USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1054 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: B 22 TYR OH : rot 101:sc= 0.851 USER MOD Set 1.2: B 52 GLN :FLIP amide:sc= -2.15! F(o=-2.7,f=-1.3!) USER MOD Set 2.1: A 58 TYR OH : rot -99:sc= 0.189 USER MOD Set 2.2: A 61 GLN :FLIP amide:sc= -3.34! C(o=-8.6!,f=-5.2!) USER MOD Set 2.3: A 62 HIS : no HE2:sc= -2.1 K(o=-5.2,f=-5.8) USER MOD Set 3.1: A 22 TYR OH : rot 86:sc= 0.555 USER MOD Set 3.2: A 52 GLN :FLIP amide:sc= -1.86! F(o=-2.5,f=-1.3!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.00495 USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 CYS SG : rot 69:sc= -1.01 USER MOD Single : A 14 GLN :FLIP amide:sc= -2.75 F(o=-4!,f=-2.8) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -158:sc= -0.111 (180deg=-0.724) USER MOD Single : A 27 MET CE :methyl -146:sc= -0.541 (180deg=-3.39!) USER MOD Single : A 30 MET CE :methyl 174:sc= -2.92 (180deg=-3.15!) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 165:sc= -0.0838 (180deg=-0.686) USER MOD Single : A 40 ASN : amide:sc= -3.78 X(o=-3.8,f=-3.4!) USER MOD Single : A 45 SER OG : rot -66:sc= 0.718 USER MOD Single : A 53 TYR OH : rot 11:sc= 0.251 USER MOD Single : A 56 ASN : amide:sc= -2.84! C(o=-2.8!,f=-6.8!) USER MOD Single : A 59 SER OG : rot 180:sc= -0.624 USER MOD Single : A 63 ASN :FLIP amide:sc= -1.42! C(o=-3.5!,f=-1.4!) USER MOD Single : A 65 ASN :FLIP amide:sc= -0.0483 F(o=-0.73,f=-0.048) USER MOD Single : B 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 SER OG : rot 170:sc= -0.572 USER MOD Single : B 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 12 TYR OH : rot 180:sc= 0 USER MOD Single : B 13 CYS SG : rot 65:sc= -1.1 USER MOD Single : B 14 GLN :FLIP amide:sc= -2.69! C(o=-4.6!,f=-2.7!) USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 LYS NZ :NH3+ -163:sc= -0.221 (180deg=-0.831) USER MOD Single : B 27 MET CE :methyl -142:sc= -0.638 (180deg=-3.56!) USER MOD Single : B 30 MET CE :methyl 180:sc= -3.29! (180deg=-3.31!) USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ -165:sc= -0.0168 (180deg=-0.215) USER MOD Single : B 40 ASN :FLIP amide:sc= -0.039 F(o=-1.3!,f=-0.039) USER MOD Single : B 45 SER OG : rot -72:sc= -0.374 USER MOD Single : B 53 TYR OH : rot 8:sc= -0.17 USER MOD Single : B 56 ASN : amide:sc= -3.18! C(o=-3.2!,f=-8.5!) USER MOD Single : B 58 TYR OH : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot 180:sc=-0.00263 USER MOD Single : B 61 GLN :FLIP amide:sc= -0.0319 F(o=-1.3!,f=-0.032) USER MOD Single : B 62 HIS : no HD1:sc= -5.82! C(o=-5.8!,f=-5.5!) USER MOD Single : B 63 ASN : amide:sc= -1.66 K(o=-1.7,f=-4.4!) USER MOD Single : B 65 ASN : amide:sc= -0.216! C(o=-0.22!,f=-6.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 51.125 16.505 30.037 1.00 58.26 N ATOM 2 CA GLY A 1 49.976 17.513 29.966 1.00 58.79 C ATOM 3 C GLY A 1 49.525 18.033 28.643 1.00 58.82 C ATOM 4 O GLY A 1 50.175 17.825 27.639 1.00 58.84 O ATOM 0 H1 GLY A 1 51.305 16.253 31.030 1.00 58.26 H new ATOM 0 H2 GLY A 1 50.870 15.650 29.503 1.00 58.26 H new ATOM 0 H3 GLY A 1 51.982 16.926 29.626 1.00 58.26 H new ATOM 0 HA2 GLY A 1 49.112 17.055 30.447 1.00 58.79 H new ATOM 0 HA3 GLY A 1 50.260 18.373 30.573 1.00 58.79 H new ATOM 10 N SER A 2 48.404 18.719 28.622 1.00 59.10 N ATOM 11 CA SER A 2 47.849 19.294 27.350 1.00 59.23 C ATOM 12 C SER A 2 48.985 19.699 26.382 1.00 58.93 C ATOM 13 O SER A 2 49.537 20.772 26.528 1.00 59.05 O ATOM 14 CB SER A 2 47.044 20.545 27.700 1.00 59.14 C ATOM 15 OG SER A 2 46.055 20.212 28.666 1.00 60.12 O ATOM 0 H SER A 2 47.839 18.908 29.450 1.00 59.10 H new ATOM 0 HA SER A 2 47.227 18.542 26.865 1.00 59.23 H new ATOM 0 HB2 SER A 2 47.705 21.319 28.091 1.00 59.14 H new ATOM 0 HB3 SER A 2 46.573 20.950 26.805 1.00 59.14 H new ATOM 0 HG SER A 2 45.538 21.013 28.894 1.00 60.12 H new ATOM 21 N PRO A 3 49.316 18.851 25.419 1.00 58.50 N ATOM 22 CA PRO A 3 50.386 19.166 24.463 1.00 58.76 C ATOM 23 C PRO A 3 49.836 20.198 23.473 1.00 59.07 C ATOM 24 O PRO A 3 49.010 21.017 23.824 1.00 59.22 O ATOM 25 CB PRO A 3 50.706 17.813 23.779 1.00 58.61 C ATOM 26 CG PRO A 3 49.568 16.828 24.159 1.00 57.51 C ATOM 27 CD PRO A 3 48.676 17.539 25.198 1.00 58.11 C ATOM 0 HA PRO A 3 51.286 19.589 24.909 1.00 58.76 H new ATOM 0 HB2 PRO A 3 50.766 17.933 22.697 1.00 58.61 H new ATOM 0 HB3 PRO A 3 51.672 17.432 24.112 1.00 58.61 H new ATOM 0 HG2 PRO A 3 48.988 16.553 23.278 1.00 57.51 H new ATOM 0 HG3 PRO A 3 49.979 15.906 24.571 1.00 57.51 H new ATOM 0 HD2 PRO A 3 47.657 17.654 24.830 1.00 58.11 H new ATOM 0 HD3 PRO A 3 48.617 16.968 26.124 1.00 58.11 H new ATOM 35 N LEU A 4 50.252 20.158 22.245 1.00 59.11 N ATOM 36 CA LEU A 4 49.704 21.131 21.266 1.00 59.07 C ATOM 37 C LEU A 4 48.251 20.767 21.004 1.00 58.86 C ATOM 38 O LEU A 4 47.463 21.611 20.637 1.00 59.18 O ATOM 39 CB LEU A 4 50.455 21.058 19.930 1.00 58.81 C ATOM 40 CG LEU A 4 51.911 21.533 20.058 1.00 58.33 C ATOM 41 CD1 LEU A 4 51.978 22.928 20.700 1.00 58.07 C ATOM 42 CD2 LEU A 4 52.726 20.535 20.897 1.00 58.05 C ATOM 0 H LEU A 4 50.941 19.502 21.877 1.00 59.11 H new ATOM 0 HA LEU A 4 49.808 22.136 21.675 1.00 59.07 H new ATOM 0 HB2 LEU A 4 50.440 20.032 19.562 1.00 58.81 H new ATOM 0 HB3 LEU A 4 49.938 21.670 19.190 1.00 58.81 H new ATOM 0 HG LEU A 4 52.336 21.591 19.056 1.00 58.33 H new ATOM 0 HD11 LEU A 4 53.019 23.242 20.780 1.00 58.07 H new ATOM 0 HD12 LEU A 4 51.430 23.640 20.082 1.00 58.07 H new ATOM 0 HD13 LEU A 4 51.532 22.893 21.694 1.00 58.07 H new ATOM 0 HD21 LEU A 4 53.755 20.884 20.979 1.00 58.05 H new ATOM 0 HD22 LEU A 4 52.289 20.455 21.892 1.00 58.05 H new ATOM 0 HD23 LEU A 4 52.712 19.558 20.415 1.00 58.05 H new ATOM 54 N GLY A 5 47.914 19.499 21.172 1.00 58.51 N ATOM 55 CA GLY A 5 46.513 18.995 20.923 1.00 58.80 C ATOM 56 C GLY A 5 45.497 20.129 21.012 1.00 58.45 C ATOM 57 O GLY A 5 44.627 20.266 20.175 1.00 59.58 O ATOM 0 H GLY A 5 48.567 18.778 21.478 1.00 58.51 H new ATOM 0 HA2 GLY A 5 46.460 18.532 19.938 1.00 58.80 H new ATOM 0 HA3 GLY A 5 46.266 18.223 21.652 1.00 58.80 H new ATOM 61 N GLN A 6 45.614 20.961 22.003 1.00 58.32 N ATOM 62 CA GLN A 6 44.677 22.109 22.106 1.00 57.66 C ATOM 63 C GLN A 6 45.164 23.229 21.174 1.00 57.98 C ATOM 64 O GLN A 6 44.439 23.721 20.340 1.00 58.04 O ATOM 65 CB GLN A 6 44.630 22.619 23.545 1.00 57.77 C ATOM 66 CG GLN A 6 43.876 23.948 23.585 1.00 56.95 C ATOM 67 CD GLN A 6 43.488 24.278 25.027 1.00 57.67 C ATOM 68 OE1 GLN A 6 44.306 24.196 25.922 1.00 58.04 O ATOM 69 NE2 GLN A 6 42.266 24.651 25.293 1.00 57.32 N ATOM 0 H GLN A 6 46.313 20.898 22.743 1.00 58.32 H new ATOM 0 HA GLN A 6 43.675 21.792 21.815 1.00 57.66 H new ATOM 0 HB2 GLN A 6 44.137 21.888 24.186 1.00 57.77 H new ATOM 0 HB3 GLN A 6 45.641 22.750 23.930 1.00 57.77 H new ATOM 0 HG2 GLN A 6 44.499 24.743 23.175 1.00 56.95 H new ATOM 0 HG3 GLN A 6 42.983 23.889 22.962 1.00 56.95 H new ATOM 0 HE21 GLN A 6 41.579 24.720 24.542 1.00 57.32 H new ATOM 0 HE22 GLN A 6 41.998 24.874 26.252 1.00 57.32 H new ATOM 78 N ASP A 7 46.391 23.646 21.326 1.00 56.98 N ATOM 79 CA ASP A 7 46.921 24.747 20.463 1.00 55.57 C ATOM 80 C ASP A 7 46.550 24.488 19.002 1.00 53.35 C ATOM 81 O ASP A 7 45.909 25.300 18.365 1.00 53.52 O ATOM 82 CB ASP A 7 48.444 24.815 20.602 1.00 56.91 C ATOM 83 CG ASP A 7 48.948 26.170 20.103 1.00 57.93 C ATOM 84 OD1 ASP A 7 48.142 26.926 19.587 1.00 59.82 O ATOM 85 OD2 ASP A 7 50.133 26.428 20.245 1.00 57.59 O ATOM 0 H ASP A 7 47.051 23.274 22.009 1.00 56.98 H new ATOM 0 HA ASP A 7 46.483 25.694 20.779 1.00 55.57 H new ATOM 0 HB2 ASP A 7 48.730 24.671 21.644 1.00 56.91 H new ATOM 0 HB3 ASP A 7 48.907 24.011 20.030 1.00 56.91 H new ATOM 90 N VAL A 8 46.924 23.353 18.472 1.00 51.37 N ATOM 91 CA VAL A 8 46.561 23.035 17.053 1.00 49.55 C ATOM 92 C VAL A 8 45.070 23.312 16.892 1.00 47.91 C ATOM 93 O VAL A 8 44.614 23.881 15.921 1.00 48.03 O ATOM 94 CB VAL A 8 46.822 21.535 16.751 1.00 49.68 C ATOM 95 CG1 VAL A 8 48.133 21.373 15.989 1.00 49.89 C ATOM 96 CG2 VAL A 8 46.893 20.750 18.061 1.00 49.65 C ATOM 0 H VAL A 8 47.462 22.634 18.955 1.00 51.37 H new ATOM 0 HA VAL A 8 47.159 23.639 16.371 1.00 49.55 H new ATOM 0 HB VAL A 8 46.005 21.151 16.140 1.00 49.68 H new ATOM 0 HG11 VAL A 8 48.306 20.317 15.783 1.00 49.89 H new ATOM 0 HG12 VAL A 8 48.078 21.922 15.049 1.00 49.89 H new ATOM 0 HG13 VAL A 8 48.954 21.764 16.590 1.00 49.89 H new ATOM 0 HG21 VAL A 8 47.076 19.697 17.845 1.00 49.65 H new ATOM 0 HG22 VAL A 8 47.704 21.141 18.676 1.00 49.65 H new ATOM 0 HG23 VAL A 8 45.950 20.851 18.597 1.00 49.65 H new ATOM 106 N PHE A 9 44.319 22.891 17.859 1.00 44.59 N ATOM 107 CA PHE A 9 42.854 23.095 17.814 1.00 42.14 C ATOM 108 C PHE A 9 42.560 24.584 17.643 1.00 41.09 C ATOM 109 O PHE A 9 41.970 25.003 16.666 1.00 40.10 O ATOM 110 CB PHE A 9 42.230 22.580 19.124 1.00 39.48 C ATOM 111 CG PHE A 9 40.803 22.194 18.871 1.00 35.93 C ATOM 112 CD1 PHE A 9 39.798 23.153 18.999 1.00 33.89 C ATOM 113 CD2 PHE A 9 40.487 20.887 18.494 1.00 34.84 C ATOM 114 CE1 PHE A 9 38.474 22.805 18.753 1.00 31.72 C ATOM 115 CE2 PHE A 9 39.160 20.540 18.245 1.00 33.98 C ATOM 116 CZ PHE A 9 38.156 21.504 18.377 1.00 33.09 C ATOM 0 H PHE A 9 44.661 22.408 18.690 1.00 44.59 H new ATOM 0 HA PHE A 9 42.426 22.547 16.975 1.00 42.14 H new ATOM 0 HB2 PHE A 9 42.791 21.723 19.496 1.00 39.48 H new ATOM 0 HB3 PHE A 9 42.280 23.351 19.893 1.00 39.48 H new ATOM 0 HD1 PHE A 9 40.047 24.163 19.288 1.00 33.89 H new ATOM 0 HD2 PHE A 9 41.268 20.148 18.396 1.00 34.84 H new ATOM 0 HE1 PHE A 9 37.693 23.544 18.854 1.00 31.72 H new ATOM 0 HE2 PHE A 9 38.909 19.531 17.952 1.00 33.98 H new ATOM 0 HZ PHE A 9 37.127 21.237 18.186 1.00 33.09 H new ATOM 126 N LEU A 10 42.972 25.388 18.581 1.00 40.61 N ATOM 127 CA LEU A 10 42.719 26.848 18.460 1.00 40.95 C ATOM 128 C LEU A 10 43.342 27.347 17.159 1.00 41.08 C ATOM 129 O LEU A 10 42.788 28.187 16.477 1.00 37.24 O ATOM 130 CB LEU A 10 43.338 27.582 19.649 1.00 41.66 C ATOM 131 CG LEU A 10 42.877 26.928 20.955 1.00 43.24 C ATOM 132 CD1 LEU A 10 43.434 27.717 22.132 1.00 42.19 C ATOM 133 CD2 LEU A 10 41.346 26.928 21.036 1.00 41.41 C ATOM 0 H LEU A 10 43.471 25.099 19.422 1.00 40.61 H new ATOM 0 HA LEU A 10 41.646 27.039 18.452 1.00 40.95 H new ATOM 0 HB2 LEU A 10 44.425 27.553 19.581 1.00 41.66 H new ATOM 0 HB3 LEU A 10 43.045 28.632 19.633 1.00 41.66 H new ATOM 0 HG LEU A 10 43.238 25.900 20.984 1.00 43.24 H new ATOM 0 HD11 LEU A 10 43.109 27.256 23.065 1.00 42.19 H new ATOM 0 HD12 LEU A 10 44.523 27.717 22.087 1.00 42.19 H new ATOM 0 HD13 LEU A 10 43.069 28.743 22.088 1.00 42.19 H new ATOM 0 HD21 LEU A 10 41.031 26.460 21.969 1.00 41.41 H new ATOM 0 HD22 LEU A 10 40.980 27.954 21.003 1.00 41.41 H new ATOM 0 HD23 LEU A 10 40.937 26.369 20.194 1.00 41.41 H new ATOM 145 N ASP A 11 44.483 26.827 16.796 1.00 41.30 N ATOM 146 CA ASP A 11 45.116 27.270 15.526 1.00 41.83 C ATOM 147 C ASP A 11 44.134 27.012 14.386 1.00 40.90 C ATOM 148 O ASP A 11 43.838 27.897 13.607 1.00 39.80 O ATOM 149 CB ASP A 11 46.412 26.494 15.281 1.00 44.60 C ATOM 150 CG ASP A 11 47.385 26.747 16.434 1.00 47.53 C ATOM 151 OD1 ASP A 11 47.522 27.894 16.827 1.00 48.01 O ATOM 152 OD2 ASP A 11 47.977 25.791 16.905 1.00 48.56 O ATOM 0 H ASP A 11 44.999 26.121 17.320 1.00 41.30 H new ATOM 0 HA ASP A 11 45.358 28.331 15.583 1.00 41.83 H new ATOM 0 HB2 ASP A 11 46.200 25.428 15.198 1.00 44.60 H new ATOM 0 HB3 ASP A 11 46.861 26.804 14.338 1.00 44.60 H new ATOM 157 N TYR A 12 43.599 25.818 14.284 1.00 39.29 N ATOM 158 CA TYR A 12 42.620 25.567 13.192 1.00 38.27 C ATOM 159 C TYR A 12 41.499 26.578 13.337 1.00 34.82 C ATOM 160 O TYR A 12 41.101 27.224 12.392 1.00 33.76 O ATOM 161 CB TYR A 12 41.999 24.170 13.286 1.00 42.68 C ATOM 162 CG TYR A 12 43.041 23.068 13.340 1.00 45.94 C ATOM 163 CD1 TYR A 12 44.209 23.113 12.558 1.00 47.36 C ATOM 164 CD2 TYR A 12 42.807 21.969 14.171 1.00 48.31 C ATOM 165 CE1 TYR A 12 45.128 22.057 12.620 1.00 48.74 C ATOM 166 CE2 TYR A 12 43.718 20.926 14.232 1.00 49.78 C ATOM 167 CZ TYR A 12 44.882 20.962 13.457 1.00 49.89 C ATOM 168 OH TYR A 12 45.787 19.922 13.519 1.00 52.12 O ATOM 0 H TYR A 12 43.795 25.026 14.897 1.00 39.29 H new ATOM 0 HA TYR A 12 43.141 25.649 12.238 1.00 38.27 H new ATOM 0 HB2 TYR A 12 41.372 24.115 14.176 1.00 42.68 H new ATOM 0 HB3 TYR A 12 41.349 24.007 12.427 1.00 42.68 H new ATOM 0 HD1 TYR A 12 44.397 23.958 11.912 1.00 47.36 H new ATOM 0 HD2 TYR A 12 41.909 21.932 14.770 1.00 48.31 H new ATOM 0 HE1 TYR A 12 46.027 22.088 12.022 1.00 48.74 H new ATOM 0 HE2 TYR A 12 43.529 20.083 14.880 1.00 49.78 H new ATOM 0 HH TYR A 12 45.464 19.244 14.149 1.00 52.12 H new ATOM 178 N CYS A 13 40.988 26.734 14.525 1.00 32.26 N ATOM 179 CA CYS A 13 39.905 27.720 14.723 1.00 30.43 C ATOM 180 C CYS A 13 40.369 29.041 14.125 1.00 30.74 C ATOM 181 O CYS A 13 39.808 29.525 13.171 1.00 28.86 O ATOM 182 CB CYS A 13 39.633 27.888 16.217 1.00 30.34 C ATOM 183 SG CYS A 13 39.521 26.258 16.995 1.00 24.58 S ATOM 0 H CYS A 13 41.275 26.222 15.360 1.00 32.26 H new ATOM 0 HA CYS A 13 38.986 27.388 14.241 1.00 30.43 H new ATOM 0 HB2 CYS A 13 40.430 28.470 16.680 1.00 30.34 H new ATOM 0 HB3 CYS A 13 38.706 28.440 16.369 1.00 30.34 H new ATOM 0 HG CYS A 13 40.692 25.694 16.991 1.00 24.58 H new ATOM 189 N GLN A 14 41.422 29.603 14.658 1.00 32.92 N ATOM 190 CA GLN A 14 41.949 30.880 14.104 1.00 34.93 C ATOM 191 C GLN A 14 42.037 30.769 12.578 1.00 35.74 C ATOM 192 O GLN A 14 41.779 31.713 11.863 1.00 35.15 O ATOM 193 CB GLN A 14 43.338 31.156 14.693 1.00 36.23 C ATOM 194 CG GLN A 14 43.708 32.633 14.507 1.00 40.72 C ATOM 195 CD GLN A 14 44.143 32.879 13.061 1.00 42.88 C ATOM 196 OE1 GLN A 14 43.343 33.517 12.251 1.00 45.84 O flip ATOM 197 NE2 GLN A 14 45.222 32.486 12.664 1.00 44.23 N flip ATOM 0 H GLN A 14 41.939 29.230 15.454 1.00 32.92 H new ATOM 0 HA GLN A 14 41.282 31.702 14.366 1.00 34.93 H new ATOM 0 HB2 GLN A 14 43.349 30.901 15.753 1.00 36.23 H new ATOM 0 HB3 GLN A 14 44.080 30.523 14.206 1.00 36.23 H new ATOM 0 HG2 GLN A 14 42.855 33.265 14.752 1.00 40.72 H new ATOM 0 HG3 GLN A 14 44.513 32.905 15.190 1.00 40.72 H new ATOM 0 HE21 GLN A 14 45.848 31.987 13.297 1.00 44.23 H new ATOM 0 HE22 GLN A 14 45.502 32.655 11.698 1.00 44.23 H new ATOM 206 N LYS A 15 42.378 29.617 12.069 1.00 35.66 N ATOM 207 CA LYS A 15 42.444 29.461 10.593 1.00 36.27 C ATOM 208 C LYS A 15 41.010 29.413 10.066 1.00 34.97 C ATOM 209 O LYS A 15 40.595 30.241 9.285 1.00 34.84 O ATOM 210 CB LYS A 15 43.174 28.155 10.256 1.00 40.22 C ATOM 211 CG LYS A 15 44.581 28.135 10.919 1.00 44.18 C ATOM 212 CD LYS A 15 45.683 28.263 9.858 1.00 47.52 C ATOM 213 CE LYS A 15 45.914 26.905 9.194 1.00 50.10 C ATOM 214 NZ LYS A 15 46.886 27.055 8.075 1.00 50.42 N ATOM 0 H LYS A 15 42.612 28.784 12.609 1.00 35.66 H new ATOM 0 HA LYS A 15 42.984 30.290 10.136 1.00 36.27 H new ATOM 0 HB2 LYS A 15 42.589 27.304 10.603 1.00 40.22 H new ATOM 0 HB3 LYS A 15 43.273 28.054 9.175 1.00 40.22 H new ATOM 0 HG2 LYS A 15 44.662 28.952 11.635 1.00 44.18 H new ATOM 0 HG3 LYS A 15 44.712 27.208 11.477 1.00 44.18 H new ATOM 0 HD2 LYS A 15 45.397 29.002 9.109 1.00 47.52 H new ATOM 0 HD3 LYS A 15 46.606 28.616 10.318 1.00 47.52 H new ATOM 0 HE2 LYS A 15 46.293 26.191 9.925 1.00 50.10 H new ATOM 0 HE3 LYS A 15 44.971 26.507 8.819 1.00 50.10 H new ATOM 0 HZ1 LYS A 15 47.042 26.131 7.624 1.00 50.42 H new ATOM 0 HZ2 LYS A 15 46.507 27.723 7.373 1.00 50.42 H new ATOM 0 HZ3 LYS A 15 47.788 27.416 8.445 1.00 50.42 H new ATOM 228 N LEU A 16 40.227 28.472 10.520 1.00 31.52 N ATOM 229 CA LEU A 16 38.807 28.410 10.068 1.00 30.64 C ATOM 230 C LEU A 16 38.208 29.802 10.259 1.00 29.20 C ATOM 231 O LEU A 16 37.416 30.282 9.472 1.00 30.83 O ATOM 232 CB LEU A 16 38.060 27.379 10.930 1.00 29.49 C ATOM 233 CG LEU A 16 36.827 26.838 10.188 1.00 29.11 C ATOM 234 CD1 LEU A 16 37.247 26.099 8.903 1.00 29.81 C ATOM 235 CD2 LEU A 16 36.070 25.877 11.116 1.00 25.98 C ATOM 0 H LEU A 16 40.507 27.747 11.181 1.00 31.52 H new ATOM 0 HA LEU A 16 38.729 28.111 9.023 1.00 30.64 H new ATOM 0 HB2 LEU A 16 38.729 26.556 11.182 1.00 29.49 H new ATOM 0 HB3 LEU A 16 37.752 27.838 11.869 1.00 29.49 H new ATOM 0 HG LEU A 16 36.183 27.672 9.908 1.00 29.11 H new ATOM 0 HD11 LEU A 16 36.360 25.724 8.393 1.00 29.81 H new ATOM 0 HD12 LEU A 16 37.780 26.786 8.246 1.00 29.81 H new ATOM 0 HD13 LEU A 16 37.898 25.264 9.160 1.00 29.81 H new ATOM 0 HD21 LEU A 16 35.193 25.487 10.599 1.00 25.98 H new ATOM 0 HD22 LEU A 16 36.724 25.051 11.395 1.00 25.98 H new ATOM 0 HD23 LEU A 16 35.755 26.410 12.013 1.00 25.98 H new ATOM 247 N LEU A 17 38.633 30.453 11.299 1.00 27.96 N ATOM 248 CA LEU A 17 38.171 31.834 11.587 1.00 28.93 C ATOM 249 C LEU A 17 38.668 32.742 10.458 1.00 30.06 C ATOM 250 O LEU A 17 37.998 33.665 10.038 1.00 30.41 O ATOM 251 CB LEU A 17 38.795 32.278 12.919 1.00 24.89 C ATOM 252 CG LEU A 17 38.040 33.491 13.517 1.00 25.03 C ATOM 253 CD1 LEU A 17 36.913 33.019 14.462 1.00 21.31 C ATOM 254 CD2 LEU A 17 39.019 34.374 14.314 1.00 20.22 C ATOM 0 H LEU A 17 39.296 30.078 11.977 1.00 27.96 H new ATOM 0 HA LEU A 17 37.084 31.885 11.654 1.00 28.93 H new ATOM 0 HB2 LEU A 17 38.775 31.449 13.627 1.00 24.89 H new ATOM 0 HB3 LEU A 17 39.842 32.539 12.764 1.00 24.89 H new ATOM 0 HG LEU A 17 37.605 34.061 12.696 1.00 25.03 H new ATOM 0 HD11 LEU A 17 36.395 33.886 14.872 1.00 21.31 H new ATOM 0 HD12 LEU A 17 36.206 32.403 13.906 1.00 21.31 H new ATOM 0 HD13 LEU A 17 37.342 32.434 15.276 1.00 21.31 H new ATOM 0 HD21 LEU A 17 38.483 35.226 14.732 1.00 20.22 H new ATOM 0 HD22 LEU A 17 39.460 33.790 15.122 1.00 20.22 H new ATOM 0 HD23 LEU A 17 39.808 34.732 13.652 1.00 20.22 H new ATOM 266 N GLU A 18 39.854 32.473 9.967 1.00 32.20 N ATOM 267 CA GLU A 18 40.425 33.300 8.865 1.00 35.35 C ATOM 268 C GLU A 18 39.816 32.846 7.530 1.00 35.74 C ATOM 269 O GLU A 18 39.405 33.652 6.719 1.00 35.74 O ATOM 270 CB GLU A 18 41.978 33.159 8.878 1.00 37.07 C ATOM 271 CG GLU A 18 42.500 32.222 7.770 1.00 39.76 C ATOM 272 CD GLU A 18 44.016 32.071 7.908 1.00 41.67 C ATOM 273 OE1 GLU A 18 44.588 32.764 8.732 1.00 43.93 O ATOM 274 OE2 GLU A 18 44.579 31.264 7.186 1.00 43.25 O ATOM 0 H GLU A 18 40.452 31.711 10.286 1.00 32.20 H new ATOM 0 HA GLU A 18 40.182 34.354 9.002 1.00 35.35 H new ATOM 0 HB2 GLU A 18 42.429 34.144 8.758 1.00 37.07 H new ATOM 0 HB3 GLU A 18 42.296 32.779 9.849 1.00 37.07 H new ATOM 0 HG2 GLU A 18 42.018 31.247 7.845 1.00 39.76 H new ATOM 0 HG3 GLU A 18 42.251 32.626 6.789 1.00 39.76 H new ATOM 281 N LYS A 19 39.750 31.562 7.302 1.00 37.19 N ATOM 282 CA LYS A 19 39.164 31.059 6.030 1.00 36.85 C ATOM 283 C LYS A 19 37.822 31.750 5.785 1.00 36.69 C ATOM 284 O LYS A 19 37.510 32.161 4.685 1.00 36.88 O ATOM 285 CB LYS A 19 38.969 29.555 6.126 1.00 36.86 C ATOM 286 CG LYS A 19 38.875 28.976 4.713 1.00 40.15 C ATOM 287 CD LYS A 19 38.344 27.567 4.807 1.00 41.50 C ATOM 288 CE LYS A 19 38.412 26.890 3.438 1.00 44.93 C ATOM 289 NZ LYS A 19 37.946 27.841 2.389 1.00 44.88 N ATOM 0 H LYS A 19 40.078 30.840 7.944 1.00 37.19 H new ATOM 0 HA LYS A 19 39.835 31.278 5.199 1.00 36.85 H new ATOM 0 HB2 LYS A 19 39.801 29.101 6.665 1.00 36.86 H new ATOM 0 HB3 LYS A 19 38.063 29.327 6.688 1.00 36.86 H new ATOM 0 HG2 LYS A 19 38.217 29.588 4.096 1.00 40.15 H new ATOM 0 HG3 LYS A 19 39.855 28.980 4.236 1.00 40.15 H new ATOM 0 HD2 LYS A 19 38.926 26.998 5.532 1.00 41.50 H new ATOM 0 HD3 LYS A 19 37.314 27.581 5.164 1.00 41.50 H new ATOM 0 HE2 LYS A 19 39.433 26.572 3.228 1.00 44.93 H new ATOM 0 HE3 LYS A 19 37.792 25.994 3.433 1.00 44.93 H new ATOM 0 HZ1 LYS A 19 37.637 27.309 1.551 1.00 44.88 H new ATOM 0 HZ2 LYS A 19 37.150 28.401 2.757 1.00 44.88 H new ATOM 0 HZ3 LYS A 19 38.725 28.478 2.127 1.00 44.88 H new ATOM 303 N PHE A 20 37.029 31.886 6.814 1.00 34.99 N ATOM 304 CA PHE A 20 35.707 32.553 6.677 1.00 34.93 C ATOM 305 C PHE A 20 35.834 34.001 7.155 1.00 34.32 C ATOM 306 O PHE A 20 34.881 34.754 7.153 1.00 35.01 O ATOM 307 CB PHE A 20 34.704 31.815 7.556 1.00 34.20 C ATOM 308 CG PHE A 20 34.311 30.516 6.899 1.00 33.79 C ATOM 309 CD1 PHE A 20 35.102 29.378 7.084 1.00 32.30 C ATOM 310 CD2 PHE A 20 33.164 30.452 6.102 1.00 34.75 C ATOM 311 CE1 PHE A 20 34.747 28.173 6.471 1.00 34.86 C ATOM 312 CE2 PHE A 20 32.808 29.249 5.485 1.00 35.66 C ATOM 313 CZ PHE A 20 33.601 28.108 5.670 1.00 35.69 C ATOM 0 H PHE A 20 37.246 31.558 7.755 1.00 34.99 H new ATOM 0 HA PHE A 20 35.375 32.539 5.639 1.00 34.93 H new ATOM 0 HB2 PHE A 20 35.139 31.621 8.536 1.00 34.20 H new ATOM 0 HB3 PHE A 20 33.821 32.434 7.716 1.00 34.20 H new ATOM 0 HD1 PHE A 20 35.987 29.430 7.700 1.00 32.30 H new ATOM 0 HD2 PHE A 20 32.553 31.332 5.963 1.00 34.75 H new ATOM 0 HE1 PHE A 20 35.356 27.293 6.615 1.00 34.86 H new ATOM 0 HE2 PHE A 20 31.924 29.199 4.867 1.00 35.66 H new ATOM 0 HZ PHE A 20 33.327 27.178 5.194 1.00 35.69 H new ATOM 323 N ARG A 21 37.012 34.386 7.567 1.00 34.35 N ATOM 324 CA ARG A 21 37.232 35.778 8.050 1.00 34.08 C ATOM 325 C ARG A 21 36.244 36.113 9.170 1.00 33.06 C ATOM 326 O ARG A 21 35.797 37.237 9.291 1.00 31.60 O ATOM 327 CB ARG A 21 37.037 36.767 6.893 1.00 37.64 C ATOM 328 CG ARG A 21 38.027 36.457 5.756 1.00 41.19 C ATOM 329 CD ARG A 21 39.388 37.103 6.046 1.00 45.12 C ATOM 330 NE ARG A 21 40.280 36.926 4.867 1.00 48.87 N ATOM 331 CZ ARG A 21 41.360 37.649 4.753 1.00 50.17 C ATOM 332 NH1 ARG A 21 41.658 38.525 5.673 1.00 52.38 N ATOM 333 NH2 ARG A 21 42.142 37.497 3.719 1.00 50.69 N ATOM 0 H ARG A 21 37.839 33.789 7.589 1.00 34.35 H new ATOM 0 HA ARG A 21 38.249 35.857 8.433 1.00 34.08 H new ATOM 0 HB2 ARG A 21 36.014 36.706 6.521 1.00 37.64 H new ATOM 0 HB3 ARG A 21 37.187 37.787 7.248 1.00 37.64 H new ATOM 0 HG2 ARG A 21 38.144 35.378 5.650 1.00 41.19 H new ATOM 0 HG3 ARG A 21 37.634 36.830 4.810 1.00 41.19 H new ATOM 0 HD2 ARG A 21 39.261 38.163 6.264 1.00 45.12 H new ATOM 0 HD3 ARG A 21 39.838 36.648 6.928 1.00 45.12 H new ATOM 0 HE ARG A 21 40.047 36.240 4.149 1.00 48.87 H new ATOM 0 HH11 ARG A 21 41.047 38.644 6.481 1.00 52.38 H new ATOM 0 HH12 ARG A 21 42.502 39.091 5.584 1.00 52.38 H new ATOM 0 HH21 ARG A 21 41.909 36.813 2.999 1.00 50.69 H new ATOM 0 HH22 ARG A 21 42.986 38.063 3.631 1.00 50.69 H new ATOM 347 N TYR A 22 35.895 35.162 9.996 1.00 30.22 N ATOM 348 CA TYR A 22 34.940 35.466 11.094 1.00 29.11 C ATOM 349 C TYR A 22 35.641 36.381 12.135 1.00 27.15 C ATOM 350 O TYR A 22 36.833 36.258 12.332 1.00 25.96 O ATOM 351 CB TYR A 22 34.533 34.150 11.775 1.00 27.09 C ATOM 352 CG TYR A 22 33.435 33.438 10.992 1.00 27.40 C ATOM 353 CD1 TYR A 22 32.207 34.071 10.723 1.00 26.95 C ATOM 354 CD2 TYR A 22 33.649 32.129 10.534 1.00 25.13 C ATOM 355 CE1 TYR A 22 31.214 33.399 10.001 1.00 26.07 C ATOM 356 CE2 TYR A 22 32.652 31.461 9.814 1.00 24.89 C ATOM 357 CZ TYR A 22 31.436 32.097 9.546 1.00 24.53 C ATOM 358 OH TYR A 22 30.454 31.438 8.835 1.00 21.93 O ATOM 0 H TYR A 22 36.227 34.199 9.957 1.00 30.22 H new ATOM 0 HA TYR A 22 34.058 35.968 10.695 1.00 29.11 H new ATOM 0 HB2 TYR A 22 35.403 33.498 11.861 1.00 27.09 H new ATOM 0 HB3 TYR A 22 34.186 34.354 12.788 1.00 27.09 H new ATOM 0 HD1 TYR A 22 32.031 35.077 11.074 1.00 26.95 H new ATOM 0 HD2 TYR A 22 34.587 31.635 10.738 1.00 25.13 H new ATOM 0 HE1 TYR A 22 30.274 33.888 9.795 1.00 26.07 H new ATOM 0 HE2 TYR A 22 32.822 30.453 9.465 1.00 24.89 H new ATOM 0 HH TYR A 22 30.524 31.672 7.886 1.00 21.93 H new ATOM 368 N PRO A 23 34.894 37.254 12.795 1.00 25.95 N ATOM 369 CA PRO A 23 35.469 38.144 13.828 1.00 26.49 C ATOM 370 C PRO A 23 36.206 37.312 14.892 1.00 26.35 C ATOM 371 O PRO A 23 36.207 36.103 14.852 1.00 24.48 O ATOM 372 CB PRO A 23 34.256 38.887 14.436 1.00 27.06 C ATOM 373 CG PRO A 23 32.985 38.403 13.682 1.00 29.61 C ATOM 374 CD PRO A 23 33.446 37.432 12.574 1.00 27.83 C ATOM 0 HA PRO A 23 36.200 38.842 13.420 1.00 26.49 H new ATOM 0 HB2 PRO A 23 34.173 38.676 15.502 1.00 27.06 H new ATOM 0 HB3 PRO A 23 34.376 39.965 14.332 1.00 27.06 H new ATOM 0 HG2 PRO A 23 32.299 37.905 14.367 1.00 29.61 H new ATOM 0 HG3 PRO A 23 32.449 39.249 13.252 1.00 29.61 H new ATOM 0 HD2 PRO A 23 32.918 36.481 12.639 1.00 27.83 H new ATOM 0 HD3 PRO A 23 33.246 37.841 11.584 1.00 27.83 H new ATOM 382 N TRP A 24 36.839 37.961 15.835 1.00 23.75 N ATOM 383 CA TRP A 24 37.587 37.217 16.897 1.00 24.21 C ATOM 384 C TRP A 24 36.638 36.699 17.984 1.00 24.68 C ATOM 385 O TRP A 24 37.010 35.869 18.790 1.00 22.18 O ATOM 386 CB TRP A 24 38.631 38.142 17.531 1.00 24.39 C ATOM 387 CG TRP A 24 39.334 37.418 18.638 1.00 26.00 C ATOM 388 CD1 TRP A 24 39.287 37.770 19.943 1.00 27.56 C ATOM 389 CD2 TRP A 24 40.182 36.232 18.564 1.00 24.99 C ATOM 390 NE1 TRP A 24 40.049 36.877 20.676 1.00 24.44 N ATOM 391 CE2 TRP A 24 40.621 35.912 19.871 1.00 27.17 C ATOM 392 CE3 TRP A 24 40.610 35.411 17.503 1.00 27.07 C ATOM 393 CZ2 TRP A 24 41.452 34.818 20.117 1.00 26.88 C ATOM 394 CZ3 TRP A 24 41.447 34.309 17.749 1.00 28.86 C ATOM 395 CH2 TRP A 24 41.866 34.014 19.053 1.00 27.85 C ATOM 0 H TRP A 24 36.871 38.977 15.917 1.00 23.75 H new ATOM 0 HA TRP A 24 38.078 36.361 16.433 1.00 24.21 H new ATOM 0 HB2 TRP A 24 39.351 38.465 16.779 1.00 24.39 H new ATOM 0 HB3 TRP A 24 38.150 39.040 17.918 1.00 24.39 H new ATOM 0 HD1 TRP A 24 38.743 38.611 20.347 1.00 27.56 H new ATOM 0 HE1 TRP A 24 40.173 36.926 21.687 1.00 24.44 H new ATOM 0 HE3 TRP A 24 40.293 35.629 16.494 1.00 27.07 H new ATOM 0 HZ2 TRP A 24 41.773 34.595 21.124 1.00 26.88 H new ATOM 0 HZ3 TRP A 24 41.769 33.686 16.928 1.00 28.86 H new ATOM 0 HH2 TRP A 24 42.509 33.165 19.235 1.00 27.85 H new ATOM 406 N GLU A 25 35.428 37.182 18.035 1.00 21.18 N ATOM 407 CA GLU A 25 34.489 36.710 19.098 1.00 25.10 C ATOM 408 C GLU A 25 33.867 35.359 18.710 1.00 23.53 C ATOM 409 O GLU A 25 33.237 34.719 19.524 1.00 22.15 O ATOM 410 CB GLU A 25 33.381 37.756 19.315 1.00 30.80 C ATOM 411 CG GLU A 25 33.017 38.410 17.981 1.00 38.77 C ATOM 412 CD GLU A 25 31.666 39.119 18.106 1.00 43.31 C ATOM 413 OE1 GLU A 25 30.654 38.448 17.991 1.00 46.36 O ATOM 414 OE2 GLU A 25 31.668 40.322 18.314 1.00 45.94 O ATOM 0 H GLU A 25 35.048 37.878 17.393 1.00 21.18 H new ATOM 0 HA GLU A 25 35.048 36.579 20.024 1.00 25.10 H new ATOM 0 HB2 GLU A 25 32.501 37.282 19.750 1.00 30.80 H new ATOM 0 HB3 GLU A 25 33.717 38.514 20.022 1.00 30.80 H new ATOM 0 HG2 GLU A 25 33.788 39.124 17.693 1.00 38.77 H new ATOM 0 HG3 GLU A 25 32.971 37.656 17.196 1.00 38.77 H new ATOM 421 N LEU A 26 34.009 34.927 17.477 1.00 21.26 N ATOM 422 CA LEU A 26 33.391 33.620 17.065 1.00 20.65 C ATOM 423 C LEU A 26 34.374 32.464 17.221 1.00 20.00 C ATOM 424 O LEU A 26 34.219 31.429 16.604 1.00 16.59 O ATOM 425 CB LEU A 26 32.934 33.698 15.611 1.00 23.25 C ATOM 426 CG LEU A 26 32.138 34.989 15.373 1.00 26.24 C ATOM 427 CD1 LEU A 26 31.371 34.869 14.056 1.00 29.07 C ATOM 428 CD2 LEU A 26 31.133 35.223 16.510 1.00 26.56 C ATOM 0 H LEU A 26 34.521 35.417 16.743 1.00 21.26 H new ATOM 0 HA LEU A 26 32.537 33.436 17.716 1.00 20.65 H new ATOM 0 HB2 LEU A 26 33.799 33.668 14.948 1.00 23.25 H new ATOM 0 HB3 LEU A 26 32.317 32.832 15.369 1.00 23.25 H new ATOM 0 HG LEU A 26 32.834 35.827 15.336 1.00 26.24 H new ATOM 0 HD11 LEU A 26 30.803 35.783 13.881 1.00 29.07 H new ATOM 0 HD12 LEU A 26 32.075 34.717 13.238 1.00 29.07 H new ATOM 0 HD13 LEU A 26 30.687 34.022 14.109 1.00 29.07 H new ATOM 0 HD21 LEU A 26 30.579 36.143 16.322 1.00 26.56 H new ATOM 0 HD22 LEU A 26 30.438 34.385 16.560 1.00 26.56 H new ATOM 0 HD23 LEU A 26 31.667 35.308 17.456 1.00 26.56 H new ATOM 440 N MET A 27 35.357 32.596 18.065 1.00 18.56 N ATOM 441 CA MET A 27 36.285 31.456 18.260 1.00 17.95 C ATOM 442 C MET A 27 35.540 30.303 18.970 1.00 17.26 C ATOM 443 O MET A 27 35.771 29.158 18.636 1.00 15.06 O ATOM 444 CB MET A 27 37.521 31.881 19.068 1.00 20.02 C ATOM 445 CG MET A 27 38.468 32.677 18.174 1.00 18.07 C ATOM 446 SD MET A 27 39.339 31.560 17.044 1.00 11.26 S ATOM 447 CE MET A 27 40.306 30.659 18.281 1.00 20.89 C ATOM 0 H MET A 27 35.554 33.430 18.619 1.00 18.56 H new ATOM 0 HA MET A 27 36.632 31.114 17.285 1.00 17.95 H new ATOM 0 HB2 MET A 27 37.219 32.485 19.924 1.00 20.02 H new ATOM 0 HB3 MET A 27 38.030 31.002 19.463 1.00 20.02 H new ATOM 0 HG2 MET A 27 37.907 33.418 17.605 1.00 18.07 H new ATOM 0 HG3 MET A 27 39.187 33.222 18.786 1.00 18.07 H new ATOM 0 HE1 MET A 27 41.275 30.390 17.860 1.00 20.89 H new ATOM 0 HE2 MET A 27 40.453 31.290 19.158 1.00 20.89 H new ATOM 0 HE3 MET A 27 39.773 29.754 18.571 1.00 20.89 H new ATOM 457 N PRO A 28 34.650 30.606 19.914 1.00 16.29 N ATOM 458 CA PRO A 28 33.892 29.547 20.608 1.00 17.09 C ATOM 459 C PRO A 28 33.049 28.779 19.586 1.00 15.81 C ATOM 460 O PRO A 28 32.696 27.645 19.794 1.00 16.73 O ATOM 461 CB PRO A 28 33.010 30.302 21.634 1.00 16.95 C ATOM 462 CG PRO A 28 33.547 31.751 21.690 1.00 18.75 C ATOM 463 CD PRO A 28 34.323 31.974 20.383 1.00 16.75 C ATOM 0 HA PRO A 28 34.525 28.812 21.105 1.00 17.09 H new ATOM 0 HB2 PRO A 28 31.963 30.287 21.331 1.00 16.95 H new ATOM 0 HB3 PRO A 28 33.065 29.830 22.615 1.00 16.95 H new ATOM 0 HG2 PRO A 28 32.729 32.465 21.783 1.00 18.75 H new ATOM 0 HG3 PRO A 28 34.194 31.893 22.556 1.00 18.75 H new ATOM 0 HD2 PRO A 28 33.722 32.513 19.650 1.00 16.75 H new ATOM 0 HD3 PRO A 28 35.225 32.563 20.551 1.00 16.75 H new ATOM 471 N LEU A 29 32.734 29.390 18.475 1.00 15.35 N ATOM 472 CA LEU A 29 31.928 28.684 17.436 1.00 15.54 C ATOM 473 C LEU A 29 32.871 27.893 16.529 1.00 15.13 C ATOM 474 O LEU A 29 32.709 26.703 16.349 1.00 14.57 O ATOM 475 CB LEU A 29 31.129 29.709 16.627 1.00 15.26 C ATOM 476 CG LEU A 29 30.352 30.619 17.589 1.00 13.96 C ATOM 477 CD1 LEU A 29 29.482 31.585 16.781 1.00 15.02 C ATOM 478 CD2 LEU A 29 29.458 29.762 18.508 1.00 15.96 C ATOM 0 H LEU A 29 33.000 30.347 18.242 1.00 15.35 H new ATOM 0 HA LEU A 29 31.227 27.994 17.906 1.00 15.54 H new ATOM 0 HB2 LEU A 29 31.800 30.304 16.008 1.00 15.26 H new ATOM 0 HB3 LEU A 29 30.440 29.200 15.953 1.00 15.26 H new ATOM 0 HG LEU A 29 31.055 31.185 18.200 1.00 13.96 H new ATOM 0 HD11 LEU A 29 28.929 32.233 17.461 1.00 15.02 H new ATOM 0 HD12 LEU A 29 30.116 32.193 16.136 1.00 15.02 H new ATOM 0 HD13 LEU A 29 28.780 31.018 16.169 1.00 15.02 H new ATOM 0 HD21 LEU A 29 28.908 30.411 19.189 1.00 15.96 H new ATOM 0 HD22 LEU A 29 28.754 29.192 17.902 1.00 15.96 H new ATOM 0 HD23 LEU A 29 30.080 29.076 19.083 1.00 15.96 H new ATOM 490 N MET A 30 33.875 28.524 15.977 1.00 15.06 N ATOM 491 CA MET A 30 34.825 27.764 15.121 1.00 12.45 C ATOM 492 C MET A 30 35.376 26.613 15.956 1.00 12.90 C ATOM 493 O MET A 30 35.629 25.530 15.467 1.00 14.81 O ATOM 494 CB MET A 30 35.986 28.666 14.696 1.00 15.01 C ATOM 495 CG MET A 30 35.498 29.761 13.748 1.00 12.65 C ATOM 496 SD MET A 30 34.869 29.017 12.218 1.00 8.44 S ATOM 497 CE MET A 30 33.143 29.535 12.378 1.00 27.75 C ATOM 0 H MET A 30 34.074 29.519 16.081 1.00 15.06 H new ATOM 0 HA MET A 30 34.317 27.399 14.228 1.00 12.45 H new ATOM 0 HB2 MET A 30 36.444 29.117 15.576 1.00 15.01 H new ATOM 0 HB3 MET A 30 36.756 28.070 14.206 1.00 15.01 H new ATOM 0 HG2 MET A 30 34.713 30.346 14.228 1.00 12.65 H new ATOM 0 HG3 MET A 30 36.314 30.447 13.520 1.00 12.65 H new ATOM 0 HE1 MET A 30 32.597 29.266 11.474 1.00 27.75 H new ATOM 0 HE2 MET A 30 32.692 29.037 13.236 1.00 27.75 H new ATOM 0 HE3 MET A 30 33.099 30.615 12.520 1.00 27.75 H new ATOM 507 N TYR A 31 35.557 26.855 17.225 1.00 13.07 N ATOM 508 CA TYR A 31 36.086 25.800 18.129 1.00 15.35 C ATOM 509 C TYR A 31 35.145 24.589 18.114 1.00 16.32 C ATOM 510 O TYR A 31 35.560 23.467 17.903 1.00 15.86 O ATOM 511 CB TYR A 31 36.179 26.365 19.551 1.00 14.82 C ATOM 512 CG TYR A 31 36.539 25.261 20.517 1.00 17.46 C ATOM 513 CD1 TYR A 31 35.535 24.427 21.024 1.00 20.04 C ATOM 514 CD2 TYR A 31 37.872 25.073 20.909 1.00 19.91 C ATOM 515 CE1 TYR A 31 35.858 23.405 21.920 1.00 21.64 C ATOM 516 CE2 TYR A 31 38.194 24.047 21.803 1.00 22.38 C ATOM 517 CZ TYR A 31 37.189 23.213 22.310 1.00 23.93 C ATOM 518 OH TYR A 31 37.510 22.204 23.195 1.00 30.09 O ATOM 0 H TYR A 31 35.359 27.748 17.677 1.00 13.07 H new ATOM 0 HA TYR A 31 37.074 25.486 17.792 1.00 15.35 H new ATOM 0 HB2 TYR A 31 36.930 27.154 19.590 1.00 14.82 H new ATOM 0 HB3 TYR A 31 35.228 26.815 19.836 1.00 14.82 H new ATOM 0 HD1 TYR A 31 34.509 24.574 20.722 1.00 20.04 H new ATOM 0 HD2 TYR A 31 38.647 25.718 20.522 1.00 19.91 H new ATOM 0 HE1 TYR A 31 35.082 22.764 22.311 1.00 21.64 H new ATOM 0 HE2 TYR A 31 39.220 23.897 22.103 1.00 22.38 H new ATOM 0 HH TYR A 31 38.476 22.208 23.359 1.00 30.09 H new ATOM 528 N VAL A 32 33.879 24.808 18.345 1.00 16.31 N ATOM 529 CA VAL A 32 32.911 23.672 18.358 1.00 13.79 C ATOM 530 C VAL A 32 32.852 23.006 16.982 1.00 15.33 C ATOM 531 O VAL A 32 32.995 21.806 16.862 1.00 15.78 O ATOM 532 CB VAL A 32 31.519 24.192 18.725 1.00 15.68 C ATOM 533 CG1 VAL A 32 30.546 23.017 18.785 1.00 14.40 C ATOM 534 CG2 VAL A 32 31.562 24.891 20.093 1.00 13.96 C ATOM 0 H VAL A 32 33.472 25.726 18.526 1.00 16.31 H new ATOM 0 HA VAL A 32 33.241 22.939 19.094 1.00 13.79 H new ATOM 0 HB VAL A 32 31.191 24.908 17.971 1.00 15.68 H new ATOM 0 HG11 VAL A 32 29.552 23.381 19.046 1.00 14.40 H new ATOM 0 HG12 VAL A 32 30.509 22.525 17.813 1.00 14.40 H new ATOM 0 HG13 VAL A 32 30.881 22.305 19.539 1.00 14.40 H new ATOM 0 HG21 VAL A 32 30.567 25.258 20.346 1.00 13.96 H new ATOM 0 HG22 VAL A 32 31.892 24.183 20.853 1.00 13.96 H new ATOM 0 HG23 VAL A 32 32.258 25.729 20.052 1.00 13.96 H new ATOM 544 N ILE A 33 32.632 23.770 15.943 1.00 13.65 N ATOM 545 CA ILE A 33 32.555 23.177 14.575 1.00 13.17 C ATOM 546 C ILE A 33 33.689 22.154 14.384 1.00 15.24 C ATOM 547 O ILE A 33 33.454 20.992 14.115 1.00 15.62 O ATOM 548 CB ILE A 33 32.656 24.322 13.554 1.00 15.80 C ATOM 549 CG1 ILE A 33 31.312 25.083 13.539 1.00 14.63 C ATOM 550 CG2 ILE A 33 32.954 23.764 12.159 1.00 15.09 C ATOM 551 CD1 ILE A 33 31.439 26.442 12.829 1.00 15.66 C ATOM 0 H ILE A 33 32.502 24.781 15.984 1.00 13.65 H new ATOM 0 HA ILE A 33 31.612 22.650 14.433 1.00 13.17 H new ATOM 0 HB ILE A 33 33.466 24.995 13.834 1.00 15.80 H new ATOM 0 HG12 ILE A 33 30.557 24.479 13.037 1.00 14.63 H new ATOM 0 HG13 ILE A 33 30.969 25.237 14.562 1.00 14.63 H new ATOM 0 HG21 ILE A 33 33.023 24.585 11.446 1.00 15.09 H new ATOM 0 HG22 ILE A 33 33.899 23.220 12.179 1.00 15.09 H new ATOM 0 HG23 ILE A 33 32.153 23.089 11.858 1.00 15.09 H new ATOM 0 HD11 ILE A 33 30.474 26.949 12.838 1.00 15.66 H new ATOM 0 HD12 ILE A 33 32.176 27.056 13.347 1.00 15.66 H new ATOM 0 HD13 ILE A 33 31.757 26.286 11.798 1.00 15.66 H new ATOM 563 N LEU A 34 34.905 22.577 14.545 1.00 16.71 N ATOM 564 CA LEU A 34 36.073 21.650 14.406 1.00 19.71 C ATOM 565 C LEU A 34 35.870 20.439 15.341 1.00 20.61 C ATOM 566 O LEU A 34 36.046 19.303 14.945 1.00 22.08 O ATOM 567 CB LEU A 34 37.345 22.450 14.825 1.00 19.59 C ATOM 568 CG LEU A 34 38.316 22.900 13.652 1.00 26.84 C ATOM 569 CD1 LEU A 34 37.826 22.583 12.231 1.00 24.93 C ATOM 570 CD2 LEU A 34 38.554 24.418 13.740 1.00 27.25 C ATOM 0 H LEU A 34 35.152 23.541 14.771 1.00 16.71 H new ATOM 0 HA LEU A 34 36.174 21.283 13.385 1.00 19.71 H new ATOM 0 HB2 LEU A 34 37.025 23.342 15.364 1.00 19.59 H new ATOM 0 HB3 LEU A 34 37.916 21.841 15.526 1.00 19.59 H new ATOM 0 HG LEU A 34 39.225 22.318 13.803 1.00 26.84 H new ATOM 0 HD11 LEU A 34 38.562 22.931 11.506 1.00 24.93 H new ATOM 0 HD12 LEU A 34 37.693 21.507 12.124 1.00 24.93 H new ATOM 0 HD13 LEU A 34 36.875 23.086 12.053 1.00 24.93 H new ATOM 0 HD21 LEU A 34 39.220 24.729 12.936 1.00 27.25 H new ATOM 0 HD22 LEU A 34 37.603 24.942 13.646 1.00 27.25 H new ATOM 0 HD23 LEU A 34 39.008 24.660 14.701 1.00 27.25 H new ATOM 582 N LYS A 35 35.521 20.676 16.576 1.00 19.14 N ATOM 583 CA LYS A 35 35.328 19.544 17.540 1.00 20.97 C ATOM 584 C LYS A 35 34.502 18.440 16.895 1.00 22.25 C ATOM 585 O LYS A 35 34.656 17.274 17.198 1.00 22.80 O ATOM 586 CB LYS A 35 34.594 20.054 18.788 1.00 22.98 C ATOM 587 CG LYS A 35 34.641 18.984 19.881 1.00 26.83 C ATOM 588 CD LYS A 35 34.074 19.555 21.183 1.00 29.91 C ATOM 589 CE LYS A 35 34.027 18.455 22.245 1.00 33.36 C ATOM 590 NZ LYS A 35 35.380 17.848 22.391 1.00 35.88 N ATOM 0 H LYS A 35 35.360 21.605 16.964 1.00 19.14 H new ATOM 0 HA LYS A 35 36.305 19.148 17.818 1.00 20.97 H new ATOM 0 HB2 LYS A 35 35.057 20.974 19.145 1.00 22.98 H new ATOM 0 HB3 LYS A 35 33.559 20.293 18.542 1.00 22.98 H new ATOM 0 HG2 LYS A 35 34.066 18.111 19.574 1.00 26.83 H new ATOM 0 HG3 LYS A 35 35.668 18.651 20.035 1.00 26.83 H new ATOM 0 HD2 LYS A 35 34.693 20.383 21.529 1.00 29.91 H new ATOM 0 HD3 LYS A 35 33.074 19.954 21.013 1.00 29.91 H new ATOM 0 HE2 LYS A 35 33.697 18.869 23.198 1.00 33.36 H new ATOM 0 HE3 LYS A 35 33.303 17.691 21.961 1.00 33.36 H new ATOM 0 HZ1 LYS A 35 35.418 17.291 23.269 1.00 35.88 H new ATOM 0 HZ2 LYS A 35 35.572 17.228 21.579 1.00 35.88 H new ATOM 0 HZ3 LYS A 35 36.096 18.601 22.428 1.00 35.88 H new ATOM 604 N ASP A 36 33.614 18.800 16.023 1.00 20.87 N ATOM 605 CA ASP A 36 32.755 17.785 15.365 1.00 18.89 C ATOM 606 C ASP A 36 33.439 17.237 14.116 1.00 17.97 C ATOM 607 O ASP A 36 33.447 16.048 13.867 1.00 19.23 O ATOM 608 CB ASP A 36 31.448 18.460 14.982 1.00 16.73 C ATOM 609 CG ASP A 36 30.981 19.323 16.157 1.00 19.06 C ATOM 610 OD1 ASP A 36 30.786 18.773 17.229 1.00 14.84 O ATOM 611 OD2 ASP A 36 30.825 20.517 15.965 1.00 17.75 O ATOM 0 H ASP A 36 33.443 19.763 15.734 1.00 20.87 H new ATOM 0 HA ASP A 36 32.574 16.952 16.044 1.00 18.89 H new ATOM 0 HB2 ASP A 36 31.586 19.075 14.093 1.00 16.73 H new ATOM 0 HB3 ASP A 36 30.693 17.712 14.738 1.00 16.73 H new ATOM 616 N ALA A 37 33.994 18.100 13.320 1.00 19.53 N ATOM 617 CA ALA A 37 34.659 17.648 12.070 1.00 20.29 C ATOM 618 C ALA A 37 36.033 17.069 12.382 1.00 23.93 C ATOM 619 O ALA A 37 36.971 17.243 11.629 1.00 23.82 O ATOM 620 CB ALA A 37 34.819 18.843 11.143 1.00 19.16 C ATOM 0 H ALA A 37 34.017 19.107 13.481 1.00 19.53 H new ATOM 0 HA ALA A 37 34.051 16.877 11.596 1.00 20.29 H new ATOM 0 HB1 ALA A 37 35.306 18.526 10.221 1.00 19.16 H new ATOM 0 HB2 ALA A 37 33.838 19.257 10.911 1.00 19.16 H new ATOM 0 HB3 ALA A 37 35.428 19.604 11.632 1.00 19.16 H new ATOM 626 N ASP A 38 36.175 16.393 13.482 1.00 25.04 N ATOM 627 CA ASP A 38 37.505 15.828 13.816 1.00 29.02 C ATOM 628 C ASP A 38 38.532 16.961 13.764 1.00 30.09 C ATOM 629 O ASP A 38 39.723 16.738 13.696 1.00 29.56 O ATOM 630 CB ASP A 38 37.864 14.740 12.793 1.00 31.78 C ATOM 631 CG ASP A 38 38.878 13.765 13.400 1.00 34.21 C ATOM 632 OD1 ASP A 38 40.032 14.141 13.522 1.00 39.08 O ATOM 633 OD2 ASP A 38 38.482 12.660 13.733 1.00 37.98 O ATOM 0 H ASP A 38 35.435 16.208 14.159 1.00 25.04 H new ATOM 0 HA ASP A 38 37.496 15.384 14.811 1.00 29.02 H new ATOM 0 HB2 ASP A 38 36.965 14.202 12.491 1.00 31.78 H new ATOM 0 HB3 ASP A 38 38.279 15.197 11.894 1.00 31.78 H new ATOM 638 N ALA A 39 38.057 18.177 13.788 1.00 30.33 N ATOM 639 CA ALA A 39 38.964 19.351 13.735 1.00 32.12 C ATOM 640 C ALA A 39 39.591 19.458 12.341 1.00 33.86 C ATOM 641 O ALA A 39 40.619 20.080 12.158 1.00 34.96 O ATOM 642 CB ALA A 39 40.048 19.206 14.804 1.00 32.67 C ATOM 0 H ALA A 39 37.065 18.406 13.843 1.00 30.33 H new ATOM 0 HA ALA A 39 38.398 20.262 13.930 1.00 32.12 H new ATOM 0 HB1 ALA A 39 40.714 20.068 14.766 1.00 32.67 H new ATOM 0 HB2 ALA A 39 39.583 19.150 15.788 1.00 32.67 H new ATOM 0 HB3 ALA A 39 40.620 18.296 14.621 1.00 32.67 H new ATOM 648 N ASN A 40 38.972 18.864 11.353 1.00 33.92 N ATOM 649 CA ASN A 40 39.520 18.938 9.965 1.00 34.20 C ATOM 650 C ASN A 40 38.887 20.128 9.240 1.00 34.98 C ATOM 651 O ASN A 40 37.771 20.053 8.765 1.00 32.10 O ATOM 652 CB ASN A 40 39.185 17.646 9.212 1.00 33.87 C ATOM 653 CG ASN A 40 39.570 17.792 7.737 1.00 32.69 C ATOM 654 OD1 ASN A 40 39.045 17.098 6.889 1.00 34.27 O ATOM 655 ND2 ASN A 40 40.472 18.670 7.395 1.00 33.64 N ATOM 0 H ASN A 40 38.108 18.330 11.448 1.00 33.92 H new ATOM 0 HA ASN A 40 40.602 19.063 10.004 1.00 34.20 H new ATOM 0 HB2 ASN A 40 39.720 16.806 9.656 1.00 33.87 H new ATOM 0 HB3 ASN A 40 38.121 17.428 9.300 1.00 33.87 H new ATOM 0 HD21 ASN A 40 40.737 18.774 6.415 1.00 33.64 H new ATOM 0 HD22 ASN A 40 40.913 19.252 8.107 1.00 33.64 H new ATOM 662 N ILE A 41 39.591 21.224 9.155 1.00 35.49 N ATOM 663 CA ILE A 41 39.036 22.425 8.463 1.00 37.55 C ATOM 664 C ILE A 41 38.391 22.010 7.144 1.00 36.60 C ATOM 665 O ILE A 41 37.250 22.324 6.878 1.00 34.64 O ATOM 666 CB ILE A 41 40.179 23.416 8.197 1.00 39.67 C ATOM 667 CG1 ILE A 41 40.623 23.993 9.556 1.00 42.22 C ATOM 668 CG2 ILE A 41 39.728 24.541 7.207 1.00 40.78 C ATOM 669 CD1 ILE A 41 41.675 25.092 9.367 1.00 44.19 C ATOM 0 H ILE A 41 40.530 21.341 9.536 1.00 35.49 H new ATOM 0 HA ILE A 41 38.279 22.896 9.090 1.00 37.55 H new ATOM 0 HB ILE A 41 41.019 22.910 7.721 1.00 39.67 H new ATOM 0 HG12 ILE A 41 39.759 24.398 10.083 1.00 42.22 H new ATOM 0 HG13 ILE A 41 41.031 23.196 10.178 1.00 42.22 H new ATOM 0 HG21 ILE A 41 40.556 25.229 7.036 1.00 40.78 H new ATOM 0 HG22 ILE A 41 39.427 24.093 6.260 1.00 40.78 H new ATOM 0 HG23 ILE A 41 38.886 25.086 7.634 1.00 40.78 H new ATOM 0 HD11 ILE A 41 41.972 25.483 10.340 1.00 44.19 H new ATOM 0 HD12 ILE A 41 42.547 24.678 8.861 1.00 44.19 H new ATOM 0 HD13 ILE A 41 41.255 25.898 8.765 1.00 44.19 H new ATOM 681 N GLU A 42 39.110 21.313 6.314 1.00 37.01 N ATOM 682 CA GLU A 42 38.533 20.888 5.011 1.00 36.07 C ATOM 683 C GLU A 42 37.141 20.299 5.234 1.00 33.02 C ATOM 684 O GLU A 42 36.182 20.699 4.608 1.00 31.66 O ATOM 685 CB GLU A 42 39.443 19.835 4.378 1.00 40.46 C ATOM 686 CG GLU A 42 40.816 20.452 4.103 1.00 45.44 C ATOM 687 CD GLU A 42 41.693 19.439 3.365 1.00 49.08 C ATOM 688 OE1 GLU A 42 41.382 19.135 2.225 1.00 50.84 O ATOM 689 OE2 GLU A 42 42.661 18.984 3.952 1.00 51.71 O ATOM 0 H GLU A 42 40.072 21.019 6.481 1.00 37.01 H new ATOM 0 HA GLU A 42 38.454 21.749 4.347 1.00 36.07 H new ATOM 0 HB2 GLU A 42 39.544 18.978 5.043 1.00 40.46 H new ATOM 0 HB3 GLU A 42 39.004 19.469 3.450 1.00 40.46 H new ATOM 0 HG2 GLU A 42 40.706 21.357 3.506 1.00 45.44 H new ATOM 0 HG3 GLU A 42 41.289 20.744 5.040 1.00 45.44 H new ATOM 696 N GLU A 43 37.020 19.361 6.127 1.00 29.75 N ATOM 697 CA GLU A 43 35.685 18.758 6.391 1.00 27.99 C ATOM 698 C GLU A 43 34.829 19.749 7.182 1.00 25.26 C ATOM 699 O GLU A 43 33.661 19.930 6.904 1.00 22.77 O ATOM 700 CB GLU A 43 35.850 17.468 7.198 1.00 30.94 C ATOM 701 CG GLU A 43 34.555 16.655 7.138 1.00 33.24 C ATOM 702 CD GLU A 43 34.384 16.071 5.735 1.00 37.98 C ATOM 703 OE1 GLU A 43 35.063 15.104 5.431 1.00 43.17 O ATOM 704 OE2 GLU A 43 33.577 16.600 4.988 1.00 38.40 O ATOM 0 H GLU A 43 37.786 18.985 6.686 1.00 29.75 H new ATOM 0 HA GLU A 43 35.198 18.528 5.443 1.00 27.99 H new ATOM 0 HB2 GLU A 43 36.678 16.882 6.800 1.00 30.94 H new ATOM 0 HB3 GLU A 43 36.095 17.704 8.233 1.00 30.94 H new ATOM 0 HG2 GLU A 43 34.582 15.854 7.876 1.00 33.24 H new ATOM 0 HG3 GLU A 43 33.703 17.289 7.386 1.00 33.24 H new ATOM 711 N ALA A 44 35.398 20.394 8.167 1.00 22.98 N ATOM 712 CA ALA A 44 34.602 21.367 8.965 1.00 23.88 C ATOM 713 C ALA A 44 34.107 22.486 8.042 1.00 22.87 C ATOM 714 O ALA A 44 32.988 22.943 8.152 1.00 22.85 O ATOM 715 CB ALA A 44 35.466 21.934 10.116 1.00 22.28 C ATOM 0 H ALA A 44 36.372 20.289 8.450 1.00 22.98 H new ATOM 0 HA ALA A 44 33.738 20.870 9.407 1.00 23.88 H new ATOM 0 HB1 ALA A 44 34.878 22.645 10.696 1.00 22.28 H new ATOM 0 HB2 ALA A 44 35.791 21.119 10.763 1.00 22.28 H new ATOM 0 HB3 ALA A 44 36.339 22.438 9.701 1.00 22.28 H new ATOM 721 N SER A 45 34.929 22.923 7.134 1.00 25.55 N ATOM 722 CA SER A 45 34.509 24.007 6.205 1.00 26.34 C ATOM 723 C SER A 45 33.286 23.558 5.400 1.00 26.21 C ATOM 724 O SER A 45 32.315 24.279 5.279 1.00 23.95 O ATOM 725 CB SER A 45 35.658 24.327 5.251 1.00 29.82 C ATOM 726 OG SER A 45 35.682 23.366 4.204 1.00 33.07 O ATOM 0 H SER A 45 35.878 22.576 6.994 1.00 25.55 H new ATOM 0 HA SER A 45 34.251 24.896 6.781 1.00 26.34 H new ATOM 0 HB2 SER A 45 35.535 25.328 4.838 1.00 29.82 H new ATOM 0 HB3 SER A 45 36.606 24.319 5.789 1.00 29.82 H new ATOM 0 HG SER A 45 35.912 22.487 4.572 1.00 33.07 H new ATOM 732 N ARG A 46 33.321 22.375 4.843 1.00 26.25 N ATOM 733 CA ARG A 46 32.155 21.896 4.044 1.00 26.19 C ATOM 734 C ARG A 46 30.865 22.117 4.837 1.00 24.78 C ATOM 735 O ARG A 46 29.859 22.531 4.297 1.00 20.51 O ATOM 736 CB ARG A 46 32.311 20.401 3.729 1.00 30.93 C ATOM 737 CG ARG A 46 33.446 20.182 2.709 1.00 37.66 C ATOM 738 CD ARG A 46 33.223 18.864 1.951 1.00 43.41 C ATOM 739 NE ARG A 46 32.536 17.886 2.841 1.00 47.39 N ATOM 740 CZ ARG A 46 31.978 16.823 2.329 1.00 49.82 C ATOM 741 NH1 ARG A 46 32.025 16.618 1.042 1.00 51.10 N ATOM 742 NH2 ARG A 46 31.372 15.966 3.105 1.00 51.02 N ATOM 0 H ARG A 46 34.103 21.723 4.907 1.00 26.25 H new ATOM 0 HA ARG A 46 32.111 22.456 3.110 1.00 26.19 H new ATOM 0 HB2 ARG A 46 32.525 19.850 4.645 1.00 30.93 H new ATOM 0 HB3 ARG A 46 31.376 20.007 3.332 1.00 30.93 H new ATOM 0 HG2 ARG A 46 33.480 21.014 2.006 1.00 37.66 H new ATOM 0 HG3 ARG A 46 34.408 20.158 3.222 1.00 37.66 H new ATOM 0 HD2 ARG A 46 32.623 19.043 1.059 1.00 43.41 H new ATOM 0 HD3 ARG A 46 34.178 18.459 1.617 1.00 43.41 H new ATOM 0 HE ARG A 46 32.502 18.047 3.848 1.00 47.39 H new ATOM 0 HH11 ARG A 46 32.498 17.288 0.436 1.00 51.10 H new ATOM 0 HH12 ARG A 46 31.589 15.787 0.642 1.00 51.10 H new ATOM 0 HH21 ARG A 46 31.335 16.127 4.112 1.00 51.02 H new ATOM 0 HH22 ARG A 46 30.936 15.135 2.705 1.00 51.02 H new ATOM 756 N ARG A 47 30.886 21.852 6.112 1.00 20.40 N ATOM 757 CA ARG A 47 29.658 22.056 6.930 1.00 20.79 C ATOM 758 C ARG A 47 29.298 23.537 6.912 1.00 20.46 C ATOM 759 O ARG A 47 28.243 23.925 6.451 1.00 20.27 O ATOM 760 CB ARG A 47 29.916 21.600 8.368 1.00 18.12 C ATOM 761 CG ARG A 47 30.586 20.223 8.348 1.00 19.83 C ATOM 762 CD ARG A 47 30.822 19.729 9.780 1.00 24.63 C ATOM 763 NE ARG A 47 30.912 18.243 9.774 1.00 25.15 N ATOM 764 CZ ARG A 47 31.393 17.618 10.810 1.00 28.72 C ATOM 765 NH1 ARG A 47 31.779 18.296 11.853 1.00 25.84 N ATOM 766 NH2 ARG A 47 31.490 16.318 10.803 1.00 22.33 N ATOM 0 H ARG A 47 31.697 21.504 6.623 1.00 20.40 H new ATOM 0 HA ARG A 47 28.835 21.472 6.518 1.00 20.79 H new ATOM 0 HB2 ARG A 47 30.553 22.320 8.882 1.00 18.12 H new ATOM 0 HB3 ARG A 47 28.978 21.553 8.921 1.00 18.12 H new ATOM 0 HG2 ARG A 47 29.959 19.513 7.809 1.00 19.83 H new ATOM 0 HG3 ARG A 47 31.535 20.280 7.814 1.00 19.83 H new ATOM 0 HD2 ARG A 47 31.740 20.160 10.180 1.00 24.63 H new ATOM 0 HD3 ARG A 47 30.009 20.054 10.429 1.00 24.63 H new ATOM 0 HE ARG A 47 30.597 17.715 8.960 1.00 25.15 H new ATOM 0 HH11 ARG A 47 31.704 19.313 11.856 1.00 25.84 H new ATOM 0 HH12 ARG A 47 32.156 17.810 12.666 1.00 25.84 H new ATOM 0 HH21 ARG A 47 31.189 15.789 9.985 1.00 22.33 H new ATOM 0 HH22 ARG A 47 31.867 15.830 11.616 1.00 22.33 H new ATOM 780 N ILE A 48 30.181 24.372 7.384 1.00 19.14 N ATOM 781 CA ILE A 48 29.911 25.838 7.366 1.00 21.78 C ATOM 782 C ILE A 48 29.425 26.211 5.975 1.00 25.27 C ATOM 783 O ILE A 48 28.348 26.739 5.794 1.00 23.94 O ATOM 784 CB ILE A 48 31.204 26.584 7.678 1.00 20.97 C ATOM 785 CG1 ILE A 48 31.781 26.013 8.974 1.00 21.08 C ATOM 786 CG2 ILE A 48 30.900 28.074 7.842 1.00 21.08 C ATOM 787 CD1 ILE A 48 32.992 26.835 9.438 1.00 19.82 C ATOM 0 H ILE A 48 31.080 24.102 7.783 1.00 19.14 H new ATOM 0 HA ILE A 48 29.158 26.102 8.108 1.00 21.78 H new ATOM 0 HB ILE A 48 31.925 26.464 6.870 1.00 20.97 H new ATOM 0 HG12 ILE A 48 31.016 26.014 9.750 1.00 21.08 H new ATOM 0 HG13 ILE A 48 32.077 24.975 8.820 1.00 21.08 H new ATOM 0 HG21 ILE A 48 31.822 28.611 8.065 1.00 21.08 H new ATOM 0 HG22 ILE A 48 30.469 28.461 6.919 1.00 21.08 H new ATOM 0 HG23 ILE A 48 30.192 28.213 8.659 1.00 21.08 H new ATOM 0 HD11 ILE A 48 33.387 26.412 10.361 1.00 19.82 H new ATOM 0 HD12 ILE A 48 33.764 26.812 8.669 1.00 19.82 H new ATOM 0 HD13 ILE A 48 32.686 27.866 9.614 1.00 19.82 H new ATOM 799 N GLU A 49 30.212 25.902 4.992 1.00 26.87 N ATOM 800 CA GLU A 49 29.822 26.196 3.588 1.00 31.21 C ATOM 801 C GLU A 49 28.379 25.775 3.360 1.00 31.88 C ATOM 802 O GLU A 49 27.518 26.583 3.072 1.00 31.73 O ATOM 803 CB GLU A 49 30.684 25.352 2.670 1.00 32.85 C ATOM 804 CG GLU A 49 32.087 25.952 2.552 1.00 36.76 C ATOM 805 CD GLU A 49 32.838 25.269 1.408 1.00 40.40 C ATOM 806 OE1 GLU A 49 32.861 24.049 1.386 1.00 43.41 O ATOM 807 OE2 GLU A 49 33.377 25.976 0.573 1.00 40.28 O ATOM 0 H GLU A 49 31.121 25.452 5.100 1.00 26.87 H new ATOM 0 HA GLU A 49 29.944 27.261 3.393 1.00 31.21 H new ATOM 0 HB2 GLU A 49 30.748 24.334 3.055 1.00 32.85 H new ATOM 0 HB3 GLU A 49 30.224 25.291 1.684 1.00 32.85 H new ATOM 0 HG2 GLU A 49 32.021 27.025 2.369 1.00 36.76 H new ATOM 0 HG3 GLU A 49 32.630 25.821 3.488 1.00 36.76 H new ATOM 814 N GLU A 50 28.109 24.502 3.506 1.00 32.05 N ATOM 815 CA GLU A 50 26.721 24.017 3.322 1.00 30.33 C ATOM 816 C GLU A 50 25.846 24.909 4.171 1.00 29.99 C ATOM 817 O GLU A 50 24.820 25.361 3.757 1.00 26.76 O ATOM 818 CB GLU A 50 26.629 22.550 3.791 1.00 33.38 C ATOM 819 CG GLU A 50 25.487 21.830 3.066 1.00 33.45 C ATOM 820 CD GLU A 50 25.495 20.348 3.446 1.00 36.89 C ATOM 821 OE1 GLU A 50 26.571 19.777 3.505 1.00 35.55 O ATOM 822 OE2 GLU A 50 24.423 19.810 3.673 1.00 36.13 O ATOM 0 H GLU A 50 28.793 23.784 3.744 1.00 32.05 H new ATOM 0 HA GLU A 50 26.407 24.052 2.279 1.00 30.33 H new ATOM 0 HB2 GLU A 50 27.572 22.039 3.596 1.00 33.38 H new ATOM 0 HB3 GLU A 50 26.464 22.515 4.868 1.00 33.38 H new ATOM 0 HG2 GLU A 50 24.531 22.280 3.334 1.00 33.45 H new ATOM 0 HG3 GLU A 50 25.600 21.940 1.988 1.00 33.45 H new ATOM 829 N GLY A 51 26.312 25.199 5.340 1.00 0.00 N ATOM 830 CA GLY A 51 25.574 26.095 6.263 1.00 0.00 C ATOM 831 C GLY A 51 25.333 27.457 5.595 1.00 0.00 C ATOM 832 O GLY A 51 24.220 27.905 5.421 1.00 0.00 O ATOM 0 H GLY A 51 27.195 24.846 5.708 1.00 0.00 H new ATOM 0 HA2 GLY A 51 24.621 25.642 6.538 1.00 0.00 H new ATOM 0 HA3 GLY A 51 26.141 26.228 7.184 1.00 0.00 H new ATOM 836 N GLN A 52 26.390 28.133 5.231 1.00 29.60 N ATOM 837 CA GLN A 52 26.237 29.471 4.581 1.00 32.81 C ATOM 838 C GLN A 52 25.235 29.334 3.449 1.00 33.63 C ATOM 839 O GLN A 52 24.285 30.082 3.333 1.00 32.37 O ATOM 840 CB GLN A 52 27.579 29.921 3.995 1.00 32.81 C ATOM 841 CG GLN A 52 28.691 29.836 5.060 1.00 34.44 C ATOM 842 CD GLN A 52 28.815 31.162 5.814 1.00 35.84 C ATOM 843 OE1 GLN A 52 29.994 31.555 6.209 1.00 36.29 O flip ATOM 844 NE2 GLN A 52 27.835 31.842 6.043 1.00 38.34 N flip ATOM 0 H GLN A 52 27.352 27.819 5.355 1.00 29.60 H new ATOM 0 HA GLN A 52 25.900 30.203 5.315 1.00 32.81 H new ATOM 0 HB2 GLN A 52 27.837 29.295 3.141 1.00 32.81 H new ATOM 0 HB3 GLN A 52 27.497 30.944 3.628 1.00 32.81 H new ATOM 0 HG2 GLN A 52 28.470 29.032 5.761 1.00 34.44 H new ATOM 0 HG3 GLN A 52 29.641 29.592 4.584 1.00 34.44 H new ATOM 0 HE21 GLN A 52 26.915 31.531 5.732 1.00 38.34 H new ATOM 0 HE22 GLN A 52 27.932 32.724 6.546 1.00 38.34 H new ATOM 853 N TYR A 53 25.447 28.356 2.627 1.00 34.79 N ATOM 854 CA TYR A 53 24.524 28.110 1.496 1.00 37.88 C ATOM 855 C TYR A 53 23.170 27.706 2.069 1.00 39.97 C ATOM 856 O TYR A 53 22.136 28.198 1.678 1.00 39.08 O ATOM 857 CB TYR A 53 25.090 26.963 0.642 1.00 39.97 C ATOM 858 CG TYR A 53 23.989 26.333 -0.179 1.00 42.20 C ATOM 859 CD1 TYR A 53 23.150 25.377 0.397 1.00 42.61 C ATOM 860 CD2 TYR A 53 23.808 26.714 -1.503 1.00 42.58 C ATOM 861 CE1 TYR A 53 22.129 24.800 -0.353 1.00 45.45 C ATOM 862 CE2 TYR A 53 22.783 26.139 -2.265 1.00 44.68 C ATOM 863 CZ TYR A 53 21.941 25.179 -1.688 1.00 45.19 C ATOM 864 OH TYR A 53 20.930 24.608 -2.434 1.00 49.10 O ATOM 0 H TYR A 53 26.231 27.707 2.691 1.00 34.79 H new ATOM 0 HA TYR A 53 24.415 29.002 0.879 1.00 37.88 H new ATOM 0 HB2 TYR A 53 25.873 27.341 -0.015 1.00 39.97 H new ATOM 0 HB3 TYR A 53 25.549 26.213 1.286 1.00 39.97 H new ATOM 0 HD1 TYR A 53 23.293 25.085 1.427 1.00 42.61 H new ATOM 0 HD2 TYR A 53 24.458 27.454 -1.945 1.00 42.58 H new ATOM 0 HE1 TYR A 53 21.482 24.060 0.095 1.00 45.45 H new ATOM 0 HE2 TYR A 53 22.642 26.435 -3.294 1.00 44.68 H new ATOM 0 HH TYR A 53 20.338 24.096 -1.845 1.00 49.10 H new ATOM 874 N VAL A 54 23.191 26.799 2.992 1.00 39.04 N ATOM 875 CA VAL A 54 21.939 26.313 3.620 1.00 40.51 C ATOM 876 C VAL A 54 21.112 27.524 4.062 1.00 40.89 C ATOM 877 O VAL A 54 20.021 27.761 3.585 1.00 40.52 O ATOM 878 CB VAL A 54 22.369 25.466 4.821 1.00 40.89 C ATOM 879 CG1 VAL A 54 21.301 25.411 5.885 1.00 41.12 C ATOM 880 CG2 VAL A 54 22.771 24.027 4.394 1.00 40.75 C ATOM 0 H VAL A 54 24.042 26.363 3.347 1.00 39.04 H new ATOM 0 HA VAL A 54 21.326 25.721 2.940 1.00 40.51 H new ATOM 0 HB VAL A 54 23.245 25.957 5.245 1.00 40.89 H new ATOM 0 HG11 VAL A 54 21.648 24.800 6.718 1.00 41.12 H new ATOM 0 HG12 VAL A 54 21.088 26.420 6.239 1.00 41.12 H new ATOM 0 HG13 VAL A 54 20.394 24.974 5.468 1.00 41.12 H new ATOM 0 HG21 VAL A 54 23.070 23.457 5.273 1.00 40.75 H new ATOM 0 HG22 VAL A 54 21.922 23.539 3.916 1.00 40.75 H new ATOM 0 HG23 VAL A 54 23.604 24.075 3.692 1.00 40.75 H new ATOM 890 N VAL A 55 21.640 28.292 4.969 1.00 40.66 N ATOM 891 CA VAL A 55 20.915 29.495 5.452 1.00 41.79 C ATOM 892 C VAL A 55 20.591 30.389 4.254 1.00 43.19 C ATOM 893 O VAL A 55 19.447 30.712 4.000 1.00 42.93 O ATOM 894 CB VAL A 55 21.814 30.242 6.444 1.00 40.93 C ATOM 895 CG1 VAL A 55 21.064 31.429 7.053 1.00 40.61 C ATOM 896 CG2 VAL A 55 22.229 29.278 7.559 1.00 41.17 C ATOM 0 H VAL A 55 22.551 28.136 5.400 1.00 40.66 H new ATOM 0 HA VAL A 55 19.986 29.213 5.949 1.00 41.79 H new ATOM 0 HB VAL A 55 22.694 30.615 5.920 1.00 40.93 H new ATOM 0 HG11 VAL A 55 21.715 31.949 7.755 1.00 40.61 H new ATOM 0 HG12 VAL A 55 20.763 32.115 6.261 1.00 40.61 H new ATOM 0 HG13 VAL A 55 20.179 31.070 7.577 1.00 40.61 H new ATOM 0 HG21 VAL A 55 22.869 29.799 8.271 1.00 41.17 H new ATOM 0 HG22 VAL A 55 21.340 28.910 8.072 1.00 41.17 H new ATOM 0 HG23 VAL A 55 22.774 28.437 7.129 1.00 41.17 H new ATOM 906 N ASN A 56 21.586 30.780 3.507 1.00 43.65 N ATOM 907 CA ASN A 56 21.329 31.639 2.318 1.00 46.57 C ATOM 908 C ASN A 56 20.239 30.985 1.466 1.00 47.19 C ATOM 909 O ASN A 56 19.324 31.635 1.003 1.00 46.87 O ATOM 910 CB ASN A 56 22.617 31.776 1.502 1.00 46.25 C ATOM 911 CG ASN A 56 23.694 32.444 2.358 1.00 46.74 C ATOM 912 OD1 ASN A 56 23.533 32.588 3.554 1.00 46.94 O ATOM 913 ND2 ASN A 56 24.794 32.861 1.793 1.00 47.06 N ATOM 0 H ASN A 56 22.565 30.542 3.668 1.00 43.65 H new ATOM 0 HA ASN A 56 21.002 32.630 2.634 1.00 46.57 H new ATOM 0 HB2 ASN A 56 22.957 30.795 1.171 1.00 46.25 H new ATOM 0 HB3 ASN A 56 22.431 32.367 0.606 1.00 46.25 H new ATOM 0 HD21 ASN A 56 25.518 33.308 2.355 1.00 47.06 H new ATOM 0 HD22 ASN A 56 24.929 32.740 0.789 1.00 47.06 H new ATOM 920 N GLU A 57 20.326 29.696 1.272 1.00 49.43 N ATOM 921 CA GLU A 57 19.295 28.984 0.467 1.00 51.03 C ATOM 922 C GLU A 57 17.930 29.184 1.125 1.00 51.99 C ATOM 923 O GLU A 57 16.992 29.642 0.504 1.00 52.02 O ATOM 924 CB GLU A 57 19.630 27.491 0.418 1.00 52.77 C ATOM 925 CG GLU A 57 18.696 26.779 -0.559 1.00 54.20 C ATOM 926 CD GLU A 57 18.882 25.265 -0.433 1.00 56.33 C ATOM 927 OE1 GLU A 57 19.184 24.815 0.660 1.00 57.76 O ATOM 928 OE2 GLU A 57 18.718 24.583 -1.431 1.00 57.66 O ATOM 0 H GLU A 57 21.071 29.104 1.639 1.00 49.43 H new ATOM 0 HA GLU A 57 19.275 29.380 -0.548 1.00 51.03 H new ATOM 0 HB2 GLU A 57 20.666 27.352 0.110 1.00 52.77 H new ATOM 0 HB3 GLU A 57 19.531 27.055 1.412 1.00 52.77 H new ATOM 0 HG2 GLU A 57 17.661 27.047 -0.350 1.00 54.20 H new ATOM 0 HG3 GLU A 57 18.908 27.098 -1.579 1.00 54.20 H new ATOM 935 N TYR A 58 17.814 28.853 2.384 1.00 53.12 N ATOM 936 CA TYR A 58 16.510 29.037 3.080 1.00 54.13 C ATOM 937 C TYR A 58 16.034 30.465 2.853 1.00 54.38 C ATOM 938 O TYR A 58 14.858 30.762 2.882 1.00 55.12 O ATOM 939 CB TYR A 58 16.685 28.790 4.580 1.00 54.54 C ATOM 940 CG TYR A 58 15.333 28.667 5.229 1.00 55.20 C ATOM 941 CD1 TYR A 58 14.731 27.412 5.326 1.00 55.36 C ATOM 942 CD2 TYR A 58 14.684 29.800 5.735 1.00 55.64 C ATOM 943 CE1 TYR A 58 13.480 27.282 5.930 1.00 55.93 C ATOM 944 CE2 TYR A 58 13.428 29.671 6.342 1.00 56.15 C ATOM 945 CZ TYR A 58 12.826 28.410 6.440 1.00 56.20 C ATOM 946 OH TYR A 58 11.589 28.280 7.037 1.00 58.01 O ATOM 0 H TYR A 58 18.563 28.465 2.957 1.00 53.12 H new ATOM 0 HA TYR A 58 15.778 28.331 2.687 1.00 54.13 H new ATOM 0 HB2 TYR A 58 17.263 27.881 4.745 1.00 54.54 H new ATOM 0 HB3 TYR A 58 17.244 29.610 5.032 1.00 54.54 H new ATOM 0 HD1 TYR A 58 15.234 26.541 4.933 1.00 55.36 H new ATOM 0 HD2 TYR A 58 15.151 30.771 5.657 1.00 55.64 H new ATOM 0 HE1 TYR A 58 13.015 26.310 6.004 1.00 55.93 H new ATOM 0 HE2 TYR A 58 12.925 30.542 6.734 1.00 56.15 H new ATOM 0 HH TYR A 58 10.889 28.528 6.397 1.00 58.01 H new ATOM 956 N SER A 59 16.954 31.345 2.621 1.00 54.68 N ATOM 957 CA SER A 59 16.600 32.767 2.380 1.00 55.46 C ATOM 958 C SER A 59 16.130 32.927 0.927 1.00 55.54 C ATOM 959 O SER A 59 15.429 33.860 0.593 1.00 55.84 O ATOM 960 CB SER A 59 17.842 33.627 2.663 1.00 55.66 C ATOM 961 OG SER A 59 17.619 34.398 3.836 1.00 56.43 O ATOM 0 H SER A 59 17.953 31.140 2.587 1.00 54.68 H new ATOM 0 HA SER A 59 15.791 33.088 3.036 1.00 55.46 H new ATOM 0 HB2 SER A 59 18.718 32.991 2.792 1.00 55.66 H new ATOM 0 HB3 SER A 59 18.046 34.282 1.816 1.00 55.66 H new ATOM 0 HG SER A 59 18.409 34.947 4.022 1.00 56.43 H new ATOM 967 N ARG A 60 16.503 32.021 0.062 1.00 56.10 N ATOM 968 CA ARG A 60 16.065 32.132 -1.359 1.00 56.11 C ATOM 969 C ARG A 60 14.635 31.604 -1.496 1.00 56.20 C ATOM 970 O ARG A 60 13.771 32.261 -2.042 1.00 56.47 O ATOM 971 CB ARG A 60 16.998 31.311 -2.255 1.00 56.10 C ATOM 972 CG ARG A 60 18.416 31.895 -2.201 1.00 55.55 C ATOM 973 CD ARG A 60 19.219 31.413 -3.413 1.00 56.56 C ATOM 974 NE ARG A 60 18.740 32.116 -4.637 1.00 57.08 N ATOM 975 CZ ARG A 60 19.456 32.089 -5.728 1.00 58.26 C ATOM 976 NH1 ARG A 60 20.590 31.442 -5.749 1.00 59.07 N ATOM 977 NH2 ARG A 60 19.038 32.707 -6.799 1.00 59.27 N ATOM 0 H ARG A 60 17.088 31.214 0.277 1.00 56.10 H new ATOM 0 HA ARG A 60 16.100 33.178 -1.664 1.00 56.11 H new ATOM 0 HB2 ARG A 60 17.010 30.271 -1.928 1.00 56.10 H new ATOM 0 HB3 ARG A 60 16.631 31.318 -3.281 1.00 56.10 H new ATOM 0 HG2 ARG A 60 18.371 32.984 -2.192 1.00 55.55 H new ATOM 0 HG3 ARG A 60 18.911 31.589 -1.279 1.00 55.55 H new ATOM 0 HD2 ARG A 60 20.281 31.608 -3.260 1.00 56.56 H new ATOM 0 HD3 ARG A 60 19.107 30.335 -3.532 1.00 56.56 H new ATOM 0 HE ARG A 60 17.852 32.618 -4.622 1.00 57.08 H new ATOM 0 HH11 ARG A 60 20.916 30.958 -4.913 1.00 59.07 H new ATOM 0 HH12 ARG A 60 21.149 31.421 -6.602 1.00 59.07 H new ATOM 0 HH21 ARG A 60 18.152 33.211 -6.784 1.00 59.27 H new ATOM 0 HH22 ARG A 60 19.598 32.686 -7.651 1.00 59.27 H new ATOM 991 N GLN A 61 14.376 30.423 -1.003 1.00 56.73 N ATOM 992 CA GLN A 61 12.999 29.860 -1.108 1.00 56.60 C ATOM 993 C GLN A 61 11.992 30.895 -0.602 1.00 56.69 C ATOM 994 O GLN A 61 11.007 31.188 -1.250 1.00 57.21 O ATOM 995 CB GLN A 61 12.906 28.590 -0.252 1.00 56.43 C ATOM 996 CG GLN A 61 11.660 27.784 -0.639 1.00 56.29 C ATOM 997 CD GLN A 61 10.397 28.539 -0.224 1.00 56.52 C ATOM 998 OE1 GLN A 61 10.419 29.286 0.842 1.00 57.90 O flip ATOM 999 NE2 GLN A 61 9.378 28.446 -0.879 1.00 57.08 N flip ATOM 0 H GLN A 61 15.056 29.825 -0.533 1.00 56.73 H new ATOM 0 HA GLN A 61 12.777 29.615 -2.147 1.00 56.60 H new ATOM 0 HB2 GLN A 61 13.800 27.982 -0.391 1.00 56.43 H new ATOM 0 HB3 GLN A 61 12.863 28.856 0.804 1.00 56.43 H new ATOM 0 HG2 GLN A 61 11.651 27.608 -1.715 1.00 56.29 H new ATOM 0 HG3 GLN A 61 11.685 26.807 -0.156 1.00 56.29 H new ATOM 0 HE21 GLN A 61 9.360 27.861 -1.714 1.00 57.08 H new ATOM 0 HE22 GLN A 61 8.540 28.953 -0.594 1.00 57.08 H new ATOM 1008 N HIS A 62 12.231 31.447 0.556 1.00 56.46 N ATOM 1009 CA HIS A 62 11.291 32.457 1.113 1.00 56.65 C ATOM 1010 C HIS A 62 11.555 33.824 0.475 1.00 56.99 C ATOM 1011 O HIS A 62 10.731 34.337 -0.250 1.00 57.01 O ATOM 1012 CB HIS A 62 11.504 32.536 2.624 1.00 56.67 C ATOM 1013 CG HIS A 62 11.060 31.239 3.235 1.00 56.67 C ATOM 1014 ND1 HIS A 62 9.723 30.877 3.310 1.00 56.31 N ATOM 1015 CD2 HIS A 62 11.763 30.193 3.778 1.00 56.12 C ATOM 1016 CE1 HIS A 62 9.665 29.658 3.876 1.00 55.98 C ATOM 1017 NE2 HIS A 62 10.879 29.202 4.179 1.00 56.26 N ATOM 0 H HIS A 62 13.040 31.240 1.141 1.00 56.46 H new ATOM 0 HA HIS A 62 10.263 32.168 0.897 1.00 56.65 H new ATOM 0 HB2 HIS A 62 12.554 32.721 2.849 1.00 56.67 H new ATOM 0 HB3 HIS A 62 10.937 33.367 3.044 1.00 56.67 H new ATOM 0 HD1 HIS A 62 8.929 31.434 2.994 1.00 56.31 H new ATOM 0 HD2 HIS A 62 12.837 30.148 3.878 1.00 56.12 H new ATOM 0 HE1 HIS A 62 8.749 29.117 4.061 1.00 55.98 H new ATOM 1025 N ASN A 63 12.703 34.400 0.740 1.00 56.77 N ATOM 1026 CA ASN A 63 13.061 35.737 0.162 1.00 56.71 C ATOM 1027 C ASN A 63 14.160 36.357 1.035 1.00 56.43 C ATOM 1028 O ASN A 63 15.336 36.201 0.773 1.00 55.91 O ATOM 1029 CB ASN A 63 11.821 36.663 0.127 1.00 57.63 C ATOM 1030 CG ASN A 63 12.237 38.141 0.153 1.00 58.30 C ATOM 1031 OD1 ASN A 63 12.071 38.833 1.246 1.00 59.15 O flip ATOM 1032 ND2 ASN A 63 12.716 38.666 -0.832 1.00 57.90 N flip ATOM 0 H ASN A 63 13.419 33.994 1.342 1.00 56.77 H new ATOM 0 HA ASN A 63 13.416 35.615 -0.861 1.00 56.71 H new ATOM 0 HB2 ASN A 63 11.237 36.462 -0.771 1.00 57.63 H new ATOM 0 HB3 ASN A 63 11.178 36.448 0.980 1.00 57.63 H new ATOM 0 HD21 ASN A 63 12.846 38.124 -1.687 1.00 57.90 H new ATOM 0 HD22 ASN A 63 12.989 39.649 -0.805 1.00 57.90 H new ATOM 1039 N LEU A 64 13.770 37.050 2.076 1.00 55.89 N ATOM 1040 CA LEU A 64 14.763 37.688 2.996 1.00 55.54 C ATOM 1041 C LEU A 64 15.947 38.252 2.200 1.00 56.58 C ATOM 1042 O LEU A 64 15.785 39.109 1.354 1.00 56.83 O ATOM 1043 CB LEU A 64 15.256 36.642 3.996 1.00 54.99 C ATOM 1044 CG LEU A 64 14.059 35.873 4.567 1.00 53.83 C ATOM 1045 CD1 LEU A 64 14.553 34.853 5.595 1.00 52.85 C ATOM 1046 CD2 LEU A 64 13.088 36.851 5.241 1.00 52.35 C ATOM 0 H LEU A 64 12.794 37.203 2.331 1.00 55.89 H new ATOM 0 HA LEU A 64 14.286 38.511 3.527 1.00 55.54 H new ATOM 0 HB2 LEU A 64 15.944 35.953 3.507 1.00 54.99 H new ATOM 0 HB3 LEU A 64 15.808 37.126 4.802 1.00 54.99 H new ATOM 0 HG LEU A 64 13.543 35.356 3.758 1.00 53.83 H new ATOM 0 HD11 LEU A 64 13.703 34.305 6.002 1.00 52.85 H new ATOM 0 HD12 LEU A 64 15.238 34.155 5.114 1.00 52.85 H new ATOM 0 HD13 LEU A 64 15.071 35.371 6.402 1.00 52.85 H new ATOM 0 HD21 LEU A 64 12.239 36.300 5.645 1.00 52.35 H new ATOM 0 HD22 LEU A 64 13.600 37.373 6.049 1.00 52.35 H new ATOM 0 HD23 LEU A 64 12.734 37.576 4.508 1.00 52.35 H new ATOM 1058 N ASN A 65 17.136 37.778 2.464 1.00 56.78 N ATOM 1059 CA ASN A 65 18.326 38.287 1.722 1.00 57.57 C ATOM 1060 C ASN A 65 19.434 37.232 1.753 1.00 58.02 C ATOM 1061 O ASN A 65 19.406 36.347 0.914 1.00 58.31 O ATOM 1062 CB ASN A 65 18.828 39.573 2.382 1.00 57.98 C ATOM 1063 CG ASN A 65 20.032 40.109 1.607 1.00 58.92 C ATOM 1064 OD1 ASN A 65 20.042 40.030 0.304 1.00 59.15 O flip ATOM 1065 ND2 ASN A 65 20.975 40.604 2.192 1.00 58.20 N flip ATOM 1066 OXT ASN A 65 20.292 37.328 2.616 1.00 57.92 O ATOM 0 H ASN A 65 17.334 37.060 3.161 1.00 56.78 H new ATOM 0 HA ASN A 65 18.049 38.494 0.688 1.00 57.57 H new ATOM 0 HB2 ASN A 65 18.033 40.319 2.401 1.00 57.98 H new ATOM 0 HB3 ASN A 65 19.107 39.378 3.418 1.00 57.98 H new ATOM 0 HD21 ASN A 65 20.968 40.666 3.210 1.00 58.20 H new ATOM 0 HD22 ASN A 65 21.774 40.957 1.665 1.00 58.20 H new TER 1073 ASN A 65 ATOM 1074 N GLY B 1 11.125 21.614 0.746 1.00 59.05 N ATOM 1075 CA GLY B 1 10.298 21.209 1.968 1.00 59.53 C ATOM 1076 C GLY B 1 10.500 19.868 2.586 1.00 60.25 C ATOM 1077 O GLY B 1 10.980 18.948 1.955 1.00 60.45 O ATOM 0 H1 GLY B 1 10.857 22.574 0.448 1.00 59.05 H new ATOM 0 H2 GLY B 1 12.136 21.597 0.990 1.00 59.05 H new ATOM 0 H3 GLY B 1 10.945 20.947 -0.031 1.00 59.05 H new ATOM 0 HA2 GLY B 1 10.476 21.955 2.743 1.00 59.53 H new ATOM 0 HA3 GLY B 1 9.247 21.284 1.689 1.00 59.53 H new ATOM 1083 N SER B 2 10.139 19.718 3.832 1.00 60.60 N ATOM 1084 CA SER B 2 10.314 18.401 4.508 1.00 60.69 C ATOM 1085 C SER B 2 9.395 18.360 5.744 1.00 60.53 C ATOM 1086 O SER B 2 8.720 19.332 6.020 1.00 60.52 O ATOM 1087 CB SER B 2 11.789 18.249 4.916 1.00 60.68 C ATOM 1088 OG SER B 2 11.920 18.419 6.322 1.00 61.65 O ATOM 0 H SER B 2 9.730 20.451 4.411 1.00 60.60 H new ATOM 0 HA SER B 2 10.048 17.580 3.843 1.00 60.69 H new ATOM 0 HB2 SER B 2 12.157 17.266 4.624 1.00 60.68 H new ATOM 0 HB3 SER B 2 12.398 18.986 4.393 1.00 60.68 H new ATOM 0 HG SER B 2 12.825 18.164 6.599 1.00 61.65 H new ATOM 1094 N PRO B 3 9.375 17.249 6.457 1.00 60.34 N ATOM 1095 CA PRO B 3 8.519 17.125 7.650 1.00 60.36 C ATOM 1096 C PRO B 3 9.099 18.005 8.749 1.00 60.68 C ATOM 1097 O PRO B 3 9.441 17.554 9.822 1.00 61.60 O ATOM 1098 CB PRO B 3 8.570 15.628 8.020 1.00 60.19 C ATOM 1099 CG PRO B 3 9.552 14.937 7.028 1.00 60.02 C ATOM 1100 CD PRO B 3 10.180 16.048 6.156 1.00 59.96 C ATOM 0 HA PRO B 3 7.489 17.444 7.493 1.00 60.36 H new ATOM 0 HB2 PRO B 3 8.908 15.498 9.048 1.00 60.19 H new ATOM 0 HB3 PRO B 3 7.578 15.182 7.952 1.00 60.19 H new ATOM 0 HG2 PRO B 3 10.324 14.391 7.569 1.00 60.02 H new ATOM 0 HG3 PRO B 3 9.025 14.213 6.407 1.00 60.02 H new ATOM 0 HD2 PRO B 3 11.230 16.201 6.403 1.00 59.96 H new ATOM 0 HD3 PRO B 3 10.136 15.795 5.097 1.00 59.96 H new ATOM 1108 N LEU B 4 9.237 19.257 8.456 1.00 60.46 N ATOM 1109 CA LEU B 4 9.821 20.215 9.418 1.00 60.07 C ATOM 1110 C LEU B 4 11.275 19.843 9.706 1.00 60.01 C ATOM 1111 O LEU B 4 12.077 20.716 9.945 1.00 60.26 O ATOM 1112 CB LEU B 4 9.052 20.258 10.751 1.00 60.07 C ATOM 1113 CG LEU B 4 7.568 20.625 10.560 1.00 59.36 C ATOM 1114 CD1 LEU B 4 7.425 21.842 9.637 1.00 58.78 C ATOM 1115 CD2 LEU B 4 6.784 19.439 9.973 1.00 59.10 C ATOM 0 H LEU B 4 8.961 19.668 7.564 1.00 60.46 H new ATOM 0 HA LEU B 4 9.756 21.201 8.958 1.00 60.07 H new ATOM 0 HB2 LEU B 4 9.123 19.287 11.240 1.00 60.07 H new ATOM 0 HB3 LEU B 4 9.521 20.984 11.415 1.00 60.07 H new ATOM 0 HG LEU B 4 7.157 20.871 11.539 1.00 59.36 H new ATOM 0 HD11 LEU B 4 6.369 22.084 9.515 1.00 58.78 H new ATOM 0 HD12 LEU B 4 7.945 22.694 10.075 1.00 58.78 H new ATOM 0 HD13 LEU B 4 7.859 21.613 8.664 1.00 58.78 H new ATOM 0 HD21 LEU B 4 5.739 19.721 9.847 1.00 59.10 H new ATOM 0 HD22 LEU B 4 7.206 19.167 9.006 1.00 59.10 H new ATOM 0 HD23 LEU B 4 6.851 18.588 10.650 1.00 59.10 H new ATOM 1127 N GLY B 5 11.606 18.558 9.711 1.00 59.40 N ATOM 1128 CA GLY B 5 13.012 18.091 10.009 1.00 58.93 C ATOM 1129 C GLY B 5 14.023 19.205 9.769 1.00 58.42 C ATOM 1130 O GLY B 5 14.883 19.467 10.586 1.00 59.07 O ATOM 0 H GLY B 5 10.948 17.803 9.517 1.00 59.40 H new ATOM 0 HA2 GLY B 5 13.075 17.755 11.044 1.00 58.93 H new ATOM 0 HA3 GLY B 5 13.255 17.234 9.381 1.00 58.93 H new ATOM 1134 N GLN B 6 13.911 19.886 8.668 1.00 58.08 N ATOM 1135 CA GLN B 6 14.843 21.016 8.415 1.00 57.10 C ATOM 1136 C GLN B 6 14.338 22.252 9.176 1.00 56.82 C ATOM 1137 O GLN B 6 15.052 22.861 9.940 1.00 57.96 O ATOM 1138 CB GLN B 6 14.909 21.320 6.921 1.00 56.98 C ATOM 1139 CG GLN B 6 15.650 22.641 6.708 1.00 57.27 C ATOM 1140 CD GLN B 6 16.087 22.760 5.246 1.00 57.86 C ATOM 1141 OE1 GLN B 6 15.286 23.058 4.382 1.00 59.53 O ATOM 1142 NE2 GLN B 6 17.334 22.538 4.931 1.00 58.69 N ATOM 0 H GLN B 6 13.221 19.712 7.937 1.00 58.08 H new ATOM 0 HA GLN B 6 15.843 20.749 8.759 1.00 57.10 H new ATOM 0 HB2 GLN B 6 15.421 20.514 6.396 1.00 56.98 H new ATOM 0 HB3 GLN B 6 13.903 21.383 6.506 1.00 56.98 H new ATOM 0 HG2 GLN B 6 15.004 23.478 6.973 1.00 57.27 H new ATOM 0 HG3 GLN B 6 16.520 22.690 7.362 1.00 57.27 H new ATOM 0 HE21 GLN B 6 18.006 22.288 5.656 1.00 58.69 H new ATOM 0 HE22 GLN B 6 17.636 22.615 3.960 1.00 58.69 H new ATOM 1151 N ASP B 7 13.109 22.633 8.957 1.00 55.77 N ATOM 1152 CA ASP B 7 12.560 23.837 9.654 1.00 53.95 C ATOM 1153 C ASP B 7 12.925 23.790 11.140 1.00 52.49 C ATOM 1154 O ASP B 7 13.554 24.690 11.659 1.00 51.89 O ATOM 1155 CB ASP B 7 11.036 23.863 9.502 1.00 54.63 C ATOM 1156 CG ASP B 7 10.509 25.262 9.826 1.00 55.27 C ATOM 1157 OD1 ASP B 7 11.309 26.104 10.201 1.00 56.33 O ATOM 1158 OD2 ASP B 7 9.314 25.469 9.695 1.00 55.55 O ATOM 0 H ASP B 7 12.459 22.164 8.326 1.00 55.77 H new ATOM 0 HA ASP B 7 12.987 24.736 9.209 1.00 53.95 H new ATOM 0 HB2 ASP B 7 10.758 23.586 8.485 1.00 54.63 H new ATOM 0 HB3 ASP B 7 10.582 23.130 10.168 1.00 54.63 H new ATOM 1163 N VAL B 8 12.560 22.738 11.824 1.00 50.38 N ATOM 1164 CA VAL B 8 12.918 22.630 13.277 1.00 48.45 C ATOM 1165 C VAL B 8 14.407 22.934 13.405 1.00 46.36 C ATOM 1166 O VAL B 8 14.850 23.662 14.269 1.00 44.84 O ATOM 1167 CB VAL B 8 12.662 21.190 13.796 1.00 48.63 C ATOM 1168 CG1 VAL B 8 11.353 21.136 14.577 1.00 48.83 C ATOM 1169 CG2 VAL B 8 12.592 20.223 12.618 1.00 47.55 C ATOM 0 H VAL B 8 12.033 21.951 11.446 1.00 50.38 H new ATOM 0 HA VAL B 8 12.312 23.325 13.859 1.00 48.45 H new ATOM 0 HB VAL B 8 13.481 20.903 14.455 1.00 48.63 H new ATOM 0 HG11 VAL B 8 11.185 20.121 14.936 1.00 48.83 H new ATOM 0 HG12 VAL B 8 11.408 21.817 15.427 1.00 48.83 H new ATOM 0 HG13 VAL B 8 10.529 21.432 13.928 1.00 48.83 H new ATOM 0 HG21 VAL B 8 12.412 19.213 12.986 1.00 47.55 H new ATOM 0 HG22 VAL B 8 11.779 20.517 11.954 1.00 47.55 H new ATOM 0 HG23 VAL B 8 13.534 20.247 12.071 1.00 47.55 H new ATOM 1179 N PHE B 9 15.174 22.356 12.540 1.00 44.57 N ATOM 1180 CA PHE B 9 16.636 22.573 12.579 1.00 42.68 C ATOM 1181 C PHE B 9 16.919 24.072 12.614 1.00 41.92 C ATOM 1182 O PHE B 9 17.545 24.576 13.526 1.00 40.56 O ATOM 1183 CB PHE B 9 17.277 21.942 11.330 1.00 41.99 C ATOM 1184 CG PHE B 9 18.711 21.616 11.625 1.00 41.32 C ATOM 1185 CD1 PHE B 9 19.685 22.603 11.474 1.00 41.38 C ATOM 1186 CD2 PHE B 9 19.063 20.337 12.061 1.00 41.88 C ATOM 1187 CE1 PHE B 9 21.014 22.311 11.757 1.00 39.40 C ATOM 1188 CE2 PHE B 9 20.397 20.048 12.346 1.00 39.39 C ATOM 1189 CZ PHE B 9 21.369 21.040 12.191 1.00 40.84 C ATOM 0 H PHE B 9 14.849 21.735 11.799 1.00 44.57 H new ATOM 0 HA PHE B 9 17.059 22.108 13.470 1.00 42.68 H new ATOM 0 HB2 PHE B 9 16.737 21.039 11.046 1.00 41.99 H new ATOM 0 HB3 PHE B 9 17.214 22.630 10.487 1.00 41.99 H new ATOM 0 HD1 PHE B 9 19.407 23.591 11.138 1.00 41.38 H new ATOM 0 HD2 PHE B 9 18.306 19.576 12.177 1.00 41.88 H new ATOM 0 HE1 PHE B 9 21.771 23.072 11.639 1.00 39.40 H new ATOM 0 HE2 PHE B 9 20.678 19.062 12.685 1.00 39.39 H new ATOM 0 HZ PHE B 9 22.403 20.817 12.410 1.00 40.84 H new ATOM 1199 N LEU B 10 16.450 24.791 11.637 1.00 41.09 N ATOM 1200 CA LEU B 10 16.684 26.258 11.632 1.00 41.50 C ATOM 1201 C LEU B 10 16.028 26.852 12.872 1.00 41.09 C ATOM 1202 O LEU B 10 16.544 27.766 13.482 1.00 38.55 O ATOM 1203 CB LEU B 10 16.080 26.875 10.374 1.00 42.71 C ATOM 1204 CG LEU B 10 16.544 26.091 9.144 1.00 43.61 C ATOM 1205 CD1 LEU B 10 16.083 26.817 7.889 1.00 44.50 C ATOM 1206 CD2 LEU B 10 18.073 25.988 9.126 1.00 43.61 C ATOM 0 H LEU B 10 15.918 24.429 10.846 1.00 41.09 H new ATOM 0 HA LEU B 10 17.754 26.468 11.640 1.00 41.50 H new ATOM 0 HB2 LEU B 10 14.992 26.862 10.437 1.00 42.71 H new ATOM 0 HB3 LEU B 10 16.382 27.919 10.288 1.00 42.71 H new ATOM 0 HG LEU B 10 16.118 25.088 9.180 1.00 43.61 H new ATOM 0 HD11 LEU B 10 16.410 26.264 7.008 1.00 44.50 H new ATOM 0 HD12 LEU B 10 14.995 26.889 7.889 1.00 44.50 H new ATOM 0 HD13 LEU B 10 16.513 27.818 7.869 1.00 44.50 H new ATOM 0 HD21 LEU B 10 18.390 25.428 8.246 1.00 43.61 H new ATOM 0 HD22 LEU B 10 18.505 26.988 9.094 1.00 43.61 H new ATOM 0 HD23 LEU B 10 18.414 25.474 10.025 1.00 43.61 H new ATOM 1218 N ASP B 11 14.901 26.328 13.267 1.00 41.28 N ATOM 1219 CA ASP B 11 14.244 26.863 14.486 1.00 41.44 C ATOM 1220 C ASP B 11 15.234 26.747 15.642 1.00 39.86 C ATOM 1221 O ASP B 11 15.571 27.727 16.273 1.00 37.26 O ATOM 1222 CB ASP B 11 12.978 26.066 14.804 1.00 44.23 C ATOM 1223 CG ASP B 11 12.098 25.980 13.555 1.00 46.87 C ATOM 1224 OD1 ASP B 11 12.459 26.584 12.558 1.00 49.31 O ATOM 1225 OD2 ASP B 11 11.077 25.316 13.618 1.00 48.41 O ATOM 0 H ASP B 11 14.413 25.562 12.803 1.00 41.28 H new ATOM 0 HA ASP B 11 13.958 27.903 14.329 1.00 41.44 H new ATOM 0 HB2 ASP B 11 13.242 25.065 15.144 1.00 44.23 H new ATOM 0 HB3 ASP B 11 12.429 26.544 15.615 1.00 44.23 H new ATOM 1230 N TYR B 12 15.730 25.563 15.918 1.00 39.23 N ATOM 1231 CA TYR B 12 16.717 25.434 17.030 1.00 38.08 C ATOM 1232 C TYR B 12 17.814 26.461 16.815 1.00 34.01 C ATOM 1233 O TYR B 12 18.196 27.178 17.714 1.00 32.49 O ATOM 1234 CB TYR B 12 17.382 24.052 17.045 1.00 42.28 C ATOM 1235 CG TYR B 12 16.378 22.915 17.072 1.00 47.31 C ATOM 1236 CD1 TYR B 12 15.193 22.990 17.825 1.00 49.49 C ATOM 1237 CD2 TYR B 12 16.663 21.756 16.344 1.00 48.65 C ATOM 1238 CE1 TYR B 12 14.308 21.904 17.839 1.00 50.83 C ATOM 1239 CE2 TYR B 12 15.785 20.682 16.358 1.00 51.34 C ATOM 1240 CZ TYR B 12 14.605 20.748 17.105 1.00 50.67 C ATOM 1241 OH TYR B 12 13.733 19.678 17.118 1.00 52.32 O ATOM 0 H TYR B 12 15.498 24.698 15.430 1.00 39.23 H new ATOM 0 HA TYR B 12 16.186 25.582 17.970 1.00 38.08 H new ATOM 0 HB2 TYR B 12 18.016 23.950 16.164 1.00 42.28 H new ATOM 0 HB3 TYR B 12 18.032 23.977 17.916 1.00 42.28 H new ATOM 0 HD1 TYR B 12 14.966 23.882 18.391 1.00 49.49 H new ATOM 0 HD2 TYR B 12 17.574 21.696 15.766 1.00 48.65 H new ATOM 0 HE1 TYR B 12 13.396 21.958 18.416 1.00 50.83 H new ATOM 0 HE2 TYR B 12 16.014 19.792 15.790 1.00 51.34 H new ATOM 0 HH TYR B 12 14.090 18.959 16.556 1.00 52.32 H new ATOM 1251 N CYS B 13 18.328 26.547 15.621 1.00 32.32 N ATOM 1252 CA CYS B 13 19.390 27.544 15.365 1.00 29.00 C ATOM 1253 C CYS B 13 18.891 28.888 15.876 1.00 29.81 C ATOM 1254 O CYS B 13 19.436 29.444 16.799 1.00 24.62 O ATOM 1255 CB CYS B 13 19.678 27.619 13.867 1.00 28.41 C ATOM 1256 SG CYS B 13 19.867 25.943 13.210 1.00 23.95 S ATOM 0 H CYS B 13 18.059 25.974 14.821 1.00 32.32 H new ATOM 0 HA CYS B 13 20.313 27.266 15.873 1.00 29.00 H new ATOM 0 HB2 CYS B 13 18.866 28.134 13.354 1.00 28.41 H new ATOM 0 HB3 CYS B 13 20.585 28.197 13.688 1.00 28.41 H new ATOM 0 HG CYS B 13 18.736 25.309 13.306 1.00 23.95 H new ATOM 1262 N GLN B 14 17.825 29.387 15.311 1.00 29.76 N ATOM 1263 CA GLN B 14 17.265 30.681 15.788 1.00 32.34 C ATOM 1264 C GLN B 14 17.169 30.655 17.319 1.00 33.14 C ATOM 1265 O GLN B 14 17.391 31.649 17.979 1.00 33.29 O ATOM 1266 CB GLN B 14 15.875 30.891 15.172 1.00 34.56 C ATOM 1267 CG GLN B 14 15.515 32.380 15.184 1.00 39.08 C ATOM 1268 CD GLN B 14 15.293 32.848 16.621 1.00 41.02 C ATOM 1269 OE1 GLN B 14 14.733 32.042 17.475 1.00 42.67 O flip ATOM 1270 NE2 GLN B 14 15.633 33.961 16.969 1.00 42.20 N flip ATOM 0 H GLN B 14 17.318 28.953 14.539 1.00 29.76 H new ATOM 0 HA GLN B 14 17.914 31.503 15.485 1.00 32.34 H new ATOM 0 HB2 GLN B 14 15.861 30.513 14.150 1.00 34.56 H new ATOM 0 HB3 GLN B 14 15.131 30.324 15.732 1.00 34.56 H new ATOM 0 HG2 GLN B 14 16.314 32.960 14.722 1.00 39.08 H new ATOM 0 HG3 GLN B 14 14.615 32.551 14.593 1.00 39.08 H new ATOM 0 HE21 GLN B 14 16.072 34.593 16.299 1.00 42.20 H new ATOM 0 HE22 GLN B 14 15.479 34.264 17.931 1.00 42.20 H new ATOM 1279 N LYS B 15 16.866 29.520 17.895 1.00 31.48 N ATOM 1280 CA LYS B 15 16.798 29.451 19.383 1.00 31.70 C ATOM 1281 C LYS B 15 18.232 29.501 19.905 1.00 30.74 C ATOM 1282 O LYS B 15 18.613 30.391 20.634 1.00 30.57 O ATOM 1283 CB LYS B 15 16.146 28.132 19.824 1.00 35.91 C ATOM 1284 CG LYS B 15 14.740 27.979 19.202 1.00 40.53 C ATOM 1285 CD LYS B 15 13.667 28.517 20.151 1.00 42.80 C ATOM 1286 CE LYS B 15 12.286 28.172 19.596 1.00 45.27 C ATOM 1287 NZ LYS B 15 11.238 28.857 20.405 1.00 48.21 N ATOM 0 H LYS B 15 16.665 28.648 17.405 1.00 31.48 H new ATOM 0 HA LYS B 15 16.204 30.277 19.774 1.00 31.70 H new ATOM 0 HB2 LYS B 15 16.774 27.293 19.525 1.00 35.91 H new ATOM 0 HB3 LYS B 15 16.073 28.103 20.911 1.00 35.91 H new ATOM 0 HG2 LYS B 15 14.696 28.515 18.254 1.00 40.53 H new ATOM 0 HG3 LYS B 15 14.546 26.929 18.984 1.00 40.53 H new ATOM 0 HD2 LYS B 15 13.792 28.084 21.143 1.00 42.80 H new ATOM 0 HD3 LYS B 15 13.769 29.597 20.260 1.00 42.80 H new ATOM 0 HE2 LYS B 15 12.214 28.480 18.553 1.00 45.27 H new ATOM 0 HE3 LYS B 15 12.132 27.093 19.621 1.00 45.27 H new ATOM 0 HZ1 LYS B 15 10.298 28.622 20.027 1.00 48.21 H new ATOM 0 HZ2 LYS B 15 11.302 28.542 21.394 1.00 48.21 H new ATOM 0 HZ3 LYS B 15 11.382 29.886 20.360 1.00 48.21 H new ATOM 1301 N LEU B 16 19.051 28.568 19.504 1.00 26.59 N ATOM 1302 CA LEU B 16 20.472 28.589 19.950 1.00 27.03 C ATOM 1303 C LEU B 16 21.018 29.987 19.665 1.00 24.17 C ATOM 1304 O LEU B 16 21.789 30.548 20.418 1.00 23.26 O ATOM 1305 CB LEU B 16 21.251 27.525 19.158 1.00 28.15 C ATOM 1306 CG LEU B 16 22.487 27.058 19.943 1.00 28.00 C ATOM 1307 CD1 LEU B 16 22.069 26.390 21.267 1.00 30.50 C ATOM 1308 CD2 LEU B 16 23.275 26.059 19.082 1.00 26.29 C ATOM 0 H LEU B 16 18.799 27.795 18.889 1.00 26.59 H new ATOM 0 HA LEU B 16 20.568 28.367 21.013 1.00 27.03 H new ATOM 0 HB2 LEU B 16 20.603 26.673 18.950 1.00 28.15 H new ATOM 0 HB3 LEU B 16 21.559 27.934 18.196 1.00 28.15 H new ATOM 0 HG LEU B 16 23.110 27.921 20.178 1.00 28.00 H new ATOM 0 HD11 LEU B 16 22.958 26.066 21.808 1.00 30.50 H new ATOM 0 HD12 LEU B 16 21.514 27.104 21.875 1.00 30.50 H new ATOM 0 HD13 LEU B 16 21.439 25.526 21.056 1.00 30.50 H new ATOM 0 HD21 LEU B 16 24.155 25.721 19.630 1.00 26.29 H new ATOM 0 HD22 LEU B 16 22.643 25.203 18.847 1.00 26.29 H new ATOM 0 HD23 LEU B 16 23.588 26.543 18.157 1.00 26.29 H new ATOM 1320 N LEU B 17 20.569 30.553 18.586 1.00 23.83 N ATOM 1321 CA LEU B 17 20.978 31.932 18.212 1.00 25.91 C ATOM 1322 C LEU B 17 20.457 32.879 19.299 1.00 28.74 C ATOM 1323 O LEU B 17 21.080 33.864 19.641 1.00 29.35 O ATOM 1324 CB LEU B 17 20.326 32.278 16.863 1.00 23.53 C ATOM 1325 CG LEU B 17 21.068 33.439 16.155 1.00 23.31 C ATOM 1326 CD1 LEU B 17 22.189 32.898 15.236 1.00 16.92 C ATOM 1327 CD2 LEU B 17 20.069 34.242 15.303 1.00 19.75 C ATOM 0 H LEU B 17 19.922 30.110 17.933 1.00 23.83 H new ATOM 0 HA LEU B 17 22.061 32.021 18.125 1.00 25.91 H new ATOM 0 HB2 LEU B 17 20.328 31.398 16.220 1.00 23.53 H new ATOM 0 HB3 LEU B 17 19.284 32.554 17.022 1.00 23.53 H new ATOM 0 HG LEU B 17 21.514 34.077 16.918 1.00 23.31 H new ATOM 0 HD11 LEU B 17 22.695 33.732 14.750 1.00 16.92 H new ATOM 0 HD12 LEU B 17 22.907 32.335 15.831 1.00 16.92 H new ATOM 0 HD13 LEU B 17 21.755 32.246 14.478 1.00 16.92 H new ATOM 0 HD21 LEU B 17 20.590 35.059 14.805 1.00 19.75 H new ATOM 0 HD22 LEU B 17 19.621 33.588 14.555 1.00 19.75 H new ATOM 0 HD23 LEU B 17 19.288 34.648 15.945 1.00 19.75 H new ATOM 1339 N GLU B 18 19.302 32.569 19.841 1.00 30.66 N ATOM 1340 CA GLU B 18 18.706 33.423 20.909 1.00 33.61 C ATOM 1341 C GLU B 18 19.343 33.056 22.257 1.00 34.68 C ATOM 1342 O GLU B 18 19.730 33.915 23.024 1.00 34.80 O ATOM 1343 CB GLU B 18 17.161 33.220 20.914 1.00 35.91 C ATOM 1344 CG GLU B 18 16.679 32.352 22.093 1.00 37.64 C ATOM 1345 CD GLU B 18 15.169 32.135 21.975 1.00 40.24 C ATOM 1346 OE1 GLU B 18 14.443 33.114 22.028 1.00 40.89 O ATOM 1347 OE2 GLU B 18 14.764 30.992 21.834 1.00 40.39 O ATOM 0 H GLU B 18 18.745 31.754 19.584 1.00 30.66 H new ATOM 0 HA GLU B 18 18.904 34.479 20.724 1.00 33.61 H new ATOM 0 HB2 GLU B 18 16.671 34.193 20.960 1.00 35.91 H new ATOM 0 HB3 GLU B 18 16.857 32.754 19.977 1.00 35.91 H new ATOM 0 HG2 GLU B 18 17.197 31.393 22.090 1.00 37.64 H new ATOM 0 HG3 GLU B 18 16.915 32.839 23.039 1.00 37.64 H new ATOM 1354 N LYS B 19 19.465 31.787 22.546 1.00 34.95 N ATOM 1355 CA LYS B 19 20.087 31.376 23.835 1.00 36.04 C ATOM 1356 C LYS B 19 21.408 32.128 24.004 1.00 35.87 C ATOM 1357 O LYS B 19 21.734 32.610 25.071 1.00 36.90 O ATOM 1358 CB LYS B 19 20.329 29.872 23.825 1.00 36.58 C ATOM 1359 CG LYS B 19 20.398 29.372 25.268 1.00 39.52 C ATOM 1360 CD LYS B 19 20.950 27.969 25.262 1.00 41.12 C ATOM 1361 CE LYS B 19 20.875 27.371 26.667 1.00 43.76 C ATOM 1362 NZ LYS B 19 21.171 28.430 27.674 1.00 45.38 N ATOM 0 H LYS B 19 19.161 31.020 21.946 1.00 34.95 H new ATOM 0 HA LYS B 19 19.426 31.616 24.668 1.00 36.04 H new ATOM 0 HB2 LYS B 19 19.527 29.365 23.288 1.00 36.58 H new ATOM 0 HB3 LYS B 19 21.257 29.643 23.302 1.00 36.58 H new ATOM 0 HG2 LYS B 19 21.033 30.026 25.866 1.00 39.52 H new ATOM 0 HG3 LYS B 19 19.407 29.387 25.722 1.00 39.52 H new ATOM 0 HD2 LYS B 19 20.386 27.350 24.564 1.00 41.12 H new ATOM 0 HD3 LYS B 19 21.984 27.978 24.916 1.00 41.12 H new ATOM 0 HE2 LYS B 19 19.884 26.953 26.844 1.00 43.76 H new ATOM 0 HE3 LYS B 19 21.588 26.552 26.764 1.00 43.76 H new ATOM 0 HZ1 LYS B 19 21.404 27.987 28.585 1.00 45.38 H new ATOM 0 HZ2 LYS B 19 21.978 29.001 27.350 1.00 45.38 H new ATOM 0 HZ3 LYS B 19 20.338 29.042 27.790 1.00 45.38 H new ATOM 1376 N PHE B 20 22.158 32.245 22.941 1.00 35.16 N ATOM 1377 CA PHE B 20 23.451 32.977 22.991 1.00 34.19 C ATOM 1378 C PHE B 20 23.245 34.356 22.361 1.00 34.42 C ATOM 1379 O PHE B 20 24.156 35.154 22.264 1.00 33.94 O ATOM 1380 CB PHE B 20 24.479 32.200 22.180 1.00 34.18 C ATOM 1381 CG PHE B 20 24.910 30.976 22.946 1.00 32.04 C ATOM 1382 CD1 PHE B 20 24.162 29.798 22.848 1.00 31.71 C ATOM 1383 CD2 PHE B 20 26.048 31.020 23.759 1.00 34.13 C ATOM 1384 CE1 PHE B 20 24.552 28.662 23.563 1.00 31.01 C ATOM 1385 CE2 PHE B 20 26.437 29.885 24.476 1.00 33.69 C ATOM 1386 CZ PHE B 20 25.688 28.705 24.378 1.00 32.95 C ATOM 0 H PHE B 20 21.923 31.857 22.027 1.00 35.16 H new ATOM 0 HA PHE B 20 23.797 33.084 24.019 1.00 34.19 H new ATOM 0 HB2 PHE B 20 24.054 31.909 21.219 1.00 34.18 H new ATOM 0 HB3 PHE B 20 25.342 32.831 21.968 1.00 34.18 H new ATOM 0 HD1 PHE B 20 23.284 29.766 22.220 1.00 31.71 H new ATOM 0 HD2 PHE B 20 26.625 31.930 23.832 1.00 34.13 H new ATOM 0 HE1 PHE B 20 23.976 27.751 23.486 1.00 31.01 H new ATOM 0 HE2 PHE B 20 27.314 29.918 25.105 1.00 33.69 H new ATOM 0 HZ PHE B 20 25.988 27.828 24.932 1.00 32.95 H new ATOM 1396 N ARG B 21 22.042 34.634 21.933 1.00 33.90 N ATOM 1397 CA ARG B 21 21.743 35.950 21.309 1.00 35.50 C ATOM 1398 C ARG B 21 22.783 36.276 20.235 1.00 34.22 C ATOM 1399 O ARG B 21 23.196 37.409 20.085 1.00 33.41 O ATOM 1400 CB ARG B 21 21.754 37.043 22.387 1.00 38.56 C ATOM 1401 CG ARG B 21 20.584 36.836 23.378 1.00 42.96 C ATOM 1402 CD ARG B 21 21.044 36.001 24.573 1.00 46.75 C ATOM 1403 NE ARG B 21 21.884 36.842 25.471 1.00 50.46 N ATOM 1404 CZ ARG B 21 22.149 36.442 26.685 1.00 51.88 C ATOM 1405 NH1 ARG B 21 21.675 35.304 27.115 1.00 54.10 N ATOM 1406 NH2 ARG B 21 22.887 37.180 27.467 1.00 54.21 N ATOM 0 H ARG B 21 21.248 33.997 21.991 1.00 33.90 H new ATOM 0 HA ARG B 21 20.758 35.906 20.843 1.00 35.50 H new ATOM 0 HB2 ARG B 21 22.702 37.023 22.925 1.00 38.56 H new ATOM 0 HB3 ARG B 21 21.674 38.024 21.920 1.00 38.56 H new ATOM 0 HG2 ARG B 21 20.214 37.802 23.721 1.00 42.96 H new ATOM 0 HG3 ARG B 21 19.756 36.338 22.875 1.00 42.96 H new ATOM 0 HD2 ARG B 21 20.181 35.619 25.117 1.00 46.75 H new ATOM 0 HD3 ARG B 21 21.612 35.137 24.229 1.00 46.75 H new ATOM 0 HE ARG B 21 22.253 37.732 25.137 1.00 50.46 H new ATOM 0 HH11 ARG B 21 21.098 34.728 26.502 1.00 54.10 H new ATOM 0 HH12 ARG B 21 21.882 34.991 28.064 1.00 54.10 H new ATOM 0 HH21 ARG B 21 23.257 38.069 27.130 1.00 54.21 H new ATOM 0 HH22 ARG B 21 23.095 36.868 28.416 1.00 54.21 H new ATOM 1420 N TYR B 22 23.204 35.300 19.473 1.00 31.03 N ATOM 1421 CA TYR B 22 24.202 35.576 18.407 1.00 30.00 C ATOM 1422 C TYR B 22 23.514 36.412 17.295 1.00 28.60 C ATOM 1423 O TYR B 22 22.321 36.286 17.105 1.00 27.38 O ATOM 1424 CB TYR B 22 24.667 34.236 17.816 1.00 26.97 C ATOM 1425 CG TYR B 22 25.773 33.612 18.662 1.00 28.47 C ATOM 1426 CD1 TYR B 22 26.980 34.295 18.894 1.00 28.83 C ATOM 1427 CD2 TYR B 22 25.586 32.336 19.216 1.00 26.95 C ATOM 1428 CE1 TYR B 22 27.982 33.707 19.673 1.00 27.02 C ATOM 1429 CE2 TYR B 22 26.593 31.751 19.994 1.00 26.27 C ATOM 1430 CZ TYR B 22 27.789 32.437 20.223 1.00 26.46 C ATOM 1431 OH TYR B 22 28.780 31.860 20.991 1.00 23.82 O ATOM 0 H TYR B 22 22.899 34.329 19.545 1.00 31.03 H new ATOM 0 HA TYR B 22 25.055 36.121 18.810 1.00 30.00 H new ATOM 0 HB2 TYR B 22 23.822 33.550 17.755 1.00 26.97 H new ATOM 0 HB3 TYR B 22 25.027 34.390 16.799 1.00 26.97 H new ATOM 0 HD1 TYR B 22 27.134 35.276 18.470 1.00 28.83 H new ATOM 0 HD2 TYR B 22 24.663 31.804 19.042 1.00 26.95 H new ATOM 0 HE1 TYR B 22 28.907 34.236 19.850 1.00 27.02 H new ATOM 0 HE2 TYR B 22 26.445 30.769 20.418 1.00 26.27 H new ATOM 0 HH TYR B 22 28.560 31.964 21.940 1.00 23.82 H new ATOM 1441 N PRO B 23 24.269 37.225 16.571 1.00 29.13 N ATOM 1442 CA PRO B 23 23.699 38.036 15.474 1.00 28.62 C ATOM 1443 C PRO B 23 22.984 37.124 14.462 1.00 28.74 C ATOM 1444 O PRO B 23 22.999 35.919 14.584 1.00 26.54 O ATOM 1445 CB PRO B 23 24.911 38.750 14.830 1.00 29.12 C ATOM 1446 CG PRO B 23 26.177 38.328 15.626 1.00 29.87 C ATOM 1447 CD PRO B 23 25.717 37.407 16.778 1.00 29.51 C ATOM 0 HA PRO B 23 22.956 38.753 15.824 1.00 28.62 H new ATOM 0 HB2 PRO B 23 25.007 38.471 13.781 1.00 29.12 H new ATOM 0 HB3 PRO B 23 24.781 39.832 14.862 1.00 29.12 H new ATOM 0 HG2 PRO B 23 26.882 37.808 14.977 1.00 29.87 H new ATOM 0 HG3 PRO B 23 26.693 39.204 16.019 1.00 29.87 H new ATOM 0 HD2 PRO B 23 26.242 36.452 16.752 1.00 29.51 H new ATOM 0 HD3 PRO B 23 25.923 37.858 17.749 1.00 29.51 H new ATOM 1455 N TRP B 24 22.352 37.698 13.472 1.00 24.77 N ATOM 1456 CA TRP B 24 21.625 36.871 12.458 1.00 26.20 C ATOM 1457 C TRP B 24 22.591 36.295 11.419 1.00 24.23 C ATOM 1458 O TRP B 24 22.241 35.403 10.672 1.00 20.77 O ATOM 1459 CB TRP B 24 20.574 37.732 11.754 1.00 28.27 C ATOM 1460 CG TRP B 24 19.873 36.914 10.714 1.00 30.88 C ATOM 1461 CD1 TRP B 24 19.912 37.157 9.384 1.00 31.38 C ATOM 1462 CD2 TRP B 24 19.032 35.733 10.889 1.00 29.00 C ATOM 1463 NE1 TRP B 24 19.154 36.202 8.731 1.00 31.09 N ATOM 1464 CE2 TRP B 24 18.591 35.302 9.615 1.00 31.07 C ATOM 1465 CE3 TRP B 24 18.613 34.999 12.016 1.00 30.12 C ATOM 1466 CZ2 TRP B 24 17.766 34.186 9.464 1.00 31.07 C ATOM 1467 CZ3 TRP B 24 17.782 33.877 11.866 1.00 31.73 C ATOM 1468 CH2 TRP B 24 17.360 33.471 10.593 1.00 30.51 C ATOM 0 H TRP B 24 22.307 38.706 13.320 1.00 24.77 H new ATOM 0 HA TRP B 24 21.143 36.042 12.976 1.00 26.20 H new ATOM 0 HB2 TRP B 24 19.854 38.112 12.479 1.00 28.27 H new ATOM 0 HB3 TRP B 24 21.048 38.598 11.292 1.00 28.27 H new ATOM 0 HD1 TRP B 24 20.448 37.965 8.909 1.00 31.38 H new ATOM 0 HE1 TRP B 24 19.026 36.167 7.720 1.00 31.09 H new ATOM 0 HE3 TRP B 24 18.933 35.301 13.002 1.00 30.12 H new ATOM 0 HZ2 TRP B 24 17.444 33.877 8.480 1.00 31.07 H new ATOM 0 HZ3 TRP B 24 17.466 33.323 12.738 1.00 31.73 H new ATOM 0 HH2 TRP B 24 16.722 32.606 10.485 1.00 30.51 H new ATOM 1479 N GLU B 25 23.794 36.793 11.345 1.00 21.71 N ATOM 1480 CA GLU B 25 24.751 36.259 10.329 1.00 23.69 C ATOM 1481 C GLU B 25 25.374 34.944 10.818 1.00 22.17 C ATOM 1482 O GLU B 25 26.018 34.251 10.060 1.00 20.98 O ATOM 1483 CB GLU B 25 25.858 37.293 10.057 1.00 29.06 C ATOM 1484 CG GLU B 25 26.212 38.029 11.351 1.00 37.12 C ATOM 1485 CD GLU B 25 27.575 38.710 11.203 1.00 42.03 C ATOM 1486 OE1 GLU B 25 28.508 38.041 10.788 1.00 44.49 O ATOM 1487 OE2 GLU B 25 27.663 39.889 11.506 1.00 44.52 O ATOM 0 H GLU B 25 24.156 37.540 11.937 1.00 21.71 H new ATOM 0 HA GLU B 25 24.206 36.065 9.405 1.00 23.69 H new ATOM 0 HB2 GLU B 25 26.742 36.796 9.658 1.00 29.06 H new ATOM 0 HB3 GLU B 25 25.525 38.006 9.302 1.00 29.06 H new ATOM 0 HG2 GLU B 25 25.447 38.771 11.579 1.00 37.12 H new ATOM 0 HG3 GLU B 25 26.234 37.327 12.185 1.00 37.12 H new ATOM 1494 N LEU B 26 25.216 34.598 12.078 1.00 18.07 N ATOM 1495 CA LEU B 26 25.831 33.327 12.589 1.00 16.50 C ATOM 1496 C LEU B 26 24.843 32.169 12.508 1.00 16.77 C ATOM 1497 O LEU B 26 25.012 31.161 13.165 1.00 16.07 O ATOM 1498 CB LEU B 26 26.271 33.504 14.040 1.00 18.60 C ATOM 1499 CG LEU B 26 27.066 34.807 14.206 1.00 21.90 C ATOM 1500 CD1 LEU B 26 27.838 34.758 15.523 1.00 24.06 C ATOM 1501 CD2 LEU B 26 28.067 34.983 13.054 1.00 25.09 C ATOM 0 H LEU B 26 24.692 35.136 12.769 1.00 18.07 H new ATOM 0 HA LEU B 26 26.694 33.100 11.964 1.00 16.50 H new ATOM 0 HB2 LEU B 26 25.397 33.519 14.692 1.00 18.60 H new ATOM 0 HB3 LEU B 26 26.883 32.656 14.346 1.00 18.60 H new ATOM 0 HG LEU B 26 26.368 35.644 14.201 1.00 21.90 H new ATOM 0 HD11 LEU B 26 28.405 35.681 15.647 1.00 24.06 H new ATOM 0 HD12 LEU B 26 27.138 34.648 16.351 1.00 24.06 H new ATOM 0 HD13 LEU B 26 28.523 33.910 15.512 1.00 24.06 H new ATOM 0 HD21 LEU B 26 28.620 35.912 13.191 1.00 25.09 H new ATOM 0 HD22 LEU B 26 28.763 34.144 13.046 1.00 25.09 H new ATOM 0 HD23 LEU B 26 27.529 35.017 12.107 1.00 25.09 H new ATOM 1513 N MET B 27 23.836 32.270 11.690 1.00 15.51 N ATOM 1514 CA MET B 27 22.898 31.130 11.577 1.00 15.51 C ATOM 1515 C MET B 27 23.636 29.920 10.963 1.00 15.79 C ATOM 1516 O MET B 27 23.415 28.809 11.401 1.00 14.86 O ATOM 1517 CB MET B 27 21.666 31.508 10.737 1.00 16.03 C ATOM 1518 CG MET B 27 20.686 32.305 11.594 1.00 14.48 C ATOM 1519 SD MET B 27 19.881 31.212 12.795 1.00 11.00 S ATOM 1520 CE MET B 27 18.948 30.197 11.623 1.00 16.96 C ATOM 0 H MET B 27 23.626 33.079 11.105 1.00 15.51 H new ATOM 0 HA MET B 27 22.542 30.863 12.572 1.00 15.51 H new ATOM 0 HB2 MET B 27 21.970 32.097 9.872 1.00 16.03 H new ATOM 0 HB3 MET B 27 21.183 30.608 10.356 1.00 16.03 H new ATOM 0 HG2 MET B 27 21.213 33.105 12.114 1.00 14.48 H new ATOM 0 HG3 MET B 27 19.936 32.777 10.959 1.00 14.48 H new ATOM 0 HE1 MET B 27 17.969 29.965 12.042 1.00 16.96 H new ATOM 0 HE2 MET B 27 18.823 30.743 10.688 1.00 16.96 H new ATOM 0 HE3 MET B 27 19.490 29.270 11.433 1.00 16.96 H new ATOM 1530 N PRO B 28 24.516 30.139 9.987 1.00 15.25 N ATOM 1531 CA PRO B 28 25.274 29.024 9.388 1.00 16.18 C ATOM 1532 C PRO B 28 26.110 28.345 10.478 1.00 15.53 C ATOM 1533 O PRO B 28 26.379 27.170 10.417 1.00 16.52 O ATOM 1534 CB PRO B 28 26.165 29.690 8.310 1.00 16.78 C ATOM 1535 CG PRO B 28 25.614 31.120 8.113 1.00 19.84 C ATOM 1536 CD PRO B 28 24.834 31.460 9.392 1.00 17.18 C ATOM 0 HA PRO B 28 24.642 28.251 8.950 1.00 16.18 H new ATOM 0 HB2 PRO B 28 27.207 29.716 8.629 1.00 16.78 H new ATOM 0 HB3 PRO B 28 26.131 29.128 7.376 1.00 16.78 H new ATOM 0 HG2 PRO B 28 26.425 31.830 7.951 1.00 19.84 H new ATOM 0 HG3 PRO B 28 24.967 31.170 7.238 1.00 19.84 H new ATOM 0 HD2 PRO B 28 25.430 32.070 10.071 1.00 17.18 H new ATOM 0 HD3 PRO B 28 23.929 32.024 9.168 1.00 17.18 H new ATOM 1544 N LEU B 29 26.512 29.077 11.482 1.00 13.35 N ATOM 1545 CA LEU B 29 27.318 28.459 12.574 1.00 12.43 C ATOM 1546 C LEU B 29 26.382 27.721 13.530 1.00 12.94 C ATOM 1547 O LEU B 29 26.533 26.537 13.758 1.00 13.87 O ATOM 1548 CB LEU B 29 28.095 29.545 13.323 1.00 15.82 C ATOM 1549 CG LEU B 29 28.845 30.425 12.316 1.00 12.60 C ATOM 1550 CD1 LEU B 29 29.749 31.400 13.074 1.00 13.73 C ATOM 1551 CD2 LEU B 29 29.700 29.542 11.389 1.00 13.81 C ATOM 0 H LEU B 29 26.318 30.072 11.593 1.00 13.35 H new ATOM 0 HA LEU B 29 28.031 27.751 12.151 1.00 12.43 H new ATOM 0 HB2 LEU B 29 27.411 30.153 13.915 1.00 15.82 H new ATOM 0 HB3 LEU B 29 28.799 29.089 14.019 1.00 15.82 H new ATOM 0 HG LEU B 29 28.127 30.983 11.715 1.00 12.60 H new ATOM 0 HD11 LEU B 29 30.285 32.028 12.362 1.00 13.73 H new ATOM 0 HD12 LEU B 29 29.141 32.027 13.726 1.00 13.73 H new ATOM 0 HD13 LEU B 29 30.466 30.840 13.674 1.00 13.73 H new ATOM 0 HD21 LEU B 29 30.231 30.171 10.675 1.00 13.81 H new ATOM 0 HD22 LEU B 29 30.420 28.981 11.984 1.00 13.81 H new ATOM 0 HD23 LEU B 29 29.055 28.848 10.851 1.00 13.81 H new ATOM 1563 N MET B 30 25.395 28.388 14.076 1.00 13.14 N ATOM 1564 CA MET B 30 24.453 27.678 14.984 1.00 14.92 C ATOM 1565 C MET B 30 23.942 26.446 14.246 1.00 15.06 C ATOM 1566 O MET B 30 23.683 25.410 14.827 1.00 14.78 O ATOM 1567 CB MET B 30 23.260 28.580 15.312 1.00 14.70 C ATOM 1568 CG MET B 30 23.700 29.764 16.171 1.00 10.57 C ATOM 1569 SD MET B 30 24.318 29.169 17.769 1.00 7.09 S ATOM 1570 CE MET B 30 26.051 29.642 17.560 1.00 13.40 C ATOM 0 H MET B 30 25.205 29.380 13.933 1.00 13.14 H new ATOM 0 HA MET B 30 24.960 27.407 15.910 1.00 14.92 H new ATOM 0 HB2 MET B 30 22.807 28.942 14.389 1.00 14.70 H new ATOM 0 HB3 MET B 30 22.497 28.006 15.838 1.00 14.70 H new ATOM 0 HG2 MET B 30 24.478 30.328 15.657 1.00 10.57 H new ATOM 0 HG3 MET B 30 22.862 30.444 16.325 1.00 10.57 H new ATOM 0 HE1 MET B 30 26.615 29.359 18.449 1.00 13.40 H new ATOM 0 HE2 MET B 30 26.465 29.132 16.690 1.00 13.40 H new ATOM 0 HE3 MET B 30 26.119 30.720 17.415 1.00 13.40 H new ATOM 1580 N TYR B 31 23.798 26.568 12.957 1.00 13.82 N ATOM 1581 CA TYR B 31 23.307 25.429 12.141 1.00 14.24 C ATOM 1582 C TYR B 31 24.274 24.243 12.268 1.00 15.20 C ATOM 1583 O TYR B 31 23.889 23.152 12.638 1.00 15.23 O ATOM 1584 CB TYR B 31 23.210 25.865 10.675 1.00 15.18 C ATOM 1585 CG TYR B 31 22.884 24.671 9.813 1.00 19.70 C ATOM 1586 CD1 TYR B 31 23.913 23.833 9.371 1.00 21.03 C ATOM 1587 CD2 TYR B 31 21.556 24.399 9.456 1.00 22.09 C ATOM 1588 CE1 TYR B 31 23.621 22.724 8.574 1.00 22.51 C ATOM 1589 CE2 TYR B 31 21.264 23.287 8.660 1.00 25.56 C ATOM 1590 CZ TYR B 31 22.295 22.450 8.217 1.00 25.00 C ATOM 1591 OH TYR B 31 22.005 21.354 7.430 1.00 30.46 O ATOM 0 H TYR B 31 24.002 27.417 12.431 1.00 13.82 H new ATOM 0 HA TYR B 31 22.323 25.123 12.497 1.00 14.24 H new ATOM 0 HB2 TYR B 31 22.440 26.629 10.562 1.00 15.18 H new ATOM 0 HB3 TYR B 31 24.151 26.311 10.355 1.00 15.18 H new ATOM 0 HD1 TYR B 31 24.936 24.044 9.647 1.00 21.03 H new ATOM 0 HD2 TYR B 31 20.761 25.046 9.795 1.00 22.09 H new ATOM 0 HE1 TYR B 31 24.417 22.078 8.233 1.00 22.51 H new ATOM 0 HE2 TYR B 31 20.241 23.074 8.386 1.00 25.56 H new ATOM 0 HH TYR B 31 21.038 21.308 7.276 1.00 30.46 H new ATOM 1601 N VAL B 32 25.526 24.445 11.952 1.00 14.03 N ATOM 1602 CA VAL B 32 26.512 23.326 12.040 1.00 12.14 C ATOM 1603 C VAL B 32 26.566 22.780 13.469 1.00 12.91 C ATOM 1604 O VAL B 32 26.434 21.593 13.692 1.00 14.47 O ATOM 1605 CB VAL B 32 27.900 23.831 11.633 1.00 12.64 C ATOM 1606 CG1 VAL B 32 28.888 22.667 11.662 1.00 12.95 C ATOM 1607 CG2 VAL B 32 27.839 24.412 10.216 1.00 14.27 C ATOM 0 H VAL B 32 25.909 25.336 11.637 1.00 14.03 H new ATOM 0 HA VAL B 32 26.201 22.528 11.366 1.00 12.14 H new ATOM 0 HB VAL B 32 28.225 24.605 12.328 1.00 12.64 H new ATOM 0 HG11 VAL B 32 29.877 23.022 11.373 1.00 12.95 H new ATOM 0 HG12 VAL B 32 28.931 22.252 12.669 1.00 12.95 H new ATOM 0 HG13 VAL B 32 28.562 21.895 10.965 1.00 12.95 H new ATOM 0 HG21 VAL B 32 28.827 24.771 9.927 1.00 14.27 H new ATOM 0 HG22 VAL B 32 27.516 23.639 9.519 1.00 14.27 H new ATOM 0 HG23 VAL B 32 27.131 25.240 10.193 1.00 14.27 H new ATOM 1617 N ILE B 33 26.766 23.634 14.435 1.00 13.72 N ATOM 1618 CA ILE B 33 26.836 23.174 15.852 1.00 9.81 C ATOM 1619 C ILE B 33 25.717 22.156 16.135 1.00 12.06 C ATOM 1620 O ILE B 33 25.962 21.061 16.601 1.00 13.15 O ATOM 1621 CB ILE B 33 26.706 24.415 16.747 1.00 11.56 C ATOM 1622 CG1 ILE B 33 28.035 25.192 16.686 1.00 12.90 C ATOM 1623 CG2 ILE B 33 26.404 24.013 18.194 1.00 12.06 C ATOM 1624 CD1 ILE B 33 27.897 26.585 17.315 1.00 11.54 C ATOM 0 H ILE B 33 26.885 24.638 14.303 1.00 13.72 H new ATOM 0 HA ILE B 33 27.782 22.672 16.054 1.00 9.81 H new ATOM 0 HB ILE B 33 25.883 25.036 16.394 1.00 11.56 H new ATOM 0 HG12 ILE B 33 28.811 24.631 17.207 1.00 12.90 H new ATOM 0 HG13 ILE B 33 28.354 25.289 15.648 1.00 12.90 H new ATOM 0 HG21 ILE B 33 26.316 24.908 18.810 1.00 12.06 H new ATOM 0 HG22 ILE B 33 25.468 23.455 18.229 1.00 12.06 H new ATOM 0 HG23 ILE B 33 27.213 23.389 18.575 1.00 12.06 H new ATOM 0 HD11 ILE B 33 28.852 27.107 17.256 1.00 11.54 H new ATOM 0 HD12 ILE B 33 27.139 27.154 16.777 1.00 11.54 H new ATOM 0 HD13 ILE B 33 27.602 26.485 18.360 1.00 11.54 H new ATOM 1636 N LEU B 34 24.502 22.508 15.843 1.00 13.55 N ATOM 1637 CA LEU B 34 23.349 21.578 16.066 1.00 16.27 C ATOM 1638 C LEU B 34 23.552 20.302 15.223 1.00 18.00 C ATOM 1639 O LEU B 34 23.248 19.209 15.658 1.00 20.35 O ATOM 1640 CB LEU B 34 22.060 22.330 15.611 1.00 15.33 C ATOM 1641 CG LEU B 34 21.093 22.833 16.763 1.00 18.88 C ATOM 1642 CD1 LEU B 34 21.624 22.643 18.189 1.00 18.63 C ATOM 1643 CD2 LEU B 34 20.803 24.331 16.569 1.00 18.04 C ATOM 0 H LEU B 34 24.247 23.415 15.452 1.00 13.55 H new ATOM 0 HA LEU B 34 23.269 21.285 17.113 1.00 16.27 H new ATOM 0 HB2 LEU B 34 22.360 23.193 15.016 1.00 15.33 H new ATOM 0 HB3 LEU B 34 21.494 21.670 14.953 1.00 15.33 H new ATOM 0 HG LEU B 34 20.201 22.213 16.673 1.00 18.88 H new ATOM 0 HD11 LEU B 34 20.891 23.018 18.903 1.00 18.63 H new ATOM 0 HD12 LEU B 34 21.801 21.583 18.373 1.00 18.63 H new ATOM 0 HD13 LEU B 34 22.558 23.193 18.306 1.00 18.63 H new ATOM 0 HD21 LEU B 34 20.138 24.678 17.360 1.00 18.04 H new ATOM 0 HD22 LEU B 34 21.738 24.891 16.608 1.00 18.04 H new ATOM 0 HD23 LEU B 34 20.327 24.487 15.601 1.00 18.04 H new ATOM 1655 N LYS B 35 24.048 20.434 14.026 1.00 16.90 N ATOM 1656 CA LYS B 35 24.253 19.229 13.158 1.00 19.51 C ATOM 1657 C LYS B 35 25.111 18.207 13.887 1.00 18.97 C ATOM 1658 O LYS B 35 25.003 17.016 13.673 1.00 18.29 O ATOM 1659 CB LYS B 35 24.962 19.645 11.863 1.00 23.32 C ATOM 1660 CG LYS B 35 24.952 18.476 10.876 1.00 27.46 C ATOM 1661 CD LYS B 35 25.457 18.956 9.513 1.00 30.03 C ATOM 1662 CE LYS B 35 25.429 17.793 8.519 1.00 33.24 C ATOM 1663 NZ LYS B 35 26.489 16.808 8.877 1.00 34.14 N ATOM 0 H LYS B 35 24.322 21.322 13.606 1.00 16.90 H new ATOM 0 HA LYS B 35 23.283 18.790 12.925 1.00 19.51 H new ATOM 0 HB2 LYS B 35 24.463 20.509 11.424 1.00 23.32 H new ATOM 0 HB3 LYS B 35 25.988 19.944 12.078 1.00 23.32 H new ATOM 0 HG2 LYS B 35 25.583 17.668 11.246 1.00 27.46 H new ATOM 0 HG3 LYS B 35 23.943 18.074 10.781 1.00 27.46 H new ATOM 0 HD2 LYS B 35 24.834 19.773 9.150 1.00 30.03 H new ATOM 0 HD3 LYS B 35 26.471 19.345 9.605 1.00 30.03 H new ATOM 0 HE2 LYS B 35 24.451 17.312 8.533 1.00 33.24 H new ATOM 0 HE3 LYS B 35 25.588 18.162 7.506 1.00 33.24 H new ATOM 0 HZ1 LYS B 35 26.644 16.160 8.079 1.00 34.14 H new ATOM 0 HZ2 LYS B 35 27.373 17.312 9.091 1.00 34.14 H new ATOM 0 HZ3 LYS B 35 26.190 16.264 9.712 1.00 34.14 H new ATOM 1677 N ASP B 36 25.974 18.667 14.736 1.00 17.40 N ATOM 1678 CA ASP B 36 26.864 17.744 15.479 1.00 17.99 C ATOM 1679 C ASP B 36 26.183 17.269 16.758 1.00 20.53 C ATOM 1680 O ASP B 36 26.212 16.103 17.099 1.00 21.50 O ATOM 1681 CB ASP B 36 28.131 18.506 15.828 1.00 17.75 C ATOM 1682 CG ASP B 36 28.630 19.228 14.573 1.00 19.30 C ATOM 1683 OD1 ASP B 36 28.801 18.567 13.562 1.00 17.31 O ATOM 1684 OD2 ASP B 36 28.831 20.429 14.645 1.00 18.21 O ATOM 0 H ASP B 36 26.104 19.656 14.951 1.00 17.40 H new ATOM 0 HA ASP B 36 27.093 16.870 14.869 1.00 17.99 H new ATOM 0 HB2 ASP B 36 27.933 19.224 16.624 1.00 17.75 H new ATOM 0 HB3 ASP B 36 28.894 17.821 16.199 1.00 17.75 H new ATOM 1689 N ALA B 37 25.588 18.173 17.477 1.00 17.76 N ATOM 1690 CA ALA B 37 24.921 17.801 18.752 1.00 20.31 C ATOM 1691 C ALA B 37 23.560 17.175 18.472 1.00 21.98 C ATOM 1692 O ALA B 37 22.614 17.377 19.207 1.00 20.93 O ATOM 1693 CB ALA B 37 24.738 19.060 19.586 1.00 16.79 C ATOM 0 H ALA B 37 25.534 19.162 17.235 1.00 17.76 H new ATOM 0 HA ALA B 37 25.534 17.076 19.288 1.00 20.31 H new ATOM 0 HB1 ALA B 37 24.249 18.806 20.527 1.00 16.79 H new ATOM 0 HB2 ALA B 37 25.712 19.505 19.792 1.00 16.79 H new ATOM 0 HB3 ALA B 37 24.122 19.773 19.038 1.00 16.79 H new ATOM 1699 N ASP B 38 23.443 16.423 17.422 1.00 22.08 N ATOM 1700 CA ASP B 38 22.132 15.802 17.118 1.00 24.70 C ATOM 1701 C ASP B 38 21.069 16.902 17.083 1.00 27.43 C ATOM 1702 O ASP B 38 19.884 16.640 17.120 1.00 26.89 O ATOM 1703 CB ASP B 38 21.795 14.780 18.211 1.00 26.17 C ATOM 1704 CG ASP B 38 20.788 13.757 17.677 1.00 26.41 C ATOM 1705 OD1 ASP B 38 21.069 13.158 16.652 1.00 29.79 O ATOM 1706 OD2 ASP B 38 19.754 13.591 18.303 1.00 30.65 O ATOM 0 H ASP B 38 24.193 16.212 16.764 1.00 22.08 H new ATOM 0 HA ASP B 38 22.164 15.294 16.154 1.00 24.70 H new ATOM 0 HB2 ASP B 38 22.702 14.273 18.539 1.00 26.17 H new ATOM 0 HB3 ASP B 38 21.382 15.289 19.082 1.00 26.17 H new ATOM 1711 N ALA B 39 21.502 18.131 17.012 1.00 25.83 N ATOM 1712 CA ALA B 39 20.555 19.275 16.973 1.00 28.40 C ATOM 1713 C ALA B 39 19.944 19.502 18.363 1.00 30.32 C ATOM 1714 O ALA B 39 19.055 20.312 18.531 1.00 32.55 O ATOM 1715 CB ALA B 39 19.456 18.992 15.944 1.00 28.82 C ATOM 0 H ALA B 39 22.488 18.392 16.979 1.00 25.83 H new ATOM 0 HA ALA B 39 21.090 20.179 16.682 1.00 28.40 H new ATOM 0 HB1 ALA B 39 18.760 19.831 15.914 1.00 28.82 H new ATOM 0 HB2 ALA B 39 19.905 18.858 14.960 1.00 28.82 H new ATOM 0 HB3 ALA B 39 18.920 18.086 16.225 1.00 28.82 H new ATOM 1721 N ASN B 40 20.419 18.805 19.363 1.00 29.50 N ATOM 1722 CA ASN B 40 19.863 19.006 20.735 1.00 32.01 C ATOM 1723 C ASN B 40 20.509 20.249 21.354 1.00 32.47 C ATOM 1724 O ASN B 40 21.646 20.223 21.781 1.00 29.40 O ATOM 1725 CB ASN B 40 20.162 17.777 21.609 1.00 33.06 C ATOM 1726 CG ASN B 40 19.118 16.688 21.351 1.00 33.55 C ATOM 1727 OD1 ASN B 40 19.491 15.562 20.815 1.00 35.11 O flip ATOM 1728 ND2 ASN B 40 17.951 16.867 21.640 1.00 33.85 N flip ATOM 0 H ASN B 40 21.162 18.110 19.290 1.00 29.50 H new ATOM 0 HA ASN B 40 18.783 19.140 20.676 1.00 32.01 H new ATOM 0 HB2 ASN B 40 21.159 17.397 21.388 1.00 33.06 H new ATOM 0 HB3 ASN B 40 20.154 18.058 22.662 1.00 33.06 H new ATOM 0 HD21 ASN B 40 17.659 17.750 22.060 1.00 33.85 H new ATOM 0 HD22 ASN B 40 17.264 16.135 21.463 1.00 33.85 H new ATOM 1735 N ILE B 41 19.792 21.337 21.398 1.00 33.58 N ATOM 1736 CA ILE B 41 20.358 22.587 21.981 1.00 35.14 C ATOM 1737 C ILE B 41 21.024 22.279 23.323 1.00 34.57 C ATOM 1738 O ILE B 41 22.184 22.570 23.527 1.00 33.97 O ATOM 1739 CB ILE B 41 19.224 23.606 22.176 1.00 38.72 C ATOM 1740 CG1 ILE B 41 18.786 24.089 20.779 1.00 39.13 C ATOM 1741 CG2 ILE B 41 19.691 24.794 23.073 1.00 40.27 C ATOM 1742 CD1 ILE B 41 17.705 25.169 20.885 1.00 40.55 C ATOM 0 H ILE B 41 18.835 21.415 21.054 1.00 33.58 H new ATOM 0 HA ILE B 41 21.108 23.001 21.307 1.00 35.14 H new ATOM 0 HB ILE B 41 18.380 23.145 22.689 1.00 38.72 H new ATOM 0 HG12 ILE B 41 19.647 24.483 20.240 1.00 39.13 H new ATOM 0 HG13 ILE B 41 18.407 23.246 20.201 1.00 39.13 H new ATOM 0 HG21 ILE B 41 18.871 25.501 23.196 1.00 40.27 H new ATOM 0 HG22 ILE B 41 19.993 24.416 24.049 1.00 40.27 H new ATOM 0 HG23 ILE B 41 20.536 25.296 22.601 1.00 40.27 H new ATOM 0 HD11 ILE B 41 17.414 25.492 19.885 1.00 40.55 H new ATOM 0 HD12 ILE B 41 16.836 24.764 21.403 1.00 40.55 H new ATOM 0 HD13 ILE B 41 18.095 26.021 21.442 1.00 40.55 H new ATOM 1754 N GLU B 42 20.304 21.699 24.240 1.00 35.46 N ATOM 1755 CA GLU B 42 20.908 21.386 25.565 1.00 34.62 C ATOM 1756 C GLU B 42 22.263 20.706 25.363 1.00 31.10 C ATOM 1757 O GLU B 42 23.200 20.934 26.102 1.00 29.48 O ATOM 1758 CB GLU B 42 19.977 20.449 26.337 1.00 40.18 C ATOM 1759 CG GLU B 42 18.611 21.117 26.512 1.00 46.15 C ATOM 1760 CD GLU B 42 17.673 20.172 27.266 1.00 50.80 C ATOM 1761 OE1 GLU B 42 18.082 19.659 28.295 1.00 52.61 O ATOM 1762 OE2 GLU B 42 16.562 19.977 26.802 1.00 53.92 O ATOM 0 H GLU B 42 19.327 21.428 24.131 1.00 35.46 H new ATOM 0 HA GLU B 42 21.048 22.309 26.128 1.00 34.62 H new ATOM 0 HB2 GLU B 42 19.867 19.506 25.801 1.00 40.18 H new ATOM 0 HB3 GLU B 42 20.406 20.214 27.311 1.00 40.18 H new ATOM 0 HG2 GLU B 42 18.720 22.053 27.060 1.00 46.15 H new ATOM 0 HG3 GLU B 42 18.188 21.365 25.538 1.00 46.15 H new ATOM 1769 N GLU B 43 22.376 19.877 24.363 1.00 26.75 N ATOM 1770 CA GLU B 43 23.671 19.186 24.105 1.00 25.31 C ATOM 1771 C GLU B 43 24.566 20.093 23.263 1.00 22.10 C ATOM 1772 O GLU B 43 25.768 20.110 23.422 1.00 21.22 O ATOM 1773 CB GLU B 43 23.413 17.880 23.349 1.00 24.85 C ATOM 1774 CG GLU B 43 24.678 17.019 23.364 1.00 27.31 C ATOM 1775 CD GLU B 43 24.851 16.385 24.745 1.00 29.91 C ATOM 1776 OE1 GLU B 43 24.112 15.463 25.049 1.00 28.72 O ATOM 1777 OE2 GLU B 43 25.720 16.833 25.476 1.00 30.00 O ATOM 0 H GLU B 43 21.626 19.647 23.711 1.00 26.75 H new ATOM 0 HA GLU B 43 24.162 18.964 25.053 1.00 25.31 H new ATOM 0 HB2 GLU B 43 22.587 17.338 23.810 1.00 24.85 H new ATOM 0 HB3 GLU B 43 23.119 18.095 22.321 1.00 24.85 H new ATOM 0 HG2 GLU B 43 24.610 16.242 22.602 1.00 27.31 H new ATOM 0 HG3 GLU B 43 25.548 17.629 23.121 1.00 27.31 H new ATOM 1784 N ALA B 44 23.990 20.851 22.370 1.00 21.46 N ATOM 1785 CA ALA B 44 24.816 21.756 21.525 1.00 22.00 C ATOM 1786 C ALA B 44 25.264 22.956 22.367 1.00 21.74 C ATOM 1787 O ALA B 44 26.361 23.456 22.221 1.00 19.07 O ATOM 1788 CB ALA B 44 23.991 22.210 20.303 1.00 22.06 C ATOM 0 H ALA B 44 22.986 20.882 22.190 1.00 21.46 H new ATOM 0 HA ALA B 44 25.702 21.235 21.164 1.00 22.00 H new ATOM 0 HB1 ALA B 44 24.594 22.873 19.683 1.00 22.06 H new ATOM 0 HB2 ALA B 44 23.694 21.338 19.720 1.00 22.06 H new ATOM 0 HB3 ALA B 44 23.101 22.740 20.642 1.00 22.06 H new ATOM 1794 N SER B 45 24.424 23.413 23.248 1.00 21.72 N ATOM 1795 CA SER B 45 24.796 24.572 24.105 1.00 24.00 C ATOM 1796 C SER B 45 26.004 24.204 24.967 1.00 24.30 C ATOM 1797 O SER B 45 26.961 24.947 25.059 1.00 23.27 O ATOM 1798 CB SER B 45 23.618 24.926 25.010 1.00 25.03 C ATOM 1799 OG SER B 45 23.594 24.039 26.123 1.00 28.51 O ATOM 0 H SER B 45 23.492 23.034 23.413 1.00 21.72 H new ATOM 0 HA SER B 45 25.047 25.426 23.475 1.00 24.00 H new ATOM 0 HB2 SER B 45 23.706 25.957 25.354 1.00 25.03 H new ATOM 0 HB3 SER B 45 22.683 24.855 24.454 1.00 25.03 H new ATOM 0 HG SER B 45 23.312 23.149 25.826 1.00 28.51 H new ATOM 1805 N ARG B 46 25.966 23.066 25.604 1.00 26.45 N ATOM 1806 CA ARG B 46 27.111 22.661 26.465 1.00 27.79 C ATOM 1807 C ARG B 46 28.415 22.765 25.669 1.00 26.86 C ATOM 1808 O ARG B 46 29.464 23.036 26.219 1.00 25.99 O ATOM 1809 CB ARG B 46 26.903 21.220 26.959 1.00 31.64 C ATOM 1810 CG ARG B 46 25.878 21.196 28.114 1.00 39.02 C ATOM 1811 CD ARG B 46 26.024 19.907 28.930 1.00 43.92 C ATOM 1812 NE ARG B 46 25.534 18.726 28.140 1.00 48.12 N ATOM 1813 CZ ARG B 46 24.295 18.630 27.736 1.00 50.42 C ATOM 1814 NH1 ARG B 46 23.407 19.515 28.097 1.00 52.31 N ATOM 1815 NH2 ARG B 46 23.934 17.616 26.999 1.00 52.39 N ATOM 0 H ARG B 46 25.193 22.401 25.565 1.00 26.45 H new ATOM 0 HA ARG B 46 27.170 23.324 27.328 1.00 27.79 H new ATOM 0 HB2 ARG B 46 26.553 20.593 26.139 1.00 31.64 H new ATOM 0 HB3 ARG B 46 27.852 20.803 27.296 1.00 31.64 H new ATOM 0 HG2 ARG B 46 26.027 22.062 28.759 1.00 39.02 H new ATOM 0 HG3 ARG B 46 24.867 21.268 27.713 1.00 39.02 H new ATOM 0 HD2 ARG B 46 27.068 19.760 29.205 1.00 43.92 H new ATOM 0 HD3 ARG B 46 25.459 19.991 29.858 1.00 43.92 H new ATOM 0 HE ARG B 46 26.188 17.977 27.912 1.00 48.12 H new ATOM 0 HH11 ARG B 46 23.677 20.292 28.701 1.00 52.31 H new ATOM 0 HH12 ARG B 46 22.443 19.430 27.776 1.00 52.31 H new ATOM 0 HH21 ARG B 46 24.617 16.904 26.741 1.00 52.39 H new ATOM 0 HH22 ARG B 46 22.968 17.535 26.680 1.00 52.39 H new ATOM 1829 N ARG B 47 28.364 22.574 24.379 1.00 22.86 N ATOM 1830 CA ARG B 47 29.611 22.688 23.569 1.00 20.88 C ATOM 1831 C ARG B 47 29.983 24.163 23.468 1.00 18.23 C ATOM 1832 O ARG B 47 31.037 24.582 23.903 1.00 21.17 O ATOM 1833 CB ARG B 47 29.379 22.115 22.170 1.00 19.97 C ATOM 1834 CG ARG B 47 28.888 20.671 22.288 1.00 21.43 C ATOM 1835 CD ARG B 47 28.659 20.084 20.894 1.00 22.98 C ATOM 1836 NE ARG B 47 28.627 18.598 20.994 1.00 20.54 N ATOM 1837 CZ ARG B 47 28.215 17.887 19.983 1.00 24.59 C ATOM 1838 NH1 ARG B 47 27.874 18.477 18.874 1.00 24.12 N ATOM 1839 NH2 ARG B 47 28.147 16.589 20.080 1.00 16.51 N ATOM 0 H ARG B 47 27.520 22.346 23.854 1.00 22.86 H new ATOM 0 HA ARG B 47 30.417 22.128 24.043 1.00 20.88 H new ATOM 0 HB2 ARG B 47 28.645 22.718 21.635 1.00 19.97 H new ATOM 0 HB3 ARG B 47 30.303 22.151 21.592 1.00 19.97 H new ATOM 0 HG2 ARG B 47 29.620 20.072 22.829 1.00 21.43 H new ATOM 0 HG3 ARG B 47 27.962 20.638 22.863 1.00 21.43 H new ATOM 0 HD2 ARG B 47 27.721 20.454 20.479 1.00 22.98 H new ATOM 0 HD3 ARG B 47 29.453 20.399 20.217 1.00 22.98 H new ATOM 0 HE ARG B 47 28.927 18.138 21.853 1.00 20.54 H new ATOM 0 HH11 ARG B 47 27.930 19.493 18.799 1.00 24.12 H new ATOM 0 HH12 ARG B 47 27.551 17.924 18.080 1.00 24.12 H new ATOM 0 HH21 ARG B 47 28.417 16.128 20.949 1.00 16.51 H new ATOM 0 HH22 ARG B 47 27.824 16.035 19.287 1.00 16.51 H new ATOM 1853 N ILE B 48 29.106 24.960 22.924 1.00 16.11 N ATOM 1854 CA ILE B 48 29.379 26.422 22.823 1.00 18.86 C ATOM 1855 C ILE B 48 29.853 26.905 24.182 1.00 23.26 C ATOM 1856 O ILE B 48 30.919 27.468 24.327 1.00 21.90 O ATOM 1857 CB ILE B 48 28.090 27.140 22.446 1.00 18.65 C ATOM 1858 CG1 ILE B 48 27.532 26.484 21.186 1.00 19.26 C ATOM 1859 CG2 ILE B 48 28.395 28.617 22.184 1.00 21.02 C ATOM 1860 CD1 ILE B 48 26.285 27.232 20.697 1.00 15.25 C ATOM 0 H ILE B 48 28.208 24.661 22.543 1.00 16.11 H new ATOM 0 HA ILE B 48 30.137 26.624 22.067 1.00 18.86 H new ATOM 0 HB ILE B 48 27.359 27.072 23.251 1.00 18.65 H new ATOM 0 HG12 ILE B 48 28.291 26.481 20.404 1.00 19.26 H new ATOM 0 HG13 ILE B 48 27.282 25.443 21.391 1.00 19.26 H new ATOM 0 HG21 ILE B 48 27.475 29.136 21.914 1.00 21.02 H new ATOM 0 HG22 ILE B 48 28.815 29.067 23.084 1.00 21.02 H new ATOM 0 HG23 ILE B 48 29.113 28.701 21.368 1.00 21.02 H new ATOM 0 HD11 ILE B 48 25.901 26.750 19.798 1.00 15.25 H new ATOM 0 HD12 ILE B 48 25.521 27.212 21.474 1.00 15.25 H new ATOM 0 HD13 ILE B 48 26.546 28.266 20.471 1.00 15.25 H new ATOM 1872 N GLU B 49 29.065 26.651 25.180 1.00 24.41 N ATOM 1873 CA GLU B 49 29.432 27.050 26.564 1.00 29.72 C ATOM 1874 C GLU B 49 30.888 26.704 26.826 1.00 31.01 C ATOM 1875 O GLU B 49 31.714 27.561 27.069 1.00 30.32 O ATOM 1876 CB GLU B 49 28.600 26.223 27.525 1.00 30.86 C ATOM 1877 CG GLU B 49 27.181 26.791 27.639 1.00 35.37 C ATOM 1878 CD GLU B 49 26.483 26.176 28.853 1.00 37.77 C ATOM 1879 OE1 GLU B 49 25.958 25.082 28.718 1.00 38.78 O ATOM 1880 OE2 GLU B 49 26.484 26.808 29.896 1.00 38.92 O ATOM 0 H GLU B 49 28.166 26.176 25.097 1.00 24.41 H new ATOM 0 HA GLU B 49 29.265 28.119 26.692 1.00 29.72 H new ATOM 0 HB2 GLU B 49 28.557 25.190 27.181 1.00 30.86 H new ATOM 0 HB3 GLU B 49 29.073 26.212 28.507 1.00 30.86 H new ATOM 0 HG2 GLU B 49 27.219 27.876 27.738 1.00 35.37 H new ATOM 0 HG3 GLU B 49 26.616 26.573 26.732 1.00 35.37 H new ATOM 1887 N GLU B 50 31.206 25.436 26.761 1.00 31.22 N ATOM 1888 CA GLU B 50 32.608 25.015 26.986 1.00 30.52 C ATOM 1889 C GLU B 50 33.459 25.888 26.091 1.00 30.97 C ATOM 1890 O GLU B 50 34.440 26.436 26.496 1.00 30.11 O ATOM 1891 CB GLU B 50 32.756 23.525 26.609 1.00 33.65 C ATOM 1892 CG GLU B 50 33.860 22.865 27.446 1.00 34.45 C ATOM 1893 CD GLU B 50 33.878 21.361 27.169 1.00 36.26 C ATOM 1894 OE1 GLU B 50 34.044 20.993 26.017 1.00 35.94 O ATOM 1895 OE2 GLU B 50 33.727 20.602 28.112 1.00 36.07 O ATOM 0 H GLU B 50 30.551 24.680 26.562 1.00 31.22 H new ATOM 0 HA GLU B 50 32.912 25.124 28.027 1.00 30.52 H new ATOM 0 HB2 GLU B 50 31.810 23.007 26.771 1.00 33.65 H new ATOM 0 HB3 GLU B 50 32.992 23.434 25.549 1.00 33.65 H new ATOM 0 HG2 GLU B 50 34.828 23.303 27.201 1.00 34.45 H new ATOM 0 HG3 GLU B 50 33.686 23.048 28.506 1.00 34.45 H new ATOM 1902 N GLY B 51 33.021 26.051 24.886 1.00 0.00 N ATOM 1903 CA GLY B 51 33.740 26.916 23.918 1.00 0.00 C ATOM 1904 C GLY B 51 33.948 28.319 24.506 1.00 0.00 C ATOM 1905 O GLY B 51 35.051 28.800 24.661 1.00 0.00 O ATOM 0 H GLY B 51 32.176 25.613 24.519 1.00 0.00 H new ATOM 0 HA2 GLY B 51 34.704 26.472 23.670 1.00 0.00 H new ATOM 0 HA3 GLY B 51 33.172 26.984 22.990 1.00 0.00 H new ATOM 1909 N GLN B 52 32.873 28.993 24.812 1.00 30.19 N ATOM 1910 CA GLN B 52 32.984 30.375 25.372 1.00 33.26 C ATOM 1911 C GLN B 52 33.984 30.350 26.514 1.00 34.21 C ATOM 1912 O GLN B 52 34.919 31.124 26.571 1.00 33.27 O ATOM 1913 CB GLN B 52 31.628 30.829 25.924 1.00 34.36 C ATOM 1914 CG GLN B 52 30.517 30.625 24.875 1.00 37.06 C ATOM 1915 CD GLN B 52 30.370 31.869 23.998 1.00 39.18 C ATOM 1916 OE1 GLN B 52 29.185 32.197 23.563 1.00 39.82 O flip ATOM 1917 NE2 GLN B 52 31.336 32.546 23.709 1.00 40.80 N flip ATOM 0 H GLN B 52 31.920 28.648 24.699 1.00 30.19 H new ATOM 0 HA GLN B 52 33.303 31.061 24.587 1.00 33.26 H new ATOM 0 HB2 GLN B 52 31.390 30.266 26.827 1.00 34.36 H new ATOM 0 HB3 GLN B 52 31.679 31.880 26.208 1.00 34.36 H new ATOM 0 HG2 GLN B 52 30.751 29.761 24.253 1.00 37.06 H new ATOM 0 HG3 GLN B 52 29.572 30.412 25.375 1.00 37.06 H new ATOM 0 HE21 GLN B 52 32.261 32.287 24.051 1.00 40.80 H new ATOM 0 HE22 GLN B 52 31.222 33.374 23.124 1.00 40.80 H new ATOM 1926 N TYR B 53 33.787 29.442 27.415 1.00 35.76 N ATOM 1927 CA TYR B 53 34.708 29.312 28.566 1.00 38.60 C ATOM 1928 C TYR B 53 36.069 28.879 28.033 1.00 39.68 C ATOM 1929 O TYR B 53 37.097 29.406 28.395 1.00 39.52 O ATOM 1930 CB TYR B 53 34.152 28.239 29.515 1.00 40.83 C ATOM 1931 CG TYR B 53 35.255 27.701 30.394 1.00 43.21 C ATOM 1932 CD1 TYR B 53 36.118 26.718 29.907 1.00 44.13 C ATOM 1933 CD2 TYR B 53 35.411 28.189 31.684 1.00 43.89 C ATOM 1934 CE1 TYR B 53 37.140 26.223 30.711 1.00 47.20 C ATOM 1935 CE2 TYR B 53 36.435 27.696 32.503 1.00 46.12 C ATOM 1936 CZ TYR B 53 37.302 26.710 32.015 1.00 46.20 C ATOM 1937 OH TYR B 53 38.311 26.218 32.817 1.00 48.95 O ATOM 0 H TYR B 53 33.016 28.774 27.404 1.00 35.76 H new ATOM 0 HA TYR B 53 34.804 30.255 29.104 1.00 38.60 H new ATOM 0 HB2 TYR B 53 33.360 28.663 30.132 1.00 40.83 H new ATOM 0 HB3 TYR B 53 33.708 27.428 28.938 1.00 40.83 H new ATOM 0 HD1 TYR B 53 35.992 26.340 28.903 1.00 44.13 H new ATOM 0 HD2 TYR B 53 34.742 28.950 32.057 1.00 43.89 H new ATOM 0 HE1 TYR B 53 37.808 25.464 30.331 1.00 47.20 H new ATOM 0 HE2 TYR B 53 36.556 28.075 33.507 1.00 46.12 H new ATOM 0 HH TYR B 53 38.895 25.635 32.288 1.00 48.95 H new ATOM 1947 N VAL B 54 36.062 27.910 27.177 1.00 39.35 N ATOM 1948 CA VAL B 54 37.322 27.395 26.594 1.00 40.00 C ATOM 1949 C VAL B 54 38.118 28.577 26.032 1.00 40.47 C ATOM 1950 O VAL B 54 39.188 28.906 26.505 1.00 39.23 O ATOM 1951 CB VAL B 54 36.915 26.428 25.481 1.00 40.33 C ATOM 1952 CG1 VAL B 54 38.003 26.274 24.447 1.00 40.58 C ATOM 1953 CG2 VAL B 54 36.520 25.036 26.044 1.00 39.92 C ATOM 0 H VAL B 54 35.218 27.441 26.848 1.00 39.35 H new ATOM 0 HA VAL B 54 37.947 26.885 27.327 1.00 40.00 H new ATOM 0 HB VAL B 54 36.041 26.865 24.998 1.00 40.33 H new ATOM 0 HG11 VAL B 54 37.675 25.579 23.674 1.00 40.58 H new ATOM 0 HG12 VAL B 54 38.217 27.243 23.997 1.00 40.58 H new ATOM 0 HG13 VAL B 54 38.905 25.888 24.922 1.00 40.58 H new ATOM 0 HG21 VAL B 54 36.237 24.378 25.222 1.00 39.92 H new ATOM 0 HG22 VAL B 54 37.367 24.606 26.578 1.00 39.92 H new ATOM 0 HG23 VAL B 54 35.678 25.145 26.727 1.00 39.92 H new ATOM 1963 N VAL B 55 37.588 29.219 25.030 1.00 40.13 N ATOM 1964 CA VAL B 55 38.289 30.386 24.429 1.00 42.29 C ATOM 1965 C VAL B 55 38.609 31.385 25.539 1.00 43.82 C ATOM 1966 O VAL B 55 39.750 31.744 25.758 1.00 43.78 O ATOM 1967 CB VAL B 55 37.368 31.034 23.387 1.00 41.62 C ATOM 1968 CG1 VAL B 55 38.089 32.187 22.673 1.00 42.45 C ATOM 1969 CG2 VAL B 55 36.960 29.978 22.359 1.00 41.12 C ATOM 0 H VAL B 55 36.694 28.984 24.599 1.00 40.13 H new ATOM 0 HA VAL B 55 39.214 30.072 23.945 1.00 42.29 H new ATOM 0 HB VAL B 55 36.486 31.432 23.890 1.00 41.62 H new ATOM 0 HG11 VAL B 55 37.420 32.634 21.938 1.00 42.45 H new ATOM 0 HG12 VAL B 55 38.382 32.941 23.404 1.00 42.45 H new ATOM 0 HG13 VAL B 55 38.977 31.805 22.170 1.00 42.45 H new ATOM 0 HG21 VAL B 55 36.305 30.430 21.614 1.00 41.12 H new ATOM 0 HG22 VAL B 55 37.850 29.585 21.869 1.00 41.12 H new ATOM 0 HG23 VAL B 55 36.433 29.166 22.861 1.00 41.12 H new ATOM 1979 N ASN B 56 37.611 31.831 26.251 1.00 44.48 N ATOM 1980 CA ASN B 56 37.859 32.798 27.355 1.00 47.06 C ATOM 1981 C ASN B 56 38.971 32.244 28.246 1.00 47.69 C ATOM 1982 O ASN B 56 39.961 32.897 28.505 1.00 47.82 O ATOM 1983 CB ASN B 56 36.577 32.974 28.173 1.00 46.90 C ATOM 1984 CG ASN B 56 35.490 33.590 27.290 1.00 47.81 C ATOM 1985 OD1 ASN B 56 35.511 33.437 26.085 1.00 48.43 O ATOM 1986 ND2 ASN B 56 34.535 34.287 27.842 1.00 47.03 N ATOM 0 H ASN B 56 36.635 31.567 26.115 1.00 44.48 H new ATOM 0 HA ASN B 56 38.157 33.765 26.950 1.00 47.06 H new ATOM 0 HB2 ASN B 56 36.244 32.011 28.559 1.00 46.90 H new ATOM 0 HB3 ASN B 56 36.767 33.614 29.034 1.00 46.90 H new ATOM 0 HD21 ASN B 56 33.807 34.703 27.262 1.00 47.03 H new ATOM 0 HD22 ASN B 56 34.517 34.416 28.854 1.00 47.03 H new ATOM 1993 N GLU B 57 38.819 31.031 28.700 1.00 49.57 N ATOM 1994 CA GLU B 57 39.866 30.412 29.558 1.00 51.35 C ATOM 1995 C GLU B 57 41.224 30.566 28.874 1.00 52.18 C ATOM 1996 O GLU B 57 42.167 31.070 29.449 1.00 52.13 O ATOM 1997 CB GLU B 57 39.551 28.924 29.743 1.00 52.66 C ATOM 1998 CG GLU B 57 40.542 28.298 30.726 1.00 53.83 C ATOM 1999 CD GLU B 57 40.314 26.786 30.792 1.00 55.85 C ATOM 2000 OE1 GLU B 57 39.986 26.211 29.767 1.00 56.34 O ATOM 2001 OE2 GLU B 57 40.474 26.229 31.866 1.00 57.10 O ATOM 0 H GLU B 57 38.010 30.439 28.512 1.00 49.57 H new ATOM 0 HA GLU B 57 39.888 30.902 30.531 1.00 51.35 H new ATOM 0 HB2 GLU B 57 38.533 28.803 30.113 1.00 52.66 H new ATOM 0 HB3 GLU B 57 39.605 28.410 28.783 1.00 52.66 H new ATOM 0 HG2 GLU B 57 41.564 28.508 30.411 1.00 53.83 H new ATOM 0 HG3 GLU B 57 40.416 28.738 31.715 1.00 53.83 H new ATOM 2008 N TYR B 58 41.329 30.135 27.647 1.00 53.28 N ATOM 2009 CA TYR B 58 42.625 30.257 26.925 1.00 53.59 C ATOM 2010 C TYR B 58 43.132 31.685 27.042 1.00 53.48 C ATOM 2011 O TYR B 58 44.317 31.940 27.129 1.00 53.22 O ATOM 2012 CB TYR B 58 42.424 29.923 25.447 1.00 54.17 C ATOM 2013 CG TYR B 58 43.766 29.749 24.794 1.00 55.41 C ATOM 2014 CD1 TYR B 58 44.425 28.524 24.901 1.00 55.52 C ATOM 2015 CD2 TYR B 58 44.353 30.806 24.089 1.00 55.85 C ATOM 2016 CE1 TYR B 58 45.671 28.348 24.304 1.00 56.08 C ATOM 2017 CE2 TYR B 58 45.605 30.631 23.488 1.00 56.67 C ATOM 2018 CZ TYR B 58 46.265 29.400 23.595 1.00 56.58 C ATOM 2019 OH TYR B 58 47.499 29.225 23.004 1.00 57.66 O ATOM 0 H TYR B 58 40.573 29.704 27.114 1.00 53.28 H new ATOM 0 HA TYR B 58 43.347 29.567 27.362 1.00 53.59 H new ATOM 0 HB2 TYR B 58 41.835 29.011 25.344 1.00 54.17 H new ATOM 0 HB3 TYR B 58 41.867 30.720 24.954 1.00 54.17 H new ATOM 0 HD1 TYR B 58 43.969 27.712 25.447 1.00 55.52 H new ATOM 0 HD2 TYR B 58 43.842 31.754 24.009 1.00 55.85 H new ATOM 0 HE1 TYR B 58 46.180 27.399 24.388 1.00 56.08 H new ATOM 0 HE2 TYR B 58 46.061 31.444 22.943 1.00 56.67 H new ATOM 0 HH TYR B 58 47.766 30.053 22.552 1.00 57.66 H new ATOM 2029 N SER B 59 42.232 32.613 27.034 1.00 54.11 N ATOM 2030 CA SER B 59 42.621 34.041 27.133 1.00 55.21 C ATOM 2031 C SER B 59 42.932 34.386 28.594 1.00 55.26 C ATOM 2032 O SER B 59 43.626 35.340 28.877 1.00 55.74 O ATOM 2033 CB SER B 59 41.464 34.892 26.604 1.00 54.87 C ATOM 2034 OG SER B 59 41.646 35.107 25.211 1.00 55.97 O ATOM 0 H SER B 59 41.229 32.445 26.962 1.00 54.11 H new ATOM 0 HA SER B 59 43.514 34.240 26.541 1.00 55.21 H new ATOM 0 HB2 SER B 59 40.514 34.390 26.786 1.00 54.87 H new ATOM 0 HB3 SER B 59 41.427 35.846 27.130 1.00 54.87 H new ATOM 0 HG SER B 59 40.907 35.650 24.865 1.00 55.97 H new ATOM 2040 N ARG B 60 42.434 33.616 29.523 1.00 56.15 N ATOM 2041 CA ARG B 60 42.720 33.908 30.958 1.00 56.48 C ATOM 2042 C ARG B 60 44.085 33.326 31.331 1.00 57.06 C ATOM 2043 O ARG B 60 44.863 33.938 32.035 1.00 57.59 O ATOM 2044 CB ARG B 60 41.641 33.273 31.841 1.00 56.67 C ATOM 2045 CG ARG B 60 40.294 33.984 31.626 1.00 56.97 C ATOM 2046 CD ARG B 60 39.367 33.715 32.819 1.00 57.03 C ATOM 2047 NE ARG B 60 37.937 33.837 32.386 1.00 57.35 N ATOM 2048 CZ ARG B 60 37.502 34.902 31.766 1.00 57.17 C ATOM 2049 NH1 ARG B 60 38.248 35.968 31.677 1.00 57.40 N ATOM 2050 NH2 ARG B 60 36.289 34.919 31.283 1.00 57.40 N ATOM 0 H ARG B 60 41.844 32.801 29.353 1.00 56.15 H new ATOM 0 HA ARG B 60 42.724 34.987 31.112 1.00 56.48 H new ATOM 0 HB2 ARG B 60 41.543 32.214 31.604 1.00 56.67 H new ATOM 0 HB3 ARG B 60 41.933 33.339 32.889 1.00 56.67 H new ATOM 0 HG2 ARG B 60 40.453 35.056 31.512 1.00 56.97 H new ATOM 0 HG3 ARG B 60 39.829 33.631 30.706 1.00 56.97 H new ATOM 0 HD2 ARG B 60 39.552 32.718 33.218 1.00 57.03 H new ATOM 0 HD3 ARG B 60 39.576 34.423 33.621 1.00 57.03 H new ATOM 0 HE ARG B 60 37.290 33.073 32.579 1.00 57.35 H new ATOM 0 HH11 ARG B 60 39.179 35.975 32.093 1.00 57.40 H new ATOM 0 HH12 ARG B 60 37.900 36.795 31.191 1.00 57.40 H new ATOM 0 HH21 ARG B 60 35.686 34.104 31.390 1.00 57.40 H new ATOM 0 HH22 ARG B 60 35.945 35.748 30.798 1.00 57.40 H new ATOM 2064 N GLN B 61 44.377 32.142 30.868 1.00 57.55 N ATOM 2065 CA GLN B 61 45.687 31.511 31.197 1.00 57.41 C ATOM 2066 C GLN B 61 46.815 32.231 30.455 1.00 57.21 C ATOM 2067 O GLN B 61 47.825 32.587 31.029 1.00 57.39 O ATOM 2068 CB GLN B 61 45.660 30.043 30.763 1.00 57.31 C ATOM 2069 CG GLN B 61 46.835 29.299 31.401 1.00 57.11 C ATOM 2070 CD GLN B 61 47.029 27.954 30.699 1.00 56.91 C ATOM 2071 OE1 GLN B 61 46.163 27.570 29.802 1.00 57.16 O flip ATOM 2072 NE2 GLN B 61 47.978 27.245 30.970 1.00 55.54 N flip ATOM 0 H GLN B 61 43.764 31.583 30.275 1.00 57.55 H new ATOM 0 HA GLN B 61 45.860 31.582 32.271 1.00 57.41 H new ATOM 0 HB2 GLN B 61 44.719 29.582 31.062 1.00 57.31 H new ATOM 0 HB3 GLN B 61 45.718 29.973 29.677 1.00 57.31 H new ATOM 0 HG2 GLN B 61 47.743 29.897 31.323 1.00 57.11 H new ATOM 0 HG3 GLN B 61 46.647 29.143 32.463 1.00 57.11 H new ATOM 0 HE21 GLN B 61 48.655 27.545 31.671 1.00 55.54 H new ATOM 0 HE22 GLN B 61 48.097 26.350 30.496 1.00 55.54 H new ATOM 2081 N HIS B 62 46.656 32.429 29.178 1.00 56.89 N ATOM 2082 CA HIS B 62 47.717 33.103 28.380 1.00 57.07 C ATOM 2083 C HIS B 62 47.671 34.616 28.588 1.00 57.46 C ATOM 2084 O HIS B 62 48.692 35.272 28.614 1.00 57.24 O ATOM 2085 CB HIS B 62 47.484 32.792 26.902 1.00 57.39 C ATOM 2086 CG HIS B 62 47.795 31.343 26.659 1.00 57.83 C ATOM 2087 ND1 HIS B 62 49.071 30.823 26.820 1.00 57.71 N ATOM 2088 CD2 HIS B 62 47.000 30.284 26.297 1.00 57.63 C ATOM 2089 CE1 HIS B 62 49.007 29.505 26.561 1.00 57.29 C ATOM 2090 NE2 HIS B 62 47.769 29.131 26.237 1.00 57.64 N ATOM 0 H HIS B 62 45.830 32.151 28.648 1.00 56.89 H new ATOM 0 HA HIS B 62 48.693 32.739 28.702 1.00 57.07 H new ATOM 0 HB2 HIS B 62 46.451 33.007 26.629 1.00 57.39 H new ATOM 0 HB3 HIS B 62 48.117 33.424 26.279 1.00 57.39 H new ATOM 0 HD2 HIS B 62 45.941 30.340 26.091 1.00 57.63 H new ATOM 0 HE1 HIS B 62 49.852 28.834 26.609 1.00 57.29 H new ATOM 0 HE2 HIS B 62 47.453 28.192 25.995 1.00 57.64 H new ATOM 2098 N ASN B 63 46.500 35.175 28.712 1.00 57.19 N ATOM 2099 CA ASN B 63 46.389 36.651 28.889 1.00 57.15 C ATOM 2100 C ASN B 63 46.968 37.341 27.655 1.00 57.27 C ATOM 2101 O ASN B 63 48.031 36.998 27.178 1.00 57.68 O ATOM 2102 CB ASN B 63 47.144 37.103 30.135 1.00 56.97 C ATOM 2103 CG ASN B 63 46.859 36.138 31.287 1.00 57.45 C ATOM 2104 OD1 ASN B 63 47.494 35.109 31.404 1.00 56.92 O ATOM 2105 ND2 ASN B 63 45.924 36.430 32.148 1.00 56.37 N ATOM 0 H ASN B 63 45.612 34.673 28.698 1.00 57.19 H new ATOM 0 HA ASN B 63 45.339 36.919 29.010 1.00 57.15 H new ATOM 0 HB2 ASN B 63 48.214 37.136 29.932 1.00 56.97 H new ATOM 0 HB3 ASN B 63 46.840 38.113 30.410 1.00 56.97 H new ATOM 0 HD21 ASN B 63 45.725 35.794 32.920 1.00 56.37 H new ATOM 0 HD22 ASN B 63 45.391 37.294 32.049 1.00 56.37 H new ATOM 2112 N LEU B 64 46.259 38.298 27.123 1.00 57.25 N ATOM 2113 CA LEU B 64 46.726 39.016 25.900 1.00 57.09 C ATOM 2114 C LEU B 64 46.690 40.526 26.169 1.00 57.50 C ATOM 2115 O LEU B 64 47.712 41.183 26.216 1.00 58.07 O ATOM 2116 CB LEU B 64 45.797 38.676 24.705 1.00 56.70 C ATOM 2117 CG LEU B 64 45.191 37.249 24.824 1.00 56.31 C ATOM 2118 CD1 LEU B 64 46.298 36.167 24.938 1.00 54.93 C ATOM 2119 CD2 LEU B 64 44.207 37.164 26.026 1.00 55.41 C ATOM 0 H LEU B 64 45.362 38.619 27.488 1.00 57.25 H new ATOM 0 HA LEU B 64 47.743 38.707 25.656 1.00 57.09 H new ATOM 0 HB2 LEU B 64 44.991 39.408 24.653 1.00 56.70 H new ATOM 0 HB3 LEU B 64 46.360 38.754 23.775 1.00 56.70 H new ATOM 0 HG LEU B 64 44.632 37.052 23.909 1.00 56.31 H new ATOM 0 HD11 LEU B 64 45.837 35.182 25.019 1.00 54.93 H new ATOM 0 HD12 LEU B 64 46.931 36.199 24.051 1.00 54.93 H new ATOM 0 HD13 LEU B 64 46.904 36.358 25.824 1.00 54.93 H new ATOM 0 HD21 LEU B 64 43.796 36.157 26.089 1.00 55.41 H new ATOM 0 HD22 LEU B 64 44.739 37.397 26.949 1.00 55.41 H new ATOM 0 HD23 LEU B 64 43.396 37.879 25.884 1.00 55.41 H new ATOM 2131 N ASN B 65 45.521 41.078 26.346 1.00 56.51 N ATOM 2132 CA ASN B 65 45.419 42.540 26.611 1.00 56.36 C ATOM 2133 C ASN B 65 46.041 42.855 27.973 1.00 56.60 C ATOM 2134 O ASN B 65 46.811 43.799 28.046 1.00 56.21 O ATOM 2135 CB ASN B 65 43.946 42.954 26.612 1.00 56.30 C ATOM 2136 CG ASN B 65 43.234 42.312 25.420 1.00 56.56 C ATOM 2137 OD1 ASN B 65 43.307 41.115 25.226 1.00 56.82 O ATOM 2138 ND2 ASN B 65 42.542 43.063 24.607 1.00 56.36 N ATOM 2139 OXT ASN B 65 45.737 42.148 28.919 1.00 56.16 O ATOM 0 H ASN B 65 44.632 40.579 26.318 1.00 56.51 H new ATOM 0 HA ASN B 65 45.950 43.090 25.834 1.00 56.36 H new ATOM 0 HB2 ASN B 65 43.471 42.644 27.543 1.00 56.30 H new ATOM 0 HB3 ASN B 65 43.862 44.039 26.557 1.00 56.30 H new ATOM 0 HD21 ASN B 65 42.063 42.645 23.809 1.00 56.36 H new ATOM 0 HD22 ASN B 65 42.480 44.068 24.769 1.00 56.36 H new TER 2146 ASN B 65