USER MOD reduce.3.24.130724 H: found=0, std=0, add=1218, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1221 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 128 HIS : no HD1:sc= -0.14 X(o=-1.4,f=-1.3) USER MOD Set 1.2: A 131 THR OG1 : rot -130:sc= -1.28 USER MOD Set 2.1: A 115 ASN : amide:sc= -2.49! C(o=-1.7!,f=-3.2!) USER MOD Set 2.2: A 118 THR OG1 : rot 166:sc= 0.529 USER MOD Set 2.3: A 137 TYR OH : rot -122:sc= 0.304 USER MOD Set 3.1: A 99 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 114 ASN :FLIP amide:sc= -6.14! F(o=-7.8,f=-6.1!) USER MOD Set 4.1: A 51 TYR OH : rot 143:sc= 0.864 USER MOD Set 4.2: A 60 SER OG : rot -86:sc= 1.63 USER MOD Set 5.1: A 52 TYR OH : rot 142:sc= -0.283 USER MOD Set 5.2: A 57 HIS : no HE2:sc= -0.395 K(o=-0.68,f=-3.9) USER MOD Set 6.1: A 28 GLN :FLIP amide:sc= 0.374 F(o=-7.8,f=-6.2) USER MOD Set 6.2: A 35 GLN :FLIP amide:sc= -6.59! C(o=-7.8!,f=-6.2!) USER MOD Set 7.1: A 0 SER N :NH3+ 145:sc= -1.14 (180deg=-3.15!) USER MOD Set 7.2: A 129 TYR OH : rot 165:sc= -5.25! USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 170:sc= -3.46 USER MOD Single : A 7 TYR OH : rot -172:sc= -3.75! USER MOD Single : A 8 ASN :FLIP amide:sc= 0.143! F(o=-0.79,f=0.14!) USER MOD Single : A 10 GLN : amide:sc= -0.785 X(o=-0.79,f=-0.88) USER MOD Single : A 13 ASN : amide:sc= -4.67! C(o=-4.7!,f=-6.3!) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -111:sc= 0.93 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ -109:sc= -6.67! (180deg=-11.6!) USER MOD Single : A 31 GLN : amide:sc= -0.0506 X(o=-0.051,f=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.502 USER MOD Single : A 49 HIS : no HE2:sc= -5.69! C(o=-5.7!,f=-8.4!) USER MOD Single : A 54 HIS :FLIP no HE2:sc= -0.456 F(o=-1.4,f=-0.46) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ -136:sc= -4.44! (180deg=-8.77!) USER MOD Single : A 67 SER OG : rot -51:sc= 0.498 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0568 USER MOD Single : A 75 SER OG : rot -56:sc= 0.159 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 51:sc= 0.00498 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0.00509 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN :FLIP amide:sc= -3.45! C(o=-4.1!,f=-3.4!) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.27 USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 106 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.00524) USER MOD Single : A 108 SER OG : rot 180:sc= -1.46 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 TYR OH : rot -2:sc= 0.21 USER MOD Single : A 112 TYR OH : rot 130:sc= 1.12 USER MOD Single : A 116 CYS SG : rot 180:sc= 0.0641 USER MOD Single : A 121 ASN :FLIP amide:sc= -1.64 F(o=-4.3!,f=-1.6) USER MOD Single : A 124 SER OG : rot -44:sc= -4.36 USER MOD Single : A 135 SER OG : rot -21:sc= -3.08! USER MOD Single : A 144 ASN : amide:sc= -0.116 X(o=-0.12,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 0 3.905 0.816 -1.466 1.00 32.14 N ATOM 2 CA SER A 0 2.780 1.448 -2.134 1.00 44.32 C ATOM 3 C SER A 0 2.276 0.554 -3.269 1.00 12.14 C ATOM 4 O SER A 0 2.390 0.909 -4.441 1.00 31.51 O ATOM 5 CB SER A 0 3.166 2.826 -2.676 1.00 51.20 C ATOM 6 OG SER A 0 2.044 3.521 -3.215 1.00 64.34 O ATOM 0 H1 SER A 0 4.583 1.544 -1.163 1.00 32.14 H new ATOM 0 H2 SER A 0 3.565 0.292 -0.634 1.00 32.14 H new ATOM 0 H3 SER A 0 4.373 0.158 -2.122 1.00 32.14 H new ATOM 0 HA SER A 0 1.981 1.584 -1.405 1.00 44.32 H new ATOM 0 HB2 SER A 0 3.610 3.419 -1.876 1.00 51.20 H new ATOM 0 HB3 SER A 0 3.927 2.712 -3.448 1.00 51.20 H new ATOM 0 HG SER A 0 2.331 4.396 -3.549 1.00 64.34 H new ATOM 12 N MET A 1 1.729 -0.588 -2.880 1.00 34.22 N ATOM 13 CA MET A 1 1.206 -1.536 -3.849 1.00 42.14 C ATOM 14 C MET A 1 2.199 -1.755 -4.993 1.00 3.54 C ATOM 15 O MET A 1 1.811 -2.157 -6.088 1.00 63.31 O ATOM 16 CB MET A 1 -0.116 -1.012 -4.414 1.00 63.13 C ATOM 17 CG MET A 1 -1.171 -2.119 -4.456 1.00 31.12 C ATOM 18 SD MET A 1 -2.768 -1.426 -4.852 1.00 4.13 S ATOM 19 CE MET A 1 -2.913 -1.936 -6.556 1.00 50.11 C ATOM 0 H MET A 1 1.637 -0.878 -1.907 1.00 34.22 H new ATOM 0 HA MET A 1 1.044 -2.489 -3.346 1.00 42.14 H new ATOM 0 HB2 MET A 1 -0.475 -0.185 -3.801 1.00 63.13 H new ATOM 0 HB3 MET A 1 0.044 -0.619 -5.418 1.00 63.13 H new ATOM 0 HG2 MET A 1 -0.896 -2.867 -5.199 1.00 31.12 H new ATOM 0 HG3 MET A 1 -1.215 -2.628 -3.493 1.00 31.12 H new ATOM 0 HE1 MET A 1 -3.861 -1.583 -6.962 1.00 50.11 H new ATOM 0 HE2 MET A 1 -2.091 -1.513 -7.134 1.00 50.11 H new ATOM 0 HE3 MET A 1 -2.875 -3.024 -6.615 1.00 50.11 H new ATOM 29 N LEU A 2 3.461 -1.479 -4.698 1.00 64.32 N ATOM 30 CA LEU A 2 4.513 -1.641 -5.688 1.00 1.22 C ATOM 31 C LEU A 2 4.708 -3.130 -5.980 1.00 3.13 C ATOM 32 O LEU A 2 5.123 -3.889 -5.105 1.00 11.52 O ATOM 33 CB LEU A 2 5.790 -0.931 -5.233 1.00 51.45 C ATOM 34 CG LEU A 2 6.941 -0.910 -6.241 1.00 60.52 C ATOM 35 CD1 LEU A 2 6.696 0.133 -7.333 1.00 74.41 C ATOM 36 CD2 LEU A 2 8.283 -0.698 -5.537 1.00 34.21 C ATOM 0 H LEU A 2 3.779 -1.144 -3.788 1.00 64.32 H new ATOM 0 HA LEU A 2 4.229 -1.166 -6.627 1.00 1.22 H new ATOM 0 HB2 LEU A 2 5.538 0.098 -4.977 1.00 51.45 H new ATOM 0 HB3 LEU A 2 6.142 -1.409 -4.319 1.00 51.45 H new ATOM 0 HG LEU A 2 6.984 -1.883 -6.730 1.00 60.52 H new ATOM 0 HD11 LEU A 2 7.529 0.127 -8.036 1.00 74.41 H new ATOM 0 HD12 LEU A 2 5.773 -0.104 -7.862 1.00 74.41 H new ATOM 0 HD13 LEU A 2 6.611 1.121 -6.880 1.00 74.41 H new ATOM 0 HD21 LEU A 2 9.084 -0.687 -6.276 1.00 34.21 H new ATOM 0 HD22 LEU A 2 8.268 0.253 -5.004 1.00 34.21 H new ATOM 0 HD23 LEU A 2 8.454 -1.508 -4.828 1.00 34.21 H new ATOM 48 N THR A 3 4.400 -3.504 -7.213 1.00 3.21 N ATOM 49 CA THR A 3 4.537 -4.889 -7.631 1.00 53.42 C ATOM 50 C THR A 3 5.997 -5.205 -7.961 1.00 53.32 C ATOM 51 O THR A 3 6.881 -4.381 -7.732 1.00 40.11 O ATOM 52 CB THR A 3 3.584 -5.124 -8.805 1.00 33.13 C ATOM 53 OG1 THR A 3 4.091 -4.284 -9.838 1.00 22.11 O ATOM 54 CG2 THR A 3 2.179 -4.579 -8.537 1.00 44.33 C ATOM 0 H THR A 3 4.056 -2.872 -7.936 1.00 3.21 H new ATOM 0 HA THR A 3 4.263 -5.574 -6.828 1.00 53.42 H new ATOM 0 HB THR A 3 3.525 -6.192 -9.016 1.00 33.13 H new ATOM 0 HG1 THR A 3 3.636 -4.491 -10.681 1.00 22.11 H new ATOM 0 HG21 THR A 3 1.543 -4.772 -9.401 1.00 44.33 H new ATOM 0 HG22 THR A 3 1.759 -5.072 -7.660 1.00 44.33 H new ATOM 0 HG23 THR A 3 2.233 -3.505 -8.359 1.00 44.33 H new ATOM 62 N LEU A 4 6.204 -6.400 -8.494 1.00 42.21 N ATOM 63 CA LEU A 4 7.542 -6.835 -8.858 1.00 50.10 C ATOM 64 C LEU A 4 7.960 -6.149 -10.160 1.00 4.52 C ATOM 65 O LEU A 4 9.079 -5.649 -10.271 1.00 13.45 O ATOM 66 CB LEU A 4 7.611 -8.362 -8.918 1.00 73.24 C ATOM 67 CG LEU A 4 9.012 -8.967 -9.025 1.00 2.14 C ATOM 68 CD1 LEU A 4 9.803 -8.321 -10.163 1.00 43.55 C ATOM 69 CD2 LEU A 4 9.752 -8.875 -7.688 1.00 52.45 C ATOM 0 H LEU A 4 5.468 -7.081 -8.683 1.00 42.21 H new ATOM 0 HA LEU A 4 8.261 -6.536 -8.095 1.00 50.10 H new ATOM 0 HB2 LEU A 4 7.131 -8.763 -8.025 1.00 73.24 H new ATOM 0 HB3 LEU A 4 7.025 -8.699 -9.773 1.00 73.24 H new ATOM 0 HG LEU A 4 8.910 -10.025 -9.265 1.00 2.14 H new ATOM 0 HD11 LEU A 4 10.795 -8.769 -10.217 1.00 43.55 H new ATOM 0 HD12 LEU A 4 9.281 -8.481 -11.106 1.00 43.55 H new ATOM 0 HD13 LEU A 4 9.898 -7.251 -9.978 1.00 43.55 H new ATOM 0 HD21 LEU A 4 10.745 -9.312 -7.791 1.00 52.45 H new ATOM 0 HD22 LEU A 4 9.844 -7.829 -7.394 1.00 52.45 H new ATOM 0 HD23 LEU A 4 9.194 -9.418 -6.925 1.00 52.45 H new ATOM 81 N PRO A 5 7.015 -6.146 -11.138 1.00 25.41 N ATOM 82 CA PRO A 5 7.275 -5.530 -12.428 1.00 13.33 C ATOM 83 C PRO A 5 7.223 -4.004 -12.326 1.00 51.13 C ATOM 84 O PRO A 5 7.568 -3.303 -13.276 1.00 43.12 O ATOM 85 CB PRO A 5 6.215 -6.100 -13.356 1.00 41.34 C ATOM 86 CG PRO A 5 5.123 -6.651 -12.454 1.00 60.03 C ATOM 87 CD PRO A 5 5.680 -6.729 -11.042 1.00 41.12 C ATOM 0 HA PRO A 5 8.274 -5.748 -12.805 1.00 13.33 H new ATOM 0 HB2 PRO A 5 5.822 -5.330 -14.019 1.00 41.34 H new ATOM 0 HB3 PRO A 5 6.631 -6.884 -13.989 1.00 41.34 H new ATOM 0 HG2 PRO A 5 4.244 -6.008 -12.482 1.00 60.03 H new ATOM 0 HG3 PRO A 5 4.808 -7.637 -12.795 1.00 60.03 H new ATOM 0 HD2 PRO A 5 5.056 -6.177 -10.339 1.00 41.12 H new ATOM 0 HD3 PRO A 5 5.722 -7.759 -10.689 1.00 41.12 H new ATOM 95 N GLU A 6 6.789 -3.534 -11.166 1.00 34.30 N ATOM 96 CA GLU A 6 6.687 -2.104 -10.928 1.00 23.50 C ATOM 97 C GLU A 6 8.010 -1.562 -10.383 1.00 40.11 C ATOM 98 O GLU A 6 8.436 -0.469 -10.753 1.00 63.11 O ATOM 99 CB GLU A 6 5.531 -1.787 -9.977 1.00 64.51 C ATOM 100 CG GLU A 6 4.200 -1.739 -10.729 1.00 50.04 C ATOM 101 CD GLU A 6 3.976 -0.362 -11.358 1.00 75.44 C ATOM 102 OE1 GLU A 6 3.709 0.612 -10.639 1.00 71.21 O ATOM 103 OE2 GLU A 6 4.088 -0.325 -12.643 1.00 31.00 O ATOM 0 H GLU A 6 6.504 -4.118 -10.380 1.00 34.30 H new ATOM 0 HA GLU A 6 6.478 -1.611 -11.877 1.00 23.50 H new ATOM 0 HB2 GLU A 6 5.483 -2.543 -9.193 1.00 64.51 H new ATOM 0 HB3 GLU A 6 5.711 -0.830 -9.487 1.00 64.51 H new ATOM 0 HG2 GLU A 6 4.189 -2.504 -11.506 1.00 50.04 H new ATOM 0 HG3 GLU A 6 3.383 -1.968 -10.045 1.00 50.04 H new ATOM 111 N TYR A 7 8.623 -2.351 -9.513 1.00 14.24 N ATOM 112 CA TYR A 7 9.888 -1.963 -8.913 1.00 62.20 C ATOM 113 C TYR A 7 11.064 -2.368 -9.805 1.00 0.34 C ATOM 114 O TYR A 7 12.067 -1.659 -9.874 1.00 63.53 O ATOM 115 CB TYR A 7 9.980 -2.727 -7.591 1.00 31.33 C ATOM 116 CG TYR A 7 11.305 -3.465 -7.389 1.00 0.22 C ATOM 117 CD1 TYR A 7 11.552 -4.640 -8.069 1.00 55.25 C ATOM 118 CD2 TYR A 7 12.254 -2.955 -6.526 1.00 21.21 C ATOM 119 CE1 TYR A 7 12.799 -5.334 -7.879 1.00 53.05 C ATOM 120 CE2 TYR A 7 13.501 -3.649 -6.336 1.00 23.42 C ATOM 121 CZ TYR A 7 13.712 -4.805 -7.022 1.00 0.50 C ATOM 122 OH TYR A 7 14.890 -5.460 -6.842 1.00 70.15 O ATOM 0 H TYR A 7 8.267 -3.257 -9.209 1.00 14.24 H new ATOM 0 HA TYR A 7 9.932 -0.883 -8.775 1.00 62.20 H new ATOM 0 HB2 TYR A 7 9.837 -2.027 -6.768 1.00 31.33 H new ATOM 0 HB3 TYR A 7 9.164 -3.448 -7.542 1.00 31.33 H new ATOM 0 HD1 TYR A 7 10.810 -5.039 -8.744 1.00 55.25 H new ATOM 0 HD2 TYR A 7 12.061 -2.035 -5.993 1.00 21.21 H new ATOM 0 HE1 TYR A 7 13.004 -6.254 -8.406 1.00 53.05 H new ATOM 0 HE2 TYR A 7 14.252 -3.261 -5.664 1.00 23.42 H new ATOM 0 HH TYR A 7 15.390 -5.039 -6.112 1.00 70.15 H new ATOM 132 N ASN A 8 10.901 -3.505 -10.464 1.00 62.21 N ATOM 133 CA ASN A 8 11.937 -4.012 -11.348 1.00 73.54 C ATOM 134 C ASN A 8 12.125 -3.042 -12.516 1.00 1.53 C ATOM 135 O ASN A 8 13.145 -3.081 -13.202 1.00 40.20 O ATOM 136 CB ASN A 8 11.549 -5.376 -11.925 1.00 43.40 C ATOM 137 CG ASN A 8 12.782 -6.126 -12.434 1.00 53.10 C ATOM 138 OD1 ASN A 8 12.816 -7.409 -12.086 1.00 24.20 O flip ATOM 139 ND2 ASN A 8 13.644 -5.576 -13.099 1.00 11.02 N flip ATOM 0 H ASN A 8 10.067 -4.090 -10.404 1.00 62.21 H new ATOM 0 HA ASN A 8 12.855 -4.112 -10.769 1.00 73.54 H new ATOM 0 HB2 ASN A 8 11.048 -5.969 -11.160 1.00 43.40 H new ATOM 0 HB3 ASN A 8 10.838 -5.241 -12.740 1.00 43.40 H new ATOM 0 HD21 ASN A 8 13.556 -4.587 -13.331 1.00 11.02 H new ATOM 0 HD22 ASN A 8 14.453 -6.105 -13.423 1.00 11.02 H new ATOM 146 N GLU A 9 11.125 -2.193 -12.705 1.00 5.21 N ATOM 147 CA GLU A 9 11.168 -1.213 -13.777 1.00 62.34 C ATOM 148 C GLU A 9 12.141 -0.086 -13.428 1.00 5.31 C ATOM 149 O GLU A 9 12.706 0.549 -14.317 1.00 44.31 O ATOM 150 CB GLU A 9 9.772 -0.661 -14.071 1.00 41.04 C ATOM 151 CG GLU A 9 9.838 0.485 -15.082 1.00 53.55 C ATOM 152 CD GLU A 9 8.440 0.854 -15.585 1.00 63.33 C ATOM 153 OE1 GLU A 9 8.297 1.785 -16.392 1.00 30.15 O ATOM 154 OE2 GLU A 9 7.482 0.133 -15.110 1.00 22.24 O ATOM 0 H GLU A 9 10.280 -2.164 -12.134 1.00 5.21 H new ATOM 0 HA GLU A 9 11.525 -1.707 -14.680 1.00 62.34 H new ATOM 0 HB2 GLU A 9 9.136 -1.457 -14.459 1.00 41.04 H new ATOM 0 HB3 GLU A 9 9.314 -0.309 -13.147 1.00 41.04 H new ATOM 0 HG2 GLU A 9 10.304 1.356 -14.620 1.00 53.55 H new ATOM 0 HG3 GLU A 9 10.467 0.196 -15.924 1.00 53.55 H new ATOM 162 N GLN A 10 12.308 0.129 -12.131 1.00 74.21 N ATOM 163 CA GLN A 10 13.203 1.169 -11.653 1.00 72.22 C ATOM 164 C GLN A 10 14.446 0.547 -11.013 1.00 74.44 C ATOM 165 O GLN A 10 15.216 1.236 -10.347 1.00 21.10 O ATOM 166 CB GLN A 10 12.488 2.099 -10.671 1.00 71.10 C ATOM 167 CG GLN A 10 11.401 2.911 -11.378 1.00 12.35 C ATOM 168 CD GLN A 10 10.081 2.849 -10.606 1.00 70.52 C ATOM 169 OE1 GLN A 10 9.181 2.090 -10.926 1.00 74.03 O ATOM 170 NE2 GLN A 10 10.017 3.686 -9.575 1.00 32.33 N ATOM 0 H GLN A 10 11.838 -0.400 -11.396 1.00 74.21 H new ATOM 0 HA GLN A 10 13.519 1.769 -12.506 1.00 72.22 H new ATOM 0 HB2 GLN A 10 12.044 1.512 -9.867 1.00 71.10 H new ATOM 0 HB3 GLN A 10 13.210 2.774 -10.212 1.00 71.10 H new ATOM 0 HG2 GLN A 10 11.722 3.948 -11.474 1.00 12.35 H new ATOM 0 HG3 GLN A 10 11.254 2.528 -12.388 1.00 12.35 H new ATOM 0 HE21 GLN A 10 10.807 4.295 -9.362 1.00 32.33 H new ATOM 0 HE22 GLN A 10 9.178 3.719 -8.997 1.00 32.33 H new ATOM 179 N ILE A 11 14.602 -0.750 -11.239 1.00 0.44 N ATOM 180 CA ILE A 11 15.738 -1.472 -10.693 1.00 21.45 C ATOM 181 C ILE A 11 17.033 -0.866 -11.237 1.00 53.33 C ATOM 182 O ILE A 11 17.971 -0.615 -10.482 1.00 71.33 O ATOM 183 CB ILE A 11 15.600 -2.972 -10.964 1.00 12.23 C ATOM 184 CG1 ILE A 11 14.985 -3.692 -9.762 1.00 12.10 C ATOM 185 CG2 ILE A 11 16.943 -3.581 -11.372 1.00 34.34 C ATOM 186 CD1 ILE A 11 15.965 -3.735 -8.588 1.00 62.21 C ATOM 0 H ILE A 11 13.961 -1.318 -11.792 1.00 0.44 H new ATOM 0 HA ILE A 11 15.769 -1.368 -9.608 1.00 21.45 H new ATOM 0 HB ILE A 11 14.917 -3.106 -11.803 1.00 12.23 H new ATOM 0 HG12 ILE A 11 14.070 -3.183 -9.458 1.00 12.10 H new ATOM 0 HG13 ILE A 11 14.706 -4.707 -10.045 1.00 12.10 H new ATOM 0 HG21 ILE A 11 16.817 -4.647 -11.559 1.00 34.34 H new ATOM 0 HG22 ILE A 11 17.303 -3.094 -12.278 1.00 34.34 H new ATOM 0 HG23 ILE A 11 17.667 -3.436 -10.570 1.00 34.34 H new ATOM 0 HD11 ILE A 11 15.503 -4.252 -7.747 1.00 62.21 H new ATOM 0 HD12 ILE A 11 16.869 -4.265 -8.888 1.00 62.21 H new ATOM 0 HD13 ILE A 11 16.223 -2.718 -8.292 1.00 62.21 H new ATOM 198 N PRO A 12 17.042 -0.641 -12.579 1.00 23.14 N ATOM 199 CA PRO A 12 18.206 -0.068 -13.233 1.00 62.52 C ATOM 200 C PRO A 12 18.315 1.431 -12.946 1.00 74.55 C ATOM 201 O PRO A 12 19.239 2.091 -13.417 1.00 63.04 O ATOM 202 CB PRO A 12 18.020 -0.379 -14.709 1.00 52.04 C ATOM 203 CG PRO A 12 16.545 -0.701 -14.885 1.00 34.15 C ATOM 204 CD PRO A 12 15.949 -0.925 -13.504 1.00 64.20 C ATOM 0 HA PRO A 12 19.143 -0.487 -12.866 1.00 62.52 H new ATOM 0 HB2 PRO A 12 18.311 0.471 -15.327 1.00 52.04 H new ATOM 0 HB3 PRO A 12 18.642 -1.221 -15.012 1.00 52.04 H new ATOM 0 HG2 PRO A 12 16.034 0.116 -15.393 1.00 34.15 H new ATOM 0 HG3 PRO A 12 16.419 -1.589 -15.504 1.00 34.15 H new ATOM 0 HD2 PRO A 12 15.099 -0.266 -13.328 1.00 64.20 H new ATOM 0 HD3 PRO A 12 15.588 -1.947 -13.389 1.00 64.20 H new ATOM 212 N ASN A 13 17.357 1.924 -12.175 1.00 72.32 N ATOM 213 CA ASN A 13 17.333 3.332 -11.820 1.00 1.51 C ATOM 214 C ASN A 13 18.053 3.529 -10.484 1.00 51.32 C ATOM 215 O ASN A 13 18.702 4.552 -10.270 1.00 25.42 O ATOM 216 CB ASN A 13 15.897 3.837 -11.662 1.00 63.50 C ATOM 217 CG ASN A 13 15.064 3.517 -12.905 1.00 2.20 C ATOM 218 OD1 ASN A 13 15.521 2.889 -13.846 1.00 21.34 O ATOM 219 ND2 ASN A 13 13.820 3.984 -12.857 1.00 32.13 N ATOM 0 H ASN A 13 16.592 1.373 -11.786 1.00 72.32 H new ATOM 0 HA ASN A 13 17.825 3.889 -12.618 1.00 1.51 H new ATOM 0 HB2 ASN A 13 15.440 3.377 -10.785 1.00 63.50 H new ATOM 0 HB3 ASN A 13 15.903 4.913 -11.491 1.00 63.50 H new ATOM 0 HD21 ASN A 13 13.185 3.824 -13.639 1.00 32.13 H new ATOM 0 HD22 ASN A 13 13.501 4.502 -12.038 1.00 32.13 H new ATOM 226 N VAL A 14 17.913 2.534 -9.621 1.00 10.12 N ATOM 227 CA VAL A 14 18.542 2.585 -8.312 1.00 12.01 C ATOM 228 C VAL A 14 20.039 2.307 -8.459 1.00 30.51 C ATOM 229 O VAL A 14 20.859 2.935 -7.792 1.00 4.01 O ATOM 230 CB VAL A 14 17.844 1.613 -7.358 1.00 12.41 C ATOM 231 CG1 VAL A 14 18.534 1.595 -5.993 1.00 30.14 C ATOM 232 CG2 VAL A 14 16.359 1.955 -7.217 1.00 60.24 C ATOM 0 H VAL A 14 17.373 1.688 -9.802 1.00 10.12 H new ATOM 0 HA VAL A 14 18.437 3.579 -7.876 1.00 12.01 H new ATOM 0 HB VAL A 14 17.919 0.613 -7.785 1.00 12.41 H new ATOM 0 HG11 VAL A 14 18.018 0.896 -5.334 1.00 30.14 H new ATOM 0 HG12 VAL A 14 19.571 1.282 -6.114 1.00 30.14 H new ATOM 0 HG13 VAL A 14 18.505 2.594 -5.557 1.00 30.14 H new ATOM 0 HG21 VAL A 14 15.886 1.249 -6.534 1.00 60.24 H new ATOM 0 HG22 VAL A 14 16.254 2.966 -6.824 1.00 60.24 H new ATOM 0 HG23 VAL A 14 15.877 1.893 -8.193 1.00 60.24 H new ATOM 242 N ARG A 15 20.350 1.364 -9.336 1.00 74.25 N ATOM 243 CA ARG A 15 21.734 0.994 -9.580 1.00 13.34 C ATOM 244 C ARG A 15 22.438 2.081 -10.395 1.00 74.33 C ATOM 245 O ARG A 15 23.666 2.149 -10.416 1.00 34.32 O ATOM 246 CB ARG A 15 21.825 -0.336 -10.329 1.00 61.31 C ATOM 247 CG ARG A 15 21.539 -0.146 -11.820 1.00 72.51 C ATOM 248 CD ARG A 15 21.483 -1.494 -12.544 1.00 2.44 C ATOM 249 NE ARG A 15 21.391 -1.280 -14.005 1.00 42.31 N ATOM 250 CZ ARG A 15 22.440 -0.950 -14.789 1.00 55.22 C ATOM 251 NH1 ARG A 15 23.670 -0.793 -14.257 1.00 44.03 N ATOM 252 NH2 ARG A 15 22.243 -0.783 -16.084 1.00 10.22 N ATOM 0 H ARG A 15 19.667 0.845 -9.887 1.00 74.25 H new ATOM 0 HA ARG A 15 22.224 0.886 -8.612 1.00 13.34 H new ATOM 0 HB2 ARG A 15 22.819 -0.764 -10.197 1.00 61.31 H new ATOM 0 HB3 ARG A 15 21.113 -1.045 -9.906 1.00 61.31 H new ATOM 0 HG2 ARG A 15 20.593 0.379 -11.948 1.00 72.51 H new ATOM 0 HG3 ARG A 15 22.313 0.478 -12.266 1.00 72.51 H new ATOM 0 HD2 ARG A 15 22.372 -2.079 -12.309 1.00 2.44 H new ATOM 0 HD3 ARG A 15 20.623 -2.067 -12.197 1.00 2.44 H new ATOM 0 HE ARG A 15 20.479 -1.388 -14.448 1.00 42.31 H new ATOM 0 HH11 ARG A 15 23.813 -0.924 -13.256 1.00 44.03 H new ATOM 0 HH12 ARG A 15 24.457 -0.544 -14.856 1.00 44.03 H new ATOM 0 HH21 ARG A 15 21.310 -0.903 -16.478 1.00 10.22 H new ATOM 0 HH22 ARG A 15 23.024 -0.534 -16.691 1.00 10.22 H new ATOM 265 N SER A 16 21.629 2.903 -11.048 1.00 4.34 N ATOM 266 CA SER A 16 22.159 3.983 -11.863 1.00 5.13 C ATOM 267 C SER A 16 22.709 5.095 -10.966 1.00 73.51 C ATOM 268 O SER A 16 23.809 5.594 -11.194 1.00 24.01 O ATOM 269 CB SER A 16 21.089 4.540 -12.803 1.00 33.01 C ATOM 270 OG SER A 16 21.552 5.678 -13.525 1.00 60.44 O ATOM 0 H SER A 16 20.611 2.843 -11.029 1.00 4.34 H new ATOM 0 HA SER A 16 22.969 3.584 -12.474 1.00 5.13 H new ATOM 0 HB2 SER A 16 20.784 3.764 -13.506 1.00 33.01 H new ATOM 0 HB3 SER A 16 20.205 4.812 -12.226 1.00 33.01 H new ATOM 0 HG SER A 16 20.840 6.003 -14.115 1.00 60.44 H new ATOM 276 N LEU A 17 21.916 5.449 -9.965 1.00 44.22 N ATOM 277 CA LEU A 17 22.309 6.492 -9.033 1.00 43.41 C ATOM 278 C LEU A 17 23.384 5.949 -8.090 1.00 21.14 C ATOM 279 O LEU A 17 24.200 6.708 -7.569 1.00 15.34 O ATOM 280 CB LEU A 17 21.084 7.055 -8.310 1.00 74.43 C ATOM 281 CG LEU A 17 20.294 6.061 -7.456 1.00 23.41 C ATOM 282 CD1 LEU A 17 20.889 5.953 -6.050 1.00 55.13 C ATOM 283 CD2 LEU A 17 18.808 6.424 -7.424 1.00 4.12 C ATOM 0 H LEU A 17 21.004 5.032 -9.779 1.00 44.22 H new ATOM 0 HA LEU A 17 22.749 7.334 -9.568 1.00 43.41 H new ATOM 0 HB2 LEU A 17 21.410 7.875 -7.670 1.00 74.43 H new ATOM 0 HB3 LEU A 17 20.411 7.480 -9.055 1.00 74.43 H new ATOM 0 HG LEU A 17 20.374 5.076 -7.916 1.00 23.41 H new ATOM 0 HD11 LEU A 17 20.309 5.240 -5.463 1.00 55.13 H new ATOM 0 HD12 LEU A 17 21.922 5.612 -6.117 1.00 55.13 H new ATOM 0 HD13 LEU A 17 20.860 6.930 -5.567 1.00 55.13 H new ATOM 0 HD21 LEU A 17 18.270 5.701 -6.810 1.00 4.12 H new ATOM 0 HD22 LEU A 17 18.686 7.421 -7.001 1.00 4.12 H new ATOM 0 HD23 LEU A 17 18.408 6.408 -8.438 1.00 4.12 H new ATOM 295 N LEU A 18 23.350 4.638 -7.898 1.00 44.33 N ATOM 296 CA LEU A 18 24.312 3.984 -7.027 1.00 15.34 C ATOM 297 C LEU A 18 25.727 4.259 -7.538 1.00 60.34 C ATOM 298 O LEU A 18 26.672 4.331 -6.754 1.00 35.03 O ATOM 299 CB LEU A 18 23.985 2.496 -6.890 1.00 72.20 C ATOM 300 CG LEU A 18 23.166 2.099 -5.660 1.00 55.02 C ATOM 301 CD1 LEU A 18 24.053 2.005 -4.417 1.00 53.53 C ATOM 302 CD2 LEU A 18 21.989 3.055 -5.454 1.00 34.42 C ATOM 0 H LEU A 18 22.671 4.011 -8.331 1.00 44.33 H new ATOM 0 HA LEU A 18 24.253 4.394 -6.019 1.00 15.34 H new ATOM 0 HB2 LEU A 18 23.442 2.180 -7.781 1.00 72.20 H new ATOM 0 HB3 LEU A 18 24.922 1.939 -6.874 1.00 72.20 H new ATOM 0 HG LEU A 18 22.749 1.107 -5.833 1.00 55.02 H new ATOM 0 HD11 LEU A 18 23.446 1.721 -3.557 1.00 53.53 H new ATOM 0 HD12 LEU A 18 24.827 1.255 -4.578 1.00 53.53 H new ATOM 0 HD13 LEU A 18 24.519 2.972 -4.229 1.00 53.53 H new ATOM 0 HD21 LEU A 18 21.423 2.751 -4.574 1.00 34.42 H new ATOM 0 HD22 LEU A 18 22.364 4.069 -5.312 1.00 34.42 H new ATOM 0 HD23 LEU A 18 21.340 3.028 -6.330 1.00 34.42 H new ATOM 314 N THR A 19 25.829 4.404 -8.851 1.00 43.23 N ATOM 315 CA THR A 19 27.114 4.669 -9.477 1.00 54.21 C ATOM 316 C THR A 19 27.689 5.994 -8.973 1.00 50.34 C ATOM 317 O THR A 19 28.865 6.285 -9.185 1.00 63.03 O ATOM 318 CB THR A 19 26.918 4.629 -10.994 1.00 14.21 C ATOM 319 OG1 THR A 19 26.178 5.813 -11.280 1.00 1.23 O ATOM 320 CG2 THR A 19 25.990 3.495 -11.435 1.00 2.01 C ATOM 0 H THR A 19 25.043 4.343 -9.499 1.00 43.23 H new ATOM 0 HA THR A 19 27.849 3.909 -9.210 1.00 54.21 H new ATOM 0 HB THR A 19 27.886 4.517 -11.482 1.00 14.21 H new ATOM 0 HG1 THR A 19 25.272 5.572 -11.565 1.00 1.23 H new ATOM 0 HG21 THR A 19 25.885 3.512 -12.520 1.00 2.01 H new ATOM 0 HG22 THR A 19 26.412 2.539 -11.126 1.00 2.01 H new ATOM 0 HG23 THR A 19 25.011 3.626 -10.974 1.00 2.01 H new ATOM 328 N LYS A 20 26.833 6.763 -8.316 1.00 72.42 N ATOM 329 CA LYS A 20 27.241 8.050 -7.781 1.00 2.14 C ATOM 330 C LYS A 20 27.927 7.841 -6.429 1.00 63.02 C ATOM 331 O LYS A 20 28.719 8.677 -5.995 1.00 34.52 O ATOM 332 CB LYS A 20 26.050 9.009 -7.724 1.00 22.02 C ATOM 333 CG LYS A 20 25.516 9.303 -9.127 1.00 13.10 C ATOM 334 CD LYS A 20 26.609 9.899 -10.016 1.00 71.24 C ATOM 335 CE LYS A 20 26.007 10.552 -11.262 1.00 12.21 C ATOM 336 NZ LYS A 20 27.068 10.876 -12.242 1.00 32.52 N ATOM 0 H LYS A 20 25.858 6.519 -8.142 1.00 72.42 H new ATOM 0 HA LYS A 20 27.970 8.522 -8.440 1.00 2.14 H new ATOM 0 HB2 LYS A 20 25.258 8.575 -7.113 1.00 22.02 H new ATOM 0 HB3 LYS A 20 26.351 9.940 -7.243 1.00 22.02 H new ATOM 0 HG2 LYS A 20 25.138 8.385 -9.576 1.00 13.10 H new ATOM 0 HG3 LYS A 20 24.677 9.995 -9.063 1.00 13.10 H new ATOM 0 HD2 LYS A 20 27.178 10.638 -9.452 1.00 71.24 H new ATOM 0 HD3 LYS A 20 27.308 9.117 -10.313 1.00 71.24 H new ATOM 0 HE2 LYS A 20 25.278 9.880 -11.715 1.00 12.21 H new ATOM 0 HE3 LYS A 20 25.473 11.460 -10.982 1.00 12.21 H new ATOM 0 HZ1 LYS A 20 26.642 11.318 -13.081 1.00 32.52 H new ATOM 0 HZ2 LYS A 20 27.749 11.534 -11.812 1.00 32.52 H new ATOM 0 HZ3 LYS A 20 27.560 10.004 -12.522 1.00 32.52 H new ATOM 349 N TRP A 21 27.599 6.721 -5.802 1.00 0.11 N ATOM 350 CA TRP A 21 28.174 6.392 -4.509 1.00 32.53 C ATOM 351 C TRP A 21 29.690 6.275 -4.681 1.00 34.31 C ATOM 352 O TRP A 21 30.165 5.557 -5.560 1.00 14.32 O ATOM 353 CB TRP A 21 27.538 5.125 -3.933 1.00 61.41 C ATOM 354 CG TRP A 21 27.511 5.081 -2.404 1.00 4.21 C ATOM 355 CD1 TRP A 21 28.115 5.913 -1.544 1.00 40.33 C ATOM 356 CD2 TRP A 21 26.818 4.118 -1.583 1.00 72.11 C ATOM 357 NE1 TRP A 21 27.862 5.558 -0.235 1.00 4.22 N ATOM 358 CE2 TRP A 21 27.048 4.432 -0.259 1.00 64.23 C ATOM 359 CE3 TRP A 21 26.022 3.018 -1.947 1.00 73.33 C ATOM 360 CZ2 TRP A 21 26.519 3.695 0.807 1.00 60.32 C ATOM 361 CZ3 TRP A 21 25.500 2.291 -0.870 1.00 41.21 C ATOM 362 CH2 TRP A 21 25.723 2.594 0.468 1.00 11.10 C ATOM 0 H TRP A 21 26.942 6.030 -6.165 1.00 0.11 H new ATOM 0 HA TRP A 21 27.966 7.178 -3.783 1.00 32.53 H new ATOM 0 HB2 TRP A 21 26.517 5.041 -4.307 1.00 61.41 H new ATOM 0 HB3 TRP A 21 28.085 4.257 -4.301 1.00 61.41 H new ATOM 0 HD1 TRP A 21 28.723 6.755 -1.839 1.00 40.33 H new ATOM 0 HE1 TRP A 21 28.209 6.035 0.598 1.00 4.22 H new ATOM 0 HE3 TRP A 21 25.828 2.754 -2.976 1.00 73.33 H new ATOM 0 HZ2 TRP A 21 26.714 3.961 1.835 1.00 60.32 H new ATOM 0 HZ3 TRP A 21 24.881 1.435 -1.095 1.00 41.21 H new ATOM 0 HH2 TRP A 21 25.284 1.983 1.243 1.00 11.10 H new ATOM 373 N ALA A 22 30.407 6.991 -3.828 1.00 32.14 N ATOM 374 CA ALA A 22 31.859 6.977 -3.874 1.00 60.43 C ATOM 375 C ALA A 22 32.381 5.818 -3.022 1.00 70.23 C ATOM 376 O ALA A 22 33.544 5.433 -3.137 1.00 13.13 O ATOM 377 CB ALA A 22 32.398 8.331 -3.410 1.00 22.13 C ATOM 0 H ALA A 22 30.009 7.585 -3.100 1.00 32.14 H new ATOM 0 HA ALA A 22 32.209 6.820 -4.894 1.00 60.43 H new ATOM 0 HB1 ALA A 22 33.487 8.320 -3.445 1.00 22.13 H new ATOM 0 HB2 ALA A 22 32.022 9.116 -4.066 1.00 22.13 H new ATOM 0 HB3 ALA A 22 32.069 8.523 -2.389 1.00 22.13 H new ATOM 383 N LYS A 23 31.496 5.294 -2.187 1.00 71.11 N ATOM 384 CA LYS A 23 31.853 4.187 -1.316 1.00 72.12 C ATOM 385 C LYS A 23 31.681 2.870 -2.076 1.00 42.12 C ATOM 386 O LYS A 23 32.339 1.879 -1.764 1.00 64.11 O ATOM 387 CB LYS A 23 31.055 4.253 -0.012 1.00 65.40 C ATOM 388 CG LYS A 23 31.082 5.665 0.576 1.00 20.12 C ATOM 389 CD LYS A 23 30.566 5.669 2.017 1.00 63.53 C ATOM 390 CE LYS A 23 31.245 4.576 2.845 1.00 62.21 C ATOM 391 NZ LYS A 23 30.478 3.313 2.765 1.00 70.33 N ATOM 0 H LYS A 23 30.532 5.615 -2.095 1.00 71.11 H new ATOM 0 HA LYS A 23 32.901 4.253 -1.025 1.00 72.12 H new ATOM 0 HB2 LYS A 23 30.024 3.952 -0.197 1.00 65.40 H new ATOM 0 HB3 LYS A 23 31.469 3.547 0.708 1.00 65.40 H new ATOM 0 HG2 LYS A 23 32.100 6.055 0.549 1.00 20.12 H new ATOM 0 HG3 LYS A 23 30.470 6.329 -0.035 1.00 20.12 H new ATOM 0 HD2 LYS A 23 30.752 6.642 2.471 1.00 63.53 H new ATOM 0 HD3 LYS A 23 29.487 5.516 2.021 1.00 63.53 H new ATOM 0 HE2 LYS A 23 32.260 4.415 2.483 1.00 62.21 H new ATOM 0 HE3 LYS A 23 31.324 4.895 3.884 1.00 62.21 H new ATOM 0 HZ1 LYS A 23 30.016 3.129 3.678 1.00 70.33 H new ATOM 0 HZ2 LYS A 23 29.756 3.392 2.021 1.00 70.33 H new ATOM 0 HZ3 LYS A 23 31.123 2.529 2.539 1.00 70.33 H new ATOM 404 N VAL A 24 30.793 2.902 -3.059 1.00 45.41 N ATOM 405 CA VAL A 24 30.527 1.724 -3.866 1.00 61.30 C ATOM 406 C VAL A 24 31.748 1.420 -4.736 1.00 64.01 C ATOM 407 O VAL A 24 32.081 2.190 -5.636 1.00 22.03 O ATOM 408 CB VAL A 24 29.248 1.926 -4.681 1.00 31.41 C ATOM 409 CG1 VAL A 24 29.135 0.880 -5.792 1.00 43.34 C ATOM 410 CG2 VAL A 24 28.013 1.901 -3.778 1.00 1.11 C ATOM 0 H VAL A 24 30.249 3.726 -3.315 1.00 45.41 H new ATOM 0 HA VAL A 24 30.357 0.856 -3.229 1.00 61.30 H new ATOM 0 HB VAL A 24 29.301 2.909 -5.150 1.00 31.41 H new ATOM 0 HG11 VAL A 24 28.217 1.046 -6.356 1.00 43.34 H new ATOM 0 HG12 VAL A 24 29.992 0.965 -6.460 1.00 43.34 H new ATOM 0 HG13 VAL A 24 29.115 -0.117 -5.352 1.00 43.34 H new ATOM 0 HG21 VAL A 24 27.118 2.047 -4.382 1.00 1.11 H new ATOM 0 HG22 VAL A 24 27.954 0.939 -3.268 1.00 1.11 H new ATOM 0 HG23 VAL A 24 28.086 2.699 -3.039 1.00 1.11 H new ATOM 420 N GLU A 25 32.383 0.296 -4.437 1.00 70.14 N ATOM 421 CA GLU A 25 33.560 -0.119 -5.181 1.00 63.21 C ATOM 422 C GLU A 25 33.154 -0.972 -6.385 1.00 4.12 C ATOM 423 O GLU A 25 33.720 -0.833 -7.468 1.00 5.51 O ATOM 424 CB GLU A 25 34.540 -0.874 -4.280 1.00 41.42 C ATOM 425 CG GLU A 25 35.711 -1.432 -5.091 1.00 22.53 C ATOM 426 CD GLU A 25 37.030 -1.271 -4.332 1.00 32.35 C ATOM 427 OE1 GLU A 25 38.107 -1.312 -4.944 1.00 60.14 O ATOM 428 OE2 GLU A 25 36.909 -1.097 -3.059 1.00 74.11 O ATOM 0 H GLU A 25 32.105 -0.340 -3.690 1.00 70.14 H new ATOM 0 HA GLU A 25 34.067 0.773 -5.547 1.00 63.21 H new ATOM 0 HB2 GLU A 25 34.915 -0.206 -3.505 1.00 41.42 H new ATOM 0 HB3 GLU A 25 34.021 -1.689 -3.775 1.00 41.42 H new ATOM 0 HG2 GLU A 25 35.538 -2.486 -5.308 1.00 22.53 H new ATOM 0 HG3 GLU A 25 35.773 -0.916 -6.049 1.00 22.53 H new ATOM 436 N ARG A 26 32.177 -1.836 -6.155 1.00 31.23 N ATOM 437 CA ARG A 26 31.689 -2.711 -7.207 1.00 34.42 C ATOM 438 C ARG A 26 30.177 -2.546 -7.376 1.00 60.10 C ATOM 439 O ARG A 26 29.488 -2.120 -6.450 1.00 62.23 O ATOM 440 CB ARG A 26 32.003 -4.176 -6.895 1.00 12.11 C ATOM 441 CG ARG A 26 31.517 -5.092 -8.020 1.00 22.53 C ATOM 442 CD ARG A 26 31.947 -6.540 -7.772 1.00 10.23 C ATOM 443 NE ARG A 26 32.107 -7.248 -9.061 1.00 73.32 N ATOM 444 CZ ARG A 26 33.152 -7.072 -9.897 1.00 62.40 C ATOM 445 NH1 ARG A 26 34.141 -6.208 -9.585 1.00 1.02 N ATOM 446 NH2 ARG A 26 33.193 -7.758 -11.024 1.00 70.21 N ATOM 0 H ARG A 26 31.710 -1.949 -5.255 1.00 31.23 H new ATOM 0 HA ARG A 26 32.194 -2.432 -8.131 1.00 34.42 H new ATOM 0 HB2 ARG A 26 33.077 -4.300 -6.758 1.00 12.11 H new ATOM 0 HB3 ARG A 26 31.527 -4.462 -5.957 1.00 12.11 H new ATOM 0 HG2 ARG A 26 30.431 -5.039 -8.094 1.00 22.53 H new ATOM 0 HG3 ARG A 26 31.918 -4.748 -8.973 1.00 22.53 H new ATOM 0 HD2 ARG A 26 32.886 -6.560 -7.218 1.00 10.23 H new ATOM 0 HD3 ARG A 26 31.204 -7.049 -7.158 1.00 10.23 H new ATOM 0 HE ARG A 26 31.382 -7.911 -9.335 1.00 73.32 H new ATOM 0 HH11 ARG A 26 34.102 -5.682 -8.712 1.00 1.02 H new ATOM 0 HH12 ARG A 26 34.927 -6.081 -10.222 1.00 1.02 H new ATOM 0 HH21 ARG A 26 32.442 -8.409 -11.252 1.00 70.21 H new ATOM 0 HH22 ARG A 26 33.976 -7.637 -11.667 1.00 70.21 H new ATOM 459 N ILE A 27 29.706 -2.892 -8.565 1.00 15.30 N ATOM 460 CA ILE A 27 28.288 -2.787 -8.867 1.00 41.03 C ATOM 461 C ILE A 27 27.861 -3.988 -9.713 1.00 64.24 C ATOM 462 O ILE A 27 28.227 -4.089 -10.883 1.00 62.34 O ATOM 463 CB ILE A 27 27.977 -1.437 -9.516 1.00 10.54 C ATOM 464 CG1 ILE A 27 27.836 -0.340 -8.458 1.00 1.01 C ATOM 465 CG2 ILE A 27 26.741 -1.531 -10.412 1.00 15.40 C ATOM 466 CD1 ILE A 27 26.421 -0.318 -7.876 1.00 41.45 C ATOM 0 H ILE A 27 30.280 -3.245 -9.330 1.00 15.30 H new ATOM 0 HA ILE A 27 27.700 -2.817 -7.950 1.00 41.03 H new ATOM 0 HB ILE A 27 28.817 -1.163 -10.154 1.00 10.54 H new ATOM 0 HG12 ILE A 27 28.559 -0.505 -7.659 1.00 1.01 H new ATOM 0 HG13 ILE A 27 28.066 0.629 -8.901 1.00 1.01 H new ATOM 0 HG21 ILE A 27 26.542 -0.558 -10.861 1.00 15.40 H new ATOM 0 HG22 ILE A 27 26.917 -2.264 -11.199 1.00 15.40 H new ATOM 0 HG23 ILE A 27 25.882 -1.838 -9.816 1.00 15.40 H new ATOM 0 HD11 ILE A 27 26.348 0.470 -7.127 1.00 41.45 H new ATOM 0 HD12 ILE A 27 25.702 -0.129 -8.673 1.00 41.45 H new ATOM 0 HD13 ILE A 27 26.203 -1.280 -7.413 1.00 41.45 H new ATOM 478 N GLN A 28 27.093 -4.869 -9.088 1.00 45.35 N ATOM 479 CA GLN A 28 26.613 -6.059 -9.769 1.00 60.03 C ATOM 480 C GLN A 28 25.094 -6.176 -9.626 1.00 42.10 C ATOM 481 O GLN A 28 24.500 -5.552 -8.748 1.00 22.32 O ATOM 482 CB GLN A 28 27.312 -7.313 -9.240 1.00 72.02 C ATOM 483 CG GLN A 28 26.706 -8.578 -9.852 1.00 44.24 C ATOM 484 CD GLN A 28 27.533 -9.813 -9.489 1.00 43.32 C ATOM 485 OE1 GLN A 28 27.828 -9.905 -8.196 1.00 41.51 O flip ATOM 486 NE2 GLN A 28 27.881 -10.628 -10.328 1.00 32.35 N flip ATOM 0 H GLN A 28 26.792 -4.782 -8.117 1.00 45.35 H new ATOM 0 HA GLN A 28 26.853 -5.969 -10.829 1.00 60.03 H new ATOM 0 HB2 GLN A 28 28.376 -7.266 -9.472 1.00 72.02 H new ATOM 0 HB3 GLN A 28 27.224 -7.352 -8.154 1.00 72.02 H new ATOM 0 HG2 GLN A 28 25.683 -8.704 -9.497 1.00 44.24 H new ATOM 0 HG3 GLN A 28 26.657 -8.474 -10.936 1.00 44.24 H new ATOM 0 HE21 GLN A 28 27.620 -10.497 -11.305 1.00 32.35 H new ATOM 0 HE22 GLN A 28 28.433 -11.440 -10.052 1.00 32.35 H new ATOM 495 N ASP A 29 24.509 -6.979 -10.502 1.00 63.33 N ATOM 496 CA ASP A 29 23.071 -7.186 -10.484 1.00 41.14 C ATOM 497 C ASP A 29 22.776 -8.662 -10.212 1.00 73.34 C ATOM 498 O ASP A 29 23.648 -9.514 -10.375 1.00 4.22 O ATOM 499 CB ASP A 29 22.445 -6.819 -11.831 1.00 42.13 C ATOM 500 CG ASP A 29 23.064 -7.518 -13.044 1.00 11.53 C ATOM 501 OD1 ASP A 29 23.396 -6.875 -14.051 1.00 12.43 O ATOM 502 OD2 ASP A 29 23.203 -8.794 -12.925 1.00 22.53 O ATOM 0 H ASP A 29 25.005 -7.494 -11.229 1.00 63.33 H new ATOM 0 HA ASP A 29 22.649 -6.551 -9.705 1.00 41.14 H new ATOM 0 HB2 ASP A 29 21.382 -7.056 -11.797 1.00 42.13 H new ATOM 0 HB3 ASP A 29 22.527 -5.741 -11.971 1.00 42.13 H new ATOM 508 N VAL A 30 21.542 -8.920 -9.803 1.00 63.31 N ATOM 509 CA VAL A 30 21.121 -10.279 -9.507 1.00 71.10 C ATOM 510 C VAL A 30 19.701 -10.494 -10.035 1.00 30.44 C ATOM 511 O VAL A 30 19.101 -9.583 -10.602 1.00 70.03 O ATOM 512 CB VAL A 30 21.249 -10.552 -8.007 1.00 0.41 C ATOM 513 CG1 VAL A 30 22.698 -10.867 -7.629 1.00 14.13 C ATOM 514 CG2 VAL A 30 20.712 -9.376 -7.188 1.00 50.23 C ATOM 0 H VAL A 30 20.821 -8.211 -9.670 1.00 63.31 H new ATOM 0 HA VAL A 30 21.768 -10.998 -10.010 1.00 71.10 H new ATOM 0 HB VAL A 30 20.644 -11.428 -7.773 1.00 0.41 H new ATOM 0 HG11 VAL A 30 22.761 -11.057 -6.558 1.00 14.13 H new ATOM 0 HG12 VAL A 30 23.033 -11.749 -8.175 1.00 14.13 H new ATOM 0 HG13 VAL A 30 23.333 -10.019 -7.885 1.00 14.13 H new ATOM 0 HG21 VAL A 30 20.815 -9.596 -6.125 1.00 50.23 H new ATOM 0 HG22 VAL A 30 21.278 -8.476 -7.429 1.00 50.23 H new ATOM 0 HG23 VAL A 30 19.660 -9.217 -7.426 1.00 50.23 H new ATOM 524 N GLN A 31 19.205 -11.705 -9.828 1.00 73.54 N ATOM 525 CA GLN A 31 17.867 -12.052 -10.276 1.00 74.12 C ATOM 526 C GLN A 31 16.820 -11.445 -9.340 1.00 53.33 C ATOM 527 O GLN A 31 16.469 -12.042 -8.324 1.00 70.51 O ATOM 528 CB GLN A 31 17.698 -13.569 -10.376 1.00 72.44 C ATOM 529 CG GLN A 31 16.230 -13.945 -10.588 1.00 32.13 C ATOM 530 CD GLN A 31 16.106 -15.309 -11.270 1.00 54.23 C ATOM 531 OE1 GLN A 31 15.665 -16.286 -10.687 1.00 41.22 O ATOM 532 NE2 GLN A 31 16.517 -15.320 -12.535 1.00 22.31 N ATOM 0 H GLN A 31 19.706 -12.458 -9.356 1.00 73.54 H new ATOM 0 HA GLN A 31 17.720 -11.637 -11.273 1.00 74.12 H new ATOM 0 HB2 GLN A 31 18.298 -13.952 -11.202 1.00 72.44 H new ATOM 0 HB3 GLN A 31 18.070 -14.041 -9.466 1.00 72.44 H new ATOM 0 HG2 GLN A 31 15.714 -13.966 -9.628 1.00 32.13 H new ATOM 0 HG3 GLN A 31 15.740 -13.184 -11.196 1.00 32.13 H new ATOM 0 HE21 GLN A 31 16.876 -14.466 -12.962 1.00 22.31 H new ATOM 0 HE22 GLN A 31 16.474 -16.182 -13.078 1.00 22.31 H new ATOM 541 N ASP A 32 16.350 -10.264 -9.716 1.00 71.44 N ATOM 542 CA ASP A 32 15.350 -9.570 -8.923 1.00 41.54 C ATOM 543 C ASP A 32 16.036 -8.860 -7.754 1.00 32.32 C ATOM 544 O ASP A 32 15.569 -8.935 -6.618 1.00 51.43 O ATOM 545 CB ASP A 32 14.326 -10.549 -8.347 1.00 72.12 C ATOM 546 CG ASP A 32 12.938 -9.958 -8.091 1.00 41.44 C ATOM 547 OD1 ASP A 32 12.597 -9.598 -6.955 1.00 10.41 O ATOM 548 OD2 ASP A 32 12.182 -9.871 -9.133 1.00 32.31 O ATOM 0 H ASP A 32 16.643 -9.771 -10.559 1.00 71.44 H new ATOM 0 HA ASP A 32 14.841 -8.857 -9.571 1.00 41.54 H new ATOM 0 HB2 ASP A 32 14.225 -11.391 -9.032 1.00 72.12 H new ATOM 0 HB3 ASP A 32 14.714 -10.946 -7.409 1.00 72.12 H new ATOM 554 N GLY A 33 17.133 -8.189 -8.072 1.00 13.32 N ATOM 555 CA GLY A 33 17.887 -7.467 -7.062 1.00 4.35 C ATOM 556 C GLY A 33 19.226 -6.980 -7.621 1.00 30.25 C ATOM 557 O GLY A 33 19.476 -7.083 -8.820 1.00 70.54 O ATOM 0 H GLY A 33 17.518 -8.130 -9.015 1.00 13.32 H new ATOM 0 HA2 GLY A 33 17.305 -6.616 -6.708 1.00 4.35 H new ATOM 0 HA3 GLY A 33 18.061 -8.113 -6.202 1.00 4.35 H new ATOM 561 N LEU A 34 20.051 -6.460 -6.724 1.00 64.30 N ATOM 562 CA LEU A 34 21.358 -5.958 -7.113 1.00 1.53 C ATOM 563 C LEU A 34 22.333 -6.126 -5.945 1.00 74.32 C ATOM 564 O LEU A 34 21.929 -6.085 -4.784 1.00 72.51 O ATOM 565 CB LEU A 34 21.249 -4.518 -7.620 1.00 23.13 C ATOM 566 CG LEU A 34 21.033 -4.352 -9.125 1.00 53.22 C ATOM 567 CD1 LEU A 34 19.629 -3.821 -9.422 1.00 11.02 C ATOM 568 CD2 LEU A 34 22.121 -3.470 -9.742 1.00 31.54 C ATOM 0 H LEU A 34 19.840 -6.375 -5.730 1.00 64.30 H new ATOM 0 HA LEU A 34 21.756 -6.537 -7.947 1.00 1.53 H new ATOM 0 HB2 LEU A 34 20.424 -4.032 -7.099 1.00 23.13 H new ATOM 0 HB3 LEU A 34 22.159 -3.986 -7.343 1.00 23.13 H new ATOM 0 HG LEU A 34 21.112 -5.334 -9.591 1.00 53.22 H new ATOM 0 HD11 LEU A 34 19.501 -3.712 -10.499 1.00 11.02 H new ATOM 0 HD12 LEU A 34 18.887 -4.520 -9.038 1.00 11.02 H new ATOM 0 HD13 LEU A 34 19.497 -2.852 -8.941 1.00 11.02 H new ATOM 0 HD21 LEU A 34 21.943 -3.369 -10.813 1.00 31.54 H new ATOM 0 HD22 LEU A 34 22.099 -2.485 -9.276 1.00 31.54 H new ATOM 0 HD23 LEU A 34 23.097 -3.927 -9.578 1.00 31.54 H new ATOM 580 N GLN A 35 23.597 -6.312 -6.294 1.00 21.41 N ATOM 581 CA GLN A 35 24.632 -6.488 -5.289 1.00 44.44 C ATOM 582 C GLN A 35 25.768 -5.487 -5.517 1.00 74.31 C ATOM 583 O GLN A 35 26.442 -5.531 -6.545 1.00 74.41 O ATOM 584 CB GLN A 35 25.159 -7.924 -5.290 1.00 21.03 C ATOM 585 CG GLN A 35 26.433 -8.041 -4.450 1.00 61.05 C ATOM 586 CD GLN A 35 27.648 -7.525 -5.224 1.00 3.02 C ATOM 587 OE1 GLN A 35 28.211 -6.445 -4.689 1.00 41.10 O flip ATOM 588 NE2 GLN A 35 28.048 -8.071 -6.239 1.00 24.31 N flip ATOM 0 H GLN A 35 23.928 -6.345 -7.258 1.00 21.41 H new ATOM 0 HA GLN A 35 24.196 -6.297 -4.309 1.00 44.44 H new ATOM 0 HB2 GLN A 35 24.396 -8.595 -4.896 1.00 21.03 H new ATOM 0 HB3 GLN A 35 25.363 -8.240 -6.313 1.00 21.03 H new ATOM 0 HG2 GLN A 35 26.318 -7.474 -3.526 1.00 61.05 H new ATOM 0 HG3 GLN A 35 26.592 -9.082 -4.167 1.00 61.05 H new ATOM 0 HE21 GLN A 35 27.569 -8.898 -6.596 1.00 24.31 H new ATOM 0 HE22 GLN A 35 28.862 -7.701 -6.730 1.00 24.31 H new ATOM 597 N LEU A 36 25.944 -4.609 -4.541 1.00 41.00 N ATOM 598 CA LEU A 36 26.986 -3.599 -4.622 1.00 60.50 C ATOM 599 C LEU A 36 27.932 -3.752 -3.429 1.00 72.11 C ATOM 600 O LEU A 36 27.506 -4.131 -2.339 1.00 70.22 O ATOM 601 CB LEU A 36 26.371 -2.204 -4.745 1.00 3.21 C ATOM 602 CG LEU A 36 24.934 -2.147 -5.266 1.00 32.41 C ATOM 603 CD1 LEU A 36 23.967 -2.805 -4.279 1.00 60.23 C ATOM 604 CD2 LEU A 36 24.526 -0.710 -5.596 1.00 62.20 C ATOM 0 H LEU A 36 25.383 -4.576 -3.690 1.00 41.00 H new ATOM 0 HA LEU A 36 27.584 -3.739 -5.523 1.00 60.50 H new ATOM 0 HB2 LEU A 36 26.400 -1.728 -3.765 1.00 3.21 H new ATOM 0 HB3 LEU A 36 27.000 -1.609 -5.407 1.00 3.21 H new ATOM 0 HG LEU A 36 24.885 -2.716 -6.194 1.00 32.41 H new ATOM 0 HD11 LEU A 36 22.952 -2.751 -4.673 1.00 60.23 H new ATOM 0 HD12 LEU A 36 24.246 -3.849 -4.137 1.00 60.23 H new ATOM 0 HD13 LEU A 36 24.013 -2.284 -3.323 1.00 60.23 H new ATOM 0 HD21 LEU A 36 23.500 -0.698 -5.964 1.00 62.20 H new ATOM 0 HD22 LEU A 36 24.596 -0.096 -4.698 1.00 62.20 H new ATOM 0 HD23 LEU A 36 25.191 -0.310 -6.361 1.00 62.20 H new ATOM 616 N ASP A 37 29.198 -3.449 -3.676 1.00 13.11 N ATOM 617 CA ASP A 37 30.207 -3.548 -2.636 1.00 5.43 C ATOM 618 C ASP A 37 30.427 -2.168 -2.011 1.00 72.13 C ATOM 619 O ASP A 37 31.203 -1.366 -2.527 1.00 50.54 O ATOM 620 CB ASP A 37 31.543 -4.025 -3.208 1.00 64.14 C ATOM 621 CG ASP A 37 31.670 -5.541 -3.376 1.00 4.42 C ATOM 622 OD1 ASP A 37 32.781 -6.093 -3.369 1.00 35.11 O ATOM 623 OD2 ASP A 37 30.553 -6.169 -3.520 1.00 51.31 O ATOM 0 H ASP A 37 29.548 -3.135 -4.581 1.00 13.11 H new ATOM 0 HA ASP A 37 29.856 -4.264 -1.893 1.00 5.43 H new ATOM 0 HB2 ASP A 37 31.695 -3.553 -4.179 1.00 64.14 H new ATOM 0 HB3 ASP A 37 32.345 -3.678 -2.556 1.00 64.14 H new ATOM 629 N VAL A 38 29.729 -1.935 -0.909 1.00 40.15 N ATOM 630 CA VAL A 38 29.838 -0.666 -0.209 1.00 72.33 C ATOM 631 C VAL A 38 31.067 -0.695 0.701 1.00 30.03 C ATOM 632 O VAL A 38 31.059 -1.352 1.741 1.00 74.42 O ATOM 633 CB VAL A 38 28.540 -0.373 0.547 1.00 64.11 C ATOM 634 CG1 VAL A 38 28.664 0.910 1.372 1.00 64.44 C ATOM 635 CG2 VAL A 38 27.352 -0.295 -0.413 1.00 52.14 C ATOM 0 H VAL A 38 29.086 -2.603 -0.484 1.00 40.15 H new ATOM 0 HA VAL A 38 29.977 0.151 -0.917 1.00 72.33 H new ATOM 0 HB VAL A 38 28.360 -1.198 1.236 1.00 64.11 H new ATOM 0 HG11 VAL A 38 27.728 1.095 1.899 1.00 64.44 H new ATOM 0 HG12 VAL A 38 29.472 0.801 2.095 1.00 64.44 H new ATOM 0 HG13 VAL A 38 28.880 1.749 0.710 1.00 64.44 H new ATOM 0 HG21 VAL A 38 26.442 -0.086 0.150 1.00 52.14 H new ATOM 0 HG22 VAL A 38 27.521 0.501 -1.138 1.00 52.14 H new ATOM 0 HG23 VAL A 38 27.244 -1.245 -0.937 1.00 52.14 H new ATOM 645 N ARG A 39 32.095 0.026 0.278 1.00 54.14 N ATOM 646 CA ARG A 39 33.329 0.092 1.042 1.00 73.51 C ATOM 647 C ARG A 39 33.156 1.013 2.251 1.00 31.22 C ATOM 648 O ARG A 39 33.557 2.175 2.213 1.00 21.10 O ATOM 649 CB ARG A 39 34.484 0.604 0.180 1.00 52.43 C ATOM 650 CG ARG A 39 35.389 -0.546 -0.265 1.00 72.42 C ATOM 651 CD ARG A 39 35.972 -1.283 0.942 1.00 21.41 C ATOM 652 NE ARG A 39 37.429 -1.040 1.028 1.00 3.54 N ATOM 653 CZ ARG A 39 38.327 -1.495 0.129 1.00 24.23 C ATOM 654 NH1 ARG A 39 37.924 -2.224 -0.933 1.00 41.32 N ATOM 655 NH2 ARG A 39 39.606 -1.218 0.305 1.00 50.21 N ATOM 0 H ARG A 39 32.098 0.570 -0.585 1.00 54.14 H new ATOM 0 HA ARG A 39 33.564 -0.917 1.381 1.00 73.51 H new ATOM 0 HB2 ARG A 39 34.088 1.119 -0.695 1.00 52.43 H new ATOM 0 HB3 ARG A 39 35.067 1.333 0.743 1.00 52.43 H new ATOM 0 HG2 ARG A 39 34.821 -1.243 -0.882 1.00 72.42 H new ATOM 0 HG3 ARG A 39 36.198 -0.158 -0.884 1.00 72.42 H new ATOM 0 HD2 ARG A 39 35.484 -0.944 1.856 1.00 21.41 H new ATOM 0 HD3 ARG A 39 35.778 -2.352 0.854 1.00 21.41 H new ATOM 0 HE ARG A 39 37.777 -0.494 1.816 1.00 3.54 H new ATOM 0 HH11 ARG A 39 36.934 -2.435 -1.061 1.00 41.32 H new ATOM 0 HH12 ARG A 39 38.609 -2.564 -1.608 1.00 41.32 H new ATOM 0 HH21 ARG A 39 39.902 -0.668 1.111 1.00 50.21 H new ATOM 0 HH22 ARG A 39 40.298 -1.554 -0.365 1.00 50.21 H new ATOM 668 N LEU A 40 32.558 0.459 3.296 1.00 43.10 N ATOM 669 CA LEU A 40 32.327 1.217 4.514 1.00 25.54 C ATOM 670 C LEU A 40 33.664 1.739 5.046 1.00 53.35 C ATOM 671 O LEU A 40 33.711 2.778 5.703 1.00 71.02 O ATOM 672 CB LEU A 40 31.549 0.376 5.528 1.00 21.05 C ATOM 673 CG LEU A 40 30.026 0.522 5.492 1.00 24.34 C ATOM 674 CD1 LEU A 40 29.571 1.728 6.316 1.00 24.22 C ATOM 675 CD2 LEU A 40 29.516 0.586 4.052 1.00 52.25 C ATOM 0 H LEU A 40 32.227 -0.505 3.324 1.00 43.10 H new ATOM 0 HA LEU A 40 31.703 2.087 4.309 1.00 25.54 H new ATOM 0 HB2 LEU A 40 31.798 -0.673 5.367 1.00 21.05 H new ATOM 0 HB3 LEU A 40 31.896 0.636 6.528 1.00 21.05 H new ATOM 0 HG LEU A 40 29.587 -0.364 5.950 1.00 24.34 H new ATOM 0 HD11 LEU A 40 28.485 1.809 6.274 1.00 24.22 H new ATOM 0 HD12 LEU A 40 29.885 1.600 7.352 1.00 24.22 H new ATOM 0 HD13 LEU A 40 30.018 2.635 5.910 1.00 24.22 H new ATOM 0 HD21 LEU A 40 28.431 0.690 4.055 1.00 52.25 H new ATOM 0 HD22 LEU A 40 29.961 1.443 3.546 1.00 52.25 H new ATOM 0 HD23 LEU A 40 29.792 -0.329 3.527 1.00 52.25 H new ATOM 687 N LYS A 41 34.717 0.996 4.741 1.00 71.42 N ATOM 688 CA LYS A 41 36.050 1.371 5.179 1.00 4.03 C ATOM 689 C LYS A 41 37.082 0.803 4.203 1.00 44.42 C ATOM 690 O LYS A 41 36.771 -0.087 3.413 1.00 1.21 O ATOM 691 CB LYS A 41 36.277 0.944 6.631 1.00 62.22 C ATOM 692 CG LYS A 41 37.300 1.852 7.316 1.00 14.45 C ATOM 693 CD LYS A 41 37.437 1.502 8.800 1.00 54.34 C ATOM 694 CE LYS A 41 36.210 1.965 9.588 1.00 51.52 C ATOM 695 NZ LYS A 41 36.586 3.013 10.564 1.00 70.42 N ATOM 0 H LYS A 41 34.674 0.135 4.195 1.00 71.42 H new ATOM 0 HA LYS A 41 36.163 2.455 5.168 1.00 4.03 H new ATOM 0 HB2 LYS A 41 35.333 0.978 7.175 1.00 62.22 H new ATOM 0 HB3 LYS A 41 36.625 -0.089 6.660 1.00 62.22 H new ATOM 0 HG2 LYS A 41 38.268 1.752 6.824 1.00 14.45 H new ATOM 0 HG3 LYS A 41 36.995 2.893 7.211 1.00 14.45 H new ATOM 0 HD2 LYS A 41 37.561 0.425 8.913 1.00 54.34 H new ATOM 0 HD3 LYS A 41 38.333 1.971 9.207 1.00 54.34 H new ATOM 0 HE2 LYS A 41 35.455 2.351 8.903 1.00 51.52 H new ATOM 0 HE3 LYS A 41 35.764 1.118 10.109 1.00 51.52 H new ATOM 0 HZ1 LYS A 41 35.742 3.316 11.090 1.00 70.42 H new ATOM 0 HZ2 LYS A 41 37.290 2.632 11.228 1.00 70.42 H new ATOM 0 HZ3 LYS A 41 36.991 3.828 10.060 1.00 70.42 H new ATOM 708 N THR A 42 38.290 1.342 4.289 1.00 71.14 N ATOM 709 CA THR A 42 39.370 0.900 3.422 1.00 14.33 C ATOM 710 C THR A 42 39.697 -0.571 3.686 1.00 52.13 C ATOM 711 O THR A 42 40.421 -1.197 2.913 1.00 34.54 O ATOM 712 CB THR A 42 40.561 1.836 3.637 1.00 21.34 C ATOM 713 OG1 THR A 42 40.334 2.903 2.721 1.00 1.34 O ATOM 714 CG2 THR A 42 41.881 1.219 3.171 1.00 24.00 C ATOM 0 H THR A 42 38.545 2.080 4.945 1.00 71.14 H new ATOM 0 HA THR A 42 39.082 0.953 2.372 1.00 14.33 H new ATOM 0 HB THR A 42 40.634 2.094 4.693 1.00 21.34 H new ATOM 0 HG1 THR A 42 41.059 3.558 2.795 1.00 1.34 H new ATOM 0 HG21 THR A 42 42.694 1.924 3.346 1.00 24.00 H new ATOM 0 HG22 THR A 42 42.070 0.301 3.728 1.00 24.00 H new ATOM 0 HG23 THR A 42 41.821 0.992 2.107 1.00 24.00 H new ATOM 722 N ASP A 43 39.148 -1.079 4.779 1.00 74.51 N ATOM 723 CA ASP A 43 39.372 -2.465 5.154 1.00 71.31 C ATOM 724 C ASP A 43 38.041 -3.101 5.561 1.00 50.14 C ATOM 725 O ASP A 43 38.016 -4.207 6.098 1.00 73.35 O ATOM 726 CB ASP A 43 40.327 -2.566 6.345 1.00 43.15 C ATOM 727 CG ASP A 43 41.606 -1.736 6.219 1.00 3.43 C ATOM 728 OD1 ASP A 43 41.557 -0.506 6.066 1.00 61.10 O ATOM 729 OD2 ASP A 43 42.703 -2.411 6.286 1.00 64.01 O ATOM 0 H ASP A 43 38.548 -0.556 5.417 1.00 74.51 H new ATOM 0 HA ASP A 43 39.807 -2.979 4.297 1.00 71.31 H new ATOM 0 HB2 ASP A 43 39.796 -2.254 7.245 1.00 43.15 H new ATOM 0 HB3 ASP A 43 40.602 -3.612 6.483 1.00 43.15 H new ATOM 735 N THR A 44 36.967 -2.374 5.289 1.00 1.22 N ATOM 736 CA THR A 44 35.636 -2.853 5.620 1.00 12.33 C ATOM 737 C THR A 44 34.755 -2.886 4.370 1.00 71.12 C ATOM 738 O THR A 44 34.630 -1.884 3.667 1.00 62.40 O ATOM 739 CB THR A 44 35.077 -1.964 6.734 1.00 61.44 C ATOM 740 OG1 THR A 44 36.076 -2.010 7.749 1.00 62.24 O ATOM 741 CG2 THR A 44 33.840 -2.570 7.401 1.00 43.34 C ATOM 0 H THR A 44 36.992 -1.457 4.843 1.00 1.22 H new ATOM 0 HA THR A 44 35.665 -3.879 5.986 1.00 12.33 H new ATOM 0 HB THR A 44 34.827 -0.985 6.326 1.00 61.44 H new ATOM 0 HG1 THR A 44 35.796 -1.459 8.509 1.00 62.24 H new ATOM 0 HG21 THR A 44 33.484 -1.900 8.183 1.00 43.34 H new ATOM 0 HG22 THR A 44 33.056 -2.708 6.656 1.00 43.34 H new ATOM 0 HG23 THR A 44 34.098 -3.534 7.839 1.00 43.34 H new ATOM 749 N LEU A 45 34.167 -4.049 4.130 1.00 14.24 N ATOM 750 CA LEU A 45 33.301 -4.226 2.977 1.00 71.11 C ATOM 751 C LEU A 45 31.863 -4.441 3.452 1.00 34.34 C ATOM 752 O LEU A 45 31.620 -5.216 4.376 1.00 31.32 O ATOM 753 CB LEU A 45 33.827 -5.349 2.080 1.00 54.51 C ATOM 754 CG LEU A 45 32.906 -5.779 0.936 1.00 65.42 C ATOM 755 CD1 LEU A 45 31.637 -6.442 1.473 1.00 32.24 C ATOM 756 CD2 LEU A 45 32.591 -4.601 0.012 1.00 10.15 C ATOM 0 H LEU A 45 34.273 -4.878 4.715 1.00 14.24 H new ATOM 0 HA LEU A 45 33.301 -3.328 2.359 1.00 71.11 H new ATOM 0 HB2 LEU A 45 34.779 -5.032 1.654 1.00 54.51 H new ATOM 0 HB3 LEU A 45 34.031 -6.220 2.703 1.00 54.51 H new ATOM 0 HG LEU A 45 33.430 -6.525 0.338 1.00 65.42 H new ATOM 0 HD11 LEU A 45 31.000 -6.738 0.639 1.00 32.24 H new ATOM 0 HD12 LEU A 45 31.905 -7.324 2.055 1.00 32.24 H new ATOM 0 HD13 LEU A 45 31.099 -5.738 2.108 1.00 32.24 H new ATOM 0 HD21 LEU A 45 31.935 -4.935 -0.792 1.00 10.15 H new ATOM 0 HD22 LEU A 45 32.096 -3.814 0.581 1.00 10.15 H new ATOM 0 HD23 LEU A 45 33.517 -4.214 -0.413 1.00 10.15 H new ATOM 768 N LEU A 46 30.946 -3.742 2.800 1.00 44.45 N ATOM 769 CA LEU A 46 29.539 -3.846 3.144 1.00 73.40 C ATOM 770 C LEU A 46 28.737 -4.203 1.891 1.00 54.22 C ATOM 771 O LEU A 46 28.534 -3.360 1.019 1.00 52.54 O ATOM 772 CB LEU A 46 29.060 -2.569 3.838 1.00 63.42 C ATOM 773 CG LEU A 46 27.850 -2.721 4.761 1.00 11.04 C ATOM 774 CD1 LEU A 46 26.807 -1.637 4.481 1.00 62.21 C ATOM 775 CD2 LEU A 46 27.256 -4.127 4.661 1.00 61.44 C ATOM 0 H LEU A 46 31.151 -3.100 2.034 1.00 44.45 H new ATOM 0 HA LEU A 46 29.382 -4.650 3.863 1.00 73.40 H new ATOM 0 HB2 LEU A 46 29.887 -2.163 4.420 1.00 63.42 H new ATOM 0 HB3 LEU A 46 28.818 -1.832 3.072 1.00 63.42 H new ATOM 0 HG LEU A 46 28.186 -2.587 5.789 1.00 11.04 H new ATOM 0 HD11 LEU A 46 25.957 -1.768 5.151 1.00 62.21 H new ATOM 0 HD12 LEU A 46 27.250 -0.655 4.645 1.00 62.21 H new ATOM 0 HD13 LEU A 46 26.470 -1.715 3.447 1.00 62.21 H new ATOM 0 HD21 LEU A 46 26.397 -4.207 5.327 1.00 61.44 H new ATOM 0 HD22 LEU A 46 26.938 -4.316 3.636 1.00 61.44 H new ATOM 0 HD23 LEU A 46 28.009 -4.861 4.949 1.00 61.44 H new ATOM 787 N GLU A 47 28.302 -5.453 1.841 1.00 61.40 N ATOM 788 CA GLU A 47 27.527 -5.932 0.709 1.00 13.20 C ATOM 789 C GLU A 47 26.058 -5.533 0.865 1.00 33.45 C ATOM 790 O GLU A 47 25.368 -6.028 1.756 1.00 62.12 O ATOM 791 CB GLU A 47 27.670 -7.446 0.547 1.00 33.43 C ATOM 792 CG GLU A 47 28.978 -7.801 -0.163 1.00 13.11 C ATOM 793 CD GLU A 47 29.514 -9.151 0.318 1.00 5.53 C ATOM 794 OE1 GLU A 47 28.741 -9.986 0.810 1.00 51.14 O ATOM 795 OE2 GLU A 47 30.785 -9.318 0.166 1.00 15.31 O ATOM 0 H GLU A 47 28.472 -6.149 2.567 1.00 61.40 H new ATOM 0 HA GLU A 47 27.916 -5.465 -0.196 1.00 13.20 H new ATOM 0 HB2 GLU A 47 27.642 -7.924 1.526 1.00 33.43 H new ATOM 0 HB3 GLU A 47 26.826 -7.836 -0.022 1.00 33.43 H new ATOM 0 HG2 GLU A 47 28.814 -7.834 -1.240 1.00 13.11 H new ATOM 0 HG3 GLU A 47 29.719 -7.024 0.023 1.00 13.11 H new ATOM 803 N LEU A 48 25.622 -4.643 -0.014 1.00 4.24 N ATOM 804 CA LEU A 48 24.248 -4.172 0.016 1.00 71.42 C ATOM 805 C LEU A 48 23.418 -4.973 -0.989 1.00 73.15 C ATOM 806 O LEU A 48 23.730 -4.997 -2.179 1.00 2.31 O ATOM 807 CB LEU A 48 24.194 -2.660 -0.209 1.00 4.12 C ATOM 808 CG LEU A 48 22.797 -2.044 -0.300 1.00 34.31 C ATOM 809 CD1 LEU A 48 22.052 -2.556 -1.534 1.00 75.21 C ATOM 810 CD2 LEU A 48 22.006 -2.286 0.988 1.00 43.32 C ATOM 0 H LEU A 48 26.196 -4.235 -0.752 1.00 4.24 H new ATOM 0 HA LEU A 48 23.809 -4.340 1.000 1.00 71.42 H new ATOM 0 HB2 LEU A 48 24.732 -2.172 0.604 1.00 4.12 H new ATOM 0 HB3 LEU A 48 24.731 -2.430 -1.129 1.00 4.12 H new ATOM 0 HG LEU A 48 22.906 -0.965 -0.413 1.00 34.31 H new ATOM 0 HD11 LEU A 48 21.062 -2.103 -1.575 1.00 75.21 H new ATOM 0 HD12 LEU A 48 22.610 -2.291 -2.432 1.00 75.21 H new ATOM 0 HD13 LEU A 48 21.953 -3.640 -1.475 1.00 75.21 H new ATOM 0 HD21 LEU A 48 21.017 -1.838 0.897 1.00 43.32 H new ATOM 0 HD22 LEU A 48 21.905 -3.358 1.157 1.00 43.32 H new ATOM 0 HD23 LEU A 48 22.533 -1.835 1.829 1.00 43.32 H new ATOM 822 N HIS A 49 22.376 -5.610 -0.474 1.00 41.44 N ATOM 823 CA HIS A 49 21.499 -6.409 -1.312 1.00 73.42 C ATOM 824 C HIS A 49 20.133 -5.728 -1.422 1.00 61.31 C ATOM 825 O HIS A 49 19.602 -5.231 -0.431 1.00 12.43 O ATOM 826 CB HIS A 49 21.405 -7.844 -0.788 1.00 5.44 C ATOM 827 CG HIS A 49 22.742 -8.469 -0.468 1.00 5.44 C ATOM 828 ND1 HIS A 49 22.867 -9.648 0.246 1.00 2.42 N ATOM 829 CD2 HIS A 49 24.010 -8.067 -0.772 1.00 52.23 C ATOM 830 CE1 HIS A 49 24.156 -9.933 0.361 1.00 50.31 C ATOM 831 NE2 HIS A 49 24.862 -8.952 -0.271 1.00 5.45 N ATOM 0 H HIS A 49 22.120 -5.589 0.513 1.00 41.44 H new ATOM 0 HA HIS A 49 21.915 -6.477 -2.317 1.00 73.42 H new ATOM 0 HB2 HIS A 49 20.787 -7.852 0.110 1.00 5.44 H new ATOM 0 HB3 HIS A 49 20.896 -8.459 -1.531 1.00 5.44 H new ATOM 0 HD1 HIS A 49 22.098 -10.203 0.620 1.00 2.42 H new ATOM 0 HD2 HIS A 49 24.275 -7.179 -1.326 1.00 52.23 H new ATOM 0 HE1 HIS A 49 24.574 -10.791 0.866 1.00 50.31 H new ATOM 839 N ILE A 50 19.604 -5.728 -2.637 1.00 31.12 N ATOM 840 CA ILE A 50 18.310 -5.116 -2.889 1.00 63.44 C ATOM 841 C ILE A 50 17.369 -6.158 -3.498 1.00 13.42 C ATOM 842 O ILE A 50 17.667 -6.734 -4.543 1.00 14.31 O ATOM 843 CB ILE A 50 18.471 -3.858 -3.745 1.00 13.02 C ATOM 844 CG1 ILE A 50 17.120 -3.177 -3.976 1.00 43.34 C ATOM 845 CG2 ILE A 50 19.185 -4.176 -5.060 1.00 22.23 C ATOM 846 CD1 ILE A 50 17.172 -2.258 -5.198 1.00 44.45 C ATOM 0 H ILE A 50 20.048 -6.142 -3.457 1.00 31.12 H new ATOM 0 HA ILE A 50 17.857 -4.783 -1.955 1.00 63.44 H new ATOM 0 HB ILE A 50 19.099 -3.153 -3.201 1.00 13.02 H new ATOM 0 HG12 ILE A 50 16.347 -3.933 -4.117 1.00 43.34 H new ATOM 0 HG13 ILE A 50 16.844 -2.600 -3.094 1.00 43.34 H new ATOM 0 HG21 ILE A 50 19.286 -3.264 -5.649 1.00 22.23 H new ATOM 0 HG22 ILE A 50 20.174 -4.583 -4.848 1.00 22.23 H new ATOM 0 HG23 ILE A 50 18.604 -4.908 -5.621 1.00 22.23 H new ATOM 0 HD11 ILE A 50 16.200 -1.786 -5.340 1.00 44.45 H new ATOM 0 HD12 ILE A 50 17.929 -1.489 -5.043 1.00 44.45 H new ATOM 0 HD13 ILE A 50 17.424 -2.843 -6.083 1.00 44.45 H new ATOM 858 N TYR A 51 16.251 -6.367 -2.818 1.00 23.34 N ATOM 859 CA TYR A 51 15.264 -7.329 -3.278 1.00 21.01 C ATOM 860 C TYR A 51 13.843 -6.821 -3.024 1.00 45.34 C ATOM 861 O TYR A 51 13.656 -5.779 -2.397 1.00 74.34 O ATOM 862 CB TYR A 51 15.494 -8.597 -2.453 1.00 41.11 C ATOM 863 CG TYR A 51 15.523 -8.359 -0.942 1.00 64.40 C ATOM 864 CD1 TYR A 51 16.558 -7.641 -0.376 1.00 74.52 C ATOM 865 CD2 TYR A 51 14.516 -8.863 -0.145 1.00 11.04 C ATOM 866 CE1 TYR A 51 16.585 -7.418 1.046 1.00 2.11 C ATOM 867 CE2 TYR A 51 14.543 -8.639 1.278 1.00 65.44 C ATOM 868 CZ TYR A 51 15.577 -7.928 1.803 1.00 52.22 C ATOM 869 OH TYR A 51 15.603 -7.717 3.146 1.00 11.30 O ATOM 0 H TYR A 51 16.007 -5.886 -1.952 1.00 23.34 H new ATOM 0 HA TYR A 51 15.368 -7.502 -4.349 1.00 21.01 H new ATOM 0 HB2 TYR A 51 14.707 -9.315 -2.682 1.00 41.11 H new ATOM 0 HB3 TYR A 51 16.437 -9.050 -2.757 1.00 41.11 H new ATOM 0 HD1 TYR A 51 17.347 -7.247 -1.000 1.00 74.52 H new ATOM 0 HD2 TYR A 51 13.707 -9.426 -0.588 1.00 11.04 H new ATOM 0 HE1 TYR A 51 17.388 -6.858 1.502 1.00 2.11 H new ATOM 0 HE2 TYR A 51 13.760 -9.027 1.913 1.00 65.44 H new ATOM 0 HH TYR A 51 14.690 -7.572 3.472 1.00 11.30 H new ATOM 879 N TYR A 52 12.880 -7.580 -3.525 1.00 14.42 N ATOM 880 CA TYR A 52 11.482 -7.219 -3.360 1.00 54.04 C ATOM 881 C TYR A 52 10.808 -8.100 -2.306 1.00 5.11 C ATOM 882 O TYR A 52 11.149 -9.273 -2.162 1.00 44.04 O ATOM 883 CB TYR A 52 10.819 -7.471 -4.716 1.00 50.53 C ATOM 884 CG TYR A 52 9.324 -7.146 -4.748 1.00 43.42 C ATOM 885 CD1 TYR A 52 8.404 -8.092 -4.346 1.00 13.20 C ATOM 886 CD2 TYR A 52 8.897 -5.906 -5.179 1.00 75.23 C ATOM 887 CE1 TYR A 52 6.997 -7.786 -4.376 1.00 51.11 C ATOM 888 CE2 TYR A 52 7.490 -5.600 -5.209 1.00 73.34 C ATOM 889 CZ TYR A 52 6.609 -6.555 -4.806 1.00 63.34 C ATOM 890 OH TYR A 52 5.281 -6.266 -4.835 1.00 33.52 O ATOM 0 H TYR A 52 13.040 -8.443 -4.045 1.00 14.42 H new ATOM 0 HA TYR A 52 11.390 -6.183 -3.034 1.00 54.04 H new ATOM 0 HB2 TYR A 52 11.326 -6.874 -5.474 1.00 50.53 H new ATOM 0 HB3 TYR A 52 10.959 -8.517 -4.988 1.00 50.53 H new ATOM 0 HD1 TYR A 52 8.739 -9.062 -4.009 1.00 13.20 H new ATOM 0 HD2 TYR A 52 9.618 -5.166 -5.494 1.00 75.23 H new ATOM 0 HE1 TYR A 52 6.266 -8.517 -4.064 1.00 51.11 H new ATOM 0 HE2 TYR A 52 7.142 -4.634 -5.544 1.00 73.34 H new ATOM 0 HH TYR A 52 5.143 -5.335 -4.561 1.00 33.52 H new ATOM 900 N ASP A 53 9.865 -7.500 -1.595 1.00 73.41 N ATOM 901 CA ASP A 53 9.141 -8.216 -0.558 1.00 53.31 C ATOM 902 C ASP A 53 7.666 -8.321 -0.952 1.00 11.44 C ATOM 903 O ASP A 53 6.956 -7.317 -0.985 1.00 53.20 O ATOM 904 CB ASP A 53 9.222 -7.477 0.779 1.00 32.54 C ATOM 905 CG ASP A 53 10.258 -8.029 1.761 1.00 42.14 C ATOM 906 OD1 ASP A 53 11.209 -8.718 1.364 1.00 24.52 O ATOM 907 OD2 ASP A 53 10.057 -7.720 2.997 1.00 71.01 O ATOM 0 H ASP A 53 9.585 -6.527 -1.716 1.00 73.41 H new ATOM 0 HA ASP A 53 9.590 -9.203 -0.452 1.00 53.31 H new ATOM 0 HB2 ASP A 53 9.450 -6.429 0.585 1.00 32.54 H new ATOM 0 HB3 ASP A 53 8.241 -7.507 1.254 1.00 32.54 H new ATOM 913 N HIS A 54 7.249 -9.545 -1.240 1.00 11.24 N ATOM 914 CA HIS A 54 5.871 -9.794 -1.629 1.00 45.14 C ATOM 915 C HIS A 54 4.990 -9.865 -0.381 1.00 73.11 C ATOM 916 O HIS A 54 3.793 -10.133 -0.476 1.00 61.43 O ATOM 917 CB HIS A 54 5.771 -11.049 -2.498 1.00 64.15 C ATOM 918 CG HIS A 54 6.923 -11.224 -3.459 1.00 64.40 C ATOM 919 ND1 HIS A 54 8.226 -11.563 -3.236 1.00 42.33 N flip ATOM 920 CD2 HIS A 54 6.794 -11.046 -4.825 1.00 51.24 C flip ATOM 921 CE1 HIS A 54 8.857 -11.591 -4.403 1.00 14.13 C flip ATOM 922 NE2 HIS A 54 7.972 -11.270 -5.390 1.00 45.24 N flip ATOM 0 H HIS A 54 7.841 -10.375 -1.212 1.00 11.24 H new ATOM 0 HA HIS A 54 5.507 -8.969 -2.241 1.00 45.14 H new ATOM 0 HB2 HIS A 54 5.716 -11.924 -1.850 1.00 64.15 H new ATOM 0 HB3 HIS A 54 4.841 -11.013 -3.065 1.00 64.15 H new ATOM 0 HD1 HIS A 54 8.644 -11.761 -2.327 1.00 42.33 H new ATOM 0 HD2 HIS A 54 5.887 -10.771 -5.343 1.00 51.24 H new ATOM 0 HE1 HIS A 54 9.900 -11.829 -4.548 1.00 14.13 H new ATOM 930 N VAL A 55 5.615 -9.620 0.761 1.00 63.12 N ATOM 931 CA VAL A 55 4.903 -9.653 2.027 1.00 74.03 C ATOM 932 C VAL A 55 4.181 -8.320 2.236 1.00 62.14 C ATOM 933 O VAL A 55 3.066 -8.288 2.753 1.00 74.42 O ATOM 934 CB VAL A 55 5.869 -9.994 3.163 1.00 61.23 C ATOM 935 CG1 VAL A 55 6.303 -11.460 3.092 1.00 41.43 C ATOM 936 CG2 VAL A 55 7.082 -9.062 3.149 1.00 10.32 C ATOM 0 H VAL A 55 6.608 -9.398 0.836 1.00 63.12 H new ATOM 0 HA VAL A 55 4.145 -10.436 2.018 1.00 74.03 H new ATOM 0 HB VAL A 55 5.343 -9.846 4.106 1.00 61.23 H new ATOM 0 HG11 VAL A 55 6.989 -11.676 3.911 1.00 41.43 H new ATOM 0 HG12 VAL A 55 5.427 -12.103 3.174 1.00 41.43 H new ATOM 0 HG13 VAL A 55 6.802 -11.646 2.141 1.00 41.43 H new ATOM 0 HG21 VAL A 55 7.753 -9.326 3.967 1.00 10.32 H new ATOM 0 HG22 VAL A 55 7.609 -9.164 2.200 1.00 10.32 H new ATOM 0 HG23 VAL A 55 6.750 -8.031 3.270 1.00 10.32 H new ATOM 946 N TYR A 56 4.848 -7.252 1.823 1.00 75.04 N ATOM 947 CA TYR A 56 4.284 -5.920 1.958 1.00 12.41 C ATOM 948 C TYR A 56 4.196 -5.221 0.600 1.00 43.42 C ATOM 949 O TYR A 56 3.712 -4.094 0.508 1.00 52.23 O ATOM 950 CB TYR A 56 5.248 -5.143 2.857 1.00 63.13 C ATOM 951 CG TYR A 56 5.526 -5.818 4.201 1.00 21.12 C ATOM 952 CD1 TYR A 56 4.483 -6.101 5.060 1.00 64.53 C ATOM 953 CD2 TYR A 56 6.820 -6.144 4.556 1.00 53.13 C ATOM 954 CE1 TYR A 56 4.745 -6.737 6.325 1.00 11.22 C ATOM 955 CE2 TYR A 56 7.081 -6.779 5.821 1.00 22.22 C ATOM 956 CZ TYR A 56 6.031 -7.044 6.643 1.00 31.35 C ATOM 957 OH TYR A 56 6.278 -7.644 7.839 1.00 70.43 O ATOM 0 H TYR A 56 5.773 -7.282 1.395 1.00 75.04 H new ATOM 0 HA TYR A 56 3.276 -5.970 2.370 1.00 12.41 H new ATOM 0 HB2 TYR A 56 6.191 -5.007 2.328 1.00 63.13 H new ATOM 0 HB3 TYR A 56 4.838 -4.150 3.039 1.00 63.13 H new ATOM 0 HD1 TYR A 56 3.471 -5.845 4.783 1.00 64.53 H new ATOM 0 HD2 TYR A 56 7.636 -5.922 3.884 1.00 53.13 H new ATOM 0 HE1 TYR A 56 3.938 -6.965 7.006 1.00 11.22 H new ATOM 0 HE2 TYR A 56 8.088 -7.039 6.111 1.00 22.22 H new ATOM 0 HH TYR A 56 7.240 -7.806 7.931 1.00 70.43 H new ATOM 967 N HIS A 57 4.673 -5.918 -0.421 1.00 32.33 N ATOM 968 CA HIS A 57 4.654 -5.379 -1.770 1.00 5.23 C ATOM 969 C HIS A 57 5.531 -4.126 -1.833 1.00 60.45 C ATOM 970 O HIS A 57 5.095 -3.083 -2.317 1.00 50.12 O ATOM 971 CB HIS A 57 3.219 -5.122 -2.233 1.00 20.04 C ATOM 972 CG HIS A 57 2.571 -6.306 -2.909 1.00 72.33 C ATOM 973 ND1 HIS A 57 2.659 -6.532 -4.272 1.00 14.31 N ATOM 974 CD2 HIS A 57 1.826 -7.328 -2.397 1.00 53.41 C ATOM 975 CE1 HIS A 57 1.992 -7.641 -4.556 1.00 52.32 C ATOM 976 NE2 HIS A 57 1.476 -8.132 -3.393 1.00 70.21 N ATOM 0 H HIS A 57 5.075 -6.852 -0.341 1.00 32.33 H new ATOM 0 HA HIS A 57 5.072 -6.109 -2.463 1.00 5.23 H new ATOM 0 HB2 HIS A 57 2.616 -4.834 -1.372 1.00 20.04 H new ATOM 0 HB3 HIS A 57 3.216 -4.277 -2.921 1.00 20.04 H new ATOM 0 HD1 HIS A 57 3.153 -5.945 -4.944 1.00 14.31 H new ATOM 0 HD2 HIS A 57 1.565 -7.460 -1.357 1.00 53.41 H new ATOM 0 HE1 HIS A 57 1.877 -8.079 -5.536 1.00 52.32 H new ATOM 984 N VAL A 58 6.751 -4.271 -1.338 1.00 63.42 N ATOM 985 CA VAL A 58 7.693 -3.165 -1.333 1.00 22.03 C ATOM 986 C VAL A 58 9.120 -3.716 -1.352 1.00 4.23 C ATOM 987 O VAL A 58 9.339 -4.892 -1.068 1.00 64.51 O ATOM 988 CB VAL A 58 7.421 -2.252 -0.136 1.00 13.33 C ATOM 989 CG1 VAL A 58 6.436 -1.141 -0.506 1.00 73.35 C ATOM 990 CG2 VAL A 58 6.915 -3.056 1.063 1.00 15.14 C ATOM 0 H VAL A 58 7.109 -5.138 -0.937 1.00 63.42 H new ATOM 0 HA VAL A 58 7.569 -2.553 -2.227 1.00 22.03 H new ATOM 0 HB VAL A 58 8.363 -1.783 0.148 1.00 13.33 H new ATOM 0 HG11 VAL A 58 6.260 -0.507 0.363 1.00 73.35 H new ATOM 0 HG12 VAL A 58 6.852 -0.541 -1.315 1.00 73.35 H new ATOM 0 HG13 VAL A 58 5.494 -1.583 -0.829 1.00 73.35 H new ATOM 0 HG21 VAL A 58 6.729 -2.383 1.900 1.00 15.14 H new ATOM 0 HG22 VAL A 58 5.989 -3.565 0.795 1.00 15.14 H new ATOM 0 HG23 VAL A 58 7.665 -3.793 1.349 1.00 15.14 H new ATOM 1000 N PRO A 59 10.079 -2.816 -1.698 1.00 4.44 N ATOM 1001 CA PRO A 59 11.479 -3.199 -1.757 1.00 65.33 C ATOM 1002 C PRO A 59 12.070 -3.340 -0.353 1.00 33.52 C ATOM 1003 O PRO A 59 11.520 -2.810 0.612 1.00 63.34 O ATOM 1004 CB PRO A 59 12.151 -2.110 -2.577 1.00 63.13 C ATOM 1005 CG PRO A 59 11.201 -0.924 -2.552 1.00 43.33 C ATOM 1006 CD PRO A 59 9.857 -1.414 -2.040 1.00 11.22 C ATOM 0 HA PRO A 59 11.628 -4.176 -2.218 1.00 65.33 H new ATOM 0 HB2 PRO A 59 13.119 -1.844 -2.154 1.00 63.13 H new ATOM 0 HB3 PRO A 59 12.331 -2.445 -3.599 1.00 63.13 H new ATOM 0 HG2 PRO A 59 11.591 -0.136 -1.907 1.00 43.33 H new ATOM 0 HG3 PRO A 59 11.097 -0.497 -3.550 1.00 43.33 H new ATOM 0 HD2 PRO A 59 9.531 -0.841 -1.172 1.00 11.22 H new ATOM 0 HD3 PRO A 59 9.082 -1.310 -2.799 1.00 11.22 H new ATOM 1014 N SER A 60 13.181 -4.058 -0.282 1.00 63.01 N ATOM 1015 CA SER A 60 13.852 -4.275 0.988 1.00 22.53 C ATOM 1016 C SER A 60 15.363 -4.109 0.817 1.00 25.22 C ATOM 1017 O SER A 60 15.859 -4.027 -0.305 1.00 64.35 O ATOM 1018 CB SER A 60 13.531 -5.662 1.551 1.00 40.44 C ATOM 1019 OG SER A 60 14.115 -5.865 2.835 1.00 74.24 O ATOM 0 H SER A 60 13.633 -4.497 -1.084 1.00 63.01 H new ATOM 0 HA SER A 60 13.489 -3.531 1.698 1.00 22.53 H new ATOM 0 HB2 SER A 60 12.450 -5.784 1.621 1.00 40.44 H new ATOM 0 HB3 SER A 60 13.894 -6.426 0.863 1.00 40.44 H new ATOM 0 HG SER A 60 15.032 -6.194 2.729 1.00 74.24 H new ATOM 1025 N ILE A 61 16.053 -4.064 1.947 1.00 23.34 N ATOM 1026 CA ILE A 61 17.498 -3.909 1.937 1.00 60.23 C ATOM 1027 C ILE A 61 18.115 -4.849 2.975 1.00 41.14 C ATOM 1028 O ILE A 61 17.672 -4.890 4.121 1.00 11.13 O ATOM 1029 CB ILE A 61 17.881 -2.441 2.132 1.00 12.20 C ATOM 1030 CG1 ILE A 61 17.425 -1.593 0.943 1.00 13.41 C ATOM 1031 CG2 ILE A 61 19.381 -2.296 2.398 1.00 54.22 C ATOM 1032 CD1 ILE A 61 16.977 -0.203 1.401 1.00 72.03 C ATOM 0 H ILE A 61 15.638 -4.132 2.876 1.00 23.34 H new ATOM 0 HA ILE A 61 17.905 -4.194 0.967 1.00 60.23 H new ATOM 0 HB ILE A 61 17.360 -2.066 3.013 1.00 12.20 H new ATOM 0 HG12 ILE A 61 18.240 -1.498 0.225 1.00 13.41 H new ATOM 0 HG13 ILE A 61 16.604 -2.093 0.429 1.00 13.41 H new ATOM 0 HG21 ILE A 61 19.626 -1.243 2.533 1.00 54.22 H new ATOM 0 HG22 ILE A 61 19.646 -2.849 3.299 1.00 54.22 H new ATOM 0 HG23 ILE A 61 19.941 -2.693 1.551 1.00 54.22 H new ATOM 0 HD11 ILE A 61 16.658 0.380 0.537 1.00 72.03 H new ATOM 0 HD12 ILE A 61 16.146 -0.300 2.100 1.00 72.03 H new ATOM 0 HD13 ILE A 61 17.808 0.303 1.893 1.00 72.03 H new ATOM 1044 N LYS A 62 19.128 -5.581 2.535 1.00 4.41 N ATOM 1045 CA LYS A 62 19.811 -6.517 3.412 1.00 72.23 C ATOM 1046 C LYS A 62 21.303 -6.533 3.072 1.00 55.02 C ATOM 1047 O LYS A 62 21.675 -6.590 1.901 1.00 44.10 O ATOM 1048 CB LYS A 62 19.150 -7.895 3.342 1.00 34.24 C ATOM 1049 CG LYS A 62 20.148 -9.001 3.690 1.00 5.23 C ATOM 1050 CD LYS A 62 20.812 -9.557 2.429 1.00 43.21 C ATOM 1051 CE LYS A 62 19.808 -10.340 1.581 1.00 42.12 C ATOM 1052 NZ LYS A 62 19.211 -9.466 0.546 1.00 33.14 N ATOM 0 H LYS A 62 19.492 -5.545 1.583 1.00 4.41 H new ATOM 0 HA LYS A 62 19.724 -6.199 4.451 1.00 72.23 H new ATOM 0 HB2 LYS A 62 18.306 -7.933 4.030 1.00 34.24 H new ATOM 0 HB3 LYS A 62 18.752 -8.061 2.341 1.00 34.24 H new ATOM 0 HG2 LYS A 62 20.910 -8.609 4.364 1.00 5.23 H new ATOM 0 HG3 LYS A 62 19.636 -9.804 4.220 1.00 5.23 H new ATOM 0 HD2 LYS A 62 21.229 -8.739 1.842 1.00 43.21 H new ATOM 0 HD3 LYS A 62 21.643 -10.206 2.707 1.00 43.21 H new ATOM 0 HE2 LYS A 62 20.305 -11.187 1.108 1.00 42.12 H new ATOM 0 HE3 LYS A 62 19.023 -10.747 2.219 1.00 42.12 H new ATOM 0 HZ1 LYS A 62 18.185 -9.631 0.502 1.00 33.14 H new ATOM 0 HZ2 LYS A 62 19.392 -8.470 0.786 1.00 33.14 H new ATOM 0 HZ3 LYS A 62 19.636 -9.682 -0.378 1.00 33.14 H new ATOM 1065 N PHE A 63 22.115 -6.482 4.117 1.00 45.44 N ATOM 1066 CA PHE A 63 23.558 -6.489 3.943 1.00 22.35 C ATOM 1067 C PHE A 63 24.248 -7.178 5.123 1.00 44.41 C ATOM 1068 O PHE A 63 23.666 -7.306 6.199 1.00 41.32 O ATOM 1069 CB PHE A 63 24.009 -5.029 3.885 1.00 5.45 C ATOM 1070 CG PHE A 63 23.585 -4.198 5.098 1.00 53.51 C ATOM 1071 CD1 PHE A 63 24.220 -4.359 6.289 1.00 3.23 C ATOM 1072 CD2 PHE A 63 22.571 -3.297 4.984 1.00 24.50 C ATOM 1073 CE1 PHE A 63 23.826 -3.587 7.414 1.00 21.45 C ATOM 1074 CE2 PHE A 63 22.177 -2.526 6.109 1.00 22.22 C ATOM 1075 CZ PHE A 63 22.813 -2.687 7.301 1.00 71.34 C ATOM 0 H PHE A 63 21.802 -6.436 5.087 1.00 45.44 H new ATOM 0 HA PHE A 63 23.821 -7.032 3.035 1.00 22.35 H new ATOM 0 HB2 PHE A 63 25.095 -4.998 3.798 1.00 5.45 H new ATOM 0 HB3 PHE A 63 23.604 -4.570 2.983 1.00 5.45 H new ATOM 0 HD1 PHE A 63 25.024 -5.074 6.380 1.00 3.23 H new ATOM 0 HD2 PHE A 63 22.066 -3.169 4.038 1.00 24.50 H new ATOM 0 HE1 PHE A 63 24.331 -3.715 8.360 1.00 21.45 H new ATOM 0 HE2 PHE A 63 21.372 -1.811 6.019 1.00 22.22 H new ATOM 0 HZ PHE A 63 22.513 -2.100 8.157 1.00 71.34 H new ATOM 1085 N ARG A 64 25.480 -7.602 4.881 1.00 73.42 N ATOM 1086 CA ARG A 64 26.255 -8.274 5.909 1.00 24.35 C ATOM 1087 C ARG A 64 27.658 -7.669 5.997 1.00 70.21 C ATOM 1088 O ARG A 64 28.452 -7.798 5.067 1.00 44.24 O ATOM 1089 CB ARG A 64 26.371 -9.773 5.622 1.00 52.52 C ATOM 1090 CG ARG A 64 25.031 -10.346 5.157 1.00 71.35 C ATOM 1091 CD ARG A 64 25.137 -10.903 3.735 1.00 13.31 C ATOM 1092 NE ARG A 64 26.350 -11.740 3.608 1.00 23.14 N ATOM 1093 CZ ARG A 64 26.377 -13.072 3.828 1.00 3.20 C ATOM 1094 NH1 ARG A 64 25.255 -13.730 4.188 1.00 52.21 N ATOM 1095 NH2 ARG A 64 27.518 -13.721 3.686 1.00 52.02 N ATOM 0 H ARG A 64 25.960 -7.493 3.988 1.00 73.42 H new ATOM 0 HA ARG A 64 25.736 -8.137 6.857 1.00 24.35 H new ATOM 0 HB2 ARG A 64 27.129 -9.943 4.857 1.00 52.52 H new ATOM 0 HB3 ARG A 64 26.702 -10.295 6.520 1.00 52.52 H new ATOM 0 HG2 ARG A 64 24.713 -11.135 5.838 1.00 71.35 H new ATOM 0 HG3 ARG A 64 24.267 -9.569 5.191 1.00 71.35 H new ATOM 0 HD2 ARG A 64 24.252 -11.494 3.500 1.00 13.31 H new ATOM 0 HD3 ARG A 64 25.174 -10.084 3.017 1.00 13.31 H new ATOM 0 HE ARG A 64 27.220 -11.282 3.337 1.00 23.14 H new ATOM 0 HH11 ARG A 64 24.378 -13.221 4.296 1.00 52.21 H new ATOM 0 HH12 ARG A 64 25.284 -14.736 4.352 1.00 52.21 H new ATOM 0 HH21 ARG A 64 28.361 -13.216 3.414 1.00 52.02 H new ATOM 0 HH22 ARG A 64 27.556 -14.727 3.848 1.00 52.02 H new ATOM 1108 N LEU A 65 27.920 -7.022 7.123 1.00 34.42 N ATOM 1109 CA LEU A 65 29.213 -6.397 7.344 1.00 35.11 C ATOM 1110 C LEU A 65 30.319 -7.430 7.119 1.00 52.21 C ATOM 1111 O LEU A 65 30.174 -8.592 7.494 1.00 34.23 O ATOM 1112 CB LEU A 65 29.259 -5.736 8.723 1.00 25.43 C ATOM 1113 CG LEU A 65 28.374 -4.502 8.906 1.00 45.30 C ATOM 1114 CD1 LEU A 65 28.220 -4.152 10.387 1.00 21.24 C ATOM 1115 CD2 LEU A 65 28.906 -3.321 8.091 1.00 53.02 C ATOM 0 H LEU A 65 27.259 -6.917 7.892 1.00 34.42 H new ATOM 0 HA LEU A 65 29.376 -5.594 6.626 1.00 35.11 H new ATOM 0 HB2 LEU A 65 28.973 -6.477 9.469 1.00 25.43 H new ATOM 0 HB3 LEU A 65 30.290 -5.453 8.934 1.00 25.43 H new ATOM 0 HG LEU A 65 27.380 -4.735 8.525 1.00 45.30 H new ATOM 0 HD11 LEU A 65 27.586 -3.271 10.489 1.00 21.24 H new ATOM 0 HD12 LEU A 65 27.763 -4.990 10.913 1.00 21.24 H new ATOM 0 HD13 LEU A 65 29.200 -3.945 10.816 1.00 21.24 H new ATOM 0 HD21 LEU A 65 28.259 -2.456 8.238 1.00 53.02 H new ATOM 0 HD22 LEU A 65 29.917 -3.078 8.419 1.00 53.02 H new ATOM 0 HD23 LEU A 65 28.922 -3.586 7.034 1.00 53.02 H new ATOM 1127 N TRP A 66 31.399 -6.968 6.507 1.00 25.31 N ATOM 1128 CA TRP A 66 32.530 -7.837 6.227 1.00 32.44 C ATOM 1129 C TRP A 66 33.776 -7.210 6.857 1.00 75.33 C ATOM 1130 O TRP A 66 33.791 -6.017 7.155 1.00 61.13 O ATOM 1131 CB TRP A 66 32.677 -8.079 4.724 1.00 72.01 C ATOM 1132 CG TRP A 66 31.542 -8.903 4.112 1.00 13.40 C ATOM 1133 CD1 TRP A 66 30.411 -8.457 3.547 1.00 22.30 C ATOM 1134 CD2 TRP A 66 31.473 -10.342 4.026 1.00 2.41 C ATOM 1135 NE1 TRP A 66 29.622 -9.500 3.105 1.00 10.31 N ATOM 1136 CE2 TRP A 66 30.289 -10.682 3.406 1.00 55.04 C ATOM 1137 CE3 TRP A 66 32.382 -11.323 4.458 1.00 23.22 C ATOM 1138 CZ2 TRP A 66 29.904 -12.006 3.161 1.00 13.34 C ATOM 1139 CZ3 TRP A 66 31.983 -12.641 4.207 1.00 70.42 C ATOM 1140 CH2 TRP A 66 30.794 -13.001 3.583 1.00 13.54 C ATOM 0 H TRP A 66 31.515 -6.003 6.197 1.00 25.31 H new ATOM 0 HA TRP A 66 32.377 -8.823 6.666 1.00 32.44 H new ATOM 0 HB2 TRP A 66 32.729 -7.117 4.215 1.00 72.01 H new ATOM 0 HB3 TRP A 66 33.623 -8.589 4.539 1.00 72.01 H new ATOM 0 HD1 TRP A 66 30.150 -7.413 3.450 1.00 22.30 H new ATOM 0 HE1 TRP A 66 28.716 -9.418 2.643 1.00 10.31 H new ATOM 0 HE3 TRP A 66 33.315 -11.079 4.945 1.00 23.22 H new ATOM 0 HZ2 TRP A 66 28.971 -12.247 2.673 1.00 13.34 H new ATOM 0 HZ3 TRP A 66 32.646 -13.434 4.520 1.00 70.42 H new ATOM 0 HH2 TRP A 66 30.558 -14.043 3.425 1.00 13.54 H new ATOM 1151 N SER A 67 34.790 -8.043 7.040 1.00 14.03 N ATOM 1152 CA SER A 67 36.037 -7.585 7.629 1.00 72.12 C ATOM 1153 C SER A 67 37.219 -8.045 6.773 1.00 51.51 C ATOM 1154 O SER A 67 37.673 -9.181 6.894 1.00 30.21 O ATOM 1155 CB SER A 67 36.189 -8.096 9.063 1.00 64.12 C ATOM 1156 OG SER A 67 37.482 -8.648 9.298 1.00 0.11 O ATOM 0 H SER A 67 34.774 -9.032 6.791 1.00 14.03 H new ATOM 0 HA SER A 67 36.021 -6.496 7.660 1.00 72.12 H new ATOM 0 HB2 SER A 67 36.012 -7.277 9.760 1.00 64.12 H new ATOM 0 HB3 SER A 67 35.430 -8.853 9.261 1.00 64.12 H new ATOM 0 HG SER A 67 37.687 -9.308 8.603 1.00 0.11 H new ATOM 1162 N LEU A 68 37.684 -7.137 5.927 1.00 74.02 N ATOM 1163 CA LEU A 68 38.804 -7.435 5.051 1.00 41.20 C ATOM 1164 C LEU A 68 40.075 -7.588 5.890 1.00 74.23 C ATOM 1165 O LEU A 68 40.428 -6.694 6.657 1.00 32.21 O ATOM 1166 CB LEU A 68 38.918 -6.379 3.949 1.00 23.23 C ATOM 1167 CG LEU A 68 37.993 -6.564 2.745 1.00 52.00 C ATOM 1168 CD1 LEU A 68 37.192 -5.290 2.468 1.00 3.12 C ATOM 1169 CD2 LEU A 68 38.778 -7.026 1.516 1.00 50.12 C ATOM 0 H LEU A 68 37.305 -6.195 5.830 1.00 74.02 H new ATOM 0 HA LEU A 68 38.644 -8.383 4.537 1.00 41.20 H new ATOM 0 HB2 LEU A 68 38.719 -5.401 4.388 1.00 23.23 H new ATOM 0 HB3 LEU A 68 39.948 -6.365 3.592 1.00 23.23 H new ATOM 0 HG LEU A 68 37.276 -7.350 2.983 1.00 52.00 H new ATOM 0 HD11 LEU A 68 36.542 -5.449 1.607 1.00 3.12 H new ATOM 0 HD12 LEU A 68 36.586 -5.045 3.340 1.00 3.12 H new ATOM 0 HD13 LEU A 68 37.877 -4.468 2.259 1.00 3.12 H new ATOM 0 HD21 LEU A 68 38.097 -7.150 0.674 1.00 50.12 H new ATOM 0 HD22 LEU A 68 39.533 -6.281 1.265 1.00 50.12 H new ATOM 0 HD23 LEU A 68 39.265 -7.977 1.732 1.00 50.12 H new ATOM 1181 N ASP A 69 40.727 -8.728 5.715 1.00 74.22 N ATOM 1182 CA ASP A 69 41.950 -9.010 6.446 1.00 22.30 C ATOM 1183 C ASP A 69 43.081 -9.287 5.453 1.00 54.43 C ATOM 1184 O ASP A 69 43.058 -10.293 4.745 1.00 1.43 O ATOM 1185 CB ASP A 69 41.789 -10.246 7.334 1.00 12.40 C ATOM 1186 CG ASP A 69 40.760 -10.104 8.458 1.00 62.22 C ATOM 1187 OD1 ASP A 69 40.407 -8.987 8.864 1.00 41.04 O ATOM 1188 OD2 ASP A 69 40.310 -11.218 8.928 1.00 52.11 O ATOM 0 H ASP A 69 40.431 -9.467 5.077 1.00 74.22 H new ATOM 0 HA ASP A 69 42.177 -8.145 7.069 1.00 22.30 H new ATOM 0 HB2 ASP A 69 41.506 -11.091 6.707 1.00 12.40 H new ATOM 0 HB3 ASP A 69 42.756 -10.487 7.775 1.00 12.40 H new ATOM 1194 N THR A 70 44.042 -8.375 5.431 1.00 23.53 N ATOM 1195 CA THR A 70 45.179 -8.508 4.536 1.00 23.43 C ATOM 1196 C THR A 70 46.437 -8.879 5.324 1.00 64.20 C ATOM 1197 O THR A 70 47.539 -8.454 4.978 1.00 15.11 O ATOM 1198 CB THR A 70 45.317 -7.203 3.750 1.00 22.12 C ATOM 1199 OG1 THR A 70 44.853 -6.203 4.653 1.00 30.31 O ATOM 1200 CG2 THR A 70 44.343 -7.123 2.573 1.00 44.12 C ATOM 0 H THR A 70 44.057 -7.541 6.018 1.00 23.53 H new ATOM 0 HA THR A 70 45.029 -9.319 3.823 1.00 23.43 H new ATOM 0 HB THR A 70 46.339 -7.107 3.383 1.00 22.12 H new ATOM 0 HG1 THR A 70 44.910 -5.324 4.224 1.00 30.31 H new ATOM 0 HG21 THR A 70 44.482 -6.177 2.049 1.00 44.12 H new ATOM 0 HG22 THR A 70 44.532 -7.949 1.888 1.00 44.12 H new ATOM 0 HG23 THR A 70 43.320 -7.185 2.943 1.00 44.12 H new ATOM 1208 N GLU A 71 46.232 -9.668 6.368 1.00 32.13 N ATOM 1209 CA GLU A 71 47.336 -10.101 7.208 1.00 32.00 C ATOM 1210 C GLU A 71 48.526 -10.522 6.344 1.00 4.02 C ATOM 1211 O GLU A 71 49.665 -10.156 6.630 1.00 44.21 O ATOM 1212 CB GLU A 71 46.905 -11.237 8.138 1.00 13.42 C ATOM 1213 CG GLU A 71 46.280 -10.687 9.422 1.00 55.32 C ATOM 1214 CD GLU A 71 46.394 -11.698 10.564 1.00 35.12 C ATOM 1215 OE1 GLU A 71 46.831 -11.340 11.668 1.00 54.01 O ATOM 1216 OE2 GLU A 71 46.008 -12.894 10.274 1.00 75.31 O ATOM 0 H GLU A 71 45.317 -10.019 6.652 1.00 32.13 H new ATOM 0 HA GLU A 71 47.643 -9.262 7.832 1.00 32.00 H new ATOM 0 HB2 GLU A 71 46.188 -11.879 7.626 1.00 13.42 H new ATOM 0 HB3 GLU A 71 47.767 -11.856 8.385 1.00 13.42 H new ATOM 0 HG2 GLU A 71 46.776 -9.758 9.703 1.00 55.32 H new ATOM 0 HG3 GLU A 71 45.231 -10.448 9.247 1.00 55.32 H new ATOM 1224 N GLU A 72 48.222 -11.285 5.305 1.00 61.40 N ATOM 1225 CA GLU A 72 49.253 -11.760 4.398 1.00 60.04 C ATOM 1226 C GLU A 72 49.228 -10.954 3.097 1.00 35.42 C ATOM 1227 O GLU A 72 50.151 -11.043 2.290 1.00 45.50 O ATOM 1228 CB GLU A 72 49.092 -13.256 4.119 1.00 1.21 C ATOM 1229 CG GLU A 72 48.464 -13.972 5.316 1.00 14.13 C ATOM 1230 CD GLU A 72 48.539 -15.491 5.148 1.00 54.22 C ATOM 1231 OE1 GLU A 72 47.757 -16.069 4.378 1.00 13.51 O ATOM 1232 OE2 GLU A 72 49.450 -16.073 5.850 1.00 5.15 O ATOM 0 H GLU A 72 47.276 -11.586 5.071 1.00 61.40 H new ATOM 0 HA GLU A 72 50.223 -11.615 4.874 1.00 60.04 H new ATOM 0 HB2 GLU A 72 48.469 -13.400 3.236 1.00 1.21 H new ATOM 0 HB3 GLU A 72 50.065 -13.695 3.897 1.00 1.21 H new ATOM 0 HG2 GLU A 72 48.978 -13.678 6.231 1.00 14.13 H new ATOM 0 HG3 GLU A 72 47.423 -13.665 5.423 1.00 14.13 H new ATOM 1240 N ASP A 73 48.160 -10.187 2.935 1.00 73.24 N ATOM 1241 CA ASP A 73 48.002 -9.367 1.746 1.00 53.51 C ATOM 1242 C ASP A 73 47.465 -10.230 0.603 1.00 60.23 C ATOM 1243 O ASP A 73 48.027 -10.237 -0.491 1.00 71.15 O ATOM 1244 CB ASP A 73 49.341 -8.775 1.303 1.00 64.21 C ATOM 1245 CG ASP A 73 49.253 -7.401 0.635 1.00 33.43 C ATOM 1246 OD1 ASP A 73 48.933 -7.290 -0.558 1.00 24.43 O ATOM 1247 OD2 ASP A 73 49.532 -6.403 1.403 1.00 33.13 O ATOM 0 H ASP A 73 47.396 -10.116 3.607 1.00 73.24 H new ATOM 0 HA ASP A 73 47.311 -8.558 1.984 1.00 53.51 H new ATOM 0 HB2 ASP A 73 49.992 -8.698 2.174 1.00 64.21 H new ATOM 0 HB3 ASP A 73 49.816 -9.469 0.610 1.00 64.21 H new ATOM 1253 N ILE A 74 46.384 -10.938 0.896 1.00 51.14 N ATOM 1254 CA ILE A 74 45.765 -11.803 -0.094 1.00 61.22 C ATOM 1255 C ILE A 74 44.374 -11.266 -0.437 1.00 2.22 C ATOM 1256 O ILE A 74 43.656 -11.859 -1.240 1.00 42.24 O ATOM 1257 CB ILE A 74 45.761 -13.254 0.390 1.00 24.53 C ATOM 1258 CG1 ILE A 74 44.617 -13.501 1.375 1.00 13.12 C ATOM 1259 CG2 ILE A 74 47.119 -13.638 0.982 1.00 22.40 C ATOM 1260 CD1 ILE A 74 44.885 -12.808 2.713 1.00 64.04 C ATOM 0 H ILE A 74 45.921 -10.930 1.805 1.00 51.14 H new ATOM 0 HA ILE A 74 46.345 -11.800 -1.017 1.00 61.22 H new ATOM 0 HB ILE A 74 45.590 -13.900 -0.471 1.00 24.53 H new ATOM 0 HG12 ILE A 74 43.682 -13.133 0.952 1.00 13.12 H new ATOM 0 HG13 ILE A 74 44.495 -14.572 1.534 1.00 13.12 H new ATOM 0 HG21 ILE A 74 47.089 -14.674 1.319 1.00 22.40 H new ATOM 0 HG22 ILE A 74 47.892 -13.525 0.222 1.00 22.40 H new ATOM 0 HG23 ILE A 74 47.344 -12.988 1.828 1.00 22.40 H new ATOM 0 HD11 ILE A 74 44.056 -13.000 3.395 1.00 64.04 H new ATOM 0 HD12 ILE A 74 45.807 -13.196 3.145 1.00 64.04 H new ATOM 0 HD13 ILE A 74 44.982 -11.734 2.553 1.00 64.04 H new ATOM 1272 N SER A 75 44.036 -10.149 0.190 1.00 55.31 N ATOM 1273 CA SER A 75 42.743 -9.525 -0.039 1.00 4.45 C ATOM 1274 C SER A 75 41.626 -10.423 0.497 1.00 5.30 C ATOM 1275 O SER A 75 40.637 -10.666 -0.192 1.00 31.34 O ATOM 1276 CB SER A 75 42.526 -9.237 -1.525 1.00 40.43 C ATOM 1277 OG SER A 75 41.393 -8.401 -1.747 1.00 44.42 O ATOM 0 H SER A 75 44.634 -9.660 0.856 1.00 55.31 H new ATOM 0 HA SER A 75 42.723 -8.574 0.494 1.00 4.45 H new ATOM 0 HB2 SER A 75 43.415 -8.759 -1.935 1.00 40.43 H new ATOM 0 HB3 SER A 75 42.394 -10.177 -2.061 1.00 40.43 H new ATOM 0 HG SER A 75 40.600 -8.811 -1.342 1.00 44.42 H new ATOM 1283 N SER A 76 41.823 -10.891 1.721 1.00 53.41 N ATOM 1284 CA SER A 76 40.844 -11.757 2.357 1.00 44.51 C ATOM 1285 C SER A 76 39.788 -10.914 3.075 1.00 3.01 C ATOM 1286 O SER A 76 39.896 -9.690 3.127 1.00 53.21 O ATOM 1287 CB SER A 76 41.516 -12.717 3.340 1.00 31.04 C ATOM 1288 OG SER A 76 41.292 -14.081 2.992 1.00 41.41 O ATOM 0 H SER A 76 42.645 -10.687 2.289 1.00 53.41 H new ATOM 0 HA SER A 76 40.359 -12.352 1.583 1.00 44.51 H new ATOM 0 HB2 SER A 76 42.588 -12.520 3.364 1.00 31.04 H new ATOM 0 HB3 SER A 76 41.136 -12.532 4.345 1.00 31.04 H new ATOM 0 HG SER A 76 41.738 -14.662 3.643 1.00 41.41 H new ATOM 1294 N LEU A 77 38.792 -11.603 3.611 1.00 31.32 N ATOM 1295 CA LEU A 77 37.717 -10.934 4.324 1.00 2.21 C ATOM 1296 C LEU A 77 36.893 -11.972 5.087 1.00 34.41 C ATOM 1297 O LEU A 77 37.016 -13.171 4.841 1.00 61.23 O ATOM 1298 CB LEU A 77 36.890 -10.076 3.364 1.00 21.41 C ATOM 1299 CG LEU A 77 36.147 -10.832 2.261 1.00 74.12 C ATOM 1300 CD1 LEU A 77 34.801 -11.355 2.766 1.00 75.11 C ATOM 1301 CD2 LEU A 77 35.992 -9.964 1.010 1.00 34.14 C ATOM 0 H LEU A 77 38.706 -12.618 3.566 1.00 31.32 H new ATOM 0 HA LEU A 77 38.122 -10.243 5.063 1.00 2.21 H new ATOM 0 HB2 LEU A 77 36.160 -9.514 3.947 1.00 21.41 H new ATOM 0 HB3 LEU A 77 37.553 -9.348 2.896 1.00 21.41 H new ATOM 0 HG LEU A 77 36.744 -11.699 1.979 1.00 74.12 H new ATOM 0 HD11 LEU A 77 34.293 -11.888 1.962 1.00 75.11 H new ATOM 0 HD12 LEU A 77 34.965 -12.032 3.604 1.00 75.11 H new ATOM 0 HD13 LEU A 77 34.184 -10.517 3.092 1.00 75.11 H new ATOM 0 HD21 LEU A 77 35.461 -10.525 0.241 1.00 34.14 H new ATOM 0 HD22 LEU A 77 35.428 -9.065 1.258 1.00 34.14 H new ATOM 0 HD23 LEU A 77 36.977 -9.683 0.638 1.00 34.14 H new ATOM 1313 N ARG A 78 36.070 -11.475 5.998 1.00 13.53 N ATOM 1314 CA ARG A 78 35.225 -12.344 6.799 1.00 71.41 C ATOM 1315 C ARG A 78 33.995 -11.581 7.295 1.00 44.32 C ATOM 1316 O ARG A 78 34.097 -10.418 7.683 1.00 24.01 O ATOM 1317 CB ARG A 78 35.990 -12.901 8.001 1.00 2.12 C ATOM 1318 CG ARG A 78 36.237 -11.811 9.046 1.00 32.14 C ATOM 1319 CD ARG A 78 36.897 -12.392 10.299 1.00 53.32 C ATOM 1320 NE ARG A 78 37.973 -11.491 10.768 1.00 41.33 N ATOM 1321 CZ ARG A 78 38.745 -11.732 11.849 1.00 15.20 C ATOM 1322 NH1 ARG A 78 38.564 -12.850 12.584 1.00 64.14 N ATOM 1323 NH2 ARG A 78 39.678 -10.858 12.177 1.00 15.33 N ATOM 0 H ARG A 78 35.970 -10.480 6.200 1.00 13.53 H new ATOM 0 HA ARG A 78 34.910 -13.174 6.166 1.00 71.41 H new ATOM 0 HB2 ARG A 78 35.425 -13.718 8.449 1.00 2.12 H new ATOM 0 HB3 ARG A 78 36.942 -13.315 7.670 1.00 2.12 H new ATOM 0 HG2 ARG A 78 36.873 -11.034 8.623 1.00 32.14 H new ATOM 0 HG3 ARG A 78 35.292 -11.338 9.314 1.00 32.14 H new ATOM 0 HD2 ARG A 78 36.153 -12.523 11.085 1.00 53.32 H new ATOM 0 HD3 ARG A 78 37.307 -13.378 10.080 1.00 53.32 H new ATOM 0 HE ARG A 78 38.142 -10.634 10.241 1.00 41.33 H new ATOM 0 HH11 ARG A 78 37.840 -13.520 12.324 1.00 64.14 H new ATOM 0 HH12 ARG A 78 39.151 -13.025 13.399 1.00 64.14 H new ATOM 0 HH21 ARG A 78 39.807 -10.016 11.617 1.00 15.33 H new ATOM 0 HH22 ARG A 78 40.270 -11.025 12.991 1.00 15.33 H new ATOM 1336 N LEU A 79 32.861 -12.265 7.265 1.00 25.45 N ATOM 1337 CA LEU A 79 31.614 -11.666 7.707 1.00 13.01 C ATOM 1338 C LEU A 79 31.702 -11.358 9.203 1.00 5.51 C ATOM 1339 O LEU A 79 32.099 -12.212 9.994 1.00 2.22 O ATOM 1340 CB LEU A 79 30.429 -12.558 7.332 1.00 34.25 C ATOM 1341 CG LEU A 79 29.081 -11.851 7.173 1.00 31.42 C ATOM 1342 CD1 LEU A 79 28.583 -11.939 5.729 1.00 30.33 C ATOM 1343 CD2 LEU A 79 28.054 -12.398 8.168 1.00 45.43 C ATOM 0 H LEU A 79 32.780 -13.229 6.941 1.00 25.45 H new ATOM 0 HA LEU A 79 31.445 -10.718 7.196 1.00 13.01 H new ATOM 0 HB2 LEU A 79 30.663 -13.065 6.396 1.00 34.25 H new ATOM 0 HB3 LEU A 79 30.325 -13.329 8.095 1.00 34.25 H new ATOM 0 HG LEU A 79 29.220 -10.794 7.402 1.00 31.42 H new ATOM 0 HD11 LEU A 79 27.624 -11.429 5.643 1.00 30.33 H new ATOM 0 HD12 LEU A 79 29.306 -11.465 5.065 1.00 30.33 H new ATOM 0 HD13 LEU A 79 28.464 -12.985 5.448 1.00 30.33 H new ATOM 0 HD21 LEU A 79 27.105 -11.879 8.034 1.00 45.43 H new ATOM 0 HD22 LEU A 79 27.912 -13.465 7.995 1.00 45.43 H new ATOM 0 HD23 LEU A 79 28.413 -12.241 9.185 1.00 45.43 H new ATOM 1355 N LEU A 80 31.327 -10.134 9.546 1.00 74.22 N ATOM 1356 CA LEU A 80 31.359 -9.702 10.933 1.00 73.32 C ATOM 1357 C LEU A 80 29.953 -9.808 11.528 1.00 42.40 C ATOM 1358 O LEU A 80 28.963 -9.775 10.799 1.00 13.44 O ATOM 1359 CB LEU A 80 31.971 -8.305 11.045 1.00 52.43 C ATOM 1360 CG LEU A 80 33.400 -8.154 10.519 1.00 20.25 C ATOM 1361 CD1 LEU A 80 33.764 -6.680 10.336 1.00 44.31 C ATOM 1362 CD2 LEU A 80 34.396 -8.882 11.424 1.00 21.42 C ATOM 0 H LEU A 80 30.999 -9.428 8.887 1.00 74.22 H new ATOM 0 HA LEU A 80 32.004 -10.355 11.521 1.00 73.32 H new ATOM 0 HB2 LEU A 80 31.331 -7.606 10.507 1.00 52.43 H new ATOM 0 HB3 LEU A 80 31.958 -8.007 12.093 1.00 52.43 H new ATOM 0 HG LEU A 80 33.454 -8.623 9.537 1.00 20.25 H new ATOM 0 HD11 LEU A 80 34.785 -6.601 9.961 1.00 44.31 H new ATOM 0 HD12 LEU A 80 33.079 -6.222 9.622 1.00 44.31 H new ATOM 0 HD13 LEU A 80 33.688 -6.165 11.294 1.00 44.31 H new ATOM 0 HD21 LEU A 80 35.404 -8.759 11.028 1.00 21.42 H new ATOM 0 HD22 LEU A 80 34.347 -8.464 12.429 1.00 21.42 H new ATOM 0 HD23 LEU A 80 34.147 -9.943 11.460 1.00 21.42 H new ATOM 1374 N THR A 81 29.911 -9.932 12.846 1.00 23.23 N ATOM 1375 CA THR A 81 28.644 -10.043 13.548 1.00 55.53 C ATOM 1376 C THR A 81 28.696 -9.273 14.869 1.00 42.32 C ATOM 1377 O THR A 81 29.209 -9.778 15.866 1.00 32.41 O ATOM 1378 CB THR A 81 28.328 -11.529 13.723 1.00 70.30 C ATOM 1379 OG1 THR A 81 29.598 -12.127 13.967 1.00 21.31 O ATOM 1380 CG2 THR A 81 27.851 -12.184 12.425 1.00 44.23 C ATOM 0 H THR A 81 30.735 -9.958 13.447 1.00 23.23 H new ATOM 0 HA THR A 81 27.835 -9.589 12.976 1.00 55.53 H new ATOM 0 HB THR A 81 27.564 -11.649 14.492 1.00 70.30 H new ATOM 0 HG1 THR A 81 30.054 -11.644 14.688 1.00 21.31 H new ATOM 0 HG21 THR A 81 27.641 -13.238 12.605 1.00 44.23 H new ATOM 0 HG22 THR A 81 26.945 -11.687 12.078 1.00 44.23 H new ATOM 0 HG23 THR A 81 28.627 -12.094 11.665 1.00 44.23 H new ATOM 1388 N LEU A 82 28.159 -8.062 14.833 1.00 21.11 N ATOM 1389 CA LEU A 82 28.138 -7.217 16.015 1.00 24.42 C ATOM 1390 C LEU A 82 26.718 -6.693 16.237 1.00 44.40 C ATOM 1391 O LEU A 82 25.865 -6.812 15.359 1.00 13.44 O ATOM 1392 CB LEU A 82 29.192 -6.113 15.903 1.00 34.22 C ATOM 1393 CG LEU A 82 29.416 -5.540 14.502 1.00 22.25 C ATOM 1394 CD1 LEU A 82 28.192 -4.754 14.029 1.00 3.21 C ATOM 1395 CD2 LEU A 82 30.693 -4.698 14.453 1.00 72.23 C ATOM 0 H LEU A 82 27.735 -7.646 14.004 1.00 21.11 H new ATOM 0 HA LEU A 82 28.407 -7.793 16.900 1.00 24.42 H new ATOM 0 HB2 LEU A 82 28.907 -5.297 16.567 1.00 34.22 H new ATOM 0 HB3 LEU A 82 30.141 -6.505 16.270 1.00 34.22 H new ATOM 0 HG LEU A 82 29.551 -6.371 13.810 1.00 22.25 H new ATOM 0 HD11 LEU A 82 28.378 -4.358 13.031 1.00 3.21 H new ATOM 0 HD12 LEU A 82 27.324 -5.413 14.002 1.00 3.21 H new ATOM 0 HD13 LEU A 82 28.001 -3.930 14.717 1.00 3.21 H new ATOM 0 HD21 LEU A 82 30.829 -4.302 13.447 1.00 72.23 H new ATOM 0 HD22 LEU A 82 30.612 -3.872 15.160 1.00 72.23 H new ATOM 0 HD23 LEU A 82 31.549 -5.319 14.718 1.00 72.23 H new ATOM 1407 N SER A 83 26.510 -6.123 17.415 1.00 75.02 N ATOM 1408 CA SER A 83 25.208 -5.580 17.763 1.00 13.40 C ATOM 1409 C SER A 83 24.954 -4.288 16.983 1.00 4.23 C ATOM 1410 O SER A 83 25.687 -3.969 16.048 1.00 2.02 O ATOM 1411 CB SER A 83 25.103 -5.321 19.267 1.00 4.33 C ATOM 1412 OG SER A 83 25.786 -6.314 20.028 1.00 13.44 O ATOM 0 H SER A 83 27.221 -6.025 18.140 1.00 75.02 H new ATOM 0 HA SER A 83 24.449 -6.314 17.494 1.00 13.40 H new ATOM 0 HB2 SER A 83 25.518 -4.339 19.496 1.00 4.33 H new ATOM 0 HB3 SER A 83 24.053 -5.299 19.559 1.00 4.33 H new ATOM 0 HG SER A 83 25.697 -6.113 20.983 1.00 13.44 H new ATOM 1418 N ASP A 84 23.914 -3.579 17.397 1.00 62.01 N ATOM 1419 CA ASP A 84 23.555 -2.329 16.749 1.00 70.01 C ATOM 1420 C ASP A 84 24.581 -1.256 17.117 1.00 42.50 C ATOM 1421 O ASP A 84 25.174 -0.631 16.238 1.00 13.15 O ATOM 1422 CB ASP A 84 22.179 -1.845 17.210 1.00 73.30 C ATOM 1423 CG ASP A 84 20.991 -2.561 16.563 1.00 25.51 C ATOM 1424 OD1 ASP A 84 20.645 -2.302 15.401 1.00 63.20 O ATOM 1425 OD2 ASP A 84 20.404 -3.431 17.314 1.00 41.40 O ATOM 0 H ASP A 84 23.309 -3.846 18.173 1.00 62.01 H new ATOM 0 HA ASP A 84 23.535 -2.501 15.673 1.00 70.01 H new ATOM 0 HB2 ASP A 84 22.112 -1.966 18.291 1.00 73.30 H new ATOM 0 HB3 ASP A 84 22.098 -0.778 17.003 1.00 73.30 H new ATOM 1431 N SER A 85 24.760 -1.074 18.417 1.00 32.02 N ATOM 1432 CA SER A 85 25.704 -0.087 18.912 1.00 1.23 C ATOM 1433 C SER A 85 26.957 -0.074 18.034 1.00 72.41 C ATOM 1434 O SER A 85 27.609 0.959 17.891 1.00 74.25 O ATOM 1435 CB SER A 85 26.080 -0.366 20.369 1.00 72.12 C ATOM 1436 OG SER A 85 24.933 -0.608 21.179 1.00 13.42 O ATOM 0 H SER A 85 24.267 -1.594 19.143 1.00 32.02 H new ATOM 0 HA SER A 85 25.228 0.893 18.869 1.00 1.23 H new ATOM 0 HB2 SER A 85 26.744 -1.229 20.413 1.00 72.12 H new ATOM 0 HB3 SER A 85 26.634 0.483 20.769 1.00 72.12 H new ATOM 0 HG SER A 85 25.215 -0.784 22.101 1.00 13.42 H new ATOM 1442 N GLU A 86 27.256 -1.235 17.469 1.00 51.11 N ATOM 1443 CA GLU A 86 28.419 -1.371 16.609 1.00 51.35 C ATOM 1444 C GLU A 86 28.046 -1.058 15.158 1.00 14.01 C ATOM 1445 O GLU A 86 28.775 -0.352 14.464 1.00 65.11 O ATOM 1446 CB GLU A 86 29.029 -2.768 16.728 1.00 24.44 C ATOM 1447 CG GLU A 86 28.818 -3.341 18.132 1.00 41.45 C ATOM 1448 CD GLU A 86 29.972 -4.264 18.527 1.00 44.23 C ATOM 1449 OE1 GLU A 86 31.138 -3.840 18.512 1.00 32.42 O ATOM 1450 OE2 GLU A 86 29.624 -5.461 18.859 1.00 42.31 O ATOM 0 H GLU A 86 26.713 -2.090 17.590 1.00 51.11 H new ATOM 0 HA GLU A 86 29.172 -0.653 16.934 1.00 51.35 H new ATOM 0 HB2 GLU A 86 28.577 -3.430 15.989 1.00 24.44 H new ATOM 0 HB3 GLU A 86 30.095 -2.723 16.506 1.00 24.44 H new ATOM 0 HG2 GLU A 86 28.736 -2.527 18.852 1.00 41.45 H new ATOM 0 HG3 GLU A 86 27.879 -3.893 18.166 1.00 41.45 H new ATOM 1458 N LEU A 87 26.909 -1.599 14.743 1.00 4.33 N ATOM 1459 CA LEU A 87 26.430 -1.386 13.388 1.00 24.30 C ATOM 1460 C LEU A 87 26.259 0.114 13.142 1.00 71.03 C ATOM 1461 O LEU A 87 26.838 0.663 12.206 1.00 51.23 O ATOM 1462 CB LEU A 87 25.160 -2.200 13.135 1.00 32.21 C ATOM 1463 CG LEU A 87 24.485 -1.986 11.779 1.00 70.13 C ATOM 1464 CD1 LEU A 87 23.790 -3.264 11.304 1.00 10.23 C ATOM 1465 CD2 LEU A 87 23.525 -0.795 11.826 1.00 65.34 C ATOM 0 H LEU A 87 26.306 -2.184 15.322 1.00 4.33 H new ATOM 0 HA LEU A 87 27.161 -1.746 12.664 1.00 24.30 H new ATOM 0 HB2 LEU A 87 25.404 -3.258 13.234 1.00 32.21 H new ATOM 0 HB3 LEU A 87 24.439 -1.965 13.918 1.00 32.21 H new ATOM 0 HG LEU A 87 25.257 -1.749 11.047 1.00 70.13 H new ATOM 0 HD11 LEU A 87 23.318 -3.084 10.338 1.00 10.23 H new ATOM 0 HD12 LEU A 87 24.525 -4.063 11.206 1.00 10.23 H new ATOM 0 HD13 LEU A 87 23.031 -3.557 12.029 1.00 10.23 H new ATOM 0 HD21 LEU A 87 23.059 -0.665 10.849 1.00 65.34 H new ATOM 0 HD22 LEU A 87 22.754 -0.978 12.575 1.00 65.34 H new ATOM 0 HD23 LEU A 87 24.077 0.108 12.087 1.00 65.34 H new ATOM 1477 N ARG A 88 25.461 0.734 13.998 1.00 12.42 N ATOM 1478 CA ARG A 88 25.206 2.160 13.885 1.00 13.43 C ATOM 1479 C ARG A 88 26.524 2.937 13.887 1.00 11.23 C ATOM 1480 O ARG A 88 26.565 4.097 13.481 1.00 3.51 O ATOM 1481 CB ARG A 88 24.328 2.656 15.036 1.00 21.35 C ATOM 1482 CG ARG A 88 23.575 3.928 14.643 1.00 11.24 C ATOM 1483 CD ARG A 88 24.505 5.143 14.658 1.00 22.24 C ATOM 1484 NE ARG A 88 23.823 6.295 15.289 1.00 50.13 N ATOM 1485 CZ ARG A 88 24.296 7.559 15.267 1.00 42.21 C ATOM 1486 NH1 ARG A 88 25.460 7.845 14.645 1.00 31.40 N ATOM 1487 NH2 ARG A 88 23.604 8.512 15.863 1.00 11.10 N ATOM 0 H ARG A 88 24.982 0.275 14.773 1.00 12.42 H new ATOM 0 HA ARG A 88 24.682 2.329 12.944 1.00 13.43 H new ATOM 0 HB2 ARG A 88 23.616 1.879 15.316 1.00 21.35 H new ATOM 0 HB3 ARG A 88 24.947 2.851 15.912 1.00 21.35 H new ATOM 0 HG2 ARG A 88 23.144 3.807 13.649 1.00 11.24 H new ATOM 0 HG3 ARG A 88 22.746 4.092 15.332 1.00 11.24 H new ATOM 0 HD2 ARG A 88 25.418 4.906 15.205 1.00 22.24 H new ATOM 0 HD3 ARG A 88 24.800 5.398 13.640 1.00 22.24 H new ATOM 0 HE ARG A 88 22.940 6.123 15.771 1.00 50.13 H new ATOM 0 HH11 ARG A 88 25.989 7.103 14.187 1.00 31.40 H new ATOM 0 HH12 ARG A 88 25.810 8.803 14.633 1.00 31.40 H new ATOM 0 HH21 ARG A 88 22.726 8.288 16.331 1.00 11.10 H new ATOM 0 HH22 ARG A 88 23.947 9.472 15.856 1.00 11.10 H new ATOM 1500 N SER A 89 27.569 2.266 14.349 1.00 33.01 N ATOM 1501 CA SER A 89 28.885 2.879 14.409 1.00 32.22 C ATOM 1502 C SER A 89 29.306 3.351 13.016 1.00 25.32 C ATOM 1503 O SER A 89 30.077 4.301 12.885 1.00 32.35 O ATOM 1504 CB SER A 89 29.920 1.905 14.976 1.00 42.41 C ATOM 1505 OG SER A 89 31.045 2.584 15.528 1.00 41.11 O ATOM 0 H SER A 89 27.531 1.304 14.685 1.00 33.01 H new ATOM 0 HA SER A 89 28.832 3.739 15.076 1.00 32.22 H new ATOM 0 HB2 SER A 89 29.455 1.289 15.746 1.00 42.41 H new ATOM 0 HB3 SER A 89 30.254 1.231 14.187 1.00 42.41 H new ATOM 0 HG SER A 89 31.682 1.928 15.881 1.00 41.11 H new ATOM 1511 N ILE A 90 28.783 2.665 12.011 1.00 51.24 N ATOM 1512 CA ILE A 90 29.095 3.002 10.632 1.00 3.32 C ATOM 1513 C ILE A 90 27.804 3.362 9.894 1.00 21.43 C ATOM 1514 O ILE A 90 27.782 4.295 9.094 1.00 53.32 O ATOM 1515 CB ILE A 90 29.888 1.873 9.971 1.00 74.32 C ATOM 1516 CG1 ILE A 90 29.679 0.550 10.712 1.00 44.24 C ATOM 1517 CG2 ILE A 90 31.369 2.237 9.854 1.00 10.42 C ATOM 1518 CD1 ILE A 90 30.587 0.461 11.940 1.00 41.10 C ATOM 0 H ILE A 90 28.145 1.877 12.124 1.00 51.24 H new ATOM 0 HA ILE A 90 29.740 3.880 10.591 1.00 3.32 H new ATOM 0 HB ILE A 90 29.510 1.738 8.958 1.00 74.32 H new ATOM 0 HG12 ILE A 90 28.637 0.461 11.019 1.00 44.24 H new ATOM 0 HG13 ILE A 90 29.886 -0.284 10.041 1.00 44.24 H new ATOM 0 HG21 ILE A 90 31.909 1.417 9.381 1.00 10.42 H new ATOM 0 HG22 ILE A 90 31.476 3.138 9.250 1.00 10.42 H new ATOM 0 HG23 ILE A 90 31.779 2.416 10.848 1.00 10.42 H new ATOM 0 HD11 ILE A 90 30.419 -0.488 12.449 1.00 41.10 H new ATOM 0 HD12 ILE A 90 31.629 0.526 11.627 1.00 41.10 H new ATOM 0 HD13 ILE A 90 30.361 1.282 12.620 1.00 41.10 H new ATOM 1530 N LEU A 91 26.760 2.602 10.190 1.00 21.51 N ATOM 1531 CA LEU A 91 25.468 2.828 9.565 1.00 42.12 C ATOM 1532 C LEU A 91 24.724 3.928 10.325 1.00 23.22 C ATOM 1533 O LEU A 91 25.050 4.223 11.474 1.00 64.30 O ATOM 1534 CB LEU A 91 24.687 1.517 9.459 1.00 33.01 C ATOM 1535 CG LEU A 91 25.401 0.366 8.748 1.00 21.21 C ATOM 1536 CD1 LEU A 91 24.394 -0.613 8.141 1.00 41.20 C ATOM 1537 CD2 LEU A 91 26.388 0.894 7.705 1.00 72.23 C ATOM 0 H LEU A 91 26.783 1.829 10.855 1.00 21.51 H new ATOM 0 HA LEU A 91 25.596 3.179 8.541 1.00 42.12 H new ATOM 0 HB2 LEU A 91 24.427 1.190 10.466 1.00 33.01 H new ATOM 0 HB3 LEU A 91 23.751 1.716 8.936 1.00 33.01 H new ATOM 0 HG LEU A 91 25.980 -0.186 9.488 1.00 21.21 H new ATOM 0 HD11 LEU A 91 24.928 -1.421 7.642 1.00 41.20 H new ATOM 0 HD12 LEU A 91 23.767 -1.026 8.931 1.00 41.20 H new ATOM 0 HD13 LEU A 91 23.769 -0.090 7.417 1.00 41.20 H new ATOM 0 HD21 LEU A 91 26.882 0.055 7.214 1.00 72.23 H new ATOM 0 HD22 LEU A 91 25.851 1.484 6.962 1.00 72.23 H new ATOM 0 HD23 LEU A 91 27.135 1.519 8.194 1.00 72.23 H new ATOM 1549 N ASN A 92 23.739 4.505 9.653 1.00 34.55 N ATOM 1550 CA ASN A 92 22.946 5.565 10.251 1.00 13.25 C ATOM 1551 C ASN A 92 21.488 5.111 10.355 1.00 65.54 C ATOM 1552 O ASN A 92 20.745 5.171 9.376 1.00 20.45 O ATOM 1553 CB ASN A 92 22.986 6.833 9.395 1.00 20.53 C ATOM 1554 CG ASN A 92 24.340 7.534 9.518 1.00 42.13 C ATOM 1555 OD1 ASN A 92 25.025 7.591 8.379 1.00 20.50 O flip ATOM 1556 ND2 ASN A 92 24.737 7.994 10.576 1.00 31.20 N flip ATOM 0 H ASN A 92 23.472 4.258 8.700 1.00 34.55 H new ATOM 0 HA ASN A 92 23.361 5.781 11.236 1.00 13.25 H new ATOM 0 HB2 ASN A 92 22.798 6.578 8.352 1.00 20.53 H new ATOM 0 HB3 ASN A 92 22.192 7.511 9.706 1.00 20.53 H new ATOM 0 HD21 ASN A 92 24.161 7.916 11.414 1.00 31.20 H new ATOM 0 HD22 ASN A 92 25.645 8.456 10.622 1.00 31.20 H new ATOM 1563 N LEU A 93 21.124 4.666 11.548 1.00 32.12 N ATOM 1564 CA LEU A 93 19.769 4.201 11.792 1.00 52.22 C ATOM 1565 C LEU A 93 18.899 5.384 12.223 1.00 74.52 C ATOM 1566 O LEU A 93 17.888 5.680 11.587 1.00 63.34 O ATOM 1567 CB LEU A 93 19.771 3.043 12.791 1.00 22.24 C ATOM 1568 CG LEU A 93 20.492 1.770 12.342 1.00 51.34 C ATOM 1569 CD1 LEU A 93 19.545 0.847 11.572 1.00 24.12 C ATOM 1570 CD2 LEU A 93 21.747 2.107 11.533 1.00 15.33 C ATOM 0 H LEU A 93 21.744 4.617 12.357 1.00 32.12 H new ATOM 0 HA LEU A 93 19.333 3.800 10.877 1.00 52.22 H new ATOM 0 HB2 LEU A 93 20.230 3.389 13.717 1.00 22.24 H new ATOM 0 HB3 LEU A 93 18.737 2.788 13.024 1.00 22.24 H new ATOM 0 HG LEU A 93 20.817 1.230 13.231 1.00 51.34 H new ATOM 0 HD11 LEU A 93 20.082 -0.050 11.264 1.00 24.12 H new ATOM 0 HD12 LEU A 93 18.709 0.568 12.213 1.00 24.12 H new ATOM 0 HD13 LEU A 93 19.169 1.365 10.690 1.00 24.12 H new ATOM 0 HD21 LEU A 93 22.241 1.185 11.226 1.00 15.33 H new ATOM 0 HD22 LEU A 93 21.467 2.680 10.649 1.00 15.33 H new ATOM 0 HD23 LEU A 93 22.428 2.696 12.147 1.00 15.33 H new ATOM 1582 N GLY A 94 19.322 6.027 13.300 1.00 4.25 N ATOM 1583 CA GLY A 94 18.594 7.171 13.824 1.00 64.41 C ATOM 1584 C GLY A 94 17.198 6.762 14.298 1.00 63.41 C ATOM 1585 O GLY A 94 17.027 6.332 15.438 1.00 51.03 O ATOM 0 H GLY A 94 20.160 5.778 13.825 1.00 4.25 H new ATOM 0 HA2 GLY A 94 19.149 7.611 14.653 1.00 64.41 H new ATOM 0 HA3 GLY A 94 18.510 7.937 13.053 1.00 64.41 H new ATOM 1589 N THR A 95 16.236 6.909 13.399 1.00 2.51 N ATOM 1590 CA THR A 95 14.861 6.561 13.711 1.00 35.21 C ATOM 1591 C THR A 95 14.491 5.223 13.068 1.00 34.32 C ATOM 1592 O THR A 95 13.482 4.616 13.425 1.00 54.31 O ATOM 1593 CB THR A 95 13.966 7.718 13.263 1.00 41.23 C ATOM 1594 OG1 THR A 95 12.644 7.257 13.524 1.00 34.52 O ATOM 1595 CG2 THR A 95 13.995 7.927 11.747 1.00 12.43 C ATOM 0 H THR A 95 16.382 7.265 12.454 1.00 2.51 H new ATOM 0 HA THR A 95 14.722 6.421 14.783 1.00 35.21 H new ATOM 0 HB THR A 95 14.281 8.634 13.763 1.00 41.23 H new ATOM 0 HG1 THR A 95 11.999 7.948 13.264 1.00 34.52 H new ATOM 0 HG21 THR A 95 13.343 8.760 11.482 1.00 12.43 H new ATOM 0 HG22 THR A 95 15.014 8.149 11.430 1.00 12.43 H new ATOM 0 HG23 THR A 95 13.648 7.022 11.248 1.00 12.43 H new ATOM 1603 N PHE A 96 15.327 4.801 12.131 1.00 5.34 N ATOM 1604 CA PHE A 96 15.101 3.546 11.435 1.00 2.14 C ATOM 1605 C PHE A 96 15.452 2.353 12.327 1.00 14.55 C ATOM 1606 O PHE A 96 15.996 2.527 13.417 1.00 42.34 O ATOM 1607 CB PHE A 96 16.021 3.541 10.213 1.00 74.34 C ATOM 1608 CG PHE A 96 15.483 4.344 9.026 1.00 31.52 C ATOM 1609 CD1 PHE A 96 14.500 3.824 8.243 1.00 62.32 C ATOM 1610 CD2 PHE A 96 15.988 5.577 8.755 1.00 33.01 C ATOM 1611 CE1 PHE A 96 14.001 4.569 7.142 1.00 61.11 C ATOM 1612 CE2 PHE A 96 15.489 6.322 7.654 1.00 14.02 C ATOM 1613 CZ PHE A 96 14.506 5.802 6.871 1.00 51.32 C ATOM 0 H PHE A 96 16.163 5.307 11.837 1.00 5.34 H new ATOM 0 HA PHE A 96 14.051 3.460 11.155 1.00 2.14 H new ATOM 0 HB2 PHE A 96 16.992 3.943 10.501 1.00 74.34 H new ATOM 0 HB3 PHE A 96 16.184 2.510 9.898 1.00 74.34 H new ATOM 0 HD1 PHE A 96 14.099 2.845 8.459 1.00 62.32 H new ATOM 0 HD2 PHE A 96 16.769 5.990 9.377 1.00 33.01 H new ATOM 0 HE1 PHE A 96 13.220 4.156 6.520 1.00 61.11 H new ATOM 0 HE2 PHE A 96 15.890 7.301 7.438 1.00 14.02 H new ATOM 0 HZ PHE A 96 14.126 6.369 6.034 1.00 51.32 H new ATOM 1623 N SER A 97 15.125 1.169 11.832 1.00 31.24 N ATOM 1624 CA SER A 97 15.398 -0.052 12.571 1.00 24.30 C ATOM 1625 C SER A 97 15.926 -1.131 11.623 1.00 44.55 C ATOM 1626 O SER A 97 15.764 -1.027 10.408 1.00 63.14 O ATOM 1627 CB SER A 97 14.146 -0.550 13.296 1.00 42.24 C ATOM 1628 OG SER A 97 14.016 0.026 14.593 1.00 53.14 O ATOM 0 H SER A 97 14.673 1.029 10.928 1.00 31.24 H new ATOM 0 HA SER A 97 16.157 0.166 13.322 1.00 24.30 H new ATOM 0 HB2 SER A 97 13.264 -0.310 12.703 1.00 42.24 H new ATOM 0 HB3 SER A 97 14.185 -1.636 13.384 1.00 42.24 H new ATOM 0 HG SER A 97 13.204 -0.315 15.023 1.00 53.14 H new ATOM 1634 N VAL A 98 16.547 -2.141 12.213 1.00 4.34 N ATOM 1635 CA VAL A 98 17.100 -3.237 11.436 1.00 22.03 C ATOM 1636 C VAL A 98 16.814 -4.559 12.152 1.00 53.23 C ATOM 1637 O VAL A 98 16.521 -4.571 13.346 1.00 21.53 O ATOM 1638 CB VAL A 98 18.592 -3.003 11.188 1.00 13.42 C ATOM 1639 CG1 VAL A 98 19.319 -4.324 10.931 1.00 11.10 C ATOM 1640 CG2 VAL A 98 18.808 -2.024 10.032 1.00 11.45 C ATOM 0 H VAL A 98 16.680 -2.224 13.221 1.00 4.34 H new ATOM 0 HA VAL A 98 16.625 -3.288 10.456 1.00 22.03 H new ATOM 0 HB VAL A 98 19.016 -2.558 12.088 1.00 13.42 H new ATOM 0 HG11 VAL A 98 20.377 -4.129 10.758 1.00 11.10 H new ATOM 0 HG12 VAL A 98 19.207 -4.976 11.798 1.00 11.10 H new ATOM 0 HG13 VAL A 98 18.891 -4.810 10.054 1.00 11.10 H new ATOM 0 HG21 VAL A 98 19.876 -1.875 9.876 1.00 11.45 H new ATOM 0 HG22 VAL A 98 18.362 -2.429 9.124 1.00 11.45 H new ATOM 0 HG23 VAL A 98 18.340 -1.069 10.271 1.00 11.45 H new ATOM 1650 N THR A 99 16.908 -5.639 11.391 1.00 72.24 N ATOM 1651 CA THR A 99 16.662 -6.963 11.937 1.00 64.12 C ATOM 1652 C THR A 99 17.783 -7.923 11.533 1.00 43.22 C ATOM 1653 O THR A 99 17.824 -8.393 10.397 1.00 53.21 O ATOM 1654 CB THR A 99 15.277 -7.417 11.472 1.00 1.22 C ATOM 1655 OG1 THR A 99 14.376 -6.637 12.254 1.00 61.04 O ATOM 1656 CG2 THR A 99 14.968 -8.860 11.876 1.00 55.21 C ATOM 0 H THR A 99 17.151 -5.625 10.401 1.00 72.24 H new ATOM 0 HA THR A 99 16.666 -6.948 13.027 1.00 64.12 H new ATOM 0 HB THR A 99 15.208 -7.321 10.388 1.00 1.22 H new ATOM 0 HG1 THR A 99 13.453 -6.866 12.016 1.00 61.04 H new ATOM 0 HG21 THR A 99 13.974 -9.132 11.522 1.00 55.21 H new ATOM 0 HG22 THR A 99 15.706 -9.528 11.433 1.00 55.21 H new ATOM 0 HG23 THR A 99 15.003 -8.949 12.962 1.00 55.21 H new ATOM 1664 N LEU A 100 18.666 -8.185 12.485 1.00 30.24 N ATOM 1665 CA LEU A 100 19.785 -9.080 12.243 1.00 34.51 C ATOM 1666 C LEU A 100 19.358 -10.517 12.551 1.00 23.24 C ATOM 1667 O LEU A 100 18.923 -10.814 13.663 1.00 60.42 O ATOM 1668 CB LEU A 100 21.016 -8.623 13.027 1.00 45.13 C ATOM 1669 CG LEU A 100 22.316 -9.376 12.734 1.00 35.51 C ATOM 1670 CD1 LEU A 100 22.762 -9.157 11.287 1.00 24.44 C ATOM 1671 CD2 LEU A 100 23.408 -8.996 13.735 1.00 12.54 C ATOM 0 H LEU A 100 18.629 -7.793 13.426 1.00 30.24 H new ATOM 0 HA LEU A 100 20.076 -9.051 11.193 1.00 34.51 H new ATOM 0 HB2 LEU A 100 21.179 -7.565 12.824 1.00 45.13 H new ATOM 0 HB3 LEU A 100 20.799 -8.714 14.091 1.00 45.13 H new ATOM 0 HG LEU A 100 22.127 -10.443 12.855 1.00 35.51 H new ATOM 0 HD11 LEU A 100 23.688 -9.703 11.105 1.00 24.44 H new ATOM 0 HD12 LEU A 100 21.989 -9.518 10.609 1.00 24.44 H new ATOM 0 HD13 LEU A 100 22.928 -8.094 11.114 1.00 24.44 H new ATOM 0 HD21 LEU A 100 24.321 -9.545 13.504 1.00 12.54 H new ATOM 0 HD22 LEU A 100 23.603 -7.925 13.672 1.00 12.54 H new ATOM 0 HD23 LEU A 100 23.080 -9.246 14.744 1.00 12.54 H new ATOM 1683 N SER A 101 19.498 -11.370 11.548 1.00 65.54 N ATOM 1684 CA SER A 101 19.133 -12.769 11.698 1.00 44.15 C ATOM 1685 C SER A 101 20.362 -13.656 11.488 1.00 4.14 C ATOM 1686 O SER A 101 21.090 -13.494 10.510 1.00 3.32 O ATOM 1687 CB SER A 101 18.026 -13.157 10.716 1.00 35.14 C ATOM 1688 OG SER A 101 17.513 -14.461 10.978 1.00 11.35 O ATOM 0 H SER A 101 19.859 -11.120 10.627 1.00 65.54 H new ATOM 0 HA SER A 101 18.754 -12.917 12.709 1.00 44.15 H new ATOM 0 HB2 SER A 101 17.216 -12.430 10.777 1.00 35.14 H new ATOM 0 HB3 SER A 101 18.414 -13.118 9.698 1.00 35.14 H new ATOM 0 HG SER A 101 16.807 -14.671 10.331 1.00 11.35 H new ATOM 1694 N THR A 102 20.556 -14.574 12.424 1.00 74.35 N ATOM 1695 CA THR A 102 21.684 -15.487 12.354 1.00 31.31 C ATOM 1696 C THR A 102 21.207 -16.899 12.007 1.00 20.15 C ATOM 1697 O THR A 102 20.087 -17.280 12.343 1.00 13.35 O ATOM 1698 CB THR A 102 22.437 -15.410 13.683 1.00 4.43 C ATOM 1699 OG1 THR A 102 22.372 -14.031 14.039 1.00 23.43 O ATOM 1700 CG2 THR A 102 23.934 -15.683 13.525 1.00 65.13 C ATOM 0 H THR A 102 19.951 -14.705 13.235 1.00 74.35 H new ATOM 0 HA THR A 102 22.372 -15.205 11.557 1.00 31.31 H new ATOM 0 HB THR A 102 22.009 -16.127 14.384 1.00 4.43 H new ATOM 0 HG1 THR A 102 22.835 -13.891 14.891 1.00 23.43 H new ATOM 0 HG21 THR A 102 24.421 -15.616 14.498 1.00 65.13 H new ATOM 0 HG22 THR A 102 24.080 -16.682 13.114 1.00 65.13 H new ATOM 0 HG23 THR A 102 24.369 -14.946 12.850 1.00 65.13 H new ATOM 1708 N ASP A 103 22.081 -17.637 11.340 1.00 64.23 N ATOM 1709 CA ASP A 103 21.764 -18.999 10.944 1.00 53.31 C ATOM 1710 C ASP A 103 22.088 -19.950 12.098 1.00 44.43 C ATOM 1711 O ASP A 103 22.680 -19.541 13.096 1.00 63.14 O ATOM 1712 CB ASP A 103 22.592 -19.427 9.731 1.00 71.10 C ATOM 1713 CG ASP A 103 22.125 -20.717 9.052 1.00 5.42 C ATOM 1714 OD1 ASP A 103 20.959 -20.841 8.650 1.00 42.43 O ATOM 1715 OD2 ASP A 103 23.028 -21.632 8.942 1.00 50.45 O ATOM 0 H ASP A 103 23.009 -17.318 11.063 1.00 64.23 H new ATOM 0 HA ASP A 103 20.705 -19.038 10.689 1.00 53.31 H new ATOM 0 HB2 ASP A 103 22.576 -18.622 8.997 1.00 71.10 H new ATOM 0 HB3 ASP A 103 23.629 -19.553 10.044 1.00 71.10 H new ATOM 1721 N MET A 104 21.687 -21.200 11.923 1.00 53.02 N ATOM 1722 CA MET A 104 21.927 -22.212 12.937 1.00 25.21 C ATOM 1723 C MET A 104 23.424 -22.487 13.093 1.00 65.44 C ATOM 1724 O MET A 104 23.839 -23.174 14.025 1.00 65.32 O ATOM 1725 CB MET A 104 21.208 -23.505 12.549 1.00 61.53 C ATOM 1726 CG MET A 104 21.829 -24.122 11.294 1.00 71.53 C ATOM 1727 SD MET A 104 20.951 -25.611 10.847 1.00 51.12 S ATOM 1728 CE MET A 104 21.779 -26.788 11.902 1.00 30.15 C ATOM 0 H MET A 104 21.197 -21.535 11.094 1.00 53.02 H new ATOM 0 HA MET A 104 21.543 -21.844 13.888 1.00 25.21 H new ATOM 0 HB2 MET A 104 21.262 -24.216 13.373 1.00 61.53 H new ATOM 0 HB3 MET A 104 20.152 -23.300 12.373 1.00 61.53 H new ATOM 0 HG2 MET A 104 21.793 -23.408 10.471 1.00 71.53 H new ATOM 0 HG3 MET A 104 22.880 -24.349 11.472 1.00 71.53 H new ATOM 0 HE1 MET A 104 21.351 -27.778 11.749 1.00 30.15 H new ATOM 0 HE2 MET A 104 22.841 -26.810 11.659 1.00 30.15 H new ATOM 0 HE3 MET A 104 21.652 -26.495 12.944 1.00 30.15 H new ATOM 1738 N GLU A 105 24.194 -21.937 12.165 1.00 22.22 N ATOM 1739 CA GLU A 105 25.636 -22.115 12.188 1.00 42.35 C ATOM 1740 C GLU A 105 26.315 -20.874 12.771 1.00 51.45 C ATOM 1741 O GLU A 105 27.465 -20.936 13.201 1.00 3.54 O ATOM 1742 CB GLU A 105 26.172 -22.426 10.789 1.00 60.52 C ATOM 1743 CG GLU A 105 25.928 -23.892 10.422 1.00 0.22 C ATOM 1744 CD GLU A 105 26.793 -24.822 11.276 1.00 52.24 C ATOM 1745 OE1 GLU A 105 26.455 -26.003 11.442 1.00 33.13 O ATOM 1746 OE2 GLU A 105 27.851 -24.278 11.774 1.00 41.43 O ATOM 0 H GLU A 105 23.846 -21.368 11.393 1.00 22.22 H new ATOM 0 HA GLU A 105 25.867 -22.966 12.828 1.00 42.35 H new ATOM 0 HB2 GLU A 105 25.688 -21.779 10.058 1.00 60.52 H new ATOM 0 HB3 GLU A 105 27.240 -22.210 10.748 1.00 60.52 H new ATOM 0 HG2 GLU A 105 24.875 -24.136 10.564 1.00 0.22 H new ATOM 0 HG3 GLU A 105 26.152 -24.049 9.367 1.00 0.22 H new ATOM 1754 N MET A 106 25.574 -19.775 12.765 1.00 33.52 N ATOM 1755 CA MET A 106 26.090 -18.522 13.288 1.00 15.22 C ATOM 1756 C MET A 106 27.291 -18.041 12.473 1.00 44.42 C ATOM 1757 O MET A 106 28.051 -17.186 12.926 1.00 41.34 O ATOM 1758 CB MET A 106 26.506 -18.710 14.748 1.00 35.35 C ATOM 1759 CG MET A 106 26.231 -17.445 15.564 1.00 32.44 C ATOM 1760 SD MET A 106 27.171 -17.481 17.081 1.00 31.33 S ATOM 1761 CE MET A 106 25.975 -18.238 18.169 1.00 10.13 C ATOM 0 H MET A 106 24.620 -19.727 12.406 1.00 33.52 H new ATOM 0 HA MET A 106 25.304 -17.770 13.219 1.00 15.22 H new ATOM 0 HB2 MET A 106 25.962 -19.551 15.179 1.00 35.35 H new ATOM 0 HB3 MET A 106 27.567 -18.956 14.799 1.00 35.35 H new ATOM 0 HG2 MET A 106 26.497 -16.562 14.983 1.00 32.44 H new ATOM 0 HG3 MET A 106 25.167 -17.371 15.788 1.00 32.44 H new ATOM 0 HE1 MET A 106 26.402 -18.336 19.167 1.00 10.13 H new ATOM 0 HE2 MET A 106 25.081 -17.616 18.217 1.00 10.13 H new ATOM 0 HE3 MET A 106 25.710 -19.225 17.789 1.00 10.13 H new ATOM 1771 N LYS A 107 27.426 -18.611 11.284 1.00 2.35 N ATOM 1772 CA LYS A 107 28.523 -18.251 10.402 1.00 52.33 C ATOM 1773 C LYS A 107 28.029 -17.235 9.369 1.00 35.34 C ATOM 1774 O LYS A 107 28.830 -16.577 8.708 1.00 12.44 O ATOM 1775 CB LYS A 107 29.146 -19.504 9.783 1.00 53.54 C ATOM 1776 CG LYS A 107 28.169 -20.184 8.822 1.00 73.13 C ATOM 1777 CD LYS A 107 28.402 -19.720 7.383 1.00 42.04 C ATOM 1778 CE LYS A 107 29.485 -20.561 6.704 1.00 23.12 C ATOM 1779 NZ LYS A 107 28.930 -21.859 6.258 1.00 4.25 N ATOM 0 H LYS A 107 26.794 -19.319 10.911 1.00 2.35 H new ATOM 0 HA LYS A 107 29.323 -17.770 10.965 1.00 52.33 H new ATOM 0 HB2 LYS A 107 30.058 -19.236 9.250 1.00 53.54 H new ATOM 0 HB3 LYS A 107 29.430 -20.201 10.572 1.00 53.54 H new ATOM 0 HG2 LYS A 107 28.288 -21.266 8.883 1.00 73.13 H new ATOM 0 HG3 LYS A 107 27.145 -19.958 9.119 1.00 73.13 H new ATOM 0 HD2 LYS A 107 27.472 -19.793 6.819 1.00 42.04 H new ATOM 0 HD3 LYS A 107 28.696 -18.670 7.379 1.00 42.04 H new ATOM 0 HE2 LYS A 107 29.892 -20.020 5.850 1.00 23.12 H new ATOM 0 HE3 LYS A 107 30.310 -20.730 7.396 1.00 23.12 H new ATOM 0 HZ1 LYS A 107 29.685 -22.574 6.247 1.00 4.25 H new ATOM 0 HZ2 LYS A 107 28.179 -22.159 6.912 1.00 4.25 H new ATOM 0 HZ3 LYS A 107 28.536 -21.757 5.301 1.00 4.25 H new ATOM 1792 N SER A 108 26.711 -17.141 9.263 1.00 3.34 N ATOM 1793 CA SER A 108 26.101 -16.217 8.323 1.00 54.32 C ATOM 1794 C SER A 108 25.050 -15.363 9.035 1.00 11.34 C ATOM 1795 O SER A 108 24.148 -15.893 9.682 1.00 23.33 O ATOM 1796 CB SER A 108 25.468 -16.965 7.148 1.00 44.25 C ATOM 1797 OG SER A 108 26.374 -17.892 6.555 1.00 4.32 O ATOM 0 H SER A 108 26.050 -17.690 9.813 1.00 3.34 H new ATOM 0 HA SER A 108 26.882 -15.567 7.928 1.00 54.32 H new ATOM 0 HB2 SER A 108 24.580 -17.495 7.492 1.00 44.25 H new ATOM 0 HB3 SER A 108 25.140 -16.247 6.396 1.00 44.25 H new ATOM 0 HG SER A 108 25.932 -18.350 5.810 1.00 4.32 H new ATOM 1803 N VAL A 109 25.201 -14.054 8.893 1.00 63.34 N ATOM 1804 CA VAL A 109 24.277 -13.122 9.515 1.00 52.34 C ATOM 1805 C VAL A 109 24.018 -11.954 8.561 1.00 43.25 C ATOM 1806 O VAL A 109 24.955 -11.384 8.003 1.00 20.00 O ATOM 1807 CB VAL A 109 24.819 -12.675 10.874 1.00 44.45 C ATOM 1808 CG1 VAL A 109 23.686 -12.211 11.791 1.00 61.41 C ATOM 1809 CG2 VAL A 109 25.637 -13.789 11.531 1.00 54.41 C ATOM 0 H VAL A 109 25.950 -13.617 8.356 1.00 63.34 H new ATOM 0 HA VAL A 109 23.319 -13.605 9.706 1.00 52.34 H new ATOM 0 HB VAL A 109 25.482 -11.826 10.708 1.00 44.45 H new ATOM 0 HG11 VAL A 109 24.099 -11.899 12.750 1.00 61.41 H new ATOM 0 HG12 VAL A 109 23.165 -11.372 11.330 1.00 61.41 H new ATOM 0 HG13 VAL A 109 22.985 -13.031 11.947 1.00 61.41 H new ATOM 0 HG21 VAL A 109 26.011 -13.445 12.496 1.00 54.41 H new ATOM 0 HG22 VAL A 109 25.006 -14.666 11.678 1.00 54.41 H new ATOM 0 HG23 VAL A 109 26.478 -14.050 10.888 1.00 54.41 H new ATOM 1819 N TYR A 110 22.743 -11.632 8.402 1.00 32.10 N ATOM 1820 CA TYR A 110 22.349 -10.542 7.525 1.00 23.40 C ATOM 1821 C TYR A 110 21.639 -9.437 8.309 1.00 73.12 C ATOM 1822 O TYR A 110 21.052 -9.695 9.359 1.00 41.41 O ATOM 1823 CB TYR A 110 21.370 -11.146 6.516 1.00 2.20 C ATOM 1824 CG TYR A 110 21.608 -12.630 6.229 1.00 45.53 C ATOM 1825 CD1 TYR A 110 21.180 -13.584 7.128 1.00 34.23 C ATOM 1826 CD2 TYR A 110 22.252 -13.013 5.070 1.00 63.33 C ATOM 1827 CE1 TYR A 110 21.404 -14.981 6.858 1.00 51.32 C ATOM 1828 CE2 TYR A 110 22.476 -14.410 4.799 1.00 5.22 C ATOM 1829 CZ TYR A 110 22.041 -15.325 5.707 1.00 43.54 C ATOM 1830 OH TYR A 110 22.253 -16.643 5.451 1.00 21.42 O ATOM 0 H TYR A 110 21.969 -12.107 8.866 1.00 32.10 H new ATOM 0 HA TYR A 110 23.222 -10.099 7.046 1.00 23.40 H new ATOM 0 HB2 TYR A 110 20.354 -11.017 6.889 1.00 2.20 H new ATOM 0 HB3 TYR A 110 21.439 -10.590 5.581 1.00 2.20 H new ATOM 0 HD1 TYR A 110 20.677 -13.284 8.035 1.00 34.23 H new ATOM 0 HD2 TYR A 110 22.588 -12.266 4.366 1.00 63.33 H new ATOM 0 HE1 TYR A 110 21.074 -15.738 7.554 1.00 51.32 H new ATOM 0 HE2 TYR A 110 22.978 -14.724 3.896 1.00 5.22 H new ATOM 0 HH TYR A 110 22.717 -16.739 4.593 1.00 21.42 H new ATOM 1840 N TYR A 111 21.715 -8.230 7.768 1.00 13.23 N ATOM 1841 CA TYR A 111 21.086 -7.084 8.404 1.00 61.31 C ATOM 1842 C TYR A 111 19.923 -6.558 7.560 1.00 64.43 C ATOM 1843 O TYR A 111 20.083 -5.599 6.806 1.00 33.24 O ATOM 1844 CB TYR A 111 22.167 -6.005 8.491 1.00 53.31 C ATOM 1845 CG TYR A 111 23.260 -6.300 9.519 1.00 21.25 C ATOM 1846 CD1 TYR A 111 22.985 -6.198 10.868 1.00 13.21 C ATOM 1847 CD2 TYR A 111 24.522 -6.669 9.099 1.00 73.01 C ATOM 1848 CE1 TYR A 111 24.014 -6.476 11.836 1.00 12.12 C ATOM 1849 CE2 TYR A 111 25.551 -6.947 10.067 1.00 33.11 C ATOM 1850 CZ TYR A 111 25.246 -6.837 11.388 1.00 50.11 C ATOM 1851 OH TYR A 111 26.218 -7.099 12.302 1.00 32.53 O ATOM 0 H TYR A 111 22.202 -8.020 6.897 1.00 13.23 H new ATOM 0 HA TYR A 111 20.688 -7.357 9.381 1.00 61.31 H new ATOM 0 HB2 TYR A 111 22.628 -5.887 7.510 1.00 53.31 H new ATOM 0 HB3 TYR A 111 21.697 -5.053 8.739 1.00 53.31 H new ATOM 0 HD1 TYR A 111 21.998 -5.910 11.197 1.00 13.21 H new ATOM 0 HD2 TYR A 111 24.738 -6.749 8.044 1.00 73.01 H new ATOM 0 HE1 TYR A 111 23.812 -6.400 12.894 1.00 12.12 H new ATOM 0 HE2 TYR A 111 26.543 -7.236 9.751 1.00 33.11 H new ATOM 0 HH TYR A 111 25.868 -6.948 13.205 1.00 32.53 H new ATOM 1861 N TYR A 112 18.780 -7.210 7.714 1.00 10.31 N ATOM 1862 CA TYR A 112 17.591 -6.820 6.975 1.00 0.34 C ATOM 1863 C TYR A 112 16.997 -5.526 7.536 1.00 42.33 C ATOM 1864 O TYR A 112 16.445 -5.517 8.635 1.00 51.23 O ATOM 1865 CB TYR A 112 16.583 -7.955 7.169 1.00 44.33 C ATOM 1866 CG TYR A 112 17.090 -9.322 6.706 1.00 61.11 C ATOM 1867 CD1 TYR A 112 17.036 -9.662 5.369 1.00 3.22 C ATOM 1868 CD2 TYR A 112 17.601 -10.216 7.625 1.00 40.01 C ATOM 1869 CE1 TYR A 112 17.513 -10.949 4.934 1.00 43.24 C ATOM 1870 CE2 TYR A 112 18.078 -11.503 7.189 1.00 11.13 C ATOM 1871 CZ TYR A 112 18.011 -11.806 5.865 1.00 14.21 C ATOM 1872 OH TYR A 112 18.461 -13.021 5.454 1.00 60.33 O ATOM 0 H TYR A 112 18.652 -8.006 8.339 1.00 10.31 H new ATOM 0 HA TYR A 112 17.830 -6.648 5.926 1.00 0.34 H new ATOM 0 HB2 TYR A 112 16.318 -8.015 8.225 1.00 44.33 H new ATOM 0 HB3 TYR A 112 15.670 -7.714 6.624 1.00 44.33 H new ATOM 0 HD1 TYR A 112 16.636 -8.963 4.650 1.00 3.22 H new ATOM 0 HD2 TYR A 112 17.643 -9.950 8.671 1.00 40.01 H new ATOM 0 HE1 TYR A 112 17.476 -11.228 3.891 1.00 43.24 H new ATOM 0 HE2 TYR A 112 18.480 -12.212 7.898 1.00 11.13 H new ATOM 0 HH TYR A 112 19.356 -13.179 5.820 1.00 60.33 H new ATOM 1882 N ILE A 113 17.131 -4.464 6.755 1.00 41.05 N ATOM 1883 CA ILE A 113 16.615 -3.167 7.159 1.00 73.41 C ATOM 1884 C ILE A 113 15.102 -3.267 7.365 1.00 71.41 C ATOM 1885 O ILE A 113 14.415 -3.966 6.621 1.00 44.23 O ATOM 1886 CB ILE A 113 17.029 -2.089 6.156 1.00 73.15 C ATOM 1887 CG1 ILE A 113 18.552 -1.964 6.082 1.00 11.05 C ATOM 1888 CG2 ILE A 113 16.359 -0.752 6.480 1.00 73.34 C ATOM 1889 CD1 ILE A 113 18.963 -0.630 5.457 1.00 41.33 C ATOM 0 H ILE A 113 17.590 -4.475 5.844 1.00 41.05 H new ATOM 0 HA ILE A 113 17.048 -2.865 8.113 1.00 73.41 H new ATOM 0 HB ILE A 113 16.683 -2.391 5.168 1.00 73.15 H new ATOM 0 HG12 ILE A 113 18.976 -2.047 7.083 1.00 11.05 H new ATOM 0 HG13 ILE A 113 18.960 -2.786 5.494 1.00 11.05 H new ATOM 0 HG21 ILE A 113 16.670 -0.003 5.752 1.00 73.34 H new ATOM 0 HG22 ILE A 113 15.276 -0.869 6.440 1.00 73.34 H new ATOM 0 HG23 ILE A 113 16.653 -0.431 7.479 1.00 73.34 H new ATOM 0 HD11 ILE A 113 20.050 -0.567 5.416 1.00 41.33 H new ATOM 0 HD12 ILE A 113 18.558 -0.561 4.448 1.00 41.33 H new ATOM 0 HD13 ILE A 113 18.574 0.190 6.061 1.00 41.33 H new ATOM 1901 N ASN A 114 14.627 -2.559 8.379 1.00 72.03 N ATOM 1902 CA ASN A 114 13.208 -2.559 8.692 1.00 30.30 C ATOM 1903 C ASN A 114 12.427 -1.997 7.502 1.00 23.23 C ATOM 1904 O ASN A 114 12.467 -0.796 7.241 1.00 45.04 O ATOM 1905 CB ASN A 114 12.913 -1.680 9.909 1.00 35.40 C ATOM 1906 CG ASN A 114 13.077 -2.471 11.209 1.00 54.32 C ATOM 1907 OD1 ASN A 114 14.079 -3.345 11.188 1.00 31.35 O flip ATOM 1908 ND2 ASN A 114 12.342 -2.298 12.167 1.00 52.33 N flip ATOM 0 H ASN A 114 15.200 -1.981 8.995 1.00 72.03 H new ATOM 0 HA ASN A 114 12.910 -3.585 8.907 1.00 30.30 H new ATOM 0 HB2 ASN A 114 13.585 -0.822 9.914 1.00 35.40 H new ATOM 0 HB3 ASN A 114 11.898 -1.289 9.842 1.00 35.40 H new ATOM 0 HD21 ASN A 114 11.591 -1.610 12.116 1.00 52.33 H new ATOM 0 HD22 ASN A 114 12.478 -2.842 13.019 1.00 52.33 H new ATOM 1915 N ASN A 115 11.735 -2.893 6.813 1.00 2.44 N ATOM 1916 CA ASN A 115 10.946 -2.501 5.658 1.00 64.05 C ATOM 1917 C ASN A 115 9.590 -3.207 5.709 1.00 51.35 C ATOM 1918 O ASN A 115 9.451 -4.328 5.222 1.00 12.04 O ATOM 1919 CB ASN A 115 11.640 -2.904 4.355 1.00 24.10 C ATOM 1920 CG ASN A 115 10.927 -2.299 3.144 1.00 64.41 C ATOM 1921 OD1 ASN A 115 11.177 -1.175 2.742 1.00 52.22 O ATOM 1922 ND2 ASN A 115 10.029 -3.106 2.587 1.00 55.01 N ATOM 0 H ASN A 115 11.705 -3.889 7.033 1.00 2.44 H new ATOM 0 HA ASN A 115 10.826 -1.418 5.683 1.00 64.05 H new ATOM 0 HB2 ASN A 115 12.678 -2.572 4.374 1.00 24.10 H new ATOM 0 HB3 ASN A 115 11.655 -3.990 4.268 1.00 24.10 H new ATOM 0 HD21 ASN A 115 9.500 -2.795 1.772 1.00 55.01 H new ATOM 0 HD22 ASN A 115 9.869 -4.036 2.975 1.00 55.01 H new ATOM 1929 N CYS A 116 8.624 -2.521 6.302 1.00 52.25 N ATOM 1930 CA CYS A 116 7.283 -3.068 6.422 1.00 1.24 C ATOM 1931 C CYS A 116 6.284 -1.989 5.999 1.00 22.02 C ATOM 1932 O CYS A 116 5.467 -2.211 5.107 1.00 14.43 O ATOM 1933 CB CYS A 116 7.006 -3.579 7.838 1.00 41.33 C ATOM 1934 SG CYS A 116 7.759 -2.452 9.068 1.00 33.30 S ATOM 0 H CYS A 116 8.743 -1.591 6.705 1.00 52.25 H new ATOM 0 HA CYS A 116 7.180 -3.933 5.767 1.00 1.24 H new ATOM 0 HB2 CYS A 116 5.931 -3.647 8.005 1.00 41.33 H new ATOM 0 HB3 CYS A 116 7.412 -4.584 7.957 1.00 41.33 H new ATOM 0 HG CYS A 116 7.516 -2.893 10.267 1.00 33.30 H new ATOM 1940 N ASP A 117 6.383 -0.845 6.659 1.00 0.53 N ATOM 1941 CA ASP A 117 5.498 0.269 6.363 1.00 42.33 C ATOM 1942 C ASP A 117 6.289 1.367 5.649 1.00 42.23 C ATOM 1943 O ASP A 117 6.617 2.391 6.247 1.00 33.43 O ATOM 1944 CB ASP A 117 4.914 0.865 7.645 1.00 1.20 C ATOM 1945 CG ASP A 117 3.970 -0.059 8.416 1.00 74.11 C ATOM 1946 OD1 ASP A 117 4.118 -1.290 8.390 1.00 41.14 O ATOM 1947 OD2 ASP A 117 3.036 0.541 9.073 1.00 32.13 O ATOM 0 H ASP A 117 7.063 -0.665 7.398 1.00 0.53 H new ATOM 0 HA ASP A 117 4.687 -0.102 5.736 1.00 42.33 H new ATOM 0 HB2 ASP A 117 5.735 1.151 8.302 1.00 1.20 H new ATOM 0 HB3 ASP A 117 4.377 1.779 7.391 1.00 1.20 H new ATOM 1953 N THR A 118 6.573 1.117 4.379 1.00 43.10 N ATOM 1954 CA THR A 118 7.320 2.072 3.577 1.00 33.40 C ATOM 1955 C THR A 118 6.385 3.149 3.023 1.00 21.12 C ATOM 1956 O THR A 118 6.578 4.336 3.282 1.00 31.20 O ATOM 1957 CB THR A 118 8.064 1.295 2.489 1.00 0.10 C ATOM 1958 OG1 THR A 118 9.204 0.765 3.159 1.00 23.13 O ATOM 1959 CG2 THR A 118 8.655 2.212 1.416 1.00 63.40 C ATOM 0 H THR A 118 6.299 0.267 3.886 1.00 43.10 H new ATOM 0 HA THR A 118 8.057 2.604 4.179 1.00 33.40 H new ATOM 0 HB THR A 118 7.384 0.582 2.023 1.00 0.10 H new ATOM 0 HG1 THR A 118 9.619 0.074 2.602 1.00 23.13 H new ATOM 0 HG21 THR A 118 9.172 1.611 0.668 1.00 63.40 H new ATOM 0 HG22 THR A 118 7.854 2.776 0.938 1.00 63.40 H new ATOM 0 HG23 THR A 118 9.360 2.904 1.877 1.00 63.40 H new ATOM 1967 N ASP A 119 5.393 2.696 2.271 1.00 15.33 N ATOM 1968 CA ASP A 119 4.427 3.607 1.679 1.00 64.33 C ATOM 1969 C ASP A 119 3.883 4.541 2.761 1.00 34.20 C ATOM 1970 O ASP A 119 3.455 5.656 2.466 1.00 72.30 O ATOM 1971 CB ASP A 119 3.247 2.842 1.076 1.00 1.21 C ATOM 1972 CG ASP A 119 2.159 2.441 2.074 1.00 11.52 C ATOM 1973 OD1 ASP A 119 0.961 2.649 1.831 1.00 50.34 O ATOM 1974 OD2 ASP A 119 2.589 1.886 3.156 1.00 3.21 O ATOM 0 H ASP A 119 5.237 1.711 2.058 1.00 15.33 H new ATOM 0 HA ASP A 119 4.931 4.170 0.893 1.00 64.33 H new ATOM 0 HB2 ASP A 119 2.796 3.456 0.296 1.00 1.21 H new ATOM 0 HB3 ASP A 119 3.626 1.941 0.593 1.00 1.21 H new ATOM 1980 N ALA A 120 3.916 4.051 3.992 1.00 42.42 N ATOM 1981 CA ALA A 120 3.431 4.829 5.120 1.00 61.43 C ATOM 1982 C ALA A 120 4.568 5.697 5.662 1.00 23.52 C ATOM 1983 O ALA A 120 4.326 6.765 6.221 1.00 40.34 O ATOM 1984 CB ALA A 120 2.860 3.886 6.181 1.00 55.31 C ATOM 0 H ALA A 120 4.271 3.126 4.233 1.00 42.42 H new ATOM 0 HA ALA A 120 2.627 5.496 4.810 1.00 61.43 H new ATOM 0 HB1 ALA A 120 2.496 4.468 7.027 1.00 55.31 H new ATOM 0 HB2 ALA A 120 2.037 3.313 5.754 1.00 55.31 H new ATOM 0 HB3 ALA A 120 3.640 3.203 6.519 1.00 55.31 H new ATOM 1990 N ASN A 121 5.785 5.204 5.479 1.00 54.53 N ATOM 1991 CA ASN A 121 6.960 5.922 5.943 1.00 70.22 C ATOM 1992 C ASN A 121 7.406 6.912 4.865 1.00 2.13 C ATOM 1993 O ASN A 121 7.275 8.123 5.037 1.00 35.01 O ATOM 1994 CB ASN A 121 8.120 4.962 6.212 1.00 24.23 C ATOM 1995 CG ASN A 121 8.022 4.363 7.617 1.00 75.34 C ATOM 1996 OD1 ASN A 121 6.775 4.140 8.023 1.00 45.03 O flip ATOM 1997 ND2 ASN A 121 9.011 4.119 8.287 1.00 20.40 N flip ATOM 0 H ASN A 121 5.982 4.317 5.016 1.00 54.53 H new ATOM 0 HA ASN A 121 6.697 6.439 6.866 1.00 70.22 H new ATOM 0 HB2 ASN A 121 8.115 4.163 5.471 1.00 24.23 H new ATOM 0 HB3 ASN A 121 9.067 5.491 6.104 1.00 24.23 H new ATOM 0 HD21 ASN A 121 9.940 4.315 7.915 1.00 20.40 H new ATOM 0 HD22 ASN A 121 8.909 3.719 9.220 1.00 20.40 H new ATOM 2004 N VAL A 122 7.925 6.361 3.778 1.00 31.51 N ATOM 2005 CA VAL A 122 8.391 7.180 2.673 1.00 43.23 C ATOM 2006 C VAL A 122 7.211 7.957 2.086 1.00 10.21 C ATOM 2007 O VAL A 122 7.171 9.184 2.163 1.00 2.22 O ATOM 2008 CB VAL A 122 9.105 6.307 1.639 1.00 43.33 C ATOM 2009 CG1 VAL A 122 9.616 7.150 0.468 1.00 10.25 C ATOM 2010 CG2 VAL A 122 10.245 5.516 2.283 1.00 62.30 C ATOM 0 H VAL A 122 8.033 5.356 3.639 1.00 31.51 H new ATOM 0 HA VAL A 122 9.121 7.911 3.021 1.00 43.23 H new ATOM 0 HB VAL A 122 8.381 5.593 1.247 1.00 43.33 H new ATOM 0 HG11 VAL A 122 10.119 6.505 -0.252 1.00 10.25 H new ATOM 0 HG12 VAL A 122 8.776 7.648 -0.016 1.00 10.25 H new ATOM 0 HG13 VAL A 122 10.317 7.898 0.837 1.00 10.25 H new ATOM 0 HG21 VAL A 122 10.736 4.904 1.526 1.00 62.30 H new ATOM 0 HG22 VAL A 122 10.968 6.207 2.716 1.00 62.30 H new ATOM 0 HG23 VAL A 122 9.844 4.873 3.066 1.00 62.30 H new ATOM 2020 N GLY A 123 6.278 7.211 1.513 1.00 24.31 N ATOM 2021 CA GLY A 123 5.100 7.814 0.914 1.00 43.12 C ATOM 2022 C GLY A 123 5.358 8.185 -0.548 1.00 53.21 C ATOM 2023 O GLY A 123 4.421 8.300 -1.337 1.00 42.12 O ATOM 0 H GLY A 123 6.314 6.194 1.451 1.00 24.31 H new ATOM 0 HA2 GLY A 123 4.261 7.120 0.974 1.00 43.12 H new ATOM 0 HA3 GLY A 123 4.818 8.705 1.475 1.00 43.12 H new ATOM 2027 N SER A 124 6.632 8.362 -0.865 1.00 10.33 N ATOM 2028 CA SER A 124 7.024 8.718 -2.218 1.00 4.12 C ATOM 2029 C SER A 124 6.146 7.978 -3.229 1.00 1.40 C ATOM 2030 O SER A 124 5.822 6.808 -3.036 1.00 20.42 O ATOM 2031 CB SER A 124 8.501 8.400 -2.465 1.00 15.44 C ATOM 2032 OG SER A 124 9.354 9.093 -1.558 1.00 45.32 O ATOM 0 H SER A 124 7.406 8.266 -0.208 1.00 10.33 H new ATOM 0 HA SER A 124 6.885 9.792 -2.343 1.00 4.12 H new ATOM 0 HB2 SER A 124 8.662 7.327 -2.366 1.00 15.44 H new ATOM 0 HB3 SER A 124 8.764 8.669 -3.488 1.00 15.44 H new ATOM 0 HG SER A 124 9.057 10.023 -1.476 1.00 45.32 H new ATOM 2038 N ASP A 125 5.786 8.692 -4.285 1.00 53.33 N ATOM 2039 CA ASP A 125 4.951 8.118 -5.327 1.00 42.32 C ATOM 2040 C ASP A 125 5.623 6.859 -5.877 1.00 23.53 C ATOM 2041 O ASP A 125 6.748 6.535 -5.498 1.00 32.24 O ATOM 2042 CB ASP A 125 4.765 9.099 -6.487 1.00 3.04 C ATOM 2043 CG ASP A 125 4.271 10.490 -6.084 1.00 61.01 C ATOM 2044 OD1 ASP A 125 4.995 11.263 -5.440 1.00 43.40 O ATOM 2045 OD2 ASP A 125 3.071 10.773 -6.464 1.00 44.43 O ATOM 0 H ASP A 125 6.057 9.663 -4.442 1.00 53.33 H new ATOM 0 HA ASP A 125 3.979 7.886 -4.891 1.00 42.32 H new ATOM 0 HB2 ASP A 125 5.716 9.205 -7.010 1.00 3.04 H new ATOM 0 HB3 ASP A 125 4.057 8.670 -7.196 1.00 3.04 H new ATOM 2051 N VAL A 126 4.906 6.182 -6.762 1.00 30.25 N ATOM 2052 CA VAL A 126 5.419 4.965 -7.367 1.00 71.41 C ATOM 2053 C VAL A 126 6.292 5.327 -8.570 1.00 1.31 C ATOM 2054 O VAL A 126 6.953 4.464 -9.145 1.00 32.32 O ATOM 2055 CB VAL A 126 4.261 4.032 -7.728 1.00 62.24 C ATOM 2056 CG1 VAL A 126 4.780 2.673 -8.205 1.00 13.54 C ATOM 2057 CG2 VAL A 126 3.300 3.869 -6.549 1.00 53.14 C ATOM 0 H VAL A 126 3.974 6.453 -7.075 1.00 30.25 H new ATOM 0 HA VAL A 126 6.048 4.423 -6.661 1.00 71.41 H new ATOM 0 HB VAL A 126 3.708 4.487 -8.550 1.00 62.24 H new ATOM 0 HG11 VAL A 126 3.937 2.029 -8.455 1.00 13.54 H new ATOM 0 HG12 VAL A 126 5.405 2.811 -9.087 1.00 13.54 H new ATOM 0 HG13 VAL A 126 5.368 2.210 -7.413 1.00 13.54 H new ATOM 0 HG21 VAL A 126 2.486 3.201 -6.832 1.00 53.14 H new ATOM 0 HG22 VAL A 126 3.836 3.448 -5.698 1.00 53.14 H new ATOM 0 HG23 VAL A 126 2.892 4.842 -6.275 1.00 53.14 H new ATOM 2067 N GLU A 127 6.267 6.606 -8.915 1.00 12.32 N ATOM 2068 CA GLU A 127 7.048 7.094 -10.039 1.00 31.12 C ATOM 2069 C GLU A 127 8.543 6.935 -9.755 1.00 71.22 C ATOM 2070 O GLU A 127 9.219 6.136 -10.401 1.00 63.20 O ATOM 2071 CB GLU A 127 6.702 8.550 -10.356 1.00 40.12 C ATOM 2072 CG GLU A 127 5.194 8.726 -10.547 1.00 43.53 C ATOM 2073 CD GLU A 127 4.629 7.647 -11.472 1.00 72.31 C ATOM 2074 OE1 GLU A 127 4.558 7.851 -12.693 1.00 41.11 O ATOM 2075 OE2 GLU A 127 4.256 6.563 -10.880 1.00 71.35 O ATOM 0 H GLU A 127 5.718 7.320 -8.436 1.00 12.32 H new ATOM 0 HA GLU A 127 6.799 6.497 -10.916 1.00 31.12 H new ATOM 0 HB2 GLU A 127 7.047 9.194 -9.547 1.00 40.12 H new ATOM 0 HB3 GLU A 127 7.226 8.864 -11.259 1.00 40.12 H new ATOM 0 HG2 GLU A 127 4.693 8.679 -9.580 1.00 43.53 H new ATOM 0 HG3 GLU A 127 4.989 9.712 -10.965 1.00 43.53 H new ATOM 2083 N HIS A 128 9.015 7.708 -8.788 1.00 51.25 N ATOM 2084 CA HIS A 128 10.417 7.663 -8.411 1.00 44.14 C ATOM 2085 C HIS A 128 10.551 7.089 -7.000 1.00 21.44 C ATOM 2086 O HIS A 128 11.261 7.645 -6.164 1.00 2.24 O ATOM 2087 CB HIS A 128 11.063 9.043 -8.554 1.00 32.13 C ATOM 2088 CG HIS A 128 11.730 9.274 -9.889 1.00 0.14 C ATOM 2089 ND1 HIS A 128 12.707 10.235 -10.082 1.00 53.40 N ATOM 2090 CD2 HIS A 128 11.552 8.659 -11.093 1.00 33.54 C ATOM 2091 CE1 HIS A 128 13.091 10.192 -11.349 1.00 51.22 C ATOM 2092 NE2 HIS A 128 12.374 9.215 -11.974 1.00 75.40 N ATOM 0 H HIS A 128 8.451 8.369 -8.254 1.00 51.25 H new ATOM 0 HA HIS A 128 10.958 7.001 -9.087 1.00 44.14 H new ATOM 0 HB2 HIS A 128 10.300 9.807 -8.403 1.00 32.13 H new ATOM 0 HB3 HIS A 128 11.802 9.170 -7.763 1.00 32.13 H new ATOM 0 HD2 HIS A 128 10.859 7.855 -11.295 1.00 33.54 H new ATOM 0 HE1 HIS A 128 13.841 10.821 -11.807 1.00 51.22 H new ATOM 0 HE2 HIS A 128 12.456 8.954 -12.957 1.00 75.40 H new ATOM 2100 N TYR A 129 9.857 5.982 -6.778 1.00 1.14 N ATOM 2101 CA TYR A 129 9.889 5.326 -5.481 1.00 61.05 C ATOM 2102 C TYR A 129 11.201 4.562 -5.286 1.00 15.53 C ATOM 2103 O TYR A 129 11.801 4.617 -4.214 1.00 11.54 O ATOM 2104 CB TYR A 129 8.728 4.330 -5.484 1.00 62.55 C ATOM 2105 CG TYR A 129 8.183 4.005 -4.092 1.00 62.12 C ATOM 2106 CD1 TYR A 129 7.736 5.021 -3.272 1.00 24.20 C ATOM 2107 CD2 TYR A 129 8.138 2.696 -3.657 1.00 4.05 C ATOM 2108 CE1 TYR A 129 7.223 4.715 -1.962 1.00 5.34 C ATOM 2109 CE2 TYR A 129 7.625 2.391 -2.346 1.00 65.52 C ATOM 2110 CZ TYR A 129 7.193 3.415 -1.563 1.00 43.23 C ATOM 2111 OH TYR A 129 6.709 3.127 -0.326 1.00 31.33 O ATOM 0 H TYR A 129 9.269 5.523 -7.474 1.00 1.14 H new ATOM 0 HA TYR A 129 9.809 6.058 -4.678 1.00 61.05 H new ATOM 0 HB2 TYR A 129 7.920 4.732 -6.095 1.00 62.55 H new ATOM 0 HB3 TYR A 129 9.057 3.406 -5.959 1.00 62.55 H new ATOM 0 HD1 TYR A 129 7.771 6.045 -3.613 1.00 24.20 H new ATOM 0 HD2 TYR A 129 8.487 1.901 -4.299 1.00 4.05 H new ATOM 0 HE1 TYR A 129 6.870 5.500 -1.310 1.00 5.34 H new ATOM 0 HE2 TYR A 129 7.584 1.371 -1.993 1.00 65.52 H new ATOM 0 HH TYR A 129 6.522 2.167 -0.263 1.00 31.33 H new ATOM 2121 N LEU A 130 11.606 3.868 -6.338 1.00 64.33 N ATOM 2122 CA LEU A 130 12.836 3.094 -6.296 1.00 14.04 C ATOM 2123 C LEU A 130 14.008 4.025 -5.982 1.00 25.02 C ATOM 2124 O LEU A 130 15.021 3.591 -5.435 1.00 30.14 O ATOM 2125 CB LEU A 130 13.012 2.297 -7.590 1.00 3.13 C ATOM 2126 CG LEU A 130 12.584 0.829 -7.537 1.00 51.22 C ATOM 2127 CD1 LEU A 130 13.313 0.085 -6.417 1.00 11.02 C ATOM 2128 CD2 LEU A 130 11.064 0.706 -7.413 1.00 30.31 C ATOM 0 H LEU A 130 11.105 3.825 -7.225 1.00 64.33 H new ATOM 0 HA LEU A 130 12.794 2.354 -5.497 1.00 14.04 H new ATOM 0 HB2 LEU A 130 12.445 2.792 -8.378 1.00 3.13 H new ATOM 0 HB3 LEU A 130 14.062 2.338 -7.879 1.00 3.13 H new ATOM 0 HG LEU A 130 12.870 0.355 -8.476 1.00 51.22 H new ATOM 0 HD11 LEU A 130 12.990 -0.956 -6.402 1.00 11.02 H new ATOM 0 HD12 LEU A 130 14.388 0.129 -6.591 1.00 11.02 H new ATOM 0 HD13 LEU A 130 13.081 0.551 -5.459 1.00 11.02 H new ATOM 0 HD21 LEU A 130 10.786 -0.347 -7.377 1.00 30.31 H new ATOM 0 HD22 LEU A 130 10.732 1.200 -6.500 1.00 30.31 H new ATOM 0 HD23 LEU A 130 10.589 1.178 -8.273 1.00 30.31 H new ATOM 2140 N THR A 131 13.833 5.288 -6.342 1.00 32.13 N ATOM 2141 CA THR A 131 14.864 6.284 -6.105 1.00 70.13 C ATOM 2142 C THR A 131 14.679 6.927 -4.730 1.00 13.24 C ATOM 2143 O THR A 131 15.619 6.992 -3.939 1.00 52.10 O ATOM 2144 CB THR A 131 14.822 7.290 -7.257 1.00 44.02 C ATOM 2145 OG1 THR A 131 13.432 7.517 -7.470 1.00 12.02 O ATOM 2146 CG2 THR A 131 15.308 6.689 -8.578 1.00 20.23 C ATOM 0 H THR A 131 12.992 5.645 -6.796 1.00 32.13 H new ATOM 0 HA THR A 131 15.855 5.831 -6.086 1.00 70.13 H new ATOM 0 HB THR A 131 15.435 8.155 -7.005 1.00 44.02 H new ATOM 0 HG1 THR A 131 13.226 7.416 -8.423 1.00 12.02 H new ATOM 0 HG21 THR A 131 15.258 7.445 -9.362 1.00 20.23 H new ATOM 0 HG22 THR A 131 16.338 6.350 -8.466 1.00 20.23 H new ATOM 0 HG23 THR A 131 14.675 5.844 -8.848 1.00 20.23 H new ATOM 2154 N ARG A 132 13.460 7.386 -4.486 1.00 1.41 N ATOM 2155 CA ARG A 132 13.139 8.022 -3.219 1.00 44.44 C ATOM 2156 C ARG A 132 13.218 7.005 -2.080 1.00 32.34 C ATOM 2157 O ARG A 132 13.290 7.381 -0.911 1.00 21.13 O ATOM 2158 CB ARG A 132 11.738 8.636 -3.250 1.00 42.15 C ATOM 2159 CG ARG A 132 11.712 9.981 -2.521 1.00 23.32 C ATOM 2160 CD ARG A 132 12.778 10.927 -3.077 1.00 25.22 C ATOM 2161 NE ARG A 132 12.374 12.333 -2.853 1.00 30.32 N ATOM 2162 CZ ARG A 132 11.396 12.958 -3.542 1.00 32.21 C ATOM 2163 NH1 ARG A 132 10.713 12.305 -4.506 1.00 54.43 N ATOM 2164 NH2 ARG A 132 11.117 14.217 -3.259 1.00 25.34 N ATOM 0 H ARG A 132 12.683 7.330 -5.144 1.00 1.41 H new ATOM 0 HA ARG A 132 13.867 8.816 -3.053 1.00 44.44 H new ATOM 0 HB2 ARG A 132 11.420 8.772 -4.284 1.00 42.15 H new ATOM 0 HB3 ARG A 132 11.027 7.953 -2.785 1.00 42.15 H new ATOM 0 HG2 ARG A 132 10.727 10.436 -2.625 1.00 23.32 H new ATOM 0 HG3 ARG A 132 11.880 9.824 -1.455 1.00 23.32 H new ATOM 0 HD2 ARG A 132 13.735 10.734 -2.593 1.00 25.22 H new ATOM 0 HD3 ARG A 132 12.917 10.745 -4.143 1.00 25.22 H new ATOM 0 HE ARG A 132 12.865 12.863 -2.133 1.00 30.32 H new ATOM 0 HH11 ARG A 132 10.935 11.332 -4.718 1.00 54.43 H new ATOM 0 HH12 ARG A 132 9.975 12.784 -5.022 1.00 54.43 H new ATOM 0 HH21 ARG A 132 11.638 14.703 -2.529 1.00 25.34 H new ATOM 0 HH22 ARG A 132 10.381 14.704 -3.770 1.00 25.34 H new ATOM 2177 N TRP A 133 13.201 5.736 -2.460 1.00 33.32 N ATOM 2178 CA TRP A 133 13.269 4.661 -1.484 1.00 50.11 C ATOM 2179 C TRP A 133 14.741 4.429 -1.139 1.00 63.51 C ATOM 2180 O TRP A 133 15.147 4.592 0.011 1.00 54.23 O ATOM 2181 CB TRP A 133 12.571 3.403 -2.004 1.00 50.03 C ATOM 2182 CG TRP A 133 12.798 2.162 -1.138 1.00 53.33 C ATOM 2183 CD1 TRP A 133 12.203 1.844 0.020 1.00 51.53 C ATOM 2184 CD2 TRP A 133 13.712 1.079 -1.410 1.00 41.32 C ATOM 2185 NE1 TRP A 133 12.665 0.641 0.512 1.00 21.02 N ATOM 2186 CE2 TRP A 133 13.612 0.161 -0.385 1.00 60.11 C ATOM 2187 CE3 TRP A 133 14.595 0.882 -2.487 1.00 14.31 C ATOM 2188 CZ2 TRP A 133 14.366 -1.018 -0.335 1.00 41.43 C ATOM 2189 CZ3 TRP A 133 15.341 -0.300 -2.422 1.00 62.32 C ATOM 2190 CH2 TRP A 133 15.252 -1.235 -1.397 1.00 42.12 C ATOM 0 H TRP A 133 13.141 5.428 -3.430 1.00 33.32 H new ATOM 0 HA TRP A 133 12.736 4.933 -0.573 1.00 50.11 H new ATOM 0 HB2 TRP A 133 11.500 3.596 -2.071 1.00 50.03 H new ATOM 0 HB3 TRP A 133 12.922 3.197 -3.015 1.00 50.03 H new ATOM 0 HD1 TRP A 133 11.456 2.453 0.507 1.00 51.53 H new ATOM 0 HE1 TRP A 133 12.367 0.187 1.375 1.00 21.02 H new ATOM 0 HE3 TRP A 133 14.690 1.587 -3.300 1.00 14.31 H new ATOM 0 HZ2 TRP A 133 14.269 -1.722 0.479 1.00 41.43 H new ATOM 0 HZ3 TRP A 133 16.035 -0.500 -3.225 1.00 62.32 H new ATOM 0 HH2 TRP A 133 15.864 -2.125 -1.420 1.00 42.12 H new ATOM 2201 N ILE A 134 15.502 4.050 -2.156 1.00 53.40 N ATOM 2202 CA ILE A 134 16.920 3.794 -1.975 1.00 24.31 C ATOM 2203 C ILE A 134 17.589 5.038 -1.387 1.00 54.44 C ATOM 2204 O ILE A 134 18.237 4.966 -0.344 1.00 74.35 O ATOM 2205 CB ILE A 134 17.550 3.318 -3.286 1.00 5.25 C ATOM 2206 CG1 ILE A 134 19.025 2.959 -3.087 1.00 15.23 C ATOM 2207 CG2 ILE A 134 17.357 4.355 -4.394 1.00 64.54 C ATOM 2208 CD1 ILE A 134 19.180 1.498 -2.662 1.00 64.40 C ATOM 0 H ILE A 134 15.162 3.914 -3.108 1.00 53.40 H new ATOM 0 HA ILE A 134 17.072 2.984 -1.262 1.00 24.31 H new ATOM 0 HB ILE A 134 17.037 2.409 -3.602 1.00 5.25 H new ATOM 0 HG12 ILE A 134 19.573 3.132 -4.013 1.00 15.23 H new ATOM 0 HG13 ILE A 134 19.463 3.610 -2.330 1.00 15.23 H new ATOM 0 HG21 ILE A 134 17.814 3.993 -5.315 1.00 64.54 H new ATOM 0 HG22 ILE A 134 16.292 4.519 -4.557 1.00 64.54 H new ATOM 0 HG23 ILE A 134 17.828 5.293 -4.100 1.00 64.54 H new ATOM 0 HD11 ILE A 134 20.237 1.268 -2.527 1.00 64.40 H new ATOM 0 HD12 ILE A 134 18.651 1.334 -1.723 1.00 64.40 H new ATOM 0 HD13 ILE A 134 18.763 0.849 -3.432 1.00 64.40 H new ATOM 2220 N SER A 135 17.408 6.152 -2.082 1.00 73.24 N ATOM 2221 CA SER A 135 17.985 7.411 -1.643 1.00 31.33 C ATOM 2222 C SER A 135 17.541 7.718 -0.211 1.00 52.32 C ATOM 2223 O SER A 135 18.145 8.549 0.465 1.00 23.12 O ATOM 2224 CB SER A 135 17.589 8.555 -2.578 1.00 64.45 C ATOM 2225 OG SER A 135 18.029 9.819 -2.091 1.00 11.52 O ATOM 0 H SER A 135 16.870 6.208 -2.946 1.00 73.24 H new ATOM 0 HA SER A 135 19.071 7.317 -1.669 1.00 31.33 H new ATOM 0 HB2 SER A 135 18.014 8.379 -3.566 1.00 64.45 H new ATOM 0 HB3 SER A 135 16.505 8.569 -2.695 1.00 64.45 H new ATOM 0 HG SER A 135 18.188 9.760 -1.126 1.00 11.52 H new ATOM 2231 N LEU A 136 16.488 7.032 0.208 1.00 30.11 N ATOM 2232 CA LEU A 136 15.956 7.221 1.547 1.00 52.22 C ATOM 2233 C LEU A 136 16.608 6.215 2.497 1.00 33.12 C ATOM 2234 O LEU A 136 16.839 6.519 3.666 1.00 13.43 O ATOM 2235 CB LEU A 136 14.427 7.151 1.531 1.00 45.02 C ATOM 2236 CG LEU A 136 13.750 6.980 2.892 1.00 54.22 C ATOM 2237 CD1 LEU A 136 12.395 7.690 2.922 1.00 12.34 C ATOM 2238 CD2 LEU A 136 13.630 5.501 3.263 1.00 72.22 C ATOM 0 H LEU A 136 15.989 6.344 -0.356 1.00 30.11 H new ATOM 0 HA LEU A 136 16.203 8.216 1.918 1.00 52.22 H new ATOM 0 HB2 LEU A 136 14.046 8.062 1.070 1.00 45.02 H new ATOM 0 HB3 LEU A 136 14.128 6.321 0.891 1.00 45.02 H new ATOM 0 HG LEU A 136 14.378 7.451 3.648 1.00 54.22 H new ATOM 0 HD11 LEU A 136 11.934 7.553 3.900 1.00 12.34 H new ATOM 0 HD12 LEU A 136 12.538 8.754 2.734 1.00 12.34 H new ATOM 0 HD13 LEU A 136 11.747 7.269 2.154 1.00 12.34 H new ATOM 0 HD21 LEU A 136 13.145 5.408 4.235 1.00 72.22 H new ATOM 0 HD22 LEU A 136 13.035 4.984 2.510 1.00 72.22 H new ATOM 0 HD23 LEU A 136 14.624 5.056 3.309 1.00 72.22 H new ATOM 2250 N TYR A 137 16.886 5.036 1.960 1.00 40.33 N ATOM 2251 CA TYR A 137 17.507 3.983 2.745 1.00 12.32 C ATOM 2252 C TYR A 137 19.027 3.997 2.576 1.00 64.43 C ATOM 2253 O TYR A 137 19.732 3.203 3.198 1.00 11.42 O ATOM 2254 CB TYR A 137 16.956 2.666 2.195 1.00 13.32 C ATOM 2255 CG TYR A 137 15.671 2.196 2.879 1.00 75.31 C ATOM 2256 CD1 TYR A 137 15.721 1.661 4.150 1.00 61.50 C ATOM 2257 CD2 TYR A 137 14.460 2.306 2.225 1.00 43.45 C ATOM 2258 CE1 TYR A 137 14.511 1.218 4.793 1.00 25.45 C ATOM 2259 CE2 TYR A 137 13.251 1.863 2.868 1.00 13.50 C ATOM 2260 CZ TYR A 137 13.336 1.341 4.121 1.00 71.13 C ATOM 2261 OH TYR A 137 12.193 0.923 4.728 1.00 24.44 O ATOM 0 H TYR A 137 16.692 4.787 0.990 1.00 40.33 H new ATOM 0 HA TYR A 137 17.291 4.116 3.805 1.00 12.32 H new ATOM 0 HB2 TYR A 137 16.766 2.781 1.128 1.00 13.32 H new ATOM 0 HB3 TYR A 137 17.717 1.893 2.302 1.00 13.32 H new ATOM 0 HD1 TYR A 137 16.668 1.575 4.663 1.00 61.50 H new ATOM 0 HD2 TYR A 137 14.420 2.725 1.230 1.00 43.45 H new ATOM 0 HE1 TYR A 137 14.537 0.797 5.787 1.00 25.45 H new ATOM 0 HE2 TYR A 137 12.298 1.943 2.367 1.00 13.50 H new ATOM 0 HH TYR A 137 11.763 0.235 4.178 1.00 24.44 H new ATOM 2271 N ILE A 138 19.489 4.906 1.730 1.00 55.21 N ATOM 2272 CA ILE A 138 20.913 5.033 1.471 1.00 54.24 C ATOM 2273 C ILE A 138 21.546 5.917 2.547 1.00 32.33 C ATOM 2274 O ILE A 138 22.756 5.867 2.764 1.00 34.42 O ATOM 2275 CB ILE A 138 21.155 5.532 0.045 1.00 42.03 C ATOM 2276 CG1 ILE A 138 22.490 5.017 -0.497 1.00 4.14 C ATOM 2277 CG2 ILE A 138 21.058 7.057 -0.027 1.00 14.34 C ATOM 2278 CD1 ILE A 138 22.527 3.488 -0.502 1.00 75.53 C ATOM 0 H ILE A 138 18.902 5.562 1.215 1.00 55.21 H new ATOM 0 HA ILE A 138 21.400 4.059 1.531 1.00 54.24 H new ATOM 0 HB ILE A 138 20.370 5.129 -0.595 1.00 42.03 H new ATOM 0 HG12 ILE A 138 22.644 5.391 -1.509 1.00 4.14 H new ATOM 0 HG13 ILE A 138 23.307 5.402 0.113 1.00 4.14 H new ATOM 0 HG21 ILE A 138 21.234 7.385 -1.052 1.00 14.34 H new ATOM 0 HG22 ILE A 138 20.064 7.374 0.290 1.00 14.34 H new ATOM 0 HG23 ILE A 138 21.806 7.501 0.630 1.00 14.34 H new ATOM 0 HD11 ILE A 138 23.487 3.149 -0.892 1.00 75.53 H new ATOM 0 HD12 ILE A 138 22.397 3.118 0.515 1.00 75.53 H new ATOM 0 HD13 ILE A 138 21.724 3.107 -1.133 1.00 75.53 H new ATOM 2290 N ARG A 139 20.700 6.705 3.193 1.00 13.43 N ATOM 2291 CA ARG A 139 21.161 7.599 4.242 1.00 24.22 C ATOM 2292 C ARG A 139 21.617 6.795 5.462 1.00 54.02 C ATOM 2293 O ARG A 139 22.168 7.355 6.408 1.00 21.01 O ATOM 2294 CB ARG A 139 20.057 8.571 4.663 1.00 23.55 C ATOM 2295 CG ARG A 139 20.001 9.777 3.725 1.00 44.44 C ATOM 2296 CD ARG A 139 18.632 10.457 3.786 1.00 73.42 C ATOM 2297 NE ARG A 139 18.618 11.472 4.862 1.00 10.03 N ATOM 2298 CZ ARG A 139 17.629 12.374 5.039 1.00 4.22 C ATOM 2299 NH1 ARG A 139 16.564 12.395 4.210 1.00 30.54 N ATOM 2300 NH2 ARG A 139 17.720 13.236 6.035 1.00 42.23 N ATOM 0 H ARG A 139 19.697 6.743 3.010 1.00 13.43 H new ATOM 0 HA ARG A 139 22.000 8.171 3.845 1.00 24.22 H new ATOM 0 HB2 ARG A 139 19.095 8.058 4.659 1.00 23.55 H new ATOM 0 HB3 ARG A 139 20.234 8.908 5.684 1.00 23.55 H new ATOM 0 HG2 ARG A 139 20.778 10.491 3.998 1.00 44.44 H new ATOM 0 HG3 ARG A 139 20.207 9.457 2.703 1.00 44.44 H new ATOM 0 HD2 ARG A 139 18.407 10.927 2.829 1.00 73.42 H new ATOM 0 HD3 ARG A 139 17.855 9.714 3.966 1.00 73.42 H new ATOM 0 HE ARG A 139 19.405 11.492 5.511 1.00 10.03 H new ATOM 0 HH11 ARG A 139 16.502 11.726 3.443 1.00 30.54 H new ATOM 0 HH12 ARG A 139 15.821 13.080 4.351 1.00 30.54 H new ATOM 0 HH21 ARG A 139 18.529 13.214 6.656 1.00 42.23 H new ATOM 0 HH22 ARG A 139 16.982 13.924 6.183 1.00 42.23 H new ATOM 2313 N ILE A 140 21.369 5.495 5.400 1.00 70.00 N ATOM 2314 CA ILE A 140 21.747 4.609 6.488 1.00 74.43 C ATOM 2315 C ILE A 140 23.173 4.105 6.258 1.00 41.40 C ATOM 2316 O ILE A 140 23.770 3.496 7.144 1.00 44.21 O ATOM 2317 CB ILE A 140 20.717 3.488 6.647 1.00 24.23 C ATOM 2318 CG1 ILE A 140 19.292 4.038 6.577 1.00 54.52 C ATOM 2319 CG2 ILE A 140 20.963 2.697 7.934 1.00 64.33 C ATOM 2320 CD1 ILE A 140 18.267 2.903 6.524 1.00 43.25 C ATOM 0 H ILE A 140 20.911 5.034 4.614 1.00 70.00 H new ATOM 0 HA ILE A 140 21.748 5.148 7.436 1.00 74.43 H new ATOM 0 HB ILE A 140 20.835 2.795 5.814 1.00 24.23 H new ATOM 0 HG12 ILE A 140 19.098 4.667 7.446 1.00 54.52 H new ATOM 0 HG13 ILE A 140 19.185 4.670 5.695 1.00 54.52 H new ATOM 0 HG21 ILE A 140 20.218 1.907 8.023 1.00 64.33 H new ATOM 0 HG22 ILE A 140 21.959 2.255 7.905 1.00 64.33 H new ATOM 0 HG23 ILE A 140 20.888 3.365 8.792 1.00 64.33 H new ATOM 0 HD11 ILE A 140 17.262 3.322 6.475 1.00 43.25 H new ATOM 0 HD12 ILE A 140 18.448 2.290 5.641 1.00 43.25 H new ATOM 0 HD13 ILE A 140 18.360 2.287 7.418 1.00 43.25 H new ATOM 2332 N PHE A 141 23.678 4.379 5.064 1.00 52.01 N ATOM 2333 CA PHE A 141 25.023 3.962 4.707 1.00 60.35 C ATOM 2334 C PHE A 141 25.901 5.169 4.371 1.00 53.21 C ATOM 2335 O PHE A 141 27.105 5.154 4.621 1.00 40.43 O ATOM 2336 CB PHE A 141 24.901 3.074 3.466 1.00 3.23 C ATOM 2337 CG PHE A 141 23.991 1.860 3.657 1.00 34.43 C ATOM 2338 CD1 PHE A 141 24.385 0.833 4.458 1.00 13.51 C ATOM 2339 CD2 PHE A 141 22.787 1.806 3.026 1.00 0.12 C ATOM 2340 CE1 PHE A 141 23.540 -0.294 4.635 1.00 15.24 C ATOM 2341 CE2 PHE A 141 21.942 0.679 3.204 1.00 71.05 C ATOM 2342 CZ PHE A 141 22.336 -0.347 4.004 1.00 31.24 C ATOM 0 H PHE A 141 23.180 4.885 4.332 1.00 52.01 H new ATOM 0 HA PHE A 141 25.483 3.434 5.542 1.00 60.35 H new ATOM 0 HB2 PHE A 141 24.521 3.674 2.639 1.00 3.23 H new ATOM 0 HB3 PHE A 141 25.895 2.729 3.180 1.00 3.23 H new ATOM 0 HD1 PHE A 141 25.341 0.875 4.959 1.00 13.51 H new ATOM 0 HD2 PHE A 141 22.474 2.620 2.390 1.00 0.12 H new ATOM 0 HE1 PHE A 141 23.853 -1.109 5.271 1.00 15.24 H new ATOM 0 HE2 PHE A 141 20.986 0.637 2.704 1.00 71.05 H new ATOM 0 HZ PHE A 141 21.693 -1.204 4.139 1.00 31.24 H new ATOM 2352 N ASP A 142 25.263 6.186 3.810 1.00 42.12 N ATOM 2353 CA ASP A 142 25.971 7.399 3.437 1.00 11.33 C ATOM 2354 C ASP A 142 25.038 8.601 3.605 1.00 24.45 C ATOM 2355 O ASP A 142 23.971 8.653 2.996 1.00 22.41 O ATOM 2356 CB ASP A 142 26.418 7.349 1.975 1.00 2.11 C ATOM 2357 CG ASP A 142 27.659 8.183 1.649 1.00 22.35 C ATOM 2358 OD1 ASP A 142 28.268 8.031 0.580 1.00 52.02 O ATOM 2359 OD2 ASP A 142 28.002 9.029 2.561 1.00 53.24 O ATOM 0 H ASP A 142 24.264 6.195 3.605 1.00 42.12 H new ATOM 0 HA ASP A 142 26.847 7.489 4.079 1.00 11.33 H new ATOM 0 HB2 ASP A 142 26.615 6.311 1.706 1.00 2.11 H new ATOM 0 HB3 ASP A 142 25.595 7.690 1.347 1.00 2.11 H new ATOM 2365 N LEU A 143 25.475 9.537 4.435 1.00 22.42 N ATOM 2366 CA LEU A 143 24.693 10.734 4.691 1.00 32.02 C ATOM 2367 C LEU A 143 25.219 11.877 3.821 1.00 11.42 C ATOM 2368 O LEU A 143 24.739 13.006 3.917 1.00 62.04 O ATOM 2369 CB LEU A 143 24.679 11.055 6.187 1.00 2.40 C ATOM 2370 CG LEU A 143 23.455 10.571 6.966 1.00 13.01 C ATOM 2371 CD1 LEU A 143 23.782 10.401 8.451 1.00 73.11 C ATOM 2372 CD2 LEU A 143 22.261 11.502 6.745 1.00 32.11 C ATOM 0 H LEU A 143 26.361 9.490 4.939 1.00 22.42 H new ATOM 0 HA LEU A 143 23.651 10.575 4.413 1.00 32.02 H new ATOM 0 HB2 LEU A 143 25.569 10.619 6.640 1.00 2.40 H new ATOM 0 HB3 LEU A 143 24.757 12.136 6.307 1.00 2.40 H new ATOM 0 HG LEU A 143 23.173 9.590 6.584 1.00 13.01 H new ATOM 0 HD11 LEU A 143 22.895 10.056 8.982 1.00 73.11 H new ATOM 0 HD12 LEU A 143 24.581 9.669 8.566 1.00 73.11 H new ATOM 0 HD13 LEU A 143 24.104 11.357 8.865 1.00 73.11 H new ATOM 0 HD21 LEU A 143 21.404 11.135 7.310 1.00 32.11 H new ATOM 0 HD22 LEU A 143 22.515 12.507 7.083 1.00 32.11 H new ATOM 0 HD23 LEU A 143 22.012 11.529 5.684 1.00 32.11 H new ATOM 2384 N ASN A 144 26.198 11.546 2.993 1.00 60.44 N ATOM 2385 CA ASN A 144 26.794 12.531 2.106 1.00 24.44 C ATOM 2386 C ASN A 144 26.473 12.166 0.656 1.00 52.03 C ATOM 2387 O ASN A 144 26.684 12.969 -0.252 1.00 2.35 O ATOM 2388 CB ASN A 144 28.316 12.560 2.260 1.00 3.02 C ATOM 2389 CG ASN A 144 28.726 13.335 3.514 1.00 12.30 C ATOM 2390 OD1 ASN A 144 29.254 14.433 3.452 1.00 45.15 O ATOM 2391 ND2 ASN A 144 28.453 12.705 4.653 1.00 40.11 N ATOM 0 H ASN A 144 26.594 10.609 2.917 1.00 60.44 H new ATOM 0 HA ASN A 144 26.386 13.508 2.364 1.00 24.44 H new ATOM 0 HB2 ASN A 144 28.699 11.541 2.317 1.00 3.02 H new ATOM 0 HB3 ASN A 144 28.765 13.021 1.380 1.00 3.02 H new ATOM 0 HD21 ASN A 144 28.687 13.140 5.545 1.00 40.11 H new ATOM 0 HD22 ASN A 144 28.009 11.787 4.634 1.00 40.11 H new ATOM 2398 N PHE A 145 25.967 10.954 0.482 1.00 71.10 N ATOM 2399 CA PHE A 145 25.614 10.473 -0.843 1.00 40.10 C ATOM 2400 C PHE A 145 24.355 11.170 -1.362 1.00 51.41 C ATOM 2401 O PHE A 145 23.266 10.976 -0.823 1.00 64.12 O ATOM 2402 CB PHE A 145 25.337 8.974 -0.716 1.00 35.15 C ATOM 2403 CG PHE A 145 24.873 8.314 -2.016 1.00 14.12 C ATOM 2404 CD1 PHE A 145 25.600 8.470 -3.154 1.00 71.14 C ATOM 2405 CD2 PHE A 145 23.733 7.572 -2.033 1.00 1.11 C ATOM 2406 CE1 PHE A 145 25.169 7.858 -4.361 1.00 64.31 C ATOM 2407 CE2 PHE A 145 23.303 6.960 -3.240 1.00 35.14 C ATOM 2408 CZ PHE A 145 24.030 7.116 -4.378 1.00 72.43 C ATOM 0 H PHE A 145 25.793 10.290 1.237 1.00 71.10 H new ATOM 0 HA PHE A 145 26.425 10.679 -1.542 1.00 40.10 H new ATOM 0 HB2 PHE A 145 26.243 8.476 -0.371 1.00 35.15 H new ATOM 0 HB3 PHE A 145 24.577 8.819 0.049 1.00 35.15 H new ATOM 0 HD1 PHE A 145 26.505 9.059 -3.140 1.00 71.14 H new ATOM 0 HD2 PHE A 145 23.155 7.448 -1.129 1.00 1.11 H new ATOM 0 HE1 PHE A 145 25.746 7.982 -5.265 1.00 64.31 H new ATOM 0 HE2 PHE A 145 22.398 6.370 -3.254 1.00 35.14 H new ATOM 0 HZ PHE A 145 23.703 6.650 -5.296 1.00 72.43 H new ATOM 2418 N VAL A 146 24.545 11.968 -2.403 1.00 3.24 N ATOM 2419 CA VAL A 146 23.438 12.695 -3.000 1.00 45.54 C ATOM 2420 C VAL A 146 23.107 12.082 -4.362 1.00 72.41 C ATOM 2421 O VAL A 146 23.877 12.215 -5.311 1.00 43.05 O ATOM 2422 CB VAL A 146 23.775 14.186 -3.083 1.00 20.25 C ATOM 2423 CG1 VAL A 146 23.240 14.937 -1.862 1.00 30.34 C ATOM 2424 CG2 VAL A 146 25.282 14.400 -3.241 1.00 73.41 C ATOM 0 H VAL A 146 25.449 12.127 -2.848 1.00 3.24 H new ATOM 0 HA VAL A 146 22.546 12.610 -2.379 1.00 45.54 H new ATOM 0 HB VAL A 146 23.285 14.592 -3.968 1.00 20.25 H new ATOM 0 HG11 VAL A 146 23.493 15.994 -1.945 1.00 30.34 H new ATOM 0 HG12 VAL A 146 22.157 14.826 -1.812 1.00 30.34 H new ATOM 0 HG13 VAL A 146 23.689 14.527 -0.957 1.00 30.34 H new ATOM 0 HG21 VAL A 146 25.494 15.468 -3.298 1.00 73.41 H new ATOM 0 HG22 VAL A 146 25.802 13.972 -2.384 1.00 73.41 H new ATOM 0 HG23 VAL A 146 25.625 13.913 -4.154 1.00 73.41 H new ATOM 2434 N PRO A 147 21.929 11.405 -4.416 1.00 35.54 N ATOM 2435 CA PRO A 147 21.485 10.770 -5.645 1.00 63.31 C ATOM 2436 C PRO A 147 20.974 11.809 -6.645 1.00 74.41 C ATOM 2437 O PRO A 147 19.798 12.170 -6.623 1.00 2.32 O ATOM 2438 CB PRO A 147 20.414 9.782 -5.214 1.00 15.12 C ATOM 2439 CG PRO A 147 19.969 10.228 -3.830 1.00 72.52 C ATOM 2440 CD PRO A 147 20.990 11.226 -3.311 1.00 45.02 C ATOM 0 HA PRO A 147 22.292 10.257 -6.169 1.00 63.31 H new ATOM 0 HB2 PRO A 147 19.577 9.783 -5.913 1.00 15.12 H new ATOM 0 HB3 PRO A 147 20.807 8.766 -5.189 1.00 15.12 H new ATOM 0 HG2 PRO A 147 18.980 10.683 -3.875 1.00 72.52 H new ATOM 0 HG3 PRO A 147 19.896 9.373 -3.158 1.00 72.52 H new ATOM 0 HD2 PRO A 147 20.518 12.169 -3.036 1.00 45.02 H new ATOM 0 HD3 PRO A 147 21.494 10.850 -2.420 1.00 45.02 H new TER 2448 PRO A 147