USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=28 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 75 SER OG : rot 72:sc= 0.315 USER MOD Set 1.2: A 133 MET CE :methyl 155:sc= -2.34 (180deg=-3.6!) USER MOD Set 2.1: A 62 SER OG : rot 180:sc= -0.014 USER MOD Set 2.2: A 94 HIS : no HD1:sc= 0 X(o=-0.014,f=0.45) USER MOD Single : A 2 MET CE :methyl 161:sc= -0.0642 (180deg=-0.484) USER MOD Single : A 4 SER OG : rot 180:sc= -0.25 USER MOD Single : A 9 THR OG1 : rot -159:sc= 0.275 USER MOD Single : A 23 THR OG1 : rot 180:sc= -0.205 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 147:sc= 0.902 (180deg=0.309) USER MOD Single : A 67 SER OG : rot 180:sc= 0.0168 USER MOD Single : A 68 HIS : no HD1:sc= -0.0953 K(o=-0.095,f=-0.75) USER MOD Single : A 71 GLN : amide:sc= -0.952 K(o=-0.95,f=-3.7!) USER MOD Single : A 72 GLN : amide:sc= 0.593 K(o=0.59,f=-0.17) USER MOD Single : A 73 THR OG1 : rot 81:sc= 1.24 USER MOD Single : A 76 GLN : amide:sc= -0.156 K(o=-0.16,f=-0.9) USER MOD Single : A 77 GLN : amide:sc= -5.29! C(o=-5.3!,f=-4.9!) USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -0.0892 X(o=-0.089,f=-0.19) USER MOD Single : A 86 GLN : amide:sc= -0.349 X(o=-0.35,f=-0.51) 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= -0.509 X(o=-0.51,f=-0.013) USER MOD Single : A 100 GLN : amide:sc= -0.0109 K(o=-0.011,f=-1.1) USER MOD Single : A 102 HIS : no HD1:sc= -0.294 X(o=-0.29,f=-0.0073) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= 0.373 X(o=0.37,f=0) USER MOD Single : A 111 GLN : amide:sc= 0.724 K(o=0.72,f=-0.59) USER MOD Single : A 113 GLN :FLIP amide:sc= -1.23 F(o=-2.7!,f=-1.2) USER MOD Single : A 115 GLN : amide:sc= -2.16 K(o=-2.2,f=-3.5!) USER MOD Single : A 116 MET CE :methyl -163:sc= -0.273 (180deg=-1.51) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HD1:sc= -0.0787 X(o=-0.079,f=-0.018) USER MOD Single : A 121 SER OG : rot -120:sc= 0 USER MOD Single : A 122 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 136 THR OG1 : rot 93:sc= 1.27 USER MOD Single : A 137 GLN : amide:sc= -0.0044 X(o=-0.0044,f=-0.0044) USER MOD Single : A 141 SER OG : rot -36:sc= 0.0129 USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 GLN : amide:sc= -0.115 X(o=-0.12,f=-0.57) USER MOD Single : A 148 SER OG : rot 170:sc= 0 USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= -0.0285 USER MOD Single : A 152 SER OG : rot 180:sc= 0.0137 USER MOD Single : A 158 GLN : amide:sc= -0.0909 X(o=-0.091,f=-0.17) USER MOD Single : A 159 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 160 GLN : amide:sc=-0.000803 K(o=-0.0008,f=-0.82) USER MOD Single : A 161 SER OG : rot 180:sc= -0.0238 USER MOD Single : A 162 SER OG : rot 39:sc= 0.0894 USER MOD Single : A 163 SER OG : rot 180:sc= 0.0353 USER MOD Single : A 164 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 165 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 166 GLN : amide:sc= -0.0491 K(o=-0.049,f=-0.58) USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 21 N MET A 2 56.773 -21.616 50.471 1.00 52.15 N ATOM 22 CA MET A 2 56.715 -22.468 49.297 1.00 65.10 C ATOM 23 C MET A 2 58.116 -22.680 48.733 1.00 31.44 C ATOM 24 O MET A 2 59.111 -22.424 49.419 1.00 61.25 O ATOM 25 CB MET A 2 55.798 -21.853 48.225 1.00 41.14 C ATOM 26 CG MET A 2 54.311 -21.898 48.560 1.00 11.10 C ATOM 27 SD MET A 2 53.820 -20.719 49.839 1.00 11.03 S ATOM 28 CE MET A 2 54.049 -19.163 48.973 1.00 11.21 C ATOM 0 HA MET A 2 56.302 -23.433 49.590 1.00 65.10 H new ATOM 0 HB2 MET A 2 56.090 -20.815 48.068 1.00 41.14 H new ATOM 0 HB3 MET A 2 55.961 -22.376 47.283 1.00 41.14 H new ATOM 0 HG2 MET A 2 53.737 -21.699 47.655 1.00 11.10 H new ATOM 0 HG3 MET A 2 54.051 -22.905 48.887 1.00 11.10 H new ATOM 0 HE1 MET A 2 53.487 -18.379 49.479 1.00 11.21 H new ATOM 0 HE2 MET A 2 55.108 -18.903 48.965 1.00 11.21 H new ATOM 0 HE3 MET A 2 53.692 -19.261 47.948 1.00 11.21 H new ATOM 38 N ALA A 3 58.192 -23.130 47.489 1.00 25.01 N ATOM 39 CA ALA A 3 59.467 -23.378 46.830 1.00 34.30 C ATOM 40 C ALA A 3 59.256 -23.600 45.342 1.00 33.41 C ATOM 41 O ALA A 3 58.624 -24.578 44.932 1.00 63.13 O ATOM 42 CB ALA A 3 60.164 -24.589 47.446 1.00 41.42 C ATOM 0 H ALA A 3 57.377 -23.333 46.910 1.00 25.01 H new ATOM 0 HA ALA A 3 60.102 -22.503 46.971 1.00 34.30 H new ATOM 0 HB1 ALA A 3 61.115 -24.758 46.940 1.00 41.42 H new ATOM 0 HB2 ALA A 3 60.344 -24.405 48.505 1.00 41.42 H new ATOM 0 HB3 ALA A 3 59.531 -25.469 47.333 1.00 41.42 H new ATOM 48 N SER A 4 59.772 -22.688 44.538 1.00 21.35 N ATOM 49 CA SER A 4 59.638 -22.762 43.092 1.00 41.34 C ATOM 50 C SER A 4 60.732 -21.942 42.416 1.00 53.21 C ATOM 51 O SER A 4 60.915 -20.754 42.714 1.00 72.44 O ATOM 52 CB SER A 4 58.260 -22.242 42.651 1.00 62.21 C ATOM 53 OG SER A 4 57.209 -22.949 43.293 1.00 50.21 O ATOM 0 H SER A 4 60.295 -21.876 44.867 1.00 21.35 H new ATOM 0 HA SER A 4 59.736 -23.806 42.794 1.00 41.34 H new ATOM 0 HB2 SER A 4 58.180 -21.180 42.881 1.00 62.21 H new ATOM 0 HB3 SER A 4 58.161 -22.342 41.570 1.00 62.21 H new ATOM 0 HG SER A 4 56.346 -22.595 42.994 1.00 50.21 H new ATOM 59 N ASP A 5 61.460 -22.577 41.524 1.00 44.42 N ATOM 60 CA ASP A 5 62.533 -21.920 40.796 1.00 62.55 C ATOM 61 C ASP A 5 61.960 -21.138 39.608 1.00 52.54 C ATOM 62 O ASP A 5 62.242 -19.950 39.437 1.00 11.23 O ATOM 63 CB ASP A 5 63.546 -22.957 40.321 1.00 44.04 C ATOM 64 CG ASP A 5 64.765 -22.338 39.693 1.00 50.33 C ATOM 65 OD1 ASP A 5 64.737 -22.067 38.494 1.00 64.31 O ATOM 66 OD2 ASP A 5 65.767 -22.133 40.402 1.00 5.11 O ATOM 0 H ASP A 5 61.329 -23.559 41.281 1.00 44.42 H new ATOM 0 HA ASP A 5 63.039 -21.217 41.458 1.00 62.55 H new ATOM 0 HB2 ASP A 5 63.852 -23.573 41.167 1.00 44.04 H new ATOM 0 HB3 ASP A 5 63.069 -23.620 39.600 1.00 44.04 H new ATOM 71 N ASP A 6 61.145 -21.827 38.801 1.00 0.25 N ATOM 72 CA ASP A 6 60.437 -21.221 37.648 1.00 72.44 C ATOM 73 C ASP A 6 61.375 -20.713 36.550 1.00 4.24 C ATOM 74 O ASP A 6 61.004 -19.824 35.781 1.00 73.12 O ATOM 75 CB ASP A 6 59.499 -20.085 38.099 1.00 23.42 C ATOM 76 CG ASP A 6 58.255 -20.586 38.800 1.00 71.40 C ATOM 77 OD1 ASP A 6 57.444 -21.285 38.154 1.00 64.31 O ATOM 78 OD2 ASP A 6 58.066 -20.269 39.994 1.00 33.04 O ATOM 0 H ASP A 6 60.952 -22.821 38.922 1.00 0.25 H new ATOM 0 HA ASP A 6 59.848 -22.030 37.216 1.00 72.44 H new ATOM 0 HB2 ASP A 6 60.042 -19.417 38.768 1.00 23.42 H new ATOM 0 HB3 ASP A 6 59.207 -19.496 37.229 1.00 23.42 H new ATOM 83 N ARG A 7 62.566 -21.283 36.453 1.00 13.54 N ATOM 84 CA ARG A 7 63.511 -20.877 35.411 1.00 14.21 C ATOM 85 C ARG A 7 63.019 -21.331 34.036 1.00 21.24 C ATOM 86 O ARG A 7 62.259 -22.303 33.926 1.00 21.32 O ATOM 87 CB ARG A 7 64.896 -21.462 35.677 1.00 11.40 C ATOM 88 CG ARG A 7 66.003 -20.854 34.839 1.00 21.42 C ATOM 89 CD ARG A 7 67.322 -21.551 35.091 1.00 54.24 C ATOM 90 NE ARG A 7 68.414 -20.952 34.328 1.00 44.52 N ATOM 91 CZ ARG A 7 69.676 -21.383 34.364 1.00 34.44 C ATOM 92 NH1 ARG A 7 70.005 -22.429 35.112 1.00 12.22 N ATOM 93 NH2 ARG A 7 70.605 -20.771 33.649 1.00 63.43 N ATOM 0 H ARG A 7 62.903 -22.020 37.072 1.00 13.54 H new ATOM 0 HA ARG A 7 63.579 -19.789 35.426 1.00 14.21 H new ATOM 0 HB2 ARG A 7 65.138 -21.326 36.731 1.00 11.40 H new ATOM 0 HB3 ARG A 7 64.865 -22.536 35.493 1.00 11.40 H new ATOM 0 HG2 ARG A 7 65.746 -20.927 33.782 1.00 21.42 H new ATOM 0 HG3 ARG A 7 66.098 -19.793 35.071 1.00 21.42 H new ATOM 0 HD2 ARG A 7 67.557 -21.508 36.154 1.00 54.24 H new ATOM 0 HD3 ARG A 7 67.231 -22.605 34.827 1.00 54.24 H new ATOM 0 HE ARG A 7 68.198 -20.154 33.730 1.00 44.52 H new ATOM 0 HH11 ARG A 7 69.292 -22.907 35.662 1.00 12.22 H new ATOM 0 HH12 ARG A 7 70.971 -22.755 35.136 1.00 12.22 H new ATOM 0 HH21 ARG A 7 70.357 -19.969 33.070 1.00 63.43 H new ATOM 0 HH22 ARG A 7 71.570 -21.101 33.677 1.00 63.43 H new ATOM 107 N ALA A 8 63.454 -20.636 33.000 1.00 71.10 N ATOM 108 CA ALA A 8 63.070 -20.954 31.637 1.00 41.12 C ATOM 109 C ALA A 8 64.026 -20.290 30.657 1.00 42.13 C ATOM 110 O ALA A 8 63.609 -19.680 29.671 1.00 40.21 O ATOM 111 CB ALA A 8 61.639 -20.502 31.378 1.00 0.44 C ATOM 0 H ALA A 8 64.082 -19.837 33.080 1.00 71.10 H new ATOM 0 HA ALA A 8 63.123 -22.033 31.495 1.00 41.12 H new ATOM 0 HB1 ALA A 8 61.361 -20.745 30.353 1.00 0.44 H new ATOM 0 HB2 ALA A 8 60.966 -21.012 32.067 1.00 0.44 H new ATOM 0 HB3 ALA A 8 61.565 -19.425 31.528 1.00 0.44 H new ATOM 117 N THR A 9 65.308 -20.431 30.926 1.00 62.41 N ATOM 118 CA THR A 9 66.329 -19.832 30.104 1.00 54.44 C ATOM 119 C THR A 9 66.678 -20.750 28.933 1.00 43.15 C ATOM 120 O THR A 9 67.571 -21.598 29.035 1.00 43.10 O ATOM 121 CB THR A 9 67.603 -19.557 30.925 1.00 23.24 C ATOM 122 OG1 THR A 9 67.246 -19.040 32.220 1.00 51.21 O ATOM 123 CG2 THR A 9 68.495 -18.552 30.211 1.00 42.32 C ATOM 0 H THR A 9 65.666 -20.963 31.719 1.00 62.41 H new ATOM 0 HA THR A 9 65.938 -18.888 29.724 1.00 54.44 H new ATOM 0 HB THR A 9 68.148 -20.494 31.039 1.00 23.24 H new ATOM 0 HG1 THR A 9 68.011 -18.563 32.604 1.00 51.21 H new ATOM 0 HG21 THR A 9 69.389 -18.371 30.807 1.00 42.32 H new ATOM 0 HG22 THR A 9 68.782 -18.948 29.237 1.00 42.32 H new ATOM 0 HG23 THR A 9 67.953 -17.616 30.077 1.00 42.32 H new ATOM 131 N GLY A 10 65.953 -20.604 27.842 1.00 43.04 N ATOM 132 CA GLY A 10 66.208 -21.413 26.676 1.00 4.12 C ATOM 133 C GLY A 10 66.615 -20.579 25.484 1.00 14.42 C ATOM 134 O GLY A 10 67.073 -19.447 25.647 1.00 23.10 O ATOM 0 H GLY A 10 65.188 -19.936 27.742 1.00 43.04 H new ATOM 0 HA2 GLY A 10 66.995 -22.133 26.900 1.00 4.12 H new ATOM 0 HA3 GLY A 10 65.313 -21.985 26.429 1.00 4.12 H new ATOM 138 N PRO A 11 66.469 -21.113 24.270 1.00 22.34 N ATOM 139 CA PRO A 11 66.814 -20.397 23.046 1.00 1.43 C ATOM 140 C PRO A 11 65.690 -19.477 22.592 1.00 34.45 C ATOM 141 O PRO A 11 64.595 -19.496 23.158 1.00 31.22 O ATOM 142 CB PRO A 11 67.014 -21.527 22.044 1.00 3.13 C ATOM 143 CG PRO A 11 66.068 -22.592 22.490 1.00 34.35 C ATOM 144 CD PRO A 11 65.954 -22.467 23.990 1.00 14.04 C ATOM 0 HA PRO A 11 67.683 -19.750 23.167 1.00 1.43 H new ATOM 0 HB2 PRO A 11 66.794 -21.200 21.028 1.00 3.13 H new ATOM 0 HB3 PRO A 11 68.044 -21.884 22.048 1.00 3.13 H new ATOM 0 HG2 PRO A 11 65.094 -22.469 22.016 1.00 34.35 H new ATOM 0 HG3 PRO A 11 66.436 -23.579 22.210 1.00 34.35 H new ATOM 0 HD2 PRO A 11 64.922 -22.580 24.324 1.00 14.04 H new ATOM 0 HD3 PRO A 11 66.540 -23.231 24.501 1.00 14.04 H new ATOM 209 N LEU A 16 62.694 -9.948 12.960 1.00 53.40 N ATOM 210 CA LEU A 16 63.184 -8.813 12.202 1.00 22.15 C ATOM 211 C LEU A 16 62.349 -8.609 10.956 1.00 15.30 C ATOM 212 O LEU A 16 61.745 -9.549 10.443 1.00 4.43 O ATOM 213 CB LEU A 16 64.675 -8.988 11.818 1.00 5.31 C ATOM 214 CG LEU A 16 65.002 -10.038 10.732 1.00 42.42 C ATOM 215 CD1 LEU A 16 66.446 -9.900 10.283 1.00 72.34 C ATOM 216 CD2 LEU A 16 64.749 -11.455 11.236 1.00 72.21 C ATOM 0 HA LEU A 16 63.100 -7.931 12.837 1.00 22.15 H new ATOM 0 HB2 LEU A 16 65.053 -8.023 11.481 1.00 5.31 H new ATOM 0 HB3 LEU A 16 65.228 -9.250 12.720 1.00 5.31 H new ATOM 0 HG LEU A 16 64.342 -9.855 9.884 1.00 42.42 H new ATOM 0 HD11 LEU A 16 66.662 -10.646 9.518 1.00 72.34 H new ATOM 0 HD12 LEU A 16 66.606 -8.903 9.873 1.00 72.34 H new ATOM 0 HD13 LEU A 16 67.108 -10.052 11.135 1.00 72.34 H new ATOM 0 HD21 LEU A 16 64.989 -12.169 10.448 1.00 72.21 H new ATOM 0 HD22 LEU A 16 65.377 -11.649 12.106 1.00 72.21 H new ATOM 0 HD23 LEU A 16 63.700 -11.560 11.515 1.00 72.21 H new ATOM 228 N VAL A 17 62.316 -7.386 10.477 1.00 5.32 N ATOM 229 CA VAL A 17 61.563 -7.044 9.291 1.00 2.35 C ATOM 230 C VAL A 17 62.289 -5.950 8.518 1.00 73.01 C ATOM 231 O VAL A 17 62.882 -5.047 9.110 1.00 2.42 O ATOM 232 CB VAL A 17 60.115 -6.582 9.651 1.00 63.11 C ATOM 233 CG1 VAL A 17 60.134 -5.390 10.599 1.00 54.52 C ATOM 234 CG2 VAL A 17 59.313 -6.258 8.396 1.00 41.05 C ATOM 0 H VAL A 17 62.811 -6.600 10.899 1.00 5.32 H new ATOM 0 HA VAL A 17 61.482 -7.935 8.668 1.00 2.35 H new ATOM 0 HB VAL A 17 59.625 -7.411 10.162 1.00 63.11 H new ATOM 0 HG11 VAL A 17 59.111 -5.093 10.830 1.00 54.52 H new ATOM 0 HG12 VAL A 17 60.649 -5.665 11.520 1.00 54.52 H new ATOM 0 HG13 VAL A 17 60.656 -4.558 10.127 1.00 54.52 H new ATOM 0 HG21 VAL A 17 58.309 -5.939 8.678 1.00 41.05 H new ATOM 0 HG22 VAL A 17 59.807 -5.457 7.845 1.00 41.05 H new ATOM 0 HG23 VAL A 17 59.249 -7.145 7.766 1.00 41.05 H new ATOM 244 N VAL A 18 62.268 -6.051 7.204 1.00 52.55 N ATOM 245 CA VAL A 18 62.923 -5.076 6.360 1.00 54.31 C ATOM 246 C VAL A 18 62.003 -3.885 6.136 1.00 52.45 C ATOM 247 O VAL A 18 60.931 -4.017 5.530 1.00 41.55 O ATOM 248 CB VAL A 18 63.323 -5.687 4.997 1.00 43.13 C ATOM 249 CG1 VAL A 18 64.107 -4.684 4.166 1.00 41.04 C ATOM 250 CG2 VAL A 18 64.128 -6.962 5.197 1.00 13.21 C ATOM 0 H VAL A 18 61.801 -6.803 6.697 1.00 52.55 H new ATOM 0 HA VAL A 18 63.832 -4.750 6.866 1.00 54.31 H new ATOM 0 HB VAL A 18 62.411 -5.938 4.456 1.00 43.13 H new ATOM 0 HG11 VAL A 18 64.378 -5.135 3.211 1.00 41.04 H new ATOM 0 HG12 VAL A 18 63.494 -3.800 3.989 1.00 41.04 H new ATOM 0 HG13 VAL A 18 65.012 -4.396 4.701 1.00 41.04 H new ATOM 0 HG21 VAL A 18 64.400 -7.377 4.226 1.00 13.21 H new ATOM 0 HG22 VAL A 18 65.033 -6.736 5.761 1.00 13.21 H new ATOM 0 HG23 VAL A 18 63.529 -7.688 5.747 1.00 13.21 H new ATOM 260 N ALA A 19 62.421 -2.732 6.635 1.00 62.33 N ATOM 261 CA ALA A 19 61.637 -1.514 6.533 1.00 4.22 C ATOM 262 C ALA A 19 62.487 -0.300 6.887 1.00 44.51 C ATOM 263 O ALA A 19 62.691 0.007 8.066 1.00 63.41 O ATOM 264 CB ALA A 19 60.419 -1.591 7.450 1.00 52.00 C ATOM 0 H ALA A 19 63.311 -2.616 7.120 1.00 62.33 H new ATOM 0 HA ALA A 19 61.295 -1.409 5.503 1.00 4.22 H new ATOM 0 HB1 ALA A 19 59.840 -0.672 7.364 1.00 52.00 H new ATOM 0 HB2 ALA A 19 59.799 -2.439 7.160 1.00 52.00 H new ATOM 0 HB3 ALA A 19 60.748 -1.717 8.482 1.00 52.00 H new ATOM 270 N ALA A 20 63.003 0.364 5.871 1.00 23.32 N ATOM 271 CA ALA A 20 63.824 1.549 6.061 1.00 52.21 C ATOM 272 C ALA A 20 62.968 2.735 6.481 1.00 4.04 C ATOM 273 O ALA A 20 63.219 3.364 7.513 1.00 64.33 O ATOM 274 CB ALA A 20 64.595 1.871 4.788 1.00 61.42 C ATOM 0 H ALA A 20 62.867 0.101 4.895 1.00 23.32 H new ATOM 0 HA ALA A 20 64.540 1.346 6.858 1.00 52.21 H new ATOM 0 HB1 ALA A 20 65.205 2.761 4.947 1.00 61.42 H new ATOM 0 HB2 ALA A 20 65.240 1.031 4.531 1.00 61.42 H new ATOM 0 HB3 ALA A 20 63.893 2.053 3.974 1.00 61.42 H new ATOM 280 N ALA A 21 61.937 3.012 5.694 1.00 14.02 N ATOM 281 CA ALA A 21 61.038 4.129 5.947 1.00 10.44 C ATOM 282 C ALA A 21 59.810 4.025 5.054 1.00 61.53 C ATOM 283 O ALA A 21 59.913 3.615 3.896 1.00 33.22 O ATOM 284 CB ALA A 21 61.754 5.450 5.696 1.00 21.23 C ATOM 0 H ALA A 21 61.701 2.469 4.863 1.00 14.02 H new ATOM 0 HA ALA A 21 60.722 4.093 6.990 1.00 10.44 H new ATOM 0 HB1 ALA A 21 61.070 6.277 5.889 1.00 21.23 H new ATOM 0 HB2 ALA A 21 62.615 5.529 6.360 1.00 21.23 H new ATOM 0 HB3 ALA A 21 62.089 5.491 4.660 1.00 21.23 H new ATOM 290 N ALA A 22 58.656 4.398 5.590 1.00 52.21 N ATOM 291 CA ALA A 22 57.401 4.340 4.851 1.00 51.32 C ATOM 292 C ALA A 22 56.326 5.140 5.554 1.00 22.31 C ATOM 293 O ALA A 22 55.936 4.826 6.680 1.00 2.41 O ATOM 294 CB ALA A 22 56.949 2.896 4.673 1.00 22.32 C ATOM 0 H ALA A 22 58.563 4.747 6.544 1.00 52.21 H new ATOM 0 HA ALA A 22 57.569 4.777 3.867 1.00 51.32 H new ATOM 0 HB1 ALA A 22 56.011 2.874 4.119 1.00 22.32 H new ATOM 0 HB2 ALA A 22 57.709 2.342 4.122 1.00 22.32 H new ATOM 0 HB3 ALA A 22 56.804 2.437 5.651 1.00 22.32 H new ATOM 300 N THR A 23 55.862 6.186 4.905 1.00 52.20 N ATOM 301 CA THR A 23 54.814 7.027 5.454 1.00 51.14 C ATOM 302 C THR A 23 54.029 7.669 4.306 1.00 14.15 C ATOM 303 O THR A 23 53.583 8.814 4.390 1.00 5.15 O ATOM 304 CB THR A 23 55.402 8.132 6.373 1.00 31.32 C ATOM 305 OG1 THR A 23 56.479 7.590 7.156 1.00 41.31 O ATOM 306 CG2 THR A 23 54.336 8.660 7.318 1.00 73.12 C ATOM 0 H THR A 23 56.197 6.478 3.987 1.00 52.20 H new ATOM 0 HA THR A 23 54.152 6.406 6.057 1.00 51.14 H new ATOM 0 HB THR A 23 55.765 8.944 5.743 1.00 31.32 H new ATOM 0 HG1 THR A 23 56.848 8.290 7.733 1.00 41.31 H new ATOM 0 HG21 THR A 23 54.765 9.434 7.955 1.00 73.12 H new ATOM 0 HG22 THR A 23 53.513 9.081 6.740 1.00 73.12 H new ATOM 0 HG23 THR A 23 53.964 7.845 7.938 1.00 73.12 H new ATOM 314 N SER A 24 53.861 6.908 3.235 1.00 22.44 N ATOM 315 CA SER A 24 53.143 7.373 2.068 1.00 73.20 C ATOM 316 C SER A 24 51.645 7.441 2.352 1.00 43.02 C ATOM 317 O SER A 24 50.929 6.444 2.224 1.00 20.34 O ATOM 318 CB SER A 24 53.419 6.451 0.884 1.00 5.24 C ATOM 319 OG SER A 24 54.819 6.281 0.694 1.00 74.44 O ATOM 0 H SER A 24 54.218 5.956 3.155 1.00 22.44 H new ATOM 0 HA SER A 24 53.490 8.376 1.821 1.00 73.20 H new ATOM 0 HB2 SER A 24 52.950 5.482 1.054 1.00 5.24 H new ATOM 0 HB3 SER A 24 52.972 6.867 -0.019 1.00 5.24 H new ATOM 0 HG SER A 24 54.976 5.685 -0.068 1.00 74.44 H new ATOM 325 N ALA A 25 51.187 8.614 2.751 1.00 34.21 N ATOM 326 CA ALA A 25 49.788 8.840 3.065 1.00 63.43 C ATOM 327 C ALA A 25 49.508 10.328 3.170 1.00 0.43 C ATOM 328 O ALA A 25 49.383 10.878 4.267 1.00 1.41 O ATOM 329 CB ALA A 25 49.397 8.133 4.360 1.00 34.14 C ATOM 0 H ALA A 25 51.776 9.438 2.867 1.00 34.21 H new ATOM 0 HA ALA A 25 49.186 8.424 2.258 1.00 63.43 H new ATOM 0 HB1 ALA A 25 48.344 8.319 4.572 1.00 34.14 H new ATOM 0 HB2 ALA A 25 49.562 7.061 4.253 1.00 34.14 H new ATOM 0 HB3 ALA A 25 50.005 8.514 5.180 1.00 34.14 H new ATOM 335 N LYS A 26 49.443 10.979 2.024 1.00 14.13 N ATOM 336 CA LYS A 26 49.202 12.406 1.962 1.00 35.03 C ATOM 337 C LYS A 26 48.712 12.768 0.560 1.00 31.10 C ATOM 338 O LYS A 26 49.456 12.642 -0.414 1.00 55.02 O ATOM 339 CB LYS A 26 50.503 13.175 2.294 1.00 21.44 C ATOM 340 CG LYS A 26 50.293 14.574 2.877 1.00 51.23 C ATOM 341 CD LYS A 26 49.630 15.514 1.887 1.00 22.52 C ATOM 342 CE LYS A 26 49.223 16.821 2.544 1.00 4.33 C ATOM 343 NZ LYS A 26 48.528 17.720 1.589 1.00 70.23 N ATOM 0 H LYS A 26 49.556 10.534 1.113 1.00 14.13 H new ATOM 0 HA LYS A 26 48.442 12.684 2.692 1.00 35.03 H new ATOM 0 HB2 LYS A 26 51.086 12.586 3.002 1.00 21.44 H new ATOM 0 HB3 LYS A 26 51.099 13.261 1.385 1.00 21.44 H new ATOM 0 HG2 LYS A 26 49.679 14.503 3.775 1.00 51.23 H new ATOM 0 HG3 LYS A 26 51.255 14.988 3.180 1.00 51.23 H new ATOM 0 HD2 LYS A 26 50.314 15.718 1.063 1.00 22.52 H new ATOM 0 HD3 LYS A 26 48.751 15.032 1.459 1.00 22.52 H new ATOM 0 HE2 LYS A 26 48.569 16.615 3.392 1.00 4.33 H new ATOM 0 HE3 LYS A 26 50.107 17.322 2.938 1.00 4.33 H new ATOM 0 HZ1 LYS A 26 47.812 18.279 2.096 1.00 70.23 H new ATOM 0 HZ2 LYS A 26 49.219 18.360 1.149 1.00 70.23 H new ATOM 0 HZ3 LYS A 26 48.065 17.152 0.852 1.00 70.23 H new ATOM 357 N VAL A 27 47.470 13.204 0.461 1.00 11.04 N ATOM 358 CA VAL A 27 46.900 13.572 -0.827 1.00 42.34 C ATOM 359 C VAL A 27 47.255 15.006 -1.192 1.00 63.51 C ATOM 360 O VAL A 27 47.337 15.882 -0.318 1.00 21.15 O ATOM 361 CB VAL A 27 45.364 13.393 -0.861 1.00 62.40 C ATOM 362 CG1 VAL A 27 44.999 11.924 -0.770 1.00 64.33 C ATOM 363 CG2 VAL A 27 44.699 14.177 0.259 1.00 51.33 C ATOM 0 H VAL A 27 46.836 13.313 1.253 1.00 11.04 H new ATOM 0 HA VAL A 27 47.335 12.895 -1.562 1.00 42.34 H new ATOM 0 HB VAL A 27 44.999 13.784 -1.811 1.00 62.40 H new ATOM 0 HG11 VAL A 27 43.915 11.816 -0.795 1.00 64.33 H new ATOM 0 HG12 VAL A 27 45.437 11.388 -1.612 1.00 64.33 H new ATOM 0 HG13 VAL A 27 45.383 11.511 0.163 1.00 64.33 H new ATOM 0 HG21 VAL A 27 43.619 14.034 0.212 1.00 51.33 H new ATOM 0 HG22 VAL A 27 45.071 13.824 1.221 1.00 51.33 H new ATOM 0 HG23 VAL A 27 44.930 15.237 0.148 1.00 51.33 H new ATOM 799 N VAL A 60 11.119 8.838 -1.256 1.00 22.15 N ATOM 800 CA VAL A 60 9.855 9.508 -1.032 1.00 64.10 C ATOM 801 C VAL A 60 9.344 10.098 -2.331 1.00 34.40 C ATOM 802 O VAL A 60 10.113 10.308 -3.274 1.00 32.34 O ATOM 803 CB VAL A 60 9.970 10.620 0.037 1.00 11.53 C ATOM 804 CG1 VAL A 60 10.303 10.020 1.391 1.00 20.11 C ATOM 805 CG2 VAL A 60 11.016 11.652 -0.362 1.00 3.01 C ATOM 0 HA VAL A 60 9.151 8.763 -0.662 1.00 64.10 H new ATOM 0 HB VAL A 60 9.007 11.125 0.108 1.00 11.53 H new ATOM 0 HG11 VAL A 60 10.381 10.815 2.132 1.00 20.11 H new ATOM 0 HG12 VAL A 60 9.516 9.326 1.685 1.00 20.11 H new ATOM 0 HG13 VAL A 60 11.252 9.488 1.330 1.00 20.11 H new ATOM 0 HG21 VAL A 60 11.078 12.423 0.406 1.00 3.01 H new ATOM 0 HG22 VAL A 60 11.986 11.165 -0.467 1.00 3.01 H new ATOM 0 HG23 VAL A 60 10.734 12.107 -1.311 1.00 3.01 H new ATOM 815 N LEU A 61 8.062 10.368 -2.389 1.00 23.21 N ATOM 816 CA LEU A 61 7.476 10.888 -3.595 1.00 22.20 C ATOM 817 C LEU A 61 7.480 12.411 -3.588 1.00 41.44 C ATOM 818 O LEU A 61 6.529 13.057 -3.133 1.00 70.22 O ATOM 819 CB LEU A 61 6.063 10.326 -3.782 1.00 63.52 C ATOM 820 CG LEU A 61 5.314 10.753 -5.045 1.00 22.02 C ATOM 821 CD1 LEU A 61 6.177 10.553 -6.275 1.00 74.34 C ATOM 822 CD2 LEU A 61 4.026 9.962 -5.176 1.00 41.43 C ATOM 0 H LEU A 61 7.409 10.236 -1.617 1.00 23.21 H new ATOM 0 HA LEU A 61 8.079 10.568 -4.445 1.00 22.20 H new ATOM 0 HB2 LEU A 61 6.126 9.238 -3.776 1.00 63.52 H new ATOM 0 HB3 LEU A 61 5.465 10.615 -2.918 1.00 63.52 H new ATOM 0 HG LEU A 61 5.075 11.813 -4.963 1.00 22.02 H new ATOM 0 HD11 LEU A 61 5.624 10.863 -7.162 1.00 74.34 H new ATOM 0 HD12 LEU A 61 7.083 11.152 -6.185 1.00 74.34 H new ATOM 0 HD13 LEU A 61 6.445 9.500 -6.364 1.00 74.34 H new ATOM 0 HD21 LEU A 61 3.499 10.272 -6.078 1.00 41.43 H new ATOM 0 HD22 LEU A 61 4.257 8.899 -5.238 1.00 41.43 H new ATOM 0 HD23 LEU A 61 3.396 10.146 -4.306 1.00 41.43 H new ATOM 834 N SER A 62 8.570 12.976 -4.068 1.00 33.45 N ATOM 835 CA SER A 62 8.707 14.409 -4.154 1.00 20.55 C ATOM 836 C SER A 62 8.606 14.860 -5.603 1.00 54.43 C ATOM 837 O SER A 62 9.607 15.191 -6.241 1.00 33.30 O ATOM 838 CB SER A 62 10.040 14.854 -3.547 1.00 74.44 C ATOM 839 OG SER A 62 10.161 14.409 -2.204 1.00 31.32 O ATOM 0 H SER A 62 9.379 12.455 -4.406 1.00 33.45 H new ATOM 0 HA SER A 62 7.899 14.872 -3.588 1.00 20.55 H new ATOM 0 HB2 SER A 62 10.864 14.458 -4.141 1.00 74.44 H new ATOM 0 HB3 SER A 62 10.115 15.941 -3.582 1.00 74.44 H new ATOM 0 HG SER A 62 11.021 14.704 -1.838 1.00 31.32 H new ATOM 845 N ALA A 63 7.402 14.833 -6.123 1.00 74.22 N ATOM 846 CA ALA A 63 7.143 15.243 -7.483 1.00 62.21 C ATOM 847 C ALA A 63 5.884 16.092 -7.527 1.00 40.41 C ATOM 848 O ALA A 63 5.052 16.005 -6.619 1.00 71.43 O ATOM 849 CB ALA A 63 7.005 14.019 -8.384 1.00 30.30 C ATOM 0 H ALA A 63 6.573 14.526 -5.614 1.00 74.22 H new ATOM 0 HA ALA A 63 7.980 15.839 -7.848 1.00 62.21 H new ATOM 0 HB1 ALA A 63 6.810 14.340 -9.407 1.00 30.30 H new ATOM 0 HB2 ALA A 63 7.928 13.440 -8.355 1.00 30.30 H new ATOM 0 HB3 ALA A 63 6.178 13.401 -8.034 1.00 30.30 H new ATOM 855 N PRO A 64 5.730 16.946 -8.553 1.00 61.54 N ATOM 856 CA PRO A 64 4.528 17.768 -8.708 1.00 55.33 C ATOM 857 C PRO A 64 3.279 16.899 -8.835 1.00 41.34 C ATOM 858 O PRO A 64 3.249 15.950 -9.625 1.00 14.02 O ATOM 859 CB PRO A 64 4.779 18.535 -10.014 1.00 74.21 C ATOM 860 CG PRO A 64 6.256 18.502 -10.198 1.00 64.51 C ATOM 861 CD PRO A 64 6.710 17.194 -9.624 1.00 54.33 C ATOM 0 HA PRO A 64 4.356 18.420 -7.852 1.00 55.33 H new ATOM 0 HB2 PRO A 64 4.265 18.066 -10.853 1.00 74.21 H new ATOM 0 HB3 PRO A 64 4.412 19.559 -9.948 1.00 74.21 H new ATOM 0 HG2 PRO A 64 6.520 18.579 -11.253 1.00 64.51 H new ATOM 0 HG3 PRO A 64 6.732 19.339 -9.688 1.00 64.51 H new ATOM 0 HD2 PRO A 64 6.701 16.400 -10.371 1.00 54.33 H new ATOM 0 HD3 PRO A 64 7.726 17.255 -9.235 1.00 54.33 H new ATOM 869 N LEU A 65 2.252 17.229 -8.071 1.00 30.13 N ATOM 870 CA LEU A 65 1.022 16.455 -8.082 1.00 35.33 C ATOM 871 C LEU A 65 0.310 16.601 -9.420 1.00 21.21 C ATOM 872 O LEU A 65 0.228 17.693 -9.976 1.00 65.42 O ATOM 873 CB LEU A 65 0.080 16.876 -6.937 1.00 4.42 C ATOM 874 CG LEU A 65 -0.413 18.335 -6.954 1.00 1.10 C ATOM 875 CD1 LEU A 65 -1.760 18.446 -6.267 1.00 14.25 C ATOM 876 CD2 LEU A 65 0.592 19.257 -6.272 1.00 2.01 C ATOM 0 H LEU A 65 2.245 18.027 -7.436 1.00 30.13 H new ATOM 0 HA LEU A 65 1.292 15.409 -7.933 1.00 35.33 H new ATOM 0 HB2 LEU A 65 -0.791 16.221 -6.954 1.00 4.42 H new ATOM 0 HB3 LEU A 65 0.593 16.700 -5.991 1.00 4.42 H new ATOM 0 HG LEU A 65 -0.517 18.643 -7.995 1.00 1.10 H new ATOM 0 HD11 LEU A 65 -2.094 19.483 -6.287 1.00 14.25 H new ATOM 0 HD12 LEU A 65 -2.486 17.820 -6.786 1.00 14.25 H new ATOM 0 HD13 LEU A 65 -1.669 18.114 -5.233 1.00 14.25 H new ATOM 0 HD21 LEU A 65 0.221 20.282 -6.297 1.00 2.01 H new ATOM 0 HD22 LEU A 65 0.727 18.945 -5.236 1.00 2.01 H new ATOM 0 HD23 LEU A 65 1.547 19.204 -6.795 1.00 2.01 H new ATOM 888 N GLY A 66 -0.175 15.489 -9.941 1.00 52.51 N ATOM 889 CA GLY A 66 -0.858 15.504 -11.218 1.00 22.12 C ATOM 890 C GLY A 66 0.031 14.999 -12.333 1.00 55.43 C ATOM 891 O GLY A 66 -0.450 14.415 -13.308 1.00 21.13 O ATOM 0 H GLY A 66 -0.109 14.571 -9.502 1.00 52.51 H new ATOM 0 HA2 GLY A 66 -1.754 14.886 -11.159 1.00 22.12 H new ATOM 0 HA3 GLY A 66 -1.185 16.519 -11.444 1.00 22.12 H new ATOM 895 N SER A 67 1.331 15.234 -12.187 1.00 34.10 N ATOM 896 CA SER A 67 2.321 14.798 -13.159 1.00 45.42 C ATOM 897 C SER A 67 2.305 13.277 -13.321 1.00 21.30 C ATOM 898 O SER A 67 2.062 12.541 -12.359 1.00 55.32 O ATOM 899 CB SER A 67 3.717 15.265 -12.731 1.00 41.40 C ATOM 900 OG SER A 67 4.719 14.772 -13.606 1.00 11.43 O ATOM 0 H SER A 67 1.726 15.733 -11.390 1.00 34.10 H new ATOM 0 HA SER A 67 2.070 15.244 -14.121 1.00 45.42 H new ATOM 0 HB2 SER A 67 3.749 16.354 -12.716 1.00 41.40 H new ATOM 0 HB3 SER A 67 3.920 14.926 -11.715 1.00 41.40 H new ATOM 0 HG SER A 67 5.598 15.088 -13.308 1.00 11.43 H new ATOM 906 N HIS A 68 2.572 12.811 -14.534 1.00 25.24 N ATOM 907 CA HIS A 68 2.621 11.386 -14.800 1.00 52.14 C ATOM 908 C HIS A 68 3.854 10.795 -14.125 1.00 15.14 C ATOM 909 O HIS A 68 3.862 9.631 -13.742 1.00 63.11 O ATOM 910 CB HIS A 68 2.643 11.113 -16.312 1.00 63.03 C ATOM 911 CG HIS A 68 2.321 9.690 -16.689 1.00 73.12 C ATOM 912 ND1 HIS A 68 1.078 9.292 -17.131 1.00 71.05 N ATOM 913 CD2 HIS A 68 3.092 8.576 -16.700 1.00 51.15 C ATOM 914 CE1 HIS A 68 1.098 8.000 -17.396 1.00 34.54 C ATOM 915 NE2 HIS A 68 2.308 7.543 -17.144 1.00 54.34 N ATOM 0 H HIS A 68 2.757 13.401 -15.346 1.00 25.24 H new ATOM 0 HA HIS A 68 1.727 10.913 -14.394 1.00 52.14 H new ATOM 0 HB2 HIS A 68 1.929 11.776 -16.800 1.00 63.03 H new ATOM 0 HB3 HIS A 68 3.630 11.365 -16.701 1.00 63.03 H new ATOM 0 HD2 HIS A 68 4.131 8.514 -16.412 1.00 51.15 H new ATOM 0 HE1 HIS A 68 0.265 7.416 -17.758 1.00 34.54 H new ATOM 0 HE2 HIS A 68 2.612 6.576 -17.261 1.00 54.34 H new ATOM 924 N GLU A 69 4.895 11.625 -13.986 1.00 15.01 N ATOM 925 CA GLU A 69 6.117 11.227 -13.286 1.00 75.42 C ATOM 926 C GLU A 69 5.801 10.907 -11.830 1.00 71.13 C ATOM 927 O GLU A 69 6.322 9.946 -11.262 1.00 62.40 O ATOM 928 CB GLU A 69 7.168 12.338 -13.351 1.00 71.40 C ATOM 929 CG GLU A 69 8.429 12.022 -12.562 1.00 42.22 C ATOM 930 CD GLU A 69 9.398 13.174 -12.516 1.00 34.53 C ATOM 931 OE1 GLU A 69 9.287 14.015 -11.605 1.00 73.43 O ATOM 932 OE2 GLU A 69 10.293 13.240 -13.385 1.00 14.04 O ATOM 0 H GLU A 69 4.913 12.577 -14.351 1.00 15.01 H new ATOM 0 HA GLU A 69 6.518 10.340 -13.776 1.00 75.42 H new ATOM 0 HB2 GLU A 69 7.435 12.515 -14.393 1.00 71.40 H new ATOM 0 HB3 GLU A 69 6.733 13.263 -12.972 1.00 71.40 H new ATOM 0 HG2 GLU A 69 8.154 11.744 -11.544 1.00 42.22 H new ATOM 0 HG3 GLU A 69 8.922 11.157 -13.006 1.00 42.22 H new ATOM 939 N TRP A 70 4.927 11.712 -11.247 1.00 45.13 N ATOM 940 CA TRP A 70 4.494 11.528 -9.871 1.00 44.53 C ATOM 941 C TRP A 70 3.740 10.211 -9.749 1.00 53.34 C ATOM 942 O TRP A 70 3.946 9.449 -8.805 1.00 65.13 O ATOM 943 CB TRP A 70 3.580 12.710 -9.492 1.00 22.15 C ATOM 944 CG TRP A 70 3.040 12.691 -8.092 1.00 1.20 C ATOM 945 CD1 TRP A 70 3.571 13.312 -7.003 1.00 74.33 C ATOM 946 CD2 TRP A 70 1.850 12.037 -7.638 1.00 41.33 C ATOM 947 NE1 TRP A 70 2.792 13.081 -5.901 1.00 2.14 N ATOM 948 CE2 TRP A 70 1.731 12.299 -6.262 1.00 3.42 C ATOM 949 CE3 TRP A 70 0.875 11.253 -8.259 1.00 3.43 C ATOM 950 CZ2 TRP A 70 0.681 11.808 -5.500 1.00 64.10 C ATOM 951 CZ3 TRP A 70 -0.165 10.764 -7.501 1.00 60.31 C ATOM 952 CH2 TRP A 70 -0.255 11.044 -6.135 1.00 3.44 C ATOM 0 H TRP A 70 4.498 12.511 -11.714 1.00 45.13 H new ATOM 0 HA TRP A 70 5.351 11.497 -9.198 1.00 44.53 H new ATOM 0 HB2 TRP A 70 4.137 13.636 -9.635 1.00 22.15 H new ATOM 0 HB3 TRP A 70 2.740 12.733 -10.186 1.00 22.15 H new ATOM 0 HD1 TRP A 70 4.476 13.902 -7.008 1.00 74.33 H new ATOM 0 HE1 TRP A 70 2.974 13.435 -4.962 1.00 2.14 H new ATOM 0 HE3 TRP A 70 0.936 11.034 -9.315 1.00 3.43 H new ATOM 0 HZ2 TRP A 70 0.607 12.022 -4.444 1.00 64.10 H new ATOM 0 HZ3 TRP A 70 -0.923 10.154 -7.970 1.00 60.31 H new ATOM 0 HH2 TRP A 70 -1.084 10.647 -5.569 1.00 3.44 H new ATOM 963 N GLN A 71 2.904 9.937 -10.729 1.00 44.42 N ATOM 964 CA GLN A 71 2.147 8.699 -10.765 1.00 74.24 C ATOM 965 C GLN A 71 3.090 7.504 -10.957 1.00 54.20 C ATOM 966 O GLN A 71 2.981 6.492 -10.262 1.00 1.21 O ATOM 967 CB GLN A 71 1.115 8.751 -11.882 1.00 15.53 C ATOM 968 CG GLN A 71 0.170 9.933 -11.778 1.00 43.31 C ATOM 969 CD GLN A 71 -0.831 9.967 -12.902 1.00 11.25 C ATOM 970 OE1 GLN A 71 -0.580 10.549 -13.956 1.00 3.11 O ATOM 971 NE2 GLN A 71 -1.975 9.363 -12.685 1.00 74.53 N ATOM 0 H GLN A 71 2.730 10.559 -11.518 1.00 44.42 H new ATOM 0 HA GLN A 71 1.626 8.576 -9.816 1.00 74.24 H new ATOM 0 HB2 GLN A 71 1.631 8.792 -12.841 1.00 15.53 H new ATOM 0 HB3 GLN A 71 0.534 7.829 -11.872 1.00 15.53 H new ATOM 0 HG2 GLN A 71 -0.358 9.890 -10.826 1.00 43.31 H new ATOM 0 HG3 GLN A 71 0.747 10.858 -11.781 1.00 43.31 H new ATOM 0 HE21 GLN A 71 -2.142 8.892 -11.796 1.00 74.53 H new ATOM 0 HE22 GLN A 71 -2.697 9.365 -13.405 1.00 74.53 H new ATOM 980 N GLN A 72 4.005 7.631 -11.919 1.00 42.25 N ATOM 981 CA GLN A 72 5.009 6.599 -12.191 1.00 25.50 C ATOM 982 C GLN A 72 5.859 6.292 -10.965 1.00 55.34 C ATOM 983 O GLN A 72 6.084 5.125 -10.637 1.00 55.04 O ATOM 984 CB GLN A 72 5.909 7.019 -13.349 1.00 14.52 C ATOM 985 CG GLN A 72 5.463 6.508 -14.709 1.00 74.35 C ATOM 986 CD GLN A 72 5.553 4.996 -14.815 1.00 61.13 C ATOM 987 OE1 GLN A 72 6.601 4.451 -15.151 1.00 4.14 O ATOM 988 NE2 GLN A 72 4.456 4.313 -14.555 1.00 60.31 N ATOM 0 H GLN A 72 4.072 8.446 -12.528 1.00 42.25 H new ATOM 0 HA GLN A 72 4.469 5.691 -12.461 1.00 25.50 H new ATOM 0 HB2 GLN A 72 5.955 8.108 -13.381 1.00 14.52 H new ATOM 0 HB3 GLN A 72 6.921 6.663 -13.155 1.00 14.52 H new ATOM 0 HG2 GLN A 72 4.436 6.822 -14.894 1.00 74.35 H new ATOM 0 HG3 GLN A 72 6.080 6.962 -15.485 1.00 74.35 H new ATOM 0 HE21 GLN A 72 3.604 4.802 -14.279 1.00 60.31 H new ATOM 0 HE22 GLN A 72 4.459 3.296 -14.630 1.00 60.31 H new ATOM 997 N THR A 73 6.326 7.333 -10.286 1.00 0.10 N ATOM 998 CA THR A 73 7.145 7.151 -9.102 1.00 52.42 C ATOM 999 C THR A 73 6.321 6.482 -7.999 1.00 33.44 C ATOM 1000 O THR A 73 6.825 5.639 -7.255 1.00 4.05 O ATOM 1001 CB THR A 73 7.716 8.495 -8.600 1.00 12.21 C ATOM 1002 OG1 THR A 73 8.354 9.190 -9.689 1.00 55.25 O ATOM 1003 CG2 THR A 73 8.732 8.271 -7.486 1.00 55.24 C ATOM 0 H THR A 73 6.151 8.306 -10.536 1.00 0.10 H new ATOM 0 HA THR A 73 7.986 6.510 -9.366 1.00 52.42 H new ATOM 0 HB THR A 73 6.891 9.091 -8.210 1.00 12.21 H new ATOM 0 HG1 THR A 73 7.676 9.652 -10.225 1.00 55.25 H new ATOM 0 HG21 THR A 73 9.120 9.232 -7.149 1.00 55.24 H new ATOM 0 HG22 THR A 73 8.251 7.761 -6.652 1.00 55.24 H new ATOM 0 HG23 THR A 73 9.553 7.659 -7.860 1.00 55.24 H new ATOM 1011 N PHE A 74 5.051 6.872 -7.897 1.00 4.51 N ATOM 1012 CA PHE A 74 4.128 6.236 -6.971 1.00 11.54 C ATOM 1013 C PHE A 74 4.066 4.729 -7.242 1.00 1.13 C ATOM 1014 O PHE A 74 4.118 3.925 -6.323 1.00 23.01 O ATOM 1015 CB PHE A 74 2.732 6.860 -7.096 1.00 50.11 C ATOM 1016 CG PHE A 74 1.725 6.302 -6.131 1.00 1.13 C ATOM 1017 CD1 PHE A 74 1.633 6.800 -4.843 1.00 63.12 C ATOM 1018 CD2 PHE A 74 0.870 5.280 -6.512 1.00 72.35 C ATOM 1019 CE1 PHE A 74 0.709 6.291 -3.953 1.00 53.21 C ATOM 1020 CE2 PHE A 74 -0.053 4.766 -5.628 1.00 4.35 C ATOM 1021 CZ PHE A 74 -0.135 5.272 -4.346 1.00 74.04 C ATOM 0 H PHE A 74 4.642 7.627 -8.447 1.00 4.51 H new ATOM 0 HA PHE A 74 4.487 6.394 -5.954 1.00 11.54 H new ATOM 0 HB2 PHE A 74 2.811 7.936 -6.941 1.00 50.11 H new ATOM 0 HB3 PHE A 74 2.368 6.710 -8.112 1.00 50.11 H new ATOM 0 HD1 PHE A 74 2.292 7.596 -4.531 1.00 63.12 H new ATOM 0 HD2 PHE A 74 0.928 4.882 -7.514 1.00 72.35 H new ATOM 0 HE1 PHE A 74 0.646 6.689 -2.951 1.00 53.21 H new ATOM 0 HE2 PHE A 74 -0.712 3.968 -5.937 1.00 4.35 H new ATOM 0 HZ PHE A 74 -0.859 4.871 -3.652 1.00 74.04 H new ATOM 1031 N SER A 75 3.959 4.357 -8.513 1.00 43.30 N ATOM 1032 CA SER A 75 3.938 2.951 -8.895 1.00 3.22 C ATOM 1033 C SER A 75 5.250 2.258 -8.499 1.00 63.31 C ATOM 1034 O SER A 75 5.249 1.096 -8.090 1.00 3.52 O ATOM 1035 CB SER A 75 3.705 2.823 -10.400 1.00 72.53 C ATOM 1036 OG SER A 75 2.543 3.538 -10.792 1.00 40.43 O ATOM 0 H SER A 75 3.886 5.009 -9.294 1.00 43.30 H new ATOM 0 HA SER A 75 3.121 2.461 -8.365 1.00 3.22 H new ATOM 0 HB2 SER A 75 4.572 3.204 -10.941 1.00 72.53 H new ATOM 0 HB3 SER A 75 3.599 1.772 -10.668 1.00 72.53 H new ATOM 0 HG SER A 75 2.719 4.501 -10.743 1.00 40.43 H new ATOM 1042 N GLN A 76 6.358 2.984 -8.635 1.00 13.10 N ATOM 1043 CA GLN A 76 7.681 2.472 -8.268 1.00 14.35 C ATOM 1044 C GLN A 76 7.716 1.930 -6.838 1.00 52.15 C ATOM 1045 O GLN A 76 8.222 0.837 -6.606 1.00 24.42 O ATOM 1046 CB GLN A 76 8.755 3.549 -8.450 1.00 43.40 C ATOM 1047 CG GLN A 76 9.103 3.840 -9.901 1.00 31.03 C ATOM 1048 CD GLN A 76 9.748 2.653 -10.592 1.00 44.23 C ATOM 1049 OE1 GLN A 76 10.425 1.839 -9.956 1.00 74.11 O ATOM 1050 NE2 GLN A 76 9.559 2.550 -11.891 1.00 0.45 N ATOM 0 H GLN A 76 6.367 3.937 -9.000 1.00 13.10 H new ATOM 0 HA GLN A 76 7.894 1.641 -8.941 1.00 14.35 H new ATOM 0 HB2 GLN A 76 8.414 4.470 -7.978 1.00 43.40 H new ATOM 0 HB3 GLN A 76 9.659 3.238 -7.926 1.00 43.40 H new ATOM 0 HG2 GLN A 76 8.198 4.122 -10.439 1.00 31.03 H new ATOM 0 HG3 GLN A 76 9.779 4.694 -9.945 1.00 31.03 H new ATOM 0 HE21 GLN A 76 8.993 3.243 -12.381 1.00 0.45 H new ATOM 0 HE22 GLN A 76 9.979 1.777 -12.408 1.00 0.45 H new ATOM 1059 N GLN A 77 7.170 2.687 -5.881 1.00 14.21 N ATOM 1060 CA GLN A 77 7.171 2.253 -4.473 1.00 31.54 C ATOM 1061 C GLN A 77 6.401 0.937 -4.295 1.00 44.04 C ATOM 1062 O GLN A 77 6.683 0.157 -3.387 1.00 62.23 O ATOM 1063 CB GLN A 77 6.588 3.327 -3.541 1.00 0.15 C ATOM 1064 CG GLN A 77 5.069 3.411 -3.564 1.00 12.14 C ATOM 1065 CD GLN A 77 4.501 4.355 -2.524 1.00 44.51 C ATOM 1066 OE1 GLN A 77 3.455 4.951 -2.725 1.00 33.20 O ATOM 1067 NE2 GLN A 77 5.179 4.484 -1.397 1.00 72.10 N ATOM 0 H GLN A 77 6.727 3.591 -6.047 1.00 14.21 H new ATOM 0 HA GLN A 77 8.213 2.092 -4.197 1.00 31.54 H new ATOM 0 HB2 GLN A 77 6.915 3.124 -2.521 1.00 0.15 H new ATOM 0 HB3 GLN A 77 6.999 4.297 -3.820 1.00 0.15 H new ATOM 0 HG2 GLN A 77 4.746 3.735 -4.553 1.00 12.14 H new ATOM 0 HG3 GLN A 77 4.655 2.415 -3.404 1.00 12.14 H new ATOM 0 HE21 GLN A 77 6.050 3.970 -1.264 1.00 72.10 H new ATOM 0 HE22 GLN A 77 4.831 5.098 -0.660 1.00 72.10 H new ATOM 1076 N VAL A 78 5.459 0.680 -5.194 1.00 70.12 N ATOM 1077 CA VAL A 78 4.633 -0.510 -5.110 1.00 63.52 C ATOM 1078 C VAL A 78 5.413 -1.722 -5.604 1.00 64.32 C ATOM 1079 O VAL A 78 5.118 -2.865 -5.241 1.00 51.03 O ATOM 1080 CB VAL A 78 3.323 -0.344 -5.924 1.00 24.44 C ATOM 1081 CG1 VAL A 78 2.402 -1.540 -5.731 1.00 54.03 C ATOM 1082 CG2 VAL A 78 2.611 0.943 -5.530 1.00 53.42 C ATOM 0 H VAL A 78 5.251 1.283 -5.990 1.00 70.12 H new ATOM 0 HA VAL A 78 4.360 -0.662 -4.066 1.00 63.52 H new ATOM 0 HB VAL A 78 3.588 -0.289 -6.980 1.00 24.44 H new ATOM 0 HG11 VAL A 78 1.492 -1.396 -6.313 1.00 54.03 H new ATOM 0 HG12 VAL A 78 2.907 -2.446 -6.066 1.00 54.03 H new ATOM 0 HG13 VAL A 78 2.146 -1.636 -4.676 1.00 54.03 H new ATOM 0 HG21 VAL A 78 1.694 1.044 -6.111 1.00 53.42 H new ATOM 0 HG22 VAL A 78 2.367 0.913 -4.468 1.00 53.42 H new ATOM 0 HG23 VAL A 78 3.262 1.794 -5.729 1.00 53.42 H new ATOM 1092 N MET A 79 6.442 -1.463 -6.401 1.00 65.32 N ATOM 1093 CA MET A 79 7.317 -2.522 -6.882 1.00 72.54 C ATOM 1094 C MET A 79 8.140 -3.064 -5.721 1.00 62.23 C ATOM 1095 O MET A 79 8.629 -4.185 -5.762 1.00 24.02 O ATOM 1096 CB MET A 79 8.238 -2.014 -7.996 1.00 64.02 C ATOM 1097 CG MET A 79 7.505 -1.624 -9.272 1.00 24.04 C ATOM 1098 SD MET A 79 6.640 -3.014 -10.029 1.00 52.21 S ATOM 1099 CE MET A 79 5.901 -2.219 -11.455 1.00 31.31 C ATOM 0 H MET A 79 6.690 -0.529 -6.727 1.00 65.32 H new ATOM 0 HA MET A 79 6.703 -3.321 -7.298 1.00 72.54 H new ATOM 0 HB2 MET A 79 8.794 -1.151 -7.629 1.00 64.02 H new ATOM 0 HB3 MET A 79 8.969 -2.788 -8.231 1.00 64.02 H new ATOM 0 HG2 MET A 79 6.788 -0.834 -9.048 1.00 24.04 H new ATOM 0 HG3 MET A 79 8.219 -1.213 -9.986 1.00 24.04 H new ATOM 0 HE1 MET A 79 5.331 -2.952 -12.026 1.00 31.31 H new ATOM 0 HE2 MET A 79 5.237 -1.421 -11.123 1.00 31.31 H new ATOM 0 HE3 MET A 79 6.685 -1.799 -12.085 1.00 31.31 H new ATOM 1109 N LEU A 80 8.272 -2.252 -4.681 1.00 52.13 N ATOM 1110 CA LEU A 80 8.978 -2.662 -3.482 1.00 53.44 C ATOM 1111 C LEU A 80 8.034 -3.404 -2.551 1.00 64.32 C ATOM 1112 O LEU A 80 8.429 -4.367 -1.890 1.00 75.42 O ATOM 1113 CB LEU A 80 9.618 -1.467 -2.754 1.00 53.52 C ATOM 1114 CG LEU A 80 10.885 -0.871 -3.394 1.00 53.11 C ATOM 1115 CD1 LEU A 80 11.880 -1.959 -3.748 1.00 71.33 C ATOM 1116 CD2 LEU A 80 10.550 -0.028 -4.613 1.00 71.02 C ATOM 0 H LEU A 80 7.897 -1.304 -4.647 1.00 52.13 H new ATOM 0 HA LEU A 80 9.786 -3.328 -3.785 1.00 53.44 H new ATOM 0 HB2 LEU A 80 8.872 -0.676 -2.675 1.00 53.52 H new ATOM 0 HB3 LEU A 80 9.863 -1.778 -1.738 1.00 53.52 H new ATOM 0 HG LEU A 80 11.346 -0.216 -2.655 1.00 53.11 H new ATOM 0 HD11 LEU A 80 12.765 -1.510 -4.198 1.00 71.33 H new ATOM 0 HD12 LEU A 80 12.166 -2.498 -2.845 1.00 71.33 H new ATOM 0 HD13 LEU A 80 11.425 -2.652 -4.456 1.00 71.33 H new ATOM 0 HD21 LEU A 80 11.468 0.377 -5.039 1.00 71.02 H new ATOM 0 HD22 LEU A 80 10.047 -0.647 -5.356 1.00 71.02 H new ATOM 0 HD23 LEU A 80 9.894 0.792 -4.319 1.00 71.02 H new ATOM 1128 N PHE A 81 6.782 -2.937 -2.494 1.00 4.25 N ATOM 1129 CA PHE A 81 5.740 -3.588 -1.692 1.00 74.14 C ATOM 1130 C PHE A 81 5.672 -5.085 -1.987 1.00 13.31 C ATOM 1131 O PHE A 81 5.768 -5.902 -1.077 1.00 13.34 O ATOM 1132 CB PHE A 81 4.362 -2.955 -1.945 1.00 71.34 C ATOM 1133 CG PHE A 81 4.238 -1.507 -1.534 1.00 54.42 C ATOM 1134 CD1 PHE A 81 5.182 -0.907 -0.715 1.00 51.20 C ATOM 1135 CD2 PHE A 81 3.161 -0.750 -1.967 1.00 41.22 C ATOM 1136 CE1 PHE A 81 5.055 0.417 -0.346 1.00 73.04 C ATOM 1137 CE2 PHE A 81 3.031 0.573 -1.598 1.00 11.41 C ATOM 1138 CZ PHE A 81 3.979 1.157 -0.787 1.00 22.33 C ATOM 0 H PHE A 81 6.465 -2.107 -2.996 1.00 4.25 H new ATOM 0 HA PHE A 81 6.007 -3.444 -0.645 1.00 74.14 H new ATOM 0 HB2 PHE A 81 4.131 -3.036 -3.007 1.00 71.34 H new ATOM 0 HB3 PHE A 81 3.609 -3.534 -1.410 1.00 71.34 H new ATOM 0 HD1 PHE A 81 6.026 -1.482 -0.362 1.00 51.20 H new ATOM 0 HD2 PHE A 81 2.413 -1.202 -2.602 1.00 41.22 H new ATOM 0 HE1 PHE A 81 5.800 0.874 0.289 1.00 73.04 H new ATOM 0 HE2 PHE A 81 2.187 1.150 -1.945 1.00 11.41 H new ATOM 0 HZ PHE A 81 3.879 2.193 -0.497 1.00 22.33 H new ATOM 1148 N THR A 82 5.518 -5.434 -3.263 1.00 54.14 N ATOM 1149 CA THR A 82 5.438 -6.837 -3.679 1.00 65.11 C ATOM 1150 C THR A 82 6.747 -7.599 -3.381 1.00 70.05 C ATOM 1151 O THR A 82 6.749 -8.823 -3.239 1.00 62.24 O ATOM 1152 CB THR A 82 5.078 -6.959 -5.190 1.00 42.55 C ATOM 1153 OG1 THR A 82 4.992 -8.335 -5.578 1.00 55.52 O ATOM 1154 CG2 THR A 82 6.109 -6.251 -6.061 1.00 45.11 C ATOM 0 H THR A 82 5.446 -4.765 -4.029 1.00 54.14 H new ATOM 0 HA THR A 82 4.641 -7.295 -3.094 1.00 65.11 H new ATOM 0 HB THR A 82 4.109 -6.481 -5.336 1.00 42.55 H new ATOM 0 HG1 THR A 82 4.764 -8.393 -6.529 1.00 55.52 H new ATOM 0 HG21 THR A 82 5.831 -6.353 -7.110 1.00 45.11 H new ATOM 0 HG22 THR A 82 6.145 -5.194 -5.797 1.00 45.11 H new ATOM 0 HG23 THR A 82 7.090 -6.698 -5.900 1.00 45.11 H new ATOM 1162 N ARG A 83 7.849 -6.869 -3.279 1.00 61.05 N ATOM 1163 CA ARG A 83 9.144 -7.475 -2.994 1.00 24.52 C ATOM 1164 C ARG A 83 9.259 -7.903 -1.534 1.00 65.41 C ATOM 1165 O ARG A 83 9.296 -9.093 -1.223 1.00 53.31 O ATOM 1166 CB ARG A 83 10.284 -6.518 -3.342 1.00 71.31 C ATOM 1167 CG ARG A 83 10.554 -6.381 -4.828 1.00 41.13 C ATOM 1168 CD ARG A 83 11.692 -5.411 -5.094 1.00 14.15 C ATOM 1169 NE ARG A 83 12.882 -5.718 -4.295 1.00 43.03 N ATOM 1170 CZ ARG A 83 14.099 -5.220 -4.524 1.00 73.32 C ATOM 1171 NH1 ARG A 83 14.317 -4.431 -5.575 1.00 30.12 N ATOM 1172 NH2 ARG A 83 15.097 -5.522 -3.704 1.00 23.04 N ATOM 0 H ARG A 83 7.873 -5.855 -3.389 1.00 61.05 H new ATOM 0 HA ARG A 83 9.222 -8.365 -3.618 1.00 24.52 H new ATOM 0 HB2 ARG A 83 10.053 -5.534 -2.935 1.00 71.31 H new ATOM 0 HB3 ARG A 83 11.194 -6.861 -2.850 1.00 71.31 H new ATOM 0 HG2 ARG A 83 10.800 -7.357 -5.247 1.00 41.13 H new ATOM 0 HG3 ARG A 83 9.652 -6.035 -5.333 1.00 41.13 H new ATOM 0 HD2 ARG A 83 11.951 -5.439 -6.153 1.00 14.15 H new ATOM 0 HD3 ARG A 83 11.361 -4.396 -4.873 1.00 14.15 H new ATOM 0 HE ARG A 83 12.772 -6.358 -3.508 1.00 43.03 H new ATOM 0 HH11 ARG A 83 13.552 -4.204 -6.210 1.00 30.12 H new ATOM 0 HH12 ARG A 83 15.249 -4.053 -5.745 1.00 30.12 H new ATOM 0 HH21 ARG A 83 14.932 -6.132 -2.903 1.00 23.04 H new ATOM 0 HH22 ARG A 83 16.029 -5.144 -3.874 1.00 23.04 H new ATOM 1186 N GLN A 84 9.294 -6.925 -0.642 1.00 74.43 N ATOM 1187 CA GLN A 84 9.488 -7.189 0.782 1.00 31.35 C ATOM 1188 C GLN A 84 8.194 -7.588 1.485 1.00 2.41 C ATOM 1189 O GLN A 84 8.201 -7.885 2.682 1.00 43.41 O ATOM 1190 CB GLN A 84 10.100 -5.969 1.471 1.00 71.25 C ATOM 1191 CG GLN A 84 11.500 -5.629 0.987 1.00 72.43 C ATOM 1192 CD GLN A 84 12.508 -6.723 1.290 1.00 40.31 C ATOM 1193 OE1 GLN A 84 12.720 -7.635 0.487 1.00 43.34 O ATOM 1194 NE2 GLN A 84 13.136 -6.637 2.446 1.00 61.40 N ATOM 0 H GLN A 84 9.191 -5.938 -0.876 1.00 74.43 H new ATOM 0 HA GLN A 84 10.172 -8.034 0.856 1.00 31.35 H new ATOM 0 HB2 GLN A 84 9.451 -5.108 1.309 1.00 71.25 H new ATOM 0 HB3 GLN A 84 10.131 -6.148 2.546 1.00 71.25 H new ATOM 0 HG2 GLN A 84 11.475 -5.452 -0.088 1.00 72.43 H new ATOM 0 HG3 GLN A 84 11.826 -4.700 1.456 1.00 72.43 H new ATOM 0 HE21 GLN A 84 12.931 -5.866 3.082 1.00 61.40 H new ATOM 0 HE22 GLN A 84 13.827 -7.341 2.705 1.00 61.40 H new ATOM 1203 N GLY A 85 7.090 -7.591 0.754 1.00 4.10 N ATOM 1204 CA GLY A 85 5.817 -7.939 1.355 1.00 22.34 C ATOM 1205 C GLY A 85 5.340 -6.856 2.291 1.00 32.24 C ATOM 1206 O GLY A 85 4.763 -7.135 3.341 1.00 54.15 O ATOM 0 H GLY A 85 7.051 -7.360 -0.239 1.00 4.10 H new ATOM 0 HA2 GLY A 85 5.075 -8.100 0.573 1.00 22.34 H new ATOM 0 HA3 GLY A 85 5.914 -8.878 1.900 1.00 22.34 H new ATOM 1210 N GLN A 86 5.594 -5.616 1.915 1.00 20.25 N ATOM 1211 CA GLN A 86 5.226 -4.482 2.734 1.00 13.12 C ATOM 1212 C GLN A 86 3.754 -4.139 2.545 1.00 30.44 C ATOM 1213 O GLN A 86 3.390 -3.340 1.683 1.00 65.31 O ATOM 1214 CB GLN A 86 6.125 -3.282 2.422 1.00 50.12 C ATOM 1215 CG GLN A 86 5.836 -2.059 3.267 1.00 11.00 C ATOM 1216 CD GLN A 86 6.872 -0.972 3.100 1.00 31.34 C ATOM 1217 OE1 GLN A 86 6.760 -0.115 2.230 1.00 54.01 O ATOM 1218 NE2 GLN A 86 7.885 -0.996 3.935 1.00 51.23 N ATOM 0 H GLN A 86 6.057 -5.370 1.040 1.00 20.25 H new ATOM 0 HA GLN A 86 5.372 -4.745 3.782 1.00 13.12 H new ATOM 0 HB2 GLN A 86 7.165 -3.573 2.567 1.00 50.12 H new ATOM 0 HB3 GLN A 86 6.011 -3.019 1.370 1.00 50.12 H new ATOM 0 HG2 GLN A 86 4.856 -1.664 3.002 1.00 11.00 H new ATOM 0 HG3 GLN A 86 5.789 -2.351 4.316 1.00 11.00 H new ATOM 0 HE21 GLN A 86 7.943 -1.725 4.646 1.00 51.23 H new ATOM 0 HE22 GLN A 86 8.614 -0.285 3.873 1.00 51.23 H new ATOM 1227 N GLN A 87 2.910 -4.797 3.328 1.00 1.02 N ATOM 1228 CA GLN A 87 1.465 -4.605 3.261 1.00 1.12 C ATOM 1229 C GLN A 87 1.010 -3.261 3.851 1.00 11.23 C ATOM 1230 O GLN A 87 -0.169 -2.920 3.788 1.00 51.11 O ATOM 1231 CB GLN A 87 0.740 -5.760 3.956 1.00 52.54 C ATOM 1232 CG GLN A 87 1.045 -5.873 5.440 1.00 61.35 C ATOM 1233 CD GLN A 87 0.394 -7.080 6.077 1.00 15.03 C ATOM 1234 OE1 GLN A 87 0.987 -8.158 6.139 1.00 24.51 O ATOM 1235 NE2 GLN A 87 -0.818 -6.912 6.558 1.00 4.01 N ATOM 0 H GLN A 87 3.206 -5.478 4.027 1.00 1.02 H new ATOM 0 HA GLN A 87 1.201 -4.591 2.203 1.00 1.12 H new ATOM 0 HB2 GLN A 87 -0.335 -5.633 3.824 1.00 52.54 H new ATOM 0 HB3 GLN A 87 1.013 -6.695 3.467 1.00 52.54 H new ATOM 0 HG2 GLN A 87 2.124 -5.930 5.582 1.00 61.35 H new ATOM 0 HG3 GLN A 87 0.704 -4.971 5.947 1.00 61.35 H new ATOM 0 HE21 GLN A 87 -1.274 -6.002 6.486 1.00 4.01 H new ATOM 0 HE22 GLN A 87 -1.303 -7.691 7.003 1.00 4.01 H new ATOM 1244 N SER A 88 1.923 -2.525 4.446 1.00 62.10 N ATOM 1245 CA SER A 88 1.598 -1.222 4.995 1.00 4.31 C ATOM 1246 C SER A 88 2.791 -0.297 4.884 1.00 31.30 C ATOM 1247 O SER A 88 3.921 -0.695 5.163 1.00 11.34 O ATOM 1248 CB SER A 88 1.143 -1.359 6.448 1.00 31.22 C ATOM 1249 OG SER A 88 2.054 -2.152 7.198 1.00 24.31 O ATOM 0 H SER A 88 2.897 -2.804 4.563 1.00 62.10 H new ATOM 0 HA SER A 88 0.778 -0.790 4.422 1.00 4.31 H new ATOM 0 HB2 SER A 88 1.059 -0.371 6.900 1.00 31.22 H new ATOM 0 HB3 SER A 88 0.151 -1.810 6.481 1.00 31.22 H new ATOM 0 HG SER A 88 1.741 -2.223 8.124 1.00 24.31 H new ATOM 1255 N ALA A 89 2.543 0.937 4.489 1.00 74.40 N ATOM 1256 CA ALA A 89 3.617 1.879 4.269 1.00 61.42 C ATOM 1257 C ALA A 89 3.145 3.310 4.419 1.00 42.45 C ATOM 1258 O ALA A 89 1.967 3.618 4.205 1.00 31.14 O ATOM 1259 CB ALA A 89 4.197 1.676 2.885 1.00 41.21 C ATOM 0 H ALA A 89 1.609 1.307 4.315 1.00 74.40 H new ATOM 0 HA ALA A 89 4.382 1.698 5.024 1.00 61.42 H new ATOM 0 HB1 ALA A 89 5.006 2.387 2.722 1.00 41.21 H new ATOM 0 HB2 ALA A 89 4.583 0.661 2.798 1.00 41.21 H new ATOM 0 HB3 ALA A 89 3.419 1.834 2.138 1.00 41.21 H new ATOM 1265 N GLN A 90 4.060 4.174 4.816 1.00 54.31 N ATOM 1266 CA GLN A 90 3.791 5.592 4.926 1.00 23.53 C ATOM 1267 C GLN A 90 4.575 6.331 3.857 1.00 5.12 C ATOM 1268 O GLN A 90 5.806 6.288 3.843 1.00 31.00 O ATOM 1269 CB GLN A 90 4.166 6.139 6.316 1.00 72.13 C ATOM 1270 CG GLN A 90 3.193 5.783 7.443 1.00 42.22 C ATOM 1271 CD GLN A 90 3.361 4.369 7.979 1.00 31.45 C ATOM 1272 OE1 GLN A 90 4.149 4.133 8.889 1.00 33.12 O ATOM 1273 NE2 GLN A 90 2.608 3.433 7.436 1.00 74.40 N ATOM 0 H GLN A 90 5.012 3.910 5.071 1.00 54.31 H new ATOM 0 HA GLN A 90 2.721 5.748 4.788 1.00 23.53 H new ATOM 0 HB2 GLN A 90 5.155 5.765 6.581 1.00 72.13 H new ATOM 0 HB3 GLN A 90 4.242 7.225 6.253 1.00 72.13 H new ATOM 0 HG2 GLN A 90 3.327 6.490 8.262 1.00 42.22 H new ATOM 0 HG3 GLN A 90 2.172 5.905 7.080 1.00 42.22 H new ATOM 0 HE21 GLN A 90 1.965 3.670 6.681 1.00 74.40 H new ATOM 0 HE22 GLN A 90 2.669 2.472 7.771 1.00 74.40 H new ATOM 1282 N LEU A 91 3.876 6.988 2.958 1.00 64.22 N ATOM 1283 CA LEU A 91 4.525 7.711 1.875 1.00 15.25 C ATOM 1284 C LEU A 91 4.525 9.208 2.130 1.00 61.43 C ATOM 1285 O LEU A 91 3.482 9.799 2.407 1.00 21.42 O ATOM 1286 CB LEU A 91 3.835 7.420 0.541 1.00 30.45 C ATOM 1287 CG LEU A 91 4.370 8.202 -0.663 1.00 63.42 C ATOM 1288 CD1 LEU A 91 5.796 7.783 -0.994 1.00 22.24 C ATOM 1289 CD2 LEU A 91 3.460 8.024 -1.864 1.00 43.20 C ATOM 0 H LEU A 91 2.857 7.039 2.951 1.00 64.22 H new ATOM 0 HA LEU A 91 5.558 7.367 1.829 1.00 15.25 H new ATOM 0 HB2 LEU A 91 3.926 6.355 0.330 1.00 30.45 H new ATOM 0 HB3 LEU A 91 2.772 7.634 0.648 1.00 30.45 H new ATOM 0 HG LEU A 91 4.385 9.260 -0.402 1.00 63.42 H new ATOM 0 HD11 LEU A 91 6.153 8.353 -1.852 1.00 22.24 H new ATOM 0 HD12 LEU A 91 6.440 7.977 -0.137 1.00 22.24 H new ATOM 0 HD13 LEU A 91 5.817 6.719 -1.231 1.00 22.24 H new ATOM 0 HD21 LEU A 91 3.857 8.587 -2.708 1.00 43.20 H new ATOM 0 HD22 LEU A 91 3.406 6.967 -2.126 1.00 43.20 H new ATOM 0 HD23 LEU A 91 2.462 8.389 -1.622 1.00 43.20 H new ATOM 1301 N ARG A 92 5.699 9.808 2.061 1.00 62.42 N ATOM 1302 CA ARG A 92 5.837 11.241 2.204 1.00 51.40 C ATOM 1303 C ARG A 92 5.517 11.910 0.864 1.00 30.22 C ATOM 1304 O ARG A 92 5.671 11.297 -0.193 1.00 24.32 O ATOM 1305 CB ARG A 92 7.265 11.581 2.644 1.00 23.24 C ATOM 1306 CG ARG A 92 7.420 12.946 3.292 1.00 42.05 C ATOM 1307 CD ARG A 92 8.862 13.194 3.720 1.00 4.43 C ATOM 1308 NE ARG A 92 8.973 14.343 4.619 1.00 2.31 N ATOM 1309 CZ ARG A 92 10.120 14.935 4.966 1.00 44.22 C ATOM 1310 NH1 ARG A 92 11.278 14.529 4.445 1.00 24.55 N ATOM 1311 NH2 ARG A 92 10.100 15.945 5.832 1.00 22.00 N ATOM 0 H ARG A 92 6.579 9.316 1.905 1.00 62.42 H new ATOM 0 HA ARG A 92 5.144 11.607 2.962 1.00 51.40 H new ATOM 0 HB2 ARG A 92 7.606 10.820 3.346 1.00 23.24 H new ATOM 0 HB3 ARG A 92 7.921 11.530 1.775 1.00 23.24 H new ATOM 0 HG2 ARG A 92 7.107 13.721 2.592 1.00 42.05 H new ATOM 0 HG3 ARG A 92 6.764 13.016 4.159 1.00 42.05 H new ATOM 0 HD2 ARG A 92 9.252 12.305 4.217 1.00 4.43 H new ATOM 0 HD3 ARG A 92 9.479 13.362 2.837 1.00 4.43 H new ATOM 0 HE ARG A 92 8.110 14.721 5.010 1.00 2.31 H new ATOM 0 HH11 ARG A 92 11.294 13.760 3.775 1.00 24.55 H new ATOM 0 HH12 ARG A 92 12.148 14.987 4.716 1.00 24.55 H new ATOM 0 HH21 ARG A 92 9.214 16.262 6.226 1.00 22.00 H new ATOM 0 HH22 ARG A 92 10.971 16.402 6.102 1.00 22.00 H new ATOM 1325 N LEU A 93 5.106 13.164 0.916 1.00 74.04 N ATOM 1326 CA LEU A 93 4.694 13.884 -0.288 1.00 64.33 C ATOM 1327 C LEU A 93 5.156 15.321 -0.267 1.00 45.43 C ATOM 1328 O LEU A 93 5.394 15.892 0.793 1.00 31.34 O ATOM 1329 CB LEU A 93 3.166 13.866 -0.444 1.00 72.21 C ATOM 1330 CG LEU A 93 2.523 12.529 -0.814 1.00 70.23 C ATOM 1331 CD1 LEU A 93 1.016 12.687 -0.904 1.00 10.34 C ATOM 1332 CD2 LEU A 93 3.075 12.016 -2.133 1.00 34.41 C ATOM 0 H LEU A 93 5.047 13.710 1.776 1.00 74.04 H new ATOM 0 HA LEU A 93 5.160 13.372 -1.130 1.00 64.33 H new ATOM 0 HB2 LEU A 93 2.726 14.206 0.493 1.00 72.21 H new ATOM 0 HB3 LEU A 93 2.895 14.595 -1.207 1.00 72.21 H new ATOM 0 HG LEU A 93 2.760 11.802 -0.037 1.00 70.23 H new ATOM 0 HD11 LEU A 93 0.565 11.730 -1.168 1.00 10.34 H new ATOM 0 HD12 LEU A 93 0.627 13.018 0.059 1.00 10.34 H new ATOM 0 HD13 LEU A 93 0.773 13.426 -1.667 1.00 10.34 H new ATOM 0 HD21 LEU A 93 2.605 11.064 -2.378 1.00 34.41 H new ATOM 0 HD22 LEU A 93 2.864 12.739 -2.921 1.00 34.41 H new ATOM 0 HD23 LEU A 93 4.153 11.877 -2.047 1.00 34.41 H new ATOM 1344 N HIS A 94 5.321 15.880 -1.451 1.00 22.23 N ATOM 1345 CA HIS A 94 5.628 17.291 -1.614 1.00 75.24 C ATOM 1346 C HIS A 94 4.531 17.963 -2.423 1.00 62.50 C ATOM 1347 O HIS A 94 4.202 17.509 -3.518 1.00 25.04 O ATOM 1348 CB HIS A 94 6.986 17.498 -2.283 1.00 53.11 C ATOM 1349 CG HIS A 94 8.142 17.378 -1.345 1.00 4.35 C ATOM 1350 ND1 HIS A 94 9.136 18.320 -1.258 1.00 3.44 N ATOM 1351 CD2 HIS A 94 8.460 16.418 -0.452 1.00 1.11 C ATOM 1352 CE1 HIS A 94 10.014 17.945 -0.356 1.00 14.11 C ATOM 1353 NE2 HIS A 94 9.630 16.794 0.147 1.00 51.45 N ATOM 0 H HIS A 94 5.246 15.368 -2.330 1.00 22.23 H new ATOM 0 HA HIS A 94 5.679 17.745 -0.624 1.00 75.24 H new ATOM 0 HB2 HIS A 94 7.102 16.767 -3.084 1.00 53.11 H new ATOM 0 HB3 HIS A 94 7.006 18.484 -2.746 1.00 53.11 H new ATOM 0 HD2 HIS A 94 7.896 15.520 -0.248 1.00 1.11 H new ATOM 0 HE1 HIS A 94 10.902 18.491 -0.075 1.00 14.11 H new ATOM 0 HE2 HIS A 94 10.124 16.267 0.867 1.00 51.45 H new ATOM 1362 N PRO A 95 3.942 19.050 -1.900 1.00 71.42 N ATOM 1363 CA PRO A 95 4.339 19.636 -0.613 1.00 53.12 C ATOM 1364 C PRO A 95 3.904 18.770 0.561 1.00 21.55 C ATOM 1365 O PRO A 95 2.869 18.102 0.502 1.00 31.13 O ATOM 1366 CB PRO A 95 3.606 20.976 -0.594 1.00 61.44 C ATOM 1367 CG PRO A 95 2.410 20.768 -1.461 1.00 51.41 C ATOM 1368 CD PRO A 95 2.812 19.770 -2.512 1.00 1.10 C ATOM 0 HA PRO A 95 5.421 19.731 -0.516 1.00 53.12 H new ATOM 0 HB2 PRO A 95 3.316 21.254 0.419 1.00 61.44 H new ATOM 0 HB3 PRO A 95 4.237 21.778 -0.977 1.00 61.44 H new ATOM 0 HG2 PRO A 95 1.567 20.398 -0.877 1.00 51.41 H new ATOM 0 HG3 PRO A 95 2.094 21.706 -1.918 1.00 51.41 H new ATOM 0 HD2 PRO A 95 1.992 19.094 -2.756 1.00 1.10 H new ATOM 0 HD3 PRO A 95 3.106 20.262 -3.439 1.00 1.10 H new ATOM 1376 N GLU A 96 4.694 18.773 1.624 1.00 53.22 N ATOM 1377 CA GLU A 96 4.439 17.949 2.798 1.00 3.44 C ATOM 1378 C GLU A 96 3.253 18.425 3.644 1.00 21.12 C ATOM 1379 O GLU A 96 3.163 18.090 4.823 1.00 64.32 O ATOM 1380 CB GLU A 96 5.710 17.836 3.668 1.00 23.44 C ATOM 1381 CG GLU A 96 6.362 19.172 4.041 1.00 60.12 C ATOM 1382 CD GLU A 96 7.201 19.765 2.921 1.00 44.11 C ATOM 1383 OE1 GLU A 96 6.647 20.503 2.082 1.00 45.50 O ATOM 1384 OE2 GLU A 96 8.414 19.498 2.879 1.00 72.01 O ATOM 0 H GLU A 96 5.533 19.348 1.698 1.00 53.22 H new ATOM 0 HA GLU A 96 4.164 16.965 2.419 1.00 3.44 H new ATOM 0 HB2 GLU A 96 5.458 17.304 4.585 1.00 23.44 H new ATOM 0 HB3 GLU A 96 6.442 17.227 3.137 1.00 23.44 H new ATOM 0 HG2 GLU A 96 5.584 19.883 4.318 1.00 60.12 H new ATOM 0 HG3 GLU A 96 6.991 19.029 4.920 1.00 60.12 H new ATOM 1391 N GLU A 97 2.352 19.197 3.048 1.00 1.13 N ATOM 1392 CA GLU A 97 1.135 19.597 3.738 1.00 75.14 C ATOM 1393 C GLU A 97 0.362 18.345 4.178 1.00 50.23 C ATOM 1394 O GLU A 97 0.013 18.197 5.353 1.00 4.02 O ATOM 1395 CB GLU A 97 0.269 20.513 2.858 1.00 22.43 C ATOM 1396 CG GLU A 97 -0.035 19.962 1.474 1.00 20.13 C ATOM 1397 CD GLU A 97 -0.916 20.884 0.669 1.00 54.53 C ATOM 1398 OE1 GLU A 97 -0.388 21.798 0.024 1.00 62.21 O ATOM 1399 OE2 GLU A 97 -2.150 20.699 0.689 1.00 31.42 O ATOM 0 H GLU A 97 2.441 19.555 2.097 1.00 1.13 H new ATOM 0 HA GLU A 97 1.403 20.173 4.624 1.00 75.14 H new ATOM 0 HB2 GLU A 97 -0.672 20.705 3.373 1.00 22.43 H new ATOM 0 HB3 GLU A 97 0.774 21.473 2.749 1.00 22.43 H new ATOM 0 HG2 GLU A 97 0.900 19.797 0.938 1.00 20.13 H new ATOM 0 HG3 GLU A 97 -0.522 18.992 1.571 1.00 20.13 H new ATOM 1406 N LEU A 98 0.092 17.445 3.220 1.00 40.22 N ATOM 1407 CA LEU A 98 -0.517 16.154 3.524 1.00 64.52 C ATOM 1408 C LEU A 98 0.406 15.360 4.440 1.00 53.33 C ATOM 1409 O LEU A 98 -0.049 14.588 5.285 1.00 64.14 O ATOM 1410 CB LEU A 98 -0.768 15.353 2.234 1.00 51.51 C ATOM 1411 CG LEU A 98 -1.247 16.155 1.014 1.00 73.14 C ATOM 1412 CD1 LEU A 98 -0.074 16.523 0.114 1.00 23.42 C ATOM 1413 CD2 LEU A 98 -2.294 15.376 0.240 1.00 1.40 C ATOM 0 H LEU A 98 0.288 17.594 2.230 1.00 40.22 H new ATOM 0 HA LEU A 98 -1.472 16.328 4.019 1.00 64.52 H new ATOM 0 HB2 LEU A 98 0.156 14.841 1.965 1.00 51.51 H new ATOM 0 HB3 LEU A 98 -1.509 14.583 2.449 1.00 51.51 H new ATOM 0 HG LEU A 98 -1.703 17.079 1.371 1.00 73.14 H new ATOM 0 HD11 LEU A 98 -0.437 17.090 -0.743 1.00 23.42 H new ATOM 0 HD12 LEU A 98 0.639 17.128 0.674 1.00 23.42 H new ATOM 0 HD13 LEU A 98 0.417 15.614 -0.234 1.00 23.42 H new ATOM 0 HD21 LEU A 98 -2.621 15.961 -0.620 1.00 1.40 H new ATOM 0 HD22 LEU A 98 -1.867 14.434 -0.103 1.00 1.40 H new ATOM 0 HD23 LEU A 98 -3.148 15.173 0.886 1.00 1.40 H new ATOM 1425 N GLY A 99 1.707 15.578 4.260 1.00 42.24 N ATOM 1426 CA GLY A 99 2.745 14.964 5.075 1.00 40.51 C ATOM 1427 C GLY A 99 2.919 13.464 4.916 1.00 63.13 C ATOM 1428 O GLY A 99 4.052 12.987 4.801 1.00 73.03 O ATOM 0 H GLY A 99 2.071 16.195 3.534 1.00 42.24 H new ATOM 0 HA2 GLY A 99 3.694 15.446 4.842 1.00 40.51 H new ATOM 0 HA3 GLY A 99 2.529 15.175 6.122 1.00 40.51 H new ATOM 1432 N GLN A 100 1.833 12.718 4.895 1.00 31.34 N ATOM 1433 CA GLN A 100 1.931 11.277 4.837 1.00 0.04 C ATOM 1434 C GLN A 100 0.710 10.635 4.199 1.00 23.41 C ATOM 1435 O GLN A 100 -0.383 11.212 4.172 1.00 50.10 O ATOM 1436 CB GLN A 100 2.163 10.710 6.240 1.00 73.14 C ATOM 1437 CG GLN A 100 1.135 11.162 7.266 1.00 22.12 C ATOM 1438 CD GLN A 100 1.507 10.762 8.676 1.00 72.02 C ATOM 1439 OE1 GLN A 100 2.682 10.653 9.012 1.00 74.11 O ATOM 1440 NE2 GLN A 100 0.513 10.559 9.511 1.00 61.44 N ATOM 0 H GLN A 100 0.881 13.083 4.917 1.00 31.34 H new ATOM 0 HA GLN A 100 2.783 11.035 4.201 1.00 0.04 H new ATOM 0 HB2 GLN A 100 2.154 9.621 6.187 1.00 73.14 H new ATOM 0 HB3 GLN A 100 3.156 11.005 6.581 1.00 73.14 H new ATOM 0 HG2 GLN A 100 1.029 12.246 7.216 1.00 22.12 H new ATOM 0 HG3 GLN A 100 0.164 10.735 7.015 1.00 22.12 H new ATOM 0 HE21 GLN A 100 -0.450 10.660 9.191 1.00 61.44 H new ATOM 0 HE22 GLN A 100 0.705 10.300 10.479 1.00 61.44 H new ATOM 1449 N VAL A 101 0.916 9.433 3.701 1.00 22.30 N ATOM 1450 CA VAL A 101 -0.128 8.625 3.103 1.00 2.52 C ATOM 1451 C VAL A 101 -0.001 7.210 3.640 1.00 25.53 C ATOM 1452 O VAL A 101 1.095 6.647 3.654 1.00 22.10 O ATOM 1453 CB VAL A 101 -0.020 8.588 1.553 1.00 43.25 C ATOM 1454 CG1 VAL A 101 -1.134 7.744 0.947 1.00 32.31 C ATOM 1455 CG2 VAL A 101 -0.046 9.991 0.976 1.00 24.10 C ATOM 0 H VAL A 101 1.831 8.982 3.700 1.00 22.30 H new ATOM 0 HA VAL A 101 -1.092 9.064 3.358 1.00 2.52 H new ATOM 0 HB VAL A 101 0.934 8.128 1.297 1.00 43.25 H new ATOM 0 HG11 VAL A 101 -1.034 7.735 -0.138 1.00 32.31 H new ATOM 0 HG12 VAL A 101 -1.065 6.724 1.326 1.00 32.31 H new ATOM 0 HG13 VAL A 101 -2.101 8.168 1.219 1.00 32.31 H new ATOM 0 HG21 VAL A 101 0.031 9.939 -0.110 1.00 24.10 H new ATOM 0 HG22 VAL A 101 -0.981 10.480 1.251 1.00 24.10 H new ATOM 0 HG23 VAL A 101 0.793 10.563 1.372 1.00 24.10 H new ATOM 1465 N HIS A 102 -1.096 6.648 4.104 1.00 41.15 N ATOM 1466 CA HIS A 102 -1.073 5.299 4.651 1.00 64.43 C ATOM 1467 C HIS A 102 -1.629 4.320 3.638 1.00 35.15 C ATOM 1468 O HIS A 102 -2.835 4.265 3.417 1.00 71.15 O ATOM 1469 CB HIS A 102 -1.867 5.215 5.966 1.00 73.24 C ATOM 1470 CG HIS A 102 -1.348 6.100 7.054 1.00 62.11 C ATOM 1471 ND1 HIS A 102 -1.840 7.362 7.297 1.00 1.44 N ATOM 1472 CD2 HIS A 102 -0.374 5.900 7.972 1.00 21.42 C ATOM 1473 CE1 HIS A 102 -1.197 7.896 8.311 1.00 14.42 C ATOM 1474 NE2 HIS A 102 -0.303 7.033 8.739 1.00 70.25 N ATOM 0 H HIS A 102 -2.012 7.097 4.116 1.00 41.15 H new ATOM 0 HA HIS A 102 -0.037 5.039 4.870 1.00 64.43 H new ATOM 0 HB2 HIS A 102 -2.907 5.475 5.767 1.00 73.24 H new ATOM 0 HB3 HIS A 102 -1.858 4.183 6.317 1.00 73.24 H new ATOM 0 HD2 HIS A 102 0.233 5.014 8.080 1.00 21.42 H new ATOM 0 HE1 HIS A 102 -1.373 8.879 8.723 1.00 14.42 H new ATOM 0 HE2 HIS A 102 0.340 7.183 9.517 1.00 70.25 H new ATOM 1483 N ILE A 103 -0.754 3.579 2.997 1.00 4.13 N ATOM 1484 CA ILE A 103 -1.177 2.610 2.008 1.00 71.54 C ATOM 1485 C ILE A 103 -1.345 1.232 2.631 1.00 61.34 C ATOM 1486 O ILE A 103 -0.388 0.654 3.159 1.00 4.02 O ATOM 1487 CB ILE A 103 -0.177 2.514 0.812 1.00 34.53 C ATOM 1488 CG1 ILE A 103 -0.084 3.850 0.059 1.00 4.02 C ATOM 1489 CG2 ILE A 103 -0.574 1.394 -0.144 1.00 32.13 C ATOM 1490 CD1 ILE A 103 0.944 4.807 0.627 1.00 11.44 C ATOM 0 H ILE A 103 0.255 3.628 3.142 1.00 4.13 H new ATOM 0 HA ILE A 103 -2.137 2.958 1.626 1.00 71.54 H new ATOM 0 HB ILE A 103 0.806 2.284 1.223 1.00 34.53 H new ATOM 0 HG12 ILE A 103 0.158 3.651 -0.985 1.00 4.02 H new ATOM 0 HG13 ILE A 103 -1.061 4.332 0.073 1.00 4.02 H new ATOM 0 HG21 ILE A 103 0.139 1.349 -0.968 1.00 32.13 H new ATOM 0 HG22 ILE A 103 -0.573 0.443 0.389 1.00 32.13 H new ATOM 0 HG23 ILE A 103 -1.572 1.588 -0.538 1.00 32.13 H new ATOM 0 HD11 ILE A 103 0.949 5.726 0.041 1.00 11.44 H new ATOM 0 HD12 ILE A 103 0.693 5.038 1.662 1.00 11.44 H new ATOM 0 HD13 ILE A 103 1.931 4.346 0.587 1.00 11.44 H new ATOM 1502 N SER A 104 -2.568 0.733 2.600 1.00 12.10 N ATOM 1503 CA SER A 104 -2.857 -0.600 3.077 1.00 65.04 C ATOM 1504 C SER A 104 -2.790 -1.567 1.898 1.00 20.14 C ATOM 1505 O SER A 104 -2.828 -1.138 0.736 1.00 55.11 O ATOM 1506 CB SER A 104 -4.239 -0.649 3.733 1.00 64.14 C ATOM 1507 OG SER A 104 -4.429 0.446 4.622 1.00 40.34 O ATOM 0 H SER A 104 -3.380 1.239 2.246 1.00 12.10 H new ATOM 0 HA SER A 104 -2.122 -0.887 3.829 1.00 65.04 H new ATOM 0 HB2 SER A 104 -5.010 -0.633 2.963 1.00 64.14 H new ATOM 0 HB3 SER A 104 -4.352 -1.586 4.278 1.00 64.14 H new ATOM 0 HG SER A 104 -5.321 0.389 5.025 1.00 40.34 H new ATOM 1513 N LEU A 105 -2.730 -2.855 2.177 1.00 15.45 N ATOM 1514 CA LEU A 105 -2.563 -3.831 1.121 1.00 5.24 C ATOM 1515 C LEU A 105 -3.183 -5.165 1.493 1.00 2.41 C ATOM 1516 O LEU A 105 -2.663 -5.889 2.350 1.00 64.50 O ATOM 1517 CB LEU A 105 -1.083 -4.013 0.774 1.00 44.44 C ATOM 1518 CG LEU A 105 -0.780 -4.967 -0.389 1.00 22.43 C ATOM 1519 CD1 LEU A 105 -1.406 -4.460 -1.681 1.00 64.21 C ATOM 1520 CD2 LEU A 105 0.722 -5.147 -0.558 1.00 50.20 C ATOM 0 H LEU A 105 -2.794 -3.246 3.117 1.00 15.45 H new ATOM 0 HA LEU A 105 -3.083 -3.450 0.242 1.00 5.24 H new ATOM 0 HB2 LEU A 105 -0.663 -3.036 0.536 1.00 44.44 H new ATOM 0 HB3 LEU A 105 -0.564 -4.376 1.661 1.00 44.44 H new ATOM 0 HG LEU A 105 -1.219 -5.937 -0.155 1.00 22.43 H new ATOM 0 HD11 LEU A 105 -1.178 -5.152 -2.492 1.00 64.21 H new ATOM 0 HD12 LEU A 105 -2.487 -4.388 -1.558 1.00 64.21 H new ATOM 0 HD13 LEU A 105 -1.002 -3.476 -1.919 1.00 64.21 H new ATOM 0 HD21 LEU A 105 0.916 -5.827 -1.388 1.00 50.20 H new ATOM 0 HD22 LEU A 105 1.183 -4.181 -0.765 1.00 50.20 H new ATOM 0 HD23 LEU A 105 1.144 -5.562 0.357 1.00 50.20 H new ATOM 1532 N LYS A 106 -4.289 -5.478 0.870 1.00 24.44 N ATOM 1533 CA LYS A 106 -4.927 -6.762 1.070 1.00 11.23 C ATOM 1534 C LYS A 106 -4.549 -7.679 -0.071 1.00 3.43 C ATOM 1535 O LYS A 106 -4.673 -7.305 -1.230 1.00 24.12 O ATOM 1536 CB LYS A 106 -6.441 -6.613 1.167 1.00 21.23 C ATOM 1537 CG LYS A 106 -6.904 -5.826 2.381 1.00 2.23 C ATOM 1538 CD LYS A 106 -8.416 -5.811 2.481 1.00 34.25 C ATOM 1539 CE LYS A 106 -8.884 -5.089 3.732 1.00 60.03 C ATOM 1540 NZ LYS A 106 -10.360 -5.124 3.870 1.00 12.05 N ATOM 0 H LYS A 106 -4.772 -4.862 0.216 1.00 24.44 H new ATOM 0 HA LYS A 106 -4.584 -7.191 2.011 1.00 11.23 H new ATOM 0 HB2 LYS A 106 -6.807 -6.121 0.266 1.00 21.23 H new ATOM 0 HB3 LYS A 106 -6.893 -7.604 1.195 1.00 21.23 H new ATOM 0 HG2 LYS A 106 -6.482 -6.265 3.285 1.00 2.23 H new ATOM 0 HG3 LYS A 106 -6.531 -4.804 2.319 1.00 2.23 H new ATOM 0 HD2 LYS A 106 -8.835 -5.324 1.600 1.00 34.25 H new ATOM 0 HD3 LYS A 106 -8.791 -6.834 2.488 1.00 34.25 H new ATOM 0 HE2 LYS A 106 -8.426 -5.547 4.609 1.00 60.03 H new ATOM 0 HE3 LYS A 106 -8.547 -4.053 3.701 1.00 60.03 H new ATOM 0 HZ1 LYS A 106 -10.640 -4.621 4.736 1.00 12.05 H new ATOM 0 HZ2 LYS A 106 -10.797 -4.664 3.046 1.00 12.05 H new ATOM 0 HZ3 LYS A 106 -10.680 -6.112 3.925 1.00 12.05 H new ATOM 1554 N LEU A 107 -4.089 -8.871 0.252 1.00 62.34 N ATOM 1555 CA LEU A 107 -3.609 -9.789 -0.764 1.00 35.32 C ATOM 1556 C LEU A 107 -4.187 -11.182 -0.575 1.00 0.21 C ATOM 1557 O LEU A 107 -4.192 -11.724 0.531 1.00 53.42 O ATOM 1558 CB LEU A 107 -2.073 -9.850 -0.742 1.00 3.40 C ATOM 1559 CG LEU A 107 -1.420 -10.820 -1.738 1.00 11.40 C ATOM 1560 CD1 LEU A 107 -1.692 -10.395 -3.174 1.00 42.35 C ATOM 1561 CD2 LEU A 107 0.078 -10.917 -1.484 1.00 24.12 C ATOM 0 H LEU A 107 -4.037 -9.227 1.206 1.00 62.34 H new ATOM 0 HA LEU A 107 -3.942 -9.416 -1.733 1.00 35.32 H new ATOM 0 HB2 LEU A 107 -1.687 -8.849 -0.935 1.00 3.40 H new ATOM 0 HB3 LEU A 107 -1.755 -10.126 0.264 1.00 3.40 H new ATOM 0 HG LEU A 107 -1.862 -11.805 -1.589 1.00 11.40 H new ATOM 0 HD11 LEU A 107 -1.218 -11.099 -3.858 1.00 42.35 H new ATOM 0 HD12 LEU A 107 -2.767 -10.383 -3.353 1.00 42.35 H new ATOM 0 HD13 LEU A 107 -1.286 -9.398 -3.341 1.00 42.35 H new ATOM 0 HD21 LEU A 107 0.524 -11.608 -2.199 1.00 24.12 H new ATOM 0 HD22 LEU A 107 0.531 -9.933 -1.600 1.00 24.12 H new ATOM 0 HD23 LEU A 107 0.253 -11.280 -0.471 1.00 24.12 H new ATOM 1573 N ASP A 108 -4.673 -11.745 -1.661 1.00 60.24 N ATOM 1574 CA ASP A 108 -5.210 -13.092 -1.676 1.00 64.35 C ATOM 1575 C ASP A 108 -4.748 -13.773 -2.952 1.00 21.44 C ATOM 1576 O ASP A 108 -5.060 -13.307 -4.031 1.00 0.31 O ATOM 1577 CB ASP A 108 -6.743 -13.045 -1.626 1.00 51.42 C ATOM 1578 CG ASP A 108 -7.380 -14.418 -1.627 1.00 32.35 C ATOM 1579 OD1 ASP A 108 -7.504 -15.022 -0.537 1.00 60.44 O ATOM 1580 OD2 ASP A 108 -7.772 -14.898 -2.711 1.00 21.23 O ATOM 0 H ASP A 108 -4.707 -11.278 -2.567 1.00 60.24 H new ATOM 0 HA ASP A 108 -4.857 -13.648 -0.808 1.00 64.35 H new ATOM 0 HB2 ASP A 108 -7.055 -12.507 -0.731 1.00 51.42 H new ATOM 0 HB3 ASP A 108 -7.111 -12.480 -2.482 1.00 51.42 H new ATOM 1585 N ASP A 109 -4.029 -14.891 -2.809 1.00 22.43 N ATOM 1586 CA ASP A 109 -3.394 -15.619 -3.946 1.00 11.51 C ATOM 1587 C ASP A 109 -2.605 -14.690 -4.901 1.00 2.43 C ATOM 1588 O ASP A 109 -1.383 -14.605 -4.825 1.00 61.52 O ATOM 1589 CB ASP A 109 -4.427 -16.443 -4.733 1.00 34.13 C ATOM 1590 CG ASP A 109 -3.798 -17.210 -5.887 1.00 43.32 C ATOM 1591 OD1 ASP A 109 -3.031 -18.165 -5.630 1.00 22.54 O ATOM 1592 OD2 ASP A 109 -4.073 -16.867 -7.058 1.00 5.53 O ATOM 0 H ASP A 109 -3.862 -15.330 -1.903 1.00 22.43 H new ATOM 0 HA ASP A 109 -2.671 -16.298 -3.495 1.00 11.51 H new ATOM 0 HB2 ASP A 109 -4.918 -17.144 -4.059 1.00 34.13 H new ATOM 0 HB3 ASP A 109 -5.200 -15.778 -5.120 1.00 34.13 H new ATOM 1597 N ASN A 110 -3.326 -13.989 -5.775 1.00 34.24 N ATOM 1598 CA ASN A 110 -2.721 -13.088 -6.764 1.00 62.31 C ATOM 1599 C ASN A 110 -3.631 -11.901 -7.039 1.00 45.33 C ATOM 1600 O ASN A 110 -3.524 -11.247 -8.078 1.00 11.33 O ATOM 1601 CB ASN A 110 -2.420 -13.815 -8.081 1.00 71.00 C ATOM 1602 CG ASN A 110 -1.192 -14.699 -8.013 1.00 64.53 C ATOM 1603 OD1 ASN A 110 -0.070 -14.236 -8.214 1.00 42.50 O ATOM 1604 ND2 ASN A 110 -1.392 -15.971 -7.749 1.00 23.22 N ATOM 0 H ASN A 110 -4.344 -14.027 -5.820 1.00 34.24 H new ATOM 0 HA ASN A 110 -1.781 -12.734 -6.342 1.00 62.31 H new ATOM 0 HB2 ASN A 110 -3.282 -14.423 -8.357 1.00 71.00 H new ATOM 0 HB3 ASN A 110 -2.284 -13.077 -8.872 1.00 71.00 H new ATOM 0 HD21 ASN A 110 -0.601 -16.613 -7.705 1.00 23.22 H new ATOM 0 HD22 ASN A 110 -2.338 -16.316 -7.588 1.00 23.22 H new ATOM 1611 N GLN A 111 -4.495 -11.606 -6.090 1.00 33.35 N ATOM 1612 CA GLN A 111 -5.403 -10.482 -6.197 1.00 24.42 C ATOM 1613 C GLN A 111 -5.193 -9.581 -4.999 1.00 13.23 C ATOM 1614 O GLN A 111 -5.203 -10.044 -3.852 1.00 13.24 O ATOM 1615 CB GLN A 111 -6.875 -10.939 -6.303 1.00 65.22 C ATOM 1616 CG GLN A 111 -7.385 -11.724 -5.103 1.00 42.24 C ATOM 1617 CD GLN A 111 -8.838 -12.132 -5.237 1.00 14.13 C ATOM 1618 OE1 GLN A 111 -9.637 -11.443 -5.875 1.00 2.15 O ATOM 1619 NE2 GLN A 111 -9.191 -13.250 -4.634 1.00 31.54 N ATOM 0 H GLN A 111 -4.588 -12.137 -5.224 1.00 33.35 H new ATOM 0 HA GLN A 111 -5.187 -9.934 -7.114 1.00 24.42 H new ATOM 0 HB2 GLN A 111 -7.505 -10.060 -6.440 1.00 65.22 H new ATOM 0 HB3 GLN A 111 -6.987 -11.553 -7.196 1.00 65.22 H new ATOM 0 HG2 GLN A 111 -6.773 -12.617 -4.973 1.00 42.24 H new ATOM 0 HG3 GLN A 111 -7.264 -11.121 -4.203 1.00 42.24 H new ATOM 0 HE21 GLN A 111 -8.498 -13.791 -4.116 1.00 31.54 H new ATOM 0 HE22 GLN A 111 -10.157 -13.574 -4.685 1.00 31.54 H new ATOM 1628 N ALA A 112 -4.967 -8.316 -5.249 1.00 31.54 N ATOM 1629 CA ALA A 112 -4.670 -7.392 -4.183 1.00 0.43 C ATOM 1630 C ALA A 112 -5.489 -6.126 -4.281 1.00 24.44 C ATOM 1631 O ALA A 112 -5.768 -5.636 -5.370 1.00 70.44 O ATOM 1632 CB ALA A 112 -3.190 -7.054 -4.195 1.00 50.44 C ATOM 0 H ALA A 112 -4.983 -7.902 -6.181 1.00 31.54 H new ATOM 0 HA ALA A 112 -4.932 -7.878 -3.243 1.00 0.43 H new ATOM 0 HB1 ALA A 112 -2.970 -6.355 -3.388 1.00 50.44 H new ATOM 0 HB2 ALA A 112 -2.608 -7.965 -4.056 1.00 50.44 H new ATOM 0 HB3 ALA A 112 -2.928 -6.599 -5.150 1.00 50.44 H new ATOM 1638 N GLN A 113 -5.905 -5.628 -3.140 1.00 43.02 N ATOM 1639 CA GLN A 113 -6.589 -4.358 -3.065 1.00 72.13 C ATOM 1640 C GLN A 113 -5.625 -3.296 -2.568 1.00 3.31 C ATOM 1641 O GLN A 113 -5.084 -3.403 -1.461 1.00 1.12 O ATOM 1642 CB GLN A 113 -7.810 -4.438 -2.142 1.00 23.22 C ATOM 1643 CG GLN A 113 -8.447 -3.080 -1.852 1.00 63.45 C ATOM 1644 CD GLN A 113 -9.697 -3.172 -0.998 1.00 5.43 C ATOM 1645 OE1 GLN A 113 -9.787 -4.207 -0.188 1.00 34.53 O flip ATOM 1646 NE2 GLN A 113 -10.584 -2.320 -1.082 1.00 60.44 N flip ATOM 0 H GLN A 113 -5.779 -6.090 -2.240 1.00 43.02 H new ATOM 0 HA GLN A 113 -6.943 -4.095 -4.062 1.00 72.13 H new ATOM 0 HB2 GLN A 113 -8.556 -5.090 -2.596 1.00 23.22 H new ATOM 0 HB3 GLN A 113 -7.513 -4.900 -1.200 1.00 23.22 H new ATOM 0 HG2 GLN A 113 -7.718 -2.445 -1.349 1.00 63.45 H new ATOM 0 HG3 GLN A 113 -8.695 -2.594 -2.796 1.00 63.45 H new ATOM 0 HE21 GLN A 113 -10.476 -1.533 -1.722 1.00 60.44 H new ATOM 0 HE22 GLN A 113 -11.426 -2.402 -0.512 1.00 60.44 H new ATOM 1655 N LEU A 114 -5.403 -2.287 -3.384 1.00 42.02 N ATOM 1656 CA LEU A 114 -4.502 -1.212 -3.032 1.00 14.14 C ATOM 1657 C LEU A 114 -5.303 -0.078 -2.410 1.00 14.12 C ATOM 1658 O LEU A 114 -6.119 0.566 -3.078 1.00 51.14 O ATOM 1659 CB LEU A 114 -3.741 -0.727 -4.288 1.00 62.40 C ATOM 1660 CG LEU A 114 -2.386 -0.019 -4.059 1.00 15.00 C ATOM 1661 CD1 LEU A 114 -2.557 1.301 -3.324 1.00 52.24 C ATOM 1662 CD2 LEU A 114 -1.421 -0.929 -3.310 1.00 33.45 C ATOM 0 H LEU A 114 -5.838 -2.190 -4.301 1.00 42.02 H new ATOM 0 HA LEU A 114 -3.767 -1.565 -2.309 1.00 14.14 H new ATOM 0 HB2 LEU A 114 -3.568 -1.589 -4.933 1.00 62.40 H new ATOM 0 HB3 LEU A 114 -4.391 -0.045 -4.835 1.00 62.40 H new ATOM 0 HG LEU A 114 -1.965 0.203 -5.039 1.00 15.00 H new ATOM 0 HD11 LEU A 114 -1.582 1.768 -3.182 1.00 52.24 H new ATOM 0 HD12 LEU A 114 -3.195 1.963 -3.909 1.00 52.24 H new ATOM 0 HD13 LEU A 114 -3.017 1.120 -2.353 1.00 52.24 H new ATOM 0 HD21 LEU A 114 -0.474 -0.410 -3.160 1.00 33.45 H new ATOM 0 HD22 LEU A 114 -1.847 -1.194 -2.342 1.00 33.45 H new ATOM 0 HD23 LEU A 114 -1.250 -1.835 -3.891 1.00 33.45 H new ATOM 1674 N GLN A 115 -5.103 0.133 -1.128 1.00 22.14 N ATOM 1675 CA GLN A 115 -5.813 1.169 -0.411 1.00 15.41 C ATOM 1676 C GLN A 115 -4.936 2.392 -0.236 1.00 75.23 C ATOM 1677 O GLN A 115 -3.734 2.276 -0.026 1.00 22.24 O ATOM 1678 CB GLN A 115 -6.269 0.654 0.941 1.00 3.10 C ATOM 1679 CG GLN A 115 -7.057 -0.644 0.863 1.00 1.43 C ATOM 1680 CD GLN A 115 -7.478 -1.159 2.221 1.00 34.21 C ATOM 1681 OE1 GLN A 115 -7.598 -2.361 2.427 1.00 22.12 O ATOM 1682 NE2 GLN A 115 -7.712 -0.255 3.154 1.00 4.53 N ATOM 0 H GLN A 115 -4.450 -0.403 -0.557 1.00 22.14 H new ATOM 0 HA GLN A 115 -6.690 1.452 -0.993 1.00 15.41 H new ATOM 0 HB2 GLN A 115 -5.396 0.502 1.576 1.00 3.10 H new ATOM 0 HB3 GLN A 115 -6.884 1.415 1.422 1.00 3.10 H new ATOM 0 HG2 GLN A 115 -7.943 -0.489 0.248 1.00 1.43 H new ATOM 0 HG3 GLN A 115 -6.452 -1.401 0.364 1.00 1.43 H new ATOM 0 HE21 GLN A 115 -7.601 0.737 2.943 1.00 4.53 H new ATOM 0 HE22 GLN A 115 -8.004 -0.548 4.086 1.00 4.53 H new ATOM 1691 N MET A 116 -5.541 3.553 -0.311 1.00 24.31 N ATOM 1692 CA MET A 116 -4.820 4.804 -0.187 1.00 43.33 C ATOM 1693 C MET A 116 -5.489 5.691 0.846 1.00 15.40 C ATOM 1694 O MET A 116 -6.612 6.161 0.642 1.00 52.15 O ATOM 1695 CB MET A 116 -4.781 5.525 -1.537 1.00 1.02 C ATOM 1696 CG MET A 116 -4.151 4.714 -2.656 1.00 72.10 C ATOM 1697 SD MET A 116 -4.375 5.484 -4.269 1.00 61.32 S ATOM 1698 CE MET A 116 -3.602 4.277 -5.336 1.00 54.45 C ATOM 0 H MET A 116 -6.544 3.661 -0.459 1.00 24.31 H new ATOM 0 HA MET A 116 -3.800 4.589 0.133 1.00 43.33 H new ATOM 0 HB2 MET A 116 -5.798 5.791 -1.824 1.00 1.02 H new ATOM 0 HB3 MET A 116 -4.228 6.457 -1.423 1.00 1.02 H new ATOM 0 HG2 MET A 116 -3.086 4.593 -2.459 1.00 72.10 H new ATOM 0 HG3 MET A 116 -4.588 3.716 -2.669 1.00 72.10 H new ATOM 0 HE1 MET A 116 -3.389 4.731 -6.304 1.00 54.45 H new ATOM 0 HE2 MET A 116 -2.672 3.934 -4.883 1.00 54.45 H new ATOM 0 HE3 MET A 116 -4.273 3.429 -5.472 1.00 54.45 H new ATOM 1708 N VAL A 117 -4.825 5.892 1.964 1.00 44.21 N ATOM 1709 CA VAL A 117 -5.344 6.752 3.005 1.00 45.12 C ATOM 1710 C VAL A 117 -4.596 8.078 3.001 1.00 61.15 C ATOM 1711 O VAL A 117 -3.394 8.127 3.282 1.00 15.44 O ATOM 1712 CB VAL A 117 -5.243 6.093 4.396 1.00 72.53 C ATOM 1713 CG1 VAL A 117 -5.823 7.003 5.469 1.00 14.33 C ATOM 1714 CG2 VAL A 117 -5.946 4.742 4.404 1.00 23.42 C ATOM 0 H VAL A 117 -3.921 5.470 2.175 1.00 44.21 H new ATOM 0 HA VAL A 117 -6.400 6.926 2.798 1.00 45.12 H new ATOM 0 HB VAL A 117 -4.188 5.933 4.618 1.00 72.53 H new ATOM 0 HG11 VAL A 117 -5.741 6.517 6.441 1.00 14.33 H new ATOM 0 HG12 VAL A 117 -5.272 7.943 5.485 1.00 14.33 H new ATOM 0 HG13 VAL A 117 -6.872 7.201 5.250 1.00 14.33 H new ATOM 0 HG21 VAL A 117 -5.863 4.294 5.394 1.00 23.42 H new ATOM 0 HG22 VAL A 117 -6.998 4.878 4.154 1.00 23.42 H new ATOM 0 HG23 VAL A 117 -5.481 4.085 3.669 1.00 23.42 H new ATOM 1724 N SER A 118 -5.315 9.137 2.694 1.00 4.22 N ATOM 1725 CA SER A 118 -4.747 10.466 2.572 1.00 73.22 C ATOM 1726 C SER A 118 -5.857 11.514 2.611 1.00 63.20 C ATOM 1727 O SER A 118 -6.982 11.231 2.190 1.00 4.14 O ATOM 1728 CB SER A 118 -3.950 10.576 1.264 1.00 72.12 C ATOM 1729 OG SER A 118 -4.706 10.083 0.169 1.00 32.52 O ATOM 0 H SER A 118 -6.319 9.101 2.520 1.00 4.22 H new ATOM 0 HA SER A 118 -4.071 10.644 3.408 1.00 73.22 H new ATOM 0 HB2 SER A 118 -3.679 11.616 1.085 1.00 72.12 H new ATOM 0 HB3 SER A 118 -3.020 10.014 1.352 1.00 72.12 H new ATOM 0 HG SER A 118 -4.180 10.164 -0.654 1.00 32.52 H new ATOM 1735 N PRO A 119 -5.570 12.730 3.129 1.00 33.20 N ATOM 1736 CA PRO A 119 -6.556 13.820 3.182 1.00 73.10 C ATOM 1737 C PRO A 119 -7.131 14.128 1.796 1.00 23.22 C ATOM 1738 O PRO A 119 -6.508 13.818 0.774 1.00 71.12 O ATOM 1739 CB PRO A 119 -5.740 15.015 3.693 1.00 62.44 C ATOM 1740 CG PRO A 119 -4.592 14.408 4.419 1.00 20.23 C ATOM 1741 CD PRO A 119 -4.273 13.129 3.700 1.00 24.53 C ATOM 0 HA PRO A 119 -7.411 13.573 3.811 1.00 73.10 H new ATOM 0 HB2 PRO A 119 -5.400 15.643 2.870 1.00 62.44 H new ATOM 0 HB3 PRO A 119 -6.335 15.648 4.352 1.00 62.44 H new ATOM 0 HG2 PRO A 119 -3.733 15.079 4.420 1.00 20.23 H new ATOM 0 HG3 PRO A 119 -4.848 14.216 5.461 1.00 20.23 H new ATOM 0 HD2 PRO A 119 -3.521 13.280 2.925 1.00 24.53 H new ATOM 0 HD3 PRO A 119 -3.883 12.372 4.380 1.00 24.53 H new ATOM 1749 N HIS A 120 -8.285 14.770 1.746 1.00 10.32 N ATOM 1750 CA HIS A 120 -8.911 15.043 0.469 1.00 45.20 C ATOM 1751 C HIS A 120 -8.384 16.341 -0.114 1.00 73.52 C ATOM 1752 O HIS A 120 -8.413 17.390 0.530 1.00 62.12 O ATOM 1753 CB HIS A 120 -10.463 15.051 0.566 1.00 13.33 C ATOM 1754 CG HIS A 120 -11.068 16.192 1.351 1.00 54.24 C ATOM 1755 ND1 HIS A 120 -11.424 16.094 2.676 1.00 65.23 N ATOM 1756 CD2 HIS A 120 -11.406 17.451 0.972 1.00 65.04 C ATOM 1757 CE1 HIS A 120 -11.951 17.231 3.078 1.00 1.31 C ATOM 1758 NE2 HIS A 120 -11.951 18.073 2.065 1.00 4.20 N ATOM 0 H HIS A 120 -8.799 15.106 2.561 1.00 10.32 H new ATOM 0 HA HIS A 120 -8.647 14.231 -0.208 1.00 45.20 H new ATOM 0 HB2 HIS A 120 -10.871 15.074 -0.444 1.00 13.33 H new ATOM 0 HB3 HIS A 120 -10.785 14.113 1.019 1.00 13.33 H new ATOM 0 HD2 HIS A 120 -11.271 17.882 -0.009 1.00 65.04 H new ATOM 0 HE1 HIS A 120 -12.321 17.439 4.071 1.00 1.31 H new ATOM 0 HE2 HIS A 120 -12.300 19.031 2.090 1.00 4.20 H new ATOM 1767 N SER A 121 -7.877 16.242 -1.316 1.00 51.41 N ATOM 1768 CA SER A 121 -7.300 17.361 -2.017 1.00 54.00 C ATOM 1769 C SER A 121 -7.153 16.988 -3.483 1.00 74.43 C ATOM 1770 O SER A 121 -7.600 15.908 -3.894 1.00 70.01 O ATOM 1771 CB SER A 121 -5.936 17.701 -1.410 1.00 24.01 C ATOM 1772 OG SER A 121 -5.094 16.555 -1.385 1.00 31.42 O ATOM 0 H SER A 121 -7.853 15.369 -1.843 1.00 51.41 H new ATOM 0 HA SER A 121 -7.943 18.237 -1.928 1.00 54.00 H new ATOM 0 HB2 SER A 121 -5.462 18.493 -1.990 1.00 24.01 H new ATOM 0 HB3 SER A 121 -6.068 18.083 -0.398 1.00 24.01 H new ATOM 0 HG SER A 121 -4.839 16.356 -0.460 1.00 31.42 H new ATOM 1778 N HIS A 122 -6.517 17.843 -4.271 1.00 22.21 N ATOM 1779 CA HIS A 122 -6.321 17.543 -5.683 1.00 64.42 C ATOM 1780 C HIS A 122 -5.353 16.390 -5.862 1.00 70.44 C ATOM 1781 O HIS A 122 -5.322 15.752 -6.916 1.00 24.24 O ATOM 1782 CB HIS A 122 -5.869 18.771 -6.471 1.00 35.21 C ATOM 1783 CG HIS A 122 -7.006 19.645 -6.902 1.00 52.54 C ATOM 1784 ND1 HIS A 122 -7.672 19.473 -8.096 1.00 30.43 N ATOM 1785 CD2 HIS A 122 -7.603 20.696 -6.291 1.00 21.41 C ATOM 1786 CE1 HIS A 122 -8.625 20.375 -8.203 1.00 64.22 C ATOM 1787 NE2 HIS A 122 -8.606 21.131 -7.121 1.00 51.05 N ATOM 0 H HIS A 122 -6.133 18.737 -3.964 1.00 22.21 H new ATOM 0 HA HIS A 122 -7.287 17.242 -6.088 1.00 64.42 H new ATOM 0 HB2 HIS A 122 -5.182 19.355 -5.859 1.00 35.21 H new ATOM 0 HB3 HIS A 122 -5.315 18.446 -7.351 1.00 35.21 H new ATOM 0 HD2 HIS A 122 -7.339 21.114 -5.331 1.00 21.41 H new ATOM 0 HE1 HIS A 122 -9.306 20.479 -9.034 1.00 64.22 H new ATOM 0 HE2 HIS A 122 -9.235 21.912 -6.932 1.00 51.05 H new ATOM 1796 N VAL A 123 -4.572 16.106 -4.823 1.00 75.31 N ATOM 1797 CA VAL A 123 -3.671 14.972 -4.842 1.00 51.44 C ATOM 1798 C VAL A 123 -4.484 13.683 -4.896 1.00 34.45 C ATOM 1799 O VAL A 123 -4.114 12.733 -5.572 1.00 54.44 O ATOM 1800 CB VAL A 123 -2.757 14.951 -3.586 1.00 45.52 C ATOM 1801 CG1 VAL A 123 -1.787 13.782 -3.637 1.00 74.12 C ATOM 1802 CG2 VAL A 123 -1.998 16.257 -3.451 1.00 44.25 C ATOM 0 H VAL A 123 -4.550 16.650 -3.960 1.00 75.31 H new ATOM 0 HA VAL A 123 -3.035 15.057 -5.723 1.00 51.44 H new ATOM 0 HB VAL A 123 -3.396 14.828 -2.712 1.00 45.52 H new ATOM 0 HG11 VAL A 123 -1.159 13.791 -2.746 1.00 74.12 H new ATOM 0 HG12 VAL A 123 -2.346 12.847 -3.678 1.00 74.12 H new ATOM 0 HG13 VAL A 123 -1.159 13.868 -4.524 1.00 74.12 H new ATOM 0 HG21 VAL A 123 -1.364 16.220 -2.565 1.00 44.25 H new ATOM 0 HG22 VAL A 123 -1.378 16.410 -4.334 1.00 44.25 H new ATOM 0 HG23 VAL A 123 -2.705 17.081 -3.357 1.00 44.25 H new ATOM 1812 N ARG A 124 -5.630 13.688 -4.207 1.00 41.31 N ATOM 1813 CA ARG A 124 -6.521 12.528 -4.167 1.00 5.45 C ATOM 1814 C ARG A 124 -7.011 12.187 -5.577 1.00 23.30 C ATOM 1815 O ARG A 124 -7.189 11.016 -5.922 1.00 11.54 O ATOM 1816 CB ARG A 124 -7.707 12.794 -3.201 1.00 50.11 C ATOM 1817 CG ARG A 124 -8.724 11.652 -3.090 1.00 41.41 C ATOM 1818 CD ARG A 124 -9.812 11.759 -4.152 1.00 3.42 C ATOM 1819 NE ARG A 124 -10.629 10.549 -4.236 1.00 51.04 N ATOM 1820 CZ ARG A 124 -11.179 10.099 -5.366 1.00 50.53 C ATOM 1821 NH1 ARG A 124 -11.082 10.814 -6.489 1.00 3.24 N ATOM 1822 NH2 ARG A 124 -11.849 8.949 -5.368 1.00 0.54 N ATOM 0 H ARG A 124 -5.962 14.488 -3.668 1.00 41.31 H new ATOM 0 HA ARG A 124 -5.970 11.667 -3.789 1.00 5.45 H new ATOM 0 HB2 ARG A 124 -7.307 13.002 -2.208 1.00 50.11 H new ATOM 0 HB3 ARG A 124 -8.228 13.693 -3.529 1.00 50.11 H new ATOM 0 HG2 ARG A 124 -8.210 10.696 -3.191 1.00 41.41 H new ATOM 0 HG3 ARG A 124 -9.180 11.666 -2.100 1.00 41.41 H new ATOM 0 HD2 ARG A 124 -10.453 12.612 -3.928 1.00 3.42 H new ATOM 0 HD3 ARG A 124 -9.352 11.952 -5.121 1.00 3.42 H new ATOM 0 HE ARG A 124 -10.788 10.017 -3.380 1.00 51.04 H new ATOM 0 HH11 ARG A 124 -10.587 11.706 -6.485 1.00 3.24 H new ATOM 0 HH12 ARG A 124 -11.503 10.469 -7.352 1.00 3.24 H new ATOM 0 HH21 ARG A 124 -11.942 8.412 -4.506 1.00 0.54 H new ATOM 0 HH22 ARG A 124 -12.269 8.605 -6.231 1.00 0.54 H new ATOM 1836 N ALA A 125 -7.213 13.218 -6.391 1.00 71.01 N ATOM 1837 CA ALA A 125 -7.631 13.026 -7.771 1.00 72.41 C ATOM 1838 C ALA A 125 -6.526 12.330 -8.555 1.00 0.33 C ATOM 1839 O ALA A 125 -6.790 11.467 -9.396 1.00 64.34 O ATOM 1840 CB ALA A 125 -7.983 14.363 -8.412 1.00 2.34 C ATOM 0 H ALA A 125 -7.094 14.193 -6.117 1.00 71.01 H new ATOM 0 HA ALA A 125 -8.521 12.397 -7.786 1.00 72.41 H new ATOM 0 HB1 ALA A 125 -8.294 14.201 -9.444 1.00 2.34 H new ATOM 0 HB2 ALA A 125 -8.797 14.829 -7.857 1.00 2.34 H new ATOM 0 HB3 ALA A 125 -7.111 15.016 -8.394 1.00 2.34 H new ATOM 1846 N ALA A 126 -5.291 12.713 -8.262 1.00 1.02 N ATOM 1847 CA ALA A 126 -4.124 12.108 -8.888 1.00 22.44 C ATOM 1848 C ALA A 126 -3.958 10.653 -8.460 1.00 25.31 C ATOM 1849 O ALA A 126 -3.505 9.828 -9.248 1.00 3.04 O ATOM 1850 CB ALA A 126 -2.872 12.912 -8.570 1.00 51.03 C ATOM 0 H ALA A 126 -5.071 13.447 -7.588 1.00 1.02 H new ATOM 0 HA ALA A 126 -4.277 12.119 -9.967 1.00 22.44 H new ATOM 0 HB1 ALA A 126 -2.009 12.446 -9.046 1.00 51.03 H new ATOM 0 HB2 ALA A 126 -2.988 13.929 -8.945 1.00 51.03 H new ATOM 0 HB3 ALA A 126 -2.721 12.938 -7.491 1.00 51.03 H new ATOM 1856 N LEU A 127 -4.328 10.338 -7.216 1.00 55.22 N ATOM 1857 CA LEU A 127 -4.276 8.951 -6.748 1.00 2.02 C ATOM 1858 C LEU A 127 -5.260 8.095 -7.524 1.00 73.22 C ATOM 1859 O LEU A 127 -4.908 7.027 -8.024 1.00 4.22 O ATOM 1860 CB LEU A 127 -4.569 8.827 -5.237 1.00 34.24 C ATOM 1861 CG LEU A 127 -3.375 8.957 -4.275 1.00 14.21 C ATOM 1862 CD1 LEU A 127 -2.163 8.202 -4.789 1.00 62.24 C ATOM 1863 CD2 LEU A 127 -3.040 10.404 -3.999 1.00 44.40 C ATOM 0 H LEU A 127 -4.661 11.011 -6.526 1.00 55.22 H new ATOM 0 HA LEU A 127 -3.259 8.599 -6.920 1.00 2.02 H new ATOM 0 HB2 LEU A 127 -5.301 9.590 -4.971 1.00 34.24 H new ATOM 0 HB3 LEU A 127 -5.039 7.859 -5.063 1.00 34.24 H new ATOM 0 HG LEU A 127 -3.671 8.502 -3.330 1.00 14.21 H new ATOM 0 HD11 LEU A 127 -1.338 8.315 -4.085 1.00 62.24 H new ATOM 0 HD12 LEU A 127 -2.409 7.145 -4.892 1.00 62.24 H new ATOM 0 HD13 LEU A 127 -1.869 8.602 -5.759 1.00 62.24 H new ATOM 0 HD21 LEU A 127 -2.192 10.457 -3.316 1.00 44.40 H new ATOM 0 HD22 LEU A 127 -2.785 10.903 -4.934 1.00 44.40 H new ATOM 0 HD23 LEU A 127 -3.901 10.897 -3.548 1.00 44.40 H new ATOM 1875 N GLU A 128 -6.490 8.578 -7.632 1.00 51.53 N ATOM 1876 CA GLU A 128 -7.530 7.868 -8.360 1.00 41.11 C ATOM 1877 C GLU A 128 -7.134 7.711 -9.824 1.00 73.03 C ATOM 1878 O GLU A 128 -7.226 6.625 -10.391 1.00 52.11 O ATOM 1879 CB GLU A 128 -8.862 8.608 -8.232 1.00 41.10 C ATOM 1880 CG GLU A 128 -10.033 7.907 -8.902 1.00 20.41 C ATOM 1881 CD GLU A 128 -11.343 8.604 -8.634 1.00 41.14 C ATOM 1882 OE1 GLU A 128 -11.525 9.743 -9.105 1.00 74.02 O ATOM 1883 OE2 GLU A 128 -12.200 8.033 -7.930 1.00 44.21 O ATOM 0 H GLU A 128 -6.792 9.462 -7.223 1.00 51.53 H new ATOM 0 HA GLU A 128 -7.649 6.874 -7.930 1.00 41.11 H new ATOM 0 HB2 GLU A 128 -9.090 8.742 -7.175 1.00 41.10 H new ATOM 0 HB3 GLU A 128 -8.754 9.603 -8.663 1.00 41.10 H new ATOM 0 HG2 GLU A 128 -9.861 7.862 -9.977 1.00 20.41 H new ATOM 0 HG3 GLU A 128 -10.091 6.879 -8.545 1.00 20.41 H new ATOM 1890 N ALA A 129 -6.689 8.802 -10.429 1.00 61.30 N ATOM 1891 CA ALA A 129 -6.220 8.789 -11.808 1.00 31.52 C ATOM 1892 C ALA A 129 -5.046 7.837 -12.002 1.00 45.24 C ATOM 1893 O ALA A 129 -4.823 7.342 -13.103 1.00 21.20 O ATOM 1894 CB ALA A 129 -5.816 10.189 -12.226 1.00 3.23 C ATOM 0 H ALA A 129 -6.642 9.717 -9.981 1.00 61.30 H new ATOM 0 HA ALA A 129 -7.041 8.436 -12.432 1.00 31.52 H new ATOM 0 HB1 ALA A 129 -5.466 10.174 -13.258 1.00 3.23 H new ATOM 0 HB2 ALA A 129 -6.675 10.855 -12.144 1.00 3.23 H new ATOM 0 HB3 ALA A 129 -5.016 10.546 -11.577 1.00 3.23 H new ATOM 1900 N ALA A 130 -4.293 7.589 -10.945 1.00 3.00 N ATOM 1901 CA ALA A 130 -3.136 6.718 -11.023 1.00 5.42 C ATOM 1902 C ALA A 130 -3.525 5.240 -11.002 1.00 32.14 C ATOM 1903 O ALA A 130 -2.718 4.384 -11.360 1.00 31.15 O ATOM 1904 CB ALA A 130 -2.163 7.031 -9.895 1.00 61.03 C ATOM 0 H ALA A 130 -4.464 7.981 -10.019 1.00 3.00 H new ATOM 0 HA ALA A 130 -2.648 6.908 -11.979 1.00 5.42 H new ATOM 0 HB1 ALA A 130 -1.299 6.370 -9.966 1.00 61.03 H new ATOM 0 HB2 ALA A 130 -1.834 8.067 -9.975 1.00 61.03 H new ATOM 0 HB3 ALA A 130 -2.658 6.880 -8.935 1.00 61.03 H new ATOM 1910 N LEU A 131 -4.768 4.950 -10.608 1.00 72.14 N ATOM 1911 CA LEU A 131 -5.241 3.564 -10.475 1.00 35.34 C ATOM 1912 C LEU A 131 -5.092 2.741 -11.774 1.00 31.24 C ATOM 1913 O LEU A 131 -4.513 1.653 -11.736 1.00 0.13 O ATOM 1914 CB LEU A 131 -6.689 3.509 -9.955 1.00 55.33 C ATOM 1915 CG LEU A 131 -6.899 3.962 -8.507 1.00 73.10 C ATOM 1916 CD1 LEU A 131 -8.380 3.994 -8.171 1.00 13.34 C ATOM 1917 CD2 LEU A 131 -6.159 3.041 -7.549 1.00 4.15 C ATOM 0 H LEU A 131 -5.467 5.655 -10.375 1.00 72.14 H new ATOM 0 HA LEU A 131 -4.590 3.098 -9.735 1.00 35.34 H new ATOM 0 HB2 LEU A 131 -7.310 4.128 -10.602 1.00 55.33 H new ATOM 0 HB3 LEU A 131 -7.050 2.485 -10.051 1.00 55.33 H new ATOM 0 HG LEU A 131 -6.497 4.969 -8.399 1.00 73.10 H new ATOM 0 HD11 LEU A 131 -8.512 4.318 -7.139 1.00 13.34 H new ATOM 0 HD12 LEU A 131 -8.889 4.690 -8.838 1.00 13.34 H new ATOM 0 HD13 LEU A 131 -8.803 2.997 -8.295 1.00 13.34 H new ATOM 0 HD21 LEU A 131 -6.319 3.377 -6.525 1.00 4.15 H new ATOM 0 HD22 LEU A 131 -6.534 2.024 -7.660 1.00 4.15 H new ATOM 0 HD23 LEU A 131 -5.093 3.061 -7.775 1.00 4.15 H new ATOM 1929 N PRO A 132 -5.611 3.235 -12.947 1.00 15.15 N ATOM 1930 CA PRO A 132 -5.493 2.512 -14.222 1.00 62.23 C ATOM 1931 C PRO A 132 -4.053 2.089 -14.515 1.00 54.22 C ATOM 1932 O PRO A 132 -3.747 0.894 -14.571 1.00 52.53 O ATOM 1933 CB PRO A 132 -5.968 3.535 -15.257 1.00 51.43 C ATOM 1934 CG PRO A 132 -6.902 4.415 -14.511 1.00 33.42 C ATOM 1935 CD PRO A 132 -6.359 4.504 -13.112 1.00 55.31 C ATOM 0 HA PRO A 132 -6.070 1.587 -14.221 1.00 62.23 H new ATOM 0 HB2 PRO A 132 -5.132 4.101 -15.667 1.00 51.43 H new ATOM 0 HB3 PRO A 132 -6.466 3.049 -16.096 1.00 51.43 H new ATOM 0 HG2 PRO A 132 -6.960 5.402 -14.971 1.00 33.42 H new ATOM 0 HG3 PRO A 132 -7.911 4.003 -14.512 1.00 33.42 H new ATOM 0 HD2 PRO A 132 -5.710 5.371 -12.988 1.00 55.31 H new ATOM 0 HD3 PRO A 132 -7.158 4.597 -12.377 1.00 55.31 H new ATOM 1943 N MET A 133 -3.179 3.072 -14.699 1.00 25.03 N ATOM 1944 CA MET A 133 -1.759 2.814 -14.955 1.00 52.34 C ATOM 1945 C MET A 133 -1.153 1.888 -13.897 1.00 43.43 C ATOM 1946 O MET A 133 -0.449 0.938 -14.233 1.00 5.12 O ATOM 1947 CB MET A 133 -0.980 4.123 -14.984 1.00 14.21 C ATOM 1948 CG MET A 133 0.504 3.947 -15.277 1.00 52.22 C ATOM 1949 SD MET A 133 1.477 5.398 -14.837 1.00 41.32 S ATOM 1950 CE MET A 133 1.203 5.445 -13.069 1.00 63.21 C ATOM 0 H MET A 133 -3.427 4.061 -14.676 1.00 25.03 H new ATOM 0 HA MET A 133 -1.688 2.321 -15.925 1.00 52.34 H new ATOM 0 HB2 MET A 133 -1.415 4.778 -15.739 1.00 14.21 H new ATOM 0 HB3 MET A 133 -1.094 4.625 -14.023 1.00 14.21 H new ATOM 0 HG2 MET A 133 0.879 3.083 -14.728 1.00 52.22 H new ATOM 0 HG3 MET A 133 0.638 3.733 -16.337 1.00 52.22 H new ATOM 0 HE1 MET A 133 2.033 5.960 -12.586 1.00 63.21 H new ATOM 0 HE2 MET A 133 0.274 5.976 -12.859 1.00 63.21 H new ATOM 0 HE3 MET A 133 1.135 4.427 -12.684 1.00 63.21 H new ATOM 1960 N LEU A 134 -1.446 2.157 -12.626 1.00 71.11 N ATOM 1961 CA LEU A 134 -0.914 1.356 -11.522 1.00 23.43 C ATOM 1962 C LEU A 134 -1.254 -0.125 -11.700 1.00 32.24 C ATOM 1963 O LEU A 134 -0.361 -0.969 -11.803 1.00 25.23 O ATOM 1964 CB LEU A 134 -1.461 1.862 -10.182 1.00 52.02 C ATOM 1965 CG LEU A 134 -0.954 1.137 -8.934 1.00 3.30 C ATOM 1966 CD1 LEU A 134 0.544 1.331 -8.772 1.00 55.21 C ATOM 1967 CD2 LEU A 134 -1.694 1.624 -7.700 1.00 30.33 C ATOM 0 H LEU A 134 -2.050 2.925 -12.333 1.00 71.11 H new ATOM 0 HA LEU A 134 0.171 1.461 -11.526 1.00 23.43 H new ATOM 0 HB2 LEU A 134 -1.216 2.920 -10.088 1.00 52.02 H new ATOM 0 HB3 LEU A 134 -2.548 1.788 -10.205 1.00 52.02 H new ATOM 0 HG LEU A 134 -1.148 0.071 -9.053 1.00 3.30 H new ATOM 0 HD11 LEU A 134 0.884 0.807 -7.879 1.00 55.21 H new ATOM 0 HD12 LEU A 134 1.059 0.931 -9.645 1.00 55.21 H new ATOM 0 HD13 LEU A 134 0.765 2.394 -8.676 1.00 55.21 H new ATOM 0 HD21 LEU A 134 -1.321 1.098 -6.821 1.00 30.33 H new ATOM 0 HD22 LEU A 134 -1.532 2.695 -7.578 1.00 30.33 H new ATOM 0 HD23 LEU A 134 -2.760 1.429 -7.814 1.00 30.33 H new ATOM 1979 N ARG A 135 -2.546 -0.433 -11.738 1.00 71.01 N ATOM 1980 CA ARG A 135 -2.995 -1.814 -11.905 1.00 4.44 C ATOM 1981 C ARG A 135 -2.465 -2.430 -13.202 1.00 70.40 C ATOM 1982 O ARG A 135 -2.269 -3.634 -13.276 1.00 30.42 O ATOM 1983 CB ARG A 135 -4.538 -1.931 -11.792 1.00 14.42 C ATOM 1984 CG ARG A 135 -5.338 -1.323 -12.943 1.00 23.44 C ATOM 1985 CD ARG A 135 -5.583 -2.335 -14.058 1.00 32.52 C ATOM 1986 NE ARG A 135 -6.384 -1.777 -15.145 1.00 15.54 N ATOM 1987 CZ ARG A 135 -6.894 -2.495 -16.153 1.00 10.42 C ATOM 1988 NH1 ARG A 135 -6.721 -3.818 -16.197 1.00 74.40 N ATOM 1989 NH2 ARG A 135 -7.585 -1.893 -17.108 1.00 34.03 N ATOM 0 H ARG A 135 -3.299 0.250 -11.656 1.00 71.01 H new ATOM 0 HA ARG A 135 -2.571 -2.394 -11.085 1.00 4.44 H new ATOM 0 HB2 ARG A 135 -4.798 -2.986 -11.712 1.00 14.42 H new ATOM 0 HB3 ARG A 135 -4.853 -1.453 -10.864 1.00 14.42 H new ATOM 0 HG2 ARG A 135 -6.294 -0.957 -12.568 1.00 23.44 H new ATOM 0 HG3 ARG A 135 -4.802 -0.463 -13.344 1.00 23.44 H new ATOM 0 HD2 ARG A 135 -4.626 -2.677 -14.453 1.00 32.52 H new ATOM 0 HD3 ARG A 135 -6.089 -3.209 -13.648 1.00 32.52 H new ATOM 0 HE ARG A 135 -6.567 -0.774 -15.135 1.00 15.54 H new ATOM 0 HH11 ARG A 135 -6.197 -4.289 -15.459 1.00 74.40 H new ATOM 0 HH12 ARG A 135 -7.113 -4.358 -16.968 1.00 74.40 H new ATOM 0 HH21 ARG A 135 -7.728 -0.884 -17.075 1.00 34.03 H new ATOM 0 HH22 ARG A 135 -7.974 -2.438 -17.877 1.00 34.03 H new ATOM 2003 N THR A 136 -2.215 -1.603 -14.208 1.00 31.13 N ATOM 2004 CA THR A 136 -1.671 -2.100 -15.462 1.00 45.33 C ATOM 2005 C THR A 136 -0.198 -2.498 -15.287 1.00 73.23 C ATOM 2006 O THR A 136 0.240 -3.530 -15.794 1.00 3.22 O ATOM 2007 CB THR A 136 -1.804 -1.058 -16.595 1.00 11.43 C ATOM 2008 OG1 THR A 136 -3.156 -0.578 -16.647 1.00 45.51 O ATOM 2009 CG2 THR A 136 -1.446 -1.679 -17.939 1.00 74.21 C ATOM 0 H THR A 136 -2.378 -0.597 -14.181 1.00 31.13 H new ATOM 0 HA THR A 136 -2.250 -2.979 -15.744 1.00 45.33 H new ATOM 0 HB THR A 136 -1.120 -0.234 -16.391 1.00 11.43 H new ATOM 0 HG1 THR A 136 -3.235 0.236 -16.107 1.00 45.51 H new ATOM 0 HG21 THR A 136 -1.546 -0.930 -18.724 1.00 74.21 H new ATOM 0 HG22 THR A 136 -0.418 -2.040 -17.911 1.00 74.21 H new ATOM 0 HG23 THR A 136 -2.118 -2.512 -18.145 1.00 74.21 H new ATOM 2017 N GLN A 137 0.549 -1.695 -14.524 1.00 21.25 N ATOM 2018 CA GLN A 137 1.961 -1.974 -14.261 1.00 44.32 C ATOM 2019 C GLN A 137 2.101 -3.255 -13.450 1.00 63.41 C ATOM 2020 O GLN A 137 2.941 -4.102 -13.745 1.00 3.21 O ATOM 2021 CB GLN A 137 2.600 -0.812 -13.487 1.00 21.05 C ATOM 2022 CG GLN A 137 2.618 0.518 -14.230 1.00 70.04 C ATOM 2023 CD GLN A 137 3.578 0.531 -15.402 1.00 61.33 C ATOM 2024 OE1 GLN A 137 4.756 0.851 -15.248 1.00 33.03 O ATOM 2025 NE2 GLN A 137 3.082 0.207 -16.579 1.00 1.01 N ATOM 0 H GLN A 137 0.198 -0.847 -14.078 1.00 21.25 H new ATOM 0 HA GLN A 137 2.471 -2.092 -15.217 1.00 44.32 H new ATOM 0 HB2 GLN A 137 2.062 -0.680 -12.548 1.00 21.05 H new ATOM 0 HB3 GLN A 137 3.624 -1.084 -13.232 1.00 21.05 H new ATOM 0 HG2 GLN A 137 1.613 0.741 -14.589 1.00 70.04 H new ATOM 0 HG3 GLN A 137 2.892 1.312 -13.535 1.00 70.04 H new ATOM 0 HE21 GLN A 137 2.099 -0.053 -16.664 1.00 1.01 H new ATOM 0 HE22 GLN A 137 3.681 0.216 -17.405 1.00 1.01 H new ATOM 2034 N LEU A 138 1.254 -3.400 -12.438 1.00 74.11 N ATOM 2035 CA LEU A 138 1.279 -4.584 -11.590 1.00 73.41 C ATOM 2036 C LEU A 138 0.771 -5.805 -12.338 1.00 42.32 C ATOM 2037 O LEU A 138 1.187 -6.928 -12.066 1.00 65.35 O ATOM 2038 CB LEU A 138 0.469 -4.370 -10.307 1.00 24.22 C ATOM 2039 CG LEU A 138 1.208 -3.674 -9.159 1.00 22.40 C ATOM 2040 CD1 LEU A 138 1.465 -2.210 -9.469 1.00 43.30 C ATOM 2041 CD2 LEU A 138 0.439 -3.828 -7.859 1.00 14.51 C ATOM 0 H LEU A 138 0.543 -2.714 -12.185 1.00 74.11 H new ATOM 0 HA LEU A 138 2.318 -4.760 -11.310 1.00 73.41 H new ATOM 0 HB2 LEU A 138 -0.416 -3.783 -10.552 1.00 24.22 H new ATOM 0 HB3 LEU A 138 0.120 -5.341 -9.954 1.00 24.22 H new ATOM 0 HG LEU A 138 2.178 -4.158 -9.044 1.00 22.40 H new ATOM 0 HD11 LEU A 138 1.991 -1.748 -8.633 1.00 43.30 H new ATOM 0 HD12 LEU A 138 2.074 -2.130 -10.369 1.00 43.30 H new ATOM 0 HD13 LEU A 138 0.515 -1.699 -9.627 1.00 43.30 H new ATOM 0 HD21 LEU A 138 0.979 -3.327 -7.055 1.00 14.51 H new ATOM 0 HD22 LEU A 138 -0.549 -3.381 -7.966 1.00 14.51 H new ATOM 0 HD23 LEU A 138 0.334 -4.887 -7.621 1.00 14.51 H new ATOM 2053 N ALA A 139 -0.118 -5.579 -13.292 1.00 40.12 N ATOM 2054 CA ALA A 139 -0.665 -6.660 -14.095 1.00 73.00 C ATOM 2055 C ALA A 139 0.429 -7.296 -14.939 1.00 51.52 C ATOM 2056 O ALA A 139 0.436 -8.504 -15.163 1.00 13.12 O ATOM 2057 CB ALA A 139 -1.793 -6.153 -14.975 1.00 61.31 C ATOM 0 H ALA A 139 -0.477 -4.654 -13.529 1.00 40.12 H new ATOM 0 HA ALA A 139 -1.070 -7.419 -13.425 1.00 73.00 H new ATOM 0 HB1 ALA A 139 -2.190 -6.977 -15.569 1.00 61.31 H new ATOM 0 HB2 ALA A 139 -2.585 -5.742 -14.350 1.00 61.31 H new ATOM 0 HB3 ALA A 139 -1.415 -5.376 -15.639 1.00 61.31 H new ATOM 2063 N GLU A 140 1.371 -6.470 -15.375 1.00 4.42 N ATOM 2064 CA GLU A 140 2.495 -6.939 -16.170 1.00 32.03 C ATOM 2065 C GLU A 140 3.537 -7.622 -15.285 1.00 74.33 C ATOM 2066 O GLU A 140 4.440 -8.295 -15.778 1.00 62.24 O ATOM 2067 CB GLU A 140 3.141 -5.781 -16.927 1.00 60.44 C ATOM 2068 CG GLU A 140 2.199 -5.046 -17.865 1.00 41.33 C ATOM 2069 CD GLU A 140 2.911 -3.999 -18.692 1.00 62.11 C ATOM 2070 OE1 GLU A 140 3.246 -2.923 -18.148 1.00 20.04 O ATOM 2071 OE2 GLU A 140 3.143 -4.245 -19.898 1.00 75.04 O ATOM 0 H GLU A 140 1.377 -5.467 -15.190 1.00 4.42 H new ATOM 0 HA GLU A 140 2.115 -7.664 -16.890 1.00 32.03 H new ATOM 0 HB2 GLU A 140 3.544 -5.070 -16.206 1.00 60.44 H new ATOM 0 HB3 GLU A 140 3.984 -6.164 -17.503 1.00 60.44 H new ATOM 0 HG2 GLU A 140 1.718 -5.764 -18.529 1.00 41.33 H new ATOM 0 HG3 GLU A 140 1.409 -4.571 -17.283 1.00 41.33 H new ATOM 2078 N SER A 141 3.403 -7.439 -13.983 1.00 71.52 N ATOM 2079 CA SER A 141 4.324 -8.028 -13.024 1.00 52.12 C ATOM 2080 C SER A 141 3.734 -9.324 -12.442 1.00 23.40 C ATOM 2081 O SER A 141 4.444 -10.128 -11.833 1.00 12.14 O ATOM 2082 CB SER A 141 4.628 -7.019 -11.906 1.00 52.42 C ATOM 2083 OG SER A 141 5.655 -7.485 -11.047 1.00 33.33 O ATOM 0 H SER A 141 2.659 -6.882 -13.562 1.00 71.52 H new ATOM 0 HA SER A 141 5.256 -8.277 -13.532 1.00 52.12 H new ATOM 0 HB2 SER A 141 4.925 -6.067 -12.345 1.00 52.42 H new ATOM 0 HB3 SER A 141 3.724 -6.834 -11.326 1.00 52.42 H new ATOM 0 HG SER A 141 5.574 -8.456 -10.937 1.00 33.33 H new ATOM 2089 N GLY A 142 2.433 -9.510 -12.632 1.00 10.34 N ATOM 2090 CA GLY A 142 1.780 -10.713 -12.155 1.00 24.30 C ATOM 2091 C GLY A 142 0.958 -10.480 -10.899 1.00 64.14 C ATOM 2092 O GLY A 142 0.841 -11.366 -10.054 1.00 13.44 O ATOM 0 H GLY A 142 1.819 -8.849 -13.108 1.00 10.34 H new ATOM 0 HA2 GLY A 142 1.133 -11.105 -12.940 1.00 24.30 H new ATOM 0 HA3 GLY A 142 2.534 -11.474 -11.954 1.00 24.30 H new ATOM 2096 N ILE A 143 0.375 -9.297 -10.785 1.00 15.10 N ATOM 2097 CA ILE A 143 -0.449 -8.945 -9.632 1.00 4.43 C ATOM 2098 C ILE A 143 -1.745 -8.315 -10.124 1.00 23.03 C ATOM 2099 O ILE A 143 -1.722 -7.395 -10.941 1.00 21.12 O ATOM 2100 CB ILE A 143 0.264 -7.957 -8.643 1.00 61.42 C ATOM 2101 CG1 ILE A 143 1.513 -8.591 -8.004 1.00 30.14 C ATOM 2102 CG2 ILE A 143 -0.698 -7.496 -7.554 1.00 50.14 C ATOM 2103 CD1 ILE A 143 2.761 -8.511 -8.860 1.00 51.13 C ATOM 0 H ILE A 143 0.457 -8.557 -11.482 1.00 15.10 H new ATOM 0 HA ILE A 143 -0.641 -9.864 -9.079 1.00 4.43 H new ATOM 0 HB ILE A 143 0.584 -7.094 -9.226 1.00 61.42 H new ATOM 0 HG12 ILE A 143 1.708 -8.099 -7.051 1.00 30.14 H new ATOM 0 HG13 ILE A 143 1.303 -9.638 -7.785 1.00 30.14 H new ATOM 0 HG21 ILE A 143 -0.183 -6.812 -6.879 1.00 50.14 H new ATOM 0 HG22 ILE A 143 -1.546 -6.986 -8.010 1.00 50.14 H new ATOM 0 HG23 ILE A 143 -1.053 -8.360 -6.993 1.00 50.14 H new ATOM 0 HD11 ILE A 143 3.593 -8.981 -8.335 1.00 51.13 H new ATOM 0 HD12 ILE A 143 2.589 -9.029 -9.804 1.00 51.13 H new ATOM 0 HD13 ILE A 143 3.000 -7.466 -9.058 1.00 51.13 H new ATOM 2115 N GLN A 144 -2.866 -8.813 -9.641 1.00 10.42 N ATOM 2116 CA GLN A 144 -4.161 -8.331 -10.085 1.00 23.32 C ATOM 2117 C GLN A 144 -4.832 -7.447 -9.038 1.00 32.41 C ATOM 2118 O GLN A 144 -5.271 -7.931 -7.993 1.00 32.21 O ATOM 2119 CB GLN A 144 -5.072 -9.504 -10.436 1.00 30.12 C ATOM 2120 CG GLN A 144 -4.562 -10.363 -11.576 1.00 40.55 C ATOM 2121 CD GLN A 144 -5.512 -11.487 -11.910 1.00 54.24 C ATOM 2122 OE1 GLN A 144 -6.406 -11.336 -12.747 1.00 4.35 O ATOM 2123 NE2 GLN A 144 -5.330 -12.619 -11.265 1.00 51.33 N ATOM 0 H GLN A 144 -2.907 -9.553 -8.940 1.00 10.42 H new ATOM 0 HA GLN A 144 -3.993 -7.723 -10.974 1.00 23.32 H new ATOM 0 HB2 GLN A 144 -5.198 -10.129 -9.552 1.00 30.12 H new ATOM 0 HB3 GLN A 144 -6.058 -9.119 -10.698 1.00 30.12 H new ATOM 0 HG2 GLN A 144 -4.412 -9.741 -12.459 1.00 40.55 H new ATOM 0 HG3 GLN A 144 -3.590 -10.778 -11.310 1.00 40.55 H new ATOM 0 HE21 GLN A 144 -4.578 -12.701 -10.581 1.00 51.33 H new ATOM 0 HE22 GLN A 144 -5.941 -13.415 -11.449 1.00 51.33 H new ATOM 2132 N LEU A 145 -4.897 -6.154 -9.316 1.00 24.41 N ATOM 2133 CA LEU A 145 -5.584 -5.218 -8.438 1.00 34.24 C ATOM 2134 C LEU A 145 -7.048 -5.131 -8.851 1.00 14.45 C ATOM 2135 O LEU A 145 -7.392 -4.424 -9.801 1.00 4.31 O ATOM 2136 CB LEU A 145 -4.955 -3.816 -8.510 1.00 54.21 C ATOM 2137 CG LEU A 145 -3.479 -3.697 -8.120 1.00 42.40 C ATOM 2138 CD1 LEU A 145 -3.038 -2.242 -8.186 1.00 70.34 C ATOM 2139 CD2 LEU A 145 -3.236 -4.260 -6.729 1.00 35.01 C ATOM 0 H LEU A 145 -4.482 -5.728 -10.144 1.00 24.41 H new ATOM 0 HA LEU A 145 -5.495 -5.580 -7.414 1.00 34.24 H new ATOM 0 HB2 LEU A 145 -5.067 -3.446 -9.529 1.00 54.21 H new ATOM 0 HB3 LEU A 145 -5.531 -3.153 -7.865 1.00 54.21 H new ATOM 0 HG LEU A 145 -2.889 -4.280 -8.828 1.00 42.40 H new ATOM 0 HD11 LEU A 145 -1.987 -2.167 -7.907 1.00 70.34 H new ATOM 0 HD12 LEU A 145 -3.172 -1.867 -9.201 1.00 70.34 H new ATOM 0 HD13 LEU A 145 -3.639 -1.648 -7.498 1.00 70.34 H new ATOM 0 HD21 LEU A 145 -2.180 -4.163 -6.477 1.00 35.01 H new ATOM 0 HD22 LEU A 145 -3.834 -3.709 -6.004 1.00 35.01 H new ATOM 0 HD23 LEU A 145 -3.519 -5.312 -6.708 1.00 35.01 H new ATOM 2151 N GLY A 146 -7.899 -5.863 -8.164 1.00 51.25 N ATOM 2152 CA GLY A 146 -9.304 -5.864 -8.503 1.00 12.52 C ATOM 2153 C GLY A 146 -10.043 -4.726 -7.849 1.00 54.21 C ATOM 2154 O GLY A 146 -10.689 -3.922 -8.521 1.00 22.53 O ATOM 0 H GLY A 146 -7.645 -6.459 -7.376 1.00 51.25 H new ATOM 0 HA2 GLY A 146 -9.416 -5.795 -9.585 1.00 12.52 H new ATOM 0 HA3 GLY A 146 -9.750 -6.810 -8.196 1.00 12.52 H new ATOM 2158 N GLN A 147 -9.945 -4.658 -6.547 1.00 73.41 N ATOM 2159 CA GLN A 147 -10.600 -3.620 -5.786 1.00 34.43 C ATOM 2160 C GLN A 147 -9.581 -2.566 -5.351 1.00 23.12 C ATOM 2161 O GLN A 147 -8.386 -2.850 -5.233 1.00 63.33 O ATOM 2162 CB GLN A 147 -11.307 -4.235 -4.566 1.00 72.21 C ATOM 2163 CG GLN A 147 -12.167 -3.258 -3.773 1.00 43.43 C ATOM 2164 CD GLN A 147 -13.286 -2.652 -4.594 1.00 63.11 C ATOM 2165 OE1 GLN A 147 -13.812 -3.279 -5.520 1.00 43.32 O ATOM 2166 NE2 GLN A 147 -13.656 -1.430 -4.269 1.00 73.15 N ATOM 0 H GLN A 147 -9.410 -5.318 -5.983 1.00 73.41 H new ATOM 0 HA GLN A 147 -11.349 -3.133 -6.411 1.00 34.43 H new ATOM 0 HB2 GLN A 147 -11.934 -5.060 -4.904 1.00 72.21 H new ATOM 0 HB3 GLN A 147 -10.554 -4.658 -3.901 1.00 72.21 H new ATOM 0 HG2 GLN A 147 -12.594 -3.774 -2.913 1.00 43.43 H new ATOM 0 HG3 GLN A 147 -11.535 -2.459 -3.385 1.00 43.43 H new ATOM 0 HE21 GLN A 147 -13.196 -0.946 -3.498 1.00 73.15 H new ATOM 0 HE22 GLN A 147 -14.402 -0.968 -4.789 1.00 73.15 H new ATOM 2175 N SER A 148 -10.048 -1.358 -5.137 1.00 72.12 N ATOM 2176 CA SER A 148 -9.208 -0.272 -4.691 1.00 42.42 C ATOM 2177 C SER A 148 -9.998 0.589 -3.721 1.00 53.42 C ATOM 2178 O SER A 148 -11.222 0.668 -3.822 1.00 34.21 O ATOM 2179 CB SER A 148 -8.737 0.560 -5.888 1.00 0.20 C ATOM 2180 OG SER A 148 -8.073 -0.258 -6.844 1.00 23.44 O ATOM 0 H SER A 148 -11.026 -1.100 -5.268 1.00 72.12 H new ATOM 0 HA SER A 148 -8.326 -0.669 -4.189 1.00 42.42 H new ATOM 0 HB2 SER A 148 -9.592 1.051 -6.354 1.00 0.20 H new ATOM 0 HB3 SER A 148 -8.064 1.347 -5.547 1.00 0.20 H new ATOM 0 HG SER A 148 -7.924 0.255 -7.666 1.00 23.44 H new ATOM 2186 N SER A 149 -9.322 1.215 -2.782 1.00 71.25 N ATOM 2187 CA SER A 149 -10.000 2.034 -1.803 1.00 13.03 C ATOM 2188 C SER A 149 -9.201 3.296 -1.530 1.00 61.24 C ATOM 2189 O SER A 149 -7.991 3.242 -1.342 1.00 44.21 O ATOM 2190 CB SER A 149 -10.201 1.234 -0.506 1.00 51.52 C ATOM 2191 OG SER A 149 -10.993 1.943 0.433 1.00 21.12 O ATOM 0 H SER A 149 -8.308 1.173 -2.676 1.00 71.25 H new ATOM 0 HA SER A 149 -10.976 2.323 -2.194 1.00 13.03 H new ATOM 0 HB2 SER A 149 -10.677 0.281 -0.737 1.00 51.52 H new ATOM 0 HB3 SER A 149 -9.230 1.007 -0.065 1.00 51.52 H new ATOM 0 HG SER A 149 -11.101 1.403 1.244 1.00 21.12 H new ATOM 2197 N ILE A 150 -9.881 4.424 -1.519 1.00 13.30 N ATOM 2198 CA ILE A 150 -9.247 5.706 -1.269 1.00 33.24 C ATOM 2199 C ILE A 150 -10.036 6.454 -0.207 1.00 12.30 C ATOM 2200 O ILE A 150 -11.231 6.713 -0.377 1.00 63.13 O ATOM 2201 CB ILE A 150 -9.155 6.570 -2.557 1.00 53.04 C ATOM 2202 CG1 ILE A 150 -8.388 5.821 -3.655 1.00 4.12 C ATOM 2203 CG2 ILE A 150 -8.483 7.907 -2.255 1.00 2.13 C ATOM 2204 CD1 ILE A 150 -8.308 6.569 -4.968 1.00 75.52 C ATOM 0 H ILE A 150 -10.886 4.480 -1.682 1.00 13.30 H new ATOM 0 HA ILE A 150 -8.230 5.518 -0.926 1.00 33.24 H new ATOM 0 HB ILE A 150 -10.166 6.763 -2.914 1.00 53.04 H new ATOM 0 HG12 ILE A 150 -7.377 5.616 -3.303 1.00 4.12 H new ATOM 0 HG13 ILE A 150 -8.867 4.857 -3.826 1.00 4.12 H new ATOM 0 HG21 ILE A 150 -8.426 8.500 -3.168 1.00 2.13 H new ATOM 0 HG22 ILE A 150 -9.065 8.446 -1.507 1.00 2.13 H new ATOM 0 HG23 ILE A 150 -7.477 7.731 -1.874 1.00 2.13 H new ATOM 0 HD11 ILE A 150 -7.751 5.974 -5.692 1.00 75.52 H new ATOM 0 HD12 ILE A 150 -9.314 6.751 -5.345 1.00 75.52 H new ATOM 0 HD13 ILE A 150 -7.801 7.521 -4.814 1.00 75.52 H new ATOM 2216 N SER A 151 -9.389 6.774 0.890 1.00 33.42 N ATOM 2217 CA SER A 151 -10.057 7.436 1.995 1.00 73.43 C ATOM 2218 C SER A 151 -9.116 8.395 2.705 1.00 13.43 C ATOM 2219 O SER A 151 -7.905 8.246 2.633 1.00 65.02 O ATOM 2220 CB SER A 151 -10.556 6.388 2.993 1.00 11.41 C ATOM 2221 OG SER A 151 -11.296 5.368 2.342 1.00 3.13 O ATOM 0 H SER A 151 -8.398 6.587 1.044 1.00 33.42 H new ATOM 0 HA SER A 151 -10.897 8.004 1.596 1.00 73.43 H new ATOM 0 HB2 SER A 151 -9.707 5.947 3.516 1.00 11.41 H new ATOM 0 HB3 SER A 151 -11.180 6.868 3.747 1.00 11.41 H new ATOM 0 HG SER A 151 -11.601 4.712 3.003 1.00 3.13 H new ATOM 2227 N SER A 152 -9.681 9.379 3.383 1.00 3.11 N ATOM 2228 CA SER A 152 -8.896 10.297 4.184 1.00 14.01 C ATOM 2229 C SER A 152 -8.659 9.670 5.546 1.00 41.43 C ATOM 2230 O SER A 152 -7.573 9.748 6.116 1.00 41.34 O ATOM 2231 CB SER A 152 -9.642 11.618 4.323 1.00 30.34 C ATOM 2232 OG SER A 152 -10.989 11.390 4.720 1.00 70.43 O ATOM 0 H SER A 152 -10.684 9.562 3.393 1.00 3.11 H new ATOM 0 HA SER A 152 -7.936 10.494 3.706 1.00 14.01 H new ATOM 0 HB2 SER A 152 -9.142 12.249 5.058 1.00 30.34 H new ATOM 0 HB3 SER A 152 -9.622 12.155 3.375 1.00 30.34 H new ATOM 0 HG SER A 152 -11.454 12.248 4.807 1.00 70.43 H new ATOM 2238 N GLU A 153 -9.703 9.039 6.040 1.00 72.03 N ATOM 2239 CA GLU A 153 -9.676 8.302 7.282 1.00 15.31 C ATOM 2240 C GLU A 153 -10.553 7.063 7.123 1.00 32.42 C ATOM 2241 O GLU A 153 -10.161 5.952 7.465 1.00 61.23 O ATOM 2242 CB GLU A 153 -10.167 9.181 8.448 1.00 52.22 C ATOM 2243 CG GLU A 153 -11.524 9.831 8.209 1.00 1.11 C ATOM 2244 CD GLU A 153 -11.986 10.663 9.378 1.00 24.45 C ATOM 2245 OE1 GLU A 153 -12.574 10.095 10.317 1.00 35.22 O ATOM 2246 OE2 GLU A 153 -11.773 11.895 9.359 1.00 72.14 O ATOM 0 H GLU A 153 -10.612 9.025 5.578 1.00 72.03 H new ATOM 0 HA GLU A 153 -8.654 8.001 7.514 1.00 15.31 H new ATOM 0 HB2 GLU A 153 -10.222 8.572 9.350 1.00 52.22 H new ATOM 0 HB3 GLU A 153 -9.430 9.962 8.635 1.00 52.22 H new ATOM 0 HG2 GLU A 153 -11.469 10.460 7.320 1.00 1.11 H new ATOM 0 HG3 GLU A 153 -12.263 9.056 8.006 1.00 1.11 H new ATOM 2284 N ALA A 156 -17.072 6.943 3.991 1.00 2.23 N ATOM 2285 CA ALA A 156 -18.451 6.708 4.374 1.00 73.34 C ATOM 2286 C ALA A 156 -19.242 8.001 4.304 1.00 73.53 C ATOM 2287 O ALA A 156 -18.986 8.936 5.064 1.00 2.15 O ATOM 2288 CB ALA A 156 -18.522 6.121 5.780 1.00 34.32 C ATOM 0 HA ALA A 156 -18.887 5.992 3.678 1.00 73.34 H new ATOM 0 HB1 ALA A 156 -19.564 5.951 6.051 1.00 34.32 H new ATOM 0 HB2 ALA A 156 -17.981 5.175 5.807 1.00 34.32 H new ATOM 0 HB3 ALA A 156 -18.072 6.817 6.488 1.00 34.32 H new ATOM 2294 N GLY A 157 -20.183 8.059 3.389 1.00 13.04 N ATOM 2295 CA GLY A 157 -21.000 9.241 3.245 1.00 1.44 C ATOM 2296 C GLY A 157 -21.773 9.227 1.955 1.00 75.54 C ATOM 2297 O GLY A 157 -21.189 9.089 0.882 1.00 61.23 O ATOM 0 H GLY A 157 -20.400 7.306 2.737 1.00 13.04 H new ATOM 0 HA2 GLY A 157 -21.693 9.309 4.084 1.00 1.44 H new ATOM 0 HA3 GLY A 157 -20.367 10.128 3.281 1.00 1.44 H new ATOM 2301 N GLN A 158 -23.082 9.366 2.051 1.00 23.12 N ATOM 2302 CA GLN A 158 -23.937 9.338 0.876 1.00 24.43 C ATOM 2303 C GLN A 158 -23.898 10.662 0.136 1.00 2.10 C ATOM 2304 O GLN A 158 -23.179 11.585 0.522 1.00 25.04 O ATOM 2305 CB GLN A 158 -25.377 8.999 1.266 1.00 5.22 C ATOM 2306 CG GLN A 158 -25.529 7.649 1.937 1.00 3.44 C ATOM 2307 CD GLN A 158 -24.993 6.514 1.089 1.00 2.43 C ATOM 2308 OE1 GLN A 158 -23.822 6.150 1.185 1.00 33.31 O ATOM 2309 NE2 GLN A 158 -25.839 5.955 0.250 1.00 5.41 N ATOM 0 H GLN A 158 -23.579 9.500 2.932 1.00 23.12 H new ATOM 0 HA GLN A 158 -23.558 8.563 0.210 1.00 24.43 H new ATOM 0 HB2 GLN A 158 -25.753 9.772 1.937 1.00 5.22 H new ATOM 0 HB3 GLN A 158 -26.000 9.022 0.372 1.00 5.22 H new ATOM 0 HG2 GLN A 158 -25.006 7.662 2.893 1.00 3.44 H new ATOM 0 HG3 GLN A 158 -26.583 7.471 2.152 1.00 3.44 H new ATOM 0 HE21 GLN A 158 -26.802 6.286 0.201 1.00 5.41 H new ATOM 0 HE22 GLN A 158 -25.531 5.190 -0.351 1.00 5.41 H new ATOM 2318 N GLN A 159 -24.679 10.751 -0.916 1.00 15.21 N ATOM 2319 CA GLN A 159 -24.760 11.950 -1.720 1.00 65.41 C ATOM 2320 C GLN A 159 -26.096 11.985 -2.446 1.00 21.42 C ATOM 2321 O GLN A 159 -26.304 11.269 -3.434 1.00 31.50 O ATOM 2322 CB GLN A 159 -23.602 11.996 -2.725 1.00 3.12 C ATOM 2323 CG GLN A 159 -23.597 13.226 -3.622 1.00 20.43 C ATOM 2324 CD GLN A 159 -22.414 13.247 -4.570 1.00 71.32 C ATOM 2325 OE1 GLN A 159 -21.337 12.736 -4.255 1.00 23.15 O ATOM 2326 NE2 GLN A 159 -22.601 13.829 -5.736 1.00 62.44 N ATOM 0 H GLN A 159 -25.278 9.992 -1.240 1.00 15.21 H new ATOM 0 HA GLN A 159 -24.684 12.823 -1.072 1.00 65.41 H new ATOM 0 HB2 GLN A 159 -22.660 11.956 -2.178 1.00 3.12 H new ATOM 0 HB3 GLN A 159 -23.645 11.105 -3.351 1.00 3.12 H new ATOM 0 HG2 GLN A 159 -24.521 13.255 -4.199 1.00 20.43 H new ATOM 0 HG3 GLN A 159 -23.579 14.123 -3.003 1.00 20.43 H new ATOM 0 HE21 GLN A 159 -23.507 14.241 -5.961 1.00 62.44 H new ATOM 0 HE22 GLN A 159 -21.840 13.868 -6.414 1.00 62.44 H new ATOM 2335 N GLN A 160 -27.009 12.786 -1.929 1.00 21.43 N ATOM 2336 CA GLN A 160 -28.334 12.914 -2.506 1.00 73.01 C ATOM 2337 C GLN A 160 -28.331 13.941 -3.624 1.00 20.20 C ATOM 2338 O GLN A 160 -27.779 15.036 -3.477 1.00 13.23 O ATOM 2339 CB GLN A 160 -29.350 13.313 -1.434 1.00 34.21 C ATOM 2340 CG GLN A 160 -30.766 13.496 -1.966 1.00 62.11 C ATOM 2341 CD GLN A 160 -31.725 14.010 -0.915 1.00 45.32 C ATOM 2342 OE1 GLN A 160 -31.331 14.731 0.002 1.00 52.54 O ATOM 2343 NE2 GLN A 160 -32.987 13.651 -1.041 1.00 0.42 N ATOM 0 H GLN A 160 -26.855 13.363 -1.102 1.00 21.43 H new ATOM 0 HA GLN A 160 -28.620 11.946 -2.918 1.00 73.01 H new ATOM 0 HB2 GLN A 160 -29.360 12.551 -0.655 1.00 34.21 H new ATOM 0 HB3 GLN A 160 -29.025 14.242 -0.966 1.00 34.21 H new ATOM 0 HG2 GLN A 160 -30.747 14.191 -2.805 1.00 62.11 H new ATOM 0 HG3 GLN A 160 -31.131 12.543 -2.350 1.00 62.11 H new ATOM 0 HE21 GLN A 160 -33.272 13.052 -1.816 1.00 0.42 H new ATOM 0 HE22 GLN A 160 -33.679 13.972 -0.364 1.00 0.42 H new ATOM 2352 N SER A 161 -28.941 13.592 -4.729 1.00 12.03 N ATOM 2353 CA SER A 161 -29.020 14.478 -5.860 1.00 60.10 C ATOM 2354 C SER A 161 -30.473 14.883 -6.099 1.00 72.23 C ATOM 2355 O SER A 161 -31.396 14.291 -5.529 1.00 44.21 O ATOM 2356 CB SER A 161 -28.431 13.799 -7.105 1.00 24.14 C ATOM 2357 OG SER A 161 -28.336 14.703 -8.198 1.00 54.02 O ATOM 0 H SER A 161 -29.395 12.689 -4.868 1.00 12.03 H new ATOM 0 HA SER A 161 -28.438 15.377 -5.655 1.00 60.10 H new ATOM 0 HB2 SER A 161 -27.442 13.404 -6.871 1.00 24.14 H new ATOM 0 HB3 SER A 161 -29.055 12.951 -7.387 1.00 24.14 H new ATOM 0 HG SER A 161 -27.956 14.240 -8.974 1.00 54.02 H new ATOM 2363 N SER A 162 -30.673 15.874 -6.940 1.00 32.45 N ATOM 2364 CA SER A 162 -31.997 16.356 -7.262 1.00 33.21 C ATOM 2365 C SER A 162 -31.953 17.201 -8.525 1.00 71.01 C ATOM 2366 O SER A 162 -31.276 18.226 -8.582 1.00 43.22 O ATOM 2367 CB SER A 162 -32.583 17.155 -6.083 1.00 2.44 C ATOM 2368 OG SER A 162 -31.661 18.128 -5.606 1.00 73.40 O ATOM 0 H SER A 162 -29.921 16.368 -7.420 1.00 32.45 H new ATOM 0 HA SER A 162 -32.648 15.501 -7.444 1.00 33.21 H new ATOM 0 HB2 SER A 162 -33.504 17.647 -6.397 1.00 2.44 H new ATOM 0 HB3 SER A 162 -32.846 16.473 -5.274 1.00 2.44 H new ATOM 0 HG SER A 162 -31.187 18.529 -6.364 1.00 73.40 H new ATOM 2374 N SER A 163 -32.650 16.748 -9.540 1.00 75.53 N ATOM 2375 CA SER A 163 -32.680 17.431 -10.807 1.00 54.11 C ATOM 2376 C SER A 163 -34.125 17.575 -11.274 1.00 73.20 C ATOM 2377 O SER A 163 -35.052 17.134 -10.589 1.00 64.33 O ATOM 2378 CB SER A 163 -31.850 16.645 -11.838 1.00 54.51 C ATOM 2379 OG SER A 163 -31.593 17.418 -13.001 1.00 0.04 O ATOM 0 H SER A 163 -33.211 15.897 -9.509 1.00 75.53 H new ATOM 0 HA SER A 163 -32.247 18.426 -10.700 1.00 54.11 H new ATOM 0 HB2 SER A 163 -30.906 16.339 -11.388 1.00 54.51 H new ATOM 0 HB3 SER A 163 -32.381 15.735 -12.116 1.00 54.51 H new ATOM 0 HG SER A 163 -31.063 16.890 -13.634 1.00 0.04 H new ATOM 2385 N GLN A 164 -34.311 18.169 -12.428 1.00 1.33 N ATOM 2386 CA GLN A 164 -35.630 18.374 -12.981 1.00 14.31 C ATOM 2387 C GLN A 164 -35.523 18.479 -14.491 1.00 55.21 C ATOM 2388 O GLN A 164 -34.492 18.913 -15.012 1.00 52.41 O ATOM 2389 CB GLN A 164 -36.264 19.647 -12.396 1.00 5.03 C ATOM 2390 CG GLN A 164 -37.745 19.804 -12.708 1.00 61.30 C ATOM 2391 CD GLN A 164 -38.344 21.070 -12.120 1.00 22.30 C ATOM 2392 OE1 GLN A 164 -37.668 22.089 -11.978 1.00 34.15 O ATOM 2393 NE2 GLN A 164 -39.612 21.013 -11.776 1.00 41.35 N ATOM 0 H GLN A 164 -33.553 18.524 -13.011 1.00 1.33 H new ATOM 0 HA GLN A 164 -36.269 17.530 -12.722 1.00 14.31 H new ATOM 0 HB2 GLN A 164 -36.130 19.642 -11.314 1.00 5.03 H new ATOM 0 HB3 GLN A 164 -35.729 20.516 -12.780 1.00 5.03 H new ATOM 0 HG2 GLN A 164 -37.884 19.811 -13.789 1.00 61.30 H new ATOM 0 HG3 GLN A 164 -38.286 18.940 -12.322 1.00 61.30 H new ATOM 0 HE21 GLN A 164 -40.138 20.150 -11.910 1.00 41.35 H new ATOM 0 HE22 GLN A 164 -40.069 21.832 -11.376 1.00 41.35 H new ATOM 2402 N GLN A 165 -36.577 18.086 -15.188 1.00 44.53 N ATOM 2403 CA GLN A 165 -36.592 18.090 -16.648 1.00 51.23 C ATOM 2404 C GLN A 165 -38.004 18.321 -17.160 1.00 71.43 C ATOM 2405 O GLN A 165 -38.945 17.622 -16.764 1.00 72.42 O ATOM 2406 CB GLN A 165 -36.076 16.748 -17.204 1.00 42.25 C ATOM 2407 CG GLN A 165 -34.598 16.474 -16.958 1.00 75.44 C ATOM 2408 CD GLN A 165 -34.165 15.116 -17.478 1.00 22.03 C ATOM 2409 OE1 GLN A 165 -34.737 14.592 -18.435 1.00 11.44 O ATOM 2410 NE2 GLN A 165 -33.153 14.540 -16.864 1.00 13.04 N ATOM 0 H GLN A 165 -37.444 17.756 -14.763 1.00 44.53 H new ATOM 0 HA GLN A 165 -35.940 18.895 -16.986 1.00 51.23 H new ATOM 0 HB2 GLN A 165 -36.658 15.940 -16.760 1.00 42.25 H new ATOM 0 HB3 GLN A 165 -36.261 16.722 -18.278 1.00 42.25 H new ATOM 0 HG2 GLN A 165 -34.003 17.250 -17.439 1.00 75.44 H new ATOM 0 HG3 GLN A 165 -34.394 16.532 -15.889 1.00 75.44 H new ATOM 0 HE21 GLN A 165 -32.704 15.005 -16.075 1.00 13.04 H new ATOM 0 HE22 GLN A 165 -32.818 13.629 -17.178 1.00 13.04 H new ATOM 2419 N GLN A 166 -38.154 19.297 -18.033 1.00 63.35 N ATOM 2420 CA GLN A 166 -39.446 19.611 -18.614 1.00 43.04 C ATOM 2421 C GLN A 166 -39.626 18.861 -19.926 1.00 14.25 C ATOM 2422 O GLN A 166 -38.704 18.186 -20.392 1.00 21.40 O ATOM 2423 CB GLN A 166 -39.577 21.120 -18.842 1.00 11.13 C ATOM 2424 CG GLN A 166 -39.372 21.945 -17.580 1.00 2.44 C ATOM 2425 CD GLN A 166 -40.364 21.605 -16.486 1.00 53.55 C ATOM 2426 OE1 GLN A 166 -41.506 21.238 -16.754 1.00 11.42 O ATOM 2427 NE2 GLN A 166 -39.934 21.714 -15.248 1.00 3.45 N ATOM 0 H GLN A 166 -37.391 19.891 -18.358 1.00 63.35 H new ATOM 0 HA GLN A 166 -40.226 19.297 -17.920 1.00 43.04 H new ATOM 0 HB2 GLN A 166 -38.849 21.431 -19.592 1.00 11.13 H new ATOM 0 HB3 GLN A 166 -40.565 21.333 -19.249 1.00 11.13 H new ATOM 0 HG2 GLN A 166 -38.360 21.786 -17.208 1.00 2.44 H new ATOM 0 HG3 GLN A 166 -39.458 23.003 -17.826 1.00 2.44 H new ATOM 0 HE21 GLN A 166 -38.979 22.022 -15.065 1.00 3.45 H new ATOM 0 HE22 GLN A 166 -40.556 21.491 -14.471 1.00 3.45 H new ATOM 2436 N SER A 167 -40.796 18.983 -20.521 1.00 35.00 N ATOM 2437 CA SER A 167 -41.105 18.306 -21.768 1.00 41.42 C ATOM 2438 C SER A 167 -42.394 18.851 -22.365 1.00 10.43 C ATOM 2439 O SER A 167 -43.346 19.147 -21.642 1.00 53.40 O ATOM 2440 CB SER A 167 -41.216 16.795 -21.530 1.00 22.03 C ATOM 2441 OG SER A 167 -41.915 16.520 -20.320 1.00 63.04 O ATOM 0 H SER A 167 -41.559 19.553 -20.156 1.00 35.00 H new ATOM 0 HA SER A 167 -40.298 18.490 -22.478 1.00 41.42 H new ATOM 0 HB2 SER A 167 -41.734 16.328 -22.368 1.00 22.03 H new ATOM 0 HB3 SER A 167 -40.219 16.356 -21.487 1.00 22.03 H new ATOM 0 HG SER A 167 -41.975 15.551 -20.190 1.00 63.04 H new