USER MOD reduce.3.24.130724 H: found=0, std=0, add=1522, rem=0, adj=73 USER MOD reduce.3.24.130724 removed 1514 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 86 GLN : amide:sc= 0.901 K(o=1.8,f=-0.84) USER MOD Set 1.2: B 90 THR OG1 : rot 138:sc= 0.857 USER MOD Set 2.1: B 66 MET CE :methyl 138:sc= -3.58 (180deg=-9.12!) USER MOD Set 2.2: B 67 THR OG1 : rot 180:sc= -0.714 USER MOD Set 3.1: B 51 ASN :FLIP amide:sc= 0 X(o=-1.5,f=-1.3) USER MOD Set 3.2: B 54 GLN :FLIP amide:sc= -1.29 F(o=-1.9,f=-1.3) USER MOD Set 4.1: B 15 SER OG : rot -85:sc= 0.529 USER MOD Set 4.2: B 61 TYR OH : rot 180:sc= 0 USER MOD Set 5.1: A 66 MET CE :methyl -113:sc= -3.89 (180deg=-9.06!) USER MOD Set 5.2: A 67 THR OG1 : rot 180:sc= -0.0799 USER MOD Set 6.1: A 60 LYS NZ :NH3+ 138:sc= -1.26 (180deg=-2.98!) USER MOD Set 6.2: A 61 TYR OH : rot 180:sc= 0.18 USER MOD Set 7.1: A 51 ASN :FLIP amide:sc= 0 X(o=-1.7,f=-1.3) USER MOD Set 7.2: A 54 GLN :FLIP amide:sc= -1.33 F(o=-1.8,f=-1.3) USER MOD Set 8.1: A 50 MET CE :methyl -163:sc= -0.347 (180deg=-1.59) USER MOD Set 8.2: B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 9.1: A 21 GLN : amide:sc= -0.606 X(o=-1.2,f=-0.86) USER MOD Set 9.2: A 22 GLN : amide:sc= -0.617 K(o=-1.2,f=-3.2) USER MOD Set10.1: A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set10.2: B 50 MET CE :methyl -165:sc= -0.42 (180deg=-0.911) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -99:sc= 0.0418 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 ASN : amide:sc= -0.124 K(o=-0.12,f=-1.8) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.106 USER MOD Single : A 6 SER OG : rot 120:sc= -0.971 USER MOD Single : A 12 MET CE :methyl -172:sc= -0.23 (180deg=-0.42) USER MOD Single : A 14 LYS NZ :NH3+ -144:sc= -0.417 (180deg=-3.02!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 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 27 THR OG1 : rot -71:sc= -0.0518 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 84:sc= 0.0474 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 113:sc= 1.19 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0.107 USER MOD Single : A 46 THR OG1 : rot 61:sc= 0.402 USER MOD Single : A 49 MET CE :methyl 155:sc= -2.32 (180deg=-4.41!) USER MOD Single : A 55 THR OG1 : rot -91:sc= -0.151 USER MOD Single : A 57 GLN : amide:sc= -3.76! C(o=-3.8!,f=-6.9!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -170:sc= -0.411 USER MOD Single : A 68 ASN : amide:sc= -0.268 X(o=-0.27,f=0.026) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 SER OG : rot 180:sc= -0.0425 USER MOD Single : A 76 GLN : amide:sc= -0.468 K(o=-0.47,f=-4.7!) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 86 GLN :FLIP amide:sc=-0.00226 F(o=-1.2,f=-0.0023) USER MOD Single : A 87 ASN : amide:sc= -0.0558 K(o=-0.056,f=-1.6!) USER MOD Single : A 89 THR OG1 : rot 180:sc= -0.36 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= -0.0192 X(o=-0.019,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -117:sc= 0.12 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 3 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : B 4 THR OG1 : rot 180:sc= 0.092 USER MOD Single : B 6 SER OG : rot 129:sc= 1.2 USER MOD Single : B 12 MET CE :methyl -104:sc= -3.12! (180deg=-6.42!) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=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= -0.23 X(o=-0.23,f=0) USER MOD Single : B 22 GLN : amide:sc= -0.0138 K(o=-0.014,f=-1.4) USER MOD Single : B 27 THR OG1 : rot -71:sc= -0.455 USER MOD Single : B 31 TYR OH : rot 180:sc= 0.0339 USER MOD Single : B 33 THR OG1 : rot -170:sc= -0.894 USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 TYR OH : rot -107:sc= 0.759 USER MOD Single : B 37 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot -42:sc= 0.0266 USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0.0259 USER MOD Single : B 46 THR OG1 : rot -170:sc= 0 USER MOD Single : B 49 MET CE :methyl 149:sc= -3.69 (180deg=-7.22!) USER MOD Single : B 55 THR OG1 : rot -90:sc= -0.0805 USER MOD Single : B 57 GLN : amide:sc= -0.795 K(o=-0.8,f=-4.9!) USER MOD Single : B 59 THR OG1 : rot 4:sc= 0.214 USER MOD Single : B 60 LYS NZ :NH3+ -153:sc= 0.106 (180deg=0.00302) USER MOD Single : B 62 THR OG1 : rot -68:sc= 1.19 USER MOD Single : B 68 ASN : amide:sc= 0.115 X(o=0.11,f=0) USER MOD Single : B 69 GLN : amide:sc= 0.0288 X(o=0.029,f=0) USER MOD Single : B 74 SER OG : rot 135:sc= -0.604 USER MOD Single : B 76 GLN : amide:sc= 0.56 K(o=0.56,f=-3.5) USER MOD Single : B 83 HIS : no HD1:sc= -0.0745 X(o=-0.075,f=-0.21) USER MOD Single : B 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 89 THR OG1 : rot 180:sc= 0 USER MOD Single : B 91 SER OG : rot -66:sc= 0.63 USER MOD Single : B 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 94 SER OG : rot 15:sc= 0.666 USER MOD Single : B 96 GLN : amide:sc= 0 X(o=0,f=0.006) USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 98 THR OG1 : rot 180:sc= -0.496 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.953 -1.251 -4.362 1.00 52.20 N ATOM 2 CA MET A 1 5.436 -0.854 -3.057 1.00 50.55 C ATOM 3 C MET A 1 5.215 0.654 -2.997 1.00 74.40 C ATOM 4 O MET A 1 5.925 1.421 -3.645 1.00 64.45 O ATOM 5 CB MET A 1 6.400 -1.285 -1.950 1.00 3.44 C ATOM 6 CG MET A 1 5.868 -1.032 -0.549 1.00 12.32 C ATOM 7 SD MET A 1 6.803 -1.909 0.718 1.00 41.14 S ATOM 8 CE MET A 1 5.596 -1.984 2.039 1.00 21.33 C ATOM 0 H1 MET A 1 5.174 -1.612 -4.949 1.00 52.20 H new ATOM 0 H2 MET A 1 6.386 -0.429 -4.829 1.00 52.20 H new ATOM 0 H3 MET A 1 6.668 -1.996 -4.240 1.00 52.20 H new ATOM 0 HA MET A 1 4.477 -1.350 -2.907 1.00 50.55 H new ATOM 0 HB2 MET A 1 6.616 -2.347 -2.061 1.00 3.44 H new ATOM 0 HB3 MET A 1 7.343 -0.753 -2.073 1.00 3.44 H new ATOM 0 HG2 MET A 1 5.897 0.038 -0.341 1.00 12.32 H new ATOM 0 HG3 MET A 1 4.823 -1.338 -0.501 1.00 12.32 H new ATOM 0 HE1 MET A 1 6.027 -2.500 2.897 1.00 21.33 H new ATOM 0 HE2 MET A 1 5.311 -0.973 2.329 1.00 21.33 H new ATOM 0 HE3 MET A 1 4.714 -2.525 1.696 1.00 21.33 H new ATOM 18 N SER A 2 4.226 1.071 -2.212 1.00 63.31 N ATOM 19 CA SER A 2 3.910 2.488 -2.070 1.00 1.32 C ATOM 20 C SER A 2 3.511 3.093 -3.412 1.00 12.31 C ATOM 21 O SER A 2 3.330 2.379 -4.397 1.00 62.31 O ATOM 22 CB SER A 2 5.108 3.244 -1.492 1.00 41.23 C ATOM 23 OG SER A 2 4.684 4.309 -0.658 1.00 50.11 O ATOM 0 H SER A 2 3.631 0.449 -1.665 1.00 63.31 H new ATOM 0 HA SER A 2 3.067 2.580 -1.385 1.00 1.32 H new ATOM 0 HB2 SER A 2 5.734 2.558 -0.921 1.00 41.23 H new ATOM 0 HB3 SER A 2 5.721 3.635 -2.304 1.00 41.23 H new ATOM 0 HG SER A 2 5.468 4.776 -0.299 1.00 50.11 H new ATOM 29 N ASN A 3 3.375 4.415 -3.442 1.00 52.21 N ATOM 30 CA ASN A 3 2.998 5.117 -4.662 1.00 14.51 C ATOM 31 C ASN A 3 4.145 5.989 -5.165 1.00 2.30 C ATOM 32 O ASN A 3 4.574 6.922 -4.486 1.00 44.20 O ATOM 33 CB ASN A 3 1.757 5.978 -4.416 1.00 31.41 C ATOM 34 CG ASN A 3 0.470 5.184 -4.524 1.00 63.51 C ATOM 35 OD1 ASN A 3 0.475 3.957 -4.418 1.00 34.44 O ATOM 36 ND2 ASN A 3 -0.640 5.880 -4.735 1.00 13.33 N ATOM 0 H ASN A 3 3.520 5.021 -2.635 1.00 52.21 H new ATOM 0 HA ASN A 3 2.770 4.373 -5.425 1.00 14.51 H new ATOM 0 HB2 ASN A 3 1.821 6.427 -3.425 1.00 31.41 H new ATOM 0 HB3 ASN A 3 1.737 6.796 -5.136 1.00 31.41 H new ATOM 0 HD21 ASN A 3 -1.536 5.399 -4.816 1.00 13.33 H new ATOM 0 HD22 ASN A 3 -0.597 6.896 -4.816 1.00 13.33 H new ATOM 43 N THR A 4 4.636 5.680 -6.361 1.00 55.11 N ATOM 44 CA THR A 4 5.732 6.434 -6.955 1.00 61.02 C ATOM 45 C THR A 4 5.411 7.923 -7.007 1.00 34.12 C ATOM 46 O THR A 4 4.251 8.321 -6.895 1.00 24.32 O ATOM 47 CB THR A 4 6.046 5.939 -8.380 1.00 65.03 C ATOM 48 OG1 THR A 4 5.401 4.682 -8.616 1.00 41.45 O ATOM 49 CG2 THR A 4 7.546 5.792 -8.582 1.00 24.23 C ATOM 0 H THR A 4 4.291 4.912 -6.937 1.00 55.11 H new ATOM 0 HA THR A 4 6.605 6.275 -6.321 1.00 61.02 H new ATOM 0 HB THR A 4 5.670 6.677 -9.089 1.00 65.03 H new ATOM 0 HG1 THR A 4 5.604 4.375 -9.524 1.00 41.45 H new ATOM 0 HG21 THR A 4 7.744 5.441 -9.595 1.00 24.23 H new ATOM 0 HG22 THR A 4 8.030 6.757 -8.431 1.00 24.23 H new ATOM 0 HG23 THR A 4 7.941 5.072 -7.865 1.00 24.23 H new ATOM 57 N ILE A 5 6.444 8.741 -7.177 1.00 21.33 N ATOM 58 CA ILE A 5 6.270 10.186 -7.245 1.00 1.35 C ATOM 59 C ILE A 5 5.205 10.565 -8.267 1.00 62.20 C ATOM 60 O ILE A 5 4.290 11.334 -7.970 1.00 53.40 O ATOM 61 CB ILE A 5 7.589 10.896 -7.608 1.00 73.54 C ATOM 62 CG1 ILE A 5 8.682 10.531 -6.602 1.00 25.20 C ATOM 63 CG2 ILE A 5 7.385 12.402 -7.654 1.00 34.15 C ATOM 64 CD1 ILE A 5 10.011 10.201 -7.246 1.00 64.05 C ATOM 0 H ILE A 5 7.410 8.427 -7.270 1.00 21.33 H new ATOM 0 HA ILE A 5 5.952 10.511 -6.255 1.00 1.35 H new ATOM 0 HB ILE A 5 7.905 10.562 -8.597 1.00 73.54 H new ATOM 0 HG12 ILE A 5 8.819 11.362 -5.910 1.00 25.20 H new ATOM 0 HG13 ILE A 5 8.351 9.676 -6.012 1.00 25.20 H new ATOM 0 HG21 ILE A 5 8.326 12.889 -7.912 1.00 34.15 H new ATOM 0 HG22 ILE A 5 6.633 12.645 -8.405 1.00 34.15 H new ATOM 0 HG23 ILE A 5 7.050 12.754 -6.678 1.00 34.15 H new ATOM 0 HD11 ILE A 5 10.738 9.952 -6.473 1.00 64.05 H new ATOM 0 HD12 ILE A 5 9.889 9.351 -7.917 1.00 64.05 H new ATOM 0 HD13 ILE A 5 10.365 11.062 -7.813 1.00 64.05 H new ATOM 76 N SER A 6 5.329 10.019 -9.473 1.00 63.44 N ATOM 77 CA SER A 6 4.376 10.301 -10.541 1.00 34.41 C ATOM 78 C SER A 6 2.958 9.938 -10.114 1.00 2.22 C ATOM 79 O SER A 6 1.984 10.481 -10.634 1.00 53.23 O ATOM 80 CB SER A 6 4.753 9.527 -11.806 1.00 71.40 C ATOM 81 OG SER A 6 6.146 9.269 -11.849 1.00 42.32 O ATOM 0 H SER A 6 6.079 9.379 -9.735 1.00 63.44 H new ATOM 0 HA SER A 6 4.411 11.370 -10.752 1.00 34.41 H new ATOM 0 HB2 SER A 6 4.204 8.586 -11.837 1.00 71.40 H new ATOM 0 HB3 SER A 6 4.458 10.097 -12.687 1.00 71.40 H new ATOM 0 HG SER A 6 6.299 8.301 -11.873 1.00 42.32 H new ATOM 87 N GLU A 7 2.850 9.016 -9.161 1.00 61.11 N ATOM 88 CA GLU A 7 1.550 8.580 -8.665 1.00 23.42 C ATOM 89 C GLU A 7 0.992 9.578 -7.653 1.00 40.04 C ATOM 90 O GLU A 7 -0.212 9.610 -7.396 1.00 33.31 O ATOM 91 CB GLU A 7 1.662 7.196 -8.024 1.00 72.32 C ATOM 92 CG GLU A 7 2.428 6.192 -8.871 1.00 53.22 C ATOM 93 CD GLU A 7 1.751 5.913 -10.199 1.00 62.25 C ATOM 94 OE1 GLU A 7 1.953 6.701 -11.145 1.00 43.33 O ATOM 95 OE2 GLU A 7 1.018 4.905 -10.289 1.00 50.32 O ATOM 0 H GLU A 7 3.646 8.558 -8.718 1.00 61.11 H new ATOM 0 HA GLU A 7 0.866 8.526 -9.512 1.00 23.42 H new ATOM 0 HB2 GLU A 7 2.154 7.292 -7.056 1.00 72.32 H new ATOM 0 HB3 GLU A 7 0.660 6.810 -7.836 1.00 72.32 H new ATOM 0 HG2 GLU A 7 3.435 6.568 -9.053 1.00 53.22 H new ATOM 0 HG3 GLU A 7 2.532 5.259 -8.317 1.00 53.22 H new ATOM 102 N LYS A 8 1.875 10.389 -7.082 1.00 33.13 N ATOM 103 CA LYS A 8 1.474 11.388 -6.100 1.00 4.14 C ATOM 104 C LYS A 8 0.982 12.658 -6.784 1.00 74.14 C ATOM 105 O LYS A 8 0.650 13.643 -6.123 1.00 64.53 O ATOM 106 CB LYS A 8 2.644 11.717 -5.169 1.00 75.53 C ATOM 107 CG LYS A 8 3.476 10.506 -4.786 1.00 22.34 C ATOM 108 CD LYS A 8 4.371 10.800 -3.593 1.00 11.10 C ATOM 109 CE LYS A 8 4.009 9.931 -2.398 1.00 11.21 C ATOM 110 NZ LYS A 8 5.218 9.470 -1.660 1.00 5.33 N ATOM 0 H LYS A 8 2.875 10.374 -7.283 1.00 33.13 H new ATOM 0 HA LYS A 8 0.655 10.974 -5.512 1.00 4.14 H new ATOM 0 HB2 LYS A 8 3.288 12.451 -5.654 1.00 75.53 H new ATOM 0 HB3 LYS A 8 2.256 12.182 -4.263 1.00 75.53 H new ATOM 0 HG2 LYS A 8 2.817 9.670 -4.551 1.00 22.34 H new ATOM 0 HG3 LYS A 8 4.088 10.200 -5.635 1.00 22.34 H new ATOM 0 HD2 LYS A 8 5.412 10.629 -3.867 1.00 11.10 H new ATOM 0 HD3 LYS A 8 4.282 11.852 -3.320 1.00 11.10 H new ATOM 0 HE2 LYS A 8 3.364 10.493 -1.723 1.00 11.21 H new ATOM 0 HE3 LYS A 8 3.439 9.066 -2.737 1.00 11.21 H new ATOM 0 HZ1 LYS A 8 4.929 8.881 -0.853 1.00 5.33 H new ATOM 0 HZ2 LYS A 8 5.822 8.912 -2.297 1.00 5.33 H new ATOM 0 HZ3 LYS A 8 5.749 10.295 -1.314 1.00 5.33 H new ATOM 124 N ILE A 9 0.936 12.629 -8.112 1.00 15.20 N ATOM 125 CA ILE A 9 0.482 13.778 -8.886 1.00 41.10 C ATOM 126 C ILE A 9 -0.686 13.403 -9.793 1.00 71.21 C ATOM 127 O ILE A 9 -1.261 14.258 -10.467 1.00 5.21 O ATOM 128 CB ILE A 9 1.618 14.362 -9.746 1.00 42.44 C ATOM 129 CG1 ILE A 9 2.905 14.468 -8.925 1.00 3.22 C ATOM 130 CG2 ILE A 9 1.220 15.723 -10.296 1.00 73.14 C ATOM 131 CD1 ILE A 9 4.074 15.030 -9.705 1.00 55.24 C ATOM 0 H ILE A 9 1.208 11.822 -8.674 1.00 15.20 H new ATOM 0 HA ILE A 9 0.155 14.532 -8.170 1.00 41.10 H new ATOM 0 HB ILE A 9 1.799 13.692 -10.586 1.00 42.44 H new ATOM 0 HG12 ILE A 9 2.721 15.100 -8.056 1.00 3.22 H new ATOM 0 HG13 ILE A 9 3.170 13.479 -8.550 1.00 3.22 H new ATOM 0 HG21 ILE A 9 2.033 16.123 -10.902 1.00 73.14 H new ATOM 0 HG22 ILE A 9 0.326 15.620 -10.911 1.00 73.14 H new ATOM 0 HG23 ILE A 9 1.015 16.404 -9.470 1.00 73.14 H new ATOM 0 HD11 ILE A 9 4.952 15.077 -9.061 1.00 55.24 H new ATOM 0 HD12 ILE A 9 4.284 14.387 -10.559 1.00 55.24 H new ATOM 0 HD13 ILE A 9 3.828 16.032 -10.057 1.00 55.24 H new ATOM 143 N VAL A 10 -1.032 12.121 -9.802 1.00 4.30 N ATOM 144 CA VAL A 10 -2.134 11.632 -10.622 1.00 43.34 C ATOM 145 C VAL A 10 -3.372 11.358 -9.775 1.00 34.04 C ATOM 146 O VAL A 10 -4.502 11.536 -10.231 1.00 71.51 O ATOM 147 CB VAL A 10 -1.745 10.346 -11.375 1.00 22.34 C ATOM 148 CG1 VAL A 10 -0.545 10.596 -12.276 1.00 23.30 C ATOM 149 CG2 VAL A 10 -1.460 9.219 -10.393 1.00 51.14 C ATOM 0 H VAL A 10 -0.565 11.401 -9.250 1.00 4.30 H new ATOM 0 HA VAL A 10 -2.360 12.414 -11.346 1.00 43.34 H new ATOM 0 HB VAL A 10 -2.584 10.046 -12.003 1.00 22.34 H new ATOM 0 HG11 VAL A 10 -0.285 9.676 -12.800 1.00 23.30 H new ATOM 0 HG12 VAL A 10 -0.791 11.370 -13.003 1.00 23.30 H new ATOM 0 HG13 VAL A 10 0.302 10.921 -11.672 1.00 23.30 H new ATOM 0 HG21 VAL A 10 -1.187 8.318 -10.942 1.00 51.14 H new ATOM 0 HG22 VAL A 10 -0.639 9.507 -9.737 1.00 51.14 H new ATOM 0 HG23 VAL A 10 -2.350 9.023 -9.795 1.00 51.14 H new ATOM 159 N LEU A 11 -3.151 10.924 -8.539 1.00 33.50 N ATOM 160 CA LEU A 11 -4.248 10.625 -7.626 1.00 22.11 C ATOM 161 C LEU A 11 -4.876 11.909 -7.091 1.00 23.40 C ATOM 162 O LEU A 11 -6.021 11.908 -6.636 1.00 73.14 O ATOM 163 CB LEU A 11 -3.751 9.764 -6.463 1.00 73.11 C ATOM 164 CG LEU A 11 -2.584 10.336 -5.657 1.00 24.02 C ATOM 165 CD1 LEU A 11 -3.090 11.306 -4.601 1.00 11.31 C ATOM 166 CD2 LEU A 11 -1.782 9.214 -5.013 1.00 62.13 C ATOM 0 H LEU A 11 -2.222 10.771 -8.146 1.00 33.50 H new ATOM 0 HA LEU A 11 -5.008 10.073 -8.179 1.00 22.11 H new ATOM 0 HB2 LEU A 11 -4.585 9.590 -5.783 1.00 73.11 H new ATOM 0 HB3 LEU A 11 -3.453 8.793 -6.857 1.00 73.11 H new ATOM 0 HG LEU A 11 -1.929 10.881 -6.337 1.00 24.02 H new ATOM 0 HD11 LEU A 11 -2.246 11.703 -4.037 1.00 11.31 H new ATOM 0 HD12 LEU A 11 -3.621 12.126 -5.085 1.00 11.31 H new ATOM 0 HD13 LEU A 11 -3.766 10.785 -3.923 1.00 11.31 H new ATOM 0 HD21 LEU A 11 -0.955 9.638 -4.443 1.00 62.13 H new ATOM 0 HD22 LEU A 11 -2.427 8.642 -4.346 1.00 62.13 H new ATOM 0 HD23 LEU A 11 -1.389 8.557 -5.788 1.00 62.13 H new ATOM 178 N MET A 12 -4.122 13.000 -7.151 1.00 51.31 N ATOM 179 CA MET A 12 -4.606 14.291 -6.676 1.00 35.35 C ATOM 180 C MET A 12 -5.093 15.150 -7.839 1.00 14.33 C ATOM 181 O MET A 12 -6.027 15.938 -7.691 1.00 15.55 O ATOM 182 CB MET A 12 -3.503 15.024 -5.912 1.00 43.44 C ATOM 183 CG MET A 12 -2.137 14.925 -6.572 1.00 42.04 C ATOM 184 SD MET A 12 -1.165 16.433 -6.387 1.00 23.34 S ATOM 185 CE MET A 12 -1.375 17.172 -8.005 1.00 1.34 C ATOM 0 H MET A 12 -3.173 13.017 -7.524 1.00 51.31 H new ATOM 0 HA MET A 12 -5.445 14.111 -6.004 1.00 35.35 H new ATOM 0 HB2 MET A 12 -3.776 16.075 -5.816 1.00 43.44 H new ATOM 0 HB3 MET A 12 -3.440 14.618 -4.903 1.00 43.44 H new ATOM 0 HG2 MET A 12 -1.588 14.088 -6.139 1.00 42.04 H new ATOM 0 HG3 MET A 12 -2.265 14.708 -7.632 1.00 42.04 H new ATOM 0 HE1 MET A 12 -0.720 18.038 -8.097 1.00 1.34 H new ATOM 0 HE2 MET A 12 -1.122 16.442 -8.774 1.00 1.34 H new ATOM 0 HE3 MET A 12 -2.411 17.486 -8.130 1.00 1.34 H new ATOM 195 N ARG A 13 -4.453 14.994 -8.993 1.00 72.22 N ATOM 196 CA ARG A 13 -4.820 15.757 -10.180 1.00 43.34 C ATOM 197 C ARG A 13 -6.185 15.321 -10.705 1.00 25.20 C ATOM 198 O ARG A 13 -6.973 16.143 -11.175 1.00 32.00 O ATOM 199 CB ARG A 13 -3.763 15.583 -11.271 1.00 43.40 C ATOM 200 CG ARG A 13 -4.047 16.389 -12.528 1.00 23.54 C ATOM 201 CD ARG A 13 -4.645 15.520 -13.624 1.00 1.24 C ATOM 202 NE ARG A 13 -3.642 14.662 -14.249 1.00 13.15 N ATOM 203 CZ ARG A 13 -3.793 14.105 -15.445 1.00 62.43 C ATOM 204 NH1 ARG A 13 -4.901 14.315 -16.142 1.00 34.04 N ATOM 205 NH2 ARG A 13 -2.836 13.335 -15.947 1.00 3.12 N ATOM 0 H ARG A 13 -3.678 14.346 -9.131 1.00 72.22 H new ATOM 0 HA ARG A 13 -4.875 16.810 -9.902 1.00 43.34 H new ATOM 0 HB2 ARG A 13 -2.791 15.876 -10.874 1.00 43.40 H new ATOM 0 HB3 ARG A 13 -3.695 14.527 -11.534 1.00 43.40 H new ATOM 0 HG2 ARG A 13 -4.733 17.203 -12.292 1.00 23.54 H new ATOM 0 HG3 ARG A 13 -3.124 16.844 -12.886 1.00 23.54 H new ATOM 0 HD2 ARG A 13 -5.440 14.903 -13.205 1.00 1.24 H new ATOM 0 HD3 ARG A 13 -5.102 16.156 -14.382 1.00 1.24 H new ATOM 0 HE ARG A 13 -2.778 14.481 -13.739 1.00 13.15 H new ATOM 0 HH11 ARG A 13 -5.640 14.905 -15.760 1.00 34.04 H new ATOM 0 HH12 ARG A 13 -5.015 13.886 -17.060 1.00 34.04 H new ATOM 0 HH21 ARG A 13 -1.982 13.170 -15.414 1.00 3.12 H new ATOM 0 HH22 ARG A 13 -2.954 12.908 -16.866 1.00 3.12 H new ATOM 219 N LYS A 14 -6.460 14.024 -10.620 1.00 43.14 N ATOM 220 CA LYS A 14 -7.729 13.478 -11.087 1.00 24.33 C ATOM 221 C LYS A 14 -8.861 13.846 -10.134 1.00 14.43 C ATOM 222 O LYS A 14 -10.037 13.759 -10.489 1.00 20.12 O ATOM 223 CB LYS A 14 -7.635 11.956 -11.220 1.00 73.54 C ATOM 224 CG LYS A 14 -7.548 11.476 -12.658 1.00 21.53 C ATOM 225 CD LYS A 14 -6.245 10.742 -12.923 1.00 2.42 C ATOM 226 CE LYS A 14 -5.138 11.701 -13.336 1.00 1.21 C ATOM 227 NZ LYS A 14 -4.389 11.205 -14.523 1.00 3.32 N ATOM 0 H LYS A 14 -5.821 13.331 -10.232 1.00 43.14 H new ATOM 0 HA LYS A 14 -7.945 13.909 -12.065 1.00 24.33 H new ATOM 0 HB2 LYS A 14 -6.759 11.605 -10.675 1.00 73.54 H new ATOM 0 HB3 LYS A 14 -8.507 11.504 -10.747 1.00 73.54 H new ATOM 0 HG2 LYS A 14 -8.389 10.816 -12.874 1.00 21.53 H new ATOM 0 HG3 LYS A 14 -7.630 12.328 -13.333 1.00 21.53 H new ATOM 0 HD2 LYS A 14 -5.943 10.200 -12.027 1.00 2.42 H new ATOM 0 HD3 LYS A 14 -6.397 10.001 -13.708 1.00 2.42 H new ATOM 0 HE2 LYS A 14 -5.568 12.677 -13.560 1.00 1.21 H new ATOM 0 HE3 LYS A 14 -4.448 11.840 -12.503 1.00 1.21 H new ATOM 0 HZ1 LYS A 14 -3.385 11.459 -14.431 1.00 3.32 H new ATOM 0 HZ2 LYS A 14 -4.481 10.171 -14.584 1.00 3.32 H new ATOM 0 HZ3 LYS A 14 -4.778 11.639 -15.385 1.00 3.32 H new ATOM 241 N SER A 15 -8.501 14.260 -8.924 1.00 0.52 N ATOM 242 CA SER A 15 -9.487 14.639 -7.919 1.00 34.52 C ATOM 243 C SER A 15 -10.187 15.938 -8.309 1.00 4.13 C ATOM 244 O SER A 15 -11.338 16.169 -7.939 1.00 42.32 O ATOM 245 CB SER A 15 -8.819 14.797 -6.552 1.00 23.33 C ATOM 246 OG SER A 15 -9.778 14.767 -5.509 1.00 1.04 O ATOM 0 H SER A 15 -7.532 14.342 -8.615 1.00 0.52 H new ATOM 0 HA SER A 15 -10.233 13.847 -7.861 1.00 34.52 H new ATOM 0 HB2 SER A 15 -8.092 13.998 -6.405 1.00 23.33 H new ATOM 0 HB3 SER A 15 -8.270 15.738 -6.519 1.00 23.33 H new ATOM 0 HG SER A 15 -9.326 14.868 -4.646 1.00 1.04 H new ATOM 252 N GLU A 16 -9.483 16.781 -9.058 1.00 24.43 N ATOM 253 CA GLU A 16 -10.037 18.056 -9.497 1.00 22.34 C ATOM 254 C GLU A 16 -10.894 17.876 -10.747 1.00 32.11 C ATOM 255 O GLU A 16 -11.473 18.834 -11.260 1.00 43.32 O ATOM 256 CB GLU A 16 -8.913 19.056 -9.776 1.00 13.35 C ATOM 257 CG GLU A 16 -9.375 20.504 -9.787 1.00 62.31 C ATOM 258 CD GLU A 16 -9.501 21.087 -8.393 1.00 2.34 C ATOM 259 OE1 GLU A 16 -8.472 21.168 -7.689 1.00 72.53 O ATOM 260 OE2 GLU A 16 -10.627 21.460 -8.005 1.00 14.23 O ATOM 0 H GLU A 16 -8.529 16.604 -9.373 1.00 24.43 H new ATOM 0 HA GLU A 16 -10.669 18.443 -8.697 1.00 22.34 H new ATOM 0 HB2 GLU A 16 -8.136 18.937 -9.020 1.00 13.35 H new ATOM 0 HB3 GLU A 16 -8.460 18.821 -10.739 1.00 13.35 H new ATOM 0 HG2 GLU A 16 -8.670 21.102 -10.364 1.00 62.31 H new ATOM 0 HG3 GLU A 16 -10.338 20.570 -10.293 1.00 62.31 H new ATOM 267 N TYR A 17 -10.968 16.642 -11.233 1.00 34.24 N ATOM 268 CA TYR A 17 -11.751 16.336 -12.424 1.00 3.21 C ATOM 269 C TYR A 17 -11.338 17.226 -13.591 1.00 63.52 C ATOM 270 O TYR A 17 -12.183 17.721 -14.339 1.00 30.34 O ATOM 271 CB TYR A 17 -13.243 16.509 -12.137 1.00 21.42 C ATOM 272 CG TYR A 17 -13.758 15.611 -11.036 1.00 23.24 C ATOM 273 CD1 TYR A 17 -13.697 16.003 -9.705 1.00 22.22 C ATOM 274 CD2 TYR A 17 -14.307 14.368 -11.327 1.00 54.02 C ATOM 275 CE1 TYR A 17 -14.164 15.184 -8.696 1.00 21.13 C ATOM 276 CE2 TYR A 17 -14.779 13.542 -10.325 1.00 50.43 C ATOM 277 CZ TYR A 17 -14.705 13.955 -9.012 1.00 22.22 C ATOM 278 OH TYR A 17 -15.174 13.137 -8.009 1.00 41.24 O ATOM 0 H TYR A 17 -10.495 15.838 -10.821 1.00 34.24 H new ATOM 0 HA TYR A 17 -11.559 15.299 -12.698 1.00 3.21 H new ATOM 0 HB2 TYR A 17 -13.434 17.547 -11.866 1.00 21.42 H new ATOM 0 HB3 TYR A 17 -13.805 16.309 -13.049 1.00 21.42 H new ATOM 0 HD1 TYR A 17 -13.277 16.966 -9.455 1.00 22.22 H new ATOM 0 HD2 TYR A 17 -14.366 14.042 -12.355 1.00 54.02 H new ATOM 0 HE1 TYR A 17 -14.106 15.504 -7.666 1.00 21.13 H new ATOM 0 HE2 TYR A 17 -15.203 12.579 -10.569 1.00 50.43 H new ATOM 0 HH TYR A 17 -15.524 12.309 -8.399 1.00 41.24 H new ATOM 288 N LEU A 18 -10.034 17.426 -13.742 1.00 50.01 N ATOM 289 CA LEU A 18 -9.506 18.257 -14.818 1.00 55.21 C ATOM 290 C LEU A 18 -8.540 17.464 -15.695 1.00 11.42 C ATOM 291 O LEU A 18 -7.959 16.472 -15.255 1.00 23.51 O ATOM 292 CB LEU A 18 -8.798 19.484 -14.242 1.00 71.45 C ATOM 293 CG LEU A 18 -7.542 19.209 -13.415 1.00 20.12 C ATOM 294 CD1 LEU A 18 -6.341 18.999 -14.323 1.00 2.31 C ATOM 295 CD2 LEU A 18 -7.284 20.349 -12.441 1.00 52.43 C ATOM 0 H LEU A 18 -9.322 17.024 -13.132 1.00 50.01 H new ATOM 0 HA LEU A 18 -10.343 18.584 -15.434 1.00 55.21 H new ATOM 0 HB2 LEU A 18 -8.528 20.143 -15.067 1.00 71.45 H new ATOM 0 HB3 LEU A 18 -9.507 20.028 -13.618 1.00 71.45 H new ATOM 0 HG LEU A 18 -7.701 18.297 -12.840 1.00 20.12 H new ATOM 0 HD11 LEU A 18 -5.456 18.805 -13.717 1.00 2.31 H new ATOM 0 HD12 LEU A 18 -6.525 18.148 -14.979 1.00 2.31 H new ATOM 0 HD13 LEU A 18 -6.179 19.893 -14.925 1.00 2.31 H new ATOM 0 HD21 LEU A 18 -6.386 20.136 -11.861 1.00 52.43 H new ATOM 0 HD22 LEU A 18 -7.146 21.277 -12.996 1.00 52.43 H new ATOM 0 HD23 LEU A 18 -8.135 20.452 -11.768 1.00 52.43 H new ATOM 307 N SER A 19 -8.374 17.910 -16.936 1.00 75.14 N ATOM 308 CA SER A 19 -7.480 17.242 -17.874 1.00 42.32 C ATOM 309 C SER A 19 -6.081 17.847 -17.816 1.00 72.22 C ATOM 310 O SER A 19 -5.887 18.941 -17.287 1.00 2.13 O ATOM 311 CB SER A 19 -8.033 17.343 -19.298 1.00 3.34 C ATOM 312 OG SER A 19 -7.715 16.185 -20.051 1.00 61.02 O ATOM 0 H SER A 19 -8.847 18.731 -17.315 1.00 75.14 H new ATOM 0 HA SER A 19 -7.415 16.192 -17.590 1.00 42.32 H new ATOM 0 HB2 SER A 19 -9.115 17.473 -19.263 1.00 3.34 H new ATOM 0 HB3 SER A 19 -7.622 18.225 -19.790 1.00 3.34 H new ATOM 0 HG SER A 19 -8.080 16.273 -20.956 1.00 61.02 H new ATOM 318 N ARG A 20 -5.108 17.126 -18.366 1.00 71.01 N ATOM 319 CA ARG A 20 -3.726 17.590 -18.377 1.00 24.20 C ATOM 320 C ARG A 20 -3.623 18.978 -19.003 1.00 73.30 C ATOM 321 O ARG A 20 -2.875 19.830 -18.525 1.00 23.14 O ATOM 322 CB ARG A 20 -2.842 16.606 -19.144 1.00 14.35 C ATOM 323 CG ARG A 20 -2.318 15.463 -18.290 1.00 64.12 C ATOM 324 CD ARG A 20 -1.574 14.437 -19.128 1.00 52.12 C ATOM 325 NE ARG A 20 -2.369 13.233 -19.353 1.00 31.03 N ATOM 326 CZ ARG A 20 -2.141 12.375 -20.343 1.00 33.21 C ATOM 327 NH1 ARG A 20 -1.148 12.589 -21.194 1.00 13.10 N ATOM 328 NH2 ARG A 20 -2.908 11.302 -20.482 1.00 51.12 N ATOM 0 H ARG A 20 -5.252 16.219 -18.809 1.00 71.01 H new ATOM 0 HA ARG A 20 -3.381 17.650 -17.345 1.00 24.20 H new ATOM 0 HB2 ARG A 20 -3.411 16.194 -19.978 1.00 14.35 H new ATOM 0 HB3 ARG A 20 -1.997 17.146 -19.570 1.00 14.35 H new ATOM 0 HG2 ARG A 20 -1.653 15.857 -17.521 1.00 64.12 H new ATOM 0 HG3 ARG A 20 -3.149 14.981 -17.776 1.00 64.12 H new ATOM 0 HD2 ARG A 20 -1.306 14.879 -20.088 1.00 52.12 H new ATOM 0 HD3 ARG A 20 -0.643 14.168 -18.629 1.00 52.12 H new ATOM 0 HE ARG A 20 -3.142 13.039 -18.716 1.00 31.03 H new ATOM 0 HH11 ARG A 20 -0.556 13.413 -21.090 1.00 13.10 H new ATOM 0 HH12 ARG A 20 -0.975 11.929 -21.952 1.00 13.10 H new ATOM 0 HH21 ARG A 20 -3.674 11.134 -19.829 1.00 51.12 H new ATOM 0 HH22 ARG A 20 -2.732 10.644 -21.242 1.00 51.12 H new ATOM 342 N GLN A 21 -4.381 19.197 -20.073 1.00 33.24 N ATOM 343 CA GLN A 21 -4.373 20.481 -20.764 1.00 62.13 C ATOM 344 C GLN A 21 -4.765 21.611 -19.817 1.00 32.54 C ATOM 345 O GLN A 21 -4.221 22.712 -19.894 1.00 15.25 O ATOM 346 CB GLN A 21 -5.327 20.446 -21.959 1.00 31.45 C ATOM 347 CG GLN A 21 -5.403 21.763 -22.715 1.00 12.41 C ATOM 348 CD GLN A 21 -6.675 22.533 -22.420 1.00 73.14 C ATOM 349 OE1 GLN A 21 -6.666 23.499 -21.656 1.00 3.42 O ATOM 350 NE2 GLN A 21 -7.778 22.109 -23.026 1.00 2.12 N ATOM 0 H GLN A 21 -5.008 18.503 -20.480 1.00 33.24 H new ATOM 0 HA GLN A 21 -3.360 20.667 -21.122 1.00 62.13 H new ATOM 0 HB2 GLN A 21 -5.009 19.661 -22.645 1.00 31.45 H new ATOM 0 HB3 GLN A 21 -6.324 20.179 -21.610 1.00 31.45 H new ATOM 0 HG2 GLN A 21 -4.542 22.378 -22.453 1.00 12.41 H new ATOM 0 HG3 GLN A 21 -5.341 21.567 -23.785 1.00 12.41 H new ATOM 0 HE21 GLN A 21 -7.739 21.304 -23.651 1.00 2.12 H new ATOM 0 HE22 GLN A 21 -8.664 22.588 -22.866 1.00 2.12 H new ATOM 359 N GLN A 22 -5.712 21.329 -18.928 1.00 51.23 N ATOM 360 CA GLN A 22 -6.176 22.323 -17.968 1.00 0.45 C ATOM 361 C GLN A 22 -5.055 22.728 -17.017 1.00 51.31 C ATOM 362 O GLN A 22 -4.575 23.862 -17.053 1.00 43.21 O ATOM 363 CB GLN A 22 -7.363 21.778 -17.172 1.00 11.44 C ATOM 364 CG GLN A 22 -8.394 21.062 -18.031 1.00 2.14 C ATOM 365 CD GLN A 22 -8.846 21.894 -19.216 1.00 62.24 C ATOM 366 OE1 GLN A 22 -8.496 21.604 -20.360 1.00 71.22 O ATOM 367 NE2 GLN A 22 -9.625 22.933 -18.946 1.00 62.52 N ATOM 0 H GLN A 22 -6.172 20.422 -18.853 1.00 51.23 H new ATOM 0 HA GLN A 22 -6.493 23.206 -18.523 1.00 0.45 H new ATOM 0 HB2 GLN A 22 -6.995 21.090 -16.412 1.00 11.44 H new ATOM 0 HB3 GLN A 22 -7.848 22.602 -16.648 1.00 11.44 H new ATOM 0 HG2 GLN A 22 -7.973 20.123 -18.391 1.00 2.14 H new ATOM 0 HG3 GLN A 22 -9.259 20.809 -17.418 1.00 2.14 H new ATOM 0 HE21 GLN A 22 -9.890 23.135 -17.982 1.00 62.52 H new ATOM 0 HE22 GLN A 22 -9.959 23.530 -19.702 1.00 62.52 H new ATOM 376 N LEU A 23 -4.641 21.795 -16.167 1.00 1.25 N ATOM 377 CA LEU A 23 -3.575 22.054 -15.205 1.00 22.42 C ATOM 378 C LEU A 23 -2.333 22.599 -15.904 1.00 63.10 C ATOM 379 O LEU A 23 -1.651 23.480 -15.381 1.00 73.44 O ATOM 380 CB LEU A 23 -3.226 20.775 -14.443 1.00 64.12 C ATOM 381 CG LEU A 23 -1.890 20.780 -13.700 1.00 63.23 C ATOM 382 CD1 LEU A 23 -2.088 20.389 -12.244 1.00 72.12 C ATOM 383 CD2 LEU A 23 -0.901 19.842 -14.375 1.00 24.14 C ATOM 0 H LEU A 23 -5.027 20.852 -16.124 1.00 1.25 H new ATOM 0 HA LEU A 23 -3.931 22.804 -14.498 1.00 22.42 H new ATOM 0 HB2 LEU A 23 -4.019 20.578 -13.722 1.00 64.12 H new ATOM 0 HB3 LEU A 23 -3.223 19.945 -15.149 1.00 64.12 H new ATOM 0 HG LEU A 23 -1.482 21.790 -13.732 1.00 63.23 H new ATOM 0 HD11 LEU A 23 -1.126 20.398 -11.731 1.00 72.12 H new ATOM 0 HD12 LEU A 23 -2.762 21.099 -11.765 1.00 72.12 H new ATOM 0 HD13 LEU A 23 -2.518 19.389 -12.191 1.00 72.12 H new ATOM 0 HD21 LEU A 23 0.044 19.858 -13.833 1.00 24.14 H new ATOM 0 HD22 LEU A 23 -1.302 18.829 -14.374 1.00 24.14 H new ATOM 0 HD23 LEU A 23 -0.735 20.166 -15.402 1.00 24.14 H new ATOM 395 N ALA A 24 -2.046 22.070 -17.088 1.00 40.14 N ATOM 396 CA ALA A 24 -0.889 22.505 -17.860 1.00 33.11 C ATOM 397 C ALA A 24 -0.924 24.011 -18.100 1.00 23.23 C ATOM 398 O ALA A 24 0.113 24.638 -18.316 1.00 34.43 O ATOM 399 CB ALA A 24 -0.826 21.759 -19.184 1.00 43.12 C ATOM 0 H ALA A 24 -2.599 21.339 -17.534 1.00 40.14 H new ATOM 0 HA ALA A 24 0.008 22.276 -17.284 1.00 33.11 H new ATOM 0 HB1 ALA A 24 0.043 22.094 -19.750 1.00 43.12 H new ATOM 0 HB2 ALA A 24 -0.745 20.689 -18.995 1.00 43.12 H new ATOM 0 HB3 ALA A 24 -1.731 21.959 -19.758 1.00 43.12 H new ATOM 405 N ASP A 25 -2.122 24.583 -18.059 1.00 0.02 N ATOM 406 CA ASP A 25 -2.292 26.016 -18.271 1.00 72.22 C ATOM 407 C ASP A 25 -2.425 26.750 -16.942 1.00 62.10 C ATOM 408 O ASP A 25 -2.177 27.954 -16.857 1.00 11.21 O ATOM 409 CB ASP A 25 -3.521 26.282 -19.141 1.00 75.11 C ATOM 410 CG ASP A 25 -3.222 27.221 -20.295 1.00 52.02 C ATOM 411 OD1 ASP A 25 -2.313 26.911 -21.091 1.00 32.35 O ATOM 412 OD2 ASP A 25 -3.897 28.267 -20.399 1.00 73.30 O ATOM 0 H ASP A 25 -2.990 24.077 -17.881 1.00 0.02 H new ATOM 0 HA ASP A 25 -1.406 26.390 -18.784 1.00 72.22 H new ATOM 0 HB2 ASP A 25 -3.896 25.337 -19.533 1.00 75.11 H new ATOM 0 HB3 ASP A 25 -4.313 26.708 -18.525 1.00 75.11 H new ATOM 417 N LEU A 26 -2.822 26.020 -15.905 1.00 11.45 N ATOM 418 CA LEU A 26 -2.991 26.602 -14.579 1.00 42.33 C ATOM 419 C LEU A 26 -1.649 26.725 -13.863 1.00 31.40 C ATOM 420 O LEU A 26 -1.539 27.394 -12.835 1.00 63.25 O ATOM 421 CB LEU A 26 -3.950 25.751 -13.745 1.00 5.25 C ATOM 422 CG LEU A 26 -5.424 26.152 -13.799 1.00 72.31 C ATOM 423 CD1 LEU A 26 -6.222 25.143 -14.611 1.00 51.25 C ATOM 424 CD2 LEU A 26 -5.994 26.279 -12.394 1.00 64.15 C ATOM 0 H LEU A 26 -3.033 25.023 -15.958 1.00 11.45 H new ATOM 0 HA LEU A 26 -3.411 27.601 -14.699 1.00 42.33 H new ATOM 0 HB2 LEU A 26 -3.864 24.715 -14.073 1.00 5.25 H new ATOM 0 HB3 LEU A 26 -3.623 25.784 -12.706 1.00 5.25 H new ATOM 0 HG LEU A 26 -5.499 27.123 -14.289 1.00 72.31 H new ATOM 0 HD11 LEU A 26 -7.269 25.445 -14.639 1.00 51.25 H new ATOM 0 HD12 LEU A 26 -5.829 25.102 -15.627 1.00 51.25 H new ATOM 0 HD13 LEU A 26 -6.140 24.159 -14.150 1.00 51.25 H new ATOM 0 HD21 LEU A 26 -7.044 26.565 -12.452 1.00 64.15 H new ATOM 0 HD22 LEU A 26 -5.906 25.323 -11.878 1.00 64.15 H new ATOM 0 HD23 LEU A 26 -5.440 27.040 -11.844 1.00 64.15 H new ATOM 436 N THR A 27 -0.628 26.076 -14.415 1.00 4.14 N ATOM 437 CA THR A 27 0.707 26.114 -13.831 1.00 54.35 C ATOM 438 C THR A 27 1.744 26.552 -14.859 1.00 0.33 C ATOM 439 O THR A 27 2.936 26.623 -14.560 1.00 41.53 O ATOM 440 CB THR A 27 1.111 24.740 -13.263 1.00 71.31 C ATOM 441 OG1 THR A 27 1.379 23.828 -14.334 1.00 70.12 O ATOM 442 CG2 THR A 27 0.011 24.177 -12.375 1.00 31.12 C ATOM 0 H THR A 27 -0.700 25.518 -15.266 1.00 4.14 H new ATOM 0 HA THR A 27 0.676 26.840 -13.018 1.00 54.35 H new ATOM 0 HB THR A 27 2.011 24.870 -12.662 1.00 71.31 H new ATOM 0 HG1 THR A 27 0.538 23.586 -14.776 1.00 70.12 H new ATOM 0 HG21 THR A 27 0.319 23.207 -11.986 1.00 31.12 H new ATOM 0 HG22 THR A 27 -0.172 24.860 -11.545 1.00 31.12 H new ATOM 0 HG23 THR A 27 -0.903 24.061 -12.957 1.00 31.12 H new ATOM 450 N GLY A 28 1.283 26.844 -16.070 1.00 71.14 N ATOM 451 CA GLY A 28 2.186 27.273 -17.124 1.00 55.42 C ATOM 452 C GLY A 28 3.095 26.156 -17.597 1.00 63.01 C ATOM 453 O GLY A 28 4.131 26.408 -18.212 1.00 24.43 O ATOM 0 H GLY A 28 0.301 26.792 -16.341 1.00 71.14 H new ATOM 0 HA2 GLY A 28 1.605 27.646 -17.967 1.00 55.42 H new ATOM 0 HA3 GLY A 28 2.793 28.103 -16.763 1.00 55.42 H new ATOM 457 N VAL A 29 2.710 24.917 -17.307 1.00 50.12 N ATOM 458 CA VAL A 29 3.499 23.758 -17.707 1.00 54.03 C ATOM 459 C VAL A 29 3.143 23.313 -19.120 1.00 24.12 C ATOM 460 O VAL A 29 1.977 23.284 -19.515 1.00 11.23 O ATOM 461 CB VAL A 29 3.290 22.577 -16.740 1.00 3.24 C ATOM 462 CG1 VAL A 29 3.356 21.255 -17.489 1.00 14.34 C ATOM 463 CG2 VAL A 29 4.319 22.617 -15.620 1.00 50.23 C ATOM 0 H VAL A 29 1.857 24.690 -16.797 1.00 50.12 H new ATOM 0 HA VAL A 29 4.546 24.061 -17.678 1.00 54.03 H new ATOM 0 HB VAL A 29 2.299 22.665 -16.295 1.00 3.24 H new ATOM 0 HG11 VAL A 29 3.206 20.433 -16.789 1.00 14.34 H new ATOM 0 HG12 VAL A 29 2.577 21.229 -18.251 1.00 14.34 H new ATOM 0 HG13 VAL A 29 4.332 21.154 -17.964 1.00 14.34 H new ATOM 0 HG21 VAL A 29 4.156 21.776 -14.946 1.00 50.23 H new ATOM 0 HG22 VAL A 29 5.321 22.554 -16.044 1.00 50.23 H new ATOM 0 HG23 VAL A 29 4.218 23.550 -15.066 1.00 50.23 H new ATOM 473 N PRO A 30 4.171 22.954 -19.904 1.00 5.34 N ATOM 474 CA PRO A 30 3.993 22.501 -21.286 1.00 54.13 C ATOM 475 C PRO A 30 3.327 21.132 -21.367 1.00 3.43 C ATOM 476 O PRO A 30 3.869 20.138 -20.883 1.00 5.21 O ATOM 477 CB PRO A 30 5.424 22.431 -21.825 1.00 44.23 C ATOM 478 CG PRO A 30 6.273 22.226 -20.617 1.00 71.13 C ATOM 479 CD PRO A 30 5.587 22.961 -19.499 1.00 14.15 C ATOM 0 HA PRO A 30 3.342 23.168 -21.851 1.00 54.13 H new ATOM 0 HB2 PRO A 30 5.540 21.612 -22.535 1.00 44.23 H new ATOM 0 HB3 PRO A 30 5.695 23.348 -22.349 1.00 44.23 H new ATOM 0 HG2 PRO A 30 6.371 21.166 -20.384 1.00 71.13 H new ATOM 0 HG3 PRO A 30 7.280 22.612 -20.778 1.00 71.13 H new ATOM 0 HD2 PRO A 30 5.733 22.462 -18.541 1.00 14.15 H new ATOM 0 HD3 PRO A 30 5.969 23.976 -19.392 1.00 14.15 H new ATOM 487 N TYR A 31 2.150 21.087 -21.980 1.00 25.44 N ATOM 488 CA TYR A 31 1.408 19.839 -22.122 1.00 32.30 C ATOM 489 C TYR A 31 2.228 18.802 -22.884 1.00 14.22 C ATOM 490 O TYR A 31 2.065 17.599 -22.689 1.00 34.33 O ATOM 491 CB TYR A 31 0.083 20.089 -22.843 1.00 63.02 C ATOM 492 CG TYR A 31 -0.687 18.824 -23.149 1.00 1.51 C ATOM 493 CD1 TYR A 31 -0.476 18.125 -24.331 1.00 32.10 C ATOM 494 CD2 TYR A 31 -1.627 18.326 -22.254 1.00 12.33 C ATOM 495 CE1 TYR A 31 -1.177 16.970 -24.614 1.00 35.12 C ATOM 496 CE2 TYR A 31 -2.332 17.171 -22.528 1.00 62.12 C ATOM 497 CZ TYR A 31 -2.105 16.496 -23.709 1.00 32.41 C ATOM 498 OH TYR A 31 -2.805 15.345 -23.987 1.00 11.03 O ATOM 0 H TYR A 31 1.688 21.900 -22.387 1.00 25.44 H new ATOM 0 HA TYR A 31 1.203 19.451 -21.124 1.00 32.30 H new ATOM 0 HB2 TYR A 31 -0.537 20.743 -22.230 1.00 63.02 H new ATOM 0 HB3 TYR A 31 0.280 20.619 -23.775 1.00 63.02 H new ATOM 0 HD1 TYR A 31 0.250 18.492 -25.042 1.00 32.10 H new ATOM 0 HD2 TYR A 31 -1.809 18.852 -21.328 1.00 12.33 H new ATOM 0 HE1 TYR A 31 -1.000 16.440 -25.538 1.00 35.12 H new ATOM 0 HE2 TYR A 31 -3.058 16.798 -21.821 1.00 62.12 H new ATOM 0 HH TYR A 31 -3.417 15.148 -23.248 1.00 11.03 H new ATOM 508 N GLY A 32 3.112 19.280 -23.754 1.00 2.44 N ATOM 509 CA GLY A 32 3.946 18.382 -24.534 1.00 73.33 C ATOM 510 C GLY A 32 4.810 17.492 -23.663 1.00 15.40 C ATOM 511 O GLY A 32 5.070 16.338 -24.006 1.00 5.33 O ATOM 0 H GLY A 32 3.266 20.272 -23.933 1.00 2.44 H new ATOM 0 HA2 GLY A 32 3.313 17.761 -25.168 1.00 73.33 H new ATOM 0 HA3 GLY A 32 4.584 18.967 -25.197 1.00 73.33 H new ATOM 515 N THR A 33 5.258 18.028 -22.533 1.00 2.10 N ATOM 516 CA THR A 33 6.101 17.276 -21.611 1.00 33.22 C ATOM 517 C THR A 33 5.289 16.737 -20.439 1.00 41.20 C ATOM 518 O THR A 33 5.587 15.668 -19.904 1.00 25.30 O ATOM 519 CB THR A 33 7.253 18.142 -21.068 1.00 51.23 C ATOM 520 OG1 THR A 33 7.660 19.092 -22.059 1.00 63.51 O ATOM 521 CG2 THR A 33 8.440 17.277 -20.671 1.00 43.02 C ATOM 0 H THR A 33 5.051 18.981 -22.233 1.00 2.10 H new ATOM 0 HA THR A 33 6.519 16.442 -22.174 1.00 33.22 H new ATOM 0 HB THR A 33 6.896 18.669 -20.183 1.00 51.23 H new ATOM 0 HG1 THR A 33 8.392 19.640 -21.706 1.00 63.51 H new ATOM 0 HG21 THR A 33 9.241 17.911 -20.291 1.00 43.02 H new ATOM 0 HG22 THR A 33 8.135 16.574 -19.896 1.00 43.02 H new ATOM 0 HG23 THR A 33 8.796 16.726 -21.541 1.00 43.02 H new ATOM 529 N LEU A 34 4.263 17.482 -20.045 1.00 24.43 N ATOM 530 CA LEU A 34 3.407 17.077 -18.935 1.00 43.23 C ATOM 531 C LEU A 34 2.902 15.650 -19.127 1.00 50.10 C ATOM 532 O LEU A 34 2.840 14.871 -18.176 1.00 64.13 O ATOM 533 CB LEU A 34 2.221 18.035 -18.805 1.00 34.41 C ATOM 534 CG LEU A 34 1.157 17.651 -17.776 1.00 14.43 C ATOM 535 CD1 LEU A 34 1.609 18.031 -16.374 1.00 3.32 C ATOM 536 CD2 LEU A 34 -0.171 18.316 -18.107 1.00 12.32 C ATOM 0 H LEU A 34 4.003 18.369 -20.477 1.00 24.43 H new ATOM 0 HA LEU A 34 3.999 17.113 -18.021 1.00 43.23 H new ATOM 0 HB2 LEU A 34 2.604 19.023 -18.550 1.00 34.41 H new ATOM 0 HB3 LEU A 34 1.741 18.121 -19.780 1.00 34.41 H new ATOM 0 HG LEU A 34 1.019 16.570 -17.812 1.00 14.43 H new ATOM 0 HD11 LEU A 34 0.839 17.750 -15.655 1.00 3.32 H new ATOM 0 HD12 LEU A 34 2.536 17.508 -16.136 1.00 3.32 H new ATOM 0 HD13 LEU A 34 1.776 19.107 -16.325 1.00 3.32 H new ATOM 0 HD21 LEU A 34 -0.916 18.031 -17.364 1.00 12.32 H new ATOM 0 HD22 LEU A 34 -0.047 19.399 -18.100 1.00 12.32 H new ATOM 0 HD23 LEU A 34 -0.502 17.995 -19.095 1.00 12.32 H new ATOM 548 N SER A 35 2.547 15.316 -20.363 1.00 63.13 N ATOM 549 CA SER A 35 2.048 13.982 -20.680 1.00 73.31 C ATOM 550 C SER A 35 3.005 12.909 -20.171 1.00 51.22 C ATOM 551 O SER A 35 2.585 11.815 -19.793 1.00 50.40 O ATOM 552 CB SER A 35 1.851 13.834 -22.189 1.00 42.24 C ATOM 553 OG SER A 35 3.050 13.417 -22.820 1.00 24.01 O ATOM 0 H SER A 35 2.595 15.949 -21.161 1.00 63.13 H new ATOM 0 HA SER A 35 1.087 13.852 -20.182 1.00 73.31 H new ATOM 0 HB2 SER A 35 1.061 13.110 -22.387 1.00 42.24 H new ATOM 0 HB3 SER A 35 1.525 14.784 -22.612 1.00 42.24 H new ATOM 0 HG SER A 35 3.131 12.442 -22.757 1.00 24.01 H new ATOM 559 N TYR A 36 4.294 13.229 -20.166 1.00 24.31 N ATOM 560 CA TYR A 36 5.313 12.292 -19.708 1.00 24.32 C ATOM 561 C TYR A 36 5.587 12.472 -18.217 1.00 10.31 C ATOM 562 O TYR A 36 6.085 11.564 -17.552 1.00 72.52 O ATOM 563 CB TYR A 36 6.606 12.483 -20.501 1.00 60.32 C ATOM 564 CG TYR A 36 6.388 12.611 -21.992 1.00 21.33 C ATOM 565 CD1 TYR A 36 5.640 11.669 -22.688 1.00 33.34 C ATOM 566 CD2 TYR A 36 6.931 13.672 -22.705 1.00 21.51 C ATOM 567 CE1 TYR A 36 5.438 11.781 -24.050 1.00 14.13 C ATOM 568 CE2 TYR A 36 6.733 13.794 -24.067 1.00 11.33 C ATOM 569 CZ TYR A 36 5.986 12.845 -24.735 1.00 3.04 C ATOM 570 OH TYR A 36 5.789 12.962 -26.091 1.00 45.51 O ATOM 0 H TYR A 36 4.658 14.131 -20.474 1.00 24.31 H new ATOM 0 HA TYR A 36 4.940 11.281 -19.872 1.00 24.32 H new ATOM 0 HB2 TYR A 36 7.116 13.376 -20.139 1.00 60.32 H new ATOM 0 HB3 TYR A 36 7.268 11.638 -20.310 1.00 60.32 H new ATOM 0 HD1 TYR A 36 5.209 10.835 -22.155 1.00 33.34 H new ATOM 0 HD2 TYR A 36 7.518 14.415 -22.186 1.00 21.51 H new ATOM 0 HE1 TYR A 36 4.854 11.040 -24.575 1.00 14.13 H new ATOM 0 HE2 TYR A 36 7.160 14.627 -24.606 1.00 11.33 H new ATOM 0 HH TYR A 36 6.241 13.767 -26.419 1.00 45.51 H new ATOM 580 N TYR A 37 5.256 13.650 -17.700 1.00 54.21 N ATOM 581 CA TYR A 37 5.466 13.951 -16.289 1.00 5.01 C ATOM 582 C TYR A 37 4.616 13.044 -15.405 1.00 44.23 C ATOM 583 O TYR A 37 5.131 12.139 -14.749 1.00 51.30 O ATOM 584 CB TYR A 37 5.134 15.417 -16.004 1.00 11.33 C ATOM 585 CG TYR A 37 6.295 16.358 -16.242 1.00 63.44 C ATOM 586 CD1 TYR A 37 7.244 16.088 -17.220 1.00 74.01 C ATOM 587 CD2 TYR A 37 6.440 17.516 -15.489 1.00 44.14 C ATOM 588 CE1 TYR A 37 8.305 16.945 -17.441 1.00 44.51 C ATOM 589 CE2 TYR A 37 7.497 18.379 -15.704 1.00 1.34 C ATOM 590 CZ TYR A 37 8.427 18.089 -16.680 1.00 71.32 C ATOM 591 OH TYR A 37 9.482 18.945 -16.897 1.00 40.12 O ATOM 0 H TYR A 37 4.841 14.412 -18.237 1.00 54.21 H new ATOM 0 HA TYR A 37 6.516 13.771 -16.058 1.00 5.01 H new ATOM 0 HB2 TYR A 37 4.297 15.720 -16.633 1.00 11.33 H new ATOM 0 HB3 TYR A 37 4.806 15.512 -14.969 1.00 11.33 H new ATOM 0 HD1 TYR A 37 7.151 15.193 -17.818 1.00 74.01 H new ATOM 0 HD2 TYR A 37 5.714 17.746 -14.723 1.00 44.14 H new ATOM 0 HE1 TYR A 37 9.035 16.721 -18.205 1.00 44.51 H new ATOM 0 HE2 TYR A 37 7.595 19.276 -15.111 1.00 1.34 H new ATOM 0 HH TYR A 37 9.421 19.703 -16.279 1.00 40.12 H new ATOM 601 N GLU A 38 3.311 13.295 -15.394 1.00 3.11 N ATOM 602 CA GLU A 38 2.388 12.501 -14.590 1.00 5.14 C ATOM 603 C GLU A 38 2.470 11.025 -14.967 1.00 64.14 C ATOM 604 O GLU A 38 2.119 10.150 -14.175 1.00 41.42 O ATOM 605 CB GLU A 38 0.955 13.006 -14.771 1.00 45.31 C ATOM 606 CG GLU A 38 0.495 13.028 -16.219 1.00 24.31 C ATOM 607 CD GLU A 38 -0.273 11.779 -16.607 1.00 34.22 C ATOM 608 OE1 GLU A 38 -0.996 11.238 -15.744 1.00 33.41 O ATOM 609 OE2 GLU A 38 -0.149 11.343 -17.770 1.00 25.54 O ATOM 0 H GLU A 38 2.869 14.041 -15.932 1.00 3.11 H new ATOM 0 HA GLU A 38 2.674 12.607 -13.544 1.00 5.14 H new ATOM 0 HB2 GLU A 38 0.280 12.373 -14.194 1.00 45.31 H new ATOM 0 HB3 GLU A 38 0.879 14.012 -14.359 1.00 45.31 H new ATOM 0 HG2 GLU A 38 -0.135 13.903 -16.383 1.00 24.31 H new ATOM 0 HG3 GLU A 38 1.363 13.133 -16.870 1.00 24.31 H new ATOM 616 N SER A 39 2.934 10.755 -16.183 1.00 60.13 N ATOM 617 CA SER A 39 3.058 9.386 -16.669 1.00 34.13 C ATOM 618 C SER A 39 4.246 8.684 -16.016 1.00 11.41 C ATOM 619 O SER A 39 4.376 7.463 -16.089 1.00 14.05 O ATOM 620 CB SER A 39 3.217 9.373 -18.190 1.00 51.23 C ATOM 621 OG SER A 39 1.955 9.401 -18.834 1.00 13.01 O ATOM 0 H SER A 39 3.231 11.467 -16.850 1.00 60.13 H new ATOM 0 HA SER A 39 2.148 8.849 -16.402 1.00 34.13 H new ATOM 0 HB2 SER A 39 3.809 10.233 -18.504 1.00 51.23 H new ATOM 0 HB3 SER A 39 3.764 8.481 -18.494 1.00 51.23 H new ATOM 0 HG SER A 39 1.850 10.250 -19.312 1.00 13.01 H new ATOM 627 N GLY A 40 5.110 9.467 -15.376 1.00 14.52 N ATOM 628 CA GLY A 40 6.275 8.903 -14.720 1.00 24.23 C ATOM 629 C GLY A 40 7.350 8.488 -15.705 1.00 45.11 C ATOM 630 O GLY A 40 8.218 7.677 -15.380 1.00 74.53 O ATOM 0 H GLY A 40 5.024 10.481 -15.300 1.00 14.52 H new ATOM 0 HA2 GLY A 40 6.686 9.635 -14.025 1.00 24.23 H new ATOM 0 HA3 GLY A 40 5.973 8.037 -14.130 1.00 24.23 H new ATOM 634 N ARG A 41 7.293 9.042 -16.911 1.00 4.24 N ATOM 635 CA ARG A 41 8.267 8.722 -17.947 1.00 13.35 C ATOM 636 C ARG A 41 9.658 9.214 -17.556 1.00 52.13 C ATOM 637 O ARG A 41 10.667 8.660 -17.990 1.00 61.34 O ATOM 638 CB ARG A 41 7.850 9.344 -19.281 1.00 40.30 C ATOM 639 CG ARG A 41 8.132 8.457 -20.482 1.00 52.51 C ATOM 640 CD ARG A 41 6.912 7.635 -20.865 1.00 42.11 C ATOM 641 NE ARG A 41 6.893 7.317 -22.291 1.00 62.55 N ATOM 642 CZ ARG A 41 5.851 6.771 -22.908 1.00 34.51 C ATOM 643 NH1 ARG A 41 4.749 6.484 -22.228 1.00 62.54 N ATOM 644 NH2 ARG A 41 5.910 6.511 -24.208 1.00 43.33 N ATOM 0 H ARG A 41 6.582 9.716 -17.195 1.00 4.24 H new ATOM 0 HA ARG A 41 8.301 7.638 -18.056 1.00 13.35 H new ATOM 0 HB2 ARG A 41 6.784 9.570 -19.249 1.00 40.30 H new ATOM 0 HB3 ARG A 41 8.373 10.292 -19.409 1.00 40.30 H new ATOM 0 HG2 ARG A 41 8.437 9.074 -21.328 1.00 52.51 H new ATOM 0 HG3 ARG A 41 8.965 7.791 -20.256 1.00 52.51 H new ATOM 0 HD2 ARG A 41 6.901 6.711 -20.287 1.00 42.11 H new ATOM 0 HD3 ARG A 41 6.008 8.185 -20.604 1.00 42.11 H new ATOM 0 HE ARG A 41 7.725 7.526 -22.843 1.00 62.55 H new ATOM 0 HH11 ARG A 41 4.700 6.683 -21.229 1.00 62.54 H new ATOM 0 HH12 ARG A 41 3.950 6.065 -22.704 1.00 62.54 H new ATOM 0 HH21 ARG A 41 6.756 6.730 -24.734 1.00 43.33 H new ATOM 0 HH22 ARG A 41 5.110 6.092 -24.681 1.00 43.33 H new ATOM 658 N SER A 42 9.701 10.258 -16.735 1.00 70.41 N ATOM 659 CA SER A 42 10.967 10.828 -16.289 1.00 61.23 C ATOM 660 C SER A 42 10.757 11.748 -15.090 1.00 5.23 C ATOM 661 O SER A 42 9.786 12.504 -15.035 1.00 13.14 O ATOM 662 CB SER A 42 11.631 11.601 -17.429 1.00 24.10 C ATOM 663 OG SER A 42 13.011 11.292 -17.520 1.00 12.30 O ATOM 0 H SER A 42 8.874 10.726 -16.365 1.00 70.41 H new ATOM 0 HA SER A 42 11.619 10.009 -15.986 1.00 61.23 H new ATOM 0 HB2 SER A 42 11.138 11.360 -18.371 1.00 24.10 H new ATOM 0 HB3 SER A 42 11.505 12.672 -17.268 1.00 24.10 H new ATOM 0 HG SER A 42 13.412 11.798 -18.258 1.00 12.30 H new ATOM 669 N THR A 43 11.673 11.678 -14.130 1.00 12.02 N ATOM 670 CA THR A 43 11.590 12.501 -12.931 1.00 14.23 C ATOM 671 C THR A 43 11.736 13.980 -13.269 1.00 53.01 C ATOM 672 O THR A 43 12.792 14.442 -13.701 1.00 0.33 O ATOM 673 CB THR A 43 12.670 12.111 -11.905 1.00 21.52 C ATOM 674 OG1 THR A 43 13.243 10.847 -12.253 1.00 2.04 O ATOM 675 CG2 THR A 43 12.083 12.038 -10.503 1.00 51.25 C ATOM 0 H THR A 43 12.483 11.058 -14.160 1.00 12.02 H new ATOM 0 HA THR A 43 10.606 12.326 -12.495 1.00 14.23 H new ATOM 0 HB THR A 43 13.445 12.877 -11.918 1.00 21.52 H new ATOM 0 HG1 THR A 43 13.930 10.607 -11.596 1.00 2.04 H new ATOM 0 HG21 THR A 43 12.864 11.761 -9.795 1.00 51.25 H new ATOM 0 HG22 THR A 43 11.673 13.010 -10.229 1.00 51.25 H new ATOM 0 HG23 THR A 43 11.290 11.290 -10.479 1.00 51.25 H new ATOM 683 N PRO A 44 10.652 14.744 -13.068 1.00 21.02 N ATOM 684 CA PRO A 44 10.636 16.184 -13.344 1.00 52.42 C ATOM 685 C PRO A 44 11.495 16.972 -12.361 1.00 70.25 C ATOM 686 O PRO A 44 11.892 16.475 -11.308 1.00 3.54 O ATOM 687 CB PRO A 44 9.160 16.559 -13.185 1.00 71.00 C ATOM 688 CG PRO A 44 8.605 15.530 -12.262 1.00 72.24 C ATOM 689 CD PRO A 44 9.359 14.262 -12.554 1.00 61.30 C ATOM 0 HA PRO A 44 11.045 16.415 -14.327 1.00 52.42 H new ATOM 0 HB2 PRO A 44 9.049 17.562 -12.773 1.00 71.00 H new ATOM 0 HB3 PRO A 44 8.644 16.550 -14.145 1.00 71.00 H new ATOM 0 HG2 PRO A 44 8.733 15.829 -11.222 1.00 72.24 H new ATOM 0 HG3 PRO A 44 7.536 15.395 -12.426 1.00 72.24 H new ATOM 0 HD2 PRO A 44 9.484 13.654 -11.658 1.00 61.30 H new ATOM 0 HD3 PRO A 44 8.840 13.646 -13.288 1.00 61.30 H new ATOM 697 N PRO A 45 11.790 18.234 -12.711 1.00 71.15 N ATOM 698 CA PRO A 45 12.604 19.118 -11.872 1.00 45.31 C ATOM 699 C PRO A 45 11.879 19.537 -10.598 1.00 45.42 C ATOM 700 O PRO A 45 10.743 19.132 -10.355 1.00 14.40 O ATOM 701 CB PRO A 45 12.850 20.332 -12.771 1.00 13.01 C ATOM 702 CG PRO A 45 11.706 20.336 -13.724 1.00 51.14 C ATOM 703 CD PRO A 45 11.351 18.893 -13.953 1.00 25.43 C ATOM 0 HA PRO A 45 13.517 18.630 -11.532 1.00 45.31 H new ATOM 0 HB2 PRO A 45 12.885 21.254 -12.190 1.00 13.01 H new ATOM 0 HB3 PRO A 45 13.802 20.250 -13.296 1.00 13.01 H new ATOM 0 HG2 PRO A 45 10.859 20.886 -13.314 1.00 51.14 H new ATOM 0 HG3 PRO A 45 11.980 20.824 -14.660 1.00 51.14 H new ATOM 0 HD2 PRO A 45 10.282 18.764 -14.121 1.00 25.43 H new ATOM 0 HD3 PRO A 45 11.862 18.487 -14.826 1.00 25.43 H new ATOM 711 N THR A 46 12.545 20.352 -9.785 1.00 13.11 N ATOM 712 CA THR A 46 11.964 20.827 -8.535 1.00 31.11 C ATOM 713 C THR A 46 11.251 22.159 -8.731 1.00 24.32 C ATOM 714 O THR A 46 10.351 22.511 -7.968 1.00 10.01 O ATOM 715 CB THR A 46 13.038 20.988 -7.443 1.00 23.32 C ATOM 716 OG1 THR A 46 13.663 19.726 -7.181 1.00 51.14 O ATOM 717 CG2 THR A 46 12.427 21.532 -6.160 1.00 20.13 C ATOM 0 H THR A 46 13.487 20.697 -9.970 1.00 13.11 H new ATOM 0 HA THR A 46 11.242 20.076 -8.216 1.00 31.11 H new ATOM 0 HB THR A 46 13.785 21.696 -7.801 1.00 23.32 H new ATOM 0 HG1 THR A 46 14.090 19.397 -7.999 1.00 51.14 H new ATOM 0 HG21 THR A 46 13.204 21.637 -5.403 1.00 20.13 H new ATOM 0 HG22 THR A 46 11.977 22.505 -6.356 1.00 20.13 H new ATOM 0 HG23 THR A 46 11.662 20.844 -5.801 1.00 20.13 H new ATOM 725 N ASP A 47 11.657 22.898 -9.758 1.00 42.22 N ATOM 726 CA ASP A 47 11.055 24.192 -10.055 1.00 11.00 C ATOM 727 C ASP A 47 9.655 24.020 -10.633 1.00 64.31 C ATOM 728 O ASP A 47 8.766 24.835 -10.388 1.00 65.11 O ATOM 729 CB ASP A 47 11.933 24.974 -11.034 1.00 53.22 C ATOM 730 CG ASP A 47 11.899 26.467 -10.776 1.00 65.03 C ATOM 731 OD1 ASP A 47 11.946 26.867 -9.594 1.00 21.44 O ATOM 732 OD2 ASP A 47 11.825 27.236 -11.757 1.00 61.13 O ATOM 0 H ASP A 47 12.401 22.622 -10.399 1.00 42.22 H new ATOM 0 HA ASP A 47 10.977 24.752 -9.123 1.00 11.00 H new ATOM 0 HB2 ASP A 47 12.961 24.619 -10.959 1.00 53.22 H new ATOM 0 HB3 ASP A 47 11.601 24.777 -12.053 1.00 53.22 H new ATOM 737 N VAL A 48 9.464 22.953 -11.404 1.00 60.11 N ATOM 738 CA VAL A 48 8.172 22.674 -12.018 1.00 45.24 C ATOM 739 C VAL A 48 7.257 21.925 -11.054 1.00 11.34 C ATOM 740 O VAL A 48 6.086 22.272 -10.899 1.00 1.53 O ATOM 741 CB VAL A 48 8.330 21.845 -13.306 1.00 14.52 C ATOM 742 CG1 VAL A 48 6.969 21.461 -13.865 1.00 74.34 C ATOM 743 CG2 VAL A 48 9.141 22.616 -14.338 1.00 62.30 C ATOM 0 H VAL A 48 10.189 22.268 -11.618 1.00 60.11 H new ATOM 0 HA VAL A 48 7.725 23.636 -12.267 1.00 45.24 H new ATOM 0 HB VAL A 48 8.868 20.928 -13.064 1.00 14.52 H new ATOM 0 HG11 VAL A 48 7.101 20.876 -14.775 1.00 74.34 H new ATOM 0 HG12 VAL A 48 6.427 20.868 -13.128 1.00 74.34 H new ATOM 0 HG13 VAL A 48 6.402 22.363 -14.093 1.00 74.34 H new ATOM 0 HG21 VAL A 48 9.243 22.016 -15.242 1.00 62.30 H new ATOM 0 HG22 VAL A 48 8.632 23.549 -14.578 1.00 62.30 H new ATOM 0 HG23 VAL A 48 10.129 22.835 -13.934 1.00 62.30 H new ATOM 753 N MET A 49 7.799 20.897 -10.410 1.00 23.51 N ATOM 754 CA MET A 49 7.031 20.101 -9.460 1.00 32.02 C ATOM 755 C MET A 49 6.295 20.996 -8.470 1.00 43.12 C ATOM 756 O MET A 49 5.100 20.820 -8.227 1.00 54.11 O ATOM 757 CB MET A 49 7.951 19.137 -8.708 1.00 51.33 C ATOM 758 CG MET A 49 7.241 18.334 -7.630 1.00 21.11 C ATOM 759 SD MET A 49 8.018 18.503 -6.013 1.00 71.53 S ATOM 760 CE MET A 49 7.414 20.113 -5.513 1.00 52.32 C ATOM 0 H MET A 49 8.766 20.596 -10.528 1.00 23.51 H new ATOM 0 HA MET A 49 6.293 19.526 -10.020 1.00 32.02 H new ATOM 0 HB2 MET A 49 8.405 18.449 -9.422 1.00 51.33 H new ATOM 0 HB3 MET A 49 8.763 19.704 -8.252 1.00 51.33 H new ATOM 0 HG2 MET A 49 6.202 18.659 -7.565 1.00 21.11 H new ATOM 0 HG3 MET A 49 7.229 17.282 -7.915 1.00 21.11 H new ATOM 0 HE1 MET A 49 7.416 20.180 -4.425 1.00 52.32 H new ATOM 0 HE2 MET A 49 8.060 20.888 -5.926 1.00 52.32 H new ATOM 0 HE3 MET A 49 6.398 20.252 -5.884 1.00 52.32 H new ATOM 770 N MET A 50 7.014 21.957 -7.899 1.00 13.33 N ATOM 771 CA MET A 50 6.428 22.881 -6.935 1.00 63.34 C ATOM 772 C MET A 50 5.417 23.802 -7.611 1.00 13.15 C ATOM 773 O MET A 50 4.463 24.260 -6.982 1.00 31.51 O ATOM 774 CB MET A 50 7.521 23.711 -6.261 1.00 63.11 C ATOM 775 CG MET A 50 8.241 24.654 -7.211 1.00 51.43 C ATOM 776 SD MET A 50 9.825 25.220 -6.562 1.00 41.12 S ATOM 777 CE MET A 50 9.434 25.394 -4.823 1.00 52.14 C ATOM 0 H MET A 50 8.004 22.116 -8.087 1.00 13.33 H new ATOM 0 HA MET A 50 5.909 22.295 -6.177 1.00 63.34 H new ATOM 0 HB2 MET A 50 7.078 24.292 -5.452 1.00 63.11 H new ATOM 0 HB3 MET A 50 8.250 23.038 -5.808 1.00 63.11 H new ATOM 0 HG2 MET A 50 8.403 24.150 -8.164 1.00 51.43 H new ATOM 0 HG3 MET A 50 7.606 25.517 -7.411 1.00 51.43 H new ATOM 0 HE1 MET A 50 10.192 26.010 -4.340 1.00 52.14 H new ATOM 0 HE2 MET A 50 8.458 25.868 -4.715 1.00 52.14 H new ATOM 0 HE3 MET A 50 9.413 24.410 -4.354 1.00 52.14 H new ATOM 787 N ASN A 51 5.633 24.071 -8.894 1.00 65.21 N ATOM 788 CA ASN A 51 4.741 24.939 -9.654 1.00 34.45 C ATOM 789 C ASN A 51 3.382 24.275 -9.861 1.00 20.22 C ATOM 790 O ASN A 51 2.418 24.926 -10.264 1.00 30.14 O ATOM 791 CB ASN A 51 5.363 25.284 -11.008 1.00 31.11 C ATOM 792 CG ASN A 51 6.046 26.639 -11.002 1.00 2.32 C ATOM 793 OD1 ASN A 51 6.880 26.875 -9.997 1.00 22.00 O flip ATOM 794 ND2 ASN A 51 5.825 27.461 -11.891 1.00 22.11 N flip ATOM 0 H ASN A 51 6.418 23.700 -9.430 1.00 65.21 H new ATOM 0 HA ASN A 51 4.595 25.857 -9.084 1.00 34.45 H new ATOM 0 HB2 ASN A 51 6.088 24.516 -11.278 1.00 31.11 H new ATOM 0 HB3 ASN A 51 4.588 25.274 -11.774 1.00 31.11 H new ATOM 0 HD21 ASN A 51 5.175 27.235 -12.644 1.00 22.11 H new ATOM 0 HD22 ASN A 51 6.291 28.368 -11.874 1.00 22.11 H new ATOM 801 N ILE A 52 3.315 22.978 -9.581 1.00 3.55 N ATOM 802 CA ILE A 52 2.074 22.227 -9.735 1.00 73.42 C ATOM 803 C ILE A 52 1.309 22.156 -8.418 1.00 71.13 C ATOM 804 O ILE A 52 0.080 22.079 -8.406 1.00 32.44 O ATOM 805 CB ILE A 52 2.341 20.797 -10.240 1.00 62.11 C ATOM 806 CG1 ILE A 52 3.279 20.826 -11.448 1.00 74.14 C ATOM 807 CG2 ILE A 52 1.032 20.109 -10.595 1.00 33.12 C ATOM 808 CD1 ILE A 52 2.990 21.957 -12.411 1.00 62.23 C ATOM 0 H ILE A 52 4.104 22.425 -9.247 1.00 3.55 H new ATOM 0 HA ILE A 52 1.473 22.757 -10.473 1.00 73.42 H new ATOM 0 HB ILE A 52 2.823 20.230 -9.444 1.00 62.11 H new ATOM 0 HG12 ILE A 52 4.307 20.912 -11.097 1.00 74.14 H new ATOM 0 HG13 ILE A 52 3.202 19.878 -11.980 1.00 74.14 H new ATOM 0 HG21 ILE A 52 1.236 19.099 -10.950 1.00 33.12 H new ATOM 0 HG22 ILE A 52 0.395 20.061 -9.712 1.00 33.12 H new ATOM 0 HG23 ILE A 52 0.525 20.673 -11.378 1.00 33.12 H new ATOM 0 HD11 ILE A 52 3.693 21.915 -13.243 1.00 62.23 H new ATOM 0 HD12 ILE A 52 1.973 21.861 -12.791 1.00 62.23 H new ATOM 0 HD13 ILE A 52 3.095 22.911 -11.894 1.00 62.23 H new ATOM 820 N LEU A 53 2.043 22.182 -7.311 1.00 51.45 N ATOM 821 CA LEU A 53 1.433 22.123 -5.987 1.00 74.54 C ATOM 822 C LEU A 53 1.211 23.523 -5.426 1.00 34.01 C ATOM 823 O LEU A 53 0.363 23.726 -4.559 1.00 42.22 O ATOM 824 CB LEU A 53 2.315 21.313 -5.035 1.00 74.22 C ATOM 825 CG LEU A 53 1.795 19.926 -4.655 1.00 41.43 C ATOM 826 CD1 LEU A 53 1.319 19.178 -5.890 1.00 53.22 C ATOM 827 CD2 LEU A 53 2.873 19.132 -3.931 1.00 13.23 C ATOM 0 H LEU A 53 3.061 22.244 -7.304 1.00 51.45 H new ATOM 0 HA LEU A 53 0.464 21.633 -6.082 1.00 74.54 H new ATOM 0 HB2 LEU A 53 3.298 21.198 -5.492 1.00 74.22 H new ATOM 0 HB3 LEU A 53 2.454 21.890 -4.121 1.00 74.22 H new ATOM 0 HG LEU A 53 0.948 20.049 -3.981 1.00 41.43 H new ATOM 0 HD11 LEU A 53 0.953 18.193 -5.600 1.00 53.22 H new ATOM 0 HD12 LEU A 53 0.515 19.738 -6.367 1.00 53.22 H new ATOM 0 HD13 LEU A 53 2.148 19.065 -6.589 1.00 53.22 H new ATOM 0 HD21 LEU A 53 2.485 18.148 -3.668 1.00 13.23 H new ATOM 0 HD22 LEU A 53 3.740 19.019 -4.582 1.00 13.23 H new ATOM 0 HD23 LEU A 53 3.167 19.660 -3.024 1.00 13.23 H new ATOM 839 N GLN A 54 1.978 24.486 -5.929 1.00 35.22 N ATOM 840 CA GLN A 54 1.864 25.867 -5.478 1.00 5.24 C ATOM 841 C GLN A 54 0.482 26.429 -5.793 1.00 40.02 C ATOM 842 O GLN A 54 0.044 27.407 -5.185 1.00 11.30 O ATOM 843 CB GLN A 54 2.941 26.732 -6.137 1.00 13.40 C ATOM 844 CG GLN A 54 2.717 26.954 -7.624 1.00 75.21 C ATOM 845 CD GLN A 54 3.660 27.987 -8.208 1.00 20.35 C ATOM 846 OE1 GLN A 54 4.932 27.908 -7.832 1.00 45.45 O flip ATOM 847 NE2 GLN A 54 3.251 28.847 -8.988 1.00 73.44 N flip ATOM 0 H GLN A 54 2.685 24.334 -6.649 1.00 35.22 H new ATOM 0 HA GLN A 54 2.006 25.883 -4.397 1.00 5.24 H new ATOM 0 HB2 GLN A 54 2.976 27.699 -5.635 1.00 13.40 H new ATOM 0 HB3 GLN A 54 3.913 26.261 -5.991 1.00 13.40 H new ATOM 0 HG2 GLN A 54 2.847 26.009 -8.152 1.00 75.21 H new ATOM 0 HG3 GLN A 54 1.688 27.273 -7.789 1.00 75.21 H new ATOM 0 HE21 GLN A 54 2.265 28.871 -9.250 1.00 73.44 H new ATOM 0 HE22 GLN A 54 3.898 29.536 -9.373 1.00 73.44 H new ATOM 856 N THR A 55 -0.203 25.806 -6.746 1.00 23.53 N ATOM 857 CA THR A 55 -1.536 26.244 -7.142 1.00 24.25 C ATOM 858 C THR A 55 -2.488 26.252 -5.953 1.00 71.25 C ATOM 859 O THR A 55 -2.349 25.473 -5.009 1.00 30.33 O ATOM 860 CB THR A 55 -2.119 25.342 -8.246 1.00 54.30 C ATOM 861 OG1 THR A 55 -1.623 24.006 -8.100 1.00 42.52 O ATOM 862 CG2 THR A 55 -1.759 25.874 -9.626 1.00 51.14 C ATOM 0 H THR A 55 0.144 24.995 -7.259 1.00 23.53 H new ATOM 0 HA THR A 55 -1.433 27.258 -7.528 1.00 24.25 H new ATOM 0 HB THR A 55 -3.204 25.339 -8.147 1.00 54.30 H new ATOM 0 HG1 THR A 55 -0.805 23.901 -8.629 1.00 42.52 H new ATOM 0 HG21 THR A 55 -2.182 25.221 -10.389 1.00 51.14 H new ATOM 0 HG22 THR A 55 -2.163 26.880 -9.745 1.00 51.14 H new ATOM 0 HG23 THR A 55 -0.675 25.903 -9.733 1.00 51.14 H new ATOM 870 N PRO A 56 -3.482 27.152 -5.994 1.00 53.52 N ATOM 871 CA PRO A 56 -4.479 27.282 -4.927 1.00 12.33 C ATOM 872 C PRO A 56 -5.428 26.091 -4.874 1.00 31.34 C ATOM 873 O PRO A 56 -5.966 25.762 -3.817 1.00 43.31 O ATOM 874 CB PRO A 56 -5.238 28.556 -5.305 1.00 41.51 C ATOM 875 CG PRO A 56 -5.069 28.675 -6.780 1.00 31.12 C ATOM 876 CD PRO A 56 -3.708 28.113 -7.088 1.00 2.04 C ATOM 0 HA PRO A 56 -4.018 27.322 -3.940 1.00 12.33 H new ATOM 0 HB2 PRO A 56 -6.291 28.485 -5.032 1.00 41.51 H new ATOM 0 HB3 PRO A 56 -4.833 29.426 -4.789 1.00 41.51 H new ATOM 0 HG2 PRO A 56 -5.847 28.124 -7.308 1.00 31.12 H new ATOM 0 HG3 PRO A 56 -5.143 29.715 -7.099 1.00 31.12 H new ATOM 0 HD2 PRO A 56 -3.685 27.625 -8.063 1.00 2.04 H new ATOM 0 HD3 PRO A 56 -2.945 28.892 -7.103 1.00 2.04 H new ATOM 884 N GLN A 57 -5.630 25.449 -6.020 1.00 54.13 N ATOM 885 CA GLN A 57 -6.517 24.294 -6.102 1.00 35.45 C ATOM 886 C GLN A 57 -5.840 23.048 -5.541 1.00 15.23 C ATOM 887 O GLN A 57 -6.490 22.196 -4.934 1.00 55.15 O ATOM 888 CB GLN A 57 -6.939 24.051 -7.552 1.00 31.22 C ATOM 889 CG GLN A 57 -5.825 23.491 -8.424 1.00 70.00 C ATOM 890 CD GLN A 57 -6.019 23.809 -9.893 1.00 22.24 C ATOM 891 OE1 GLN A 57 -5.080 24.211 -10.583 1.00 74.05 O ATOM 892 NE2 GLN A 57 -7.241 23.631 -10.382 1.00 50.03 N ATOM 0 H GLN A 57 -5.192 25.709 -6.904 1.00 54.13 H new ATOM 0 HA GLN A 57 -7.403 24.504 -5.504 1.00 35.45 H new ATOM 0 HB2 GLN A 57 -7.782 23.360 -7.566 1.00 31.22 H new ATOM 0 HB3 GLN A 57 -7.289 24.989 -7.982 1.00 31.22 H new ATOM 0 HG2 GLN A 57 -4.870 23.897 -8.091 1.00 70.00 H new ATOM 0 HG3 GLN A 57 -5.775 22.410 -8.294 1.00 70.00 H new ATOM 0 HE21 GLN A 57 -7.989 23.296 -9.775 1.00 50.03 H new ATOM 0 HE22 GLN A 57 -7.431 23.829 -11.364 1.00 50.03 H new ATOM 901 N PHE A 58 -4.532 22.946 -5.747 1.00 44.33 N ATOM 902 CA PHE A 58 -3.767 21.804 -5.262 1.00 12.11 C ATOM 903 C PHE A 58 -2.985 22.167 -4.004 1.00 32.20 C ATOM 904 O PHE A 58 -1.891 21.653 -3.769 1.00 14.11 O ATOM 905 CB PHE A 58 -2.809 21.308 -6.347 1.00 65.32 C ATOM 906 CG PHE A 58 -3.506 20.725 -7.543 1.00 64.12 C ATOM 907 CD1 PHE A 58 -4.201 19.531 -7.443 1.00 54.23 C ATOM 908 CD2 PHE A 58 -3.467 21.372 -8.768 1.00 14.53 C ATOM 909 CE1 PHE A 58 -4.844 18.992 -8.541 1.00 13.32 C ATOM 910 CE2 PHE A 58 -4.108 20.839 -9.869 1.00 51.05 C ATOM 911 CZ PHE A 58 -4.797 19.646 -9.756 1.00 14.14 C ATOM 0 H PHE A 58 -3.979 23.642 -6.247 1.00 44.33 H new ATOM 0 HA PHE A 58 -4.468 21.007 -5.014 1.00 12.11 H new ATOM 0 HB2 PHE A 58 -2.180 22.137 -6.672 1.00 65.32 H new ATOM 0 HB3 PHE A 58 -2.147 20.555 -5.919 1.00 65.32 H new ATOM 0 HD1 PHE A 58 -4.241 19.015 -6.495 1.00 54.23 H new ATOM 0 HD2 PHE A 58 -2.929 22.304 -8.863 1.00 14.53 H new ATOM 0 HE1 PHE A 58 -5.383 18.060 -8.449 1.00 13.32 H new ATOM 0 HE2 PHE A 58 -4.071 21.354 -10.818 1.00 51.05 H new ATOM 0 HZ PHE A 58 -5.297 19.226 -10.616 1.00 14.14 H new ATOM 921 N THR A 59 -3.554 23.058 -3.197 1.00 4.20 N ATOM 922 CA THR A 59 -2.910 23.491 -1.963 1.00 22.31 C ATOM 923 C THR A 59 -3.159 22.498 -0.834 1.00 21.11 C ATOM 924 O THR A 59 -2.353 22.375 0.088 1.00 21.14 O ATOM 925 CB THR A 59 -3.411 24.882 -1.528 1.00 62.34 C ATOM 926 OG1 THR A 59 -2.670 25.334 -0.390 1.00 4.22 O ATOM 927 CG2 THR A 59 -4.893 24.842 -1.192 1.00 32.12 C ATOM 0 H THR A 59 -4.459 23.493 -3.376 1.00 4.20 H new ATOM 0 HA THR A 59 -1.840 23.544 -2.166 1.00 22.31 H new ATOM 0 HB THR A 59 -3.262 25.574 -2.357 1.00 62.34 H new ATOM 0 HG1 THR A 59 -2.993 26.219 -0.120 1.00 4.22 H new ATOM 0 HG21 THR A 59 -5.224 25.835 -0.888 1.00 32.12 H new ATOM 0 HG22 THR A 59 -5.457 24.525 -2.069 1.00 32.12 H new ATOM 0 HG23 THR A 59 -5.063 24.138 -0.378 1.00 32.12 H new ATOM 935 N LYS A 60 -4.280 21.789 -0.913 1.00 35.52 N ATOM 936 CA LYS A 60 -4.636 20.804 0.102 1.00 52.53 C ATOM 937 C LYS A 60 -3.756 19.563 -0.014 1.00 41.24 C ATOM 938 O LYS A 60 -3.670 18.763 0.918 1.00 22.22 O ATOM 939 CB LYS A 60 -6.109 20.412 -0.033 1.00 75.42 C ATOM 940 CG LYS A 60 -7.032 21.594 -0.277 1.00 41.34 C ATOM 941 CD LYS A 60 -8.491 21.203 -0.115 1.00 60.34 C ATOM 942 CE LYS A 60 -9.021 20.495 -1.353 1.00 4.52 C ATOM 943 NZ LYS A 60 -9.664 19.195 -1.017 1.00 64.02 N ATOM 0 H LYS A 60 -4.958 21.878 -1.670 1.00 35.52 H new ATOM 0 HA LYS A 60 -4.475 21.253 1.082 1.00 52.53 H new ATOM 0 HB2 LYS A 60 -6.214 19.704 -0.855 1.00 75.42 H new ATOM 0 HB3 LYS A 60 -6.424 19.897 0.874 1.00 75.42 H new ATOM 0 HG2 LYS A 60 -6.790 22.396 0.420 1.00 41.34 H new ATOM 0 HG3 LYS A 60 -6.868 21.984 -1.282 1.00 41.34 H new ATOM 0 HD2 LYS A 60 -8.600 20.552 0.752 1.00 60.34 H new ATOM 0 HD3 LYS A 60 -9.088 22.094 0.079 1.00 60.34 H new ATOM 0 HE2 LYS A 60 -9.743 21.137 -1.857 1.00 4.52 H new ATOM 0 HE3 LYS A 60 -8.202 20.325 -2.052 1.00 4.52 H new ATOM 0 HZ1 LYS A 60 -10.538 19.086 -1.571 1.00 64.02 H new ATOM 0 HZ2 LYS A 60 -9.012 18.417 -1.243 1.00 64.02 H new ATOM 0 HZ3 LYS A 60 -9.892 19.172 -0.003 1.00 64.02 H new ATOM 957 N TYR A 61 -3.104 19.410 -1.161 1.00 14.05 N ATOM 958 CA TYR A 61 -2.232 18.266 -1.398 1.00 71.14 C ATOM 959 C TYR A 61 -0.805 18.719 -1.688 1.00 30.13 C ATOM 960 O TYR A 61 -0.328 18.628 -2.821 1.00 60.54 O ATOM 961 CB TYR A 61 -2.760 17.428 -2.564 1.00 71.25 C ATOM 962 CG TYR A 61 -4.261 17.499 -2.729 1.00 2.03 C ATOM 963 CD1 TYR A 61 -5.095 16.611 -2.061 1.00 2.40 C ATOM 964 CD2 TYR A 61 -4.845 18.452 -3.555 1.00 71.04 C ATOM 965 CE1 TYR A 61 -6.468 16.671 -2.209 1.00 73.23 C ATOM 966 CE2 TYR A 61 -6.217 18.519 -3.709 1.00 44.31 C ATOM 967 CZ TYR A 61 -7.023 17.628 -3.034 1.00 4.15 C ATOM 968 OH TYR A 61 -8.390 17.691 -3.184 1.00 1.43 O ATOM 0 H TYR A 61 -3.163 20.064 -1.941 1.00 14.05 H new ATOM 0 HA TYR A 61 -2.223 17.655 -0.495 1.00 71.14 H new ATOM 0 HB2 TYR A 61 -2.285 17.764 -3.486 1.00 71.25 H new ATOM 0 HB3 TYR A 61 -2.468 16.388 -2.415 1.00 71.25 H new ATOM 0 HD1 TYR A 61 -4.663 15.861 -1.415 1.00 2.40 H new ATOM 0 HD2 TYR A 61 -4.216 19.152 -4.085 1.00 71.04 H new ATOM 0 HE1 TYR A 61 -7.102 15.973 -1.682 1.00 73.23 H new ATOM 0 HE2 TYR A 61 -6.655 19.266 -4.355 1.00 44.31 H new ATOM 0 HH TYR A 61 -8.619 18.420 -3.797 1.00 1.43 H new ATOM 978 N THR A 62 -0.125 19.210 -0.656 1.00 71.44 N ATOM 979 CA THR A 62 1.247 19.679 -0.798 1.00 10.10 C ATOM 980 C THR A 62 2.230 18.707 -0.154 1.00 71.52 C ATOM 981 O THR A 62 3.071 18.118 -0.834 1.00 70.23 O ATOM 982 CB THR A 62 1.433 21.072 -0.168 1.00 54.41 C ATOM 983 OG1 THR A 62 0.158 21.692 0.033 1.00 54.14 O ATOM 984 CG2 THR A 62 2.300 21.956 -1.052 1.00 32.11 C ATOM 0 H THR A 62 -0.503 19.293 0.288 1.00 71.44 H new ATOM 0 HA THR A 62 1.450 19.742 -1.867 1.00 10.10 H new ATOM 0 HB THR A 62 1.932 20.948 0.793 1.00 54.41 H new ATOM 0 HG1 THR A 62 0.287 22.631 0.283 1.00 54.14 H new ATOM 0 HG21 THR A 62 2.417 22.934 -0.586 1.00 32.11 H new ATOM 0 HG22 THR A 62 3.280 21.495 -1.178 1.00 32.11 H new ATOM 0 HG23 THR A 62 1.826 22.073 -2.026 1.00 32.11 H new ATOM 992 N LEU A 63 2.119 18.544 1.159 1.00 70.40 N ATOM 993 CA LEU A 63 2.997 17.642 1.895 1.00 22.45 C ATOM 994 C LEU A 63 2.243 16.397 2.349 1.00 21.32 C ATOM 995 O LEU A 63 2.826 15.485 2.937 1.00 24.35 O ATOM 996 CB LEU A 63 3.597 18.358 3.106 1.00 14.53 C ATOM 997 CG LEU A 63 2.809 18.246 4.412 1.00 33.33 C ATOM 998 CD1 LEU A 63 3.367 17.128 5.277 1.00 44.54 C ATOM 999 CD2 LEU A 63 2.832 19.568 5.164 1.00 34.14 C ATOM 0 H LEU A 63 1.429 19.025 1.736 1.00 70.40 H new ATOM 0 HA LEU A 63 3.801 17.333 1.227 1.00 22.45 H new ATOM 0 HB2 LEU A 63 4.599 17.965 3.275 1.00 14.53 H new ATOM 0 HB3 LEU A 63 3.706 19.414 2.861 1.00 14.53 H new ATOM 0 HG LEU A 63 1.773 18.008 4.170 1.00 33.33 H new ATOM 0 HD11 LEU A 63 2.794 17.063 6.202 1.00 44.54 H new ATOM 0 HD12 LEU A 63 3.297 16.182 4.739 1.00 44.54 H new ATOM 0 HD13 LEU A 63 4.411 17.336 5.511 1.00 44.54 H new ATOM 0 HD21 LEU A 63 2.266 19.469 6.091 1.00 34.14 H new ATOM 0 HD22 LEU A 63 3.863 19.837 5.395 1.00 34.14 H new ATOM 0 HD23 LEU A 63 2.383 20.346 4.546 1.00 34.14 H new ATOM 1011 N TRP A 64 0.944 16.364 2.070 1.00 4.53 N ATOM 1012 CA TRP A 64 0.110 15.228 2.448 1.00 50.12 C ATOM 1013 C TRP A 64 0.723 13.918 1.965 1.00 52.11 C ATOM 1014 O TRP A 64 0.465 12.855 2.530 1.00 52.14 O ATOM 1015 CB TRP A 64 -1.298 15.390 1.874 1.00 45.11 C ATOM 1016 CG TRP A 64 -1.496 14.671 0.573 1.00 5.32 C ATOM 1017 CD1 TRP A 64 -2.328 13.613 0.341 1.00 25.31 C ATOM 1018 CD2 TRP A 64 -0.847 14.956 -0.671 1.00 40.31 C ATOM 1019 NE1 TRP A 64 -2.235 13.223 -0.974 1.00 23.33 N ATOM 1020 CE2 TRP A 64 -1.335 14.032 -1.615 1.00 24.22 C ATOM 1021 CE3 TRP A 64 0.096 15.903 -1.080 1.00 53.41 C ATOM 1022 CZ2 TRP A 64 -0.909 14.028 -2.941 1.00 70.32 C ATOM 1023 CZ3 TRP A 64 0.518 15.898 -2.395 1.00 55.11 C ATOM 1024 CH2 TRP A 64 0.015 14.967 -3.313 1.00 13.15 C ATOM 0 H TRP A 64 0.446 17.110 1.584 1.00 4.53 H new ATOM 0 HA TRP A 64 0.050 15.199 3.536 1.00 50.12 H new ATOM 0 HB2 TRP A 64 -2.023 15.020 2.599 1.00 45.11 H new ATOM 0 HB3 TRP A 64 -1.504 16.451 1.730 1.00 45.11 H new ATOM 0 HD1 TRP A 64 -2.965 13.151 1.081 1.00 25.31 H new ATOM 0 HE1 TRP A 64 -2.752 12.456 -1.403 1.00 23.33 H new ATOM 0 HE3 TRP A 64 0.488 16.626 -0.380 1.00 53.41 H new ATOM 0 HZ2 TRP A 64 -1.294 13.310 -3.650 1.00 70.32 H new ATOM 0 HZ3 TRP A 64 1.248 16.624 -2.721 1.00 55.11 H new ATOM 0 HH2 TRP A 64 0.363 14.991 -4.335 1.00 13.15 H new ATOM 1035 N PHE A 65 1.533 14.001 0.915 1.00 21.42 N ATOM 1036 CA PHE A 65 2.182 12.821 0.355 1.00 54.41 C ATOM 1037 C PHE A 65 3.700 12.977 0.366 1.00 55.14 C ATOM 1038 O PHE A 65 4.434 11.995 0.476 1.00 43.01 O ATOM 1039 CB PHE A 65 1.694 12.575 -1.075 1.00 0.51 C ATOM 1040 CG PHE A 65 0.763 11.402 -1.197 1.00 35.13 C ATOM 1041 CD1 PHE A 65 -0.195 11.157 -0.227 1.00 1.23 C ATOM 1042 CD2 PHE A 65 0.847 10.546 -2.283 1.00 72.04 C ATOM 1043 CE1 PHE A 65 -1.053 10.079 -0.337 1.00 74.41 C ATOM 1044 CE2 PHE A 65 -0.009 9.467 -2.399 1.00 63.43 C ATOM 1045 CZ PHE A 65 -0.959 9.233 -1.424 1.00 12.20 C ATOM 0 H PHE A 65 1.756 14.873 0.435 1.00 21.42 H new ATOM 0 HA PHE A 65 1.918 11.964 0.975 1.00 54.41 H new ATOM 0 HB2 PHE A 65 1.188 13.470 -1.437 1.00 0.51 H new ATOM 0 HB3 PHE A 65 2.556 12.413 -1.722 1.00 0.51 H new ATOM 0 HD1 PHE A 65 -0.272 11.816 0.625 1.00 1.23 H new ATOM 0 HD2 PHE A 65 1.589 10.724 -3.047 1.00 72.04 H new ATOM 0 HE1 PHE A 65 -1.796 9.899 0.426 1.00 74.41 H new ATOM 0 HE2 PHE A 65 0.065 8.808 -3.251 1.00 63.43 H new ATOM 0 HZ PHE A 65 -1.627 8.389 -1.512 1.00 12.20 H new ATOM 1055 N MET A 66 4.162 14.218 0.253 1.00 21.31 N ATOM 1056 CA MET A 66 5.592 14.503 0.251 1.00 54.24 C ATOM 1057 C MET A 66 6.274 13.870 1.460 1.00 62.12 C ATOM 1058 O MET A 66 7.396 13.372 1.363 1.00 43.23 O ATOM 1059 CB MET A 66 5.833 16.014 0.249 1.00 0.42 C ATOM 1060 CG MET A 66 7.041 16.435 -0.571 1.00 60.21 C ATOM 1061 SD MET A 66 8.174 17.490 0.354 1.00 74.33 S ATOM 1062 CE MET A 66 8.927 16.295 1.454 1.00 12.21 C ATOM 0 H MET A 66 3.567 15.042 0.162 1.00 21.31 H new ATOM 0 HA MET A 66 6.021 14.073 -0.654 1.00 54.24 H new ATOM 0 HB2 MET A 66 4.947 16.515 -0.141 1.00 0.42 H new ATOM 0 HB3 MET A 66 5.965 16.354 1.276 1.00 0.42 H new ATOM 0 HG2 MET A 66 7.573 15.546 -0.910 1.00 60.21 H new ATOM 0 HG3 MET A 66 6.704 16.964 -1.462 1.00 60.21 H new ATOM 0 HE1 MET A 66 8.628 16.507 2.481 1.00 12.21 H new ATOM 0 HE2 MET A 66 8.600 15.292 1.180 1.00 12.21 H new ATOM 0 HE3 MET A 66 10.012 16.358 1.371 1.00 12.21 H new ATOM 1072 N THR A 67 5.589 13.891 2.599 1.00 35.53 N ATOM 1073 CA THR A 67 6.130 13.321 3.826 1.00 25.30 C ATOM 1074 C THR A 67 5.148 12.339 4.455 1.00 54.02 C ATOM 1075 O THR A 67 5.374 11.842 5.558 1.00 4.44 O ATOM 1076 CB THR A 67 6.470 14.417 4.853 1.00 34.44 C ATOM 1077 OG1 THR A 67 7.113 15.517 4.200 1.00 54.41 O ATOM 1078 CG2 THR A 67 7.376 13.872 5.947 1.00 3.14 C ATOM 0 H THR A 67 4.658 14.297 2.697 1.00 35.53 H new ATOM 0 HA THR A 67 7.044 12.793 3.553 1.00 25.30 H new ATOM 0 HB THR A 67 5.540 14.757 5.309 1.00 34.44 H new ATOM 0 HG1 THR A 67 7.324 16.211 4.859 1.00 54.41 H new ATOM 0 HG21 THR A 67 7.602 14.664 6.660 1.00 3.14 H new ATOM 0 HG22 THR A 67 6.873 13.053 6.462 1.00 3.14 H new ATOM 0 HG23 THR A 67 8.303 13.507 5.504 1.00 3.14 H new ATOM 1086 N ASN A 68 4.058 12.063 3.746 1.00 30.33 N ATOM 1087 CA ASN A 68 3.041 11.140 4.235 1.00 74.32 C ATOM 1088 C ASN A 68 2.392 11.670 5.511 1.00 52.13 C ATOM 1089 O ASN A 68 2.105 10.910 6.435 1.00 64.53 O ATOM 1090 CB ASN A 68 3.657 9.763 4.498 1.00 33.53 C ATOM 1091 CG ASN A 68 2.620 8.656 4.494 1.00 60.54 C ATOM 1092 OD1 ASN A 68 2.188 8.200 3.434 1.00 41.20 O ATOM 1093 ND2 ASN A 68 2.216 8.218 5.680 1.00 22.32 N ATOM 0 H ASN A 68 3.857 12.466 2.831 1.00 30.33 H new ATOM 0 HA ASN A 68 2.272 11.048 3.468 1.00 74.32 H new ATOM 0 HB2 ASN A 68 4.411 9.554 3.739 1.00 33.53 H new ATOM 0 HB3 ASN A 68 4.169 9.775 5.460 1.00 33.53 H new ATOM 0 HD21 ASN A 68 1.520 7.474 5.739 1.00 22.32 H new ATOM 0 HD22 ASN A 68 2.601 8.625 6.532 1.00 22.32 H new ATOM 1100 N GLN A 69 2.164 12.979 5.551 1.00 44.34 N ATOM 1101 CA GLN A 69 1.549 13.612 6.711 1.00 22.34 C ATOM 1102 C GLN A 69 0.432 14.560 6.287 1.00 11.24 C ATOM 1103 O GLN A 69 0.687 15.611 5.699 1.00 12.43 O ATOM 1104 CB GLN A 69 2.600 14.373 7.521 1.00 24.40 C ATOM 1105 CG GLN A 69 2.039 15.053 8.760 1.00 53.41 C ATOM 1106 CD GLN A 69 1.894 14.103 9.931 1.00 3.24 C ATOM 1107 OE1 GLN A 69 2.824 13.920 10.717 1.00 30.13 O ATOM 1108 NE2 GLN A 69 0.721 13.492 10.056 1.00 3.22 N ATOM 0 H GLN A 69 2.396 13.621 4.793 1.00 44.34 H new ATOM 0 HA GLN A 69 1.118 12.828 7.334 1.00 22.34 H new ATOM 0 HB2 GLN A 69 3.386 13.681 7.821 1.00 24.40 H new ATOM 0 HB3 GLN A 69 3.064 15.125 6.883 1.00 24.40 H new ATOM 0 HG2 GLN A 69 2.693 15.878 9.045 1.00 53.41 H new ATOM 0 HG3 GLN A 69 1.066 15.484 8.524 1.00 53.41 H new ATOM 0 HE21 GLN A 69 -0.023 13.673 9.382 1.00 3.22 H new ATOM 0 HE22 GLN A 69 0.564 12.842 10.826 1.00 3.22 H new ATOM 1117 N ILE A 70 -0.805 14.181 6.590 1.00 53.02 N ATOM 1118 CA ILE A 70 -1.961 14.997 6.240 1.00 1.12 C ATOM 1119 C ILE A 70 -2.181 16.105 7.265 1.00 5.32 C ATOM 1120 O ILE A 70 -2.282 15.845 8.463 1.00 35.42 O ATOM 1121 CB ILE A 70 -3.241 14.146 6.138 1.00 22.12 C ATOM 1122 CG1 ILE A 70 -3.473 13.375 7.438 1.00 23.30 C ATOM 1123 CG2 ILE A 70 -3.148 13.191 4.957 1.00 74.23 C ATOM 1124 CD1 ILE A 70 -4.720 13.801 8.179 1.00 41.24 C ATOM 0 H ILE A 70 -1.032 13.314 7.077 1.00 53.02 H new ATOM 0 HA ILE A 70 -1.752 15.441 5.267 1.00 1.12 H new ATOM 0 HB ILE A 70 -4.090 14.810 5.977 1.00 22.12 H new ATOM 0 HG12 ILE A 70 -3.540 12.311 7.213 1.00 23.30 H new ATOM 0 HG13 ILE A 70 -2.609 13.509 8.089 1.00 23.30 H new ATOM 0 HG21 ILE A 70 -4.059 12.596 4.897 1.00 74.23 H new ATOM 0 HG22 ILE A 70 -3.026 13.762 4.036 1.00 74.23 H new ATOM 0 HG23 ILE A 70 -2.292 12.530 5.090 1.00 74.23 H new ATOM 0 HD11 ILE A 70 -4.821 13.212 9.091 1.00 41.24 H new ATOM 0 HD12 ILE A 70 -4.647 14.858 8.436 1.00 41.24 H new ATOM 0 HD13 ILE A 70 -5.592 13.641 7.545 1.00 41.24 H new ATOM 1136 N ALA A 71 -2.256 17.342 6.784 1.00 53.21 N ATOM 1137 CA ALA A 71 -2.469 18.489 7.657 1.00 71.32 C ATOM 1138 C ALA A 71 -3.838 19.116 7.416 1.00 23.44 C ATOM 1139 O ALA A 71 -3.964 20.169 6.791 1.00 55.01 O ATOM 1140 CB ALA A 71 -1.369 19.520 7.450 1.00 72.44 C ATOM 0 H ALA A 71 -2.172 17.575 5.794 1.00 53.21 H new ATOM 0 HA ALA A 71 -2.436 18.141 8.689 1.00 71.32 H new ATOM 0 HB1 ALA A 71 -1.540 20.372 8.108 1.00 72.44 H new ATOM 0 HB2 ALA A 71 -0.402 19.072 7.680 1.00 72.44 H new ATOM 0 HB3 ALA A 71 -1.375 19.856 6.413 1.00 72.44 H new ATOM 1146 N PRO A 72 -4.889 18.456 7.922 1.00 32.32 N ATOM 1147 CA PRO A 72 -6.269 18.931 7.775 1.00 40.23 C ATOM 1148 C PRO A 72 -6.540 20.188 8.594 1.00 33.14 C ATOM 1149 O PRO A 72 -7.513 20.900 8.350 1.00 11.03 O ATOM 1150 CB PRO A 72 -7.105 17.760 8.298 1.00 14.40 C ATOM 1151 CG PRO A 72 -6.200 17.040 9.238 1.00 21.53 C ATOM 1152 CD PRO A 72 -4.814 17.194 8.679 1.00 55.43 C ATOM 0 HA PRO A 72 -6.497 19.209 6.746 1.00 40.23 H new ATOM 0 HB2 PRO A 72 -8.004 18.110 8.804 1.00 14.40 H new ATOM 0 HB3 PRO A 72 -7.429 17.111 7.485 1.00 14.40 H new ATOM 0 HG2 PRO A 72 -6.265 17.461 10.241 1.00 21.53 H new ATOM 0 HG3 PRO A 72 -6.475 15.988 9.315 1.00 21.53 H new ATOM 0 HD2 PRO A 72 -4.065 17.244 9.470 1.00 55.43 H new ATOM 0 HD3 PRO A 72 -4.544 16.356 8.037 1.00 55.43 H new ATOM 1160 N GLU A 73 -5.672 20.455 9.564 1.00 23.32 N ATOM 1161 CA GLU A 73 -5.820 21.628 10.418 1.00 5.13 C ATOM 1162 C GLU A 73 -5.929 22.900 9.583 1.00 20.24 C ATOM 1163 O GLU A 73 -6.519 23.890 10.015 1.00 42.23 O ATOM 1164 CB GLU A 73 -4.635 21.736 11.381 1.00 31.42 C ATOM 1165 CG GLU A 73 -4.647 20.689 12.483 1.00 1.34 C ATOM 1166 CD GLU A 73 -5.360 21.166 13.733 1.00 12.40 C ATOM 1167 OE1 GLU A 73 -4.914 22.172 14.323 1.00 62.13 O ATOM 1168 OE2 GLU A 73 -6.364 20.533 14.122 1.00 50.44 O ATOM 0 H GLU A 73 -4.860 19.876 9.778 1.00 23.32 H new ATOM 0 HA GLU A 73 -6.739 21.514 10.994 1.00 5.13 H new ATOM 0 HB2 GLU A 73 -3.708 21.644 10.815 1.00 31.42 H new ATOM 0 HB3 GLU A 73 -4.635 22.728 11.834 1.00 31.42 H new ATOM 0 HG2 GLU A 73 -5.132 19.785 12.115 1.00 1.34 H new ATOM 0 HG3 GLU A 73 -3.621 20.420 12.735 1.00 1.34 H new ATOM 1175 N SER A 74 -5.353 22.864 8.385 1.00 3.44 N ATOM 1176 CA SER A 74 -5.382 24.016 7.490 1.00 51.31 C ATOM 1177 C SER A 74 -6.182 23.703 6.229 1.00 0.10 C ATOM 1178 O SER A 74 -6.495 24.595 5.442 1.00 72.23 O ATOM 1179 CB SER A 74 -3.959 24.431 7.114 1.00 74.54 C ATOM 1180 OG SER A 74 -3.214 24.796 8.264 1.00 24.41 O ATOM 0 H SER A 74 -4.862 22.052 8.012 1.00 3.44 H new ATOM 0 HA SER A 74 -5.867 24.840 8.013 1.00 51.31 H new ATOM 0 HB2 SER A 74 -3.461 23.609 6.600 1.00 74.54 H new ATOM 0 HB3 SER A 74 -3.993 25.269 6.418 1.00 74.54 H new ATOM 0 HG SER A 74 -2.307 25.056 7.998 1.00 24.41 H new ATOM 1186 N GLY A 75 -6.509 22.428 6.043 1.00 44.22 N ATOM 1187 CA GLY A 75 -7.269 22.018 4.876 1.00 41.33 C ATOM 1188 C GLY A 75 -6.515 21.029 4.011 1.00 61.32 C ATOM 1189 O GLY A 75 -7.008 20.608 2.965 1.00 21.02 O ATOM 0 H GLY A 75 -6.261 21.671 6.680 1.00 44.22 H new ATOM 0 HA2 GLY A 75 -8.210 21.571 5.198 1.00 41.33 H new ATOM 0 HA3 GLY A 75 -7.520 22.897 4.283 1.00 41.33 H new ATOM 1193 N GLN A 76 -5.316 20.658 4.447 1.00 43.44 N ATOM 1194 CA GLN A 76 -4.492 19.713 3.702 1.00 71.34 C ATOM 1195 C GLN A 76 -4.928 18.278 3.974 1.00 22.20 C ATOM 1196 O GLN A 76 -4.746 17.761 5.077 1.00 15.14 O ATOM 1197 CB GLN A 76 -3.017 19.888 4.071 1.00 1.44 C ATOM 1198 CG GLN A 76 -2.135 20.262 2.892 1.00 0.22 C ATOM 1199 CD GLN A 76 -1.207 21.420 3.200 1.00 70.30 C ATOM 1200 OE1 GLN A 76 -0.083 21.225 3.663 1.00 4.14 O ATOM 1201 NE2 GLN A 76 -1.673 22.638 2.943 1.00 55.24 N ATOM 0 H GLN A 76 -4.893 20.997 5.311 1.00 43.44 H new ATOM 0 HA GLN A 76 -4.621 19.918 2.639 1.00 71.34 H new ATOM 0 HB2 GLN A 76 -2.932 20.659 4.837 1.00 1.44 H new ATOM 0 HB3 GLN A 76 -2.648 18.961 4.510 1.00 1.44 H new ATOM 0 HG2 GLN A 76 -1.543 19.396 2.597 1.00 0.22 H new ATOM 0 HG3 GLN A 76 -2.764 20.522 2.041 1.00 0.22 H new ATOM 0 HE21 GLN A 76 -2.611 22.755 2.559 1.00 55.24 H new ATOM 0 HE22 GLN A 76 -1.093 23.456 3.129 1.00 55.24 H new ATOM 1210 N ILE A 77 -5.506 17.639 2.962 1.00 35.21 N ATOM 1211 CA ILE A 77 -5.968 16.262 3.092 1.00 50.55 C ATOM 1212 C ILE A 77 -5.779 15.494 1.789 1.00 25.22 C ATOM 1213 O ILE A 77 -5.608 16.089 0.725 1.00 5.00 O ATOM 1214 CB ILE A 77 -7.451 16.203 3.501 1.00 45.42 C ATOM 1215 CG1 ILE A 77 -8.245 17.294 2.779 1.00 11.52 C ATOM 1216 CG2 ILE A 77 -7.592 16.347 5.008 1.00 62.31 C ATOM 1217 CD1 ILE A 77 -8.239 17.153 1.273 1.00 65.21 C ATOM 0 H ILE A 77 -5.665 18.053 2.043 1.00 35.21 H new ATOM 0 HA ILE A 77 -5.366 15.799 3.874 1.00 50.55 H new ATOM 0 HB ILE A 77 -7.854 15.233 3.210 1.00 45.42 H new ATOM 0 HG12 ILE A 77 -9.276 17.276 3.133 1.00 11.52 H new ATOM 0 HG13 ILE A 77 -7.834 18.268 3.046 1.00 11.52 H new ATOM 0 HG21 ILE A 77 -8.646 16.303 5.281 1.00 62.31 H new ATOM 0 HG22 ILE A 77 -7.055 15.537 5.503 1.00 62.31 H new ATOM 0 HG23 ILE A 77 -7.175 17.304 5.323 1.00 62.31 H new ATOM 0 HD11 ILE A 77 -8.821 17.961 0.830 1.00 65.21 H new ATOM 0 HD12 ILE A 77 -7.213 17.202 0.907 1.00 65.21 H new ATOM 0 HD13 ILE A 77 -8.678 16.195 0.996 1.00 65.21 H new ATOM 1229 N ALA A 78 -5.815 14.169 1.879 1.00 44.32 N ATOM 1230 CA ALA A 78 -5.653 13.318 0.707 1.00 35.42 C ATOM 1231 C ALA A 78 -6.944 13.244 -0.101 1.00 61.12 C ATOM 1232 O ALA A 78 -8.048 13.289 0.442 1.00 40.31 O ATOM 1233 CB ALA A 78 -5.207 11.924 1.124 1.00 72.54 C ATOM 0 H ALA A 78 -5.955 13.661 2.752 1.00 44.32 H new ATOM 0 HA ALA A 78 -4.884 13.758 0.073 1.00 35.42 H new ATOM 0 HB1 ALA A 78 -5.090 11.299 0.238 1.00 72.54 H new ATOM 0 HB2 ALA A 78 -4.255 11.989 1.651 1.00 72.54 H new ATOM 0 HB3 ALA A 78 -5.956 11.484 1.782 1.00 72.54 H new ATOM 1239 N PRO A 79 -6.806 13.128 -1.430 1.00 45.11 N ATOM 1240 CA PRO A 79 -7.951 13.044 -2.340 1.00 73.10 C ATOM 1241 C PRO A 79 -8.705 11.725 -2.205 1.00 74.34 C ATOM 1242 O PRO A 79 -8.487 10.970 -1.259 1.00 72.43 O ATOM 1243 CB PRO A 79 -7.311 13.154 -3.727 1.00 3.43 C ATOM 1244 CG PRO A 79 -5.916 12.666 -3.539 1.00 4.55 C ATOM 1245 CD PRO A 79 -5.520 13.067 -2.146 1.00 54.14 C ATOM 0 HA PRO A 79 -8.692 13.817 -2.134 1.00 73.10 H new ATOM 0 HB2 PRO A 79 -7.847 12.550 -4.459 1.00 3.43 H new ATOM 0 HB3 PRO A 79 -7.326 14.182 -4.090 1.00 3.43 H new ATOM 0 HG2 PRO A 79 -5.861 11.585 -3.664 1.00 4.55 H new ATOM 0 HG3 PRO A 79 -5.246 13.107 -4.277 1.00 4.55 H new ATOM 0 HD2 PRO A 79 -4.843 12.341 -1.696 1.00 54.14 H new ATOM 0 HD3 PRO A 79 -5.008 14.029 -2.135 1.00 54.14 H new ATOM 1253 N ALA A 80 -9.592 11.456 -3.157 1.00 1.11 N ATOM 1254 CA ALA A 80 -10.376 10.227 -3.145 1.00 34.34 C ATOM 1255 C ALA A 80 -9.665 9.114 -3.907 1.00 51.31 C ATOM 1256 O ALA A 80 -9.936 7.931 -3.696 1.00 70.35 O ATOM 1257 CB ALA A 80 -11.756 10.476 -3.737 1.00 63.50 C ATOM 0 H ALA A 80 -9.786 12.072 -3.946 1.00 1.11 H new ATOM 0 HA ALA A 80 -10.489 9.907 -2.109 1.00 34.34 H new ATOM 0 HB1 ALA A 80 -12.331 9.550 -3.722 1.00 63.50 H new ATOM 0 HB2 ALA A 80 -12.273 11.234 -3.148 1.00 63.50 H new ATOM 0 HB3 ALA A 80 -11.654 10.823 -4.765 1.00 63.50 H new ATOM 1263 N LEU A 81 -8.755 9.500 -4.795 1.00 5.22 N ATOM 1264 CA LEU A 81 -8.005 8.535 -5.591 1.00 2.43 C ATOM 1265 C LEU A 81 -6.703 8.150 -4.894 1.00 54.42 C ATOM 1266 O LEU A 81 -6.120 7.104 -5.179 1.00 41.41 O ATOM 1267 CB LEU A 81 -7.705 9.108 -6.976 1.00 34.21 C ATOM 1268 CG LEU A 81 -8.863 9.820 -7.673 1.00 32.21 C ATOM 1269 CD1 LEU A 81 -8.697 11.329 -7.582 1.00 11.43 C ATOM 1270 CD2 LEU A 81 -8.964 9.379 -9.127 1.00 41.44 C ATOM 0 H LEU A 81 -8.519 10.475 -4.982 1.00 5.22 H new ATOM 0 HA LEU A 81 -8.616 7.639 -5.701 1.00 2.43 H new ATOM 0 HB2 LEU A 81 -6.876 9.809 -6.885 1.00 34.21 H new ATOM 0 HB3 LEU A 81 -7.366 8.295 -7.618 1.00 34.21 H new ATOM 0 HG LEU A 81 -9.788 9.547 -7.166 1.00 32.21 H new ATOM 0 HD11 LEU A 81 -9.532 11.818 -8.084 1.00 11.43 H new ATOM 0 HD12 LEU A 81 -8.677 11.630 -6.535 1.00 11.43 H new ATOM 0 HD13 LEU A 81 -7.763 11.622 -8.062 1.00 11.43 H new ATOM 0 HD21 LEU A 81 -9.794 9.897 -9.607 1.00 41.44 H new ATOM 0 HD22 LEU A 81 -8.037 9.621 -9.646 1.00 41.44 H new ATOM 0 HD23 LEU A 81 -9.133 8.303 -9.170 1.00 41.44 H new ATOM 1282 N ALA A 82 -6.254 9.001 -3.977 1.00 61.40 N ATOM 1283 CA ALA A 82 -5.024 8.749 -3.237 1.00 42.42 C ATOM 1284 C ALA A 82 -5.011 7.338 -2.660 1.00 41.25 C ATOM 1285 O ALA A 82 -4.014 6.623 -2.764 1.00 1.31 O ATOM 1286 CB ALA A 82 -4.856 9.777 -2.128 1.00 60.33 C ATOM 0 H ALA A 82 -6.724 9.871 -3.729 1.00 61.40 H new ATOM 0 HA ALA A 82 -4.187 8.838 -3.929 1.00 42.42 H new ATOM 0 HB1 ALA A 82 -3.933 9.577 -1.583 1.00 60.33 H new ATOM 0 HB2 ALA A 82 -4.812 10.776 -2.562 1.00 60.33 H new ATOM 0 HB3 ALA A 82 -5.702 9.715 -1.444 1.00 60.33 H new ATOM 1292 N HIS A 83 -6.124 6.943 -2.049 1.00 52.44 N ATOM 1293 CA HIS A 83 -6.240 5.616 -1.455 1.00 62.14 C ATOM 1294 C HIS A 83 -5.249 5.446 -0.307 1.00 43.04 C ATOM 1295 O HIS A 83 -4.880 4.326 0.048 1.00 74.24 O ATOM 1296 CB HIS A 83 -6.002 4.537 -2.513 1.00 52.01 C ATOM 1297 CG HIS A 83 -7.202 3.678 -2.771 1.00 71.45 C ATOM 1298 ND1 HIS A 83 -7.727 2.817 -1.831 1.00 72.31 N ATOM 1299 CD2 HIS A 83 -7.979 3.550 -3.871 1.00 33.10 C ATOM 1300 CE1 HIS A 83 -8.775 2.196 -2.341 1.00 41.15 C ATOM 1301 NE2 HIS A 83 -8.950 2.623 -3.579 1.00 35.44 N ATOM 0 H HIS A 83 -6.958 7.523 -1.952 1.00 52.44 H new ATOM 0 HA HIS A 83 -7.250 5.510 -1.059 1.00 62.14 H new ATOM 0 HB2 HIS A 83 -5.699 5.014 -3.445 1.00 52.01 H new ATOM 0 HB3 HIS A 83 -5.174 3.904 -2.195 1.00 52.01 H new ATOM 0 HD2 HIS A 83 -7.858 4.078 -4.805 1.00 33.10 H new ATOM 0 HE1 HIS A 83 -9.385 1.464 -1.833 1.00 41.15 H new ATOM 0 HE2 HIS A 83 -9.686 2.315 -4.214 1.00 35.44 H new ATOM 1309 N PHE A 84 -4.820 6.565 0.268 1.00 61.54 N ATOM 1310 CA PHE A 84 -3.871 6.541 1.374 1.00 21.02 C ATOM 1311 C PHE A 84 -4.458 7.216 2.610 1.00 45.34 C ATOM 1312 O PHE A 84 -4.806 6.554 3.587 1.00 11.55 O ATOM 1313 CB PHE A 84 -2.567 7.233 0.972 1.00 72.42 C ATOM 1314 CG PHE A 84 -1.391 6.302 0.903 1.00 14.02 C ATOM 1315 CD1 PHE A 84 -1.418 5.188 0.080 1.00 20.34 C ATOM 1316 CD2 PHE A 84 -0.257 6.541 1.663 1.00 43.32 C ATOM 1317 CE1 PHE A 84 -0.337 4.330 0.014 1.00 14.32 C ATOM 1318 CE2 PHE A 84 0.828 5.687 1.601 1.00 15.34 C ATOM 1319 CZ PHE A 84 0.788 4.579 0.777 1.00 4.42 C ATOM 0 H PHE A 84 -5.115 7.500 -0.014 1.00 61.54 H new ATOM 0 HA PHE A 84 -3.661 5.499 1.616 1.00 21.02 H new ATOM 0 HB2 PHE A 84 -2.702 7.708 0.000 1.00 72.42 H new ATOM 0 HB3 PHE A 84 -2.351 8.026 1.687 1.00 72.42 H new ATOM 0 HD1 PHE A 84 -2.295 4.988 -0.518 1.00 20.34 H new ATOM 0 HD2 PHE A 84 -0.221 7.404 2.311 1.00 43.32 H new ATOM 0 HE1 PHE A 84 -0.371 3.466 -0.633 1.00 14.32 H new ATOM 0 HE2 PHE A 84 1.707 5.886 2.197 1.00 15.34 H new ATOM 0 HZ PHE A 84 1.634 3.909 0.729 1.00 4.42 H new ATOM 1329 N GLY A 85 -4.564 8.541 2.558 1.00 64.22 N ATOM 1330 CA GLY A 85 -5.108 9.285 3.680 1.00 5.30 C ATOM 1331 C GLY A 85 -6.591 9.038 3.874 1.00 2.52 C ATOM 1332 O GLY A 85 -7.307 8.737 2.920 1.00 22.04 O ATOM 0 H GLY A 85 -4.283 9.112 1.760 1.00 64.22 H new ATOM 0 HA2 GLY A 85 -4.574 9.008 4.589 1.00 5.30 H new ATOM 0 HA3 GLY A 85 -4.938 10.350 3.523 1.00 5.30 H new ATOM 1336 N GLN A 86 -7.053 9.164 5.115 1.00 42.43 N ATOM 1337 CA GLN A 86 -8.460 8.949 5.431 1.00 52.01 C ATOM 1338 C GLN A 86 -8.823 9.601 6.762 1.00 63.41 C ATOM 1339 O GLN A 86 -8.072 9.515 7.732 1.00 73.22 O ATOM 1340 CB GLN A 86 -8.770 7.453 5.482 1.00 35.20 C ATOM 1341 CG GLN A 86 -9.917 7.038 4.573 1.00 10.42 C ATOM 1342 CD GLN A 86 -11.159 6.642 5.346 1.00 73.52 C ATOM 1343 OE1 GLN A 86 -11.535 7.461 6.323 1.00 42.32 O flip ATOM 1344 NE2 GLN A 86 -11.775 5.613 5.069 1.00 61.55 N flip ATOM 0 H GLN A 86 -6.474 9.414 5.917 1.00 42.43 H new ATOM 0 HA GLN A 86 -9.058 9.410 4.645 1.00 52.01 H new ATOM 0 HB2 GLN A 86 -7.876 6.895 5.203 1.00 35.20 H new ATOM 0 HB3 GLN A 86 -9.012 7.175 6.508 1.00 35.20 H new ATOM 0 HG2 GLN A 86 -10.159 7.861 3.901 1.00 10.42 H new ATOM 0 HG3 GLN A 86 -9.598 6.201 3.951 1.00 10.42 H new ATOM 0 HE21 GLN A 86 -11.451 5.013 4.311 1.00 61.55 H new ATOM 0 HE22 GLN A 86 -12.610 5.360 5.598 1.00 61.55 H new ATOM 1353 N ASN A 87 -9.981 10.253 6.798 1.00 31.20 N ATOM 1354 CA ASN A 87 -10.444 10.921 8.010 1.00 45.35 C ATOM 1355 C ASN A 87 -10.430 9.964 9.197 1.00 15.25 C ATOM 1356 O ASN A 87 -10.264 8.756 9.031 1.00 4.03 O ATOM 1357 CB ASN A 87 -11.856 11.474 7.803 1.00 34.33 C ATOM 1358 CG ASN A 87 -11.860 12.766 7.009 1.00 11.22 C ATOM 1359 OD1 ASN A 87 -10.872 13.498 6.990 1.00 22.11 O ATOM 1360 ND2 ASN A 87 -12.977 13.049 6.348 1.00 35.51 N ATOM 0 H ASN A 87 -10.615 10.333 6.003 1.00 31.20 H new ATOM 0 HA ASN A 87 -9.765 11.746 8.223 1.00 45.35 H new ATOM 0 HB2 ASN A 87 -12.462 10.731 7.285 1.00 34.33 H new ATOM 0 HB3 ASN A 87 -12.322 11.646 8.773 1.00 34.33 H new ATOM 0 HD21 ASN A 87 -13.040 13.904 5.795 1.00 35.51 H new ATOM 0 HD22 ASN A 87 -13.772 12.411 6.393 1.00 35.51 H new ATOM 1367 N GLU A 88 -10.604 10.512 10.396 1.00 63.12 N ATOM 1368 CA GLU A 88 -10.610 9.707 11.611 1.00 73.11 C ATOM 1369 C GLU A 88 -11.978 9.066 11.832 1.00 72.51 C ATOM 1370 O GLU A 88 -12.076 7.899 12.213 1.00 5.10 O ATOM 1371 CB GLU A 88 -10.236 10.567 12.820 1.00 3.53 C ATOM 1372 CG GLU A 88 -8.776 10.449 13.221 1.00 14.52 C ATOM 1373 CD GLU A 88 -7.946 11.630 12.754 1.00 25.53 C ATOM 1374 OE1 GLU A 88 -8.244 12.767 13.175 1.00 74.22 O ATOM 1375 OE2 GLU A 88 -7.000 11.416 11.968 1.00 1.34 O ATOM 0 H GLU A 88 -10.743 11.511 10.551 1.00 63.12 H new ATOM 0 HA GLU A 88 -9.871 8.914 11.495 1.00 73.11 H new ATOM 0 HB2 GLU A 88 -10.460 11.610 12.597 1.00 3.53 H new ATOM 0 HB3 GLU A 88 -10.861 10.281 13.666 1.00 3.53 H new ATOM 0 HG2 GLU A 88 -8.706 10.367 14.306 1.00 14.52 H new ATOM 0 HG3 GLU A 88 -8.362 9.531 12.805 1.00 14.52 H new ATOM 1382 N THR A 89 -13.032 9.839 11.591 1.00 42.12 N ATOM 1383 CA THR A 89 -14.394 9.348 11.764 1.00 64.33 C ATOM 1384 C THR A 89 -14.670 8.998 13.222 1.00 65.52 C ATOM 1385 O THR A 89 -13.772 9.038 14.062 1.00 3.15 O ATOM 1386 CB THR A 89 -14.661 8.108 10.890 1.00 3.44 C ATOM 1387 OG1 THR A 89 -13.681 8.023 9.849 1.00 34.35 O ATOM 1388 CG2 THR A 89 -16.053 8.167 10.279 1.00 35.32 C ATOM 0 H THR A 89 -12.969 10.807 11.276 1.00 42.12 H new ATOM 0 HA THR A 89 -15.062 10.152 11.453 1.00 64.33 H new ATOM 0 HB THR A 89 -14.596 7.223 11.523 1.00 3.44 H new ATOM 0 HG1 THR A 89 -13.856 7.231 9.299 1.00 34.35 H new ATOM 0 HG21 THR A 89 -16.219 7.281 9.666 1.00 35.32 H new ATOM 0 HG22 THR A 89 -16.798 8.203 11.074 1.00 35.32 H new ATOM 0 HG23 THR A 89 -16.141 9.059 9.659 1.00 35.32 H new ATOM 1396 N THR A 90 -15.920 8.651 13.515 1.00 53.34 N ATOM 1397 CA THR A 90 -16.315 8.292 14.872 1.00 64.10 C ATOM 1398 C THR A 90 -17.383 7.204 14.865 1.00 11.52 C ATOM 1399 O THR A 90 -17.237 6.173 15.520 1.00 4.22 O ATOM 1400 CB THR A 90 -16.847 9.514 15.644 1.00 4.33 C ATOM 1401 OG1 THR A 90 -16.970 10.635 14.761 1.00 0.33 O ATOM 1402 CG2 THR A 90 -15.923 9.870 16.798 1.00 44.52 C ATOM 0 H THR A 90 -16.676 8.611 12.831 1.00 53.34 H new ATOM 0 HA THR A 90 -15.422 7.916 15.372 1.00 64.10 H new ATOM 0 HB THR A 90 -17.827 9.262 16.049 1.00 4.33 H new ATOM 0 HG1 THR A 90 -17.310 11.408 15.259 1.00 0.33 H new ATOM 0 HG21 THR A 90 -16.320 10.736 17.328 1.00 44.52 H new ATOM 0 HG22 THR A 90 -15.855 9.025 17.483 1.00 44.52 H new ATOM 0 HG23 THR A 90 -14.931 10.105 16.411 1.00 44.52 H new ATOM 1410 N SER A 91 -18.457 7.443 14.119 1.00 52.22 N ATOM 1411 CA SER A 91 -19.552 6.484 14.029 1.00 23.32 C ATOM 1412 C SER A 91 -19.138 5.260 13.218 1.00 73.34 C ATOM 1413 O SER A 91 -18.177 5.290 12.448 1.00 65.30 O ATOM 1414 CB SER A 91 -20.781 7.138 13.394 1.00 10.52 C ATOM 1415 OG SER A 91 -20.934 6.733 12.044 1.00 22.30 O ATOM 0 H SER A 91 -18.592 8.291 13.569 1.00 52.22 H new ATOM 0 HA SER A 91 -19.802 6.161 15.040 1.00 23.32 H new ATOM 0 HB2 SER A 91 -21.673 6.870 13.961 1.00 10.52 H new ATOM 0 HB3 SER A 91 -20.686 8.223 13.443 1.00 10.52 H new ATOM 0 HG SER A 91 -21.727 7.163 11.661 1.00 22.30 H new ATOM 1421 N PRO A 92 -19.879 4.156 13.394 1.00 60.30 N ATOM 1422 CA PRO A 92 -19.609 2.900 12.688 1.00 30.11 C ATOM 1423 C PRO A 92 -19.924 2.994 11.199 1.00 60.04 C ATOM 1424 O PRO A 92 -20.952 3.544 10.804 1.00 32.42 O ATOM 1425 CB PRO A 92 -20.545 1.900 13.371 1.00 33.35 C ATOM 1426 CG PRO A 92 -21.656 2.731 13.914 1.00 55.04 C ATOM 1427 CD PRO A 92 -21.038 4.049 14.295 1.00 64.13 C ATOM 0 HA PRO A 92 -18.556 2.622 12.739 1.00 30.11 H new ATOM 0 HB2 PRO A 92 -20.915 1.158 12.664 1.00 33.35 H new ATOM 0 HB3 PRO A 92 -20.033 1.357 14.165 1.00 33.35 H new ATOM 0 HG2 PRO A 92 -22.441 2.868 13.170 1.00 55.04 H new ATOM 0 HG3 PRO A 92 -22.116 2.251 14.778 1.00 55.04 H new ATOM 0 HD2 PRO A 92 -21.735 4.875 14.153 1.00 64.13 H new ATOM 0 HD3 PRO A 92 -20.736 4.063 15.342 1.00 64.13 H new ATOM 1435 N HIS A 93 -19.033 2.451 10.374 1.00 62.43 N ATOM 1436 CA HIS A 93 -19.218 2.472 8.928 1.00 33.42 C ATOM 1437 C HIS A 93 -19.105 1.066 8.345 1.00 14.13 C ATOM 1438 O HIS A 93 -18.430 0.203 8.906 1.00 3.43 O ATOM 1439 CB HIS A 93 -18.185 3.391 8.274 1.00 33.41 C ATOM 1440 CG HIS A 93 -16.773 2.919 8.440 1.00 64.35 C ATOM 1441 ND1 HIS A 93 -16.072 2.277 7.442 1.00 62.41 N ATOM 1442 CD2 HIS A 93 -15.930 3.000 9.497 1.00 34.41 C ATOM 1443 CE1 HIS A 93 -14.860 1.982 7.877 1.00 44.51 C ATOM 1444 NE2 HIS A 93 -14.748 2.410 9.121 1.00 24.32 N ATOM 0 H HIS A 93 -18.176 1.991 10.683 1.00 62.43 H new ATOM 0 HA HIS A 93 -20.218 2.854 8.720 1.00 33.42 H new ATOM 0 HB2 HIS A 93 -18.408 3.476 7.211 1.00 33.41 H new ATOM 0 HB3 HIS A 93 -18.278 4.390 8.700 1.00 33.41 H new ATOM 0 HD2 HIS A 93 -16.147 3.445 10.457 1.00 34.41 H new ATOM 0 HE1 HIS A 93 -14.091 1.477 7.311 1.00 44.51 H new ATOM 0 HE2 HIS A 93 -13.919 2.318 9.707 1.00 24.32 H new ATOM 1452 N SER A 94 -19.774 0.844 7.218 1.00 52.11 N ATOM 1453 CA SER A 94 -19.753 -0.459 6.561 1.00 70.32 C ATOM 1454 C SER A 94 -18.945 -0.403 5.268 1.00 14.44 C ATOM 1455 O SER A 94 -19.448 0.016 4.227 1.00 10.43 O ATOM 1456 CB SER A 94 -21.179 -0.926 6.265 1.00 51.10 C ATOM 1457 OG SER A 94 -21.741 -1.590 7.385 1.00 3.42 O ATOM 0 H SER A 94 -20.337 1.548 6.741 1.00 52.11 H new ATOM 0 HA SER A 94 -19.277 -1.171 7.235 1.00 70.32 H new ATOM 0 HB2 SER A 94 -21.798 -0.069 5.998 1.00 51.10 H new ATOM 0 HB3 SER A 94 -21.175 -1.596 5.405 1.00 51.10 H new ATOM 0 HG SER A 94 -22.653 -1.877 7.171 1.00 3.42 H new ATOM 1463 N GLY A 95 -17.688 -0.828 5.345 1.00 21.35 N ATOM 1464 CA GLY A 95 -16.829 -0.819 4.175 1.00 44.10 C ATOM 1465 C GLY A 95 -15.597 -1.685 4.353 1.00 74.11 C ATOM 1466 O GLY A 95 -15.313 -2.151 5.455 1.00 73.43 O ATOM 0 H GLY A 95 -17.249 -1.178 6.196 1.00 21.35 H new ATOM 0 HA2 GLY A 95 -17.394 -1.169 3.311 1.00 44.10 H new ATOM 0 HA3 GLY A 95 -16.522 0.205 3.961 1.00 44.10 H new ATOM 1470 N GLN A 96 -14.865 -1.900 3.264 1.00 10.41 N ATOM 1471 CA GLN A 96 -13.658 -2.717 3.306 1.00 71.33 C ATOM 1472 C GLN A 96 -12.408 -1.844 3.288 1.00 34.40 C ATOM 1473 O GLN A 96 -11.602 -1.912 2.360 1.00 15.22 O ATOM 1474 CB GLN A 96 -13.634 -3.688 2.124 1.00 73.40 C ATOM 1475 CG GLN A 96 -12.709 -4.876 2.332 1.00 74.35 C ATOM 1476 CD GLN A 96 -13.438 -6.203 2.256 1.00 20.51 C ATOM 1477 OE1 GLN A 96 -13.126 -7.050 1.417 1.00 20.51 O ATOM 1478 NE2 GLN A 96 -14.415 -6.393 3.135 1.00 12.22 N ATOM 0 H GLN A 96 -15.086 -1.520 2.344 1.00 10.41 H new ATOM 0 HA GLN A 96 -13.667 -3.286 4.235 1.00 71.33 H new ATOM 0 HB2 GLN A 96 -14.645 -4.053 1.943 1.00 73.40 H new ATOM 0 HB3 GLN A 96 -13.325 -3.150 1.228 1.00 73.40 H new ATOM 0 HG2 GLN A 96 -11.921 -4.855 1.579 1.00 74.35 H new ATOM 0 HG3 GLN A 96 -12.223 -4.788 3.304 1.00 74.35 H new ATOM 0 HE21 GLN A 96 -14.640 -5.665 3.813 1.00 12.22 H new ATOM 0 HE22 GLN A 96 -14.940 -7.267 3.133 1.00 12.22 H new ATOM 1487 N LYS A 97 -12.253 -1.021 4.320 1.00 3.33 N ATOM 1488 CA LYS A 97 -11.100 -0.134 4.425 1.00 3.12 C ATOM 1489 C LYS A 97 -10.505 -0.178 5.829 1.00 51.43 C ATOM 1490 O LYS A 97 -11.021 -0.864 6.712 1.00 55.44 O ATOM 1491 CB LYS A 97 -11.502 1.300 4.075 1.00 25.30 C ATOM 1492 CG LYS A 97 -12.200 1.426 2.732 1.00 72.12 C ATOM 1493 CD LYS A 97 -12.259 2.872 2.268 1.00 72.33 C ATOM 1494 CE LYS A 97 -13.648 3.462 2.459 1.00 74.13 C ATOM 1495 NZ LYS A 97 -14.603 2.979 1.424 1.00 13.31 N ATOM 0 H LYS A 97 -12.912 -0.950 5.096 1.00 3.33 H new ATOM 0 HA LYS A 97 -10.344 -0.476 3.719 1.00 3.12 H new ATOM 0 HB2 LYS A 97 -12.160 1.684 4.854 1.00 25.30 H new ATOM 0 HB3 LYS A 97 -10.611 1.928 4.072 1.00 25.30 H new ATOM 0 HG2 LYS A 97 -11.674 0.826 1.990 1.00 72.12 H new ATOM 0 HG3 LYS A 97 -13.211 1.025 2.807 1.00 72.12 H new ATOM 0 HD2 LYS A 97 -11.532 3.464 2.824 1.00 72.33 H new ATOM 0 HD3 LYS A 97 -11.980 2.929 1.216 1.00 72.33 H new ATOM 0 HE2 LYS A 97 -14.021 3.199 3.449 1.00 74.13 H new ATOM 0 HE3 LYS A 97 -13.589 4.550 2.419 1.00 74.13 H new ATOM 0 HZ1 LYS A 97 -15.538 3.404 1.589 1.00 13.31 H new ATOM 0 HZ2 LYS A 97 -14.260 3.252 0.481 1.00 13.31 H new ATOM 0 HZ3 LYS A 97 -14.679 1.943 1.478 1.00 13.31 H new ATOM 1509 N THR A 98 -9.417 0.558 6.029 1.00 53.15 N ATOM 1510 CA THR A 98 -8.752 0.604 7.325 1.00 52.21 C ATOM 1511 C THR A 98 -7.988 1.910 7.506 1.00 33.53 C ATOM 1512 O THR A 98 -7.547 2.522 6.535 1.00 23.30 O ATOM 1513 CB THR A 98 -7.776 -0.577 7.498 1.00 34.33 C ATOM 1514 OG1 THR A 98 -7.221 -0.564 8.817 1.00 75.54 O ATOM 1515 CG2 THR A 98 -6.657 -0.507 6.470 1.00 31.14 C ATOM 0 H THR A 98 -8.977 1.131 5.309 1.00 53.15 H new ATOM 0 HA THR A 98 -9.533 0.535 8.083 1.00 52.21 H new ATOM 0 HB THR A 98 -8.330 -1.504 7.347 1.00 34.33 H new ATOM 0 HG1 THR A 98 -6.604 -1.318 8.920 1.00 75.54 H new ATOM 0 HG21 THR A 98 -5.980 -1.350 6.611 1.00 31.14 H new ATOM 0 HG22 THR A 98 -7.082 -0.546 5.467 1.00 31.14 H new ATOM 0 HG23 THR A 98 -6.106 0.425 6.595 1.00 31.14 H new ATOM 1523 N GLY A 99 -7.834 2.332 8.757 1.00 2.33 N ATOM 1524 CA GLY A 99 -7.122 3.564 9.042 1.00 43.31 C ATOM 1525 C GLY A 99 -8.026 4.780 9.000 1.00 74.10 C ATOM 1526 O GLY A 99 -7.798 5.669 8.181 1.00 11.42 O ATOM 0 H GLY A 99 -8.190 1.843 9.578 1.00 2.33 H new ATOM 0 HA2 GLY A 99 -6.659 3.493 10.026 1.00 43.31 H new ATOM 0 HA3 GLY A 99 -6.316 3.689 8.319 1.00 43.31 H new TER 1530 GLY A 99 ATOM 1531 N MET B 1 10.362 39.975 -5.443 1.00 51.11 N ATOM 1532 CA MET B 1 11.044 38.847 -6.067 1.00 63.42 C ATOM 1533 C MET B 1 10.915 37.592 -5.212 1.00 24.41 C ATOM 1534 O MET B 1 10.377 37.636 -4.106 1.00 25.51 O ATOM 1535 CB MET B 1 12.522 39.178 -6.290 1.00 75.14 C ATOM 1536 CG MET B 1 12.769 40.089 -7.481 1.00 44.22 C ATOM 1537 SD MET B 1 14.142 39.534 -8.509 1.00 21.25 S ATOM 1538 CE MET B 1 14.811 41.102 -9.057 1.00 23.32 C ATOM 0 H1 MET B 1 9.584 40.293 -6.056 1.00 51.11 H new ATOM 0 H2 MET B 1 9.979 39.682 -4.521 1.00 51.11 H new ATOM 0 H3 MET B 1 11.036 40.755 -5.306 1.00 51.11 H new ATOM 0 HA MET B 1 10.572 38.657 -7.031 1.00 63.42 H new ATOM 0 HB2 MET B 1 12.919 39.652 -5.392 1.00 75.14 H new ATOM 0 HB3 MET B 1 13.076 38.250 -6.432 1.00 75.14 H new ATOM 0 HG2 MET B 1 11.865 40.141 -8.087 1.00 44.22 H new ATOM 0 HG3 MET B 1 12.972 41.099 -7.125 1.00 44.22 H new ATOM 0 HE1 MET B 1 15.670 40.925 -9.704 1.00 23.32 H new ATOM 0 HE2 MET B 1 14.048 41.650 -9.609 1.00 23.32 H new ATOM 0 HE3 MET B 1 15.123 41.687 -8.192 1.00 23.32 H new ATOM 1548 N SER B 2 11.413 36.474 -5.730 1.00 52.41 N ATOM 1549 CA SER B 2 11.349 35.204 -5.015 1.00 52.31 C ATOM 1550 C SER B 2 12.747 34.634 -4.796 1.00 72.12 C ATOM 1551 O SER B 2 13.737 35.190 -5.269 1.00 1.24 O ATOM 1552 CB SER B 2 10.491 34.201 -5.788 1.00 33.21 C ATOM 1553 OG SER B 2 9.126 34.582 -5.776 1.00 21.32 O ATOM 0 H SER B 2 11.866 36.421 -6.643 1.00 52.41 H new ATOM 0 HA SER B 2 10.893 35.385 -4.042 1.00 52.31 H new ATOM 0 HB2 SER B 2 10.844 34.133 -6.817 1.00 33.21 H new ATOM 0 HB3 SER B 2 10.599 33.210 -5.348 1.00 33.21 H new ATOM 0 HG SER B 2 8.599 33.926 -6.278 1.00 21.32 H new ATOM 1559 N ASN B 3 12.818 33.518 -4.077 1.00 61.32 N ATOM 1560 CA ASN B 3 14.093 32.871 -3.795 1.00 34.05 C ATOM 1561 C ASN B 3 14.230 31.571 -4.583 1.00 13.43 C ATOM 1562 O ASN B 3 13.271 30.812 -4.722 1.00 63.53 O ATOM 1563 CB ASN B 3 14.225 32.588 -2.297 1.00 35.42 C ATOM 1564 CG ASN B 3 14.750 33.785 -1.526 1.00 24.34 C ATOM 1565 OD1 ASN B 3 14.183 34.955 -1.793 1.00 34.54 O flip ATOM 1566 ND2 ASN B 3 15.654 33.657 -0.701 1.00 22.22 N flip ATOM 0 H ASN B 3 12.007 33.044 -3.679 1.00 61.32 H new ATOM 0 HA ASN B 3 14.891 33.547 -4.102 1.00 34.05 H new ATOM 0 HB2 ASN B 3 13.253 32.300 -1.897 1.00 35.42 H new ATOM 0 HB3 ASN B 3 14.895 31.741 -2.148 1.00 35.42 H new ATOM 0 HD21 ASN B 3 16.060 32.738 -0.528 1.00 22.22 H new ATOM 0 HD22 ASN B 3 15.997 34.470 -0.190 1.00 22.22 H new ATOM 1573 N THR B 4 15.430 31.321 -5.096 1.00 72.34 N ATOM 1574 CA THR B 4 15.694 30.114 -5.870 1.00 42.42 C ATOM 1575 C THR B 4 15.461 28.862 -5.033 1.00 52.45 C ATOM 1576 O THR B 4 15.479 28.914 -3.803 1.00 62.33 O ATOM 1577 CB THR B 4 17.137 30.096 -6.410 1.00 14.31 C ATOM 1578 OG1 THR B 4 17.722 31.398 -6.287 1.00 24.44 O ATOM 1579 CG2 THR B 4 17.165 29.658 -7.866 1.00 44.11 C ATOM 0 H THR B 4 16.235 31.938 -4.990 1.00 72.34 H new ATOM 0 HA THR B 4 15.000 30.120 -6.710 1.00 42.42 H new ATOM 0 HB THR B 4 17.713 29.382 -5.821 1.00 14.31 H new ATOM 0 HG1 THR B 4 18.640 31.378 -6.631 1.00 24.44 H new ATOM 0 HG21 THR B 4 18.194 29.653 -8.225 1.00 44.11 H new ATOM 0 HG22 THR B 4 16.746 28.656 -7.953 1.00 44.11 H new ATOM 0 HG23 THR B 4 16.575 30.351 -8.466 1.00 44.11 H new ATOM 1587 N ILE B 5 15.244 27.738 -5.707 1.00 72.43 N ATOM 1588 CA ILE B 5 15.009 26.472 -5.024 1.00 60.40 C ATOM 1589 C ILE B 5 16.099 26.192 -3.994 1.00 73.52 C ATOM 1590 O ILE B 5 15.811 25.929 -2.827 1.00 14.01 O ATOM 1591 CB ILE B 5 14.945 25.298 -6.020 1.00 41.35 C ATOM 1592 CG1 ILE B 5 13.872 25.557 -7.079 1.00 41.00 C ATOM 1593 CG2 ILE B 5 14.670 23.995 -5.285 1.00 64.43 C ATOM 1594 CD1 ILE B 5 13.753 24.448 -8.101 1.00 71.13 C ATOM 0 H ILE B 5 15.226 27.678 -6.725 1.00 72.43 H new ATOM 0 HA ILE B 5 14.048 26.561 -4.517 1.00 60.40 H new ATOM 0 HB ILE B 5 15.909 25.212 -6.521 1.00 41.35 H new ATOM 0 HG12 ILE B 5 12.910 25.690 -6.585 1.00 41.00 H new ATOM 0 HG13 ILE B 5 14.098 26.491 -7.593 1.00 41.00 H new ATOM 0 HG21 ILE B 5 14.628 23.175 -6.002 1.00 64.43 H new ATOM 0 HG22 ILE B 5 15.467 23.808 -4.566 1.00 64.43 H new ATOM 0 HG23 ILE B 5 13.718 24.067 -4.760 1.00 64.43 H new ATOM 0 HD11 ILE B 5 12.974 24.698 -8.821 1.00 71.13 H new ATOM 0 HD12 ILE B 5 14.703 24.330 -8.622 1.00 71.13 H new ATOM 0 HD13 ILE B 5 13.496 23.516 -7.598 1.00 71.13 H new ATOM 1606 N SER B 6 17.352 26.252 -4.436 1.00 1.32 N ATOM 1607 CA SER B 6 18.486 26.004 -3.553 1.00 35.53 C ATOM 1608 C SER B 6 18.417 26.894 -2.317 1.00 22.31 C ATOM 1609 O SER B 6 18.731 26.460 -1.209 1.00 0.21 O ATOM 1610 CB SER B 6 19.801 26.246 -4.297 1.00 41.32 C ATOM 1611 OG SER B 6 20.381 27.481 -3.918 1.00 21.35 O ATOM 0 H SER B 6 17.607 26.470 -5.399 1.00 1.32 H new ATOM 0 HA SER B 6 18.444 24.963 -3.232 1.00 35.53 H new ATOM 0 HB2 SER B 6 20.497 25.434 -4.086 1.00 41.32 H new ATOM 0 HB3 SER B 6 19.621 26.240 -5.372 1.00 41.32 H new ATOM 0 HG SER B 6 21.316 27.338 -3.661 1.00 21.35 H new ATOM 1617 N GLU B 7 18.004 28.143 -2.516 1.00 32.11 N ATOM 1618 CA GLU B 7 17.894 29.094 -1.416 1.00 62.35 C ATOM 1619 C GLU B 7 16.904 28.601 -0.366 1.00 42.41 C ATOM 1620 O GLU B 7 16.995 28.963 0.808 1.00 11.21 O ATOM 1621 CB GLU B 7 17.459 30.464 -1.941 1.00 23.21 C ATOM 1622 CG GLU B 7 18.336 30.994 -3.063 1.00 1.43 C ATOM 1623 CD GLU B 7 19.741 31.325 -2.598 1.00 1.34 C ATOM 1624 OE1 GLU B 7 20.578 30.401 -2.537 1.00 2.32 O ATOM 1625 OE2 GLU B 7 20.004 32.508 -2.295 1.00 64.22 O ATOM 0 H GLU B 7 17.741 28.519 -3.427 1.00 32.11 H new ATOM 0 HA GLU B 7 18.874 29.186 -0.949 1.00 62.35 H new ATOM 0 HB2 GLU B 7 16.431 30.398 -2.296 1.00 23.21 H new ATOM 0 HB3 GLU B 7 17.466 31.178 -1.118 1.00 23.21 H new ATOM 0 HG2 GLU B 7 18.386 30.253 -3.861 1.00 1.43 H new ATOM 0 HG3 GLU B 7 17.877 31.888 -3.486 1.00 1.43 H new ATOM 1632 N LYS B 8 15.958 27.773 -0.796 1.00 33.03 N ATOM 1633 CA LYS B 8 14.949 27.229 0.106 1.00 74.20 C ATOM 1634 C LYS B 8 15.478 25.995 0.831 1.00 72.42 C ATOM 1635 O LYS B 8 14.750 25.349 1.586 1.00 55.43 O ATOM 1636 CB LYS B 8 13.681 26.872 -0.671 1.00 61.22 C ATOM 1637 CG LYS B 8 13.410 27.791 -1.850 1.00 10.12 C ATOM 1638 CD LYS B 8 11.965 27.701 -2.308 1.00 72.53 C ATOM 1639 CE LYS B 8 11.283 29.060 -2.274 1.00 74.45 C ATOM 1640 NZ LYS B 8 10.515 29.325 -3.522 1.00 44.13 N ATOM 0 H LYS B 8 15.869 27.464 -1.764 1.00 33.03 H new ATOM 0 HA LYS B 8 14.711 27.991 0.848 1.00 74.20 H new ATOM 0 HB2 LYS B 8 13.763 25.847 -1.032 1.00 61.22 H new ATOM 0 HB3 LYS B 8 12.828 26.904 0.007 1.00 61.22 H new ATOM 0 HG2 LYS B 8 13.641 28.819 -1.571 1.00 10.12 H new ATOM 0 HG3 LYS B 8 14.071 27.529 -2.676 1.00 10.12 H new ATOM 0 HD2 LYS B 8 11.928 27.299 -3.321 1.00 72.53 H new ATOM 0 HD3 LYS B 8 11.422 27.005 -1.669 1.00 72.53 H new ATOM 0 HE2 LYS B 8 10.611 29.108 -1.417 1.00 74.45 H new ATOM 0 HE3 LYS B 8 12.032 29.839 -2.136 1.00 74.45 H new ATOM 0 HZ1 LYS B 8 10.065 30.260 -3.461 1.00 44.13 H new ATOM 0 HZ2 LYS B 8 11.160 29.304 -4.338 1.00 44.13 H new ATOM 0 HZ3 LYS B 8 9.783 28.596 -3.641 1.00 44.13 H new ATOM 1654 N ILE B 9 16.747 25.675 0.597 1.00 12.54 N ATOM 1655 CA ILE B 9 17.372 24.520 1.231 1.00 14.12 C ATOM 1656 C ILE B 9 18.608 24.930 2.024 1.00 2.44 C ATOM 1657 O ILE B 9 19.239 24.103 2.682 1.00 32.42 O ATOM 1658 CB ILE B 9 17.771 23.456 0.192 1.00 61.41 C ATOM 1659 CG1 ILE B 9 16.636 23.240 -0.812 1.00 2.42 C ATOM 1660 CG2 ILE B 9 18.129 22.149 0.884 1.00 21.54 C ATOM 1661 CD1 ILE B 9 16.957 22.213 -1.875 1.00 4.43 C ATOM 0 H ILE B 9 17.362 26.199 -0.026 1.00 12.54 H new ATOM 0 HA ILE B 9 16.633 24.094 1.910 1.00 14.12 H new ATOM 0 HB ILE B 9 18.648 23.810 -0.350 1.00 61.41 H new ATOM 0 HG12 ILE B 9 15.741 22.927 -0.274 1.00 2.42 H new ATOM 0 HG13 ILE B 9 16.403 24.189 -1.294 1.00 2.42 H new ATOM 0 HG21 ILE B 9 18.409 21.406 0.137 1.00 21.54 H new ATOM 0 HG22 ILE B 9 18.966 22.314 1.563 1.00 21.54 H new ATOM 0 HG23 ILE B 9 17.269 21.789 1.449 1.00 21.54 H new ATOM 0 HD11 ILE B 9 16.108 22.112 -2.551 1.00 4.43 H new ATOM 0 HD12 ILE B 9 17.833 22.534 -2.438 1.00 4.43 H new ATOM 0 HD13 ILE B 9 17.161 21.252 -1.403 1.00 4.43 H new ATOM 1673 N VAL B 10 18.949 26.213 1.956 1.00 31.43 N ATOM 1674 CA VAL B 10 20.109 26.735 2.669 1.00 4.14 C ATOM 1675 C VAL B 10 19.685 27.539 3.893 1.00 20.24 C ATOM 1676 O VAL B 10 20.331 27.482 4.941 1.00 25.00 O ATOM 1677 CB VAL B 10 20.975 27.625 1.758 1.00 14.00 C ATOM 1678 CG1 VAL B 10 21.530 26.819 0.593 1.00 0.51 C ATOM 1679 CG2 VAL B 10 20.171 28.816 1.257 1.00 13.31 C ATOM 0 H VAL B 10 18.438 26.910 1.414 1.00 31.43 H new ATOM 0 HA VAL B 10 20.697 25.875 2.989 1.00 4.14 H new ATOM 0 HB VAL B 10 21.816 28.001 2.341 1.00 14.00 H new ATOM 0 HG11 VAL B 10 22.139 27.465 -0.039 1.00 0.51 H new ATOM 0 HG12 VAL B 10 22.143 26.003 0.975 1.00 0.51 H new ATOM 0 HG13 VAL B 10 20.706 26.411 0.008 1.00 0.51 H new ATOM 0 HG21 VAL B 10 20.798 29.434 0.615 1.00 13.31 H new ATOM 0 HG22 VAL B 10 19.310 28.461 0.690 1.00 13.31 H new ATOM 0 HG23 VAL B 10 19.828 29.407 2.106 1.00 13.31 H new ATOM 1689 N LEU B 11 18.597 28.288 3.754 1.00 4.44 N ATOM 1690 CA LEU B 11 18.086 29.104 4.849 1.00 2.34 C ATOM 1691 C LEU B 11 17.522 28.229 5.963 1.00 45.43 C ATOM 1692 O LEU B 11 17.618 28.569 7.142 1.00 75.44 O ATOM 1693 CB LEU B 11 17.005 30.060 4.338 1.00 4.21 C ATOM 1694 CG LEU B 11 15.816 29.409 3.630 1.00 62.10 C ATOM 1695 CD1 LEU B 11 14.754 28.998 4.638 1.00 1.11 C ATOM 1696 CD2 LEU B 11 15.230 30.356 2.593 1.00 42.24 C ATOM 0 H LEU B 11 18.052 28.347 2.894 1.00 4.44 H new ATOM 0 HA LEU B 11 18.915 29.685 5.253 1.00 2.34 H new ATOM 0 HB2 LEU B 11 16.628 30.636 5.183 1.00 4.21 H new ATOM 0 HB3 LEU B 11 17.469 30.768 3.651 1.00 4.21 H new ATOM 0 HG LEU B 11 16.168 28.513 3.118 1.00 62.10 H new ATOM 0 HD11 LEU B 11 13.916 28.537 4.116 1.00 1.11 H new ATOM 0 HD12 LEU B 11 15.179 28.284 5.344 1.00 1.11 H new ATOM 0 HD13 LEU B 11 14.405 29.878 5.178 1.00 1.11 H new ATOM 0 HD21 LEU B 11 14.385 29.877 2.099 1.00 42.24 H new ATOM 0 HD22 LEU B 11 14.893 31.269 3.083 1.00 42.24 H new ATOM 0 HD23 LEU B 11 15.992 30.601 1.853 1.00 42.24 H new ATOM 1708 N MET B 12 16.934 27.100 5.583 1.00 15.32 N ATOM 1709 CA MET B 12 16.358 26.174 6.550 1.00 4.44 C ATOM 1710 C MET B 12 17.409 25.188 7.052 1.00 75.53 C ATOM 1711 O MET B 12 17.275 24.622 8.137 1.00 31.24 O ATOM 1712 CB MET B 12 15.185 25.415 5.927 1.00 24.25 C ATOM 1713 CG MET B 12 15.484 24.870 4.539 1.00 13.14 C ATOM 1714 SD MET B 12 14.559 23.367 4.169 1.00 25.25 S ATOM 1715 CE MET B 12 15.880 22.276 3.648 1.00 64.33 C ATOM 0 H MET B 12 16.844 26.804 4.611 1.00 15.32 H new ATOM 0 HA MET B 12 15.995 26.754 7.399 1.00 4.44 H new ATOM 0 HB2 MET B 12 14.909 24.588 6.582 1.00 24.25 H new ATOM 0 HB3 MET B 12 14.322 26.079 5.870 1.00 24.25 H new ATOM 0 HG2 MET B 12 15.246 25.631 3.795 1.00 13.14 H new ATOM 0 HG3 MET B 12 16.551 24.665 4.456 1.00 13.14 H new ATOM 0 HE1 MET B 12 15.864 22.178 2.563 1.00 64.33 H new ATOM 0 HE2 MET B 12 16.839 22.690 3.961 1.00 64.33 H new ATOM 0 HE3 MET B 12 15.743 21.295 4.103 1.00 64.33 H new ATOM 1725 N ARG B 13 18.453 24.986 6.254 1.00 31.24 N ATOM 1726 CA ARG B 13 19.525 24.067 6.617 1.00 74.51 C ATOM 1727 C ARG B 13 20.347 24.621 7.777 1.00 20.12 C ATOM 1728 O ARG B 13 20.624 23.916 8.748 1.00 41.34 O ATOM 1729 CB ARG B 13 20.432 23.808 5.413 1.00 32.34 C ATOM 1730 CG ARG B 13 21.722 23.085 5.766 1.00 45.45 C ATOM 1731 CD ARG B 13 22.383 22.489 4.534 1.00 63.05 C ATOM 1732 NE ARG B 13 23.480 23.319 4.045 1.00 42.01 N ATOM 1733 CZ ARG B 13 24.620 23.492 4.705 1.00 41.31 C ATOM 1734 NH1 ARG B 13 24.812 22.895 5.872 1.00 23.35 N ATOM 1735 NH2 ARG B 13 25.572 24.263 4.194 1.00 12.23 N ATOM 0 H ARG B 13 18.579 25.446 5.352 1.00 31.24 H new ATOM 0 HA ARG B 13 19.073 23.127 6.932 1.00 74.51 H new ATOM 0 HB2 ARG B 13 19.885 23.219 4.677 1.00 32.34 H new ATOM 0 HB3 ARG B 13 20.676 24.760 4.942 1.00 32.34 H new ATOM 0 HG2 ARG B 13 22.409 23.780 6.248 1.00 45.45 H new ATOM 0 HG3 ARG B 13 21.511 22.294 6.486 1.00 45.45 H new ATOM 0 HD2 ARG B 13 22.759 21.494 4.770 1.00 63.05 H new ATOM 0 HD3 ARG B 13 21.640 22.370 3.746 1.00 63.05 H new ATOM 0 HE ARG B 13 23.365 23.792 3.148 1.00 42.01 H new ATOM 0 HH11 ARG B 13 24.083 22.300 6.267 1.00 23.35 H new ATOM 0 HH12 ARG B 13 25.689 23.030 6.376 1.00 23.35 H new ATOM 0 HH21 ARG B 13 25.428 24.723 3.295 1.00 12.23 H new ATOM 0 HH22 ARG B 13 26.447 24.396 4.701 1.00 12.23 H new ATOM 1749 N LYS B 14 20.735 25.888 7.668 1.00 12.22 N ATOM 1750 CA LYS B 14 21.524 26.538 8.707 1.00 65.30 C ATOM 1751 C LYS B 14 20.728 26.653 10.003 1.00 55.42 C ATOM 1752 O LYS B 14 21.301 26.801 11.083 1.00 72.04 O ATOM 1753 CB LYS B 14 21.970 27.927 8.244 1.00 13.55 C ATOM 1754 CG LYS B 14 23.337 27.939 7.584 1.00 13.50 C ATOM 1755 CD LYS B 14 23.227 28.082 6.075 1.00 31.23 C ATOM 1756 CE LYS B 14 22.663 29.438 5.683 1.00 22.12 C ATOM 1757 NZ LYS B 14 23.607 30.205 4.823 1.00 72.34 N ATOM 0 H LYS B 14 20.515 26.484 6.870 1.00 12.22 H new ATOM 0 HA LYS B 14 22.405 25.925 8.896 1.00 65.30 H new ATOM 0 HB2 LYS B 14 21.234 28.321 7.543 1.00 13.55 H new ATOM 0 HB3 LYS B 14 21.984 28.599 9.102 1.00 13.55 H new ATOM 0 HG2 LYS B 14 23.929 28.761 7.986 1.00 13.50 H new ATOM 0 HG3 LYS B 14 23.867 27.017 7.825 1.00 13.50 H new ATOM 0 HD2 LYS B 14 24.211 27.952 5.624 1.00 31.23 H new ATOM 0 HD3 LYS B 14 22.588 27.293 5.679 1.00 31.23 H new ATOM 0 HE2 LYS B 14 21.720 29.300 5.154 1.00 22.12 H new ATOM 0 HE3 LYS B 14 22.442 30.013 6.582 1.00 22.12 H new ATOM 0 HZ1 LYS B 14 23.185 31.123 4.578 1.00 72.34 H new ATOM 0 HZ2 LYS B 14 24.498 30.359 5.337 1.00 72.34 H new ATOM 0 HZ3 LYS B 14 23.798 29.668 3.953 1.00 72.34 H new ATOM 1771 N SER B 15 19.406 26.584 9.889 1.00 70.12 N ATOM 1772 CA SER B 15 18.532 26.683 11.052 1.00 60.13 C ATOM 1773 C SER B 15 18.695 25.468 11.959 1.00 64.13 C ATOM 1774 O SER B 15 18.431 25.536 13.159 1.00 73.31 O ATOM 1775 CB SER B 15 17.073 26.812 10.610 1.00 63.31 C ATOM 1776 OG SER B 15 16.387 25.580 10.747 1.00 42.11 O ATOM 0 H SER B 15 18.916 26.460 9.003 1.00 70.12 H new ATOM 0 HA SER B 15 18.814 27.574 11.613 1.00 60.13 H new ATOM 0 HB2 SER B 15 16.576 27.577 11.206 1.00 63.31 H new ATOM 0 HB3 SER B 15 17.032 27.141 9.572 1.00 63.31 H new ATOM 0 HG SER B 15 16.532 25.034 9.946 1.00 42.11 H new ATOM 1782 N GLU B 16 19.132 24.356 11.376 1.00 40.41 N ATOM 1783 CA GLU B 16 19.329 23.124 12.131 1.00 13.44 C ATOM 1784 C GLU B 16 20.732 23.072 12.730 1.00 32.01 C ATOM 1785 O GLU B 16 21.065 22.152 13.476 1.00 23.44 O ATOM 1786 CB GLU B 16 19.101 21.907 11.232 1.00 54.12 C ATOM 1787 CG GLU B 16 19.156 20.583 11.977 1.00 50.43 C ATOM 1788 CD GLU B 16 18.259 20.563 13.199 1.00 43.22 C ATOM 1789 OE1 GLU B 16 17.114 21.050 13.103 1.00 51.44 O ATOM 1790 OE2 GLU B 16 18.704 20.060 14.252 1.00 35.53 O ATOM 0 H GLU B 16 19.356 24.283 10.384 1.00 40.41 H new ATOM 0 HA GLU B 16 18.604 23.106 12.945 1.00 13.44 H new ATOM 0 HB2 GLU B 16 18.130 22.001 10.746 1.00 54.12 H new ATOM 0 HB3 GLU B 16 19.853 21.902 10.443 1.00 54.12 H new ATOM 0 HG2 GLU B 16 18.863 19.779 11.303 1.00 50.43 H new ATOM 0 HG3 GLU B 16 20.183 20.385 12.282 1.00 50.43 H new ATOM 1797 N TYR B 17 21.547 24.066 12.398 1.00 34.32 N ATOM 1798 CA TYR B 17 22.915 24.133 12.900 1.00 12.14 C ATOM 1799 C TYR B 17 23.705 22.893 12.494 1.00 53.41 C ATOM 1800 O TYR B 17 24.418 22.303 13.307 1.00 71.22 O ATOM 1801 CB TYR B 17 22.914 24.276 14.423 1.00 12.25 C ATOM 1802 CG TYR B 17 22.677 25.692 14.897 1.00 11.31 C ATOM 1803 CD1 TYR B 17 21.554 26.403 14.492 1.00 24.11 C ATOM 1804 CD2 TYR B 17 23.575 26.318 15.753 1.00 4.33 C ATOM 1805 CE1 TYR B 17 21.333 27.696 14.923 1.00 12.34 C ATOM 1806 CE2 TYR B 17 23.361 27.612 16.191 1.00 21.33 C ATOM 1807 CZ TYR B 17 22.239 28.296 15.772 1.00 21.44 C ATOM 1808 OH TYR B 17 22.022 29.585 16.205 1.00 40.42 O ATOM 0 H TYR B 17 21.285 24.837 11.784 1.00 34.32 H new ATOM 0 HA TYR B 17 23.395 25.007 12.460 1.00 12.14 H new ATOM 0 HB2 TYR B 17 22.143 23.628 14.840 1.00 12.25 H new ATOM 0 HB3 TYR B 17 23.870 23.926 14.813 1.00 12.25 H new ATOM 0 HD1 TYR B 17 20.841 25.936 13.828 1.00 24.11 H new ATOM 0 HD2 TYR B 17 24.455 25.785 16.082 1.00 4.33 H new ATOM 0 HE1 TYR B 17 20.455 28.234 14.597 1.00 12.34 H new ATOM 0 HE2 TYR B 17 24.068 28.084 16.857 1.00 21.33 H new ATOM 0 HH TYR B 17 22.753 29.858 16.798 1.00 40.42 H new ATOM 1818 N LEU B 18 23.575 22.504 11.231 1.00 12.20 N ATOM 1819 CA LEU B 18 24.277 21.333 10.714 1.00 24.40 C ATOM 1820 C LEU B 18 25.124 21.698 9.499 1.00 52.21 C ATOM 1821 O LEU B 18 24.941 22.757 8.899 1.00 53.11 O ATOM 1822 CB LEU B 18 23.278 20.237 10.343 1.00 20.43 C ATOM 1823 CG LEU B 18 22.324 20.559 9.193 1.00 13.14 C ATOM 1824 CD1 LEU B 18 22.964 20.214 7.856 1.00 73.11 C ATOM 1825 CD2 LEU B 18 21.009 19.814 9.365 1.00 4.13 C ATOM 0 H LEU B 18 22.990 22.982 10.545 1.00 12.20 H new ATOM 0 HA LEU B 18 24.939 20.962 11.497 1.00 24.40 H new ATOM 0 HB2 LEU B 18 23.836 19.337 10.084 1.00 20.43 H new ATOM 0 HB3 LEU B 18 22.684 20.001 11.226 1.00 20.43 H new ATOM 0 HG LEU B 18 22.116 21.629 9.208 1.00 13.14 H new ATOM 0 HD11 LEU B 18 22.270 20.450 7.049 1.00 73.11 H new ATOM 0 HD12 LEU B 18 23.878 20.794 7.730 1.00 73.11 H new ATOM 0 HD13 LEU B 18 23.202 19.151 7.830 1.00 73.11 H new ATOM 0 HD21 LEU B 18 20.343 20.056 8.537 1.00 4.13 H new ATOM 0 HD22 LEU B 18 21.198 18.741 9.377 1.00 4.13 H new ATOM 0 HD23 LEU B 18 20.543 20.111 10.304 1.00 4.13 H new ATOM 1837 N SER B 19 26.049 20.814 9.141 1.00 12.41 N ATOM 1838 CA SER B 19 26.924 21.044 7.999 1.00 64.34 C ATOM 1839 C SER B 19 26.383 20.351 6.752 1.00 33.32 C ATOM 1840 O SER B 19 25.560 19.440 6.843 1.00 1.23 O ATOM 1841 CB SER B 19 28.337 20.541 8.303 1.00 15.24 C ATOM 1842 OG SER B 19 28.956 21.333 9.302 1.00 63.44 O ATOM 0 H SER B 19 26.212 19.931 9.626 1.00 12.41 H new ATOM 0 HA SER B 19 26.960 22.117 7.811 1.00 64.34 H new ATOM 0 HB2 SER B 19 28.294 19.503 8.632 1.00 15.24 H new ATOM 0 HB3 SER B 19 28.938 20.562 7.394 1.00 15.24 H new ATOM 0 HG SER B 19 29.857 20.990 9.480 1.00 63.44 H new ATOM 1848 N ARG B 20 26.852 20.790 5.589 1.00 0.34 N ATOM 1849 CA ARG B 20 26.416 20.214 4.322 1.00 13.34 C ATOM 1850 C ARG B 20 26.571 18.697 4.333 1.00 61.45 C ATOM 1851 O ARG B 20 25.730 17.974 3.798 1.00 32.35 O ATOM 1852 CB ARG B 20 27.215 20.811 3.162 1.00 32.01 C ATOM 1853 CG ARG B 20 26.763 20.323 1.796 1.00 12.30 C ATOM 1854 CD ARG B 20 27.157 21.298 0.698 1.00 43.42 C ATOM 1855 NE ARG B 20 28.604 21.345 0.500 1.00 33.34 N ATOM 1856 CZ ARG B 20 29.192 22.071 -0.443 1.00 13.22 C ATOM 1857 NH1 ARG B 20 28.464 22.809 -1.269 1.00 45.34 N ATOM 1858 NH2 ARG B 20 30.514 22.062 -0.560 1.00 44.43 N ATOM 0 H ARG B 20 27.534 21.543 5.497 1.00 0.34 H new ATOM 0 HA ARG B 20 25.361 20.454 4.187 1.00 13.34 H new ATOM 0 HB2 ARG B 20 27.132 21.897 3.196 1.00 32.01 H new ATOM 0 HB3 ARG B 20 28.269 20.568 3.295 1.00 32.01 H new ATOM 0 HG2 ARG B 20 27.204 19.347 1.593 1.00 12.30 H new ATOM 0 HG3 ARG B 20 25.681 20.190 1.795 1.00 12.30 H new ATOM 0 HD2 ARG B 20 26.673 21.008 -0.235 1.00 43.42 H new ATOM 0 HD3 ARG B 20 26.793 22.294 0.950 1.00 43.42 H new ATOM 0 HE ARG B 20 29.194 20.790 1.120 1.00 33.34 H new ATOM 0 HH11 ARG B 20 27.448 22.821 -1.181 1.00 45.34 H new ATOM 0 HH12 ARG B 20 28.920 23.365 -1.992 1.00 45.34 H new ATOM 0 HH21 ARG B 20 31.078 21.497 0.075 1.00 44.43 H new ATOM 0 HH22 ARG B 20 30.966 22.620 -1.285 1.00 44.43 H new ATOM 1872 N GLN B 21 27.650 18.221 4.945 1.00 14.43 N ATOM 1873 CA GLN B 21 27.916 16.790 5.024 1.00 43.34 C ATOM 1874 C GLN B 21 26.928 16.104 5.962 1.00 62.14 C ATOM 1875 O GLN B 21 26.612 14.927 5.791 1.00 41.54 O ATOM 1876 CB GLN B 21 29.347 16.540 5.502 1.00 2.32 C ATOM 1877 CG GLN B 21 29.888 15.173 5.117 1.00 23.52 C ATOM 1878 CD GLN B 21 31.234 14.879 5.750 1.00 53.34 C ATOM 1879 OE1 GLN B 21 32.191 14.518 5.063 1.00 14.14 O ATOM 1880 NE2 GLN B 21 31.315 15.031 7.067 1.00 71.20 N ATOM 0 H GLN B 21 28.355 18.806 5.394 1.00 14.43 H new ATOM 0 HA GLN B 21 27.795 16.369 4.026 1.00 43.34 H new ATOM 0 HB2 GLN B 21 29.999 17.309 5.088 1.00 2.32 H new ATOM 0 HB3 GLN B 21 29.382 16.643 6.587 1.00 2.32 H new ATOM 0 HG2 GLN B 21 29.174 14.406 5.417 1.00 23.52 H new ATOM 0 HG3 GLN B 21 29.980 15.115 4.032 1.00 23.52 H new ATOM 0 HE21 GLN B 21 30.497 15.332 7.597 1.00 71.20 H new ATOM 0 HE22 GLN B 21 32.195 14.847 7.548 1.00 71.20 H new ATOM 1889 N GLN B 22 26.443 16.847 6.951 1.00 33.40 N ATOM 1890 CA GLN B 22 25.492 16.309 7.915 1.00 53.02 C ATOM 1891 C GLN B 22 24.193 15.902 7.229 1.00 53.44 C ATOM 1892 O GLN B 22 23.812 14.731 7.241 1.00 72.23 O ATOM 1893 CB GLN B 22 25.204 17.340 9.008 1.00 4.03 C ATOM 1894 CG GLN B 22 25.407 16.806 10.418 1.00 5.22 C ATOM 1895 CD GLN B 22 26.870 16.613 10.763 1.00 40.14 C ATOM 1896 OE1 GLN B 22 27.751 17.188 10.125 1.00 24.31 O ATOM 1897 NE2 GLN B 22 27.135 15.800 11.779 1.00 70.34 N ATOM 0 H GLN B 22 26.693 17.824 7.106 1.00 33.40 H new ATOM 0 HA GLN B 22 25.935 15.422 8.369 1.00 53.02 H new ATOM 0 HB2 GLN B 22 25.851 18.205 8.859 1.00 4.03 H new ATOM 0 HB3 GLN B 22 24.176 17.689 8.905 1.00 4.03 H new ATOM 0 HG2 GLN B 22 24.957 17.496 11.132 1.00 5.22 H new ATOM 0 HG3 GLN B 22 24.885 15.855 10.521 1.00 5.22 H new ATOM 0 HE21 GLN B 22 26.372 15.344 12.280 1.00 70.34 H new ATOM 0 HE22 GLN B 22 28.101 15.631 12.059 1.00 70.34 H new ATOM 1906 N LEU B 23 23.514 16.876 6.631 1.00 15.24 N ATOM 1907 CA LEU B 23 22.256 16.619 5.939 1.00 60.42 C ATOM 1908 C LEU B 23 22.409 15.480 4.937 1.00 74.31 C ATOM 1909 O LEU B 23 21.609 14.545 4.917 1.00 34.01 O ATOM 1910 CB LEU B 23 21.778 17.882 5.223 1.00 62.13 C ATOM 1911 CG LEU B 23 20.498 17.744 4.398 1.00 44.52 C ATOM 1912 CD1 LEU B 23 19.287 18.163 5.216 1.00 33.53 C ATOM 1913 CD2 LEU B 23 20.594 18.566 3.121 1.00 12.23 C ATOM 0 H LEU B 23 23.814 17.851 6.612 1.00 15.24 H new ATOM 0 HA LEU B 23 21.514 16.327 6.682 1.00 60.42 H new ATOM 0 HB2 LEU B 23 21.623 18.661 5.969 1.00 62.13 H new ATOM 0 HB3 LEU B 23 22.575 18.226 4.564 1.00 62.13 H new ATOM 0 HG LEU B 23 20.378 16.696 4.122 1.00 44.52 H new ATOM 0 HD11 LEU B 23 18.386 18.058 4.612 1.00 33.53 H new ATOM 0 HD12 LEU B 23 19.208 17.529 6.099 1.00 33.53 H new ATOM 0 HD13 LEU B 23 19.398 19.203 5.524 1.00 33.53 H new ATOM 0 HD21 LEU B 23 19.674 18.455 2.547 1.00 12.23 H new ATOM 0 HD22 LEU B 23 20.740 19.616 3.374 1.00 12.23 H new ATOM 0 HD23 LEU B 23 21.437 18.216 2.526 1.00 12.23 H new ATOM 1925 N ALA B 24 23.444 15.563 4.108 1.00 31.24 N ATOM 1926 CA ALA B 24 23.705 14.537 3.106 1.00 75.43 C ATOM 1927 C ALA B 24 23.764 13.152 3.741 1.00 63.14 C ATOM 1928 O ALA B 24 23.496 12.146 3.084 1.00 31.23 O ATOM 1929 CB ALA B 24 25.002 14.837 2.368 1.00 65.45 C ATOM 0 H ALA B 24 24.116 16.331 4.110 1.00 31.24 H new ATOM 0 HA ALA B 24 22.883 14.546 2.391 1.00 75.43 H new ATOM 0 HB1 ALA B 24 25.184 14.063 1.623 1.00 65.45 H new ATOM 0 HB2 ALA B 24 24.924 15.805 1.873 1.00 65.45 H new ATOM 0 HB3 ALA B 24 25.828 14.858 3.079 1.00 65.45 H new ATOM 1935 N ASP B 25 24.116 13.107 5.020 1.00 53.33 N ATOM 1936 CA ASP B 25 24.209 11.845 5.744 1.00 63.20 C ATOM 1937 C ASP B 25 22.901 11.533 6.464 1.00 41.34 C ATOM 1938 O ASP B 25 22.575 10.370 6.706 1.00 55.50 O ATOM 1939 CB ASP B 25 25.361 11.893 6.751 1.00 35.03 C ATOM 1940 CG ASP B 25 26.172 10.613 6.764 1.00 31.34 C ATOM 1941 OD1 ASP B 25 26.533 10.127 5.672 1.00 75.51 O ATOM 1942 OD2 ASP B 25 26.447 10.096 7.867 1.00 43.25 O ATOM 0 H ASP B 25 24.342 13.931 5.578 1.00 53.33 H new ATOM 0 HA ASP B 25 24.402 11.053 5.020 1.00 63.20 H new ATOM 0 HB2 ASP B 25 26.015 12.731 6.511 1.00 35.03 H new ATOM 0 HB3 ASP B 25 24.961 12.076 7.748 1.00 35.03 H new ATOM 1947 N LEU B 26 22.155 12.578 6.804 1.00 71.41 N ATOM 1948 CA LEU B 26 20.883 12.417 7.497 1.00 64.24 C ATOM 1949 C LEU B 26 19.794 11.950 6.536 1.00 43.13 C ATOM 1950 O LEU B 26 18.857 11.254 6.931 1.00 10.22 O ATOM 1951 CB LEU B 26 20.467 13.734 8.156 1.00 4.31 C ATOM 1952 CG LEU B 26 20.837 13.892 9.631 1.00 10.30 C ATOM 1953 CD1 LEU B 26 19.883 13.100 10.510 1.00 61.54 C ATOM 1954 CD2 LEU B 26 22.275 13.453 9.870 1.00 62.25 C ATOM 0 H LEU B 26 22.410 13.547 6.611 1.00 71.41 H new ATOM 0 HA LEU B 26 21.012 11.657 8.268 1.00 64.24 H new ATOM 0 HB2 LEU B 26 20.919 14.555 7.599 1.00 4.31 H new ATOM 0 HB3 LEU B 26 19.386 13.840 8.060 1.00 4.31 H new ATOM 0 HG LEU B 26 20.751 14.946 9.896 1.00 10.30 H new ATOM 0 HD11 LEU B 26 20.163 13.225 11.556 1.00 61.54 H new ATOM 0 HD12 LEU B 26 18.866 13.462 10.361 1.00 61.54 H new ATOM 0 HD13 LEU B 26 19.935 12.044 10.244 1.00 61.54 H new ATOM 0 HD21 LEU B 26 22.521 13.572 10.925 1.00 62.25 H new ATOM 0 HD22 LEU B 26 22.388 12.406 9.587 1.00 62.25 H new ATOM 0 HD23 LEU B 26 22.947 14.066 9.269 1.00 62.25 H new ATOM 1966 N THR B 27 19.923 12.337 5.270 1.00 72.41 N ATOM 1967 CA THR B 27 18.952 11.958 4.252 1.00 53.05 C ATOM 1968 C THR B 27 19.468 10.799 3.405 1.00 51.22 C ATOM 1969 O THR B 27 18.706 10.159 2.682 1.00 32.24 O ATOM 1970 CB THR B 27 18.615 13.144 3.328 1.00 52.21 C ATOM 1971 OG1 THR B 27 19.697 13.380 2.420 1.00 2.43 O ATOM 1972 CG2 THR B 27 18.343 14.401 4.141 1.00 64.34 C ATOM 0 H THR B 27 20.691 12.913 4.926 1.00 72.41 H new ATOM 0 HA THR B 27 18.048 11.647 4.777 1.00 53.05 H new ATOM 0 HB THR B 27 17.717 12.894 2.763 1.00 52.21 H new ATOM 0 HG1 THR B 27 20.459 13.754 2.910 1.00 2.43 H new ATOM 0 HG21 THR B 27 18.107 15.226 3.468 1.00 64.34 H new ATOM 0 HG22 THR B 27 17.500 14.226 4.810 1.00 64.34 H new ATOM 0 HG23 THR B 27 19.226 14.653 4.728 1.00 64.34 H new ATOM 1980 N GLY B 28 20.767 10.535 3.500 1.00 31.12 N ATOM 1981 CA GLY B 28 21.362 9.453 2.737 1.00 0.51 C ATOM 1982 C GLY B 28 21.755 9.879 1.336 1.00 21.43 C ATOM 1983 O GLY B 28 21.992 9.039 0.468 1.00 31.15 O ATOM 0 H GLY B 28 21.418 11.051 4.092 1.00 31.12 H new ATOM 0 HA2 GLY B 28 22.243 9.084 3.262 1.00 0.51 H new ATOM 0 HA3 GLY B 28 20.657 8.624 2.677 1.00 0.51 H new ATOM 1987 N VAL B 29 21.822 11.188 1.114 1.00 41.33 N ATOM 1988 CA VAL B 29 22.188 11.724 -0.191 1.00 64.40 C ATOM 1989 C VAL B 29 23.698 11.882 -0.317 1.00 1.32 C ATOM 1990 O VAL B 29 24.407 12.117 0.663 1.00 12.41 O ATOM 1991 CB VAL B 29 21.516 13.087 -0.446 1.00 61.44 C ATOM 1992 CG1 VAL B 29 22.564 14.153 -0.729 1.00 50.43 C ATOM 1993 CG2 VAL B 29 20.524 12.985 -1.595 1.00 55.14 C ATOM 0 H VAL B 29 21.627 11.897 1.821 1.00 41.33 H new ATOM 0 HA VAL B 29 21.838 11.010 -0.936 1.00 64.40 H new ATOM 0 HB VAL B 29 20.969 13.377 0.451 1.00 61.44 H new ATOM 0 HG11 VAL B 29 22.072 15.109 -0.907 1.00 50.43 H new ATOM 0 HG12 VAL B 29 23.232 14.243 0.127 1.00 50.43 H new ATOM 0 HG13 VAL B 29 23.140 13.872 -1.611 1.00 50.43 H new ATOM 0 HG21 VAL B 29 20.059 13.957 -1.761 1.00 55.14 H new ATOM 0 HG22 VAL B 29 21.046 12.673 -2.500 1.00 55.14 H new ATOM 0 HG23 VAL B 29 19.756 12.252 -1.348 1.00 55.14 H new ATOM 2003 N PRO B 30 24.207 11.752 -1.550 1.00 64.31 N ATOM 2004 CA PRO B 30 25.639 11.879 -1.834 1.00 44.21 C ATOM 2005 C PRO B 30 26.139 13.311 -1.673 1.00 55.44 C ATOM 2006 O PRO B 30 25.649 14.227 -2.335 1.00 52.10 O ATOM 2007 CB PRO B 30 25.753 11.434 -3.294 1.00 72.05 C ATOM 2008 CG PRO B 30 24.408 11.701 -3.877 1.00 25.14 C ATOM 2009 CD PRO B 30 23.422 11.474 -2.765 1.00 2.43 C ATOM 0 HA PRO B 30 26.244 11.289 -1.146 1.00 44.21 H new ATOM 0 HB2 PRO B 30 26.529 11.991 -3.818 1.00 72.05 H new ATOM 0 HB3 PRO B 30 26.014 10.378 -3.367 1.00 72.05 H new ATOM 0 HG2 PRO B 30 24.342 12.721 -4.255 1.00 25.14 H new ATOM 0 HG3 PRO B 30 24.208 11.036 -4.717 1.00 25.14 H new ATOM 0 HD2 PRO B 30 22.562 12.139 -2.849 1.00 2.43 H new ATOM 0 HD3 PRO B 30 23.038 10.454 -2.771 1.00 2.43 H new ATOM 2017 N TYR B 31 27.114 13.496 -0.791 1.00 55.04 N ATOM 2018 CA TYR B 31 27.679 14.818 -0.543 1.00 73.24 C ATOM 2019 C TYR B 31 28.241 15.421 -1.827 1.00 50.10 C ATOM 2020 O TYR B 31 28.002 16.587 -2.136 1.00 14.12 O ATOM 2021 CB TYR B 31 28.776 14.736 0.519 1.00 71.51 C ATOM 2022 CG TYR B 31 29.495 16.046 0.750 1.00 71.30 C ATOM 2023 CD1 TYR B 31 28.914 17.055 1.508 1.00 4.21 C ATOM 2024 CD2 TYR B 31 30.754 16.275 0.210 1.00 11.35 C ATOM 2025 CE1 TYR B 31 29.566 18.254 1.721 1.00 23.24 C ATOM 2026 CE2 TYR B 31 31.415 17.469 0.419 1.00 75.30 C ATOM 2027 CZ TYR B 31 30.817 18.456 1.175 1.00 13.24 C ATOM 2028 OH TYR B 31 31.471 19.649 1.384 1.00 2.20 O ATOM 0 H TYR B 31 27.530 12.748 -0.236 1.00 55.04 H new ATOM 0 HA TYR B 31 26.880 15.464 -0.180 1.00 73.24 H new ATOM 0 HB2 TYR B 31 28.336 14.402 1.459 1.00 71.51 H new ATOM 0 HB3 TYR B 31 29.503 13.980 0.221 1.00 71.51 H new ATOM 0 HD1 TYR B 31 27.936 16.899 1.938 1.00 4.21 H new ATOM 0 HD2 TYR B 31 31.224 15.505 -0.384 1.00 11.35 H new ATOM 0 HE1 TYR B 31 29.099 19.029 2.311 1.00 23.24 H new ATOM 0 HE2 TYR B 31 32.394 17.629 -0.007 1.00 75.30 H new ATOM 0 HH TYR B 31 32.341 19.629 0.933 1.00 2.20 H new ATOM 2038 N GLY B 32 28.992 14.614 -2.572 1.00 45.13 N ATOM 2039 CA GLY B 32 29.579 15.083 -3.813 1.00 74.01 C ATOM 2040 C GLY B 32 28.559 15.736 -4.725 1.00 73.43 C ATOM 2041 O GLY B 32 28.883 16.659 -5.473 1.00 1.33 O ATOM 0 H GLY B 32 29.204 13.644 -2.337 1.00 45.13 H new ATOM 0 HA2 GLY B 32 30.372 15.797 -3.590 1.00 74.01 H new ATOM 0 HA3 GLY B 32 30.042 14.244 -4.332 1.00 74.01 H new ATOM 2045 N THR B 33 27.321 15.254 -4.667 1.00 10.04 N ATOM 2046 CA THR B 33 26.251 15.793 -5.496 1.00 11.04 C ATOM 2047 C THR B 33 25.495 16.900 -4.768 1.00 2.51 C ATOM 2048 O THR B 33 25.099 17.897 -5.374 1.00 23.25 O ATOM 2049 CB THR B 33 25.254 14.695 -5.912 1.00 3.23 C ATOM 2050 OG1 THR B 33 25.868 13.407 -5.795 1.00 14.15 O ATOM 2051 CG2 THR B 33 24.778 14.909 -7.341 1.00 42.22 C ATOM 0 H THR B 33 27.035 14.491 -4.054 1.00 10.04 H new ATOM 0 HA THR B 33 26.721 16.204 -6.389 1.00 11.04 H new ATOM 0 HB THR B 33 24.391 14.747 -5.248 1.00 3.23 H new ATOM 0 HG1 THR B 33 25.291 12.731 -6.207 1.00 14.15 H new ATOM 0 HG21 THR B 33 24.075 14.121 -7.612 1.00 42.22 H new ATOM 0 HG22 THR B 33 24.285 15.878 -7.419 1.00 42.22 H new ATOM 0 HG23 THR B 33 25.632 14.881 -8.017 1.00 42.22 H new ATOM 2059 N LEU B 34 25.302 16.720 -3.467 1.00 5.42 N ATOM 2060 CA LEU B 34 24.594 17.704 -2.655 1.00 11.23 C ATOM 2061 C LEU B 34 25.329 19.040 -2.657 1.00 53.41 C ATOM 2062 O LEU B 34 24.744 20.083 -2.368 1.00 25.43 O ATOM 2063 CB LEU B 34 24.440 17.196 -1.220 1.00 44.11 C ATOM 2064 CG LEU B 34 24.062 18.244 -0.174 1.00 20.43 C ATOM 2065 CD1 LEU B 34 22.593 18.617 -0.296 1.00 30.33 C ATOM 2066 CD2 LEU B 34 24.371 17.735 1.226 1.00 54.42 C ATOM 0 H LEU B 34 25.626 15.902 -2.951 1.00 5.42 H new ATOM 0 HA LEU B 34 23.605 17.853 -3.089 1.00 11.23 H new ATOM 0 HB2 LEU B 34 23.681 16.414 -1.212 1.00 44.11 H new ATOM 0 HB3 LEU B 34 25.379 16.732 -0.917 1.00 44.11 H new ATOM 0 HG LEU B 34 24.658 19.139 -0.354 1.00 20.43 H new ATOM 0 HD11 LEU B 34 22.344 19.364 0.457 1.00 30.33 H new ATOM 0 HD12 LEU B 34 22.402 19.025 -1.289 1.00 30.33 H new ATOM 0 HD13 LEU B 34 21.978 17.730 -0.144 1.00 30.33 H new ATOM 0 HD21 LEU B 34 24.096 18.494 1.958 1.00 54.42 H new ATOM 0 HD22 LEU B 34 23.803 16.825 1.416 1.00 54.42 H new ATOM 0 HD23 LEU B 34 25.437 17.521 1.308 1.00 54.42 H new ATOM 2078 N SER B 35 26.616 19.002 -2.987 1.00 61.31 N ATOM 2079 CA SER B 35 27.433 20.210 -3.026 1.00 34.14 C ATOM 2080 C SER B 35 26.823 21.248 -3.962 1.00 4.52 C ATOM 2081 O SER B 35 26.738 22.429 -3.625 1.00 30.41 O ATOM 2082 CB SER B 35 28.856 19.874 -3.475 1.00 14.21 C ATOM 2083 OG SER B 35 29.420 20.941 -4.218 1.00 62.41 O ATOM 0 H SER B 35 27.116 18.147 -3.231 1.00 61.31 H new ATOM 0 HA SER B 35 27.467 20.629 -2.020 1.00 34.14 H new ATOM 0 HB2 SER B 35 29.476 19.665 -2.603 1.00 14.21 H new ATOM 0 HB3 SER B 35 28.845 18.969 -4.082 1.00 14.21 H new ATOM 0 HG SER B 35 30.330 20.703 -4.492 1.00 62.41 H new ATOM 2089 N TYR B 36 26.399 20.798 -5.138 1.00 41.34 N ATOM 2090 CA TYR B 36 25.798 21.688 -6.125 1.00 34.30 C ATOM 2091 C TYR B 36 24.306 21.868 -5.861 1.00 45.21 C ATOM 2092 O TYR B 36 23.709 22.866 -6.263 1.00 45.01 O ATOM 2093 CB TYR B 36 26.016 21.139 -7.536 1.00 40.31 C ATOM 2094 CG TYR B 36 24.877 20.276 -8.031 1.00 34.30 C ATOM 2095 CD1 TYR B 36 23.673 20.842 -8.431 1.00 45.14 C ATOM 2096 CD2 TYR B 36 25.006 18.895 -8.102 1.00 32.43 C ATOM 2097 CE1 TYR B 36 22.630 20.058 -8.885 1.00 64.54 C ATOM 2098 CE2 TYR B 36 23.970 18.102 -8.555 1.00 62.53 C ATOM 2099 CZ TYR B 36 22.784 18.689 -8.945 1.00 62.20 C ATOM 2100 OH TYR B 36 21.748 17.904 -9.396 1.00 51.03 O ATOM 0 H TYR B 36 26.460 19.823 -5.431 1.00 41.34 H new ATOM 0 HA TYR B 36 26.282 22.661 -6.042 1.00 34.30 H new ATOM 0 HB2 TYR B 36 26.155 21.973 -8.224 1.00 40.31 H new ATOM 0 HB3 TYR B 36 26.937 20.556 -7.552 1.00 40.31 H new ATOM 0 HD1 TYR B 36 23.550 21.914 -8.386 1.00 45.14 H new ATOM 0 HD2 TYR B 36 25.933 18.433 -7.797 1.00 32.43 H new ATOM 0 HE1 TYR B 36 21.700 20.514 -9.191 1.00 64.54 H new ATOM 0 HE2 TYR B 36 24.088 17.030 -8.604 1.00 62.53 H new ATOM 0 HH TYR B 36 21.351 17.421 -8.641 1.00 51.03 H new ATOM 2110 N TYR B 37 23.712 20.894 -5.180 1.00 23.03 N ATOM 2111 CA TYR B 37 22.289 20.941 -4.863 1.00 71.53 C ATOM 2112 C TYR B 37 21.918 22.277 -4.225 1.00 1.34 C ATOM 2113 O TYR B 37 21.113 23.033 -4.768 1.00 12.02 O ATOM 2114 CB TYR B 37 21.917 19.794 -3.924 1.00 44.25 C ATOM 2115 CG TYR B 37 21.507 18.530 -4.645 1.00 22.43 C ATOM 2116 CD1 TYR B 37 22.147 18.133 -5.812 1.00 52.14 C ATOM 2117 CD2 TYR B 37 20.481 17.730 -4.157 1.00 15.42 C ATOM 2118 CE1 TYR B 37 21.775 16.980 -6.474 1.00 2.53 C ATOM 2119 CE2 TYR B 37 20.102 16.573 -4.812 1.00 0.41 C ATOM 2120 CZ TYR B 37 20.753 16.203 -5.970 1.00 71.12 C ATOM 2121 OH TYR B 37 20.381 15.052 -6.626 1.00 2.50 O ATOM 0 H TYR B 37 24.193 20.063 -4.837 1.00 23.03 H new ATOM 0 HA TYR B 37 21.731 20.835 -5.793 1.00 71.53 H new ATOM 0 HB2 TYR B 37 22.767 19.574 -3.278 1.00 44.25 H new ATOM 0 HB3 TYR B 37 21.100 20.115 -3.278 1.00 44.25 H new ATOM 0 HD1 TYR B 37 22.950 18.737 -6.209 1.00 52.14 H new ATOM 0 HD2 TYR B 37 19.970 18.017 -3.250 1.00 15.42 H new ATOM 0 HE1 TYR B 37 22.282 16.688 -7.382 1.00 2.53 H new ATOM 0 HE2 TYR B 37 19.302 15.963 -4.420 1.00 0.41 H new ATOM 0 HH TYR B 37 19.647 14.621 -6.140 1.00 2.50 H new ATOM 2131 N GLU B 38 22.513 22.559 -3.071 1.00 43.22 N ATOM 2132 CA GLU B 38 22.244 23.804 -2.359 1.00 44.31 C ATOM 2133 C GLU B 38 22.811 24.999 -3.118 1.00 24.45 C ATOM 2134 O GLU B 38 22.370 26.133 -2.933 1.00 42.22 O ATOM 2135 CB GLU B 38 22.841 23.750 -0.951 1.00 11.21 C ATOM 2136 CG GLU B 38 22.709 22.392 -0.283 1.00 54.50 C ATOM 2137 CD GLU B 38 22.641 22.487 1.228 1.00 35.11 C ATOM 2138 OE1 GLU B 38 22.001 23.432 1.735 1.00 70.20 O ATOM 2139 OE2 GLU B 38 23.230 21.617 1.904 1.00 63.32 O ATOM 0 H GLU B 38 23.183 21.944 -2.609 1.00 43.22 H new ATOM 0 HA GLU B 38 21.163 23.924 -2.284 1.00 44.31 H new ATOM 0 HB2 GLU B 38 23.896 24.018 -1.003 1.00 11.21 H new ATOM 0 HB3 GLU B 38 22.352 24.500 -0.329 1.00 11.21 H new ATOM 0 HG2 GLU B 38 21.812 21.896 -0.652 1.00 54.50 H new ATOM 0 HG3 GLU B 38 23.557 21.769 -0.566 1.00 54.50 H new ATOM 2146 N SER B 39 23.793 24.736 -3.976 1.00 53.34 N ATOM 2147 CA SER B 39 24.424 25.790 -4.762 1.00 70.11 C ATOM 2148 C SER B 39 23.508 26.245 -5.893 1.00 24.54 C ATOM 2149 O SER B 39 23.793 27.225 -6.581 1.00 41.42 O ATOM 2150 CB SER B 39 25.756 25.300 -5.333 1.00 1.22 C ATOM 2151 OG SER B 39 26.590 26.390 -5.685 1.00 11.15 O ATOM 0 H SER B 39 24.168 23.803 -4.144 1.00 53.34 H new ATOM 0 HA SER B 39 24.610 26.640 -4.105 1.00 70.11 H new ATOM 0 HB2 SER B 39 26.262 24.673 -4.599 1.00 1.22 H new ATOM 0 HB3 SER B 39 25.573 24.679 -6.210 1.00 1.22 H new ATOM 0 HG SER B 39 26.054 27.084 -6.123 1.00 11.15 H new ATOM 2157 N GLY B 40 22.407 25.525 -6.082 1.00 41.23 N ATOM 2158 CA GLY B 40 21.465 25.870 -7.132 1.00 73.32 C ATOM 2159 C GLY B 40 22.032 25.633 -8.518 1.00 71.50 C ATOM 2160 O GLY B 40 21.444 26.052 -9.515 1.00 64.32 O ATOM 0 H GLY B 40 22.150 24.709 -5.527 1.00 41.23 H new ATOM 0 HA2 GLY B 40 20.556 25.281 -7.009 1.00 73.32 H new ATOM 0 HA3 GLY B 40 21.182 26.918 -7.033 1.00 73.32 H new ATOM 2164 N ARG B 41 23.176 24.961 -8.581 1.00 73.33 N ATOM 2165 CA ARG B 41 23.823 24.671 -9.855 1.00 73.31 C ATOM 2166 C ARG B 41 22.844 24.014 -10.825 1.00 30.24 C ATOM 2167 O ARG B 41 22.797 24.362 -12.004 1.00 23.15 O ATOM 2168 CB ARG B 41 25.034 23.763 -9.642 1.00 2.45 C ATOM 2169 CG ARG B 41 26.172 24.026 -10.616 1.00 71.20 C ATOM 2170 CD ARG B 41 27.089 25.130 -10.115 1.00 3.45 C ATOM 2171 NE ARG B 41 27.953 25.646 -11.174 1.00 73.34 N ATOM 2172 CZ ARG B 41 27.515 26.394 -12.181 1.00 44.45 C ATOM 2173 NH1 ARG B 41 26.231 26.714 -12.265 1.00 73.10 N ATOM 2174 NH2 ARG B 41 28.363 26.825 -13.105 1.00 72.43 N ATOM 0 H ARG B 41 23.674 24.607 -7.765 1.00 73.33 H new ATOM 0 HA ARG B 41 24.157 25.614 -10.287 1.00 73.31 H new ATOM 0 HB2 ARG B 41 25.401 23.894 -8.624 1.00 2.45 H new ATOM 0 HB3 ARG B 41 24.719 22.724 -9.736 1.00 2.45 H new ATOM 0 HG2 ARG B 41 26.747 23.111 -10.761 1.00 71.20 H new ATOM 0 HG3 ARG B 41 25.764 24.303 -11.588 1.00 71.20 H new ATOM 0 HD2 ARG B 41 26.488 25.944 -9.708 1.00 3.45 H new ATOM 0 HD3 ARG B 41 27.703 24.749 -9.299 1.00 3.45 H new ATOM 0 HE ARG B 41 28.947 25.420 -11.138 1.00 73.34 H new ATOM 0 HH11 ARG B 41 25.576 26.386 -11.555 1.00 73.10 H new ATOM 0 HH12 ARG B 41 25.898 27.288 -13.039 1.00 73.10 H new ATOM 0 HH21 ARG B 41 29.352 26.582 -13.043 1.00 72.43 H new ATOM 0 HH22 ARG B 41 28.026 27.399 -13.878 1.00 72.43 H new ATOM 2188 N SER B 42 22.067 23.063 -10.318 1.00 53.33 N ATOM 2189 CA SER B 42 21.093 22.353 -11.140 1.00 23.23 C ATOM 2190 C SER B 42 19.871 21.960 -10.316 1.00 3.44 C ATOM 2191 O SER B 42 19.912 21.956 -9.085 1.00 55.33 O ATOM 2192 CB SER B 42 21.728 21.106 -11.758 1.00 33.02 C ATOM 2193 OG SER B 42 21.583 21.105 -13.168 1.00 14.24 O ATOM 0 H SER B 42 22.092 22.766 -9.343 1.00 53.33 H new ATOM 0 HA SER B 42 20.772 23.022 -11.938 1.00 23.23 H new ATOM 0 HB2 SER B 42 22.786 21.066 -11.498 1.00 33.02 H new ATOM 0 HB3 SER B 42 21.263 20.213 -11.341 1.00 33.02 H new ATOM 0 HG SER B 42 21.999 20.299 -13.539 1.00 14.24 H new ATOM 2199 N THR B 43 18.782 21.632 -11.004 1.00 54.02 N ATOM 2200 CA THR B 43 17.547 21.238 -10.337 1.00 44.13 C ATOM 2201 C THR B 43 17.509 19.735 -10.090 1.00 62.42 C ATOM 2202 O THR B 43 17.470 18.929 -11.020 1.00 42.45 O ATOM 2203 CB THR B 43 16.310 21.642 -11.163 1.00 15.34 C ATOM 2204 OG1 THR B 43 16.704 22.475 -12.260 1.00 15.25 O ATOM 2205 CG2 THR B 43 15.298 22.378 -10.298 1.00 51.13 C ATOM 0 H THR B 43 18.730 21.631 -12.023 1.00 54.02 H new ATOM 0 HA THR B 43 17.524 21.760 -9.381 1.00 44.13 H new ATOM 0 HB THR B 43 15.844 20.734 -11.546 1.00 15.34 H new ATOM 0 HG1 THR B 43 15.913 22.726 -12.781 1.00 15.25 H new ATOM 0 HG21 THR B 43 14.434 22.653 -10.903 1.00 51.13 H new ATOM 0 HG22 THR B 43 14.978 21.731 -9.481 1.00 51.13 H new ATOM 0 HG23 THR B 43 15.756 23.279 -9.889 1.00 51.13 H new ATOM 2213 N PRO B 44 17.522 19.345 -8.807 1.00 34.10 N ATOM 2214 CA PRO B 44 17.489 17.935 -8.407 1.00 64.22 C ATOM 2215 C PRO B 44 16.141 17.282 -8.695 1.00 65.12 C ATOM 2216 O PRO B 44 15.152 17.951 -8.998 1.00 43.23 O ATOM 2217 CB PRO B 44 17.747 17.987 -6.899 1.00 42.35 C ATOM 2218 CG PRO B 44 17.286 19.341 -6.483 1.00 43.14 C ATOM 2219 CD PRO B 44 17.568 20.251 -7.647 1.00 4.14 C ATOM 0 HA PRO B 44 18.217 17.339 -8.957 1.00 64.22 H new ATOM 0 HB2 PRO B 44 17.198 17.204 -6.376 1.00 42.35 H new ATOM 0 HB3 PRO B 44 18.803 17.841 -6.673 1.00 42.35 H new ATOM 0 HG2 PRO B 44 16.223 19.334 -6.242 1.00 43.14 H new ATOM 0 HG3 PRO B 44 17.813 19.675 -5.590 1.00 43.14 H new ATOM 0 HD2 PRO B 44 16.824 21.044 -7.727 1.00 4.14 H new ATOM 0 HD3 PRO B 44 18.540 20.734 -7.553 1.00 4.14 H new ATOM 2227 N PRO B 45 16.098 15.945 -8.598 1.00 22.42 N ATOM 2228 CA PRO B 45 14.876 15.173 -8.844 1.00 43.51 C ATOM 2229 C PRO B 45 13.828 15.384 -7.755 1.00 62.05 C ATOM 2230 O PRO B 45 14.070 16.088 -6.774 1.00 14.40 O ATOM 2231 CB PRO B 45 15.366 13.723 -8.840 1.00 65.34 C ATOM 2232 CG PRO B 45 16.601 13.742 -8.007 1.00 42.52 C ATOM 2233 CD PRO B 45 17.238 15.084 -8.242 1.00 44.51 C ATOM 0 HA PRO B 45 14.386 15.469 -9.772 1.00 43.51 H new ATOM 0 HB2 PRO B 45 14.616 13.053 -8.420 1.00 65.34 H new ATOM 0 HB3 PRO B 45 15.576 13.373 -9.851 1.00 65.34 H new ATOM 0 HG2 PRO B 45 16.363 13.602 -6.953 1.00 42.52 H new ATOM 0 HG3 PRO B 45 17.276 12.935 -8.291 1.00 42.52 H new ATOM 0 HD2 PRO B 45 17.752 15.446 -7.352 1.00 44.51 H new ATOM 0 HD3 PRO B 45 17.977 15.044 -9.043 1.00 44.51 H new ATOM 2241 N THR B 46 12.664 14.769 -7.933 1.00 11.44 N ATOM 2242 CA THR B 46 11.580 14.889 -6.968 1.00 63.42 C ATOM 2243 C THR B 46 11.710 13.847 -5.863 1.00 5.13 C ATOM 2244 O THR B 46 11.325 14.091 -4.718 1.00 4.01 O ATOM 2245 CB THR B 46 10.204 14.734 -7.644 1.00 52.33 C ATOM 2246 OG1 THR B 46 10.081 15.670 -8.721 1.00 33.31 O ATOM 2247 CG2 THR B 46 9.081 14.957 -6.643 1.00 3.02 C ATOM 0 H THR B 46 12.448 14.182 -8.738 1.00 11.44 H new ATOM 0 HA THR B 46 11.653 15.886 -6.535 1.00 63.42 H new ATOM 0 HB THR B 46 10.127 13.719 -8.033 1.00 52.33 H new ATOM 0 HG1 THR B 46 9.156 15.678 -9.044 1.00 33.31 H new ATOM 0 HG21 THR B 46 8.119 14.842 -7.143 1.00 3.02 H new ATOM 0 HG22 THR B 46 9.161 14.226 -5.838 1.00 3.02 H new ATOM 0 HG23 THR B 46 9.157 15.962 -6.229 1.00 3.02 H new ATOM 2255 N ASP B 47 12.254 12.687 -6.211 1.00 1.43 N ATOM 2256 CA ASP B 47 12.436 11.608 -5.247 1.00 54.30 C ATOM 2257 C ASP B 47 13.424 12.013 -4.158 1.00 63.03 C ATOM 2258 O ASP B 47 13.256 11.660 -2.990 1.00 32.00 O ATOM 2259 CB ASP B 47 12.928 10.342 -5.953 1.00 61.00 C ATOM 2260 CG ASP B 47 12.411 9.077 -5.297 1.00 74.43 C ATOM 2261 OD1 ASP B 47 11.762 9.181 -4.236 1.00 53.32 O ATOM 2262 OD2 ASP B 47 12.657 7.981 -5.845 1.00 4.34 O ATOM 0 H ASP B 47 12.577 12.469 -7.154 1.00 1.43 H new ATOM 0 HA ASP B 47 11.472 11.404 -4.781 1.00 54.30 H new ATOM 0 HB2 ASP B 47 12.610 10.364 -6.995 1.00 61.00 H new ATOM 0 HB3 ASP B 47 14.018 10.329 -5.952 1.00 61.00 H new ATOM 2267 N VAL B 48 14.455 12.755 -4.548 1.00 74.22 N ATOM 2268 CA VAL B 48 15.471 13.209 -3.604 1.00 22.51 C ATOM 2269 C VAL B 48 15.019 14.469 -2.874 1.00 4.50 C ATOM 2270 O VAL B 48 15.142 14.568 -1.654 1.00 11.21 O ATOM 2271 CB VAL B 48 16.809 13.492 -4.313 1.00 0.11 C ATOM 2272 CG1 VAL B 48 17.833 14.031 -3.326 1.00 24.23 C ATOM 2273 CG2 VAL B 48 17.325 12.236 -4.998 1.00 54.21 C ATOM 0 H VAL B 48 14.610 13.055 -5.511 1.00 74.22 H new ATOM 0 HA VAL B 48 15.614 12.405 -2.882 1.00 22.51 H new ATOM 0 HB VAL B 48 16.642 14.252 -5.077 1.00 0.11 H new ATOM 0 HG11 VAL B 48 18.772 14.225 -3.845 1.00 24.23 H new ATOM 0 HG12 VAL B 48 17.463 14.958 -2.887 1.00 24.23 H new ATOM 0 HG13 VAL B 48 17.999 13.297 -2.537 1.00 24.23 H new ATOM 0 HG21 VAL B 48 18.271 12.454 -5.494 1.00 54.21 H new ATOM 0 HG22 VAL B 48 17.477 11.453 -4.255 1.00 54.21 H new ATOM 0 HG23 VAL B 48 16.598 11.899 -5.737 1.00 54.21 H new ATOM 2283 N MET B 49 14.494 15.428 -3.629 1.00 33.43 N ATOM 2284 CA MET B 49 14.021 16.681 -3.052 1.00 40.22 C ATOM 2285 C MET B 49 13.107 16.420 -1.859 1.00 4.22 C ATOM 2286 O MET B 49 13.277 17.013 -0.795 1.00 1.31 O ATOM 2287 CB MET B 49 13.280 17.505 -4.107 1.00 44.14 C ATOM 2288 CG MET B 49 12.627 18.759 -3.550 1.00 51.34 C ATOM 2289 SD MET B 49 10.848 18.803 -3.836 1.00 51.12 S ATOM 2290 CE MET B 49 10.254 17.890 -2.415 1.00 51.15 C ATOM 0 H MET B 49 14.385 15.362 -4.641 1.00 33.43 H new ATOM 0 HA MET B 49 14.888 17.243 -2.706 1.00 40.22 H new ATOM 0 HB2 MET B 49 13.980 17.788 -4.893 1.00 44.14 H new ATOM 0 HB3 MET B 49 12.515 16.882 -4.571 1.00 44.14 H new ATOM 0 HG2 MET B 49 12.820 18.819 -2.479 1.00 51.34 H new ATOM 0 HG3 MET B 49 13.086 19.636 -4.006 1.00 51.34 H new ATOM 0 HE1 MET B 49 9.271 18.263 -2.128 1.00 51.15 H new ATOM 0 HE2 MET B 49 10.181 16.832 -2.667 1.00 51.15 H new ATOM 0 HE3 MET B 49 10.948 18.018 -1.584 1.00 51.15 H new ATOM 2300 N MET B 50 12.138 15.529 -2.045 1.00 73.41 N ATOM 2301 CA MET B 50 11.199 15.190 -0.983 1.00 53.21 C ATOM 2302 C MET B 50 11.904 14.456 0.152 1.00 3.12 C ATOM 2303 O MET B 50 11.483 14.528 1.307 1.00 20.05 O ATOM 2304 CB MET B 50 10.061 14.329 -1.536 1.00 34.20 C ATOM 2305 CG MET B 50 10.448 12.874 -1.747 1.00 34.23 C ATOM 2306 SD MET B 50 9.279 11.989 -2.796 1.00 14.43 S ATOM 2307 CE MET B 50 7.726 12.674 -2.223 1.00 65.11 C ATOM 0 H MET B 50 11.983 15.029 -2.921 1.00 73.41 H new ATOM 0 HA MET B 50 10.784 16.117 -0.588 1.00 53.21 H new ATOM 0 HB2 MET B 50 9.215 14.376 -0.851 1.00 34.20 H new ATOM 0 HB3 MET B 50 9.726 14.749 -2.485 1.00 34.20 H new ATOM 0 HG2 MET B 50 11.440 12.828 -2.196 1.00 34.23 H new ATOM 0 HG3 MET B 50 10.512 12.375 -0.780 1.00 34.23 H new ATOM 0 HE1 MET B 50 6.903 12.051 -2.573 1.00 65.11 H new ATOM 0 HE2 MET B 50 7.721 12.703 -1.133 1.00 65.11 H new ATOM 0 HE3 MET B 50 7.608 13.685 -2.613 1.00 65.11 H new ATOM 2317 N ASN B 51 12.978 13.749 -0.184 1.00 10.42 N ATOM 2318 CA ASN B 51 13.741 13.001 0.808 1.00 73.03 C ATOM 2319 C ASN B 51 14.487 13.944 1.748 1.00 51.31 C ATOM 2320 O ASN B 51 14.997 13.526 2.788 1.00 61.22 O ATOM 2321 CB ASN B 51 14.733 12.062 0.118 1.00 41.34 C ATOM 2322 CG ASN B 51 14.210 10.642 0.017 1.00 53.40 C ATOM 2323 OD1 ASN B 51 12.975 10.497 -0.448 1.00 40.12 O flip ATOM 2324 ND2 ASN B 51 14.910 9.686 0.355 1.00 25.24 N flip ATOM 0 H ASN B 51 13.339 13.678 -1.135 1.00 10.42 H new ATOM 0 HA ASN B 51 13.040 12.410 1.397 1.00 73.03 H new ATOM 0 HB2 ASN B 51 14.950 12.438 -0.882 1.00 41.34 H new ATOM 0 HB3 ASN B 51 15.673 12.062 0.670 1.00 41.34 H new ATOM 0 HD21 ASN B 51 15.854 9.844 0.707 1.00 25.24 H new ATOM 0 HD22 ASN B 51 14.545 8.736 0.283 1.00 25.24 H new ATOM 2331 N ILE B 52 14.545 15.218 1.374 1.00 15.14 N ATOM 2332 CA ILE B 52 15.226 16.220 2.183 1.00 71.33 C ATOM 2333 C ILE B 52 14.246 16.946 3.099 1.00 63.34 C ATOM 2334 O ILE B 52 14.616 17.418 4.174 1.00 22.32 O ATOM 2335 CB ILE B 52 15.952 17.255 1.303 1.00 0.12 C ATOM 2336 CG1 ILE B 52 16.810 16.550 0.250 1.00 22.15 C ATOM 2337 CG2 ILE B 52 16.808 18.174 2.163 1.00 64.33 C ATOM 2338 CD1 ILE B 52 17.512 15.315 0.771 1.00 3.43 C ATOM 0 H ILE B 52 14.129 15.580 0.516 1.00 15.14 H new ATOM 0 HA ILE B 52 15.961 15.690 2.789 1.00 71.33 H new ATOM 0 HB ILE B 52 15.205 17.861 0.790 1.00 0.12 H new ATOM 0 HG12 ILE B 52 16.179 16.271 -0.594 1.00 22.15 H new ATOM 0 HG13 ILE B 52 17.555 17.250 -0.128 1.00 22.15 H new ATOM 0 HG21 ILE B 52 17.315 18.900 1.527 1.00 64.33 H new ATOM 0 HG22 ILE B 52 16.174 18.698 2.878 1.00 64.33 H new ATOM 0 HG23 ILE B 52 17.549 17.583 2.701 1.00 64.33 H new ATOM 0 HD11 ILE B 52 18.102 14.867 -0.029 1.00 3.43 H new ATOM 0 HD12 ILE B 52 18.169 15.591 1.596 1.00 3.43 H new ATOM 0 HD13 ILE B 52 16.771 14.596 1.122 1.00 3.43 H new ATOM 2350 N LEU B 53 12.992 17.032 2.666 1.00 63.51 N ATOM 2351 CA LEU B 53 11.957 17.699 3.447 1.00 30.02 C ATOM 2352 C LEU B 53 11.176 16.693 4.286 1.00 3.01 C ATOM 2353 O LEU B 53 10.578 17.050 5.301 1.00 32.54 O ATOM 2354 CB LEU B 53 11.003 18.458 2.523 1.00 71.32 C ATOM 2355 CG LEU B 53 11.137 19.981 2.527 1.00 24.34 C ATOM 2356 CD1 LEU B 53 12.589 20.390 2.339 1.00 64.42 C ATOM 2357 CD2 LEU B 53 10.263 20.595 1.443 1.00 70.41 C ATOM 0 H LEU B 53 12.668 16.648 1.778 1.00 63.51 H new ATOM 0 HA LEU B 53 12.442 18.407 4.119 1.00 30.02 H new ATOM 0 HB2 LEU B 53 11.156 18.102 1.504 1.00 71.32 H new ATOM 0 HB3 LEU B 53 9.980 18.202 2.800 1.00 71.32 H new ATOM 0 HG LEU B 53 10.799 20.354 3.494 1.00 24.34 H new ATOM 0 HD11 LEU B 53 12.664 21.477 2.345 1.00 64.42 H new ATOM 0 HD12 LEU B 53 13.190 19.980 3.151 1.00 64.42 H new ATOM 0 HD13 LEU B 53 12.955 20.006 1.387 1.00 64.42 H new ATOM 0 HD21 LEU B 53 10.370 21.680 1.460 1.00 70.41 H new ATOM 0 HD22 LEU B 53 10.571 20.215 0.469 1.00 70.41 H new ATOM 0 HD23 LEU B 53 9.221 20.331 1.623 1.00 70.41 H new ATOM 2369 N GLN B 54 11.189 15.435 3.858 1.00 45.30 N ATOM 2370 CA GLN B 54 10.482 14.378 4.572 1.00 4.44 C ATOM 2371 C GLN B 54 11.049 14.197 5.976 1.00 73.55 C ATOM 2372 O GLN B 54 10.413 13.595 6.843 1.00 22.03 O ATOM 2373 CB GLN B 54 10.575 13.061 3.798 1.00 31.43 C ATOM 2374 CG GLN B 54 11.968 12.454 3.796 1.00 54.24 C ATOM 2375 CD GLN B 54 11.995 11.057 3.208 1.00 53.44 C ATOM 2376 OE1 GLN B 54 11.294 10.869 2.096 1.00 62.11 O flip ATOM 2377 NE2 GLN B 54 12.637 10.156 3.748 1.00 32.34 N flip ATOM 0 H GLN B 54 11.681 15.123 3.021 1.00 45.30 H new ATOM 0 HA GLN B 54 9.435 14.668 4.657 1.00 4.44 H new ATOM 0 HB2 GLN B 54 9.876 12.345 4.231 1.00 31.43 H new ATOM 0 HB3 GLN B 54 10.260 13.231 2.768 1.00 31.43 H new ATOM 0 HG2 GLN B 54 12.639 13.097 3.227 1.00 54.24 H new ATOM 0 HG3 GLN B 54 12.348 12.422 4.817 1.00 54.24 H new ATOM 0 HE21 GLN B 54 13.162 10.345 4.602 1.00 32.34 H new ATOM 0 HE22 GLN B 54 12.644 9.221 3.341 1.00 32.34 H new ATOM 2386 N THR B 55 12.251 14.721 6.196 1.00 55.12 N ATOM 2387 CA THR B 55 12.905 14.616 7.495 1.00 13.51 C ATOM 2388 C THR B 55 12.082 15.299 8.581 1.00 42.11 C ATOM 2389 O THR B 55 11.316 16.228 8.322 1.00 72.25 O ATOM 2390 CB THR B 55 14.314 15.238 7.466 1.00 53.41 C ATOM 2391 OG1 THR B 55 14.367 16.286 6.491 1.00 50.54 O ATOM 2392 CG2 THR B 55 15.364 14.185 7.146 1.00 63.21 C ATOM 0 H THR B 55 12.792 15.222 5.491 1.00 55.12 H new ATOM 0 HA THR B 55 12.990 13.553 7.722 1.00 13.51 H new ATOM 0 HB THR B 55 14.526 15.650 8.453 1.00 53.41 H new ATOM 0 HG1 THR B 55 14.632 15.913 5.624 1.00 50.54 H new ATOM 0 HG21 THR B 55 16.351 14.648 7.131 1.00 63.21 H new ATOM 0 HG22 THR B 55 15.341 13.405 7.907 1.00 63.21 H new ATOM 0 HG23 THR B 55 15.154 13.747 6.170 1.00 63.21 H new ATOM 2400 N PRO B 56 12.242 14.832 9.828 1.00 31.25 N ATOM 2401 CA PRO B 56 11.522 15.385 10.979 1.00 41.22 C ATOM 2402 C PRO B 56 11.997 16.788 11.340 1.00 3.50 C ATOM 2403 O PRO B 56 11.229 17.598 11.859 1.00 61.54 O ATOM 2404 CB PRO B 56 11.850 14.403 12.107 1.00 43.23 C ATOM 2405 CG PRO B 56 13.151 13.793 11.712 1.00 22.11 C ATOM 2406 CD PRO B 56 13.138 13.727 10.210 1.00 60.25 C ATOM 0 HA PRO B 56 10.455 15.488 10.781 1.00 41.22 H new ATOM 0 HB2 PRO B 56 11.928 14.914 13.067 1.00 43.23 H new ATOM 0 HB3 PRO B 56 11.073 13.646 12.211 1.00 43.23 H new ATOM 0 HG2 PRO B 56 13.988 14.393 12.069 1.00 22.11 H new ATOM 0 HG3 PRO B 56 13.264 12.799 12.145 1.00 22.11 H new ATOM 0 HD2 PRO B 56 14.137 13.857 9.793 1.00 60.25 H new ATOM 0 HD3 PRO B 56 12.766 12.766 9.853 1.00 60.25 H new ATOM 2414 N GLN B 57 13.267 17.069 11.060 1.00 42.31 N ATOM 2415 CA GLN B 57 13.842 18.376 11.356 1.00 55.32 C ATOM 2416 C GLN B 57 13.376 19.418 10.346 1.00 1.51 C ATOM 2417 O GLN B 57 13.185 20.585 10.686 1.00 23.51 O ATOM 2418 CB GLN B 57 15.369 18.295 11.356 1.00 61.00 C ATOM 2419 CG GLN B 57 15.944 17.635 10.113 1.00 72.54 C ATOM 2420 CD GLN B 57 16.541 16.272 10.398 1.00 74.05 C ATOM 2421 OE1 GLN B 57 15.836 15.342 10.791 1.00 63.42 O ATOM 2422 NE2 GLN B 57 17.849 16.146 10.201 1.00 41.13 N ATOM 0 H GLN B 57 13.916 16.410 10.629 1.00 42.31 H new ATOM 0 HA GLN B 57 13.501 18.680 12.346 1.00 55.32 H new ATOM 0 HB2 GLN B 57 15.778 19.302 11.445 1.00 61.00 H new ATOM 0 HB3 GLN B 57 15.695 17.740 12.236 1.00 61.00 H new ATOM 0 HG2 GLN B 57 15.159 17.534 9.364 1.00 72.54 H new ATOM 0 HG3 GLN B 57 16.711 18.281 9.685 1.00 72.54 H new ATOM 0 HE21 GLN B 57 18.395 16.943 9.874 1.00 41.13 H new ATOM 0 HE22 GLN B 57 18.307 15.252 10.376 1.00 41.13 H new ATOM 2431 N PHE B 58 13.194 18.988 9.102 1.00 72.25 N ATOM 2432 CA PHE B 58 12.751 19.884 8.040 1.00 73.52 C ATOM 2433 C PHE B 58 11.275 19.664 7.723 1.00 1.21 C ATOM 2434 O PHE B 58 10.814 19.955 6.619 1.00 54.13 O ATOM 2435 CB PHE B 58 13.592 19.671 6.779 1.00 21.34 C ATOM 2436 CG PHE B 58 15.044 20.008 6.964 1.00 1.42 C ATOM 2437 CD1 PHE B 58 15.483 21.319 6.863 1.00 51.33 C ATOM 2438 CD2 PHE B 58 15.970 19.015 7.237 1.00 54.32 C ATOM 2439 CE1 PHE B 58 16.819 21.632 7.032 1.00 4.43 C ATOM 2440 CE2 PHE B 58 17.307 19.323 7.407 1.00 23.24 C ATOM 2441 CZ PHE B 58 17.732 20.633 7.303 1.00 13.33 C ATOM 0 H PHE B 58 13.346 18.024 8.804 1.00 72.25 H new ATOM 0 HA PHE B 58 12.881 20.909 8.387 1.00 73.52 H new ATOM 0 HB2 PHE B 58 13.506 18.631 6.466 1.00 21.34 H new ATOM 0 HB3 PHE B 58 13.185 20.282 5.973 1.00 21.34 H new ATOM 0 HD1 PHE B 58 14.773 22.105 6.650 1.00 51.33 H new ATOM 0 HD2 PHE B 58 15.644 17.989 7.318 1.00 54.32 H new ATOM 0 HE1 PHE B 58 17.148 22.658 6.952 1.00 4.43 H new ATOM 0 HE2 PHE B 58 18.019 18.540 7.621 1.00 23.24 H new ATOM 0 HZ PHE B 58 18.776 20.875 7.433 1.00 13.33 H new ATOM 2451 N THR B 59 10.537 19.147 8.701 1.00 3.42 N ATOM 2452 CA THR B 59 9.113 18.886 8.527 1.00 32.14 C ATOM 2453 C THR B 59 8.316 20.184 8.492 1.00 21.44 C ATOM 2454 O THR B 59 7.402 20.342 7.683 1.00 24.22 O ATOM 2455 CB THR B 59 8.565 17.990 9.654 1.00 53.35 C ATOM 2456 OG1 THR B 59 9.053 16.652 9.497 1.00 50.44 O ATOM 2457 CG2 THR B 59 7.043 17.984 9.649 1.00 63.52 C ATOM 0 H THR B 59 10.902 18.901 9.621 1.00 3.42 H new ATOM 0 HA THR B 59 9.000 18.369 7.574 1.00 32.14 H new ATOM 0 HB THR B 59 8.908 18.392 10.607 1.00 53.35 H new ATOM 0 HG1 THR B 59 9.674 16.617 8.740 1.00 50.44 H new ATOM 0 HG21 THR B 59 6.679 17.345 10.453 1.00 63.52 H new ATOM 0 HG22 THR B 59 6.675 18.999 9.797 1.00 63.52 H new ATOM 0 HG23 THR B 59 6.684 17.604 8.693 1.00 63.52 H new ATOM 2465 N LYS B 60 8.668 21.113 9.374 1.00 13.34 N ATOM 2466 CA LYS B 60 7.987 22.400 9.444 1.00 2.41 C ATOM 2467 C LYS B 60 8.284 23.241 8.207 1.00 33.42 C ATOM 2468 O LYS B 60 7.637 24.259 7.967 1.00 21.23 O ATOM 2469 CB LYS B 60 8.413 23.158 10.704 1.00 14.22 C ATOM 2470 CG LYS B 60 9.916 23.178 10.921 1.00 61.42 C ATOM 2471 CD LYS B 60 10.297 22.529 12.241 1.00 54.34 C ATOM 2472 CE LYS B 60 11.717 22.889 12.651 1.00 31.41 C ATOM 2473 NZ LYS B 60 12.356 21.805 13.449 1.00 31.11 N ATOM 0 H LYS B 60 9.422 20.998 10.051 1.00 13.34 H new ATOM 0 HA LYS B 60 6.914 22.213 9.485 1.00 2.41 H new ATOM 0 HB2 LYS B 60 8.049 24.184 10.641 1.00 14.22 H new ATOM 0 HB3 LYS B 60 7.935 22.703 11.571 1.00 14.22 H new ATOM 0 HG2 LYS B 60 10.410 22.656 10.102 1.00 61.42 H new ATOM 0 HG3 LYS B 60 10.273 24.208 10.904 1.00 61.42 H new ATOM 0 HD2 LYS B 60 9.601 22.847 13.018 1.00 54.34 H new ATOM 0 HD3 LYS B 60 10.206 21.446 12.155 1.00 54.34 H new ATOM 0 HE2 LYS B 60 12.314 23.084 11.760 1.00 31.41 H new ATOM 0 HE3 LYS B 60 11.704 23.810 13.234 1.00 31.41 H new ATOM 0 HZ1 LYS B 60 13.078 22.215 14.075 1.00 31.11 H new ATOM 0 HZ2 LYS B 60 11.634 21.324 14.022 1.00 31.11 H new ATOM 0 HZ3 LYS B 60 12.803 21.119 12.808 1.00 31.11 H new ATOM 2487 N TYR B 61 9.265 22.806 7.425 1.00 63.31 N ATOM 2488 CA TYR B 61 9.648 23.520 6.212 1.00 12.35 C ATOM 2489 C TYR B 61 9.334 22.691 4.970 1.00 43.03 C ATOM 2490 O TYR B 61 10.227 22.348 4.195 1.00 15.42 O ATOM 2491 CB TYR B 61 11.139 23.862 6.246 1.00 51.41 C ATOM 2492 CG TYR B 61 11.622 24.333 7.599 1.00 52.31 C ATOM 2493 CD1 TYR B 61 11.078 25.462 8.198 1.00 24.22 C ATOM 2494 CD2 TYR B 61 12.621 23.647 8.279 1.00 43.25 C ATOM 2495 CE1 TYR B 61 11.517 25.896 9.434 1.00 72.43 C ATOM 2496 CE2 TYR B 61 13.063 24.072 9.516 1.00 20.34 C ATOM 2497 CZ TYR B 61 12.509 25.198 10.090 1.00 62.03 C ATOM 2498 OH TYR B 61 12.949 25.625 11.322 1.00 73.32 O ATOM 0 H TYR B 61 9.809 21.963 7.609 1.00 63.31 H new ATOM 0 HA TYR B 61 9.071 24.443 6.167 1.00 12.35 H new ATOM 0 HB2 TYR B 61 11.712 22.983 5.951 1.00 51.41 H new ATOM 0 HB3 TYR B 61 11.342 24.637 5.507 1.00 51.41 H new ATOM 0 HD1 TYR B 61 10.299 26.010 7.689 1.00 24.22 H new ATOM 0 HD2 TYR B 61 13.059 22.767 7.832 1.00 43.25 H new ATOM 0 HE1 TYR B 61 11.085 26.778 9.884 1.00 72.43 H new ATOM 0 HE2 TYR B 61 13.839 23.526 10.032 1.00 20.34 H new ATOM 0 HH TYR B 61 13.650 25.021 11.646 1.00 73.32 H new ATOM 2508 N THR B 62 8.056 22.374 4.787 1.00 34.42 N ATOM 2509 CA THR B 62 7.621 21.586 3.640 1.00 72.42 C ATOM 2510 C THR B 62 7.077 22.481 2.533 1.00 31.24 C ATOM 2511 O THR B 62 7.700 22.634 1.481 1.00 31.52 O ATOM 2512 CB THR B 62 6.538 20.565 4.039 1.00 33.53 C ATOM 2513 OG1 THR B 62 6.204 20.720 5.422 1.00 23.01 O ATOM 2514 CG2 THR B 62 7.016 19.143 3.783 1.00 4.41 C ATOM 0 H THR B 62 7.304 22.651 5.418 1.00 34.42 H new ATOM 0 HA THR B 62 8.497 21.051 3.273 1.00 72.42 H new ATOM 0 HB THR B 62 5.653 20.750 3.430 1.00 33.53 H new ATOM 0 HG1 THR B 62 6.969 20.455 5.975 1.00 23.01 H new ATOM 0 HG21 THR B 62 6.235 18.439 4.072 1.00 4.41 H new ATOM 0 HG22 THR B 62 7.241 19.020 2.724 1.00 4.41 H new ATOM 0 HG23 THR B 62 7.914 18.950 4.370 1.00 4.41 H new ATOM 2522 N LEU B 63 5.911 23.070 2.774 1.00 12.13 N ATOM 2523 CA LEU B 63 5.282 23.952 1.797 1.00 1.11 C ATOM 2524 C LEU B 63 5.434 25.413 2.204 1.00 22.24 C ATOM 2525 O LEU B 63 4.991 26.315 1.493 1.00 42.13 O ATOM 2526 CB LEU B 63 3.801 23.604 1.646 1.00 73.21 C ATOM 2527 CG LEU B 63 2.840 24.331 2.588 1.00 75.31 C ATOM 2528 CD1 LEU B 63 2.204 25.521 1.886 1.00 21.21 C ATOM 2529 CD2 LEU B 63 1.771 23.378 3.100 1.00 54.43 C ATOM 0 H LEU B 63 5.382 22.953 3.638 1.00 12.13 H new ATOM 0 HA LEU B 63 5.782 23.808 0.839 1.00 1.11 H new ATOM 0 HB2 LEU B 63 3.502 23.816 0.620 1.00 73.21 H new ATOM 0 HB3 LEU B 63 3.683 22.531 1.797 1.00 73.21 H new ATOM 0 HG LEU B 63 3.408 24.699 3.442 1.00 75.31 H new ATOM 0 HD11 LEU B 63 1.523 26.026 2.571 1.00 21.21 H new ATOM 0 HD12 LEU B 63 2.982 26.215 1.570 1.00 21.21 H new ATOM 0 HD13 LEU B 63 1.650 25.175 1.013 1.00 21.21 H new ATOM 0 HD21 LEU B 63 1.097 23.913 3.769 1.00 54.43 H new ATOM 0 HD22 LEU B 63 1.206 22.979 2.258 1.00 54.43 H new ATOM 0 HD23 LEU B 63 2.243 22.558 3.641 1.00 54.43 H new ATOM 2541 N TRP B 64 6.063 25.640 3.352 1.00 1.21 N ATOM 2542 CA TRP B 64 6.275 26.993 3.853 1.00 43.23 C ATOM 2543 C TRP B 64 6.909 27.877 2.784 1.00 72.02 C ATOM 2544 O TRP B 64 6.746 29.097 2.797 1.00 64.33 O ATOM 2545 CB TRP B 64 7.163 26.964 5.099 1.00 62.22 C ATOM 2546 CG TRP B 64 8.598 27.283 4.813 1.00 4.30 C ATOM 2547 CD1 TRP B 64 9.291 28.385 5.223 1.00 74.40 C ATOM 2548 CD2 TRP B 64 9.517 26.489 4.053 1.00 4.15 C ATOM 2549 NE1 TRP B 64 10.585 28.326 4.764 1.00 54.00 N ATOM 2550 CE2 TRP B 64 10.749 27.173 4.043 1.00 33.35 C ATOM 2551 CE3 TRP B 64 9.419 25.269 3.381 1.00 30.31 C ATOM 2552 CZ2 TRP B 64 11.872 26.674 3.388 1.00 50.25 C ATOM 2553 CZ3 TRP B 64 10.534 24.775 2.730 1.00 42.23 C ATOM 2554 CH2 TRP B 64 11.748 25.476 2.738 1.00 30.42 C ATOM 0 H TRP B 64 6.435 24.905 3.953 1.00 1.21 H new ATOM 0 HA TRP B 64 5.304 27.412 4.116 1.00 43.23 H new ATOM 0 HB2 TRP B 64 6.778 27.678 5.827 1.00 62.22 H new ATOM 0 HB3 TRP B 64 7.102 25.977 5.557 1.00 62.22 H new ATOM 0 HD1 TRP B 64 8.882 29.186 5.821 1.00 74.40 H new ATOM 0 HE1 TRP B 64 11.306 29.027 4.933 1.00 54.00 H new ATOM 0 HE3 TRP B 64 8.488 24.721 3.370 1.00 30.31 H new ATOM 0 HZ2 TRP B 64 12.808 27.213 3.393 1.00 50.25 H new ATOM 0 HZ3 TRP B 64 10.469 23.833 2.206 1.00 42.23 H new ATOM 0 HH2 TRP B 64 12.602 25.063 2.221 1.00 30.42 H new ATOM 2565 N PHE B 65 7.630 27.254 1.858 1.00 3.22 N ATOM 2566 CA PHE B 65 8.288 27.984 0.781 1.00 51.24 C ATOM 2567 C PHE B 65 7.823 27.479 -0.582 1.00 44.13 C ATOM 2568 O PHE B 65 7.782 28.233 -1.554 1.00 61.53 O ATOM 2569 CB PHE B 65 9.807 27.847 0.898 1.00 33.14 C ATOM 2570 CG PHE B 65 10.487 29.099 1.374 1.00 11.11 C ATOM 2571 CD1 PHE B 65 9.884 29.915 2.317 1.00 22.30 C ATOM 2572 CD2 PHE B 65 11.729 29.461 0.878 1.00 2.15 C ATOM 2573 CE1 PHE B 65 10.507 31.067 2.758 1.00 2.32 C ATOM 2574 CE2 PHE B 65 12.357 30.612 1.315 1.00 4.54 C ATOM 2575 CZ PHE B 65 11.744 31.417 2.256 1.00 1.24 C ATOM 0 H PHE B 65 7.774 26.244 1.832 1.00 3.22 H new ATOM 0 HA PHE B 65 8.017 29.036 0.870 1.00 51.24 H new ATOM 0 HB2 PHE B 65 10.039 27.034 1.586 1.00 33.14 H new ATOM 0 HB3 PHE B 65 10.215 27.569 -0.074 1.00 33.14 H new ATOM 0 HD1 PHE B 65 8.915 29.648 2.712 1.00 22.30 H new ATOM 0 HD2 PHE B 65 12.212 28.836 0.141 1.00 2.15 H new ATOM 0 HE1 PHE B 65 10.026 31.693 3.495 1.00 2.32 H new ATOM 0 HE2 PHE B 65 13.326 30.882 0.921 1.00 4.54 H new ATOM 0 HZ PHE B 65 12.232 32.318 2.598 1.00 1.24 H new ATOM 2585 N MET B 66 7.476 26.198 -0.645 1.00 55.55 N ATOM 2586 CA MET B 66 7.014 25.592 -1.888 1.00 63.34 C ATOM 2587 C MET B 66 5.868 26.396 -2.492 1.00 2.10 C ATOM 2588 O MET B 66 5.737 26.493 -3.713 1.00 23.20 O ATOM 2589 CB MET B 66 6.567 24.149 -1.642 1.00 52.14 C ATOM 2590 CG MET B 66 6.966 23.192 -2.754 1.00 45.22 C ATOM 2591 SD MET B 66 5.592 22.164 -3.310 1.00 33.32 S ATOM 2592 CE MET B 66 4.521 23.400 -4.044 1.00 54.53 C ATOM 0 H MET B 66 7.506 25.560 0.150 1.00 55.55 H new ATOM 0 HA MET B 66 7.845 25.592 -2.593 1.00 63.34 H new ATOM 0 HB2 MET B 66 6.995 23.800 -0.702 1.00 52.14 H new ATOM 0 HB3 MET B 66 5.483 24.127 -1.526 1.00 52.14 H new ATOM 0 HG2 MET B 66 7.353 23.763 -3.598 1.00 45.22 H new ATOM 0 HG3 MET B 66 7.776 22.552 -2.404 1.00 45.22 H new ATOM 0 HE1 MET B 66 4.111 23.017 -4.979 1.00 54.53 H new ATOM 0 HE2 MET B 66 3.706 23.629 -3.357 1.00 54.53 H new ATOM 0 HE3 MET B 66 5.094 24.306 -4.243 1.00 54.53 H new ATOM 2602 N THR B 67 5.036 26.972 -1.629 1.00 4.01 N ATOM 2603 CA THR B 67 3.899 27.766 -2.077 1.00 64.01 C ATOM 2604 C THR B 67 3.850 29.110 -1.359 1.00 4.11 C ATOM 2605 O THR B 67 2.927 29.898 -1.559 1.00 25.32 O ATOM 2606 CB THR B 67 2.569 27.025 -1.845 1.00 50.32 C ATOM 2607 OG1 THR B 67 2.700 25.651 -2.230 1.00 43.04 O ATOM 2608 CG2 THR B 67 1.443 27.672 -2.636 1.00 73.01 C ATOM 0 H THR B 67 5.129 26.903 -0.616 1.00 4.01 H new ATOM 0 HA THR B 67 4.032 27.932 -3.146 1.00 64.01 H new ATOM 0 HB THR B 67 2.327 27.084 -0.784 1.00 50.32 H new ATOM 0 HG1 THR B 67 1.851 25.186 -2.078 1.00 43.04 H new ATOM 0 HG21 THR B 67 0.514 27.131 -2.456 1.00 73.01 H new ATOM 0 HG22 THR B 67 1.326 28.709 -2.321 1.00 73.01 H new ATOM 0 HG23 THR B 67 1.681 27.641 -3.699 1.00 73.01 H new ATOM 2616 N ASN B 68 4.851 29.366 -0.523 1.00 11.41 N ATOM 2617 CA ASN B 68 4.922 30.616 0.225 1.00 74.22 C ATOM 2618 C ASN B 68 3.743 30.743 1.185 1.00 14.40 C ATOM 2619 O ASN B 68 3.124 31.802 1.286 1.00 0.14 O ATOM 2620 CB ASN B 68 4.943 31.808 -0.735 1.00 72.14 C ATOM 2621 CG ASN B 68 5.827 32.935 -0.236 1.00 24.42 C ATOM 2622 OD1 ASN B 68 5.345 34.023 0.077 1.00 31.00 O ATOM 2623 ND2 ASN B 68 7.128 32.678 -0.162 1.00 25.24 N ATOM 0 H ASN B 68 5.624 28.725 -0.347 1.00 11.41 H new ATOM 0 HA ASN B 68 5.843 30.610 0.808 1.00 74.22 H new ATOM 0 HB2 ASN B 68 5.296 31.478 -1.712 1.00 72.14 H new ATOM 0 HB3 ASN B 68 3.927 32.179 -0.872 1.00 72.14 H new ATOM 0 HD21 ASN B 68 7.772 33.398 0.165 1.00 25.24 H new ATOM 0 HD22 ASN B 68 7.483 31.761 -0.432 1.00 25.24 H new ATOM 2630 N GLN B 69 3.441 29.656 1.888 1.00 42.21 N ATOM 2631 CA GLN B 69 2.336 29.646 2.840 1.00 70.13 C ATOM 2632 C GLN B 69 2.698 28.844 4.085 1.00 10.34 C ATOM 2633 O GLN B 69 2.804 27.618 4.036 1.00 41.40 O ATOM 2634 CB GLN B 69 1.080 29.062 2.190 1.00 35.41 C ATOM 2635 CG GLN B 69 -0.197 29.361 2.959 1.00 60.42 C ATOM 2636 CD GLN B 69 -0.876 30.632 2.488 1.00 22.34 C ATOM 2637 OE1 GLN B 69 -1.389 30.700 1.371 1.00 42.13 O ATOM 2638 NE2 GLN B 69 -0.885 31.649 3.342 1.00 14.11 N ATOM 0 H GLN B 69 3.945 28.772 1.817 1.00 42.21 H new ATOM 0 HA GLN B 69 2.137 30.675 3.138 1.00 70.13 H new ATOM 0 HB2 GLN B 69 0.987 29.458 1.179 1.00 35.41 H new ATOM 0 HB3 GLN B 69 1.196 27.982 2.100 1.00 35.41 H new ATOM 0 HG2 GLN B 69 -0.886 28.524 2.851 1.00 60.42 H new ATOM 0 HG3 GLN B 69 0.034 29.449 4.021 1.00 60.42 H new ATOM 0 HE21 GLN B 69 -0.448 31.549 4.258 1.00 14.11 H new ATOM 0 HE22 GLN B 69 -1.329 32.530 3.082 1.00 14.11 H new ATOM 2647 N ILE B 70 2.887 29.544 5.199 1.00 24.34 N ATOM 2648 CA ILE B 70 3.237 28.896 6.457 1.00 24.43 C ATOM 2649 C ILE B 70 2.014 28.249 7.101 1.00 41.10 C ATOM 2650 O ILE B 70 0.980 28.891 7.276 1.00 43.13 O ATOM 2651 CB ILE B 70 3.857 29.896 7.451 1.00 12.12 C ATOM 2652 CG1 ILE B 70 2.929 31.096 7.648 1.00 1.24 C ATOM 2653 CG2 ILE B 70 5.224 30.351 6.961 1.00 40.03 C ATOM 2654 CD1 ILE B 70 2.379 31.211 9.052 1.00 23.21 C ATOM 0 H ILE B 70 2.804 30.559 5.256 1.00 24.34 H new ATOM 0 HA ILE B 70 3.972 28.126 6.222 1.00 24.43 H new ATOM 0 HB ILE B 70 3.984 29.398 8.412 1.00 12.12 H new ATOM 0 HG12 ILE B 70 3.472 32.009 7.403 1.00 1.24 H new ATOM 0 HG13 ILE B 70 2.098 31.022 6.946 1.00 1.24 H new ATOM 0 HG21 ILE B 70 5.649 31.057 7.674 1.00 40.03 H new ATOM 0 HG22 ILE B 70 5.883 29.488 6.868 1.00 40.03 H new ATOM 0 HG23 ILE B 70 5.120 30.834 5.990 1.00 40.03 H new ATOM 0 HD11 ILE B 70 1.730 32.084 9.118 1.00 23.21 H new ATOM 0 HD12 ILE B 70 1.808 30.315 9.294 1.00 23.21 H new ATOM 0 HD13 ILE B 70 3.203 31.317 9.758 1.00 23.21 H new ATOM 2666 N ALA B 71 2.144 26.973 7.451 1.00 31.41 N ATOM 2667 CA ALA B 71 1.051 26.240 8.078 1.00 42.14 C ATOM 2668 C ALA B 71 1.398 25.862 9.514 1.00 13.21 C ATOM 2669 O ALA B 71 1.670 24.702 9.828 1.00 44.11 O ATOM 2670 CB ALA B 71 0.717 24.995 7.268 1.00 21.42 C ATOM 0 H ALA B 71 2.994 26.427 7.311 1.00 31.41 H new ATOM 0 HA ALA B 71 0.176 26.890 8.102 1.00 42.14 H new ATOM 0 HB1 ALA B 71 -0.101 24.457 7.748 1.00 21.42 H new ATOM 0 HB2 ALA B 71 0.419 25.285 6.261 1.00 21.42 H new ATOM 0 HB3 ALA B 71 1.594 24.350 7.215 1.00 21.42 H new ATOM 2676 N PRO B 72 1.389 26.860 10.409 1.00 64.10 N ATOM 2677 CA PRO B 72 1.701 26.657 11.827 1.00 11.04 C ATOM 2678 C PRO B 72 0.616 25.868 12.551 1.00 33.42 C ATOM 2679 O PRO B 72 0.847 25.327 13.632 1.00 25.43 O ATOM 2680 CB PRO B 72 1.786 28.081 12.380 1.00 2.43 C ATOM 2681 CG PRO B 72 0.936 28.894 11.465 1.00 51.11 C ATOM 2682 CD PRO B 72 1.074 28.267 10.105 1.00 31.23 C ATOM 0 HA PRO B 72 2.614 26.077 11.964 1.00 11.04 H new ATOM 0 HB2 PRO B 72 1.422 28.130 13.406 1.00 2.43 H new ATOM 0 HB3 PRO B 72 2.815 28.441 12.389 1.00 2.43 H new ATOM 0 HG2 PRO B 72 -0.104 28.891 11.792 1.00 51.11 H new ATOM 0 HG3 PRO B 72 1.262 29.934 11.450 1.00 51.11 H new ATOM 0 HD2 PRO B 72 0.155 28.357 9.526 1.00 31.23 H new ATOM 0 HD3 PRO B 72 1.865 28.739 9.523 1.00 31.23 H new ATOM 2690 N GLU B 73 -0.567 25.807 11.948 1.00 4.23 N ATOM 2691 CA GLU B 73 -1.688 25.084 12.538 1.00 61.34 C ATOM 2692 C GLU B 73 -1.362 23.600 12.684 1.00 54.44 C ATOM 2693 O GLU B 73 -1.958 22.900 13.501 1.00 31.22 O ATOM 2694 CB GLU B 73 -2.945 25.260 11.682 1.00 60.13 C ATOM 2695 CG GLU B 73 -3.299 26.713 11.413 1.00 64.33 C ATOM 2696 CD GLU B 73 -3.387 27.537 12.683 1.00 11.13 C ATOM 2697 OE1 GLU B 73 -3.868 27.001 13.704 1.00 41.10 O ATOM 2698 OE2 GLU B 73 -2.979 28.716 12.655 1.00 33.02 O ATOM 0 H GLU B 73 -0.774 26.249 11.052 1.00 4.23 H new ATOM 0 HA GLU B 73 -1.872 25.497 13.530 1.00 61.34 H new ATOM 0 HB2 GLU B 73 -2.801 24.748 10.731 1.00 60.13 H new ATOM 0 HB3 GLU B 73 -3.785 24.776 12.181 1.00 60.13 H new ATOM 0 HG2 GLU B 73 -2.550 27.149 10.753 1.00 64.33 H new ATOM 0 HG3 GLU B 73 -4.253 26.759 10.887 1.00 64.33 H new ATOM 2705 N SER B 74 -0.411 23.129 11.884 1.00 3.13 N ATOM 2706 CA SER B 74 -0.008 21.727 11.919 1.00 54.43 C ATOM 2707 C SER B 74 1.429 21.588 12.414 1.00 41.34 C ATOM 2708 O SER B 74 1.802 20.567 12.991 1.00 62.25 O ATOM 2709 CB SER B 74 -0.144 21.100 10.531 1.00 12.33 C ATOM 2710 OG SER B 74 -0.875 21.945 9.659 1.00 21.43 O ATOM 0 H SER B 74 0.095 23.697 11.204 1.00 3.13 H new ATOM 0 HA SER B 74 -0.666 21.202 12.612 1.00 54.43 H new ATOM 0 HB2 SER B 74 0.846 20.912 10.115 1.00 12.33 H new ATOM 0 HB3 SER B 74 -0.645 20.135 10.612 1.00 12.33 H new ATOM 0 HG SER B 74 -0.420 21.994 8.793 1.00 21.43 H new ATOM 2716 N GLY B 75 2.231 22.623 12.184 1.00 32.12 N ATOM 2717 CA GLY B 75 3.617 22.598 12.612 1.00 40.12 C ATOM 2718 C GLY B 75 4.573 23.005 11.508 1.00 61.53 C ATOM 2719 O GLY B 75 5.672 22.463 11.400 1.00 74.03 O ATOM 0 H GLY B 75 1.945 23.479 11.709 1.00 32.12 H new ATOM 0 HA2 GLY B 75 3.743 23.268 13.463 1.00 40.12 H new ATOM 0 HA3 GLY B 75 3.870 21.595 12.956 1.00 40.12 H new ATOM 2723 N GLN B 76 4.151 23.960 10.685 1.00 5.14 N ATOM 2724 CA GLN B 76 4.977 24.438 9.583 1.00 30.43 C ATOM 2725 C GLN B 76 5.145 25.952 9.645 1.00 1.04 C ATOM 2726 O GLN B 76 4.166 26.698 9.592 1.00 20.13 O ATOM 2727 CB GLN B 76 4.357 24.037 8.243 1.00 34.10 C ATOM 2728 CG GLN B 76 4.795 22.665 7.757 1.00 32.22 C ATOM 2729 CD GLN B 76 4.177 21.536 8.559 1.00 51.40 C ATOM 2730 OE1 GLN B 76 3.180 21.728 9.257 1.00 11.02 O ATOM 2731 NE2 GLN B 76 4.765 20.349 8.465 1.00 72.22 N ATOM 0 H GLN B 76 3.242 24.417 10.761 1.00 5.14 H new ATOM 0 HA GLN B 76 5.961 23.978 9.673 1.00 30.43 H new ATOM 0 HB2 GLN B 76 3.271 24.051 8.336 1.00 34.10 H new ATOM 0 HB3 GLN B 76 4.622 24.781 7.492 1.00 34.10 H new ATOM 0 HG2 GLN B 76 4.522 22.552 6.708 1.00 32.22 H new ATOM 0 HG3 GLN B 76 5.881 22.593 7.814 1.00 32.22 H new ATOM 0 HE21 GLN B 76 5.589 20.233 7.875 1.00 72.22 H new ATOM 0 HE22 GLN B 76 4.392 19.553 8.983 1.00 72.22 H new ATOM 2740 N ILE B 77 6.391 26.400 9.758 1.00 41.52 N ATOM 2741 CA ILE B 77 6.687 27.826 9.827 1.00 50.31 C ATOM 2742 C ILE B 77 8.001 28.149 9.125 1.00 5.22 C ATOM 2743 O ILE B 77 8.744 27.250 8.732 1.00 61.33 O ATOM 2744 CB ILE B 77 6.763 28.316 11.285 1.00 44.11 C ATOM 2745 CG1 ILE B 77 8.096 27.908 11.914 1.00 70.24 C ATOM 2746 CG2 ILE B 77 5.598 27.759 12.092 1.00 64.41 C ATOM 2747 CD1 ILE B 77 8.326 26.413 11.927 1.00 2.32 C ATOM 0 H ILE B 77 7.212 25.796 9.804 1.00 41.52 H new ATOM 0 HA ILE B 77 5.871 28.342 9.321 1.00 50.31 H new ATOM 0 HB ILE B 77 6.698 29.404 11.291 1.00 44.11 H new ATOM 0 HG12 ILE B 77 8.908 28.388 11.368 1.00 70.24 H new ATOM 0 HG13 ILE B 77 8.135 28.282 12.937 1.00 70.24 H new ATOM 0 HG21 ILE B 77 5.665 28.114 13.120 1.00 64.41 H new ATOM 0 HG22 ILE B 77 4.658 28.094 11.653 1.00 64.41 H new ATOM 0 HG23 ILE B 77 5.636 26.670 12.081 1.00 64.41 H new ATOM 0 HD11 ILE B 77 9.290 26.197 12.387 1.00 2.32 H new ATOM 0 HD12 ILE B 77 7.534 25.928 12.498 1.00 2.32 H new ATOM 0 HD13 ILE B 77 8.319 26.035 10.905 1.00 2.32 H new ATOM 2759 N ALA B 78 8.283 29.439 8.972 1.00 60.23 N ATOM 2760 CA ALA B 78 9.509 29.881 8.321 1.00 30.33 C ATOM 2761 C ALA B 78 10.604 30.160 9.345 1.00 42.43 C ATOM 2762 O ALA B 78 10.374 30.778 10.384 1.00 1.45 O ATOM 2763 CB ALA B 78 9.243 31.121 7.480 1.00 22.31 C ATOM 0 H ALA B 78 7.678 30.196 9.290 1.00 60.23 H new ATOM 0 HA ALA B 78 9.853 29.079 7.668 1.00 30.33 H new ATOM 0 HB1 ALA B 78 10.168 31.440 7.000 1.00 22.31 H new ATOM 0 HB2 ALA B 78 8.499 30.891 6.718 1.00 22.31 H new ATOM 0 HB3 ALA B 78 8.872 31.922 8.120 1.00 22.31 H new ATOM 2769 N PRO B 79 11.826 29.692 9.048 1.00 54.52 N ATOM 2770 CA PRO B 79 12.982 29.879 9.930 1.00 53.33 C ATOM 2771 C PRO B 79 13.443 31.331 9.982 1.00 52.42 C ATOM 2772 O PRO B 79 12.761 32.226 9.484 1.00 11.10 O ATOM 2773 CB PRO B 79 14.059 28.998 9.294 1.00 0.21 C ATOM 2774 CG PRO B 79 13.676 28.907 7.857 1.00 1.12 C ATOM 2775 CD PRO B 79 12.173 28.946 7.827 1.00 63.55 C ATOM 0 HA PRO B 79 12.753 29.617 10.963 1.00 53.33 H new ATOM 0 HB2 PRO B 79 15.050 29.437 9.412 1.00 0.21 H new ATOM 0 HB3 PRO B 79 14.089 28.012 9.759 1.00 0.21 H new ATOM 0 HG2 PRO B 79 14.099 29.734 7.287 1.00 1.12 H new ATOM 0 HG3 PRO B 79 14.052 27.986 7.410 1.00 1.12 H new ATOM 0 HD2 PRO B 79 11.802 29.445 6.932 1.00 63.55 H new ATOM 0 HD3 PRO B 79 11.745 27.944 7.833 1.00 63.55 H new ATOM 2783 N ALA B 80 14.604 31.557 10.587 1.00 25.42 N ATOM 2784 CA ALA B 80 15.158 32.901 10.700 1.00 0.54 C ATOM 2785 C ALA B 80 15.792 33.346 9.387 1.00 35.22 C ATOM 2786 O ALA B 80 15.440 34.392 8.839 1.00 62.14 O ATOM 2787 CB ALA B 80 16.178 32.958 11.827 1.00 73.13 C ATOM 0 H ALA B 80 15.180 30.827 11.007 1.00 25.42 H new ATOM 0 HA ALA B 80 14.341 33.586 10.929 1.00 0.54 H new ATOM 0 HB1 ALA B 80 16.584 33.967 11.900 1.00 73.13 H new ATOM 0 HB2 ALA B 80 15.696 32.692 12.768 1.00 73.13 H new ATOM 0 HB3 ALA B 80 16.986 32.256 11.622 1.00 73.13 H new ATOM 2793 N LEU B 81 16.729 32.549 8.888 1.00 30.02 N ATOM 2794 CA LEU B 81 17.414 32.861 7.638 1.00 34.04 C ATOM 2795 C LEU B 81 16.417 33.014 6.494 1.00 42.43 C ATOM 2796 O LEU B 81 16.679 33.717 5.519 1.00 23.42 O ATOM 2797 CB LEU B 81 18.429 31.768 7.302 1.00 64.45 C ATOM 2798 CG LEU B 81 19.510 31.510 8.352 1.00 64.45 C ATOM 2799 CD1 LEU B 81 19.544 30.038 8.733 1.00 35.40 C ATOM 2800 CD2 LEU B 81 20.870 31.961 7.838 1.00 62.22 C ATOM 0 H LEU B 81 17.033 31.681 9.330 1.00 30.02 H new ATOM 0 HA LEU B 81 17.939 33.808 7.767 1.00 34.04 H new ATOM 0 HB2 LEU B 81 17.888 30.838 7.131 1.00 64.45 H new ATOM 0 HB3 LEU B 81 18.918 32.030 6.363 1.00 64.45 H new ATOM 0 HG LEU B 81 19.270 32.089 9.243 1.00 64.45 H new ATOM 0 HD11 LEU B 81 20.319 29.874 9.481 1.00 35.40 H new ATOM 0 HD12 LEU B 81 18.577 29.746 9.142 1.00 35.40 H new ATOM 0 HD13 LEU B 81 19.760 29.438 7.849 1.00 35.40 H new ATOM 0 HD21 LEU B 81 21.628 31.770 8.598 1.00 62.22 H new ATOM 0 HD22 LEU B 81 21.118 31.409 6.932 1.00 62.22 H new ATOM 0 HD23 LEU B 81 20.840 33.028 7.616 1.00 62.22 H new ATOM 2812 N ALA B 82 15.271 32.353 6.623 1.00 60.51 N ATOM 2813 CA ALA B 82 14.232 32.419 5.602 1.00 44.45 C ATOM 2814 C ALA B 82 13.913 33.865 5.235 1.00 20.32 C ATOM 2815 O ALA B 82 13.881 34.225 4.059 1.00 2.23 O ATOM 2816 CB ALA B 82 12.976 31.706 6.080 1.00 40.20 C ATOM 0 H ALA B 82 15.039 31.766 7.424 1.00 60.51 H new ATOM 0 HA ALA B 82 14.604 31.918 4.708 1.00 44.45 H new ATOM 0 HB1 ALA B 82 12.209 31.763 5.308 1.00 40.20 H new ATOM 0 HB2 ALA B 82 13.207 30.661 6.285 1.00 40.20 H new ATOM 0 HB3 ALA B 82 12.611 32.182 6.990 1.00 40.20 H new ATOM 2822 N HIS B 83 13.677 34.690 6.251 1.00 22.34 N ATOM 2823 CA HIS B 83 13.360 36.097 6.034 1.00 63.42 C ATOM 2824 C HIS B 83 12.096 36.247 5.194 1.00 41.50 C ATOM 2825 O HIS B 83 11.889 37.270 4.541 1.00 61.44 O ATOM 2826 CB HIS B 83 14.530 36.805 5.349 1.00 44.31 C ATOM 2827 CG HIS B 83 15.538 37.361 6.307 1.00 73.22 C ATOM 2828 ND1 HIS B 83 15.202 38.191 7.355 1.00 55.33 N ATOM 2829 CD2 HIS B 83 16.880 37.200 6.371 1.00 3.54 C ATOM 2830 CE1 HIS B 83 16.295 38.519 8.022 1.00 61.52 C ATOM 2831 NE2 HIS B 83 17.327 37.930 7.446 1.00 31.24 N ATOM 0 H HIS B 83 13.699 34.409 7.231 1.00 22.34 H new ATOM 0 HA HIS B 83 13.184 36.558 7.006 1.00 63.42 H new ATOM 0 HB2 HIS B 83 15.026 36.103 4.679 1.00 44.31 H new ATOM 0 HB3 HIS B 83 14.142 37.615 4.732 1.00 44.31 H new ATOM 0 HD2 HIS B 83 17.487 36.608 5.702 1.00 3.54 H new ATOM 0 HE1 HIS B 83 16.337 39.160 8.890 1.00 61.52 H new ATOM 0 HE2 HIS B 83 18.298 38.005 7.750 1.00 31.24 H new ATOM 2839 N PHE B 84 11.253 35.219 5.214 1.00 53.42 N ATOM 2840 CA PHE B 84 10.010 35.236 4.452 1.00 42.43 C ATOM 2841 C PHE B 84 8.823 34.871 5.339 1.00 52.55 C ATOM 2842 O PHE B 84 8.968 34.700 6.549 1.00 52.41 O ATOM 2843 CB PHE B 84 10.096 34.265 3.273 1.00 71.00 C ATOM 2844 CG PHE B 84 10.179 34.948 1.938 1.00 12.12 C ATOM 2845 CD1 PHE B 84 9.028 35.326 1.265 1.00 2.13 C ATOM 2846 CD2 PHE B 84 11.409 35.212 1.356 1.00 61.02 C ATOM 2847 CE1 PHE B 84 9.102 35.956 0.037 1.00 63.12 C ATOM 2848 CE2 PHE B 84 11.488 35.842 0.128 1.00 75.43 C ATOM 2849 CZ PHE B 84 10.333 36.213 -0.533 1.00 4.43 C ATOM 0 H PHE B 84 11.408 34.365 5.749 1.00 53.42 H new ATOM 0 HA PHE B 84 9.861 36.247 4.072 1.00 42.43 H new ATOM 0 HB2 PHE B 84 10.971 33.628 3.401 1.00 71.00 H new ATOM 0 HB3 PHE B 84 9.222 33.613 3.285 1.00 71.00 H new ATOM 0 HD1 PHE B 84 8.062 35.126 1.705 1.00 2.13 H new ATOM 0 HD2 PHE B 84 12.315 34.922 1.867 1.00 61.02 H new ATOM 0 HE1 PHE B 84 8.197 36.247 -0.476 1.00 63.12 H new ATOM 0 HE2 PHE B 84 12.452 36.044 -0.314 1.00 75.43 H new ATOM 0 HZ PHE B 84 10.393 36.703 -1.494 1.00 4.43 H new ATOM 2859 N GLY B 85 7.648 34.755 4.728 1.00 21.14 N ATOM 2860 CA GLY B 85 6.453 34.412 5.477 1.00 12.21 C ATOM 2861 C GLY B 85 5.188 34.585 4.661 1.00 31.01 C ATOM 2862 O GLY B 85 5.246 34.746 3.442 1.00 44.13 O ATOM 0 H GLY B 85 7.502 34.892 3.728 1.00 21.14 H new ATOM 0 HA2 GLY B 85 6.525 33.379 5.816 1.00 12.21 H new ATOM 0 HA3 GLY B 85 6.395 35.037 6.368 1.00 12.21 H new ATOM 2866 N GLN B 86 4.042 34.549 5.332 1.00 3.43 N ATOM 2867 CA GLN B 86 2.758 34.700 4.660 1.00 12.21 C ATOM 2868 C GLN B 86 2.327 36.164 4.631 1.00 13.14 C ATOM 2869 O GLN B 86 3.036 37.038 5.126 1.00 55.43 O ATOM 2870 CB GLN B 86 1.689 33.857 5.359 1.00 53.42 C ATOM 2871 CG GLN B 86 1.480 34.226 6.818 1.00 53.00 C ATOM 2872 CD GLN B 86 0.141 34.893 7.065 1.00 33.32 C ATOM 2873 OE1 GLN B 86 -0.913 34.283 6.881 1.00 54.14 O ATOM 2874 NE2 GLN B 86 0.175 36.153 7.483 1.00 34.34 N ATOM 0 H GLN B 86 3.977 34.416 6.341 1.00 3.43 H new ATOM 0 HA GLN B 86 2.872 34.352 3.633 1.00 12.21 H new ATOM 0 HB2 GLN B 86 0.745 33.968 4.826 1.00 53.42 H new ATOM 0 HB3 GLN B 86 1.969 32.805 5.295 1.00 53.42 H new ATOM 0 HG2 GLN B 86 1.552 33.327 7.430 1.00 53.00 H new ATOM 0 HG3 GLN B 86 2.279 34.895 7.138 1.00 53.00 H new ATOM 0 HE21 GLN B 86 1.071 36.620 7.622 1.00 34.34 H new ATOM 0 HE22 GLN B 86 -0.695 36.654 7.665 1.00 34.34 H new ATOM 2883 N ASN B 87 1.162 36.421 4.047 1.00 61.14 N ATOM 2884 CA ASN B 87 0.637 37.779 3.952 1.00 22.41 C ATOM 2885 C ASN B 87 -0.885 37.768 3.846 1.00 34.44 C ATOM 2886 O ASN B 87 -1.451 38.239 2.860 1.00 43.53 O ATOM 2887 CB ASN B 87 1.239 38.496 2.743 1.00 1.54 C ATOM 2888 CG ASN B 87 1.177 40.006 2.877 1.00 64.20 C ATOM 2889 OD1 ASN B 87 0.413 40.672 2.178 1.00 64.54 O ATOM 2890 ND2 ASN B 87 1.985 40.553 3.778 1.00 70.15 N ATOM 0 H ASN B 87 0.563 35.707 3.632 1.00 61.14 H new ATOM 0 HA ASN B 87 0.916 38.314 4.860 1.00 22.41 H new ATOM 0 HB2 ASN B 87 2.277 38.187 2.620 1.00 1.54 H new ATOM 0 HB3 ASN B 87 0.707 38.192 1.841 1.00 1.54 H new ATOM 0 HD21 ASN B 87 1.989 41.564 3.913 1.00 70.15 H new ATOM 0 HD22 ASN B 87 2.602 39.962 4.335 1.00 70.15 H new ATOM 2897 N GLU B 88 -1.541 37.227 4.868 1.00 72.14 N ATOM 2898 CA GLU B 88 -2.996 37.155 4.889 1.00 60.50 C ATOM 2899 C GLU B 88 -3.504 36.795 6.282 1.00 51.31 C ATOM 2900 O GLU B 88 -2.721 36.644 7.221 1.00 64.11 O ATOM 2901 CB GLU B 88 -3.493 36.125 3.872 1.00 11.22 C ATOM 2902 CG GLU B 88 -2.871 34.749 4.046 1.00 72.12 C ATOM 2903 CD GLU B 88 -3.744 33.640 3.492 1.00 70.14 C ATOM 2904 OE1 GLU B 88 -4.728 33.266 4.166 1.00 44.44 O ATOM 2905 OE2 GLU B 88 -3.444 33.144 2.386 1.00 31.35 O ATOM 0 H GLU B 88 -1.087 36.832 5.692 1.00 72.14 H new ATOM 0 HA GLU B 88 -3.386 38.137 4.622 1.00 60.50 H new ATOM 0 HB2 GLU B 88 -4.576 36.038 3.955 1.00 11.22 H new ATOM 0 HB3 GLU B 88 -3.279 36.487 2.866 1.00 11.22 H new ATOM 0 HG2 GLU B 88 -1.902 34.727 3.548 1.00 72.12 H new ATOM 0 HG3 GLU B 88 -2.689 34.568 5.105 1.00 72.12 H new ATOM 2912 N THR B 89 -4.821 36.661 6.411 1.00 72.22 N ATOM 2913 CA THR B 89 -5.433 36.322 7.688 1.00 72.03 C ATOM 2914 C THR B 89 -4.981 34.947 8.168 1.00 64.32 C ATOM 2915 O THR B 89 -4.271 34.829 9.166 1.00 11.41 O ATOM 2916 CB THR B 89 -6.971 36.341 7.596 1.00 44.43 C ATOM 2917 OG1 THR B 89 -7.417 37.613 7.115 1.00 72.23 O ATOM 2918 CG2 THR B 89 -7.598 36.058 8.953 1.00 55.41 C ATOM 0 H THR B 89 -5.484 36.782 5.645 1.00 72.22 H new ATOM 0 HA THR B 89 -5.109 37.078 8.404 1.00 72.03 H new ATOM 0 HB THR B 89 -7.281 35.561 6.901 1.00 44.43 H new ATOM 0 HG1 THR B 89 -8.395 37.616 7.058 1.00 72.23 H new ATOM 0 HG21 THR B 89 -8.684 36.077 8.863 1.00 55.41 H new ATOM 0 HG22 THR B 89 -7.280 35.076 9.303 1.00 55.41 H new ATOM 0 HG23 THR B 89 -7.280 36.818 9.666 1.00 55.41 H new ATOM 2926 N THR B 90 -5.396 33.909 7.449 1.00 33.34 N ATOM 2927 CA THR B 90 -5.034 32.542 7.801 1.00 70.14 C ATOM 2928 C THR B 90 -5.535 32.182 9.195 1.00 13.32 C ATOM 2929 O THR B 90 -4.827 32.364 10.186 1.00 24.44 O ATOM 2930 CB THR B 90 -3.509 32.333 7.745 1.00 21.30 C ATOM 2931 OG1 THR B 90 -3.024 32.612 6.428 1.00 24.01 O ATOM 2932 CG2 THR B 90 -3.144 30.909 8.136 1.00 74.34 C ATOM 0 H THR B 90 -5.983 33.989 6.619 1.00 33.34 H new ATOM 0 HA THR B 90 -5.510 31.890 7.068 1.00 70.14 H new ATOM 0 HB THR B 90 -3.044 33.018 8.454 1.00 21.30 H new ATOM 0 HG1 THR B 90 -2.190 33.123 6.488 1.00 24.01 H new ATOM 0 HG21 THR B 90 -2.062 30.785 8.089 1.00 74.34 H new ATOM 0 HG22 THR B 90 -3.488 30.711 9.151 1.00 74.34 H new ATOM 0 HG23 THR B 90 -3.620 30.210 7.448 1.00 74.34 H new ATOM 2940 N SER B 91 -6.759 31.670 9.265 1.00 21.33 N ATOM 2941 CA SER B 91 -7.356 31.288 10.539 1.00 52.45 C ATOM 2942 C SER B 91 -8.433 30.226 10.338 1.00 40.41 C ATOM 2943 O SER B 91 -9.627 30.479 10.500 1.00 20.02 O ATOM 2944 CB SER B 91 -7.954 32.512 11.235 1.00 73.32 C ATOM 2945 OG SER B 91 -8.755 32.130 12.339 1.00 4.32 O ATOM 0 H SER B 91 -7.357 31.510 8.454 1.00 21.33 H new ATOM 0 HA SER B 91 -6.571 30.870 11.168 1.00 52.45 H new ATOM 0 HB2 SER B 91 -7.153 33.169 11.573 1.00 73.32 H new ATOM 0 HB3 SER B 91 -8.555 33.081 10.525 1.00 73.32 H new ATOM 0 HG SER B 91 -9.540 31.638 12.019 1.00 4.32 H new ATOM 2951 N PRO B 92 -8.003 29.009 9.977 1.00 53.44 N ATOM 2952 CA PRO B 92 -8.913 27.883 9.746 1.00 21.04 C ATOM 2953 C PRO B 92 -9.554 27.382 11.036 1.00 43.21 C ATOM 2954 O PRO B 92 -9.409 27.997 12.093 1.00 61.11 O ATOM 2955 CB PRO B 92 -8.003 26.807 9.148 1.00 71.35 C ATOM 2956 CG PRO B 92 -6.642 27.137 9.656 1.00 30.20 C ATOM 2957 CD PRO B 92 -6.594 28.636 9.767 1.00 2.15 C ATOM 0 HA PRO B 92 -9.748 28.160 9.102 1.00 21.04 H new ATOM 0 HB2 PRO B 92 -8.311 25.809 9.461 1.00 71.35 H new ATOM 0 HB3 PRO B 92 -8.034 26.823 8.059 1.00 71.35 H new ATOM 0 HG2 PRO B 92 -6.462 26.668 10.623 1.00 30.20 H new ATOM 0 HG3 PRO B 92 -5.872 26.771 8.976 1.00 30.20 H new ATOM 0 HD2 PRO B 92 -5.965 28.957 10.598 1.00 2.15 H new ATOM 0 HD3 PRO B 92 -6.188 29.093 8.865 1.00 2.15 H new ATOM 2965 N HIS B 93 -10.264 26.261 10.942 1.00 34.50 N ATOM 2966 CA HIS B 93 -10.926 25.676 12.103 1.00 54.15 C ATOM 2967 C HIS B 93 -10.289 24.341 12.477 1.00 12.25 C ATOM 2968 O HIS B 93 -9.309 23.917 11.864 1.00 33.42 O ATOM 2969 CB HIS B 93 -12.416 25.482 11.822 1.00 0.42 C ATOM 2970 CG HIS B 93 -13.166 26.768 11.652 1.00 62.42 C ATOM 2971 ND1 HIS B 93 -13.296 27.408 10.438 1.00 13.24 N ATOM 2972 CD2 HIS B 93 -13.828 27.533 12.551 1.00 50.12 C ATOM 2973 CE1 HIS B 93 -14.005 28.512 10.598 1.00 55.53 C ATOM 2974 NE2 HIS B 93 -14.341 28.610 11.871 1.00 23.02 N ATOM 0 H HIS B 93 -10.395 25.740 10.075 1.00 34.50 H new ATOM 0 HA HIS B 93 -10.808 26.362 12.942 1.00 54.15 H new ATOM 0 HB2 HIS B 93 -12.532 24.881 10.920 1.00 0.42 H new ATOM 0 HB3 HIS B 93 -12.861 24.917 12.641 1.00 0.42 H new ATOM 0 HD2 HIS B 93 -13.933 27.333 13.607 1.00 50.12 H new ATOM 0 HE1 HIS B 93 -14.265 29.214 9.820 1.00 55.53 H new ATOM 0 HE2 HIS B 93 -14.892 29.363 12.282 1.00 23.02 H new ATOM 2982 N SER B 94 -10.851 23.685 13.485 1.00 3.43 N ATOM 2983 CA SER B 94 -10.336 22.400 13.944 1.00 1.32 C ATOM 2984 C SER B 94 -11.416 21.612 14.680 1.00 64.45 C ATOM 2985 O SER B 94 -12.476 22.144 15.003 1.00 61.34 O ATOM 2986 CB SER B 94 -9.128 22.609 14.860 1.00 12.44 C ATOM 2987 OG SER B 94 -7.985 22.991 14.116 1.00 54.11 O ATOM 0 H SER B 94 -11.664 24.022 14.001 1.00 3.43 H new ATOM 0 HA SER B 94 -10.026 21.828 13.070 1.00 1.32 H new ATOM 0 HB2 SER B 94 -9.357 23.376 15.600 1.00 12.44 H new ATOM 0 HB3 SER B 94 -8.919 21.690 15.407 1.00 12.44 H new ATOM 0 HG SER B 94 -8.258 23.266 13.216 1.00 54.11 H new ATOM 2993 N GLY B 95 -11.137 20.338 14.940 1.00 1.35 N ATOM 2994 CA GLY B 95 -12.093 19.497 15.635 1.00 64.00 C ATOM 2995 C GLY B 95 -11.422 18.410 16.452 1.00 62.35 C ATOM 2996 O GLY B 95 -10.557 17.694 15.951 1.00 43.33 O ATOM 0 H GLY B 95 -10.266 19.874 14.682 1.00 1.35 H new ATOM 0 HA2 GLY B 95 -12.706 20.115 16.291 1.00 64.00 H new ATOM 0 HA3 GLY B 95 -12.765 19.039 14.909 1.00 64.00 H new ATOM 3000 N GLN B 96 -11.822 18.289 17.714 1.00 50.51 N ATOM 3001 CA GLN B 96 -11.251 17.282 18.602 1.00 72.12 C ATOM 3002 C GLN B 96 -12.115 17.102 19.845 1.00 65.24 C ATOM 3003 O GLN B 96 -12.039 17.891 20.788 1.00 63.21 O ATOM 3004 CB GLN B 96 -9.829 17.676 19.006 1.00 43.41 C ATOM 3005 CG GLN B 96 -9.001 16.513 19.529 1.00 33.45 C ATOM 3006 CD GLN B 96 -8.806 16.564 21.031 1.00 33.12 C ATOM 3007 OE1 GLN B 96 -9.461 15.838 21.778 1.00 74.24 O ATOM 3008 NE2 GLN B 96 -7.902 17.427 21.482 1.00 2.42 N ATOM 0 H GLN B 96 -12.538 18.874 18.144 1.00 50.51 H new ATOM 0 HA GLN B 96 -11.218 16.334 18.064 1.00 72.12 H new ATOM 0 HB2 GLN B 96 -9.323 18.113 18.145 1.00 43.41 H new ATOM 0 HB3 GLN B 96 -9.879 18.449 19.773 1.00 43.41 H new ATOM 0 HG2 GLN B 96 -9.489 15.576 19.261 1.00 33.45 H new ATOM 0 HG3 GLN B 96 -8.027 16.517 19.040 1.00 33.45 H new ATOM 0 HE21 GLN B 96 -7.382 18.010 20.826 1.00 2.42 H new ATOM 0 HE22 GLN B 96 -7.728 17.507 22.484 1.00 2.42 H new ATOM 3017 N LYS B 97 -12.937 16.058 19.843 1.00 34.32 N ATOM 3018 CA LYS B 97 -13.815 15.772 20.971 1.00 14.32 C ATOM 3019 C LYS B 97 -13.180 14.752 21.910 1.00 71.32 C ATOM 3020 O LYS B 97 -12.204 14.090 21.556 1.00 33.34 O ATOM 3021 CB LYS B 97 -15.166 15.251 20.472 1.00 35.20 C ATOM 3022 CG LYS B 97 -15.084 13.885 19.812 1.00 51.33 C ATOM 3023 CD LYS B 97 -16.001 13.795 18.604 1.00 44.12 C ATOM 3024 CE LYS B 97 -15.225 13.939 17.303 1.00 74.43 C ATOM 3025 NZ LYS B 97 -16.018 14.646 16.260 1.00 5.41 N ATOM 0 H LYS B 97 -13.013 15.395 19.071 1.00 34.32 H new ATOM 0 HA LYS B 97 -13.971 16.699 21.523 1.00 14.32 H new ATOM 0 HB2 LYS B 97 -15.859 15.199 21.312 1.00 35.20 H new ATOM 0 HB3 LYS B 97 -15.581 15.965 19.761 1.00 35.20 H new ATOM 0 HG2 LYS B 97 -14.057 13.689 19.506 1.00 51.33 H new ATOM 0 HG3 LYS B 97 -15.354 13.114 20.534 1.00 51.33 H new ATOM 0 HD2 LYS B 97 -16.524 12.839 18.613 1.00 44.12 H new ATOM 0 HD3 LYS B 97 -16.761 14.574 18.664 1.00 44.12 H new ATOM 0 HE2 LYS B 97 -14.301 14.486 17.490 1.00 74.43 H new ATOM 0 HE3 LYS B 97 -14.942 12.952 16.937 1.00 74.43 H new ATOM 0 HZ1 LYS B 97 -15.455 14.724 15.389 1.00 5.41 H new ATOM 0 HZ2 LYS B 97 -16.888 14.111 16.063 1.00 5.41 H new ATOM 0 HZ3 LYS B 97 -16.266 15.598 16.598 1.00 5.41 H new ATOM 3039 N THR B 98 -13.740 14.630 23.110 1.00 34.52 N ATOM 3040 CA THR B 98 -13.229 13.691 24.100 1.00 3.20 C ATOM 3041 C THR B 98 -11.772 13.989 24.439 1.00 4.23 C ATOM 3042 O THR B 98 -11.200 14.965 23.958 1.00 73.42 O ATOM 3043 CB THR B 98 -13.341 12.236 23.606 1.00 33.41 C ATOM 3044 OG1 THR B 98 -14.217 12.169 22.475 1.00 41.12 O ATOM 3045 CG2 THR B 98 -13.859 11.328 24.710 1.00 31.23 C ATOM 0 H THR B 98 -14.548 15.170 23.419 1.00 34.52 H new ATOM 0 HA THR B 98 -13.840 13.811 24.994 1.00 3.20 H new ATOM 0 HB THR B 98 -12.347 11.896 23.315 1.00 33.41 H new ATOM 0 HG1 THR B 98 -14.282 11.241 22.166 1.00 41.12 H new ATOM 0 HG21 THR B 98 -13.930 10.306 24.337 1.00 31.23 H new ATOM 0 HG22 THR B 98 -13.174 11.359 25.558 1.00 31.23 H new ATOM 0 HG23 THR B 98 -14.845 11.667 25.028 1.00 31.23 H new ATOM 3053 N GLY B 99 -11.177 13.140 25.272 1.00 24.23 N ATOM 3054 CA GLY B 99 -9.793 13.331 25.661 1.00 5.30 C ATOM 3055 C GLY B 99 -9.427 12.544 26.905 1.00 13.10 C ATOM 3056 O GLY B 99 -10.152 12.570 27.899 1.00 22.51 O ATOM 0 H GLY B 99 -11.629 12.324 25.684 1.00 24.23 H new ATOM 0 HA2 GLY B 99 -9.143 13.030 24.840 1.00 5.30 H new ATOM 0 HA3 GLY B 99 -9.612 14.391 25.839 1.00 5.30 H new TER 3060 GLY B 99