.23 O ATOM 1922 CB LYS A 117 -14.599 -3.513 -4.305 1.00 11.31 C ATOM 1923 CG LYS A 117 -15.473 -4.364 -5.272 1.00 3.42 C ATOM 1924 CD LYS A 117 -14.944 -5.795 -5.470 1.00 55.43 C ATOM 1925 CE LYS A 117 -15.823 -6.662 -6.390 1.00 21.02 C ATOM 1926 NZ LYS A 117 -15.855 -6.155 -7.788 1.00 72.12 N ATOM 0 H LYS A 117 -12.482 -4.826 -4.960 1.00 12.43 H new ATOM 0 HA LYS A 117 -13.601 -2.342 -5.807 1.00 74.15 H new ATOM 0 HB2 LYS A 117 -14.313 -4.142 -3.462 1.00 11.31 H new ATOM 0 HB3 LYS A 117 -15.216 -2.708 -3.907 1.00 11.31 H new ATOM 0 HG2 LYS A 117 -16.491 -4.411 -4.885 1.00 3.42 H new ATOM 0 HG3 LYS A 117 -15.523 -3.865 -6.240 1.00 3.42 H new ATOM 0 HD2 LYS A 117 -13.938 -5.746 -5.886 1.00 55.43 H new ATOM 0 HD3 LYS A 117 -14.864 -6.280 -4.497 1.00 55.43 H new ATOM 0 HE2 LYS A 117 -15.448 -7.686 -6.386 1.00 21.02 H new ATOM 0 HE3 LYS A 117 -16.838 -6.693 -5.994 1.00 21.02 H new ATOM 0 HZ1 LYS A 117 -16.446 -6.782 -8.371 1.00 72.12 H new ATOM 0 HZ2 LYS A 117 -16.253 -5.194 -7.800 1.00 72.12 H new ATOM 0 HZ3 LYS A 117 -14.889 -6.134 -8.172 1.00 72.12 H new ATOM 1940 N ARG A 118 -11.935 -2.536 -2.901 1.00 50.45 N ATOM 1941 CA ARG A 118 -11.294 -1.800 -1.782 1.00 5.45 C ATOM 1942 C ARG A 118 -10.087 -0.953 -2.235 1.00 73.30 C ATOM 1943 O ARG A 118 -9.723 0.032 -1.574 1.00 61.11 O ATOM 1944 CB ARG A 118 -10.875 -2.793 -0.665 1.00 73.21 C ATOM 1945 CG ARG A 118 -12.038 -3.671 -0.143 1.00 42.13 C ATOM 1946 CD ARG A 118 -13.284 -2.853 0.250 1.00 1.21 C ATOM 1947 NE ARG A 118 -14.350 -3.689 0.795 1.00 61.42 N ATOM 1948 CZ ARG A 118 -15.463 -3.237 1.390 1.00 2.41 C ATOM 1949 NH1 ARG A 118 -15.688 -1.931 1.536 1.00 11.43 N ATOM 1950 NH2 ARG A 118 -16.369 -4.102 1.803 1.00 32.31 N ATOM 0 H ARG A 118 -11.779 -3.543 -2.867 1.00 50.45 H new ATOM 0 HA ARG A 118 -12.034 -1.101 -1.391 1.00 5.45 H new ATOM 0 HB2 ARG A 118 -10.085 -3.441 -1.045 1.00 73.21 H new ATOM 0 HB3 ARG A 118 -10.453 -2.231 0.169 1.00 73.21 H new ATOM 0 HG2 ARG A 118 -12.313 -4.394 -0.911 1.00 42.13 H new ATOM 0 HG3 ARG A 118 -11.696 -4.239 0.722 1.00 42.13 H new ATOM 0 HD2 ARG A 118 -13.004 -2.100 0.987 1.00 1.21 H new ATOM 0 HD3 ARG A 118 -13.656 -2.319 -0.625 1.00 1.21 H new ATOM 0 HE ARG A 118 -14.239 -4.700 0.717 1.00 61.42 H new ATOM 0 HH11 ARG A 118 -15.007 -1.254 1.192 1.00 11.43 H new ATOM 0 HH12 ARG A 118 -16.542 -1.608 1.992 1.00 11.43 H new ATOM 0 HH21 ARG A 118 -16.218 -5.102 1.668 1.00 32.31 H new ATOM 0 HH22 ARG A 118 -17.220 -3.771 2.257 1.00 32.31 H new ATOM 1964 N LEU A 119 -9.484 -1.349 -3.362 1.00 1.32 N ATOM 1965 CA LEU A 119 -8.358 -0.637 -3.982 1.00 4.24 C ATOM 1966 C LEU A 119 -8.906 0.692 -4.536 1.00 63.34 C ATOM 1967 O LEU A 119 -8.451 1.779 -4.156 1.00 42.05 O ATOM 1968 CB LEU A 119 -7.737 -1.533 -5.114 1.00 22.14 C ATOM 1969 CG LEU A 119 -6.214 -1.347 -5.452 1.00 23.35 C ATOM 1970 CD1 LEU A 119 -5.874 0.069 -5.940 1.00 55.44 C ATOM 1971 CD2 LEU A 119 -5.321 -1.752 -4.260 1.00 22.33 C ATOM 0 H LEU A 119 -9.767 -2.183 -3.876 1.00 1.32 H new ATOM 0 HA LEU A 119 -7.565 -0.427 -3.264 1.00 4.24 H new ATOM 0 HB2 LEU A 119 -7.892 -2.576 -4.837 1.00 22.14 H new ATOM 0 HB3 LEU A 119 -8.305 -1.358 -6.028 1.00 22.14 H new ATOM 0 HG LEU A 119 -6.004 -2.019 -6.284 1.00 23.35 H new ATOM 0 HD11 LEU A 119 -4.808 0.133 -6.157 1.00 55.44 H new ATOM 0 HD12 LEU A 119 -6.442 0.288 -6.844 1.00 55.44 H new ATOM 0 HD13 LEU A 119 -6.131 0.792 -5.166 1.00 55.44 H new ATOM 0 HD21 LEU A 119 -4.273 -1.612 -4.526 1.00 22.33 H new ATOM 0 HD22 LEU A 119 -5.563 -1.131 -3.397 1.00 22.33 H new ATOM 0 HD23 LEU A 119 -5.496 -2.799 -4.014 1.00 22.33 H new ATOM 1983 N LYS A 120 -9.944 0.559 -5.389 1.00 34.50 N ATOM 1984 CA LYS A 120 -10.670 1.689 -6.001 1.00 40.11 C ATOM 1985 C LYS A 120 -11.281 2.618 -4.923 1.00 20.43 C ATOM 1986 O LYS A 120 -11.348 3.847 -5.096 1.00 31.22 O ATOM 1987 CB LYS A 120 -11.783 1.115 -6.930 1.00 62.03 C ATOM 1988 CG LYS A 120 -12.583 2.174 -7.723 1.00 24.44 C ATOM 1989 CD LYS A 120 -13.564 1.563 -8.755 1.00 21.52 C ATOM 1990 CE LYS A 120 -12.868 0.655 -9.793 1.00 44.43 C ATOM 1991 NZ LYS A 120 -13.808 0.193 -10.852 1.00 10.45 N ATOM 0 H LYS A 120 -10.305 -0.351 -5.675 1.00 34.50 H new ATOM 0 HA LYS A 120 -9.973 2.292 -6.583 1.00 40.11 H new ATOM 0 HB2 LYS A 120 -11.324 0.424 -7.637 1.00 62.03 H new ATOM 0 HB3 LYS A 120 -12.479 0.535 -6.323 1.00 62.03 H new ATOM 0 HG2 LYS A 120 -13.144 2.793 -7.023 1.00 24.44 H new ATOM 0 HG3 LYS A 120 -11.885 2.831 -8.242 1.00 24.44 H new ATOM 0 HD2 LYS A 120 -14.323 0.985 -8.227 1.00 21.52 H new ATOM 0 HD3 LYS A 120 -14.082 2.369 -9.276 1.00 21.52 H new ATOM 0 HE2 LYS A 120 -12.042 1.198 -10.253 1.00 44.43 H new ATOM 0 HE3 LYS A 120 -12.438 -0.210 -9.287 1.00 44.43 H new ATOM 0 HZ1 LYS A 120 -13.300 -0.413 -11.527 1.00 10.45 H new ATOM 0 HZ2 LYS A 120 -14.583 -0.347 -10.417 1.00 10.45 H new ATOM 0 HZ3 LYS A 120 -14.199 1.017 -11.353 1.00 10.45 H new ATOM 2005 N GLU A 121 -11.696 1.998 -3.809 1.00 22.45 N ATOM 2006 CA GLU A 121 -12.331 2.672 -2.667 1.00 64.31 C ATOM 2007 C GLU A 121 -11.343 3.616 -1.952 1.00 54.53 C ATOM 2008 O GLU A 121 -11.698 4.754 -1.626 1.00 33.33 O ATOM 2009 CB GLU A 121 -12.902 1.589 -1.712 1.00 55.12 C ATOM 2010 CG GLU A 121 -13.704 2.111 -0.513 1.00 20.04 C ATOM 2011 CD GLU A 121 -14.386 0.982 0.279 1.00 51.52 C ATOM 2012 OE1 GLU A 121 -15.572 0.679 0.012 1.00 63.41 O ATOM 2013 OE2 GLU A 121 -13.739 0.383 1.166 1.00 53.33 O ATOM 0 H GLU A 121 -11.597 0.992 -3.674 1.00 22.45 H new ATOM 0 HA GLU A 121 -13.148 3.303 -3.017 1.00 64.31 H new ATOM 0 HB2 GLU A 121 -13.542 0.923 -2.290 1.00 55.12 H new ATOM 0 HB3 GLU A 121 -12.073 0.989 -1.337 1.00 55.12 H new ATOM 0 HG2 GLU A 121 -13.040 2.665 0.150 1.00 20.04 H new ATOM 0 HG3 GLU A 121 -14.461 2.812 -0.864 1.00 20.04 H new ATOM 2020 N LEU A 122 -10.089 3.163 -1.741 1.00 15.21 N ATOM 2021 CA LEU A 122 -9.056 4.002 -1.088 1.00 61.05 C ATOM 2022 C LEU A 122 -8.517 5.089 -2.031 1.00 20.32 C ATOM 2023 O LEU A 122 -7.983 6.096 -1.550 1.00 3.40 O ATOM 2024 CB LEU A 122 -7.876 3.177 -0.501 1.00 41.35 C ATOM 2025 CG LEU A 122 -8.187 2.286 0.750 1.00 12.24 C ATOM 2026 CD1 LEU A 122 -6.885 1.941 1.498 1.00 53.12 C ATOM 2027 CD2 LEU A 122 -9.199 2.943 1.712 1.00 35.42 C ATOM 0 H LEU A 122 -9.768 2.233 -2.009 1.00 15.21 H new ATOM 0 HA LEU A 122 -9.566 4.482 -0.253 1.00 61.05 H new ATOM 0 HB2 LEU A 122 -7.488 2.532 -1.289 1.00 41.35 H new ATOM 0 HB3 LEU A 122 -7.078 3.869 -0.234 1.00 41.35 H new ATOM 0 HG LEU A 122 -8.648 1.370 0.381 1.00 12.24 H new ATOM 0 HD11 LEU A 122 -7.116 1.322 2.365 1.00 53.12 H new ATOM 0 HD12 LEU A 122 -6.216 1.397 0.832 1.00 53.12 H new ATOM 0 HD13 LEU A 122 -6.400 2.860 1.828 1.00 53.12 H new ATOM 0 HD21 LEU A 122 -9.377 2.282 2.560 1.00 35.42 H new ATOM 0 HD22 LEU A 122 -8.798 3.892 2.069 1.00 35.42 H new ATOM 0 HD23 LEU A 122 -10.138 3.120 1.187 1.00 35.42 H new ATOM 2039 N LEU A 123 -8.646 4.900 -3.367 1.00 31.05 N ATOM 2040 CA LEU A 123 -8.296 5.969 -4.331 1.00 15.21 C ATOM 2041 C LEU A 123 -9.215 7.194 -4.162 1.00 53.21 C ATOM 2042 O LEU A 123 -8.839 8.282 -4.558 1.00 60.53 O ATOM 2043 CB LEU A 123 -8.269 5.487 -5.820 1.00 54.44 C ATOM 2044 CG LEU A 123 -6.882 4.995 -6.382 1.00 12.32 C ATOM 2045 CD1 LEU A 123 -5.744 6.005 -6.090 1.00 1.43 C ATOM 2046 CD2 LEU A 123 -6.517 3.590 -5.883 1.00 44.01 C ATOM 0 H LEU A 123 -8.982 4.037 -3.794 1.00 31.05 H new ATOM 0 HA LEU A 123 -7.274 6.263 -4.092 1.00 15.21 H new ATOM 0 HB2 LEU A 123 -8.987 4.674 -5.927 1.00 54.44 H new ATOM 0 HB3 LEU A 123 -8.619 6.306 -6.449 1.00 54.44 H new ATOM 0 HG LEU A 123 -6.996 4.934 -7.464 1.00 12.32 H new ATOM 0 HD11 LEU A 123 -4.807 5.624 -6.496 1.00 1.43 H new ATOM 0 HD12 LEU A 123 -5.979 6.962 -6.556 1.00 1.43 H new ATOM 0 HD13 LEU A 123 -5.645 6.140 -5.013 1.00 1.43 H new ATOM 0 HD21 LEU A 123 -5.553 3.296 -6.298 1.00 44.01 H new ATOM 0 HD22 LEU A 123 -6.458 3.594 -4.795 1.00 44.01 H new ATOM 0 HD23 LEU A 123 -7.281 2.881 -6.202 1.00 44.01 H new ATOM 2058 N GLU A 124 -10.406 7.018 -3.554 1.00 13.35 N ATOM 2059 CA GLU A 124 -11.266 8.160 -3.166 1.00 54.33 C ATOM 2060 C GLU A 124 -10.626 8.923 -1.987 1.00 72.10 C ATOM 2061 O GLU A 124 -10.679 10.154 -1.929 1.00 41.43 O ATOM 2062 CB GLU A 124 -12.691 7.688 -2.790 1.00 11.53 C ATOM 2063 CG GLU A 124 -13.427 6.916 -3.911 1.00 53.22 C ATOM 2064 CD GLU A 124 -14.861 6.470 -3.548 1.00 71.31 C ATOM 2065 OE1 GLU A 124 -15.258 6.540 -2.362 1.00 11.45 O ATOM 2066 OE2 GLU A 124 -15.590 6.025 -4.459 1.00 73.52 O ATOM 0 H GLU A 124 -10.794 6.104 -3.321 1.00 13.35 H new ATOM 0 HA GLU A 124 -11.352 8.829 -4.023 1.00 54.33 H new ATOM 0 HB2 GLU A 124 -12.628 7.051 -1.908 1.00 11.53 H new ATOM 0 HB3 GLU A 124 -13.287 8.558 -2.513 1.00 11.53 H new ATOM 0 HG2 GLU A 124 -13.470 7.545 -4.800 1.00 53.22 H new ATOM 0 HG3 GLU A 124 -12.841 6.035 -4.172 1.00 53.22 H new ATOM 2073 N LYS A 125 -10.005 8.169 -1.057 1.00 71.42 N ATOM 2074 CA LYS A 125 -9.282 8.741 0.100 1.00 14.34 C ATOM 2075 C LYS A 125 -7.922 9.343 -0.318 1.00 63.15 C ATOM 2076 O LYS A 125 -7.325 10.089 0.450 1.00 63.24 O ATOM 2077 CB LYS A 125 -9.100 7.677 1.218 1.00 72.13 C ATOM 2078 CG LYS A 125 -10.424 7.244 1.895 1.00 75.31 C ATOM 2079 CD LYS A 125 -10.217 6.200 3.025 1.00 51.33 C ATOM 2080 CE LYS A 125 -9.358 6.726 4.189 1.00 23.42 C ATOM 2081 NZ LYS A 125 -9.186 5.714 5.272 1.00 75.04 N ATOM 0 H LYS A 125 -9.990 7.150 -1.086 1.00 71.42 H new ATOM 0 HA LYS A 125 -9.889 9.554 0.498 1.00 14.34 H new ATOM 0 HB2 LYS A 125 -8.616 6.797 0.793 1.00 72.13 H new ATOM 0 HB3 LYS A 125 -8.428 8.075 1.978 1.00 72.13 H new ATOM 0 HG2 LYS A 125 -10.919 8.123 2.307 1.00 75.31 H new ATOM 0 HG3 LYS A 125 -11.091 6.827 1.141 1.00 75.31 H new ATOM 0 HD2 LYS A 125 -11.190 5.893 3.410 1.00 51.33 H new ATOM 0 HD3 LYS A 125 -9.745 5.311 2.607 1.00 51.33 H new ATOM 0 HE2 LYS A 125 -8.379 7.019 3.811 1.00 23.42 H new ATOM 0 HE3 LYS A 125 -9.821 7.622 4.603 1.00 23.42 H new ATOM 0 HZ1 LYS A 125 -8.765 6.168 6.108 1.00 75.04 H new ATOM 0 HZ2 LYS A 125 -10.113 5.315 5.525 1.00 75.04 H new ATOM 0 HZ3 LYS A 125 -8.560 4.953 4.939 1.00 75.04 H new ATOM 2095 N VAL A 126 -7.438 9.006 -1.521 1.00 63.31 N ATOM 2096 CA VAL A 126 -6.289 9.694 -2.142 1.00 3.02 C ATOM 2097 C VAL A 126 -6.785 10.986 -2.835 1.00 4.25 C ATOM 2098 O VAL A 126 -6.245 12.080 -2.623 1.00 11.34 O ATOM 2099 CB VAL A 126 -5.554 8.754 -3.179 1.00 72.13 C ATOM 2100 CG1 VAL A 126 -4.336 9.447 -3.834 1.00 1.32 C ATOM 2101 CG2 VAL A 126 -5.135 7.419 -2.514 1.00 12.53 C ATOM 0 H VAL A 126 -7.826 8.254 -2.091 1.00 63.31 H new ATOM 0 HA VAL A 126 -5.568 9.951 -1.366 1.00 3.02 H new ATOM 0 HB VAL A 126 -6.267 8.537 -3.975 1.00 72.13 H new ATOM 0 HG11 VAL A 126 -3.863 8.763 -4.539 1.00 1.32 H new ATOM 0 HG12 VAL A 126 -4.667 10.341 -4.363 1.00 1.32 H new ATOM 0 HG13 VAL A 126 -3.618 9.727 -3.063 1.00 1.32 H new ATOM 0 HG21 VAL A 126 -4.631 6.789 -3.248 1.00 12.53 H new ATOM 0 HG22 VAL A 126 -4.458 7.623 -1.685 1.00 12.53 H new ATOM 0 HG23 VAL A 126 -6.021 6.904 -2.141 1.00 12.53 H new