USER MOD reduce.3.24.130724 H: found=0, std=0, add=2001, rem=0, adj=64 USER MOD reduce.3.24.130724 removed 2000 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 54 TYR OH : rot -99:sc= -1.29! USER MOD Set 1.2: B 119 HIS : no HE2:sc= 0.629 K(o=-0.66,f=-5.8!) USER MOD Set 2.1: B 60 SER OG : rot 171:sc= 0.96 USER MOD Set 2.2: B 63 LYS NZ :NH3+ -156:sc= 2.04 (180deg=-0.435) USER MOD Set 3.1: B 29 LYS NZ :NH3+ 143:sc= 0.918 (180deg=-0.413) USER MOD Set 3.2: B 31 SER OG : rot 110:sc= -1.34! USER MOD Set 4.1: A 48 GLN : amide:sc= -3.38! C(o=-3.5!,f=-5.1!) USER MOD Set 4.2: B 7 THR OG1 : rot -161:sc= 0.88 USER MOD Set 4.3: B 21 SER OG : rot 80:sc= -1.05 USER MOD Set 5.1: A 125 SER OG : rot 160:sc= 0.0811 USER MOD Set 5.2: A 126 ASN : amide:sc= -0.675 K(o=-2.1,f=-6.6!) USER MOD Set 5.3: B 131 ASN : amide:sc= -1.54! C(o=-2.1!,f=-5.1!) USER MOD Set 6.1: A 57 CYS SG : rot -141:sc= -3.58! USER MOD Set 6.2: A 124 TYR OH : rot -154:sc= 1.43 USER MOD Set 7.1: A 54 TYR OH : rot -124:sc= 1.67 USER MOD Set 7.2: A 119 HIS : no HD1:sc= 1.21 K(o=3.6,f=-7.3!) USER MOD Set 7.3: A 122 CYS SG : rot -168:sc= 0.717! USER MOD Set 7.4: A 128 THR OG1 : rot -43:sc= 0.0101 USER MOD Set 8.1: A 55 SER OG : rot -79:sc= 1.67 USER MOD Set 8.2: B 11 SER OG : rot 142:sc= 1.04 USER MOD Set 9.1: A 45 ASN : amide:sc= -3.3! C(o=-3.2!,f=-5.3!) USER MOD Set 9.2: B 5 TYR OH : rot 180:sc= 0.126 USER MOD Set10.1: A 5 TYR OH : rot -140:sc= 0.659 USER MOD Set10.2: A 7 THR OG1 : rot 18:sc= 0.982 USER MOD Set10.3: A 25 LYS NZ :NH3+ -147:sc= 1.57 (180deg=0) USER MOD Set10.4: B 45 ASN : amide:sc= -1.35! C(o=0.79!,f=0.029!) USER MOD Set10.5: B 48 GLN : amide:sc= -1.07 K(o=0.79,f=-7.8!) USER MOD Single : A 1 MET CE :methyl -142:sc= -0.473 (180deg=-1.51) USER MOD Single : A 1 MET N :NH3+ 137:sc= 0.0604 (180deg=-0.0681) USER MOD Single : A 2 ASN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 6 LYS NZ :NH3+ 163:sc= 2.34 (180deg=2.02) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot -56:sc= 0.0341 USER MOD Single : A 12 THR OG1 : rot -130:sc= -0.0487 USER MOD Single : A 20 THR OG1 : rot -106:sc= 0.575 USER MOD Single : A 21 SER OG : rot 160:sc= -0.877 USER MOD Single : A 22 HIS : no HD1:sc= -0.103 X(o=-0.1,f=0) USER MOD Single : A 24 GLN : amide:sc= -0.33 X(o=-0.33,f=-0.22) USER MOD Single : A 29 LYS NZ :NH3+ 154:sc= -2.74! (180deg=-4.26!) USER MOD Single : A 31 SER OG : rot -14:sc= 0.696 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 73:sc= 0.569 USER MOD Single : A 62 MET CE :methyl -142:sc= -0.12 (180deg=-1.84) USER MOD Single : A 63 LYS NZ :NH3+ -119:sc= 1.08 (180deg=0.4) USER MOD Single : A 68 GLN : amide:sc=-0.00587 X(o=-0.0059,f=0.43) USER MOD Single : A 69 ASN :FLIP amide:sc= -0.0413 F(o=-2.6,f=-0.041) USER MOD Single : A 70 LYS NZ :NH3+ -164:sc= -0.0339 (180deg=-0.258) USER MOD Single : A 71 GLN :FLIP amide:sc= -0.485 F(o=-2.8!,f=-0.49) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 32:sc= 1.25 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.417 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc= -0.82 K(o=-0.82,f=-3.2) USER MOD Single : A 112 LYS NZ :NH3+ -166:sc= 1.22 (180deg=1.06) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HD1:sc= -0.0631 X(o=-0.063,f=0) USER MOD Single : A 130 ASN : amide:sc= -1.62 K(o=-1.6,f=-2.6) USER MOD Single : A 131 ASN : amide:sc= -0.343! X(o=-0.34!,f=-0.081) USER MOD Single : B 1 MET CE :methyl -157:sc= -2.23 (180deg=-4.26!) USER MOD Single : B 1 MET N :NH3+ 133:sc= 0.102 (180deg=-0.058) USER MOD Single : B 2 ASN : amide:sc=-0.00705 X(o=-0.0071,f=-0.33) USER MOD Single : B 6 LYS NZ :NH3+ 170:sc= 1.26 (180deg=1.2) USER MOD Single : B 10 THR OG1 : rot 180:sc= -0.655 USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 THR OG1 : rot 180:sc= 0 USER MOD Single : B 22 HIS : no HE2:sc= 0.427 K(o=0.43,f=-1.7!) USER MOD Single : B 24 GLN : amide:sc= 0.181 X(o=0.18,f=-0.15) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 THR OG1 : rot 180:sc= -0.665 USER MOD Single : B 55 SER OG : rot -81:sc= 0.561 USER MOD Single : B 57 CYS SG : rot 78:sc= -2.99! USER MOD Single : B 62 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 69 ASN : amide:sc= -1.6 K(o=-1.6,f=-6.3!) USER MOD Single : B 70 LYS NZ :NH3+ -161:sc= -0.0748 (180deg=-0.468) USER MOD Single : B 71 GLN :FLIP amide:sc= -0.49 F(o=-0.99,f=-0.49) USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 77 THR OG1 : rot 46:sc= 0.822 USER MOD Single : B 78 THR OG1 : rot 180:sc= -0.138 USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 88 ASN : amide:sc= 0.808 K(o=0.81,f=-6.1!) USER MOD Single : B 112 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0338) USER MOD Single : B 113 THR OG1 : rot 180:sc= 0 USER MOD Single : B 120 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 122 CYS SG : rot 170:sc= -1.04 USER MOD Single : B 124 TYR OH : rot 2:sc= 1.6 USER MOD Single : B 128 THR OG1 : rot 178:sc= -1.67! USER MOD Single : B 130 ASN : amide:sc= -0.104 X(o=-0.1,f=-0.45) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.003 0.438 1.898 1.00 60.05 N ATOM 2 CA MET A 1 2.744 0.923 0.703 1.00 3.23 C ATOM 3 C MET A 1 3.437 -0.235 -0.012 1.00 42.13 C ATOM 4 O MET A 1 3.300 -1.395 0.378 1.00 30.31 O ATOM 5 CB MET A 1 3.791 1.976 1.094 1.00 13.52 C ATOM 6 CG MET A 1 4.802 1.470 2.106 1.00 60.32 C ATOM 7 SD MET A 1 6.116 2.657 2.452 1.00 71.43 S ATOM 8 CE MET A 1 7.113 2.498 0.972 1.00 20.11 C ATOM 0 H1 MET A 1 2.163 1.089 2.693 1.00 60.05 H new ATOM 0 H2 MET A 1 0.986 0.397 1.683 1.00 60.05 H new ATOM 0 H3 MET A 1 2.341 -0.511 2.155 1.00 60.05 H new ATOM 0 HA MET A 1 2.017 1.378 0.030 1.00 3.23 H new ATOM 0 HB2 MET A 1 4.318 2.305 0.198 1.00 13.52 H new ATOM 0 HB3 MET A 1 3.283 2.849 1.504 1.00 13.52 H new ATOM 0 HG2 MET A 1 4.286 1.228 3.035 1.00 60.32 H new ATOM 0 HG3 MET A 1 5.245 0.545 1.736 1.00 60.32 H new ATOM 0 HE1 MET A 1 8.169 2.566 1.235 1.00 20.11 H new ATOM 0 HE2 MET A 1 6.917 1.534 0.503 1.00 20.11 H new ATOM 0 HE3 MET A 1 6.861 3.298 0.276 1.00 20.11 H new ATOM 20 N ASN A 2 4.206 0.099 -1.044 1.00 22.52 N ATOM 21 CA ASN A 2 4.917 -0.894 -1.846 1.00 14.33 C ATOM 22 C ASN A 2 6.307 -1.119 -1.267 1.00 22.14 C ATOM 23 O ASN A 2 7.274 -0.478 -1.670 1.00 72.55 O ATOM 24 CB ASN A 2 5.022 -0.440 -3.313 1.00 31.34 C ATOM 25 CG ASN A 2 5.712 -1.469 -4.199 1.00 75.52 C ATOM 26 OD1 ASN A 2 5.610 -2.672 -3.968 1.00 52.13 O ATOM 27 ND2 ASN A 2 6.420 -1.004 -5.217 1.00 35.23 N ATOM 0 H ASN A 2 4.354 1.061 -1.348 1.00 22.52 H new ATOM 0 HA ASN A 2 4.358 -1.829 -1.819 1.00 14.33 H new ATOM 0 HB2 ASN A 2 4.022 -0.245 -3.701 1.00 31.34 H new ATOM 0 HB3 ASN A 2 5.571 0.500 -3.360 1.00 31.34 H new ATOM 0 HD21 ASN A 2 6.903 -1.651 -5.840 1.00 35.23 H new ATOM 0 HD22 ASN A 2 6.482 0.001 -5.378 1.00 35.23 H new ATOM 34 N ILE A 3 6.383 -1.984 -0.273 1.00 0.23 N ATOM 35 CA ILE A 3 7.633 -2.282 0.407 1.00 51.02 C ATOM 36 C ILE A 3 8.537 -3.202 -0.414 1.00 3.13 C ATOM 37 O ILE A 3 8.098 -4.231 -0.935 1.00 22.24 O ATOM 38 CB ILE A 3 7.348 -2.930 1.778 1.00 43.32 C ATOM 39 CG1 ILE A 3 6.528 -1.966 2.648 1.00 25.54 C ATOM 40 CG2 ILE A 3 8.643 -3.328 2.475 1.00 24.42 C ATOM 41 CD1 ILE A 3 7.308 -0.753 3.113 1.00 23.10 C ATOM 0 H ILE A 3 5.581 -2.501 0.087 1.00 0.23 H new ATOM 0 HA ILE A 3 8.158 -1.336 0.542 1.00 51.02 H new ATOM 0 HB ILE A 3 6.769 -3.840 1.621 1.00 43.32 H new ATOM 0 HG12 ILE A 3 5.657 -1.633 2.084 1.00 25.54 H new ATOM 0 HG13 ILE A 3 6.156 -2.504 3.520 1.00 25.54 H new ATOM 0 HG21 ILE A 3 8.413 -3.782 3.439 1.00 24.42 H new ATOM 0 HG22 ILE A 3 9.184 -4.044 1.856 1.00 24.42 H new ATOM 0 HG23 ILE A 3 9.260 -2.443 2.629 1.00 24.42 H new ATOM 0 HD11 ILE A 3 6.664 -0.118 3.722 1.00 23.10 H new ATOM 0 HD12 ILE A 3 8.164 -1.076 3.705 1.00 23.10 H new ATOM 0 HD13 ILE A 3 7.657 -0.191 2.247 1.00 23.10 H new ATOM 53 N LEU A 4 9.800 -2.803 -0.525 1.00 41.13 N ATOM 54 CA LEU A 4 10.844 -3.626 -1.128 1.00 42.04 C ATOM 55 C LEU A 4 11.518 -4.466 -0.056 1.00 41.22 C ATOM 56 O LEU A 4 11.771 -5.662 -0.245 1.00 74.21 O ATOM 57 CB LEU A 4 11.900 -2.748 -1.813 1.00 22.30 C ATOM 58 CG LEU A 4 11.368 -1.794 -2.887 1.00 5.11 C ATOM 59 CD1 LEU A 4 12.501 -0.941 -3.453 1.00 73.22 C ATOM 60 CD2 LEU A 4 10.664 -2.571 -3.997 1.00 52.13 C ATOM 0 H LEU A 4 10.130 -1.895 -0.198 1.00 41.13 H new ATOM 0 HA LEU A 4 10.382 -4.273 -1.874 1.00 42.04 H new ATOM 0 HB2 LEU A 4 12.409 -2.160 -1.049 1.00 22.30 H new ATOM 0 HB3 LEU A 4 12.648 -3.397 -2.267 1.00 22.30 H new ATOM 0 HG LEU A 4 10.638 -1.128 -2.426 1.00 5.11 H new ATOM 0 HD11 LEU A 4 12.105 -0.269 -4.215 1.00 73.22 H new ATOM 0 HD12 LEU A 4 12.951 -0.356 -2.651 1.00 73.22 H new ATOM 0 HD13 LEU A 4 13.257 -1.589 -3.898 1.00 73.22 H new ATOM 0 HD21 LEU A 4 10.294 -1.875 -4.750 1.00 52.13 H new ATOM 0 HD22 LEU A 4 11.367 -3.264 -4.459 1.00 52.13 H new ATOM 0 HD23 LEU A 4 9.828 -3.129 -3.576 1.00 52.13 H new ATOM 72 N TYR A 5 11.810 -3.828 1.075 1.00 24.01 N ATOM 73 CA TYR A 5 12.508 -4.493 2.177 1.00 4.44 C ATOM 74 C TYR A 5 11.844 -4.138 3.501 1.00 12.52 C ATOM 75 O TYR A 5 11.597 -2.973 3.772 1.00 21.34 O ATOM 76 CB TYR A 5 13.990 -4.069 2.184 1.00 54.43 C ATOM 77 CG TYR A 5 14.854 -4.760 3.234 1.00 2.54 C ATOM 78 CD1 TYR A 5 14.795 -4.386 4.576 1.00 4.50 C ATOM 79 CD2 TYR A 5 15.739 -5.776 2.879 1.00 14.20 C ATOM 80 CE1 TYR A 5 15.584 -5.004 5.528 1.00 2.54 C ATOM 81 CE2 TYR A 5 16.532 -6.395 3.830 1.00 4.33 C ATOM 82 CZ TYR A 5 16.451 -6.006 5.151 1.00 33.20 C ATOM 83 OH TYR A 5 17.240 -6.627 6.101 1.00 31.30 O ATOM 0 H TYR A 5 11.575 -2.852 1.254 1.00 24.01 H new ATOM 0 HA TYR A 5 12.453 -5.573 2.041 1.00 4.44 H new ATOM 0 HB2 TYR A 5 14.413 -4.267 1.199 1.00 54.43 H new ATOM 0 HB3 TYR A 5 14.043 -2.992 2.343 1.00 54.43 H new ATOM 0 HD1 TYR A 5 14.120 -3.599 4.877 1.00 4.50 H new ATOM 0 HD2 TYR A 5 15.807 -6.085 1.846 1.00 14.20 H new ATOM 0 HE1 TYR A 5 15.521 -4.703 6.563 1.00 2.54 H new ATOM 0 HE2 TYR A 5 17.213 -7.181 3.538 1.00 4.33 H new ATOM 0 HH TYR A 5 18.135 -6.782 5.732 1.00 31.30 H new ATOM 93 N LYS A 6 11.530 -5.144 4.308 1.00 51.40 N ATOM 94 CA LYS A 6 10.995 -4.914 5.649 1.00 43.32 C ATOM 95 C LYS A 6 11.557 -5.943 6.621 1.00 62.42 C ATOM 96 O LYS A 6 11.593 -7.138 6.329 1.00 13.53 O ATOM 97 CB LYS A 6 9.453 -4.934 5.654 1.00 1.54 C ATOM 98 CG LYS A 6 8.834 -4.863 7.055 1.00 51.03 C ATOM 99 CD LYS A 6 7.370 -4.410 7.038 1.00 30.33 C ATOM 100 CE LYS A 6 7.233 -2.928 6.688 1.00 61.32 C ATOM 101 NZ LYS A 6 5.847 -2.428 6.880 1.00 4.41 N1+ ATOM 0 H LYS A 6 11.636 -6.128 4.060 1.00 51.40 H new ATOM 0 HA LYS A 6 11.306 -3.921 5.973 1.00 43.32 H new ATOM 0 HB2 LYS A 6 9.087 -4.094 5.063 1.00 1.54 H new ATOM 0 HB3 LYS A 6 9.110 -5.844 5.162 1.00 1.54 H new ATOM 0 HG2 LYS A 6 8.900 -5.844 7.526 1.00 51.03 H new ATOM 0 HG3 LYS A 6 9.415 -4.175 7.669 1.00 51.03 H new ATOM 0 HD2 LYS A 6 6.814 -5.006 6.314 1.00 30.33 H new ATOM 0 HD3 LYS A 6 6.922 -4.595 8.014 1.00 30.33 H new ATOM 0 HE2 LYS A 6 7.916 -2.346 7.307 1.00 61.32 H new ATOM 0 HE3 LYS A 6 7.532 -2.773 5.651 1.00 61.32 H new ATOM 0 HZ1 LYS A 6 5.854 -1.389 6.914 1.00 4.41 H new ATOM 0 HZ2 LYS A 6 5.251 -2.744 6.089 1.00 4.41 H new ATOM 0 HZ3 LYS A 6 5.464 -2.801 7.772 1.00 4.41 H new ATOM 115 N THR A 7 12.016 -5.454 7.763 1.00 30.21 N ATOM 116 CA THR A 7 12.621 -6.294 8.791 1.00 33.22 C ATOM 117 C THR A 7 12.062 -5.917 10.167 1.00 54.23 C ATOM 118 O THR A 7 11.688 -4.762 10.396 1.00 73.02 O ATOM 119 CB THR A 7 14.165 -6.149 8.762 1.00 43.13 C ATOM 120 OG1 THR A 7 14.791 -7.062 9.680 1.00 11.53 O ATOM 121 CG2 THR A 7 14.591 -4.717 9.080 1.00 62.33 C ATOM 0 H THR A 7 11.981 -4.464 8.005 1.00 30.21 H new ATOM 0 HA THR A 7 12.375 -7.337 8.592 1.00 33.22 H new ATOM 0 HB THR A 7 14.493 -6.393 7.752 1.00 43.13 H new ATOM 0 HG1 THR A 7 14.156 -7.767 9.925 1.00 11.53 H new ATOM 0 HG21 THR A 7 15.678 -4.646 9.052 1.00 62.33 H new ATOM 0 HG22 THR A 7 14.164 -4.038 8.342 1.00 62.33 H new ATOM 0 HG23 THR A 7 14.235 -4.444 10.073 1.00 62.33 H new ATOM 129 N ALA A 8 11.993 -6.892 11.074 1.00 51.42 N ATOM 130 CA ALA A 8 11.361 -6.689 12.377 1.00 62.45 C ATOM 131 C ALA A 8 12.379 -6.744 13.512 1.00 64.34 C ATOM 132 O ALA A 8 13.405 -7.425 13.417 1.00 4.53 O ATOM 133 CB ALA A 8 10.276 -7.738 12.595 1.00 11.23 C ATOM 0 H ALA A 8 12.367 -7.830 10.930 1.00 51.42 H new ATOM 0 HA ALA A 8 10.914 -5.695 12.382 1.00 62.45 H new ATOM 0 HB1 ALA A 8 9.809 -7.582 13.567 1.00 11.23 H new ATOM 0 HB2 ALA A 8 9.523 -7.650 11.812 1.00 11.23 H new ATOM 0 HB3 ALA A 8 10.720 -8.733 12.562 1.00 11.23 H new ATOM 139 N ALA A 9 12.083 -6.027 14.591 1.00 62.04 N ATOM 140 CA ALA A 9 12.913 -6.038 15.788 1.00 13.24 C ATOM 141 C ALA A 9 12.036 -5.948 17.035 1.00 53.42 C ATOM 142 O ALA A 9 11.192 -5.065 17.144 1.00 45.34 O ATOM 143 CB ALA A 9 13.916 -4.891 15.748 1.00 65.14 C ATOM 0 H ALA A 9 11.263 -5.424 14.659 1.00 62.04 H new ATOM 0 HA ALA A 9 13.469 -6.975 15.824 1.00 13.24 H new ATOM 0 HB1 ALA A 9 14.529 -4.912 16.649 1.00 65.14 H new ATOM 0 HB2 ALA A 9 14.555 -4.997 14.872 1.00 65.14 H new ATOM 0 HB3 ALA A 9 13.382 -3.942 15.695 1.00 65.14 H new ATOM 149 N THR A 10 12.223 -6.881 17.957 1.00 61.23 N ATOM 150 CA THR A 10 11.478 -6.902 19.207 1.00 51.35 C ATOM 151 C THR A 10 12.321 -6.303 20.331 1.00 43.21 C ATOM 152 O THR A 10 13.519 -6.568 20.428 1.00 73.43 O ATOM 153 CB THR A 10 11.049 -8.347 19.576 1.00 34.35 C ATOM 154 OG1 THR A 10 10.410 -8.371 20.861 1.00 3.15 O ATOM 155 CG2 THR A 10 12.235 -9.305 19.577 1.00 70.40 C ATOM 0 H THR A 10 12.894 -7.643 17.860 1.00 61.23 H new ATOM 0 HA THR A 10 10.577 -6.302 19.076 1.00 51.35 H new ATOM 0 HB THR A 10 10.344 -8.678 18.814 1.00 34.35 H new ATOM 0 HG1 THR A 10 10.144 -9.289 21.077 1.00 3.15 H new ATOM 0 HG21 THR A 10 11.894 -10.306 19.840 1.00 70.40 H new ATOM 0 HG22 THR A 10 12.688 -9.325 18.586 1.00 70.40 H new ATOM 0 HG23 THR A 10 12.973 -8.970 20.306 1.00 70.40 H new ATOM 163 N SER A 11 11.701 -5.477 21.161 1.00 71.32 N ATOM 164 CA SER A 11 12.392 -4.856 22.284 1.00 2.43 C ATOM 165 C SER A 11 11.645 -5.127 23.587 1.00 11.12 C ATOM 166 O SER A 11 10.517 -4.669 23.782 1.00 53.54 O ATOM 167 CB SER A 11 12.546 -3.347 22.046 1.00 22.21 C ATOM 168 OG SER A 11 11.295 -2.730 21.807 1.00 52.01 O ATOM 0 H SER A 11 10.717 -5.220 21.078 1.00 71.32 H new ATOM 0 HA SER A 11 13.387 -5.293 22.367 1.00 2.43 H new ATOM 0 HB2 SER A 11 13.020 -2.887 22.913 1.00 22.21 H new ATOM 0 HB3 SER A 11 13.205 -3.177 21.195 1.00 22.21 H new ATOM 0 HG SER A 11 10.854 -3.167 21.049 1.00 52.01 H new ATOM 174 N THR A 12 12.269 -5.894 24.470 1.00 54.12 N ATOM 175 CA THR A 12 11.671 -6.254 25.744 1.00 52.53 C ATOM 176 C THR A 12 12.333 -5.487 26.889 1.00 72.12 C ATOM 177 O THR A 12 13.434 -4.960 26.733 1.00 13.04 O ATOM 178 CB THR A 12 11.831 -7.766 25.987 1.00 35.03 C ATOM 179 OG1 THR A 12 11.545 -8.485 24.779 1.00 61.53 O ATOM 180 CG2 THR A 12 10.901 -8.243 27.088 1.00 33.34 C ATOM 0 H THR A 12 13.201 -6.282 24.323 1.00 54.12 H new ATOM 0 HA THR A 12 10.613 -5.995 25.711 1.00 52.53 H new ATOM 0 HB THR A 12 12.860 -7.953 26.295 1.00 35.03 H new ATOM 0 HG1 THR A 12 10.908 -9.205 24.970 1.00 61.53 H new ATOM 0 HG21 THR A 12 11.035 -9.314 27.239 1.00 33.34 H new ATOM 0 HG22 THR A 12 11.131 -7.715 28.013 1.00 33.34 H new ATOM 0 HG23 THR A 12 9.868 -8.043 26.804 1.00 33.34 H new ATOM 188 N GLY A 13 11.665 -5.430 28.032 1.00 62.44 N ATOM 189 CA GLY A 13 12.255 -4.831 29.213 1.00 34.44 C ATOM 190 C GLY A 13 13.218 -5.781 29.904 1.00 13.14 C ATOM 191 O GLY A 13 12.894 -6.348 30.950 1.00 50.55 O ATOM 0 H GLY A 13 10.720 -5.790 28.163 1.00 62.44 H new ATOM 0 HA2 GLY A 13 12.782 -3.919 28.934 1.00 34.44 H new ATOM 0 HA3 GLY A 13 11.466 -4.544 29.908 1.00 34.44 H new ATOM 195 N GLY A 14 14.389 -5.986 29.290 1.00 62.02 N ATOM 196 CA GLY A 14 15.412 -6.846 29.871 1.00 43.32 C ATOM 197 C GLY A 14 15.874 -6.356 31.234 1.00 33.13 C ATOM 198 O GLY A 14 15.194 -6.571 32.238 1.00 44.52 O ATOM 0 H GLY A 14 14.646 -5.568 28.396 1.00 62.02 H new ATOM 0 HA2 GLY A 14 15.021 -7.859 29.965 1.00 43.32 H new ATOM 0 HA3 GLY A 14 16.267 -6.896 29.197 1.00 43.32 H new ATOM 202 N ARG A 15 17.037 -5.710 31.280 1.00 24.13 N ATOM 203 CA ARG A 15 17.514 -5.095 32.519 1.00 34.21 C ATOM 204 C ARG A 15 16.862 -3.725 32.676 1.00 4.22 C ATOM 205 O ARG A 15 16.252 -3.422 33.701 1.00 73.04 O ATOM 206 CB ARG A 15 19.046 -4.964 32.521 1.00 34.44 C ATOM 207 CG ARG A 15 19.608 -4.453 33.846 1.00 1.44 C ATOM 208 CD ARG A 15 19.322 -5.422 34.989 1.00 44.04 C ATOM 209 NE ARG A 15 19.656 -4.852 36.297 1.00 64.51 N ATOM 210 CZ ARG A 15 20.145 -5.555 37.321 1.00 22.54 C ATOM 211 NH1 ARG A 15 20.444 -6.840 37.172 1.00 12.40 N1+ ATOM 212 NH2 ARG A 15 20.346 -4.970 38.493 1.00 44.23 N ATOM 0 H ARG A 15 17.663 -5.599 30.482 1.00 24.13 H new ATOM 0 HA ARG A 15 17.239 -5.732 33.359 1.00 34.21 H new ATOM 0 HB2 ARG A 15 19.487 -5.936 32.298 1.00 34.44 H new ATOM 0 HB3 ARG A 15 19.347 -4.287 31.722 1.00 34.44 H new ATOM 0 HG2 ARG A 15 20.684 -4.307 33.753 1.00 1.44 H new ATOM 0 HG3 ARG A 15 19.173 -3.480 34.075 1.00 1.44 H new ATOM 0 HD2 ARG A 15 18.268 -5.698 34.974 1.00 44.04 H new ATOM 0 HD3 ARG A 15 19.893 -6.338 34.838 1.00 44.04 H new ATOM 0 HE ARG A 15 19.505 -3.853 36.434 1.00 64.51 H new ATOM 0 HH11 ARG A 15 20.300 -7.296 36.271 1.00 12.40 H new ATOM 0 HH12 ARG A 15 20.817 -7.371 37.959 1.00 12.40 H new ATOM 0 HH21 ARG A 15 20.127 -3.981 38.614 1.00 44.23 H new ATOM 0 HH22 ARG A 15 20.720 -5.509 39.274 1.00 44.23 H new ATOM 226 N ASP A 16 17.021 -2.902 31.646 1.00 4.14 N ATOM 227 CA ASP A 16 16.281 -1.647 31.519 1.00 22.02 C ATOM 228 C ASP A 16 15.584 -1.654 30.167 1.00 52.02 C ATOM 229 O ASP A 16 14.420 -1.267 30.043 1.00 74.22 O ATOM 230 CB ASP A 16 17.211 -0.430 31.639 1.00 50.13 C ATOM 231 CG ASP A 16 16.450 0.894 31.671 1.00 53.42 C ATOM 232 OD1 ASP A 16 16.002 1.302 32.762 1.00 45.04 O ATOM 233 OD2 ASP A 16 16.292 1.532 30.607 1.00 61.02 O1- ATOM 0 H ASP A 16 17.665 -3.083 30.876 1.00 4.14 H new ATOM 0 HA ASP A 16 15.553 -1.568 32.326 1.00 22.02 H new ATOM 0 HB2 ASP A 16 17.808 -0.523 32.546 1.00 50.13 H new ATOM 0 HB3 ASP A 16 17.906 -0.425 30.799 1.00 50.13 H new ATOM 238 N GLY A 17 16.313 -2.122 29.153 1.00 73.12 N ATOM 239 CA GLY A 17 15.727 -2.382 27.858 1.00 31.14 C ATOM 240 C GLY A 17 16.518 -3.433 27.108 1.00 63.12 C ATOM 241 O GLY A 17 17.682 -3.686 27.425 1.00 34.35 O ATOM 0 H GLY A 17 17.311 -2.326 29.214 1.00 73.12 H new ATOM 0 HA2 GLY A 17 14.697 -2.716 27.981 1.00 31.14 H new ATOM 0 HA3 GLY A 17 15.696 -1.461 27.277 1.00 31.14 H new ATOM 245 N ARG A 18 15.892 -4.062 26.133 1.00 71.41 N ATOM 246 CA ARG A 18 16.558 -5.045 25.290 1.00 64.41 C ATOM 247 C ARG A 18 16.144 -4.831 23.844 1.00 2.04 C ATOM 248 O ARG A 18 15.023 -4.407 23.581 1.00 73.24 O ATOM 249 CB ARG A 18 16.200 -6.475 25.730 1.00 30.54 C ATOM 250 CG ARG A 18 16.903 -7.554 24.911 1.00 21.30 C ATOM 251 CD ARG A 18 16.552 -8.961 25.370 1.00 2.42 C ATOM 252 NE ARG A 18 15.160 -9.320 25.070 1.00 61.43 N ATOM 253 CZ ARG A 18 14.450 -10.206 25.772 1.00 42.21 C ATOM 254 NH1 ARG A 18 14.995 -10.820 26.819 1.00 65.11 N1+ ATOM 255 NH2 ARG A 18 13.201 -10.486 25.417 1.00 11.32 N ATOM 0 H ARG A 18 14.911 -3.909 25.900 1.00 71.41 H new ATOM 0 HA ARG A 18 17.636 -4.918 25.387 1.00 64.41 H new ATOM 0 HB2 ARG A 18 16.460 -6.600 26.781 1.00 30.54 H new ATOM 0 HB3 ARG A 18 15.122 -6.613 25.650 1.00 30.54 H new ATOM 0 HG2 ARG A 18 16.633 -7.441 23.861 1.00 21.30 H new ATOM 0 HG3 ARG A 18 17.982 -7.412 24.980 1.00 21.30 H new ATOM 0 HD2 ARG A 18 17.220 -9.674 24.887 1.00 2.42 H new ATOM 0 HD3 ARG A 18 16.721 -9.042 26.444 1.00 2.42 H new ATOM 0 HE ARG A 18 14.708 -8.865 24.277 1.00 61.43 H new ATOM 0 HH11 ARG A 18 15.957 -10.614 27.087 1.00 65.11 H new ATOM 0 HH12 ARG A 18 14.450 -11.497 27.354 1.00 65.11 H new ATOM 0 HH21 ARG A 18 12.785 -10.024 24.608 1.00 11.32 H new ATOM 0 HH22 ARG A 18 12.658 -11.163 25.953 1.00 11.32 H new ATOM 269 N ALA A 19 17.049 -5.115 22.918 1.00 71.12 N ATOM 270 CA ALA A 19 16.753 -5.011 21.497 1.00 34.25 C ATOM 271 C ALA A 19 17.179 -6.286 20.786 1.00 41.03 C ATOM 272 O ALA A 19 18.346 -6.685 20.843 1.00 12.34 O ATOM 273 CB ALA A 19 17.453 -3.798 20.891 1.00 5.35 C ATOM 0 H ALA A 19 17.999 -5.421 23.128 1.00 71.12 H new ATOM 0 HA ALA A 19 15.678 -4.880 21.369 1.00 34.25 H new ATOM 0 HB1 ALA A 19 17.220 -3.737 19.828 1.00 5.35 H new ATOM 0 HB2 ALA A 19 17.109 -2.892 21.391 1.00 5.35 H new ATOM 0 HB3 ALA A 19 18.531 -3.897 21.021 1.00 5.35 H new ATOM 279 N THR A 20 16.233 -6.905 20.106 1.00 63.53 N ATOM 280 CA THR A 20 16.474 -8.143 19.386 1.00 0.02 C ATOM 281 C THR A 20 15.878 -8.057 17.984 1.00 61.21 C ATOM 282 O THR A 20 14.661 -8.027 17.822 1.00 50.32 O ATOM 283 CB THR A 20 15.854 -9.346 20.146 1.00 22.13 C ATOM 284 OG1 THR A 20 16.303 -9.342 21.511 1.00 4.20 O ATOM 285 CG2 THR A 20 16.220 -10.677 19.489 1.00 30.30 C ATOM 0 H THR A 20 15.274 -6.564 20.036 1.00 63.53 H new ATOM 0 HA THR A 20 17.551 -8.294 19.311 1.00 0.02 H new ATOM 0 HB THR A 20 14.770 -9.240 20.111 1.00 22.13 H new ATOM 0 HG1 THR A 20 16.959 -10.058 21.642 1.00 4.20 H new ATOM 0 HG21 THR A 20 15.768 -11.496 20.049 1.00 30.30 H new ATOM 0 HG22 THR A 20 15.850 -10.691 18.464 1.00 30.30 H new ATOM 0 HG23 THR A 20 17.304 -10.795 19.485 1.00 30.30 H new ATOM 293 N SER A 21 16.737 -8.010 16.971 1.00 52.22 N ATOM 294 CA SER A 21 16.265 -7.981 15.599 1.00 61.23 C ATOM 295 C SER A 21 15.643 -9.333 15.302 1.00 4.01 C ATOM 296 O SER A 21 16.366 -10.341 15.189 1.00 53.51 O ATOM 297 CB SER A 21 17.395 -7.659 14.613 1.00 62.30 C ATOM 298 OG SER A 21 16.934 -7.664 13.271 1.00 0.33 O ATOM 0 H SER A 21 17.751 -7.991 17.076 1.00 52.22 H new ATOM 0 HA SER A 21 15.527 -7.188 15.478 1.00 61.23 H new ATOM 0 HB2 SER A 21 17.818 -6.683 14.849 1.00 62.30 H new ATOM 0 HB3 SER A 21 18.196 -8.389 14.726 1.00 62.30 H new ATOM 0 HG SER A 21 17.558 -7.159 12.709 1.00 0.33 H new ATOM 304 N HIS A 22 14.302 -9.310 15.191 1.00 22.03 N ATOM 305 CA HIS A 22 13.436 -10.497 15.217 1.00 2.11 C ATOM 306 C HIS A 22 13.815 -11.519 14.157 1.00 71.44 C ATOM 307 O HIS A 22 13.549 -12.709 14.319 1.00 63.31 O ATOM 308 CB HIS A 22 11.968 -10.063 15.038 1.00 42.33 C ATOM 309 CG HIS A 22 10.970 -11.192 15.042 1.00 64.41 C ATOM 310 ND1 HIS A 22 10.230 -11.541 16.154 1.00 70.44 N ATOM 311 CD2 HIS A 22 10.580 -12.039 14.056 1.00 33.23 C ATOM 312 CE1 HIS A 22 9.434 -12.550 15.852 1.00 21.33 C ATOM 313 NE2 HIS A 22 9.628 -12.869 14.589 1.00 41.54 N ATOM 0 H HIS A 22 13.780 -8.441 15.078 1.00 22.03 H new ATOM 0 HA HIS A 22 13.569 -10.982 16.184 1.00 2.11 H new ATOM 0 HB2 HIS A 22 11.710 -9.366 15.835 1.00 42.33 H new ATOM 0 HB3 HIS A 22 11.877 -9.519 14.098 1.00 42.33 H new ATOM 0 HD2 HIS A 22 10.950 -12.056 13.042 1.00 33.23 H new ATOM 0 HE1 HIS A 22 8.741 -13.032 16.526 1.00 21.33 H new ATOM 0 HE2 HIS A 22 9.146 -13.615 14.087 1.00 41.54 H new ATOM 322 N ASP A 23 14.472 -11.072 13.103 1.00 65.30 N ATOM 323 CA ASP A 23 14.892 -11.972 12.030 1.00 52.23 C ATOM 324 C ASP A 23 16.172 -12.703 12.441 1.00 2.53 C ATOM 325 O ASP A 23 16.906 -13.220 11.600 1.00 21.54 O ATOM 326 CB ASP A 23 15.129 -11.181 10.738 1.00 41.44 C ATOM 327 CG ASP A 23 13.890 -10.441 10.249 1.00 73.43 C ATOM 328 OD1 ASP A 23 13.545 -9.395 10.839 1.00 71.33 O ATOM 329 OD2 ASP A 23 13.267 -10.888 9.262 1.00 13.13 O1- ATOM 0 H ASP A 23 14.729 -10.095 12.961 1.00 65.30 H new ATOM 0 HA ASP A 23 14.104 -12.704 11.851 1.00 52.23 H new ATOM 0 HB2 ASP A 23 15.932 -10.462 10.902 1.00 41.44 H new ATOM 0 HB3 ASP A 23 15.467 -11.864 9.959 1.00 41.44 H new ATOM 334 N GLN A 24 16.421 -12.720 13.755 1.00 30.45 N ATOM 335 CA GLN A 24 17.551 -13.424 14.358 1.00 23.53 C ATOM 336 C GLN A 24 18.851 -12.725 13.999 1.00 71.34 C ATOM 337 O GLN A 24 19.942 -13.271 14.169 1.00 22.01 O ATOM 338 CB GLN A 24 17.577 -14.904 13.940 1.00 42.54 C ATOM 339 CG GLN A 24 16.354 -15.692 14.401 1.00 72.53 C ATOM 340 CD GLN A 24 16.146 -15.622 15.906 1.00 14.50 C ATOM 341 OE1 GLN A 24 16.679 -16.437 16.658 1.00 45.33 O ATOM 342 NE2 GLN A 24 15.362 -14.648 16.355 1.00 4.22 N ATOM 0 H GLN A 24 15.834 -12.238 14.436 1.00 30.45 H new ATOM 0 HA GLN A 24 17.434 -13.400 15.441 1.00 23.53 H new ATOM 0 HB2 GLN A 24 17.649 -14.965 12.854 1.00 42.54 H new ATOM 0 HB3 GLN A 24 18.474 -15.372 14.346 1.00 42.54 H new ATOM 0 HG2 GLN A 24 15.467 -15.307 13.897 1.00 72.53 H new ATOM 0 HG3 GLN A 24 16.464 -16.734 14.101 1.00 72.53 H new ATOM 0 HE21 GLN A 24 14.938 -13.991 15.700 1.00 4.22 H new ATOM 0 HE22 GLN A 24 15.184 -14.557 17.355 1.00 4.22 H new ATOM 351 N LYS A 25 18.717 -11.488 13.542 1.00 22.35 N ATOM 352 CA LYS A 25 19.853 -10.691 13.127 1.00 24.04 C ATOM 353 C LYS A 25 20.582 -10.109 14.333 1.00 45.31 C ATOM 354 O LYS A 25 21.808 -9.994 14.322 1.00 73.44 O ATOM 355 CB LYS A 25 19.400 -9.574 12.195 1.00 30.31 C ATOM 356 CG LYS A 25 18.791 -10.098 10.908 1.00 12.14 C ATOM 357 CD LYS A 25 18.225 -8.976 10.056 1.00 61.23 C ATOM 358 CE LYS A 25 17.479 -9.521 8.857 1.00 52.51 C ATOM 359 NZ LYS A 25 16.766 -8.449 8.103 1.00 22.01 N1+ ATOM 0 H LYS A 25 17.819 -11.014 13.450 1.00 22.35 H new ATOM 0 HA LYS A 25 20.546 -11.340 12.592 1.00 24.04 H new ATOM 0 HB2 LYS A 25 18.670 -8.950 12.710 1.00 30.31 H new ATOM 0 HB3 LYS A 25 20.252 -8.937 11.956 1.00 30.31 H new ATOM 0 HG2 LYS A 25 19.549 -10.639 10.341 1.00 12.14 H new ATOM 0 HG3 LYS A 25 18.000 -10.810 11.143 1.00 12.14 H new ATOM 0 HD2 LYS A 25 17.554 -8.363 10.657 1.00 61.23 H new ATOM 0 HD3 LYS A 25 19.034 -8.327 9.720 1.00 61.23 H new ATOM 0 HE2 LYS A 25 18.181 -10.025 8.193 1.00 52.51 H new ATOM 0 HE3 LYS A 25 16.760 -10.270 9.188 1.00 52.51 H new ATOM 0 HZ1 LYS A 25 15.890 -8.834 7.697 1.00 22.01 H new ATOM 0 HZ2 LYS A 25 16.534 -7.667 8.748 1.00 22.01 H new ATOM 0 HZ3 LYS A 25 17.377 -8.098 7.338 1.00 22.01 H new ATOM 373 N LEU A 26 19.834 -9.746 15.386 1.00 32.33 N ATOM 374 CA LEU A 26 20.457 -9.089 16.541 1.00 24.31 C ATOM 375 C LEU A 26 19.781 -9.488 17.846 1.00 21.31 C ATOM 376 O LEU A 26 18.582 -9.734 17.868 1.00 11.34 O ATOM 377 CB LEU A 26 20.396 -7.565 16.358 1.00 35.55 C ATOM 378 CG LEU A 26 20.866 -6.721 17.554 1.00 2.25 C ATOM 379 CD1 LEU A 26 22.351 -6.943 17.838 1.00 31.22 C ATOM 380 CD2 LEU A 26 20.567 -5.248 17.303 1.00 74.42 C ATOM 0 H LEU A 26 18.827 -9.891 15.461 1.00 32.33 H new ATOM 0 HA LEU A 26 21.496 -9.412 16.597 1.00 24.31 H new ATOM 0 HB2 LEU A 26 21.001 -7.299 15.491 1.00 35.55 H new ATOM 0 HB3 LEU A 26 19.368 -7.288 16.126 1.00 35.55 H new ATOM 0 HG LEU A 26 20.316 -7.040 18.440 1.00 2.25 H new ATOM 0 HD11 LEU A 26 22.654 -6.333 18.689 1.00 31.22 H new ATOM 0 HD12 LEU A 26 22.525 -7.995 18.066 1.00 31.22 H new ATOM 0 HD13 LEU A 26 22.935 -6.660 16.962 1.00 31.22 H new ATOM 0 HD21 LEU A 26 20.903 -4.658 18.156 1.00 74.42 H new ATOM 0 HD22 LEU A 26 21.089 -4.919 16.405 1.00 74.42 H new ATOM 0 HD23 LEU A 26 19.494 -5.112 17.169 1.00 74.42 H new ATOM 392 N ASP A 27 20.564 -9.538 18.925 1.00 3.11 N ATOM 393 CA ASP A 27 20.048 -9.843 20.260 1.00 12.11 C ATOM 394 C ASP A 27 20.986 -9.291 21.333 1.00 11.44 C ATOM 395 O ASP A 27 21.985 -9.923 21.682 1.00 42.31 O ATOM 396 CB ASP A 27 19.866 -11.361 20.442 1.00 5.04 C ATOM 397 CG ASP A 27 19.430 -11.742 21.853 1.00 74.13 C ATOM 398 OD1 ASP A 27 18.300 -11.386 22.247 1.00 54.23 O ATOM 399 OD2 ASP A 27 20.204 -12.423 22.565 1.00 11.42 O1- ATOM 0 H ASP A 27 21.570 -9.369 18.898 1.00 3.11 H new ATOM 0 HA ASP A 27 19.074 -9.365 20.366 1.00 12.11 H new ATOM 0 HB2 ASP A 27 19.125 -11.721 19.729 1.00 5.04 H new ATOM 0 HB3 ASP A 27 20.804 -11.865 20.209 1.00 5.04 H new ATOM 404 N VAL A 28 20.682 -8.089 21.820 1.00 5.03 N ATOM 405 CA VAL A 28 21.450 -7.452 22.896 1.00 42.02 C ATOM 406 C VAL A 28 20.534 -6.640 23.803 1.00 62.12 C ATOM 407 O VAL A 28 19.339 -6.526 23.548 1.00 32.30 O ATOM 408 CB VAL A 28 22.571 -6.524 22.359 1.00 24.24 C ATOM 409 CG1 VAL A 28 23.753 -7.337 21.846 1.00 34.22 C ATOM 410 CG2 VAL A 28 22.031 -5.588 21.275 1.00 1.00 C ATOM 0 H VAL A 28 19.899 -7.528 21.483 1.00 5.03 H new ATOM 0 HA VAL A 28 21.917 -8.261 23.458 1.00 42.02 H new ATOM 0 HB VAL A 28 22.926 -5.908 23.186 1.00 24.24 H new ATOM 0 HG11 VAL A 28 24.525 -6.663 21.475 1.00 34.22 H new ATOM 0 HG12 VAL A 28 24.158 -7.941 22.657 1.00 34.22 H new ATOM 0 HG13 VAL A 28 23.422 -7.989 21.038 1.00 34.22 H new ATOM 0 HG21 VAL A 28 22.835 -4.947 20.914 1.00 1.00 H new ATOM 0 HG22 VAL A 28 21.638 -6.178 20.447 1.00 1.00 H new ATOM 0 HG23 VAL A 28 21.234 -4.971 21.691 1.00 1.00 H new ATOM 420 N LYS A 29 21.108 -6.060 24.849 1.00 24.10 N ATOM 421 CA LYS A 29 20.350 -5.306 25.842 1.00 44.35 C ATOM 422 C LYS A 29 21.007 -3.953 26.111 1.00 43.02 C ATOM 423 O LYS A 29 22.231 -3.821 26.037 1.00 12.55 O ATOM 424 CB LYS A 29 20.213 -6.151 27.129 1.00 13.02 C ATOM 425 CG LYS A 29 20.280 -5.378 28.454 1.00 22.53 C ATOM 426 CD LYS A 29 21.713 -5.220 28.983 1.00 24.23 C ATOM 427 CE LYS A 29 22.289 -6.523 29.546 1.00 1.41 C ATOM 428 NZ LYS A 29 22.533 -7.555 28.501 1.00 62.42 N1+ ATOM 0 H LYS A 29 22.110 -6.098 25.034 1.00 24.10 H new ATOM 0 HA LYS A 29 19.350 -5.099 25.461 1.00 44.35 H new ATOM 0 HB2 LYS A 29 19.263 -6.684 27.090 1.00 13.02 H new ATOM 0 HB3 LYS A 29 21.001 -6.904 27.131 1.00 13.02 H new ATOM 0 HG2 LYS A 29 19.839 -4.391 28.316 1.00 22.53 H new ATOM 0 HG3 LYS A 29 19.677 -5.895 29.201 1.00 22.53 H new ATOM 0 HD2 LYS A 29 22.355 -4.863 28.177 1.00 24.23 H new ATOM 0 HD3 LYS A 29 21.725 -4.457 29.762 1.00 24.23 H new ATOM 0 HE2 LYS A 29 23.226 -6.307 30.060 1.00 1.41 H new ATOM 0 HE3 LYS A 29 21.602 -6.925 30.291 1.00 1.41 H new ATOM 0 HZ1 LYS A 29 23.287 -8.198 28.817 1.00 62.42 H new ATOM 0 HZ2 LYS A 29 21.661 -8.097 28.338 1.00 62.42 H new ATOM 0 HZ3 LYS A 29 22.822 -7.091 27.616 1.00 62.42 H new ATOM 442 N LEU A 30 20.184 -2.948 26.409 1.00 2.53 N ATOM 443 CA LEU A 30 20.663 -1.611 26.714 1.00 41.03 C ATOM 444 C LEU A 30 20.030 -1.088 28.009 1.00 64.12 C ATOM 445 O LEU A 30 19.045 -1.655 28.514 1.00 54.30 O ATOM 446 CB LEU A 30 20.420 -0.648 25.524 1.00 11.12 C ATOM 447 CG LEU A 30 19.059 -0.726 24.792 1.00 54.41 C ATOM 448 CD1 LEU A 30 18.912 -2.020 23.989 1.00 21.32 C ATOM 449 CD2 LEU A 30 17.896 -0.542 25.758 1.00 54.12 C ATOM 0 H LEU A 30 19.169 -3.043 26.444 1.00 2.53 H new ATOM 0 HA LEU A 30 21.740 -1.661 26.873 1.00 41.03 H new ATOM 0 HB2 LEU A 30 20.545 0.372 25.889 1.00 11.12 H new ATOM 0 HB3 LEU A 30 21.205 -0.822 24.788 1.00 11.12 H new ATOM 0 HG LEU A 30 19.035 0.099 24.080 1.00 54.41 H new ATOM 0 HD11 LEU A 30 17.942 -2.032 23.492 1.00 21.32 H new ATOM 0 HD12 LEU A 30 19.703 -2.076 23.242 1.00 21.32 H new ATOM 0 HD13 LEU A 30 18.986 -2.875 24.661 1.00 21.32 H new ATOM 0 HD21 LEU A 30 16.955 -0.602 25.211 1.00 54.12 H new ATOM 0 HD22 LEU A 30 17.926 -1.324 26.516 1.00 54.12 H new ATOM 0 HD23 LEU A 30 17.974 0.433 26.239 1.00 54.12 H new ATOM 461 N SER A 31 20.603 -0.014 28.542 1.00 75.34 N ATOM 462 CA SER A 31 20.186 0.548 29.823 1.00 34.22 C ATOM 463 C SER A 31 20.670 1.986 29.951 1.00 62.41 C ATOM 464 O SER A 31 21.361 2.499 29.069 1.00 64.13 O ATOM 465 CB SER A 31 20.738 -0.298 30.980 1.00 52.23 C ATOM 466 OG SER A 31 20.306 -1.647 30.882 1.00 11.31 O ATOM 0 H SER A 31 21.370 0.492 28.099 1.00 75.34 H new ATOM 0 HA SER A 31 19.097 0.538 29.868 1.00 34.22 H new ATOM 0 HB2 SER A 31 21.827 -0.261 30.973 1.00 52.23 H new ATOM 0 HB3 SER A 31 20.410 0.123 31.930 1.00 52.23 H new ATOM 0 HG SER A 31 19.573 -1.710 30.234 1.00 11.31 H new ATOM 472 N ALA A 32 20.306 2.623 31.055 1.00 52.21 N ATOM 473 CA ALA A 32 20.695 3.997 31.317 1.00 43.51 C ATOM 474 C ALA A 32 22.041 4.034 32.045 1.00 25.12 C ATOM 475 O ALA A 32 22.369 3.110 32.795 1.00 4.30 O ATOM 476 CB ALA A 32 19.605 4.688 32.128 1.00 22.44 C ATOM 0 H ALA A 32 19.736 2.203 31.789 1.00 52.21 H new ATOM 0 HA ALA A 32 20.813 4.531 30.374 1.00 43.51 H new ATOM 0 HB1 ALA A 32 19.897 5.720 32.325 1.00 22.44 H new ATOM 0 HB2 ALA A 32 18.671 4.676 31.567 1.00 22.44 H new ATOM 0 HB3 ALA A 32 19.467 4.163 33.073 1.00 22.44 H new ATOM 482 N PRO A 33 22.846 5.087 31.825 1.00 32.33 N ATOM 483 CA PRO A 33 24.164 5.220 32.457 1.00 35.40 C ATOM 484 C PRO A 33 24.075 5.278 33.983 1.00 50.42 C ATOM 485 O PRO A 33 23.347 6.105 34.539 1.00 70.53 O ATOM 486 CB PRO A 33 24.709 6.549 31.900 1.00 73.33 C ATOM 487 CG PRO A 33 23.897 6.821 30.677 1.00 10.15 C ATOM 488 CD PRO A 33 22.541 6.230 30.943 1.00 32.53 C ATOM 0 HA PRO A 33 24.801 4.363 32.240 1.00 35.40 H new ATOM 0 HB2 PRO A 33 24.606 7.353 32.628 1.00 73.33 H new ATOM 0 HB3 PRO A 33 25.769 6.470 31.660 1.00 73.33 H new ATOM 0 HG2 PRO A 33 23.826 7.892 30.486 1.00 10.15 H new ATOM 0 HG3 PRO A 33 24.354 6.370 29.796 1.00 10.15 H new ATOM 0 HD2 PRO A 33 21.876 6.946 31.425 1.00 32.53 H new ATOM 0 HD3 PRO A 33 22.052 5.911 30.023 1.00 32.53 H new ATOM 496 N ARG A 34 24.800 4.387 34.657 1.00 10.53 N ATOM 497 CA ARG A 34 24.920 4.411 36.109 1.00 33.33 C ATOM 498 C ARG A 34 25.350 5.797 36.597 1.00 40.12 C ATOM 499 O ARG A 34 25.016 6.207 37.712 1.00 0.24 O ATOM 500 CB ARG A 34 25.919 3.333 36.561 1.00 35.21 C ATOM 501 CG ARG A 34 25.298 2.281 37.464 1.00 34.41 C ATOM 502 CD ARG A 34 24.966 2.849 38.830 1.00 50.12 C ATOM 503 NE ARG A 34 26.175 3.230 39.562 1.00 3.50 N ATOM 504 CZ ARG A 34 26.227 4.180 40.497 1.00 2.33 C ATOM 505 NH1 ARG A 34 25.138 4.866 40.824 1.00 23.02 N1+ ATOM 506 NH2 ARG A 34 27.373 4.448 41.101 1.00 21.42 N ATOM 0 H ARG A 34 25.319 3.631 34.211 1.00 10.53 H new ATOM 0 HA ARG A 34 23.947 4.196 36.549 1.00 33.33 H new ATOM 0 HB2 ARG A 34 26.339 2.845 35.682 1.00 35.21 H new ATOM 0 HB3 ARG A 34 26.746 3.811 37.086 1.00 35.21 H new ATOM 0 HG2 ARG A 34 24.392 1.891 37.001 1.00 34.41 H new ATOM 0 HG3 ARG A 34 25.986 1.443 37.574 1.00 34.41 H new ATOM 0 HD2 ARG A 34 24.319 3.719 38.716 1.00 50.12 H new ATOM 0 HD3 ARG A 34 24.408 2.111 39.406 1.00 50.12 H new ATOM 0 HE ARG A 34 27.039 2.734 39.342 1.00 3.50 H new ATOM 0 HH11 ARG A 34 24.252 4.668 40.359 1.00 23.02 H new ATOM 0 HH12 ARG A 34 25.188 5.591 41.540 1.00 23.02 H new ATOM 0 HH21 ARG A 34 28.215 3.929 40.851 1.00 21.42 H new ATOM 0 HH22 ARG A 34 27.415 5.174 41.816 1.00 21.42 H new ATOM 520 N GLU A 35 26.067 6.512 35.735 1.00 72.31 N ATOM 521 CA GLU A 35 26.498 7.881 36.011 1.00 75.14 C ATOM 522 C GLU A 35 25.296 8.770 36.318 1.00 65.21 C ATOM 523 O GLU A 35 25.374 9.681 37.142 1.00 33.12 O ATOM 524 CB GLU A 35 27.259 8.457 34.805 1.00 20.34 C ATOM 525 CG GLU A 35 28.608 7.790 34.526 1.00 71.30 C ATOM 526 CD GLU A 35 28.499 6.307 34.194 1.00 31.03 C ATOM 527 OE1 GLU A 35 27.636 5.936 33.368 1.00 31.45 O ATOM 528 OE2 GLU A 35 29.279 5.504 34.748 1.00 43.03 O1- ATOM 0 H GLU A 35 26.366 6.160 34.826 1.00 72.31 H new ATOM 0 HA GLU A 35 27.158 7.858 36.878 1.00 75.14 H new ATOM 0 HB2 GLU A 35 26.632 8.364 33.918 1.00 20.34 H new ATOM 0 HB3 GLU A 35 27.422 9.522 34.970 1.00 20.34 H new ATOM 0 HG2 GLU A 35 29.093 8.305 33.697 1.00 71.30 H new ATOM 0 HG3 GLU A 35 29.251 7.912 35.397 1.00 71.30 H new ATOM 535 N LEU A 36 24.184 8.491 35.649 1.00 33.22 N ATOM 536 CA LEU A 36 22.972 9.292 35.776 1.00 32.24 C ATOM 537 C LEU A 36 21.903 8.538 36.568 1.00 55.25 C ATOM 538 O LEU A 36 20.733 8.920 36.569 1.00 40.24 O ATOM 539 CB LEU A 36 22.452 9.651 34.378 1.00 11.21 C ATOM 540 CG LEU A 36 23.472 10.363 33.470 1.00 24.22 C ATOM 541 CD1 LEU A 36 22.886 10.608 32.083 1.00 52.21 C ATOM 542 CD2 LEU A 36 23.943 11.674 34.102 1.00 63.44 C ATOM 0 H LEU A 36 24.097 7.705 35.005 1.00 33.22 H new ATOM 0 HA LEU A 36 23.206 10.207 36.320 1.00 32.24 H new ATOM 0 HB2 LEU A 36 22.123 8.737 33.883 1.00 11.21 H new ATOM 0 HB3 LEU A 36 21.575 10.289 34.485 1.00 11.21 H new ATOM 0 HG LEU A 36 24.339 9.711 33.360 1.00 24.22 H new ATOM 0 HD11 LEU A 36 23.625 11.112 31.460 1.00 52.21 H new ATOM 0 HD12 LEU A 36 22.617 9.655 31.628 1.00 52.21 H new ATOM 0 HD13 LEU A 36 21.997 11.233 32.169 1.00 52.21 H new ATOM 0 HD21 LEU A 36 24.663 12.158 33.442 1.00 63.44 H new ATOM 0 HD22 LEU A 36 23.088 12.333 34.253 1.00 63.44 H new ATOM 0 HD23 LEU A 36 24.414 11.466 35.063 1.00 63.44 H new ATOM 554 N GLY A 37 22.319 7.476 37.254 1.00 72.22 N ATOM 555 CA GLY A 37 21.392 6.685 38.047 1.00 12.23 C ATOM 556 C GLY A 37 20.718 5.591 37.237 1.00 31.23 C ATOM 557 O GLY A 37 19.547 5.284 37.452 1.00 41.24 O ATOM 0 H GLY A 37 23.285 7.148 37.275 1.00 72.22 H new ATOM 0 HA2 GLY A 37 21.927 6.236 38.884 1.00 12.23 H new ATOM 0 HA3 GLY A 37 20.631 7.340 38.470 1.00 12.23 H new ATOM 561 N GLY A 38 21.469 4.997 36.308 1.00 73.44 N ATOM 562 CA GLY A 38 20.938 3.935 35.462 1.00 31.42 C ATOM 563 C GLY A 38 20.603 2.662 36.223 1.00 22.15 C ATOM 564 O GLY A 38 20.074 1.714 35.643 1.00 21.21 O ATOM 0 H GLY A 38 22.444 5.235 36.125 1.00 73.44 H new ATOM 0 HA2 GLY A 38 20.040 4.296 34.961 1.00 31.42 H new ATOM 0 HA3 GLY A 38 21.666 3.703 34.684 1.00 31.42 H new ATOM 568 N ALA A 39 20.979 2.624 37.507 1.00 14.21 N ATOM 569 CA ALA A 39 20.606 1.567 38.423 1.00 43.43 C ATOM 570 C ALA A 39 21.431 0.319 38.190 1.00 63.22 C ATOM 571 O ALA A 39 21.266 -0.693 38.876 1.00 3.43 O ATOM 572 CB ALA A 39 19.125 1.321 38.332 1.00 5.43 C ATOM 0 H ALA A 39 21.561 3.344 37.935 1.00 14.21 H new ATOM 0 HA ALA A 39 20.826 1.878 39.444 1.00 43.43 H new ATOM 0 HB1 ALA A 39 18.845 0.525 39.022 1.00 5.43 H new ATOM 0 HB2 ALA A 39 18.588 2.233 38.593 1.00 5.43 H new ATOM 0 HB3 ALA A 39 18.867 1.027 37.315 1.00 5.43 H new ATOM 578 N GLY A 40 22.314 0.405 37.209 1.00 15.31 N ATOM 579 CA GLY A 40 23.383 -0.543 37.093 1.00 42.15 C ATOM 580 C GLY A 40 23.158 -1.590 36.020 1.00 45.53 C ATOM 581 O GLY A 40 22.388 -2.533 36.213 1.00 15.12 O ATOM 0 H GLY A 40 22.302 1.125 36.487 1.00 15.31 H new ATOM 0 HA2 GLY A 40 24.308 -0.009 36.878 1.00 42.15 H new ATOM 0 HA3 GLY A 40 23.519 -1.043 38.052 1.00 42.15 H new ATOM 585 N ALA A 41 23.821 -1.407 34.884 1.00 5.32 N ATOM 586 CA ALA A 41 23.823 -2.391 33.813 1.00 5.21 C ATOM 587 C ALA A 41 24.947 -2.086 32.833 1.00 44.21 C ATOM 588 O ALA A 41 25.276 -0.923 32.592 1.00 13.22 O ATOM 589 CB ALA A 41 22.483 -2.420 33.092 1.00 40.21 C ATOM 0 H ALA A 41 24.371 -0.572 34.681 1.00 5.32 H new ATOM 0 HA ALA A 41 23.988 -3.376 34.251 1.00 5.21 H new ATOM 0 HB1 ALA A 41 22.514 -3.165 32.297 1.00 40.21 H new ATOM 0 HB2 ALA A 41 21.695 -2.677 33.799 1.00 40.21 H new ATOM 0 HB3 ALA A 41 22.279 -1.439 32.663 1.00 40.21 H new ATOM 595 N GLU A 42 25.523 -3.137 32.269 1.00 32.32 N ATOM 596 CA GLU A 42 26.650 -3.018 31.345 1.00 71.23 C ATOM 597 C GLU A 42 26.175 -3.163 29.899 1.00 1.12 C ATOM 598 O GLU A 42 26.881 -3.710 29.046 1.00 55.43 O ATOM 599 CB GLU A 42 27.703 -4.079 31.697 1.00 42.31 C ATOM 600 CG GLU A 42 27.119 -5.470 31.918 1.00 52.14 C ATOM 601 CD GLU A 42 28.146 -6.473 32.414 1.00 31.41 C ATOM 602 OE1 GLU A 42 28.526 -7.385 31.642 1.00 24.22 O ATOM 603 OE2 GLU A 42 28.571 -6.362 33.584 1.00 54.53 O1- ATOM 0 H GLU A 42 25.225 -4.098 32.436 1.00 32.32 H new ATOM 0 HA GLU A 42 27.101 -2.030 31.441 1.00 71.23 H new ATOM 0 HB2 GLU A 42 28.440 -4.127 30.895 1.00 42.31 H new ATOM 0 HB3 GLU A 42 28.232 -3.769 32.598 1.00 42.31 H new ATOM 0 HG2 GLU A 42 26.304 -5.406 32.639 1.00 52.14 H new ATOM 0 HG3 GLU A 42 26.689 -5.830 30.983 1.00 52.14 H new ATOM 610 N GLY A 43 24.979 -2.643 29.629 1.00 3.30 N ATOM 611 CA GLY A 43 24.400 -2.722 28.298 1.00 20.41 C ATOM 612 C GLY A 43 24.915 -1.631 27.372 1.00 55.55 C ATOM 613 O GLY A 43 26.120 -1.494 27.168 1.00 25.21 O ATOM 0 H GLY A 43 24.396 -2.164 30.316 1.00 3.30 H new ATOM 0 HA2 GLY A 43 24.624 -3.697 27.865 1.00 20.41 H new ATOM 0 HA3 GLY A 43 23.315 -2.648 28.373 1.00 20.41 H new ATOM 617 N THR A 44 24.001 -0.852 26.807 1.00 1.14 N ATOM 618 CA THR A 44 24.349 0.207 25.880 1.00 0.00 C ATOM 619 C THR A 44 23.464 1.430 26.128 1.00 54.32 C ATOM 620 O THR A 44 22.338 1.292 26.604 1.00 53.24 O ATOM 621 CB THR A 44 24.177 -0.298 24.429 1.00 74.01 C ATOM 622 OG1 THR A 44 25.030 -1.433 24.208 1.00 60.01 O ATOM 623 CG2 THR A 44 24.499 0.792 23.422 1.00 54.14 C ATOM 0 H THR A 44 23.000 -0.940 26.981 1.00 1.14 H new ATOM 0 HA THR A 44 25.389 0.495 26.033 1.00 0.00 H new ATOM 0 HB THR A 44 23.135 -0.587 24.291 1.00 74.01 H new ATOM 0 HG1 THR A 44 24.918 -1.752 23.288 1.00 60.01 H new ATOM 0 HG21 THR A 44 24.368 0.404 22.412 1.00 54.14 H new ATOM 0 HG22 THR A 44 23.829 1.638 23.575 1.00 54.14 H new ATOM 0 HG23 THR A 44 25.531 1.117 23.555 1.00 54.14 H new ATOM 631 N ASN A 45 23.981 2.618 25.829 1.00 72.33 N ATOM 632 CA ASN A 45 23.231 3.860 26.023 1.00 33.43 C ATOM 633 C ASN A 45 22.336 4.129 24.807 1.00 24.30 C ATOM 634 O ASN A 45 22.759 3.913 23.671 1.00 63.01 O ATOM 635 CB ASN A 45 24.187 5.044 26.244 1.00 4.20 C ATOM 636 CG ASN A 45 25.211 4.798 27.343 1.00 5.33 C ATOM 637 OD1 ASN A 45 25.666 3.672 27.555 1.00 50.31 O ATOM 638 ND2 ASN A 45 25.585 5.853 28.049 1.00 41.45 N ATOM 0 H ASN A 45 24.919 2.749 25.450 1.00 72.33 H new ATOM 0 HA ASN A 45 22.607 3.750 26.910 1.00 33.43 H new ATOM 0 HB2 ASN A 45 24.710 5.258 25.312 1.00 4.20 H new ATOM 0 HB3 ASN A 45 23.604 5.931 26.493 1.00 4.20 H new ATOM 0 HD21 ASN A 45 26.271 5.749 28.797 1.00 41.45 H new ATOM 0 HD22 ASN A 45 25.187 6.770 27.846 1.00 41.45 H new ATOM 645 N PRO A 46 21.095 4.601 25.031 1.00 63.04 N ATOM 646 CA PRO A 46 20.114 4.841 23.953 1.00 61.02 C ATOM 647 C PRO A 46 20.608 5.842 22.898 1.00 4.44 C ATOM 648 O PRO A 46 20.725 5.502 21.712 1.00 23.02 O ATOM 649 CB PRO A 46 18.886 5.394 24.701 1.00 23.35 C ATOM 650 CG PRO A 46 19.053 4.919 26.106 1.00 42.23 C ATOM 651 CD PRO A 46 20.534 4.930 26.358 1.00 1.14 C ATOM 0 HA PRO A 46 19.912 3.932 23.387 1.00 61.02 H new ATOM 0 HB2 PRO A 46 18.850 6.482 24.653 1.00 23.35 H new ATOM 0 HB3 PRO A 46 17.958 5.024 24.266 1.00 23.35 H new ATOM 0 HG2 PRO A 46 18.531 5.571 26.806 1.00 42.23 H new ATOM 0 HG3 PRO A 46 18.640 3.918 26.234 1.00 42.23 H new ATOM 0 HD2 PRO A 46 20.877 5.902 26.712 1.00 1.14 H new ATOM 0 HD3 PRO A 46 20.821 4.197 27.112 1.00 1.14 H new ATOM 659 N GLU A 47 20.909 7.068 23.333 1.00 25.31 N ATOM 660 CA GLU A 47 21.373 8.125 22.422 1.00 53.11 C ATOM 661 C GLU A 47 22.608 7.642 21.670 1.00 42.42 C ATOM 662 O GLU A 47 22.779 7.893 20.477 1.00 0.52 O ATOM 663 CB GLU A 47 21.729 9.426 23.177 1.00 52.55 C ATOM 664 CG GLU A 47 20.751 9.834 24.277 1.00 35.10 C ATOM 665 CD GLU A 47 20.935 9.026 25.553 1.00 32.04 C ATOM 666 OE1 GLU A 47 20.048 8.212 25.883 1.00 53.13 O ATOM 667 OE2 GLU A 47 21.988 9.177 26.208 1.00 62.13 O1- ATOM 0 H GLU A 47 20.841 7.356 24.309 1.00 25.31 H new ATOM 0 HA GLU A 47 20.558 8.343 21.731 1.00 53.11 H new ATOM 0 HB2 GLU A 47 22.719 9.310 23.619 1.00 52.55 H new ATOM 0 HB3 GLU A 47 21.796 10.239 22.454 1.00 52.55 H new ATOM 0 HG2 GLU A 47 20.882 10.893 24.500 1.00 35.10 H new ATOM 0 HG3 GLU A 47 19.730 9.708 23.916 1.00 35.10 H new ATOM 674 N GLN A 48 23.457 6.940 22.405 1.00 41.14 N ATOM 675 CA GLN A 48 24.686 6.367 21.876 1.00 71.11 C ATOM 676 C GLN A 48 24.382 5.352 20.776 1.00 34.04 C ATOM 677 O GLN A 48 25.065 5.304 19.751 1.00 32.22 O ATOM 678 CB GLN A 48 25.436 5.691 23.024 1.00 12.45 C ATOM 679 CG GLN A 48 26.748 5.025 22.639 1.00 72.35 C ATOM 680 CD GLN A 48 27.327 4.236 23.795 1.00 3.55 C ATOM 681 OE1 GLN A 48 28.091 4.758 24.603 1.00 43.42 O ATOM 682 NE2 GLN A 48 26.949 2.972 23.894 1.00 72.04 N ATOM 0 H GLN A 48 23.311 6.750 23.396 1.00 41.14 H new ATOM 0 HA GLN A 48 25.298 7.156 21.440 1.00 71.11 H new ATOM 0 HB2 GLN A 48 25.638 6.436 23.793 1.00 12.45 H new ATOM 0 HB3 GLN A 48 24.784 4.941 23.471 1.00 12.45 H new ATOM 0 HG2 GLN A 48 26.586 4.362 21.789 1.00 72.35 H new ATOM 0 HG3 GLN A 48 27.463 5.783 22.320 1.00 72.35 H new ATOM 0 HE21 GLN A 48 26.313 2.574 23.203 1.00 72.04 H new ATOM 0 HE22 GLN A 48 27.294 2.395 24.661 1.00 72.04 H new ATOM 691 N LEU A 49 23.347 4.546 21.003 1.00 51.33 N ATOM 692 CA LEU A 49 22.950 3.508 20.061 1.00 61.13 C ATOM 693 C LEU A 49 22.466 4.151 18.758 1.00 21.55 C ATOM 694 O LEU A 49 22.908 3.775 17.667 1.00 71.11 O ATOM 695 CB LEU A 49 21.857 2.619 20.694 1.00 4.20 C ATOM 696 CG LEU A 49 21.597 1.252 20.020 1.00 31.10 C ATOM 697 CD1 LEU A 49 20.851 1.409 18.699 1.00 0.52 C ATOM 698 CD2 LEU A 49 22.909 0.495 19.812 1.00 52.41 C ATOM 0 H LEU A 49 22.765 4.595 21.839 1.00 51.33 H new ATOM 0 HA LEU A 49 23.805 2.874 19.827 1.00 61.13 H new ATOM 0 HB2 LEU A 49 22.125 2.439 21.735 1.00 4.20 H new ATOM 0 HB3 LEU A 49 20.922 3.180 20.698 1.00 4.20 H new ATOM 0 HG LEU A 49 20.962 0.671 20.689 1.00 31.10 H new ATOM 0 HD11 LEU A 49 20.687 0.427 18.255 1.00 0.52 H new ATOM 0 HD12 LEU A 49 19.890 1.891 18.879 1.00 0.52 H new ATOM 0 HD13 LEU A 49 21.442 2.021 18.018 1.00 0.52 H new ATOM 0 HD21 LEU A 49 22.704 -0.464 19.337 1.00 52.41 H new ATOM 0 HD22 LEU A 49 23.571 1.082 19.175 1.00 52.41 H new ATOM 0 HD23 LEU A 49 23.389 0.327 20.776 1.00 52.41 H new ATOM 710 N PHE A 50 21.571 5.132 18.879 1.00 3.42 N ATOM 711 CA PHE A 50 21.068 5.860 17.712 1.00 25.51 C ATOM 712 C PHE A 50 22.215 6.561 16.988 1.00 64.45 C ATOM 713 O PHE A 50 22.297 6.527 15.762 1.00 15.22 O ATOM 714 CB PHE A 50 19.991 6.881 18.122 1.00 52.14 C ATOM 715 CG PHE A 50 19.601 7.842 17.016 1.00 40.34 C ATOM 716 CD1 PHE A 50 18.840 7.424 15.929 1.00 40.14 C ATOM 717 CD2 PHE A 50 19.992 9.168 17.070 1.00 31.01 C ATOM 718 CE1 PHE A 50 18.484 8.306 14.928 1.00 11.20 C ATOM 719 CE2 PHE A 50 19.640 10.053 16.071 1.00 34.34 C ATOM 720 CZ PHE A 50 18.885 9.621 14.998 1.00 61.21 C ATOM 0 H PHE A 50 21.180 5.440 19.769 1.00 3.42 H new ATOM 0 HA PHE A 50 20.612 5.139 17.033 1.00 25.51 H new ATOM 0 HB2 PHE A 50 19.102 6.344 18.453 1.00 52.14 H new ATOM 0 HB3 PHE A 50 20.354 7.453 18.976 1.00 52.14 H new ATOM 0 HD1 PHE A 50 18.523 6.394 15.867 1.00 40.14 H new ATOM 0 HD2 PHE A 50 20.581 9.516 17.906 1.00 31.01 H new ATOM 0 HE1 PHE A 50 17.892 7.965 14.092 1.00 11.20 H new ATOM 0 HE2 PHE A 50 19.955 11.084 16.128 1.00 34.34 H new ATOM 0 HZ PHE A 50 18.610 10.313 14.216 1.00 61.21 H new ATOM 730 N ALA A 51 23.092 7.198 17.757 1.00 33.43 N ATOM 731 CA ALA A 51 24.266 7.875 17.211 1.00 33.33 C ATOM 732 C ALA A 51 25.099 6.934 16.340 1.00 4.13 C ATOM 733 O ALA A 51 25.400 7.246 15.186 1.00 52.03 O ATOM 734 CB ALA A 51 25.123 8.434 18.339 1.00 51.41 C ATOM 0 H ALA A 51 23.011 7.260 18.772 1.00 33.43 H new ATOM 0 HA ALA A 51 23.916 8.695 16.584 1.00 33.33 H new ATOM 0 HB1 ALA A 51 25.995 8.936 17.919 1.00 51.41 H new ATOM 0 HB2 ALA A 51 24.539 9.147 18.921 1.00 51.41 H new ATOM 0 HB3 ALA A 51 25.450 7.620 18.986 1.00 51.41 H new ATOM 740 N ALA A 52 25.457 5.783 16.900 1.00 32.43 N ATOM 741 CA ALA A 52 26.262 4.793 16.190 1.00 41.10 C ATOM 742 C ALA A 52 25.542 4.318 14.931 1.00 30.53 C ATOM 743 O ALA A 52 26.132 4.244 13.848 1.00 13.40 O ATOM 744 CB ALA A 52 26.579 3.613 17.104 1.00 51.43 C ATOM 0 H ALA A 52 25.201 5.511 17.849 1.00 32.43 H new ATOM 0 HA ALA A 52 27.200 5.261 15.891 1.00 41.10 H new ATOM 0 HB1 ALA A 52 27.180 2.883 16.561 1.00 51.43 H new ATOM 0 HB2 ALA A 52 27.134 3.965 17.973 1.00 51.43 H new ATOM 0 HB3 ALA A 52 25.650 3.147 17.432 1.00 51.43 H new ATOM 750 N GLY A 53 24.256 4.022 15.078 1.00 32.23 N ATOM 751 CA GLY A 53 23.462 3.556 13.959 1.00 45.35 C ATOM 752 C GLY A 53 23.308 4.609 12.880 1.00 24.44 C ATOM 753 O GLY A 53 23.331 4.294 11.692 1.00 23.31 O ATOM 0 H GLY A 53 23.747 4.097 15.959 1.00 32.23 H new ATOM 0 HA2 GLY A 53 23.928 2.668 13.532 1.00 45.35 H new ATOM 0 HA3 GLY A 53 22.476 3.259 14.316 1.00 45.35 H new ATOM 757 N TYR A 54 23.170 5.864 13.296 1.00 20.42 N ATOM 758 CA TYR A 54 22.958 6.973 12.370 1.00 1.52 C ATOM 759 C TYR A 54 24.258 7.334 11.651 1.00 10.14 C ATOM 760 O TYR A 54 24.246 7.662 10.468 1.00 3.35 O ATOM 761 CB TYR A 54 22.389 8.195 13.115 1.00 4.31 C ATOM 762 CG TYR A 54 22.074 9.392 12.224 1.00 71.40 C ATOM 763 CD1 TYR A 54 21.730 9.224 10.883 1.00 61.33 C ATOM 764 CD2 TYR A 54 22.118 10.688 12.728 1.00 12.15 C ATOM 765 CE1 TYR A 54 21.448 10.310 10.078 1.00 65.13 C ATOM 766 CE2 TYR A 54 21.833 11.778 11.926 1.00 14.31 C ATOM 767 CZ TYR A 54 21.501 11.582 10.602 1.00 61.32 C ATOM 768 OH TYR A 54 21.220 12.663 9.794 1.00 14.13 O ATOM 0 H TYR A 54 23.202 6.141 14.277 1.00 20.42 H new ATOM 0 HA TYR A 54 22.232 6.660 11.619 1.00 1.52 H new ATOM 0 HB2 TYR A 54 21.479 7.896 13.634 1.00 4.31 H new ATOM 0 HB3 TYR A 54 23.104 8.504 13.877 1.00 4.31 H new ATOM 0 HD1 TYR A 54 21.683 8.228 10.467 1.00 61.33 H new ATOM 0 HD2 TYR A 54 22.379 10.846 13.764 1.00 12.15 H new ATOM 0 HE1 TYR A 54 21.187 10.162 9.041 1.00 65.13 H new ATOM 0 HE2 TYR A 54 21.870 12.777 12.334 1.00 14.31 H new ATOM 0 HH TYR A 54 21.976 13.287 9.808 1.00 14.13 H new ATOM 778 N SER A 55 25.375 7.270 12.366 1.00 11.10 N ATOM 779 CA SER A 55 26.676 7.537 11.761 1.00 22.53 C ATOM 780 C SER A 55 27.003 6.453 10.734 1.00 50.31 C ATOM 781 O SER A 55 27.454 6.745 9.623 1.00 23.31 O ATOM 782 CB SER A 55 27.762 7.623 12.841 1.00 0.44 C ATOM 783 OG SER A 55 27.699 6.516 13.723 1.00 35.10 O ATOM 0 H SER A 55 25.408 7.037 13.359 1.00 11.10 H new ATOM 0 HA SER A 55 26.641 8.498 11.248 1.00 22.53 H new ATOM 0 HB2 SER A 55 28.744 7.660 12.370 1.00 0.44 H new ATOM 0 HB3 SER A 55 27.644 8.548 13.406 1.00 0.44 H new ATOM 0 HG SER A 55 26.979 6.656 14.373 1.00 35.10 H new ATOM 789 N ALA A 56 26.746 5.201 11.109 1.00 25.24 N ATOM 790 CA ALA A 56 26.912 4.074 10.198 1.00 63.14 C ATOM 791 C ALA A 56 25.934 4.189 9.028 1.00 34.41 C ATOM 792 O ALA A 56 26.279 3.912 7.874 1.00 72.41 O ATOM 793 CB ALA A 56 26.707 2.764 10.946 1.00 2.41 C ATOM 0 H ALA A 56 26.421 4.943 12.041 1.00 25.24 H new ATOM 0 HA ALA A 56 27.926 4.088 9.798 1.00 63.14 H new ATOM 0 HB1 ALA A 56 26.833 1.928 10.258 1.00 2.41 H new ATOM 0 HB2 ALA A 56 27.439 2.686 11.750 1.00 2.41 H new ATOM 0 HB3 ALA A 56 25.702 2.739 11.367 1.00 2.41 H new ATOM 799 N CYS A 57 24.711 4.611 9.340 1.00 43.11 N ATOM 800 CA CYS A 57 23.686 4.842 8.329 1.00 65.50 C ATOM 801 C CYS A 57 24.122 5.949 7.379 1.00 1.30 C ATOM 802 O CYS A 57 23.867 5.883 6.181 1.00 31.43 O ATOM 803 CB CYS A 57 22.352 5.217 8.986 1.00 74.40 C ATOM 804 SG CYS A 57 21.039 5.627 7.813 1.00 3.24 S ATOM 0 H CYS A 57 24.405 4.801 10.294 1.00 43.11 H new ATOM 0 HA CYS A 57 23.550 3.920 7.764 1.00 65.50 H new ATOM 0 HB2 CYS A 57 22.021 4.387 9.610 1.00 74.40 H new ATOM 0 HB3 CYS A 57 22.512 6.068 9.647 1.00 74.40 H new ATOM 0 HG CYS A 57 20.337 6.619 8.276 1.00 3.24 H new ATOM 810 N PHE A 58 24.800 6.952 7.926 1.00 12.51 N ATOM 811 CA PHE A 58 25.264 8.095 7.150 1.00 55.51 C ATOM 812 C PHE A 58 26.284 7.630 6.111 1.00 60.31 C ATOM 813 O PHE A 58 26.272 8.074 4.963 1.00 54.45 O ATOM 814 CB PHE A 58 25.882 9.144 8.093 1.00 64.12 C ATOM 815 CG PHE A 58 25.739 10.565 7.611 1.00 32.51 C ATOM 816 CD1 PHE A 58 26.779 11.207 6.954 1.00 53.31 C ATOM 817 CD2 PHE A 58 24.557 11.259 7.827 1.00 40.52 C ATOM 818 CE1 PHE A 58 26.639 12.513 6.522 1.00 60.42 C ATOM 819 CE2 PHE A 58 24.412 12.562 7.398 1.00 51.42 C ATOM 820 CZ PHE A 58 25.455 13.192 6.745 1.00 5.31 C ATOM 0 H PHE A 58 25.042 6.995 8.916 1.00 12.51 H new ATOM 0 HA PHE A 58 24.423 8.552 6.629 1.00 55.51 H new ATOM 0 HB2 PHE A 58 25.414 9.056 9.074 1.00 64.12 H new ATOM 0 HB3 PHE A 58 26.941 8.921 8.223 1.00 64.12 H new ATOM 0 HD1 PHE A 58 27.706 10.682 6.778 1.00 53.31 H new ATOM 0 HD2 PHE A 58 23.739 10.772 8.338 1.00 40.52 H new ATOM 0 HE1 PHE A 58 27.454 13.003 6.010 1.00 60.42 H new ATOM 0 HE2 PHE A 58 23.485 13.089 7.572 1.00 51.42 H new ATOM 0 HZ PHE A 58 25.345 14.213 6.410 1.00 5.31 H new ATOM 830 N LEU A 59 27.154 6.714 6.530 1.00 64.51 N ATOM 831 CA LEU A 59 28.145 6.112 5.640 1.00 63.33 C ATOM 832 C LEU A 59 27.452 5.289 4.555 1.00 14.15 C ATOM 833 O LEU A 59 27.817 5.348 3.379 1.00 3.51 O ATOM 834 CB LEU A 59 29.101 5.224 6.446 1.00 74.12 C ATOM 835 CG LEU A 59 29.932 5.954 7.512 1.00 31.41 C ATOM 836 CD1 LEU A 59 30.677 4.956 8.388 1.00 61.22 C ATOM 837 CD2 LEU A 59 30.910 6.929 6.859 1.00 2.33 C ATOM 0 H LEU A 59 27.193 6.370 7.489 1.00 64.51 H new ATOM 0 HA LEU A 59 28.717 6.907 5.162 1.00 63.33 H new ATOM 0 HB2 LEU A 59 28.520 4.442 6.935 1.00 74.12 H new ATOM 0 HB3 LEU A 59 29.782 4.729 5.754 1.00 74.12 H new ATOM 0 HG LEU A 59 29.251 6.524 8.144 1.00 31.41 H new ATOM 0 HD11 LEU A 59 31.260 5.493 9.137 1.00 61.22 H new ATOM 0 HD12 LEU A 59 29.960 4.303 8.886 1.00 61.22 H new ATOM 0 HD13 LEU A 59 31.345 4.357 7.769 1.00 61.22 H new ATOM 0 HD21 LEU A 59 31.489 7.436 7.631 1.00 2.33 H new ATOM 0 HD22 LEU A 59 31.584 6.382 6.201 1.00 2.33 H new ATOM 0 HD23 LEU A 59 30.356 7.666 6.279 1.00 2.33 H new ATOM 849 N SER A 60 26.446 4.523 4.963 1.00 34.05 N ATOM 850 CA SER A 60 25.668 3.713 4.035 1.00 74.40 C ATOM 851 C SER A 60 24.954 4.610 3.021 1.00 42.34 C ATOM 852 O SER A 60 24.970 4.347 1.810 1.00 41.15 O ATOM 853 CB SER A 60 24.656 2.865 4.810 1.00 52.34 C ATOM 854 OG SER A 60 25.309 2.062 5.782 1.00 74.20 O ATOM 0 H SER A 60 26.150 4.447 5.936 1.00 34.05 H new ATOM 0 HA SER A 60 26.339 3.048 3.491 1.00 74.40 H new ATOM 0 HB2 SER A 60 23.929 3.514 5.297 1.00 52.34 H new ATOM 0 HB3 SER A 60 24.103 2.229 4.119 1.00 52.34 H new ATOM 0 HG SER A 60 25.610 2.627 6.524 1.00 74.20 H new ATOM 860 N ALA A 61 24.360 5.686 3.532 1.00 5.22 N ATOM 861 CA ALA A 61 23.655 6.656 2.708 1.00 61.10 C ATOM 862 C ALA A 61 24.610 7.279 1.705 1.00 23.52 C ATOM 863 O ALA A 61 24.307 7.355 0.521 1.00 64.15 O ATOM 864 CB ALA A 61 23.015 7.732 3.582 1.00 23.00 C ATOM 0 H ALA A 61 24.356 5.907 4.528 1.00 5.22 H new ATOM 0 HA ALA A 61 22.862 6.144 2.162 1.00 61.10 H new ATOM 0 HB1 ALA A 61 22.492 8.450 2.951 1.00 23.00 H new ATOM 0 HB2 ALA A 61 22.307 7.269 4.269 1.00 23.00 H new ATOM 0 HB3 ALA A 61 23.789 8.246 4.151 1.00 23.00 H new ATOM 870 N MET A 62 25.779 7.697 2.186 1.00 1.42 N ATOM 871 CA MET A 62 26.800 8.289 1.326 1.00 22.23 C ATOM 872 C MET A 62 27.276 7.289 0.276 1.00 52.25 C ATOM 873 O MET A 62 27.591 7.671 -0.852 1.00 52.11 O ATOM 874 CB MET A 62 27.993 8.792 2.152 1.00 12.31 C ATOM 875 CG MET A 62 27.704 10.067 2.936 1.00 13.45 C ATOM 876 SD MET A 62 27.222 11.445 1.873 1.00 13.34 S ATOM 877 CE MET A 62 28.637 11.568 0.779 1.00 61.32 C ATOM 0 H MET A 62 26.043 7.636 3.169 1.00 1.42 H new ATOM 0 HA MET A 62 26.348 9.140 0.817 1.00 22.23 H new ATOM 0 HB2 MET A 62 28.297 8.010 2.848 1.00 12.31 H new ATOM 0 HB3 MET A 62 28.836 8.970 1.484 1.00 12.31 H new ATOM 0 HG2 MET A 62 26.909 9.874 3.656 1.00 13.45 H new ATOM 0 HG3 MET A 62 28.590 10.346 3.507 1.00 13.45 H new ATOM 0 HE1 MET A 62 28.847 12.617 0.573 1.00 61.32 H new ATOM 0 HE2 MET A 62 29.505 11.111 1.254 1.00 61.32 H new ATOM 0 HE3 MET A 62 28.420 11.051 -0.156 1.00 61.32 H new ATOM 887 N LYS A 63 27.327 6.010 0.649 1.00 50.31 N ATOM 888 CA LYS A 63 27.738 4.963 -0.284 1.00 32.21 C ATOM 889 C LYS A 63 26.717 4.842 -1.416 1.00 55.33 C ATOM 890 O LYS A 63 27.085 4.735 -2.588 1.00 31.21 O ATOM 891 CB LYS A 63 27.922 3.607 0.434 1.00 32.54 C ATOM 892 CG LYS A 63 28.443 2.505 -0.490 1.00 62.32 C ATOM 893 CD LYS A 63 28.883 1.239 0.256 1.00 52.53 C ATOM 894 CE LYS A 63 27.714 0.426 0.815 1.00 52.13 C ATOM 895 NZ LYS A 63 27.288 0.882 2.167 1.00 51.23 N1+ ATOM 0 H LYS A 63 27.091 5.677 1.584 1.00 50.31 H new ATOM 0 HA LYS A 63 28.703 5.242 -0.706 1.00 32.21 H new ATOM 0 HB2 LYS A 63 28.615 3.734 1.265 1.00 32.54 H new ATOM 0 HB3 LYS A 63 26.968 3.295 0.859 1.00 32.54 H new ATOM 0 HG2 LYS A 63 27.664 2.243 -1.206 1.00 62.32 H new ATOM 0 HG3 LYS A 63 29.286 2.891 -1.063 1.00 62.32 H new ATOM 0 HD2 LYS A 63 29.462 0.611 -0.420 1.00 52.53 H new ATOM 0 HD3 LYS A 63 29.545 1.520 1.075 1.00 52.53 H new ATOM 0 HE2 LYS A 63 26.869 0.495 0.130 1.00 52.13 H new ATOM 0 HE3 LYS A 63 27.999 -0.625 0.864 1.00 52.13 H new ATOM 0 HZ1 LYS A 63 27.405 0.105 2.848 1.00 51.23 H new ATOM 0 HZ2 LYS A 63 27.872 1.691 2.461 1.00 51.23 H new ATOM 0 HZ3 LYS A 63 26.289 1.169 2.138 1.00 51.23 H new ATOM 909 N PHE A 64 25.434 4.878 -1.057 1.00 54.13 N ATOM 910 CA PHE A 64 24.360 4.830 -2.050 1.00 15.41 C ATOM 911 C PHE A 64 24.359 6.103 -2.906 1.00 43.31 C ATOM 912 O PHE A 64 24.324 6.036 -4.139 1.00 31.42 O ATOM 913 CB PHE A 64 22.997 4.647 -1.363 1.00 54.23 C ATOM 914 CG PHE A 64 21.834 4.644 -2.326 1.00 22.52 C ATOM 915 CD1 PHE A 64 21.650 3.587 -3.207 1.00 70.34 C ATOM 916 CD2 PHE A 64 20.927 5.696 -2.353 1.00 44.41 C ATOM 917 CE1 PHE A 64 20.588 3.580 -4.092 1.00 70.35 C ATOM 918 CE2 PHE A 64 19.865 5.692 -3.236 1.00 31.33 C ATOM 919 CZ PHE A 64 19.696 4.633 -4.106 1.00 62.32 C ATOM 0 H PHE A 64 25.113 4.940 -0.091 1.00 54.13 H new ATOM 0 HA PHE A 64 24.536 3.975 -2.702 1.00 15.41 H new ATOM 0 HB2 PHE A 64 23.002 3.709 -0.808 1.00 54.23 H new ATOM 0 HB3 PHE A 64 22.855 5.447 -0.636 1.00 54.23 H new ATOM 0 HD1 PHE A 64 22.345 2.760 -3.201 1.00 70.34 H new ATOM 0 HD2 PHE A 64 21.054 6.527 -1.675 1.00 44.41 H new ATOM 0 HE1 PHE A 64 20.456 2.751 -4.772 1.00 70.35 H new ATOM 0 HE2 PHE A 64 19.167 6.516 -3.246 1.00 31.33 H new ATOM 0 HZ PHE A 64 18.866 4.629 -4.797 1.00 62.32 H new ATOM 929 N VAL A 65 24.411 7.254 -2.241 1.00 22.12 N ATOM 930 CA VAL A 65 24.405 8.551 -2.915 1.00 1.13 C ATOM 931 C VAL A 65 25.539 8.641 -3.932 1.00 2.04 C ATOM 932 O VAL A 65 25.323 9.021 -5.082 1.00 1.42 O ATOM 933 CB VAL A 65 24.522 9.720 -1.901 1.00 51.41 C ATOM 934 CG1 VAL A 65 24.749 11.047 -2.625 1.00 35.23 C ATOM 935 CG2 VAL A 65 23.276 9.798 -1.017 1.00 41.32 C ATOM 0 H VAL A 65 24.458 7.315 -1.224 1.00 22.12 H new ATOM 0 HA VAL A 65 23.451 8.638 -3.435 1.00 1.13 H new ATOM 0 HB VAL A 65 25.384 9.527 -1.262 1.00 51.41 H new ATOM 0 HG11 VAL A 65 24.828 11.852 -1.894 1.00 35.23 H new ATOM 0 HG12 VAL A 65 25.670 10.992 -3.205 1.00 35.23 H new ATOM 0 HG13 VAL A 65 23.911 11.245 -3.293 1.00 35.23 H new ATOM 0 HG21 VAL A 65 23.380 10.624 -0.314 1.00 41.32 H new ATOM 0 HG22 VAL A 65 22.397 9.961 -1.641 1.00 41.32 H new ATOM 0 HG23 VAL A 65 23.162 8.865 -0.466 1.00 41.32 H new ATOM 945 N ALA A 66 26.743 8.271 -3.509 1.00 10.53 N ATOM 946 CA ALA A 66 27.904 8.277 -4.394 1.00 34.24 C ATOM 947 C ALA A 66 27.640 7.415 -5.629 1.00 52.01 C ATOM 948 O ALA A 66 28.120 7.710 -6.726 1.00 55.45 O ATOM 949 CB ALA A 66 29.140 7.786 -3.646 1.00 2.15 C ATOM 0 H ALA A 66 26.941 7.963 -2.557 1.00 10.53 H new ATOM 0 HA ALA A 66 28.085 9.299 -4.726 1.00 34.24 H new ATOM 0 HB1 ALA A 66 29.999 7.795 -4.317 1.00 2.15 H new ATOM 0 HB2 ALA A 66 29.336 8.441 -2.797 1.00 2.15 H new ATOM 0 HB3 ALA A 66 28.970 6.770 -3.289 1.00 2.15 H new ATOM 955 N GLY A 67 26.832 6.376 -5.438 1.00 41.30 N ATOM 956 CA GLY A 67 26.519 5.448 -6.513 1.00 41.44 C ATOM 957 C GLY A 67 25.608 6.061 -7.561 1.00 65.01 C ATOM 958 O GLY A 67 25.702 5.732 -8.744 1.00 24.21 O ATOM 0 H GLY A 67 26.384 6.158 -4.548 1.00 41.30 H new ATOM 0 HA2 GLY A 67 27.444 5.120 -6.987 1.00 41.44 H new ATOM 0 HA3 GLY A 67 26.043 4.561 -6.096 1.00 41.44 H new ATOM 962 N GLN A 68 24.736 6.969 -7.133 1.00 2.22 N ATOM 963 CA GLN A 68 23.808 7.637 -8.046 1.00 3.22 C ATOM 964 C GLN A 68 24.392 8.979 -8.467 1.00 13.50 C ATOM 965 O GLN A 68 23.910 9.625 -9.396 1.00 73.33 O ATOM 966 CB GLN A 68 22.437 7.834 -7.386 1.00 70.02 C ATOM 967 CG GLN A 68 22.495 8.597 -6.068 1.00 23.14 C ATOM 968 CD GLN A 68 21.128 9.028 -5.577 1.00 11.52 C ATOM 969 OE1 GLN A 68 20.471 8.322 -4.817 1.00 54.51 O ATOM 970 NE2 GLN A 68 20.685 10.190 -6.025 1.00 55.13 N ATOM 0 H GLN A 68 24.651 7.261 -6.159 1.00 2.22 H new ATOM 0 HA GLN A 68 23.667 7.011 -8.927 1.00 3.22 H new ATOM 0 HB2 GLN A 68 21.785 8.369 -8.077 1.00 70.02 H new ATOM 0 HB3 GLN A 68 21.984 6.858 -7.211 1.00 70.02 H new ATOM 0 HG2 GLN A 68 22.967 7.970 -5.311 1.00 23.14 H new ATOM 0 HG3 GLN A 68 23.126 9.477 -6.191 1.00 23.14 H new ATOM 0 HE21 GLN A 68 21.262 10.747 -6.655 1.00 55.13 H new ATOM 0 HE22 GLN A 68 19.766 10.530 -5.740 1.00 55.13 H new ATOM 979 N ASN A 69 25.434 9.390 -7.753 1.00 45.10 N ATOM 980 CA ASN A 69 26.175 10.605 -8.066 1.00 61.12 C ATOM 981 C ASN A 69 27.326 10.292 -9.015 1.00 41.24 C ATOM 982 O ASN A 69 28.027 11.194 -9.473 1.00 42.44 O ATOM 983 CB ASN A 69 26.702 11.250 -6.774 1.00 43.31 C ATOM 984 CG ASN A 69 25.651 12.057 -6.022 1.00 21.20 C ATOM 985 OD1 ASN A 69 24.394 11.641 -6.099 1.00 73.01 O flip ATOM 986 ND2 ASN A 69 25.970 13.045 -5.362 1.00 73.35 N flip ATOM 0 H ASN A 69 25.789 8.888 -6.939 1.00 45.10 H new ATOM 0 HA ASN A 69 25.505 11.310 -8.558 1.00 61.12 H new ATOM 0 HB2 ASN A 69 27.086 10.469 -6.118 1.00 43.31 H new ATOM 0 HB3 ASN A 69 27.541 11.901 -7.019 1.00 43.31 H new ATOM 0 HD21 ASN A 69 26.946 13.339 -5.323 1.00 73.35 H new ATOM 0 HD22 ASN A 69 25.259 13.570 -4.854 1.00 73.35 H new ATOM 993 N LYS A 70 27.514 8.998 -9.292 1.00 63.25 N ATOM 994 CA LYS A 70 28.549 8.525 -10.215 1.00 32.31 C ATOM 995 C LYS A 70 29.936 8.973 -9.755 1.00 12.34 C ATOM 996 O LYS A 70 30.864 9.100 -10.557 1.00 70.50 O ATOM 997 CB LYS A 70 28.254 8.997 -11.652 1.00 4.35 C ATOM 998 CG LYS A 70 27.246 8.117 -12.399 1.00 13.20 C ATOM 999 CD LYS A 70 26.034 7.777 -11.540 1.00 32.43 C ATOM 1000 CE LYS A 70 24.943 7.075 -12.341 1.00 4.32 C ATOM 1001 NZ LYS A 70 24.383 7.940 -13.413 1.00 52.12 N1+ ATOM 0 H LYS A 70 26.954 8.250 -8.883 1.00 63.25 H new ATOM 0 HA LYS A 70 28.538 7.435 -10.213 1.00 32.31 H new ATOM 0 HB2 LYS A 70 27.875 10.018 -11.618 1.00 4.35 H new ATOM 0 HB3 LYS A 70 29.187 9.022 -12.215 1.00 4.35 H new ATOM 0 HG2 LYS A 70 26.917 8.630 -13.302 1.00 13.20 H new ATOM 0 HG3 LYS A 70 27.735 7.196 -12.716 1.00 13.20 H new ATOM 0 HD2 LYS A 70 26.344 7.138 -10.713 1.00 32.43 H new ATOM 0 HD3 LYS A 70 25.632 8.691 -11.103 1.00 32.43 H new ATOM 0 HE2 LYS A 70 25.350 6.167 -12.786 1.00 4.32 H new ATOM 0 HE3 LYS A 70 24.142 6.769 -11.668 1.00 4.32 H new ATOM 0 HZ1 LYS A 70 23.483 7.540 -13.747 1.00 52.12 H new ATOM 0 HZ2 LYS A 70 24.219 8.896 -13.038 1.00 52.12 H new ATOM 0 HZ3 LYS A 70 25.055 7.990 -14.205 1.00 52.12 H new ATOM 1015 N GLN A 71 30.072 9.183 -8.450 1.00 41.25 N ATOM 1016 CA GLN A 71 31.336 9.599 -7.852 1.00 41.44 C ATOM 1017 C GLN A 71 31.829 8.532 -6.881 1.00 11.15 C ATOM 1018 O GLN A 71 31.054 7.684 -6.433 1.00 3.32 O ATOM 1019 CB GLN A 71 31.179 10.939 -7.125 1.00 65.11 C ATOM 1020 CG GLN A 71 30.149 10.896 -6.003 1.00 11.32 C ATOM 1021 CD GLN A 71 30.552 11.724 -4.798 1.00 14.24 C ATOM 1022 OE1 GLN A 71 30.303 11.189 -3.620 1.00 4.02 O flip ATOM 1023 NE2 GLN A 71 31.140 12.796 -4.926 1.00 60.02 N flip ATOM 0 H GLN A 71 29.312 9.070 -7.779 1.00 41.25 H new ATOM 0 HA GLN A 71 32.069 9.725 -8.649 1.00 41.44 H new ATOM 0 HB2 GLN A 71 32.143 11.237 -6.713 1.00 65.11 H new ATOM 0 HB3 GLN A 71 30.890 11.704 -7.845 1.00 65.11 H new ATOM 0 HG2 GLN A 71 29.192 11.256 -6.381 1.00 11.32 H new ATOM 0 HG3 GLN A 71 30.000 9.862 -5.693 1.00 11.32 H new ATOM 0 HE21 GLN A 71 31.313 13.175 -5.857 1.00 60.02 H new ATOM 0 HE22 GLN A 71 31.455 13.306 -4.101 1.00 60.02 H new ATOM 1032 N THR A 72 33.114 8.576 -6.556 1.00 0.13 N ATOM 1033 CA THR A 72 33.712 7.610 -5.644 1.00 33.54 C ATOM 1034 C THR A 72 34.209 8.293 -4.374 1.00 64.51 C ATOM 1035 O THR A 72 34.763 9.391 -4.422 1.00 2.32 O ATOM 1036 CB THR A 72 34.876 6.854 -6.324 1.00 55.21 C ATOM 1037 OG1 THR A 72 35.651 7.765 -7.120 1.00 1.42 O ATOM 1038 CG2 THR A 72 34.358 5.721 -7.204 1.00 71.13 C ATOM 0 H THR A 72 33.766 9.275 -6.913 1.00 0.13 H new ATOM 0 HA THR A 72 32.939 6.891 -5.374 1.00 33.54 H new ATOM 0 HB THR A 72 35.502 6.424 -5.542 1.00 55.21 H new ATOM 0 HG1 THR A 72 36.388 7.281 -7.547 1.00 1.42 H new ATOM 0 HG21 THR A 72 35.200 5.208 -7.669 1.00 71.13 H new ATOM 0 HG22 THR A 72 33.794 5.015 -6.594 1.00 71.13 H new ATOM 0 HG23 THR A 72 33.709 6.130 -7.979 1.00 71.13 H new ATOM 1046 N LEU A 73 33.989 7.641 -3.240 1.00 24.22 N ATOM 1047 CA LEU A 73 34.440 8.147 -1.951 1.00 2.33 C ATOM 1048 C LEU A 73 35.589 7.279 -1.433 1.00 44.11 C ATOM 1049 O LEU A 73 35.544 6.054 -1.559 1.00 52.40 O ATOM 1050 CB LEU A 73 33.271 8.154 -0.955 1.00 54.54 C ATOM 1051 CG LEU A 73 32.085 9.054 -1.344 1.00 53.14 C ATOM 1052 CD1 LEU A 73 30.939 8.896 -0.349 1.00 63.13 C ATOM 1053 CD2 LEU A 73 32.529 10.515 -1.431 1.00 44.41 C ATOM 0 H LEU A 73 33.495 6.750 -3.188 1.00 24.22 H new ATOM 0 HA LEU A 73 34.800 9.170 -2.066 1.00 2.33 H new ATOM 0 HB2 LEU A 73 32.908 7.133 -0.838 1.00 54.54 H new ATOM 0 HB3 LEU A 73 33.645 8.473 0.018 1.00 54.54 H new ATOM 0 HG LEU A 73 31.726 8.745 -2.326 1.00 53.14 H new ATOM 0 HD11 LEU A 73 30.111 9.541 -0.643 1.00 63.13 H new ATOM 0 HD12 LEU A 73 30.605 7.858 -0.340 1.00 63.13 H new ATOM 0 HD13 LEU A 73 31.281 9.176 0.647 1.00 63.13 H new ATOM 0 HD21 LEU A 73 31.678 11.138 -1.707 1.00 44.41 H new ATOM 0 HD22 LEU A 73 32.915 10.836 -0.464 1.00 44.41 H new ATOM 0 HD23 LEU A 73 33.311 10.614 -2.184 1.00 44.41 H new ATOM 1065 N PRO A 74 36.643 7.901 -0.866 1.00 14.33 N ATOM 1066 CA PRO A 74 37.806 7.171 -0.333 1.00 71.54 C ATOM 1067 C PRO A 74 37.422 6.193 0.780 1.00 22.35 C ATOM 1068 O PRO A 74 36.630 6.527 1.660 1.00 71.04 O ATOM 1069 CB PRO A 74 38.705 8.280 0.230 1.00 0.31 C ATOM 1070 CG PRO A 74 38.270 9.523 -0.472 1.00 75.32 C ATOM 1071 CD PRO A 74 36.794 9.360 -0.710 1.00 21.31 C ATOM 0 HA PRO A 74 38.283 6.563 -1.102 1.00 71.54 H new ATOM 0 HB2 PRO A 74 38.587 8.374 1.309 1.00 0.31 H new ATOM 0 HB3 PRO A 74 39.758 8.068 0.042 1.00 0.31 H new ATOM 0 HG2 PRO A 74 38.474 10.406 0.133 1.00 75.32 H new ATOM 0 HG3 PRO A 74 38.807 9.650 -1.412 1.00 75.32 H new ATOM 0 HD2 PRO A 74 36.206 9.740 0.126 1.00 21.31 H new ATOM 0 HD3 PRO A 74 36.467 9.897 -1.600 1.00 21.31 H new ATOM 1079 N ALA A 75 38.021 5.007 0.760 1.00 74.43 N ATOM 1080 CA ALA A 75 37.693 3.954 1.723 1.00 72.21 C ATOM 1081 C ALA A 75 38.325 4.205 3.090 1.00 34.41 C ATOM 1082 O ALA A 75 38.178 3.401 4.014 1.00 42.34 O ATOM 1083 CB ALA A 75 38.115 2.592 1.178 1.00 2.05 C ATOM 0 H ALA A 75 38.740 4.747 0.085 1.00 74.43 H new ATOM 0 HA ALA A 75 36.612 3.964 1.864 1.00 72.21 H new ATOM 0 HB1 ALA A 75 37.866 1.817 1.903 1.00 2.05 H new ATOM 0 HB2 ALA A 75 37.591 2.396 0.243 1.00 2.05 H new ATOM 0 HB3 ALA A 75 39.190 2.589 0.999 1.00 2.05 H new ATOM 1089 N ASP A 76 39.019 5.326 3.219 1.00 35.21 N ATOM 1090 CA ASP A 76 39.699 5.683 4.464 1.00 24.42 C ATOM 1091 C ASP A 76 38.819 6.596 5.318 1.00 33.35 C ATOM 1092 O ASP A 76 39.203 7.019 6.410 1.00 61.01 O ATOM 1093 CB ASP A 76 41.032 6.361 4.131 1.00 72.44 C ATOM 1094 CG ASP A 76 41.884 6.661 5.361 1.00 23.12 C ATOM 1095 OD1 ASP A 76 42.523 5.728 5.892 1.00 55.31 O ATOM 1096 OD2 ASP A 76 41.934 7.835 5.790 1.00 42.23 O1- ATOM 0 H ASP A 76 39.129 6.012 2.472 1.00 35.21 H new ATOM 0 HA ASP A 76 39.892 4.780 5.043 1.00 24.42 H new ATOM 0 HB2 ASP A 76 41.598 5.721 3.454 1.00 72.44 H new ATOM 0 HB3 ASP A 76 40.835 7.292 3.599 1.00 72.44 H new ATOM 1101 N THR A 77 37.624 6.872 4.820 1.00 11.55 N ATOM 1102 CA THR A 77 36.709 7.804 5.467 1.00 12.43 C ATOM 1103 C THR A 77 36.109 7.212 6.747 1.00 50.31 C ATOM 1104 O THR A 77 35.994 5.989 6.895 1.00 30.02 O ATOM 1105 CB THR A 77 35.584 8.236 4.498 1.00 41.10 C ATOM 1106 OG1 THR A 77 34.695 9.160 5.138 1.00 73.42 O ATOM 1107 CG2 THR A 77 34.787 7.036 3.993 1.00 73.22 C ATOM 0 H THR A 77 37.261 6.460 3.961 1.00 11.55 H new ATOM 0 HA THR A 77 37.289 8.684 5.745 1.00 12.43 H new ATOM 0 HB THR A 77 36.061 8.719 3.645 1.00 41.10 H new ATOM 0 HG1 THR A 77 35.195 9.699 5.786 1.00 73.42 H new ATOM 0 HG21 THR A 77 34.005 7.378 3.315 1.00 73.22 H new ATOM 0 HG22 THR A 77 35.453 6.353 3.465 1.00 73.22 H new ATOM 0 HG23 THR A 77 34.333 6.519 4.838 1.00 73.22 H new ATOM 1115 N THR A 78 35.746 8.091 7.676 1.00 13.54 N ATOM 1116 CA THR A 78 35.186 7.692 8.966 1.00 2.03 C ATOM 1117 C THR A 78 34.308 8.813 9.526 1.00 41.21 C ATOM 1118 O THR A 78 34.545 9.988 9.247 1.00 33.42 O ATOM 1119 CB THR A 78 36.310 7.370 9.985 1.00 65.01 C ATOM 1120 OG1 THR A 78 37.228 6.419 9.427 1.00 41.13 O ATOM 1121 CG2 THR A 78 35.747 6.815 11.292 1.00 52.04 C ATOM 0 H THR A 78 35.831 9.100 7.557 1.00 13.54 H new ATOM 0 HA THR A 78 34.586 6.796 8.808 1.00 2.03 H new ATOM 0 HB THR A 78 36.828 8.304 10.202 1.00 65.01 H new ATOM 0 HG1 THR A 78 37.934 6.225 10.078 1.00 41.13 H new ATOM 0 HG21 THR A 78 36.566 6.602 11.979 1.00 52.04 H new ATOM 0 HG22 THR A 78 35.078 7.549 11.741 1.00 52.04 H new ATOM 0 HG23 THR A 78 35.195 5.897 11.090 1.00 52.04 H new ATOM 1129 N VAL A 79 33.299 8.446 10.307 1.00 13.33 N ATOM 1130 CA VAL A 79 32.417 9.413 10.956 1.00 51.35 C ATOM 1131 C VAL A 79 32.303 9.099 12.442 1.00 40.33 C ATOM 1132 O VAL A 79 31.897 7.999 12.826 1.00 15.54 O ATOM 1133 CB VAL A 79 31.000 9.430 10.322 1.00 73.54 C ATOM 1134 CG1 VAL A 79 30.044 10.310 11.133 1.00 32.33 C ATOM 1135 CG2 VAL A 79 31.068 9.912 8.876 1.00 4.51 C ATOM 0 H VAL A 79 33.068 7.473 10.509 1.00 13.33 H new ATOM 0 HA VAL A 79 32.859 10.399 10.814 1.00 51.35 H new ATOM 0 HB VAL A 79 30.614 8.411 10.333 1.00 73.54 H new ATOM 0 HG11 VAL A 79 29.059 10.304 10.666 1.00 32.33 H new ATOM 0 HG12 VAL A 79 29.967 9.923 12.149 1.00 32.33 H new ATOM 0 HG13 VAL A 79 30.425 11.331 11.162 1.00 32.33 H new ATOM 0 HG21 VAL A 79 30.066 9.918 8.447 1.00 4.51 H new ATOM 0 HG22 VAL A 79 31.481 10.920 8.848 1.00 4.51 H new ATOM 0 HG23 VAL A 79 31.706 9.243 8.299 1.00 4.51 H new ATOM 1145 N THR A 80 32.677 10.064 13.273 1.00 3.21 N ATOM 1146 CA THR A 80 32.604 9.905 14.716 1.00 52.54 C ATOM 1147 C THR A 80 31.390 10.652 15.272 1.00 43.34 C ATOM 1148 O THR A 80 31.339 11.884 15.244 1.00 4.30 O ATOM 1149 CB THR A 80 33.894 10.417 15.400 1.00 61.00 C ATOM 1150 OG1 THR A 80 35.046 9.852 14.756 1.00 41.24 O ATOM 1151 CG2 THR A 80 33.908 10.050 16.882 1.00 20.33 C ATOM 0 H THR A 80 33.036 10.969 12.968 1.00 3.21 H new ATOM 0 HA THR A 80 32.500 8.841 14.931 1.00 52.54 H new ATOM 0 HB THR A 80 33.919 11.503 15.310 1.00 61.00 H new ATOM 0 HG1 THR A 80 35.859 10.181 15.193 1.00 41.24 H new ATOM 0 HG21 THR A 80 34.825 10.421 17.340 1.00 20.33 H new ATOM 0 HG22 THR A 80 33.047 10.500 17.377 1.00 20.33 H new ATOM 0 HG23 THR A 80 33.862 8.966 16.989 1.00 20.33 H new ATOM 1159 N ALA A 81 30.408 9.896 15.748 1.00 63.21 N ATOM 1160 CA ALA A 81 29.207 10.465 16.347 1.00 75.00 C ATOM 1161 C ALA A 81 29.378 10.569 17.859 1.00 14.40 C ATOM 1162 O ALA A 81 29.357 9.559 18.564 1.00 73.21 O ATOM 1163 CB ALA A 81 27.988 9.614 16.002 1.00 42.42 C ATOM 0 H ALA A 81 30.421 8.876 15.730 1.00 63.21 H new ATOM 0 HA ALA A 81 29.051 11.466 15.944 1.00 75.00 H new ATOM 0 HB1 ALA A 81 27.099 10.051 16.456 1.00 42.42 H new ATOM 0 HB2 ALA A 81 27.863 9.579 14.920 1.00 42.42 H new ATOM 0 HB3 ALA A 81 28.130 8.603 16.383 1.00 42.42 H new ATOM 1169 N GLU A 82 29.570 11.787 18.350 1.00 71.31 N ATOM 1170 CA GLU A 82 29.773 12.025 19.775 1.00 72.51 C ATOM 1171 C GLU A 82 28.553 12.737 20.351 1.00 53.13 C ATOM 1172 O GLU A 82 28.320 13.912 20.070 1.00 25.01 O ATOM 1173 CB GLU A 82 31.046 12.856 20.003 1.00 74.00 C ATOM 1174 CG GLU A 82 31.415 13.023 21.473 1.00 3.23 C ATOM 1175 CD GLU A 82 32.704 13.806 21.678 1.00 23.22 C ATOM 1176 OE1 GLU A 82 32.634 14.996 22.054 1.00 3.55 O ATOM 1177 OE2 GLU A 82 33.794 13.228 21.484 1.00 51.44 O1- ATOM 0 H GLU A 82 29.590 12.631 17.778 1.00 71.31 H new ATOM 0 HA GLU A 82 29.898 11.070 20.285 1.00 72.51 H new ATOM 0 HB2 GLU A 82 31.877 12.382 19.481 1.00 74.00 H new ATOM 0 HB3 GLU A 82 30.910 13.842 19.558 1.00 74.00 H new ATOM 0 HG2 GLU A 82 30.601 13.531 21.990 1.00 3.23 H new ATOM 0 HG3 GLU A 82 31.518 12.039 21.930 1.00 3.23 H new ATOM 1184 N VAL A 83 27.770 12.020 21.151 1.00 31.40 N ATOM 1185 CA VAL A 83 26.503 12.544 21.656 1.00 74.25 C ATOM 1186 C VAL A 83 26.592 12.849 23.144 1.00 12.15 C ATOM 1187 O VAL A 83 27.265 12.147 23.894 1.00 3.30 O ATOM 1188 CB VAL A 83 25.331 11.561 21.402 1.00 22.15 C ATOM 1189 CG1 VAL A 83 25.052 11.438 19.908 1.00 60.03 C ATOM 1190 CG2 VAL A 83 25.624 10.191 22.015 1.00 42.03 C ATOM 0 H VAL A 83 27.989 11.074 21.464 1.00 31.40 H new ATOM 0 HA VAL A 83 26.305 13.467 21.110 1.00 74.25 H new ATOM 0 HB VAL A 83 24.440 11.960 21.886 1.00 22.15 H new ATOM 0 HG11 VAL A 83 24.227 10.744 19.748 1.00 60.03 H new ATOM 0 HG12 VAL A 83 24.787 12.416 19.506 1.00 60.03 H new ATOM 0 HG13 VAL A 83 25.942 11.066 19.401 1.00 60.03 H new ATOM 0 HG21 VAL A 83 24.787 9.520 21.823 1.00 42.03 H new ATOM 0 HG22 VAL A 83 26.529 9.779 21.569 1.00 42.03 H new ATOM 0 HG23 VAL A 83 25.765 10.296 23.091 1.00 42.03 H new ATOM 1200 N GLY A 84 25.903 13.901 23.557 1.00 33.12 N ATOM 1201 CA GLY A 84 25.910 14.312 24.943 1.00 23.12 C ATOM 1202 C GLY A 84 24.556 14.809 25.389 1.00 64.22 C ATOM 1203 O GLY A 84 23.684 15.084 24.564 1.00 21.33 O ATOM 0 H GLY A 84 25.331 14.484 22.946 1.00 33.12 H new ATOM 0 HA2 GLY A 84 26.213 13.473 25.569 1.00 23.12 H new ATOM 0 HA3 GLY A 84 26.651 15.099 25.085 1.00 23.12 H new ATOM 1207 N ILE A 85 24.389 14.931 26.692 1.00 23.52 N ATOM 1208 CA ILE A 85 23.132 15.364 27.277 1.00 1.40 C ATOM 1209 C ILE A 85 23.403 16.196 28.521 1.00 61.15 C ATOM 1210 O ILE A 85 24.215 15.813 29.375 1.00 10.52 O ATOM 1211 CB ILE A 85 22.214 14.149 27.613 1.00 52.02 C ATOM 1212 CG1 ILE A 85 20.868 14.595 28.231 1.00 53.33 C ATOM 1213 CG2 ILE A 85 22.936 13.165 28.531 1.00 35.55 C ATOM 1214 CD1 ILE A 85 20.890 14.775 29.740 1.00 71.32 C ATOM 0 H ILE A 85 25.120 14.733 27.376 1.00 23.52 H new ATOM 0 HA ILE A 85 22.605 15.978 26.547 1.00 1.40 H new ATOM 0 HB ILE A 85 21.985 13.643 26.675 1.00 52.02 H new ATOM 0 HG12 ILE A 85 20.567 15.536 27.771 1.00 53.33 H new ATOM 0 HG13 ILE A 85 20.106 13.858 27.978 1.00 53.33 H new ATOM 0 HG21 ILE A 85 22.278 12.325 28.753 1.00 35.55 H new ATOM 0 HG22 ILE A 85 23.836 12.800 28.037 1.00 35.55 H new ATOM 0 HG23 ILE A 85 23.210 13.667 29.459 1.00 35.55 H new ATOM 0 HD11 ILE A 85 19.904 15.088 30.083 1.00 71.32 H new ATOM 0 HD12 ILE A 85 21.157 13.831 30.215 1.00 71.32 H new ATOM 0 HD13 ILE A 85 21.625 15.535 30.005 1.00 71.32 H new ATOM 1226 N GLY A 86 22.742 17.344 28.589 1.00 43.44 N ATOM 1227 CA GLY A 86 22.844 18.229 29.737 1.00 64.20 C ATOM 1228 C GLY A 86 21.552 18.989 29.967 1.00 43.21 C ATOM 1229 O GLY A 86 20.657 18.939 29.123 1.00 31.32 O ATOM 0 H GLY A 86 22.124 17.685 27.853 1.00 43.44 H new ATOM 0 HA2 GLY A 86 23.089 17.648 30.626 1.00 64.20 H new ATOM 0 HA3 GLY A 86 23.660 18.935 29.583 1.00 64.20 H new ATOM 1233 N PRO A 87 21.410 19.692 31.104 1.00 20.43 N ATOM 1234 CA PRO A 87 20.202 20.443 31.425 1.00 73.43 C ATOM 1235 C PRO A 87 20.157 21.786 30.691 1.00 33.24 C ATOM 1236 O PRO A 87 21.074 22.603 30.809 1.00 11.41 O ATOM 1237 CB PRO A 87 20.287 20.657 32.952 1.00 75.13 C ATOM 1238 CG PRO A 87 21.565 20.004 33.393 1.00 24.22 C ATOM 1239 CD PRO A 87 22.412 19.841 32.161 1.00 44.21 C ATOM 0 HA PRO A 87 19.299 19.914 31.119 1.00 73.43 H new ATOM 0 HB2 PRO A 87 20.287 21.719 33.197 1.00 75.13 H new ATOM 0 HB3 PRO A 87 19.428 20.213 33.456 1.00 75.13 H new ATOM 0 HG2 PRO A 87 22.076 20.616 34.136 1.00 24.22 H new ATOM 0 HG3 PRO A 87 21.366 19.038 33.857 1.00 24.22 H new ATOM 0 HD2 PRO A 87 23.054 20.706 31.993 1.00 44.21 H new ATOM 0 HD3 PRO A 87 23.063 18.969 32.229 1.00 44.21 H new ATOM 1247 N ASN A 88 19.096 21.997 29.924 1.00 50.13 N ATOM 1248 CA ASN A 88 18.892 23.254 29.213 1.00 62.23 C ATOM 1249 C ASN A 88 18.547 24.363 30.199 1.00 31.22 C ATOM 1250 O ASN A 88 17.913 24.110 31.227 1.00 11.01 O ATOM 1251 CB ASN A 88 17.768 23.105 28.181 1.00 63.43 C ATOM 1252 CG ASN A 88 17.528 24.370 27.370 1.00 21.32 C ATOM 1253 OD1 ASN A 88 18.433 25.182 27.171 1.00 63.22 O ATOM 1254 ND2 ASN A 88 16.307 24.543 26.890 1.00 22.41 N ATOM 0 H ASN A 88 18.358 21.309 29.777 1.00 50.13 H new ATOM 0 HA ASN A 88 19.814 23.514 28.694 1.00 62.23 H new ATOM 0 HB2 ASN A 88 18.012 22.287 27.503 1.00 63.43 H new ATOM 0 HB3 ASN A 88 16.847 22.830 28.694 1.00 63.43 H new ATOM 0 HD21 ASN A 88 16.090 25.370 26.335 1.00 22.41 H new ATOM 0 HD22 ASN A 88 15.583 23.849 27.075 1.00 22.41 H new ATOM 1261 N GLU A 89 18.938 25.588 29.867 1.00 43.32 N ATOM 1262 CA GLU A 89 18.729 26.738 30.744 1.00 2.23 C ATOM 1263 C GLU A 89 17.237 26.990 30.988 1.00 10.40 C ATOM 1264 O GLU A 89 16.857 27.659 31.950 1.00 74.31 O ATOM 1265 CB GLU A 89 19.399 27.985 30.148 1.00 13.04 C ATOM 1266 CG GLU A 89 18.950 28.303 28.724 1.00 64.14 C ATOM 1267 CD GLU A 89 19.591 29.567 28.171 1.00 35.31 C ATOM 1268 OE1 GLU A 89 18.980 30.650 28.280 1.00 70.11 O ATOM 1269 OE2 GLU A 89 20.713 29.484 27.622 1.00 74.23 O1- ATOM 0 H GLU A 89 19.406 25.813 28.989 1.00 43.32 H new ATOM 0 HA GLU A 89 19.187 26.518 31.708 1.00 2.23 H new ATOM 0 HB2 GLU A 89 19.185 28.842 30.787 1.00 13.04 H new ATOM 0 HB3 GLU A 89 20.480 27.844 30.156 1.00 13.04 H new ATOM 0 HG2 GLU A 89 19.196 27.463 28.075 1.00 64.14 H new ATOM 0 HG3 GLU A 89 17.866 28.413 28.706 1.00 64.14 H new ATOM 1276 N GLU A 90 16.403 26.440 30.115 1.00 62.24 N ATOM 1277 CA GLU A 90 14.950 26.556 30.238 1.00 33.11 C ATOM 1278 C GLU A 90 14.437 25.797 31.467 1.00 41.22 C ATOM 1279 O GLU A 90 13.360 26.088 31.988 1.00 23.51 O ATOM 1280 CB GLU A 90 14.283 26.020 28.963 1.00 62.35 C ATOM 1281 CG GLU A 90 12.771 25.870 29.072 1.00 2.12 C ATOM 1282 CD GLU A 90 12.125 25.406 27.775 1.00 32.41 C ATOM 1283 OE1 GLU A 90 12.120 24.187 27.506 1.00 34.55 O ATOM 1284 OE2 GLU A 90 11.621 26.265 27.019 1.00 15.02 O1- ATOM 0 H GLU A 90 16.710 25.903 29.304 1.00 62.24 H new ATOM 0 HA GLU A 90 14.695 27.608 30.366 1.00 33.11 H new ATOM 0 HB2 GLU A 90 14.513 26.691 28.135 1.00 62.35 H new ATOM 0 HB3 GLU A 90 14.717 25.051 28.718 1.00 62.35 H new ATOM 0 HG2 GLU A 90 12.538 25.157 29.863 1.00 2.12 H new ATOM 0 HG3 GLU A 90 12.337 26.825 29.366 1.00 2.12 H new ATOM 1291 N GLY A 91 15.228 24.837 31.932 1.00 4.53 N ATOM 1292 CA GLY A 91 14.814 23.994 33.043 1.00 50.31 C ATOM 1293 C GLY A 91 14.400 22.617 32.570 1.00 52.42 C ATOM 1294 O GLY A 91 13.468 22.015 33.105 1.00 50.31 O ATOM 0 H GLY A 91 16.153 24.625 31.559 1.00 4.53 H new ATOM 0 HA2 GLY A 91 15.632 23.904 33.757 1.00 50.31 H new ATOM 0 HA3 GLY A 91 13.983 24.465 33.568 1.00 50.31 H new ATOM 1298 N GLY A 92 15.086 22.134 31.542 1.00 31.10 N ATOM 1299 CA GLY A 92 14.809 20.822 30.988 1.00 44.24 C ATOM 1300 C GLY A 92 16.080 20.148 30.525 1.00 74.12 C ATOM 1301 O GLY A 92 17.161 20.464 31.019 1.00 42.22 O ATOM 0 H GLY A 92 15.841 22.637 31.076 1.00 31.10 H new ATOM 0 HA2 GLY A 92 14.318 20.203 31.739 1.00 44.24 H new ATOM 0 HA3 GLY A 92 14.118 20.916 30.151 1.00 44.24 H new ATOM 1305 N PHE A 93 15.966 19.234 29.572 1.00 65.13 N ATOM 1306 CA PHE A 93 17.134 18.549 29.023 1.00 72.25 C ATOM 1307 C PHE A 93 17.536 19.166 27.690 1.00 30.35 C ATOM 1308 O PHE A 93 16.780 19.938 27.100 1.00 35.35 O ATOM 1309 CB PHE A 93 16.858 17.051 28.836 1.00 70.53 C ATOM 1310 CG PHE A 93 16.612 16.310 30.126 1.00 33.33 C ATOM 1311 CD1 PHE A 93 15.456 15.562 30.305 1.00 41.34 C ATOM 1312 CD2 PHE A 93 17.539 16.360 31.158 1.00 64.21 C ATOM 1313 CE1 PHE A 93 15.229 14.878 31.485 1.00 2.11 C ATOM 1314 CE2 PHE A 93 17.316 15.678 32.342 1.00 3.04 C ATOM 1315 CZ PHE A 93 16.159 14.936 32.504 1.00 12.34 C ATOM 0 H PHE A 93 15.078 18.948 29.161 1.00 65.13 H new ATOM 0 HA PHE A 93 17.952 18.666 29.734 1.00 72.25 H new ATOM 0 HB2 PHE A 93 15.990 16.929 28.187 1.00 70.53 H new ATOM 0 HB3 PHE A 93 17.706 16.596 28.323 1.00 70.53 H new ATOM 0 HD1 PHE A 93 14.724 15.514 29.512 1.00 41.34 H new ATOM 0 HD2 PHE A 93 18.444 16.937 31.036 1.00 64.21 H new ATOM 0 HE1 PHE A 93 14.326 14.299 31.609 1.00 2.11 H new ATOM 0 HE2 PHE A 93 18.044 15.725 33.138 1.00 3.04 H new ATOM 0 HZ PHE A 93 15.984 14.403 33.427 1.00 12.34 H new ATOM 1325 N ALA A 94 18.735 18.825 27.235 1.00 73.43 N ATOM 1326 CA ALA A 94 19.231 19.260 25.939 1.00 60.33 C ATOM 1327 C ALA A 94 20.228 18.235 25.406 1.00 65.32 C ATOM 1328 O ALA A 94 21.176 17.859 26.104 1.00 32.10 O ATOM 1329 CB ALA A 94 19.869 20.643 26.041 1.00 64.21 C ATOM 0 H ALA A 94 19.389 18.240 27.755 1.00 73.43 H new ATOM 0 HA ALA A 94 18.396 19.334 25.243 1.00 60.33 H new ATOM 0 HB1 ALA A 94 20.233 20.949 25.060 1.00 64.21 H new ATOM 0 HB2 ALA A 94 19.128 21.361 26.393 1.00 64.21 H new ATOM 0 HB3 ALA A 94 20.702 20.608 26.743 1.00 64.21 H new ATOM 1335 N LEU A 95 19.978 17.766 24.188 1.00 31.23 N ATOM 1336 CA LEU A 95 20.822 16.764 23.544 1.00 75.45 C ATOM 1337 C LEU A 95 21.771 17.428 22.558 1.00 41.42 C ATOM 1338 O LEU A 95 21.339 18.116 21.631 1.00 2.34 O ATOM 1339 CB LEU A 95 19.959 15.706 22.829 1.00 51.22 C ATOM 1340 CG LEU A 95 19.416 14.572 23.722 1.00 42.15 C ATOM 1341 CD1 LEU A 95 20.557 13.679 24.205 1.00 64.34 C ATOM 1342 CD2 LEU A 95 18.640 15.135 24.911 1.00 71.23 C ATOM 0 H LEU A 95 19.187 18.068 23.620 1.00 31.23 H new ATOM 0 HA LEU A 95 21.411 16.264 24.313 1.00 75.45 H new ATOM 0 HB2 LEU A 95 19.114 16.210 22.359 1.00 51.22 H new ATOM 0 HB3 LEU A 95 20.551 15.262 22.029 1.00 51.22 H new ATOM 0 HG LEU A 95 18.731 13.970 23.125 1.00 42.15 H new ATOM 0 HD11 LEU A 95 20.156 12.884 24.834 1.00 64.34 H new ATOM 0 HD12 LEU A 95 21.065 13.241 23.346 1.00 64.34 H new ATOM 0 HD13 LEU A 95 21.266 14.274 24.781 1.00 64.34 H new ATOM 0 HD21 LEU A 95 18.268 14.314 25.524 1.00 71.23 H new ATOM 0 HD22 LEU A 95 19.298 15.766 25.509 1.00 71.23 H new ATOM 0 HD23 LEU A 95 17.800 15.727 24.549 1.00 71.23 H new ATOM 1354 N ASP A 96 23.057 17.209 22.775 1.00 51.32 N ATOM 1355 CA ASP A 96 24.108 17.767 21.928 1.00 15.24 C ATOM 1356 C ASP A 96 24.765 16.653 21.125 1.00 33.43 C ATOM 1357 O ASP A 96 25.435 15.783 21.683 1.00 1.11 O ATOM 1358 CB ASP A 96 25.166 18.467 22.781 1.00 62.10 C ATOM 1359 CG ASP A 96 26.295 19.068 21.947 1.00 42.14 C ATOM 1360 OD1 ASP A 96 26.067 20.093 21.272 1.00 0.44 O ATOM 1361 OD2 ASP A 96 27.422 18.514 21.976 1.00 11.32 O1- ATOM 0 H ASP A 96 23.407 16.638 23.545 1.00 51.32 H new ATOM 0 HA ASP A 96 23.660 18.494 21.251 1.00 15.24 H new ATOM 0 HB2 ASP A 96 24.692 19.256 23.365 1.00 62.10 H new ATOM 0 HB3 ASP A 96 25.585 17.753 23.491 1.00 62.10 H new ATOM 1366 N VAL A 97 24.557 16.675 19.824 1.00 3.45 N ATOM 1367 CA VAL A 97 25.104 15.654 18.936 1.00 33.41 C ATOM 1368 C VAL A 97 26.181 16.252 18.041 1.00 35.23 C ATOM 1369 O VAL A 97 25.892 17.055 17.159 1.00 5.33 O ATOM 1370 CB VAL A 97 24.006 15.009 18.050 1.00 12.11 C ATOM 1371 CG1 VAL A 97 24.604 13.925 17.150 1.00 31.40 C ATOM 1372 CG2 VAL A 97 22.873 14.445 18.910 1.00 41.42 C ATOM 0 H VAL A 97 24.009 17.393 19.350 1.00 3.45 H new ATOM 0 HA VAL A 97 25.535 14.877 19.568 1.00 33.41 H new ATOM 0 HB VAL A 97 23.586 15.785 17.410 1.00 12.11 H new ATOM 0 HG11 VAL A 97 23.817 13.486 16.537 1.00 31.40 H new ATOM 0 HG12 VAL A 97 25.363 14.366 16.504 1.00 31.40 H new ATOM 0 HG13 VAL A 97 25.059 13.150 17.767 1.00 31.40 H new ATOM 0 HG21 VAL A 97 22.115 13.998 18.266 1.00 41.42 H new ATOM 0 HG22 VAL A 97 23.271 13.686 19.583 1.00 41.42 H new ATOM 0 HG23 VAL A 97 22.425 15.249 19.494 1.00 41.42 H new ATOM 1382 N GLU A 98 27.420 15.858 18.274 1.00 23.12 N ATOM 1383 CA GLU A 98 28.545 16.345 17.492 1.00 44.32 C ATOM 1384 C GLU A 98 28.945 15.294 16.462 1.00 21.31 C ATOM 1385 O GLU A 98 29.472 14.236 16.815 1.00 34.12 O ATOM 1386 CB GLU A 98 29.725 16.678 18.417 1.00 13.10 C ATOM 1387 CG GLU A 98 30.880 17.374 17.709 1.00 35.31 C ATOM 1388 CD GLU A 98 31.996 17.776 18.655 1.00 11.53 C ATOM 1389 OE1 GLU A 98 31.822 18.755 19.403 1.00 51.52 O ATOM 1390 OE2 GLU A 98 33.061 17.125 18.648 1.00 21.24 O1- ATOM 0 H GLU A 98 27.675 15.195 19.006 1.00 23.12 H new ATOM 0 HA GLU A 98 28.255 17.256 16.968 1.00 44.32 H new ATOM 0 HB2 GLU A 98 29.371 17.314 19.228 1.00 13.10 H new ATOM 0 HB3 GLU A 98 30.091 15.757 18.871 1.00 13.10 H new ATOM 0 HG2 GLU A 98 31.282 16.712 16.942 1.00 35.31 H new ATOM 0 HG3 GLU A 98 30.505 18.262 17.199 1.00 35.31 H new ATOM 1397 N LEU A 99 28.675 15.576 15.192 1.00 4.53 N ATOM 1398 CA LEU A 99 28.966 14.633 14.114 1.00 32.31 C ATOM 1399 C LEU A 99 30.256 15.020 13.403 1.00 52.01 C ATOM 1400 O LEU A 99 30.319 16.060 12.743 1.00 21.43 O ATOM 1401 CB LEU A 99 27.807 14.574 13.105 1.00 42.25 C ATOM 1402 CG LEU A 99 26.488 13.989 13.643 1.00 64.41 C ATOM 1403 CD1 LEU A 99 25.425 13.952 12.545 1.00 73.33 C ATOM 1404 CD2 LEU A 99 26.711 12.596 14.229 1.00 23.33 C ATOM 0 H LEU A 99 28.254 16.452 14.882 1.00 4.53 H new ATOM 0 HA LEU A 99 29.087 13.644 14.557 1.00 32.31 H new ATOM 0 HB2 LEU A 99 27.614 15.583 12.740 1.00 42.25 H new ATOM 0 HB3 LEU A 99 28.125 13.980 12.248 1.00 42.25 H new ATOM 0 HG LEU A 99 26.129 14.638 14.442 1.00 64.41 H new ATOM 0 HD11 LEU A 99 24.501 13.535 12.947 1.00 73.33 H new ATOM 0 HD12 LEU A 99 25.240 14.964 12.184 1.00 73.33 H new ATOM 0 HD13 LEU A 99 25.775 13.331 11.721 1.00 73.33 H new ATOM 0 HD21 LEU A 99 25.766 12.203 14.603 1.00 23.33 H new ATOM 0 HD22 LEU A 99 27.099 11.934 13.455 1.00 23.33 H new ATOM 0 HD23 LEU A 99 27.428 12.656 15.048 1.00 23.33 H new ATOM 1416 N ARG A 100 31.279 14.185 13.551 1.00 15.15 N ATOM 1417 CA ARG A 100 32.575 14.427 12.928 1.00 11.05 C ATOM 1418 C ARG A 100 32.701 13.607 11.657 1.00 44.33 C ATOM 1419 O ARG A 100 32.741 12.378 11.708 1.00 60.34 O ATOM 1420 CB ARG A 100 33.711 14.073 13.894 1.00 62.13 C ATOM 1421 CG ARG A 100 33.636 14.831 15.209 1.00 11.51 C ATOM 1422 CD ARG A 100 34.797 14.497 16.127 1.00 61.51 C ATOM 1423 NE ARG A 100 34.648 15.145 17.430 1.00 42.53 N ATOM 1424 CZ ARG A 100 35.398 14.887 18.498 1.00 32.53 C ATOM 1425 NH1 ARG A 100 36.429 14.057 18.413 1.00 73.43 N1+ ATOM 1426 NH2 ARG A 100 35.120 15.486 19.648 1.00 1.52 N ATOM 0 H ARG A 100 31.234 13.328 14.102 1.00 15.15 H new ATOM 0 HA ARG A 100 32.648 15.486 12.679 1.00 11.05 H new ATOM 0 HB2 ARG A 100 33.686 13.002 14.097 1.00 62.13 H new ATOM 0 HB3 ARG A 100 34.667 14.284 13.414 1.00 62.13 H new ATOM 0 HG2 ARG A 100 33.629 15.903 15.009 1.00 11.51 H new ATOM 0 HG3 ARG A 100 32.698 14.594 15.711 1.00 11.51 H new ATOM 0 HD2 ARG A 100 34.859 13.417 16.261 1.00 61.51 H new ATOM 0 HD3 ARG A 100 35.732 14.815 15.665 1.00 61.51 H new ATOM 0 HE ARG A 100 33.914 15.847 17.527 1.00 42.53 H new ATOM 0 HH11 ARG A 100 36.652 13.611 17.523 1.00 73.43 H new ATOM 0 HH12 ARG A 100 36.999 13.865 19.237 1.00 73.43 H new ATOM 0 HH21 ARG A 100 34.337 16.137 19.708 1.00 1.52 H new ATOM 0 HH22 ARG A 100 35.689 15.295 20.473 1.00 1.52 H new ATOM 1440 N VAL A 101 32.760 14.286 10.526 1.00 42.14 N ATOM 1441 CA VAL A 101 32.784 13.616 9.232 1.00 72.23 C ATOM 1442 C VAL A 101 34.169 13.710 8.615 1.00 42.25 C ATOM 1443 O VAL A 101 34.518 14.729 8.018 1.00 41.22 O ATOM 1444 CB VAL A 101 31.751 14.235 8.261 1.00 14.41 C ATOM 1445 CG1 VAL A 101 31.714 13.465 6.940 1.00 25.41 C ATOM 1446 CG2 VAL A 101 30.366 14.287 8.905 1.00 42.30 C ATOM 0 H VAL A 101 32.792 15.304 10.474 1.00 42.14 H new ATOM 0 HA VAL A 101 32.526 12.570 9.398 1.00 72.23 H new ATOM 0 HB VAL A 101 32.060 15.257 8.043 1.00 14.41 H new ATOM 0 HG11 VAL A 101 30.980 13.920 6.274 1.00 25.41 H new ATOM 0 HG12 VAL A 101 32.698 13.498 6.472 1.00 25.41 H new ATOM 0 HG13 VAL A 101 31.437 12.428 7.131 1.00 25.41 H new ATOM 0 HG21 VAL A 101 29.655 14.726 8.205 1.00 42.30 H new ATOM 0 HG22 VAL A 101 30.046 13.277 9.162 1.00 42.30 H new ATOM 0 HG23 VAL A 101 30.408 14.895 9.809 1.00 42.30 H new ATOM 1456 N ALA A 102 34.964 12.663 8.769 1.00 43.12 N ATOM 1457 CA ALA A 102 36.307 12.645 8.214 1.00 40.03 C ATOM 1458 C ALA A 102 36.289 12.034 6.823 1.00 12.52 C ATOM 1459 O ALA A 102 36.225 10.812 6.670 1.00 73.10 O ATOM 1460 CB ALA A 102 37.255 11.874 9.132 1.00 44.05 C ATOM 0 H ALA A 102 34.702 11.816 9.273 1.00 43.12 H new ATOM 0 HA ALA A 102 36.669 13.670 8.137 1.00 40.03 H new ATOM 0 HB1 ALA A 102 38.256 11.871 8.701 1.00 44.05 H new ATOM 0 HB2 ALA A 102 37.283 12.353 10.111 1.00 44.05 H new ATOM 0 HB3 ALA A 102 36.903 10.848 9.240 1.00 44.05 H new ATOM 1466 N LEU A 103 36.337 12.892 5.811 1.00 73.31 N ATOM 1467 CA LEU A 103 36.385 12.448 4.424 1.00 63.24 C ATOM 1468 C LEU A 103 37.726 12.870 3.824 1.00 11.33 C ATOM 1469 O LEU A 103 37.965 14.052 3.578 1.00 24.41 O ATOM 1470 CB LEU A 103 35.200 13.015 3.619 1.00 41.13 C ATOM 1471 CG LEU A 103 35.017 12.428 2.201 1.00 32.24 C ATOM 1472 CD1 LEU A 103 34.879 10.908 2.251 1.00 55.32 C ATOM 1473 CD2 LEU A 103 33.799 13.041 1.514 1.00 41.41 C ATOM 0 H LEU A 103 36.344 13.905 5.927 1.00 73.31 H new ATOM 0 HA LEU A 103 36.299 11.362 4.382 1.00 63.24 H new ATOM 0 HB2 LEU A 103 34.284 12.844 4.185 1.00 41.13 H new ATOM 0 HB3 LEU A 103 35.325 14.094 3.533 1.00 41.13 H new ATOM 0 HG LEU A 103 35.907 12.676 1.623 1.00 32.24 H new ATOM 0 HD11 LEU A 103 34.751 10.521 1.240 1.00 55.32 H new ATOM 0 HD12 LEU A 103 35.776 10.476 2.695 1.00 55.32 H new ATOM 0 HD13 LEU A 103 34.011 10.641 2.854 1.00 55.32 H new ATOM 0 HD21 LEU A 103 33.690 12.613 0.517 1.00 41.41 H new ATOM 0 HD22 LEU A 103 32.905 12.828 2.100 1.00 41.41 H new ATOM 0 HD23 LEU A 103 33.932 14.120 1.433 1.00 41.41 H new ATOM 1485 N PRO A 104 38.625 11.898 3.609 1.00 73.52 N ATOM 1486 CA PRO A 104 40.007 12.168 3.209 1.00 62.42 C ATOM 1487 C PRO A 104 40.118 12.683 1.776 1.00 45.15 C ATOM 1488 O PRO A 104 39.309 12.339 0.911 1.00 0.45 O ATOM 1489 CB PRO A 104 40.692 10.807 3.363 1.00 24.31 C ATOM 1490 CG PRO A 104 39.604 9.803 3.207 1.00 63.40 C ATOM 1491 CD PRO A 104 38.350 10.457 3.717 1.00 45.41 C ATOM 0 HA PRO A 104 40.460 12.954 3.813 1.00 62.42 H new ATOM 0 HB2 PRO A 104 41.467 10.668 2.609 1.00 24.31 H new ATOM 0 HB3 PRO A 104 41.175 10.717 4.336 1.00 24.31 H new ATOM 0 HG2 PRO A 104 39.493 9.509 2.163 1.00 63.40 H new ATOM 0 HG3 PRO A 104 39.827 8.897 3.771 1.00 63.40 H new ATOM 0 HD2 PRO A 104 37.482 10.172 3.123 1.00 45.41 H new ATOM 0 HD3 PRO A 104 38.140 10.168 4.747 1.00 45.41 H new ATOM 1499 N GLY A 105 41.127 13.517 1.545 1.00 54.45 N ATOM 1500 CA GLY A 105 41.343 14.101 0.233 1.00 13.33 C ATOM 1501 C GLY A 105 40.387 15.246 -0.051 1.00 43.42 C ATOM 1502 O GLY A 105 40.394 15.820 -1.142 1.00 1.41 O ATOM 0 H GLY A 105 41.806 13.801 2.251 1.00 54.45 H new ATOM 0 HA2 GLY A 105 42.369 14.461 0.162 1.00 13.33 H new ATOM 0 HA3 GLY A 105 41.222 13.332 -0.529 1.00 13.33 H new ATOM 1506 N LEU A 106 39.579 15.592 0.945 1.00 4.51 N ATOM 1507 CA LEU A 106 38.544 16.610 0.805 1.00 40.14 C ATOM 1508 C LEU A 106 38.851 17.830 1.678 1.00 43.11 C ATOM 1509 O LEU A 106 39.350 17.698 2.798 1.00 42.33 O ATOM 1510 CB LEU A 106 37.180 16.000 1.180 1.00 65.03 C ATOM 1511 CG LEU A 106 36.052 17.001 1.476 1.00 43.51 C ATOM 1512 CD1 LEU A 106 35.699 17.829 0.243 1.00 44.14 C ATOM 1513 CD2 LEU A 106 34.822 16.276 2.004 1.00 41.21 C ATOM 0 H LEU A 106 39.623 15.174 1.874 1.00 4.51 H new ATOM 0 HA LEU A 106 38.516 16.948 -0.231 1.00 40.14 H new ATOM 0 HB2 LEU A 106 36.858 15.351 0.365 1.00 65.03 H new ATOM 0 HB3 LEU A 106 37.316 15.367 2.057 1.00 65.03 H new ATOM 0 HG LEU A 106 36.410 17.688 2.243 1.00 43.51 H new ATOM 0 HD11 LEU A 106 34.898 18.526 0.490 1.00 44.14 H new ATOM 0 HD12 LEU A 106 36.577 18.386 -0.084 1.00 44.14 H new ATOM 0 HD13 LEU A 106 35.370 17.167 -0.558 1.00 44.14 H new ATOM 0 HD21 LEU A 106 34.033 17.000 2.208 1.00 41.21 H new ATOM 0 HD22 LEU A 106 34.474 15.560 1.259 1.00 41.21 H new ATOM 0 HD23 LEU A 106 35.077 15.748 2.923 1.00 41.21 H new ATOM 1525 N ASP A 107 38.564 19.014 1.141 1.00 72.42 N ATOM 1526 CA ASP A 107 38.733 20.273 1.870 1.00 14.02 C ATOM 1527 C ASP A 107 37.583 20.487 2.844 1.00 1.12 C ATOM 1528 O ASP A 107 36.435 20.168 2.535 1.00 10.24 O ATOM 1529 CB ASP A 107 38.786 21.463 0.899 1.00 13.35 C ATOM 1530 CG ASP A 107 40.102 21.572 0.149 1.00 12.43 C ATOM 1531 OD1 ASP A 107 41.046 22.196 0.675 1.00 14.01 O ATOM 1532 OD2 ASP A 107 40.191 21.059 -0.986 1.00 2.52 O1- ATOM 0 H ASP A 107 38.209 19.130 0.192 1.00 72.42 H new ATOM 0 HA ASP A 107 39.672 20.211 2.420 1.00 14.02 H new ATOM 0 HB2 ASP A 107 37.973 21.371 0.179 1.00 13.35 H new ATOM 0 HB3 ASP A 107 38.616 22.385 1.456 1.00 13.35 H new ATOM 1537 N ALA A 108 37.892 21.056 4.005 1.00 41.30 N ATOM 1538 CA ALA A 108 36.883 21.353 5.021 1.00 54.32 C ATOM 1539 C ALA A 108 35.808 22.289 4.469 1.00 74.35 C ATOM 1540 O ALA A 108 34.622 22.139 4.771 1.00 33.14 O ATOM 1541 CB ALA A 108 37.540 21.966 6.255 1.00 73.33 C ATOM 0 H ALA A 108 38.840 21.323 4.269 1.00 41.30 H new ATOM 0 HA ALA A 108 36.402 20.418 5.307 1.00 54.32 H new ATOM 0 HB1 ALA A 108 36.778 22.182 7.003 1.00 73.33 H new ATOM 0 HB2 ALA A 108 38.265 21.264 6.668 1.00 73.33 H new ATOM 0 HB3 ALA A 108 38.047 22.890 5.976 1.00 73.33 H new ATOM 1547 N ALA A 109 36.234 23.243 3.642 1.00 23.13 N ATOM 1548 CA ALA A 109 35.325 24.217 3.037 1.00 64.13 C ATOM 1549 C ALA A 109 34.220 23.525 2.239 1.00 31.24 C ATOM 1550 O ALA A 109 33.039 23.847 2.381 1.00 41.21 O ATOM 1551 CB ALA A 109 36.102 25.181 2.145 1.00 33.23 C ATOM 0 H ALA A 109 37.211 23.363 3.374 1.00 23.13 H new ATOM 0 HA ALA A 109 34.852 24.781 3.841 1.00 64.13 H new ATOM 0 HB1 ALA A 109 35.414 25.901 1.701 1.00 33.23 H new ATOM 0 HB2 ALA A 109 36.845 25.710 2.742 1.00 33.23 H new ATOM 0 HB3 ALA A 109 36.603 24.622 1.354 1.00 33.23 H new ATOM 1557 N ALA A 110 34.610 22.567 1.403 1.00 73.25 N ATOM 1558 CA ALA A 110 33.651 21.818 0.595 1.00 12.34 C ATOM 1559 C ALA A 110 32.921 20.795 1.459 1.00 44.05 C ATOM 1560 O ALA A 110 31.718 20.560 1.298 1.00 34.04 O ATOM 1561 CB ALA A 110 34.355 21.135 -0.572 1.00 53.00 C ATOM 0 H ALA A 110 35.582 22.291 1.267 1.00 73.25 H new ATOM 0 HA ALA A 110 32.917 22.514 0.188 1.00 12.34 H new ATOM 0 HB1 ALA A 110 33.626 20.582 -1.163 1.00 53.00 H new ATOM 0 HB2 ALA A 110 34.834 21.887 -1.198 1.00 53.00 H new ATOM 0 HB3 ALA A 110 35.109 20.447 -0.190 1.00 53.00 H new ATOM 1567 N ALA A 111 33.659 20.207 2.393 1.00 5.14 N ATOM 1568 CA ALA A 111 33.110 19.211 3.303 1.00 43.54 C ATOM 1569 C ALA A 111 31.902 19.767 4.045 1.00 4.44 C ATOM 1570 O ALA A 111 30.908 19.070 4.241 1.00 54.13 O ATOM 1571 CB ALA A 111 34.181 18.749 4.281 1.00 13.31 C ATOM 0 H ALA A 111 34.649 20.406 2.540 1.00 5.14 H new ATOM 0 HA ALA A 111 32.779 18.351 2.721 1.00 43.54 H new ATOM 0 HB1 ALA A 111 33.760 18.005 4.957 1.00 13.31 H new ATOM 0 HB2 ALA A 111 35.012 18.310 3.729 1.00 13.31 H new ATOM 0 HB3 ALA A 111 34.539 19.602 4.858 1.00 13.31 H new ATOM 1577 N LYS A 112 31.992 21.035 4.438 1.00 1.14 N ATOM 1578 CA LYS A 112 30.888 21.713 5.109 1.00 13.13 C ATOM 1579 C LYS A 112 29.603 21.635 4.284 1.00 74.23 C ATOM 1580 O LYS A 112 28.527 21.389 4.831 1.00 4.50 O ATOM 1581 CB LYS A 112 31.246 23.180 5.396 1.00 13.05 C ATOM 1582 CG LYS A 112 32.031 23.387 6.690 1.00 32.13 C ATOM 1583 CD LYS A 112 31.193 23.012 7.913 1.00 10.41 C ATOM 1584 CE LYS A 112 31.881 23.391 9.219 1.00 22.11 C ATOM 1585 NZ LYS A 112 31.026 23.102 10.403 1.00 2.23 N1+ ATOM 0 H LYS A 112 32.821 21.614 4.303 1.00 1.14 H new ATOM 0 HA LYS A 112 30.714 21.202 6.056 1.00 13.13 H new ATOM 0 HB2 LYS A 112 31.830 23.570 4.563 1.00 13.05 H new ATOM 0 HB3 LYS A 112 30.327 23.765 5.443 1.00 13.05 H new ATOM 0 HG2 LYS A 112 32.938 22.783 6.669 1.00 32.13 H new ATOM 0 HG3 LYS A 112 32.344 24.428 6.766 1.00 32.13 H new ATOM 0 HD2 LYS A 112 30.226 23.511 7.856 1.00 10.41 H new ATOM 0 HD3 LYS A 112 30.999 21.939 7.904 1.00 10.41 H new ATOM 0 HE2 LYS A 112 32.819 22.843 9.307 1.00 22.11 H new ATOM 0 HE3 LYS A 112 32.131 24.452 9.203 1.00 22.11 H new ATOM 0 HZ1 LYS A 112 31.417 23.582 11.239 1.00 2.23 H new ATOM 0 HZ2 LYS A 112 30.061 23.446 10.226 1.00 2.23 H new ATOM 0 HZ3 LYS A 112 31.003 22.076 10.572 1.00 2.23 H new ATOM 1599 N THR A 113 29.718 21.830 2.969 1.00 31.43 N ATOM 1600 CA THR A 113 28.546 21.826 2.099 1.00 60.21 C ATOM 1601 C THR A 113 28.076 20.394 1.839 1.00 74.22 C ATOM 1602 O THR A 113 26.876 20.135 1.733 1.00 73.22 O ATOM 1603 CB THR A 113 28.809 22.566 0.755 1.00 31.33 C ATOM 1604 OG1 THR A 113 27.593 23.157 0.278 1.00 10.35 O ATOM 1605 CG2 THR A 113 29.361 21.633 -0.323 1.00 32.43 C ATOM 0 H THR A 113 30.603 21.991 2.489 1.00 31.43 H new ATOM 0 HA THR A 113 27.757 22.370 2.618 1.00 60.21 H new ATOM 0 HB THR A 113 29.557 23.334 0.954 1.00 31.33 H new ATOM 0 HG1 THR A 113 27.765 23.623 -0.567 1.00 10.35 H new ATOM 0 HG21 THR A 113 29.528 22.196 -1.241 1.00 32.43 H new ATOM 0 HG22 THR A 113 30.304 21.204 0.016 1.00 32.43 H new ATOM 0 HG23 THR A 113 28.645 20.833 -0.513 1.00 32.43 H new ATOM 1613 N LEU A 114 29.026 19.461 1.751 1.00 23.12 N ATOM 1614 CA LEU A 114 28.695 18.057 1.510 1.00 20.51 C ATOM 1615 C LEU A 114 27.924 17.478 2.694 1.00 41.04 C ATOM 1616 O LEU A 114 26.860 16.878 2.524 1.00 13.34 O ATOM 1617 CB LEU A 114 29.966 17.235 1.237 1.00 61.01 C ATOM 1618 CG LEU A 114 30.818 17.715 0.047 1.00 11.45 C ATOM 1619 CD1 LEU A 114 31.971 16.750 -0.221 1.00 1.51 C ATOM 1620 CD2 LEU A 114 29.957 17.900 -1.204 1.00 50.51 C ATOM 0 H LEU A 114 30.024 19.651 1.842 1.00 23.12 H new ATOM 0 HA LEU A 114 28.060 18.003 0.626 1.00 20.51 H new ATOM 0 HB2 LEU A 114 30.585 17.246 2.134 1.00 61.01 H new ATOM 0 HB3 LEU A 114 29.678 16.199 1.061 1.00 61.01 H new ATOM 0 HG LEU A 114 31.243 18.684 0.307 1.00 11.45 H new ATOM 0 HD11 LEU A 114 32.558 17.110 -1.066 1.00 1.51 H new ATOM 0 HD12 LEU A 114 32.606 16.688 0.662 1.00 1.51 H new ATOM 0 HD13 LEU A 114 31.572 15.762 -0.451 1.00 1.51 H new ATOM 0 HD21 LEU A 114 30.583 18.239 -2.029 1.00 50.51 H new ATOM 0 HD22 LEU A 114 29.491 16.951 -1.468 1.00 50.51 H new ATOM 0 HD23 LEU A 114 29.183 18.642 -1.007 1.00 50.51 H new ATOM 1632 N VAL A 115 28.453 17.684 3.893 1.00 72.22 N ATOM 1633 CA VAL A 115 27.804 17.214 5.112 1.00 32.34 C ATOM 1634 C VAL A 115 26.478 17.943 5.323 1.00 1.13 C ATOM 1635 O VAL A 115 25.515 17.369 5.840 1.00 25.22 O ATOM 1636 CB VAL A 115 28.713 17.422 6.349 1.00 63.01 C ATOM 1637 CG1 VAL A 115 28.033 16.917 7.622 1.00 14.41 C ATOM 1638 CG2 VAL A 115 30.061 16.733 6.142 1.00 35.24 C ATOM 0 H VAL A 115 29.333 18.175 4.049 1.00 72.22 H new ATOM 0 HA VAL A 115 27.617 16.146 4.996 1.00 32.34 H new ATOM 0 HB VAL A 115 28.887 18.491 6.468 1.00 63.01 H new ATOM 0 HG11 VAL A 115 28.693 17.075 8.475 1.00 14.41 H new ATOM 0 HG12 VAL A 115 27.102 17.462 7.778 1.00 14.41 H new ATOM 0 HG13 VAL A 115 27.818 15.853 7.522 1.00 14.41 H new ATOM 0 HG21 VAL A 115 30.688 16.889 7.020 1.00 35.24 H new ATOM 0 HG22 VAL A 115 29.904 15.665 5.993 1.00 35.24 H new ATOM 0 HG23 VAL A 115 30.554 17.153 5.265 1.00 35.24 H new ATOM 1648 N ASP A 116 26.436 19.206 4.904 1.00 34.11 N ATOM 1649 CA ASP A 116 25.227 20.018 5.015 1.00 22.44 C ATOM 1650 C ASP A 116 24.096 19.381 4.219 1.00 4.20 C ATOM 1651 O ASP A 116 23.076 18.980 4.783 1.00 63.50 O ATOM 1652 CB ASP A 116 25.484 21.443 4.504 1.00 1.42 C ATOM 1653 CG ASP A 116 24.342 22.403 4.816 1.00 43.12 C ATOM 1654 OD1 ASP A 116 24.435 23.133 5.828 1.00 62.34 O ATOM 1655 OD2 ASP A 116 23.356 22.442 4.044 1.00 50.12 O1- ATOM 0 H ASP A 116 27.229 19.690 4.483 1.00 34.11 H new ATOM 0 HA ASP A 116 24.942 20.070 6.066 1.00 22.44 H new ATOM 0 HB2 ASP A 116 26.403 21.823 4.951 1.00 1.42 H new ATOM 0 HB3 ASP A 116 25.642 21.413 3.426 1.00 1.42 H new ATOM 1660 N ARG A 117 24.306 19.251 2.907 1.00 43.12 N ATOM 1661 CA ARG A 117 23.292 18.704 2.013 1.00 25.23 C ATOM 1662 C ARG A 117 22.949 17.269 2.408 1.00 51.42 C ATOM 1663 O ARG A 117 21.783 16.877 2.381 1.00 42.42 O ATOM 1664 CB ARG A 117 23.779 18.767 0.559 1.00 4.30 C ATOM 1665 CG ARG A 117 25.086 18.021 0.325 1.00 3.24 C ATOM 1666 CD ARG A 117 25.698 18.331 -1.033 1.00 12.41 C ATOM 1667 NE ARG A 117 24.943 17.740 -2.146 1.00 15.40 N ATOM 1668 CZ ARG A 117 25.499 17.237 -3.255 1.00 54.12 C ATOM 1669 NH1 ARG A 117 26.821 17.207 -3.387 1.00 44.31 N1+ ATOM 1670 NH2 ARG A 117 24.730 16.763 -4.227 1.00 65.24 N ATOM 0 H ARG A 117 25.173 19.519 2.442 1.00 43.12 H new ATOM 0 HA ARG A 117 22.387 19.305 2.100 1.00 25.23 H new ATOM 0 HB2 ARG A 117 23.010 18.351 -0.092 1.00 4.30 H new ATOM 0 HB3 ARG A 117 23.909 19.811 0.272 1.00 4.30 H new ATOM 0 HG2 ARG A 117 25.796 18.284 1.109 1.00 3.24 H new ATOM 0 HG3 ARG A 117 24.908 16.949 0.403 1.00 3.24 H new ATOM 0 HD2 ARG A 117 25.747 19.412 -1.166 1.00 12.41 H new ATOM 0 HD3 ARG A 117 26.723 17.960 -1.058 1.00 12.41 H new ATOM 0 HE ARG A 117 23.926 17.711 -2.069 1.00 15.40 H new ATOM 0 HH11 ARG A 117 27.416 17.568 -2.642 1.00 44.31 H new ATOM 0 HH12 ARG A 117 27.240 16.823 -4.234 1.00 44.31 H new ATOM 0 HH21 ARG A 117 23.715 16.782 -4.129 1.00 65.24 H new ATOM 0 HH22 ARG A 117 25.154 16.380 -5.072 1.00 65.24 H new ATOM 1684 N ALA A 118 23.965 16.503 2.799 1.00 40.10 N ATOM 1685 CA ALA A 118 23.774 15.113 3.213 1.00 45.33 C ATOM 1686 C ALA A 118 22.834 15.021 4.421 1.00 63.41 C ATOM 1687 O ALA A 118 21.832 14.301 4.391 1.00 0.11 O ATOM 1688 CB ALA A 118 25.119 14.463 3.525 1.00 44.02 C ATOM 0 H ALA A 118 24.933 16.822 2.838 1.00 40.10 H new ATOM 0 HA ALA A 118 23.310 14.573 2.388 1.00 45.33 H new ATOM 0 HB1 ALA A 118 24.961 13.429 3.832 1.00 44.02 H new ATOM 0 HB2 ALA A 118 25.749 14.486 2.636 1.00 44.02 H new ATOM 0 HB3 ALA A 118 25.609 15.010 4.331 1.00 44.02 H new ATOM 1694 N HIS A 119 23.142 15.777 5.473 1.00 52.13 N ATOM 1695 CA HIS A 119 22.322 15.776 6.689 1.00 15.33 C ATOM 1696 C HIS A 119 21.003 16.519 6.445 1.00 0.40 C ATOM 1697 O HIS A 119 20.060 16.419 7.239 1.00 63.33 O ATOM 1698 CB HIS A 119 23.101 16.409 7.854 1.00 54.45 C ATOM 1699 CG HIS A 119 22.404 16.328 9.184 1.00 21.21 C ATOM 1700 ND1 HIS A 119 22.207 15.143 9.865 1.00 2.34 N ATOM 1701 CD2 HIS A 119 21.864 17.297 9.964 1.00 20.34 C ATOM 1702 CE1 HIS A 119 21.586 15.387 11.004 1.00 52.23 C ATOM 1703 NE2 HIS A 119 21.365 16.684 11.087 1.00 74.13 N ATOM 0 H HIS A 119 23.951 16.398 5.511 1.00 52.13 H new ATOM 0 HA HIS A 119 22.086 14.745 6.954 1.00 15.33 H new ATOM 0 HB2 HIS A 119 24.071 15.919 7.935 1.00 54.45 H new ATOM 0 HB3 HIS A 119 23.292 17.456 7.621 1.00 54.45 H new ATOM 0 HD2 HIS A 119 21.832 18.354 9.743 1.00 20.34 H new ATOM 0 HE1 HIS A 119 21.307 14.650 11.742 1.00 52.23 H new ATOM 0 HE2 HIS A 119 20.898 17.156 11.861 1.00 74.13 H new ATOM 1712 N HIS A 120 20.950 17.260 5.341 1.00 43.52 N ATOM 1713 CA HIS A 120 19.754 18.003 4.943 1.00 31.45 C ATOM 1714 C HIS A 120 18.790 17.101 4.167 1.00 61.14 C ATOM 1715 O HIS A 120 17.574 17.285 4.227 1.00 43.11 O ATOM 1716 CB HIS A 120 20.157 19.216 4.087 1.00 2.24 C ATOM 1717 CG HIS A 120 19.022 20.114 3.688 1.00 45.12 C ATOM 1718 ND1 HIS A 120 18.776 21.327 4.292 1.00 44.32 N ATOM 1719 CD2 HIS A 120 18.090 19.990 2.712 1.00 50.50 C ATOM 1720 CE1 HIS A 120 17.744 21.906 3.709 1.00 65.24 C ATOM 1721 NE2 HIS A 120 17.309 21.116 2.744 1.00 75.14 N ATOM 0 H HIS A 120 21.734 17.363 4.696 1.00 43.52 H new ATOM 0 HA HIS A 120 19.244 18.353 5.840 1.00 31.45 H new ATOM 0 HB2 HIS A 120 20.890 19.804 4.639 1.00 2.24 H new ATOM 0 HB3 HIS A 120 20.651 18.857 3.184 1.00 2.24 H new ATOM 0 HD2 HIS A 120 17.982 19.157 2.033 1.00 50.50 H new ATOM 0 HE1 HIS A 120 17.325 22.865 3.976 1.00 65.24 H new ATOM 0 HE2 HIS A 120 16.522 21.311 2.125 1.00 75.14 H new ATOM 1730 N VAL A 121 19.336 16.132 3.433 1.00 33.11 N ATOM 1731 CA VAL A 121 18.514 15.211 2.641 1.00 23.21 C ATOM 1732 C VAL A 121 18.258 13.905 3.396 1.00 3.02 C ATOM 1733 O VAL A 121 17.511 13.046 2.925 1.00 30.52 O ATOM 1734 CB VAL A 121 19.157 14.888 1.266 1.00 61.42 C ATOM 1735 CG1 VAL A 121 19.348 16.161 0.442 1.00 74.54 C ATOM 1736 CG2 VAL A 121 20.481 14.140 1.439 1.00 44.31 C ATOM 0 H VAL A 121 20.340 15.963 3.369 1.00 33.11 H new ATOM 0 HA VAL A 121 17.566 15.720 2.468 1.00 23.21 H new ATOM 0 HB VAL A 121 18.476 14.234 0.722 1.00 61.42 H new ATOM 0 HG11 VAL A 121 19.800 15.909 -0.517 1.00 74.54 H new ATOM 0 HG12 VAL A 121 18.381 16.634 0.274 1.00 74.54 H new ATOM 0 HG13 VAL A 121 20.000 16.849 0.981 1.00 74.54 H new ATOM 0 HG21 VAL A 121 20.909 13.927 0.460 1.00 44.31 H new ATOM 0 HG22 VAL A 121 21.175 14.756 2.012 1.00 44.31 H new ATOM 0 HG23 VAL A 121 20.304 13.204 1.969 1.00 44.31 H new ATOM 1746 N CYS A 122 18.883 13.767 4.564 1.00 31.44 N ATOM 1747 CA CYS A 122 18.703 12.585 5.405 1.00 53.14 C ATOM 1748 C CYS A 122 17.255 12.509 5.904 1.00 23.34 C ATOM 1749 O CYS A 122 16.815 13.366 6.675 1.00 24.32 O ATOM 1750 CB CYS A 122 19.676 12.629 6.590 1.00 50.43 C ATOM 1751 SG CYS A 122 19.543 11.219 7.714 1.00 72.12 S ATOM 0 H CYS A 122 19.521 14.462 4.951 1.00 31.44 H new ATOM 0 HA CYS A 122 18.914 11.694 4.814 1.00 53.14 H new ATOM 0 HB2 CYS A 122 20.695 12.678 6.207 1.00 50.43 H new ATOM 0 HB3 CYS A 122 19.503 13.546 7.154 1.00 50.43 H new ATOM 0 HG CYS A 122 20.208 11.468 8.803 1.00 72.12 H new ATOM 1757 N PRO A 123 16.502 11.473 5.477 1.00 50.40 N ATOM 1758 CA PRO A 123 15.061 11.373 5.729 1.00 60.03 C ATOM 1759 C PRO A 123 14.708 10.738 7.080 1.00 74.45 C ATOM 1760 O PRO A 123 13.614 10.198 7.243 1.00 30.15 O ATOM 1761 CB PRO A 123 14.598 10.483 4.572 1.00 24.23 C ATOM 1762 CG PRO A 123 15.740 9.549 4.344 1.00 34.14 C ATOM 1763 CD PRO A 123 16.997 10.313 4.704 1.00 45.03 C ATOM 0 HA PRO A 123 14.585 12.352 5.778 1.00 60.03 H new ATOM 0 HB2 PRO A 123 13.687 9.942 4.827 1.00 24.23 H new ATOM 0 HB3 PRO A 123 14.381 11.071 3.680 1.00 24.23 H new ATOM 0 HG2 PRO A 123 15.639 8.655 4.960 1.00 34.14 H new ATOM 0 HG3 PRO A 123 15.770 9.219 3.306 1.00 34.14 H new ATOM 0 HD2 PRO A 123 17.680 9.702 5.294 1.00 45.03 H new ATOM 0 HD3 PRO A 123 17.541 10.629 3.814 1.00 45.03 H new ATOM 1771 N TYR A 124 15.623 10.803 8.047 1.00 53.44 N ATOM 1772 CA TYR A 124 15.328 10.317 9.396 1.00 1.24 C ATOM 1773 C TYR A 124 14.307 11.223 10.072 1.00 42.34 C ATOM 1774 O TYR A 124 13.462 10.750 10.829 1.00 23.13 O ATOM 1775 CB TYR A 124 16.606 10.195 10.246 1.00 65.44 C ATOM 1776 CG TYR A 124 17.232 8.816 10.169 1.00 10.42 C ATOM 1777 CD1 TYR A 124 17.154 7.925 11.241 1.00 42.12 C ATOM 1778 CD2 TYR A 124 17.863 8.385 9.007 1.00 13.25 C ATOM 1779 CE1 TYR A 124 17.690 6.660 11.152 1.00 14.31 C ATOM 1780 CE2 TYR A 124 18.407 7.120 8.918 1.00 12.12 C ATOM 1781 CZ TYR A 124 18.317 6.261 9.992 1.00 5.42 C ATOM 1782 OH TYR A 124 18.850 4.995 9.900 1.00 60.35 O ATOM 0 H TYR A 124 16.562 11.182 7.925 1.00 53.44 H new ATOM 0 HA TYR A 124 14.902 9.318 9.308 1.00 1.24 H new ATOM 0 HB2 TYR A 124 17.331 10.938 9.913 1.00 65.44 H new ATOM 0 HB3 TYR A 124 16.369 10.424 11.285 1.00 65.44 H new ATOM 0 HD1 TYR A 124 16.666 8.233 12.154 1.00 42.12 H new ATOM 0 HD2 TYR A 124 17.928 9.052 8.160 1.00 13.25 H new ATOM 0 HE1 TYR A 124 17.619 5.982 11.990 1.00 14.31 H new ATOM 0 HE2 TYR A 124 18.901 6.805 8.011 1.00 12.12 H new ATOM 0 HH TYR A 124 19.580 4.994 9.246 1.00 60.35 H new ATOM 1792 N SER A 125 14.409 12.523 9.781 1.00 23.21 N ATOM 1793 CA SER A 125 13.462 13.530 10.257 1.00 62.44 C ATOM 1794 C SER A 125 14.047 14.921 10.035 1.00 2.13 C ATOM 1795 O SER A 125 15.262 15.099 10.072 1.00 5.11 O ATOM 1796 CB SER A 125 13.143 13.350 11.753 1.00 61.32 C ATOM 1797 OG SER A 125 12.113 14.234 12.173 1.00 44.54 O ATOM 0 H SER A 125 15.157 12.907 9.204 1.00 23.21 H new ATOM 0 HA SER A 125 12.536 13.411 9.695 1.00 62.44 H new ATOM 0 HB2 SER A 125 12.840 12.320 11.941 1.00 61.32 H new ATOM 0 HB3 SER A 125 14.042 13.530 12.343 1.00 61.32 H new ATOM 0 HG SER A 125 11.711 13.898 13.001 1.00 44.54 H new ATOM 1803 N ASN A 126 13.184 15.900 9.797 1.00 23.44 N ATOM 1804 CA ASN A 126 13.603 17.301 9.783 1.00 73.42 C ATOM 1805 C ASN A 126 14.088 17.673 11.176 1.00 24.25 C ATOM 1806 O ASN A 126 14.999 18.479 11.354 1.00 64.13 O ATOM 1807 CB ASN A 126 12.463 18.238 9.348 1.00 54.23 C ATOM 1808 CG ASN A 126 12.077 18.060 7.889 1.00 23.41 C ATOM 1809 OD1 ASN A 126 12.889 17.632 7.069 1.00 4.50 O ATOM 1810 ND2 ASN A 126 10.846 18.419 7.549 1.00 5.31 N ATOM 0 H ASN A 126 12.192 15.754 9.611 1.00 23.44 H new ATOM 0 HA ASN A 126 14.406 17.419 9.055 1.00 73.42 H new ATOM 0 HB2 ASN A 126 11.590 18.055 9.975 1.00 54.23 H new ATOM 0 HB3 ASN A 126 12.765 19.272 9.515 1.00 54.23 H new ATOM 0 HD21 ASN A 126 10.543 18.345 6.578 1.00 5.31 H new ATOM 0 HD22 ASN A 126 10.202 18.769 8.259 1.00 5.31 H new ATOM 1817 N ALA A 127 13.488 17.034 12.167 1.00 54.04 N ATOM 1818 CA ALA A 127 13.832 17.259 13.562 1.00 54.10 C ATOM 1819 C ALA A 127 15.290 16.896 13.865 1.00 52.15 C ATOM 1820 O ALA A 127 15.768 17.136 14.968 1.00 1.24 O ATOM 1821 CB ALA A 127 12.899 16.452 14.449 1.00 41.33 C ATOM 0 H ALA A 127 12.749 16.345 12.027 1.00 54.04 H new ATOM 0 HA ALA A 127 13.716 18.323 13.767 1.00 54.10 H new ATOM 0 HB1 ALA A 127 13.156 16.620 15.495 1.00 41.33 H new ATOM 0 HB2 ALA A 127 11.870 16.764 14.274 1.00 41.33 H new ATOM 0 HB3 ALA A 127 13.001 15.392 14.216 1.00 41.33 H new ATOM 1827 N THR A 128 16.013 16.379 12.871 1.00 1.20 N ATOM 1828 CA THR A 128 17.365 15.884 13.086 1.00 2.03 C ATOM 1829 C THR A 128 18.328 17.047 12.922 1.00 41.31 C ATOM 1830 O THR A 128 19.532 16.934 13.160 1.00 64.41 O ATOM 1831 CB THR A 128 17.723 14.755 12.078 1.00 53.22 C ATOM 1832 OG1 THR A 128 18.838 13.993 12.558 1.00 44.43 O ATOM 1833 CG2 THR A 128 18.070 15.321 10.701 1.00 73.21 C ATOM 0 H THR A 128 15.681 16.294 11.910 1.00 1.20 H new ATOM 0 HA THR A 128 17.437 15.463 14.089 1.00 2.03 H new ATOM 0 HB THR A 128 16.845 14.115 11.985 1.00 53.22 H new ATOM 0 HG1 THR A 128 19.515 14.599 12.925 1.00 44.43 H new ATOM 0 HG21 THR A 128 18.315 14.504 10.023 1.00 73.21 H new ATOM 0 HG22 THR A 128 17.216 15.874 10.309 1.00 73.21 H new ATOM 0 HG23 THR A 128 18.927 15.989 10.788 1.00 73.21 H new ATOM 1841 N ARG A 129 17.769 18.166 12.479 1.00 15.30 N ATOM 1842 CA ARG A 129 18.533 19.355 12.213 1.00 1.24 C ATOM 1843 C ARG A 129 17.863 20.589 12.826 1.00 21.22 C ATOM 1844 O ARG A 129 18.523 21.411 13.460 1.00 60.25 O ATOM 1845 CB ARG A 129 18.663 19.497 10.694 1.00 61.34 C ATOM 1846 CG ARG A 129 17.321 19.560 9.971 1.00 45.30 C ATOM 1847 CD ARG A 129 17.453 19.427 8.466 1.00 1.10 C ATOM 1848 NE ARG A 129 17.764 18.052 8.056 1.00 10.14 N ATOM 1849 CZ ARG A 129 16.909 17.250 7.407 1.00 72.04 C ATOM 1850 NH1 ARG A 129 15.681 17.669 7.117 1.00 12.15 N1+ ATOM 1851 NH2 ARG A 129 17.286 16.028 7.055 1.00 55.55 N ATOM 0 H ARG A 129 16.770 18.264 12.297 1.00 15.30 H new ATOM 0 HA ARG A 129 19.520 19.275 12.668 1.00 1.24 H new ATOM 0 HB2 ARG A 129 19.231 20.400 10.469 1.00 61.34 H new ATOM 0 HB3 ARG A 129 19.236 18.655 10.306 1.00 61.34 H new ATOM 0 HG2 ARG A 129 16.675 18.766 10.345 1.00 45.30 H new ATOM 0 HG3 ARG A 129 16.832 20.506 10.205 1.00 45.30 H new ATOM 0 HD2 ARG A 129 16.524 19.744 7.992 1.00 1.10 H new ATOM 0 HD3 ARG A 129 18.237 20.096 8.111 1.00 1.10 H new ATOM 0 HE ARG A 129 18.689 17.684 8.279 1.00 10.14 H new ATOM 0 HH11 ARG A 129 15.384 18.606 7.389 1.00 12.15 H new ATOM 0 HH12 ARG A 129 15.035 17.053 6.623 1.00 12.15 H new ATOM 0 HH21 ARG A 129 18.226 15.700 7.278 1.00 55.55 H new ATOM 0 HH22 ARG A 129 16.636 15.416 6.561 1.00 55.55 H new ATOM 1865 N ASN A 130 16.552 20.722 12.620 1.00 53.23 N ATOM 1866 CA ASN A 130 15.817 21.900 13.081 1.00 71.44 C ATOM 1867 C ASN A 130 15.507 21.825 14.575 1.00 71.52 C ATOM 1868 O ASN A 130 15.521 22.839 15.274 1.00 41.25 O ATOM 1869 CB ASN A 130 14.515 22.081 12.279 1.00 51.21 C ATOM 1870 CG ASN A 130 14.712 21.873 10.784 1.00 65.44 C ATOM 1871 OD1 ASN A 130 14.464 20.790 10.263 1.00 64.05 O ATOM 1872 ND2 ASN A 130 15.191 22.890 10.088 1.00 32.23 N ATOM 0 H ASN A 130 15.978 20.030 12.138 1.00 53.23 H new ATOM 0 HA ASN A 130 16.458 22.765 12.914 1.00 71.44 H new ATOM 0 HB2 ASN A 130 13.767 21.377 12.644 1.00 51.21 H new ATOM 0 HB3 ASN A 130 14.122 23.083 12.454 1.00 51.21 H new ATOM 0 HD21 ASN A 130 15.365 22.787 9.088 1.00 32.23 H new ATOM 0 HD22 ASN A 130 15.387 23.778 10.551 1.00 32.23 H new ATOM 1879 N ASN A 131 15.232 20.618 15.057 1.00 23.53 N ATOM 1880 CA ASN A 131 14.791 20.417 16.440 1.00 43.51 C ATOM 1881 C ASN A 131 15.958 19.979 17.323 1.00 71.03 C ATOM 1882 O ASN A 131 16.066 20.398 18.477 1.00 72.12 O ATOM 1883 CB ASN A 131 13.671 19.362 16.477 1.00 43.33 C ATOM 1884 CG ASN A 131 12.818 19.380 17.752 1.00 4.41 C ATOM 1885 OD1 ASN A 131 11.621 19.101 17.701 1.00 52.34 O ATOM 1886 ND2 ASN A 131 13.410 19.684 18.904 1.00 53.22 N ATOM 0 H ASN A 131 15.306 19.759 14.512 1.00 23.53 H new ATOM 0 HA ASN A 131 14.409 21.362 16.827 1.00 43.51 H new ATOM 0 HB2 ASN A 131 13.019 19.514 15.617 1.00 43.33 H new ATOM 0 HB3 ASN A 131 14.117 18.374 16.368 1.00 43.33 H new ATOM 0 HD21 ASN A 131 12.870 19.689 19.769 1.00 53.22 H new ATOM 0 HD22 ASN A 131 14.404 19.912 18.922 1.00 53.22 H new ATOM 1893 N VAL A 132 16.834 19.141 16.780 1.00 22.24 N ATOM 1894 CA VAL A 132 17.927 18.566 17.565 1.00 51.15 C ATOM 1895 C VAL A 132 19.225 19.319 17.297 1.00 30.12 C ATOM 1896 O VAL A 132 19.557 19.616 16.146 1.00 33.10 O ATOM 1897 CB VAL A 132 18.115 17.050 17.267 1.00 54.43 C ATOM 1898 CG1 VAL A 132 19.311 16.481 18.034 1.00 31.31 C ATOM 1899 CG2 VAL A 132 16.840 16.268 17.606 1.00 70.22 C ATOM 0 H VAL A 132 16.812 18.844 15.804 1.00 22.24 H new ATOM 0 HA VAL A 132 17.664 18.668 18.618 1.00 51.15 H new ATOM 0 HB VAL A 132 18.314 16.942 16.201 1.00 54.43 H new ATOM 0 HG11 VAL A 132 19.418 15.420 17.806 1.00 31.31 H new ATOM 0 HG12 VAL A 132 20.218 17.009 17.738 1.00 31.31 H new ATOM 0 HG13 VAL A 132 19.150 16.608 19.105 1.00 31.31 H new ATOM 0 HG21 VAL A 132 16.993 15.211 17.390 1.00 70.22 H new ATOM 0 HG22 VAL A 132 16.607 16.392 18.664 1.00 70.22 H new ATOM 0 HG23 VAL A 132 16.012 16.644 17.006 1.00 70.22 H new ATOM 1909 N ALA A 133 19.944 19.644 18.367 1.00 44.32 N ATOM 1910 CA ALA A 133 21.201 20.372 18.261 1.00 45.42 C ATOM 1911 C ALA A 133 22.314 19.445 17.807 1.00 30.31 C ATOM 1912 O ALA A 133 22.916 18.729 18.609 1.00 14.22 O ATOM 1913 CB ALA A 133 21.549 21.036 19.590 1.00 22.23 C ATOM 0 H ALA A 133 19.674 19.412 19.323 1.00 44.32 H new ATOM 0 HA ALA A 133 21.087 21.156 17.513 1.00 45.42 H new ATOM 0 HB1 ALA A 133 22.491 21.575 19.492 1.00 22.23 H new ATOM 0 HB2 ALA A 133 20.759 21.734 19.866 1.00 22.23 H new ATOM 0 HB3 ALA A 133 21.646 20.274 20.363 1.00 22.23 H new ATOM 1919 N VAL A 134 22.551 19.430 16.505 1.00 55.21 N ATOM 1920 CA VAL A 134 23.608 18.624 15.929 1.00 14.23 C ATOM 1921 C VAL A 134 24.716 19.517 15.378 1.00 75.02 C ATOM 1922 O VAL A 134 24.523 20.213 14.378 1.00 44.45 O ATOM 1923 CB VAL A 134 23.074 17.706 14.805 1.00 13.33 C ATOM 1924 CG1 VAL A 134 24.195 16.836 14.260 1.00 2.32 C ATOM 1925 CG2 VAL A 134 21.913 16.848 15.309 1.00 40.12 C ATOM 0 H VAL A 134 22.019 19.973 15.825 1.00 55.21 H new ATOM 0 HA VAL A 134 24.009 17.994 16.723 1.00 14.23 H new ATOM 0 HB VAL A 134 22.699 18.332 13.996 1.00 13.33 H new ATOM 0 HG11 VAL A 134 23.806 16.194 13.469 1.00 2.32 H new ATOM 0 HG12 VAL A 134 24.985 17.470 13.857 1.00 2.32 H new ATOM 0 HG13 VAL A 134 24.599 16.219 15.062 1.00 2.32 H new ATOM 0 HG21 VAL A 134 21.554 16.211 14.501 1.00 40.12 H new ATOM 0 HG22 VAL A 134 22.253 16.227 16.138 1.00 40.12 H new ATOM 0 HG23 VAL A 134 21.103 17.494 15.648 1.00 40.12 H new ATOM 1935 N ARG A 135 25.865 19.507 16.044 1.00 5.32 N ATOM 1936 CA ARG A 135 27.015 20.285 15.609 1.00 35.41 C ATOM 1937 C ARG A 135 27.783 19.508 14.543 1.00 62.34 C ATOM 1938 O ARG A 135 28.362 18.452 14.823 1.00 24.24 O ATOM 1939 CB ARG A 135 27.926 20.622 16.804 1.00 72.41 C ATOM 1940 CG ARG A 135 27.171 21.243 17.977 1.00 24.53 C ATOM 1941 CD ARG A 135 28.096 21.937 18.972 1.00 72.30 C ATOM 1942 NE ARG A 135 29.124 21.045 19.520 1.00 54.11 N ATOM 1943 CZ ARG A 135 29.375 20.913 20.825 1.00 2.05 C ATOM 1944 NH1 ARG A 135 28.568 21.467 21.720 1.00 12.22 N1+ ATOM 1945 NH2 ARG A 135 30.411 20.192 21.230 1.00 32.21 N ATOM 0 H ARG A 135 26.024 18.964 16.893 1.00 5.32 H new ATOM 0 HA ARG A 135 26.668 21.225 15.180 1.00 35.41 H new ATOM 0 HB2 ARG A 135 28.424 19.713 17.141 1.00 72.41 H new ATOM 0 HB3 ARG A 135 28.705 21.310 16.476 1.00 72.41 H new ATOM 0 HG2 ARG A 135 26.447 21.964 17.597 1.00 24.53 H new ATOM 0 HG3 ARG A 135 26.607 20.466 18.493 1.00 24.53 H new ATOM 0 HD2 ARG A 135 28.580 22.781 18.481 1.00 72.30 H new ATOM 0 HD3 ARG A 135 27.501 22.342 19.790 1.00 72.30 H new ATOM 0 HE ARG A 135 29.679 20.493 18.866 1.00 54.11 H new ATOM 0 HH11 ARG A 135 27.752 21.996 21.412 1.00 12.22 H new ATOM 0 HH12 ARG A 135 28.763 21.364 22.716 1.00 12.22 H new ATOM 0 HH21 ARG A 135 31.016 19.739 20.545 1.00 32.21 H new ATOM 0 HH22 ARG A 135 30.603 20.091 22.227 1.00 32.21 H new ATOM 1959 N LEU A 136 27.748 20.011 13.314 1.00 14.32 N ATOM 1960 CA LEU A 136 28.390 19.354 12.189 1.00 2.32 C ATOM 1961 C LEU A 136 29.843 19.784 12.053 1.00 50.04 C ATOM 1962 O LEU A 136 30.151 20.875 11.566 1.00 1.31 O ATOM 1963 CB LEU A 136 27.611 19.634 10.901 1.00 33.50 C ATOM 1964 CG LEU A 136 26.241 18.944 10.830 1.00 40.54 C ATOM 1965 CD1 LEU A 136 25.521 19.285 9.527 1.00 3.54 C ATOM 1966 CD2 LEU A 136 26.403 17.431 10.988 1.00 32.41 C ATOM 0 H LEU A 136 27.275 20.882 13.073 1.00 14.32 H new ATOM 0 HA LEU A 136 28.385 18.279 12.372 1.00 2.32 H new ATOM 0 HB2 LEU A 136 27.469 20.710 10.803 1.00 33.50 H new ATOM 0 HB3 LEU A 136 28.211 19.313 10.050 1.00 33.50 H new ATOM 0 HG LEU A 136 25.626 19.313 11.651 1.00 40.54 H new ATOM 0 HD11 LEU A 136 24.554 18.783 9.504 1.00 3.54 H new ATOM 0 HD12 LEU A 136 25.372 20.363 9.465 1.00 3.54 H new ATOM 0 HD13 LEU A 136 26.123 18.953 8.681 1.00 3.54 H new ATOM 0 HD21 LEU A 136 25.425 16.953 10.936 1.00 32.41 H new ATOM 0 HD22 LEU A 136 27.037 17.048 10.189 1.00 32.41 H new ATOM 0 HD23 LEU A 136 26.863 17.213 11.952 1.00 32.41 H new ATOM 1978 N VAL A 137 30.724 18.906 12.495 1.00 24.14 N ATOM 1979 CA VAL A 137 32.161 19.125 12.436 1.00 11.21 C ATOM 1980 C VAL A 137 32.768 18.261 11.336 1.00 22.22 C ATOM 1981 O VAL A 137 32.722 17.032 11.391 1.00 60.11 O ATOM 1982 CB VAL A 137 32.833 18.831 13.809 1.00 74.42 C ATOM 1983 CG1 VAL A 137 32.054 17.763 14.567 1.00 2.12 C ATOM 1984 CG2 VAL A 137 34.300 18.412 13.649 1.00 51.44 C ATOM 0 H VAL A 137 30.462 18.012 12.909 1.00 24.14 H new ATOM 0 HA VAL A 137 32.344 20.174 12.203 1.00 11.21 H new ATOM 0 HB VAL A 137 32.817 19.756 14.385 1.00 74.42 H new ATOM 0 HG11 VAL A 137 32.538 17.570 15.524 1.00 2.12 H new ATOM 0 HG12 VAL A 137 31.035 18.109 14.739 1.00 2.12 H new ATOM 0 HG13 VAL A 137 32.031 16.844 13.981 1.00 2.12 H new ATOM 0 HG21 VAL A 137 34.732 18.216 14.631 1.00 51.44 H new ATOM 0 HG22 VAL A 137 34.356 17.509 13.041 1.00 51.44 H new ATOM 0 HG23 VAL A 137 34.856 19.213 13.161 1.00 51.44 H new ATOM 1994 N VAL A 138 33.307 18.914 10.325 1.00 43.23 N ATOM 1995 CA VAL A 138 33.893 18.224 9.188 1.00 53.11 C ATOM 1996 C VAL A 138 35.390 18.053 9.402 1.00 13.33 C ATOM 1997 O VAL A 138 36.070 18.948 9.912 1.00 44.02 O ATOM 1998 CB VAL A 138 33.634 18.948 7.852 1.00 15.42 C ATOM 1999 CG1 VAL A 138 32.154 19.288 7.701 1.00 20.25 C ATOM 2000 CG2 VAL A 138 34.515 20.181 7.730 1.00 13.44 C ATOM 0 H VAL A 138 33.352 19.931 10.266 1.00 43.23 H new ATOM 0 HA VAL A 138 33.410 17.249 9.122 1.00 53.11 H new ATOM 0 HB VAL A 138 33.898 18.277 7.035 1.00 15.42 H new ATOM 0 HG11 VAL A 138 31.993 19.798 6.751 1.00 20.25 H new ATOM 0 HG12 VAL A 138 31.566 18.371 7.724 1.00 20.25 H new ATOM 0 HG13 VAL A 138 31.845 19.938 8.519 1.00 20.25 H new ATOM 0 HG21 VAL A 138 34.317 20.677 6.780 1.00 13.44 H new ATOM 0 HG22 VAL A 138 34.298 20.866 8.550 1.00 13.44 H new ATOM 0 HG23 VAL A 138 35.563 19.885 7.773 1.00 13.44 H new ATOM 2010 N ALA A 139 35.879 16.890 9.043 1.00 53.03 N ATOM 2011 CA ALA A 139 37.272 16.520 9.276 1.00 12.31 C ATOM 2012 C ALA A 139 37.929 16.033 7.985 1.00 73.13 C ATOM 2013 O ALA A 139 37.260 15.475 7.108 1.00 43.50 O ATOM 2014 CB ALA A 139 37.358 15.451 10.360 1.00 22.50 C ATOM 0 H ALA A 139 35.329 16.166 8.580 1.00 53.03 H new ATOM 0 HA ALA A 139 37.812 17.404 9.615 1.00 12.31 H new ATOM 0 HB1 ALA A 139 38.402 15.183 10.525 1.00 22.50 H new ATOM 0 HB2 ALA A 139 36.932 15.837 11.286 1.00 22.50 H new ATOM 0 HB3 ALA A 139 36.802 14.568 10.045 1.00 22.50 H new ATOM 2021 N MET B 1 27.156 24.155 26.176 1.00 72.34 N ATOM 2022 CA MET B 1 26.167 23.875 27.211 1.00 63.32 C ATOM 2023 C MET B 1 26.800 23.126 28.382 1.00 71.35 C ATOM 2024 O MET B 1 28.006 22.856 28.387 1.00 2.40 O ATOM 2025 CB MET B 1 25.007 23.057 26.637 1.00 41.04 C ATOM 2026 CG MET B 1 25.430 21.691 26.136 1.00 5.33 C ATOM 2027 SD MET B 1 24.040 20.688 25.578 1.00 24.33 S ATOM 2028 CE MET B 1 23.221 20.363 27.136 1.00 72.42 C ATOM 0 H1 MET B 1 26.767 23.899 25.246 1.00 72.34 H new ATOM 0 H2 MET B 1 27.391 25.168 26.186 1.00 72.34 H new ATOM 0 H3 MET B 1 28.015 23.598 26.357 1.00 72.34 H new ATOM 0 HA MET B 1 25.784 24.828 27.575 1.00 63.32 H new ATOM 0 HB2 MET B 1 24.243 22.935 27.404 1.00 41.04 H new ATOM 0 HB3 MET B 1 24.550 23.612 25.818 1.00 41.04 H new ATOM 0 HG2 MET B 1 26.136 21.813 25.315 1.00 5.33 H new ATOM 0 HG3 MET B 1 25.955 21.164 26.932 1.00 5.33 H new ATOM 0 HE1 MET B 1 22.615 19.462 27.047 1.00 72.42 H new ATOM 0 HE2 MET B 1 23.968 20.222 27.917 1.00 72.42 H new ATOM 0 HE3 MET B 1 22.581 21.207 27.394 1.00 72.42 H new ATOM 2038 N ASN B 2 25.974 22.786 29.362 1.00 33.33 N ATOM 2039 CA ASN B 2 26.420 22.058 30.546 1.00 51.30 C ATOM 2040 C ASN B 2 26.093 20.577 30.395 1.00 60.31 C ATOM 2041 O ASN B 2 25.047 20.113 30.844 1.00 61.35 O ATOM 2042 CB ASN B 2 25.755 22.628 31.811 1.00 21.53 C ATOM 2043 CG ASN B 2 26.138 21.877 33.080 1.00 32.42 C ATOM 2044 OD1 ASN B 2 27.246 21.349 33.201 1.00 51.33 O ATOM 2045 ND2 ASN B 2 25.222 21.830 34.039 1.00 42.33 N ATOM 0 H ASN B 2 24.978 23.006 29.361 1.00 33.33 H new ATOM 0 HA ASN B 2 27.499 22.174 30.646 1.00 51.30 H new ATOM 0 HB2 ASN B 2 26.033 23.676 31.919 1.00 21.53 H new ATOM 0 HB3 ASN B 2 24.672 22.596 31.690 1.00 21.53 H new ATOM 0 HD21 ASN B 2 25.423 21.345 34.913 1.00 42.33 H new ATOM 0 HD22 ASN B 2 24.316 22.279 33.902 1.00 42.33 H new ATOM 2052 N ILE B 3 26.969 19.850 29.714 1.00 21.23 N ATOM 2053 CA ILE B 3 26.778 18.425 29.497 1.00 72.42 C ATOM 2054 C ILE B 3 26.985 17.631 30.782 1.00 64.03 C ATOM 2055 O ILE B 3 28.021 17.743 31.444 1.00 40.30 O ATOM 2056 CB ILE B 3 27.735 17.901 28.402 1.00 60.30 C ATOM 2057 CG1 ILE B 3 27.452 18.622 27.077 1.00 50.54 C ATOM 2058 CG2 ILE B 3 27.600 16.389 28.232 1.00 62.10 C ATOM 2059 CD1 ILE B 3 26.136 18.224 26.440 1.00 13.01 C ATOM 0 H ILE B 3 27.822 20.227 29.301 1.00 21.23 H new ATOM 0 HA ILE B 3 25.748 18.285 29.167 1.00 72.42 H new ATOM 0 HB ILE B 3 28.760 18.109 28.708 1.00 60.30 H new ATOM 0 HG12 ILE B 3 27.451 19.698 27.251 1.00 50.54 H new ATOM 0 HG13 ILE B 3 28.262 18.413 26.379 1.00 50.54 H new ATOM 0 HG21 ILE B 3 28.285 16.048 27.456 1.00 62.10 H new ATOM 0 HG22 ILE B 3 27.842 15.894 29.172 1.00 62.10 H new ATOM 0 HG23 ILE B 3 26.577 16.145 27.947 1.00 62.10 H new ATOM 0 HD11 ILE B 3 26.002 18.773 25.508 1.00 13.01 H new ATOM 0 HD12 ILE B 3 26.141 17.154 26.234 1.00 13.01 H new ATOM 0 HD13 ILE B 3 25.317 18.459 27.120 1.00 13.01 H new ATOM 2071 N LEU B 4 25.979 16.843 31.129 1.00 23.11 N ATOM 2072 CA LEU B 4 26.053 15.928 32.258 1.00 23.43 C ATOM 2073 C LEU B 4 26.738 14.645 31.827 1.00 41.14 C ATOM 2074 O LEU B 4 27.618 14.134 32.523 1.00 62.34 O ATOM 2075 CB LEU B 4 24.652 15.609 32.790 1.00 50.44 C ATOM 2076 CG LEU B 4 23.843 16.823 33.255 1.00 31.23 C ATOM 2077 CD1 LEU B 4 22.442 16.401 33.685 1.00 75.25 C ATOM 2078 CD2 LEU B 4 24.567 17.556 34.384 1.00 11.04 C ATOM 0 H LEU B 4 25.087 16.820 30.635 1.00 23.11 H new ATOM 0 HA LEU B 4 26.627 16.403 33.054 1.00 23.43 H new ATOM 0 HB2 LEU B 4 24.091 15.096 32.009 1.00 50.44 H new ATOM 0 HB3 LEU B 4 24.746 14.913 33.624 1.00 50.44 H new ATOM 0 HG LEU B 4 23.746 17.513 32.417 1.00 31.23 H new ATOM 0 HD11 LEU B 4 21.882 17.277 34.012 1.00 75.25 H new ATOM 0 HD12 LEU B 4 21.928 15.935 32.844 1.00 75.25 H new ATOM 0 HD13 LEU B 4 22.513 15.688 34.507 1.00 75.25 H new ATOM 0 HD21 LEU B 4 23.974 18.415 34.699 1.00 11.04 H new ATOM 0 HD22 LEU B 4 24.703 16.880 35.228 1.00 11.04 H new ATOM 0 HD23 LEU B 4 25.540 17.897 34.031 1.00 11.04 H new ATOM 2090 N TYR B 5 26.336 14.130 30.668 1.00 23.42 N ATOM 2091 CA TYR B 5 26.913 12.888 30.155 1.00 44.15 C ATOM 2092 C TYR B 5 27.100 12.963 28.643 1.00 24.15 C ATOM 2093 O TYR B 5 26.182 13.332 27.917 1.00 75.34 O ATOM 2094 CB TYR B 5 26.020 11.694 30.522 1.00 21.21 C ATOM 2095 CG TYR B 5 26.619 10.338 30.179 1.00 10.12 C ATOM 2096 CD1 TYR B 5 26.486 9.794 28.904 1.00 52.12 C ATOM 2097 CD2 TYR B 5 27.314 9.601 31.134 1.00 71.12 C ATOM 2098 CE1 TYR B 5 27.026 8.560 28.595 1.00 75.45 C ATOM 2099 CE2 TYR B 5 27.856 8.368 30.828 1.00 10.31 C ATOM 2100 CZ TYR B 5 27.710 7.852 29.558 1.00 52.51 C ATOM 2101 OH TYR B 5 28.244 6.617 29.252 1.00 25.44 O ATOM 0 H TYR B 5 25.621 14.547 30.071 1.00 23.42 H new ATOM 0 HA TYR B 5 27.891 12.749 30.615 1.00 44.15 H new ATOM 0 HB2 TYR B 5 25.811 11.726 31.591 1.00 21.21 H new ATOM 0 HB3 TYR B 5 25.065 11.797 30.007 1.00 21.21 H new ATOM 0 HD1 TYR B 5 25.952 10.345 28.144 1.00 52.12 H new ATOM 0 HD2 TYR B 5 27.431 10.000 32.131 1.00 71.12 H new ATOM 0 HE1 TYR B 5 26.912 8.152 27.601 1.00 75.45 H new ATOM 0 HE2 TYR B 5 28.392 7.810 31.581 1.00 10.31 H new ATOM 0 HH TYR B 5 28.695 6.251 30.041 1.00 25.44 H new ATOM 2111 N LYS B 6 28.299 12.625 28.181 1.00 30.03 N ATOM 2112 CA LYS B 6 28.594 12.559 26.754 1.00 63.12 C ATOM 2113 C LYS B 6 29.437 11.326 26.443 1.00 12.41 C ATOM 2114 O LYS B 6 30.372 10.999 27.178 1.00 54.02 O ATOM 2115 CB LYS B 6 29.309 13.837 26.277 1.00 22.40 C ATOM 2116 CG LYS B 6 29.866 13.736 24.855 1.00 43.31 C ATOM 2117 CD LYS B 6 30.262 15.095 24.278 1.00 65.01 C ATOM 2118 CE LYS B 6 29.045 15.957 23.965 1.00 23.11 C ATOM 2119 NZ LYS B 6 29.409 17.178 23.200 1.00 52.41 N1+ ATOM 0 H LYS B 6 29.090 12.390 28.781 1.00 30.03 H new ATOM 0 HA LYS B 6 27.650 12.481 26.215 1.00 63.12 H new ATOM 0 HB2 LYS B 6 28.611 14.673 26.326 1.00 22.40 H new ATOM 0 HB3 LYS B 6 30.126 14.063 26.962 1.00 22.40 H new ATOM 0 HG2 LYS B 6 30.736 13.079 24.856 1.00 43.31 H new ATOM 0 HG3 LYS B 6 29.119 13.275 24.209 1.00 43.31 H new ATOM 0 HD2 LYS B 6 30.904 15.617 24.987 1.00 65.01 H new ATOM 0 HD3 LYS B 6 30.845 14.947 23.369 1.00 65.01 H new ATOM 0 HE2 LYS B 6 28.324 15.372 23.393 1.00 23.11 H new ATOM 0 HE3 LYS B 6 28.556 16.245 24.895 1.00 23.11 H new ATOM 0 HZ1 LYS B 6 28.544 17.647 22.862 1.00 52.41 H new ATOM 0 HZ2 LYS B 6 29.938 17.829 23.815 1.00 52.41 H new ATOM 0 HZ3 LYS B 6 30.000 16.914 22.386 1.00 52.41 H new ATOM 2133 N THR B 7 29.086 10.645 25.361 1.00 10.14 N ATOM 2134 CA THR B 7 29.810 9.463 24.909 1.00 42.05 C ATOM 2135 C THR B 7 30.063 9.551 23.404 1.00 63.52 C ATOM 2136 O THR B 7 29.406 10.330 22.700 1.00 72.52 O ATOM 2137 CB THR B 7 29.034 8.169 25.243 1.00 0.35 C ATOM 2138 OG1 THR B 7 29.785 7.023 24.818 1.00 0.11 O ATOM 2139 CG2 THR B 7 27.656 8.164 24.586 1.00 24.11 C ATOM 0 H THR B 7 28.292 10.895 24.772 1.00 10.14 H new ATOM 0 HA THR B 7 30.765 9.428 25.434 1.00 42.05 H new ATOM 0 HB THR B 7 28.893 8.129 26.323 1.00 0.35 H new ATOM 0 HG1 THR B 7 29.189 6.248 24.749 1.00 0.11 H new ATOM 0 HG21 THR B 7 27.135 7.241 24.840 1.00 24.11 H new ATOM 0 HG22 THR B 7 27.079 9.017 24.944 1.00 24.11 H new ATOM 0 HG23 THR B 7 27.769 8.231 23.504 1.00 24.11 H new ATOM 2147 N ALA B 8 31.005 8.751 22.911 1.00 4.15 N ATOM 2148 CA ALA B 8 31.435 8.837 21.520 1.00 51.31 C ATOM 2149 C ALA B 8 31.299 7.499 20.802 1.00 33.43 C ATOM 2150 O ALA B 8 31.442 6.429 21.401 1.00 64.22 O ATOM 2151 CB ALA B 8 32.877 9.329 21.448 1.00 24.44 C ATOM 0 H ALA B 8 31.485 8.035 23.456 1.00 4.15 H new ATOM 0 HA ALA B 8 30.783 9.550 21.014 1.00 51.31 H new ATOM 0 HB1 ALA B 8 33.189 9.390 20.405 1.00 24.44 H new ATOM 0 HB2 ALA B 8 32.948 10.315 21.906 1.00 24.44 H new ATOM 0 HB3 ALA B 8 33.526 8.634 21.981 1.00 24.44 H new ATOM 2157 N ALA B 9 31.025 7.570 19.507 1.00 21.22 N ATOM 2158 CA ALA B 9 30.951 6.393 18.656 1.00 20.22 C ATOM 2159 C ALA B 9 31.722 6.643 17.366 1.00 31.45 C ATOM 2160 O ALA B 9 31.606 7.706 16.763 1.00 1.21 O ATOM 2161 CB ALA B 9 29.498 6.031 18.368 1.00 3.15 C ATOM 0 H ALA B 9 30.848 8.447 19.017 1.00 21.22 H new ATOM 0 HA ALA B 9 31.406 5.548 19.173 1.00 20.22 H new ATOM 0 HB1 ALA B 9 29.463 5.148 17.730 1.00 3.15 H new ATOM 0 HB2 ALA B 9 28.982 5.822 19.305 1.00 3.15 H new ATOM 0 HB3 ALA B 9 29.009 6.864 17.863 1.00 3.15 H new ATOM 2167 N THR B 10 32.500 5.661 16.950 1.00 33.23 N ATOM 2168 CA THR B 10 33.376 5.780 15.810 1.00 64.31 C ATOM 2169 C THR B 10 32.952 4.776 14.749 1.00 63.33 C ATOM 2170 O THR B 10 33.113 3.565 14.921 1.00 30.04 O ATOM 2171 CB THR B 10 34.833 5.514 16.233 1.00 62.43 C ATOM 2172 OG1 THR B 10 35.174 6.363 17.340 1.00 21.44 O ATOM 2173 CG2 THR B 10 35.792 5.756 15.077 1.00 23.24 C ATOM 0 H THR B 10 32.538 4.748 17.404 1.00 33.23 H new ATOM 0 HA THR B 10 33.310 6.790 15.405 1.00 64.31 H new ATOM 0 HB THR B 10 34.921 4.469 16.531 1.00 62.43 H new ATOM 0 HG1 THR B 10 36.100 6.192 17.610 1.00 21.44 H new ATOM 0 HG21 THR B 10 36.813 5.561 15.404 1.00 23.24 H new ATOM 0 HG22 THR B 10 35.542 5.090 14.251 1.00 23.24 H new ATOM 0 HG23 THR B 10 35.709 6.791 14.746 1.00 23.24 H new ATOM 2181 N SER B 11 32.382 5.279 13.675 1.00 64.42 N ATOM 2182 CA SER B 11 31.869 4.435 12.613 1.00 20.54 C ATOM 2183 C SER B 11 32.695 4.614 11.340 1.00 44.42 C ATOM 2184 O SER B 11 32.768 5.707 10.778 1.00 74.01 O ATOM 2185 CB SER B 11 30.395 4.764 12.384 1.00 74.14 C ATOM 2186 OG SER B 11 29.632 4.478 13.548 1.00 11.25 O ATOM 0 H SER B 11 32.261 6.279 13.512 1.00 64.42 H new ATOM 0 HA SER B 11 31.950 3.387 12.900 1.00 20.54 H new ATOM 0 HB2 SER B 11 30.288 5.817 12.122 1.00 74.14 H new ATOM 0 HB3 SER B 11 30.014 4.186 11.542 1.00 74.14 H new ATOM 0 HG SER B 11 28.939 5.162 13.661 1.00 11.25 H new ATOM 2192 N THR B 12 33.337 3.534 10.908 1.00 44.31 N ATOM 2193 CA THR B 12 34.234 3.561 9.764 1.00 14.13 C ATOM 2194 C THR B 12 33.539 3.056 8.500 1.00 53.42 C ATOM 2195 O THR B 12 32.556 2.300 8.568 1.00 32.44 O ATOM 2196 CB THR B 12 35.462 2.674 10.039 1.00 2.30 C ATOM 2197 OG1 THR B 12 35.877 2.835 11.403 1.00 14.42 O ATOM 2198 CG2 THR B 12 36.620 3.027 9.111 1.00 31.31 C ATOM 0 H THR B 12 33.248 2.616 11.343 1.00 44.31 H new ATOM 0 HA THR B 12 34.540 4.596 9.609 1.00 14.13 H new ATOM 0 HB THR B 12 35.179 1.638 9.855 1.00 2.30 H new ATOM 0 HG1 THR B 12 36.658 2.268 11.577 1.00 14.42 H new ATOM 0 HG21 THR B 12 37.472 2.383 9.331 1.00 31.31 H new ATOM 0 HG22 THR B 12 36.313 2.882 8.075 1.00 31.31 H new ATOM 0 HG23 THR B 12 36.904 4.068 9.263 1.00 31.31 H new ATOM 2206 N GLY B 13 34.058 3.474 7.350 1.00 25.11 N ATOM 2207 CA GLY B 13 33.562 2.983 6.084 1.00 71.12 C ATOM 2208 C GLY B 13 34.007 1.559 5.822 1.00 70.11 C ATOM 2209 O GLY B 13 34.897 1.315 5.005 1.00 42.34 O ATOM 0 H GLY B 13 34.819 4.149 7.276 1.00 25.11 H new ATOM 0 HA2 GLY B 13 32.473 3.031 6.076 1.00 71.12 H new ATOM 0 HA3 GLY B 13 33.915 3.628 5.280 1.00 71.12 H new ATOM 2213 N GLY B 14 33.408 0.623 6.552 1.00 21.54 N ATOM 2214 CA GLY B 14 33.694 -0.785 6.354 1.00 31.21 C ATOM 2215 C GLY B 14 33.284 -1.269 4.974 1.00 73.40 C ATOM 2216 O GLY B 14 32.831 -0.479 4.145 1.00 13.01 O ATOM 0 H GLY B 14 32.724 0.818 7.283 1.00 21.54 H new ATOM 0 HA2 GLY B 14 34.760 -0.960 6.496 1.00 31.21 H new ATOM 0 HA3 GLY B 14 33.172 -1.369 7.111 1.00 31.21 H new ATOM 2220 N ARG B 15 33.429 -2.574 4.737 1.00 12.42 N ATOM 2221 CA ARG B 15 33.116 -3.168 3.434 1.00 62.32 C ATOM 2222 C ARG B 15 31.730 -2.725 2.964 1.00 53.41 C ATOM 2223 O ARG B 15 31.516 -2.471 1.778 1.00 34.04 O ATOM 2224 CB ARG B 15 33.215 -4.701 3.515 1.00 22.32 C ATOM 2225 CG ARG B 15 33.322 -5.408 2.160 1.00 23.03 C ATOM 2226 CD ARG B 15 31.974 -5.581 1.466 1.00 52.22 C ATOM 2227 NE ARG B 15 32.114 -6.273 0.181 1.00 65.14 N ATOM 2228 CZ ARG B 15 31.658 -7.503 -0.074 1.00 55.23 C ATOM 2229 NH1 ARG B 15 31.040 -8.204 0.871 1.00 21.14 N1+ ATOM 2230 NH2 ARG B 15 31.834 -8.033 -1.277 1.00 51.30 N ATOM 0 H ARG B 15 33.762 -3.242 5.432 1.00 12.42 H new ATOM 0 HA ARG B 15 33.843 -2.819 2.701 1.00 62.32 H new ATOM 0 HB2 ARG B 15 34.085 -4.964 4.116 1.00 22.32 H new ATOM 0 HB3 ARG B 15 32.338 -5.081 4.040 1.00 22.32 H new ATOM 0 HG2 ARG B 15 33.987 -4.838 1.511 1.00 23.03 H new ATOM 0 HG3 ARG B 15 33.778 -6.387 2.303 1.00 23.03 H new ATOM 0 HD2 ARG B 15 31.301 -6.145 2.112 1.00 52.22 H new ATOM 0 HD3 ARG B 15 31.518 -4.604 1.306 1.00 52.22 H new ATOM 0 HE ARG B 15 32.594 -5.780 -0.572 1.00 65.14 H new ATOM 0 HH11 ARG B 15 30.910 -7.804 1.800 1.00 21.14 H new ATOM 0 HH12 ARG B 15 30.695 -9.142 0.667 1.00 21.14 H new ATOM 0 HH21 ARG B 15 32.316 -7.502 -2.003 1.00 51.30 H new ATOM 0 HH22 ARG B 15 31.488 -8.971 -1.476 1.00 51.30 H new ATOM 2244 N ASP B 16 30.790 -2.644 3.900 1.00 43.23 N ATOM 2245 CA ASP B 16 29.483 -2.056 3.618 1.00 64.45 C ATOM 2246 C ASP B 16 29.221 -0.950 4.643 1.00 45.23 C ATOM 2247 O ASP B 16 28.759 0.142 4.299 1.00 44.01 O ATOM 2248 CB ASP B 16 28.397 -3.140 3.671 1.00 65.33 C ATOM 2249 CG ASP B 16 27.114 -2.759 2.936 1.00 54.31 C ATOM 2250 OD1 ASP B 16 26.517 -3.644 2.282 1.00 24.34 O ATOM 2251 OD2 ASP B 16 26.689 -1.587 3.021 1.00 12.23 O1- ATOM 0 H ASP B 16 30.907 -2.976 4.857 1.00 43.23 H new ATOM 0 HA ASP B 16 29.465 -1.625 2.617 1.00 64.45 H new ATOM 0 HB2 ASP B 16 28.793 -4.060 3.240 1.00 65.33 H new ATOM 0 HB3 ASP B 16 28.159 -3.353 4.713 1.00 65.33 H new ATOM 2256 N GLY B 17 29.544 -1.247 5.910 1.00 22.41 N ATOM 2257 CA GLY B 17 29.762 -0.212 6.903 1.00 74.22 C ATOM 2258 C GLY B 17 30.356 -0.794 8.177 1.00 32.04 C ATOM 2259 O GLY B 17 30.301 -2.009 8.388 1.00 11.23 O ATOM 0 H GLY B 17 29.658 -2.198 6.261 1.00 22.41 H new ATOM 0 HA2 GLY B 17 30.431 0.548 6.500 1.00 74.22 H new ATOM 0 HA3 GLY B 17 28.818 0.283 7.131 1.00 74.22 H new ATOM 2263 N ARG B 18 30.945 0.049 9.017 1.00 41.41 N ATOM 2264 CA ARG B 18 31.491 -0.390 10.304 1.00 45.30 C ATOM 2265 C ARG B 18 31.146 0.620 11.395 1.00 1.35 C ATOM 2266 O ARG B 18 31.351 1.816 11.219 1.00 0.54 O ATOM 2267 CB ARG B 18 33.019 -0.572 10.197 1.00 74.40 C ATOM 2268 CG ARG B 18 33.755 -0.646 11.537 1.00 53.04 C ATOM 2269 CD ARG B 18 33.372 -1.869 12.366 1.00 43.11 C ATOM 2270 NE ARG B 18 33.859 -3.124 11.782 1.00 64.22 N ATOM 2271 CZ ARG B 18 34.942 -3.782 12.214 1.00 63.34 C ATOM 2272 NH1 ARG B 18 35.684 -3.282 13.194 1.00 23.22 N1+ ATOM 2273 NH2 ARG B 18 35.278 -4.944 11.669 1.00 54.01 N ATOM 0 H ARG B 18 31.059 1.046 8.832 1.00 41.41 H new ATOM 0 HA ARG B 18 31.045 -1.349 10.569 1.00 45.30 H new ATOM 0 HB2 ARG B 18 33.223 -1.484 9.636 1.00 74.40 H new ATOM 0 HB3 ARG B 18 33.429 0.256 9.619 1.00 74.40 H new ATOM 0 HG2 ARG B 18 34.829 -0.661 11.354 1.00 53.04 H new ATOM 0 HG3 ARG B 18 33.542 0.256 12.111 1.00 53.04 H new ATOM 0 HD2 ARG B 18 33.775 -1.761 13.373 1.00 43.11 H new ATOM 0 HD3 ARG B 18 32.287 -1.914 12.460 1.00 43.11 H new ATOM 0 HE ARG B 18 33.340 -3.520 10.998 1.00 64.22 H new ATOM 0 HH11 ARG B 18 35.430 -2.392 13.622 1.00 23.22 H new ATOM 0 HH12 ARG B 18 36.508 -3.788 13.519 1.00 23.22 H new ATOM 0 HH21 ARG B 18 34.711 -5.338 10.919 1.00 54.01 H new ATOM 0 HH22 ARG B 18 36.104 -5.443 12.000 1.00 54.01 H new ATOM 2287 N ALA B 19 30.610 0.133 12.511 1.00 25.44 N ATOM 2288 CA ALA B 19 30.287 0.980 13.656 1.00 25.14 C ATOM 2289 C ALA B 19 30.912 0.414 14.924 1.00 64.21 C ATOM 2290 O ALA B 19 30.783 -0.774 15.224 1.00 14.23 O ATOM 2291 CB ALA B 19 28.778 1.112 13.831 1.00 63.23 C ATOM 0 H ALA B 19 30.388 -0.853 12.647 1.00 25.44 H new ATOM 0 HA ALA B 19 30.698 1.972 13.469 1.00 25.14 H new ATOM 0 HB1 ALA B 19 28.566 1.748 14.691 1.00 63.23 H new ATOM 0 HB2 ALA B 19 28.345 1.557 12.935 1.00 63.23 H new ATOM 0 HB3 ALA B 19 28.343 0.126 13.993 1.00 63.23 H new ATOM 2297 N THR B 20 31.604 1.262 15.657 1.00 63.15 N ATOM 2298 CA THR B 20 32.201 0.885 16.925 1.00 31.24 C ATOM 2299 C THR B 20 32.020 2.012 17.928 1.00 2.34 C ATOM 2300 O THR B 20 32.633 3.067 17.801 1.00 75.11 O ATOM 2301 CB THR B 20 33.708 0.563 16.762 1.00 15.15 C ATOM 2302 OG1 THR B 20 33.870 -0.505 15.813 1.00 53.32 O ATOM 2303 CG2 THR B 20 34.352 0.173 18.096 1.00 14.05 C ATOM 0 H THR B 20 31.769 2.233 15.392 1.00 63.15 H new ATOM 0 HA THR B 20 31.701 -0.014 17.286 1.00 31.24 H new ATOM 0 HB THR B 20 34.208 1.462 16.402 1.00 15.15 H new ATOM 0 HG1 THR B 20 34.823 -0.708 15.708 1.00 53.32 H new ATOM 0 HG21 THR B 20 35.408 -0.045 17.940 1.00 14.05 H new ATOM 0 HG22 THR B 20 34.252 0.997 18.803 1.00 14.05 H new ATOM 0 HG23 THR B 20 33.854 -0.710 18.496 1.00 14.05 H new ATOM 2311 N SER B 21 31.175 1.786 18.924 1.00 21.31 N ATOM 2312 CA SER B 21 30.959 2.772 19.958 1.00 32.44 C ATOM 2313 C SER B 21 32.261 2.908 20.726 1.00 11.23 C ATOM 2314 O SER B 21 32.638 1.991 21.484 1.00 42.34 O ATOM 2315 CB SER B 21 29.799 2.371 20.874 1.00 31.41 C ATOM 2316 OG SER B 21 29.521 3.378 21.832 1.00 74.21 O ATOM 0 H SER B 21 30.632 0.929 19.033 1.00 21.31 H new ATOM 0 HA SER B 21 30.679 3.731 19.522 1.00 32.44 H new ATOM 0 HB2 SER B 21 28.909 2.183 20.274 1.00 31.41 H new ATOM 0 HB3 SER B 21 30.043 1.439 21.384 1.00 31.41 H new ATOM 0 HG SER B 21 28.988 4.087 21.416 1.00 74.21 H new ATOM 2322 N HIS B 22 32.906 4.065 20.506 1.00 5.04 N ATOM 2323 CA HIS B 22 34.312 4.332 20.833 1.00 32.51 C ATOM 2324 C HIS B 22 34.686 3.920 22.244 1.00 35.24 C ATOM 2325 O HIS B 22 35.771 3.382 22.472 1.00 73.12 O ATOM 2326 CB HIS B 22 34.588 5.835 20.637 1.00 3.43 C ATOM 2327 CG HIS B 22 35.762 6.360 21.407 1.00 12.52 C ATOM 2328 ND1 HIS B 22 35.633 7.008 22.617 1.00 31.42 N ATOM 2329 CD2 HIS B 22 37.088 6.339 21.134 1.00 34.34 C ATOM 2330 CE1 HIS B 22 36.825 7.363 23.052 1.00 23.12 C ATOM 2331 NE2 HIS B 22 37.726 6.968 22.173 1.00 12.42 N ATOM 0 H HIS B 22 32.444 4.868 20.080 1.00 5.04 H new ATOM 0 HA HIS B 22 34.926 3.730 20.163 1.00 32.51 H new ATOM 0 HB2 HIS B 22 34.751 6.026 19.576 1.00 3.43 H new ATOM 0 HB3 HIS B 22 33.699 6.395 20.928 1.00 3.43 H new ATOM 0 HD1 HIS B 22 34.752 7.185 23.100 1.00 31.42 H new ATOM 0 HD2 HIS B 22 37.556 5.908 20.261 1.00 34.34 H new ATOM 0 HE1 HIS B 22 37.030 7.889 23.973 1.00 23.12 H new ATOM 2340 N ASP B 23 33.783 4.131 23.176 1.00 44.12 N ATOM 2341 CA ASP B 23 34.064 3.894 24.590 1.00 0.24 C ATOM 2342 C ASP B 23 33.952 2.405 24.927 1.00 62.21 C ATOM 2343 O ASP B 23 33.681 2.030 26.073 1.00 40.03 O ATOM 2344 CB ASP B 23 33.137 4.755 25.453 1.00 12.04 C ATOM 2345 CG ASP B 23 33.437 6.243 25.287 1.00 5.31 C ATOM 2346 OD1 ASP B 23 34.064 6.836 26.192 1.00 63.54 O ATOM 2347 OD2 ASP B 23 33.091 6.813 24.226 1.00 33.23 O1- ATOM 0 H ASP B 23 32.839 4.469 22.986 1.00 44.12 H new ATOM 0 HA ASP B 23 35.091 4.187 24.807 1.00 0.24 H new ATOM 0 HB2 ASP B 23 32.100 4.560 25.181 1.00 12.04 H new ATOM 0 HB3 ASP B 23 33.250 4.475 26.500 1.00 12.04 H new ATOM 2352 N GLN B 24 34.167 1.567 23.901 1.00 3.35 N ATOM 2353 CA GLN B 24 34.191 0.112 24.035 1.00 64.10 C ATOM 2354 C GLN B 24 32.803 -0.402 24.373 1.00 11.02 C ATOM 2355 O GLN B 24 32.636 -1.459 24.986 1.00 0.33 O ATOM 2356 CB GLN B 24 35.220 -0.331 25.092 1.00 41.34 C ATOM 2357 CG GLN B 24 36.655 0.086 24.775 1.00 71.43 C ATOM 2358 CD GLN B 24 37.100 -0.346 23.385 1.00 54.02 C ATOM 2359 OE1 GLN B 24 37.587 -1.460 23.195 1.00 54.01 O ATOM 2360 NE2 GLN B 24 36.954 0.538 22.409 1.00 4.32 N ATOM 0 H GLN B 24 34.330 1.889 22.947 1.00 3.35 H new ATOM 0 HA GLN B 24 34.497 -0.319 23.082 1.00 64.10 H new ATOM 0 HB2 GLN B 24 34.936 0.087 26.058 1.00 41.34 H new ATOM 0 HB3 GLN B 24 35.181 -1.416 25.190 1.00 41.34 H new ATOM 0 HG2 GLN B 24 36.741 1.169 24.859 1.00 71.43 H new ATOM 0 HG3 GLN B 24 37.327 -0.345 25.517 1.00 71.43 H new ATOM 0 HE21 GLN B 24 36.546 1.452 22.605 1.00 4.32 H new ATOM 0 HE22 GLN B 24 37.250 0.305 21.461 1.00 4.32 H new ATOM 2369 N LYS B 25 31.805 0.358 23.950 1.00 34.11 N ATOM 2370 CA LYS B 25 30.421 0.008 24.191 1.00 33.22 C ATOM 2371 C LYS B 25 29.898 -0.892 23.076 1.00 40.01 C ATOM 2372 O LYS B 25 29.049 -1.751 23.319 1.00 34.42 O ATOM 2373 CB LYS B 25 29.566 1.274 24.295 1.00 20.21 C ATOM 2374 CG LYS B 25 30.021 2.283 25.356 1.00 22.43 C ATOM 2375 CD LYS B 25 29.699 1.837 26.787 1.00 41.25 C ATOM 2376 CE LYS B 25 30.770 0.926 27.380 1.00 25.52 C ATOM 2377 NZ LYS B 25 30.444 0.520 28.772 1.00 5.33 N1+ ATOM 0 H LYS B 25 31.934 1.228 23.434 1.00 34.11 H new ATOM 0 HA LYS B 25 30.359 -0.536 25.134 1.00 33.22 H new ATOM 0 HB2 LYS B 25 29.560 1.770 23.324 1.00 20.21 H new ATOM 0 HB3 LYS B 25 28.538 0.982 24.511 1.00 20.21 H new ATOM 0 HG2 LYS B 25 31.096 2.439 25.263 1.00 22.43 H new ATOM 0 HG3 LYS B 25 29.542 3.243 25.165 1.00 22.43 H new ATOM 0 HD2 LYS B 25 29.587 2.717 27.420 1.00 41.25 H new ATOM 0 HD3 LYS B 25 28.742 1.316 26.793 1.00 41.25 H new ATOM 0 HE2 LYS B 25 30.876 0.037 26.758 1.00 25.52 H new ATOM 0 HE3 LYS B 25 31.731 1.440 27.367 1.00 25.52 H new ATOM 0 HZ1 LYS B 25 31.196 -0.098 29.139 1.00 5.33 H new ATOM 0 HZ2 LYS B 25 30.368 1.366 29.372 1.00 5.33 H new ATOM 0 HZ3 LYS B 25 29.539 0.007 28.781 1.00 5.33 H new ATOM 2391 N LEU B 26 30.402 -0.704 21.848 1.00 71.52 N ATOM 2392 CA LEU B 26 29.934 -1.515 20.717 1.00 40.15 C ATOM 2393 C LEU B 26 31.002 -1.641 19.658 1.00 62.33 C ATOM 2394 O LEU B 26 31.812 -0.743 19.490 1.00 50.50 O ATOM 2395 CB LEU B 26 28.661 -0.886 20.129 1.00 64.14 C ATOM 2396 CG LEU B 26 28.164 -1.471 18.799 1.00 70.42 C ATOM 2397 CD1 LEU B 26 27.686 -2.909 18.973 1.00 23.12 C ATOM 2398 CD2 LEU B 26 27.064 -0.589 18.222 1.00 31.22 C ATOM 0 H LEU B 26 31.117 -0.014 21.616 1.00 71.52 H new ATOM 0 HA LEU B 26 29.708 -2.519 21.076 1.00 40.15 H new ATOM 0 HB2 LEU B 26 27.862 -0.981 20.864 1.00 64.14 H new ATOM 0 HB3 LEU B 26 28.840 0.180 19.988 1.00 64.14 H new ATOM 0 HG LEU B 26 28.996 -1.491 18.096 1.00 70.42 H new ATOM 0 HD11 LEU B 26 27.340 -3.296 18.014 1.00 23.12 H new ATOM 0 HD12 LEU B 26 28.509 -3.524 19.337 1.00 23.12 H new ATOM 0 HD13 LEU B 26 26.867 -2.936 19.692 1.00 23.12 H new ATOM 0 HD21 LEU B 26 26.717 -1.011 17.279 1.00 31.22 H new ATOM 0 HD22 LEU B 26 26.232 -0.538 18.925 1.00 31.22 H new ATOM 0 HD23 LEU B 26 27.455 0.414 18.049 1.00 31.22 H new ATOM 2410 N ASP B 27 30.993 -2.763 18.948 1.00 22.45 N ATOM 2411 CA ASP B 27 31.990 -3.024 17.931 1.00 53.33 C ATOM 2412 C ASP B 27 31.481 -4.051 16.910 1.00 42.15 C ATOM 2413 O ASP B 27 31.632 -5.261 17.087 1.00 22.10 O ATOM 2414 CB ASP B 27 33.290 -3.499 18.599 1.00 24.13 C ATOM 2415 CG ASP B 27 33.163 -4.841 19.310 1.00 15.20 C ATOM 2416 OD1 ASP B 27 32.436 -4.921 20.324 1.00 3.40 O ATOM 2417 OD2 ASP B 27 33.807 -5.820 18.872 1.00 21.30 O1- ATOM 0 H ASP B 27 30.302 -3.505 19.062 1.00 22.45 H new ATOM 0 HA ASP B 27 32.191 -2.102 17.386 1.00 53.33 H new ATOM 0 HB2 ASP B 27 34.071 -3.572 17.842 1.00 24.13 H new ATOM 0 HB3 ASP B 27 33.613 -2.747 19.318 1.00 24.13 H new ATOM 2422 N VAL B 28 30.850 -3.562 15.842 1.00 42.42 N ATOM 2423 CA VAL B 28 30.348 -4.431 14.773 1.00 61.03 C ATOM 2424 C VAL B 28 30.429 -3.767 13.410 1.00 62.05 C ATOM 2425 O VAL B 28 30.479 -2.544 13.288 1.00 71.42 O ATOM 2426 CB VAL B 28 28.874 -4.849 14.993 1.00 35.33 C ATOM 2427 CG1 VAL B 28 28.766 -5.956 16.030 1.00 44.41 C ATOM 2428 CG2 VAL B 28 28.033 -3.632 15.378 1.00 74.12 C ATOM 0 H VAL B 28 30.673 -2.569 15.693 1.00 42.42 H new ATOM 0 HA VAL B 28 30.992 -5.310 14.804 1.00 61.03 H new ATOM 0 HB VAL B 28 28.483 -5.249 14.057 1.00 35.33 H new ATOM 0 HG11 VAL B 28 27.719 -6.229 16.163 1.00 44.41 H new ATOM 0 HG12 VAL B 28 29.328 -6.827 15.692 1.00 44.41 H new ATOM 0 HG13 VAL B 28 29.174 -5.607 16.979 1.00 44.41 H new ATOM 0 HG21 VAL B 28 26.998 -3.938 15.530 1.00 74.12 H new ATOM 0 HG22 VAL B 28 28.422 -3.198 16.299 1.00 74.12 H new ATOM 0 HG23 VAL B 28 28.078 -2.891 14.580 1.00 74.12 H new ATOM 2438 N LYS B 29 30.436 -4.603 12.391 1.00 64.31 N ATOM 2439 CA LYS B 29 30.281 -4.176 11.018 1.00 24.45 C ATOM 2440 C LYS B 29 28.818 -4.312 10.622 1.00 31.35 C ATOM 2441 O LYS B 29 28.162 -5.295 10.975 1.00 25.23 O ATOM 2442 CB LYS B 29 31.162 -5.033 10.094 1.00 11.40 C ATOM 2443 CG LYS B 29 30.554 -5.291 8.711 1.00 53.23 C ATOM 2444 CD LYS B 29 31.542 -5.952 7.749 1.00 3.25 C ATOM 2445 CE LYS B 29 30.833 -6.628 6.575 1.00 32.51 C ATOM 2446 NZ LYS B 29 29.783 -5.764 5.965 1.00 50.55 N1+ ATOM 0 H LYS B 29 30.551 -5.611 12.497 1.00 64.31 H new ATOM 0 HA LYS B 29 30.592 -3.136 10.921 1.00 24.45 H new ATOM 0 HB2 LYS B 29 32.126 -4.540 9.969 1.00 11.40 H new ATOM 0 HB3 LYS B 29 31.354 -5.990 10.579 1.00 11.40 H new ATOM 0 HG2 LYS B 29 29.675 -5.927 8.817 1.00 53.23 H new ATOM 0 HG3 LYS B 29 30.214 -4.347 8.285 1.00 53.23 H new ATOM 0 HD2 LYS B 29 32.236 -5.202 7.370 1.00 3.25 H new ATOM 0 HD3 LYS B 29 32.135 -6.691 8.289 1.00 3.25 H new ATOM 0 HE2 LYS B 29 31.568 -6.892 5.815 1.00 32.51 H new ATOM 0 HE3 LYS B 29 30.379 -7.559 6.916 1.00 32.51 H new ATOM 0 HZ1 LYS B 29 29.775 -5.902 4.934 1.00 50.55 H new ATOM 0 HZ2 LYS B 29 28.854 -6.019 6.356 1.00 50.55 H new ATOM 0 HZ3 LYS B 29 29.987 -4.767 6.179 1.00 50.55 H new ATOM 2460 N LEU B 30 28.309 -3.337 9.893 1.00 60.42 N ATOM 2461 CA LEU B 30 26.951 -3.389 9.400 1.00 43.12 C ATOM 2462 C LEU B 30 26.942 -3.274 7.879 1.00 50.11 C ATOM 2463 O LEU B 30 27.995 -3.027 7.245 1.00 72.32 O ATOM 2464 CB LEU B 30 26.044 -2.333 10.079 1.00 4.40 C ATOM 2465 CG LEU B 30 26.590 -0.900 10.252 1.00 61.23 C ATOM 2466 CD1 LEU B 30 27.684 -0.836 11.313 1.00 42.23 C ATOM 2467 CD2 LEU B 30 27.067 -0.324 8.925 1.00 52.40 C ATOM 0 H LEU B 30 28.821 -2.495 9.629 1.00 60.42 H new ATOM 0 HA LEU B 30 26.526 -4.357 9.666 1.00 43.12 H new ATOM 0 HB2 LEU B 30 25.120 -2.269 9.504 1.00 4.40 H new ATOM 0 HB3 LEU B 30 25.779 -2.709 11.067 1.00 4.40 H new ATOM 0 HG LEU B 30 25.765 -0.280 10.603 1.00 61.23 H new ATOM 0 HD11 LEU B 30 28.042 0.189 11.405 1.00 42.23 H new ATOM 0 HD12 LEU B 30 27.282 -1.167 12.271 1.00 42.23 H new ATOM 0 HD13 LEU B 30 28.511 -1.485 11.023 1.00 42.23 H new ATOM 0 HD21 LEU B 30 27.445 0.686 9.082 1.00 52.40 H new ATOM 0 HD22 LEU B 30 27.862 -0.951 8.521 1.00 52.40 H new ATOM 0 HD23 LEU B 30 26.235 -0.295 8.221 1.00 52.40 H new ATOM 2479 N SER B 31 25.769 -3.470 7.297 1.00 24.22 N ATOM 2480 CA SER B 31 25.646 -3.576 5.860 1.00 21.40 C ATOM 2481 C SER B 31 24.253 -3.165 5.389 1.00 43.34 C ATOM 2482 O SER B 31 23.247 -3.565 5.979 1.00 1.33 O ATOM 2483 CB SER B 31 25.945 -5.019 5.431 1.00 62.35 C ATOM 2484 OG SER B 31 27.155 -5.486 6.018 1.00 3.34 O ATOM 0 H SER B 31 24.888 -3.559 7.804 1.00 24.22 H new ATOM 0 HA SER B 31 26.364 -2.897 5.399 1.00 21.40 H new ATOM 0 HB2 SER B 31 25.120 -5.668 5.725 1.00 62.35 H new ATOM 0 HB3 SER B 31 26.020 -5.071 4.345 1.00 62.35 H new ATOM 0 HG SER B 31 26.950 -6.166 6.693 1.00 3.34 H new ATOM 2490 N ALA B 32 24.210 -2.372 4.320 1.00 40.52 N ATOM 2491 CA ALA B 32 22.954 -1.974 3.687 1.00 75.13 C ATOM 2492 C ALA B 32 22.187 -3.226 3.255 1.00 31.44 C ATOM 2493 O ALA B 32 22.799 -4.267 3.057 1.00 42.31 O ATOM 2494 CB ALA B 32 23.242 -1.068 2.492 1.00 44.15 C ATOM 0 H ALA B 32 25.041 -1.989 3.870 1.00 40.52 H new ATOM 0 HA ALA B 32 22.341 -1.417 4.395 1.00 75.13 H new ATOM 0 HB1 ALA B 32 22.303 -0.774 2.024 1.00 44.15 H new ATOM 0 HB2 ALA B 32 23.773 -0.178 2.830 1.00 44.15 H new ATOM 0 HB3 ALA B 32 23.856 -1.604 1.768 1.00 44.15 H new ATOM 2500 N PRO B 33 20.851 -3.149 3.077 1.00 64.54 N ATOM 2501 CA PRO B 33 19.992 -4.340 2.868 1.00 71.30 C ATOM 2502 C PRO B 33 20.347 -5.226 1.656 1.00 44.54 C ATOM 2503 O PRO B 33 19.631 -6.188 1.395 1.00 60.20 O ATOM 2504 CB PRO B 33 18.589 -3.736 2.676 1.00 5.21 C ATOM 2505 CG PRO B 33 18.652 -2.405 3.334 1.00 53.32 C ATOM 2506 CD PRO B 33 20.050 -1.904 3.095 1.00 34.02 C ATOM 0 HA PRO B 33 20.104 -5.021 3.712 1.00 71.30 H new ATOM 0 HB2 PRO B 33 18.340 -3.643 1.619 1.00 5.21 H new ATOM 0 HB3 PRO B 33 17.823 -4.365 3.129 1.00 5.21 H new ATOM 0 HG2 PRO B 33 17.913 -1.723 2.912 1.00 53.32 H new ATOM 0 HG3 PRO B 33 18.440 -2.484 4.400 1.00 53.32 H new ATOM 0 HD2 PRO B 33 20.128 -1.360 2.154 1.00 34.02 H new ATOM 0 HD3 PRO B 33 20.376 -1.226 3.883 1.00 34.02 H new ATOM 2514 N ARG B 34 21.447 -4.930 0.942 1.00 0.10 N ATOM 2515 CA ARG B 34 21.822 -5.662 -0.283 1.00 23.43 C ATOM 2516 C ARG B 34 20.758 -5.554 -1.374 1.00 64.55 C ATOM 2517 O ARG B 34 20.987 -4.899 -2.390 1.00 62.12 O ATOM 2518 CB ARG B 34 22.144 -7.135 0.007 1.00 33.02 C ATOM 2519 CG ARG B 34 23.489 -7.320 0.692 1.00 11.34 C ATOM 2520 CD ARG B 34 23.456 -6.874 2.146 1.00 70.25 C ATOM 2521 NE ARG B 34 22.776 -7.842 3.015 1.00 41.11 N ATOM 2522 CZ ARG B 34 22.197 -7.537 4.185 1.00 71.43 C ATOM 2523 NH1 ARG B 34 22.217 -6.289 4.647 1.00 70.13 N1+ ATOM 2524 NH2 ARG B 34 21.596 -8.486 4.892 1.00 21.32 N ATOM 0 H ARG B 34 22.096 -4.184 1.193 1.00 0.10 H new ATOM 0 HA ARG B 34 22.727 -5.182 -0.656 1.00 23.43 H new ATOM 0 HB2 ARG B 34 21.360 -7.557 0.636 1.00 33.02 H new ATOM 0 HB3 ARG B 34 22.138 -7.695 -0.928 1.00 33.02 H new ATOM 0 HG2 ARG B 34 23.780 -8.369 0.641 1.00 11.34 H new ATOM 0 HG3 ARG B 34 24.250 -6.752 0.156 1.00 11.34 H new ATOM 0 HD2 ARG B 34 24.476 -6.726 2.501 1.00 70.25 H new ATOM 0 HD3 ARG B 34 22.951 -5.910 2.216 1.00 70.25 H new ATOM 0 HE ARG B 34 22.742 -8.814 2.707 1.00 41.11 H new ATOM 0 HH11 ARG B 34 22.676 -5.554 4.110 1.00 70.13 H new ATOM 0 HH12 ARG B 34 21.773 -6.068 5.538 1.00 70.13 H new ATOM 0 HH21 ARG B 34 21.575 -9.445 4.545 1.00 21.32 H new ATOM 0 HH22 ARG B 34 21.155 -8.256 5.783 1.00 21.32 H new ATOM 2538 N GLU B 35 19.611 -6.192 -1.141 1.00 42.24 N ATOM 2539 CA GLU B 35 18.467 -6.188 -2.062 1.00 63.02 C ATOM 2540 C GLU B 35 18.285 -4.842 -2.765 1.00 12.03 C ATOM 2541 O GLU B 35 17.939 -4.783 -3.945 1.00 54.43 O ATOM 2542 CB GLU B 35 17.188 -6.526 -1.279 1.00 72.41 C ATOM 2543 CG GLU B 35 17.215 -7.895 -0.607 1.00 31.33 C ATOM 2544 CD GLU B 35 17.388 -9.038 -1.596 1.00 34.33 C ATOM 2545 OE1 GLU B 35 16.371 -9.587 -2.064 1.00 72.42 O ATOM 2546 OE2 GLU B 35 18.546 -9.393 -1.913 1.00 24.25 O1- ATOM 0 H GLU B 35 19.445 -6.736 -0.294 1.00 42.24 H new ATOM 0 HA GLU B 35 18.663 -6.935 -2.831 1.00 63.02 H new ATOM 0 HB2 GLU B 35 17.028 -5.762 -0.518 1.00 72.41 H new ATOM 0 HB3 GLU B 35 16.337 -6.483 -1.958 1.00 72.41 H new ATOM 0 HG2 GLU B 35 18.029 -7.922 0.118 1.00 31.33 H new ATOM 0 HG3 GLU B 35 16.288 -8.039 -0.051 1.00 31.33 H new ATOM 2553 N LEU B 36 18.528 -3.765 -2.029 1.00 53.04 N ATOM 2554 CA LEU B 36 18.257 -2.413 -2.515 1.00 1.52 C ATOM 2555 C LEU B 36 19.538 -1.730 -2.983 1.00 52.10 C ATOM 2556 O LEU B 36 19.506 -0.867 -3.863 1.00 30.14 O ATOM 2557 CB LEU B 36 17.580 -1.592 -1.408 1.00 63.52 C ATOM 2558 CG LEU B 36 16.068 -1.840 -1.205 1.00 20.23 C ATOM 2559 CD1 LEU B 36 15.700 -3.316 -1.346 1.00 52.43 C ATOM 2560 CD2 LEU B 36 15.635 -1.335 0.162 1.00 15.21 C ATOM 0 H LEU B 36 18.915 -3.800 -1.086 1.00 53.04 H new ATOM 0 HA LEU B 36 17.586 -2.479 -3.372 1.00 1.52 H new ATOM 0 HB2 LEU B 36 18.091 -1.798 -0.467 1.00 63.52 H new ATOM 0 HB3 LEU B 36 17.728 -0.534 -1.626 1.00 63.52 H new ATOM 0 HG LEU B 36 15.544 -1.291 -1.988 1.00 20.23 H new ATOM 0 HD11 LEU B 36 14.628 -3.440 -1.195 1.00 52.43 H new ATOM 0 HD12 LEU B 36 15.969 -3.664 -2.343 1.00 52.43 H new ATOM 0 HD13 LEU B 36 16.241 -3.899 -0.600 1.00 52.43 H new ATOM 0 HD21 LEU B 36 14.568 -1.514 0.295 1.00 15.21 H new ATOM 0 HD22 LEU B 36 16.191 -1.862 0.937 1.00 15.21 H new ATOM 0 HD23 LEU B 36 15.835 -0.266 0.235 1.00 15.21 H new ATOM 2572 N GLY B 37 20.666 -2.125 -2.400 1.00 22.45 N ATOM 2573 CA GLY B 37 21.937 -1.534 -2.772 1.00 25.41 C ATOM 2574 C GLY B 37 22.973 -1.608 -1.668 1.00 51.22 C ATOM 2575 O GLY B 37 23.498 -0.581 -1.236 1.00 30.40 O ATOM 0 H GLY B 37 20.722 -2.843 -1.678 1.00 22.45 H new ATOM 0 HA2 GLY B 37 22.321 -2.041 -3.657 1.00 25.41 H new ATOM 0 HA3 GLY B 37 21.780 -0.491 -3.045 1.00 25.41 H new ATOM 2579 N GLY B 38 23.259 -2.817 -1.187 1.00 53.33 N ATOM 2580 CA GLY B 38 24.360 -3.005 -0.282 1.00 54.12 C ATOM 2581 C GLY B 38 25.515 -3.651 -1.002 1.00 61.21 C ATOM 2582 O GLY B 38 25.770 -3.354 -2.172 1.00 64.12 O ATOM 0 H GLY B 38 22.741 -3.666 -1.414 1.00 53.33 H new ATOM 0 HA2 GLY B 38 24.670 -2.045 0.131 1.00 54.12 H new ATOM 0 HA3 GLY B 38 24.050 -3.628 0.557 1.00 54.12 H new ATOM 2586 N ALA B 39 26.178 -4.561 -0.330 1.00 3.10 N ATOM 2587 CA ALA B 39 27.346 -5.233 -0.895 1.00 71.25 C ATOM 2588 C ALA B 39 27.306 -6.738 -0.665 1.00 4.43 C ATOM 2589 O ALA B 39 27.910 -7.499 -1.424 1.00 31.41 O ATOM 2590 CB ALA B 39 28.629 -4.635 -0.323 1.00 12.41 C ATOM 0 H ALA B 39 25.935 -4.861 0.614 1.00 3.10 H new ATOM 0 HA ALA B 39 27.329 -5.072 -1.973 1.00 71.25 H new ATOM 0 HB1 ALA B 39 29.491 -5.145 -0.753 1.00 12.41 H new ATOM 0 HB2 ALA B 39 28.676 -3.574 -0.567 1.00 12.41 H new ATOM 0 HB3 ALA B 39 28.637 -4.759 0.760 1.00 12.41 H new ATOM 2596 N GLY B 40 26.580 -7.174 0.357 1.00 23.34 N ATOM 2597 CA GLY B 40 26.549 -8.597 0.678 1.00 31.44 C ATOM 2598 C GLY B 40 27.208 -8.891 2.004 1.00 1.42 C ATOM 2599 O GLY B 40 28.438 -8.935 2.098 1.00 53.13 O ATOM 0 H GLY B 40 26.017 -6.580 0.966 1.00 23.34 H new ATOM 0 HA2 GLY B 40 25.515 -8.941 0.703 1.00 31.44 H new ATOM 0 HA3 GLY B 40 27.053 -9.158 -0.110 1.00 31.44 H new ATOM 2603 N ALA B 41 26.392 -9.084 3.033 1.00 13.10 N ATOM 2604 CA ALA B 41 26.889 -9.354 4.369 1.00 45.11 C ATOM 2605 C ALA B 41 25.747 -9.697 5.317 1.00 24.05 C ATOM 2606 O ALA B 41 24.574 -9.554 4.970 1.00 14.44 O ATOM 2607 CB ALA B 41 27.663 -8.153 4.886 1.00 11.53 C ATOM 0 H ALA B 41 25.375 -9.057 2.962 1.00 13.10 H new ATOM 0 HA ALA B 41 27.556 -10.214 4.321 1.00 45.11 H new ATOM 0 HB1 ALA B 41 28.033 -8.363 5.890 1.00 11.53 H new ATOM 0 HB2 ALA B 41 28.505 -7.950 4.224 1.00 11.53 H new ATOM 0 HB3 ALA B 41 27.007 -7.283 4.916 1.00 11.53 H new ATOM 2613 N GLU B 42 26.103 -10.137 6.518 1.00 15.20 N ATOM 2614 CA GLU B 42 25.125 -10.533 7.530 1.00 53.20 C ATOM 2615 C GLU B 42 25.002 -9.447 8.595 1.00 74.14 C ATOM 2616 O GLU B 42 24.546 -9.696 9.715 1.00 53.42 O ATOM 2617 CB GLU B 42 25.561 -11.854 8.166 1.00 21.14 C ATOM 2618 CG GLU B 42 26.086 -12.858 7.151 1.00 73.23 C ATOM 2619 CD GLU B 42 26.330 -14.231 7.752 1.00 72.34 C ATOM 2620 OE1 GLU B 42 25.601 -15.184 7.405 1.00 61.42 O ATOM 2621 OE2 GLU B 42 27.251 -14.362 8.584 1.00 61.14 O1- ATOM 0 H GLU B 42 27.073 -10.230 6.819 1.00 15.20 H new ATOM 0 HA GLU B 42 24.151 -10.666 7.060 1.00 53.20 H new ATOM 0 HB2 GLU B 42 26.336 -11.656 8.907 1.00 21.14 H new ATOM 0 HB3 GLU B 42 24.716 -12.291 8.698 1.00 21.14 H new ATOM 0 HG2 GLU B 42 25.372 -12.947 6.332 1.00 73.23 H new ATOM 0 HG3 GLU B 42 27.016 -12.483 6.724 1.00 73.23 H new ATOM 2628 N GLY B 43 25.427 -8.245 8.228 1.00 33.24 N ATOM 2629 CA GLY B 43 25.390 -7.115 9.138 1.00 35.43 C ATOM 2630 C GLY B 43 24.000 -6.518 9.275 1.00 2.13 C ATOM 2631 O GLY B 43 23.014 -7.099 8.814 1.00 72.12 O ATOM 0 H GLY B 43 25.802 -8.030 7.304 1.00 33.24 H new ATOM 0 HA2 GLY B 43 25.743 -7.432 10.119 1.00 35.43 H new ATOM 0 HA3 GLY B 43 26.078 -6.347 8.785 1.00 35.43 H new ATOM 2635 N THR B 44 23.923 -5.344 9.890 1.00 33.20 N ATOM 2636 CA THR B 44 22.649 -4.686 10.141 1.00 33.40 C ATOM 2637 C THR B 44 22.453 -3.532 9.166 1.00 35.03 C ATOM 2638 O THR B 44 23.402 -2.822 8.845 1.00 4.14 O ATOM 2639 CB THR B 44 22.579 -4.165 11.598 1.00 13.15 C ATOM 2640 OG1 THR B 44 23.800 -3.489 11.935 1.00 1.03 O ATOM 2641 CG2 THR B 44 22.341 -5.308 12.582 1.00 34.45 C ATOM 0 H THR B 44 24.735 -4.826 10.226 1.00 33.20 H new ATOM 0 HA THR B 44 21.852 -5.415 9.995 1.00 33.40 H new ATOM 0 HB THR B 44 21.742 -3.470 11.668 1.00 13.15 H new ATOM 0 HG1 THR B 44 23.748 -3.161 12.857 1.00 1.03 H new ATOM 0 HG21 THR B 44 22.297 -4.912 13.596 1.00 34.45 H new ATOM 0 HG22 THR B 44 21.399 -5.803 12.344 1.00 34.45 H new ATOM 0 HG23 THR B 44 23.157 -6.027 12.509 1.00 34.45 H new ATOM 2649 N ASN B 45 21.233 -3.361 8.681 1.00 4.01 N ATOM 2650 CA ASN B 45 20.931 -2.269 7.761 1.00 51.43 C ATOM 2651 C ASN B 45 20.447 -1.043 8.547 1.00 21.43 C ATOM 2652 O ASN B 45 19.923 -1.182 9.657 1.00 31.35 O ATOM 2653 CB ASN B 45 19.913 -2.706 6.678 1.00 71.14 C ATOM 2654 CG ASN B 45 19.362 -4.112 6.882 1.00 11.33 C ATOM 2655 OD1 ASN B 45 19.981 -5.103 6.479 1.00 33.20 O ATOM 2656 ND2 ASN B 45 18.182 -4.208 7.473 1.00 55.34 N ATOM 0 H ASN B 45 20.438 -3.959 8.906 1.00 4.01 H new ATOM 0 HA ASN B 45 21.843 -1.993 7.232 1.00 51.43 H new ATOM 0 HB2 ASN B 45 19.083 -1.999 6.666 1.00 71.14 H new ATOM 0 HB3 ASN B 45 20.392 -2.652 5.700 1.00 71.14 H new ATOM 0 HD21 ASN B 45 17.753 -5.123 7.609 1.00 55.34 H new ATOM 0 HD22 ASN B 45 17.702 -3.367 7.792 1.00 55.34 H new ATOM 2663 N PRO B 46 20.653 0.171 7.989 1.00 54.41 N ATOM 2664 CA PRO B 46 20.384 1.448 8.680 1.00 2.04 C ATOM 2665 C PRO B 46 19.037 1.497 9.411 1.00 14.41 C ATOM 2666 O PRO B 46 18.986 1.670 10.637 1.00 12.32 O ATOM 2667 CB PRO B 46 20.406 2.465 7.533 1.00 21.50 C ATOM 2668 CG PRO B 46 21.363 1.890 6.549 1.00 13.22 C ATOM 2669 CD PRO B 46 21.177 0.397 6.623 1.00 31.44 C ATOM 0 HA PRO B 46 21.113 1.629 9.470 1.00 2.04 H new ATOM 0 HB2 PRO B 46 19.416 2.593 7.096 1.00 21.50 H new ATOM 0 HB3 PRO B 46 20.732 3.446 7.878 1.00 21.50 H new ATOM 0 HG2 PRO B 46 21.161 2.260 5.544 1.00 13.22 H new ATOM 0 HG3 PRO B 46 22.388 2.169 6.791 1.00 13.22 H new ATOM 0 HD2 PRO B 46 20.479 0.043 5.864 1.00 31.44 H new ATOM 0 HD3 PRO B 46 22.117 -0.131 6.463 1.00 31.44 H new ATOM 2677 N GLU B 47 17.956 1.341 8.657 1.00 51.12 N ATOM 2678 CA GLU B 47 16.608 1.483 9.199 1.00 42.23 C ATOM 2679 C GLU B 47 16.333 0.409 10.249 1.00 51.31 C ATOM 2680 O GLU B 47 15.604 0.639 11.215 1.00 51.34 O ATOM 2681 CB GLU B 47 15.567 1.437 8.063 1.00 43.35 C ATOM 2682 CG GLU B 47 15.403 0.079 7.371 1.00 13.13 C ATOM 2683 CD GLU B 47 16.718 -0.518 6.895 1.00 41.12 C ATOM 2684 OE1 GLU B 47 17.380 0.092 6.030 1.00 53.12 O ATOM 2685 OE2 GLU B 47 17.104 -1.587 7.411 1.00 73.03 O1- ATOM 0 H GLU B 47 17.986 1.115 7.663 1.00 51.12 H new ATOM 0 HA GLU B 47 16.529 2.453 9.690 1.00 42.23 H new ATOM 0 HB2 GLU B 47 14.601 1.738 8.467 1.00 43.35 H new ATOM 0 HB3 GLU B 47 15.842 2.177 7.312 1.00 43.35 H new ATOM 0 HG2 GLU B 47 14.925 -0.617 8.061 1.00 13.13 H new ATOM 0 HG3 GLU B 47 14.734 0.192 6.518 1.00 13.13 H new ATOM 2692 N GLN B 48 16.950 -0.749 10.060 1.00 65.22 N ATOM 2693 CA GLN B 48 16.818 -1.877 10.975 1.00 23.21 C ATOM 2694 C GLN B 48 17.429 -1.539 12.330 1.00 44.13 C ATOM 2695 O GLN B 48 16.828 -1.782 13.381 1.00 15.51 O ATOM 2696 CB GLN B 48 17.526 -3.090 10.369 1.00 21.32 C ATOM 2697 CG GLN B 48 17.378 -4.380 11.160 1.00 64.34 C ATOM 2698 CD GLN B 48 18.108 -5.531 10.492 1.00 23.41 C ATOM 2699 OE1 GLN B 48 17.560 -6.208 9.624 1.00 3.40 O ATOM 2700 NE2 GLN B 48 19.351 -5.762 10.889 1.00 12.54 N ATOM 0 H GLN B 48 17.560 -0.935 9.264 1.00 65.22 H new ATOM 0 HA GLN B 48 15.762 -2.101 11.124 1.00 23.21 H new ATOM 0 HB2 GLN B 48 17.140 -3.252 9.363 1.00 21.32 H new ATOM 0 HB3 GLN B 48 18.587 -2.861 10.271 1.00 21.32 H new ATOM 0 HG2 GLN B 48 17.768 -4.237 12.168 1.00 64.34 H new ATOM 0 HG3 GLN B 48 16.321 -4.627 11.260 1.00 64.34 H new ATOM 0 HE21 GLN B 48 19.772 -5.179 11.612 1.00 12.54 H new ATOM 0 HE22 GLN B 48 19.887 -6.523 10.471 1.00 12.54 H new ATOM 2709 N LEU B 49 18.631 -0.972 12.292 1.00 25.52 N ATOM 2710 CA LEU B 49 19.359 -0.621 13.505 1.00 12.42 C ATOM 2711 C LEU B 49 18.612 0.488 14.246 1.00 73.15 C ATOM 2712 O LEU B 49 18.430 0.425 15.463 1.00 22.33 O ATOM 2713 CB LEU B 49 20.799 -0.189 13.146 1.00 25.41 C ATOM 2714 CG LEU B 49 21.842 -0.259 14.283 1.00 55.21 C ATOM 2715 CD1 LEU B 49 21.597 0.815 15.339 1.00 20.42 C ATOM 2716 CD2 LEU B 49 21.852 -1.648 14.922 1.00 31.54 C ATOM 0 H LEU B 49 19.123 -0.745 11.428 1.00 25.52 H new ATOM 0 HA LEU B 49 19.423 -1.488 14.163 1.00 12.42 H new ATOM 0 HB2 LEU B 49 21.148 -0.814 12.324 1.00 25.41 H new ATOM 0 HB3 LEU B 49 20.766 0.836 12.776 1.00 25.41 H new ATOM 0 HG LEU B 49 22.821 -0.071 13.842 1.00 55.21 H new ATOM 0 HD11 LEU B 49 22.351 0.734 16.122 1.00 20.42 H new ATOM 0 HD12 LEU B 49 21.659 1.800 14.877 1.00 20.42 H new ATOM 0 HD13 LEU B 49 20.606 0.679 15.773 1.00 20.42 H new ATOM 0 HD21 LEU B 49 22.594 -1.676 15.720 1.00 31.54 H new ATOM 0 HD22 LEU B 49 20.867 -1.866 15.334 1.00 31.54 H new ATOM 0 HD23 LEU B 49 22.103 -2.394 14.168 1.00 31.54 H new ATOM 2728 N PHE B 50 18.163 1.489 13.494 1.00 74.53 N ATOM 2729 CA PHE B 50 17.415 2.608 14.064 1.00 13.24 C ATOM 2730 C PHE B 50 16.087 2.141 14.658 1.00 54.12 C ATOM 2731 O PHE B 50 15.702 2.587 15.730 1.00 20.22 O ATOM 2732 CB PHE B 50 17.189 3.684 12.995 1.00 14.34 C ATOM 2733 CG PHE B 50 16.131 4.714 13.335 1.00 61.31 C ATOM 2734 CD1 PHE B 50 16.305 5.634 14.368 1.00 53.13 C ATOM 2735 CD2 PHE B 50 14.963 4.772 12.594 1.00 53.22 C ATOM 2736 CE1 PHE B 50 15.337 6.577 14.647 1.00 14.14 C ATOM 2737 CE2 PHE B 50 13.997 5.710 12.871 1.00 22.12 C ATOM 2738 CZ PHE B 50 14.180 6.615 13.898 1.00 62.30 C ATOM 0 H PHE B 50 18.304 1.549 12.486 1.00 74.53 H new ATOM 0 HA PHE B 50 18.002 3.038 14.876 1.00 13.24 H new ATOM 0 HB2 PHE B 50 18.132 4.200 12.816 1.00 14.34 H new ATOM 0 HB3 PHE B 50 16.911 3.194 12.062 1.00 14.34 H new ATOM 0 HD1 PHE B 50 17.209 5.608 14.958 1.00 53.13 H new ATOM 0 HD2 PHE B 50 14.809 4.071 11.787 1.00 53.22 H new ATOM 0 HE1 PHE B 50 15.485 7.284 15.450 1.00 14.14 H new ATOM 0 HE2 PHE B 50 13.091 5.739 12.283 1.00 22.12 H new ATOM 0 HZ PHE B 50 13.419 7.350 14.114 1.00 62.30 H new ATOM 2748 N ALA B 51 15.391 1.251 13.955 1.00 24.13 N ATOM 2749 CA ALA B 51 14.125 0.698 14.443 1.00 31.22 C ATOM 2750 C ALA B 51 14.325 -0.034 15.770 1.00 63.22 C ATOM 2751 O ALA B 51 13.614 0.220 16.746 1.00 61.14 O ATOM 2752 CB ALA B 51 13.518 -0.239 13.405 1.00 4.33 C ATOM 0 H ALA B 51 15.681 0.895 13.044 1.00 24.13 H new ATOM 0 HA ALA B 51 13.436 1.525 14.612 1.00 31.22 H new ATOM 0 HB1 ALA B 51 12.578 -0.641 13.783 1.00 4.33 H new ATOM 0 HB2 ALA B 51 13.332 0.311 12.483 1.00 4.33 H new ATOM 0 HB3 ALA B 51 14.209 -1.058 13.206 1.00 4.33 H new ATOM 2758 N ALA B 52 15.300 -0.942 15.795 1.00 2.41 N ATOM 2759 CA ALA B 52 15.622 -1.699 17.004 1.00 55.02 C ATOM 2760 C ALA B 52 15.990 -0.761 18.153 1.00 53.11 C ATOM 2761 O ALA B 52 15.447 -0.864 19.257 1.00 74.31 O ATOM 2762 CB ALA B 52 16.759 -2.679 16.728 1.00 43.35 C ATOM 0 H ALA B 52 15.882 -1.172 14.989 1.00 2.41 H new ATOM 0 HA ALA B 52 14.738 -2.264 17.299 1.00 55.02 H new ATOM 0 HB1 ALA B 52 16.988 -3.236 17.637 1.00 43.35 H new ATOM 0 HB2 ALA B 52 16.459 -3.373 15.943 1.00 43.35 H new ATOM 0 HB3 ALA B 52 17.643 -2.129 16.407 1.00 43.35 H new ATOM 2768 N GLY B 53 16.906 0.159 17.875 1.00 41.34 N ATOM 2769 CA GLY B 53 17.338 1.111 18.876 1.00 4.13 C ATOM 2770 C GLY B 53 16.202 1.985 19.366 1.00 15.42 C ATOM 2771 O GLY B 53 16.037 2.179 20.566 1.00 73.22 O ATOM 0 H GLY B 53 17.359 0.261 16.967 1.00 41.34 H new ATOM 0 HA2 GLY B 53 17.772 0.575 19.720 1.00 4.13 H new ATOM 0 HA3 GLY B 53 18.125 1.741 18.460 1.00 4.13 H new ATOM 2775 N TYR B 54 15.411 2.492 18.427 1.00 15.35 N ATOM 2776 CA TYR B 54 14.290 3.376 18.739 1.00 21.24 C ATOM 2777 C TYR B 54 13.289 2.673 19.652 1.00 2.44 C ATOM 2778 O TYR B 54 12.866 3.237 20.653 1.00 55.40 O ATOM 2779 CB TYR B 54 13.613 3.851 17.436 1.00 22.10 C ATOM 2780 CG TYR B 54 12.356 4.701 17.611 1.00 24.43 C ATOM 2781 CD1 TYR B 54 12.077 5.375 18.802 1.00 33.43 C ATOM 2782 CD2 TYR B 54 11.443 4.824 16.569 1.00 20.22 C ATOM 2783 CE1 TYR B 54 10.930 6.134 18.943 1.00 54.12 C ATOM 2784 CE2 TYR B 54 10.300 5.585 16.702 1.00 11.21 C ATOM 2785 CZ TYR B 54 10.047 6.236 17.891 1.00 15.31 C ATOM 2786 OH TYR B 54 8.902 6.985 18.036 1.00 73.14 O ATOM 0 H TYR B 54 15.527 2.304 17.431 1.00 15.35 H new ATOM 0 HA TYR B 54 14.668 4.250 19.269 1.00 21.24 H new ATOM 0 HB2 TYR B 54 14.339 4.425 16.860 1.00 22.10 H new ATOM 0 HB3 TYR B 54 13.356 2.974 16.842 1.00 22.10 H new ATOM 0 HD1 TYR B 54 12.770 5.302 19.628 1.00 33.43 H new ATOM 0 HD2 TYR B 54 11.633 4.313 15.637 1.00 20.22 H new ATOM 0 HE1 TYR B 54 10.728 6.644 19.873 1.00 54.12 H new ATOM 0 HE2 TYR B 54 9.606 5.671 15.879 1.00 11.21 H new ATOM 0 HH TYR B 54 8.146 6.392 18.228 1.00 73.14 H new ATOM 2796 N SER B 55 12.924 1.443 19.312 1.00 62.44 N ATOM 2797 CA SER B 55 11.969 0.684 20.118 1.00 11.44 C ATOM 2798 C SER B 55 12.529 0.439 21.522 1.00 45.34 C ATOM 2799 O SER B 55 11.870 0.734 22.526 1.00 23.33 O ATOM 2800 CB SER B 55 11.619 -0.640 19.426 1.00 71.55 C ATOM 2801 OG SER B 55 12.785 -1.351 19.049 1.00 22.42 O ATOM 0 H SER B 55 13.271 0.950 18.489 1.00 62.44 H new ATOM 0 HA SER B 55 11.053 1.267 20.217 1.00 11.44 H new ATOM 0 HB2 SER B 55 11.017 -1.254 20.096 1.00 71.55 H new ATOM 0 HB3 SER B 55 11.011 -0.441 18.543 1.00 71.55 H new ATOM 0 HG SER B 55 13.133 -0.987 18.208 1.00 22.42 H new ATOM 2807 N ALA B 56 13.762 -0.064 21.582 1.00 72.32 N ATOM 2808 CA ALA B 56 14.429 -0.329 22.854 1.00 72.14 C ATOM 2809 C ALA B 56 14.551 0.947 23.691 1.00 34.31 C ATOM 2810 O ALA B 56 14.368 0.928 24.909 1.00 51.54 O ATOM 2811 CB ALA B 56 15.801 -0.937 22.605 1.00 11.32 C ATOM 0 H ALA B 56 14.320 -0.296 20.760 1.00 72.32 H new ATOM 0 HA ALA B 56 13.823 -1.039 23.417 1.00 72.14 H new ATOM 0 HB1 ALA B 56 16.291 -1.131 23.559 1.00 11.32 H new ATOM 0 HB2 ALA B 56 15.690 -1.872 22.057 1.00 11.32 H new ATOM 0 HB3 ALA B 56 16.406 -0.243 22.021 1.00 11.32 H new ATOM 2817 N CYS B 57 14.854 2.054 23.022 1.00 24.02 N ATOM 2818 CA CYS B 57 14.977 3.347 23.683 1.00 54.22 C ATOM 2819 C CYS B 57 13.604 3.841 24.128 1.00 22.14 C ATOM 2820 O CYS B 57 13.467 4.444 25.190 1.00 1.03 O ATOM 2821 CB CYS B 57 15.639 4.372 22.752 1.00 72.40 C ATOM 2822 SG CYS B 57 17.319 3.931 22.250 1.00 42.35 S ATOM 0 H CYS B 57 15.020 2.081 22.016 1.00 24.02 H new ATOM 0 HA CYS B 57 15.610 3.227 24.562 1.00 54.22 H new ATOM 0 HB2 CYS B 57 15.023 4.489 21.860 1.00 72.40 H new ATOM 0 HB3 CYS B 57 15.662 5.340 23.252 1.00 72.40 H new ATOM 0 HG CYS B 57 17.270 3.020 21.324 1.00 42.35 H new ATOM 2828 N PHE B 58 12.591 3.563 23.311 1.00 34.03 N ATOM 2829 CA PHE B 58 11.231 4.015 23.577 1.00 42.11 C ATOM 2830 C PHE B 58 10.702 3.360 24.844 1.00 1.15 C ATOM 2831 O PHE B 58 9.943 3.967 25.596 1.00 52.32 O ATOM 2832 CB PHE B 58 10.315 3.691 22.388 1.00 13.13 C ATOM 2833 CG PHE B 58 8.943 4.308 22.497 1.00 50.11 C ATOM 2834 CD1 PHE B 58 7.864 3.572 22.969 1.00 2.44 C ATOM 2835 CD2 PHE B 58 8.739 5.629 22.133 1.00 25.34 C ATOM 2836 CE1 PHE B 58 6.610 4.146 23.074 1.00 5.05 C ATOM 2837 CE2 PHE B 58 7.492 6.206 22.233 1.00 25.32 C ATOM 2838 CZ PHE B 58 6.425 5.464 22.705 1.00 52.03 C ATOM 0 H PHE B 58 12.690 3.022 22.452 1.00 34.03 H new ATOM 0 HA PHE B 58 11.244 5.096 23.718 1.00 42.11 H new ATOM 0 HB2 PHE B 58 10.789 4.039 21.470 1.00 13.13 H new ATOM 0 HB3 PHE B 58 10.212 2.609 22.304 1.00 13.13 H new ATOM 0 HD1 PHE B 58 8.006 2.541 23.257 1.00 2.44 H new ATOM 0 HD2 PHE B 58 9.569 6.215 21.766 1.00 25.34 H new ATOM 0 HE1 PHE B 58 5.778 3.565 23.444 1.00 5.05 H new ATOM 0 HE2 PHE B 58 7.348 7.236 21.943 1.00 25.32 H new ATOM 0 HZ PHE B 58 5.447 5.915 22.785 1.00 52.03 H new ATOM 2848 N LEU B 59 11.116 2.117 25.070 1.00 60.43 N ATOM 2849 CA LEU B 59 10.753 1.390 26.280 1.00 11.12 C ATOM 2850 C LEU B 59 11.194 2.198 27.503 1.00 60.54 C ATOM 2851 O LEU B 59 10.427 2.397 28.447 1.00 64.41 O ATOM 2852 CB LEU B 59 11.413 -0.008 26.264 1.00 33.41 C ATOM 2853 CG LEU B 59 10.839 -1.064 27.241 1.00 23.42 C ATOM 2854 CD1 LEU B 59 11.144 -0.725 28.700 1.00 12.45 C ATOM 2855 CD2 LEU B 59 9.335 -1.229 27.028 1.00 24.24 C ATOM 0 H LEU B 59 11.707 1.590 24.426 1.00 60.43 H new ATOM 0 HA LEU B 59 9.673 1.253 26.327 1.00 11.12 H new ATOM 0 HB2 LEU B 59 11.340 -0.406 25.252 1.00 33.41 H new ATOM 0 HB3 LEU B 59 12.474 0.115 26.482 1.00 33.41 H new ATOM 0 HG LEU B 59 11.332 -2.011 27.022 1.00 23.42 H new ATOM 0 HD11 LEU B 59 10.722 -1.493 29.348 1.00 12.45 H new ATOM 0 HD12 LEU B 59 12.223 -0.680 28.845 1.00 12.45 H new ATOM 0 HD13 LEU B 59 10.704 0.241 28.949 1.00 12.45 H new ATOM 0 HD21 LEU B 59 8.949 -1.975 27.723 1.00 24.24 H new ATOM 0 HD22 LEU B 59 8.836 -0.276 27.204 1.00 24.24 H new ATOM 0 HD23 LEU B 59 9.146 -1.554 26.005 1.00 24.24 H new ATOM 2867 N SER B 60 12.425 2.694 27.458 1.00 44.21 N ATOM 2868 CA SER B 60 12.985 3.459 28.565 1.00 2.40 C ATOM 2869 C SER B 60 12.445 4.897 28.557 1.00 73.23 C ATOM 2870 O SER B 60 12.233 5.498 29.615 1.00 65.55 O ATOM 2871 CB SER B 60 14.518 3.449 28.491 1.00 63.24 C ATOM 2872 OG SER B 60 15.096 3.856 29.722 1.00 24.13 O ATOM 0 H SER B 60 13.056 2.579 26.664 1.00 44.21 H new ATOM 0 HA SER B 60 12.682 2.992 29.502 1.00 2.40 H new ATOM 0 HB2 SER B 60 14.866 2.448 28.237 1.00 63.24 H new ATOM 0 HB3 SER B 60 14.850 4.114 27.693 1.00 63.24 H new ATOM 0 HG SER B 60 16.064 3.703 29.696 1.00 24.13 H new ATOM 2878 N ALA B 61 12.198 5.428 27.360 1.00 21.42 N ATOM 2879 CA ALA B 61 11.683 6.785 27.205 1.00 31.00 C ATOM 2880 C ALA B 61 10.293 6.898 27.819 1.00 42.41 C ATOM 2881 O ALA B 61 10.032 7.782 28.631 1.00 44.10 O ATOM 2882 CB ALA B 61 11.655 7.183 25.732 1.00 4.34 C ATOM 0 H ALA B 61 12.348 4.935 26.480 1.00 21.42 H new ATOM 0 HA ALA B 61 12.348 7.470 27.730 1.00 31.00 H new ATOM 0 HB1 ALA B 61 11.268 8.198 25.637 1.00 4.34 H new ATOM 0 HB2 ALA B 61 12.665 7.140 25.324 1.00 4.34 H new ATOM 0 HB3 ALA B 61 11.012 6.496 25.182 1.00 4.34 H new ATOM 2888 N MET B 62 9.415 5.976 27.440 1.00 64.12 N ATOM 2889 CA MET B 62 8.063 5.925 27.984 1.00 62.41 C ATOM 2890 C MET B 62 8.113 5.575 29.470 1.00 51.11 C ATOM 2891 O MET B 62 7.228 5.946 30.242 1.00 53.32 O ATOM 2892 CB MET B 62 7.212 4.904 27.214 1.00 4.11 C ATOM 2893 CG MET B 62 5.765 4.836 27.681 1.00 71.00 C ATOM 2894 SD MET B 62 4.911 6.419 27.535 1.00 51.43 S ATOM 2895 CE MET B 62 3.348 6.033 28.320 1.00 33.40 C ATOM 0 H MET B 62 9.617 5.249 26.754 1.00 64.12 H new ATOM 0 HA MET B 62 7.600 6.905 27.872 1.00 62.41 H new ATOM 0 HB2 MET B 62 7.231 5.155 26.154 1.00 4.11 H new ATOM 0 HB3 MET B 62 7.664 3.917 27.316 1.00 4.11 H new ATOM 0 HG2 MET B 62 5.233 4.086 27.096 1.00 71.00 H new ATOM 0 HG3 MET B 62 5.738 4.508 28.720 1.00 71.00 H new ATOM 0 HE1 MET B 62 2.707 6.915 28.308 1.00 33.40 H new ATOM 0 HE2 MET B 62 2.860 5.223 27.779 1.00 33.40 H new ATOM 0 HE3 MET B 62 3.525 5.726 29.351 1.00 33.40 H new ATOM 2905 N LYS B 63 9.164 4.856 29.863 1.00 72.03 N ATOM 2906 CA LYS B 63 9.413 4.549 31.268 1.00 43.00 C ATOM 2907 C LYS B 63 9.727 5.833 32.042 1.00 70.35 C ATOM 2908 O LYS B 63 9.343 5.977 33.204 1.00 23.43 O ATOM 2909 CB LYS B 63 10.551 3.516 31.387 1.00 31.31 C ATOM 2910 CG LYS B 63 11.094 3.307 32.801 1.00 20.13 C ATOM 2911 CD LYS B 63 11.831 1.969 32.943 1.00 10.22 C ATOM 2912 CE LYS B 63 12.859 1.736 31.833 1.00 1.23 C ATOM 2913 NZ LYS B 63 14.005 2.686 31.898 1.00 55.13 N1+ ATOM 0 H LYS B 63 9.860 4.474 29.222 1.00 72.03 H new ATOM 0 HA LYS B 63 8.518 4.110 31.709 1.00 43.00 H new ATOM 0 HB2 LYS B 63 10.193 2.559 31.007 1.00 31.31 H new ATOM 0 HB3 LYS B 63 11.372 3.828 30.742 1.00 31.31 H new ATOM 0 HG2 LYS B 63 11.772 4.123 33.053 1.00 20.13 H new ATOM 0 HG3 LYS B 63 10.271 3.345 33.514 1.00 20.13 H new ATOM 0 HD2 LYS B 63 12.334 1.937 33.910 1.00 10.22 H new ATOM 0 HD3 LYS B 63 11.104 1.157 32.935 1.00 10.22 H new ATOM 0 HE2 LYS B 63 13.235 0.715 31.901 1.00 1.23 H new ATOM 0 HE3 LYS B 63 12.369 1.831 30.864 1.00 1.23 H new ATOM 0 HZ1 LYS B 63 14.437 2.773 30.956 1.00 55.13 H new ATOM 0 HZ2 LYS B 63 13.666 3.618 32.211 1.00 55.13 H new ATOM 0 HZ3 LYS B 63 14.713 2.331 32.572 1.00 55.13 H new ATOM 2927 N PHE B 64 10.414 6.770 31.384 1.00 21.33 N ATOM 2928 CA PHE B 64 10.649 8.096 31.959 1.00 32.24 C ATOM 2929 C PHE B 64 9.355 8.914 31.926 1.00 14.21 C ATOM 2930 O PHE B 64 9.029 9.626 32.879 1.00 73.11 O ATOM 2931 CB PHE B 64 11.769 8.826 31.200 1.00 30.41 C ATOM 2932 CG PHE B 64 12.046 10.225 31.710 1.00 63.34 C ATOM 2933 CD1 PHE B 64 12.470 10.430 33.018 1.00 43.42 C ATOM 2934 CD2 PHE B 64 11.885 11.333 30.885 1.00 31.33 C ATOM 2935 CE1 PHE B 64 12.723 11.706 33.488 1.00 55.11 C ATOM 2936 CE2 PHE B 64 12.136 12.609 31.353 1.00 33.41 C ATOM 2937 CZ PHE B 64 12.555 12.796 32.655 1.00 14.04 C ATOM 0 H PHE B 64 10.816 6.636 30.456 1.00 21.33 H new ATOM 0 HA PHE B 64 10.965 7.978 32.995 1.00 32.24 H new ATOM 0 HB2 PHE B 64 12.684 8.237 31.268 1.00 30.41 H new ATOM 0 HB3 PHE B 64 11.503 8.881 30.144 1.00 30.41 H new ATOM 0 HD1 PHE B 64 12.603 9.583 33.675 1.00 43.42 H new ATOM 0 HD2 PHE B 64 11.559 11.194 29.865 1.00 31.33 H new ATOM 0 HE1 PHE B 64 13.052 11.851 34.506 1.00 55.11 H new ATOM 0 HE2 PHE B 64 12.004 13.459 30.700 1.00 33.41 H new ATOM 0 HZ PHE B 64 12.751 13.793 33.022 1.00 14.04 H new ATOM 2947 N VAL B 65 8.616 8.790 30.823 1.00 75.05 N ATOM 2948 CA VAL B 65 7.326 9.458 30.664 1.00 40.30 C ATOM 2949 C VAL B 65 6.391 9.082 31.806 1.00 43.44 C ATOM 2950 O VAL B 65 5.720 9.939 32.383 1.00 35.52 O ATOM 2951 CB VAL B 65 6.660 9.088 29.312 1.00 54.45 C ATOM 2952 CG1 VAL B 65 5.202 9.546 29.267 1.00 70.43 C ATOM 2953 CG2 VAL B 65 7.453 9.672 28.145 1.00 51.21 C ATOM 0 H VAL B 65 8.894 8.227 30.019 1.00 75.05 H new ATOM 0 HA VAL B 65 7.509 10.532 30.678 1.00 40.30 H new ATOM 0 HB VAL B 65 6.666 8.002 29.221 1.00 54.45 H new ATOM 0 HG11 VAL B 65 4.764 9.272 28.307 1.00 70.43 H new ATOM 0 HG12 VAL B 65 4.645 9.065 30.071 1.00 70.43 H new ATOM 0 HG13 VAL B 65 5.157 10.628 29.391 1.00 70.43 H new ATOM 0 HG21 VAL B 65 6.970 9.402 27.206 1.00 51.21 H new ATOM 0 HG22 VAL B 65 7.488 10.758 28.236 1.00 51.21 H new ATOM 0 HG23 VAL B 65 8.468 9.274 28.159 1.00 51.21 H new ATOM 2963 N ALA B 66 6.371 7.798 32.138 1.00 30.22 N ATOM 2964 CA ALA B 66 5.546 7.296 33.226 1.00 74.13 C ATOM 2965 C ALA B 66 5.861 8.039 34.524 1.00 44.35 C ATOM 2966 O ALA B 66 4.981 8.257 35.359 1.00 34.23 O ATOM 2967 CB ALA B 66 5.751 5.793 33.395 1.00 23.44 C ATOM 0 H ALA B 66 6.921 7.081 31.665 1.00 30.22 H new ATOM 0 HA ALA B 66 4.499 7.473 32.981 1.00 74.13 H new ATOM 0 HB1 ALA B 66 5.128 5.430 34.212 1.00 23.44 H new ATOM 0 HB2 ALA B 66 5.474 5.282 32.473 1.00 23.44 H new ATOM 0 HB3 ALA B 66 6.798 5.592 33.620 1.00 23.44 H new ATOM 2973 N GLY B 67 7.112 8.471 34.651 1.00 23.35 N ATOM 2974 CA GLY B 67 7.555 9.173 35.841 1.00 73.24 C ATOM 2975 C GLY B 67 6.927 10.548 35.963 1.00 45.13 C ATOM 2976 O GLY B 67 6.588 10.986 37.065 1.00 75.04 O ATOM 0 H GLY B 67 7.834 8.345 33.942 1.00 23.35 H new ATOM 0 HA2 GLY B 67 7.306 8.582 36.723 1.00 73.24 H new ATOM 0 HA3 GLY B 67 8.640 9.272 35.819 1.00 73.24 H new ATOM 2980 N GLN B 68 6.746 11.220 34.825 1.00 2.12 N ATOM 2981 CA GLN B 68 6.174 12.565 34.805 1.00 44.13 C ATOM 2982 C GLN B 68 4.668 12.468 34.620 1.00 40.32 C ATOM 2983 O GLN B 68 3.924 13.416 34.866 1.00 64.50 O ATOM 2984 CB GLN B 68 6.803 13.414 33.686 1.00 33.05 C ATOM 2985 CG GLN B 68 6.697 12.798 32.294 1.00 52.44 C ATOM 2986 CD GLN B 68 7.009 13.789 31.183 1.00 54.32 C ATOM 2987 OE1 GLN B 68 8.151 13.921 30.749 1.00 53.51 O ATOM 2988 NE2 GLN B 68 5.992 14.503 30.727 1.00 53.21 N ATOM 0 H GLN B 68 6.988 10.853 33.904 1.00 2.12 H new ATOM 0 HA GLN B 68 6.390 13.056 35.754 1.00 44.13 H new ATOM 0 HB2 GLN B 68 6.323 14.392 33.675 1.00 33.05 H new ATOM 0 HB3 GLN B 68 7.855 13.578 33.919 1.00 33.05 H new ATOM 0 HG2 GLN B 68 7.382 11.953 32.223 1.00 52.44 H new ATOM 0 HG3 GLN B 68 5.690 12.405 32.152 1.00 52.44 H new ATOM 0 HE21 GLN B 68 5.058 14.365 31.113 1.00 53.21 H new ATOM 0 HE22 GLN B 68 6.142 15.192 29.990 1.00 53.21 H new ATOM 2997 N ASN B 69 4.233 11.293 34.184 1.00 21.43 N ATOM 2998 CA ASN B 69 2.820 10.996 33.982 1.00 41.54 C ATOM 2999 C ASN B 69 2.213 10.389 35.247 1.00 23.00 C ATOM 3000 O ASN B 69 1.014 10.112 35.296 1.00 34.41 O ATOM 3001 CB ASN B 69 2.653 10.038 32.793 1.00 65.13 C ATOM 3002 CG ASN B 69 2.719 10.727 31.434 1.00 21.52 C ATOM 3003 OD1 ASN B 69 2.107 10.270 30.469 1.00 65.21 O ATOM 3004 ND2 ASN B 69 3.456 11.822 31.340 1.00 45.52 N ATOM 0 H ASN B 69 4.853 10.515 33.959 1.00 21.43 H new ATOM 0 HA ASN B 69 2.293 11.925 33.764 1.00 41.54 H new ATOM 0 HB2 ASN B 69 3.430 9.275 32.841 1.00 65.13 H new ATOM 0 HB3 ASN B 69 1.696 9.525 32.884 1.00 65.13 H new ATOM 0 HD21 ASN B 69 3.529 12.313 30.449 1.00 45.52 H new ATOM 0 HD22 ASN B 69 3.951 12.175 32.159 1.00 45.52 H new ATOM 3011 N LYS B 70 3.061 10.179 36.259 1.00 4.22 N ATOM 3012 CA LYS B 70 2.635 9.674 37.571 1.00 71.04 C ATOM 3013 C LYS B 70 2.005 8.283 37.459 1.00 55.13 C ATOM 3014 O LYS B 70 1.153 7.899 38.267 1.00 71.33 O ATOM 3015 CB LYS B 70 1.671 10.663 38.254 1.00 43.15 C ATOM 3016 CG LYS B 70 2.368 11.852 38.917 1.00 61.50 C ATOM 3017 CD LYS B 70 3.429 12.466 38.016 1.00 21.25 C ATOM 3018 CE LYS B 70 3.933 13.793 38.561 1.00 20.34 C ATOM 3019 NZ LYS B 70 2.850 14.809 38.667 1.00 73.12 N1+ ATOM 0 H LYS B 70 4.064 10.354 36.193 1.00 4.22 H new ATOM 0 HA LYS B 70 3.525 9.582 38.194 1.00 71.04 H new ATOM 0 HB2 LYS B 70 0.964 11.036 37.513 1.00 43.15 H new ATOM 0 HB3 LYS B 70 1.091 10.129 39.007 1.00 43.15 H new ATOM 0 HG2 LYS B 70 1.627 12.610 39.173 1.00 61.50 H new ATOM 0 HG3 LYS B 70 2.828 11.528 39.850 1.00 61.50 H new ATOM 0 HD2 LYS B 70 4.265 11.774 37.915 1.00 21.25 H new ATOM 0 HD3 LYS B 70 3.016 12.616 37.018 1.00 21.25 H new ATOM 0 HE2 LYS B 70 4.377 13.634 39.544 1.00 20.34 H new ATOM 0 HE3 LYS B 70 4.722 14.173 37.913 1.00 20.34 H new ATOM 0 HZ1 LYS B 70 3.270 15.759 38.727 1.00 73.12 H new ATOM 0 HZ2 LYS B 70 2.238 14.753 37.828 1.00 73.12 H new ATOM 0 HZ3 LYS B 70 2.285 14.626 39.521 1.00 73.12 H new ATOM 3033 N GLN B 71 2.462 7.520 36.475 1.00 41.03 N ATOM 3034 CA GLN B 71 1.963 6.168 36.233 1.00 14.44 C ATOM 3035 C GLN B 71 3.111 5.166 36.280 1.00 73.31 C ATOM 3036 O GLN B 71 4.282 5.551 36.303 1.00 34.15 O ATOM 3037 CB GLN B 71 1.256 6.087 34.875 1.00 1.40 C ATOM 3038 CG GLN B 71 2.078 6.671 33.733 1.00 33.32 C ATOM 3039 CD GLN B 71 1.773 6.044 32.388 1.00 34.04 C ATOM 3040 OE1 GLN B 71 2.593 5.083 32.008 1.00 74.24 O flip ATOM 3041 NE2 GLN B 71 0.851 6.452 31.683 1.00 0.43 N flip ATOM 0 H GLN B 71 3.187 7.818 35.822 1.00 41.03 H new ATOM 0 HA GLN B 71 1.244 5.924 37.015 1.00 14.44 H new ATOM 0 HB2 GLN B 71 1.028 5.044 34.653 1.00 1.40 H new ATOM 0 HB3 GLN B 71 0.305 6.615 34.936 1.00 1.40 H new ATOM 0 HG2 GLN B 71 1.894 7.744 33.675 1.00 33.32 H new ATOM 0 HG3 GLN B 71 3.137 6.540 33.954 1.00 33.32 H new ATOM 0 HE21 GLN B 71 0.243 7.198 32.020 1.00 0.43 H new ATOM 0 HE22 GLN B 71 0.695 6.044 30.761 1.00 0.43 H new ATOM 3050 N THR B 72 2.771 3.885 36.292 1.00 1.35 N ATOM 3051 CA THR B 72 3.762 2.817 36.289 1.00 51.41 C ATOM 3052 C THR B 72 3.528 1.886 35.103 1.00 74.12 C ATOM 3053 O THR B 72 2.383 1.631 34.722 1.00 25.05 O ATOM 3054 CB THR B 72 3.714 2.002 37.603 1.00 13.02 C ATOM 3055 OG1 THR B 72 2.374 1.551 37.854 1.00 4.22 O ATOM 3056 CG2 THR B 72 4.206 2.833 38.786 1.00 71.50 C ATOM 0 H THR B 72 1.805 3.557 36.304 1.00 1.35 H new ATOM 0 HA THR B 72 4.747 3.277 36.205 1.00 51.41 H new ATOM 0 HB THR B 72 4.373 1.142 37.489 1.00 13.02 H new ATOM 0 HG1 THR B 72 2.353 1.035 38.687 1.00 4.22 H new ATOM 0 HG21 THR B 72 4.161 2.234 39.695 1.00 71.50 H new ATOM 0 HG22 THR B 72 5.235 3.146 38.608 1.00 71.50 H new ATOM 0 HG23 THR B 72 3.574 3.714 38.900 1.00 71.50 H new ATOM 3064 N LEU B 73 4.610 1.394 34.515 1.00 74.12 N ATOM 3065 CA LEU B 73 4.525 0.478 33.383 1.00 52.35 C ATOM 3066 C LEU B 73 4.952 -0.928 33.808 1.00 64.24 C ATOM 3067 O LEU B 73 5.920 -1.081 34.554 1.00 14.14 O ATOM 3068 CB LEU B 73 5.408 0.981 32.234 1.00 75.15 C ATOM 3069 CG LEU B 73 4.967 2.307 31.599 1.00 62.34 C ATOM 3070 CD1 LEU B 73 5.994 2.776 30.572 1.00 33.12 C ATOM 3071 CD2 LEU B 73 3.586 2.170 30.959 1.00 51.14 C ATOM 0 H LEU B 73 5.563 1.615 34.805 1.00 74.12 H new ATOM 0 HA LEU B 73 3.492 0.436 33.038 1.00 52.35 H new ATOM 0 HB2 LEU B 73 6.427 1.096 32.604 1.00 75.15 H new ATOM 0 HB3 LEU B 73 5.435 0.217 31.457 1.00 75.15 H new ATOM 0 HG LEU B 73 4.901 3.058 32.387 1.00 62.34 H new ATOM 0 HD11 LEU B 73 5.665 3.717 30.132 1.00 33.12 H new ATOM 0 HD12 LEU B 73 6.957 2.921 31.061 1.00 33.12 H new ATOM 0 HD13 LEU B 73 6.094 2.025 29.789 1.00 33.12 H new ATOM 0 HD21 LEU B 73 3.294 3.122 30.516 1.00 51.14 H new ATOM 0 HD22 LEU B 73 3.618 1.404 30.185 1.00 51.14 H new ATOM 0 HD23 LEU B 73 2.859 1.886 31.720 1.00 51.14 H new ATOM 3083 N PRO B 74 4.226 -1.966 33.354 1.00 22.31 N ATOM 3084 CA PRO B 74 4.551 -3.364 33.667 1.00 33.15 C ATOM 3085 C PRO B 74 5.900 -3.797 33.089 1.00 51.21 C ATOM 3086 O PRO B 74 6.295 -3.355 32.012 1.00 62.01 O ATOM 3087 CB PRO B 74 3.414 -4.164 33.008 1.00 23.12 C ATOM 3088 CG PRO B 74 2.323 -3.171 32.778 1.00 12.13 C ATOM 3089 CD PRO B 74 3.012 -1.861 32.526 1.00 51.43 C ATOM 0 HA PRO B 74 4.634 -3.521 34.742 1.00 33.15 H new ATOM 0 HB2 PRO B 74 3.741 -4.615 32.071 1.00 23.12 H new ATOM 0 HB3 PRO B 74 3.078 -4.976 33.653 1.00 23.12 H new ATOM 0 HG2 PRO B 74 1.705 -3.458 31.927 1.00 12.13 H new ATOM 0 HG3 PRO B 74 1.664 -3.106 33.644 1.00 12.13 H new ATOM 0 HD2 PRO B 74 3.252 -1.727 31.471 1.00 51.43 H new ATOM 0 HD3 PRO B 74 2.392 -1.015 32.822 1.00 51.43 H new ATOM 3097 N ALA B 75 6.581 -4.682 33.804 1.00 24.41 N ATOM 3098 CA ALA B 75 7.870 -5.223 33.373 1.00 71.53 C ATOM 3099 C ALA B 75 7.697 -6.214 32.236 1.00 71.01 C ATOM 3100 O ALA B 75 8.645 -6.559 31.529 1.00 12.42 O ATOM 3101 CB ALA B 75 8.537 -5.924 34.541 1.00 50.55 C ATOM 0 H ALA B 75 6.258 -5.047 34.700 1.00 24.41 H new ATOM 0 HA ALA B 75 8.487 -4.396 33.022 1.00 71.53 H new ATOM 0 HB1 ALA B 75 9.498 -6.328 34.222 1.00 50.55 H new ATOM 0 HB2 ALA B 75 8.694 -5.212 35.351 1.00 50.55 H new ATOM 0 HB3 ALA B 75 7.900 -6.736 34.890 1.00 50.55 H new ATOM 3107 N ASP B 76 6.472 -6.664 32.078 1.00 24.20 N ATOM 3108 CA ASP B 76 6.141 -7.766 31.191 1.00 60.22 C ATOM 3109 C ASP B 76 5.822 -7.267 29.779 1.00 14.12 C ATOM 3110 O ASP B 76 5.270 -8.002 28.960 1.00 34.13 O ATOM 3111 CB ASP B 76 4.934 -8.495 31.782 1.00 21.51 C ATOM 3112 CG ASP B 76 5.168 -8.972 33.207 1.00 33.51 C ATOM 3113 OD1 ASP B 76 4.786 -8.242 34.152 1.00 23.44 O ATOM 3114 OD2 ASP B 76 5.735 -10.067 33.394 1.00 41.11 O1- ATOM 0 H ASP B 76 5.666 -6.273 32.566 1.00 24.20 H new ATOM 0 HA ASP B 76 6.994 -8.439 31.108 1.00 60.22 H new ATOM 0 HB2 ASP B 76 4.070 -7.830 31.764 1.00 21.51 H new ATOM 0 HB3 ASP B 76 4.690 -9.351 31.153 1.00 21.51 H new ATOM 3119 N THR B 77 6.189 -6.021 29.498 1.00 44.41 N ATOM 3120 CA THR B 77 5.838 -5.373 28.237 1.00 1.21 C ATOM 3121 C THR B 77 6.904 -5.591 27.160 1.00 31.44 C ATOM 3122 O THR B 77 8.028 -6.017 27.451 1.00 72.52 O ATOM 3123 CB THR B 77 5.621 -3.859 28.448 1.00 44.03 C ATOM 3124 OG1 THR B 77 5.247 -3.230 27.216 1.00 73.25 O ATOM 3125 CG2 THR B 77 6.876 -3.187 28.999 1.00 30.02 C ATOM 0 H THR B 77 6.733 -5.435 30.131 1.00 44.41 H new ATOM 0 HA THR B 77 4.912 -5.832 27.892 1.00 1.21 H new ATOM 0 HB THR B 77 4.818 -3.743 29.176 1.00 44.03 H new ATOM 0 HG1 THR B 77 4.560 -3.768 26.769 1.00 73.25 H new ATOM 0 HG21 THR B 77 6.688 -2.122 29.136 1.00 30.02 H new ATOM 0 HG22 THR B 77 7.138 -3.635 29.958 1.00 30.02 H new ATOM 0 HG23 THR B 77 7.699 -3.323 28.298 1.00 30.02 H new ATOM 3133 N THR B 78 6.532 -5.298 25.910 1.00 70.31 N ATOM 3134 CA THR B 78 7.427 -5.424 24.769 1.00 64.53 C ATOM 3135 C THR B 78 6.969 -4.493 23.641 1.00 71.23 C ATOM 3136 O THR B 78 5.776 -4.225 23.496 1.00 64.44 O ATOM 3137 CB THR B 78 7.448 -6.879 24.237 1.00 53.44 C ATOM 3138 OG1 THR B 78 7.631 -7.802 25.321 1.00 34.22 O ATOM 3139 CG2 THR B 78 8.556 -7.084 23.210 1.00 23.30 C ATOM 0 H THR B 78 5.599 -4.967 25.667 1.00 70.31 H new ATOM 0 HA THR B 78 8.430 -5.151 25.098 1.00 64.53 H new ATOM 0 HB THR B 78 6.489 -7.063 23.752 1.00 53.44 H new ATOM 0 HG1 THR B 78 7.641 -8.718 24.973 1.00 34.22 H new ATOM 0 HG21 THR B 78 8.540 -8.116 22.859 1.00 23.30 H new ATOM 0 HG22 THR B 78 8.399 -6.411 22.367 1.00 23.30 H new ATOM 0 HG23 THR B 78 9.521 -6.871 23.669 1.00 23.30 H new ATOM 3147 N VAL B 79 7.916 -4.009 22.851 1.00 22.45 N ATOM 3148 CA VAL B 79 7.616 -3.198 21.673 1.00 23.02 C ATOM 3149 C VAL B 79 8.277 -3.817 20.453 1.00 31.21 C ATOM 3150 O VAL B 79 9.472 -4.098 20.466 1.00 14.34 O ATOM 3151 CB VAL B 79 8.103 -1.733 21.836 1.00 21.11 C ATOM 3152 CG1 VAL B 79 7.926 -0.944 20.537 1.00 1.41 C ATOM 3153 CG2 VAL B 79 7.362 -1.052 22.981 1.00 54.24 C ATOM 0 H VAL B 79 8.912 -4.165 23.005 1.00 22.45 H new ATOM 0 HA VAL B 79 6.533 -3.177 21.550 1.00 23.02 H new ATOM 0 HB VAL B 79 9.167 -1.755 22.072 1.00 21.11 H new ATOM 0 HG11 VAL B 79 8.276 0.078 20.682 1.00 1.41 H new ATOM 0 HG12 VAL B 79 8.504 -1.416 19.743 1.00 1.41 H new ATOM 0 HG13 VAL B 79 6.872 -0.931 20.260 1.00 1.41 H new ATOM 0 HG21 VAL B 79 7.714 -0.026 23.083 1.00 54.24 H new ATOM 0 HG22 VAL B 79 6.292 -1.049 22.772 1.00 54.24 H new ATOM 0 HG23 VAL B 79 7.549 -1.593 23.908 1.00 54.24 H new ATOM 3163 N THR B 80 7.506 -4.056 19.409 1.00 72.42 N ATOM 3164 CA THR B 80 8.052 -4.638 18.197 1.00 23.21 C ATOM 3165 C THR B 80 8.113 -3.593 17.087 1.00 63.22 C ATOM 3166 O THR B 80 7.084 -3.176 16.553 1.00 42.43 O ATOM 3167 CB THR B 80 7.227 -5.857 17.736 1.00 22.40 C ATOM 3168 OG1 THR B 80 6.915 -6.685 18.869 1.00 71.34 O ATOM 3169 CG2 THR B 80 8.005 -6.680 16.713 1.00 64.25 C ATOM 0 H THR B 80 6.506 -3.858 19.375 1.00 72.42 H new ATOM 0 HA THR B 80 9.063 -4.981 18.419 1.00 23.21 H new ATOM 0 HB THR B 80 6.308 -5.496 17.273 1.00 22.40 H new ATOM 0 HG1 THR B 80 6.389 -7.458 18.574 1.00 71.34 H new ATOM 0 HG21 THR B 80 7.405 -7.535 16.401 1.00 64.25 H new ATOM 0 HG22 THR B 80 8.233 -6.061 15.845 1.00 64.25 H new ATOM 0 HG23 THR B 80 8.934 -7.033 17.161 1.00 64.25 H new ATOM 3177 N ALA B 81 9.324 -3.160 16.764 1.00 41.34 N ATOM 3178 CA ALA B 81 9.545 -2.196 15.700 1.00 73.43 C ATOM 3179 C ALA B 81 9.835 -2.928 14.402 1.00 13.31 C ATOM 3180 O ALA B 81 10.904 -3.520 14.238 1.00 32.14 O ATOM 3181 CB ALA B 81 10.699 -1.265 16.054 1.00 31.52 C ATOM 0 H ALA B 81 10.177 -3.467 17.232 1.00 41.34 H new ATOM 0 HA ALA B 81 8.646 -1.592 15.576 1.00 73.43 H new ATOM 0 HB1 ALA B 81 10.850 -0.550 15.246 1.00 31.52 H new ATOM 0 HB2 ALA B 81 10.465 -0.729 16.974 1.00 31.52 H new ATOM 0 HB3 ALA B 81 11.608 -1.850 16.196 1.00 31.52 H new ATOM 3187 N GLU B 82 8.866 -2.921 13.502 1.00 50.12 N ATOM 3188 CA GLU B 82 9.027 -3.552 12.200 1.00 53.10 C ATOM 3189 C GLU B 82 9.121 -2.471 11.134 1.00 51.21 C ATOM 3190 O GLU B 82 8.134 -1.808 10.811 1.00 13.21 O ATOM 3191 CB GLU B 82 7.863 -4.516 11.917 1.00 51.24 C ATOM 3192 CG GLU B 82 8.072 -5.390 10.680 1.00 31.41 C ATOM 3193 CD GLU B 82 7.020 -6.483 10.541 1.00 63.34 C ATOM 3194 OE1 GLU B 82 6.111 -6.352 9.694 1.00 35.34 O ATOM 3195 OE2 GLU B 82 7.088 -7.481 11.296 1.00 71.23 O1- ATOM 0 H GLU B 82 7.956 -2.484 13.649 1.00 50.12 H new ATOM 0 HA GLU B 82 9.944 -4.141 12.189 1.00 53.10 H new ATOM 0 HB2 GLU B 82 7.717 -5.160 12.785 1.00 51.24 H new ATOM 0 HB3 GLU B 82 6.947 -3.938 11.792 1.00 51.24 H new ATOM 0 HG2 GLU B 82 8.055 -4.761 9.790 1.00 31.41 H new ATOM 0 HG3 GLU B 82 9.060 -5.848 10.728 1.00 31.41 H new ATOM 3202 N VAL B 83 10.318 -2.286 10.602 1.00 40.31 N ATOM 3203 CA VAL B 83 10.586 -1.195 9.677 1.00 71.44 C ATOM 3204 C VAL B 83 10.653 -1.708 8.248 1.00 35.11 C ATOM 3205 O VAL B 83 11.142 -2.809 7.993 1.00 1.44 O ATOM 3206 CB VAL B 83 11.905 -0.466 10.035 1.00 65.23 C ATOM 3207 CG1 VAL B 83 13.094 -1.423 9.968 1.00 71.22 C ATOM 3208 CG2 VAL B 83 12.118 0.749 9.130 1.00 51.35 C ATOM 0 H VAL B 83 11.124 -2.880 10.796 1.00 40.31 H new ATOM 0 HA VAL B 83 9.765 -0.483 9.762 1.00 71.44 H new ATOM 0 HB VAL B 83 11.827 -0.107 11.061 1.00 65.23 H new ATOM 0 HG11 VAL B 83 14.008 -0.886 10.224 1.00 71.22 H new ATOM 0 HG12 VAL B 83 12.944 -2.240 10.674 1.00 71.22 H new ATOM 0 HG13 VAL B 83 13.180 -1.826 8.959 1.00 71.22 H new ATOM 0 HG21 VAL B 83 13.050 1.245 9.400 1.00 51.35 H new ATOM 0 HG22 VAL B 83 12.168 0.424 8.091 1.00 51.35 H new ATOM 0 HG23 VAL B 83 11.288 1.445 9.254 1.00 51.35 H new ATOM 3218 N GLY B 84 10.142 -0.915 7.322 1.00 51.11 N ATOM 3219 CA GLY B 84 10.169 -1.273 5.930 1.00 52.45 C ATOM 3220 C GLY B 84 10.543 -0.099 5.066 1.00 30.33 C ATOM 3221 O GLY B 84 10.548 1.043 5.522 1.00 4.21 O ATOM 0 H GLY B 84 9.703 -0.016 7.519 1.00 51.11 H new ATOM 0 HA2 GLY B 84 10.883 -2.082 5.775 1.00 52.45 H new ATOM 0 HA3 GLY B 84 9.191 -1.649 5.631 1.00 52.45 H new ATOM 3225 N ILE B 85 10.856 -0.386 3.822 1.00 72.33 N ATOM 3226 CA ILE B 85 11.251 0.628 2.862 1.00 70.35 C ATOM 3227 C ILE B 85 10.792 0.212 1.472 1.00 24.30 C ATOM 3228 O ILE B 85 10.905 -0.964 1.100 1.00 65.43 O ATOM 3229 CB ILE B 85 12.790 0.852 2.897 1.00 43.15 C ATOM 3230 CG1 ILE B 85 13.241 1.937 1.892 1.00 73.10 C ATOM 3231 CG2 ILE B 85 13.523 -0.464 2.649 1.00 2.22 C ATOM 3232 CD1 ILE B 85 13.476 1.433 0.483 1.00 22.31 C ATOM 0 H ILE B 85 10.845 -1.333 3.443 1.00 72.33 H new ATOM 0 HA ILE B 85 10.777 1.574 3.124 1.00 70.35 H new ATOM 0 HB ILE B 85 13.049 1.215 3.892 1.00 43.15 H new ATOM 0 HG12 ILE B 85 12.485 2.722 1.862 1.00 73.10 H new ATOM 0 HG13 ILE B 85 14.160 2.393 2.259 1.00 73.10 H new ATOM 0 HG21 ILE B 85 14.599 -0.292 2.676 1.00 2.22 H new ATOM 0 HG22 ILE B 85 13.251 -1.183 3.421 1.00 2.22 H new ATOM 0 HG23 ILE B 85 13.243 -0.858 1.672 1.00 2.22 H new ATOM 0 HD11 ILE B 85 13.789 2.262 -0.152 1.00 22.31 H new ATOM 0 HD12 ILE B 85 14.255 0.670 0.495 1.00 22.31 H new ATOM 0 HD13 ILE B 85 12.554 1.004 0.091 1.00 22.31 H new ATOM 3244 N GLY B 86 10.273 1.180 0.723 1.00 43.24 N ATOM 3245 CA GLY B 86 9.768 0.933 -0.618 1.00 50.02 C ATOM 3246 C GLY B 86 9.896 2.166 -1.493 1.00 52.30 C ATOM 3247 O GLY B 86 10.204 3.243 -0.983 1.00 42.02 O ATOM 0 H GLY B 86 10.192 2.150 1.028 1.00 43.24 H new ATOM 0 HA2 GLY B 86 10.317 0.106 -1.069 1.00 50.02 H new ATOM 0 HA3 GLY B 86 8.722 0.630 -0.565 1.00 50.02 H new ATOM 3251 N PRO B 87 9.670 2.055 -2.814 1.00 42.21 N ATOM 3252 CA PRO B 87 9.842 3.169 -3.737 1.00 30.25 C ATOM 3253 C PRO B 87 8.642 4.111 -3.716 1.00 61.30 C ATOM 3254 O PRO B 87 7.498 3.684 -3.880 1.00 52.32 O ATOM 3255 CB PRO B 87 9.979 2.493 -5.118 1.00 44.10 C ATOM 3256 CG PRO B 87 9.773 1.022 -4.891 1.00 14.42 C ATOM 3257 CD PRO B 87 9.181 0.866 -3.514 1.00 45.13 C ATOM 0 HA PRO B 87 10.702 3.786 -3.476 1.00 30.25 H new ATOM 0 HB2 PRO B 87 9.241 2.885 -5.818 1.00 44.10 H new ATOM 0 HB3 PRO B 87 10.961 2.686 -5.549 1.00 44.10 H new ATOM 0 HG2 PRO B 87 9.107 0.605 -5.646 1.00 14.42 H new ATOM 0 HG3 PRO B 87 10.718 0.484 -4.967 1.00 14.42 H new ATOM 0 HD2 PRO B 87 8.092 0.833 -3.543 1.00 45.13 H new ATOM 0 HD3 PRO B 87 9.515 -0.053 -3.032 1.00 45.13 H new ATOM 3265 N ASN B 88 8.906 5.388 -3.494 1.00 53.24 N ATOM 3266 CA ASN B 88 7.873 6.409 -3.579 1.00 21.43 C ATOM 3267 C ASN B 88 7.697 6.823 -5.034 1.00 21.10 C ATOM 3268 O ASN B 88 8.671 6.882 -5.787 1.00 51.23 O ATOM 3269 CB ASN B 88 8.235 7.631 -2.729 1.00 72.30 C ATOM 3270 CG ASN B 88 7.108 8.650 -2.675 1.00 63.22 C ATOM 3271 OD1 ASN B 88 7.012 9.529 -3.525 1.00 5.32 O ATOM 3272 ND2 ASN B 88 6.245 8.534 -1.677 1.00 3.11 N ATOM 0 H ASN B 88 9.831 5.744 -3.252 1.00 53.24 H new ATOM 0 HA ASN B 88 6.940 5.996 -3.195 1.00 21.43 H new ATOM 0 HB2 ASN B 88 8.478 7.308 -1.717 1.00 72.30 H new ATOM 0 HB3 ASN B 88 9.129 8.103 -3.137 1.00 72.30 H new ATOM 0 HD21 ASN B 88 5.467 9.189 -1.596 1.00 3.11 H new ATOM 0 HD22 ASN B 88 6.358 7.789 -0.989 1.00 3.11 H new ATOM 3279 N GLU B 89 6.464 7.130 -5.417 1.00 65.22 N ATOM 3280 CA GLU B 89 6.141 7.451 -6.804 1.00 51.32 C ATOM 3281 C GLU B 89 6.885 8.699 -7.288 1.00 22.42 C ATOM 3282 O GLU B 89 6.968 8.952 -8.492 1.00 11.02 O ATOM 3283 CB GLU B 89 4.631 7.647 -6.962 1.00 62.31 C ATOM 3284 CG GLU B 89 4.081 8.824 -6.170 1.00 11.15 C ATOM 3285 CD GLU B 89 2.579 8.976 -6.324 1.00 24.23 C ATOM 3286 OE1 GLU B 89 1.859 8.863 -5.308 1.00 4.32 O ATOM 3287 OE2 GLU B 89 2.115 9.205 -7.458 1.00 35.35 O1- ATOM 0 H GLU B 89 5.666 7.164 -4.783 1.00 65.22 H new ATOM 0 HA GLU B 89 6.465 6.612 -7.420 1.00 51.32 H new ATOM 0 HB2 GLU B 89 4.401 7.791 -8.018 1.00 62.31 H new ATOM 0 HB3 GLU B 89 4.120 6.737 -6.646 1.00 62.31 H new ATOM 0 HG2 GLU B 89 4.324 8.693 -5.115 1.00 11.15 H new ATOM 0 HG3 GLU B 89 4.571 9.740 -6.499 1.00 11.15 H new ATOM 3294 N GLU B 90 7.417 9.475 -6.345 1.00 52.12 N ATOM 3295 CA GLU B 90 8.194 10.672 -6.670 1.00 15.12 C ATOM 3296 C GLU B 90 9.515 10.295 -7.346 1.00 74.05 C ATOM 3297 O GLU B 90 10.114 11.091 -8.075 1.00 53.12 O ATOM 3298 CB GLU B 90 8.469 11.486 -5.398 1.00 14.23 C ATOM 3299 CG GLU B 90 9.390 12.673 -5.629 1.00 30.33 C ATOM 3300 CD GLU B 90 9.714 13.438 -4.355 1.00 5.15 C ATOM 3301 OE1 GLU B 90 8.804 14.082 -3.789 1.00 54.43 O ATOM 3302 OE2 GLU B 90 10.886 13.418 -3.922 1.00 12.50 O1- ATOM 0 H GLU B 90 7.324 9.296 -5.345 1.00 52.12 H new ATOM 0 HA GLU B 90 7.612 11.279 -7.363 1.00 15.12 H new ATOM 0 HB2 GLU B 90 7.522 11.843 -4.992 1.00 14.23 H new ATOM 0 HB3 GLU B 90 8.912 10.833 -4.646 1.00 14.23 H new ATOM 0 HG2 GLU B 90 10.318 12.322 -6.080 1.00 30.33 H new ATOM 0 HG3 GLU B 90 8.925 13.352 -6.344 1.00 30.33 H new ATOM 3309 N GLY B 91 9.949 9.065 -7.114 1.00 72.20 N ATOM 3310 CA GLY B 91 11.210 8.587 -7.652 1.00 12.11 C ATOM 3311 C GLY B 91 12.292 8.525 -6.594 1.00 71.02 C ATOM 3312 O GLY B 91 13.462 8.796 -6.864 1.00 5.53 O ATOM 0 H GLY B 91 9.443 8.379 -6.554 1.00 72.20 H new ATOM 0 HA2 GLY B 91 11.068 7.596 -8.083 1.00 12.11 H new ATOM 0 HA3 GLY B 91 11.531 9.243 -8.461 1.00 12.11 H new ATOM 3316 N GLY B 92 11.887 8.178 -5.377 1.00 60.34 N ATOM 3317 CA GLY B 92 12.820 8.036 -4.276 1.00 61.32 C ATOM 3318 C GLY B 92 12.419 6.892 -3.368 1.00 12.52 C ATOM 3319 O GLY B 92 11.515 6.128 -3.702 1.00 70.13 O ATOM 0 H GLY B 92 10.915 7.990 -5.132 1.00 60.34 H new ATOM 0 HA2 GLY B 92 13.823 7.862 -4.665 1.00 61.32 H new ATOM 0 HA3 GLY B 92 12.857 8.963 -3.704 1.00 61.32 H new ATOM 3323 N PHE B 93 13.079 6.765 -2.226 1.00 71.13 N ATOM 3324 CA PHE B 93 12.741 5.724 -1.259 1.00 4.00 C ATOM 3325 C PHE B 93 11.907 6.302 -0.123 1.00 73.12 C ATOM 3326 O PHE B 93 12.113 7.443 0.297 1.00 63.14 O ATOM 3327 CB PHE B 93 14.006 5.053 -0.702 1.00 42.41 C ATOM 3328 CG PHE B 93 14.745 4.206 -1.711 1.00 52.32 C ATOM 3329 CD1 PHE B 93 16.126 4.277 -1.829 1.00 72.40 C ATOM 3330 CD2 PHE B 93 14.051 3.330 -2.539 1.00 72.15 C ATOM 3331 CE1 PHE B 93 16.798 3.495 -2.750 1.00 54.33 C ATOM 3332 CE2 PHE B 93 14.721 2.548 -3.462 1.00 20.53 C ATOM 3333 CZ PHE B 93 16.095 2.630 -3.567 1.00 20.53 C ATOM 0 H PHE B 93 13.852 7.368 -1.944 1.00 71.13 H new ATOM 0 HA PHE B 93 12.154 4.965 -1.776 1.00 4.00 H new ATOM 0 HB2 PHE B 93 14.679 5.824 -0.327 1.00 42.41 H new ATOM 0 HB3 PHE B 93 13.730 4.430 0.148 1.00 42.41 H new ATOM 0 HD1 PHE B 93 16.682 4.951 -1.194 1.00 72.40 H new ATOM 0 HD2 PHE B 93 12.976 3.260 -2.460 1.00 72.15 H new ATOM 0 HE1 PHE B 93 17.873 3.560 -2.831 1.00 54.33 H new ATOM 0 HE2 PHE B 93 14.170 1.874 -4.100 1.00 20.53 H new ATOM 0 HZ PHE B 93 16.620 2.019 -4.287 1.00 20.53 H new ATOM 3343 N ALA B 94 10.966 5.509 0.366 1.00 22.42 N ATOM 3344 CA ALA B 94 10.086 5.917 1.452 1.00 62.21 C ATOM 3345 C ALA B 94 10.134 4.880 2.568 1.00 42.21 C ATOM 3346 O ALA B 94 10.044 3.675 2.308 1.00 61.15 O ATOM 3347 CB ALA B 94 8.661 6.096 0.936 1.00 43.22 C ATOM 0 H ALA B 94 10.790 4.565 0.022 1.00 22.42 H new ATOM 0 HA ALA B 94 10.424 6.873 1.851 1.00 62.21 H new ATOM 0 HB1 ALA B 94 8.012 6.401 1.757 1.00 43.22 H new ATOM 0 HB2 ALA B 94 8.648 6.861 0.160 1.00 43.22 H new ATOM 0 HB3 ALA B 94 8.303 5.154 0.522 1.00 43.22 H new ATOM 3353 N LEU B 95 10.300 5.351 3.798 1.00 51.40 N ATOM 3354 CA LEU B 95 10.408 4.475 4.961 1.00 52.52 C ATOM 3355 C LEU B 95 9.060 4.339 5.660 1.00 31.45 C ATOM 3356 O LEU B 95 8.368 5.328 5.903 1.00 74.21 O ATOM 3357 CB LEU B 95 11.469 5.006 5.944 1.00 5.44 C ATOM 3358 CG LEU B 95 12.931 4.651 5.601 1.00 70.54 C ATOM 3359 CD1 LEU B 95 13.175 3.156 5.778 1.00 3.52 C ATOM 3360 CD2 LEU B 95 13.285 5.082 4.180 1.00 13.14 C ATOM 0 H LEU B 95 10.363 6.345 4.018 1.00 51.40 H new ATOM 0 HA LEU B 95 10.719 3.489 4.615 1.00 52.52 H new ATOM 0 HB2 LEU B 95 11.380 6.091 5.996 1.00 5.44 H new ATOM 0 HB3 LEU B 95 11.243 4.620 6.938 1.00 5.44 H new ATOM 0 HG LEU B 95 13.577 5.195 6.290 1.00 70.54 H new ATOM 0 HD11 LEU B 95 14.211 2.925 5.532 1.00 3.52 H new ATOM 0 HD12 LEU B 95 12.977 2.875 6.812 1.00 3.52 H new ATOM 0 HD13 LEU B 95 12.512 2.598 5.117 1.00 3.52 H new ATOM 0 HD21 LEU B 95 14.321 4.819 3.967 1.00 13.14 H new ATOM 0 HD22 LEU B 95 12.629 4.575 3.472 1.00 13.14 H new ATOM 0 HD23 LEU B 95 13.158 6.160 4.085 1.00 13.14 H new ATOM 3372 N ASP B 96 8.707 3.100 5.966 1.00 51.23 N ATOM 3373 CA ASP B 96 7.470 2.770 6.668 1.00 11.24 C ATOM 3374 C ASP B 96 7.804 2.036 7.953 1.00 14.30 C ATOM 3375 O ASP B 96 8.235 0.888 7.919 1.00 55.22 O ATOM 3376 CB ASP B 96 6.612 1.859 5.797 1.00 22.11 C ATOM 3377 CG ASP B 96 5.293 1.456 6.442 1.00 4.43 C ATOM 3378 OD1 ASP B 96 4.441 2.343 6.672 1.00 73.12 O ATOM 3379 OD2 ASP B 96 5.089 0.243 6.685 1.00 73.53 O1- ATOM 0 H ASP B 96 9.275 2.285 5.733 1.00 51.23 H new ATOM 0 HA ASP B 96 6.928 3.689 6.888 1.00 11.24 H new ATOM 0 HB2 ASP B 96 6.405 2.364 4.853 1.00 22.11 H new ATOM 0 HB3 ASP B 96 7.179 0.959 5.559 1.00 22.11 H new ATOM 3384 N VAL B 97 7.592 2.679 9.079 1.00 43.21 N ATOM 3385 CA VAL B 97 7.954 2.077 10.362 1.00 65.34 C ATOM 3386 C VAL B 97 6.710 1.669 11.141 1.00 4.12 C ATOM 3387 O VAL B 97 5.973 2.517 11.619 1.00 1.23 O ATOM 3388 CB VAL B 97 8.803 3.043 11.227 1.00 44.15 C ATOM 3389 CG1 VAL B 97 9.249 2.367 12.525 1.00 31.14 C ATOM 3390 CG2 VAL B 97 10.006 3.563 10.441 1.00 13.32 C ATOM 0 H VAL B 97 7.176 3.608 9.143 1.00 43.21 H new ATOM 0 HA VAL B 97 8.550 1.192 10.140 1.00 65.34 H new ATOM 0 HB VAL B 97 8.178 3.896 11.491 1.00 44.15 H new ATOM 0 HG11 VAL B 97 9.843 3.066 13.114 1.00 31.14 H new ATOM 0 HG12 VAL B 97 8.372 2.064 13.097 1.00 31.14 H new ATOM 0 HG13 VAL B 97 9.850 1.489 12.290 1.00 31.14 H new ATOM 0 HG21 VAL B 97 10.586 4.239 11.069 1.00 13.32 H new ATOM 0 HG22 VAL B 97 10.632 2.724 10.136 1.00 13.32 H new ATOM 0 HG23 VAL B 97 9.659 4.097 9.557 1.00 13.32 H new ATOM 3400 N GLU B 98 6.492 0.369 11.277 1.00 55.41 N ATOM 3401 CA GLU B 98 5.386 -0.146 12.073 1.00 61.25 C ATOM 3402 C GLU B 98 5.832 -0.305 13.516 1.00 55.42 C ATOM 3403 O GLU B 98 6.552 -1.250 13.848 1.00 74.01 O ATOM 3404 CB GLU B 98 4.899 -1.497 11.533 1.00 43.20 C ATOM 3405 CG GLU B 98 4.307 -1.431 10.132 1.00 33.43 C ATOM 3406 CD GLU B 98 3.725 -2.763 9.689 1.00 35.25 C ATOM 3407 OE1 GLU B 98 2.722 -3.205 10.289 1.00 70.42 O ATOM 3408 OE2 GLU B 98 4.255 -3.370 8.739 1.00 74.42 O1- ATOM 0 H GLU B 98 7.069 -0.352 10.844 1.00 55.41 H new ATOM 0 HA GLU B 98 4.560 0.563 12.015 1.00 61.25 H new ATOM 0 HB2 GLU B 98 5.734 -2.197 11.530 1.00 43.20 H new ATOM 0 HB3 GLU B 98 4.149 -1.899 12.214 1.00 43.20 H new ATOM 0 HG2 GLU B 98 3.528 -0.669 10.105 1.00 33.43 H new ATOM 0 HG3 GLU B 98 5.079 -1.122 9.428 1.00 33.43 H new ATOM 3415 N LEU B 99 5.430 0.624 14.372 1.00 61.12 N ATOM 3416 CA LEU B 99 5.823 0.567 15.770 1.00 54.24 C ATOM 3417 C LEU B 99 4.699 -0.064 16.585 1.00 51.12 C ATOM 3418 O LEU B 99 3.651 0.554 16.808 1.00 12.44 O ATOM 3419 CB LEU B 99 6.176 1.964 16.300 1.00 60.12 C ATOM 3420 CG LEU B 99 7.088 1.965 17.536 1.00 42.10 C ATOM 3421 CD1 LEU B 99 8.417 1.273 17.218 1.00 24.34 C ATOM 3422 CD2 LEU B 99 7.324 3.390 18.032 1.00 1.13 C ATOM 0 H LEU B 99 4.838 1.417 14.125 1.00 61.12 H new ATOM 0 HA LEU B 99 6.717 -0.049 15.865 1.00 54.24 H new ATOM 0 HB2 LEU B 99 6.663 2.528 15.505 1.00 60.12 H new ATOM 0 HB3 LEU B 99 5.253 2.490 16.545 1.00 60.12 H new ATOM 0 HG LEU B 99 6.592 1.409 18.332 1.00 42.10 H new ATOM 0 HD11 LEU B 99 9.053 1.282 18.103 1.00 24.34 H new ATOM 0 HD12 LEU B 99 8.228 0.243 16.917 1.00 24.34 H new ATOM 0 HD13 LEU B 99 8.918 1.802 16.407 1.00 24.34 H new ATOM 0 HD21 LEU B 99 7.972 3.368 18.908 1.00 1.13 H new ATOM 0 HD22 LEU B 99 7.798 3.976 17.244 1.00 1.13 H new ATOM 0 HD23 LEU B 99 6.370 3.845 18.298 1.00 1.13 H new ATOM 3434 N ARG B 100 4.926 -1.305 17.007 1.00 53.41 N ATOM 3435 CA ARG B 100 3.906 -2.110 17.673 1.00 2.45 C ATOM 3436 C ARG B 100 4.123 -2.129 19.180 1.00 14.01 C ATOM 3437 O ARG B 100 5.146 -2.616 19.665 1.00 24.14 O ATOM 3438 CB ARG B 100 3.925 -3.529 17.098 1.00 53.52 C ATOM 3439 CG ARG B 100 3.679 -3.543 15.595 1.00 13.43 C ATOM 3440 CD ARG B 100 3.869 -4.915 14.978 1.00 64.11 C ATOM 3441 NE ARG B 100 3.601 -4.885 13.536 1.00 3.43 N ATOM 3442 CZ ARG B 100 4.286 -5.579 12.627 1.00 52.33 C ATOM 3443 NH1 ARG B 100 5.201 -6.457 13.013 1.00 41.53 N1+ ATOM 3444 NH2 ARG B 100 4.046 -5.402 11.334 1.00 11.32 N ATOM 0 H ARG B 100 5.822 -1.781 16.897 1.00 53.41 H new ATOM 0 HA ARG B 100 2.927 -1.665 17.492 1.00 2.45 H new ATOM 0 HB2 ARG B 100 4.888 -3.993 17.311 1.00 53.52 H new ATOM 0 HB3 ARG B 100 3.164 -4.131 17.595 1.00 53.52 H new ATOM 0 HG2 ARG B 100 2.665 -3.198 15.395 1.00 13.43 H new ATOM 0 HG3 ARG B 100 4.357 -2.837 15.115 1.00 13.43 H new ATOM 0 HD2 ARG B 100 4.888 -5.259 15.155 1.00 64.11 H new ATOM 0 HD3 ARG B 100 3.203 -5.630 15.460 1.00 64.11 H new ATOM 0 HE ARG B 100 2.839 -4.293 13.206 1.00 3.43 H new ATOM 0 HH11 ARG B 100 5.382 -6.602 14.006 1.00 41.53 H new ATOM 0 HH12 ARG B 100 5.725 -6.987 12.317 1.00 41.53 H new ATOM 0 HH21 ARG B 100 3.336 -4.734 11.034 1.00 11.32 H new ATOM 0 HH22 ARG B 100 4.571 -5.934 10.640 1.00 11.32 H new ATOM 3458 N VAL B 101 3.150 -1.602 19.912 1.00 41.00 N ATOM 3459 CA VAL B 101 3.244 -1.477 21.364 1.00 50.20 C ATOM 3460 C VAL B 101 2.424 -2.561 22.057 1.00 3.30 C ATOM 3461 O VAL B 101 1.194 -2.514 22.047 1.00 1.54 O ATOM 3462 CB VAL B 101 2.746 -0.085 21.833 1.00 60.12 C ATOM 3463 CG1 VAL B 101 2.730 0.011 23.359 1.00 22.35 C ATOM 3464 CG2 VAL B 101 3.605 1.028 21.226 1.00 51.31 C ATOM 0 H VAL B 101 2.277 -1.250 19.520 1.00 41.00 H new ATOM 0 HA VAL B 101 4.294 -1.592 21.634 1.00 50.20 H new ATOM 0 HB VAL B 101 1.722 0.042 21.481 1.00 60.12 H new ATOM 0 HG11 VAL B 101 2.377 0.998 23.658 1.00 22.35 H new ATOM 0 HG12 VAL B 101 2.064 -0.751 23.765 1.00 22.35 H new ATOM 0 HG13 VAL B 101 3.738 -0.145 23.744 1.00 22.35 H new ATOM 0 HG21 VAL B 101 3.240 1.997 21.567 1.00 51.31 H new ATOM 0 HG22 VAL B 101 4.641 0.900 21.540 1.00 51.31 H new ATOM 0 HG23 VAL B 101 3.547 0.981 20.139 1.00 51.31 H new ATOM 3474 N ALA B 102 3.106 -3.537 22.647 1.00 24.03 N ATOM 3475 CA ALA B 102 2.441 -4.588 23.408 1.00 53.32 C ATOM 3476 C ALA B 102 2.609 -4.328 24.902 1.00 44.40 C ATOM 3477 O ALA B 102 3.670 -4.595 25.476 1.00 4.42 O ATOM 3478 CB ALA B 102 2.998 -5.959 23.033 1.00 42.24 C ATOM 0 H ALA B 102 4.122 -3.622 22.612 1.00 24.03 H new ATOM 0 HA ALA B 102 1.378 -4.580 23.166 1.00 53.32 H new ATOM 0 HB1 ALA B 102 2.489 -6.729 23.612 1.00 42.24 H new ATOM 0 HB2 ALA B 102 2.838 -6.138 21.970 1.00 42.24 H new ATOM 0 HB3 ALA B 102 4.066 -5.989 23.249 1.00 42.24 H new ATOM 3484 N LEU B 103 1.563 -3.800 25.525 1.00 61.44 N ATOM 3485 CA LEU B 103 1.598 -3.452 26.941 1.00 72.24 C ATOM 3486 C LEU B 103 0.536 -4.255 27.694 1.00 41.41 C ATOM 3487 O LEU B 103 -0.657 -4.132 27.413 1.00 40.11 O ATOM 3488 CB LEU B 103 1.371 -1.938 27.125 1.00 55.34 C ATOM 3489 CG LEU B 103 1.644 -1.388 28.541 1.00 34.43 C ATOM 3490 CD1 LEU B 103 3.105 -1.586 28.925 1.00 40.33 C ATOM 3491 CD2 LEU B 103 1.273 0.090 28.642 1.00 1.40 C ATOM 0 H LEU B 103 0.673 -3.602 25.068 1.00 61.44 H new ATOM 0 HA LEU B 103 2.578 -3.699 27.348 1.00 72.24 H new ATOM 0 HB2 LEU B 103 2.008 -1.405 26.419 1.00 55.34 H new ATOM 0 HB3 LEU B 103 0.339 -1.709 26.859 1.00 55.34 H new ATOM 0 HG LEU B 103 1.018 -1.947 29.237 1.00 34.43 H new ATOM 0 HD11 LEU B 103 3.275 -1.191 29.927 1.00 40.33 H new ATOM 0 HD12 LEU B 103 3.345 -2.649 28.909 1.00 40.33 H new ATOM 0 HD13 LEU B 103 3.742 -1.060 28.215 1.00 40.33 H new ATOM 0 HD21 LEU B 103 1.477 0.448 29.651 1.00 1.40 H new ATOM 0 HD22 LEU B 103 1.864 0.663 27.927 1.00 1.40 H new ATOM 0 HD23 LEU B 103 0.213 0.215 28.420 1.00 1.40 H new ATOM 3503 N PRO B 104 0.958 -5.099 28.653 1.00 3.11 N ATOM 3504 CA PRO B 104 0.043 -5.959 29.405 1.00 24.44 C ATOM 3505 C PRO B 104 -0.804 -5.167 30.393 1.00 5.10 C ATOM 3506 O PRO B 104 -0.382 -4.119 30.887 1.00 15.44 O ATOM 3507 CB PRO B 104 0.980 -6.921 30.139 1.00 10.11 C ATOM 3508 CG PRO B 104 2.248 -6.160 30.299 1.00 31.23 C ATOM 3509 CD PRO B 104 2.356 -5.269 29.090 1.00 74.24 C ATOM 0 HA PRO B 104 -0.675 -6.463 28.758 1.00 24.44 H new ATOM 0 HB2 PRO B 104 0.569 -7.215 31.105 1.00 10.11 H new ATOM 0 HB3 PRO B 104 1.136 -7.836 29.567 1.00 10.11 H new ATOM 0 HG2 PRO B 104 2.236 -5.572 31.217 1.00 31.23 H new ATOM 0 HG3 PRO B 104 3.102 -6.835 30.363 1.00 31.23 H new ATOM 0 HD2 PRO B 104 2.817 -4.313 29.338 1.00 74.24 H new ATOM 0 HD3 PRO B 104 2.966 -5.725 28.310 1.00 74.24 H new ATOM 3517 N GLY B 105 -1.996 -5.680 30.674 1.00 72.34 N ATOM 3518 CA GLY B 105 -2.907 -4.997 31.573 1.00 21.00 C ATOM 3519 C GLY B 105 -3.503 -3.752 30.940 1.00 53.31 C ATOM 3520 O GLY B 105 -4.076 -2.905 31.629 1.00 21.33 O ATOM 0 H GLY B 105 -2.348 -6.559 30.294 1.00 72.34 H new ATOM 0 HA2 GLY B 105 -3.709 -5.676 31.862 1.00 21.00 H new ATOM 0 HA3 GLY B 105 -2.378 -4.722 32.486 1.00 21.00 H new ATOM 3524 N LEU B 106 -3.369 -3.646 29.620 1.00 45.40 N ATOM 3525 CA LEU B 106 -3.826 -2.472 28.885 1.00 45.21 C ATOM 3526 C LEU B 106 -4.689 -2.867 27.688 1.00 60.53 C ATOM 3527 O LEU B 106 -4.394 -3.834 26.982 1.00 55.33 O ATOM 3528 CB LEU B 106 -2.620 -1.648 28.412 1.00 22.13 C ATOM 3529 CG LEU B 106 -2.933 -0.531 27.399 1.00 5.55 C ATOM 3530 CD1 LEU B 106 -3.898 0.496 27.991 1.00 53.52 C ATOM 3531 CD2 LEU B 106 -1.650 0.137 26.924 1.00 55.01 C ATOM 0 H LEU B 106 -2.944 -4.366 29.035 1.00 45.40 H new ATOM 0 HA LEU B 106 -4.437 -1.869 29.557 1.00 45.21 H new ATOM 0 HB2 LEU B 106 -2.144 -1.200 29.284 1.00 22.13 H new ATOM 0 HB3 LEU B 106 -1.892 -2.326 27.965 1.00 22.13 H new ATOM 0 HG LEU B 106 -3.421 -0.985 26.536 1.00 5.55 H new ATOM 0 HD11 LEU B 106 -4.101 1.272 27.253 1.00 53.52 H new ATOM 0 HD12 LEU B 106 -4.831 0.003 28.265 1.00 53.52 H new ATOM 0 HD13 LEU B 106 -3.452 0.946 28.878 1.00 53.52 H new ATOM 0 HD21 LEU B 106 -1.892 0.923 26.209 1.00 55.01 H new ATOM 0 HD22 LEU B 106 -1.128 0.571 27.777 1.00 55.01 H new ATOM 0 HD23 LEU B 106 -1.010 -0.604 26.445 1.00 55.01 H new ATOM 3543 N ASP B 107 -5.757 -2.108 27.479 1.00 0.12 N ATOM 3544 CA ASP B 107 -6.631 -2.279 26.323 1.00 50.41 C ATOM 3545 C ASP B 107 -6.108 -1.484 25.134 1.00 24.13 C ATOM 3546 O ASP B 107 -5.534 -0.410 25.304 1.00 45.41 O ATOM 3547 CB ASP B 107 -8.056 -1.825 26.661 1.00 1.44 C ATOM 3548 CG ASP B 107 -8.849 -2.890 27.398 1.00 20.21 C ATOM 3549 OD1 ASP B 107 -9.328 -3.836 26.741 1.00 63.12 O ATOM 3550 OD2 ASP B 107 -8.995 -2.792 28.639 1.00 14.11 O1- ATOM 0 H ASP B 107 -6.043 -1.356 28.106 1.00 0.12 H new ATOM 0 HA ASP B 107 -6.646 -3.337 26.061 1.00 50.41 H new ATOM 0 HB2 ASP B 107 -8.011 -0.923 27.272 1.00 1.44 H new ATOM 0 HB3 ASP B 107 -8.577 -1.561 25.741 1.00 1.44 H new ATOM 3555 N ALA B 108 -6.325 -2.011 23.931 1.00 12.24 N ATOM 3556 CA ALA B 108 -5.872 -1.366 22.701 1.00 21.33 C ATOM 3557 C ALA B 108 -6.487 0.024 22.550 1.00 4.44 C ATOM 3558 O ALA B 108 -5.830 0.962 22.082 1.00 12.01 O ATOM 3559 CB ALA B 108 -6.220 -2.233 21.497 1.00 34.32 C ATOM 0 H ALA B 108 -6.817 -2.892 23.782 1.00 12.24 H new ATOM 0 HA ALA B 108 -4.789 -1.250 22.755 1.00 21.33 H new ATOM 0 HB1 ALA B 108 -5.878 -1.743 20.585 1.00 34.32 H new ATOM 0 HB2 ALA B 108 -5.731 -3.203 21.593 1.00 34.32 H new ATOM 0 HB3 ALA B 108 -7.300 -2.374 21.450 1.00 34.32 H new ATOM 3565 N ALA B 109 -7.749 0.148 22.953 1.00 61.34 N ATOM 3566 CA ALA B 109 -8.469 1.416 22.873 1.00 64.51 C ATOM 3567 C ALA B 109 -7.717 2.518 23.615 1.00 34.40 C ATOM 3568 O ALA B 109 -7.455 3.590 23.063 1.00 22.24 O ATOM 3569 CB ALA B 109 -9.881 1.260 23.427 1.00 34.53 C ATOM 0 H ALA B 109 -8.297 -0.620 23.341 1.00 61.34 H new ATOM 0 HA ALA B 109 -8.538 1.705 21.824 1.00 64.51 H new ATOM 0 HB1 ALA B 109 -10.405 2.213 23.361 1.00 34.53 H new ATOM 0 HB2 ALA B 109 -10.418 0.509 22.847 1.00 34.53 H new ATOM 0 HB3 ALA B 109 -9.830 0.946 24.469 1.00 34.53 H new ATOM 3575 N ALA B 110 -7.363 2.240 24.866 1.00 13.42 N ATOM 3576 CA ALA B 110 -6.597 3.178 25.678 1.00 72.03 C ATOM 3577 C ALA B 110 -5.157 3.263 25.180 1.00 4.25 C ATOM 3578 O ALA B 110 -4.543 4.334 25.189 1.00 22.41 O ATOM 3579 CB ALA B 110 -6.635 2.763 27.145 1.00 4.12 C ATOM 0 H ALA B 110 -7.596 1.368 25.341 1.00 13.42 H new ATOM 0 HA ALA B 110 -7.049 4.166 25.588 1.00 72.03 H new ATOM 0 HB1 ALA B 110 -6.059 3.473 27.739 1.00 4.12 H new ATOM 0 HB2 ALA B 110 -7.668 2.752 27.493 1.00 4.12 H new ATOM 0 HB3 ALA B 110 -6.206 1.767 27.253 1.00 4.12 H new ATOM 3585 N ALA B 111 -4.630 2.130 24.726 1.00 64.14 N ATOM 3586 CA ALA B 111 -3.263 2.060 24.221 1.00 51.51 C ATOM 3587 C ALA B 111 -3.044 3.088 23.118 1.00 2.23 C ATOM 3588 O ALA B 111 -2.002 3.736 23.064 1.00 42.41 O ATOM 3589 CB ALA B 111 -2.950 0.657 23.714 1.00 4.22 C ATOM 0 H ALA B 111 -5.133 1.243 24.698 1.00 64.14 H new ATOM 0 HA ALA B 111 -2.584 2.289 25.042 1.00 51.51 H new ATOM 0 HB1 ALA B 111 -1.926 0.625 23.341 1.00 4.22 H new ATOM 0 HB2 ALA B 111 -3.062 -0.058 24.529 1.00 4.22 H new ATOM 0 HB3 ALA B 111 -3.638 0.399 22.908 1.00 4.22 H new ATOM 3595 N LYS B 112 -4.046 3.247 22.257 1.00 32.30 N ATOM 3596 CA LYS B 112 -3.981 4.221 21.170 1.00 34.20 C ATOM 3597 C LYS B 112 -3.688 5.626 21.695 1.00 24.41 C ATOM 3598 O LYS B 112 -2.914 6.372 21.092 1.00 32.01 O ATOM 3599 CB LYS B 112 -5.283 4.218 20.359 1.00 45.31 C ATOM 3600 CG LYS B 112 -5.478 2.961 19.513 1.00 74.45 C ATOM 3601 CD LYS B 112 -6.671 3.093 18.570 1.00 63.04 C ATOM 3602 CE LYS B 112 -6.822 1.876 17.663 1.00 72.33 C ATOM 3603 NZ LYS B 112 -7.125 0.638 18.430 1.00 62.21 N1+ ATOM 0 H LYS B 112 -4.914 2.713 22.291 1.00 32.30 H new ATOM 0 HA LYS B 112 -3.160 3.928 20.516 1.00 34.20 H new ATOM 0 HB2 LYS B 112 -6.126 4.320 21.042 1.00 45.31 H new ATOM 0 HB3 LYS B 112 -5.295 5.090 19.706 1.00 45.31 H new ATOM 0 HG2 LYS B 112 -4.575 2.769 18.933 1.00 74.45 H new ATOM 0 HG3 LYS B 112 -5.625 2.102 20.167 1.00 74.45 H new ATOM 0 HD2 LYS B 112 -7.582 3.224 19.154 1.00 63.04 H new ATOM 0 HD3 LYS B 112 -6.552 3.988 17.959 1.00 63.04 H new ATOM 0 HE2 LYS B 112 -7.619 2.059 16.942 1.00 72.33 H new ATOM 0 HE3 LYS B 112 -5.904 1.733 17.094 1.00 72.33 H new ATOM 0 HZ1 LYS B 112 -7.336 -0.137 17.769 1.00 62.21 H new ATOM 0 HZ2 LYS B 112 -6.303 0.381 19.014 1.00 62.21 H new ATOM 0 HZ3 LYS B 112 -7.948 0.803 19.044 1.00 62.21 H new ATOM 3617 N THR B 113 -4.290 5.983 22.827 1.00 71.03 N ATOM 3618 CA THR B 113 -4.098 7.312 23.394 1.00 12.30 C ATOM 3619 C THR B 113 -2.767 7.381 24.145 1.00 72.03 C ATOM 3620 O THR B 113 -2.098 8.416 24.144 1.00 34.03 O ATOM 3621 CB THR B 113 -5.273 7.725 24.326 1.00 51.23 C ATOM 3622 OG1 THR B 113 -5.429 9.152 24.319 1.00 15.33 O ATOM 3623 CG2 THR B 113 -5.058 7.266 25.765 1.00 55.23 C ATOM 0 H THR B 113 -4.909 5.376 23.364 1.00 71.03 H new ATOM 0 HA THR B 113 -4.078 8.021 22.567 1.00 12.30 H new ATOM 0 HB THR B 113 -6.169 7.238 23.940 1.00 51.23 H new ATOM 0 HG1 THR B 113 -6.172 9.403 24.907 1.00 15.33 H new ATOM 0 HG21 THR B 113 -5.905 7.578 26.377 1.00 55.23 H new ATOM 0 HG22 THR B 113 -4.972 6.180 25.791 1.00 55.23 H new ATOM 0 HG23 THR B 113 -4.144 7.712 26.156 1.00 55.23 H new ATOM 3631 N LEU B 114 -2.374 6.267 24.769 1.00 42.02 N ATOM 3632 CA LEU B 114 -1.110 6.204 25.503 1.00 34.43 C ATOM 3633 C LEU B 114 0.069 6.344 24.548 1.00 70.23 C ATOM 3634 O LEU B 114 1.045 7.033 24.843 1.00 14.10 O ATOM 3635 CB LEU B 114 -1.005 4.898 26.303 1.00 61.41 C ATOM 3636 CG LEU B 114 -2.121 4.669 27.339 1.00 44.12 C ATOM 3637 CD1 LEU B 114 -1.807 3.462 28.215 1.00 65.44 C ATOM 3638 CD2 LEU B 114 -2.342 5.916 28.194 1.00 20.12 C ATOM 0 H LEU B 114 -2.912 5.400 24.780 1.00 42.02 H new ATOM 0 HA LEU B 114 -1.085 7.035 26.208 1.00 34.43 H new ATOM 0 HB2 LEU B 114 -1.004 4.062 25.604 1.00 61.41 H new ATOM 0 HB3 LEU B 114 -0.045 4.883 26.819 1.00 61.41 H new ATOM 0 HG LEU B 114 -3.045 4.466 26.797 1.00 44.12 H new ATOM 0 HD11 LEU B 114 -2.609 3.320 28.939 1.00 65.44 H new ATOM 0 HD12 LEU B 114 -1.719 2.573 27.591 1.00 65.44 H new ATOM 0 HD13 LEU B 114 -0.868 3.629 28.742 1.00 65.44 H new ATOM 0 HD21 LEU B 114 -3.135 5.726 28.917 1.00 20.12 H new ATOM 0 HD22 LEU B 114 -1.421 6.163 28.723 1.00 20.12 H new ATOM 0 HD23 LEU B 114 -2.627 6.751 27.553 1.00 20.12 H new ATOM 3650 N VAL B 115 -0.044 5.705 23.392 1.00 61.11 N ATOM 3651 CA VAL B 115 0.983 5.787 22.364 1.00 23.35 C ATOM 3652 C VAL B 115 1.029 7.194 21.767 1.00 63.55 C ATOM 3653 O VAL B 115 2.098 7.677 21.379 1.00 10.54 O ATOM 3654 CB VAL B 115 0.743 4.739 21.247 1.00 32.23 C ATOM 3655 CG1 VAL B 115 1.760 4.887 20.116 1.00 53.51 C ATOM 3656 CG2 VAL B 115 0.797 3.328 21.830 1.00 32.34 C ATOM 0 H VAL B 115 -0.842 5.121 23.142 1.00 61.11 H new ATOM 0 HA VAL B 115 1.943 5.570 22.832 1.00 23.35 H new ATOM 0 HB VAL B 115 -0.248 4.914 20.828 1.00 32.23 H new ATOM 0 HG11 VAL B 115 1.563 4.137 19.350 1.00 53.51 H new ATOM 0 HG12 VAL B 115 1.677 5.882 19.680 1.00 53.51 H new ATOM 0 HG13 VAL B 115 2.766 4.747 20.511 1.00 53.51 H new ATOM 0 HG21 VAL B 115 0.627 2.600 21.037 1.00 32.34 H new ATOM 0 HG22 VAL B 115 1.776 3.156 22.277 1.00 32.34 H new ATOM 0 HG23 VAL B 115 0.026 3.220 22.593 1.00 32.34 H new ATOM 3666 N ASP B 116 -0.133 7.843 21.705 1.00 33.05 N ATOM 3667 CA ASP B 116 -0.230 9.219 21.206 1.00 4.03 C ATOM 3668 C ASP B 116 0.516 10.173 22.130 1.00 43.14 C ATOM 3669 O ASP B 116 1.464 10.842 21.715 1.00 21.31 O ATOM 3670 CB ASP B 116 -1.697 9.658 21.096 1.00 75.43 C ATOM 3671 CG ASP B 116 -1.854 11.035 20.460 1.00 20.42 C ATOM 3672 OD1 ASP B 116 -1.985 12.032 21.200 1.00 45.35 O ATOM 3673 OD2 ASP B 116 -1.844 11.121 19.213 1.00 32.45 O1- ATOM 0 H ASP B 116 -1.024 7.439 21.994 1.00 33.05 H new ATOM 0 HA ASP B 116 0.223 9.248 20.215 1.00 4.03 H new ATOM 0 HB2 ASP B 116 -2.248 8.925 20.506 1.00 75.43 H new ATOM 0 HB3 ASP B 116 -2.144 9.668 22.090 1.00 75.43 H new ATOM 3678 N ARG B 117 0.089 10.214 23.392 1.00 65.05 N ATOM 3679 CA ARG B 117 0.696 11.092 24.389 1.00 30.34 C ATOM 3680 C ARG B 117 2.189 10.794 24.527 1.00 41.22 C ATOM 3681 O ARG B 117 3.009 11.704 24.670 1.00 22.44 O ATOM 3682 CB ARG B 117 -0.024 10.950 25.741 1.00 5.33 C ATOM 3683 CG ARG B 117 -0.113 9.514 26.248 1.00 52.02 C ATOM 3684 CD ARG B 117 -1.075 9.360 27.430 1.00 70.20 C ATOM 3685 NE ARG B 117 -0.405 9.502 28.726 1.00 35.41 N ATOM 3686 CZ ARG B 117 -0.964 9.171 29.894 1.00 33.14 C ATOM 3687 NH1 ARG B 117 -2.244 8.820 29.953 1.00 12.31 N1+ ATOM 3688 NH2 ARG B 117 -0.250 9.215 31.006 1.00 12.43 N ATOM 0 H ARG B 117 -0.679 9.646 23.748 1.00 65.05 H new ATOM 0 HA ARG B 117 0.588 12.124 24.056 1.00 30.34 H new ATOM 0 HB2 ARG B 117 0.496 11.555 26.483 1.00 5.33 H new ATOM 0 HB3 ARG B 117 -1.032 11.355 25.649 1.00 5.33 H new ATOM 0 HG2 ARG B 117 -0.438 8.866 25.434 1.00 52.02 H new ATOM 0 HG3 ARG B 117 0.880 9.177 26.547 1.00 52.02 H new ATOM 0 HD2 ARG B 117 -1.865 10.107 27.350 1.00 70.20 H new ATOM 0 HD3 ARG B 117 -1.554 8.382 27.378 1.00 70.20 H new ATOM 0 HE ARG B 117 0.544 9.876 28.737 1.00 35.41 H new ATOM 0 HH11 ARG B 117 -2.808 8.802 29.103 1.00 12.31 H new ATOM 0 HH12 ARG B 117 -2.663 8.569 30.848 1.00 12.31 H new ATOM 0 HH21 ARG B 117 0.728 9.502 30.973 1.00 12.43 H new ATOM 0 HH22 ARG B 117 -0.678 8.962 31.897 1.00 12.43 H new ATOM 3702 N ALA B 118 2.531 9.513 24.466 1.00 61.11 N ATOM 3703 CA ALA B 118 3.929 9.086 24.470 1.00 4.01 C ATOM 3704 C ALA B 118 4.674 9.687 23.274 1.00 4.12 C ATOM 3705 O ALA B 118 5.775 10.225 23.411 1.00 22.32 O ATOM 3706 CB ALA B 118 4.017 7.563 24.450 1.00 4.44 C ATOM 0 H ALA B 118 1.859 8.748 24.413 1.00 61.11 H new ATOM 0 HA ALA B 118 4.402 9.446 25.384 1.00 4.01 H new ATOM 0 HB1 ALA B 118 5.064 7.259 24.453 1.00 4.44 H new ATOM 0 HB2 ALA B 118 3.519 7.158 25.331 1.00 4.44 H new ATOM 0 HB3 ALA B 118 3.531 7.182 23.552 1.00 4.44 H new ATOM 3712 N HIS B 119 4.048 9.614 22.098 1.00 53.54 N ATOM 3713 CA HIS B 119 4.603 10.197 20.879 1.00 31.05 C ATOM 3714 C HIS B 119 4.335 11.704 20.799 1.00 22.51 C ATOM 3715 O HIS B 119 4.492 12.311 19.739 1.00 73.21 O ATOM 3716 CB HIS B 119 4.057 9.471 19.640 1.00 24.30 C ATOM 3717 CG HIS B 119 4.746 8.165 19.365 1.00 50.32 C ATOM 3718 ND1 HIS B 119 4.454 6.998 20.036 1.00 33.22 N ATOM 3719 CD2 HIS B 119 5.749 7.860 18.509 1.00 55.12 C ATOM 3720 CE1 HIS B 119 5.250 6.035 19.604 1.00 74.31 C ATOM 3721 NE2 HIS B 119 6.047 6.533 18.676 1.00 22.51 N ATOM 0 H HIS B 119 3.148 9.152 21.966 1.00 53.54 H new ATOM 0 HA HIS B 119 5.685 10.064 20.908 1.00 31.05 H new ATOM 0 HB2 HIS B 119 2.991 9.290 19.774 1.00 24.30 H new ATOM 0 HB3 HIS B 119 4.163 10.120 18.771 1.00 24.30 H new ATOM 0 HD1 HIS B 119 3.736 6.893 20.753 1.00 33.22 H new ATOM 0 HD2 HIS B 119 6.228 8.539 17.819 1.00 55.12 H new ATOM 0 HE1 HIS B 119 5.249 5.012 19.952 1.00 74.31 H new ATOM 3730 N HIS B 120 3.923 12.297 21.914 1.00 35.12 N ATOM 3731 CA HIS B 120 3.698 13.741 21.986 1.00 61.52 C ATOM 3732 C HIS B 120 4.835 14.436 22.741 1.00 22.12 C ATOM 3733 O HIS B 120 5.266 15.527 22.367 1.00 21.30 O ATOM 3734 CB HIS B 120 2.358 14.037 22.674 1.00 61.10 C ATOM 3735 CG HIS B 120 2.018 15.497 22.748 1.00 45.20 C ATOM 3736 ND1 HIS B 120 2.010 16.215 23.925 1.00 23.40 N ATOM 3737 CD2 HIS B 120 1.664 16.372 21.779 1.00 61.34 C ATOM 3738 CE1 HIS B 120 1.666 17.462 23.674 1.00 14.23 C ATOM 3739 NE2 HIS B 120 1.451 17.587 22.378 1.00 33.30 N ATOM 0 H HIS B 120 3.737 11.800 22.785 1.00 35.12 H new ATOM 0 HA HIS B 120 3.671 14.129 20.968 1.00 61.52 H new ATOM 0 HB2 HIS B 120 1.564 13.516 22.139 1.00 61.10 H new ATOM 0 HB3 HIS B 120 2.382 13.629 23.684 1.00 61.10 H new ATOM 0 HD2 HIS B 120 1.567 16.154 20.726 1.00 61.34 H new ATOM 0 HE1 HIS B 120 1.575 18.250 24.407 1.00 14.23 H new ATOM 0 HE2 HIS B 120 1.173 18.445 21.901 1.00 33.30 H new ATOM 3748 N VAL B 121 5.320 13.793 23.799 1.00 53.34 N ATOM 3749 CA VAL B 121 6.313 14.403 24.688 1.00 2.11 C ATOM 3750 C VAL B 121 7.758 14.161 24.222 1.00 31.12 C ATOM 3751 O VAL B 121 8.588 15.072 24.269 1.00 43.14 O ATOM 3752 CB VAL B 121 6.145 13.897 26.146 1.00 52.03 C ATOM 3753 CG1 VAL B 121 4.805 14.348 26.725 1.00 41.33 C ATOM 3754 CG2 VAL B 121 6.274 12.375 26.217 1.00 63.42 C ATOM 0 H VAL B 121 5.043 12.848 24.065 1.00 53.34 H new ATOM 0 HA VAL B 121 6.129 15.477 24.653 1.00 2.11 H new ATOM 0 HB VAL B 121 6.944 14.334 26.746 1.00 52.03 H new ATOM 0 HG11 VAL B 121 4.709 13.982 27.747 1.00 41.33 H new ATOM 0 HG12 VAL B 121 4.756 15.437 26.723 1.00 41.33 H new ATOM 0 HG13 VAL B 121 3.993 13.947 26.118 1.00 41.33 H new ATOM 0 HG21 VAL B 121 6.152 12.047 27.249 1.00 63.42 H new ATOM 0 HG22 VAL B 121 5.504 11.915 25.597 1.00 63.42 H new ATOM 0 HG23 VAL B 121 7.258 12.076 25.855 1.00 63.42 H new ATOM 3764 N CYS B 122 8.064 12.942 23.781 1.00 64.23 N ATOM 3765 CA CYS B 122 9.436 12.578 23.419 1.00 24.42 C ATOM 3766 C CYS B 122 9.777 13.035 21.992 1.00 23.34 C ATOM 3767 O CYS B 122 8.978 12.844 21.073 1.00 74.53 O ATOM 3768 CB CYS B 122 9.627 11.064 23.552 1.00 15.34 C ATOM 3769 SG CYS B 122 9.195 10.410 25.181 1.00 14.44 S ATOM 0 H CYS B 122 7.384 12.191 23.665 1.00 64.23 H new ATOM 0 HA CYS B 122 10.115 13.087 24.103 1.00 24.42 H new ATOM 0 HB2 CYS B 122 9.019 10.564 22.798 1.00 15.34 H new ATOM 0 HB3 CYS B 122 10.667 10.819 23.337 1.00 15.34 H new ATOM 0 HG CYS B 122 9.182 9.111 25.137 1.00 14.44 H new ATOM 3775 N PRO B 123 10.972 13.641 21.790 1.00 45.45 N ATOM 3776 CA PRO B 123 11.414 14.142 20.472 1.00 1.30 C ATOM 3777 C PRO B 123 11.345 13.078 19.368 1.00 21.43 C ATOM 3778 O PRO B 123 10.644 13.255 18.366 1.00 1.12 O ATOM 3779 CB PRO B 123 12.870 14.565 20.722 1.00 65.25 C ATOM 3780 CG PRO B 123 12.929 14.872 22.179 1.00 12.41 C ATOM 3781 CD PRO B 123 11.980 13.906 22.840 1.00 30.51 C ATOM 0 HA PRO B 123 10.772 14.947 20.115 1.00 1.30 H new ATOM 0 HB2 PRO B 123 13.565 13.768 20.457 1.00 65.25 H new ATOM 0 HB3 PRO B 123 13.138 15.435 20.123 1.00 65.25 H new ATOM 0 HG2 PRO B 123 13.942 14.751 22.564 1.00 12.41 H new ATOM 0 HG3 PRO B 123 12.636 15.904 22.374 1.00 12.41 H new ATOM 0 HD2 PRO B 123 12.488 12.992 23.149 1.00 30.51 H new ATOM 0 HD3 PRO B 123 11.526 14.336 23.733 1.00 30.51 H new ATOM 3789 N TYR B 124 12.053 11.960 19.571 1.00 44.15 N ATOM 3790 CA TYR B 124 12.099 10.877 18.577 1.00 41.53 C ATOM 3791 C TYR B 124 10.721 10.245 18.396 1.00 41.03 C ATOM 3792 O TYR B 124 10.515 9.424 17.508 1.00 24.42 O ATOM 3793 CB TYR B 124 13.109 9.786 18.984 1.00 11.44 C ATOM 3794 CG TYR B 124 14.570 10.212 18.919 1.00 34.02 C ATOM 3795 CD1 TYR B 124 15.477 9.567 18.072 1.00 62.34 C ATOM 3796 CD2 TYR B 124 15.044 11.252 19.711 1.00 4.11 C ATOM 3797 CE1 TYR B 124 16.799 9.947 18.024 1.00 22.14 C ATOM 3798 CE2 TYR B 124 16.369 11.638 19.663 1.00 2.53 C ATOM 3799 CZ TYR B 124 17.242 10.985 18.822 1.00 65.35 C ATOM 3800 OH TYR B 124 18.563 11.371 18.784 1.00 21.31 O ATOM 0 H TYR B 124 12.601 11.781 20.412 1.00 44.15 H new ATOM 0 HA TYR B 124 12.419 11.320 17.634 1.00 41.53 H new ATOM 0 HB2 TYR B 124 12.884 9.463 20.001 1.00 11.44 H new ATOM 0 HB3 TYR B 124 12.968 8.921 18.336 1.00 11.44 H new ATOM 0 HD1 TYR B 124 15.134 8.757 17.445 1.00 62.34 H new ATOM 0 HD2 TYR B 124 14.365 11.766 20.375 1.00 4.11 H new ATOM 0 HE1 TYR B 124 17.487 9.437 17.366 1.00 22.14 H new ATOM 0 HE2 TYR B 124 16.719 12.450 20.283 1.00 2.53 H new ATOM 0 HH TYR B 124 19.042 10.832 18.121 1.00 21.31 H new ATOM 3845 N THR B 128 8.488 11.533 14.682 1.00 13.32 N ATOM 3846 CA THR B 128 8.549 10.273 13.954 1.00 55.14 C ATOM 3847 C THR B 128 7.203 10.009 13.297 1.00 13.14 C ATOM 3848 O THR B 128 7.100 9.258 12.334 1.00 21.45 O ATOM 3849 CB THR B 128 8.932 9.091 14.882 1.00 41.45 C ATOM 3850 OG1 THR B 128 9.500 8.022 14.117 1.00 41.22 O ATOM 3851 CG2 THR B 128 7.719 8.570 15.650 1.00 11.25 C ATOM 0 HA THR B 128 9.325 10.354 13.193 1.00 55.14 H new ATOM 0 HB THR B 128 9.665 9.461 15.598 1.00 41.45 H new ATOM 0 HG1 THR B 128 9.761 7.293 14.717 1.00 41.22 H new ATOM 0 HG21 THR B 128 8.022 7.742 16.291 1.00 11.25 H new ATOM 0 HG22 THR B 128 7.305 9.371 16.263 1.00 11.25 H new ATOM 0 HG23 THR B 128 6.963 8.225 14.945 1.00 11.25 H new ATOM 3859 N ARG B 129 6.168 10.664 13.816 1.00 41.51 N ATOM 3860 CA ARG B 129 4.819 10.470 13.324 1.00 75.21 C ATOM 3861 C ARG B 129 4.382 11.681 12.514 1.00 73.32 C ATOM 3862 O ARG B 129 3.852 11.556 11.410 1.00 44.41 O ATOM 3863 CB ARG B 129 3.862 10.234 14.502 1.00 21.01 C ATOM 3864 CG ARG B 129 3.838 11.343 15.550 1.00 45.10 C ATOM 3865 CD ARG B 129 2.771 11.086 16.607 1.00 21.21 C ATOM 3866 NE ARG B 129 2.714 12.154 17.609 1.00 2.44 N ATOM 3867 CZ ARG B 129 1.606 12.510 18.267 1.00 0.21 C ATOM 3868 NH1 ARG B 129 0.457 11.886 18.040 1.00 5.12 N1+ ATOM 3869 NH2 ARG B 129 1.656 13.490 19.160 1.00 44.44 N ATOM 0 H ARG B 129 6.245 11.335 14.580 1.00 41.51 H new ATOM 0 HA ARG B 129 4.796 9.594 12.676 1.00 75.21 H new ATOM 0 HB2 ARG B 129 2.853 10.104 14.110 1.00 21.01 H new ATOM 0 HB3 ARG B 129 4.136 9.299 14.991 1.00 21.01 H new ATOM 0 HG2 ARG B 129 4.815 11.416 16.027 1.00 45.10 H new ATOM 0 HG3 ARG B 129 3.648 12.300 15.065 1.00 45.10 H new ATOM 0 HD2 ARG B 129 1.799 10.992 16.123 1.00 21.21 H new ATOM 0 HD3 ARG B 129 2.974 10.136 17.102 1.00 21.21 H new ATOM 0 HE ARG B 129 3.576 12.658 17.818 1.00 2.44 H new ATOM 0 HH11 ARG B 129 0.414 11.128 17.359 1.00 5.12 H new ATOM 0 HH12 ARG B 129 -0.383 12.164 18.547 1.00 5.12 H new ATOM 0 HH21 ARG B 129 2.538 13.969 19.343 1.00 44.44 H new ATOM 0 HH22 ARG B 129 0.813 13.764 19.664 1.00 44.44 H new ATOM 3883 N ASN B 130 4.607 12.853 13.084 1.00 21.53 N ATOM 3884 CA ASN B 130 4.202 14.106 12.468 1.00 53.34 C ATOM 3885 C ASN B 130 5.167 14.533 11.372 1.00 22.35 C ATOM 3886 O ASN B 130 4.834 15.360 10.521 1.00 70.41 O ATOM 3887 CB ASN B 130 4.078 15.187 13.544 1.00 70.21 C ATOM 3888 CG ASN B 130 2.917 14.909 14.487 1.00 33.52 C ATOM 3889 OD1 ASN B 130 1.823 14.548 14.050 1.00 60.32 O ATOM 3890 ND2 ASN B 130 3.151 15.026 15.782 1.00 74.14 N ATOM 0 H ASN B 130 5.074 12.963 13.984 1.00 21.53 H new ATOM 0 HA ASN B 130 3.232 13.960 11.994 1.00 53.34 H new ATOM 0 HB2 ASN B 130 5.005 15.241 14.114 1.00 70.21 H new ATOM 0 HB3 ASN B 130 3.938 16.158 13.070 1.00 70.21 H new ATOM 0 HD21 ASN B 130 2.414 14.815 16.455 1.00 74.14 H new ATOM 0 HD22 ASN B 130 4.069 15.328 16.109 1.00 74.14 H new ATOM 3897 N ASN B 131 6.370 13.973 11.401 1.00 34.23 N ATOM 3898 CA ASN B 131 7.407 14.327 10.434 1.00 31.43 C ATOM 3899 C ASN B 131 7.735 13.138 9.529 1.00 54.44 C ATOM 3900 O ASN B 131 7.946 13.297 8.324 1.00 13.44 O ATOM 3901 CB ASN B 131 8.672 14.797 11.169 1.00 3.33 C ATOM 3902 CG ASN B 131 9.662 15.479 10.240 1.00 61.21 C ATOM 3903 OD1 ASN B 131 10.554 14.845 9.684 1.00 75.43 O ATOM 3904 ND2 ASN B 131 9.507 16.782 10.067 1.00 34.33 N ATOM 0 H ASN B 131 6.654 13.271 12.084 1.00 34.23 H new ATOM 0 HA ASN B 131 7.034 15.139 9.810 1.00 31.43 H new ATOM 0 HB2 ASN B 131 8.391 15.486 11.965 1.00 3.33 H new ATOM 0 HB3 ASN B 131 9.153 13.941 11.643 1.00 3.33 H new ATOM 0 HD21 ASN B 131 10.141 17.294 9.454 1.00 34.33 H new ATOM 0 HD22 ASN B 131 8.753 17.274 10.547 1.00 34.33 H new ATOM 3911 N VAL B 132 7.749 11.945 10.118 1.00 52.13 N ATOM 3912 CA VAL B 132 8.142 10.722 9.412 1.00 11.30 C ATOM 3913 C VAL B 132 6.941 9.775 9.309 1.00 11.32 C ATOM 3914 O VAL B 132 5.895 10.028 9.912 1.00 35.23 O ATOM 3915 CB VAL B 132 9.329 10.030 10.147 1.00 15.30 C ATOM 3916 CG1 VAL B 132 9.937 8.905 9.307 1.00 32.53 C ATOM 3917 CG2 VAL B 132 10.397 11.059 10.527 1.00 3.12 C ATOM 0 H VAL B 132 7.490 11.796 11.093 1.00 52.13 H new ATOM 0 HA VAL B 132 8.471 10.980 8.406 1.00 11.30 H new ATOM 0 HB VAL B 132 8.936 9.580 11.059 1.00 15.30 H new ATOM 0 HG11 VAL B 132 10.761 8.447 9.854 1.00 32.53 H new ATOM 0 HG12 VAL B 132 9.176 8.152 9.101 1.00 32.53 H new ATOM 0 HG13 VAL B 132 10.307 9.313 8.366 1.00 32.53 H new ATOM 0 HG21 VAL B 132 11.219 10.558 11.039 1.00 3.12 H new ATOM 0 HG22 VAL B 132 10.773 11.543 9.626 1.00 3.12 H new ATOM 0 HG23 VAL B 132 9.961 11.809 11.187 1.00 3.12 H new ATOM 3927 N ALA B 133 7.079 8.702 8.533 1.00 53.04 N ATOM 3928 CA ALA B 133 5.982 7.764 8.313 1.00 53.01 C ATOM 3929 C ALA B 133 6.089 6.551 9.228 1.00 72.23 C ATOM 3930 O ALA B 133 6.697 5.523 8.885 1.00 0.23 O ATOM 3931 CB ALA B 133 5.931 7.344 6.849 1.00 11.23 C ATOM 0 H ALA B 133 7.942 8.461 8.045 1.00 53.04 H new ATOM 0 HA ALA B 133 5.050 8.272 8.561 1.00 53.01 H new ATOM 0 HB1 ALA B 133 5.108 6.645 6.700 1.00 11.23 H new ATOM 0 HB2 ALA B 133 5.778 8.223 6.223 1.00 11.23 H new ATOM 0 HB3 ALA B 133 6.870 6.863 6.575 1.00 11.23 H new ATOM 3937 N VAL B 134 5.495 6.683 10.402 1.00 34.41 N ATOM 3938 CA VAL B 134 5.461 5.609 11.373 1.00 31.34 C ATOM 3939 C VAL B 134 4.024 5.172 11.651 1.00 33.12 C ATOM 3940 O VAL B 134 3.211 5.940 12.180 1.00 12.15 O ATOM 3941 CB VAL B 134 6.149 6.017 12.694 1.00 33.43 C ATOM 3942 CG1 VAL B 134 5.978 4.928 13.743 1.00 61.10 C ATOM 3943 CG2 VAL B 134 7.629 6.312 12.455 1.00 5.41 C ATOM 0 H VAL B 134 5.025 7.536 10.706 1.00 34.41 H new ATOM 0 HA VAL B 134 6.011 4.770 10.945 1.00 31.34 H new ATOM 0 HB VAL B 134 5.675 6.925 13.066 1.00 33.43 H new ATOM 0 HG11 VAL B 134 6.469 5.233 14.667 1.00 61.10 H new ATOM 0 HG12 VAL B 134 4.916 4.768 13.932 1.00 61.10 H new ATOM 0 HG13 VAL B 134 6.426 4.002 13.382 1.00 61.10 H new ATOM 0 HG21 VAL B 134 8.100 6.598 13.396 1.00 5.41 H new ATOM 0 HG22 VAL B 134 8.118 5.422 12.061 1.00 5.41 H new ATOM 0 HG23 VAL B 134 7.726 7.127 11.738 1.00 5.41 H new ATOM 3953 N ARG B 135 3.727 3.939 11.269 1.00 11.21 N ATOM 3954 CA ARG B 135 2.458 3.303 11.567 1.00 24.23 C ATOM 3955 C ARG B 135 2.410 2.952 13.051 1.00 24.22 C ATOM 3956 O ARG B 135 3.025 1.975 13.489 1.00 54.44 O ATOM 3957 CB ARG B 135 2.300 2.034 10.714 1.00 74.32 C ATOM 3958 CG ARG B 135 0.974 1.296 10.905 1.00 34.13 C ATOM 3959 CD ARG B 135 0.950 -0.011 10.120 1.00 2.43 C ATOM 3960 NE ARG B 135 -0.367 -0.652 10.136 1.00 1.50 N ATOM 3961 CZ ARG B 135 -0.625 -1.846 9.595 1.00 23.13 C ATOM 3962 NH1 ARG B 135 0.362 -2.604 9.138 1.00 1.54 N1+ ATOM 3963 NH2 ARG B 135 -1.868 -2.303 9.558 1.00 14.33 N ATOM 0 H ARG B 135 4.368 3.349 10.739 1.00 11.21 H new ATOM 0 HA ARG B 135 1.640 3.984 11.333 1.00 24.23 H new ATOM 0 HB2 ARG B 135 2.402 2.304 9.663 1.00 74.32 H new ATOM 0 HB3 ARG B 135 3.117 1.351 10.948 1.00 74.32 H new ATOM 0 HG2 ARG B 135 0.819 1.090 11.964 1.00 34.13 H new ATOM 0 HG3 ARG B 135 0.151 1.933 10.581 1.00 34.13 H new ATOM 0 HD2 ARG B 135 1.243 0.183 9.088 1.00 2.43 H new ATOM 0 HD3 ARG B 135 1.688 -0.695 10.538 1.00 2.43 H new ATOM 0 HE ARG B 135 -1.135 -0.156 10.588 1.00 1.50 H new ATOM 0 HH11 ARG B 135 1.326 -2.277 9.198 1.00 1.54 H new ATOM 0 HH12 ARG B 135 0.157 -3.514 8.726 1.00 1.54 H new ATOM 0 HH21 ARG B 135 -2.629 -1.743 9.943 1.00 14.33 H new ATOM 0 HH22 ARG B 135 -2.064 -3.215 9.145 1.00 14.33 H new ATOM 3977 N LEU B 136 1.732 3.786 13.827 1.00 62.51 N ATOM 3978 CA LEU B 136 1.552 3.534 15.247 1.00 72.41 C ATOM 3979 C LEU B 136 0.490 2.466 15.453 1.00 41.21 C ATOM 3980 O LEU B 136 -0.700 2.706 15.249 1.00 33.52 O ATOM 3981 CB LEU B 136 1.185 4.832 15.975 1.00 60.04 C ATOM 3982 CG LEU B 136 2.336 5.846 16.075 1.00 34.22 C ATOM 3983 CD1 LEU B 136 1.867 7.146 16.729 1.00 41.31 C ATOM 3984 CD2 LEU B 136 3.503 5.241 16.851 1.00 0.00 C ATOM 0 H LEU B 136 1.296 4.646 13.494 1.00 62.51 H new ATOM 0 HA LEU B 136 2.488 3.169 15.669 1.00 72.41 H new ATOM 0 HB2 LEU B 136 0.347 5.300 15.459 1.00 60.04 H new ATOM 0 HB3 LEU B 136 0.843 4.587 16.981 1.00 60.04 H new ATOM 0 HG LEU B 136 2.673 6.084 15.066 1.00 34.22 H new ATOM 0 HD11 LEU B 136 2.701 7.845 16.787 1.00 41.31 H new ATOM 0 HD12 LEU B 136 1.066 7.585 16.134 1.00 41.31 H new ATOM 0 HD13 LEU B 136 1.499 6.936 17.733 1.00 41.31 H new ATOM 0 HD21 LEU B 136 4.313 5.968 16.916 1.00 0.00 H new ATOM 0 HD22 LEU B 136 3.173 4.975 17.855 1.00 0.00 H new ATOM 0 HD23 LEU B 136 3.858 4.348 16.337 1.00 0.00 H new ATOM 3996 N VAL B 137 0.940 1.284 15.839 1.00 22.01 N ATOM 3997 CA VAL B 137 0.071 0.124 15.972 1.00 61.13 C ATOM 3998 C VAL B 137 0.146 -0.436 17.392 1.00 31.22 C ATOM 3999 O VAL B 137 1.208 -0.843 17.865 1.00 63.04 O ATOM 4000 CB VAL B 137 0.433 -0.954 14.909 1.00 72.22 C ATOM 4001 CG1 VAL B 137 1.919 -0.887 14.561 1.00 20.11 C ATOM 4002 CG2 VAL B 137 0.047 -2.362 15.376 1.00 5.14 C ATOM 0 H VAL B 137 1.917 1.100 16.069 1.00 22.01 H new ATOM 0 HA VAL B 137 -0.959 0.431 15.790 1.00 61.13 H new ATOM 0 HB VAL B 137 -0.145 -0.738 14.010 1.00 72.22 H new ATOM 0 HG11 VAL B 137 2.153 -1.648 13.817 1.00 20.11 H new ATOM 0 HG12 VAL B 137 2.154 0.098 14.159 1.00 20.11 H new ATOM 0 HG13 VAL B 137 2.511 -1.064 15.459 1.00 20.11 H new ATOM 0 HG21 VAL B 137 0.315 -3.087 14.607 1.00 5.14 H new ATOM 0 HG22 VAL B 137 0.578 -2.598 16.298 1.00 5.14 H new ATOM 0 HG23 VAL B 137 -1.027 -2.404 15.555 1.00 5.14 H new ATOM 4012 N VAL B 138 -0.988 -0.421 18.071 1.00 51.04 N ATOM 4013 CA VAL B 138 -1.074 -0.846 19.461 1.00 24.22 C ATOM 4014 C VAL B 138 -1.607 -2.270 19.558 1.00 70.52 C ATOM 4015 O VAL B 138 -2.508 -2.667 18.808 1.00 62.24 O ATOM 4016 CB VAL B 138 -1.952 0.101 20.306 1.00 51.45 C ATOM 4017 CG1 VAL B 138 -1.618 1.556 20.004 1.00 13.13 C ATOM 4018 CG2 VAL B 138 -3.428 -0.190 20.087 1.00 0.20 C ATOM 0 H VAL B 138 -1.877 -0.114 17.676 1.00 51.04 H new ATOM 0 HA VAL B 138 -0.062 -0.812 19.865 1.00 24.22 H new ATOM 0 HB VAL B 138 -1.736 -0.077 21.359 1.00 51.45 H new ATOM 0 HG11 VAL B 138 -2.248 2.207 20.610 1.00 13.13 H new ATOM 0 HG12 VAL B 138 -0.570 1.745 20.238 1.00 13.13 H new ATOM 0 HG13 VAL B 138 -1.797 1.759 18.948 1.00 13.13 H new ATOM 0 HG21 VAL B 138 -4.027 0.490 20.693 1.00 0.20 H new ATOM 0 HG22 VAL B 138 -3.674 -0.050 19.034 1.00 0.20 H new ATOM 0 HG23 VAL B 138 -3.643 -1.219 20.376 1.00 0.20 H new ATOM 4028 N ALA B 139 -1.010 -3.041 20.441 1.00 41.23 N ATOM 4029 CA ALA B 139 -1.358 -4.449 20.615 1.00 52.34 C ATOM 4030 C ALA B 139 -2.225 -4.636 21.866 1.00 22.31 C ATOM 4031 O ALA B 139 -3.464 -4.761 21.723 1.00 10.42 O ATOM 4032 CB ALA B 139 -0.095 -5.304 20.690 1.00 71.35 C ATOM 4033 OXT ALA B 139 -1.669 -4.646 22.984 1.00 0.00 O1- ATOM 0 H ALA B 139 -0.269 -2.717 21.062 1.00 41.23 H new ATOM 0 HA ALA B 139 -1.937 -4.776 19.751 1.00 52.34 H new ATOM 0 HB1 ALA B 139 -0.371 -6.350 20.820 1.00 71.35 H new ATOM 0 HB2 ALA B 139 0.476 -5.191 19.769 1.00 71.35 H new ATOM 0 HB3 ALA B 139 0.513 -4.982 21.535 1.00 71.35 H new