USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 952 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 HIS : no HE2:sc= 0.78 K(o=1.7,f=-4.5!) USER MOD Set 1.2: A 152 SER OG : rot -35:sc= 0.882 USER MOD Set 2.1: A 110 ASN : amide:sc= 0.558 K(o=1.2,f=-0.044) USER MOD Set 2.2: A 144 GLN : amide:sc= 0.624 K(o=1.2,f=-0.0064) USER MOD Set 3.1: A 104 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 115 GLN :FLIP amide:sc= 0 F(o=-0.81,f=0) USER MOD Set 4.1: A 113 GLN : amide:sc= -2.2! C(o=-2.1!,f=-4.3!) USER MOD Set 4.2: A 149 SER OG : rot 180:sc= 0.0661 USER MOD Set 5.1: A 111 GLN : amide:sc= 0.284 K(o=-0.12,f=-5.1!) USER MOD Set 5.2: A 147 GLN : amide:sc= -0.399 K(o=-0.12,f=-5!) USER MOD Set 6.1: A 72 GLN : amide:sc= -1.64! C(o=-1.5!,f=-6.4!) USER MOD Set 6.2: A 75 SER OG : rot -75:sc= 0.157 USER MOD Set 7.1: A 68 HIS : no HE2:sc= 1.04 K(o=1.9,f=-5.9!) USER MOD Set 7.2: A 71 GLN : amide:sc= 0.902 K(o=1.9,f=-2.9) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 180:sc= -0.0614 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 165:sc= -0.0854 (180deg=-0.398) USER MOD Single : A 62 SER OG : rot 51:sc= 0.119 USER MOD Single : A 67 SER OG : rot 180:sc= 0.0413 USER MOD Single : A 73 THR OG1 : rot 77:sc= 1.21 USER MOD Single : A 76 GLN : amide:sc= -0.0436 K(o=-0.044,f=-1.8!) USER MOD Single : A 77 GLN : amide:sc= -1.9! X(o=-1.9!,f=-2) USER MOD Single : A 79 MET CE :methyl 138:sc= -0.612 (180deg=-1.76!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -0.0164 X(o=-0.016,f=-0.33) USER MOD Single : A 86 GLN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 HIS : no HD1:sc= -0.403 X(o=-0.4,f=-0.23) USER MOD Single : A 106 LYS NZ :NH3+ 169:sc= -0.0118 (180deg=-0.126) USER MOD Single : A 116 MET CE :methyl -137:sc= -0.0977 (180deg=-1.93) USER MOD Single : A 118 SER OG : rot 180:sc= -0.52 USER MOD Single : A 121 SER OG : rot 180:sc= 0.379 USER MOD Single : A 122 HIS : no HD1:sc=-0.00635 X(o=-0.0063,f=-0.12) USER MOD Single : A 133 MET CE :methyl -138:sc= -0.197 (180deg=-1.18) USER MOD Single : A 136 THR OG1 : rot 81:sc= 1.05 USER MOD Single : A 137 GLN : amide:sc= 0.304 K(o=0.3,f=-0.64) USER MOD Single : A 141 SER OG : rot -32:sc= 0.335 USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= -0.0332 USER MOD Single : A 158 GLN : amide:sc=-0.000989 K(o=-0.00099,f=-0.6) USER MOD Single : A 159 GLN : amide:sc= -0.518 X(o=-0.52,f=-0.63) USER MOD Single : A 160 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 164 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 166 GLN : amide:sc= -0.705! C(o=-0.71!,f=-4.3!) USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 21 N MET A 2 -59.359 -25.145 38.855 1.00 74.41 N ATOM 22 CA MET A 2 -59.473 -23.992 37.991 1.00 0.55 C ATOM 23 C MET A 2 -59.997 -24.403 36.620 1.00 52.30 C ATOM 24 O MET A 2 -60.362 -25.566 36.401 1.00 65.13 O ATOM 25 CB MET A 2 -58.110 -23.288 37.842 1.00 15.22 C ATOM 26 CG MET A 2 -57.578 -22.637 39.119 1.00 53.21 C ATOM 27 SD MET A 2 -57.076 -23.832 40.383 1.00 22.44 S ATOM 28 CE MET A 2 -56.450 -22.730 41.651 1.00 44.44 C ATOM 0 HA MET A 2 -60.179 -23.296 38.445 1.00 0.55 H new ATOM 0 HB2 MET A 2 -57.378 -24.016 37.491 1.00 15.22 H new ATOM 0 HB3 MET A 2 -58.195 -22.523 37.070 1.00 15.22 H new ATOM 0 HG2 MET A 2 -56.725 -22.006 38.868 1.00 53.21 H new ATOM 0 HG3 MET A 2 -58.347 -21.984 39.532 1.00 53.21 H new ATOM 0 HE1 MET A 2 -56.101 -23.315 42.502 1.00 44.44 H new ATOM 0 HE2 MET A 2 -55.623 -22.145 41.249 1.00 44.44 H new ATOM 0 HE3 MET A 2 -57.245 -22.059 41.975 1.00 44.44 H new ATOM 38 N ALA A 3 -60.011 -23.455 35.701 1.00 43.25 N ATOM 39 CA ALA A 3 -60.478 -23.679 34.346 1.00 71.15 C ATOM 40 C ALA A 3 -60.092 -22.504 33.472 1.00 63.24 C ATOM 41 O ALA A 3 -60.774 -21.478 33.448 1.00 1.52 O ATOM 42 CB ALA A 3 -61.991 -23.888 34.317 1.00 11.54 C ATOM 0 H ALA A 3 -59.696 -22.501 35.876 1.00 43.25 H new ATOM 0 HA ALA A 3 -60.007 -24.583 33.961 1.00 71.15 H new ATOM 0 HB1 ALA A 3 -62.316 -24.054 33.290 1.00 11.54 H new ATOM 0 HB2 ALA A 3 -62.250 -24.755 34.924 1.00 11.54 H new ATOM 0 HB3 ALA A 3 -62.488 -23.004 34.716 1.00 11.54 H new ATOM 48 N SER A 4 -58.982 -22.644 32.781 1.00 21.20 N ATOM 49 CA SER A 4 -58.474 -21.591 31.931 1.00 12.33 C ATOM 50 C SER A 4 -59.286 -21.475 30.641 1.00 3.22 C ATOM 51 O SER A 4 -59.185 -22.321 29.751 1.00 60.43 O ATOM 52 CB SER A 4 -57.004 -21.851 31.607 1.00 21.24 C ATOM 53 OG SER A 4 -56.247 -22.037 32.796 1.00 33.22 O ATOM 0 H SER A 4 -58.409 -23.487 32.792 1.00 21.20 H new ATOM 0 HA SER A 4 -58.565 -20.647 32.468 1.00 12.33 H new ATOM 0 HB2 SER A 4 -56.918 -22.734 30.974 1.00 21.24 H new ATOM 0 HB3 SER A 4 -56.599 -21.013 31.041 1.00 21.24 H new ATOM 0 HG SER A 4 -55.309 -22.204 32.564 1.00 33.22 H new ATOM 59 N ASP A 5 -60.123 -20.455 30.571 1.00 33.34 N ATOM 60 CA ASP A 5 -60.896 -20.182 29.368 1.00 3.54 C ATOM 61 C ASP A 5 -60.071 -19.325 28.427 1.00 22.11 C ATOM 62 O ASP A 5 -59.908 -19.648 27.245 1.00 33.11 O ATOM 63 CB ASP A 5 -62.217 -19.481 29.718 1.00 13.20 C ATOM 64 CG ASP A 5 -62.972 -18.998 28.492 1.00 13.11 C ATOM 65 OD1 ASP A 5 -63.195 -19.803 27.565 1.00 23.33 O ATOM 66 OD2 ASP A 5 -63.357 -17.812 28.457 1.00 73.00 O ATOM 0 H ASP A 5 -60.286 -19.799 31.335 1.00 33.34 H new ATOM 0 HA ASP A 5 -61.139 -21.125 28.878 1.00 3.54 H new ATOM 0 HB2 ASP A 5 -62.849 -20.168 30.281 1.00 13.20 H new ATOM 0 HB3 ASP A 5 -62.010 -18.632 30.369 1.00 13.20 H new ATOM 71 N ASP A 6 -59.542 -18.232 28.978 1.00 14.23 N ATOM 72 CA ASP A 6 -58.675 -17.303 28.250 1.00 24.13 C ATOM 73 C ASP A 6 -59.409 -16.686 27.048 1.00 10.31 C ATOM 74 O ASP A 6 -60.634 -16.783 26.943 1.00 1.42 O ATOM 75 CB ASP A 6 -57.388 -18.018 27.808 1.00 71.33 C ATOM 76 CG ASP A 6 -56.236 -17.066 27.578 1.00 10.52 C ATOM 77 OD1 ASP A 6 -55.539 -16.725 28.558 1.00 44.05 O ATOM 78 OD2 ASP A 6 -56.019 -16.664 26.428 1.00 43.32 O ATOM 0 H ASP A 6 -59.704 -17.964 29.949 1.00 14.23 H new ATOM 0 HA ASP A 6 -58.404 -16.486 28.919 1.00 24.13 H new ATOM 0 HB2 ASP A 6 -57.104 -18.747 28.567 1.00 71.33 H new ATOM 0 HB3 ASP A 6 -57.583 -18.573 26.890 1.00 71.33 H new ATOM 83 N ARG A 7 -58.671 -16.056 26.154 1.00 31.43 N ATOM 84 CA ARG A 7 -59.262 -15.421 24.994 1.00 63.14 C ATOM 85 C ARG A 7 -58.266 -15.367 23.850 1.00 70.22 C ATOM 86 O ARG A 7 -57.064 -15.511 24.059 1.00 30.21 O ATOM 87 CB ARG A 7 -59.720 -14.003 25.333 1.00 14.54 C ATOM 88 CG ARG A 7 -58.588 -13.081 25.752 1.00 33.10 C ATOM 89 CD ARG A 7 -59.044 -11.639 25.829 1.00 3.25 C ATOM 90 NE ARG A 7 -60.103 -11.443 26.825 1.00 63.33 N ATOM 91 CZ ARG A 7 -60.047 -10.562 27.831 1.00 0.35 C ATOM 92 NH1 ARG A 7 -58.960 -9.813 28.012 1.00 11.34 N ATOM 93 NH2 ARG A 7 -61.079 -10.442 28.659 1.00 35.24 N ATOM 0 H ARG A 7 -57.656 -15.971 26.211 1.00 31.43 H new ATOM 0 HA ARG A 7 -60.125 -16.014 24.690 1.00 63.14 H new ATOM 0 HB2 ARG A 7 -60.223 -13.576 24.465 1.00 14.54 H new ATOM 0 HB3 ARG A 7 -60.455 -14.050 26.136 1.00 14.54 H new ATOM 0 HG2 ARG A 7 -58.203 -13.394 26.723 1.00 33.10 H new ATOM 0 HG3 ARG A 7 -57.766 -13.166 25.041 1.00 33.10 H new ATOM 0 HD2 ARG A 7 -58.193 -11.004 26.076 1.00 3.25 H new ATOM 0 HD3 ARG A 7 -59.405 -11.322 24.851 1.00 3.25 H new ATOM 0 HE ARG A 7 -60.941 -12.019 26.745 1.00 63.33 H new ATOM 0 HH11 ARG A 7 -58.164 -9.909 27.382 1.00 11.34 H new ATOM 0 HH12 ARG A 7 -58.924 -9.144 28.781 1.00 11.34 H new ATOM 0 HH21 ARG A 7 -61.909 -11.020 28.526 1.00 35.24 H new ATOM 0 HH22 ARG A 7 -61.041 -9.772 29.427 1.00 35.24 H new ATOM 107 N ALA A 8 -58.774 -15.158 22.654 1.00 64.03 N ATOM 108 CA ALA A 8 -57.949 -15.047 21.472 1.00 40.04 C ATOM 109 C ALA A 8 -58.769 -14.504 20.321 1.00 22.24 C ATOM 110 O ALA A 8 -59.991 -14.672 20.285 1.00 3.21 O ATOM 111 CB ALA A 8 -57.347 -16.394 21.103 1.00 22.23 C ATOM 0 H ALA A 8 -59.773 -15.060 22.475 1.00 64.03 H new ATOM 0 HA ALA A 8 -57.131 -14.358 21.683 1.00 40.04 H new ATOM 0 HB1 ALA A 8 -56.731 -16.285 20.211 1.00 22.23 H new ATOM 0 HB2 ALA A 8 -56.732 -16.756 21.927 1.00 22.23 H new ATOM 0 HB3 ALA A 8 -58.147 -17.108 20.906 1.00 22.23 H new ATOM 117 N THR A 9 -58.117 -13.831 19.405 1.00 2.25 N ATOM 118 CA THR A 9 -58.785 -13.278 18.246 1.00 74.02 C ATOM 119 C THR A 9 -57.820 -13.209 17.069 1.00 11.42 C ATOM 120 O THR A 9 -57.042 -12.257 16.939 1.00 32.42 O ATOM 121 CB THR A 9 -59.364 -11.869 18.540 1.00 53.33 C ATOM 122 OG1 THR A 9 -60.228 -11.935 19.690 1.00 63.13 O ATOM 123 CG2 THR A 9 -60.155 -11.344 17.348 1.00 35.20 C ATOM 0 H THR A 9 -57.114 -13.650 19.438 1.00 2.25 H new ATOM 0 HA THR A 9 -59.617 -13.937 17.995 1.00 74.02 H new ATOM 0 HB THR A 9 -58.533 -11.190 18.733 1.00 53.33 H new ATOM 0 HG1 THR A 9 -60.593 -11.045 19.877 1.00 63.13 H new ATOM 0 HG21 THR A 9 -60.550 -10.355 17.580 1.00 35.20 H new ATOM 0 HG22 THR A 9 -59.502 -11.279 16.478 1.00 35.20 H new ATOM 0 HG23 THR A 9 -60.980 -12.022 17.132 1.00 35.20 H new ATOM 131 N GLY A 10 -57.853 -14.229 16.233 1.00 14.41 N ATOM 132 CA GLY A 10 -56.970 -14.274 15.092 1.00 71.21 C ATOM 133 C GLY A 10 -57.712 -14.544 13.800 1.00 55.44 C ATOM 134 O GLY A 10 -57.848 -15.701 13.391 1.00 33.33 O ATOM 0 H GLY A 10 -58.478 -15.030 16.324 1.00 14.41 H new ATOM 0 HA2 GLY A 10 -56.437 -13.327 15.011 1.00 71.21 H new ATOM 0 HA3 GLY A 10 -56.220 -15.050 15.246 1.00 71.21 H new ATOM 138 N PRO A 11 -58.220 -13.496 13.137 1.00 41.15 N ATOM 139 CA PRO A 11 -58.936 -13.636 11.874 1.00 50.10 C ATOM 140 C PRO A 11 -58.005 -14.046 10.748 1.00 21.42 C ATOM 141 O PRO A 11 -56.890 -13.521 10.623 1.00 52.31 O ATOM 142 CB PRO A 11 -59.505 -12.229 11.609 1.00 50.20 C ATOM 143 CG PRO A 11 -59.341 -11.492 12.897 1.00 54.23 C ATOM 144 CD PRO A 11 -58.147 -12.097 13.564 1.00 32.43 C ATOM 0 HA PRO A 11 -59.704 -14.408 11.924 1.00 50.10 H new ATOM 0 HB2 PRO A 11 -58.968 -11.733 10.800 1.00 50.20 H new ATOM 0 HB3 PRO A 11 -60.553 -12.277 11.313 1.00 50.20 H new ATOM 0 HG2 PRO A 11 -59.193 -10.426 12.722 1.00 54.23 H new ATOM 0 HG3 PRO A 11 -60.230 -11.592 13.520 1.00 54.23 H new ATOM 0 HD2 PRO A 11 -57.219 -11.623 13.243 1.00 32.43 H new ATOM 0 HD3 PRO A 11 -58.196 -12.001 14.649 1.00 32.43 H new ATOM 209 N LEU A 16 -51.093 -10.053 1.296 1.00 41.13 N ATOM 210 CA LEU A 16 -51.160 -9.318 0.053 1.00 32.41 C ATOM 211 C LEU A 16 -49.843 -9.447 -0.703 1.00 11.33 C ATOM 212 O LEU A 16 -48.830 -8.846 -0.328 1.00 62.53 O ATOM 213 CB LEU A 16 -51.504 -7.841 0.324 1.00 2.12 C ATOM 214 CG LEU A 16 -52.035 -7.024 -0.868 1.00 33.31 C ATOM 215 CD1 LEU A 16 -52.728 -5.770 -0.372 1.00 1.23 C ATOM 216 CD2 LEU A 16 -50.913 -6.648 -1.828 1.00 34.12 C ATOM 0 HA LEU A 16 -51.951 -9.739 -0.568 1.00 32.41 H new ATOM 0 HB2 LEU A 16 -52.249 -7.806 1.119 1.00 2.12 H new ATOM 0 HB3 LEU A 16 -50.609 -7.347 0.703 1.00 2.12 H new ATOM 0 HG LEU A 16 -52.749 -7.646 -1.408 1.00 33.31 H new ATOM 0 HD11 LEU A 16 -53.100 -5.199 -1.223 1.00 1.23 H new ATOM 0 HD12 LEU A 16 -53.563 -6.046 0.272 1.00 1.23 H new ATOM 0 HD13 LEU A 16 -52.020 -5.162 0.191 1.00 1.23 H new ATOM 0 HD21 LEU A 16 -51.322 -6.072 -2.658 1.00 34.12 H new ATOM 0 HD22 LEU A 16 -50.170 -6.049 -1.302 1.00 34.12 H new ATOM 0 HD23 LEU A 16 -50.444 -7.554 -2.212 1.00 34.12 H new ATOM 228 N VAL A 17 -49.861 -10.252 -1.745 1.00 72.40 N ATOM 229 CA VAL A 17 -48.694 -10.460 -2.580 1.00 11.10 C ATOM 230 C VAL A 17 -48.636 -9.382 -3.662 1.00 43.52 C ATOM 231 O VAL A 17 -49.666 -9.002 -4.224 1.00 61.44 O ATOM 232 CB VAL A 17 -48.711 -11.882 -3.229 1.00 13.40 C ATOM 233 CG1 VAL A 17 -49.979 -12.103 -4.046 1.00 31.42 C ATOM 234 CG2 VAL A 17 -47.473 -12.115 -4.088 1.00 32.24 C ATOM 0 H VAL A 17 -50.683 -10.780 -2.037 1.00 72.40 H new ATOM 0 HA VAL A 17 -47.804 -10.390 -1.954 1.00 11.10 H new ATOM 0 HB VAL A 17 -48.700 -12.609 -2.417 1.00 13.40 H new ATOM 0 HG11 VAL A 17 -49.960 -13.101 -4.484 1.00 31.42 H new ATOM 0 HG12 VAL A 17 -50.850 -12.007 -3.398 1.00 31.42 H new ATOM 0 HG13 VAL A 17 -50.034 -11.359 -4.841 1.00 31.42 H new ATOM 0 HG21 VAL A 17 -47.516 -13.113 -4.525 1.00 32.24 H new ATOM 0 HG22 VAL A 17 -47.438 -11.372 -4.884 1.00 32.24 H new ATOM 0 HG23 VAL A 17 -46.580 -12.027 -3.470 1.00 32.24 H new ATOM 244 N VAL A 18 -47.449 -8.873 -3.934 1.00 34.22 N ATOM 245 CA VAL A 18 -47.291 -7.841 -4.942 1.00 2.02 C ATOM 246 C VAL A 18 -47.150 -8.476 -6.324 1.00 23.51 C ATOM 247 O VAL A 18 -46.594 -9.571 -6.462 1.00 61.42 O ATOM 248 CB VAL A 18 -46.070 -6.917 -4.642 1.00 20.51 C ATOM 249 CG1 VAL A 18 -44.757 -7.678 -4.732 1.00 51.24 C ATOM 250 CG2 VAL A 18 -46.060 -5.709 -5.568 1.00 22.21 C ATOM 0 H VAL A 18 -46.584 -9.155 -3.474 1.00 34.22 H new ATOM 0 HA VAL A 18 -48.185 -7.217 -4.921 1.00 2.02 H new ATOM 0 HB VAL A 18 -46.175 -6.561 -3.617 1.00 20.51 H new ATOM 0 HG11 VAL A 18 -43.929 -7.002 -4.517 1.00 51.24 H new ATOM 0 HG12 VAL A 18 -44.758 -8.492 -4.008 1.00 51.24 H new ATOM 0 HG13 VAL A 18 -44.641 -8.086 -5.736 1.00 51.24 H new ATOM 0 HG21 VAL A 18 -45.199 -5.081 -5.338 1.00 22.21 H new ATOM 0 HG22 VAL A 18 -45.998 -6.045 -6.603 1.00 22.21 H new ATOM 0 HG23 VAL A 18 -46.976 -5.135 -5.427 1.00 22.21 H new ATOM 260 N ALA A 19 -47.660 -7.795 -7.336 1.00 3.14 N ATOM 261 CA ALA A 19 -47.615 -8.290 -8.699 1.00 64.24 C ATOM 262 C ALA A 19 -47.909 -7.167 -9.671 1.00 23.44 C ATOM 263 O ALA A 19 -48.262 -6.058 -9.258 1.00 12.01 O ATOM 264 CB ALA A 19 -48.614 -9.430 -8.887 1.00 13.43 C ATOM 0 H ALA A 19 -48.115 -6.888 -7.236 1.00 3.14 H new ATOM 0 HA ALA A 19 -46.614 -8.673 -8.898 1.00 64.24 H new ATOM 0 HB1 ALA A 19 -48.567 -9.789 -9.915 1.00 13.43 H new ATOM 0 HB2 ALA A 19 -48.368 -10.245 -8.206 1.00 13.43 H new ATOM 0 HB3 ALA A 19 -49.621 -9.070 -8.674 1.00 13.43 H new ATOM 270 N ALA A 20 -47.773 -7.454 -10.950 1.00 75.53 N ATOM 271 CA ALA A 20 -48.002 -6.474 -11.992 1.00 25.42 C ATOM 272 C ALA A 20 -48.102 -7.167 -13.340 1.00 24.05 C ATOM 273 O ALA A 20 -48.250 -8.391 -13.405 1.00 3.42 O ATOM 274 CB ALA A 20 -46.875 -5.443 -12.002 1.00 55.41 C ATOM 0 H ALA A 20 -47.500 -8.374 -11.296 1.00 75.53 H new ATOM 0 HA ALA A 20 -48.941 -5.956 -11.794 1.00 25.42 H new ATOM 0 HB1 ALA A 20 -47.058 -4.712 -12.789 1.00 55.41 H new ATOM 0 HB2 ALA A 20 -46.837 -4.936 -11.038 1.00 55.41 H new ATOM 0 HB3 ALA A 20 -45.925 -5.944 -12.186 1.00 55.41 H new ATOM 280 N ALA A 21 -48.005 -6.398 -14.408 1.00 43.43 N ATOM 281 CA ALA A 21 -48.112 -6.928 -15.750 1.00 51.12 C ATOM 282 C ALA A 21 -47.556 -5.935 -16.743 1.00 35.11 C ATOM 283 O ALA A 21 -47.418 -4.750 -16.432 1.00 42.31 O ATOM 284 CB ALA A 21 -49.565 -7.237 -16.079 1.00 12.03 C ATOM 0 H ALA A 21 -47.850 -5.391 -14.368 1.00 43.43 H new ATOM 0 HA ALA A 21 -47.535 -7.851 -15.811 1.00 51.12 H new ATOM 0 HB1 ALA A 21 -49.632 -7.635 -17.091 1.00 12.03 H new ATOM 0 HB2 ALA A 21 -49.949 -7.974 -15.373 1.00 12.03 H new ATOM 0 HB3 ALA A 21 -50.156 -6.324 -16.008 1.00 12.03 H new ATOM 290 N ALA A 22 -47.238 -6.408 -17.930 1.00 14.13 N ATOM 291 CA ALA A 22 -46.675 -5.557 -18.955 1.00 61.14 C ATOM 292 C ALA A 22 -46.763 -6.223 -20.314 1.00 3.50 C ATOM 293 O ALA A 22 -46.894 -7.445 -20.414 1.00 12.34 O ATOM 294 CB ALA A 22 -45.224 -5.220 -18.631 1.00 54.13 C ATOM 0 H ALA A 22 -47.361 -7.381 -18.209 1.00 14.13 H new ATOM 0 HA ALA A 22 -47.253 -4.633 -18.983 1.00 61.14 H new ATOM 0 HB1 ALA A 22 -44.816 -4.579 -19.413 1.00 54.13 H new ATOM 0 HB2 ALA A 22 -45.176 -4.701 -17.674 1.00 54.13 H new ATOM 0 HB3 ALA A 22 -44.641 -6.139 -18.574 1.00 54.13 H new ATOM 300 N THR A 23 -46.683 -5.418 -21.346 1.00 33.00 N ATOM 301 CA THR A 23 -46.729 -5.884 -22.715 1.00 22.14 C ATOM 302 C THR A 23 -45.874 -4.976 -23.574 1.00 44.20 C ATOM 303 O THR A 23 -45.783 -3.775 -23.310 1.00 40.54 O ATOM 304 CB THR A 23 -48.177 -5.887 -23.269 1.00 51.33 C ATOM 305 OG1 THR A 23 -48.882 -4.722 -22.807 1.00 34.54 O ATOM 306 CG2 THR A 23 -48.929 -7.143 -22.846 1.00 14.23 C ATOM 0 H THR A 23 -46.583 -4.407 -21.260 1.00 33.00 H new ATOM 0 HA THR A 23 -46.353 -6.907 -22.739 1.00 22.14 H new ATOM 0 HB THR A 23 -48.120 -5.873 -24.357 1.00 51.33 H new ATOM 0 HG1 THR A 23 -49.795 -4.730 -23.162 1.00 34.54 H new ATOM 0 HG21 THR A 23 -49.941 -7.115 -23.250 1.00 14.23 H new ATOM 0 HG22 THR A 23 -48.411 -8.023 -23.227 1.00 14.23 H new ATOM 0 HG23 THR A 23 -48.974 -7.191 -21.758 1.00 14.23 H new ATOM 314 N SER A 24 -45.238 -5.540 -24.579 1.00 34.24 N ATOM 315 CA SER A 24 -44.377 -4.772 -25.454 1.00 2.10 C ATOM 316 C SER A 24 -44.039 -5.548 -26.719 1.00 0.34 C ATOM 317 O SER A 24 -43.733 -6.744 -26.666 1.00 14.23 O ATOM 318 CB SER A 24 -43.097 -4.357 -24.710 1.00 41.41 C ATOM 319 OG SER A 24 -42.589 -5.428 -23.915 1.00 53.32 O ATOM 0 H SER A 24 -45.301 -6.531 -24.811 1.00 34.24 H new ATOM 0 HA SER A 24 -44.914 -3.872 -25.754 1.00 2.10 H new ATOM 0 HB2 SER A 24 -42.340 -4.045 -25.430 1.00 41.41 H new ATOM 0 HB3 SER A 24 -43.306 -3.497 -24.074 1.00 41.41 H new ATOM 0 HG SER A 24 -41.774 -5.136 -23.455 1.00 53.32 H new ATOM 325 N ALA A 25 -44.100 -4.864 -27.846 1.00 53.24 N ATOM 326 CA ALA A 25 -43.802 -5.456 -29.136 1.00 34.42 C ATOM 327 C ALA A 25 -43.646 -4.364 -30.180 1.00 32.43 C ATOM 328 O ALA A 25 -44.614 -3.954 -30.825 1.00 14.45 O ATOM 329 CB ALA A 25 -44.888 -6.446 -29.547 1.00 54.52 C ATOM 0 H ALA A 25 -44.359 -3.878 -27.892 1.00 53.24 H new ATOM 0 HA ALA A 25 -42.865 -6.007 -29.059 1.00 34.42 H new ATOM 0 HB1 ALA A 25 -44.640 -6.876 -30.518 1.00 54.52 H new ATOM 0 HB2 ALA A 25 -44.955 -7.241 -28.805 1.00 54.52 H new ATOM 0 HB3 ALA A 25 -45.845 -5.929 -29.613 1.00 54.52 H new ATOM 335 N LYS A 26 -42.432 -3.878 -30.314 1.00 74.51 N ATOM 336 CA LYS A 26 -42.111 -2.809 -31.242 1.00 15.33 C ATOM 337 C LYS A 26 -40.616 -2.800 -31.504 1.00 13.21 C ATOM 338 O LYS A 26 -39.820 -3.001 -30.584 1.00 43.12 O ATOM 339 CB LYS A 26 -42.553 -1.453 -30.672 1.00 41.14 C ATOM 340 CG LYS A 26 -42.000 -1.165 -29.285 1.00 72.33 C ATOM 341 CD LYS A 26 -42.402 0.210 -28.793 1.00 62.35 C ATOM 342 CE LYS A 26 -41.854 0.472 -27.399 1.00 1.43 C ATOM 343 NZ LYS A 26 -40.384 0.290 -27.344 1.00 30.30 N ATOM 0 H LYS A 26 -41.631 -4.214 -29.779 1.00 74.51 H new ATOM 0 HA LYS A 26 -42.643 -2.979 -32.178 1.00 15.33 H new ATOM 0 HB2 LYS A 26 -42.236 -0.662 -31.352 1.00 41.14 H new ATOM 0 HB3 LYS A 26 -43.642 -1.422 -30.633 1.00 41.14 H new ATOM 0 HG2 LYS A 26 -42.360 -1.920 -28.586 1.00 72.33 H new ATOM 0 HG3 LYS A 26 -40.913 -1.241 -29.304 1.00 72.33 H new ATOM 0 HD2 LYS A 26 -42.032 0.969 -29.482 1.00 62.35 H new ATOM 0 HD3 LYS A 26 -43.489 0.293 -28.782 1.00 62.35 H new ATOM 0 HE2 LYS A 26 -42.107 1.487 -27.094 1.00 1.43 H new ATOM 0 HE3 LYS A 26 -42.331 -0.202 -26.688 1.00 1.43 H new ATOM 0 HZ1 LYS A 26 -40.014 0.714 -26.469 1.00 30.30 H new ATOM 0 HZ2 LYS A 26 -40.159 -0.725 -27.359 1.00 30.30 H new ATOM 0 HZ3 LYS A 26 -39.946 0.753 -28.166 1.00 30.30 H new ATOM 357 N VAL A 27 -40.232 -2.595 -32.742 1.00 42.24 N ATOM 358 CA VAL A 27 -38.827 -2.583 -33.092 1.00 60.12 C ATOM 359 C VAL A 27 -38.280 -1.162 -33.220 1.00 3.12 C ATOM 360 O VAL A 27 -38.794 -0.337 -33.994 1.00 21.41 O ATOM 361 CB VAL A 27 -38.532 -3.394 -34.379 1.00 34.31 C ATOM 362 CG1 VAL A 27 -38.875 -4.858 -34.166 1.00 51.54 C ATOM 363 CG2 VAL A 27 -39.296 -2.840 -35.568 1.00 64.02 C ATOM 0 H VAL A 27 -40.868 -2.435 -33.523 1.00 42.24 H new ATOM 0 HA VAL A 27 -38.309 -3.072 -32.267 1.00 60.12 H new ATOM 0 HB VAL A 27 -37.467 -3.306 -34.596 1.00 34.31 H new ATOM 0 HG11 VAL A 27 -38.663 -5.418 -35.077 1.00 51.54 H new ATOM 0 HG12 VAL A 27 -38.275 -5.257 -33.348 1.00 51.54 H new ATOM 0 HG13 VAL A 27 -39.933 -4.952 -33.920 1.00 51.54 H new ATOM 0 HG21 VAL A 27 -39.067 -3.431 -36.455 1.00 64.02 H new ATOM 0 HG22 VAL A 27 -40.366 -2.887 -35.367 1.00 64.02 H new ATOM 0 HG23 VAL A 27 -39.004 -1.804 -35.737 1.00 64.02 H new ATOM 799 N VAL A 60 11.503 10.917 -2.047 1.00 34.51 N ATOM 800 CA VAL A 60 10.059 10.943 -1.917 1.00 3.02 C ATOM 801 C VAL A 60 9.401 11.290 -3.247 1.00 3.13 C ATOM 802 O VAL A 60 10.083 11.578 -4.237 1.00 24.15 O ATOM 803 CB VAL A 60 9.600 11.948 -0.833 1.00 10.40 C ATOM 804 CG1 VAL A 60 10.181 11.569 0.518 1.00 54.24 C ATOM 805 CG2 VAL A 60 9.992 13.373 -1.209 1.00 0.12 C ATOM 0 HA VAL A 60 9.748 9.944 -1.612 1.00 3.02 H new ATOM 0 HB VAL A 60 8.513 11.907 -0.766 1.00 10.40 H new ATOM 0 HG11 VAL A 60 9.850 12.285 1.270 1.00 54.24 H new ATOM 0 HG12 VAL A 60 9.842 10.570 0.793 1.00 54.24 H new ATOM 0 HG13 VAL A 60 11.270 11.580 0.462 1.00 54.24 H new ATOM 0 HG21 VAL A 60 9.658 14.060 -0.431 1.00 0.12 H new ATOM 0 HG22 VAL A 60 11.075 13.438 -1.309 1.00 0.12 H new ATOM 0 HG23 VAL A 60 9.523 13.642 -2.156 1.00 0.12 H new ATOM 815 N LEU A 61 8.086 11.279 -3.265 1.00 75.41 N ATOM 816 CA LEU A 61 7.350 11.557 -4.477 1.00 1.24 C ATOM 817 C LEU A 61 7.115 13.052 -4.620 1.00 15.51 C ATOM 818 O LEU A 61 6.122 13.589 -4.137 1.00 14.13 O ATOM 819 CB LEU A 61 6.019 10.793 -4.476 1.00 60.32 C ATOM 820 CG LEU A 61 5.128 10.968 -5.711 1.00 51.43 C ATOM 821 CD1 LEU A 61 5.847 10.509 -6.966 1.00 45.33 C ATOM 822 CD2 LEU A 61 3.826 10.203 -5.536 1.00 50.04 C ATOM 0 H LEU A 61 7.504 11.080 -2.451 1.00 75.41 H new ATOM 0 HA LEU A 61 7.937 11.221 -5.331 1.00 1.24 H new ATOM 0 HB2 LEU A 61 6.235 9.731 -4.359 1.00 60.32 H new ATOM 0 HB3 LEU A 61 5.450 11.101 -3.599 1.00 60.32 H new ATOM 0 HG LEU A 61 4.899 12.028 -5.819 1.00 51.43 H new ATOM 0 HD11 LEU A 61 5.194 10.643 -7.829 1.00 45.33 H new ATOM 0 HD12 LEU A 61 6.754 11.098 -7.102 1.00 45.33 H new ATOM 0 HD13 LEU A 61 6.110 9.456 -6.870 1.00 45.33 H new ATOM 0 HD21 LEU A 61 3.204 10.337 -6.421 1.00 50.04 H new ATOM 0 HD22 LEU A 61 4.042 9.143 -5.401 1.00 50.04 H new ATOM 0 HD23 LEU A 61 3.297 10.580 -4.660 1.00 50.04 H new ATOM 834 N SER A 62 8.053 13.720 -5.252 1.00 0.02 N ATOM 835 CA SER A 62 7.950 15.142 -5.474 1.00 25.24 C ATOM 836 C SER A 62 8.112 15.468 -6.945 1.00 34.14 C ATOM 837 O SER A 62 9.186 15.867 -7.400 1.00 64.52 O ATOM 838 CB SER A 62 8.970 15.894 -4.621 1.00 24.41 C ATOM 839 OG SER A 62 10.266 15.334 -4.765 1.00 71.45 O ATOM 0 H SER A 62 8.903 13.296 -5.624 1.00 0.02 H new ATOM 0 HA SER A 62 6.956 15.469 -5.170 1.00 25.24 H new ATOM 0 HB2 SER A 62 8.989 16.944 -4.913 1.00 24.41 H new ATOM 0 HB3 SER A 62 8.669 15.859 -3.574 1.00 24.41 H new ATOM 0 HG SER A 62 10.486 15.259 -5.717 1.00 71.45 H new ATOM 845 N ALA A 63 7.055 15.242 -7.680 1.00 43.12 N ATOM 846 CA ALA A 63 7.020 15.503 -9.096 1.00 75.14 C ATOM 847 C ALA A 63 5.702 16.179 -9.440 1.00 54.45 C ATOM 848 O ALA A 63 4.746 16.073 -8.662 1.00 33.45 O ATOM 849 CB ALA A 63 7.173 14.192 -9.854 1.00 21.52 C ATOM 0 H ALA A 63 6.183 14.867 -7.308 1.00 43.12 H new ATOM 0 HA ALA A 63 7.839 16.163 -9.382 1.00 75.14 H new ATOM 0 HB1 ALA A 63 7.147 14.386 -10.926 1.00 21.52 H new ATOM 0 HB2 ALA A 63 8.125 13.729 -9.592 1.00 21.52 H new ATOM 0 HB3 ALA A 63 6.357 13.520 -9.587 1.00 21.52 H new ATOM 855 N PRO A 64 5.629 16.911 -10.578 1.00 63.02 N ATOM 856 CA PRO A 64 4.393 17.565 -11.022 1.00 62.14 C ATOM 857 C PRO A 64 3.191 16.620 -10.925 1.00 62.01 C ATOM 858 O PRO A 64 3.213 15.508 -11.461 1.00 51.24 O ATOM 859 CB PRO A 64 4.675 17.944 -12.491 1.00 41.14 C ATOM 860 CG PRO A 64 6.036 17.389 -12.807 1.00 4.35 C ATOM 861 CD PRO A 64 6.735 17.181 -11.496 1.00 51.13 C ATOM 0 HA PRO A 64 4.139 18.426 -10.404 1.00 62.14 H new ATOM 0 HB2 PRO A 64 3.919 17.525 -13.154 1.00 41.14 H new ATOM 0 HB3 PRO A 64 4.653 19.025 -12.626 1.00 41.14 H new ATOM 0 HG2 PRO A 64 5.953 16.450 -13.354 1.00 4.35 H new ATOM 0 HG3 PRO A 64 6.597 18.077 -13.439 1.00 4.35 H new ATOM 0 HD2 PRO A 64 7.437 16.348 -11.540 1.00 51.13 H new ATOM 0 HD3 PRO A 64 7.303 18.062 -11.197 1.00 51.13 H new ATOM 869 N LEU A 65 2.149 17.078 -10.257 1.00 51.22 N ATOM 870 CA LEU A 65 0.983 16.256 -9.987 1.00 62.24 C ATOM 871 C LEU A 65 0.222 15.953 -11.270 1.00 1.45 C ATOM 872 O LEU A 65 -0.442 16.822 -11.836 1.00 4.42 O ATOM 873 CB LEU A 65 0.068 16.963 -8.978 1.00 14.53 C ATOM 874 CG LEU A 65 -1.025 16.104 -8.343 1.00 14.20 C ATOM 875 CD1 LEU A 65 -0.412 15.022 -7.466 1.00 24.44 C ATOM 876 CD2 LEU A 65 -1.982 16.968 -7.536 1.00 22.12 C ATOM 0 H LEU A 65 2.086 18.027 -9.887 1.00 51.22 H new ATOM 0 HA LEU A 65 1.318 15.310 -9.562 1.00 62.24 H new ATOM 0 HB2 LEU A 65 0.688 17.373 -8.181 1.00 14.53 H new ATOM 0 HB3 LEU A 65 -0.407 17.807 -9.478 1.00 14.53 H new ATOM 0 HG LEU A 65 -1.589 15.621 -9.141 1.00 14.20 H new ATOM 0 HD11 LEU A 65 -1.205 14.420 -7.022 1.00 24.44 H new ATOM 0 HD12 LEU A 65 0.232 14.384 -8.072 1.00 24.44 H new ATOM 0 HD13 LEU A 65 0.177 15.485 -6.675 1.00 24.44 H new ATOM 0 HD21 LEU A 65 -2.753 16.339 -7.091 1.00 22.12 H new ATOM 0 HD22 LEU A 65 -1.432 17.480 -6.747 1.00 22.12 H new ATOM 0 HD23 LEU A 65 -2.447 17.705 -8.191 1.00 22.12 H new ATOM 888 N GLY A 66 0.346 14.721 -11.734 1.00 53.23 N ATOM 889 CA GLY A 66 -0.317 14.307 -12.952 1.00 65.12 C ATOM 890 C GLY A 66 0.674 13.908 -14.022 1.00 15.23 C ATOM 891 O GLY A 66 0.318 13.233 -14.992 1.00 45.35 O ATOM 0 H GLY A 66 0.900 13.993 -11.284 1.00 53.23 H new ATOM 0 HA2 GLY A 66 -0.979 13.468 -12.738 1.00 65.12 H new ATOM 0 HA3 GLY A 66 -0.942 15.120 -13.320 1.00 65.12 H new ATOM 895 N SER A 67 1.919 14.339 -13.847 1.00 31.01 N ATOM 896 CA SER A 67 2.992 14.031 -14.781 1.00 3.33 C ATOM 897 C SER A 67 3.229 12.527 -14.872 1.00 60.34 C ATOM 898 O SER A 67 2.942 11.778 -13.933 1.00 51.34 O ATOM 899 CB SER A 67 4.282 14.732 -14.347 1.00 12.03 C ATOM 900 OG SER A 67 5.349 14.462 -15.245 1.00 62.30 O ATOM 0 H SER A 67 2.211 14.911 -13.054 1.00 31.01 H new ATOM 0 HA SER A 67 2.695 14.391 -15.766 1.00 3.33 H new ATOM 0 HB2 SER A 67 4.113 15.807 -14.294 1.00 12.03 H new ATOM 0 HB3 SER A 67 4.557 14.403 -13.345 1.00 12.03 H new ATOM 0 HG SER A 67 6.157 14.925 -14.941 1.00 62.30 H new ATOM 906 N HIS A 68 3.766 12.088 -15.991 1.00 4.13 N ATOM 907 CA HIS A 68 4.083 10.691 -16.163 1.00 65.44 C ATOM 908 C HIS A 68 5.326 10.339 -15.361 1.00 11.31 C ATOM 909 O HIS A 68 5.500 9.204 -14.955 1.00 11.11 O ATOM 910 CB HIS A 68 4.252 10.328 -17.642 1.00 51.22 C ATOM 911 CG HIS A 68 2.976 10.430 -18.430 1.00 13.23 C ATOM 912 ND1 HIS A 68 1.864 9.651 -18.173 1.00 63.33 N ATOM 913 CD2 HIS A 68 2.631 11.237 -19.462 1.00 14.23 C ATOM 914 CE1 HIS A 68 0.900 9.974 -19.013 1.00 1.21 C ATOM 915 NE2 HIS A 68 1.337 10.932 -19.803 1.00 73.42 N ATOM 0 H HIS A 68 3.991 12.679 -16.792 1.00 4.13 H new ATOM 0 HA HIS A 68 3.247 10.101 -15.787 1.00 65.44 H new ATOM 0 HB2 HIS A 68 4.999 10.985 -18.087 1.00 51.22 H new ATOM 0 HB3 HIS A 68 4.637 9.311 -17.717 1.00 51.22 H new ATOM 0 HD1 HIS A 68 1.799 8.938 -17.447 1.00 63.33 H new ATOM 0 HD2 HIS A 68 3.258 11.982 -19.930 1.00 14.23 H new ATOM 0 HE1 HIS A 68 -0.083 9.528 -19.047 1.00 1.21 H new ATOM 924 N GLU A 69 6.171 11.343 -15.102 1.00 75.13 N ATOM 925 CA GLU A 69 7.367 11.152 -14.276 1.00 23.11 C ATOM 926 C GLU A 69 6.929 10.965 -12.823 1.00 73.00 C ATOM 927 O GLU A 69 7.588 10.297 -12.022 1.00 3.41 O ATOM 928 CB GLU A 69 8.300 12.361 -14.410 1.00 51.12 C ATOM 929 CG GLU A 69 9.633 12.206 -13.697 1.00 55.52 C ATOM 930 CD GLU A 69 10.556 13.379 -13.940 1.00 52.42 C ATOM 931 OE1 GLU A 69 11.237 13.400 -14.992 1.00 43.22 O ATOM 932 OE2 GLU A 69 10.603 14.292 -13.093 1.00 41.23 O ATOM 0 H GLU A 69 6.049 12.293 -15.452 1.00 75.13 H new ATOM 0 HA GLU A 69 7.914 10.269 -14.608 1.00 23.11 H new ATOM 0 HB2 GLU A 69 8.487 12.545 -15.468 1.00 51.12 H new ATOM 0 HB3 GLU A 69 7.792 13.242 -14.018 1.00 51.12 H new ATOM 0 HG2 GLU A 69 9.459 12.100 -12.626 1.00 55.52 H new ATOM 0 HG3 GLU A 69 10.118 11.290 -14.034 1.00 55.52 H new ATOM 939 N TRP A 70 5.781 11.536 -12.527 1.00 14.24 N ATOM 940 CA TRP A 70 5.163 11.405 -11.224 1.00 43.35 C ATOM 941 C TRP A 70 4.628 9.987 -11.090 1.00 53.32 C ATOM 942 O TRP A 70 4.805 9.333 -10.064 1.00 21.21 O ATOM 943 CB TRP A 70 4.028 12.434 -11.080 1.00 51.13 C ATOM 944 CG TRP A 70 3.285 12.366 -9.778 1.00 43.40 C ATOM 945 CD1 TRP A 70 3.633 12.962 -8.602 1.00 31.14 C ATOM 946 CD2 TRP A 70 2.056 11.673 -9.528 1.00 74.11 C ATOM 947 NE1 TRP A 70 2.703 12.675 -7.637 1.00 62.03 N ATOM 948 CE2 TRP A 70 1.725 11.884 -8.178 1.00 1.03 C ATOM 949 CE3 TRP A 70 1.206 10.890 -10.315 1.00 63.14 C ATOM 950 CZ2 TRP A 70 0.581 11.344 -7.597 1.00 21.55 C ATOM 951 CZ3 TRP A 70 0.072 10.355 -9.738 1.00 3.03 C ATOM 952 CH2 TRP A 70 -0.232 10.583 -8.391 1.00 13.32 C ATOM 0 H TRP A 70 5.248 12.106 -13.184 1.00 14.24 H new ATOM 0 HA TRP A 70 5.891 11.595 -10.435 1.00 43.35 H new ATOM 0 HB2 TRP A 70 4.446 13.434 -11.193 1.00 51.13 H new ATOM 0 HB3 TRP A 70 3.319 12.290 -11.896 1.00 51.13 H new ATOM 0 HD1 TRP A 70 4.512 13.571 -8.453 1.00 31.14 H new ATOM 0 HE1 TRP A 70 2.734 12.999 -6.670 1.00 62.03 H new ATOM 0 HE3 TRP A 70 1.433 10.707 -11.355 1.00 63.14 H new ATOM 0 HZ2 TRP A 70 0.344 11.519 -6.558 1.00 21.55 H new ATOM 0 HZ3 TRP A 70 -0.593 9.750 -10.337 1.00 3.03 H new ATOM 0 HH2 TRP A 70 -1.127 10.149 -7.970 1.00 13.32 H new ATOM 963 N GLN A 71 4.010 9.509 -12.156 1.00 62.44 N ATOM 964 CA GLN A 71 3.502 8.151 -12.213 1.00 51.14 C ATOM 965 C GLN A 71 4.644 7.127 -12.171 1.00 44.53 C ATOM 966 O GLN A 71 4.481 6.028 -11.649 1.00 73.41 O ATOM 967 CB GLN A 71 2.672 7.960 -13.471 1.00 53.53 C ATOM 968 CG GLN A 71 1.424 8.817 -13.498 1.00 5.51 C ATOM 969 CD GLN A 71 0.614 8.630 -14.754 1.00 13.01 C ATOM 970 OE1 GLN A 71 1.156 8.360 -15.830 1.00 61.21 O ATOM 971 NE2 GLN A 71 -0.685 8.763 -14.627 1.00 72.15 N ATOM 0 H GLN A 71 3.847 10.051 -13.005 1.00 62.44 H new ATOM 0 HA GLN A 71 2.873 7.987 -11.338 1.00 51.14 H new ATOM 0 HB2 GLN A 71 3.285 8.194 -14.342 1.00 53.53 H new ATOM 0 HB3 GLN A 71 2.387 6.911 -13.555 1.00 53.53 H new ATOM 0 HG2 GLN A 71 0.805 8.577 -12.633 1.00 5.51 H new ATOM 0 HG3 GLN A 71 1.707 9.866 -13.406 1.00 5.51 H new ATOM 0 HE21 GLN A 71 -1.088 8.987 -13.717 1.00 72.15 H new ATOM 0 HE22 GLN A 71 -1.292 8.643 -15.438 1.00 72.15 H new ATOM 980 N GLN A 72 5.800 7.508 -12.705 1.00 71.34 N ATOM 981 CA GLN A 72 6.965 6.621 -12.732 1.00 32.52 C ATOM 982 C GLN A 72 7.594 6.509 -11.355 1.00 53.03 C ATOM 983 O GLN A 72 8.026 5.434 -10.941 1.00 51.20 O ATOM 984 CB GLN A 72 8.008 7.104 -13.742 1.00 45.21 C ATOM 985 CG GLN A 72 7.559 7.020 -15.194 1.00 45.22 C ATOM 986 CD GLN A 72 7.342 5.595 -15.684 1.00 75.32 C ATOM 987 OE1 GLN A 72 6.980 4.702 -14.920 1.00 12.13 O ATOM 988 NE2 GLN A 72 7.566 5.379 -16.962 1.00 52.21 N ATOM 0 H GLN A 72 5.958 8.424 -13.125 1.00 71.34 H new ATOM 0 HA GLN A 72 6.616 5.636 -13.041 1.00 32.52 H new ATOM 0 HB2 GLN A 72 8.267 8.138 -13.513 1.00 45.21 H new ATOM 0 HB3 GLN A 72 8.916 6.513 -13.620 1.00 45.21 H new ATOM 0 HG2 GLN A 72 6.632 7.581 -15.312 1.00 45.22 H new ATOM 0 HG3 GLN A 72 8.306 7.502 -15.825 1.00 45.22 H new ATOM 0 HE21 GLN A 72 7.865 6.146 -17.564 1.00 52.21 H new ATOM 0 HE22 GLN A 72 7.440 4.445 -17.351 1.00 52.21 H new ATOM 997 N THR A 73 7.650 7.623 -10.649 1.00 22.42 N ATOM 998 CA THR A 73 8.201 7.643 -9.310 1.00 75.44 C ATOM 999 C THR A 73 7.256 6.912 -8.344 1.00 73.23 C ATOM 1000 O THR A 73 7.687 6.326 -7.347 1.00 42.12 O ATOM 1001 CB THR A 73 8.440 9.095 -8.834 1.00 71.10 C ATOM 1002 OG1 THR A 73 9.173 9.812 -9.843 1.00 72.52 O ATOM 1003 CG2 THR A 73 9.232 9.118 -7.531 1.00 54.13 C ATOM 0 H THR A 73 7.319 8.528 -10.983 1.00 22.42 H new ATOM 0 HA THR A 73 9.162 7.129 -9.324 1.00 75.44 H new ATOM 0 HB THR A 73 7.472 9.566 -8.663 1.00 71.10 H new ATOM 0 HG1 THR A 73 8.568 10.059 -10.573 1.00 72.52 H new ATOM 0 HG21 THR A 73 9.387 10.150 -7.217 1.00 54.13 H new ATOM 0 HG22 THR A 73 8.678 8.584 -6.759 1.00 54.13 H new ATOM 0 HG23 THR A 73 10.198 8.637 -7.684 1.00 54.13 H new ATOM 1011 N PHE A 74 5.972 6.929 -8.673 1.00 5.05 N ATOM 1012 CA PHE A 74 4.961 6.265 -7.870 1.00 54.22 C ATOM 1013 C PHE A 74 4.955 4.755 -8.144 1.00 62.31 C ATOM 1014 O PHE A 74 4.997 3.953 -7.227 1.00 40.11 O ATOM 1015 CB PHE A 74 3.578 6.869 -8.155 1.00 12.42 C ATOM 1016 CG PHE A 74 2.463 6.271 -7.340 1.00 54.13 C ATOM 1017 CD1 PHE A 74 2.352 6.546 -5.986 1.00 10.11 C ATOM 1018 CD2 PHE A 74 1.529 5.434 -7.929 1.00 73.23 C ATOM 1019 CE1 PHE A 74 1.328 5.998 -5.237 1.00 25.34 C ATOM 1020 CE2 PHE A 74 0.503 4.886 -7.184 1.00 43.11 C ATOM 1021 CZ PHE A 74 0.403 5.168 -5.837 1.00 53.41 C ATOM 0 H PHE A 74 5.606 7.401 -9.500 1.00 5.05 H new ATOM 0 HA PHE A 74 5.200 6.418 -6.818 1.00 54.22 H new ATOM 0 HB2 PHE A 74 3.616 7.942 -7.965 1.00 12.42 H new ATOM 0 HB3 PHE A 74 3.349 6.740 -9.213 1.00 12.42 H new ATOM 0 HD1 PHE A 74 3.073 7.195 -5.512 1.00 10.11 H new ATOM 0 HD2 PHE A 74 1.604 5.208 -8.982 1.00 73.23 H new ATOM 0 HE1 PHE A 74 1.252 6.219 -4.183 1.00 25.34 H new ATOM 0 HE2 PHE A 74 -0.220 4.237 -7.655 1.00 43.11 H new ATOM 0 HZ PHE A 74 -0.398 4.740 -5.253 1.00 53.41 H new ATOM 1031 N SER A 75 4.904 4.383 -9.411 1.00 35.52 N ATOM 1032 CA SER A 75 4.887 2.971 -9.800 1.00 63.31 C ATOM 1033 C SER A 75 6.065 2.180 -9.207 1.00 62.24 C ATOM 1034 O SER A 75 5.918 1.007 -8.861 1.00 35.10 O ATOM 1035 CB SER A 75 4.866 2.837 -11.322 1.00 70.33 C ATOM 1036 OG SER A 75 5.872 3.632 -11.917 1.00 14.45 O ATOM 0 H SER A 75 4.873 5.035 -10.194 1.00 35.52 H new ATOM 0 HA SER A 75 3.975 2.539 -9.388 1.00 63.31 H new ATOM 0 HB2 SER A 75 5.011 1.793 -11.600 1.00 70.33 H new ATOM 0 HB3 SER A 75 3.889 3.136 -11.703 1.00 70.33 H new ATOM 0 HG SER A 75 5.604 4.574 -11.889 1.00 14.45 H new ATOM 1042 N GLN A 76 7.218 2.828 -9.059 1.00 44.30 N ATOM 1043 CA GLN A 76 8.394 2.143 -8.540 1.00 54.20 C ATOM 1044 C GLN A 76 8.295 1.924 -7.021 1.00 4.12 C ATOM 1045 O GLN A 76 8.669 0.866 -6.521 1.00 15.43 O ATOM 1046 CB GLN A 76 9.699 2.876 -8.944 1.00 35.32 C ATOM 1047 CG GLN A 76 9.873 4.277 -8.373 1.00 74.31 C ATOM 1048 CD GLN A 76 10.520 4.280 -6.999 1.00 43.45 C ATOM 1049 OE1 GLN A 76 11.332 3.412 -6.678 1.00 0.23 O ATOM 1050 NE2 GLN A 76 10.155 5.246 -6.179 1.00 15.24 N ATOM 0 H GLN A 76 7.361 3.812 -9.288 1.00 44.30 H new ATOM 0 HA GLN A 76 8.431 1.154 -8.998 1.00 54.20 H new ATOM 0 HB2 GLN A 76 10.548 2.268 -8.631 1.00 35.32 H new ATOM 0 HB3 GLN A 76 9.737 2.939 -10.032 1.00 35.32 H new ATOM 0 HG2 GLN A 76 10.481 4.869 -9.057 1.00 74.31 H new ATOM 0 HG3 GLN A 76 8.899 4.762 -8.311 1.00 74.31 H new ATOM 0 HE21 GLN A 76 9.479 5.946 -6.484 1.00 15.24 H new ATOM 0 HE22 GLN A 76 10.549 5.293 -5.239 1.00 15.24 H new ATOM 1059 N GLN A 77 7.779 2.922 -6.296 1.00 62.42 N ATOM 1060 CA GLN A 77 7.614 2.801 -4.842 1.00 12.42 C ATOM 1061 C GLN A 77 6.617 1.690 -4.492 1.00 14.13 C ATOM 1062 O GLN A 77 6.628 1.159 -3.385 1.00 4.25 O ATOM 1063 CB GLN A 77 7.178 4.128 -4.203 1.00 14.03 C ATOM 1064 CG GLN A 77 5.753 4.528 -4.517 1.00 64.25 C ATOM 1065 CD GLN A 77 5.311 5.759 -3.772 1.00 0.01 C ATOM 1066 OE1 GLN A 77 5.467 6.878 -4.246 1.00 70.40 O ATOM 1067 NE2 GLN A 77 4.752 5.558 -2.596 1.00 74.31 N ATOM 0 H GLN A 77 7.471 3.813 -6.686 1.00 62.42 H new ATOM 0 HA GLN A 77 8.589 2.538 -4.432 1.00 12.42 H new ATOM 0 HB2 GLN A 77 7.293 4.053 -3.122 1.00 14.03 H new ATOM 0 HB3 GLN A 77 7.848 4.919 -4.540 1.00 14.03 H new ATOM 0 HG2 GLN A 77 5.659 4.705 -5.588 1.00 64.25 H new ATOM 0 HG3 GLN A 77 5.086 3.702 -4.270 1.00 64.25 H new ATOM 0 HE21 GLN A 77 4.642 4.609 -2.239 1.00 74.31 H new ATOM 0 HE22 GLN A 77 4.429 6.352 -2.042 1.00 74.31 H new ATOM 1076 N VAL A 78 5.764 1.340 -5.450 1.00 11.33 N ATOM 1077 CA VAL A 78 4.770 0.297 -5.246 1.00 22.40 C ATOM 1078 C VAL A 78 5.406 -1.079 -5.442 1.00 52.23 C ATOM 1079 O VAL A 78 4.900 -2.093 -4.961 1.00 10.44 O ATOM 1080 CB VAL A 78 3.562 0.465 -6.210 1.00 70.10 C ATOM 1081 CG1 VAL A 78 2.507 -0.608 -5.964 1.00 74.33 C ATOM 1082 CG2 VAL A 78 2.952 1.849 -6.058 1.00 21.42 C ATOM 0 H VAL A 78 5.743 1.766 -6.377 1.00 11.33 H new ATOM 0 HA VAL A 78 4.400 0.384 -4.225 1.00 22.40 H new ATOM 0 HB VAL A 78 3.928 0.351 -7.230 1.00 70.10 H new ATOM 0 HG11 VAL A 78 1.675 -0.465 -6.653 1.00 74.33 H new ATOM 0 HG12 VAL A 78 2.945 -1.593 -6.125 1.00 74.33 H new ATOM 0 HG13 VAL A 78 2.146 -0.535 -4.938 1.00 74.33 H new ATOM 0 HG21 VAL A 78 2.107 1.951 -6.739 1.00 21.42 H new ATOM 0 HG22 VAL A 78 2.609 1.985 -5.032 1.00 21.42 H new ATOM 0 HG23 VAL A 78 3.701 2.605 -6.293 1.00 21.42 H new ATOM 1092 N MET A 79 6.538 -1.105 -6.122 1.00 22.22 N ATOM 1093 CA MET A 79 7.255 -2.350 -6.343 1.00 11.40 C ATOM 1094 C MET A 79 7.848 -2.841 -5.030 1.00 72.22 C ATOM 1095 O MET A 79 8.050 -4.036 -4.834 1.00 34.32 O ATOM 1096 CB MET A 79 8.363 -2.167 -7.385 1.00 64.22 C ATOM 1097 CG MET A 79 7.883 -1.725 -8.771 1.00 44.33 C ATOM 1098 SD MET A 79 6.814 -2.937 -9.593 1.00 13.21 S ATOM 1099 CE MET A 79 5.189 -2.461 -8.995 1.00 35.34 C ATOM 0 H MET A 79 6.980 -0.282 -6.530 1.00 22.22 H new ATOM 0 HA MET A 79 6.552 -3.091 -6.723 1.00 11.40 H new ATOM 0 HB2 MET A 79 9.074 -1.430 -7.011 1.00 64.22 H new ATOM 0 HB3 MET A 79 8.903 -3.108 -7.487 1.00 64.22 H new ATOM 0 HG2 MET A 79 7.343 -0.783 -8.675 1.00 44.33 H new ATOM 0 HG3 MET A 79 8.751 -1.532 -9.402 1.00 44.33 H new ATOM 0 HE1 MET A 79 4.473 -2.502 -9.816 1.00 35.34 H new ATOM 0 HE2 MET A 79 4.877 -3.145 -8.206 1.00 35.34 H new ATOM 0 HE3 MET A 79 5.230 -1.446 -8.600 1.00 35.34 H new ATOM 1109 N LEU A 80 8.101 -1.901 -4.119 1.00 42.42 N ATOM 1110 CA LEU A 80 8.656 -2.215 -2.804 1.00 13.51 C ATOM 1111 C LEU A 80 7.748 -3.180 -2.047 1.00 2.20 C ATOM 1112 O LEU A 80 8.226 -4.025 -1.284 1.00 22.13 O ATOM 1113 CB LEU A 80 8.853 -0.935 -1.985 1.00 13.25 C ATOM 1114 CG LEU A 80 9.775 0.123 -2.600 1.00 4.55 C ATOM 1115 CD1 LEU A 80 9.825 1.362 -1.721 1.00 63.33 C ATOM 1116 CD2 LEU A 80 11.173 -0.439 -2.808 1.00 30.11 C ATOM 0 H LEU A 80 7.928 -0.907 -4.271 1.00 42.42 H new ATOM 0 HA LEU A 80 9.624 -2.693 -2.954 1.00 13.51 H new ATOM 0 HB2 LEU A 80 7.876 -0.482 -1.816 1.00 13.25 H new ATOM 0 HB3 LEU A 80 9.250 -1.210 -1.008 1.00 13.25 H new ATOM 0 HG LEU A 80 9.371 0.405 -3.572 1.00 4.55 H new ATOM 0 HD11 LEU A 80 10.485 2.103 -2.173 1.00 63.33 H new ATOM 0 HD12 LEU A 80 8.823 1.780 -1.624 1.00 63.33 H new ATOM 0 HD13 LEU A 80 10.203 1.093 -0.735 1.00 63.33 H new ATOM 0 HD21 LEU A 80 11.812 0.328 -3.246 1.00 30.11 H new ATOM 0 HD22 LEU A 80 11.586 -0.752 -1.849 1.00 30.11 H new ATOM 0 HD23 LEU A 80 11.124 -1.297 -3.479 1.00 30.11 H new ATOM 1128 N PHE A 81 6.439 -3.056 -2.280 1.00 15.50 N ATOM 1129 CA PHE A 81 5.443 -3.920 -1.649 1.00 42.32 C ATOM 1130 C PHE A 81 5.749 -5.387 -1.910 1.00 44.43 C ATOM 1131 O PHE A 81 5.930 -6.166 -0.986 1.00 1.21 O ATOM 1132 CB PHE A 81 4.034 -3.603 -2.174 1.00 74.33 C ATOM 1133 CG PHE A 81 3.451 -2.298 -1.697 1.00 21.34 C ATOM 1134 CD1 PHE A 81 3.933 -1.091 -2.165 1.00 53.11 C ATOM 1135 CD2 PHE A 81 2.407 -2.288 -0.788 1.00 10.40 C ATOM 1136 CE1 PHE A 81 3.387 0.101 -1.736 1.00 72.21 C ATOM 1137 CE2 PHE A 81 1.856 -1.101 -0.356 1.00 71.12 C ATOM 1138 CZ PHE A 81 2.346 0.095 -0.831 1.00 42.12 C ATOM 0 H PHE A 81 6.043 -2.357 -2.908 1.00 15.50 H new ATOM 0 HA PHE A 81 5.482 -3.730 -0.576 1.00 42.32 H new ATOM 0 HB2 PHE A 81 4.063 -3.593 -3.264 1.00 74.33 H new ATOM 0 HB3 PHE A 81 3.364 -4.411 -1.881 1.00 74.33 H new ATOM 0 HD1 PHE A 81 4.747 -1.080 -2.875 1.00 53.11 H new ATOM 0 HD2 PHE A 81 2.019 -3.223 -0.412 1.00 10.40 H new ATOM 0 HE1 PHE A 81 3.774 1.038 -2.108 1.00 72.21 H new ATOM 0 HE2 PHE A 81 1.042 -1.109 0.353 1.00 71.12 H new ATOM 0 HZ PHE A 81 1.916 1.027 -0.495 1.00 42.12 H new ATOM 1148 N THR A 82 5.822 -5.750 -3.176 1.00 61.51 N ATOM 1149 CA THR A 82 6.058 -7.130 -3.556 1.00 45.22 C ATOM 1150 C THR A 82 7.517 -7.554 -3.313 1.00 54.05 C ATOM 1151 O THR A 82 7.797 -8.733 -3.118 1.00 44.14 O ATOM 1152 CB THR A 82 5.654 -7.391 -5.032 1.00 33.20 C ATOM 1153 OG1 THR A 82 5.827 -8.772 -5.356 1.00 14.30 O ATOM 1154 CG2 THR A 82 6.473 -6.536 -5.993 1.00 15.43 C ATOM 0 H THR A 82 5.721 -5.107 -3.961 1.00 61.51 H new ATOM 0 HA THR A 82 5.424 -7.743 -2.915 1.00 45.22 H new ATOM 0 HB THR A 82 4.604 -7.119 -5.139 1.00 33.20 H new ATOM 0 HG1 THR A 82 5.568 -8.924 -6.289 1.00 14.30 H new ATOM 0 HG21 THR A 82 6.165 -6.744 -7.018 1.00 15.43 H new ATOM 0 HG22 THR A 82 6.309 -5.481 -5.771 1.00 15.43 H new ATOM 0 HG23 THR A 82 7.531 -6.771 -5.878 1.00 15.43 H new ATOM 1162 N ARG A 83 8.436 -6.594 -3.318 1.00 14.52 N ATOM 1163 CA ARG A 83 9.847 -6.900 -3.089 1.00 72.32 C ATOM 1164 C ARG A 83 10.110 -7.229 -1.629 1.00 1.15 C ATOM 1165 O ARG A 83 10.511 -8.341 -1.297 1.00 51.15 O ATOM 1166 CB ARG A 83 10.741 -5.741 -3.528 1.00 65.12 C ATOM 1167 CG ARG A 83 10.722 -5.483 -5.018 1.00 1.23 C ATOM 1168 CD ARG A 83 11.612 -4.315 -5.383 1.00 53.52 C ATOM 1169 NE ARG A 83 11.519 -3.988 -6.800 1.00 70.11 N ATOM 1170 CZ ARG A 83 11.936 -2.846 -7.337 1.00 64.44 C ATOM 1171 NH1 ARG A 83 12.509 -1.920 -6.575 1.00 14.55 N ATOM 1172 NH2 ARG A 83 11.781 -2.630 -8.640 1.00 3.21 N ATOM 0 H ARG A 83 8.234 -5.607 -3.476 1.00 14.52 H new ATOM 0 HA ARG A 83 10.088 -7.776 -3.692 1.00 72.32 H new ATOM 0 HB2 ARG A 83 10.427 -4.836 -3.008 1.00 65.12 H new ATOM 0 HB3 ARG A 83 11.765 -5.947 -3.218 1.00 65.12 H new ATOM 0 HG2 ARG A 83 11.053 -6.376 -5.548 1.00 1.23 H new ATOM 0 HG3 ARG A 83 9.701 -5.281 -5.342 1.00 1.23 H new ATOM 0 HD2 ARG A 83 11.332 -3.445 -4.790 1.00 53.52 H new ATOM 0 HD3 ARG A 83 12.646 -4.553 -5.132 1.00 53.52 H new ATOM 0 HE ARG A 83 11.106 -4.683 -7.422 1.00 70.11 H new ATOM 0 HH11 ARG A 83 12.630 -2.085 -5.576 1.00 14.55 H new ATOM 0 HH12 ARG A 83 12.828 -1.044 -6.990 1.00 14.55 H new ATOM 0 HH21 ARG A 83 11.342 -3.340 -9.226 1.00 3.21 H new ATOM 0 HH22 ARG A 83 12.101 -1.754 -9.053 1.00 3.21 H new ATOM 1186 N GLN A 84 9.867 -6.260 -0.757 1.00 61.14 N ATOM 1187 CA GLN A 84 10.126 -6.435 0.668 1.00 71.02 C ATOM 1188 C GLN A 84 9.010 -7.235 1.337 1.00 53.43 C ATOM 1189 O GLN A 84 9.126 -7.630 2.495 1.00 43.53 O ATOM 1190 CB GLN A 84 10.279 -5.076 1.367 1.00 54.35 C ATOM 1191 CG GLN A 84 11.245 -4.108 0.685 1.00 12.11 C ATOM 1192 CD GLN A 84 12.612 -4.712 0.419 1.00 55.22 C ATOM 1193 OE1 GLN A 84 12.858 -5.265 -0.650 1.00 54.24 O ATOM 1194 NE2 GLN A 84 13.504 -4.616 1.385 1.00 74.35 N ATOM 0 H GLN A 84 9.492 -5.346 -1.009 1.00 61.14 H new ATOM 0 HA GLN A 84 11.059 -6.990 0.765 1.00 71.02 H new ATOM 0 HB2 GLN A 84 9.299 -4.604 1.431 1.00 54.35 H new ATOM 0 HB3 GLN A 84 10.618 -5.245 2.389 1.00 54.35 H new ATOM 0 HG2 GLN A 84 10.811 -3.778 -0.259 1.00 12.11 H new ATOM 0 HG3 GLN A 84 11.362 -3.222 1.309 1.00 12.11 H new ATOM 0 HE21 GLN A 84 13.261 -4.149 2.259 1.00 74.35 H new ATOM 0 HE22 GLN A 84 14.437 -5.009 1.259 1.00 74.35 H new ATOM 1203 N GLY A 85 7.924 -7.455 0.609 1.00 34.24 N ATOM 1204 CA GLY A 85 6.802 -8.193 1.155 1.00 2.33 C ATOM 1205 C GLY A 85 5.950 -7.322 2.053 1.00 34.22 C ATOM 1206 O GLY A 85 5.055 -7.806 2.747 1.00 60.42 O ATOM 0 H GLY A 85 7.800 -7.135 -0.352 1.00 34.24 H new ATOM 0 HA2 GLY A 85 6.192 -8.585 0.341 1.00 2.33 H new ATOM 0 HA3 GLY A 85 7.169 -9.050 1.719 1.00 2.33 H new ATOM 1210 N GLN A 86 6.231 -6.033 2.031 1.00 2.32 N ATOM 1211 CA GLN A 86 5.532 -5.078 2.861 1.00 60.43 C ATOM 1212 C GLN A 86 4.225 -4.625 2.213 1.00 42.11 C ATOM 1213 O GLN A 86 4.225 -3.902 1.226 1.00 33.51 O ATOM 1214 CB GLN A 86 6.435 -3.869 3.169 1.00 54.00 C ATOM 1215 CG GLN A 86 6.927 -3.118 1.930 1.00 62.13 C ATOM 1216 CD GLN A 86 7.849 -1.962 2.264 1.00 34.24 C ATOM 1217 OE1 GLN A 86 8.615 -2.105 3.325 1.00 42.34 O flip ATOM 1218 NE2 GLN A 86 7.879 -0.953 1.563 1.00 23.22 N flip ATOM 0 H GLN A 86 6.950 -5.621 1.437 1.00 2.32 H new ATOM 0 HA GLN A 86 5.280 -5.573 3.799 1.00 60.43 H new ATOM 0 HB2 GLN A 86 5.888 -3.175 3.807 1.00 54.00 H new ATOM 0 HB3 GLN A 86 7.299 -4.211 3.739 1.00 54.00 H new ATOM 0 HG2 GLN A 86 7.450 -3.814 1.274 1.00 62.13 H new ATOM 0 HG3 GLN A 86 6.068 -2.741 1.375 1.00 62.13 H new ATOM 0 HE21 GLN A 86 7.270 -0.880 0.748 1.00 23.22 H new ATOM 0 HE22 GLN A 86 8.513 -0.189 1.796 1.00 23.22 H new ATOM 1227 N GLN A 87 3.115 -5.071 2.763 1.00 40.15 N ATOM 1228 CA GLN A 87 1.797 -4.661 2.278 1.00 44.02 C ATOM 1229 C GLN A 87 1.424 -3.273 2.827 1.00 24.54 C ATOM 1230 O GLN A 87 0.249 -2.965 3.033 1.00 12.21 O ATOM 1231 CB GLN A 87 0.740 -5.703 2.663 1.00 61.41 C ATOM 1232 CG GLN A 87 0.778 -6.118 4.122 1.00 12.30 C ATOM 1233 CD GLN A 87 -0.275 -7.150 4.458 1.00 51.21 C ATOM 1234 OE1 GLN A 87 -1.384 -6.812 4.863 1.00 1.21 O ATOM 1235 NE2 GLN A 87 0.061 -8.413 4.284 1.00 55.20 N ATOM 0 H GLN A 87 3.091 -5.720 3.549 1.00 40.15 H new ATOM 0 HA GLN A 87 1.833 -4.594 1.191 1.00 44.02 H new ATOM 0 HB2 GLN A 87 -0.248 -5.303 2.436 1.00 61.41 H new ATOM 0 HB3 GLN A 87 0.875 -6.588 2.041 1.00 61.41 H new ATOM 0 HG2 GLN A 87 1.764 -6.520 4.357 1.00 12.30 H new ATOM 0 HG3 GLN A 87 0.634 -5.239 4.750 1.00 12.30 H new ATOM 0 HE21 GLN A 87 0.993 -8.651 3.946 1.00 55.20 H new ATOM 0 HE22 GLN A 87 -0.611 -9.152 4.488 1.00 55.20 H new ATOM 1244 N SER A 88 2.433 -2.440 3.023 1.00 72.33 N ATOM 1245 CA SER A 88 2.257 -1.121 3.587 1.00 51.20 C ATOM 1246 C SER A 88 3.382 -0.209 3.120 1.00 52.02 C ATOM 1247 O SER A 88 4.461 -0.687 2.758 1.00 3.33 O ATOM 1248 CB SER A 88 2.234 -1.209 5.113 1.00 11.23 C ATOM 1249 OG SER A 88 3.371 -1.916 5.599 1.00 14.13 O ATOM 0 H SER A 88 3.401 -2.666 2.792 1.00 72.33 H new ATOM 0 HA SER A 88 1.308 -0.705 3.249 1.00 51.20 H new ATOM 0 HB2 SER A 88 2.215 -0.206 5.539 1.00 11.23 H new ATOM 0 HB3 SER A 88 1.323 -1.710 5.439 1.00 11.23 H new ATOM 0 HG SER A 88 3.336 -1.958 6.577 1.00 14.13 H new ATOM 1255 N ALA A 89 3.141 1.091 3.144 1.00 3.41 N ATOM 1256 CA ALA A 89 4.137 2.046 2.689 1.00 33.13 C ATOM 1257 C ALA A 89 3.850 3.447 3.186 1.00 45.21 C ATOM 1258 O ALA A 89 2.704 3.894 3.193 1.00 73.21 O ATOM 1259 CB ALA A 89 4.226 2.040 1.175 1.00 72.42 C ATOM 0 H ALA A 89 2.270 1.508 3.472 1.00 3.41 H new ATOM 0 HA ALA A 89 5.095 1.736 3.108 1.00 33.13 H new ATOM 0 HB1 ALA A 89 4.977 2.761 0.852 1.00 72.42 H new ATOM 0 HB2 ALA A 89 4.507 1.045 0.831 1.00 72.42 H new ATOM 0 HB3 ALA A 89 3.258 2.310 0.753 1.00 72.42 H new ATOM 1265 N GLN A 90 4.891 4.135 3.596 1.00 34.01 N ATOM 1266 CA GLN A 90 4.778 5.510 4.030 1.00 51.53 C ATOM 1267 C GLN A 90 5.198 6.428 2.900 1.00 61.34 C ATOM 1268 O GLN A 90 6.345 6.392 2.453 1.00 44.22 O ATOM 1269 CB GLN A 90 5.645 5.755 5.261 1.00 55.22 C ATOM 1270 CG GLN A 90 5.148 5.048 6.508 1.00 12.05 C ATOM 1271 CD GLN A 90 6.120 5.154 7.658 1.00 20.13 C ATOM 1272 OE1 GLN A 90 6.076 6.104 8.444 1.00 53.42 O ATOM 1273 NE2 GLN A 90 6.997 4.182 7.770 1.00 50.52 N ATOM 0 H GLN A 90 5.838 3.759 3.638 1.00 34.01 H new ATOM 0 HA GLN A 90 3.742 5.717 4.298 1.00 51.53 H new ATOM 0 HB2 GLN A 90 6.662 5.426 5.049 1.00 55.22 H new ATOM 0 HB3 GLN A 90 5.690 6.827 5.455 1.00 55.22 H new ATOM 0 HG2 GLN A 90 4.190 5.474 6.806 1.00 12.05 H new ATOM 0 HG3 GLN A 90 4.973 3.997 6.280 1.00 12.05 H new ATOM 0 HE21 GLN A 90 6.997 3.415 7.097 1.00 50.52 H new ATOM 0 HE22 GLN A 90 7.677 4.194 8.530 1.00 50.52 H new ATOM 1282 N LEU A 91 4.270 7.218 2.420 1.00 2.41 N ATOM 1283 CA LEU A 91 4.540 8.121 1.328 1.00 54.33 C ATOM 1284 C LEU A 91 4.566 9.565 1.803 1.00 13.51 C ATOM 1285 O LEU A 91 3.562 10.094 2.280 1.00 44.13 O ATOM 1286 CB LEU A 91 3.509 7.931 0.210 1.00 3.50 C ATOM 1287 CG LEU A 91 3.625 8.884 -0.983 1.00 12.04 C ATOM 1288 CD1 LEU A 91 5.029 8.853 -1.570 1.00 12.13 C ATOM 1289 CD2 LEU A 91 2.592 8.534 -2.045 1.00 62.22 C ATOM 0 H LEU A 91 3.313 7.254 2.772 1.00 2.41 H new ATOM 0 HA LEU A 91 5.527 7.887 0.930 1.00 54.33 H new ATOM 0 HB2 LEU A 91 3.588 6.908 -0.159 1.00 3.50 H new ATOM 0 HB3 LEU A 91 2.513 8.039 0.640 1.00 3.50 H new ATOM 0 HG LEU A 91 3.430 9.897 -0.630 1.00 12.04 H new ATOM 0 HD11 LEU A 91 5.085 9.538 -2.416 1.00 12.13 H new ATOM 0 HD12 LEU A 91 5.748 9.156 -0.809 1.00 12.13 H new ATOM 0 HD13 LEU A 91 5.261 7.842 -1.906 1.00 12.13 H new ATOM 0 HD21 LEU A 91 2.688 9.221 -2.886 1.00 62.22 H new ATOM 0 HD22 LEU A 91 2.756 7.513 -2.390 1.00 62.22 H new ATOM 0 HD23 LEU A 91 1.591 8.617 -1.621 1.00 62.22 H new ATOM 1301 N ARG A 92 5.727 10.173 1.705 1.00 75.13 N ATOM 1302 CA ARG A 92 5.897 11.566 2.066 1.00 70.35 C ATOM 1303 C ARG A 92 5.455 12.448 0.896 1.00 53.34 C ATOM 1304 O ARG A 92 5.818 12.188 -0.255 1.00 11.21 O ATOM 1305 CB ARG A 92 7.360 11.834 2.434 1.00 14.30 C ATOM 1306 CG ARG A 92 7.548 12.752 3.635 1.00 42.35 C ATOM 1307 CD ARG A 92 7.142 14.180 3.328 1.00 70.25 C ATOM 1308 NE ARG A 92 7.177 15.027 4.521 1.00 1.45 N ATOM 1309 CZ ARG A 92 7.635 16.278 4.540 1.00 72.24 C ATOM 1310 NH1 ARG A 92 8.151 16.815 3.443 1.00 2.24 N ATOM 1311 NH2 ARG A 92 7.591 16.985 5.663 1.00 24.52 N ATOM 0 H ARG A 92 6.578 9.719 1.374 1.00 75.13 H new ATOM 0 HA ARG A 92 5.281 11.802 2.934 1.00 70.35 H new ATOM 0 HB2 ARG A 92 7.851 10.883 2.639 1.00 14.30 H new ATOM 0 HB3 ARG A 92 7.864 12.274 1.573 1.00 14.30 H new ATOM 0 HG2 ARG A 92 6.958 12.379 4.472 1.00 42.35 H new ATOM 0 HG3 ARG A 92 8.592 12.731 3.947 1.00 42.35 H new ATOM 0 HD2 ARG A 92 7.809 14.592 2.571 1.00 70.25 H new ATOM 0 HD3 ARG A 92 6.137 14.189 2.906 1.00 70.25 H new ATOM 0 HE ARG A 92 6.828 14.634 5.395 1.00 1.45 H new ATOM 0 HH11 ARG A 92 8.198 16.270 2.582 1.00 2.24 H new ATOM 0 HH12 ARG A 92 8.501 17.773 3.460 1.00 2.24 H new ATOM 0 HH21 ARG A 92 7.206 16.570 6.512 1.00 24.52 H new ATOM 0 HH22 ARG A 92 7.942 17.943 5.677 1.00 24.52 H new ATOM 1325 N LEU A 93 4.695 13.500 1.198 1.00 54.44 N ATOM 1326 CA LEU A 93 4.110 14.361 0.173 1.00 54.30 C ATOM 1327 C LEU A 93 3.967 15.791 0.679 1.00 13.22 C ATOM 1328 O LEU A 93 4.204 16.074 1.855 1.00 20.42 O ATOM 1329 CB LEU A 93 2.721 13.849 -0.247 1.00 51.40 C ATOM 1330 CG LEU A 93 2.677 12.508 -0.976 1.00 51.11 C ATOM 1331 CD1 LEU A 93 1.240 12.081 -1.211 1.00 63.23 C ATOM 1332 CD2 LEU A 93 3.423 12.592 -2.299 1.00 34.45 C ATOM 0 H LEU A 93 4.469 13.777 2.153 1.00 54.44 H new ATOM 0 HA LEU A 93 4.782 14.342 -0.685 1.00 54.30 H new ATOM 0 HB2 LEU A 93 2.102 13.771 0.647 1.00 51.40 H new ATOM 0 HB3 LEU A 93 2.261 14.601 -0.889 1.00 51.40 H new ATOM 0 HG LEU A 93 3.166 11.762 -0.350 1.00 51.11 H new ATOM 0 HD11 LEU A 93 1.225 11.123 -1.732 1.00 63.23 H new ATOM 0 HD12 LEU A 93 0.729 11.981 -0.253 1.00 63.23 H new ATOM 0 HD13 LEU A 93 0.732 12.831 -1.817 1.00 63.23 H new ATOM 0 HD21 LEU A 93 3.380 11.626 -2.803 1.00 34.45 H new ATOM 0 HD22 LEU A 93 2.961 13.351 -2.930 1.00 34.45 H new ATOM 0 HD23 LEU A 93 4.464 12.858 -2.114 1.00 34.45 H new ATOM 1344 N HIS A 94 3.589 16.685 -0.221 1.00 41.12 N ATOM 1345 CA HIS A 94 3.304 18.070 0.127 1.00 1.00 C ATOM 1346 C HIS A 94 1.835 18.374 -0.192 1.00 63.33 C ATOM 1347 O HIS A 94 1.292 17.811 -1.145 1.00 61.32 O ATOM 1348 CB HIS A 94 4.255 19.052 -0.601 1.00 22.02 C ATOM 1349 CG HIS A 94 4.300 18.908 -2.095 1.00 44.13 C ATOM 1350 ND1 HIS A 94 5.332 18.286 -2.752 1.00 21.10 N ATOM 1351 CD2 HIS A 94 3.444 19.323 -3.060 1.00 51.01 C ATOM 1352 CE1 HIS A 94 5.116 18.320 -4.047 1.00 34.42 C ATOM 1353 NE2 HIS A 94 3.977 18.942 -4.263 1.00 33.33 N ATOM 0 H HIS A 94 3.471 16.473 -1.212 1.00 41.12 H new ATOM 0 HA HIS A 94 3.476 18.208 1.194 1.00 1.00 H new ATOM 0 HB2 HIS A 94 3.954 20.071 -0.359 1.00 22.02 H new ATOM 0 HB3 HIS A 94 5.263 18.916 -0.208 1.00 22.02 H new ATOM 0 HD2 HIS A 94 2.516 19.854 -2.909 1.00 51.01 H new ATOM 0 HE1 HIS A 94 5.764 17.907 -4.806 1.00 34.42 H new ATOM 0 HE2 HIS A 94 3.559 19.113 -5.178 1.00 33.33 H new ATOM 1362 N PRO A 95 1.149 19.266 0.578 1.00 42.31 N ATOM 1363 CA PRO A 95 1.726 20.038 1.711 1.00 4.54 C ATOM 1364 C PRO A 95 2.465 19.182 2.734 1.00 41.42 C ATOM 1365 O PRO A 95 1.980 18.126 3.157 1.00 61.13 O ATOM 1366 CB PRO A 95 0.502 20.684 2.357 1.00 54.21 C ATOM 1367 CG PRO A 95 -0.495 20.783 1.260 1.00 44.35 C ATOM 1368 CD PRO A 95 -0.281 19.578 0.394 1.00 44.40 C ATOM 0 HA PRO A 95 2.480 20.741 1.356 1.00 4.54 H new ATOM 0 HB2 PRO A 95 0.124 20.080 3.182 1.00 54.21 H new ATOM 0 HB3 PRO A 95 0.741 21.666 2.765 1.00 54.21 H new ATOM 0 HG2 PRO A 95 -1.510 20.803 1.657 1.00 44.35 H new ATOM 0 HG3 PRO A 95 -0.358 21.702 0.690 1.00 44.35 H new ATOM 0 HD2 PRO A 95 -0.915 18.746 0.701 1.00 44.40 H new ATOM 0 HD3 PRO A 95 -0.514 19.788 -0.650 1.00 44.40 H new ATOM 1376 N GLU A 96 3.630 19.667 3.145 1.00 42.31 N ATOM 1377 CA GLU A 96 4.498 18.947 4.061 1.00 35.43 C ATOM 1378 C GLU A 96 3.963 18.982 5.488 1.00 72.11 C ATOM 1379 O GLU A 96 4.391 18.198 6.335 1.00 53.00 O ATOM 1380 CB GLU A 96 5.903 19.529 4.010 1.00 1.04 C ATOM 1381 CG GLU A 96 6.533 19.485 2.630 1.00 72.13 C ATOM 1382 CD GLU A 96 7.921 20.074 2.611 1.00 52.32 C ATOM 1383 OE1 GLU A 96 8.888 19.340 2.917 1.00 44.15 O ATOM 1384 OE2 GLU A 96 8.054 21.274 2.302 1.00 0.31 O ATOM 0 H GLU A 96 3.998 20.572 2.851 1.00 42.31 H new ATOM 0 HA GLU A 96 4.527 17.904 3.746 1.00 35.43 H new ATOM 0 HB2 GLU A 96 5.871 20.563 4.352 1.00 1.04 H new ATOM 0 HB3 GLU A 96 6.538 18.983 4.707 1.00 1.04 H new ATOM 0 HG2 GLU A 96 6.575 18.452 2.286 1.00 72.13 H new ATOM 0 HG3 GLU A 96 5.901 20.029 1.928 1.00 72.13 H new ATOM 1391 N GLU A 97 3.050 19.916 5.756 1.00 44.13 N ATOM 1392 CA GLU A 97 2.395 19.995 7.062 1.00 15.04 C ATOM 1393 C GLU A 97 1.742 18.655 7.389 1.00 15.43 C ATOM 1394 O GLU A 97 1.846 18.155 8.511 1.00 24.32 O ATOM 1395 CB GLU A 97 1.381 21.135 7.090 1.00 24.21 C ATOM 1396 CG GLU A 97 0.447 21.162 5.899 1.00 3.45 C ATOM 1397 CD GLU A 97 -0.352 22.430 5.836 1.00 4.24 C ATOM 1398 OE1 GLU A 97 0.221 23.474 5.478 1.00 32.21 O ATOM 1399 OE2 GLU A 97 -1.556 22.398 6.153 1.00 22.30 O ATOM 0 H GLU A 97 2.748 20.626 5.089 1.00 44.13 H new ATOM 0 HA GLU A 97 3.142 20.209 7.826 1.00 15.04 H new ATOM 0 HB2 GLU A 97 0.788 21.057 8.001 1.00 24.21 H new ATOM 0 HB3 GLU A 97 1.917 22.083 7.139 1.00 24.21 H new ATOM 0 HG2 GLU A 97 1.026 21.053 4.982 1.00 3.45 H new ATOM 0 HG3 GLU A 97 -0.230 20.310 5.951 1.00 3.45 H new ATOM 1406 N LEU A 98 1.070 18.084 6.399 1.00 64.14 N ATOM 1407 CA LEU A 98 0.559 16.737 6.512 1.00 41.33 C ATOM 1408 C LEU A 98 1.756 15.815 6.372 1.00 63.24 C ATOM 1409 O LEU A 98 2.160 15.135 7.317 1.00 25.14 O ATOM 1410 CB LEU A 98 -0.463 16.455 5.401 1.00 33.14 C ATOM 1411 CG LEU A 98 -1.676 17.387 5.358 1.00 70.10 C ATOM 1412 CD1 LEU A 98 -2.510 17.114 4.120 1.00 4.40 C ATOM 1413 CD2 LEU A 98 -2.521 17.222 6.610 1.00 21.22 C ATOM 0 H LEU A 98 0.869 18.539 5.509 1.00 64.14 H new ATOM 0 HA LEU A 98 0.051 16.587 7.465 1.00 41.33 H new ATOM 0 HB2 LEU A 98 0.049 16.511 4.440 1.00 33.14 H new ATOM 0 HB3 LEU A 98 -0.819 15.431 5.513 1.00 33.14 H new ATOM 0 HG LEU A 98 -1.317 18.415 5.316 1.00 70.10 H new ATOM 0 HD11 LEU A 98 -3.369 17.785 4.105 1.00 4.40 H new ATOM 0 HD12 LEU A 98 -1.904 17.280 3.229 1.00 4.40 H new ATOM 0 HD13 LEU A 98 -2.857 16.081 4.136 1.00 4.40 H new ATOM 0 HD21 LEU A 98 -3.379 17.893 6.561 1.00 21.22 H new ATOM 0 HD22 LEU A 98 -2.870 16.192 6.680 1.00 21.22 H new ATOM 0 HD23 LEU A 98 -1.922 17.463 7.488 1.00 21.22 H new ATOM 1425 N GLY A 99 2.311 15.822 5.165 1.00 2.44 N ATOM 1426 CA GLY A 99 3.565 15.155 4.877 1.00 42.12 C ATOM 1427 C GLY A 99 3.497 13.645 4.786 1.00 43.31 C ATOM 1428 O GLY A 99 4.116 13.062 3.911 1.00 70.55 O ATOM 0 H GLY A 99 1.899 16.293 4.360 1.00 2.44 H new ATOM 0 HA2 GLY A 99 3.953 15.541 3.934 1.00 42.12 H new ATOM 0 HA3 GLY A 99 4.284 15.422 5.651 1.00 42.12 H new ATOM 1432 N GLN A 100 2.763 13.012 5.670 1.00 73.30 N ATOM 1433 CA GLN A 100 2.741 11.563 5.724 1.00 52.05 C ATOM 1434 C GLN A 100 1.439 10.971 5.198 1.00 24.20 C ATOM 1435 O GLN A 100 0.340 11.396 5.568 1.00 70.11 O ATOM 1436 CB GLN A 100 3.002 11.096 7.159 1.00 4.25 C ATOM 1437 CG GLN A 100 2.146 11.809 8.197 1.00 30.04 C ATOM 1438 CD GLN A 100 2.536 11.464 9.614 1.00 43.21 C ATOM 1439 OE1 GLN A 100 3.410 12.105 10.201 1.00 61.21 O ATOM 1440 NE2 GLN A 100 1.879 10.479 10.185 1.00 51.43 N ATOM 0 H GLN A 100 2.173 13.473 6.362 1.00 73.30 H new ATOM 0 HA GLN A 100 3.532 11.201 5.068 1.00 52.05 H new ATOM 0 HB2 GLN A 100 2.817 10.024 7.223 1.00 4.25 H new ATOM 0 HB3 GLN A 100 4.054 11.253 7.398 1.00 4.25 H new ATOM 0 HG2 GLN A 100 2.231 12.886 8.054 1.00 30.04 H new ATOM 0 HG3 GLN A 100 1.099 11.548 8.039 1.00 30.04 H new ATOM 0 HE21 GLN A 100 1.163 9.974 9.663 1.00 51.43 H new ATOM 0 HE22 GLN A 100 2.085 10.220 11.150 1.00 51.43 H new ATOM 1449 N VAL A 101 1.584 9.978 4.347 1.00 15.13 N ATOM 1450 CA VAL A 101 0.468 9.253 3.774 1.00 22.54 C ATOM 1451 C VAL A 101 0.732 7.759 3.904 1.00 51.25 C ATOM 1452 O VAL A 101 1.720 7.248 3.375 1.00 24.40 O ATOM 1453 CB VAL A 101 0.259 9.617 2.279 1.00 54.55 C ATOM 1454 CG1 VAL A 101 -0.703 8.648 1.611 1.00 63.21 C ATOM 1455 CG2 VAL A 101 -0.250 11.045 2.145 1.00 45.32 C ATOM 0 H VAL A 101 2.494 9.646 4.028 1.00 15.13 H new ATOM 0 HA VAL A 101 -0.438 9.529 4.314 1.00 22.54 H new ATOM 0 HB VAL A 101 1.223 9.540 1.775 1.00 54.55 H new ATOM 0 HG11 VAL A 101 -0.831 8.926 0.565 1.00 63.21 H new ATOM 0 HG12 VAL A 101 -0.301 7.637 1.671 1.00 63.21 H new ATOM 0 HG13 VAL A 101 -1.667 8.686 2.117 1.00 63.21 H new ATOM 0 HG21 VAL A 101 -0.391 11.284 1.091 1.00 45.32 H new ATOM 0 HG22 VAL A 101 -1.200 11.143 2.670 1.00 45.32 H new ATOM 0 HG23 VAL A 101 0.476 11.732 2.579 1.00 45.32 H new ATOM 1465 N HIS A 102 -0.120 7.066 4.632 1.00 3.13 N ATOM 1466 CA HIS A 102 0.057 5.640 4.842 1.00 43.20 C ATOM 1467 C HIS A 102 -0.728 4.832 3.832 1.00 62.21 C ATOM 1468 O HIS A 102 -1.959 4.870 3.806 1.00 64.10 O ATOM 1469 CB HIS A 102 -0.342 5.245 6.267 1.00 52.03 C ATOM 1470 CG HIS A 102 0.643 5.682 7.304 1.00 32.35 C ATOM 1471 ND1 HIS A 102 0.560 6.884 7.968 1.00 72.21 N ATOM 1472 CD2 HIS A 102 1.746 5.067 7.786 1.00 63.22 C ATOM 1473 CE1 HIS A 102 1.569 6.990 8.811 1.00 74.23 C ATOM 1474 NE2 HIS A 102 2.303 5.900 8.721 1.00 24.14 N ATOM 0 H HIS A 102 -0.941 7.464 5.088 1.00 3.13 H new ATOM 0 HA HIS A 102 1.115 5.417 4.703 1.00 43.20 H new ATOM 0 HB2 HIS A 102 -1.316 5.678 6.497 1.00 52.03 H new ATOM 0 HB3 HIS A 102 -0.455 4.162 6.318 1.00 52.03 H new ATOM 0 HD2 HIS A 102 2.119 4.098 7.489 1.00 63.22 H new ATOM 0 HE1 HIS A 102 1.761 7.828 9.464 1.00 74.23 H new ATOM 0 HE2 HIS A 102 3.148 5.707 9.259 1.00 24.14 H new ATOM 1483 N ILE A 103 -0.012 4.116 2.995 1.00 22.11 N ATOM 1484 CA ILE A 103 -0.621 3.273 1.994 1.00 35.35 C ATOM 1485 C ILE A 103 -0.939 1.887 2.578 1.00 40.30 C ATOM 1486 O ILE A 103 -0.390 1.482 3.609 1.00 1.04 O ATOM 1487 CB ILE A 103 0.313 3.140 0.747 1.00 35.15 C ATOM 1488 CG1 ILE A 103 0.818 4.527 0.317 1.00 41.31 C ATOM 1489 CG2 ILE A 103 -0.412 2.466 -0.421 1.00 73.14 C ATOM 1490 CD1 ILE A 103 1.767 4.499 -0.865 1.00 20.22 C ATOM 0 H ILE A 103 1.008 4.102 2.990 1.00 22.11 H new ATOM 0 HA ILE A 103 -1.555 3.736 1.677 1.00 35.35 H new ATOM 0 HB ILE A 103 1.161 2.515 1.027 1.00 35.15 H new ATOM 0 HG12 ILE A 103 -0.039 5.153 0.067 1.00 41.31 H new ATOM 0 HG13 ILE A 103 1.321 4.997 1.162 1.00 41.31 H new ATOM 0 HG21 ILE A 103 0.264 2.388 -1.273 1.00 73.14 H new ATOM 0 HG22 ILE A 103 -0.735 1.469 -0.122 1.00 73.14 H new ATOM 0 HG23 ILE A 103 -1.282 3.060 -0.701 1.00 73.14 H new ATOM 0 HD11 ILE A 103 2.078 5.516 -1.106 1.00 20.22 H new ATOM 0 HD12 ILE A 103 2.643 3.902 -0.614 1.00 20.22 H new ATOM 0 HD13 ILE A 103 1.263 4.060 -1.726 1.00 20.22 H new ATOM 1502 N SER A 104 -1.810 1.184 1.893 1.00 52.04 N ATOM 1503 CA SER A 104 -2.333 -0.072 2.366 1.00 0.05 C ATOM 1504 C SER A 104 -2.531 -1.036 1.206 1.00 64.24 C ATOM 1505 O SER A 104 -2.872 -0.626 0.097 1.00 42.13 O ATOM 1506 CB SER A 104 -3.644 0.157 3.126 1.00 61.33 C ATOM 1507 OG SER A 104 -4.198 -1.064 3.597 1.00 32.00 O ATOM 0 H SER A 104 -2.177 1.471 0.986 1.00 52.04 H new ATOM 0 HA SER A 104 -1.615 -0.519 3.053 1.00 0.05 H new ATOM 0 HB2 SER A 104 -3.464 0.824 3.969 1.00 61.33 H new ATOM 0 HB3 SER A 104 -4.361 0.654 2.473 1.00 61.33 H new ATOM 0 HG SER A 104 -5.032 -0.881 4.078 1.00 32.00 H new ATOM 1513 N LEU A 105 -2.317 -2.306 1.459 1.00 41.33 N ATOM 1514 CA LEU A 105 -2.477 -3.311 0.436 1.00 54.30 C ATOM 1515 C LEU A 105 -3.117 -4.558 1.024 1.00 62.45 C ATOM 1516 O LEU A 105 -3.020 -4.812 2.225 1.00 41.15 O ATOM 1517 CB LEU A 105 -1.117 -3.656 -0.191 1.00 65.20 C ATOM 1518 CG LEU A 105 -1.153 -4.598 -1.400 1.00 32.11 C ATOM 1519 CD1 LEU A 105 -1.842 -3.929 -2.580 1.00 71.32 C ATOM 1520 CD2 LEU A 105 0.252 -5.041 -1.778 1.00 74.22 C ATOM 0 H LEU A 105 -2.031 -2.668 2.369 1.00 41.33 H new ATOM 0 HA LEU A 105 -3.128 -2.916 -0.344 1.00 54.30 H new ATOM 0 HB2 LEU A 105 -0.633 -2.727 -0.493 1.00 65.20 H new ATOM 0 HB3 LEU A 105 -0.489 -4.107 0.577 1.00 65.20 H new ATOM 0 HG LEU A 105 -1.727 -5.483 -1.127 1.00 32.11 H new ATOM 0 HD11 LEU A 105 -1.857 -4.613 -3.428 1.00 71.32 H new ATOM 0 HD12 LEU A 105 -2.864 -3.669 -2.305 1.00 71.32 H new ATOM 0 HD13 LEU A 105 -1.299 -3.025 -2.854 1.00 71.32 H new ATOM 0 HD21 LEU A 105 0.204 -5.709 -2.638 1.00 74.22 H new ATOM 0 HD22 LEU A 105 0.853 -4.168 -2.030 1.00 74.22 H new ATOM 0 HD23 LEU A 105 0.707 -5.565 -0.937 1.00 74.22 H new ATOM 1532 N LYS A 106 -3.774 -5.313 0.180 1.00 24.51 N ATOM 1533 CA LYS A 106 -4.400 -6.549 0.582 1.00 63.53 C ATOM 1534 C LYS A 106 -4.197 -7.584 -0.504 1.00 62.55 C ATOM 1535 O LYS A 106 -4.358 -7.286 -1.683 1.00 1.22 O ATOM 1536 CB LYS A 106 -5.895 -6.344 0.860 1.00 22.31 C ATOM 1537 CG LYS A 106 -6.608 -7.603 1.331 1.00 22.11 C ATOM 1538 CD LYS A 106 -8.059 -7.330 1.683 1.00 70.11 C ATOM 1539 CE LYS A 106 -8.767 -8.595 2.150 1.00 53.12 C ATOM 1540 NZ LYS A 106 -8.197 -9.130 3.419 1.00 2.14 N ATOM 0 H LYS A 106 -3.891 -5.088 -0.808 1.00 24.51 H new ATOM 0 HA LYS A 106 -3.939 -6.897 1.506 1.00 63.53 H new ATOM 0 HB2 LYS A 106 -6.012 -5.567 1.615 1.00 22.31 H new ATOM 0 HB3 LYS A 106 -6.378 -5.982 -0.048 1.00 22.31 H new ATOM 0 HG2 LYS A 106 -6.560 -8.362 0.550 1.00 22.11 H new ATOM 0 HG3 LYS A 106 -6.093 -8.009 2.202 1.00 22.11 H new ATOM 0 HD2 LYS A 106 -8.108 -6.574 2.466 1.00 70.11 H new ATOM 0 HD3 LYS A 106 -8.575 -6.923 0.814 1.00 70.11 H new ATOM 0 HE2 LYS A 106 -9.827 -8.384 2.292 1.00 53.12 H new ATOM 0 HE3 LYS A 106 -8.695 -9.356 1.373 1.00 53.12 H new ATOM 0 HZ1 LYS A 106 -8.821 -9.873 3.794 1.00 2.14 H new ATOM 0 HZ2 LYS A 106 -7.255 -9.530 3.235 1.00 2.14 H new ATOM 0 HZ3 LYS A 106 -8.117 -8.361 4.115 1.00 2.14 H new ATOM 1554 N LEU A 107 -3.851 -8.789 -0.113 1.00 35.42 N ATOM 1555 CA LEU A 107 -3.599 -9.843 -1.068 1.00 73.52 C ATOM 1556 C LEU A 107 -4.556 -10.992 -0.827 1.00 53.55 C ATOM 1557 O LEU A 107 -4.380 -11.788 0.103 1.00 54.12 O ATOM 1558 CB LEU A 107 -2.145 -10.320 -0.983 1.00 71.23 C ATOM 1559 CG LEU A 107 -1.733 -11.394 -1.993 1.00 53.31 C ATOM 1560 CD1 LEU A 107 -1.917 -10.897 -3.421 1.00 22.43 C ATOM 1561 CD2 LEU A 107 -0.293 -11.818 -1.758 1.00 12.22 C ATOM 0 H LEU A 107 -3.737 -9.064 0.863 1.00 35.42 H new ATOM 0 HA LEU A 107 -3.762 -9.453 -2.073 1.00 73.52 H new ATOM 0 HB2 LEU A 107 -1.492 -9.457 -1.113 1.00 71.23 H new ATOM 0 HB3 LEU A 107 -1.968 -10.706 0.021 1.00 71.23 H new ATOM 0 HG LEU A 107 -2.379 -12.261 -1.851 1.00 53.31 H new ATOM 0 HD11 LEU A 107 -1.617 -11.678 -4.120 1.00 22.43 H new ATOM 0 HD12 LEU A 107 -2.964 -10.645 -3.586 1.00 22.43 H new ATOM 0 HD13 LEU A 107 -1.301 -10.012 -3.580 1.00 22.43 H new ATOM 0 HD21 LEU A 107 -0.016 -12.582 -2.484 1.00 12.22 H new ATOM 0 HD22 LEU A 107 0.363 -10.955 -1.870 1.00 12.22 H new ATOM 0 HD23 LEU A 107 -0.192 -12.222 -0.750 1.00 12.22 H new ATOM 1573 N ASP A 108 -5.574 -11.063 -1.644 1.00 64.44 N ATOM 1574 CA ASP A 108 -6.586 -12.086 -1.515 1.00 72.24 C ATOM 1575 C ASP A 108 -6.452 -13.074 -2.655 1.00 31.44 C ATOM 1576 O ASP A 108 -6.731 -12.735 -3.793 1.00 70.12 O ATOM 1577 CB ASP A 108 -7.981 -11.454 -1.505 1.00 23.42 C ATOM 1578 CG ASP A 108 -9.067 -12.440 -1.137 1.00 2.42 C ATOM 1579 OD1 ASP A 108 -9.105 -12.878 0.030 1.00 55.05 O ATOM 1580 OD2 ASP A 108 -9.891 -12.783 -2.005 1.00 23.42 O ATOM 0 H ASP A 108 -5.728 -10.416 -2.417 1.00 64.44 H new ATOM 0 HA ASP A 108 -6.448 -12.615 -0.572 1.00 72.24 H new ATOM 0 HB2 ASP A 108 -7.994 -10.625 -0.798 1.00 23.42 H new ATOM 0 HB3 ASP A 108 -8.193 -11.037 -2.489 1.00 23.42 H new ATOM 1585 N ASP A 109 -6.036 -14.299 -2.332 1.00 2.21 N ATOM 1586 CA ASP A 109 -5.777 -15.366 -3.328 1.00 72.52 C ATOM 1587 C ASP A 109 -4.840 -14.933 -4.467 1.00 12.01 C ATOM 1588 O ASP A 109 -3.647 -15.233 -4.448 1.00 62.52 O ATOM 1589 CB ASP A 109 -7.082 -15.935 -3.891 1.00 71.45 C ATOM 1590 CG ASP A 109 -7.802 -16.819 -2.898 1.00 54.41 C ATOM 1591 OD1 ASP A 109 -7.405 -17.995 -2.747 1.00 71.12 O ATOM 1592 OD2 ASP A 109 -8.765 -16.345 -2.255 1.00 71.53 O ATOM 0 H ASP A 109 -5.865 -14.591 -1.370 1.00 2.21 H new ATOM 0 HA ASP A 109 -5.256 -16.152 -2.782 1.00 72.52 H new ATOM 0 HB2 ASP A 109 -7.737 -15.114 -4.184 1.00 71.45 H new ATOM 0 HB3 ASP A 109 -6.866 -16.508 -4.793 1.00 71.45 H new ATOM 1597 N ASN A 110 -5.384 -14.225 -5.444 1.00 60.24 N ATOM 1598 CA ASN A 110 -4.618 -13.776 -6.605 1.00 22.21 C ATOM 1599 C ASN A 110 -5.099 -12.405 -7.058 1.00 3.22 C ATOM 1600 O ASN A 110 -4.993 -12.043 -8.234 1.00 22.44 O ATOM 1601 CB ASN A 110 -4.726 -14.794 -7.757 1.00 54.14 C ATOM 1602 CG ASN A 110 -6.146 -14.977 -8.271 1.00 31.31 C ATOM 1603 OD1 ASN A 110 -6.578 -14.301 -9.209 1.00 72.30 O ATOM 1604 ND2 ASN A 110 -6.872 -15.897 -7.672 1.00 42.43 N ATOM 0 H ASN A 110 -6.364 -13.944 -5.459 1.00 60.24 H new ATOM 0 HA ASN A 110 -3.570 -13.699 -6.316 1.00 22.21 H new ATOM 0 HB2 ASN A 110 -4.089 -14.469 -8.580 1.00 54.14 H new ATOM 0 HB3 ASN A 110 -4.343 -15.757 -7.418 1.00 54.14 H new ATOM 0 HD21 ASN A 110 -7.829 -16.072 -7.980 1.00 42.43 H new ATOM 0 HD22 ASN A 110 -6.478 -16.435 -6.900 1.00 42.43 H new ATOM 1611 N GLN A 111 -5.563 -11.623 -6.103 1.00 14.54 N ATOM 1612 CA GLN A 111 -6.049 -10.290 -6.373 1.00 12.01 C ATOM 1613 C GLN A 111 -5.592 -9.352 -5.268 1.00 43.33 C ATOM 1614 O GLN A 111 -5.707 -9.663 -4.078 1.00 31.33 O ATOM 1615 CB GLN A 111 -7.584 -10.250 -6.547 1.00 52.21 C ATOM 1616 CG GLN A 111 -8.387 -10.603 -5.304 1.00 52.03 C ATOM 1617 CD GLN A 111 -9.884 -10.485 -5.528 1.00 31.44 C ATOM 1618 OE1 GLN A 111 -10.477 -9.424 -5.315 1.00 24.34 O ATOM 1619 NE2 GLN A 111 -10.502 -11.564 -5.959 1.00 53.13 N ATOM 0 H GLN A 111 -5.612 -11.896 -5.121 1.00 14.54 H new ATOM 0 HA GLN A 111 -5.627 -9.959 -7.322 1.00 12.01 H new ATOM 0 HB2 GLN A 111 -7.871 -9.250 -6.873 1.00 52.21 H new ATOM 0 HB3 GLN A 111 -7.861 -10.938 -7.346 1.00 52.21 H new ATOM 0 HG2 GLN A 111 -8.148 -11.621 -4.997 1.00 52.03 H new ATOM 0 HG3 GLN A 111 -8.092 -9.946 -4.486 1.00 52.03 H new ATOM 0 HE21 GLN A 111 -9.975 -12.422 -6.123 1.00 53.13 H new ATOM 0 HE22 GLN A 111 -11.507 -11.542 -6.129 1.00 53.13 H new ATOM 1628 N ALA A 112 -5.050 -8.234 -5.663 1.00 23.33 N ATOM 1629 CA ALA A 112 -4.531 -7.268 -4.726 1.00 65.12 C ATOM 1630 C ALA A 112 -5.411 -6.041 -4.679 1.00 15.25 C ATOM 1631 O ALA A 112 -5.567 -5.349 -5.681 1.00 12.23 O ATOM 1632 CB ALA A 112 -3.114 -6.881 -5.115 1.00 34.14 C ATOM 0 H ALA A 112 -4.954 -7.964 -6.642 1.00 23.33 H new ATOM 0 HA ALA A 112 -4.520 -7.719 -3.734 1.00 65.12 H new ATOM 0 HB1 ALA A 112 -2.728 -6.151 -4.403 1.00 34.14 H new ATOM 0 HB2 ALA A 112 -2.479 -7.767 -5.106 1.00 34.14 H new ATOM 0 HB3 ALA A 112 -3.117 -6.447 -6.115 1.00 34.14 H new ATOM 1638 N GLN A 113 -6.004 -5.778 -3.533 1.00 24.31 N ATOM 1639 CA GLN A 113 -6.824 -4.601 -3.359 1.00 32.23 C ATOM 1640 C GLN A 113 -5.972 -3.443 -2.877 1.00 24.14 C ATOM 1641 O GLN A 113 -5.229 -3.563 -1.897 1.00 53.42 O ATOM 1642 CB GLN A 113 -7.949 -4.899 -2.358 1.00 23.41 C ATOM 1643 CG GLN A 113 -8.561 -3.667 -1.700 1.00 32.34 C ATOM 1644 CD GLN A 113 -9.687 -4.019 -0.751 1.00 41.24 C ATOM 1645 OE1 GLN A 113 -9.721 -5.114 -0.190 1.00 32.12 O ATOM 1646 NE2 GLN A 113 -10.604 -3.091 -0.547 1.00 60.32 N ATOM 0 H GLN A 113 -5.932 -6.369 -2.704 1.00 24.31 H new ATOM 0 HA GLN A 113 -7.270 -4.325 -4.315 1.00 32.23 H new ATOM 0 HB2 GLN A 113 -8.737 -5.449 -2.872 1.00 23.41 H new ATOM 0 HB3 GLN A 113 -7.559 -5.554 -1.579 1.00 23.41 H new ATOM 0 HG2 GLN A 113 -7.786 -3.126 -1.156 1.00 32.34 H new ATOM 0 HG3 GLN A 113 -8.936 -2.995 -2.472 1.00 32.34 H new ATOM 0 HE21 GLN A 113 -10.540 -2.196 -1.032 1.00 60.32 H new ATOM 0 HE22 GLN A 113 -11.376 -3.269 0.095 1.00 60.32 H new ATOM 1655 N LEU A 114 -6.076 -2.332 -3.575 1.00 25.51 N ATOM 1656 CA LEU A 114 -5.295 -1.160 -3.261 1.00 3.21 C ATOM 1657 C LEU A 114 -6.095 -0.224 -2.362 1.00 21.55 C ATOM 1658 O LEU A 114 -7.087 0.380 -2.788 1.00 74.25 O ATOM 1659 CB LEU A 114 -4.868 -0.451 -4.565 1.00 32.43 C ATOM 1660 CG LEU A 114 -3.673 0.525 -4.480 1.00 55.45 C ATOM 1661 CD1 LEU A 114 -4.026 1.781 -3.704 1.00 13.53 C ATOM 1662 CD2 LEU A 114 -2.458 -0.159 -3.863 1.00 64.31 C ATOM 0 H LEU A 114 -6.702 -2.218 -4.372 1.00 25.51 H new ATOM 0 HA LEU A 114 -4.395 -1.457 -2.723 1.00 3.21 H new ATOM 0 HB2 LEU A 114 -4.627 -1.217 -5.302 1.00 32.43 H new ATOM 0 HB3 LEU A 114 -5.727 0.100 -4.947 1.00 32.43 H new ATOM 0 HG LEU A 114 -3.426 0.824 -5.499 1.00 55.45 H new ATOM 0 HD11 LEU A 114 -3.160 2.441 -3.667 1.00 13.53 H new ATOM 0 HD12 LEU A 114 -4.852 2.293 -4.197 1.00 13.53 H new ATOM 0 HD13 LEU A 114 -4.320 1.511 -2.690 1.00 13.53 H new ATOM 0 HD21 LEU A 114 -1.629 0.547 -3.813 1.00 64.31 H new ATOM 0 HD22 LEU A 114 -2.704 -0.501 -2.858 1.00 64.31 H new ATOM 0 HD23 LEU A 114 -2.171 -1.013 -4.476 1.00 64.31 H new ATOM 1674 N GLN A 115 -5.681 -0.141 -1.116 1.00 30.21 N ATOM 1675 CA GLN A 115 -6.314 0.733 -0.153 1.00 21.31 C ATOM 1676 C GLN A 115 -5.422 1.940 0.099 1.00 54.21 C ATOM 1677 O GLN A 115 -4.200 1.844 0.000 1.00 51.45 O ATOM 1678 CB GLN A 115 -6.572 -0.014 1.152 1.00 31.33 C ATOM 1679 CG GLN A 115 -7.485 -1.219 1.008 1.00 31.12 C ATOM 1680 CD GLN A 115 -7.627 -2.002 2.300 1.00 1.21 C ATOM 1681 OE1 GLN A 115 -7.518 -1.318 3.423 1.00 32.45 O flip ATOM 1682 NE2 GLN A 115 -7.823 -3.213 2.286 1.00 31.24 N flip ATOM 0 H GLN A 115 -4.897 -0.677 -0.743 1.00 30.21 H new ATOM 0 HA GLN A 115 -7.271 1.070 -0.551 1.00 21.31 H new ATOM 0 HB2 GLN A 115 -5.618 -0.342 1.565 1.00 31.33 H new ATOM 0 HB3 GLN A 115 -7.011 0.676 1.872 1.00 31.33 H new ATOM 0 HG2 GLN A 115 -8.470 -0.887 0.679 1.00 31.12 H new ATOM 0 HG3 GLN A 115 -7.094 -1.876 0.231 1.00 31.12 H new ATOM 0 HE21 GLN A 115 -7.902 -3.707 1.397 1.00 31.24 H new ATOM 0 HE22 GLN A 115 -7.907 -3.726 3.163 1.00 31.24 H new ATOM 1691 N MET A 116 -6.016 3.062 0.432 1.00 52.12 N ATOM 1692 CA MET A 116 -5.248 4.274 0.664 1.00 2.42 C ATOM 1693 C MET A 116 -5.818 5.088 1.800 1.00 3.31 C ATOM 1694 O MET A 116 -7.039 5.214 1.941 1.00 73.31 O ATOM 1695 CB MET A 116 -5.150 5.135 -0.603 1.00 15.54 C ATOM 1696 CG MET A 116 -4.133 4.628 -1.613 1.00 73.53 C ATOM 1697 SD MET A 116 -3.999 5.679 -3.072 1.00 14.43 S ATOM 1698 CE MET A 116 -5.642 5.519 -3.762 1.00 22.21 C ATOM 0 H MET A 116 -7.024 3.166 0.549 1.00 52.12 H new ATOM 0 HA MET A 116 -4.243 3.956 0.941 1.00 2.42 H new ATOM 0 HB2 MET A 116 -6.130 5.178 -1.078 1.00 15.54 H new ATOM 0 HB3 MET A 116 -4.889 6.154 -0.319 1.00 15.54 H new ATOM 0 HG2 MET A 116 -3.157 4.558 -1.133 1.00 73.53 H new ATOM 0 HG3 MET A 116 -4.409 3.620 -1.923 1.00 73.53 H new ATOM 0 HE1 MET A 116 -5.572 5.395 -4.843 1.00 22.21 H new ATOM 0 HE2 MET A 116 -6.136 4.650 -3.328 1.00 22.21 H new ATOM 0 HE3 MET A 116 -6.220 6.415 -3.536 1.00 22.21 H new ATOM 1708 N VAL A 117 -4.932 5.631 2.606 1.00 61.23 N ATOM 1709 CA VAL A 117 -5.304 6.506 3.693 1.00 40.15 C ATOM 1710 C VAL A 117 -4.743 7.880 3.389 1.00 10.15 C ATOM 1711 O VAL A 117 -3.539 8.115 3.517 1.00 22.44 O ATOM 1712 CB VAL A 117 -4.761 6.010 5.058 1.00 52.21 C ATOM 1713 CG1 VAL A 117 -5.232 6.919 6.186 1.00 54.10 C ATOM 1714 CG2 VAL A 117 -5.190 4.571 5.318 1.00 54.41 C ATOM 0 H VAL A 117 -3.927 5.476 2.524 1.00 61.23 H new ATOM 0 HA VAL A 117 -6.391 6.527 3.774 1.00 40.15 H new ATOM 0 HB VAL A 117 -3.672 6.042 5.022 1.00 52.21 H new ATOM 0 HG11 VAL A 117 -4.840 6.554 7.135 1.00 54.10 H new ATOM 0 HG12 VAL A 117 -4.872 7.933 6.011 1.00 54.10 H new ATOM 0 HG13 VAL A 117 -6.321 6.922 6.220 1.00 54.10 H new ATOM 0 HG21 VAL A 117 -4.798 4.243 6.281 1.00 54.41 H new ATOM 0 HG22 VAL A 117 -6.278 4.512 5.330 1.00 54.41 H new ATOM 0 HG23 VAL A 117 -4.801 3.927 4.529 1.00 54.41 H new ATOM 1724 N SER A 118 -5.603 8.776 2.964 1.00 32.22 N ATOM 1725 CA SER A 118 -5.182 10.091 2.524 1.00 11.54 C ATOM 1726 C SER A 118 -6.338 11.075 2.618 1.00 30.50 C ATOM 1727 O SER A 118 -7.506 10.677 2.573 1.00 52.31 O ATOM 1728 CB SER A 118 -4.700 10.018 1.063 1.00 53.13 C ATOM 1729 OG SER A 118 -3.709 9.022 0.897 1.00 3.21 O ATOM 0 H SER A 118 -6.609 8.618 2.913 1.00 32.22 H new ATOM 0 HA SER A 118 -4.369 10.430 3.166 1.00 11.54 H new ATOM 0 HB2 SER A 118 -5.546 9.805 0.409 1.00 53.13 H new ATOM 0 HB3 SER A 118 -4.300 10.986 0.761 1.00 53.13 H new ATOM 0 HG SER A 118 -3.423 8.998 -0.040 1.00 3.21 H new ATOM 1735 N PRO A 119 -6.031 12.374 2.767 1.00 34.25 N ATOM 1736 CA PRO A 119 -7.047 13.422 2.816 1.00 31.21 C ATOM 1737 C PRO A 119 -7.827 13.513 1.502 1.00 2.24 C ATOM 1738 O PRO A 119 -7.476 12.870 0.510 1.00 25.51 O ATOM 1739 CB PRO A 119 -6.234 14.707 3.044 1.00 70.44 C ATOM 1740 CG PRO A 119 -4.858 14.372 2.595 1.00 13.45 C ATOM 1741 CD PRO A 119 -4.671 12.919 2.907 1.00 4.33 C ATOM 0 HA PRO A 119 -7.791 13.237 3.590 1.00 31.21 H new ATOM 0 HB2 PRO A 119 -6.644 15.541 2.474 1.00 70.44 H new ATOM 0 HB3 PRO A 119 -6.247 15.002 4.093 1.00 70.44 H new ATOM 0 HG2 PRO A 119 -4.737 14.562 1.528 1.00 13.45 H new ATOM 0 HG3 PRO A 119 -4.118 14.982 3.113 1.00 13.45 H new ATOM 0 HD2 PRO A 119 -3.973 12.444 2.217 1.00 4.33 H new ATOM 0 HD3 PRO A 119 -4.277 12.769 3.912 1.00 4.33 H new ATOM 1749 N HIS A 120 -8.852 14.329 1.484 1.00 44.21 N ATOM 1750 CA HIS A 120 -9.677 14.462 0.297 1.00 2.01 C ATOM 1751 C HIS A 120 -9.489 15.831 -0.329 1.00 41.41 C ATOM 1752 O HIS A 120 -9.865 16.848 0.249 1.00 73.30 O ATOM 1753 CB HIS A 120 -11.163 14.168 0.598 1.00 22.32 C ATOM 1754 CG HIS A 120 -11.697 14.824 1.839 1.00 51.25 C ATOM 1755 ND1 HIS A 120 -11.634 14.235 3.083 1.00 31.02 N ATOM 1756 CD2 HIS A 120 -12.313 16.017 2.024 1.00 43.03 C ATOM 1757 CE1 HIS A 120 -12.186 15.032 3.974 1.00 52.54 C ATOM 1758 NE2 HIS A 120 -12.605 16.118 3.356 1.00 54.31 N ATOM 0 H HIS A 120 -9.138 14.911 2.271 1.00 44.21 H new ATOM 0 HA HIS A 120 -9.352 13.714 -0.426 1.00 2.01 H new ATOM 0 HB2 HIS A 120 -11.762 14.491 -0.253 1.00 22.32 H new ATOM 0 HB3 HIS A 120 -11.294 13.090 0.689 1.00 22.32 H new ATOM 0 HD1 HIS A 120 -11.223 13.323 3.283 1.00 31.02 H new ATOM 0 HD2 HIS A 120 -12.532 16.750 1.262 1.00 43.03 H new ATOM 0 HE1 HIS A 120 -12.279 14.830 5.031 1.00 52.54 H new ATOM 1767 N SER A 121 -8.895 15.845 -1.507 1.00 24.00 N ATOM 1768 CA SER A 121 -8.598 17.075 -2.212 1.00 64.20 C ATOM 1769 C SER A 121 -8.186 16.741 -3.652 1.00 10.02 C ATOM 1770 O SER A 121 -8.402 15.618 -4.114 1.00 55.52 O ATOM 1771 CB SER A 121 -7.466 17.829 -1.481 1.00 53.12 C ATOM 1772 OG SER A 121 -7.283 19.136 -1.998 1.00 31.23 O ATOM 0 H SER A 121 -8.605 15.002 -2.002 1.00 24.00 H new ATOM 0 HA SER A 121 -9.480 17.715 -2.236 1.00 64.20 H new ATOM 0 HB2 SER A 121 -7.697 17.888 -0.417 1.00 53.12 H new ATOM 0 HB3 SER A 121 -6.536 17.268 -1.575 1.00 53.12 H new ATOM 0 HG SER A 121 -6.560 19.583 -1.510 1.00 31.23 H new ATOM 1778 N HIS A 122 -7.581 17.704 -4.344 1.00 1.12 N ATOM 1779 CA HIS A 122 -7.139 17.516 -5.737 1.00 54.33 C ATOM 1780 C HIS A 122 -6.102 16.389 -5.848 1.00 10.10 C ATOM 1781 O HIS A 122 -5.908 15.820 -6.919 1.00 74.02 O ATOM 1782 CB HIS A 122 -6.566 18.828 -6.293 1.00 75.20 C ATOM 1783 CG HIS A 122 -6.154 18.762 -7.738 1.00 43.20 C ATOM 1784 ND1 HIS A 122 -4.875 19.033 -8.171 1.00 34.43 N ATOM 1785 CD2 HIS A 122 -6.864 18.455 -8.850 1.00 35.25 C ATOM 1786 CE1 HIS A 122 -4.817 18.892 -9.480 1.00 22.44 C ATOM 1787 NE2 HIS A 122 -6.008 18.542 -9.917 1.00 74.22 N ATOM 0 H HIS A 122 -7.382 18.630 -3.966 1.00 1.12 H new ATOM 0 HA HIS A 122 -8.007 17.228 -6.330 1.00 54.33 H new ATOM 0 HB2 HIS A 122 -7.311 19.615 -6.176 1.00 75.20 H new ATOM 0 HB3 HIS A 122 -5.702 19.116 -5.694 1.00 75.20 H new ATOM 0 HD2 HIS A 122 -7.910 18.191 -8.889 1.00 35.25 H new ATOM 0 HE1 HIS A 122 -3.939 19.039 -10.092 1.00 22.44 H new ATOM 0 HE2 HIS A 122 -6.254 18.364 -10.891 1.00 74.22 H new ATOM 1796 N VAL A 123 -5.458 16.060 -4.733 1.00 21.12 N ATOM 1797 CA VAL A 123 -4.474 14.979 -4.704 1.00 44.21 C ATOM 1798 C VAL A 123 -5.147 13.627 -4.948 1.00 72.32 C ATOM 1799 O VAL A 123 -4.511 12.671 -5.366 1.00 43.42 O ATOM 1800 CB VAL A 123 -3.703 14.935 -3.362 1.00 12.32 C ATOM 1801 CG1 VAL A 123 -2.863 16.192 -3.189 1.00 32.32 C ATOM 1802 CG2 VAL A 123 -4.663 14.767 -2.187 1.00 34.03 C ATOM 0 H VAL A 123 -5.599 16.525 -3.836 1.00 21.12 H new ATOM 0 HA VAL A 123 -3.760 15.180 -5.502 1.00 44.21 H new ATOM 0 HB VAL A 123 -3.037 14.072 -3.381 1.00 12.32 H new ATOM 0 HG11 VAL A 123 -2.328 16.144 -2.241 1.00 32.32 H new ATOM 0 HG12 VAL A 123 -2.146 16.266 -4.007 1.00 32.32 H new ATOM 0 HG13 VAL A 123 -3.512 17.067 -3.196 1.00 32.32 H new ATOM 0 HG21 VAL A 123 -4.097 14.739 -1.256 1.00 34.03 H new ATOM 0 HG22 VAL A 123 -5.359 15.605 -2.163 1.00 34.03 H new ATOM 0 HG23 VAL A 123 -5.219 13.837 -2.302 1.00 34.03 H new ATOM 1812 N ARG A 124 -6.451 13.586 -4.726 1.00 4.33 N ATOM 1813 CA ARG A 124 -7.215 12.365 -4.915 1.00 61.41 C ATOM 1814 C ARG A 124 -7.421 12.133 -6.403 1.00 73.43 C ATOM 1815 O ARG A 124 -7.353 11.008 -6.886 1.00 1.33 O ATOM 1816 CB ARG A 124 -8.568 12.442 -4.199 1.00 13.42 C ATOM 1817 CG ARG A 124 -9.353 11.136 -4.234 1.00 0.55 C ATOM 1818 CD ARG A 124 -10.726 11.290 -3.602 1.00 12.41 C ATOM 1819 NE ARG A 124 -11.600 12.169 -4.385 1.00 71.32 N ATOM 1820 CZ ARG A 124 -12.861 12.469 -4.053 1.00 74.13 C ATOM 1821 NH1 ARG A 124 -13.400 11.965 -2.945 1.00 51.04 N ATOM 1822 NH2 ARG A 124 -13.579 13.268 -4.834 1.00 10.53 N ATOM 0 H ARG A 124 -7.002 14.386 -4.414 1.00 4.33 H new ATOM 0 HA ARG A 124 -6.659 11.532 -4.484 1.00 61.41 H new ATOM 0 HB2 ARG A 124 -8.404 12.730 -3.161 1.00 13.42 H new ATOM 0 HB3 ARG A 124 -9.168 13.229 -4.657 1.00 13.42 H new ATOM 0 HG2 ARG A 124 -9.463 10.805 -5.267 1.00 0.55 H new ATOM 0 HG3 ARG A 124 -8.795 10.361 -3.708 1.00 0.55 H new ATOM 0 HD2 ARG A 124 -11.192 10.309 -3.506 1.00 12.41 H new ATOM 0 HD3 ARG A 124 -10.618 11.692 -2.595 1.00 12.41 H new ATOM 0 HE ARG A 124 -11.222 12.579 -5.239 1.00 71.32 H new ATOM 0 HH11 ARG A 124 -12.851 11.348 -2.346 1.00 51.04 H new ATOM 0 HH12 ARG A 124 -14.362 12.196 -2.695 1.00 51.04 H new ATOM 0 HH21 ARG A 124 -13.169 13.652 -5.685 1.00 10.53 H new ATOM 0 HH22 ARG A 124 -14.540 13.498 -4.582 1.00 10.53 H new ATOM 1836 N ALA A 125 -7.629 13.233 -7.120 1.00 4.32 N ATOM 1837 CA ALA A 125 -7.847 13.208 -8.562 1.00 4.12 C ATOM 1838 C ALA A 125 -6.662 12.586 -9.287 1.00 72.40 C ATOM 1839 O ALA A 125 -6.828 11.904 -10.302 1.00 31.14 O ATOM 1840 CB ALA A 125 -8.078 14.624 -9.066 1.00 72.20 C ATOM 0 H ALA A 125 -7.651 14.169 -6.716 1.00 4.32 H new ATOM 0 HA ALA A 125 -8.726 12.597 -8.767 1.00 4.12 H new ATOM 0 HB1 ALA A 125 -8.241 14.605 -10.144 1.00 72.20 H new ATOM 0 HB2 ALA A 125 -8.954 15.047 -8.574 1.00 72.20 H new ATOM 0 HB3 ALA A 125 -7.205 15.237 -8.842 1.00 72.20 H new ATOM 1846 N ALA A 126 -5.474 12.811 -8.760 1.00 41.15 N ATOM 1847 CA ALA A 126 -4.270 12.285 -9.366 1.00 12.14 C ATOM 1848 C ALA A 126 -4.159 10.784 -9.152 1.00 13.34 C ATOM 1849 O ALA A 126 -3.746 10.053 -10.049 1.00 35.43 O ATOM 1850 CB ALA A 126 -3.051 12.999 -8.824 1.00 74.01 C ATOM 0 H ALA A 126 -5.318 13.356 -7.912 1.00 41.15 H new ATOM 0 HA ALA A 126 -4.324 12.463 -10.440 1.00 12.14 H new ATOM 0 HB1 ALA A 126 -2.154 12.592 -9.290 1.00 74.01 H new ATOM 0 HB2 ALA A 126 -3.124 14.064 -9.046 1.00 74.01 H new ATOM 0 HB3 ALA A 126 -2.996 12.857 -7.745 1.00 74.01 H new ATOM 1856 N LEU A 127 -4.540 10.324 -7.966 1.00 32.31 N ATOM 1857 CA LEU A 127 -4.512 8.897 -7.668 1.00 11.31 C ATOM 1858 C LEU A 127 -5.549 8.159 -8.499 1.00 62.21 C ATOM 1859 O LEU A 127 -5.306 7.048 -8.967 1.00 11.02 O ATOM 1860 CB LEU A 127 -4.727 8.631 -6.169 1.00 61.03 C ATOM 1861 CG LEU A 127 -3.467 8.670 -5.279 1.00 3.31 C ATOM 1862 CD1 LEU A 127 -2.451 7.633 -5.732 1.00 62.03 C ATOM 1863 CD2 LEU A 127 -2.843 10.057 -5.268 1.00 73.10 C ATOM 0 H LEU A 127 -4.869 10.913 -7.201 1.00 32.31 H new ATOM 0 HA LEU A 127 -3.523 8.521 -7.931 1.00 11.31 H new ATOM 0 HB2 LEU A 127 -5.436 9.366 -5.790 1.00 61.03 H new ATOM 0 HB3 LEU A 127 -5.193 7.652 -6.059 1.00 61.03 H new ATOM 0 HG LEU A 127 -3.774 8.430 -4.261 1.00 3.31 H new ATOM 0 HD11 LEU A 127 -1.572 7.680 -5.089 1.00 62.03 H new ATOM 0 HD12 LEU A 127 -2.893 6.639 -5.670 1.00 62.03 H new ATOM 0 HD13 LEU A 127 -2.159 7.836 -6.762 1.00 62.03 H new ATOM 0 HD21 LEU A 127 -1.957 10.053 -4.632 1.00 73.10 H new ATOM 0 HD22 LEU A 127 -2.560 10.337 -6.283 1.00 73.10 H new ATOM 0 HD23 LEU A 127 -3.564 10.777 -4.881 1.00 73.10 H new ATOM 1875 N GLU A 128 -6.703 8.793 -8.697 1.00 64.25 N ATOM 1876 CA GLU A 128 -7.755 8.221 -9.527 1.00 1.32 C ATOM 1877 C GLU A 128 -7.261 8.076 -10.964 1.00 4.12 C ATOM 1878 O GLU A 128 -7.503 7.063 -11.623 1.00 62.24 O ATOM 1879 CB GLU A 128 -9.009 9.101 -9.491 1.00 11.24 C ATOM 1880 CG GLU A 128 -9.595 9.285 -8.101 1.00 34.41 C ATOM 1881 CD GLU A 128 -10.829 10.157 -8.100 1.00 21.00 C ATOM 1882 OE1 GLU A 128 -10.691 11.398 -8.090 1.00 12.50 O ATOM 1883 OE2 GLU A 128 -11.950 9.606 -8.108 1.00 20.10 O ATOM 0 H GLU A 128 -6.931 9.702 -8.294 1.00 64.25 H new ATOM 0 HA GLU A 128 -8.012 7.237 -9.134 1.00 1.32 H new ATOM 0 HB2 GLU A 128 -8.765 10.080 -9.904 1.00 11.24 H new ATOM 0 HB3 GLU A 128 -9.768 8.662 -10.139 1.00 11.24 H new ATOM 0 HG2 GLU A 128 -9.844 8.309 -7.684 1.00 34.41 H new ATOM 0 HG3 GLU A 128 -8.842 9.727 -7.449 1.00 34.41 H new ATOM 1890 N ALA A 129 -6.564 9.103 -11.439 1.00 40.31 N ATOM 1891 CA ALA A 129 -5.992 9.101 -12.778 1.00 63.22 C ATOM 1892 C ALA A 129 -4.888 8.061 -12.908 1.00 12.10 C ATOM 1893 O ALA A 129 -4.680 7.489 -13.980 1.00 5.11 O ATOM 1894 CB ALA A 129 -5.455 10.482 -13.120 1.00 42.31 C ATOM 0 H ALA A 129 -6.381 9.955 -10.909 1.00 40.31 H new ATOM 0 HA ALA A 129 -6.783 8.840 -13.481 1.00 63.22 H new ATOM 0 HB1 ALA A 129 -5.030 10.469 -14.123 1.00 42.31 H new ATOM 0 HB2 ALA A 129 -6.267 11.208 -13.080 1.00 42.31 H new ATOM 0 HB3 ALA A 129 -4.683 10.760 -12.402 1.00 42.31 H new ATOM 1900 N ALA A 130 -4.178 7.832 -11.816 1.00 0.24 N ATOM 1901 CA ALA A 130 -3.068 6.891 -11.797 1.00 40.41 C ATOM 1902 C ALA A 130 -3.521 5.434 -11.781 1.00 52.41 C ATOM 1903 O ALA A 130 -2.716 4.540 -12.038 1.00 71.25 O ATOM 1904 CB ALA A 130 -2.160 7.165 -10.612 1.00 75.42 C ATOM 0 H ALA A 130 -4.353 8.290 -10.921 1.00 0.24 H new ATOM 0 HA ALA A 130 -2.518 7.043 -12.725 1.00 40.41 H new ATOM 0 HB1 ALA A 130 -1.335 6.452 -10.613 1.00 75.42 H new ATOM 0 HB2 ALA A 130 -1.764 8.178 -10.684 1.00 75.42 H new ATOM 0 HB3 ALA A 130 -2.728 7.062 -9.687 1.00 75.42 H new ATOM 1910 N LEU A 131 -4.795 5.190 -11.476 1.00 22.32 N ATOM 1911 CA LEU A 131 -5.317 3.819 -11.399 1.00 73.34 C ATOM 1912 C LEU A 131 -5.021 2.979 -12.666 1.00 12.54 C ATOM 1913 O LEU A 131 -4.484 1.879 -12.548 1.00 72.43 O ATOM 1914 CB LEU A 131 -6.816 3.800 -11.054 1.00 52.54 C ATOM 1915 CG LEU A 131 -7.188 4.330 -9.666 1.00 62.31 C ATOM 1916 CD1 LEU A 131 -8.694 4.310 -9.477 1.00 72.23 C ATOM 1917 CD2 LEU A 131 -6.504 3.515 -8.576 1.00 52.23 C ATOM 0 H LEU A 131 -5.484 5.916 -11.279 1.00 22.32 H new ATOM 0 HA LEU A 131 -4.776 3.341 -10.582 1.00 73.34 H new ATOM 0 HB2 LEU A 131 -7.349 4.388 -11.801 1.00 52.54 H new ATOM 0 HB3 LEU A 131 -7.176 2.775 -11.139 1.00 52.54 H new ATOM 0 HG LEU A 131 -6.842 5.361 -9.590 1.00 62.31 H new ATOM 0 HD11 LEU A 131 -8.941 4.690 -8.486 1.00 72.23 H new ATOM 0 HD12 LEU A 131 -9.164 4.938 -10.234 1.00 72.23 H new ATOM 0 HD13 LEU A 131 -9.060 3.288 -9.576 1.00 72.23 H new ATOM 0 HD21 LEU A 131 -6.782 3.909 -7.598 1.00 52.23 H new ATOM 0 HD22 LEU A 131 -6.817 2.473 -8.650 1.00 52.23 H new ATOM 0 HD23 LEU A 131 -5.423 3.579 -8.698 1.00 52.23 H new ATOM 1929 N PRO A 132 -5.356 3.471 -13.900 1.00 3.23 N ATOM 1930 CA PRO A 132 -5.056 2.735 -15.145 1.00 62.23 C ATOM 1931 C PRO A 132 -3.562 2.410 -15.273 1.00 64.34 C ATOM 1932 O PRO A 132 -3.176 1.386 -15.841 1.00 45.10 O ATOM 1933 CB PRO A 132 -5.478 3.713 -16.248 1.00 0.22 C ATOM 1934 CG PRO A 132 -6.498 4.582 -15.607 1.00 33.12 C ATOM 1935 CD PRO A 132 -6.066 4.738 -14.179 1.00 52.15 C ATOM 0 HA PRO A 132 -5.571 1.775 -15.187 1.00 62.23 H new ATOM 0 HB2 PRO A 132 -4.630 4.296 -16.607 1.00 0.22 H new ATOM 0 HB3 PRO A 132 -5.890 3.186 -17.109 1.00 0.22 H new ATOM 0 HG2 PRO A 132 -6.556 5.550 -16.106 1.00 33.12 H new ATOM 0 HG3 PRO A 132 -7.489 4.132 -15.668 1.00 33.12 H new ATOM 0 HD2 PRO A 132 -5.415 5.602 -14.048 1.00 52.15 H new ATOM 0 HD3 PRO A 132 -6.918 4.877 -13.514 1.00 52.15 H new ATOM 1943 N MET A 133 -2.739 3.281 -14.724 1.00 1.13 N ATOM 1944 CA MET A 133 -1.299 3.100 -14.751 1.00 41.14 C ATOM 1945 C MET A 133 -0.899 2.030 -13.733 1.00 5.55 C ATOM 1946 O MET A 133 -0.175 1.079 -14.050 1.00 51.52 O ATOM 1947 CB MET A 133 -0.593 4.441 -14.456 1.00 23.42 C ATOM 1948 CG MET A 133 0.932 4.420 -14.597 1.00 41.20 C ATOM 1949 SD MET A 133 1.783 3.587 -13.232 1.00 22.25 S ATOM 1950 CE MET A 133 1.288 4.602 -11.837 1.00 63.44 C ATOM 0 H MET A 133 -3.046 4.130 -14.249 1.00 1.13 H new ATOM 0 HA MET A 133 -0.990 2.767 -15.742 1.00 41.14 H new ATOM 0 HB2 MET A 133 -0.994 5.200 -15.128 1.00 23.42 H new ATOM 0 HB3 MET A 133 -0.844 4.750 -13.441 1.00 23.42 H new ATOM 0 HG2 MET A 133 1.194 3.925 -15.532 1.00 41.20 H new ATOM 0 HG3 MET A 133 1.295 5.445 -14.667 1.00 41.20 H new ATOM 0 HE1 MET A 133 2.145 4.765 -11.183 1.00 63.44 H new ATOM 0 HE2 MET A 133 0.919 5.562 -12.198 1.00 63.44 H new ATOM 0 HE3 MET A 133 0.499 4.096 -11.281 1.00 63.44 H new ATOM 1960 N LEU A 134 -1.412 2.185 -12.520 1.00 53.41 N ATOM 1961 CA LEU A 134 -1.107 1.293 -11.408 1.00 44.33 C ATOM 1962 C LEU A 134 -1.609 -0.131 -11.662 1.00 15.45 C ATOM 1963 O LEU A 134 -0.938 -1.103 -11.310 1.00 74.32 O ATOM 1964 CB LEU A 134 -1.718 1.844 -10.117 1.00 34.22 C ATOM 1965 CG LEU A 134 -1.332 1.117 -8.830 1.00 41.15 C ATOM 1966 CD1 LEU A 134 0.165 1.214 -8.588 1.00 12.23 C ATOM 1967 CD2 LEU A 134 -2.102 1.682 -7.649 1.00 12.11 C ATOM 0 H LEU A 134 -2.056 2.938 -12.278 1.00 53.41 H new ATOM 0 HA LEU A 134 -0.023 1.245 -11.309 1.00 44.33 H new ATOM 0 HB2 LEU A 134 -1.430 2.891 -10.020 1.00 34.22 H new ATOM 0 HB3 LEU A 134 -2.803 1.820 -10.213 1.00 34.22 H new ATOM 0 HG LEU A 134 -1.592 0.064 -8.939 1.00 41.15 H new ATOM 0 HD11 LEU A 134 0.419 0.690 -7.667 1.00 12.23 H new ATOM 0 HD12 LEU A 134 0.699 0.760 -9.423 1.00 12.23 H new ATOM 0 HD13 LEU A 134 0.452 2.262 -8.501 1.00 12.23 H new ATOM 0 HD21 LEU A 134 -1.815 1.153 -6.741 1.00 12.11 H new ATOM 0 HD22 LEU A 134 -1.873 2.742 -7.539 1.00 12.11 H new ATOM 0 HD23 LEU A 134 -3.171 1.557 -7.819 1.00 12.11 H new ATOM 1979 N ARG A 135 -2.773 -0.253 -12.296 1.00 10.22 N ATOM 1980 CA ARG A 135 -3.352 -1.567 -12.582 1.00 51.43 C ATOM 1981 C ARG A 135 -2.478 -2.317 -13.579 1.00 42.02 C ATOM 1982 O ARG A 135 -2.521 -3.541 -13.663 1.00 62.13 O ATOM 1983 CB ARG A 135 -4.806 -1.427 -13.104 1.00 24.03 C ATOM 1984 CG ARG A 135 -4.934 -0.882 -14.527 1.00 61.33 C ATOM 1985 CD ARG A 135 -4.916 -2.004 -15.554 1.00 54.04 C ATOM 1986 NE ARG A 135 -4.709 -1.520 -16.919 1.00 34.13 N ATOM 1987 CZ ARG A 135 -4.468 -2.321 -17.961 1.00 61.13 C ATOM 1988 NH1 ARG A 135 -4.462 -3.643 -17.799 1.00 55.35 N ATOM 1989 NH2 ARG A 135 -4.243 -1.802 -19.164 1.00 61.21 N ATOM 0 H ARG A 135 -3.332 0.536 -12.621 1.00 10.22 H new ATOM 0 HA ARG A 135 -3.389 -2.143 -11.657 1.00 51.43 H new ATOM 0 HB2 ARG A 135 -5.287 -2.404 -13.061 1.00 24.03 H new ATOM 0 HB3 ARG A 135 -5.356 -0.771 -12.429 1.00 24.03 H new ATOM 0 HG2 ARG A 135 -5.861 -0.316 -14.620 1.00 61.33 H new ATOM 0 HG3 ARG A 135 -4.117 -0.189 -14.728 1.00 61.33 H new ATOM 0 HD2 ARG A 135 -4.125 -2.710 -15.300 1.00 54.04 H new ATOM 0 HD3 ARG A 135 -5.858 -2.550 -15.506 1.00 54.04 H new ATOM 0 HE ARG A 135 -4.751 -0.514 -17.085 1.00 34.13 H new ATOM 0 HH11 ARG A 135 -4.642 -4.045 -16.879 1.00 55.35 H new ATOM 0 HH12 ARG A 135 -4.278 -4.254 -18.595 1.00 55.35 H new ATOM 0 HH21 ARG A 135 -4.254 -0.790 -19.293 1.00 61.21 H new ATOM 0 HH22 ARG A 135 -4.059 -2.416 -19.958 1.00 61.21 H new ATOM 2003 N THR A 136 -1.677 -1.567 -14.313 1.00 63.13 N ATOM 2004 CA THR A 136 -0.779 -2.135 -15.283 1.00 1.04 C ATOM 2005 C THR A 136 0.485 -2.644 -14.587 1.00 52.44 C ATOM 2006 O THR A 136 0.980 -3.727 -14.895 1.00 40.43 O ATOM 2007 CB THR A 136 -0.407 -1.099 -16.368 1.00 2.34 C ATOM 2008 OG1 THR A 136 -1.607 -0.595 -16.979 1.00 4.44 O ATOM 2009 CG2 THR A 136 0.479 -1.724 -17.441 1.00 62.22 C ATOM 0 H THR A 136 -1.636 -0.550 -14.249 1.00 63.13 H new ATOM 0 HA THR A 136 -1.283 -2.970 -15.770 1.00 1.04 H new ATOM 0 HB THR A 136 0.144 -0.287 -15.893 1.00 2.34 H new ATOM 0 HG1 THR A 136 -2.001 0.096 -16.406 1.00 4.44 H new ATOM 0 HG21 THR A 136 0.726 -0.973 -18.192 1.00 62.22 H new ATOM 0 HG22 THR A 136 1.396 -2.096 -16.984 1.00 62.22 H new ATOM 0 HG23 THR A 136 -0.051 -2.550 -17.915 1.00 62.22 H new ATOM 2017 N GLN A 137 0.979 -1.871 -13.620 1.00 15.42 N ATOM 2018 CA GLN A 137 2.174 -2.244 -12.868 1.00 24.34 C ATOM 2019 C GLN A 137 1.969 -3.548 -12.105 1.00 64.14 C ATOM 2020 O GLN A 137 2.851 -4.406 -12.089 1.00 4.45 O ATOM 2021 CB GLN A 137 2.553 -1.135 -11.884 1.00 23.12 C ATOM 2022 CG GLN A 137 2.732 0.232 -12.524 1.00 41.15 C ATOM 2023 CD GLN A 137 3.799 0.252 -13.604 1.00 52.30 C ATOM 2024 OE1 GLN A 137 4.757 -0.520 -13.567 1.00 55.04 O ATOM 2025 NE2 GLN A 137 3.646 1.147 -14.559 1.00 44.41 N ATOM 0 H GLN A 137 0.568 -0.981 -13.339 1.00 15.42 H new ATOM 0 HA GLN A 137 2.981 -2.387 -13.587 1.00 24.34 H new ATOM 0 HB2 GLN A 137 1.782 -1.066 -11.117 1.00 23.12 H new ATOM 0 HB3 GLN A 137 3.479 -1.412 -11.381 1.00 23.12 H new ATOM 0 HG2 GLN A 137 1.783 0.552 -12.954 1.00 41.15 H new ATOM 0 HG3 GLN A 137 2.992 0.956 -11.752 1.00 41.15 H new ATOM 0 HE21 GLN A 137 2.837 1.768 -14.551 1.00 44.41 H new ATOM 0 HE22 GLN A 137 4.337 1.219 -15.306 1.00 44.41 H new ATOM 2034 N LEU A 138 0.806 -3.711 -11.489 1.00 72.44 N ATOM 2035 CA LEU A 138 0.517 -4.930 -10.742 1.00 52.43 C ATOM 2036 C LEU A 138 0.258 -6.085 -11.695 1.00 32.41 C ATOM 2037 O LEU A 138 0.554 -7.241 -11.387 1.00 32.23 O ATOM 2038 CB LEU A 138 -0.688 -4.739 -9.799 1.00 53.14 C ATOM 2039 CG LEU A 138 -0.408 -4.050 -8.446 1.00 44.24 C ATOM 2040 CD1 LEU A 138 0.609 -4.837 -7.635 1.00 50.25 C ATOM 2041 CD2 LEU A 138 0.057 -2.616 -8.642 1.00 63.31 C ATOM 0 H LEU A 138 0.053 -3.023 -11.490 1.00 72.44 H new ATOM 0 HA LEU A 138 1.390 -5.161 -10.131 1.00 52.43 H new ATOM 0 HB2 LEU A 138 -1.444 -4.158 -10.327 1.00 53.14 H new ATOM 0 HB3 LEU A 138 -1.122 -5.719 -9.599 1.00 53.14 H new ATOM 0 HG LEU A 138 -1.345 -4.026 -7.889 1.00 44.24 H new ATOM 0 HD11 LEU A 138 0.789 -4.331 -6.687 1.00 50.25 H new ATOM 0 HD12 LEU A 138 0.225 -5.839 -7.444 1.00 50.25 H new ATOM 0 HD13 LEU A 138 1.543 -4.906 -8.192 1.00 50.25 H new ATOM 0 HD21 LEU A 138 0.246 -2.159 -7.671 1.00 63.31 H new ATOM 0 HD22 LEU A 138 0.974 -2.608 -9.231 1.00 63.31 H new ATOM 0 HD23 LEU A 138 -0.715 -2.051 -9.165 1.00 63.31 H new ATOM 2053 N ALA A 139 -0.258 -5.758 -12.873 1.00 42.04 N ATOM 2054 CA ALA A 139 -0.575 -6.758 -13.874 1.00 12.33 C ATOM 2055 C ALA A 139 0.682 -7.444 -14.392 1.00 62.51 C ATOM 2056 O ALA A 139 0.654 -8.610 -14.766 1.00 65.31 O ATOM 2057 CB ALA A 139 -1.357 -6.134 -15.019 1.00 30.10 C ATOM 0 H ALA A 139 -0.466 -4.800 -13.156 1.00 42.04 H new ATOM 0 HA ALA A 139 -1.196 -7.519 -13.402 1.00 12.33 H new ATOM 0 HB1 ALA A 139 -1.587 -6.898 -15.762 1.00 30.10 H new ATOM 0 HB2 ALA A 139 -2.285 -5.709 -14.637 1.00 30.10 H new ATOM 0 HB3 ALA A 139 -0.761 -5.347 -15.481 1.00 30.10 H new ATOM 2063 N GLU A 140 1.793 -6.722 -14.379 1.00 12.23 N ATOM 2064 CA GLU A 140 3.057 -7.268 -14.852 1.00 53.43 C ATOM 2065 C GLU A 140 3.737 -8.089 -13.759 1.00 35.55 C ATOM 2066 O GLU A 140 4.804 -8.669 -13.966 1.00 32.33 O ATOM 2067 CB GLU A 140 3.973 -6.155 -15.347 1.00 10.32 C ATOM 2068 CG GLU A 140 3.364 -5.336 -16.469 1.00 53.21 C ATOM 2069 CD GLU A 140 4.366 -4.444 -17.148 1.00 75.52 C ATOM 2070 OE1 GLU A 140 5.011 -4.903 -18.112 1.00 12.40 O ATOM 2071 OE2 GLU A 140 4.507 -3.274 -16.740 1.00 70.41 O ATOM 0 H GLU A 140 1.845 -5.759 -14.047 1.00 12.23 H new ATOM 0 HA GLU A 140 2.848 -7.933 -15.690 1.00 53.43 H new ATOM 0 HB2 GLU A 140 4.215 -5.495 -14.514 1.00 10.32 H new ATOM 0 HB3 GLU A 140 4.911 -6.591 -15.691 1.00 10.32 H new ATOM 0 HG2 GLU A 140 2.924 -6.008 -17.206 1.00 53.21 H new ATOM 0 HG3 GLU A 140 2.553 -4.726 -16.069 1.00 53.21 H new ATOM 2078 N SER A 141 3.104 -8.138 -12.602 1.00 25.50 N ATOM 2079 CA SER A 141 3.594 -8.925 -11.488 1.00 63.34 C ATOM 2080 C SER A 141 2.843 -10.261 -11.450 1.00 51.12 C ATOM 2081 O SER A 141 3.064 -11.101 -10.574 1.00 72.53 O ATOM 2082 CB SER A 141 3.396 -8.145 -10.174 1.00 41.44 C ATOM 2083 OG SER A 141 3.910 -8.853 -9.060 1.00 62.13 O ATOM 0 H SER A 141 2.238 -7.635 -12.409 1.00 25.50 H new ATOM 0 HA SER A 141 4.659 -9.123 -11.609 1.00 63.34 H new ATOM 0 HB2 SER A 141 3.890 -7.176 -10.248 1.00 41.44 H new ATOM 0 HB3 SER A 141 2.334 -7.951 -10.023 1.00 41.44 H new ATOM 0 HG SER A 141 3.809 -9.816 -9.209 1.00 62.13 H new ATOM 2089 N GLY A 142 1.978 -10.460 -12.443 1.00 42.25 N ATOM 2090 CA GLY A 142 1.180 -11.669 -12.517 1.00 53.24 C ATOM 2091 C GLY A 142 0.002 -11.661 -11.563 1.00 24.44 C ATOM 2092 O GLY A 142 -0.758 -12.631 -11.498 1.00 42.15 O ATOM 0 H GLY A 142 1.817 -9.798 -13.202 1.00 42.25 H new ATOM 0 HA2 GLY A 142 0.814 -11.794 -13.536 1.00 53.24 H new ATOM 0 HA3 GLY A 142 1.812 -12.529 -12.297 1.00 53.24 H new ATOM 2096 N ILE A 143 -0.153 -10.581 -10.820 1.00 40.41 N ATOM 2097 CA ILE A 143 -1.232 -10.465 -9.862 1.00 21.41 C ATOM 2098 C ILE A 143 -2.337 -9.575 -10.420 1.00 54.24 C ATOM 2099 O ILE A 143 -2.066 -8.583 -11.097 1.00 5.44 O ATOM 2100 CB ILE A 143 -0.724 -9.872 -8.519 1.00 43.54 C ATOM 2101 CG1 ILE A 143 0.483 -10.668 -8.007 1.00 34.10 C ATOM 2102 CG2 ILE A 143 -1.839 -9.867 -7.475 1.00 75.13 C ATOM 2103 CD1 ILE A 143 1.102 -10.102 -6.744 1.00 21.23 C ATOM 0 H ILE A 143 0.460 -9.767 -10.864 1.00 40.41 H new ATOM 0 HA ILE A 143 -1.625 -11.465 -9.678 1.00 21.41 H new ATOM 0 HB ILE A 143 -0.414 -8.842 -8.694 1.00 43.54 H new ATOM 0 HG12 ILE A 143 0.174 -11.696 -7.819 1.00 34.10 H new ATOM 0 HG13 ILE A 143 1.242 -10.701 -8.789 1.00 34.10 H new ATOM 0 HG21 ILE A 143 -1.462 -9.448 -6.542 1.00 75.13 H new ATOM 0 HG22 ILE A 143 -2.671 -9.262 -7.835 1.00 75.13 H new ATOM 0 HG23 ILE A 143 -2.180 -10.888 -7.302 1.00 75.13 H new ATOM 0 HD11 ILE A 143 1.949 -10.720 -6.445 1.00 21.23 H new ATOM 0 HD12 ILE A 143 1.443 -9.084 -6.931 1.00 21.23 H new ATOM 0 HD13 ILE A 143 0.359 -10.095 -5.946 1.00 21.23 H new ATOM 2115 N GLN A 144 -3.572 -9.949 -10.166 1.00 45.23 N ATOM 2116 CA GLN A 144 -4.699 -9.147 -10.595 1.00 25.24 C ATOM 2117 C GLN A 144 -5.024 -8.102 -9.547 1.00 4.40 C ATOM 2118 O GLN A 144 -4.656 -8.245 -8.380 1.00 13.04 O ATOM 2119 CB GLN A 144 -5.920 -10.021 -10.863 1.00 4.34 C ATOM 2120 CG GLN A 144 -5.668 -11.136 -11.859 1.00 12.31 C ATOM 2121 CD GLN A 144 -6.945 -11.813 -12.304 1.00 13.44 C ATOM 2122 OE1 GLN A 144 -7.548 -11.425 -13.307 1.00 4.50 O ATOM 2123 NE2 GLN A 144 -7.376 -12.809 -11.559 1.00 23.35 N ATOM 0 H GLN A 144 -3.822 -10.802 -9.665 1.00 45.23 H new ATOM 0 HA GLN A 144 -4.428 -8.647 -11.525 1.00 25.24 H new ATOM 0 HB2 GLN A 144 -6.257 -10.456 -9.922 1.00 4.34 H new ATOM 0 HB3 GLN A 144 -6.731 -9.393 -11.232 1.00 4.34 H new ATOM 0 HG2 GLN A 144 -5.152 -10.731 -12.730 1.00 12.31 H new ATOM 0 HG3 GLN A 144 -5.005 -11.876 -11.411 1.00 12.31 H new ATOM 0 HE21 GLN A 144 -6.846 -13.098 -10.737 1.00 23.35 H new ATOM 0 HE22 GLN A 144 -8.240 -13.292 -11.804 1.00 23.35 H new ATOM 2132 N LEU A 145 -5.708 -7.057 -9.954 1.00 0.34 N ATOM 2133 CA LEU A 145 -6.050 -5.994 -9.045 1.00 2.54 C ATOM 2134 C LEU A 145 -7.459 -6.222 -8.541 1.00 50.43 C ATOM 2135 O LEU A 145 -8.396 -6.372 -9.333 1.00 41.12 O ATOM 2136 CB LEU A 145 -5.938 -4.628 -9.730 1.00 23.53 C ATOM 2137 CG LEU A 145 -5.922 -3.415 -8.790 1.00 53.43 C ATOM 2138 CD1 LEU A 145 -4.610 -3.345 -8.024 1.00 54.24 C ATOM 2139 CD2 LEU A 145 -6.162 -2.130 -9.565 1.00 1.00 C ATOM 0 H LEU A 145 -6.037 -6.923 -10.910 1.00 0.34 H new ATOM 0 HA LEU A 145 -5.353 -5.997 -8.207 1.00 2.54 H new ATOM 0 HB2 LEU A 145 -5.026 -4.615 -10.327 1.00 23.53 H new ATOM 0 HB3 LEU A 145 -6.774 -4.518 -10.421 1.00 23.53 H new ATOM 0 HG LEU A 145 -6.731 -3.533 -8.069 1.00 53.43 H new ATOM 0 HD11 LEU A 145 -4.620 -2.478 -7.364 1.00 54.24 H new ATOM 0 HD12 LEU A 145 -4.486 -4.251 -7.431 1.00 54.24 H new ATOM 0 HD13 LEU A 145 -3.782 -3.256 -8.728 1.00 54.24 H new ATOM 0 HD21 LEU A 145 -6.147 -1.283 -8.879 1.00 1.00 H new ATOM 0 HD22 LEU A 145 -5.380 -2.005 -10.314 1.00 1.00 H new ATOM 0 HD23 LEU A 145 -7.132 -2.179 -10.059 1.00 1.00 H new ATOM 2151 N GLY A 146 -7.610 -6.265 -7.243 1.00 60.41 N ATOM 2152 CA GLY A 146 -8.899 -6.536 -6.668 1.00 74.50 C ATOM 2153 C GLY A 146 -9.717 -5.289 -6.476 1.00 71.35 C ATOM 2154 O GLY A 146 -9.974 -4.546 -7.426 1.00 13.23 O ATOM 0 H GLY A 146 -6.860 -6.117 -6.568 1.00 60.41 H new ATOM 0 HA2 GLY A 146 -9.442 -7.228 -7.312 1.00 74.50 H new ATOM 0 HA3 GLY A 146 -8.767 -7.032 -5.706 1.00 74.50 H new ATOM 2158 N GLN A 147 -10.114 -5.054 -5.254 1.00 73.03 N ATOM 2159 CA GLN A 147 -10.928 -3.910 -4.917 1.00 54.45 C ATOM 2160 C GLN A 147 -10.078 -2.646 -4.836 1.00 52.12 C ATOM 2161 O GLN A 147 -8.847 -2.690 -4.963 1.00 74.34 O ATOM 2162 CB GLN A 147 -11.671 -4.135 -3.586 1.00 32.51 C ATOM 2163 CG GLN A 147 -12.634 -5.324 -3.585 1.00 40.53 C ATOM 2164 CD GLN A 147 -11.924 -6.667 -3.631 1.00 61.23 C ATOM 2165 OE1 GLN A 147 -10.810 -6.816 -3.122 1.00 74.34 O ATOM 2166 NE2 GLN A 147 -12.550 -7.642 -4.250 1.00 73.54 N ATOM 0 H GLN A 147 -9.883 -5.651 -4.460 1.00 73.03 H new ATOM 0 HA GLN A 147 -11.667 -3.783 -5.708 1.00 54.45 H new ATOM 0 HB2 GLN A 147 -10.935 -4.280 -2.795 1.00 32.51 H new ATOM 0 HB3 GLN A 147 -12.230 -3.232 -3.340 1.00 32.51 H new ATOM 0 HG2 GLN A 147 -13.256 -5.279 -2.691 1.00 40.53 H new ATOM 0 HG3 GLN A 147 -13.302 -5.243 -4.443 1.00 40.53 H new ATOM 0 HE21 GLN A 147 -13.471 -7.479 -4.658 1.00 73.54 H new ATOM 0 HE22 GLN A 147 -12.116 -8.562 -4.323 1.00 73.54 H new ATOM 2175 N SER A 148 -10.730 -1.534 -4.637 1.00 44.13 N ATOM 2176 CA SER A 148 -10.062 -0.262 -4.523 1.00 0.01 C ATOM 2177 C SER A 148 -10.736 0.551 -3.439 1.00 14.24 C ATOM 2178 O SER A 148 -11.965 0.583 -3.357 1.00 51.52 O ATOM 2179 CB SER A 148 -10.092 0.478 -5.863 1.00 53.30 C ATOM 2180 OG SER A 148 -9.465 -0.297 -6.878 1.00 60.22 O ATOM 0 H SER A 148 -11.745 -1.482 -4.549 1.00 44.13 H new ATOM 0 HA SER A 148 -9.017 -0.417 -4.255 1.00 0.01 H new ATOM 0 HB2 SER A 148 -11.124 0.689 -6.145 1.00 53.30 H new ATOM 0 HB3 SER A 148 -9.585 1.438 -5.766 1.00 53.30 H new ATOM 0 HG SER A 148 -9.495 0.191 -7.727 1.00 60.22 H new ATOM 2186 N SER A 149 -9.947 1.190 -2.601 1.00 25.22 N ATOM 2187 CA SER A 149 -10.494 1.944 -1.496 1.00 53.11 C ATOM 2188 C SER A 149 -9.697 3.215 -1.238 1.00 24.42 C ATOM 2189 O SER A 149 -8.469 3.228 -1.337 1.00 64.41 O ATOM 2190 CB SER A 149 -10.521 1.075 -0.233 1.00 61.12 C ATOM 2191 OG SER A 149 -11.240 -0.131 -0.453 1.00 34.31 O ATOM 0 H SER A 149 -8.929 1.202 -2.664 1.00 25.22 H new ATOM 0 HA SER A 149 -11.511 2.235 -1.759 1.00 53.11 H new ATOM 0 HB2 SER A 149 -9.501 0.842 0.073 1.00 61.12 H new ATOM 0 HB3 SER A 149 -10.980 1.631 0.584 1.00 61.12 H new ATOM 0 HG SER A 149 -11.240 -0.666 0.368 1.00 34.31 H new ATOM 2197 N ILE A 150 -10.410 4.271 -0.895 1.00 34.23 N ATOM 2198 CA ILE A 150 -9.819 5.559 -0.595 1.00 11.52 C ATOM 2199 C ILE A 150 -10.476 6.096 0.659 1.00 42.23 C ATOM 2200 O ILE A 150 -11.698 6.212 0.720 1.00 74.53 O ATOM 2201 CB ILE A 150 -10.016 6.574 -1.755 1.00 1.43 C ATOM 2202 CG1 ILE A 150 -9.396 6.035 -3.051 1.00 21.51 C ATOM 2203 CG2 ILE A 150 -9.406 7.928 -1.391 1.00 62.24 C ATOM 2204 CD1 ILE A 150 -9.542 6.964 -4.239 1.00 4.02 C ATOM 0 H ILE A 150 -11.427 4.257 -0.816 1.00 34.23 H new ATOM 0 HA ILE A 150 -8.746 5.428 -0.456 1.00 11.52 H new ATOM 0 HB ILE A 150 -11.085 6.711 -1.916 1.00 1.43 H new ATOM 0 HG12 ILE A 150 -8.337 5.843 -2.882 1.00 21.51 H new ATOM 0 HG13 ILE A 150 -9.859 5.078 -3.292 1.00 21.51 H new ATOM 0 HG21 ILE A 150 -9.553 8.627 -2.215 1.00 62.24 H new ATOM 0 HG22 ILE A 150 -9.890 8.316 -0.495 1.00 62.24 H new ATOM 0 HG23 ILE A 150 -8.339 7.808 -1.203 1.00 62.24 H new ATOM 0 HD11 ILE A 150 -9.078 6.510 -5.115 1.00 4.02 H new ATOM 0 HD12 ILE A 150 -10.600 7.137 -4.437 1.00 4.02 H new ATOM 0 HD13 ILE A 150 -9.053 7.914 -4.021 1.00 4.02 H new ATOM 2216 N SER A 151 -9.689 6.393 1.663 1.00 14.03 N ATOM 2217 CA SER A 151 -10.237 6.843 2.923 1.00 74.42 C ATOM 2218 C SER A 151 -9.355 7.899 3.568 1.00 2.42 C ATOM 2219 O SER A 151 -8.131 7.816 3.505 1.00 71.45 O ATOM 2220 CB SER A 151 -10.400 5.646 3.858 1.00 24.54 C ATOM 2221 OG SER A 151 -11.160 4.619 3.231 1.00 12.13 O ATOM 0 H SER A 151 -8.671 6.333 1.635 1.00 14.03 H new ATOM 0 HA SER A 151 -11.209 7.299 2.735 1.00 74.42 H new ATOM 0 HB2 SER A 151 -9.420 5.261 4.138 1.00 24.54 H new ATOM 0 HB3 SER A 151 -10.893 5.961 4.778 1.00 24.54 H new ATOM 0 HG SER A 151 -11.253 3.860 3.844 1.00 12.13 H new ATOM 2227 N SER A 152 -9.980 8.894 4.175 1.00 22.43 N ATOM 2228 CA SER A 152 -9.254 9.937 4.872 1.00 11.34 C ATOM 2229 C SER A 152 -8.962 9.503 6.303 1.00 23.11 C ATOM 2230 O SER A 152 -7.973 9.923 6.907 1.00 32.22 O ATOM 2231 CB SER A 152 -10.050 11.248 4.853 1.00 72.41 C ATOM 2232 OG SER A 152 -10.277 11.683 3.515 1.00 41.43 O ATOM 0 H SER A 152 -10.994 9.000 4.198 1.00 22.43 H new ATOM 0 HA SER A 152 -8.306 10.108 4.362 1.00 11.34 H new ATOM 0 HB2 SER A 152 -11.004 11.107 5.361 1.00 72.41 H new ATOM 0 HB3 SER A 152 -9.507 12.017 5.403 1.00 72.41 H new ATOM 0 HG SER A 152 -9.501 11.457 2.961 1.00 41.43 H new ATOM 2238 N GLU A 153 -9.826 8.649 6.834 1.00 42.52 N ATOM 2239 CA GLU A 153 -9.654 8.125 8.176 1.00 74.24 C ATOM 2240 C GLU A 153 -9.921 6.623 8.199 1.00 53.11 C ATOM 2241 O GLU A 153 -9.033 5.831 8.514 1.00 3.32 O ATOM 2242 CB GLU A 153 -10.571 8.853 9.166 1.00 62.13 C ATOM 2243 CG GLU A 153 -10.388 8.410 10.611 1.00 42.55 C ATOM 2244 CD GLU A 153 -11.137 9.284 11.590 1.00 60.33 C ATOM 2245 OE1 GLU A 153 -10.568 10.306 12.031 1.00 54.13 O ATOM 2246 OE2 GLU A 153 -12.292 8.951 11.934 1.00 72.23 O ATOM 0 H GLU A 153 -10.656 8.305 6.351 1.00 42.52 H new ATOM 0 HA GLU A 153 -8.622 8.297 8.482 1.00 74.24 H new ATOM 0 HB2 GLU A 153 -10.386 9.925 9.098 1.00 62.13 H new ATOM 0 HB3 GLU A 153 -11.608 8.690 8.874 1.00 62.13 H new ATOM 0 HG2 GLU A 153 -10.728 7.380 10.716 1.00 42.55 H new ATOM 0 HG3 GLU A 153 -9.327 8.422 10.858 1.00 42.55 H new ATOM 2284 N ALA A 156 -15.863 4.450 4.812 1.00 34.41 N ATOM 2285 CA ALA A 156 -17.128 5.149 4.908 1.00 74.53 C ATOM 2286 C ALA A 156 -17.708 5.376 3.525 1.00 42.01 C ATOM 2287 O ALA A 156 -17.040 5.127 2.515 1.00 72.43 O ATOM 2288 CB ALA A 156 -16.937 6.482 5.616 1.00 73.22 C ATOM 0 HA ALA A 156 -17.822 4.538 5.485 1.00 74.53 H new ATOM 0 HB1 ALA A 156 -17.894 6.999 5.683 1.00 73.22 H new ATOM 0 HB2 ALA A 156 -16.548 6.309 6.619 1.00 73.22 H new ATOM 0 HB3 ALA A 156 -16.232 7.095 5.054 1.00 73.22 H new ATOM 2294 N GLY A 157 -18.937 5.845 3.472 1.00 44.31 N ATOM 2295 CA GLY A 157 -19.564 6.108 2.206 1.00 21.10 C ATOM 2296 C GLY A 157 -20.997 5.655 2.173 1.00 63.12 C ATOM 2297 O GLY A 157 -21.617 5.458 3.222 1.00 22.33 O ATOM 0 H GLY A 157 -19.514 6.049 4.288 1.00 44.31 H new ATOM 0 HA2 GLY A 157 -19.518 7.177 1.996 1.00 21.10 H new ATOM 0 HA3 GLY A 157 -19.008 5.604 1.416 1.00 21.10 H new ATOM 2301 N GLN A 158 -21.511 5.463 0.974 1.00 45.44 N ATOM 2302 CA GLN A 158 -22.891 5.053 0.756 1.00 44.14 C ATOM 2303 C GLN A 158 -22.965 4.253 -0.529 1.00 34.02 C ATOM 2304 O GLN A 158 -22.089 4.375 -1.392 1.00 21.51 O ATOM 2305 CB GLN A 158 -23.815 6.285 0.616 1.00 74.33 C ATOM 2306 CG GLN A 158 -23.884 7.198 1.834 1.00 30.44 C ATOM 2307 CD GLN A 158 -24.510 6.534 3.043 1.00 14.12 C ATOM 2308 OE1 GLN A 158 -25.354 5.648 2.916 1.00 54.45 O ATOM 2309 NE2 GLN A 158 -24.113 6.964 4.219 1.00 43.32 N ATOM 0 H GLN A 158 -20.979 5.588 0.112 1.00 45.44 H new ATOM 0 HA GLN A 158 -23.217 4.458 1.609 1.00 44.14 H new ATOM 0 HB2 GLN A 158 -23.479 6.873 -0.238 1.00 74.33 H new ATOM 0 HB3 GLN A 158 -24.822 5.937 0.387 1.00 74.33 H new ATOM 0 HG2 GLN A 158 -22.877 7.529 2.090 1.00 30.44 H new ATOM 0 HG3 GLN A 158 -24.457 8.090 1.580 1.00 30.44 H new ATOM 0 HE21 GLN A 158 -23.411 7.701 4.282 1.00 43.32 H new ATOM 0 HE22 GLN A 158 -24.507 6.561 5.069 1.00 43.32 H new ATOM 2318 N GLN A 159 -23.987 3.433 -0.659 1.00 34.03 N ATOM 2319 CA GLN A 159 -24.171 2.653 -1.867 1.00 34.21 C ATOM 2320 C GLN A 159 -24.768 3.522 -2.952 1.00 14.22 C ATOM 2321 O GLN A 159 -25.914 3.969 -2.844 1.00 13.44 O ATOM 2322 CB GLN A 159 -25.066 1.431 -1.617 1.00 22.12 C ATOM 2323 CG GLN A 159 -24.396 0.287 -0.859 1.00 61.00 C ATOM 2324 CD GLN A 159 -23.957 0.666 0.543 1.00 64.23 C ATOM 2325 OE1 GLN A 159 -22.825 1.103 0.757 1.00 51.12 O ATOM 2326 NE2 GLN A 159 -24.848 0.505 1.504 1.00 30.54 N ATOM 0 H GLN A 159 -24.702 3.289 0.054 1.00 34.03 H new ATOM 0 HA GLN A 159 -23.194 2.290 -2.187 1.00 34.21 H new ATOM 0 HB2 GLN A 159 -25.946 1.751 -1.059 1.00 22.12 H new ATOM 0 HB3 GLN A 159 -25.418 1.054 -2.577 1.00 22.12 H new ATOM 0 HG2 GLN A 159 -25.087 -0.554 -0.800 1.00 61.00 H new ATOM 0 HG3 GLN A 159 -23.528 -0.053 -1.424 1.00 61.00 H new ATOM 0 HE21 GLN A 159 -25.775 0.140 1.284 1.00 30.54 H new ATOM 0 HE22 GLN A 159 -24.610 0.746 2.466 1.00 30.54 H new ATOM 2335 N GLN A 160 -23.999 3.775 -3.989 1.00 12.14 N ATOM 2336 CA GLN A 160 -24.460 4.606 -5.080 1.00 74.23 C ATOM 2337 C GLN A 160 -25.243 3.786 -6.100 1.00 11.13 C ATOM 2338 O GLN A 160 -24.776 3.524 -7.211 1.00 20.44 O ATOM 2339 CB GLN A 160 -23.288 5.336 -5.742 1.00 63.00 C ATOM 2340 CG GLN A 160 -22.613 6.354 -4.829 1.00 70.51 C ATOM 2341 CD GLN A 160 -21.442 7.056 -5.489 1.00 63.54 C ATOM 2342 OE1 GLN A 160 -21.398 7.209 -6.712 1.00 72.23 O ATOM 2343 NE2 GLN A 160 -20.497 7.505 -4.686 1.00 34.10 N ATOM 0 H GLN A 160 -23.050 3.417 -4.100 1.00 12.14 H new ATOM 0 HA GLN A 160 -25.135 5.357 -4.670 1.00 74.23 H new ATOM 0 HB2 GLN A 160 -22.549 4.603 -6.065 1.00 63.00 H new ATOM 0 HB3 GLN A 160 -23.646 5.844 -6.638 1.00 63.00 H new ATOM 0 HG2 GLN A 160 -23.347 7.097 -4.518 1.00 70.51 H new ATOM 0 HG3 GLN A 160 -22.266 5.851 -3.926 1.00 70.51 H new ATOM 0 HE21 GLN A 160 -20.571 7.358 -3.679 1.00 34.10 H new ATOM 0 HE22 GLN A 160 -19.692 7.999 -5.072 1.00 34.10 H new ATOM 2352 N SER A 161 -26.424 3.354 -5.695 1.00 15.05 N ATOM 2353 CA SER A 161 -27.297 2.589 -6.557 1.00 0.44 C ATOM 2354 C SER A 161 -28.224 3.530 -7.315 1.00 55.51 C ATOM 2355 O SER A 161 -28.595 4.590 -6.801 1.00 12.25 O ATOM 2356 CB SER A 161 -28.117 1.599 -5.726 1.00 73.41 C ATOM 2357 OG SER A 161 -27.269 0.793 -4.912 1.00 24.54 O ATOM 0 H SER A 161 -26.801 3.524 -4.763 1.00 15.05 H new ATOM 0 HA SER A 161 -26.694 2.031 -7.273 1.00 0.44 H new ATOM 0 HB2 SER A 161 -28.822 2.143 -5.097 1.00 73.41 H new ATOM 0 HB3 SER A 161 -28.705 0.963 -6.387 1.00 73.41 H new ATOM 0 HG SER A 161 -27.814 0.169 -4.389 1.00 24.54 H new ATOM 2363 N SER A 162 -28.597 3.150 -8.523 1.00 43.20 N ATOM 2364 CA SER A 162 -29.468 3.968 -9.341 1.00 14.34 C ATOM 2365 C SER A 162 -29.988 3.179 -10.527 1.00 45.14 C ATOM 2366 O SER A 162 -29.290 2.317 -11.066 1.00 11.03 O ATOM 2367 CB SER A 162 -28.719 5.213 -9.832 1.00 13.23 C ATOM 2368 OG SER A 162 -27.514 4.854 -10.493 1.00 1.21 O ATOM 0 H SER A 162 -28.308 2.275 -8.960 1.00 43.20 H new ATOM 0 HA SER A 162 -30.316 4.278 -8.731 1.00 14.34 H new ATOM 0 HB2 SER A 162 -29.355 5.780 -10.511 1.00 13.23 H new ATOM 0 HB3 SER A 162 -28.495 5.864 -8.987 1.00 13.23 H new ATOM 0 HG SER A 162 -27.055 5.664 -10.799 1.00 1.21 H new ATOM 2374 N SER A 163 -31.212 3.459 -10.910 1.00 54.21 N ATOM 2375 CA SER A 163 -31.837 2.813 -12.040 1.00 4.05 C ATOM 2376 C SER A 163 -32.750 3.802 -12.738 1.00 24.43 C ATOM 2377 O SER A 163 -33.253 4.734 -12.110 1.00 25.14 O ATOM 2378 CB SER A 163 -32.636 1.593 -11.577 1.00 10.23 C ATOM 2379 OG SER A 163 -31.810 0.684 -10.860 1.00 20.34 O ATOM 0 H SER A 163 -31.805 4.145 -10.444 1.00 54.21 H new ATOM 0 HA SER A 163 -31.068 2.477 -12.735 1.00 4.05 H new ATOM 0 HB2 SER A 163 -33.463 1.915 -10.944 1.00 10.23 H new ATOM 0 HB3 SER A 163 -33.072 1.090 -12.440 1.00 10.23 H new ATOM 0 HG SER A 163 -32.344 -0.086 -10.573 1.00 20.34 H new ATOM 2385 N GLN A 164 -32.950 3.617 -14.023 1.00 21.45 N ATOM 2386 CA GLN A 164 -33.795 4.506 -14.791 1.00 34.22 C ATOM 2387 C GLN A 164 -34.272 3.817 -16.054 1.00 12.21 C ATOM 2388 O GLN A 164 -33.483 3.542 -16.958 1.00 33.32 O ATOM 2389 CB GLN A 164 -33.035 5.788 -15.140 1.00 5.13 C ATOM 2390 CG GLN A 164 -33.836 6.782 -15.960 1.00 1.20 C ATOM 2391 CD GLN A 164 -33.053 8.039 -16.255 1.00 52.42 C ATOM 2392 OE1 GLN A 164 -32.343 8.121 -17.257 1.00 74.22 O ATOM 2393 NE2 GLN A 164 -33.181 9.026 -15.399 1.00 32.21 N ATOM 0 H GLN A 164 -32.537 2.855 -14.561 1.00 21.45 H new ATOM 0 HA GLN A 164 -34.665 4.769 -14.189 1.00 34.22 H new ATOM 0 HB2 GLN A 164 -32.715 6.270 -14.216 1.00 5.13 H new ATOM 0 HB3 GLN A 164 -32.132 5.523 -15.691 1.00 5.13 H new ATOM 0 HG2 GLN A 164 -34.139 6.316 -16.898 1.00 1.20 H new ATOM 0 HG3 GLN A 164 -34.748 7.042 -15.423 1.00 1.20 H new ATOM 0 HE21 GLN A 164 -33.780 8.917 -14.581 1.00 32.21 H new ATOM 0 HE22 GLN A 164 -32.682 9.902 -15.552 1.00 32.21 H new ATOM 2402 N GLN A 165 -35.549 3.498 -16.096 1.00 44.25 N ATOM 2403 CA GLN A 165 -36.130 2.860 -17.259 1.00 44.22 C ATOM 2404 C GLN A 165 -36.408 3.877 -18.365 1.00 23.34 C ATOM 2405 O GLN A 165 -37.348 4.670 -18.284 1.00 43.10 O ATOM 2406 CB GLN A 165 -37.404 2.088 -16.893 1.00 30.44 C ATOM 2407 CG GLN A 165 -38.455 2.914 -16.169 1.00 53.33 C ATOM 2408 CD GLN A 165 -39.761 2.177 -16.012 1.00 41.13 C ATOM 2409 OE1 GLN A 165 -39.794 0.951 -15.913 1.00 63.12 O ATOM 2410 NE2 GLN A 165 -40.849 2.916 -15.992 1.00 61.12 N ATOM 0 H GLN A 165 -36.206 3.671 -15.335 1.00 44.25 H new ATOM 0 HA GLN A 165 -35.402 2.142 -17.637 1.00 44.22 H new ATOM 0 HB2 GLN A 165 -37.843 1.683 -17.805 1.00 30.44 H new ATOM 0 HB3 GLN A 165 -37.132 1.239 -16.266 1.00 30.44 H new ATOM 0 HG2 GLN A 165 -38.079 3.193 -15.185 1.00 53.33 H new ATOM 0 HG3 GLN A 165 -38.627 3.839 -16.719 1.00 53.33 H new ATOM 0 HE21 GLN A 165 -40.778 3.930 -16.077 1.00 61.12 H new ATOM 0 HE22 GLN A 165 -41.763 2.475 -15.891 1.00 61.12 H new ATOM 2419 N GLN A 166 -35.576 3.864 -19.377 1.00 12.31 N ATOM 2420 CA GLN A 166 -35.744 4.745 -20.512 1.00 34.42 C ATOM 2421 C GLN A 166 -36.446 4.003 -21.649 1.00 62.32 C ATOM 2422 O GLN A 166 -35.810 3.386 -22.506 1.00 74.30 O ATOM 2423 CB GLN A 166 -34.389 5.357 -20.972 1.00 23.00 C ATOM 2424 CG GLN A 166 -33.298 4.351 -21.377 1.00 23.11 C ATOM 2425 CD GLN A 166 -32.804 3.499 -20.222 1.00 73.45 C ATOM 2426 OE1 GLN A 166 -33.337 2.418 -19.956 1.00 13.04 O ATOM 2427 NE2 GLN A 166 -31.794 3.975 -19.530 1.00 24.15 N ATOM 0 H GLN A 166 -34.766 3.247 -19.440 1.00 12.31 H new ATOM 0 HA GLN A 166 -36.373 5.582 -20.208 1.00 34.42 H new ATOM 0 HB2 GLN A 166 -34.580 6.017 -21.819 1.00 23.00 H new ATOM 0 HB3 GLN A 166 -34.001 5.978 -20.165 1.00 23.00 H new ATOM 0 HG2 GLN A 166 -33.688 3.699 -22.159 1.00 23.11 H new ATOM 0 HG3 GLN A 166 -32.455 4.893 -21.805 1.00 23.11 H new ATOM 0 HE21 GLN A 166 -31.381 4.873 -19.782 1.00 24.15 H new ATOM 0 HE22 GLN A 166 -31.423 3.447 -18.741 1.00 24.15 H new ATOM 2436 N SER A 167 -37.762 4.019 -21.614 1.00 52.13 N ATOM 2437 CA SER A 167 -38.552 3.340 -22.608 1.00 61.25 C ATOM 2438 C SER A 167 -38.527 4.092 -23.936 1.00 0.22 C ATOM 2439 O SER A 167 -39.278 5.052 -24.135 1.00 22.13 O ATOM 2440 CB SER A 167 -39.993 3.158 -22.116 1.00 2.54 C ATOM 2441 OG SER A 167 -40.722 2.269 -22.953 1.00 23.04 O ATOM 0 H SER A 167 -38.307 4.501 -20.899 1.00 52.13 H new ATOM 0 HA SER A 167 -38.116 2.355 -22.772 1.00 61.25 H new ATOM 0 HB2 SER A 167 -39.984 2.774 -21.096 1.00 2.54 H new ATOM 0 HB3 SER A 167 -40.494 4.126 -22.088 1.00 2.54 H new ATOM 0 HG SER A 167 -41.636 2.173 -22.611 1.00 23.04 H new