USER MOD reduce.3.24.130724 H: found=0, std=0, add=1267, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1268 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 66 MET CE :methyl -112:sc= -3.59 (180deg=-8.17!) USER MOD Set 1.2: B 67 THR OG1 : rot 180:sc= -0.766 USER MOD Set 2.1: B 62 THR OG1 : rot -150:sc= -0.113 USER MOD Set 2.2: B 76 GLN : amide:sc= -0.639 X(o=-0.75,f=-1.2!) USER MOD Set 3.1: A 66 MET CE :methyl -118:sc= -4.76 (180deg=-10!) USER MOD Set 3.2: A 67 THR OG1 : rot 180:sc= -0.123 USER MOD Set 4.1: A 62 THR OG1 : rot 180:sc= -0.286 USER MOD Set 4.2: A 76 GLN : amide:sc= -1.83 K(o=-2.1,f=-3.4!) USER MOD Set 5.1: A 15 SER OG : rot -81:sc= 0.618 USER MOD Set 5.2: A 60 LYS NZ :NH3+ 159:sc= 0.494 (180deg=0) USER MOD Set 5.3: A 61 TYR OH : rot 7:sc= -0.0206 USER MOD Set 6.1: A 55 THR OG1 : rot -91:sc= 0.392 USER MOD Set 6.2: A 57 GLN : amide:sc= -2.66! C(o=-2.3!,f=-6.3!) USER MOD Set 7.1: A 51 ASN : amide:sc= -0.2 K(o=-2,f=-7.9!) USER MOD Set 7.2: A 54 GLN : amide:sc= -1.81 X(o=-2,f=-1.6) USER MOD Set 8.1: A 8 LYS NZ :NH3+ -168:sc= -0.0757 (180deg=0) USER MOD Set 8.2: B 50 MET CE :methyl -172:sc= -1.06 (180deg=-1.64) USER MOD Single : A 4 THR OG1 : rot 11:sc= 0.693 USER MOD Single : A 6 SER OG : rot 106:sc= 0.0602 USER MOD Single : A 12 MET CE :methyl -149:sc= -4.3! (180deg=-5.46!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= -0.38 (180deg=-0.38) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= -0.0701 X(o=-0.07,f=0) USER MOD Single : A 22 GLN : amide:sc= -0.0506 X(o=-0.051,f=-0.27) USER MOD Single : A 27 THR OG1 : rot -8:sc= 0.17 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot -21:sc= 0.28 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0.0229 USER MOD Single : A 46 THR OG1 : rot 60:sc= 0.667 USER MOD Single : A 49 MET CE :methyl 147:sc= -3.62 (180deg=-7.12!) USER MOD Single : A 50 MET CE :methyl -165:sc= -0.397 (180deg=-0.963) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 SER OG : rot -110:sc= -1.36 USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 4 THR OG1 : rot 29:sc= 0.441 USER MOD Single : B 6 SER OG : rot 93:sc= -0.125 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 MET CE :methyl 175:sc= -4.63! (180deg=-4.7!) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 SER OG : rot 180:sc= 0 USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 27 THR OG1 : rot -150:sc= -0.475 USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 42 SER OG : rot 36:sc= 0.143 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0.117 USER MOD Single : B 46 THR OG1 : rot 64:sc= 0.395 USER MOD Single : B 49 MET CE :methyl 171:sc= -1.77 (180deg=-2.31) USER MOD Single : B 51 ASN : amide:sc= -0.0131 X(o=-0.013,f=0) USER MOD Single : B 54 GLN : amide:sc= -1.93 K(o=-1.9,f=-1.4) USER MOD Single : B 55 THR OG1 : rot -86:sc= 0.571 USER MOD Single : B 57 GLN : amide:sc= -3.91! C(o=-3.9!,f=-8.8!) USER MOD Single : B 59 THR OG1 : rot 39:sc= 1.17 USER MOD Single : B 60 LYS NZ :NH3+ -151:sc= -0.223 (180deg=-0.928) USER MOD Single : B 61 TYR OH : rot 180:sc= 0 USER MOD Single : B 68 ASN : amide:sc= -0.0769 X(o=-0.077,f=-0.0069) USER MOD Single : B 69 GLN : amide:sc= -4.21! K(o=-4.2!,f=-1.7) USER MOD Single : B 74 SER OG : rot 110:sc= -0.638 USER MOD ----------------------------------------------------------------- ATOM 43 N THR A 4 5.291 6.042 -6.969 1.00 55.11 N ATOM 44 CA THR A 4 6.250 6.955 -7.578 1.00 61.02 C ATOM 45 C THR A 4 5.748 8.393 -7.526 1.00 34.12 C ATOM 46 O THR A 4 4.552 8.639 -7.367 1.00 24.32 O ATOM 47 CB THR A 4 6.537 6.575 -9.042 1.00 65.03 C ATOM 48 OG1 THR A 4 6.204 5.201 -9.266 1.00 41.45 O ATOM 49 CG2 THR A 4 8.000 6.810 -9.386 1.00 24.23 C ATOM 0 HA THR A 4 7.173 6.874 -7.003 1.00 61.02 H new ATOM 0 HB THR A 4 5.923 7.207 -9.685 1.00 65.03 H new ATOM 0 HG1 THR A 4 5.712 4.854 -8.493 1.00 41.45 H new ATOM 0 HG21 THR A 4 8.178 6.534 -10.425 1.00 24.23 H new ATOM 0 HG22 THR A 4 8.243 7.863 -9.243 1.00 24.23 H new ATOM 0 HG23 THR A 4 8.629 6.201 -8.736 1.00 24.23 H new ATOM 57 N ILE A 5 6.669 9.342 -7.662 1.00 21.33 N ATOM 58 CA ILE A 5 6.319 10.757 -7.633 1.00 1.35 C ATOM 59 C ILE A 5 5.187 11.062 -8.608 1.00 62.20 C ATOM 60 O ILE A 5 4.226 11.751 -8.263 1.00 53.40 O ATOM 61 CB ILE A 5 7.530 11.643 -7.977 1.00 73.54 C ATOM 62 CG1 ILE A 5 8.713 11.302 -7.069 1.00 25.20 C ATOM 63 CG2 ILE A 5 7.163 13.114 -7.847 1.00 34.15 C ATOM 64 CD1 ILE A 5 9.982 10.975 -7.826 1.00 64.05 C ATOM 0 H ILE A 5 7.663 9.156 -7.793 1.00 21.33 H new ATOM 0 HA ILE A 5 5.992 10.981 -6.618 1.00 1.35 H new ATOM 0 HB ILE A 5 7.821 11.450 -9.010 1.00 73.54 H new ATOM 0 HG12 ILE A 5 8.904 12.143 -6.403 1.00 25.20 H new ATOM 0 HG13 ILE A 5 8.445 10.452 -6.441 1.00 25.20 H new ATOM 0 HG21 ILE A 5 8.029 13.728 -8.093 1.00 34.15 H new ATOM 0 HG22 ILE A 5 6.347 13.347 -8.531 1.00 34.15 H new ATOM 0 HG23 ILE A 5 6.850 13.322 -6.824 1.00 34.15 H new ATOM 0 HD11 ILE A 5 10.778 10.743 -7.119 1.00 64.05 H new ATOM 0 HD12 ILE A 5 9.809 10.114 -8.472 1.00 64.05 H new ATOM 0 HD13 ILE A 5 10.274 11.832 -8.433 1.00 64.05 H new ATOM 76 N SER A 6 5.305 10.544 -9.826 1.00 63.44 N ATOM 77 CA SER A 6 4.292 10.763 -10.852 1.00 34.41 C ATOM 78 C SER A 6 2.903 10.411 -10.327 1.00 2.22 C ATOM 79 O SER A 6 1.943 11.152 -10.538 1.00 53.23 O ATOM 80 CB SER A 6 4.607 9.929 -12.095 1.00 71.40 C ATOM 81 OG SER A 6 3.756 8.799 -12.180 1.00 42.32 O ATOM 0 H SER A 6 6.092 9.969 -10.127 1.00 63.44 H new ATOM 0 HA SER A 6 4.303 11.819 -11.120 1.00 34.41 H new ATOM 0 HB2 SER A 6 4.491 10.543 -12.988 1.00 71.40 H new ATOM 0 HB3 SER A 6 5.647 9.604 -12.065 1.00 71.40 H new ATOM 0 HG SER A 6 3.086 8.946 -12.880 1.00 42.32 H new ATOM 87 N GLU A 7 2.806 9.275 -9.644 1.00 61.11 N ATOM 88 CA GLU A 7 1.534 8.824 -9.091 1.00 23.42 C ATOM 89 C GLU A 7 0.980 9.844 -8.100 1.00 40.04 C ATOM 90 O GLU A 7 -0.233 9.986 -7.949 1.00 33.31 O ATOM 91 CB GLU A 7 1.704 7.468 -8.403 1.00 72.32 C ATOM 92 CG GLU A 7 1.865 6.310 -9.373 1.00 53.22 C ATOM 93 CD GLU A 7 0.534 5.744 -9.830 1.00 62.25 C ATOM 94 OE1 GLU A 7 -0.054 4.933 -9.084 1.00 50.32 O ATOM 95 OE2 GLU A 7 0.081 6.111 -10.935 1.00 43.33 O ATOM 0 H GLU A 7 3.592 8.651 -9.460 1.00 61.11 H new ATOM 0 HA GLU A 7 0.826 8.720 -9.913 1.00 23.42 H new ATOM 0 HB2 GLU A 7 2.576 7.508 -7.750 1.00 72.32 H new ATOM 0 HB3 GLU A 7 0.838 7.281 -7.768 1.00 72.32 H new ATOM 0 HG2 GLU A 7 2.431 6.645 -10.242 1.00 53.22 H new ATOM 0 HG3 GLU A 7 2.448 5.521 -8.898 1.00 53.22 H new ATOM 102 N LYS A 8 1.879 10.552 -7.424 1.00 33.13 N ATOM 103 CA LYS A 8 1.483 11.560 -6.447 1.00 4.14 C ATOM 104 C LYS A 8 0.888 12.783 -7.138 1.00 74.14 C ATOM 105 O LYS A 8 0.322 13.661 -6.486 1.00 64.53 O ATOM 106 CB LYS A 8 2.685 11.976 -5.597 1.00 75.53 C ATOM 107 CG LYS A 8 3.585 10.816 -5.208 1.00 22.34 C ATOM 108 CD LYS A 8 4.568 11.213 -4.118 1.00 11.10 C ATOM 109 CE LYS A 8 4.413 10.338 -2.884 1.00 11.21 C ATOM 110 NZ LYS A 8 5.730 9.987 -2.284 1.00 5.33 N ATOM 0 H LYS A 8 2.887 10.446 -7.535 1.00 33.13 H new ATOM 0 HA LYS A 8 0.722 11.124 -5.800 1.00 4.14 H new ATOM 0 HB2 LYS A 8 3.272 12.711 -6.148 1.00 75.53 H new ATOM 0 HB3 LYS A 8 2.327 12.467 -4.692 1.00 75.53 H new ATOM 0 HG2 LYS A 8 2.975 9.981 -4.863 1.00 22.34 H new ATOM 0 HG3 LYS A 8 4.133 10.470 -6.084 1.00 22.34 H new ATOM 0 HD2 LYS A 8 5.587 11.132 -4.498 1.00 11.10 H new ATOM 0 HD3 LYS A 8 4.411 12.257 -3.847 1.00 11.10 H new ATOM 0 HE2 LYS A 8 3.804 10.858 -2.144 1.00 11.21 H new ATOM 0 HE3 LYS A 8 3.881 9.425 -3.151 1.00 11.21 H new ATOM 0 HZ1 LYS A 8 5.600 9.235 -1.578 1.00 5.33 H new ATOM 0 HZ2 LYS A 8 6.374 9.654 -3.030 1.00 5.33 H new ATOM 0 HZ3 LYS A 8 6.137 10.827 -1.825 1.00 5.33 H new ATOM 124 N ILE A 9 1.019 12.833 -8.459 1.00 15.20 N ATOM 125 CA ILE A 9 0.492 13.947 -9.237 1.00 41.10 C ATOM 126 C ILE A 9 -0.683 13.506 -10.103 1.00 71.21 C ATOM 127 O ILE A 9 -1.288 14.315 -10.807 1.00 5.21 O ATOM 128 CB ILE A 9 1.576 14.567 -10.138 1.00 42.44 C ATOM 129 CG1 ILE A 9 2.885 14.728 -9.362 1.00 3.22 C ATOM 130 CG2 ILE A 9 1.108 15.909 -10.683 1.00 73.14 C ATOM 131 CD1 ILE A 9 4.005 15.324 -10.185 1.00 55.24 C ATOM 0 H ILE A 9 1.486 12.115 -9.013 1.00 15.20 H new ATOM 0 HA ILE A 9 0.152 14.697 -8.523 1.00 41.10 H new ATOM 0 HB ILE A 9 1.755 13.897 -10.979 1.00 42.44 H new ATOM 0 HG12 ILE A 9 2.707 15.361 -8.493 1.00 3.22 H new ATOM 0 HG13 ILE A 9 3.199 13.753 -8.988 1.00 3.22 H new ATOM 0 HG21 ILE A 9 1.885 16.335 -11.318 1.00 73.14 H new ATOM 0 HG22 ILE A 9 0.199 15.767 -11.267 1.00 73.14 H new ATOM 0 HG23 ILE A 9 0.905 16.587 -9.854 1.00 73.14 H new ATOM 0 HD11 ILE A 9 4.902 15.409 -9.571 1.00 55.24 H new ATOM 0 HD12 ILE A 9 4.210 14.680 -11.040 1.00 55.24 H new ATOM 0 HD13 ILE A 9 3.711 16.313 -10.537 1.00 55.24 H new ATOM 143 N VAL A 10 -1.002 12.217 -10.046 1.00 4.30 N ATOM 144 CA VAL A 10 -2.106 11.667 -10.823 1.00 43.34 C ATOM 145 C VAL A 10 -3.363 11.530 -9.971 1.00 34.04 C ATOM 146 O VAL A 10 -4.434 12.012 -10.343 1.00 71.51 O ATOM 147 CB VAL A 10 -1.748 10.291 -11.413 1.00 22.34 C ATOM 148 CG1 VAL A 10 -2.827 9.826 -12.380 1.00 23.30 C ATOM 149 CG2 VAL A 10 -0.391 10.344 -12.101 1.00 51.14 C ATOM 0 H VAL A 10 -0.511 11.534 -9.469 1.00 4.30 H new ATOM 0 HA VAL A 10 -2.296 12.365 -11.638 1.00 43.34 H new ATOM 0 HB VAL A 10 -1.690 9.570 -10.598 1.00 22.34 H new ATOM 0 HG11 VAL A 10 -2.556 8.852 -12.787 1.00 23.30 H new ATOM 0 HG12 VAL A 10 -3.778 9.748 -11.854 1.00 23.30 H new ATOM 0 HG13 VAL A 10 -2.921 10.545 -13.194 1.00 23.30 H new ATOM 0 HG21 VAL A 10 -0.153 9.363 -12.513 1.00 51.14 H new ATOM 0 HG22 VAL A 10 -0.420 11.078 -12.906 1.00 51.14 H new ATOM 0 HG23 VAL A 10 0.373 10.629 -11.377 1.00 51.14 H new ATOM 159 N LEU A 11 -3.225 10.872 -8.826 1.00 33.50 N ATOM 160 CA LEU A 11 -4.350 10.671 -7.919 1.00 22.11 C ATOM 161 C LEU A 11 -5.036 11.996 -7.599 1.00 23.40 C ATOM 162 O LEU A 11 -6.250 12.128 -7.745 1.00 73.14 O ATOM 163 CB LEU A 11 -3.876 10.004 -6.626 1.00 73.11 C ATOM 164 CG LEU A 11 -2.606 10.583 -6.000 1.00 24.02 C ATOM 165 CD1 LEU A 11 -2.956 11.528 -4.861 1.00 11.31 C ATOM 166 CD2 LEU A 11 -1.698 9.464 -5.508 1.00 62.13 C ATOM 0 H LEU A 11 -2.346 10.468 -8.503 1.00 33.50 H new ATOM 0 HA LEU A 11 -5.071 10.020 -8.413 1.00 22.11 H new ATOM 0 HB2 LEU A 11 -4.680 10.066 -5.893 1.00 73.11 H new ATOM 0 HB3 LEU A 11 -3.709 8.946 -6.827 1.00 73.11 H new ATOM 0 HG LEU A 11 -2.072 11.149 -6.763 1.00 24.02 H new ATOM 0 HD11 LEU A 11 -2.040 11.930 -4.428 1.00 11.31 H new ATOM 0 HD12 LEU A 11 -3.567 12.346 -5.242 1.00 11.31 H new ATOM 0 HD13 LEU A 11 -3.512 10.986 -4.096 1.00 11.31 H new ATOM 0 HD21 LEU A 11 -0.799 9.893 -5.065 1.00 62.13 H new ATOM 0 HD22 LEU A 11 -2.224 8.871 -4.759 1.00 62.13 H new ATOM 0 HD23 LEU A 11 -1.420 8.825 -6.347 1.00 62.13 H new ATOM 178 N MET A 12 -4.247 12.974 -7.166 1.00 51.31 N ATOM 179 CA MET A 12 -4.778 14.290 -6.829 1.00 35.35 C ATOM 180 C MET A 12 -5.334 14.984 -8.068 1.00 14.33 C ATOM 181 O MET A 12 -6.377 15.635 -8.010 1.00 15.55 O ATOM 182 CB MET A 12 -3.689 15.155 -6.191 1.00 43.44 C ATOM 183 CG MET A 12 -2.339 15.037 -6.879 1.00 42.04 C ATOM 184 SD MET A 12 -1.208 16.364 -6.419 1.00 23.34 S ATOM 185 CE MET A 12 -0.874 17.095 -8.019 1.00 1.34 C ATOM 0 H MET A 12 -3.239 12.880 -7.040 1.00 51.31 H new ATOM 0 HA MET A 12 -5.590 14.155 -6.114 1.00 35.35 H new ATOM 0 HB2 MET A 12 -4.007 16.197 -6.209 1.00 43.44 H new ATOM 0 HB3 MET A 12 -3.580 14.873 -5.144 1.00 43.44 H new ATOM 0 HG2 MET A 12 -1.889 14.077 -6.626 1.00 42.04 H new ATOM 0 HG3 MET A 12 -2.484 15.046 -7.959 1.00 42.04 H new ATOM 0 HE1 MET A 12 0.135 17.506 -8.027 1.00 1.34 H new ATOM 0 HE2 MET A 12 -0.962 16.332 -8.793 1.00 1.34 H new ATOM 0 HE3 MET A 12 -1.592 17.892 -8.212 1.00 1.34 H new ATOM 195 N ARG A 13 -4.632 14.842 -9.187 1.00 72.22 N ATOM 196 CA ARG A 13 -5.055 15.457 -10.439 1.00 43.34 C ATOM 197 C ARG A 13 -6.499 15.088 -10.764 1.00 25.20 C ATOM 198 O ARG A 13 -7.302 15.944 -11.139 1.00 32.00 O ATOM 199 CB ARG A 13 -4.136 15.023 -11.581 1.00 43.40 C ATOM 200 CG ARG A 13 -4.646 15.420 -12.957 1.00 23.54 C ATOM 201 CD ARG A 13 -3.504 15.595 -13.945 1.00 1.24 C ATOM 202 NE ARG A 13 -3.291 14.398 -14.755 1.00 13.15 N ATOM 203 CZ ARG A 13 -4.150 13.969 -15.673 1.00 62.43 C ATOM 204 NH1 ARG A 13 -5.273 14.637 -15.897 1.00 34.04 N ATOM 205 NH2 ARG A 13 -3.886 12.871 -16.369 1.00 3.12 N ATOM 0 H ARG A 13 -3.767 14.306 -9.252 1.00 72.22 H new ATOM 0 HA ARG A 13 -4.992 16.539 -10.324 1.00 43.34 H new ATOM 0 HB2 ARG A 13 -3.149 15.460 -11.428 1.00 43.40 H new ATOM 0 HB3 ARG A 13 -4.014 13.940 -11.546 1.00 43.40 H new ATOM 0 HG2 ARG A 13 -5.334 14.658 -13.325 1.00 23.54 H new ATOM 0 HG3 ARG A 13 -5.210 16.350 -12.883 1.00 23.54 H new ATOM 0 HD2 ARG A 13 -3.717 16.441 -14.598 1.00 1.24 H new ATOM 0 HD3 ARG A 13 -2.589 15.833 -13.403 1.00 1.24 H new ATOM 0 HE ARG A 13 -2.436 13.862 -14.608 1.00 13.15 H new ATOM 0 HH11 ARG A 13 -5.479 15.482 -15.364 1.00 34.04 H new ATOM 0 HH12 ARG A 13 -5.931 14.306 -16.602 1.00 34.04 H new ATOM 0 HH21 ARG A 13 -3.023 12.355 -16.200 1.00 3.12 H new ATOM 0 HH22 ARG A 13 -4.546 12.543 -17.074 1.00 3.12 H new ATOM 219 N LYS A 14 -6.824 13.808 -10.620 1.00 43.14 N ATOM 220 CA LYS A 14 -8.171 13.324 -10.899 1.00 24.33 C ATOM 221 C LYS A 14 -9.172 13.896 -9.900 1.00 14.43 C ATOM 222 O LYS A 14 -10.361 14.010 -10.195 1.00 20.12 O ATOM 223 CB LYS A 14 -8.205 11.795 -10.850 1.00 73.54 C ATOM 224 CG LYS A 14 -8.309 11.146 -12.220 1.00 21.53 C ATOM 225 CD LYS A 14 -6.939 10.929 -12.840 1.00 2.42 C ATOM 226 CE LYS A 14 -6.149 9.866 -12.090 1.00 1.21 C ATOM 227 NZ LYS A 14 -5.727 8.755 -12.986 1.00 3.32 N ATOM 0 H LYS A 14 -6.173 13.086 -10.311 1.00 43.14 H new ATOM 0 HA LYS A 14 -8.450 13.657 -11.899 1.00 24.33 H new ATOM 0 HB2 LYS A 14 -7.303 11.435 -10.354 1.00 73.54 H new ATOM 0 HB3 LYS A 14 -9.052 11.478 -10.241 1.00 73.54 H new ATOM 0 HG2 LYS A 14 -8.825 10.190 -12.132 1.00 21.53 H new ATOM 0 HG3 LYS A 14 -8.911 11.774 -12.876 1.00 21.53 H new ATOM 0 HD2 LYS A 14 -7.053 10.631 -13.882 1.00 2.42 H new ATOM 0 HD3 LYS A 14 -6.384 11.867 -12.836 1.00 2.42 H new ATOM 0 HE2 LYS A 14 -5.269 10.321 -11.636 1.00 1.21 H new ATOM 0 HE3 LYS A 14 -6.757 9.467 -11.278 1.00 1.21 H new ATOM 0 HZ1 LYS A 14 -5.192 8.051 -12.438 1.00 3.32 H new ATOM 0 HZ2 LYS A 14 -6.568 8.305 -13.400 1.00 3.32 H new ATOM 0 HZ3 LYS A 14 -5.126 9.132 -13.747 1.00 3.32 H new ATOM 241 N SER A 15 -8.682 14.256 -8.718 1.00 0.52 N ATOM 242 CA SER A 15 -9.534 14.815 -7.675 1.00 34.52 C ATOM 243 C SER A 15 -10.175 16.119 -8.138 1.00 4.13 C ATOM 244 O SER A 15 -11.310 16.428 -7.777 1.00 42.32 O ATOM 245 CB SER A 15 -8.724 15.056 -6.400 1.00 23.33 C ATOM 246 OG SER A 15 -8.377 16.424 -6.267 1.00 1.04 O ATOM 0 H SER A 15 -7.699 14.170 -8.459 1.00 0.52 H new ATOM 0 HA SER A 15 -10.326 14.096 -7.463 1.00 34.52 H new ATOM 0 HB2 SER A 15 -9.302 14.738 -5.532 1.00 23.33 H new ATOM 0 HB3 SER A 15 -7.819 14.448 -6.420 1.00 23.33 H new ATOM 0 HG SER A 15 -7.594 16.618 -6.823 1.00 1.04 H new ATOM 252 N GLU A 16 -9.437 16.882 -8.940 1.00 24.43 N ATOM 253 CA GLU A 16 -9.933 18.154 -9.452 1.00 22.34 C ATOM 254 C GLU A 16 -10.834 17.938 -10.664 1.00 32.11 C ATOM 255 O GLU A 16 -11.502 18.864 -11.128 1.00 43.32 O ATOM 256 CB GLU A 16 -8.765 19.067 -9.828 1.00 13.35 C ATOM 257 CG GLU A 16 -9.152 20.532 -9.950 1.00 62.31 C ATOM 258 CD GLU A 16 -9.563 21.139 -8.624 1.00 2.34 C ATOM 259 OE1 GLU A 16 -9.375 20.476 -7.582 1.00 14.23 O ATOM 260 OE2 GLU A 16 -10.074 22.279 -8.627 1.00 72.53 O ATOM 0 H GLU A 16 -8.495 16.641 -9.248 1.00 24.43 H new ATOM 0 HA GLU A 16 -10.519 18.630 -8.666 1.00 22.34 H new ATOM 0 HB2 GLU A 16 -7.981 18.968 -9.077 1.00 13.35 H new ATOM 0 HB3 GLU A 16 -8.343 18.731 -10.775 1.00 13.35 H new ATOM 0 HG2 GLU A 16 -8.311 21.093 -10.357 1.00 62.31 H new ATOM 0 HG3 GLU A 16 -9.973 20.629 -10.660 1.00 62.31 H new ATOM 267 N TYR A 17 -10.849 16.711 -11.172 1.00 34.24 N ATOM 268 CA TYR A 17 -11.667 16.374 -12.331 1.00 3.21 C ATOM 269 C TYR A 17 -11.280 17.225 -13.537 1.00 63.52 C ATOM 270 O TYR A 17 -12.134 17.626 -14.328 1.00 30.34 O ATOM 271 CB TYR A 17 -13.150 16.568 -12.010 1.00 21.42 C ATOM 272 CG TYR A 17 -13.596 15.854 -10.755 1.00 23.24 C ATOM 273 CD1 TYR A 17 -13.793 14.478 -10.745 1.00 22.22 C ATOM 274 CD2 TYR A 17 -13.819 16.554 -9.575 1.00 54.02 C ATOM 275 CE1 TYR A 17 -14.202 13.823 -9.601 1.00 21.13 C ATOM 276 CE2 TYR A 17 -14.226 15.907 -8.425 1.00 50.43 C ATOM 277 CZ TYR A 17 -14.416 14.541 -8.443 1.00 22.22 C ATOM 278 OH TYR A 17 -14.822 13.892 -7.300 1.00 41.24 O ATOM 0 H TYR A 17 -10.304 15.933 -10.800 1.00 34.24 H new ATOM 0 HA TYR A 17 -11.490 15.327 -12.576 1.00 3.21 H new ATOM 0 HB2 TYR A 17 -13.354 17.633 -11.904 1.00 21.42 H new ATOM 0 HB3 TYR A 17 -13.745 16.212 -12.851 1.00 21.42 H new ATOM 0 HD1 TYR A 17 -13.623 13.911 -11.649 1.00 22.22 H new ATOM 0 HD2 TYR A 17 -13.671 17.624 -9.557 1.00 54.02 H new ATOM 0 HE1 TYR A 17 -14.354 12.754 -9.613 1.00 21.13 H new ATOM 0 HE2 TYR A 17 -14.395 16.467 -7.517 1.00 50.43 H new ATOM 0 HH TYR A 17 -14.926 14.542 -6.574 1.00 41.24 H new ATOM 288 N LEU A 18 -9.986 17.496 -13.670 1.00 50.01 N ATOM 289 CA LEU A 18 -9.483 18.299 -14.779 1.00 55.21 C ATOM 290 C LEU A 18 -8.772 17.425 -15.807 1.00 11.42 C ATOM 291 O LEU A 18 -8.576 16.229 -15.590 1.00 23.51 O ATOM 292 CB LEU A 18 -8.529 19.377 -14.263 1.00 71.45 C ATOM 293 CG LEU A 18 -7.242 18.876 -13.607 1.00 20.12 C ATOM 294 CD1 LEU A 18 -6.195 18.557 -14.664 1.00 2.31 C ATOM 295 CD2 LEU A 18 -6.710 19.905 -12.621 1.00 52.43 C ATOM 0 H LEU A 18 -9.267 17.172 -13.024 1.00 50.01 H new ATOM 0 HA LEU A 18 -10.334 18.777 -15.263 1.00 55.21 H new ATOM 0 HB2 LEU A 18 -8.260 20.025 -15.097 1.00 71.45 H new ATOM 0 HB3 LEU A 18 -9.065 19.993 -13.541 1.00 71.45 H new ATOM 0 HG LEU A 18 -7.468 17.961 -13.059 1.00 20.12 H new ATOM 0 HD11 LEU A 18 -5.285 18.202 -14.180 1.00 2.31 H new ATOM 0 HD12 LEU A 18 -6.576 17.784 -15.332 1.00 2.31 H new ATOM 0 HD13 LEU A 18 -5.973 19.456 -15.239 1.00 2.31 H new ATOM 0 HD21 LEU A 18 -5.794 19.531 -12.164 1.00 52.43 H new ATOM 0 HD22 LEU A 18 -6.500 20.837 -13.146 1.00 52.43 H new ATOM 0 HD23 LEU A 18 -7.455 20.085 -11.846 1.00 52.43 H new ATOM 307 N SER A 19 -8.387 18.029 -16.925 1.00 75.14 N ATOM 308 CA SER A 19 -7.698 17.306 -17.987 1.00 42.32 C ATOM 309 C SER A 19 -6.271 17.817 -18.156 1.00 72.22 C ATOM 310 O SER A 19 -5.929 18.903 -17.688 1.00 2.13 O ATOM 311 CB SER A 19 -8.461 17.445 -19.307 1.00 3.34 C ATOM 312 OG SER A 19 -9.463 16.449 -19.425 1.00 61.02 O ATOM 0 H SER A 19 -8.540 19.018 -17.120 1.00 75.14 H new ATOM 0 HA SER A 19 -7.658 16.253 -17.708 1.00 42.32 H new ATOM 0 HB2 SER A 19 -8.918 18.433 -19.364 1.00 3.34 H new ATOM 0 HB3 SER A 19 -7.766 17.366 -20.143 1.00 3.34 H new ATOM 0 HG SER A 19 -9.937 16.561 -20.276 1.00 61.02 H new ATOM 318 N ARG A 20 -5.442 17.026 -18.830 1.00 71.01 N ATOM 319 CA ARG A 20 -4.050 17.395 -19.061 1.00 24.20 C ATOM 320 C ARG A 20 -3.953 18.792 -19.667 1.00 73.30 C ATOM 321 O ARG A 20 -2.973 19.505 -19.452 1.00 23.14 O ATOM 322 CB ARG A 20 -3.376 16.379 -19.983 1.00 14.35 C ATOM 323 CG ARG A 20 -2.462 15.407 -19.253 1.00 64.12 C ATOM 324 CD ARG A 20 -1.572 14.645 -20.223 1.00 52.12 C ATOM 325 NE ARG A 20 -2.020 13.267 -20.410 1.00 31.03 N ATOM 326 CZ ARG A 20 -1.691 12.524 -21.460 1.00 33.21 C ATOM 327 NH1 ARG A 20 -0.914 13.022 -22.413 1.00 13.10 N ATOM 328 NH2 ARG A 20 -2.138 11.279 -21.560 1.00 51.12 N ATOM 0 H ARG A 20 -5.710 16.125 -19.226 1.00 71.01 H new ATOM 0 HA ARG A 20 -3.536 17.397 -18.100 1.00 24.20 H new ATOM 0 HB2 ARG A 20 -4.144 15.815 -20.512 1.00 14.35 H new ATOM 0 HB3 ARG A 20 -2.797 16.913 -20.737 1.00 14.35 H new ATOM 0 HG2 ARG A 20 -1.843 15.953 -18.541 1.00 64.12 H new ATOM 0 HG3 ARG A 20 -3.063 14.702 -18.678 1.00 64.12 H new ATOM 0 HD2 ARG A 20 -1.563 15.157 -21.185 1.00 52.12 H new ATOM 0 HD3 ARG A 20 -0.547 14.646 -19.852 1.00 52.12 H new ATOM 0 HE ARG A 20 -2.618 12.853 -19.695 1.00 31.03 H new ATOM 0 HH11 ARG A 20 -0.567 13.979 -22.340 1.00 13.10 H new ATOM 0 HH12 ARG A 20 -0.663 12.448 -23.218 1.00 13.10 H new ATOM 0 HH21 ARG A 20 -2.735 10.891 -20.830 1.00 51.12 H new ATOM 0 HH22 ARG A 20 -1.884 10.709 -22.367 1.00 51.12 H new ATOM 342 N GLN A 21 -4.975 19.175 -20.426 1.00 33.24 N ATOM 343 CA GLN A 21 -5.003 20.485 -21.065 1.00 62.13 C ATOM 344 C GLN A 21 -5.421 21.566 -20.072 1.00 32.54 C ATOM 345 O GLN A 21 -4.939 22.696 -20.134 1.00 15.25 O ATOM 346 CB GLN A 21 -5.962 20.474 -22.257 1.00 31.45 C ATOM 347 CG GLN A 21 -6.006 21.792 -23.013 1.00 12.41 C ATOM 348 CD GLN A 21 -7.371 22.448 -22.960 1.00 73.14 C ATOM 349 OE1 GLN A 21 -7.506 23.594 -22.528 1.00 3.42 O ATOM 350 NE2 GLN A 21 -8.394 21.726 -23.403 1.00 2.12 N ATOM 0 H GLN A 21 -5.794 18.597 -20.613 1.00 33.24 H new ATOM 0 HA GLN A 21 -3.997 20.710 -21.419 1.00 62.13 H new ATOM 0 HB2 GLN A 21 -5.667 19.680 -22.943 1.00 31.45 H new ATOM 0 HB3 GLN A 21 -6.965 20.233 -21.904 1.00 31.45 H new ATOM 0 HG2 GLN A 21 -5.264 22.472 -22.595 1.00 12.41 H new ATOM 0 HG3 GLN A 21 -5.730 21.620 -24.053 1.00 12.41 H new ATOM 0 HE21 GLN A 21 -8.238 20.781 -23.752 1.00 2.12 H new ATOM 0 HE22 GLN A 21 -9.336 22.117 -23.394 1.00 2.12 H new ATOM 359 N GLN A 22 -6.317 21.208 -19.159 1.00 51.23 N ATOM 360 CA GLN A 22 -6.800 22.149 -18.154 1.00 0.45 C ATOM 361 C GLN A 22 -5.669 22.580 -17.225 1.00 51.31 C ATOM 362 O GLN A 22 -5.532 23.761 -16.904 1.00 43.21 O ATOM 363 CB GLN A 22 -7.933 21.522 -17.340 1.00 11.44 C ATOM 364 CG GLN A 22 -8.500 22.446 -16.275 1.00 2.14 C ATOM 365 CD GLN A 22 -10.003 22.309 -16.123 1.00 62.24 C ATOM 366 OE1 GLN A 22 -10.740 22.319 -17.109 1.00 71.22 O ATOM 367 NE2 GLN A 22 -10.464 22.181 -14.885 1.00 62.52 N ATOM 0 H GLN A 22 -6.723 20.275 -19.094 1.00 51.23 H new ATOM 0 HA GLN A 22 -7.179 23.031 -18.670 1.00 0.45 H new ATOM 0 HB2 GLN A 22 -8.735 21.226 -18.017 1.00 11.44 H new ATOM 0 HB3 GLN A 22 -7.567 20.613 -16.863 1.00 11.44 H new ATOM 0 HG2 GLN A 22 -8.021 22.230 -15.320 1.00 2.14 H new ATOM 0 HG3 GLN A 22 -8.257 23.478 -16.528 1.00 2.14 H new ATOM 0 HE21 GLN A 22 -9.816 22.178 -14.097 1.00 62.52 H new ATOM 0 HE22 GLN A 22 -11.466 22.086 -14.721 1.00 62.52 H new ATOM 376 N LEU A 23 -4.862 21.616 -16.796 1.00 1.25 N ATOM 377 CA LEU A 23 -3.743 21.896 -15.904 1.00 22.42 C ATOM 378 C LEU A 23 -2.587 22.539 -16.664 1.00 63.10 C ATOM 379 O LEU A 23 -1.962 23.483 -16.181 1.00 73.44 O ATOM 380 CB LEU A 23 -3.269 20.608 -15.228 1.00 64.12 C ATOM 381 CG LEU A 23 -2.213 20.773 -14.135 1.00 63.23 C ATOM 382 CD1 LEU A 23 -2.847 20.655 -12.758 1.00 72.12 C ATOM 383 CD2 LEU A 23 -1.107 19.742 -14.303 1.00 24.14 C ATOM 0 H LEU A 23 -4.962 20.634 -17.052 1.00 1.25 H new ATOM 0 HA LEU A 23 -4.086 22.595 -15.141 1.00 22.42 H new ATOM 0 HB2 LEU A 23 -4.136 20.108 -14.795 1.00 64.12 H new ATOM 0 HB3 LEU A 23 -2.869 19.945 -15.995 1.00 64.12 H new ATOM 0 HG LEU A 23 -1.775 21.767 -14.227 1.00 63.23 H new ATOM 0 HD11 LEU A 23 -2.080 20.775 -11.993 1.00 72.12 H new ATOM 0 HD12 LEU A 23 -3.604 21.430 -12.638 1.00 72.12 H new ATOM 0 HD13 LEU A 23 -3.312 19.675 -12.655 1.00 72.12 H new ATOM 0 HD21 LEU A 23 -0.364 19.874 -13.517 1.00 24.14 H new ATOM 0 HD22 LEU A 23 -1.531 18.740 -14.237 1.00 24.14 H new ATOM 0 HD23 LEU A 23 -0.633 19.872 -15.276 1.00 24.14 H new ATOM 395 N ALA A 24 -2.310 22.022 -17.857 1.00 40.14 N ATOM 396 CA ALA A 24 -1.234 22.548 -18.686 1.00 33.11 C ATOM 397 C ALA A 24 -1.395 24.048 -18.910 1.00 23.23 C ATOM 398 O ALA A 24 -0.421 24.757 -19.160 1.00 34.43 O ATOM 399 CB ALA A 24 -1.186 21.816 -20.018 1.00 43.12 C ATOM 0 H ALA A 24 -2.817 21.239 -18.270 1.00 40.14 H new ATOM 0 HA ALA A 24 -0.293 22.385 -18.161 1.00 33.11 H new ATOM 0 HB1 ALA A 24 -0.377 22.220 -20.626 1.00 43.12 H new ATOM 0 HB2 ALA A 24 -1.013 20.754 -19.844 1.00 43.12 H new ATOM 0 HB3 ALA A 24 -2.134 21.948 -20.540 1.00 43.12 H new ATOM 405 N ASP A 25 -2.633 24.524 -18.819 1.00 0.02 N ATOM 406 CA ASP A 25 -2.923 25.940 -19.013 1.00 72.22 C ATOM 407 C ASP A 25 -2.986 26.669 -17.674 1.00 62.10 C ATOM 408 O ASP A 25 -2.866 27.894 -17.615 1.00 11.21 O ATOM 409 CB ASP A 25 -4.243 26.115 -19.765 1.00 75.11 C ATOM 410 CG ASP A 25 -4.038 26.612 -21.183 1.00 52.02 C ATOM 411 OD1 ASP A 25 -3.725 25.784 -22.064 1.00 73.30 O ATOM 412 OD2 ASP A 25 -4.195 27.829 -21.413 1.00 32.35 O ATOM 0 H ASP A 25 -3.451 23.950 -18.612 1.00 0.02 H new ATOM 0 HA ASP A 25 -2.117 26.373 -19.606 1.00 72.22 H new ATOM 0 HB2 ASP A 25 -4.773 25.163 -19.790 1.00 75.11 H new ATOM 0 HB3 ASP A 25 -4.876 26.819 -19.224 1.00 75.11 H new ATOM 417 N LEU A 26 -3.177 25.910 -16.601 1.00 11.45 N ATOM 418 CA LEU A 26 -3.259 26.484 -15.262 1.00 42.33 C ATOM 419 C LEU A 26 -1.871 26.830 -14.733 1.00 31.40 C ATOM 420 O LEU A 26 -1.573 27.991 -14.450 1.00 63.25 O ATOM 421 CB LEU A 26 -3.951 25.508 -14.309 1.00 5.25 C ATOM 422 CG LEU A 26 -5.357 25.900 -13.853 1.00 72.31 C ATOM 423 CD1 LEU A 26 -6.387 24.919 -14.391 1.00 51.25 C ATOM 424 CD2 LEU A 26 -5.426 25.967 -12.334 1.00 64.15 C ATOM 0 H LEU A 26 -3.278 24.895 -16.632 1.00 11.45 H new ATOM 0 HA LEU A 26 -3.845 27.401 -15.322 1.00 42.33 H new ATOM 0 HB2 LEU A 26 -4.007 24.534 -14.795 1.00 5.25 H new ATOM 0 HB3 LEU A 26 -3.324 25.388 -13.425 1.00 5.25 H new ATOM 0 HG LEU A 26 -5.584 26.889 -14.252 1.00 72.31 H new ATOM 0 HD11 LEU A 26 -7.381 25.215 -14.056 1.00 51.25 H new ATOM 0 HD12 LEU A 26 -6.356 24.920 -15.481 1.00 51.25 H new ATOM 0 HD13 LEU A 26 -6.163 23.918 -14.023 1.00 51.25 H new ATOM 0 HD21 LEU A 26 -6.434 26.247 -12.028 1.00 64.15 H new ATOM 0 HD22 LEU A 26 -5.177 24.992 -11.915 1.00 64.15 H new ATOM 0 HD23 LEU A 26 -4.716 26.710 -11.970 1.00 64.15 H new ATOM 436 N THR A 27 -1.022 25.813 -14.603 1.00 4.14 N ATOM 437 CA THR A 27 0.335 26.010 -14.109 1.00 54.35 C ATOM 438 C THR A 27 1.268 26.461 -15.228 1.00 0.33 C ATOM 439 O THR A 27 2.462 26.659 -15.011 1.00 41.53 O ATOM 440 CB THR A 27 0.895 24.721 -13.478 1.00 71.31 C ATOM 441 OG1 THR A 27 2.262 24.915 -13.102 1.00 70.12 O ATOM 442 CG2 THR A 27 0.792 23.554 -14.449 1.00 31.12 C ATOM 0 H THR A 27 -1.251 24.846 -14.833 1.00 4.14 H new ATOM 0 HA THR A 27 0.284 26.787 -13.347 1.00 54.35 H new ATOM 0 HB THR A 27 0.304 24.489 -12.592 1.00 71.31 H new ATOM 0 HG1 THR A 27 2.578 25.775 -13.450 1.00 70.12 H new ATOM 0 HG21 THR A 27 1.194 22.655 -13.981 1.00 31.12 H new ATOM 0 HG22 THR A 27 -0.253 23.390 -14.712 1.00 31.12 H new ATOM 0 HG23 THR A 27 1.362 23.779 -15.350 1.00 31.12 H new ATOM 450 N GLY A 28 0.713 26.622 -16.425 1.00 71.14 N ATOM 451 CA GLY A 28 1.510 27.050 -17.561 1.00 55.42 C ATOM 452 C GLY A 28 2.620 26.072 -17.891 1.00 63.01 C ATOM 453 O GLY A 28 3.782 26.460 -18.013 1.00 24.43 O ATOM 0 H GLY A 28 -0.274 26.464 -16.629 1.00 71.14 H new ATOM 0 HA2 GLY A 28 0.864 27.168 -18.431 1.00 55.42 H new ATOM 0 HA3 GLY A 28 1.942 28.028 -17.350 1.00 55.42 H new ATOM 457 N VAL A 29 2.263 24.800 -18.035 1.00 50.12 N ATOM 458 CA VAL A 29 3.238 23.764 -18.353 1.00 54.03 C ATOM 459 C VAL A 29 3.034 23.233 -19.767 1.00 24.12 C ATOM 460 O VAL A 29 1.921 23.198 -20.289 1.00 11.23 O ATOM 461 CB VAL A 29 3.153 22.590 -17.358 1.00 3.24 C ATOM 462 CG1 VAL A 29 2.885 21.286 -18.093 1.00 14.34 C ATOM 463 CG2 VAL A 29 4.429 22.496 -16.536 1.00 50.23 C ATOM 0 H VAL A 29 1.306 24.462 -17.936 1.00 50.12 H new ATOM 0 HA VAL A 29 4.224 24.223 -18.279 1.00 54.03 H new ATOM 0 HB VAL A 29 2.322 22.772 -16.677 1.00 3.24 H new ATOM 0 HG11 VAL A 29 2.828 20.468 -17.374 1.00 14.34 H new ATOM 0 HG12 VAL A 29 1.941 21.360 -18.633 1.00 14.34 H new ATOM 0 HG13 VAL A 29 3.693 21.093 -18.799 1.00 14.34 H new ATOM 0 HG21 VAL A 29 4.352 21.662 -15.839 1.00 50.23 H new ATOM 0 HG22 VAL A 29 5.279 22.337 -17.200 1.00 50.23 H new ATOM 0 HG23 VAL A 29 4.572 23.422 -15.979 1.00 50.23 H new ATOM 473 N PRO A 30 4.136 22.808 -20.403 1.00 5.34 N ATOM 474 CA PRO A 30 4.105 22.269 -21.766 1.00 54.13 C ATOM 475 C PRO A 30 3.420 20.909 -21.836 1.00 3.43 C ATOM 476 O PRO A 30 3.879 19.940 -21.229 1.00 5.21 O ATOM 477 CB PRO A 30 5.586 22.142 -22.131 1.00 44.23 C ATOM 478 CG PRO A 30 6.288 22.003 -20.825 1.00 71.13 C ATOM 479 CD PRO A 30 5.497 22.820 -19.841 1.00 14.15 C ATOM 0 HA PRO A 30 3.538 22.907 -22.444 1.00 54.13 H new ATOM 0 HB2 PRO A 30 5.763 21.277 -22.770 1.00 44.23 H new ATOM 0 HB3 PRO A 30 5.936 23.018 -22.677 1.00 44.23 H new ATOM 0 HG2 PRO A 30 6.335 20.959 -20.516 1.00 71.13 H new ATOM 0 HG3 PRO A 30 7.315 22.362 -20.894 1.00 71.13 H new ATOM 0 HD2 PRO A 30 5.523 22.383 -18.843 1.00 14.15 H new ATOM 0 HD3 PRO A 30 5.887 23.834 -19.755 1.00 14.15 H new ATOM 487 N TYR A 31 2.322 20.841 -22.580 1.00 25.44 N ATOM 488 CA TYR A 31 1.574 19.599 -22.729 1.00 32.30 C ATOM 489 C TYR A 31 2.463 18.489 -23.281 1.00 14.22 C ATOM 490 O TYR A 31 2.373 17.338 -22.860 1.00 34.33 O ATOM 491 CB TYR A 31 0.371 19.810 -23.650 1.00 63.02 C ATOM 492 CG TYR A 31 -0.453 18.560 -23.867 1.00 1.51 C ATOM 493 CD1 TYR A 31 -0.107 17.638 -24.848 1.00 32.10 C ATOM 494 CD2 TYR A 31 -1.575 18.302 -23.090 1.00 12.33 C ATOM 495 CE1 TYR A 31 -0.857 16.496 -25.049 1.00 35.12 C ATOM 496 CE2 TYR A 31 -2.330 17.161 -23.284 1.00 62.12 C ATOM 497 CZ TYR A 31 -1.968 16.262 -24.265 1.00 32.41 C ATOM 498 OH TYR A 31 -2.716 15.124 -24.462 1.00 11.03 O ATOM 0 H TYR A 31 1.930 21.633 -23.090 1.00 25.44 H new ATOM 0 HA TYR A 31 1.220 19.299 -21.743 1.00 32.30 H new ATOM 0 HB2 TYR A 31 -0.267 20.587 -23.228 1.00 63.02 H new ATOM 0 HB3 TYR A 31 0.723 20.175 -24.615 1.00 63.02 H new ATOM 0 HD1 TYR A 31 0.762 17.818 -25.463 1.00 32.10 H new ATOM 0 HD2 TYR A 31 -1.862 19.005 -22.322 1.00 12.33 H new ATOM 0 HE1 TYR A 31 -0.575 15.790 -25.816 1.00 35.12 H new ATOM 0 HE2 TYR A 31 -3.199 16.974 -22.671 1.00 62.12 H new ATOM 0 HH TYR A 31 -3.463 15.110 -23.828 1.00 11.03 H new ATOM 508 N GLY A 32 3.325 18.847 -24.229 1.00 2.44 N ATOM 509 CA GLY A 32 4.219 17.872 -24.824 1.00 73.33 C ATOM 510 C GLY A 32 5.003 17.094 -23.786 1.00 15.40 C ATOM 511 O GLY A 32 5.247 15.898 -23.948 1.00 5.33 O ATOM 0 H GLY A 32 3.419 19.795 -24.595 1.00 2.44 H new ATOM 0 HA2 GLY A 32 3.640 17.178 -25.433 1.00 73.33 H new ATOM 0 HA3 GLY A 32 4.913 18.381 -25.493 1.00 73.33 H new ATOM 515 N THR A 33 5.401 17.774 -22.715 1.00 2.10 N ATOM 516 CA THR A 33 6.165 17.141 -21.647 1.00 33.22 C ATOM 517 C THR A 33 5.247 16.640 -20.538 1.00 41.20 C ATOM 518 O THR A 33 5.512 15.610 -19.916 1.00 25.30 O ATOM 519 CB THR A 33 7.198 18.110 -21.044 1.00 51.23 C ATOM 520 OG1 THR A 33 7.625 19.051 -22.036 1.00 63.51 O ATOM 521 CG2 THR A 33 8.403 17.351 -20.507 1.00 43.02 C ATOM 0 H THR A 33 5.207 18.764 -22.564 1.00 2.10 H new ATOM 0 HA THR A 33 6.689 16.295 -22.092 1.00 33.22 H new ATOM 0 HB THR A 33 6.725 18.642 -20.218 1.00 51.23 H new ATOM 0 HG1 THR A 33 8.281 19.665 -21.644 1.00 63.51 H new ATOM 0 HG21 THR A 33 9.119 18.057 -20.086 1.00 43.02 H new ATOM 0 HG22 THR A 33 8.080 16.656 -19.732 1.00 43.02 H new ATOM 0 HG23 THR A 33 8.874 16.796 -21.318 1.00 43.02 H new ATOM 529 N LEU A 34 4.167 17.374 -20.293 1.00 24.43 N ATOM 530 CA LEU A 34 3.208 17.003 -19.259 1.00 43.23 C ATOM 531 C LEU A 34 2.758 15.556 -19.426 1.00 50.10 C ATOM 532 O LEU A 34 2.524 14.849 -18.446 1.00 64.13 O ATOM 533 CB LEU A 34 1.996 17.935 -19.302 1.00 34.41 C ATOM 534 CG LEU A 34 0.832 17.565 -18.381 1.00 14.43 C ATOM 535 CD1 LEU A 34 1.096 18.050 -16.965 1.00 3.32 C ATOM 536 CD2 LEU A 34 -0.471 18.145 -18.912 1.00 12.32 C ATOM 0 H LEU A 34 3.934 18.230 -20.797 1.00 24.43 H new ATOM 0 HA LEU A 34 3.700 17.101 -18.291 1.00 43.23 H new ATOM 0 HB2 LEU A 34 2.328 18.942 -19.049 1.00 34.41 H new ATOM 0 HB3 LEU A 34 1.626 17.970 -20.327 1.00 34.41 H new ATOM 0 HG LEU A 34 0.742 16.479 -18.359 1.00 14.43 H new ATOM 0 HD11 LEU A 34 0.257 17.778 -16.325 1.00 3.32 H new ATOM 0 HD12 LEU A 34 2.007 17.587 -16.586 1.00 3.32 H new ATOM 0 HD13 LEU A 34 1.213 19.134 -16.968 1.00 3.32 H new ATOM 0 HD21 LEU A 34 -1.289 17.872 -18.245 1.00 12.32 H new ATOM 0 HD22 LEU A 34 -0.391 19.231 -18.964 1.00 12.32 H new ATOM 0 HD23 LEU A 34 -0.667 17.748 -19.908 1.00 12.32 H new ATOM 548 N SER A 35 2.639 15.119 -20.676 1.00 63.13 N ATOM 549 CA SER A 35 2.215 13.757 -20.973 1.00 73.31 C ATOM 550 C SER A 35 3.170 12.742 -20.350 1.00 51.22 C ATOM 551 O SER A 35 2.758 11.658 -19.937 1.00 50.40 O ATOM 552 CB SER A 35 2.140 13.541 -22.486 1.00 42.24 C ATOM 553 OG SER A 35 1.973 12.169 -22.798 1.00 24.01 O ATOM 0 H SER A 35 2.831 15.690 -21.499 1.00 63.13 H new ATOM 0 HA SER A 35 1.224 13.610 -20.543 1.00 73.31 H new ATOM 0 HB2 SER A 35 1.309 14.114 -22.898 1.00 42.24 H new ATOM 0 HB3 SER A 35 3.050 13.916 -22.955 1.00 42.24 H new ATOM 0 HG SER A 35 1.926 12.058 -23.771 1.00 24.01 H new ATOM 559 N TYR A 36 4.447 13.103 -20.287 1.00 24.31 N ATOM 560 CA TYR A 36 5.462 12.225 -19.717 1.00 24.32 C ATOM 561 C TYR A 36 5.585 12.440 -18.212 1.00 10.31 C ATOM 562 O TYR A 36 6.064 11.569 -17.485 1.00 72.52 O ATOM 563 CB TYR A 36 6.814 12.469 -20.390 1.00 60.32 C ATOM 564 CG TYR A 36 6.729 12.573 -21.896 1.00 21.33 C ATOM 565 CD1 TYR A 36 6.006 11.647 -22.637 1.00 21.51 C ATOM 566 CD2 TYR A 36 7.373 13.598 -22.579 1.00 33.34 C ATOM 567 CE1 TYR A 36 5.927 11.738 -24.013 1.00 11.33 C ATOM 568 CE2 TYR A 36 7.299 13.698 -23.954 1.00 14.13 C ATOM 569 CZ TYR A 36 6.575 12.765 -24.668 1.00 3.04 C ATOM 570 OH TYR A 36 6.498 12.860 -26.038 1.00 45.51 O ATOM 0 H TYR A 36 4.804 13.997 -20.624 1.00 24.31 H new ATOM 0 HA TYR A 36 5.156 11.194 -19.895 1.00 24.32 H new ATOM 0 HB2 TYR A 36 7.247 13.388 -19.994 1.00 60.32 H new ATOM 0 HB3 TYR A 36 7.493 11.658 -20.128 1.00 60.32 H new ATOM 0 HD1 TYR A 36 5.497 10.842 -22.128 1.00 21.51 H new ATOM 0 HD2 TYR A 36 7.942 14.330 -22.024 1.00 33.34 H new ATOM 0 HE1 TYR A 36 5.361 11.009 -24.573 1.00 11.33 H new ATOM 0 HE2 TYR A 36 7.805 14.502 -24.468 1.00 14.13 H new ATOM 0 HH TYR A 36 7.009 13.640 -26.341 1.00 45.51 H new ATOM 580 N TYR A 37 5.148 13.607 -17.750 1.00 54.21 N ATOM 581 CA TYR A 37 5.210 13.938 -16.331 1.00 5.01 C ATOM 582 C TYR A 37 4.374 12.964 -15.507 1.00 44.23 C ATOM 583 O TYR A 37 4.911 12.118 -14.794 1.00 51.30 O ATOM 584 CB TYR A 37 4.722 15.370 -16.099 1.00 11.33 C ATOM 585 CG TYR A 37 5.808 16.411 -16.252 1.00 63.44 C ATOM 586 CD1 TYR A 37 6.871 16.213 -17.125 1.00 74.01 C ATOM 587 CD2 TYR A 37 5.770 17.594 -15.525 1.00 44.14 C ATOM 588 CE1 TYR A 37 7.864 17.161 -17.268 1.00 44.51 C ATOM 589 CE2 TYR A 37 6.759 18.549 -15.663 1.00 1.34 C ATOM 590 CZ TYR A 37 7.804 18.328 -16.534 1.00 71.32 C ATOM 591 OH TYR A 37 8.791 19.275 -16.675 1.00 40.12 O ATOM 0 H TYR A 37 4.747 14.339 -18.337 1.00 54.21 H new ATOM 0 HA TYR A 37 6.249 13.858 -16.010 1.00 5.01 H new ATOM 0 HB2 TYR A 37 3.918 15.589 -16.802 1.00 11.33 H new ATOM 0 HB3 TYR A 37 4.299 15.443 -15.097 1.00 11.33 H new ATOM 0 HD1 TYR A 37 6.921 15.301 -17.702 1.00 74.01 H new ATOM 0 HD2 TYR A 37 4.954 17.770 -14.840 1.00 44.14 H new ATOM 0 HE1 TYR A 37 8.683 16.990 -17.951 1.00 44.51 H new ATOM 0 HE2 TYR A 37 6.713 19.464 -15.091 1.00 1.34 H new ATOM 0 HH TYR A 37 8.599 20.037 -16.089 1.00 40.12 H new ATOM 601 N GLU A 38 3.055 13.092 -15.610 1.00 3.11 N ATOM 602 CA GLU A 38 2.143 12.224 -14.874 1.00 5.14 C ATOM 603 C GLU A 38 2.342 10.764 -15.273 1.00 64.14 C ATOM 604 O GLU A 38 1.982 9.852 -14.528 1.00 41.42 O ATOM 605 CB GLU A 38 0.693 12.639 -15.126 1.00 45.31 C ATOM 606 CG GLU A 38 0.274 12.538 -16.584 1.00 24.31 C ATOM 607 CD GLU A 38 -0.717 11.417 -16.830 1.00 34.22 C ATOM 608 OE1 GLU A 38 -1.601 11.209 -15.972 1.00 33.41 O ATOM 609 OE2 GLU A 38 -0.610 10.749 -17.879 1.00 25.54 O ATOM 0 H GLU A 38 2.594 13.788 -16.196 1.00 3.11 H new ATOM 0 HA GLU A 38 2.363 12.327 -13.811 1.00 5.14 H new ATOM 0 HB2 GLU A 38 0.035 12.013 -14.524 1.00 45.31 H new ATOM 0 HB3 GLU A 38 0.554 13.666 -14.787 1.00 45.31 H new ATOM 0 HG2 GLU A 38 -0.168 13.484 -16.897 1.00 24.31 H new ATOM 0 HG3 GLU A 38 1.158 12.379 -17.202 1.00 24.31 H new ATOM 616 N SER A 39 2.917 10.551 -16.452 1.00 60.13 N ATOM 617 CA SER A 39 3.160 9.204 -16.952 1.00 34.13 C ATOM 618 C SER A 39 4.300 8.538 -16.186 1.00 11.41 C ATOM 619 O SER A 39 4.498 7.327 -16.275 1.00 14.05 O ATOM 620 CB SER A 39 3.488 9.242 -18.446 1.00 51.23 C ATOM 621 OG SER A 39 3.878 7.963 -18.915 1.00 13.01 O ATOM 0 H SER A 39 3.223 11.295 -17.079 1.00 60.13 H new ATOM 0 HA SER A 39 2.253 8.618 -16.802 1.00 34.13 H new ATOM 0 HB2 SER A 39 2.618 9.588 -19.004 1.00 51.23 H new ATOM 0 HB3 SER A 39 4.289 9.959 -18.628 1.00 51.23 H new ATOM 0 HG SER A 39 4.172 7.413 -18.159 1.00 13.01 H new ATOM 627 N GLY A 40 5.048 9.339 -15.434 1.00 14.52 N ATOM 628 CA GLY A 40 6.159 8.812 -14.663 1.00 24.23 C ATOM 629 C GLY A 40 7.375 8.525 -15.522 1.00 45.11 C ATOM 630 O GLY A 40 8.327 7.891 -15.068 1.00 74.53 O ATOM 0 H GLY A 40 4.904 10.345 -15.345 1.00 14.52 H new ATOM 0 HA2 GLY A 40 6.428 9.526 -13.884 1.00 24.23 H new ATOM 0 HA3 GLY A 40 5.847 7.896 -14.162 1.00 24.23 H new ATOM 634 N ARG A 41 7.342 8.991 -16.767 1.00 4.24 N ATOM 635 CA ARG A 41 8.449 8.778 -17.691 1.00 13.35 C ATOM 636 C ARG A 41 9.738 9.384 -17.144 1.00 52.13 C ATOM 637 O ARG A 41 10.774 8.722 -17.090 1.00 61.34 O ATOM 638 CB ARG A 41 8.126 9.387 -19.056 1.00 40.30 C ATOM 639 CG ARG A 41 8.612 8.550 -20.227 1.00 52.51 C ATOM 640 CD ARG A 41 7.449 7.959 -21.010 1.00 42.11 C ATOM 641 NE ARG A 41 7.904 7.152 -22.139 1.00 62.55 N ATOM 642 CZ ARG A 41 8.447 5.947 -22.010 1.00 34.51 C ATOM 643 NH1 ARG A 41 8.602 5.411 -20.806 1.00 62.54 N ATOM 644 NH2 ARG A 41 8.836 5.274 -23.085 1.00 43.33 N ATOM 0 H ARG A 41 6.561 9.518 -17.158 1.00 4.24 H new ATOM 0 HA ARG A 41 8.593 7.704 -17.805 1.00 13.35 H new ATOM 0 HB2 ARG A 41 7.047 9.520 -19.139 1.00 40.30 H new ATOM 0 HB3 ARG A 41 8.575 10.378 -19.118 1.00 40.30 H new ATOM 0 HG2 ARG A 41 9.221 9.166 -20.888 1.00 52.51 H new ATOM 0 HG3 ARG A 41 9.251 7.747 -19.861 1.00 52.51 H new ATOM 0 HD2 ARG A 41 6.840 7.344 -20.347 1.00 42.11 H new ATOM 0 HD3 ARG A 41 6.810 8.764 -21.374 1.00 42.11 H new ATOM 0 HE ARG A 41 7.799 7.535 -23.078 1.00 62.55 H new ATOM 0 HH11 ARG A 41 8.304 5.925 -19.977 1.00 62.54 H new ATOM 0 HH12 ARG A 41 9.019 4.485 -20.710 1.00 62.54 H new ATOM 0 HH21 ARG A 41 8.718 5.682 -24.012 1.00 43.33 H new ATOM 0 HH22 ARG A 41 9.253 4.349 -22.984 1.00 43.33 H new ATOM 658 N SER A 42 9.666 10.649 -16.740 1.00 70.41 N ATOM 659 CA SER A 42 10.828 11.347 -16.202 1.00 61.23 C ATOM 660 C SER A 42 10.414 12.338 -15.119 1.00 5.23 C ATOM 661 O SER A 42 9.706 13.309 -15.388 1.00 13.14 O ATOM 662 CB SER A 42 11.574 12.078 -17.320 1.00 24.10 C ATOM 663 OG SER A 42 12.938 11.697 -17.359 1.00 12.30 O ATOM 0 H SER A 42 8.815 11.211 -16.775 1.00 70.41 H new ATOM 0 HA SER A 42 11.491 10.606 -15.757 1.00 61.23 H new ATOM 0 HB2 SER A 42 11.104 11.858 -18.279 1.00 24.10 H new ATOM 0 HB3 SER A 42 11.498 13.155 -17.168 1.00 24.10 H new ATOM 0 HG SER A 42 13.391 12.177 -18.083 1.00 12.30 H new ATOM 669 N THR A 43 10.860 12.086 -13.893 1.00 12.02 N ATOM 670 CA THR A 43 10.535 12.954 -12.767 1.00 14.23 C ATOM 671 C THR A 43 10.853 14.410 -13.087 1.00 53.01 C ATOM 672 O THR A 43 11.940 14.745 -13.556 1.00 0.33 O ATOM 673 CB THR A 43 11.302 12.540 -11.499 1.00 21.52 C ATOM 674 OG1 THR A 43 11.339 11.112 -11.391 1.00 2.04 O ATOM 675 CG2 THR A 43 10.653 13.129 -10.256 1.00 51.25 C ATOM 0 H THR A 43 11.448 11.287 -13.654 1.00 12.02 H new ATOM 0 HA THR A 43 9.465 12.849 -12.585 1.00 14.23 H new ATOM 0 HB THR A 43 12.319 12.925 -11.577 1.00 21.52 H new ATOM 0 HG1 THR A 43 11.830 10.858 -10.582 1.00 2.04 H new ATOM 0 HG21 THR A 43 11.213 12.822 -9.373 1.00 51.25 H new ATOM 0 HG22 THR A 43 10.653 14.217 -10.326 1.00 51.25 H new ATOM 0 HG23 THR A 43 9.627 12.771 -10.177 1.00 51.25 H new ATOM 683 N PRO A 44 9.882 15.299 -12.827 1.00 21.02 N ATOM 684 CA PRO A 44 10.035 16.735 -13.079 1.00 52.42 C ATOM 685 C PRO A 44 11.026 17.389 -12.121 1.00 70.25 C ATOM 686 O PRO A 44 11.396 16.823 -11.092 1.00 3.54 O ATOM 687 CB PRO A 44 8.627 17.288 -12.852 1.00 71.00 C ATOM 688 CG PRO A 44 7.984 16.316 -11.923 1.00 72.24 C ATOM 689 CD PRO A 44 8.560 14.971 -12.268 1.00 61.30 C ATOM 0 HA PRO A 44 10.429 16.934 -14.075 1.00 52.42 H new ATOM 0 HB2 PRO A 44 8.659 18.288 -12.419 1.00 71.00 H new ATOM 0 HB3 PRO A 44 8.076 17.364 -13.789 1.00 71.00 H new ATOM 0 HG2 PRO A 44 8.190 16.574 -10.884 1.00 72.24 H new ATOM 0 HG3 PRO A 44 6.901 16.319 -12.043 1.00 72.24 H new ATOM 0 HD2 PRO A 44 8.643 14.332 -11.389 1.00 61.30 H new ATOM 0 HD3 PRO A 44 7.939 14.441 -12.990 1.00 61.30 H new ATOM 697 N PRO A 45 11.464 18.609 -12.463 1.00 71.15 N ATOM 698 CA PRO A 45 12.417 19.366 -11.646 1.00 45.31 C ATOM 699 C PRO A 45 11.802 19.848 -10.337 1.00 45.42 C ATOM 700 O PRO A 45 10.690 19.456 -9.979 1.00 14.40 O ATOM 701 CB PRO A 45 12.780 20.557 -12.536 1.00 13.01 C ATOM 702 CG PRO A 45 11.609 20.725 -13.441 1.00 51.14 C ATOM 703 CD PRO A 45 11.065 19.343 -13.676 1.00 25.43 C ATOM 0 HA PRO A 45 13.274 18.760 -11.352 1.00 45.31 H new ATOM 0 HB2 PRO A 45 12.954 21.455 -11.944 1.00 13.01 H new ATOM 0 HB3 PRO A 45 13.692 20.366 -13.101 1.00 13.01 H new ATOM 0 HG2 PRO A 45 10.855 21.369 -12.988 1.00 51.14 H new ATOM 0 HG3 PRO A 45 11.905 21.192 -14.380 1.00 51.14 H new ATOM 0 HD2 PRO A 45 9.982 19.353 -13.802 1.00 25.43 H new ATOM 0 HD3 PRO A 45 11.486 18.893 -14.575 1.00 25.43 H new ATOM 711 N THR A 46 12.531 20.701 -9.624 1.00 13.11 N ATOM 712 CA THR A 46 12.057 21.236 -8.353 1.00 31.11 C ATOM 713 C THR A 46 11.342 22.569 -8.551 1.00 24.32 C ATOM 714 O THR A 46 10.511 22.964 -7.733 1.00 10.01 O ATOM 715 CB THR A 46 13.217 21.431 -7.359 1.00 23.32 C ATOM 716 OG1 THR A 46 13.982 20.226 -7.256 1.00 51.14 O ATOM 717 CG2 THR A 46 12.691 21.822 -5.985 1.00 20.13 C ATOM 0 H THR A 46 13.452 21.036 -9.905 1.00 13.11 H new ATOM 0 HA THR A 46 11.356 20.508 -7.944 1.00 31.11 H new ATOM 0 HB THR A 46 13.854 22.234 -7.730 1.00 23.32 H new ATOM 0 HG1 THR A 46 14.344 19.992 -8.136 1.00 51.14 H new ATOM 0 HG21 THR A 46 13.528 21.954 -5.299 1.00 20.13 H new ATOM 0 HG22 THR A 46 12.133 22.755 -6.061 1.00 20.13 H new ATOM 0 HG23 THR A 46 12.035 21.037 -5.610 1.00 20.13 H new ATOM 725 N ASP A 47 11.670 23.254 -9.640 1.00 42.22 N ATOM 726 CA ASP A 47 11.057 24.543 -9.945 1.00 11.00 C ATOM 727 C ASP A 47 9.658 24.355 -10.523 1.00 64.31 C ATOM 728 O ASP A 47 8.759 25.158 -10.273 1.00 65.11 O ATOM 729 CB ASP A 47 11.928 25.325 -10.929 1.00 53.22 C ATOM 730 CG ASP A 47 11.822 26.825 -10.730 1.00 65.03 C ATOM 731 OD1 ASP A 47 11.042 27.253 -9.853 1.00 61.13 O ATOM 732 OD2 ASP A 47 12.518 27.570 -11.451 1.00 21.44 O ATOM 0 H ASP A 47 12.356 22.940 -10.326 1.00 42.22 H new ATOM 0 HA ASP A 47 10.974 25.108 -9.017 1.00 11.00 H new ATOM 0 HB2 ASP A 47 12.968 25.018 -10.813 1.00 53.22 H new ATOM 0 HB3 ASP A 47 11.634 25.075 -11.948 1.00 53.22 H new ATOM 737 N VAL A 48 9.481 23.290 -11.298 1.00 60.11 N ATOM 738 CA VAL A 48 8.191 22.996 -11.912 1.00 45.24 C ATOM 739 C VAL A 48 7.299 22.202 -10.965 1.00 11.34 C ATOM 740 O VAL A 48 6.121 22.515 -10.796 1.00 1.53 O ATOM 741 CB VAL A 48 8.360 22.206 -13.223 1.00 14.52 C ATOM 742 CG1 VAL A 48 7.004 21.873 -13.825 1.00 74.34 C ATOM 743 CG2 VAL A 48 9.212 22.989 -14.210 1.00 62.30 C ATOM 0 H VAL A 48 10.215 22.616 -11.516 1.00 60.11 H new ATOM 0 HA VAL A 48 7.720 23.954 -12.132 1.00 45.24 H new ATOM 0 HB VAL A 48 8.871 21.270 -12.999 1.00 14.52 H new ATOM 0 HG11 VAL A 48 7.144 21.315 -14.751 1.00 74.34 H new ATOM 0 HG12 VAL A 48 6.431 21.270 -13.121 1.00 74.34 H new ATOM 0 HG13 VAL A 48 6.463 22.796 -14.036 1.00 74.34 H new ATOM 0 HG21 VAL A 48 9.321 22.416 -15.131 1.00 62.30 H new ATOM 0 HG22 VAL A 48 8.731 23.942 -14.430 1.00 62.30 H new ATOM 0 HG23 VAL A 48 10.196 23.171 -13.777 1.00 62.30 H new ATOM 753 N MET A 49 7.870 21.173 -10.346 1.00 23.51 N ATOM 754 CA MET A 49 7.126 20.334 -9.414 1.00 32.02 C ATOM 755 C MET A 49 6.376 21.187 -8.396 1.00 43.12 C ATOM 756 O MET A 49 5.196 20.957 -8.129 1.00 54.11 O ATOM 757 CB MET A 49 8.074 19.373 -8.692 1.00 51.33 C ATOM 758 CG MET A 49 7.400 18.567 -7.594 1.00 21.11 C ATOM 759 SD MET A 49 8.155 18.826 -5.978 1.00 71.53 S ATOM 760 CE MET A 49 7.298 20.304 -5.437 1.00 52.32 C ATOM 0 H MET A 49 8.845 20.901 -10.473 1.00 23.51 H new ATOM 0 HA MET A 49 6.399 19.756 -9.984 1.00 32.02 H new ATOM 0 HB2 MET A 49 8.508 18.688 -9.420 1.00 51.33 H new ATOM 0 HB3 MET A 49 8.897 19.943 -8.260 1.00 51.33 H new ATOM 0 HG2 MET A 49 6.345 18.838 -7.545 1.00 21.11 H new ATOM 0 HG3 MET A 49 7.446 17.508 -7.846 1.00 21.11 H new ATOM 0 HE1 MET A 49 7.174 20.277 -4.354 1.00 52.32 H new ATOM 0 HE2 MET A 49 7.879 21.184 -5.714 1.00 52.32 H new ATOM 0 HE3 MET A 49 6.319 20.352 -5.913 1.00 52.32 H new ATOM 770 N MET A 50 7.067 22.171 -7.831 1.00 13.33 N ATOM 771 CA MET A 50 6.464 23.058 -6.842 1.00 63.34 C ATOM 772 C MET A 50 5.417 23.959 -7.488 1.00 13.15 C ATOM 773 O MET A 50 4.439 24.347 -6.849 1.00 31.51 O ATOM 774 CB MET A 50 7.539 23.910 -6.166 1.00 63.11 C ATOM 775 CG MET A 50 8.063 25.036 -7.043 1.00 51.43 C ATOM 776 SD MET A 50 9.639 25.694 -6.462 1.00 41.12 S ATOM 777 CE MET A 50 9.398 25.633 -4.689 1.00 52.14 C ATOM 0 H MET A 50 8.044 22.375 -8.040 1.00 13.33 H new ATOM 0 HA MET A 50 5.973 22.441 -6.089 1.00 63.34 H new ATOM 0 HB2 MET A 50 7.131 24.335 -5.249 1.00 63.11 H new ATOM 0 HB3 MET A 50 8.371 23.268 -5.877 1.00 63.11 H new ATOM 0 HG2 MET A 50 8.180 24.672 -8.064 1.00 51.43 H new ATOM 0 HG3 MET A 50 7.327 25.840 -7.074 1.00 51.43 H new ATOM 0 HE1 MET A 50 10.157 26.242 -4.198 1.00 52.14 H new ATOM 0 HE2 MET A 50 8.408 26.018 -4.443 1.00 52.14 H new ATOM 0 HE3 MET A 50 9.482 24.602 -4.346 1.00 52.14 H new ATOM 787 N ASN A 51 5.628 24.290 -8.758 1.00 65.21 N ATOM 788 CA ASN A 51 4.703 25.146 -9.489 1.00 34.45 C ATOM 789 C ASN A 51 3.352 24.460 -9.667 1.00 20.22 C ATOM 790 O ASN A 51 2.349 25.109 -9.968 1.00 30.14 O ATOM 791 CB ASN A 51 5.285 25.511 -10.856 1.00 31.11 C ATOM 792 CG ASN A 51 5.922 26.889 -10.864 1.00 2.32 C ATOM 793 OD1 ASN A 51 5.506 27.780 -10.125 1.00 22.00 O ATOM 794 ND2 ASN A 51 6.934 27.067 -11.704 1.00 22.11 N ATOM 0 H ASN A 51 6.432 23.978 -9.302 1.00 65.21 H new ATOM 0 HA ASN A 51 4.555 26.057 -8.909 1.00 34.45 H new ATOM 0 HB2 ASN A 51 6.030 24.768 -11.141 1.00 31.11 H new ATOM 0 HB3 ASN A 51 4.495 25.475 -11.606 1.00 31.11 H new ATOM 0 HD21 ASN A 51 7.401 27.972 -11.755 1.00 22.11 H new ATOM 0 HD22 ASN A 51 7.245 26.298 -12.298 1.00 22.11 H new ATOM 801 N ILE A 52 3.332 23.146 -9.478 1.00 3.55 N ATOM 802 CA ILE A 52 2.104 22.373 -9.615 1.00 73.42 C ATOM 803 C ILE A 52 1.386 22.238 -8.276 1.00 71.13 C ATOM 804 O ILE A 52 0.159 22.319 -8.206 1.00 32.44 O ATOM 805 CB ILE A 52 2.384 20.966 -10.178 1.00 62.11 C ATOM 806 CG1 ILE A 52 3.289 21.056 -11.408 1.00 74.14 C ATOM 807 CG2 ILE A 52 1.079 20.265 -10.523 1.00 33.12 C ATOM 808 CD1 ILE A 52 2.949 22.209 -12.326 1.00 62.23 C ATOM 0 H ILE A 52 4.153 22.594 -9.229 1.00 3.55 H new ATOM 0 HA ILE A 52 1.467 22.915 -10.313 1.00 73.42 H new ATOM 0 HB ILE A 52 2.897 20.381 -9.415 1.00 62.11 H new ATOM 0 HG12 ILE A 52 4.324 21.156 -11.081 1.00 74.14 H new ATOM 0 HG13 ILE A 52 3.220 20.124 -11.968 1.00 74.14 H new ATOM 0 HG21 ILE A 52 1.293 19.272 -10.919 1.00 33.12 H new ATOM 0 HG22 ILE A 52 0.467 20.173 -9.626 1.00 33.12 H new ATOM 0 HG23 ILE A 52 0.541 20.846 -11.271 1.00 33.12 H new ATOM 0 HD11 ILE A 52 3.631 22.211 -13.176 1.00 62.23 H new ATOM 0 HD12 ILE A 52 1.925 22.100 -12.683 1.00 62.23 H new ATOM 0 HD13 ILE A 52 3.046 23.148 -11.782 1.00 62.23 H new ATOM 820 N LEU A 53 2.159 22.034 -7.215 1.00 51.45 N ATOM 821 CA LEU A 53 1.597 21.890 -5.877 1.00 74.54 C ATOM 822 C LEU A 53 1.238 23.251 -5.288 1.00 34.01 C ATOM 823 O LEU A 53 0.323 23.363 -4.473 1.00 42.22 O ATOM 824 CB LEU A 53 2.589 21.171 -4.961 1.00 74.22 C ATOM 825 CG LEU A 53 2.261 19.715 -4.628 1.00 41.43 C ATOM 826 CD1 LEU A 53 1.794 18.976 -5.873 1.00 53.22 C ATOM 827 CD2 LEU A 53 3.470 19.022 -4.016 1.00 13.23 C ATOM 0 H LEU A 53 3.176 21.965 -7.255 1.00 51.45 H new ATOM 0 HA LEU A 53 0.686 21.296 -5.954 1.00 74.54 H new ATOM 0 HB2 LEU A 53 3.573 21.203 -5.428 1.00 74.22 H new ATOM 0 HB3 LEU A 53 2.661 21.729 -4.027 1.00 74.22 H new ATOM 0 HG LEU A 53 1.452 19.702 -3.897 1.00 41.43 H new ATOM 0 HD11 LEU A 53 1.565 17.941 -5.618 1.00 53.22 H new ATOM 0 HD12 LEU A 53 0.900 19.458 -6.269 1.00 53.22 H new ATOM 0 HD13 LEU A 53 2.582 18.998 -6.626 1.00 53.22 H new ATOM 0 HD21 LEU A 53 3.218 17.987 -3.785 1.00 13.23 H new ATOM 0 HD22 LEU A 53 4.299 19.045 -4.723 1.00 13.23 H new ATOM 0 HD23 LEU A 53 3.760 19.537 -3.100 1.00 13.23 H new ATOM 839 N GLN A 54 1.965 24.281 -5.708 1.00 35.22 N ATOM 840 CA GLN A 54 1.721 25.635 -5.223 1.00 5.24 C ATOM 841 C GLN A 54 0.349 26.133 -5.663 1.00 40.02 C ATOM 842 O GLN A 54 -0.161 27.124 -5.141 1.00 11.30 O ATOM 843 CB GLN A 54 2.808 26.584 -5.730 1.00 13.40 C ATOM 844 CG GLN A 54 2.685 26.915 -7.209 1.00 75.21 C ATOM 845 CD GLN A 54 3.660 27.989 -7.650 1.00 20.35 C ATOM 846 OE1 GLN A 54 3.292 28.923 -8.362 1.00 45.45 O ATOM 847 NE2 GLN A 54 4.912 27.863 -7.227 1.00 73.44 N ATOM 0 H GLN A 54 2.727 24.205 -6.382 1.00 35.22 H new ATOM 0 HA GLN A 54 1.746 25.613 -4.134 1.00 5.24 H new ATOM 0 HB2 GLN A 54 2.768 27.509 -5.155 1.00 13.40 H new ATOM 0 HB3 GLN A 54 3.785 26.136 -5.546 1.00 13.40 H new ATOM 0 HG2 GLN A 54 2.856 26.012 -7.795 1.00 75.21 H new ATOM 0 HG3 GLN A 54 1.668 27.244 -7.420 1.00 75.21 H new ATOM 0 HE21 GLN A 54 5.174 27.073 -6.638 1.00 73.44 H new ATOM 0 HE22 GLN A 54 5.612 28.557 -7.491 1.00 73.44 H new ATOM 856 N THR A 55 -0.245 25.438 -6.628 1.00 23.53 N ATOM 857 CA THR A 55 -1.557 25.811 -7.141 1.00 24.25 C ATOM 858 C THR A 55 -2.615 25.739 -6.047 1.00 71.25 C ATOM 859 O THR A 55 -2.505 24.968 -5.093 1.00 30.33 O ATOM 860 CB THR A 55 -1.983 24.902 -8.310 1.00 54.30 C ATOM 861 OG1 THR A 55 -2.104 23.548 -7.859 1.00 42.52 O ATOM 862 CG2 THR A 55 -0.974 24.974 -9.447 1.00 51.14 C ATOM 0 H THR A 55 0.162 24.614 -7.070 1.00 23.53 H new ATOM 0 HA THR A 55 -1.476 26.837 -7.499 1.00 24.25 H new ATOM 0 HB THR A 55 -2.948 25.250 -8.678 1.00 54.30 H new ATOM 0 HG1 THR A 55 -1.247 23.087 -7.975 1.00 42.52 H new ATOM 0 HG21 THR A 55 -1.296 24.324 -10.261 1.00 51.14 H new ATOM 0 HG22 THR A 55 -0.905 26.000 -9.808 1.00 51.14 H new ATOM 0 HG23 THR A 55 0.003 24.649 -9.088 1.00 51.14 H new ATOM 870 N PRO A 56 -3.667 26.561 -6.184 1.00 53.52 N ATOM 871 CA PRO A 56 -4.767 26.607 -5.215 1.00 12.33 C ATOM 872 C PRO A 56 -5.622 25.346 -5.249 1.00 31.34 C ATOM 873 O PRO A 56 -6.233 24.973 -4.247 1.00 43.31 O ATOM 874 CB PRO A 56 -5.584 27.821 -5.666 1.00 41.51 C ATOM 875 CG PRO A 56 -5.287 27.960 -7.118 1.00 31.12 C ATOM 876 CD PRO A 56 -3.864 27.505 -7.295 1.00 2.04 C ATOM 0 HA PRO A 56 -4.405 26.676 -4.189 1.00 12.33 H new ATOM 0 HB2 PRO A 56 -6.649 27.668 -5.493 1.00 41.51 H new ATOM 0 HB3 PRO A 56 -5.298 28.717 -5.116 1.00 41.51 H new ATOM 0 HG2 PRO A 56 -5.968 27.354 -7.715 1.00 31.12 H new ATOM 0 HG3 PRO A 56 -5.410 28.993 -7.444 1.00 31.12 H new ATOM 0 HD2 PRO A 56 -3.713 27.025 -8.262 1.00 2.04 H new ATOM 0 HD3 PRO A 56 -3.166 28.340 -7.241 1.00 2.04 H new ATOM 884 N GLN A 57 -5.662 24.694 -6.406 1.00 54.13 N ATOM 885 CA GLN A 57 -6.445 23.474 -6.568 1.00 35.45 C ATOM 886 C GLN A 57 -5.865 22.340 -5.729 1.00 15.23 C ATOM 887 O GLN A 57 -6.602 21.564 -5.120 1.00 55.15 O ATOM 888 CB GLN A 57 -6.490 23.064 -8.040 1.00 31.22 C ATOM 889 CG GLN A 57 -5.118 22.799 -8.641 1.00 70.00 C ATOM 890 CD GLN A 57 -5.032 23.197 -10.100 1.00 22.24 C ATOM 891 OE1 GLN A 57 -4.066 23.830 -10.528 1.00 74.05 O ATOM 892 NE2 GLN A 57 -6.045 22.828 -10.875 1.00 50.03 N ATOM 0 H GLN A 57 -5.162 24.989 -7.245 1.00 54.13 H new ATOM 0 HA GLN A 57 -7.459 23.674 -6.223 1.00 35.45 H new ATOM 0 HB2 GLN A 57 -7.101 22.167 -8.140 1.00 31.22 H new ATOM 0 HB3 GLN A 57 -6.982 23.850 -8.612 1.00 31.22 H new ATOM 0 HG2 GLN A 57 -4.366 23.347 -8.074 1.00 70.00 H new ATOM 0 HG3 GLN A 57 -4.881 21.739 -8.543 1.00 70.00 H new ATOM 0 HE21 GLN A 57 -6.826 22.304 -10.479 1.00 50.03 H new ATOM 0 HE22 GLN A 57 -6.043 23.068 -11.866 1.00 50.03 H new ATOM 901 N PHE A 58 -4.539 22.248 -5.702 1.00 44.33 N ATOM 902 CA PHE A 58 -3.860 21.207 -4.940 1.00 12.11 C ATOM 903 C PHE A 58 -3.241 21.781 -3.668 1.00 32.20 C ATOM 904 O PHE A 58 -2.302 21.214 -3.111 1.00 14.11 O ATOM 905 CB PHE A 58 -2.777 20.545 -5.793 1.00 65.32 C ATOM 906 CG PHE A 58 -3.280 20.041 -7.116 1.00 64.12 C ATOM 907 CD1 PHE A 58 -4.512 19.415 -7.211 1.00 14.53 C ATOM 908 CD2 PHE A 58 -2.520 20.194 -8.265 1.00 54.23 C ATOM 909 CE1 PHE A 58 -4.977 18.950 -8.427 1.00 51.05 C ATOM 910 CE2 PHE A 58 -2.981 19.731 -9.483 1.00 13.32 C ATOM 911 CZ PHE A 58 -4.211 19.110 -9.564 1.00 14.14 C ATOM 0 H PHE A 58 -3.914 22.882 -6.199 1.00 44.33 H new ATOM 0 HA PHE A 58 -4.599 20.457 -4.658 1.00 12.11 H new ATOM 0 HB2 PHE A 58 -1.975 21.262 -5.968 1.00 65.32 H new ATOM 0 HB3 PHE A 58 -2.346 19.713 -5.237 1.00 65.32 H new ATOM 0 HD1 PHE A 58 -5.116 19.289 -6.325 1.00 14.53 H new ATOM 0 HD2 PHE A 58 -1.557 20.680 -8.208 1.00 54.23 H new ATOM 0 HE1 PHE A 58 -5.939 18.462 -8.487 1.00 51.05 H new ATOM 0 HE2 PHE A 58 -2.379 19.855 -10.371 1.00 13.32 H new ATOM 0 HZ PHE A 58 -4.573 18.750 -10.515 1.00 14.14 H new ATOM 921 N THR A 59 -3.777 22.910 -3.214 1.00 4.20 N ATOM 922 CA THR A 59 -3.277 23.563 -2.011 1.00 22.31 C ATOM 923 C THR A 59 -3.325 22.619 -0.814 1.00 21.11 C ATOM 924 O THR A 59 -2.514 22.726 0.107 1.00 21.14 O ATOM 925 CB THR A 59 -4.088 24.831 -1.682 1.00 62.34 C ATOM 926 OG1 THR A 59 -3.522 25.493 -0.546 1.00 4.22 O ATOM 927 CG2 THR A 59 -5.543 24.486 -1.403 1.00 32.12 C ATOM 0 H THR A 59 -4.557 23.391 -3.662 1.00 4.20 H new ATOM 0 HA THR A 59 -2.242 23.843 -2.209 1.00 22.31 H new ATOM 0 HB THR A 59 -4.049 25.495 -2.545 1.00 62.34 H new ATOM 0 HG1 THR A 59 -4.042 26.299 -0.344 1.00 4.22 H new ATOM 0 HG21 THR A 59 -6.095 25.397 -1.173 1.00 32.12 H new ATOM 0 HG22 THR A 59 -5.979 24.009 -2.281 1.00 32.12 H new ATOM 0 HG23 THR A 59 -5.599 23.804 -0.554 1.00 32.12 H new ATOM 935 N LYS A 60 -4.277 21.694 -0.834 1.00 35.52 N ATOM 936 CA LYS A 60 -4.430 20.729 0.248 1.00 52.53 C ATOM 937 C LYS A 60 -3.526 19.521 0.031 1.00 41.24 C ATOM 938 O LYS A 60 -3.312 18.721 0.943 1.00 22.22 O ATOM 939 CB LYS A 60 -5.888 20.276 0.354 1.00 75.42 C ATOM 940 CG LYS A 60 -6.476 19.805 -0.965 1.00 41.34 C ATOM 941 CD LYS A 60 -7.874 19.237 -0.782 1.00 60.34 C ATOM 942 CE LYS A 60 -8.782 19.608 -1.944 1.00 4.52 C ATOM 943 NZ LYS A 60 -10.059 18.843 -1.915 1.00 64.02 N ATOM 0 H LYS A 60 -4.956 21.592 -1.589 1.00 35.52 H new ATOM 0 HA LYS A 60 -4.139 21.216 1.179 1.00 52.53 H new ATOM 0 HB2 LYS A 60 -5.957 19.468 1.082 1.00 75.42 H new ATOM 0 HB3 LYS A 60 -6.489 21.101 0.736 1.00 75.42 H new ATOM 0 HG2 LYS A 60 -6.510 20.638 -1.667 1.00 41.34 H new ATOM 0 HG3 LYS A 60 -5.828 19.045 -1.402 1.00 41.34 H new ATOM 0 HD2 LYS A 60 -7.819 18.152 -0.694 1.00 60.34 H new ATOM 0 HD3 LYS A 60 -8.301 19.611 0.149 1.00 60.34 H new ATOM 0 HE2 LYS A 60 -8.997 20.676 -1.910 1.00 4.52 H new ATOM 0 HE3 LYS A 60 -8.265 19.417 -2.884 1.00 4.52 H new ATOM 0 HZ1 LYS A 60 -10.778 19.346 -2.473 1.00 64.02 H new ATOM 0 HZ2 LYS A 60 -9.906 17.897 -2.319 1.00 64.02 H new ATOM 0 HZ3 LYS A 60 -10.386 18.751 -0.932 1.00 64.02 H new ATOM 957 N TYR A 61 -2.997 19.394 -1.181 1.00 14.05 N ATOM 958 CA TYR A 61 -2.116 18.282 -1.518 1.00 71.14 C ATOM 959 C TYR A 61 -0.684 18.765 -1.728 1.00 30.13 C ATOM 960 O TYR A 61 -0.106 18.584 -2.800 1.00 60.54 O ATOM 961 CB TYR A 61 -2.616 17.571 -2.776 1.00 71.25 C ATOM 962 CG TYR A 61 -4.118 17.402 -2.819 1.00 2.03 C ATOM 963 CD1 TYR A 61 -4.784 16.680 -1.837 1.00 71.04 C ATOM 964 CD2 TYR A 61 -4.870 17.964 -3.843 1.00 2.40 C ATOM 965 CE1 TYR A 61 -6.156 16.521 -1.873 1.00 44.31 C ATOM 966 CE2 TYR A 61 -6.243 17.813 -3.887 1.00 73.23 C ATOM 967 CZ TYR A 61 -6.881 17.090 -2.901 1.00 4.15 C ATOM 968 OH TYR A 61 -8.248 16.937 -2.939 1.00 1.43 O ATOM 0 H TYR A 61 -3.163 20.047 -1.946 1.00 14.05 H new ATOM 0 HA TYR A 61 -2.124 17.580 -0.684 1.00 71.14 H new ATOM 0 HB2 TYR A 61 -2.297 18.134 -3.653 1.00 71.25 H new ATOM 0 HB3 TYR A 61 -2.146 16.589 -2.840 1.00 71.25 H new ATOM 0 HD1 TYR A 61 -4.219 16.235 -1.031 1.00 71.04 H new ATOM 0 HD2 TYR A 61 -4.373 18.529 -4.618 1.00 2.40 H new ATOM 0 HE1 TYR A 61 -6.658 15.955 -1.102 1.00 44.31 H new ATOM 0 HE2 TYR A 61 -6.813 18.259 -4.689 1.00 73.23 H new ATOM 0 HH TYR A 61 -8.551 16.500 -2.116 1.00 1.43 H new ATOM 978 N THR A 62 -0.117 19.382 -0.695 1.00 71.44 N ATOM 979 CA THR A 62 1.246 19.892 -0.764 1.00 10.10 C ATOM 980 C THR A 62 2.235 18.902 -0.160 1.00 71.52 C ATOM 981 O THR A 62 3.121 18.394 -0.849 1.00 70.23 O ATOM 982 CB THR A 62 1.378 21.242 -0.036 1.00 54.41 C ATOM 983 OG1 THR A 62 0.086 21.836 0.134 1.00 54.14 O ATOM 984 CG2 THR A 62 2.278 22.191 -0.813 1.00 32.11 C ATOM 0 H THR A 62 -0.582 19.540 0.199 1.00 71.44 H new ATOM 0 HA THR A 62 1.477 20.033 -1.820 1.00 10.10 H new ATOM 0 HB THR A 62 1.826 21.059 0.941 1.00 54.41 H new ATOM 0 HG1 THR A 62 0.179 22.694 0.599 1.00 54.14 H new ATOM 0 HG21 THR A 62 2.356 23.138 -0.279 1.00 32.11 H new ATOM 0 HG22 THR A 62 3.269 21.750 -0.916 1.00 32.11 H new ATOM 0 HG23 THR A 62 1.855 22.366 -1.802 1.00 32.11 H new ATOM 992 N LEU A 63 2.080 18.631 1.131 1.00 70.40 N ATOM 993 CA LEU A 63 2.959 17.700 1.830 1.00 22.45 C ATOM 994 C LEU A 63 2.203 16.441 2.240 1.00 21.32 C ATOM 995 O LEU A 63 2.756 15.564 2.904 1.00 24.35 O ATOM 996 CB LEU A 63 3.566 18.371 3.064 1.00 14.53 C ATOM 997 CG LEU A 63 2.814 18.160 4.379 1.00 33.33 C ATOM 998 CD1 LEU A 63 3.531 18.863 5.521 1.00 44.54 C ATOM 999 CD2 LEU A 63 1.381 18.659 4.260 1.00 34.14 C ATOM 0 H LEU A 63 1.353 19.043 1.716 1.00 70.40 H new ATOM 0 HA LEU A 63 3.760 17.413 1.149 1.00 22.45 H new ATOM 0 HB2 LEU A 63 4.585 18.005 3.188 1.00 14.53 H new ATOM 0 HB3 LEU A 63 3.633 19.442 2.875 1.00 14.53 H new ATOM 0 HG LEU A 63 2.789 17.092 4.594 1.00 33.33 H new ATOM 0 HD11 LEU A 63 2.982 18.702 6.449 1.00 44.54 H new ATOM 0 HD12 LEU A 63 4.539 18.460 5.621 1.00 44.54 H new ATOM 0 HD13 LEU A 63 3.587 19.931 5.313 1.00 44.54 H new ATOM 0 HD21 LEU A 63 0.861 18.501 5.205 1.00 34.14 H new ATOM 0 HD22 LEU A 63 1.385 19.723 4.021 1.00 34.14 H new ATOM 0 HD23 LEU A 63 0.870 18.111 3.468 1.00 34.14 H new ATOM 1011 N TRP A 64 0.940 16.358 1.839 1.00 4.53 N ATOM 1012 CA TRP A 64 0.110 15.204 2.163 1.00 50.12 C ATOM 1013 C TRP A 64 0.747 13.915 1.657 1.00 52.11 C ATOM 1014 O TRP A 64 0.494 12.835 2.191 1.00 52.14 O ATOM 1015 CB TRP A 64 -1.287 15.369 1.560 1.00 45.11 C ATOM 1016 CG TRP A 64 -1.467 14.630 0.270 1.00 5.32 C ATOM 1017 CD1 TRP A 64 -2.285 13.559 0.046 1.00 25.31 C ATOM 1018 CD2 TRP A 64 -0.813 14.905 -0.974 1.00 40.31 C ATOM 1019 NE1 TRP A 64 -2.180 13.153 -1.262 1.00 23.33 N ATOM 1020 CE2 TRP A 64 -1.284 13.962 -1.909 1.00 24.22 C ATOM 1021 CE3 TRP A 64 0.122 15.856 -1.390 1.00 53.41 C ATOM 1022 CZ2 TRP A 64 -0.848 13.945 -3.232 1.00 70.32 C ATOM 1023 CZ3 TRP A 64 0.554 15.837 -2.702 1.00 55.11 C ATOM 1024 CH2 TRP A 64 0.068 14.888 -3.611 1.00 13.15 C ATOM 0 H TRP A 64 0.468 17.076 1.289 1.00 4.53 H new ATOM 0 HA TRP A 64 0.025 15.143 3.248 1.00 50.12 H new ATOM 0 HB2 TRP A 64 -2.029 15.019 2.278 1.00 45.11 H new ATOM 0 HB3 TRP A 64 -1.480 16.429 1.394 1.00 45.11 H new ATOM 0 HD1 TRP A 64 -2.921 13.099 0.788 1.00 25.31 H new ATOM 0 HE1 TRP A 64 -2.687 12.375 -1.683 1.00 23.33 H new ATOM 0 HE3 TRP A 64 0.501 16.593 -0.698 1.00 53.41 H new ATOM 0 HZ2 TRP A 64 -1.220 13.213 -3.934 1.00 70.32 H new ATOM 0 HZ3 TRP A 64 1.279 16.566 -3.033 1.00 55.11 H new ATOM 0 HH2 TRP A 64 0.423 14.901 -4.631 1.00 13.15 H new ATOM 1035 N PHE A 65 1.574 14.035 0.623 1.00 21.42 N ATOM 1036 CA PHE A 65 2.247 12.878 0.044 1.00 54.41 C ATOM 1037 C PHE A 65 3.762 13.054 0.086 1.00 55.14 C ATOM 1038 O PHE A 65 4.506 12.084 0.230 1.00 43.01 O ATOM 1039 CB PHE A 65 1.786 12.663 -1.398 1.00 0.51 C ATOM 1040 CG PHE A 65 0.884 11.475 -1.568 1.00 35.13 C ATOM 1041 CD1 PHE A 65 -0.053 11.154 -0.598 1.00 1.23 C ATOM 1042 CD2 PHE A 65 0.972 10.677 -2.698 1.00 72.04 C ATOM 1043 CE1 PHE A 65 -0.885 10.062 -0.752 1.00 74.41 C ATOM 1044 CE2 PHE A 65 0.142 9.582 -2.856 1.00 63.43 C ATOM 1045 CZ PHE A 65 -0.787 9.274 -1.882 1.00 12.20 C ATOM 0 H PHE A 65 1.794 14.922 0.169 1.00 21.42 H new ATOM 0 HA PHE A 65 1.984 12.001 0.636 1.00 54.41 H new ATOM 0 HB2 PHE A 65 1.265 13.557 -1.741 1.00 0.51 H new ATOM 0 HB3 PHE A 65 2.661 12.539 -2.036 1.00 0.51 H new ATOM 0 HD1 PHE A 65 -0.133 11.765 0.289 1.00 1.23 H new ATOM 0 HD2 PHE A 65 1.697 10.913 -3.463 1.00 72.04 H new ATOM 0 HE1 PHE A 65 -1.612 9.825 0.011 1.00 74.41 H new ATOM 0 HE2 PHE A 65 0.220 8.968 -3.741 1.00 63.43 H new ATOM 0 HZ PHE A 65 -1.435 8.419 -2.004 1.00 12.20 H new ATOM 1055 N MET A 66 4.211 14.298 -0.044 1.00 21.31 N ATOM 1056 CA MET A 66 5.638 14.601 -0.021 1.00 54.24 C ATOM 1057 C MET A 66 6.312 13.956 1.185 1.00 62.12 C ATOM 1058 O MET A 66 7.467 13.534 1.112 1.00 43.23 O ATOM 1059 CB MET A 66 5.859 16.115 0.006 1.00 0.42 C ATOM 1060 CG MET A 66 7.111 16.560 -0.732 1.00 60.21 C ATOM 1061 SD MET A 66 8.122 17.695 0.238 1.00 74.33 S ATOM 1062 CE MET A 66 8.835 16.573 1.439 1.00 12.21 C ATOM 0 H MET A 66 3.608 15.112 -0.166 1.00 21.31 H new ATOM 0 HA MET A 66 6.085 14.191 -0.927 1.00 54.24 H new ATOM 0 HB2 MET A 66 4.993 16.608 -0.435 1.00 0.42 H new ATOM 0 HB3 MET A 66 5.921 16.446 1.043 1.00 0.42 H new ATOM 0 HG2 MET A 66 7.704 15.684 -0.994 1.00 60.21 H new ATOM 0 HG3 MET A 66 6.825 17.042 -1.667 1.00 60.21 H new ATOM 0 HE1 MET A 66 8.517 16.862 2.441 1.00 12.21 H new ATOM 0 HE2 MET A 66 8.500 15.557 1.231 1.00 12.21 H new ATOM 0 HE3 MET A 66 9.922 16.617 1.377 1.00 12.21 H new ATOM 1072 N THR A 67 5.584 13.882 2.295 1.00 35.53 N ATOM 1073 CA THR A 67 6.112 13.289 3.517 1.00 25.30 C ATOM 1074 C THR A 67 5.107 12.326 4.140 1.00 54.02 C ATOM 1075 O THR A 67 5.216 11.975 5.314 1.00 4.44 O ATOM 1076 CB THR A 67 6.480 14.370 4.552 1.00 34.44 C ATOM 1077 OG1 THR A 67 7.099 15.483 3.899 1.00 54.41 O ATOM 1078 CG2 THR A 67 7.418 13.808 5.610 1.00 3.14 C ATOM 0 H THR A 67 4.627 14.226 2.372 1.00 35.53 H new ATOM 0 HA THR A 67 7.012 12.741 3.239 1.00 25.30 H new ATOM 0 HB THR A 67 5.564 14.701 5.041 1.00 34.44 H new ATOM 0 HG1 THR A 67 7.328 16.166 4.563 1.00 54.41 H new ATOM 0 HG21 THR A 67 7.664 14.589 6.330 1.00 3.14 H new ATOM 0 HG22 THR A 67 6.931 12.980 6.125 1.00 3.14 H new ATOM 0 HG23 THR A 67 8.332 13.452 5.134 1.00 3.14 H new ATOM 1086 N ASN A 68 4.130 11.902 3.345 1.00 30.33 N ATOM 1087 CA ASN A 68 3.106 10.979 3.820 1.00 74.32 C ATOM 1088 C ASN A 68 2.473 11.485 5.112 1.00 52.13 C ATOM 1089 O ASN A 68 2.147 10.701 6.003 1.00 64.53 O ATOM 1090 CB ASN A 68 3.707 9.589 4.042 1.00 33.53 C ATOM 1091 CG ASN A 68 4.365 9.037 2.794 1.00 60.54 C ATOM 1092 OD1 ASN A 68 5.591 8.950 2.712 1.00 41.20 O ATOM 1093 ND2 ASN A 68 3.553 8.659 1.814 1.00 22.32 N ATOM 0 H ASN A 68 4.026 12.183 2.370 1.00 30.33 H new ATOM 0 HA ASN A 68 2.329 10.914 3.058 1.00 74.32 H new ATOM 0 HB2 ASN A 68 4.442 9.638 4.845 1.00 33.53 H new ATOM 0 HB3 ASN A 68 2.923 8.905 4.369 1.00 33.53 H new ATOM 0 HD21 ASN A 68 3.939 8.279 0.950 1.00 22.32 H new ATOM 0 HD22 ASN A 68 2.543 8.749 1.925 1.00 22.32 H new ATOM 1100 N GLN A 69 2.303 12.800 5.205 1.00 44.34 N ATOM 1101 CA GLN A 69 1.708 13.411 6.389 1.00 22.34 C ATOM 1102 C GLN A 69 0.623 14.409 5.999 1.00 11.24 C ATOM 1103 O GLN A 69 0.898 15.417 5.348 1.00 12.43 O ATOM 1104 CB GLN A 69 2.784 14.108 7.222 1.00 24.40 C ATOM 1105 CG GLN A 69 2.317 14.495 8.616 1.00 53.41 C ATOM 1106 CD GLN A 69 2.340 13.328 9.584 1.00 3.24 C ATOM 1107 OE1 GLN A 69 3.399 12.930 10.070 1.00 30.13 O ATOM 1108 NE2 GLN A 69 1.167 12.774 9.871 1.00 3.22 N ATOM 0 H GLN A 69 2.568 13.462 4.476 1.00 44.34 H new ATOM 0 HA GLN A 69 1.251 12.621 6.985 1.00 22.34 H new ATOM 0 HB2 GLN A 69 3.649 13.450 7.307 1.00 24.40 H new ATOM 0 HB3 GLN A 69 3.115 15.004 6.697 1.00 24.40 H new ATOM 0 HG2 GLN A 69 2.953 15.293 9.000 1.00 53.41 H new ATOM 0 HG3 GLN A 69 1.304 14.894 8.558 1.00 53.41 H new ATOM 0 HE21 GLN A 69 0.314 13.136 9.445 1.00 3.22 H new ATOM 0 HE22 GLN A 69 1.119 11.986 10.517 1.00 3.22 H new ATOM 1117 N ILE A 70 -0.610 14.121 6.403 1.00 53.02 N ATOM 1118 CA ILE A 70 -1.737 14.995 6.097 1.00 1.12 C ATOM 1119 C ILE A 70 -1.837 16.135 7.105 1.00 5.32 C ATOM 1120 O ILE A 70 -1.831 15.911 8.314 1.00 35.42 O ATOM 1121 CB ILE A 70 -3.065 14.216 6.085 1.00 22.12 C ATOM 1122 CG1 ILE A 70 -3.249 13.457 7.400 1.00 23.30 C ATOM 1123 CG2 ILE A 70 -3.107 13.259 4.903 1.00 74.23 C ATOM 1124 CD1 ILE A 70 -4.433 13.932 8.213 1.00 41.24 C ATOM 0 H ILE A 70 -0.854 13.290 6.942 1.00 53.02 H new ATOM 0 HA ILE A 70 -1.558 15.407 5.104 1.00 1.12 H new ATOM 0 HB ILE A 70 -3.885 14.927 5.981 1.00 22.12 H new ATOM 0 HG12 ILE A 70 -3.370 12.396 7.183 1.00 23.30 H new ATOM 0 HG13 ILE A 70 -2.344 13.559 7.998 1.00 23.30 H new ATOM 0 HG21 ILE A 70 -4.052 12.716 4.908 1.00 74.23 H new ATOM 0 HG22 ILE A 70 -3.018 13.823 3.975 1.00 74.23 H new ATOM 0 HG23 ILE A 70 -2.281 12.552 4.978 1.00 74.23 H new ATOM 0 HD11 ILE A 70 -4.501 13.349 9.131 1.00 41.24 H new ATOM 0 HD12 ILE A 70 -4.305 14.986 8.461 1.00 41.24 H new ATOM 0 HD13 ILE A 70 -5.347 13.804 7.633 1.00 41.24 H new ATOM 1136 N ALA A 71 -1.932 17.360 6.595 1.00 53.21 N ATOM 1137 CA ALA A 71 -2.038 18.536 7.451 1.00 71.32 C ATOM 1138 C ALA A 71 -3.402 19.201 7.302 1.00 23.44 C ATOM 1139 O ALA A 71 -3.542 20.252 6.677 1.00 55.01 O ATOM 1140 CB ALA A 71 -0.928 19.525 7.128 1.00 72.44 C ATOM 0 H ALA A 71 -1.938 17.563 5.595 1.00 53.21 H new ATOM 0 HA ALA A 71 -1.931 18.213 8.487 1.00 71.32 H new ATOM 0 HB1 ALA A 71 -1.019 20.398 7.774 1.00 72.44 H new ATOM 0 HB2 ALA A 71 0.040 19.052 7.292 1.00 72.44 H new ATOM 0 HB3 ALA A 71 -1.009 19.835 6.086 1.00 72.44 H new ATOM 1146 N PRO A 72 -4.434 18.575 7.888 1.00 32.32 N ATOM 1147 CA PRO A 72 -5.805 19.090 7.834 1.00 40.23 C ATOM 1148 C PRO A 72 -5.981 20.361 8.657 1.00 33.14 C ATOM 1149 O PRO A 72 -6.855 21.179 8.373 1.00 11.03 O ATOM 1150 CB PRO A 72 -6.635 17.949 8.428 1.00 14.40 C ATOM 1151 CG PRO A 72 -5.688 17.210 9.307 1.00 21.53 C ATOM 1152 CD PRO A 72 -4.340 17.319 8.649 1.00 55.43 C ATOM 0 HA PRO A 72 -6.097 19.366 6.821 1.00 40.23 H new ATOM 0 HB2 PRO A 72 -7.485 18.331 8.994 1.00 14.40 H new ATOM 0 HB3 PRO A 72 -7.036 17.303 7.647 1.00 14.40 H new ATOM 0 HG2 PRO A 72 -5.669 17.640 10.309 1.00 21.53 H new ATOM 0 HG3 PRO A 72 -5.987 16.167 9.413 1.00 21.53 H new ATOM 0 HD2 PRO A 72 -3.536 17.353 9.384 1.00 55.43 H new ATOM 0 HD3 PRO A 72 -4.141 16.468 7.998 1.00 55.43 H new ATOM 1160 N GLU A 73 -5.144 20.520 9.678 1.00 23.32 N ATOM 1161 CA GLU A 73 -5.209 21.693 10.543 1.00 5.13 C ATOM 1162 C GLU A 73 -5.005 22.973 9.739 1.00 20.24 C ATOM 1163 O GLU A 73 -5.403 24.057 10.166 1.00 42.23 O ATOM 1164 CB GLU A 73 -4.154 21.598 11.647 1.00 31.42 C ATOM 1165 CG GLU A 73 -4.125 20.249 12.347 1.00 1.34 C ATOM 1166 CD GLU A 73 -5.492 19.817 12.837 1.00 12.40 C ATOM 1167 OE1 GLU A 73 -5.940 20.334 13.882 1.00 50.44 O ATOM 1168 OE2 GLU A 73 -6.115 18.959 12.177 1.00 62.13 O ATOM 0 H GLU A 73 -4.414 19.852 9.926 1.00 23.32 H new ATOM 0 HA GLU A 73 -6.199 21.724 10.998 1.00 5.13 H new ATOM 0 HB2 GLU A 73 -3.172 21.796 11.218 1.00 31.42 H new ATOM 0 HB3 GLU A 73 -4.342 22.377 12.386 1.00 31.42 H new ATOM 0 HG2 GLU A 73 -3.734 19.497 11.662 1.00 1.34 H new ATOM 0 HG3 GLU A 73 -3.439 20.297 13.192 1.00 1.34 H new ATOM 1175 N SER A 74 -4.383 22.840 8.572 1.00 3.44 N ATOM 1176 CA SER A 74 -4.122 23.986 7.709 1.00 51.31 C ATOM 1177 C SER A 74 -4.889 23.863 6.396 1.00 0.10 C ATOM 1178 O SER A 74 -4.738 24.688 5.496 1.00 72.23 O ATOM 1179 CB SER A 74 -2.623 24.108 7.427 1.00 74.54 C ATOM 1180 OG SER A 74 -1.973 24.858 8.439 1.00 24.41 O ATOM 0 H SER A 74 -4.050 21.950 8.202 1.00 3.44 H new ATOM 0 HA SER A 74 -4.462 24.884 8.226 1.00 51.31 H new ATOM 0 HB2 SER A 74 -2.179 23.114 7.365 1.00 74.54 H new ATOM 0 HB3 SER A 74 -2.469 24.587 6.460 1.00 74.54 H new ATOM 0 HG SER A 74 -1.689 25.722 8.074 1.00 24.41 H new ATOM 1186 N GLY A 75 -5.715 22.826 6.295 1.00 44.22 N ATOM 1187 CA GLY A 75 -6.495 22.613 5.089 1.00 41.33 C ATOM 1188 C GLY A 75 -5.776 21.738 4.082 1.00 61.32 C ATOM 1189 O GLY A 75 -5.737 22.054 2.893 1.00 21.02 O ATOM 0 H GLY A 75 -5.858 22.130 7.026 1.00 44.22 H new ATOM 0 HA2 GLY A 75 -7.447 22.152 5.352 1.00 41.33 H new ATOM 0 HA3 GLY A 75 -6.723 23.576 4.632 1.00 41.33 H new ATOM 1193 N GLN A 76 -5.205 20.636 4.558 1.00 43.44 N ATOM 1194 CA GLN A 76 -4.483 19.714 3.690 1.00 71.34 C ATOM 1195 C GLN A 76 -4.805 18.266 4.044 1.00 22.20 C ATOM 1196 O GLN A 76 -4.560 17.822 5.166 1.00 15.14 O ATOM 1197 CB GLN A 76 -2.976 19.954 3.797 1.00 1.44 C ATOM 1198 CG GLN A 76 -2.593 21.425 3.791 1.00 0.22 C ATOM 1199 CD GLN A 76 -1.094 21.638 3.705 1.00 70.30 C ATOM 1200 OE1 GLN A 76 -0.515 22.381 4.498 1.00 4.14 O ATOM 1201 NE2 GLN A 76 -0.459 20.984 2.740 1.00 55.24 N ATOM 0 H GLN A 76 -5.229 20.360 5.540 1.00 43.44 H new ATOM 0 HA GLN A 76 -4.802 19.897 2.664 1.00 71.34 H new ATOM 0 HB2 GLN A 76 -2.607 19.495 4.714 1.00 1.44 H new ATOM 0 HB3 GLN A 76 -2.477 19.454 2.967 1.00 1.44 H new ATOM 0 HG2 GLN A 76 -3.075 21.919 2.947 1.00 0.22 H new ATOM 0 HG3 GLN A 76 -2.972 21.899 4.696 1.00 0.22 H new ATOM 0 HE21 GLN A 76 -0.980 20.379 2.106 1.00 55.24 H new ATOM 0 HE22 GLN A 76 0.550 21.087 2.633 1.00 55.24 H new ATOM 1210 N ILE A 77 -5.357 17.535 3.081 1.00 35.21 N ATOM 1211 CA ILE A 77 -5.712 16.137 3.293 1.00 50.55 C ATOM 1212 C ILE A 77 -5.519 15.322 2.018 1.00 25.22 C ATOM 1213 O ILE A 77 -5.212 15.870 0.959 1.00 5.00 O ATOM 1214 CB ILE A 77 -7.170 15.992 3.764 1.00 45.42 C ATOM 1215 CG1 ILE A 77 -8.131 16.157 2.584 1.00 11.52 C ATOM 1216 CG2 ILE A 77 -7.479 17.011 4.852 1.00 62.31 C ATOM 1217 CD1 ILE A 77 -8.010 17.494 1.889 1.00 65.21 C ATOM 0 H ILE A 77 -5.568 17.887 2.147 1.00 35.21 H new ATOM 0 HA ILE A 77 -5.048 15.757 4.069 1.00 50.55 H new ATOM 0 HB ILE A 77 -7.304 14.993 4.179 1.00 45.42 H new ATOM 0 HG12 ILE A 77 -7.945 15.363 1.861 1.00 11.52 H new ATOM 0 HG13 ILE A 77 -9.154 16.032 2.939 1.00 11.52 H new ATOM 0 HG21 ILE A 77 -8.514 16.896 5.175 1.00 62.31 H new ATOM 0 HG22 ILE A 77 -6.814 16.850 5.701 1.00 62.31 H new ATOM 0 HG23 ILE A 77 -7.331 18.017 4.461 1.00 62.31 H new ATOM 0 HD11 ILE A 77 -8.720 17.541 1.064 1.00 65.21 H new ATOM 0 HD12 ILE A 77 -8.225 18.293 2.598 1.00 65.21 H new ATOM 0 HD13 ILE A 77 -6.997 17.613 1.503 1.00 65.21 H new ATOM 1229 N ALA A 78 -5.702 14.010 2.127 1.00 44.32 N ATOM 1230 CA ALA A 78 -5.551 13.120 0.983 1.00 35.42 C ATOM 1231 C ALA A 78 -6.868 12.966 0.230 1.00 61.12 C ATOM 1232 O ALA A 78 -7.941 12.852 0.823 1.00 40.31 O ATOM 1233 CB ALA A 78 -5.039 11.761 1.435 1.00 72.54 C ATOM 0 H ALA A 78 -5.955 13.540 2.996 1.00 44.32 H new ATOM 0 HA ALA A 78 -4.823 13.563 0.304 1.00 35.42 H new ATOM 0 HB1 ALA A 78 -4.931 11.107 0.570 1.00 72.54 H new ATOM 0 HB2 ALA A 78 -4.071 11.880 1.923 1.00 72.54 H new ATOM 0 HB3 ALA A 78 -5.747 11.321 2.137 1.00 72.54 H new ATOM 1239 N PRO A 79 -6.789 12.966 -1.109 1.00 45.11 N ATOM 1240 CA PRO A 79 -7.965 12.827 -1.972 1.00 73.10 C ATOM 1241 C PRO A 79 -8.569 11.429 -1.909 1.00 74.34 C ATOM 1242 O PRO A 79 -8.191 10.617 -1.065 1.00 72.43 O ATOM 1243 CB PRO A 79 -7.414 13.110 -3.372 1.00 3.43 C ATOM 1244 CG PRO A 79 -5.968 12.762 -3.286 1.00 4.55 C ATOM 1245 CD PRO A 79 -5.543 13.099 -1.884 1.00 54.14 C ATOM 0 HA PRO A 79 -8.771 13.497 -1.673 1.00 73.10 H new ATOM 0 HB2 PRO A 79 -7.922 12.509 -4.126 1.00 3.43 H new ATOM 0 HB3 PRO A 79 -7.554 14.155 -3.649 1.00 3.43 H new ATOM 0 HG2 PRO A 79 -5.808 11.705 -3.499 1.00 4.55 H new ATOM 0 HG3 PRO A 79 -5.387 13.326 -4.016 1.00 4.55 H new ATOM 0 HD2 PRO A 79 -4.771 12.419 -1.524 1.00 54.14 H new ATOM 0 HD3 PRO A 79 -5.135 14.108 -1.819 1.00 54.14 H new ATOM 1253 N ALA A 80 -9.509 11.154 -2.808 1.00 1.11 N ATOM 1254 CA ALA A 80 -10.163 9.853 -2.856 1.00 34.34 C ATOM 1255 C ALA A 80 -9.389 8.881 -3.741 1.00 51.31 C ATOM 1256 O ALA A 80 -9.516 7.664 -3.604 1.00 70.35 O ATOM 1257 CB ALA A 80 -11.593 9.998 -3.353 1.00 63.50 C ATOM 0 H ALA A 80 -9.834 11.816 -3.513 1.00 1.11 H new ATOM 0 HA ALA A 80 -10.182 9.447 -1.845 1.00 34.34 H new ATOM 0 HB1 ALA A 80 -12.069 9.018 -3.384 1.00 63.50 H new ATOM 0 HB2 ALA A 80 -12.148 10.650 -2.679 1.00 63.50 H new ATOM 0 HB3 ALA A 80 -11.588 10.430 -4.354 1.00 63.50 H new ATOM 1263 N LEU A 81 -8.589 9.426 -4.650 1.00 5.22 N ATOM 1264 CA LEU A 81 -7.795 8.608 -5.559 1.00 2.43 C ATOM 1265 C LEU A 81 -6.448 8.251 -4.936 1.00 54.42 C ATOM 1266 O LEU A 81 -5.834 7.247 -5.293 1.00 41.41 O ATOM 1267 CB LEU A 81 -7.577 9.344 -6.883 1.00 34.21 C ATOM 1268 CG LEU A 81 -8.831 9.601 -7.720 1.00 32.21 C ATOM 1269 CD1 LEU A 81 -9.192 11.079 -7.700 1.00 11.43 C ATOM 1270 CD2 LEU A 81 -8.625 9.120 -9.149 1.00 41.44 C ATOM 0 H LEU A 81 -8.473 10.431 -4.777 1.00 5.22 H new ATOM 0 HA LEU A 81 -8.343 7.685 -5.749 1.00 2.43 H new ATOM 0 HB2 LEU A 81 -7.104 10.302 -6.670 1.00 34.21 H new ATOM 0 HB3 LEU A 81 -6.874 8.768 -7.485 1.00 34.21 H new ATOM 0 HG LEU A 81 -9.658 9.040 -7.284 1.00 32.21 H new ATOM 0 HD11 LEU A 81 -10.087 11.243 -8.301 1.00 11.43 H new ATOM 0 HD12 LEU A 81 -9.381 11.393 -6.674 1.00 11.43 H new ATOM 0 HD13 LEU A 81 -8.367 11.661 -8.111 1.00 11.43 H new ATOM 0 HD21 LEU A 81 -9.527 9.311 -9.731 1.00 41.44 H new ATOM 0 HD22 LEU A 81 -7.786 9.654 -9.595 1.00 41.44 H new ATOM 0 HD23 LEU A 81 -8.414 8.051 -9.146 1.00 41.44 H new ATOM 1282 N ALA A 82 -5.996 9.082 -4.003 1.00 61.40 N ATOM 1283 CA ALA A 82 -4.725 8.852 -3.326 1.00 42.42 C ATOM 1284 C ALA A 82 -4.643 7.431 -2.781 1.00 41.25 C ATOM 1285 O ALA A 82 -3.612 6.770 -2.899 1.00 1.31 O ATOM 1286 CB ALA A 82 -4.534 9.863 -2.205 1.00 60.33 C ATOM 0 H ALA A 82 -6.491 9.920 -3.698 1.00 61.40 H new ATOM 0 HA ALA A 82 -3.924 8.979 -4.055 1.00 42.42 H new ATOM 0 HB1 ALA A 82 -3.581 9.680 -1.708 1.00 60.33 H new ATOM 0 HB2 ALA A 82 -4.539 10.871 -2.619 1.00 60.33 H new ATOM 0 HB3 ALA A 82 -5.345 9.763 -1.483 1.00 60.33 H new ATOM 1292 N HIS A 83 -5.735 6.968 -2.182 1.00 52.44 N ATOM 1293 CA HIS A 83 -5.786 5.625 -1.616 1.00 62.14 C ATOM 1294 C HIS A 83 -4.710 5.442 -0.551 1.00 43.04 C ATOM 1295 O HIS A 83 -4.286 4.322 -0.267 1.00 74.24 O ATOM 1296 CB HIS A 83 -5.611 4.578 -2.719 1.00 52.01 C ATOM 1297 CG HIS A 83 -6.753 3.614 -2.815 1.00 71.45 C ATOM 1298 ND1 HIS A 83 -6.844 2.476 -2.041 1.00 72.31 N ATOM 1299 CD2 HIS A 83 -7.856 3.623 -3.598 1.00 33.10 C ATOM 1300 CE1 HIS A 83 -7.953 1.827 -2.346 1.00 41.15 C ATOM 1301 NE2 HIS A 83 -8.587 2.502 -3.289 1.00 35.44 N ATOM 0 H HIS A 83 -6.597 7.503 -2.076 1.00 52.44 H new ATOM 0 HA HIS A 83 -6.761 5.492 -1.148 1.00 62.14 H new ATOM 0 HB2 HIS A 83 -5.494 5.086 -3.676 1.00 52.01 H new ATOM 0 HB3 HIS A 83 -4.691 4.022 -2.538 1.00 52.01 H new ATOM 0 HD2 HIS A 83 -8.114 4.373 -4.331 1.00 33.10 H new ATOM 0 HE1 HIS A 83 -8.286 0.901 -1.900 1.00 41.15 H new ATOM 0 HE2 HIS A 83 -9.473 2.234 -3.717 1.00 35.44 H new ATOM 1309 N PHE A 84 -4.271 6.550 0.035 1.00 61.54 N ATOM 1310 CA PHE A 84 -3.242 6.513 1.069 1.00 21.02 C ATOM 1311 C PHE A 84 -3.785 7.037 2.395 1.00 45.34 C ATOM 1312 O PHE A 84 -4.002 6.273 3.334 1.00 11.55 O ATOM 1313 CB PHE A 84 -2.028 7.340 0.640 1.00 72.42 C ATOM 1314 CG PHE A 84 -0.792 6.517 0.414 1.00 14.02 C ATOM 1315 CD1 PHE A 84 -0.825 5.404 -0.410 1.00 20.34 C ATOM 1316 CD2 PHE A 84 0.403 6.855 1.028 1.00 43.32 C ATOM 1317 CE1 PHE A 84 0.310 4.644 -0.621 1.00 14.32 C ATOM 1318 CE2 PHE A 84 1.543 6.099 0.821 1.00 15.34 C ATOM 1319 CZ PHE A 84 1.495 4.992 -0.003 1.00 4.42 C ATOM 0 H PHE A 84 -4.611 7.485 -0.188 1.00 61.54 H new ATOM 0 HA PHE A 84 -2.937 5.476 1.206 1.00 21.02 H new ATOM 0 HB2 PHE A 84 -2.270 7.877 -0.277 1.00 72.42 H new ATOM 0 HB3 PHE A 84 -1.821 8.090 1.403 1.00 72.42 H new ATOM 0 HD1 PHE A 84 -1.750 5.126 -0.894 1.00 20.34 H new ATOM 0 HD2 PHE A 84 0.445 7.718 1.676 1.00 43.32 H new ATOM 0 HE1 PHE A 84 0.270 3.780 -1.268 1.00 14.32 H new ATOM 0 HE2 PHE A 84 2.469 6.374 1.303 1.00 15.34 H new ATOM 0 HZ PHE A 84 2.383 4.399 -0.164 1.00 4.42 H new ATOM 1573 N THR B 4 15.673 31.782 -4.989 1.00 72.34 N ATOM 1574 CA THR B 4 15.765 30.598 -5.833 1.00 42.42 C ATOM 1575 C THR B 4 15.504 29.329 -5.029 1.00 52.45 C ATOM 1576 O THR B 4 15.574 29.337 -3.799 1.00 62.33 O ATOM 1577 CB THR B 4 17.146 30.492 -6.504 1.00 14.31 C ATOM 1578 OG1 THR B 4 17.656 31.799 -6.786 1.00 24.44 O ATOM 1579 CG2 THR B 4 17.062 29.686 -7.792 1.00 44.11 C ATOM 0 HA THR B 4 15.002 30.700 -6.605 1.00 42.42 H new ATOM 0 HB THR B 4 17.820 29.980 -5.817 1.00 14.31 H new ATOM 0 HG1 THR B 4 17.297 32.438 -6.135 1.00 24.44 H new ATOM 0 HG21 THR B 4 18.050 29.625 -8.248 1.00 44.11 H new ATOM 0 HG22 THR B 4 16.702 28.681 -7.570 1.00 44.11 H new ATOM 0 HG23 THR B 4 16.373 30.174 -8.482 1.00 44.11 H new ATOM 1587 N ILE B 5 15.203 28.241 -5.729 1.00 72.43 N ATOM 1588 CA ILE B 5 14.934 26.964 -5.080 1.00 60.40 C ATOM 1589 C ILE B 5 16.040 26.606 -4.094 1.00 73.52 C ATOM 1590 O ILE B 5 15.774 26.293 -2.933 1.00 14.01 O ATOM 1591 CB ILE B 5 14.790 25.828 -6.109 1.00 41.35 C ATOM 1592 CG1 ILE B 5 13.661 26.142 -7.093 1.00 41.00 C ATOM 1593 CG2 ILE B 5 14.533 24.504 -5.405 1.00 64.43 C ATOM 1594 CD1 ILE B 5 13.986 25.775 -8.524 1.00 71.13 C ATOM 0 H ILE B 5 15.139 28.218 -6.747 1.00 72.43 H new ATOM 0 HA ILE B 5 13.993 27.075 -4.542 1.00 60.40 H new ATOM 0 HB ILE B 5 15.722 25.745 -6.668 1.00 41.35 H new ATOM 0 HG12 ILE B 5 12.762 25.608 -6.785 1.00 41.00 H new ATOM 0 HG13 ILE B 5 13.432 27.206 -7.043 1.00 41.00 H new ATOM 0 HG21 ILE B 5 14.434 23.711 -6.146 1.00 64.43 H new ATOM 0 HG22 ILE B 5 15.367 24.277 -4.741 1.00 64.43 H new ATOM 0 HG23 ILE B 5 13.614 24.574 -4.823 1.00 64.43 H new ATOM 0 HD11 ILE B 5 13.141 26.026 -9.165 1.00 71.13 H new ATOM 0 HD12 ILE B 5 14.866 26.329 -8.851 1.00 71.13 H new ATOM 0 HD13 ILE B 5 14.186 24.705 -8.589 1.00 71.13 H new ATOM 1606 N SER B 6 17.283 26.653 -4.564 1.00 1.32 N ATOM 1607 CA SER B 6 18.430 26.331 -3.725 1.00 35.53 C ATOM 1608 C SER B 6 18.388 27.121 -2.420 1.00 22.31 C ATOM 1609 O SER B 6 18.595 26.568 -1.341 1.00 0.21 O ATOM 1610 CB SER B 6 19.733 26.626 -4.470 1.00 41.32 C ATOM 1611 OG SER B 6 20.371 27.778 -3.948 1.00 21.35 O ATOM 0 H SER B 6 17.520 26.911 -5.522 1.00 1.32 H new ATOM 0 HA SER B 6 18.388 25.268 -3.488 1.00 35.53 H new ATOM 0 HB2 SER B 6 20.402 25.769 -4.391 1.00 41.32 H new ATOM 0 HB3 SER B 6 19.524 26.771 -5.530 1.00 41.32 H new ATOM 0 HG SER B 6 21.011 27.512 -3.256 1.00 21.35 H new ATOM 1617 N GLU B 7 18.120 28.418 -2.530 1.00 32.11 N ATOM 1618 CA GLU B 7 18.052 29.285 -1.359 1.00 62.35 C ATOM 1619 C GLU B 7 17.028 28.763 -0.355 1.00 42.41 C ATOM 1620 O GLU B 7 17.233 28.843 0.857 1.00 11.21 O ATOM 1621 CB GLU B 7 17.693 30.713 -1.774 1.00 23.21 C ATOM 1622 CG GLU B 7 18.745 31.376 -2.647 1.00 1.43 C ATOM 1623 CD GLU B 7 19.093 32.776 -2.179 1.00 1.34 C ATOM 1624 OE1 GLU B 7 19.856 32.902 -1.199 1.00 64.22 O ATOM 1625 OE2 GLU B 7 18.599 33.746 -2.794 1.00 2.32 O ATOM 0 H GLU B 7 17.947 28.891 -3.417 1.00 32.11 H new ATOM 0 HA GLU B 7 19.033 29.288 -0.884 1.00 62.35 H new ATOM 0 HB2 GLU B 7 16.744 30.699 -2.310 1.00 23.21 H new ATOM 0 HB3 GLU B 7 17.544 31.316 -0.878 1.00 23.21 H new ATOM 0 HG2 GLU B 7 19.647 30.764 -2.651 1.00 1.43 H new ATOM 0 HG3 GLU B 7 18.384 31.420 -3.675 1.00 1.43 H new ATOM 1632 N LYS B 8 15.924 28.229 -0.866 1.00 33.03 N ATOM 1633 CA LYS B 8 14.868 27.692 -0.017 1.00 74.20 C ATOM 1634 C LYS B 8 15.374 26.505 0.797 1.00 72.42 C ATOM 1635 O LYS B 8 14.745 26.098 1.774 1.00 55.43 O ATOM 1636 CB LYS B 8 13.669 27.267 -0.867 1.00 61.22 C ATOM 1637 CG LYS B 8 13.288 28.280 -1.933 1.00 10.12 C ATOM 1638 CD LYS B 8 11.826 28.153 -2.327 1.00 72.53 C ATOM 1639 CE LYS B 8 11.076 29.458 -2.116 1.00 74.45 C ATOM 1640 NZ LYS B 8 10.221 29.802 -3.285 1.00 44.13 N ATOM 0 H LYS B 8 15.737 28.157 -1.866 1.00 33.03 H new ATOM 0 HA LYS B 8 14.557 28.476 0.673 1.00 74.20 H new ATOM 0 HB2 LYS B 8 13.894 26.315 -1.347 1.00 61.22 H new ATOM 0 HB3 LYS B 8 12.812 27.100 -0.214 1.00 61.22 H new ATOM 0 HG2 LYS B 8 13.480 29.287 -1.564 1.00 10.12 H new ATOM 0 HG3 LYS B 8 13.916 28.138 -2.812 1.00 10.12 H new ATOM 0 HD2 LYS B 8 11.755 27.856 -3.373 1.00 72.53 H new ATOM 0 HD3 LYS B 8 11.357 27.364 -1.739 1.00 72.53 H new ATOM 0 HE2 LYS B 8 10.456 29.380 -1.223 1.00 74.45 H new ATOM 0 HE3 LYS B 8 11.790 30.262 -1.939 1.00 74.45 H new ATOM 0 HZ1 LYS B 8 9.726 30.698 -3.102 1.00 44.13 H new ATOM 0 HZ2 LYS B 8 10.815 29.902 -4.133 1.00 44.13 H new ATOM 0 HZ3 LYS B 8 9.523 29.047 -3.439 1.00 44.13 H new ATOM 1654 N ILE B 9 16.513 25.957 0.388 1.00 12.54 N ATOM 1655 CA ILE B 9 17.104 24.819 1.082 1.00 14.12 C ATOM 1656 C ILE B 9 18.387 25.220 1.803 1.00 2.44 C ATOM 1657 O ILE B 9 19.049 24.388 2.423 1.00 32.42 O ATOM 1658 CB ILE B 9 17.414 23.666 0.109 1.00 61.41 C ATOM 1659 CG1 ILE B 9 16.253 23.468 -0.867 1.00 2.42 C ATOM 1660 CG2 ILE B 9 17.689 22.382 0.880 1.00 21.54 C ATOM 1661 CD1 ILE B 9 16.496 22.370 -1.880 1.00 4.43 C ATOM 0 H ILE B 9 17.045 26.282 -0.419 1.00 12.54 H new ATOM 0 HA ILE B 9 16.370 24.480 1.813 1.00 14.12 H new ATOM 0 HB ILE B 9 18.306 23.922 -0.463 1.00 61.41 H new ATOM 0 HG12 ILE B 9 15.350 23.237 -0.302 1.00 2.42 H new ATOM 0 HG13 ILE B 9 16.069 24.404 -1.395 1.00 2.42 H new ATOM 0 HG21 ILE B 9 17.906 21.576 0.179 1.00 21.54 H new ATOM 0 HG22 ILE B 9 18.544 22.530 1.540 1.00 21.54 H new ATOM 0 HG23 ILE B 9 16.814 22.120 1.474 1.00 21.54 H new ATOM 0 HD11 ILE B 9 15.632 22.285 -2.539 1.00 4.43 H new ATOM 0 HD12 ILE B 9 17.381 22.609 -2.470 1.00 4.43 H new ATOM 0 HD13 ILE B 9 16.650 21.424 -1.361 1.00 4.43 H new ATOM 1673 N VAL B 10 18.731 26.501 1.718 1.00 31.43 N ATOM 1674 CA VAL B 10 19.933 27.014 2.364 1.00 4.14 C ATOM 1675 C VAL B 10 19.586 27.819 3.610 1.00 20.24 C ATOM 1676 O VAL B 10 20.182 27.631 4.671 1.00 25.00 O ATOM 1677 CB VAL B 10 20.752 27.899 1.405 1.00 14.00 C ATOM 1678 CG1 VAL B 10 22.047 28.346 2.066 1.00 0.51 C ATOM 1679 CG2 VAL B 10 21.032 27.160 0.106 1.00 13.31 C ATOM 0 H VAL B 10 18.194 27.203 1.208 1.00 31.43 H new ATOM 0 HA VAL B 10 20.532 26.149 2.649 1.00 4.14 H new ATOM 0 HB VAL B 10 20.167 28.788 1.170 1.00 14.00 H new ATOM 0 HG11 VAL B 10 22.612 28.970 1.374 1.00 0.51 H new ATOM 0 HG12 VAL B 10 21.818 28.917 2.966 1.00 0.51 H new ATOM 0 HG13 VAL B 10 22.640 27.471 2.333 1.00 0.51 H new ATOM 0 HG21 VAL B 10 21.611 27.800 -0.559 1.00 13.31 H new ATOM 0 HG22 VAL B 10 21.596 26.252 0.318 1.00 13.31 H new ATOM 0 HG23 VAL B 10 20.089 26.897 -0.374 1.00 13.31 H new ATOM 1689 N LEU B 11 18.616 28.718 3.476 1.00 4.44 N ATOM 1690 CA LEU B 11 18.188 29.554 4.593 1.00 2.34 C ATOM 1691 C LEU B 11 17.710 28.697 5.761 1.00 45.43 C ATOM 1692 O LEU B 11 18.154 28.874 6.895 1.00 75.44 O ATOM 1693 CB LEU B 11 17.071 30.499 4.148 1.00 4.21 C ATOM 1694 CG LEU B 11 15.936 29.865 3.344 1.00 62.10 C ATOM 1695 CD1 LEU B 11 14.739 29.586 4.238 1.00 1.11 C ATOM 1696 CD2 LEU B 11 15.538 30.766 2.183 1.00 42.24 C ATOM 0 H LEU B 11 18.112 28.886 2.606 1.00 4.44 H new ATOM 0 HA LEU B 11 19.043 30.143 4.924 1.00 2.34 H new ATOM 0 HB2 LEU B 11 16.644 30.967 5.035 1.00 4.21 H new ATOM 0 HB3 LEU B 11 17.513 31.295 3.549 1.00 4.21 H new ATOM 0 HG LEU B 11 16.289 28.917 2.939 1.00 62.10 H new ATOM 0 HD11 LEU B 11 13.941 29.135 3.648 1.00 1.11 H new ATOM 0 HD12 LEU B 11 15.032 28.903 5.035 1.00 1.11 H new ATOM 0 HD13 LEU B 11 14.384 30.520 4.673 1.00 1.11 H new ATOM 0 HD21 LEU B 11 14.729 30.299 1.621 1.00 42.24 H new ATOM 0 HD22 LEU B 11 15.204 31.729 2.568 1.00 42.24 H new ATOM 0 HD23 LEU B 11 16.396 30.915 1.527 1.00 42.24 H new ATOM 1708 N MET B 12 16.804 27.768 5.476 1.00 15.32 N ATOM 1709 CA MET B 12 16.269 26.883 6.503 1.00 4.44 C ATOM 1710 C MET B 12 17.337 25.910 6.993 1.00 75.53 C ATOM 1711 O MET B 12 17.462 25.662 8.193 1.00 31.24 O ATOM 1712 CB MET B 12 15.066 26.107 5.962 1.00 24.25 C ATOM 1713 CG MET B 12 15.336 25.417 4.634 1.00 13.14 C ATOM 1714 SD MET B 12 15.489 23.628 4.799 1.00 25.25 S ATOM 1715 CE MET B 12 14.750 23.082 3.262 1.00 64.33 C ATOM 0 H MET B 12 16.425 27.609 4.542 1.00 15.32 H new ATOM 0 HA MET B 12 15.948 27.497 7.345 1.00 4.44 H new ATOM 0 HB2 MET B 12 14.766 25.359 6.696 1.00 24.25 H new ATOM 0 HB3 MET B 12 14.226 26.791 5.843 1.00 24.25 H new ATOM 0 HG2 MET B 12 14.528 25.646 3.939 1.00 13.14 H new ATOM 0 HG3 MET B 12 16.252 25.818 4.201 1.00 13.14 H new ATOM 0 HE1 MET B 12 14.850 22.000 3.174 1.00 64.33 H new ATOM 0 HE2 MET B 12 13.694 23.351 3.250 1.00 64.33 H new ATOM 0 HE3 MET B 12 15.256 23.562 2.424 1.00 64.33 H new ATOM 1725 N ARG B 13 18.106 25.363 6.058 1.00 31.24 N ATOM 1726 CA ARG B 13 19.163 24.416 6.395 1.00 74.51 C ATOM 1727 C ARG B 13 20.161 25.038 7.366 1.00 20.12 C ATOM 1728 O ARG B 13 20.531 24.429 8.370 1.00 41.34 O ATOM 1729 CB ARG B 13 19.887 23.955 5.128 1.00 32.34 C ATOM 1730 CG ARG B 13 21.144 23.148 5.406 1.00 45.45 C ATOM 1731 CD ARG B 13 21.791 22.664 4.118 1.00 63.05 C ATOM 1732 NE ARG B 13 23.219 22.968 4.075 1.00 42.01 N ATOM 1733 CZ ARG B 13 23.707 24.171 3.797 1.00 41.31 C ATOM 1734 NH1 ARG B 13 22.887 25.180 3.538 1.00 23.35 N ATOM 1735 NH2 ARG B 13 25.020 24.369 3.777 1.00 12.23 N ATOM 0 H ARG B 13 18.017 25.559 5.061 1.00 31.24 H new ATOM 0 HA ARG B 13 18.703 23.553 6.877 1.00 74.51 H new ATOM 0 HB2 ARG B 13 19.204 23.353 4.528 1.00 32.34 H new ATOM 0 HB3 ARG B 13 20.150 24.829 4.532 1.00 32.34 H new ATOM 0 HG2 ARG B 13 21.854 23.759 5.964 1.00 45.45 H new ATOM 0 HG3 ARG B 13 20.897 22.292 6.034 1.00 45.45 H new ATOM 0 HD2 ARG B 13 21.646 21.588 4.022 1.00 63.05 H new ATOM 0 HD3 ARG B 13 21.295 23.130 3.266 1.00 63.05 H new ATOM 0 HE ARG B 13 23.878 22.214 4.269 1.00 42.01 H new ATOM 0 HH11 ARG B 13 21.878 25.033 3.552 1.00 23.35 H new ATOM 0 HH12 ARG B 13 23.265 26.103 3.325 1.00 23.35 H new ATOM 0 HH21 ARG B 13 25.655 23.596 3.975 1.00 12.23 H new ATOM 0 HH22 ARG B 13 25.393 25.294 3.563 1.00 12.23 H new ATOM 1749 N LYS B 14 20.593 26.257 7.061 1.00 12.22 N ATOM 1750 CA LYS B 14 21.549 26.965 7.906 1.00 65.30 C ATOM 1751 C LYS B 14 21.022 27.093 9.332 1.00 55.42 C ATOM 1752 O LYS B 14 21.797 27.182 10.285 1.00 72.04 O ATOM 1753 CB LYS B 14 21.838 28.353 7.332 1.00 13.55 C ATOM 1754 CG LYS B 14 22.945 28.363 6.292 1.00 13.50 C ATOM 1755 CD LYS B 14 23.144 29.749 5.701 1.00 31.23 C ATOM 1756 CE LYS B 14 21.886 30.241 5.001 1.00 22.12 C ATOM 1757 NZ LYS B 14 22.143 31.468 4.197 1.00 72.34 N ATOM 0 H LYS B 14 20.296 26.776 6.234 1.00 12.22 H new ATOM 0 HA LYS B 14 22.474 26.388 7.928 1.00 65.30 H new ATOM 0 HB2 LYS B 14 20.926 28.749 6.884 1.00 13.55 H new ATOM 0 HB3 LYS B 14 22.110 29.024 8.146 1.00 13.55 H new ATOM 0 HG2 LYS B 14 23.876 28.024 6.747 1.00 13.50 H new ATOM 0 HG3 LYS B 14 22.704 27.658 5.496 1.00 13.50 H new ATOM 0 HD2 LYS B 14 23.419 30.447 6.492 1.00 31.23 H new ATOM 0 HD3 LYS B 14 23.972 29.728 4.992 1.00 31.23 H new ATOM 0 HE2 LYS B 14 21.501 29.455 4.351 1.00 22.12 H new ATOM 0 HE3 LYS B 14 21.115 30.448 5.743 1.00 22.12 H new ATOM 0 HZ1 LYS B 14 21.262 31.772 3.736 1.00 72.34 H new ATOM 0 HZ2 LYS B 14 22.487 32.226 4.821 1.00 72.34 H new ATOM 0 HZ3 LYS B 14 22.861 31.264 3.472 1.00 72.34 H new ATOM 1771 N SER B 15 19.701 27.099 9.473 1.00 70.12 N ATOM 1772 CA SER B 15 19.071 27.217 10.782 1.00 60.13 C ATOM 1773 C SER B 15 19.584 26.138 11.732 1.00 64.13 C ATOM 1774 O SER B 15 19.839 26.401 12.906 1.00 73.31 O ATOM 1775 CB SER B 15 17.550 27.116 10.652 1.00 63.31 C ATOM 1776 OG SER B 15 16.903 27.729 11.753 1.00 42.11 O ATOM 0 H SER B 15 19.045 27.023 8.695 1.00 70.12 H new ATOM 0 HA SER B 15 19.329 28.193 11.194 1.00 60.13 H new ATOM 0 HB2 SER B 15 17.229 27.592 9.726 1.00 63.31 H new ATOM 0 HB3 SER B 15 17.256 26.068 10.590 1.00 63.31 H new ATOM 0 HG SER B 15 15.932 27.653 11.646 1.00 42.11 H new ATOM 1782 N GLU B 16 19.734 24.925 11.212 1.00 40.41 N ATOM 1783 CA GLU B 16 20.217 23.805 12.013 1.00 13.44 C ATOM 1784 C GLU B 16 21.724 23.897 12.225 1.00 32.01 C ATOM 1785 O GLU B 16 22.287 23.203 13.072 1.00 23.44 O ATOM 1786 CB GLU B 16 19.865 22.478 11.339 1.00 54.12 C ATOM 1787 CG GLU B 16 20.345 21.258 12.107 1.00 50.43 C ATOM 1788 CD GLU B 16 19.992 21.323 13.581 1.00 43.22 C ATOM 1789 OE1 GLU B 16 18.846 21.702 13.902 1.00 51.44 O ATOM 1790 OE2 GLU B 16 20.862 20.993 14.414 1.00 35.53 O ATOM 0 H GLU B 16 19.529 24.692 10.241 1.00 40.41 H new ATOM 0 HA GLU B 16 19.728 23.851 12.986 1.00 13.44 H new ATOM 0 HB2 GLU B 16 18.783 22.418 11.217 1.00 54.12 H new ATOM 0 HB3 GLU B 16 20.299 22.462 10.339 1.00 54.12 H new ATOM 0 HG2 GLU B 16 19.905 20.362 11.671 1.00 50.43 H new ATOM 0 HG3 GLU B 16 21.426 21.167 11.999 1.00 50.43 H new ATOM 1797 N TYR B 17 22.372 24.759 11.449 1.00 34.32 N ATOM 1798 CA TYR B 17 23.816 24.941 11.548 1.00 12.14 C ATOM 1799 C TYR B 17 24.555 23.673 11.131 1.00 53.41 C ATOM 1800 O TYR B 17 25.725 23.483 11.465 1.00 71.22 O ATOM 1801 CB TYR B 17 24.205 25.325 12.977 1.00 12.25 C ATOM 1802 CG TYR B 17 23.321 26.393 13.579 1.00 11.31 C ATOM 1803 CD1 TYR B 17 23.320 27.688 13.074 1.00 24.11 C ATOM 1804 CD2 TYR B 17 22.487 26.108 14.652 1.00 4.33 C ATOM 1805 CE1 TYR B 17 22.514 28.667 13.621 1.00 12.34 C ATOM 1806 CE2 TYR B 17 21.676 27.081 15.205 1.00 21.33 C ATOM 1807 CZ TYR B 17 21.695 28.359 14.687 1.00 21.44 C ATOM 1808 OH TYR B 17 20.890 29.331 15.234 1.00 40.42 O ATOM 0 H TYR B 17 21.921 25.343 10.745 1.00 34.32 H new ATOM 0 HA TYR B 17 24.103 25.746 10.871 1.00 12.14 H new ATOM 0 HB2 TYR B 17 24.166 24.436 13.606 1.00 12.25 H new ATOM 0 HB3 TYR B 17 25.237 25.674 12.982 1.00 12.25 H new ATOM 0 HD1 TYR B 17 23.960 27.933 12.240 1.00 24.11 H new ATOM 0 HD2 TYR B 17 22.472 25.109 15.062 1.00 4.33 H new ATOM 0 HE1 TYR B 17 22.525 29.668 13.216 1.00 12.34 H new ATOM 0 HE2 TYR B 17 21.031 26.842 16.038 1.00 21.33 H new ATOM 0 HH TYR B 17 20.375 28.950 15.976 1.00 40.42 H new ATOM 1818 N LEU B 18 23.864 22.807 10.398 1.00 12.20 N ATOM 1819 CA LEU B 18 24.452 21.556 9.933 1.00 24.40 C ATOM 1820 C LEU B 18 25.529 21.818 8.885 1.00 52.21 C ATOM 1821 O LEU B 18 25.456 22.790 8.134 1.00 53.11 O ATOM 1822 CB LEU B 18 23.370 20.645 9.352 1.00 20.43 C ATOM 1823 CG LEU B 18 22.447 21.279 8.311 1.00 13.14 C ATOM 1824 CD1 LEU B 18 22.926 20.957 6.904 1.00 73.11 C ATOM 1825 CD2 LEU B 18 21.014 20.806 8.510 1.00 4.13 C ATOM 0 H LEU B 18 22.895 22.949 10.113 1.00 12.20 H new ATOM 0 HA LEU B 18 24.914 21.061 10.787 1.00 24.40 H new ATOM 0 HB2 LEU B 18 23.856 19.781 8.899 1.00 20.43 H new ATOM 0 HB3 LEU B 18 22.757 20.273 10.173 1.00 20.43 H new ATOM 0 HG LEU B 18 22.473 22.361 8.442 1.00 13.14 H new ATOM 0 HD11 LEU B 18 22.256 21.417 6.177 1.00 73.11 H new ATOM 0 HD12 LEU B 18 23.935 21.346 6.765 1.00 73.11 H new ATOM 0 HD13 LEU B 18 22.931 19.877 6.760 1.00 73.11 H new ATOM 0 HD21 LEU B 18 20.371 21.267 7.760 1.00 4.13 H new ATOM 0 HD22 LEU B 18 20.971 19.722 8.407 1.00 4.13 H new ATOM 0 HD23 LEU B 18 20.672 21.090 9.505 1.00 4.13 H new ATOM 1837 N SER B 19 26.529 20.943 8.840 1.00 12.41 N ATOM 1838 CA SER B 19 27.623 21.080 7.886 1.00 64.34 C ATOM 1839 C SER B 19 27.340 20.282 6.617 1.00 33.32 C ATOM 1840 O SER B 19 28.241 19.672 6.040 1.00 1.23 O ATOM 1841 CB SER B 19 28.938 20.613 8.514 1.00 15.24 C ATOM 1842 OG SER B 19 30.034 21.359 8.015 1.00 63.44 O ATOM 0 H SER B 19 26.604 20.132 9.453 1.00 12.41 H new ATOM 0 HA SER B 19 27.710 22.133 7.620 1.00 64.34 H new ATOM 0 HB2 SER B 19 28.885 20.719 9.598 1.00 15.24 H new ATOM 0 HB3 SER B 19 29.089 19.554 8.304 1.00 15.24 H new ATOM 0 HG SER B 19 30.862 21.043 8.433 1.00 63.44 H new ATOM 1848 N ARG B 20 26.081 20.290 6.189 1.00 0.34 N ATOM 1849 CA ARG B 20 25.678 19.566 4.990 1.00 13.34 C ATOM 1850 C ARG B 20 25.651 18.062 5.246 1.00 61.45 C ATOM 1851 O ARG B 20 24.609 17.420 5.117 1.00 32.35 O ATOM 1852 CB ARG B 20 26.630 19.880 3.834 1.00 32.01 C ATOM 1853 CG ARG B 20 25.932 20.440 2.605 1.00 12.30 C ATOM 1854 CD ARG B 20 26.712 20.136 1.335 1.00 43.42 C ATOM 1855 NE ARG B 20 27.951 20.905 1.256 1.00 33.34 N ATOM 1856 CZ ARG B 20 27.995 22.198 0.956 1.00 13.22 C ATOM 1857 NH1 ARG B 20 26.875 22.863 0.708 1.00 45.34 N ATOM 1858 NH2 ARG B 20 29.161 22.829 0.904 1.00 44.43 N ATOM 0 H ARG B 20 25.324 20.790 6.655 1.00 0.34 H new ATOM 0 HA ARG B 20 24.672 19.890 4.722 1.00 13.34 H new ATOM 0 HB2 ARG B 20 27.378 20.596 4.175 1.00 32.01 H new ATOM 0 HB3 ARG B 20 27.163 18.971 3.556 1.00 32.01 H new ATOM 0 HG2 ARG B 20 24.931 20.016 2.529 1.00 12.30 H new ATOM 0 HG3 ARG B 20 25.814 21.518 2.712 1.00 12.30 H new ATOM 0 HD2 ARG B 20 26.943 19.071 1.298 1.00 43.42 H new ATOM 0 HD3 ARG B 20 26.092 20.358 0.467 1.00 43.42 H new ATOM 0 HE ARG B 20 28.830 20.423 1.441 1.00 33.34 H new ATOM 0 HH11 ARG B 20 25.977 22.382 0.747 1.00 45.34 H new ATOM 0 HH12 ARG B 20 26.912 23.856 0.478 1.00 45.34 H new ATOM 0 HH21 ARG B 20 30.025 22.321 1.095 1.00 44.43 H new ATOM 0 HH22 ARG B 20 29.194 23.822 0.673 1.00 44.43 H new ATOM 1872 N GLN B 21 26.802 17.507 5.608 1.00 14.43 N ATOM 1873 CA GLN B 21 26.911 16.078 5.881 1.00 43.34 C ATOM 1874 C GLN B 21 25.774 15.610 6.784 1.00 62.14 C ATOM 1875 O GLN B 21 25.239 14.516 6.605 1.00 41.54 O ATOM 1876 CB GLN B 21 28.259 15.763 6.531 1.00 2.32 C ATOM 1877 CG GLN B 21 28.754 14.354 6.247 1.00 23.52 C ATOM 1878 CD GLN B 21 30.066 14.047 6.943 1.00 53.34 C ATOM 1879 OE1 GLN B 21 31.080 13.786 6.293 1.00 14.14 O ATOM 1880 NE2 GLN B 21 30.055 14.075 8.270 1.00 71.20 N ATOM 0 H GLN B 21 27.674 18.025 5.719 1.00 14.43 H new ATOM 0 HA GLN B 21 26.841 15.545 4.933 1.00 43.34 H new ATOM 0 HB2 GLN B 21 29.001 16.479 6.176 1.00 2.32 H new ATOM 0 HB3 GLN B 21 28.174 15.900 7.609 1.00 2.32 H new ATOM 0 HG2 GLN B 21 28.000 13.636 6.568 1.00 23.52 H new ATOM 0 HG3 GLN B 21 28.878 14.226 5.172 1.00 23.52 H new ATOM 0 HE21 GLN B 21 29.193 14.296 8.768 1.00 71.20 H new ATOM 0 HE22 GLN B 21 30.909 13.876 8.791 1.00 71.20 H new ATOM 1889 N GLN B 22 25.412 16.445 7.753 1.00 33.40 N ATOM 1890 CA GLN B 22 24.340 16.114 8.684 1.00 53.02 C ATOM 1891 C GLN B 22 23.082 15.686 7.936 1.00 53.44 C ATOM 1892 O GLN B 22 22.402 14.739 8.334 1.00 72.23 O ATOM 1893 CB GLN B 22 24.029 17.312 9.583 1.00 4.03 C ATOM 1894 CG GLN B 22 23.781 16.935 11.034 1.00 5.22 C ATOM 1895 CD GLN B 22 25.063 16.787 11.828 1.00 40.14 C ATOM 1896 OE1 GLN B 22 25.720 17.775 12.158 1.00 24.31 O ATOM 1897 NE2 GLN B 22 25.429 15.548 12.138 1.00 70.34 N ATOM 0 H GLN B 22 25.845 17.355 7.913 1.00 33.40 H new ATOM 0 HA GLN B 22 24.675 15.281 9.302 1.00 53.02 H new ATOM 0 HB2 GLN B 22 24.860 18.016 9.536 1.00 4.03 H new ATOM 0 HB3 GLN B 22 23.151 17.828 9.195 1.00 4.03 H new ATOM 0 HG2 GLN B 22 23.155 17.696 11.501 1.00 5.22 H new ATOM 0 HG3 GLN B 22 23.225 15.998 11.072 1.00 5.22 H new ATOM 0 HE21 GLN B 22 24.855 14.758 11.844 1.00 70.34 H new ATOM 0 HE22 GLN B 22 26.284 15.387 12.670 1.00 70.34 H new ATOM 1906 N LEU B 23 22.777 16.389 6.850 1.00 15.24 N ATOM 1907 CA LEU B 23 21.599 16.081 6.046 1.00 60.42 C ATOM 1908 C LEU B 23 21.900 14.972 5.044 1.00 74.31 C ATOM 1909 O LEU B 23 21.059 14.109 4.789 1.00 34.01 O ATOM 1910 CB LEU B 23 21.120 17.334 5.309 1.00 62.13 C ATOM 1911 CG LEU B 23 19.832 17.184 4.498 1.00 44.52 C ATOM 1912 CD1 LEU B 23 19.138 18.527 4.346 1.00 33.53 C ATOM 1913 CD2 LEU B 23 20.129 16.576 3.135 1.00 12.23 C ATOM 0 H LEU B 23 23.329 17.175 6.506 1.00 15.24 H new ATOM 0 HA LEU B 23 20.811 15.737 6.716 1.00 60.42 H new ATOM 0 HB2 LEU B 23 20.974 18.128 6.041 1.00 62.13 H new ATOM 0 HB3 LEU B 23 21.913 17.661 4.637 1.00 62.13 H new ATOM 0 HG LEU B 23 19.162 16.512 5.035 1.00 44.52 H new ATOM 0 HD11 LEU B 23 18.224 18.401 3.766 1.00 33.53 H new ATOM 0 HD12 LEU B 23 18.891 18.923 5.331 1.00 33.53 H new ATOM 0 HD13 LEU B 23 19.801 19.223 3.831 1.00 33.53 H new ATOM 0 HD21 LEU B 23 19.202 16.476 2.571 1.00 12.23 H new ATOM 0 HD22 LEU B 23 20.817 17.223 2.590 1.00 12.23 H new ATOM 0 HD23 LEU B 23 20.581 15.593 3.266 1.00 12.23 H new ATOM 1925 N ALA B 24 23.103 15.000 4.481 1.00 31.24 N ATOM 1926 CA ALA B 24 23.515 13.993 3.510 1.00 75.43 C ATOM 1927 C ALA B 24 23.390 12.588 4.089 1.00 63.14 C ATOM 1928 O ALA B 24 23.252 11.612 3.351 1.00 31.23 O ATOM 1929 CB ALA B 24 24.943 14.254 3.054 1.00 65.45 C ATOM 0 H ALA B 24 23.809 15.708 4.680 1.00 31.24 H new ATOM 0 HA ALA B 24 22.852 14.062 2.648 1.00 75.43 H new ATOM 0 HB1 ALA B 24 25.238 13.495 2.329 1.00 65.45 H new ATOM 0 HB2 ALA B 24 25.003 15.239 2.592 1.00 65.45 H new ATOM 0 HB3 ALA B 24 25.612 14.215 3.913 1.00 65.45 H new ATOM 1935 N ASP B 25 23.441 12.492 5.412 1.00 53.33 N ATOM 1936 CA ASP B 25 23.334 11.205 6.091 1.00 63.20 C ATOM 1937 C ASP B 25 21.900 10.946 6.538 1.00 41.34 C ATOM 1938 O ASP B 25 21.530 9.812 6.850 1.00 55.50 O ATOM 1939 CB ASP B 25 24.273 11.162 7.297 1.00 35.03 C ATOM 1940 CG ASP B 25 25.509 10.322 7.038 1.00 31.34 C ATOM 1941 OD1 ASP B 25 26.508 10.877 6.533 1.00 43.25 O ATOM 1942 OD2 ASP B 25 25.478 9.110 7.339 1.00 75.51 O ATOM 0 H ASP B 25 23.556 13.290 6.037 1.00 53.33 H new ATOM 0 HA ASP B 25 23.623 10.424 5.387 1.00 63.20 H new ATOM 0 HB2 ASP B 25 24.575 12.177 7.556 1.00 35.03 H new ATOM 0 HB3 ASP B 25 23.737 10.760 8.157 1.00 35.03 H new ATOM 1947 N LEU B 26 21.093 12.002 6.568 1.00 71.41 N ATOM 1948 CA LEU B 26 19.698 11.888 6.977 1.00 64.24 C ATOM 1949 C LEU B 26 18.803 11.575 5.783 1.00 43.13 C ATOM 1950 O LEU B 26 17.609 11.316 5.939 1.00 10.22 O ATOM 1951 CB LEU B 26 19.237 13.181 7.650 1.00 4.31 C ATOM 1952 CG LEU B 26 19.046 13.119 9.166 1.00 10.30 C ATOM 1953 CD1 LEU B 26 20.054 14.017 9.868 1.00 61.54 C ATOM 1954 CD2 LEU B 26 17.626 13.514 9.542 1.00 62.25 C ATOM 0 H LEU B 26 21.382 12.947 6.314 1.00 71.41 H new ATOM 0 HA LEU B 26 19.620 11.067 7.689 1.00 64.24 H new ATOM 0 HB2 LEU B 26 19.964 13.962 7.427 1.00 4.31 H new ATOM 0 HB3 LEU B 26 18.293 13.486 7.197 1.00 4.31 H new ATOM 0 HG LEU B 26 19.214 12.093 9.492 1.00 10.30 H new ATOM 0 HD11 LEU B 26 19.903 13.960 10.946 1.00 61.54 H new ATOM 0 HD12 LEU B 26 21.065 13.689 9.625 1.00 61.54 H new ATOM 0 HD13 LEU B 26 19.917 15.046 9.536 1.00 61.54 H new ATOM 0 HD21 LEU B 26 17.509 13.464 10.625 1.00 62.25 H new ATOM 0 HD22 LEU B 26 17.429 14.531 9.202 1.00 62.25 H new ATOM 0 HD23 LEU B 26 16.921 12.831 9.069 1.00 62.25 H new ATOM 1966 N THR B 27 19.388 11.598 4.590 1.00 72.41 N ATOM 1967 CA THR B 27 18.645 11.316 3.369 1.00 53.05 C ATOM 1968 C THR B 27 19.428 10.383 2.450 1.00 51.22 C ATOM 1969 O THR B 27 19.030 10.138 1.313 1.00 32.24 O ATOM 1970 CB THR B 27 18.311 12.610 2.603 1.00 52.21 C ATOM 1971 OG1 THR B 27 19.464 13.068 1.888 1.00 2.43 O ATOM 1972 CG2 THR B 27 17.835 13.696 3.556 1.00 64.34 C ATOM 0 H THR B 27 20.375 11.809 4.444 1.00 72.41 H new ATOM 0 HA THR B 27 17.717 10.830 3.670 1.00 53.05 H new ATOM 0 HB THR B 27 17.510 12.391 1.897 1.00 52.21 H new ATOM 0 HG1 THR B 27 19.435 14.045 1.812 1.00 2.43 H new ATOM 0 HG21 THR B 27 17.605 14.600 2.992 1.00 64.34 H new ATOM 0 HG22 THR B 27 16.940 13.356 4.077 1.00 64.34 H new ATOM 0 HG23 THR B 27 18.618 13.911 4.283 1.00 64.34 H new ATOM 1980 N GLY B 28 20.545 9.866 2.953 1.00 31.12 N ATOM 1981 CA GLY B 28 21.366 8.965 2.165 1.00 0.51 C ATOM 1982 C GLY B 28 21.917 9.626 0.918 1.00 21.43 C ATOM 1983 O GLY B 28 22.387 8.949 0.003 1.00 31.15 O ATOM 0 H GLY B 28 20.896 10.055 3.892 1.00 31.12 H new ATOM 0 HA2 GLY B 28 22.193 8.603 2.776 1.00 0.51 H new ATOM 0 HA3 GLY B 28 20.775 8.095 1.880 1.00 0.51 H new ATOM 1987 N VAL B 29 21.859 10.954 0.878 1.00 41.33 N ATOM 1988 CA VAL B 29 22.356 11.707 -0.267 1.00 64.40 C ATOM 1989 C VAL B 29 23.875 11.830 -0.227 1.00 1.32 C ATOM 1990 O VAL B 29 24.478 12.037 0.826 1.00 12.41 O ATOM 1991 CB VAL B 29 21.739 13.117 -0.322 1.00 61.44 C ATOM 1992 CG1 VAL B 29 22.758 14.126 -0.830 1.00 50.43 C ATOM 1993 CG2 VAL B 29 20.493 13.120 -1.194 1.00 55.14 C ATOM 0 H VAL B 29 21.473 11.530 1.626 1.00 41.33 H new ATOM 0 HA VAL B 29 22.063 11.155 -1.160 1.00 64.40 H new ATOM 0 HB VAL B 29 21.448 13.407 0.688 1.00 61.44 H new ATOM 0 HG11 VAL B 29 22.304 15.117 -0.862 1.00 50.43 H new ATOM 0 HG12 VAL B 29 23.618 14.142 -0.161 1.00 50.43 H new ATOM 0 HG13 VAL B 29 23.082 13.843 -1.831 1.00 50.43 H new ATOM 0 HG21 VAL B 29 20.070 14.124 -1.221 1.00 55.14 H new ATOM 0 HG22 VAL B 29 20.756 12.809 -2.205 1.00 55.14 H new ATOM 0 HG23 VAL B 29 19.758 12.428 -0.781 1.00 55.14 H new ATOM 2003 N PRO B 30 24.510 11.700 -1.401 1.00 64.31 N ATOM 2004 CA PRO B 30 25.968 11.793 -1.527 1.00 44.21 C ATOM 2005 C PRO B 30 26.480 13.212 -1.295 1.00 55.44 C ATOM 2006 O PRO B 30 26.191 14.121 -2.073 1.00 52.10 O ATOM 2007 CB PRO B 30 26.227 11.361 -2.972 1.00 72.05 C ATOM 2008 CG PRO B 30 24.960 11.668 -3.693 1.00 25.14 C ATOM 2009 CD PRO B 30 23.855 11.452 -2.696 1.00 2.43 C ATOM 0 HA PRO B 30 26.482 11.180 -0.786 1.00 44.21 H new ATOM 0 HB2 PRO B 30 27.069 11.904 -3.402 1.00 72.05 H new ATOM 0 HB3 PRO B 30 26.468 10.300 -3.031 1.00 72.05 H new ATOM 0 HG2 PRO B 30 24.959 12.694 -4.061 1.00 25.14 H new ATOM 0 HG3 PRO B 30 24.837 11.018 -4.560 1.00 25.14 H new ATOM 0 HD2 PRO B 30 23.024 12.137 -2.863 1.00 2.43 H new ATOM 0 HD3 PRO B 30 23.452 10.441 -2.755 1.00 2.43 H new ATOM 2017 N TYR B 31 27.242 13.392 -0.222 1.00 55.04 N ATOM 2018 CA TYR B 31 27.792 14.700 0.112 1.00 73.24 C ATOM 2019 C TYR B 31 28.524 15.305 -1.081 1.00 50.10 C ATOM 2020 O TYR B 31 28.578 16.524 -1.237 1.00 14.12 O ATOM 2021 CB TYR B 31 28.746 14.584 1.304 1.00 71.51 C ATOM 2022 CG TYR B 31 29.384 15.898 1.697 1.00 71.30 C ATOM 2023 CD1 TYR B 31 30.513 16.369 1.039 1.00 11.35 C ATOM 2024 CD2 TYR B 31 28.856 16.668 2.727 1.00 4.21 C ATOM 2025 CE1 TYR B 31 31.100 17.567 1.397 1.00 75.30 C ATOM 2026 CE2 TYR B 31 29.435 17.868 3.089 1.00 23.24 C ATOM 2027 CZ TYR B 31 30.557 18.314 2.422 1.00 13.24 C ATOM 2028 OH TYR B 31 31.137 19.509 2.780 1.00 2.20 O ATOM 0 H TYR B 31 27.493 12.649 0.431 1.00 55.04 H new ATOM 0 HA TYR B 31 26.964 15.357 0.378 1.00 73.24 H new ATOM 0 HB2 TYR B 31 28.200 14.185 2.159 1.00 71.51 H new ATOM 0 HB3 TYR B 31 29.530 13.866 1.063 1.00 71.51 H new ATOM 0 HD1 TYR B 31 30.939 15.789 0.234 1.00 11.35 H new ATOM 0 HD2 TYR B 31 27.978 16.322 3.253 1.00 4.21 H new ATOM 0 HE1 TYR B 31 31.980 17.917 0.877 1.00 75.30 H new ATOM 0 HE2 TYR B 31 29.011 18.455 3.891 1.00 23.24 H new ATOM 0 HH TYR B 31 30.632 19.910 3.518 1.00 2.20 H new ATOM 2038 N GLY B 32 29.084 14.442 -1.924 1.00 45.13 N ATOM 2039 CA GLY B 32 29.804 14.909 -3.094 1.00 74.01 C ATOM 2040 C GLY B 32 28.937 15.748 -4.012 1.00 73.43 C ATOM 2041 O GLY B 32 29.389 16.757 -4.555 1.00 1.33 O ATOM 0 H GLY B 32 29.052 13.428 -1.817 1.00 45.13 H new ATOM 0 HA2 GLY B 32 30.666 15.496 -2.776 1.00 74.01 H new ATOM 0 HA3 GLY B 32 30.189 14.052 -3.646 1.00 74.01 H new ATOM 2045 N THR B 33 27.687 15.330 -4.188 1.00 10.04 N ATOM 2046 CA THR B 33 26.755 16.048 -5.048 1.00 11.04 C ATOM 2047 C THR B 33 25.941 17.063 -4.252 1.00 2.51 C ATOM 2048 O THR B 33 25.561 18.113 -4.770 1.00 23.25 O ATOM 2049 CB THR B 33 25.793 15.082 -5.763 1.00 3.23 C ATOM 2050 OG1 THR B 33 26.461 13.850 -6.053 1.00 14.15 O ATOM 2051 CG2 THR B 33 25.269 15.696 -7.054 1.00 42.22 C ATOM 0 H THR B 33 27.297 14.498 -3.746 1.00 10.04 H new ATOM 0 HA THR B 33 27.353 16.572 -5.794 1.00 11.04 H new ATOM 0 HB THR B 33 24.949 14.890 -5.101 1.00 3.23 H new ATOM 0 HG1 THR B 33 25.841 13.241 -6.506 1.00 14.15 H new ATOM 0 HG21 THR B 33 24.591 14.995 -7.541 1.00 42.22 H new ATOM 0 HG22 THR B 33 24.735 16.619 -6.827 1.00 42.22 H new ATOM 0 HG23 THR B 33 26.105 15.914 -7.719 1.00 42.22 H new ATOM 2059 N LEU B 34 25.678 16.742 -2.990 1.00 5.42 N ATOM 2060 CA LEU B 34 24.909 17.626 -2.121 1.00 11.23 C ATOM 2061 C LEU B 34 25.481 19.040 -2.138 1.00 53.41 C ATOM 2062 O LEU B 34 24.740 20.021 -2.099 1.00 25.43 O ATOM 2063 CB LEU B 34 24.898 17.085 -0.690 1.00 44.11 C ATOM 2064 CG LEU B 34 24.276 17.996 0.368 1.00 20.43 C ATOM 2065 CD1 LEU B 34 22.764 18.035 0.216 1.00 30.33 C ATOM 2066 CD2 LEU B 34 24.661 17.531 1.765 1.00 54.42 C ATOM 0 H LEU B 34 25.986 15.877 -2.546 1.00 5.42 H new ATOM 0 HA LEU B 34 23.886 17.663 -2.496 1.00 11.23 H new ATOM 0 HB2 LEU B 34 24.360 16.137 -0.686 1.00 44.11 H new ATOM 0 HB3 LEU B 34 25.925 16.870 -0.397 1.00 44.11 H new ATOM 0 HG LEU B 34 24.662 19.005 0.223 1.00 20.43 H new ATOM 0 HD11 LEU B 34 22.338 18.688 0.978 1.00 30.33 H new ATOM 0 HD12 LEU B 34 22.507 18.415 -0.773 1.00 30.33 H new ATOM 0 HD13 LEU B 34 22.360 17.029 0.334 1.00 30.33 H new ATOM 0 HD21 LEU B 34 24.209 18.191 2.506 1.00 54.42 H new ATOM 0 HD22 LEU B 34 24.304 16.513 1.921 1.00 54.42 H new ATOM 0 HD23 LEU B 34 25.746 17.555 1.871 1.00 54.42 H new ATOM 2078 N SER B 35 26.806 19.135 -2.200 1.00 61.31 N ATOM 2079 CA SER B 35 27.478 20.429 -2.220 1.00 34.14 C ATOM 2080 C SER B 35 26.892 21.328 -3.305 1.00 4.52 C ATOM 2081 O SER B 35 26.804 22.544 -3.137 1.00 30.41 O ATOM 2082 CB SER B 35 28.979 20.243 -2.451 1.00 14.21 C ATOM 2083 OG SER B 35 29.528 21.348 -3.149 1.00 62.41 O ATOM 0 H SER B 35 27.434 18.332 -2.237 1.00 61.31 H new ATOM 0 HA SER B 35 27.323 20.908 -1.253 1.00 34.14 H new ATOM 0 HB2 SER B 35 29.486 20.126 -1.493 1.00 14.21 H new ATOM 0 HB3 SER B 35 29.152 19.328 -3.018 1.00 14.21 H new ATOM 0 HG SER B 35 30.488 21.206 -3.283 1.00 62.41 H new ATOM 2089 N TYR B 36 26.493 20.721 -4.417 1.00 41.34 N ATOM 2090 CA TYR B 36 25.918 21.465 -5.530 1.00 34.30 C ATOM 2091 C TYR B 36 24.412 21.632 -5.354 1.00 45.21 C ATOM 2092 O TYR B 36 23.827 22.615 -5.809 1.00 45.01 O ATOM 2093 CB TYR B 36 26.212 20.755 -6.852 1.00 40.31 C ATOM 2094 CG TYR B 36 27.661 20.843 -7.277 1.00 34.30 C ATOM 2095 CD1 TYR B 36 28.360 22.041 -7.189 1.00 45.14 C ATOM 2096 CD2 TYR B 36 28.331 19.728 -7.766 1.00 32.43 C ATOM 2097 CE1 TYR B 36 29.683 22.126 -7.577 1.00 64.54 C ATOM 2098 CE2 TYR B 36 29.655 19.804 -8.155 1.00 62.53 C ATOM 2099 CZ TYR B 36 30.326 21.005 -8.059 1.00 62.20 C ATOM 2100 OH TYR B 36 31.644 21.086 -8.445 1.00 51.03 O ATOM 0 H TYR B 36 26.557 19.715 -4.571 1.00 41.34 H new ATOM 0 HA TYR B 36 26.376 22.454 -5.547 1.00 34.30 H new ATOM 0 HB2 TYR B 36 25.932 19.706 -6.761 1.00 40.31 H new ATOM 0 HB3 TYR B 36 25.586 21.186 -7.633 1.00 40.31 H new ATOM 0 HD1 TYR B 36 27.860 22.921 -6.811 1.00 45.14 H new ATOM 0 HD2 TYR B 36 27.808 18.786 -7.843 1.00 32.43 H new ATOM 0 HE1 TYR B 36 30.211 23.065 -7.503 1.00 64.54 H new ATOM 0 HE2 TYR B 36 30.161 18.928 -8.532 1.00 62.53 H new ATOM 0 HH TYR B 36 31.947 20.209 -8.759 1.00 51.03 H new ATOM 2110 N TYR B 37 23.790 20.663 -4.690 1.00 23.03 N ATOM 2111 CA TYR B 37 22.352 20.700 -4.454 1.00 71.53 C ATOM 2112 C TYR B 37 21.955 21.967 -3.703 1.00 1.34 C ATOM 2113 O TYR B 37 21.193 22.789 -4.211 1.00 12.02 O ATOM 2114 CB TYR B 37 21.912 19.466 -3.664 1.00 44.25 C ATOM 2115 CG TYR B 37 21.629 18.261 -4.532 1.00 22.43 C ATOM 2116 CD1 TYR B 37 22.312 18.065 -5.726 1.00 52.14 C ATOM 2117 CD2 TYR B 37 20.681 17.318 -4.157 1.00 15.42 C ATOM 2118 CE1 TYR B 37 22.056 16.965 -6.522 1.00 2.53 C ATOM 2119 CE2 TYR B 37 20.420 16.214 -4.946 1.00 0.41 C ATOM 2120 CZ TYR B 37 21.110 16.042 -6.128 1.00 71.12 C ATOM 2121 OH TYR B 37 20.854 14.944 -6.917 1.00 2.50 O ATOM 0 H TYR B 37 24.260 19.843 -4.306 1.00 23.03 H new ATOM 0 HA TYR B 37 21.851 20.702 -5.422 1.00 71.53 H new ATOM 0 HB2 TYR B 37 22.689 19.210 -2.944 1.00 44.25 H new ATOM 0 HB3 TYR B 37 21.016 19.711 -3.093 1.00 44.25 H new ATOM 0 HD1 TYR B 37 23.055 18.784 -6.037 1.00 52.14 H new ATOM 0 HD2 TYR B 37 20.138 17.450 -3.233 1.00 15.42 H new ATOM 0 HE1 TYR B 37 22.594 16.829 -7.448 1.00 2.53 H new ATOM 0 HE2 TYR B 37 19.680 15.490 -4.639 1.00 0.41 H new ATOM 0 HH TYR B 37 20.162 14.393 -6.496 1.00 2.50 H new ATOM 2131 N GLU B 38 22.478 22.116 -2.489 1.00 43.22 N ATOM 2132 CA GLU B 38 22.179 23.283 -1.668 1.00 44.31 C ATOM 2133 C GLU B 38 22.534 24.573 -2.402 1.00 24.45 C ATOM 2134 O GLU B 38 21.911 25.612 -2.190 1.00 42.22 O ATOM 2135 CB GLU B 38 22.941 23.210 -0.343 1.00 11.21 C ATOM 2136 CG GLU B 38 22.725 21.911 0.413 1.00 54.50 C ATOM 2137 CD GLU B 38 21.397 21.875 1.146 1.00 35.11 C ATOM 2138 OE1 GLU B 38 20.664 22.885 1.094 1.00 70.20 O ATOM 2139 OE2 GLU B 38 21.093 20.838 1.771 1.00 63.32 O ATOM 0 H GLU B 38 23.110 21.444 -2.054 1.00 43.22 H new ATOM 0 HA GLU B 38 21.108 23.286 -1.464 1.00 44.31 H new ATOM 0 HB2 GLU B 38 24.006 23.334 -0.539 1.00 11.21 H new ATOM 0 HB3 GLU B 38 22.634 24.043 0.289 1.00 11.21 H new ATOM 0 HG2 GLU B 38 22.772 21.076 -0.286 1.00 54.50 H new ATOM 0 HG3 GLU B 38 23.535 21.773 1.129 1.00 54.50 H new ATOM 2146 N SER B 39 23.541 24.495 -3.267 1.00 53.34 N ATOM 2147 CA SER B 39 23.984 25.656 -4.029 1.00 70.11 C ATOM 2148 C SER B 39 23.073 25.898 -5.229 1.00 24.54 C ATOM 2149 O SER B 39 23.062 26.983 -5.807 1.00 41.42 O ATOM 2150 CB SER B 39 25.426 25.463 -4.502 1.00 1.22 C ATOM 2151 OG SER B 39 26.276 26.464 -3.969 1.00 11.15 O ATOM 0 H SER B 39 24.065 23.641 -3.457 1.00 53.34 H new ATOM 0 HA SER B 39 23.936 26.527 -3.376 1.00 70.11 H new ATOM 0 HB2 SER B 39 25.783 24.479 -4.198 1.00 1.22 H new ATOM 0 HB3 SER B 39 25.462 25.493 -5.591 1.00 1.22 H new ATOM 0 HG SER B 39 27.192 26.317 -4.285 1.00 11.15 H new ATOM 2157 N GLY B 40 22.307 24.875 -5.598 1.00 41.23 N ATOM 2158 CA GLY B 40 21.401 24.995 -6.726 1.00 73.32 C ATOM 2159 C GLY B 40 22.116 24.877 -8.058 1.00 71.50 C ATOM 2160 O GLY B 40 21.576 25.258 -9.096 1.00 64.32 O ATOM 0 H GLY B 40 22.298 23.966 -5.136 1.00 41.23 H new ATOM 0 HA2 GLY B 40 20.636 24.221 -6.658 1.00 73.32 H new ATOM 0 HA3 GLY B 40 20.888 25.956 -6.676 1.00 73.32 H new ATOM 2164 N ARG B 41 23.336 24.350 -8.028 1.00 73.33 N ATOM 2165 CA ARG B 41 24.127 24.186 -9.241 1.00 73.31 C ATOM 2166 C ARG B 41 23.337 23.433 -10.307 1.00 30.24 C ATOM 2167 O ARG B 41 23.549 23.627 -11.504 1.00 23.15 O ATOM 2168 CB ARG B 41 25.426 23.441 -8.932 1.00 2.45 C ATOM 2169 CG ARG B 41 26.625 23.956 -9.713 1.00 71.20 C ATOM 2170 CD ARG B 41 27.160 25.251 -9.120 1.00 3.45 C ATOM 2171 NE ARG B 41 28.394 25.681 -9.772 1.00 73.34 N ATOM 2172 CZ ARG B 41 28.429 26.283 -10.956 1.00 44.45 C ATOM 2173 NH1 ARG B 41 27.303 26.524 -11.614 1.00 73.10 N ATOM 2174 NH2 ARG B 41 29.591 26.646 -11.484 1.00 72.43 N ATOM 0 H ARG B 41 23.798 24.030 -7.177 1.00 73.33 H new ATOM 0 HA ARG B 41 24.368 25.178 -9.624 1.00 73.31 H new ATOM 0 HB2 ARG B 41 25.636 23.522 -7.865 1.00 2.45 H new ATOM 0 HB3 ARG B 41 25.288 22.382 -9.151 1.00 2.45 H new ATOM 0 HG2 ARG B 41 27.412 23.202 -9.713 1.00 71.20 H new ATOM 0 HG3 ARG B 41 26.341 24.120 -10.752 1.00 71.20 H new ATOM 0 HD2 ARG B 41 26.407 26.033 -9.217 1.00 3.45 H new ATOM 0 HD3 ARG B 41 27.342 25.114 -8.054 1.00 3.45 H new ATOM 0 HE ARG B 41 29.278 25.510 -9.292 1.00 73.34 H new ATOM 0 HH11 ARG B 41 26.408 26.247 -11.211 1.00 73.10 H new ATOM 0 HH12 ARG B 41 27.332 26.986 -12.523 1.00 73.10 H new ATOM 0 HH21 ARG B 41 30.459 26.463 -10.981 1.00 72.43 H new ATOM 0 HH22 ARG B 41 29.616 27.108 -12.393 1.00 72.43 H new ATOM 2188 N SER B 42 22.427 22.572 -9.864 1.00 53.33 N ATOM 2189 CA SER B 42 21.608 21.785 -10.780 1.00 23.23 C ATOM 2190 C SER B 42 20.295 21.376 -10.119 1.00 3.44 C ATOM 2191 O SER B 42 20.285 20.655 -9.122 1.00 55.33 O ATOM 2192 CB SER B 42 22.371 20.540 -11.238 1.00 33.02 C ATOM 2193 OG SER B 42 23.019 20.766 -12.478 1.00 14.24 O ATOM 0 H SER B 42 22.238 22.401 -8.876 1.00 53.33 H new ATOM 0 HA SER B 42 21.381 22.403 -11.648 1.00 23.23 H new ATOM 0 HB2 SER B 42 23.108 20.264 -10.484 1.00 33.02 H new ATOM 0 HB3 SER B 42 21.681 19.701 -11.332 1.00 33.02 H new ATOM 0 HG SER B 42 23.348 21.688 -12.512 1.00 14.24 H new ATOM 2199 N THR B 43 19.186 21.844 -10.685 1.00 54.02 N ATOM 2200 CA THR B 43 17.866 21.529 -10.153 1.00 44.13 C ATOM 2201 C THR B 43 17.696 20.027 -9.957 1.00 62.42 C ATOM 2202 O THR B 43 17.590 19.260 -10.915 1.00 42.45 O ATOM 2203 CB THR B 43 16.749 22.045 -11.079 1.00 15.34 C ATOM 2204 OG1 THR B 43 17.272 23.035 -11.973 1.00 15.25 O ATOM 2205 CG2 THR B 43 15.606 22.639 -10.270 1.00 51.13 C ATOM 0 H THR B 43 19.176 22.442 -11.511 1.00 54.02 H new ATOM 0 HA THR B 43 17.787 22.029 -9.188 1.00 44.13 H new ATOM 0 HB THR B 43 16.366 21.202 -11.654 1.00 15.34 H new ATOM 0 HG1 THR B 43 16.556 23.357 -12.560 1.00 15.25 H new ATOM 0 HG21 THR B 43 14.829 22.997 -10.946 1.00 51.13 H new ATOM 0 HG22 THR B 43 15.191 21.876 -9.612 1.00 51.13 H new ATOM 0 HG23 THR B 43 15.978 23.471 -9.672 1.00 51.13 H new ATOM 2213 N PRO B 44 17.667 19.594 -8.689 1.00 34.10 N ATOM 2214 CA PRO B 44 17.508 18.179 -8.339 1.00 64.22 C ATOM 2215 C PRO B 44 16.110 17.658 -8.651 1.00 65.12 C ATOM 2216 O PRO B 44 15.176 18.424 -8.892 1.00 43.23 O ATOM 2217 CB PRO B 44 17.763 18.157 -6.829 1.00 42.35 C ATOM 2218 CG PRO B 44 17.422 19.530 -6.367 1.00 43.14 C ATOM 2219 CD PRO B 44 17.788 20.451 -7.497 1.00 4.14 C ATOM 0 HA PRO B 44 18.182 17.540 -8.909 1.00 64.22 H new ATOM 0 HB2 PRO B 44 17.145 17.408 -6.334 1.00 42.35 H new ATOM 0 HB3 PRO B 44 18.801 17.911 -6.606 1.00 42.35 H new ATOM 0 HG2 PRO B 44 16.362 19.609 -6.127 1.00 43.14 H new ATOM 0 HG3 PRO B 44 17.973 19.785 -5.462 1.00 43.14 H new ATOM 0 HD2 PRO B 44 17.118 21.309 -7.549 1.00 4.14 H new ATOM 0 HD3 PRO B 44 18.799 20.843 -7.385 1.00 4.14 H new ATOM 2227 N PRO B 45 15.958 16.326 -8.646 1.00 22.42 N ATOM 2228 CA PRO B 45 14.676 15.673 -8.925 1.00 43.51 C ATOM 2229 C PRO B 45 13.659 15.891 -7.809 1.00 62.05 C ATOM 2230 O PRO B 45 13.934 16.587 -6.832 1.00 14.40 O ATOM 2231 CB PRO B 45 15.047 14.192 -9.030 1.00 65.34 C ATOM 2232 CG PRO B 45 16.287 14.053 -8.216 1.00 42.52 C ATOM 2233 CD PRO B 45 17.029 15.353 -8.367 1.00 44.51 C ATOM 0 HA PRO B 45 14.202 16.072 -9.822 1.00 43.51 H new ATOM 0 HB2 PRO B 45 14.249 13.556 -8.647 1.00 65.34 H new ATOM 0 HB3 PRO B 45 15.219 13.899 -10.066 1.00 65.34 H new ATOM 0 HG2 PRO B 45 16.048 13.859 -7.170 1.00 42.52 H new ATOM 0 HG3 PRO B 45 16.891 13.216 -8.565 1.00 42.52 H new ATOM 0 HD2 PRO B 45 17.579 15.609 -7.462 1.00 44.51 H new ATOM 0 HD3 PRO B 45 17.754 15.310 -9.179 1.00 44.51 H new ATOM 2241 N THR B 46 12.483 15.290 -7.961 1.00 11.44 N ATOM 2242 CA THR B 46 11.426 15.418 -6.967 1.00 63.42 C ATOM 2243 C THR B 46 11.537 14.332 -5.903 1.00 5.13 C ATOM 2244 O THR B 46 11.119 14.523 -4.761 1.00 4.01 O ATOM 2245 CB THR B 46 10.031 15.343 -7.618 1.00 52.33 C ATOM 2246 OG1 THR B 46 9.890 16.382 -8.594 1.00 33.31 O ATOM 2247 CG2 THR B 46 8.938 15.473 -6.569 1.00 3.02 C ATOM 0 H THR B 46 12.239 14.710 -8.764 1.00 11.44 H new ATOM 0 HA THR B 46 11.549 16.395 -6.499 1.00 63.42 H new ATOM 0 HB THR B 46 9.932 14.373 -8.105 1.00 52.33 H new ATOM 0 HG1 THR B 46 10.533 16.239 -9.319 1.00 33.31 H new ATOM 0 HG21 THR B 46 7.962 15.417 -7.051 1.00 3.02 H new ATOM 0 HG22 THR B 46 9.031 14.664 -5.844 1.00 3.02 H new ATOM 0 HG23 THR B 46 9.036 16.431 -6.058 1.00 3.02 H new ATOM 2255 N ASP B 47 12.101 13.191 -6.286 1.00 1.43 N ATOM 2256 CA ASP B 47 12.268 12.075 -5.363 1.00 54.30 C ATOM 2257 C ASP B 47 13.276 12.418 -4.270 1.00 63.03 C ATOM 2258 O ASP B 47 13.161 11.953 -3.136 1.00 32.00 O ATOM 2259 CB ASP B 47 12.723 10.825 -6.119 1.00 61.00 C ATOM 2260 CG ASP B 47 12.044 9.565 -5.616 1.00 74.43 C ATOM 2261 OD1 ASP B 47 10.861 9.645 -5.221 1.00 4.34 O ATOM 2262 OD2 ASP B 47 12.694 8.500 -5.619 1.00 53.32 O ATOM 0 H ASP B 47 12.450 13.015 -7.228 1.00 1.43 H new ATOM 0 HA ASP B 47 11.304 11.877 -4.894 1.00 54.30 H new ATOM 0 HB2 ASP B 47 12.511 10.949 -7.181 1.00 61.00 H new ATOM 0 HB3 ASP B 47 13.803 10.717 -6.020 1.00 61.00 H new ATOM 2267 N VAL B 48 14.265 13.235 -4.620 1.00 74.22 N ATOM 2268 CA VAL B 48 15.294 13.640 -3.669 1.00 22.51 C ATOM 2269 C VAL B 48 14.852 14.862 -2.872 1.00 4.50 C ATOM 2270 O VAL B 48 14.997 14.903 -1.650 1.00 11.21 O ATOM 2271 CB VAL B 48 16.621 13.959 -4.381 1.00 0.11 C ATOM 2272 CG1 VAL B 48 17.657 14.457 -3.385 1.00 24.23 C ATOM 2273 CG2 VAL B 48 17.132 12.736 -5.128 1.00 54.21 C ATOM 0 H VAL B 48 14.375 13.629 -5.554 1.00 74.22 H new ATOM 0 HA VAL B 48 15.447 12.801 -2.990 1.00 22.51 H new ATOM 0 HB VAL B 48 16.441 14.752 -5.107 1.00 0.11 H new ATOM 0 HG11 VAL B 48 18.588 14.677 -3.908 1.00 24.23 H new ATOM 0 HG12 VAL B 48 17.290 15.362 -2.900 1.00 24.23 H new ATOM 0 HG13 VAL B 48 17.836 13.689 -2.632 1.00 24.23 H new ATOM 0 HG21 VAL B 48 18.071 12.979 -5.625 1.00 54.21 H new ATOM 0 HG22 VAL B 48 17.296 11.921 -4.423 1.00 54.21 H new ATOM 0 HG23 VAL B 48 16.396 12.430 -5.872 1.00 54.21 H new ATOM 2283 N MET B 49 14.312 15.855 -3.570 1.00 33.43 N ATOM 2284 CA MET B 49 13.848 17.078 -2.925 1.00 40.22 C ATOM 2285 C MET B 49 12.966 16.758 -1.722 1.00 4.22 C ATOM 2286 O MET B 49 13.114 17.353 -0.656 1.00 1.31 O ATOM 2287 CB MET B 49 13.076 17.945 -3.922 1.00 44.14 C ATOM 2288 CG MET B 49 12.530 19.227 -3.317 1.00 51.34 C ATOM 2289 SD MET B 49 10.759 19.427 -3.593 1.00 51.12 S ATOM 2290 CE MET B 49 10.114 18.030 -2.675 1.00 51.15 C ATOM 0 H MET B 49 14.185 15.837 -4.582 1.00 33.43 H new ATOM 0 HA MET B 49 14.722 17.629 -2.576 1.00 40.22 H new ATOM 0 HB2 MET B 49 13.732 18.197 -4.756 1.00 44.14 H new ATOM 0 HB3 MET B 49 12.249 17.365 -4.331 1.00 44.14 H new ATOM 0 HG2 MET B 49 12.729 19.232 -2.245 1.00 51.34 H new ATOM 0 HG3 MET B 49 13.059 20.079 -3.744 1.00 51.34 H new ATOM 0 HE1 MET B 49 9.028 18.104 -2.615 1.00 51.15 H new ATOM 0 HE2 MET B 49 10.387 17.104 -3.182 1.00 51.15 H new ATOM 0 HE3 MET B 49 10.534 18.030 -1.669 1.00 51.15 H new ATOM 2300 N MET B 50 12.048 15.814 -1.904 1.00 73.41 N ATOM 2301 CA MET B 50 11.143 15.414 -0.832 1.00 53.21 C ATOM 2302 C MET B 50 11.898 14.684 0.274 1.00 3.12 C ATOM 2303 O MET B 50 11.546 14.783 1.449 1.00 20.05 O ATOM 2304 CB MET B 50 10.030 14.520 -1.382 1.00 34.20 C ATOM 2305 CG MET B 50 10.489 13.106 -1.701 1.00 34.23 C ATOM 2306 SD MET B 50 9.420 12.280 -2.895 1.00 14.43 S ATOM 2307 CE MET B 50 7.811 12.868 -2.372 1.00 65.11 C ATOM 0 H MET B 50 11.911 15.313 -2.782 1.00 73.41 H new ATOM 0 HA MET B 50 10.700 16.316 -0.410 1.00 53.21 H new ATOM 0 HB2 MET B 50 9.219 14.475 -0.655 1.00 34.20 H new ATOM 0 HB3 MET B 50 9.623 14.974 -2.286 1.00 34.20 H new ATOM 0 HG2 MET B 50 11.506 13.138 -2.091 1.00 34.23 H new ATOM 0 HG3 MET B 50 10.519 12.522 -0.781 1.00 34.23 H new ATOM 0 HE1 MET B 50 7.033 12.337 -2.921 1.00 65.11 H new ATOM 0 HE2 MET B 50 7.688 12.689 -1.304 1.00 65.11 H new ATOM 0 HE3 MET B 50 7.731 13.936 -2.573 1.00 65.11 H new ATOM 2317 N ASN B 51 12.937 13.950 -0.110 1.00 10.42 N ATOM 2318 CA ASN B 51 13.741 13.203 0.850 1.00 73.03 C ATOM 2319 C ASN B 51 14.475 14.147 1.797 1.00 51.31 C ATOM 2320 O ASN B 51 14.980 13.728 2.839 1.00 61.22 O ATOM 2321 CB ASN B 51 14.747 12.311 0.119 1.00 41.34 C ATOM 2322 CG ASN B 51 14.271 10.877 0.000 1.00 53.40 C ATOM 2323 OD1 ASN B 51 15.008 9.939 0.303 1.00 40.12 O ATOM 2324 ND2 ASN B 51 13.031 10.701 -0.441 1.00 25.24 N ATOM 0 H ASN B 51 13.242 13.857 -1.079 1.00 10.42 H new ATOM 0 HA ASN B 51 13.070 12.577 1.438 1.00 73.03 H new ATOM 0 HB2 ASN B 51 14.929 12.714 -0.877 1.00 41.34 H new ATOM 0 HB3 ASN B 51 15.699 12.332 0.650 1.00 41.34 H new ATOM 0 HD21 ASN B 51 12.654 9.758 -0.540 1.00 25.24 H new ATOM 0 HD22 ASN B 51 12.455 11.508 -0.681 1.00 25.24 H new ATOM 2331 N ILE B 52 14.529 15.422 1.428 1.00 15.14 N ATOM 2332 CA ILE B 52 15.200 16.426 2.245 1.00 71.33 C ATOM 2333 C ILE B 52 14.218 17.109 3.192 1.00 63.34 C ATOM 2334 O ILE B 52 14.572 17.476 4.313 1.00 22.32 O ATOM 2335 CB ILE B 52 15.884 17.495 1.375 1.00 0.12 C ATOM 2336 CG1 ILE B 52 16.734 16.833 0.288 1.00 22.15 C ATOM 2337 CG2 ILE B 52 16.738 18.413 2.236 1.00 64.33 C ATOM 2338 CD1 ILE B 52 17.499 15.622 0.775 1.00 3.43 C ATOM 0 H ILE B 52 14.116 15.785 0.569 1.00 15.14 H new ATOM 0 HA ILE B 52 15.959 15.903 2.827 1.00 71.33 H new ATOM 0 HB ILE B 52 15.113 18.095 0.892 1.00 0.12 H new ATOM 0 HG12 ILE B 52 16.087 16.537 -0.538 1.00 22.15 H new ATOM 0 HG13 ILE B 52 17.440 17.564 -0.106 1.00 22.15 H new ATOM 0 HG21 ILE B 52 17.215 19.163 1.606 1.00 64.33 H new ATOM 0 HG22 ILE B 52 16.109 18.908 2.976 1.00 64.33 H new ATOM 0 HG23 ILE B 52 17.503 17.827 2.745 1.00 64.33 H new ATOM 0 HD11 ILE B 52 18.079 15.203 -0.047 1.00 3.43 H new ATOM 0 HD12 ILE B 52 18.171 15.916 1.581 1.00 3.43 H new ATOM 0 HD13 ILE B 52 16.798 14.873 1.143 1.00 3.43 H new ATOM 2350 N LEU B 53 12.982 17.276 2.734 1.00 63.51 N ATOM 2351 CA LEU B 53 11.947 17.913 3.540 1.00 30.02 C ATOM 2352 C LEU B 53 11.224 16.887 4.408 1.00 3.01 C ATOM 2353 O LEU B 53 10.554 17.244 5.376 1.00 32.54 O ATOM 2354 CB LEU B 53 10.942 18.635 2.640 1.00 71.32 C ATOM 2355 CG LEU B 53 11.019 20.161 2.639 1.00 24.34 C ATOM 2356 CD1 LEU B 53 12.461 20.624 2.508 1.00 64.42 C ATOM 2357 CD2 LEU B 53 10.168 20.737 1.515 1.00 70.41 C ATOM 0 H LEU B 53 12.672 16.979 1.809 1.00 63.51 H new ATOM 0 HA LEU B 53 12.428 18.641 4.194 1.00 30.02 H new ATOM 0 HB2 LEU B 53 11.082 18.283 1.618 1.00 71.32 H new ATOM 0 HB3 LEU B 53 9.937 18.342 2.943 1.00 71.32 H new ATOM 0 HG LEU B 53 10.628 20.525 3.589 1.00 24.34 H new ATOM 0 HD11 LEU B 53 12.495 21.713 2.509 1.00 64.42 H new ATOM 0 HD12 LEU B 53 13.043 20.242 3.346 1.00 64.42 H new ATOM 0 HD13 LEU B 53 12.880 20.249 1.574 1.00 64.42 H new ATOM 0 HD21 LEU B 53 10.235 21.825 1.529 1.00 70.41 H new ATOM 0 HD22 LEU B 53 10.530 20.364 0.557 1.00 70.41 H new ATOM 0 HD23 LEU B 53 9.130 20.435 1.653 1.00 70.41 H new ATOM 2369 N GLN B 54 11.367 15.615 4.054 1.00 45.30 N ATOM 2370 CA GLN B 54 10.729 14.538 4.802 1.00 4.44 C ATOM 2371 C GLN B 54 11.434 14.308 6.134 1.00 73.55 C ATOM 2372 O GLN B 54 10.852 13.762 7.072 1.00 22.03 O ATOM 2373 CB GLN B 54 10.731 13.247 3.981 1.00 31.43 C ATOM 2374 CG GLN B 54 12.096 12.583 3.893 1.00 54.24 C ATOM 2375 CD GLN B 54 12.038 11.214 3.248 1.00 53.44 C ATOM 2376 OE1 GLN B 54 12.665 10.265 3.721 1.00 62.11 O ATOM 2377 NE2 GLN B 54 11.283 11.102 2.161 1.00 32.34 N ATOM 0 H GLN B 54 11.919 15.304 3.254 1.00 45.30 H new ATOM 0 HA GLN B 54 9.699 14.831 5.003 1.00 4.44 H new ATOM 0 HB2 GLN B 54 10.023 12.545 4.421 1.00 31.43 H new ATOM 0 HB3 GLN B 54 10.378 13.467 2.974 1.00 31.43 H new ATOM 0 HG2 GLN B 54 12.770 13.221 3.322 1.00 54.24 H new ATOM 0 HG3 GLN B 54 12.516 12.491 4.894 1.00 54.24 H new ATOM 0 HE21 GLN B 54 10.780 11.914 1.803 1.00 32.34 H new ATOM 0 HE22 GLN B 54 11.206 10.204 1.684 1.00 32.34 H new ATOM 2386 N THR B 55 12.694 14.727 6.212 1.00 55.12 N ATOM 2387 CA THR B 55 13.480 14.565 7.429 1.00 13.51 C ATOM 2388 C THR B 55 12.732 15.106 8.642 1.00 42.11 C ATOM 2389 O THR B 55 11.915 16.021 8.540 1.00 72.25 O ATOM 2390 CB THR B 55 14.840 15.279 7.318 1.00 53.41 C ATOM 2391 OG1 THR B 55 14.665 16.582 6.750 1.00 50.54 O ATOM 2392 CG2 THR B 55 15.807 14.473 6.463 1.00 63.21 C ATOM 0 H THR B 55 13.192 15.181 5.446 1.00 55.12 H new ATOM 0 HA THR B 55 13.649 13.496 7.557 1.00 13.51 H new ATOM 0 HB THR B 55 15.258 15.373 8.320 1.00 53.41 H new ATOM 0 HG1 THR B 55 14.672 16.516 5.772 1.00 50.54 H new ATOM 0 HG21 THR B 55 16.760 14.997 6.399 1.00 63.21 H new ATOM 0 HG22 THR B 55 15.961 13.493 6.914 1.00 63.21 H new ATOM 0 HG23 THR B 55 15.393 14.351 5.462 1.00 63.21 H new ATOM 2400 N PRO B 56 13.018 14.530 9.819 1.00 31.25 N ATOM 2401 CA PRO B 56 12.384 14.940 11.075 1.00 41.22 C ATOM 2402 C PRO B 56 12.839 16.323 11.530 1.00 3.50 C ATOM 2403 O PRO B 56 12.260 16.906 12.447 1.00 61.54 O ATOM 2404 CB PRO B 56 12.844 13.872 12.070 1.00 43.23 C ATOM 2405 CG PRO B 56 14.125 13.358 11.509 1.00 22.11 C ATOM 2406 CD PRO B 56 13.983 13.435 10.014 1.00 60.25 C ATOM 0 HA PRO B 56 11.301 15.015 10.979 1.00 41.22 H new ATOM 0 HB2 PRO B 56 12.988 14.294 13.065 1.00 43.23 H new ATOM 0 HB3 PRO B 56 12.106 13.076 12.165 1.00 43.23 H new ATOM 0 HG2 PRO B 56 14.969 13.956 11.852 1.00 22.11 H new ATOM 0 HG3 PRO B 56 14.309 12.333 11.831 1.00 22.11 H new ATOM 0 HD2 PRO B 56 14.936 13.649 9.530 1.00 60.25 H new ATOM 0 HD3 PRO B 56 13.617 12.497 9.596 1.00 60.25 H new ATOM 2414 N GLN B 57 13.878 16.841 10.884 1.00 42.31 N ATOM 2415 CA GLN B 57 14.410 18.155 11.223 1.00 55.32 C ATOM 2416 C GLN B 57 13.841 19.228 10.300 1.00 1.51 C ATOM 2417 O GLN B 57 13.735 20.395 10.679 1.00 23.51 O ATOM 2418 CB GLN B 57 15.937 18.149 11.137 1.00 61.00 C ATOM 2419 CG GLN B 57 16.466 17.946 9.726 1.00 72.54 C ATOM 2420 CD GLN B 57 17.802 17.232 9.701 1.00 74.05 C ATOM 2421 OE1 GLN B 57 18.015 16.316 8.906 1.00 63.42 O ATOM 2422 NE2 GLN B 57 18.713 17.650 10.571 1.00 41.13 N ATOM 0 H GLN B 57 14.368 16.371 10.123 1.00 42.31 H new ATOM 0 HA GLN B 57 14.112 18.386 12.246 1.00 55.32 H new ATOM 0 HB2 GLN B 57 16.318 19.093 11.527 1.00 61.00 H new ATOM 0 HB3 GLN B 57 16.326 17.359 11.779 1.00 61.00 H new ATOM 0 HG2 GLN B 57 15.741 17.372 9.149 1.00 72.54 H new ATOM 0 HG3 GLN B 57 16.567 18.915 9.237 1.00 72.54 H new ATOM 0 HE21 GLN B 57 18.494 18.413 11.212 1.00 41.13 H new ATOM 0 HE22 GLN B 57 19.632 17.209 10.599 1.00 41.13 H new ATOM 2431 N PHE B 58 13.476 18.825 9.089 1.00 72.25 N ATOM 2432 CA PHE B 58 12.918 19.752 8.110 1.00 73.52 C ATOM 2433 C PHE B 58 11.461 19.415 7.810 1.00 1.21 C ATOM 2434 O PHE B 58 10.978 19.627 6.697 1.00 54.13 O ATOM 2435 CB PHE B 58 13.739 19.717 6.818 1.00 21.34 C ATOM 2436 CG PHE B 58 15.147 20.210 6.988 1.00 1.42 C ATOM 2437 CD1 PHE B 58 15.394 21.508 7.405 1.00 51.33 C ATOM 2438 CD2 PHE B 58 16.222 19.377 6.728 1.00 54.32 C ATOM 2439 CE1 PHE B 58 16.689 21.966 7.562 1.00 4.43 C ATOM 2440 CE2 PHE B 58 17.520 19.829 6.885 1.00 23.24 C ATOM 2441 CZ PHE B 58 17.753 21.125 7.301 1.00 13.33 C ATOM 0 H PHE B 58 13.556 17.863 8.761 1.00 72.25 H new ATOM 0 HA PHE B 58 12.960 20.756 8.532 1.00 73.52 H new ATOM 0 HB2 PHE B 58 13.764 18.695 6.441 1.00 21.34 H new ATOM 0 HB3 PHE B 58 13.239 20.324 6.063 1.00 21.34 H new ATOM 0 HD1 PHE B 58 14.565 22.170 7.610 1.00 51.33 H new ATOM 0 HD2 PHE B 58 16.045 18.364 6.399 1.00 54.32 H new ATOM 0 HE1 PHE B 58 16.868 22.980 7.888 1.00 4.43 H new ATOM 0 HE2 PHE B 58 18.350 19.169 6.682 1.00 23.24 H new ATOM 0 HZ PHE B 58 18.766 21.480 7.422 1.00 13.33 H new ATOM 2451 N THR B 59 10.764 18.889 8.812 1.00 3.42 N ATOM 2452 CA THR B 59 9.362 18.520 8.657 1.00 32.14 C ATOM 2453 C THR B 59 8.457 19.742 8.770 1.00 21.44 C ATOM 2454 O THR B 59 7.358 19.766 8.217 1.00 24.22 O ATOM 2455 CB THR B 59 8.935 17.479 9.709 1.00 53.35 C ATOM 2456 OG1 THR B 59 9.536 16.212 9.417 1.00 50.44 O ATOM 2457 CG2 THR B 59 7.422 17.333 9.742 1.00 63.52 C ATOM 0 H THR B 59 11.147 18.709 9.740 1.00 3.42 H new ATOM 0 HA THR B 59 9.257 18.084 7.663 1.00 32.14 H new ATOM 0 HB THR B 59 9.272 17.823 10.687 1.00 53.35 H new ATOM 0 HG1 THR B 59 10.455 16.350 9.106 1.00 50.44 H new ATOM 0 HG21 THR B 59 7.144 16.593 10.492 1.00 63.52 H new ATOM 0 HG22 THR B 59 6.969 18.292 9.994 1.00 63.52 H new ATOM 0 HG23 THR B 59 7.066 17.009 8.764 1.00 63.52 H new ATOM 2465 N LYS B 60 8.926 20.755 9.490 1.00 13.34 N ATOM 2466 CA LYS B 60 8.160 21.982 9.676 1.00 2.41 C ATOM 2467 C LYS B 60 8.259 22.877 8.444 1.00 33.42 C ATOM 2468 O LYS B 60 7.325 23.608 8.120 1.00 21.23 O ATOM 2469 CB LYS B 60 8.658 22.737 10.909 1.00 14.22 C ATOM 2470 CG LYS B 60 8.949 21.837 12.097 1.00 61.42 C ATOM 2471 CD LYS B 60 9.612 22.604 13.229 1.00 54.34 C ATOM 2472 CE LYS B 60 11.120 22.403 13.229 1.00 31.41 C ATOM 2473 NZ LYS B 60 11.489 20.971 13.401 1.00 31.11 N ATOM 0 H LYS B 60 9.834 20.751 9.955 1.00 13.34 H new ATOM 0 HA LYS B 60 7.115 21.709 9.823 1.00 2.41 H new ATOM 0 HB2 LYS B 60 9.564 23.284 10.648 1.00 14.22 H new ATOM 0 HB3 LYS B 60 7.911 23.476 11.198 1.00 14.22 H new ATOM 0 HG2 LYS B 60 8.020 21.392 12.453 1.00 61.42 H new ATOM 0 HG3 LYS B 60 9.596 21.017 11.784 1.00 61.42 H new ATOM 0 HD2 LYS B 60 9.385 23.666 13.132 1.00 54.34 H new ATOM 0 HD3 LYS B 60 9.200 22.275 14.183 1.00 54.34 H new ATOM 0 HE2 LYS B 60 11.536 22.775 12.293 1.00 31.41 H new ATOM 0 HE3 LYS B 60 11.565 22.991 14.032 1.00 31.41 H new ATOM 0 HZ1 LYS B 60 12.413 20.905 13.873 1.00 31.11 H new ATOM 0 HZ2 LYS B 60 10.769 20.494 13.981 1.00 31.11 H new ATOM 0 HZ3 LYS B 60 11.542 20.512 12.469 1.00 31.11 H new ATOM 2487 N TYR B 61 9.397 22.810 7.761 1.00 63.31 N ATOM 2488 CA TYR B 61 9.618 23.615 6.566 1.00 12.35 C ATOM 2489 C TYR B 61 9.382 22.792 5.303 1.00 43.03 C ATOM 2490 O TYR B 61 10.301 22.562 4.516 1.00 15.42 O ATOM 2491 CB TYR B 61 11.041 24.180 6.561 1.00 51.41 C ATOM 2492 CG TYR B 61 11.566 24.507 7.940 1.00 52.31 C ATOM 2493 CD1 TYR B 61 11.255 25.714 8.555 1.00 43.25 C ATOM 2494 CD2 TYR B 61 12.372 23.609 8.630 1.00 24.22 C ATOM 2495 CE1 TYR B 61 11.734 26.017 9.815 1.00 20.34 C ATOM 2496 CE2 TYR B 61 12.854 23.904 9.891 1.00 72.43 C ATOM 2497 CZ TYR B 61 12.533 25.110 10.479 1.00 62.03 C ATOM 2498 OH TYR B 61 13.010 25.408 11.734 1.00 73.32 O ATOM 0 H TYR B 61 10.180 22.207 8.015 1.00 63.31 H new ATOM 0 HA TYR B 61 8.906 24.440 6.579 1.00 12.35 H new ATOM 0 HB2 TYR B 61 11.708 23.459 6.089 1.00 51.41 H new ATOM 0 HB3 TYR B 61 11.063 25.082 5.949 1.00 51.41 H new ATOM 0 HD1 TYR B 61 10.629 26.427 8.039 1.00 43.25 H new ATOM 0 HD2 TYR B 61 12.626 22.664 8.173 1.00 24.22 H new ATOM 0 HE1 TYR B 61 11.484 26.960 10.278 1.00 20.34 H new ATOM 0 HE2 TYR B 61 13.479 23.194 10.413 1.00 72.43 H new ATOM 0 HH TYR B 61 13.556 24.663 12.062 1.00 73.32 H new ATOM 2508 N THR B 62 8.143 22.349 5.117 1.00 34.42 N ATOM 2509 CA THR B 62 7.783 21.552 3.951 1.00 72.42 C ATOM 2510 C THR B 62 7.246 22.431 2.827 1.00 31.24 C ATOM 2511 O THR B 62 7.861 22.544 1.766 1.00 31.52 O ATOM 2512 CB THR B 62 6.729 20.486 4.303 1.00 33.53 C ATOM 2513 OG1 THR B 62 6.873 20.087 5.670 1.00 23.01 O ATOM 2514 CG2 THR B 62 6.864 19.271 3.398 1.00 4.41 C ATOM 0 H THR B 62 7.371 22.529 5.759 1.00 34.42 H new ATOM 0 HA THR B 62 8.693 21.055 3.615 1.00 72.42 H new ATOM 0 HB THR B 62 5.741 20.922 4.154 1.00 33.53 H new ATOM 0 HG1 THR B 62 6.586 19.155 5.771 1.00 23.01 H new ATOM 0 HG21 THR B 62 6.109 18.532 3.666 1.00 4.41 H new ATOM 0 HG22 THR B 62 6.724 19.573 2.360 1.00 4.41 H new ATOM 0 HG23 THR B 62 7.856 18.836 3.519 1.00 4.41 H new ATOM 2522 N LEU B 63 6.096 23.050 3.066 1.00 12.13 N ATOM 2523 CA LEU B 63 5.475 23.921 2.073 1.00 1.11 C ATOM 2524 C LEU B 63 5.591 25.385 2.485 1.00 22.24 C ATOM 2525 O LEU B 63 5.096 26.275 1.792 1.00 42.13 O ATOM 2526 CB LEU B 63 4.004 23.546 1.886 1.00 73.21 C ATOM 2527 CG LEU B 63 3.005 24.282 2.782 1.00 75.31 C ATOM 2528 CD1 LEU B 63 2.340 25.416 2.018 1.00 21.21 C ATOM 2529 CD2 LEU B 63 1.960 23.315 3.321 1.00 54.43 C ATOM 0 H LEU B 63 5.574 22.966 3.938 1.00 12.13 H new ATOM 0 HA LEU B 63 6.000 23.786 1.128 1.00 1.11 H new ATOM 0 HB2 LEU B 63 3.732 23.729 0.846 1.00 73.21 H new ATOM 0 HB3 LEU B 63 3.898 22.475 2.060 1.00 73.21 H new ATOM 0 HG LEU B 63 3.547 24.708 3.626 1.00 75.31 H new ATOM 0 HD11 LEU B 63 1.633 25.929 2.670 1.00 21.21 H new ATOM 0 HD12 LEU B 63 3.099 26.122 1.680 1.00 21.21 H new ATOM 0 HD13 LEU B 63 1.811 25.012 1.155 1.00 21.21 H new ATOM 0 HD21 LEU B 63 1.258 23.855 3.956 1.00 54.43 H new ATOM 0 HD22 LEU B 63 1.422 22.860 2.489 1.00 54.43 H new ATOM 0 HD23 LEU B 63 2.451 22.536 3.904 1.00 54.43 H new ATOM 2541 N TRP B 64 6.248 25.627 3.613 1.00 1.21 N ATOM 2542 CA TRP B 64 6.431 26.984 4.115 1.00 43.23 C ATOM 2543 C TRP B 64 7.005 27.892 3.033 1.00 72.02 C ATOM 2544 O TRP B 64 6.798 29.106 3.054 1.00 64.33 O ATOM 2545 CB TRP B 64 7.352 26.979 5.336 1.00 62.22 C ATOM 2546 CG TRP B 64 8.773 27.328 5.009 1.00 4.30 C ATOM 2547 CD1 TRP B 64 9.450 28.449 5.394 1.00 74.40 C ATOM 2548 CD2 TRP B 64 9.689 26.552 4.229 1.00 4.15 C ATOM 2549 NE1 TRP B 64 10.732 28.417 4.900 1.00 54.00 N ATOM 2550 CE2 TRP B 64 10.904 27.263 4.183 1.00 33.35 C ATOM 2551 CE3 TRP B 64 9.601 25.324 3.566 1.00 30.31 C ATOM 2552 CZ2 TRP B 64 12.019 26.786 3.499 1.00 50.25 C ATOM 2553 CZ3 TRP B 64 10.709 24.853 2.888 1.00 42.23 C ATOM 2554 CH2 TRP B 64 11.905 25.582 2.860 1.00 30.42 C ATOM 0 H TRP B 64 6.663 24.901 4.198 1.00 1.21 H new ATOM 0 HA TRP B 64 5.455 27.371 4.407 1.00 43.23 H new ATOM 0 HB2 TRP B 64 6.972 27.687 6.072 1.00 62.22 H new ATOM 0 HB3 TRP B 64 7.325 25.993 5.799 1.00 62.22 H new ATOM 0 HD1 TRP B 64 9.039 29.244 5.998 1.00 74.40 H new ATOM 0 HE1 TRP B 64 11.441 29.136 5.044 1.00 54.00 H new ATOM 0 HE3 TRP B 64 8.684 24.754 3.584 1.00 30.31 H new ATOM 0 HZ2 TRP B 64 12.942 27.347 3.474 1.00 50.25 H new ATOM 0 HZ3 TRP B 64 10.652 23.907 2.371 1.00 42.23 H new ATOM 0 HH2 TRP B 64 12.754 25.185 2.323 1.00 30.42 H new ATOM 2565 N PHE B 65 7.726 27.298 2.089 1.00 3.22 N ATOM 2566 CA PHE B 65 8.331 28.053 0.998 1.00 51.24 C ATOM 2567 C PHE B 65 7.852 27.535 -0.354 1.00 44.13 C ATOM 2568 O PHE B 65 7.755 28.291 -1.321 1.00 61.53 O ATOM 2569 CB PHE B 65 9.857 27.971 1.077 1.00 33.14 C ATOM 2570 CG PHE B 65 10.503 29.243 1.547 1.00 11.11 C ATOM 2571 CD1 PHE B 65 9.902 30.021 2.524 1.00 22.30 C ATOM 2572 CD2 PHE B 65 11.710 29.662 1.012 1.00 2.15 C ATOM 2573 CE1 PHE B 65 10.494 31.193 2.959 1.00 2.32 C ATOM 2574 CE2 PHE B 65 12.306 30.832 1.443 1.00 4.54 C ATOM 2575 CZ PHE B 65 11.697 31.598 2.416 1.00 1.24 C ATOM 0 H PHE B 65 7.906 26.295 2.057 1.00 3.22 H new ATOM 0 HA PHE B 65 8.024 29.094 1.097 1.00 51.24 H new ATOM 0 HB2 PHE B 65 10.135 27.161 1.752 1.00 33.14 H new ATOM 0 HB3 PHE B 65 10.250 27.715 0.093 1.00 33.14 H new ATOM 0 HD1 PHE B 65 8.960 29.708 2.951 1.00 22.30 H new ATOM 0 HD2 PHE B 65 12.191 29.068 0.249 1.00 2.15 H new ATOM 0 HE1 PHE B 65 10.016 31.790 3.722 1.00 2.32 H new ATOM 0 HE2 PHE B 65 13.248 31.147 1.019 1.00 4.54 H new ATOM 0 HZ PHE B 65 12.161 32.513 2.752 1.00 1.24 H new ATOM 2585 N MET B 66 7.554 26.242 -0.414 1.00 55.55 N ATOM 2586 CA MET B 66 7.083 25.622 -1.647 1.00 63.34 C ATOM 2587 C MET B 66 5.932 26.420 -2.251 1.00 2.10 C ATOM 2588 O MET B 66 5.789 26.497 -3.472 1.00 23.20 O ATOM 2589 CB MET B 66 6.638 24.183 -1.382 1.00 52.14 C ATOM 2590 CG MET B 66 6.968 23.227 -2.518 1.00 45.22 C ATOM 2591 SD MET B 66 5.556 22.218 -3.008 1.00 33.32 S ATOM 2592 CE MET B 66 4.543 23.437 -3.843 1.00 54.53 C ATOM 0 H MET B 66 7.630 25.603 0.377 1.00 55.55 H new ATOM 0 HA MET B 66 7.909 25.613 -2.359 1.00 63.34 H new ATOM 0 HB2 MET B 66 7.113 23.827 -0.468 1.00 52.14 H new ATOM 0 HB3 MET B 66 5.562 24.170 -1.208 1.00 52.14 H new ATOM 0 HG2 MET B 66 7.318 23.798 -3.378 1.00 45.22 H new ATOM 0 HG3 MET B 66 7.787 22.576 -2.213 1.00 45.22 H new ATOM 0 HE1 MET B 66 3.640 23.620 -3.261 1.00 54.53 H new ATOM 0 HE2 MET B 66 5.103 24.366 -3.946 1.00 54.53 H new ATOM 0 HE3 MET B 66 4.269 23.067 -4.831 1.00 54.53 H new ATOM 2602 N THR B 67 5.110 27.012 -1.389 1.00 4.01 N ATOM 2603 CA THR B 67 3.970 27.801 -1.838 1.00 64.01 C ATOM 2604 C THR B 67 3.851 29.096 -1.042 1.00 4.11 C ATOM 2605 O THR B 67 2.809 29.750 -1.056 1.00 25.32 O ATOM 2606 CB THR B 67 2.655 27.010 -1.712 1.00 50.32 C ATOM 2607 OG1 THR B 67 2.857 25.653 -2.123 1.00 43.04 O ATOM 2608 CG2 THR B 67 1.560 27.643 -2.558 1.00 73.01 C ATOM 0 H THR B 67 5.213 26.959 -0.376 1.00 4.01 H new ATOM 0 HA THR B 67 4.142 28.038 -2.888 1.00 64.01 H new ATOM 0 HB THR B 67 2.344 27.030 -0.668 1.00 50.32 H new ATOM 0 HG1 THR B 67 2.016 25.157 -2.038 1.00 43.04 H new ATOM 0 HG21 THR B 67 0.640 27.067 -2.453 1.00 73.01 H new ATOM 0 HG22 THR B 67 1.388 28.666 -2.224 1.00 73.01 H new ATOM 0 HG23 THR B 67 1.867 27.650 -3.604 1.00 73.01 H new ATOM 2616 N ASN B 68 4.924 29.459 -0.347 1.00 11.41 N ATOM 2617 CA ASN B 68 4.938 30.676 0.457 1.00 74.22 C ATOM 2618 C ASN B 68 3.740 30.720 1.400 1.00 14.40 C ATOM 2619 O ASN B 68 3.088 31.755 1.542 1.00 0.14 O ATOM 2620 CB ASN B 68 4.935 31.909 -0.449 1.00 72.14 C ATOM 2621 CG ASN B 68 5.790 31.720 -1.687 1.00 24.42 C ATOM 2622 OD1 ASN B 68 7.010 31.870 -1.641 1.00 31.00 O ATOM 2623 ND2 ASN B 68 5.150 31.389 -2.803 1.00 25.24 N ATOM 0 H ASN B 68 5.795 28.928 -0.324 1.00 11.41 H new ATOM 0 HA ASN B 68 5.848 30.676 1.057 1.00 74.22 H new ATOM 0 HB2 ASN B 68 3.911 32.133 -0.749 1.00 72.14 H new ATOM 0 HB3 ASN B 68 5.299 32.770 0.112 1.00 72.14 H new ATOM 0 HD21 ASN B 68 5.672 31.249 -3.668 1.00 25.24 H new ATOM 0 HD22 ASN B 68 4.136 31.275 -2.795 1.00 25.24 H new ATOM 2630 N GLN B 69 3.456 29.590 2.040 1.00 42.21 N ATOM 2631 CA GLN B 69 2.335 29.500 2.969 1.00 70.13 C ATOM 2632 C GLN B 69 2.731 28.731 4.226 1.00 10.34 C ATOM 2633 O GLN B 69 2.906 27.513 4.189 1.00 41.40 O ATOM 2634 CB GLN B 69 1.141 28.822 2.297 1.00 35.41 C ATOM 2635 CG GLN B 69 -0.065 28.669 3.208 1.00 60.42 C ATOM 2636 CD GLN B 69 -0.267 27.241 3.674 1.00 22.34 C ATOM 2637 OE1 GLN B 69 -0.734 26.390 2.917 1.00 42.13 O ATOM 2638 NE2 GLN B 69 0.083 26.971 4.927 1.00 14.11 N ATOM 0 H GLN B 69 3.986 28.725 1.933 1.00 42.21 H new ATOM 0 HA GLN B 69 2.053 30.512 3.258 1.00 70.13 H new ATOM 0 HB2 GLN B 69 0.852 29.401 1.420 1.00 35.41 H new ATOM 0 HB3 GLN B 69 1.445 27.837 1.943 1.00 35.41 H new ATOM 0 HG2 GLN B 69 0.056 29.317 4.076 1.00 60.42 H new ATOM 0 HG3 GLN B 69 -0.958 29.005 2.681 1.00 60.42 H new ATOM 0 HE21 GLN B 69 0.466 27.708 5.519 1.00 14.11 H new ATOM 0 HE22 GLN B 69 -0.032 26.027 5.296 1.00 14.11 H new ATOM 2647 N ILE B 70 2.870 29.450 5.334 1.00 24.34 N ATOM 2648 CA ILE B 70 3.244 28.836 6.601 1.00 24.43 C ATOM 2649 C ILE B 70 2.047 28.158 7.257 1.00 41.10 C ATOM 2650 O ILE B 70 0.989 28.766 7.419 1.00 43.13 O ATOM 2651 CB ILE B 70 3.834 29.871 7.577 1.00 12.12 C ATOM 2652 CG1 ILE B 70 2.863 31.039 7.762 1.00 1.24 C ATOM 2653 CG2 ILE B 70 5.180 30.367 7.073 1.00 40.03 C ATOM 2654 CD1 ILE B 70 2.343 31.175 9.176 1.00 23.21 C ATOM 0 H ILE B 70 2.729 30.459 5.380 1.00 24.34 H new ATOM 0 HA ILE B 70 4.004 28.088 6.377 1.00 24.43 H new ATOM 0 HB ILE B 70 3.986 29.393 8.545 1.00 12.12 H new ATOM 0 HG12 ILE B 70 3.363 31.965 7.477 1.00 1.24 H new ATOM 0 HG13 ILE B 70 2.019 30.910 7.084 1.00 1.24 H new ATOM 0 HG21 ILE B 70 5.584 31.098 7.774 1.00 40.03 H new ATOM 0 HG22 ILE B 70 5.869 29.527 6.988 1.00 40.03 H new ATOM 0 HG23 ILE B 70 5.053 30.833 6.096 1.00 40.03 H new ATOM 0 HD11 ILE B 70 1.661 32.023 9.233 1.00 23.21 H new ATOM 0 HD12 ILE B 70 1.814 30.265 9.458 1.00 23.21 H new ATOM 0 HD13 ILE B 70 3.179 31.336 9.857 1.00 23.21 H new ATOM 2666 N ALA B 71 2.221 26.896 7.636 1.00 31.41 N ATOM 2667 CA ALA B 71 1.156 26.137 8.280 1.00 42.14 C ATOM 2668 C ALA B 71 1.509 25.813 9.726 1.00 13.21 C ATOM 2669 O ALA B 71 1.829 24.676 10.073 1.00 44.11 O ATOM 2670 CB ALA B 71 0.876 24.859 7.504 1.00 21.42 C ATOM 0 H ALA B 71 3.090 26.378 7.508 1.00 31.41 H new ATOM 0 HA ALA B 71 0.256 26.752 8.283 1.00 42.14 H new ATOM 0 HB1 ALA B 71 0.079 24.302 7.996 1.00 21.42 H new ATOM 0 HB2 ALA B 71 0.570 25.110 6.488 1.00 21.42 H new ATOM 0 HB3 ALA B 71 1.778 24.248 7.471 1.00 21.42 H new ATOM 2676 N PRO B 72 1.453 26.835 10.593 1.00 64.10 N ATOM 2677 CA PRO B 72 1.765 26.683 12.018 1.00 11.04 C ATOM 2678 C PRO B 72 0.709 25.869 12.759 1.00 33.42 C ATOM 2679 O PRO B 72 0.889 25.516 13.924 1.00 25.43 O ATOM 2680 CB PRO B 72 1.786 28.124 12.532 1.00 2.43 C ATOM 2681 CG PRO B 72 0.908 28.875 11.592 1.00 51.11 C ATOM 2682 CD PRO B 72 1.080 28.218 10.250 1.00 31.23 C ATOM 0 HA PRO B 72 2.700 26.146 12.175 1.00 11.04 H new ATOM 0 HB2 PRO B 72 1.414 28.185 13.555 1.00 2.43 H new ATOM 0 HB3 PRO B 72 2.798 28.528 12.536 1.00 2.43 H new ATOM 0 HG2 PRO B 72 -0.132 28.837 11.915 1.00 51.11 H new ATOM 0 HG3 PRO B 72 1.190 29.927 11.551 1.00 51.11 H new ATOM 0 HD2 PRO B 72 0.161 28.253 9.665 1.00 31.23 H new ATOM 0 HD3 PRO B 72 1.854 28.708 9.659 1.00 31.23 H new ATOM 2690 N GLU B 73 -0.391 25.573 12.074 1.00 4.23 N ATOM 2691 CA GLU B 73 -1.476 24.801 12.669 1.00 61.34 C ATOM 2692 C GLU B 73 -1.082 23.334 12.815 1.00 54.44 C ATOM 2693 O GLU B 73 -1.671 22.598 13.607 1.00 31.22 O ATOM 2694 CB GLU B 73 -2.742 24.918 11.818 1.00 60.13 C ATOM 2695 CG GLU B 73 -3.916 25.540 12.556 1.00 64.33 C ATOM 2696 CD GLU B 73 -4.144 24.918 13.920 1.00 11.13 C ATOM 2697 OE1 GLU B 73 -4.881 23.914 13.999 1.00 33.02 O ATOM 2698 OE2 GLU B 73 -3.583 25.436 14.909 1.00 41.10 O ATOM 0 H GLU B 73 -0.554 25.856 11.108 1.00 4.23 H new ATOM 0 HA GLU B 73 -1.675 25.207 13.661 1.00 61.34 H new ATOM 0 HB2 GLU B 73 -2.521 25.516 10.934 1.00 60.13 H new ATOM 0 HB3 GLU B 73 -3.028 23.926 11.469 1.00 60.13 H new ATOM 0 HG2 GLU B 73 -3.741 26.609 12.673 1.00 64.33 H new ATOM 0 HG3 GLU B 73 -4.818 25.429 11.955 1.00 64.33 H new ATOM 2705 N SER B 74 -0.083 22.916 12.044 1.00 3.13 N ATOM 2706 CA SER B 74 0.388 21.537 12.083 1.00 54.43 C ATOM 2707 C SER B 74 1.883 21.480 12.381 1.00 41.34 C ATOM 2708 O SER B 74 2.498 20.416 12.335 1.00 62.25 O ATOM 2709 CB SER B 74 0.095 20.837 10.755 1.00 12.33 C ATOM 2710 OG SER B 74 -1.296 20.619 10.590 1.00 21.43 O ATOM 0 H SER B 74 0.416 23.513 11.385 1.00 3.13 H new ATOM 0 HA SER B 74 -0.144 21.022 12.883 1.00 54.43 H new ATOM 0 HB2 SER B 74 0.472 21.442 9.930 1.00 12.33 H new ATOM 0 HB3 SER B 74 0.623 19.884 10.718 1.00 12.33 H new ATOM 0 HG SER B 74 -1.637 21.205 9.883 1.00 21.43 H new ATOM 2716 N GLY B 75 2.463 22.638 12.687 1.00 32.12 N ATOM 2717 CA GLY B 75 3.882 22.700 12.988 1.00 40.12 C ATOM 2718 C GLY B 75 4.715 23.076 11.778 1.00 61.53 C ATOM 2719 O GLY B 75 5.729 22.441 11.494 1.00 74.03 O ATOM 0 H GLY B 75 1.976 23.533 12.732 1.00 32.12 H new ATOM 0 HA2 GLY B 75 4.051 23.428 13.782 1.00 40.12 H new ATOM 0 HA3 GLY B 75 4.213 21.733 13.367 1.00 40.12 H new ATOM 2723 N GLN B 76 4.284 24.111 11.064 1.00 5.14 N ATOM 2724 CA GLN B 76 4.997 24.569 9.878 1.00 30.43 C ATOM 2725 C GLN B 76 5.164 26.084 9.894 1.00 1.04 C ATOM 2726 O GLN B 76 4.185 26.827 9.814 1.00 20.13 O ATOM 2727 CB GLN B 76 4.252 24.140 8.612 1.00 34.10 C ATOM 2728 CG GLN B 76 3.709 22.721 8.677 1.00 32.22 C ATOM 2729 CD GLN B 76 4.802 21.674 8.601 1.00 51.40 C ATOM 2730 OE1 GLN B 76 5.001 20.898 9.536 1.00 11.02 O ATOM 2731 NE2 GLN B 76 5.518 21.646 7.482 1.00 72.22 N ATOM 0 H GLN B 76 3.445 24.648 11.286 1.00 5.14 H new ATOM 0 HA GLN B 76 5.987 24.113 9.882 1.00 30.43 H new ATOM 0 HB2 GLN B 76 3.426 24.829 8.436 1.00 34.10 H new ATOM 0 HB3 GLN B 76 4.925 24.224 7.758 1.00 34.10 H new ATOM 0 HG2 GLN B 76 3.151 22.592 9.604 1.00 32.22 H new ATOM 0 HG3 GLN B 76 3.006 22.567 7.858 1.00 32.22 H new ATOM 0 HE21 GLN B 76 5.319 22.308 6.732 1.00 72.22 H new ATOM 0 HE22 GLN B 76 6.267 20.962 7.373 1.00 72.22 H new ATOM 2740 N ILE B 77 6.409 26.537 9.998 1.00 41.52 N ATOM 2741 CA ILE B 77 6.704 27.964 10.024 1.00 50.31 C ATOM 2742 C ILE B 77 8.023 28.265 9.322 1.00 5.22 C ATOM 2743 O ILE B 77 8.771 27.355 8.966 1.00 61.33 O ATOM 2744 CB ILE B 77 6.769 28.499 11.467 1.00 44.11 C ATOM 2745 CG1 ILE B 77 8.099 28.116 12.116 1.00 70.24 C ATOM 2746 CG2 ILE B 77 5.601 27.965 12.283 1.00 64.41 C ATOM 2747 CD1 ILE B 77 8.336 26.623 12.176 1.00 2.32 C ATOM 0 H ILE B 77 7.230 25.936 10.066 1.00 41.52 H new ATOM 0 HA ILE B 77 5.892 28.464 9.496 1.00 50.31 H new ATOM 0 HB ILE B 77 6.700 29.586 11.439 1.00 44.11 H new ATOM 0 HG12 ILE B 77 8.912 28.583 11.560 1.00 70.24 H new ATOM 0 HG13 ILE B 77 8.130 28.521 13.127 1.00 70.24 H new ATOM 0 HG21 ILE B 77 5.661 28.352 13.300 1.00 64.41 H new ATOM 0 HG22 ILE B 77 4.663 28.284 11.828 1.00 64.41 H new ATOM 0 HG23 ILE B 77 5.641 26.876 12.306 1.00 64.41 H new ATOM 0 HD11 ILE B 77 9.298 26.426 12.649 1.00 2.32 H new ATOM 0 HD12 ILE B 77 7.543 26.152 12.757 1.00 2.32 H new ATOM 0 HD13 ILE B 77 8.338 26.214 11.166 1.00 2.32 H new ATOM 2759 N ALA B 78 8.303 29.550 9.128 1.00 60.23 N ATOM 2760 CA ALA B 78 9.535 29.972 8.471 1.00 30.33 C ATOM 2761 C ALA B 78 10.635 30.244 9.492 1.00 42.43 C ATOM 2762 O ALA B 78 10.398 30.813 10.559 1.00 1.45 O ATOM 2763 CB ALA B 78 9.283 31.209 7.622 1.00 22.31 C ATOM 0 H ALA B 78 7.694 30.316 9.416 1.00 60.23 H new ATOM 0 HA ALA B 78 9.869 29.162 7.823 1.00 30.33 H new ATOM 0 HB1 ALA B 78 10.211 31.513 7.138 1.00 22.31 H new ATOM 0 HB2 ALA B 78 8.534 30.983 6.863 1.00 22.31 H new ATOM 0 HB3 ALA B 78 8.923 32.019 8.257 1.00 22.31 H new ATOM 2769 N PRO B 79 11.866 29.831 9.160 1.00 54.52 N ATOM 2770 CA PRO B 79 13.027 30.019 10.034 1.00 53.33 C ATOM 2771 C PRO B 79 13.441 31.483 10.141 1.00 52.42 C ATOM 2772 O PRO B 79 12.732 32.374 9.676 1.00 11.10 O ATOM 2773 CB PRO B 79 14.125 29.202 9.349 1.00 0.21 C ATOM 2774 CG PRO B 79 13.724 29.159 7.914 1.00 1.12 C ATOM 2775 CD PRO B 79 12.221 29.148 7.904 1.00 63.55 C ATOM 0 HA PRO B 79 12.820 29.706 11.057 1.00 53.33 H new ATOM 0 HB2 PRO B 79 15.102 29.669 9.473 1.00 0.21 H new ATOM 0 HB3 PRO B 79 14.195 28.199 9.771 1.00 0.21 H new ATOM 0 HG2 PRO B 79 14.111 30.023 7.375 1.00 1.12 H new ATOM 0 HG3 PRO B 79 14.124 28.272 7.424 1.00 1.12 H new ATOM 0 HD2 PRO B 79 11.821 29.671 7.035 1.00 63.55 H new ATOM 0 HD3 PRO B 79 11.827 28.132 7.874 1.00 63.55 H new ATOM 2783 N ALA B 80 14.595 31.724 10.756 1.00 25.42 N ATOM 2784 CA ALA B 80 15.103 33.080 10.922 1.00 0.54 C ATOM 2785 C ALA B 80 15.679 33.613 9.614 1.00 35.22 C ATOM 2786 O ALA B 80 15.247 34.650 9.111 1.00 62.14 O ATOM 2787 CB ALA B 80 16.157 33.117 12.019 1.00 73.13 C ATOM 0 H ALA B 80 15.195 30.998 11.147 1.00 25.42 H new ATOM 0 HA ALA B 80 14.271 33.722 11.211 1.00 0.54 H new ATOM 0 HB1 ALA B 80 16.528 34.136 12.133 1.00 73.13 H new ATOM 0 HB2 ALA B 80 15.716 32.784 12.959 1.00 73.13 H new ATOM 0 HB3 ALA B 80 16.983 32.458 11.752 1.00 73.13 H new ATOM 2793 N LEU B 81 16.658 32.898 9.069 1.00 30.02 N ATOM 2794 CA LEU B 81 17.293 33.300 7.819 1.00 34.04 C ATOM 2795 C LEU B 81 16.253 33.535 6.729 1.00 42.43 C ATOM 2796 O LEU B 81 16.401 34.431 5.899 1.00 23.42 O ATOM 2797 CB LEU B 81 18.291 32.233 7.366 1.00 64.45 C ATOM 2798 CG LEU B 81 19.492 32.003 8.285 1.00 64.45 C ATOM 2799 CD1 LEU B 81 19.490 30.580 8.819 1.00 35.40 C ATOM 2800 CD2 LEU B 81 20.791 32.298 7.549 1.00 62.22 C ATOM 0 H LEU B 81 17.029 32.038 9.473 1.00 30.02 H new ATOM 0 HA LEU B 81 17.824 34.235 7.995 1.00 34.04 H new ATOM 0 HB2 LEU B 81 17.758 31.289 7.255 1.00 64.45 H new ATOM 0 HB3 LEU B 81 18.662 32.507 6.378 1.00 64.45 H new ATOM 0 HG LEU B 81 19.415 32.686 9.131 1.00 64.45 H new ATOM 0 HD11 LEU B 81 20.352 30.435 9.471 1.00 35.40 H new ATOM 0 HD12 LEU B 81 18.574 30.405 9.383 1.00 35.40 H new ATOM 0 HD13 LEU B 81 19.543 29.879 7.986 1.00 35.40 H new ATOM 0 HD21 LEU B 81 21.635 32.129 8.218 1.00 62.22 H new ATOM 0 HD22 LEU B 81 20.877 31.640 6.684 1.00 62.22 H new ATOM 0 HD23 LEU B 81 20.793 33.336 7.217 1.00 62.22 H new ATOM 2812 N ALA B 82 15.199 32.725 6.740 1.00 60.51 N ATOM 2813 CA ALA B 82 14.131 32.847 5.755 1.00 44.45 C ATOM 2814 C ALA B 82 13.659 34.292 5.634 1.00 20.32 C ATOM 2815 O ALA B 82 13.711 34.884 4.555 1.00 2.23 O ATOM 2816 CB ALA B 82 12.968 31.939 6.123 1.00 40.20 C ATOM 0 H ALA B 82 15.062 31.977 7.420 1.00 60.51 H new ATOM 0 HA ALA B 82 14.526 32.539 4.787 1.00 44.45 H new ATOM 0 HB1 ALA B 82 12.178 32.040 5.379 1.00 40.20 H new ATOM 0 HB2 ALA B 82 13.309 30.904 6.151 1.00 40.20 H new ATOM 0 HB3 ALA B 82 12.582 32.221 7.103 1.00 40.20 H new