USER MOD reduce.3.24.130724 H: found=0, std=0, add=1272, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1272 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 99 MET CE :methyl 152:sc= -4.35! (180deg=-6.5!) USER MOD Set 1.2: A 118 MET CE :methyl 155:sc= -8.69! (180deg=-7.92!) USER MOD Set 2.1: A 31 SER OG : rot 44:sc= 0.635 USER MOD Set 2.2: A 62 THR OG1 : rot 54:sc= 1.19 USER MOD Set 3.1: A 10 ASN : amide:sc= -9.71! C(o=-34!,f=-31!) USER MOD Set 3.2: A 48 GLN : amide:sc= -13! C(o=-34!,f=-31!) USER MOD Set 3.3: A 50 GLN : amide:sc= -10.9! C(o=-34!,f=-32!) USER MOD Set 4.1: A 37 SER OG : rot -170:sc= 1.21 USER MOD Set 4.2: A 40 TYR OH : rot 23:sc= 0.913 USER MOD Single : A 1 THR N :NH3+ 152:sc= 0.234 (180deg=0.069) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.0647 USER MOD Single : A 4 TYR OH : rot 180:sc= -3.14! USER MOD Single : A 9 SER OG : rot 177:sc= -0.568! USER MOD Single : A 13 SER OG : rot 150:sc= -0.274 USER MOD Single : A 17 GLN : amide:sc= -1.52 K(o=-1.5,f=-2.5!) USER MOD Single : A 19 ASN : amide:sc= -1.93! K(o=-1.9!,f=-0.27) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 HIS : no HD1:sc= 0 X(o=0,f=-0.00034) USER MOD Single : A 35 THR OG1 : rot 153:sc= 0.165 USER MOD Single : A 38 SER OG : rot 180:sc= 0.319 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -6.21! C(o=-6.2!,f=-3!) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -1.67! K(o=-1.7!,f=-0.37) USER MOD Single : A 72 HIS : no HE2:sc= -4.97! C(o=-5!,f=-6!) USER MOD Single : A 73 THR OG1 : rot 117:sc= 0.683 USER MOD Single : A 74 GLN : amide:sc= -0.544 X(o=-0.54,f=-1) USER MOD Single : A 79 GLN : amide:sc= -4.61! C(o=-4.6!,f=-11!) USER MOD Single : A 80 GLN : amide:sc= -6.53! C(o=-6.5!,f=-7.8!) USER MOD Single : A 85 LYS NZ :NH3+ -149:sc= -0.0555 (180deg=-0.31) USER MOD Single : A 93 THR OG1 : rot -130:sc= -3.63! USER MOD Single : A 103 ASN : amide:sc= -0.349 X(o=-0.35,f=-0.018) USER MOD Single : A 107 ASN : amide:sc= -3.49! K(o=-3.5!,f=-0.11) USER MOD Single : A 108 THR OG1 : rot 178:sc= -3.09! USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.0607 USER MOD Single : A 115 HIS : no HD1:sc= -0.259 K(o=-0.26,f=-1.3) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ -179:sc= -3.76! (180deg=-3.96!) USER MOD Single : A 120 ASN : amide:sc= -0.22 X(o=-0.22,f=0) USER MOD Single : A 124 MET CE :methyl 175:sc= -0.0107 (180deg=-0.0496) USER MOD Single : A 142 MET CE :methyl 139:sc= -0.819 (180deg=-1.33) USER MOD Single : A 145 GLN : amide:sc= -11.2! C(o=-11!,f=-4.9!) USER MOD Single : A 148 HIS : no HE2:sc= -1.29 K(o=-1.3,f=-3.4!) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 150:sc= 0 (180deg=-0.844) USER MOD Single : A 156 ASN : amide:sc= -2.15 K(o=-2.2,f=-0.15) USER MOD Single : A 157 LYS NZ :NH3+ -162:sc= -0.0809 (180deg=-0.44) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 1.917 -13.599 -9.644 1.00 0.73 N ATOM 2 CA THR A 1 0.727 -13.121 -8.895 1.00 0.53 C ATOM 3 C THR A 1 0.744 -11.600 -8.756 1.00 0.47 C ATOM 4 O THR A 1 1.743 -10.953 -9.070 1.00 0.70 O ATOM 5 CB THR A 1 0.726 -13.788 -7.517 1.00 0.54 C ATOM 6 OG1 THR A 1 0.853 -15.191 -7.644 1.00 0.58 O ATOM 7 CG2 THR A 1 -0.531 -13.516 -6.718 1.00 0.81 C ATOM 0 H1 THR A 1 2.152 -14.566 -9.341 1.00 0.73 H new ATOM 0 H2 THR A 1 1.710 -13.596 -10.663 1.00 0.73 H new ATOM 0 H3 THR A 1 2.723 -12.970 -9.453 1.00 0.73 H new ATOM 0 HA THR A 1 -0.180 -13.387 -9.439 1.00 0.53 H new ATOM 0 HB THR A 1 1.575 -13.356 -6.987 1.00 0.54 H new ATOM 0 HG1 THR A 1 0.852 -15.601 -6.754 1.00 0.58 H new ATOM 0 HG21 THR A 1 -0.465 -14.018 -5.753 1.00 0.81 H new ATOM 0 HG22 THR A 1 -0.638 -12.443 -6.562 1.00 0.81 H new ATOM 0 HG23 THR A 1 -1.397 -13.891 -7.263 1.00 0.81 H new ATOM 17 N VAL A 2 -0.365 -11.034 -8.291 1.00 0.44 N ATOM 18 CA VAL A 2 -0.475 -9.590 -8.120 1.00 0.42 C ATOM 19 C VAL A 2 -0.040 -9.147 -6.728 1.00 0.38 C ATOM 20 O VAL A 2 -0.293 -9.831 -5.737 1.00 0.43 O ATOM 21 CB VAL A 2 -1.918 -9.104 -8.359 1.00 0.51 C ATOM 22 CG1 VAL A 2 -2.051 -7.631 -8.015 1.00 1.29 C ATOM 23 CG2 VAL A 2 -2.336 -9.348 -9.796 1.00 0.85 C ATOM 0 H VAL A 2 -1.201 -11.554 -8.026 1.00 0.44 H new ATOM 0 HA VAL A 2 0.190 -9.146 -8.861 1.00 0.42 H new ATOM 0 HB VAL A 2 -2.579 -9.674 -7.706 1.00 0.51 H new ATOM 0 HG11 VAL A 2 -3.077 -7.308 -8.191 1.00 1.29 H new ATOM 0 HG12 VAL A 2 -1.797 -7.478 -6.966 1.00 1.29 H new ATOM 0 HG13 VAL A 2 -1.375 -7.049 -8.641 1.00 1.29 H new ATOM 0 HG21 VAL A 2 -3.358 -8.997 -9.942 1.00 0.85 H new ATOM 0 HG22 VAL A 2 -1.667 -8.808 -10.466 1.00 0.85 H new ATOM 0 HG23 VAL A 2 -2.284 -10.415 -10.014 1.00 0.85 H new ATOM 33 N ALA A 3 0.595 -7.980 -6.665 1.00 0.38 N ATOM 34 CA ALA A 3 1.048 -7.416 -5.400 1.00 0.40 C ATOM 35 C ALA A 3 0.242 -6.165 -5.061 1.00 0.40 C ATOM 36 O ALA A 3 0.507 -5.081 -5.581 1.00 0.65 O ATOM 37 CB ALA A 3 2.533 -7.099 -5.458 1.00 0.43 C ATOM 0 H ALA A 3 0.808 -7.405 -7.480 1.00 0.38 H new ATOM 0 HA ALA A 3 0.889 -8.153 -4.613 1.00 0.40 H new ATOM 0 HB1 ALA A 3 2.853 -6.679 -4.504 1.00 0.43 H new ATOM 0 HB2 ALA A 3 3.093 -8.013 -5.658 1.00 0.43 H new ATOM 0 HB3 ALA A 3 2.720 -6.378 -6.253 1.00 0.43 H new ATOM 43 N TYR A 4 -0.743 -6.332 -4.189 1.00 0.25 N ATOM 44 CA TYR A 4 -1.607 -5.236 -3.767 1.00 0.24 C ATOM 45 C TYR A 4 -0.940 -4.459 -2.633 1.00 0.27 C ATOM 46 O TYR A 4 -1.064 -4.824 -1.464 1.00 0.35 O ATOM 47 CB TYR A 4 -2.946 -5.807 -3.317 1.00 0.25 C ATOM 48 CG TYR A 4 -3.549 -6.774 -4.315 1.00 0.27 C ATOM 49 CD1 TYR A 4 -3.085 -8.075 -4.415 1.00 0.55 C ATOM 50 CD2 TYR A 4 -4.586 -6.387 -5.158 1.00 0.62 C ATOM 51 CE1 TYR A 4 -3.636 -8.959 -5.321 1.00 0.61 C ATOM 52 CE2 TYR A 4 -5.138 -7.265 -6.066 1.00 0.66 C ATOM 53 CZ TYR A 4 -4.650 -8.549 -6.151 1.00 0.45 C ATOM 54 OH TYR A 4 -5.210 -9.437 -7.040 1.00 0.55 O ATOM 0 H TYR A 4 -0.966 -7.228 -3.755 1.00 0.25 H new ATOM 0 HA TYR A 4 -1.774 -4.550 -4.597 1.00 0.24 H new ATOM 0 HB2 TYR A 4 -2.814 -6.316 -2.362 1.00 0.25 H new ATOM 0 HB3 TYR A 4 -3.644 -4.988 -3.148 1.00 0.25 H new ATOM 0 HD1 TYR A 4 -2.280 -8.403 -3.774 1.00 0.55 H new ATOM 0 HD2 TYR A 4 -4.966 -5.378 -5.100 1.00 0.62 H new ATOM 0 HE1 TYR A 4 -3.269 -9.973 -5.377 1.00 0.61 H new ATOM 0 HE2 TYR A 4 -5.948 -6.948 -6.706 1.00 0.66 H new ATOM 0 HH TYR A 4 -5.915 -8.987 -7.551 1.00 0.55 H new ATOM 64 N ILE A 5 -0.201 -3.408 -2.986 1.00 0.28 N ATOM 65 CA ILE A 5 0.521 -2.612 -1.999 1.00 0.34 C ATOM 66 C ILE A 5 -0.152 -1.264 -1.731 1.00 0.34 C ATOM 67 O ILE A 5 -0.957 -0.789 -2.531 1.00 0.39 O ATOM 68 CB ILE A 5 1.966 -2.353 -2.473 1.00 0.41 C ATOM 69 CG1 ILE A 5 2.586 -3.645 -3.004 1.00 0.44 C ATOM 70 CG2 ILE A 5 2.809 -1.786 -1.338 1.00 0.53 C ATOM 71 CD1 ILE A 5 3.928 -3.440 -3.675 1.00 0.95 C ATOM 0 H ILE A 5 -0.088 -3.089 -3.948 1.00 0.28 H new ATOM 0 HA ILE A 5 0.519 -3.188 -1.074 1.00 0.34 H new ATOM 0 HB ILE A 5 1.940 -1.620 -3.279 1.00 0.41 H new ATOM 0 HG12 ILE A 5 2.705 -4.347 -2.179 1.00 0.44 H new ATOM 0 HG13 ILE A 5 1.899 -4.103 -3.716 1.00 0.44 H new ATOM 0 HG21 ILE A 5 3.825 -1.610 -1.692 1.00 0.53 H new ATOM 0 HG22 ILE A 5 2.375 -0.846 -0.997 1.00 0.53 H new ATOM 0 HG23 ILE A 5 2.831 -2.496 -0.511 1.00 0.53 H new ATOM 0 HD11 ILE A 5 4.309 -4.399 -4.027 1.00 0.95 H new ATOM 0 HD12 ILE A 5 3.812 -2.762 -4.521 1.00 0.95 H new ATOM 0 HD13 ILE A 5 4.630 -3.011 -2.960 1.00 0.95 H new ATOM 83 N ALA A 6 0.203 -0.651 -0.602 1.00 0.40 N ATOM 84 CA ALA A 6 -0.336 0.650 -0.218 1.00 0.44 C ATOM 85 C ALA A 6 0.804 1.621 0.083 1.00 0.42 C ATOM 86 O ALA A 6 1.505 1.470 1.080 1.00 0.58 O ATOM 87 CB ALA A 6 -1.248 0.510 0.993 1.00 0.53 C ATOM 0 H ALA A 6 0.868 -1.040 0.067 1.00 0.40 H new ATOM 0 HA ALA A 6 -0.923 1.045 -1.047 1.00 0.44 H new ATOM 0 HB1 ALA A 6 -1.642 1.489 1.267 1.00 0.53 H new ATOM 0 HB2 ALA A 6 -2.074 -0.159 0.751 1.00 0.53 H new ATOM 0 HB3 ALA A 6 -0.682 0.100 1.829 1.00 0.53 H new ATOM 93 N ILE A 7 0.996 2.603 -0.795 1.00 0.41 N ATOM 94 CA ILE A 7 2.074 3.579 -0.632 1.00 0.40 C ATOM 95 C ILE A 7 1.631 4.787 0.186 1.00 0.44 C ATOM 96 O ILE A 7 0.455 5.144 0.190 1.00 0.52 O ATOM 97 CB ILE A 7 2.582 4.070 -2.002 1.00 0.50 C ATOM 98 CG1 ILE A 7 2.871 2.872 -2.910 1.00 0.65 C ATOM 99 CG2 ILE A 7 3.830 4.924 -1.823 1.00 0.53 C ATOM 100 CD1 ILE A 7 3.183 3.249 -4.341 1.00 0.99 C ATOM 0 H ILE A 7 0.421 2.745 -1.625 1.00 0.41 H new ATOM 0 HA ILE A 7 2.876 3.069 -0.099 1.00 0.40 H new ATOM 0 HB ILE A 7 1.812 4.683 -2.471 1.00 0.50 H new ATOM 0 HG12 ILE A 7 3.712 2.313 -2.500 1.00 0.65 H new ATOM 0 HG13 ILE A 7 2.009 2.205 -2.900 1.00 0.65 H new ATOM 0 HG21 ILE A 7 4.180 5.265 -2.797 1.00 0.53 H new ATOM 0 HG22 ILE A 7 3.594 5.786 -1.199 1.00 0.53 H new ATOM 0 HG23 ILE A 7 4.610 4.332 -1.344 1.00 0.53 H new ATOM 0 HD11 ILE A 7 3.376 2.347 -4.921 1.00 0.99 H new ATOM 0 HD12 ILE A 7 2.334 3.781 -4.770 1.00 0.99 H new ATOM 0 HD13 ILE A 7 4.064 3.891 -4.364 1.00 0.99 H new ATOM 112 N GLY A 8 2.585 5.428 0.863 1.00 0.50 N ATOM 113 CA GLY A 8 2.267 6.598 1.652 1.00 0.61 C ATOM 114 C GLY A 8 3.211 7.741 1.354 1.00 0.62 C ATOM 115 O GLY A 8 4.368 7.520 0.993 1.00 0.90 O ATOM 0 H GLY A 8 3.568 5.155 0.876 1.00 0.50 H new ATOM 0 HA2 GLY A 8 1.242 6.908 1.448 1.00 0.61 H new ATOM 0 HA3 GLY A 8 2.319 6.349 2.712 1.00 0.61 H new ATOM 119 N SER A 9 2.721 8.964 1.485 1.00 0.56 N ATOM 120 CA SER A 9 3.532 10.143 1.208 1.00 0.63 C ATOM 121 C SER A 9 3.047 11.335 2.023 1.00 0.66 C ATOM 122 O SER A 9 1.858 11.653 2.023 1.00 0.77 O ATOM 123 CB SER A 9 3.480 10.458 -0.281 1.00 0.77 C ATOM 124 OG SER A 9 2.148 10.656 -0.714 1.00 1.58 O ATOM 0 H SER A 9 1.766 9.168 1.781 1.00 0.56 H new ATOM 0 HA SER A 9 4.563 9.938 1.495 1.00 0.63 H new ATOM 0 HB2 SER A 9 4.069 11.351 -0.488 1.00 0.77 H new ATOM 0 HB3 SER A 9 3.931 9.641 -0.845 1.00 0.77 H new ATOM 0 HG SER A 9 2.146 10.911 -1.660 1.00 1.58 H new ATOM 130 N ASN A 10 3.972 11.982 2.733 1.00 0.69 N ATOM 131 CA ASN A 10 3.614 13.122 3.568 1.00 0.79 C ATOM 132 C ASN A 10 4.779 14.090 3.780 1.00 0.83 C ATOM 133 O ASN A 10 4.796 15.184 3.215 1.00 0.98 O ATOM 134 CB ASN A 10 3.112 12.621 4.920 1.00 0.99 C ATOM 135 CG ASN A 10 1.763 11.938 4.812 1.00 1.05 C ATOM 136 OD1 ASN A 10 0.781 12.545 4.390 1.00 2.01 O ATOM 137 ND2 ASN A 10 1.710 10.668 5.196 1.00 1.01 N ATOM 0 H ASN A 10 4.962 11.738 2.745 1.00 0.69 H new ATOM 0 HA ASN A 10 2.831 13.673 3.047 1.00 0.79 H new ATOM 0 HB2 ASN A 10 3.838 11.924 5.340 1.00 0.99 H new ATOM 0 HB3 ASN A 10 3.038 13.460 5.612 1.00 0.99 H new ATOM 0 HD21 ASN A 10 0.829 10.157 5.147 1.00 1.01 H new ATOM 0 HD22 ASN A 10 2.551 10.204 5.540 1.00 1.01 H new ATOM 144 N LEU A 11 5.732 13.695 4.622 1.00 0.83 N ATOM 145 CA LEU A 11 6.882 14.542 4.939 1.00 0.95 C ATOM 146 C LEU A 11 7.934 14.515 3.834 1.00 0.93 C ATOM 147 O LEU A 11 9.120 14.312 4.098 1.00 1.38 O ATOM 148 CB LEU A 11 7.512 14.108 6.266 1.00 1.12 C ATOM 149 CG LEU A 11 6.578 14.165 7.477 1.00 0.90 C ATOM 150 CD1 LEU A 11 7.302 13.685 8.725 1.00 1.77 C ATOM 151 CD2 LEU A 11 6.045 15.576 7.679 1.00 1.54 C ATOM 0 H LEU A 11 5.731 12.793 5.098 1.00 0.83 H new ATOM 0 HA LEU A 11 6.516 15.565 5.026 1.00 0.95 H new ATOM 0 HB2 LEU A 11 7.881 13.088 6.159 1.00 1.12 H new ATOM 0 HB3 LEU A 11 8.377 14.741 6.464 1.00 1.12 H new ATOM 0 HG LEU A 11 5.731 13.504 7.290 1.00 0.90 H new ATOM 0 HD11 LEU A 11 6.626 13.731 9.578 1.00 1.77 H new ATOM 0 HD12 LEU A 11 7.634 12.657 8.580 1.00 1.77 H new ATOM 0 HD13 LEU A 11 8.166 14.322 8.912 1.00 1.77 H new ATOM 0 HD21 LEU A 11 5.383 15.594 8.545 1.00 1.54 H new ATOM 0 HD22 LEU A 11 6.878 16.259 7.844 1.00 1.54 H new ATOM 0 HD23 LEU A 11 5.492 15.886 6.793 1.00 1.54 H new ATOM 163 N ALA A 12 7.492 14.737 2.602 1.00 0.84 N ATOM 164 CA ALA A 12 8.382 14.753 1.446 1.00 0.91 C ATOM 165 C ALA A 12 7.579 14.969 0.173 1.00 0.95 C ATOM 166 O ALA A 12 7.806 14.303 -0.838 1.00 1.72 O ATOM 167 CB ALA A 12 9.174 13.457 1.358 1.00 0.97 C ATOM 0 H ALA A 12 6.513 14.910 2.376 1.00 0.84 H new ATOM 0 HA ALA A 12 9.087 15.576 1.563 1.00 0.91 H new ATOM 0 HB1 ALA A 12 9.831 13.490 0.489 1.00 0.97 H new ATOM 0 HB2 ALA A 12 9.772 13.334 2.261 1.00 0.97 H new ATOM 0 HB3 ALA A 12 8.487 12.616 1.261 1.00 0.97 H new ATOM 173 N SER A 13 6.626 15.894 0.239 1.00 0.81 N ATOM 174 CA SER A 13 5.766 16.191 -0.899 1.00 0.79 C ATOM 175 C SER A 13 5.009 14.935 -1.318 1.00 0.71 C ATOM 176 O SER A 13 5.516 14.135 -2.105 1.00 0.71 O ATOM 177 CB SER A 13 6.588 16.728 -2.073 1.00 0.89 C ATOM 178 OG SER A 13 5.752 17.085 -3.159 1.00 1.47 O ATOM 0 H SER A 13 6.431 16.451 1.071 1.00 0.81 H new ATOM 0 HA SER A 13 5.050 16.958 -0.603 1.00 0.79 H new ATOM 0 HB2 SER A 13 7.163 17.597 -1.752 1.00 0.89 H new ATOM 0 HB3 SER A 13 7.305 15.973 -2.395 1.00 0.89 H new ATOM 0 HG SER A 13 6.163 17.820 -3.661 1.00 1.47 H new ATOM 184 N PRO A 14 3.793 14.736 -0.779 1.00 0.69 N ATOM 185 CA PRO A 14 2.970 13.564 -1.083 1.00 0.66 C ATOM 186 C PRO A 14 2.999 13.160 -2.560 1.00 0.67 C ATOM 187 O PRO A 14 2.777 11.995 -2.892 1.00 0.66 O ATOM 188 CB PRO A 14 1.574 14.024 -0.686 1.00 0.68 C ATOM 189 CG PRO A 14 1.801 14.952 0.457 1.00 0.80 C ATOM 190 CD PRO A 14 3.125 15.629 0.194 1.00 0.78 C ATOM 0 HA PRO A 14 3.325 12.677 -0.559 1.00 0.66 H new ATOM 0 HB2 PRO A 14 1.071 14.527 -1.512 1.00 0.68 H new ATOM 0 HB3 PRO A 14 0.946 13.182 -0.396 1.00 0.68 H new ATOM 0 HG2 PRO A 14 0.997 15.684 0.529 1.00 0.80 H new ATOM 0 HG3 PRO A 14 1.823 14.408 1.401 1.00 0.80 H new ATOM 0 HD2 PRO A 14 2.988 16.631 -0.212 1.00 0.78 H new ATOM 0 HD3 PRO A 14 3.710 15.733 1.108 1.00 0.78 H new ATOM 198 N LEU A 15 3.260 14.120 -3.440 1.00 0.73 N ATOM 199 CA LEU A 15 3.297 13.852 -4.878 1.00 0.78 C ATOM 200 C LEU A 15 4.642 13.275 -5.322 1.00 0.73 C ATOM 201 O LEU A 15 4.693 12.416 -6.203 1.00 0.79 O ATOM 202 CB LEU A 15 3.007 15.138 -5.658 1.00 0.92 C ATOM 203 CG LEU A 15 2.963 14.980 -7.181 1.00 0.98 C ATOM 204 CD1 LEU A 15 1.852 14.026 -7.590 1.00 1.00 C ATOM 205 CD2 LEU A 15 2.777 16.334 -7.849 1.00 1.15 C ATOM 0 H LEU A 15 3.449 15.090 -3.186 1.00 0.73 H new ATOM 0 HA LEU A 15 2.530 13.107 -5.089 1.00 0.78 H new ATOM 0 HB2 LEU A 15 2.051 15.540 -5.322 1.00 0.92 H new ATOM 0 HB3 LEU A 15 3.769 15.876 -5.407 1.00 0.92 H new ATOM 0 HG LEU A 15 3.913 14.559 -7.511 1.00 0.98 H new ATOM 0 HD11 LEU A 15 1.838 13.928 -8.675 1.00 1.00 H new ATOM 0 HD12 LEU A 15 2.027 13.049 -7.139 1.00 1.00 H new ATOM 0 HD13 LEU A 15 0.893 14.416 -7.249 1.00 1.00 H new ATOM 0 HD21 LEU A 15 2.748 16.205 -8.931 1.00 1.15 H new ATOM 0 HD22 LEU A 15 1.842 16.781 -7.511 1.00 1.15 H new ATOM 0 HD23 LEU A 15 3.608 16.988 -7.584 1.00 1.15 H new ATOM 217 N GLU A 16 5.726 13.761 -4.726 1.00 0.71 N ATOM 218 CA GLU A 16 7.067 13.308 -5.076 1.00 0.71 C ATOM 219 C GLU A 16 7.312 11.851 -4.705 1.00 0.63 C ATOM 220 O GLU A 16 7.944 11.110 -5.459 1.00 0.65 O ATOM 221 CB GLU A 16 8.099 14.186 -4.378 1.00 0.81 C ATOM 222 CG GLU A 16 8.191 15.584 -4.954 1.00 0.95 C ATOM 223 CD GLU A 16 9.357 16.374 -4.389 1.00 1.57 C ATOM 224 OE1 GLU A 16 9.399 16.568 -3.156 1.00 2.35 O ATOM 225 OE2 GLU A 16 10.225 16.801 -5.177 1.00 2.01 O ATOM 0 H GLU A 16 5.701 14.472 -3.995 1.00 0.71 H new ATOM 0 HA GLU A 16 7.161 13.388 -6.159 1.00 0.71 H new ATOM 0 HB2 GLU A 16 7.850 14.254 -3.319 1.00 0.81 H new ATOM 0 HB3 GLU A 16 9.076 13.708 -4.446 1.00 0.81 H new ATOM 0 HG2 GLU A 16 8.291 15.520 -6.037 1.00 0.95 H new ATOM 0 HG3 GLU A 16 7.263 16.118 -4.751 1.00 0.95 H new ATOM 232 N GLN A 17 6.834 11.450 -3.536 1.00 0.59 N ATOM 233 CA GLN A 17 7.030 10.085 -3.061 1.00 0.56 C ATOM 234 C GLN A 17 6.363 9.058 -3.972 1.00 0.55 C ATOM 235 O GLN A 17 6.917 7.988 -4.217 1.00 0.61 O ATOM 236 CB GLN A 17 6.494 9.950 -1.640 1.00 0.62 C ATOM 237 CG GLN A 17 7.238 10.815 -0.635 1.00 0.71 C ATOM 238 CD GLN A 17 8.653 10.330 -0.390 1.00 1.20 C ATOM 239 OE1 GLN A 17 8.869 9.183 0.001 1.00 1.99 O ATOM 240 NE2 GLN A 17 9.625 11.206 -0.611 1.00 1.63 N ATOM 0 H GLN A 17 6.308 12.048 -2.899 1.00 0.59 H new ATOM 0 HA GLN A 17 8.101 9.883 -3.072 1.00 0.56 H new ATOM 0 HB2 GLN A 17 5.438 10.219 -1.630 1.00 0.62 H new ATOM 0 HB3 GLN A 17 6.560 8.907 -1.331 1.00 0.62 H new ATOM 0 HG2 GLN A 17 7.267 11.843 -0.996 1.00 0.71 H new ATOM 0 HG3 GLN A 17 6.691 10.823 0.308 1.00 0.71 H new ATOM 0 HE21 GLN A 17 9.400 12.147 -0.935 1.00 1.63 H new ATOM 0 HE22 GLN A 17 10.597 10.939 -0.457 1.00 1.63 H new ATOM 249 N VAL A 18 5.169 9.379 -4.457 1.00 0.56 N ATOM 250 CA VAL A 18 4.425 8.471 -5.326 1.00 0.62 C ATOM 251 C VAL A 18 5.175 8.169 -6.622 1.00 0.60 C ATOM 252 O VAL A 18 5.104 7.053 -7.137 1.00 0.64 O ATOM 253 CB VAL A 18 3.034 9.037 -5.669 1.00 0.76 C ATOM 254 CG1 VAL A 18 2.268 8.079 -6.570 1.00 0.82 C ATOM 255 CG2 VAL A 18 2.249 9.321 -4.398 1.00 0.83 C ATOM 0 H VAL A 18 4.694 10.261 -4.264 1.00 0.56 H new ATOM 0 HA VAL A 18 4.311 7.542 -4.767 1.00 0.62 H new ATOM 0 HB VAL A 18 3.169 9.974 -6.209 1.00 0.76 H new ATOM 0 HG11 VAL A 18 1.289 8.499 -6.799 1.00 0.82 H new ATOM 0 HG12 VAL A 18 2.823 7.927 -7.496 1.00 0.82 H new ATOM 0 HG13 VAL A 18 2.142 7.123 -6.061 1.00 0.82 H new ATOM 0 HG21 VAL A 18 1.269 9.720 -4.657 1.00 0.83 H new ATOM 0 HG22 VAL A 18 2.126 8.398 -3.832 1.00 0.83 H new ATOM 0 HG23 VAL A 18 2.789 10.049 -3.792 1.00 0.83 H new ATOM 265 N ASN A 19 5.881 9.162 -7.156 1.00 0.60 N ATOM 266 CA ASN A 19 6.622 8.982 -8.403 1.00 0.64 C ATOM 267 C ASN A 19 7.639 7.849 -8.299 1.00 0.56 C ATOM 268 O ASN A 19 7.610 6.906 -9.089 1.00 0.63 O ATOM 269 CB ASN A 19 7.332 10.277 -8.798 1.00 0.72 C ATOM 270 CG ASN A 19 6.365 11.421 -9.029 1.00 0.82 C ATOM 271 OD1 ASN A 19 5.452 11.322 -9.849 1.00 0.92 O ATOM 272 ND2 ASN A 19 6.571 12.520 -8.315 1.00 0.84 N ATOM 0 H ASN A 19 5.956 10.094 -6.749 1.00 0.60 H new ATOM 0 HA ASN A 19 5.897 8.717 -9.173 1.00 0.64 H new ATOM 0 HB2 ASN A 19 8.038 10.554 -8.015 1.00 0.72 H new ATOM 0 HB3 ASN A 19 7.913 10.107 -9.705 1.00 0.72 H new ATOM 0 HD21 ASN A 19 5.960 13.328 -8.434 1.00 0.84 H new ATOM 0 HD22 ASN A 19 7.341 12.557 -7.647 1.00 0.84 H new ATOM 279 N ALA A 20 8.545 7.951 -7.333 1.00 0.47 N ATOM 280 CA ALA A 20 9.577 6.937 -7.143 1.00 0.42 C ATOM 281 C ALA A 20 9.024 5.688 -6.467 1.00 0.35 C ATOM 282 O ALA A 20 9.621 4.617 -6.543 1.00 0.36 O ATOM 283 CB ALA A 20 10.734 7.504 -6.336 1.00 0.43 C ATOM 0 H ALA A 20 8.586 8.725 -6.670 1.00 0.47 H new ATOM 0 HA ALA A 20 9.938 6.647 -8.130 1.00 0.42 H new ATOM 0 HB1 ALA A 20 11.496 6.736 -6.203 1.00 0.43 H new ATOM 0 HB2 ALA A 20 11.165 8.354 -6.865 1.00 0.43 H new ATOM 0 HB3 ALA A 20 10.372 7.829 -5.361 1.00 0.43 H new ATOM 289 N ALA A 21 7.883 5.828 -5.804 1.00 0.36 N ATOM 290 CA ALA A 21 7.261 4.702 -5.117 1.00 0.39 C ATOM 291 C ALA A 21 6.787 3.640 -6.103 1.00 0.41 C ATOM 292 O ALA A 21 7.062 2.452 -5.929 1.00 0.44 O ATOM 293 CB ALA A 21 6.097 5.180 -4.265 1.00 0.46 C ATOM 0 H ALA A 21 7.371 6.707 -5.727 1.00 0.36 H new ATOM 0 HA ALA A 21 8.014 4.250 -4.472 1.00 0.39 H new ATOM 0 HB1 ALA A 21 5.643 4.328 -3.759 1.00 0.46 H new ATOM 0 HB2 ALA A 21 6.457 5.893 -3.524 1.00 0.46 H new ATOM 0 HB3 ALA A 21 5.354 5.662 -4.901 1.00 0.46 H new ATOM 299 N LEU A 22 6.070 4.072 -7.137 1.00 0.47 N ATOM 300 CA LEU A 22 5.554 3.152 -8.148 1.00 0.53 C ATOM 301 C LEU A 22 6.606 2.847 -9.209 1.00 0.50 C ATOM 302 O LEU A 22 6.483 1.876 -9.957 1.00 0.64 O ATOM 303 CB LEU A 22 4.286 3.729 -8.793 1.00 0.70 C ATOM 304 CG LEU A 22 4.420 5.137 -9.390 1.00 0.81 C ATOM 305 CD1 LEU A 22 5.212 5.112 -10.687 1.00 1.28 C ATOM 306 CD2 LEU A 22 3.044 5.745 -9.618 1.00 1.35 C ATOM 0 H LEU A 22 5.833 5.051 -7.297 1.00 0.47 H new ATOM 0 HA LEU A 22 5.301 2.214 -7.654 1.00 0.53 H new ATOM 0 HB2 LEU A 22 3.961 3.050 -9.582 1.00 0.70 H new ATOM 0 HB3 LEU A 22 3.496 3.747 -8.043 1.00 0.70 H new ATOM 0 HG LEU A 22 4.966 5.756 -8.678 1.00 0.81 H new ATOM 0 HD11 LEU A 22 5.290 6.124 -11.085 1.00 1.28 H new ATOM 0 HD12 LEU A 22 6.211 4.720 -10.496 1.00 1.28 H new ATOM 0 HD13 LEU A 22 4.704 4.475 -11.411 1.00 1.28 H new ATOM 0 HD21 LEU A 22 3.153 6.743 -10.042 1.00 1.35 H new ATOM 0 HD22 LEU A 22 2.479 5.118 -10.308 1.00 1.35 H new ATOM 0 HD23 LEU A 22 2.513 5.810 -8.668 1.00 1.35 H new ATOM 318 N LYS A 23 7.638 3.682 -9.272 1.00 0.45 N ATOM 319 CA LYS A 23 8.710 3.505 -10.245 1.00 0.49 C ATOM 320 C LYS A 23 9.733 2.486 -9.744 1.00 0.43 C ATOM 321 O LYS A 23 10.170 1.613 -10.493 1.00 0.51 O ATOM 322 CB LYS A 23 9.388 4.856 -10.523 1.00 0.56 C ATOM 323 CG LYS A 23 10.405 4.839 -11.661 1.00 0.93 C ATOM 324 CD LYS A 23 11.717 4.176 -11.258 1.00 1.62 C ATOM 325 CE LYS A 23 12.382 4.906 -10.099 1.00 2.52 C ATOM 326 NZ LYS A 23 13.648 4.243 -9.677 1.00 3.23 N ATOM 0 H LYS A 23 7.755 4.489 -8.660 1.00 0.45 H new ATOM 0 HA LYS A 23 8.282 3.125 -11.173 1.00 0.49 H new ATOM 0 HB2 LYS A 23 8.618 5.592 -10.753 1.00 0.56 H new ATOM 0 HB3 LYS A 23 9.887 5.190 -9.613 1.00 0.56 H new ATOM 0 HG2 LYS A 23 9.982 4.311 -12.515 1.00 0.93 H new ATOM 0 HG3 LYS A 23 10.602 5.861 -11.984 1.00 0.93 H new ATOM 0 HD2 LYS A 23 11.530 3.140 -10.977 1.00 1.62 H new ATOM 0 HD3 LYS A 23 12.393 4.157 -12.113 1.00 1.62 H new ATOM 0 HE2 LYS A 23 12.591 5.935 -10.390 1.00 2.52 H new ATOM 0 HE3 LYS A 23 11.695 4.947 -9.254 1.00 2.52 H new ATOM 0 HZ1 LYS A 23 14.069 4.771 -8.886 1.00 3.23 H new ATOM 0 HZ2 LYS A 23 13.446 3.269 -9.374 1.00 3.23 H new ATOM 0 HZ3 LYS A 23 14.314 4.226 -10.476 1.00 3.23 H new ATOM 340 N ALA A 24 10.110 2.610 -8.476 1.00 0.37 N ATOM 341 CA ALA A 24 11.085 1.708 -7.871 1.00 0.41 C ATOM 342 C ALA A 24 10.648 0.252 -7.991 1.00 0.41 C ATOM 343 O ALA A 24 11.485 -0.650 -8.057 1.00 0.43 O ATOM 344 CB ALA A 24 11.307 2.074 -6.411 1.00 0.46 C ATOM 0 H ALA A 24 9.754 3.328 -7.845 1.00 0.37 H new ATOM 0 HA ALA A 24 12.024 1.820 -8.413 1.00 0.41 H new ATOM 0 HB1 ALA A 24 12.036 1.393 -5.972 1.00 0.46 H new ATOM 0 HB2 ALA A 24 11.679 3.096 -6.345 1.00 0.46 H new ATOM 0 HB3 ALA A 24 10.365 1.995 -5.869 1.00 0.46 H new ATOM 350 N LEU A 25 9.339 0.026 -8.023 1.00 0.43 N ATOM 351 CA LEU A 25 8.802 -1.325 -8.144 1.00 0.48 C ATOM 352 C LEU A 25 9.294 -1.971 -9.432 1.00 0.49 C ATOM 353 O LEU A 25 9.632 -3.154 -9.456 1.00 0.57 O ATOM 354 CB LEU A 25 7.269 -1.295 -8.125 1.00 0.53 C ATOM 355 CG LEU A 25 6.642 -0.599 -6.915 1.00 0.70 C ATOM 356 CD1 LEU A 25 5.128 -0.566 -7.047 1.00 0.95 C ATOM 357 CD2 LEU A 25 7.046 -1.295 -5.624 1.00 1.00 C ATOM 0 H LEU A 25 8.632 0.759 -7.967 1.00 0.43 H new ATOM 0 HA LEU A 25 9.151 -1.914 -7.296 1.00 0.48 H new ATOM 0 HB2 LEU A 25 6.921 -0.797 -9.030 1.00 0.53 H new ATOM 0 HB3 LEU A 25 6.902 -2.321 -8.164 1.00 0.53 H new ATOM 0 HG LEU A 25 7.011 0.426 -6.882 1.00 0.70 H new ATOM 0 HD11 LEU A 25 4.698 -0.068 -6.178 1.00 0.95 H new ATOM 0 HD12 LEU A 25 4.853 -0.022 -7.951 1.00 0.95 H new ATOM 0 HD13 LEU A 25 4.746 -1.585 -7.107 1.00 0.95 H new ATOM 0 HD21 LEU A 25 6.589 -0.784 -4.777 1.00 1.00 H new ATOM 0 HD22 LEU A 25 6.708 -2.331 -5.648 1.00 1.00 H new ATOM 0 HD23 LEU A 25 8.131 -1.270 -5.521 1.00 1.00 H new ATOM 369 N GLY A 26 9.344 -1.178 -10.501 1.00 0.47 N ATOM 370 CA GLY A 26 9.813 -1.688 -11.774 1.00 0.53 C ATOM 371 C GLY A 26 11.246 -2.167 -11.682 1.00 0.50 C ATOM 372 O GLY A 26 11.651 -3.089 -12.391 1.00 0.64 O ATOM 0 H GLY A 26 9.069 -0.196 -10.506 1.00 0.47 H new ATOM 0 HA2 GLY A 26 9.173 -2.509 -12.097 1.00 0.53 H new ATOM 0 HA3 GLY A 26 9.736 -0.908 -12.531 1.00 0.53 H new ATOM 376 N ASP A 27 12.008 -1.542 -10.790 1.00 0.43 N ATOM 377 CA ASP A 27 13.402 -1.906 -10.582 1.00 0.46 C ATOM 378 C ASP A 27 13.495 -3.126 -9.671 1.00 0.41 C ATOM 379 O ASP A 27 14.459 -3.889 -9.734 1.00 0.56 O ATOM 380 CB ASP A 27 14.173 -0.735 -9.972 1.00 0.59 C ATOM 381 CG ASP A 27 15.636 -1.062 -9.746 1.00 1.05 C ATOM 382 OD1 ASP A 27 16.334 -1.371 -10.736 1.00 1.50 O ATOM 383 OD2 ASP A 27 16.084 -1.010 -8.583 1.00 1.48 O ATOM 0 H ASP A 27 11.680 -0.778 -10.198 1.00 0.43 H new ATOM 0 HA ASP A 27 13.846 -2.150 -11.547 1.00 0.46 H new ATOM 0 HB2 ASP A 27 14.094 0.130 -10.630 1.00 0.59 H new ATOM 0 HB3 ASP A 27 13.715 -0.457 -9.023 1.00 0.59 H new ATOM 388 N ILE A 28 12.474 -3.308 -8.832 1.00 0.37 N ATOM 389 CA ILE A 28 12.429 -4.440 -7.917 1.00 0.36 C ATOM 390 C ILE A 28 12.571 -5.751 -8.692 1.00 0.42 C ATOM 391 O ILE A 28 11.997 -5.907 -9.771 1.00 0.47 O ATOM 392 CB ILE A 28 11.123 -4.448 -7.090 1.00 0.41 C ATOM 393 CG1 ILE A 28 11.086 -3.241 -6.144 1.00 0.45 C ATOM 394 CG2 ILE A 28 10.980 -5.749 -6.308 1.00 0.47 C ATOM 395 CD1 ILE A 28 9.834 -3.171 -5.295 1.00 1.27 C ATOM 0 H ILE A 28 11.669 -2.684 -8.770 1.00 0.37 H new ATOM 0 HA ILE A 28 13.263 -4.342 -7.223 1.00 0.36 H new ATOM 0 HB ILE A 28 10.281 -4.377 -7.779 1.00 0.41 H new ATOM 0 HG12 ILE A 28 11.957 -3.277 -5.489 1.00 0.45 H new ATOM 0 HG13 ILE A 28 11.167 -2.327 -6.732 1.00 0.45 H new ATOM 0 HG21 ILE A 28 10.053 -5.729 -5.735 1.00 0.47 H new ATOM 0 HG22 ILE A 28 10.960 -6.590 -7.001 1.00 0.47 H new ATOM 0 HG23 ILE A 28 11.825 -5.860 -5.628 1.00 0.47 H new ATOM 0 HD11 ILE A 28 9.879 -2.292 -4.652 1.00 1.27 H new ATOM 0 HD12 ILE A 28 8.959 -3.103 -5.942 1.00 1.27 H new ATOM 0 HD13 ILE A 28 9.761 -4.068 -4.679 1.00 1.27 H new ATOM 407 N PRO A 29 13.352 -6.706 -8.158 1.00 0.49 N ATOM 408 CA PRO A 29 13.586 -8.000 -8.807 1.00 0.65 C ATOM 409 C PRO A 29 12.298 -8.760 -9.107 1.00 0.73 C ATOM 410 O PRO A 29 11.297 -8.616 -8.408 1.00 0.77 O ATOM 411 CB PRO A 29 14.445 -8.772 -7.800 1.00 0.75 C ATOM 412 CG PRO A 29 14.307 -8.030 -6.515 1.00 0.74 C ATOM 413 CD PRO A 29 14.078 -6.596 -6.888 1.00 0.51 C ATOM 0 HA PRO A 29 14.063 -7.871 -9.779 1.00 0.65 H new ATOM 0 HB2 PRO A 29 14.102 -9.802 -7.698 1.00 0.75 H new ATOM 0 HB3 PRO A 29 15.486 -8.813 -8.121 1.00 0.75 H new ATOM 0 HG2 PRO A 29 13.475 -8.418 -5.928 1.00 0.74 H new ATOM 0 HG3 PRO A 29 15.204 -8.136 -5.905 1.00 0.74 H new ATOM 0 HD2 PRO A 29 13.495 -6.069 -6.133 1.00 0.51 H new ATOM 0 HD3 PRO A 29 15.016 -6.053 -7.003 1.00 0.51 H new ATOM 421 N GLU A 30 12.362 -9.574 -10.160 1.00 0.83 N ATOM 422 CA GLU A 30 11.240 -10.394 -10.617 1.00 0.95 C ATOM 423 C GLU A 30 9.903 -9.682 -10.449 1.00 0.84 C ATOM 424 O GLU A 30 8.886 -10.315 -10.187 1.00 1.18 O ATOM 425 CB GLU A 30 11.219 -11.724 -9.866 1.00 1.17 C ATOM 426 CG GLU A 30 12.510 -12.513 -10.001 1.00 1.47 C ATOM 427 CD GLU A 30 12.758 -13.000 -11.417 1.00 2.16 C ATOM 428 OE1 GLU A 30 12.901 -12.149 -12.319 1.00 2.65 O ATOM 429 OE2 GLU A 30 12.811 -14.231 -11.622 1.00 2.84 O ATOM 0 H GLU A 30 13.203 -9.684 -10.726 1.00 0.83 H new ATOM 0 HA GLU A 30 11.384 -10.577 -11.682 1.00 0.95 H new ATOM 0 HB2 GLU A 30 11.027 -11.534 -8.810 1.00 1.17 H new ATOM 0 HB3 GLU A 30 10.392 -12.329 -10.237 1.00 1.17 H new ATOM 0 HG2 GLU A 30 13.346 -11.889 -9.685 1.00 1.47 H new ATOM 0 HG3 GLU A 30 12.479 -13.370 -9.328 1.00 1.47 H new ATOM 436 N SER A 31 9.910 -8.363 -10.602 1.00 0.60 N ATOM 437 CA SER A 31 8.690 -7.574 -10.460 1.00 0.54 C ATOM 438 C SER A 31 8.358 -6.833 -11.747 1.00 0.47 C ATOM 439 O SER A 31 9.249 -6.396 -12.475 1.00 0.59 O ATOM 440 CB SER A 31 8.833 -6.580 -9.307 1.00 0.57 C ATOM 441 OG SER A 31 9.011 -7.253 -8.074 1.00 1.37 O ATOM 0 H SER A 31 10.743 -7.818 -10.824 1.00 0.60 H new ATOM 0 HA SER A 31 7.872 -8.260 -10.243 1.00 0.54 H new ATOM 0 HB2 SER A 31 9.683 -5.923 -9.492 1.00 0.57 H new ATOM 0 HB3 SER A 31 7.946 -5.948 -9.255 1.00 0.57 H new ATOM 0 HG SER A 31 9.647 -7.989 -8.192 1.00 1.37 H new ATOM 447 N HIS A 32 7.065 -6.701 -12.021 1.00 0.38 N ATOM 448 CA HIS A 32 6.602 -6.017 -13.223 1.00 0.42 C ATOM 449 C HIS A 32 5.240 -5.380 -12.990 1.00 0.39 C ATOM 450 O HIS A 32 4.220 -6.066 -12.977 1.00 0.39 O ATOM 451 CB HIS A 32 6.513 -7.008 -14.377 1.00 0.52 C ATOM 452 CG HIS A 32 6.234 -6.364 -15.698 1.00 1.10 C ATOM 453 ND1 HIS A 32 7.068 -5.426 -16.268 1.00 1.90 N ATOM 454 CD2 HIS A 32 5.205 -6.526 -16.565 1.00 1.90 C ATOM 455 CE1 HIS A 32 6.565 -5.040 -17.428 1.00 2.46 C ATOM 456 NE2 HIS A 32 5.436 -5.692 -17.630 1.00 2.42 N ATOM 0 H HIS A 32 6.318 -7.059 -11.426 1.00 0.38 H new ATOM 0 HA HIS A 32 7.316 -5.231 -13.470 1.00 0.42 H new ATOM 0 HB2 HIS A 32 7.450 -7.562 -14.443 1.00 0.52 H new ATOM 0 HB3 HIS A 32 5.728 -7.733 -14.163 1.00 0.52 H new ATOM 0 HD2 HIS A 32 4.361 -7.188 -16.441 1.00 1.90 H new ATOM 0 HE1 HIS A 32 7.004 -4.314 -18.097 1.00 2.46 H new ATOM 0 HE2 HIS A 32 4.832 -5.592 -18.446 1.00 2.42 H new ATOM 465 N ILE A 33 5.225 -4.068 -12.792 1.00 0.42 N ATOM 466 CA ILE A 33 3.984 -3.354 -12.544 1.00 0.42 C ATOM 467 C ILE A 33 2.997 -3.522 -13.698 1.00 0.41 C ATOM 468 O ILE A 33 3.373 -3.464 -14.870 1.00 0.48 O ATOM 469 CB ILE A 33 4.245 -1.859 -12.258 1.00 0.51 C ATOM 470 CG1 ILE A 33 3.685 -1.503 -10.884 1.00 0.61 C ATOM 471 CG2 ILE A 33 3.643 -0.961 -13.336 1.00 0.79 C ATOM 472 CD1 ILE A 33 3.987 -0.083 -10.451 1.00 0.70 C ATOM 0 H ILE A 33 6.058 -3.479 -12.799 1.00 0.42 H new ATOM 0 HA ILE A 33 3.532 -3.794 -11.655 1.00 0.42 H new ATOM 0 HB ILE A 33 5.322 -1.689 -12.269 1.00 0.51 H new ATOM 0 HG12 ILE A 33 2.605 -1.648 -10.893 1.00 0.61 H new ATOM 0 HG13 ILE A 33 4.093 -2.193 -10.145 1.00 0.61 H new ATOM 0 HG21 ILE A 33 3.849 0.082 -13.097 1.00 0.79 H new ATOM 0 HG22 ILE A 33 4.084 -1.206 -14.302 1.00 0.79 H new ATOM 0 HG23 ILE A 33 2.565 -1.117 -13.380 1.00 0.79 H new ATOM 0 HD11 ILE A 33 3.557 0.096 -9.465 1.00 0.70 H new ATOM 0 HD12 ILE A 33 5.066 0.063 -10.408 1.00 0.70 H new ATOM 0 HD13 ILE A 33 3.555 0.616 -11.167 1.00 0.70 H new ATOM 484 N LEU A 34 1.732 -3.739 -13.349 1.00 0.39 N ATOM 485 CA LEU A 34 0.679 -3.925 -14.338 1.00 0.40 C ATOM 486 C LEU A 34 -0.236 -2.704 -14.410 1.00 0.37 C ATOM 487 O LEU A 34 -0.361 -2.076 -15.462 1.00 0.50 O ATOM 488 CB LEU A 34 -0.144 -5.172 -14.006 1.00 0.43 C ATOM 489 CG LEU A 34 -1.258 -5.502 -15.000 1.00 0.66 C ATOM 490 CD1 LEU A 34 -0.678 -5.812 -16.372 1.00 1.42 C ATOM 491 CD2 LEU A 34 -2.092 -6.670 -14.495 1.00 1.39 C ATOM 0 H LEU A 34 1.412 -3.790 -12.382 1.00 0.39 H new ATOM 0 HA LEU A 34 1.153 -4.054 -15.311 1.00 0.40 H new ATOM 0 HB2 LEU A 34 0.530 -6.026 -13.944 1.00 0.43 H new ATOM 0 HB3 LEU A 34 -0.587 -5.043 -13.018 1.00 0.43 H new ATOM 0 HG LEU A 34 -1.906 -4.630 -15.093 1.00 0.66 H new ATOM 0 HD11 LEU A 34 -1.487 -6.044 -17.065 1.00 1.42 H new ATOM 0 HD12 LEU A 34 -0.125 -4.947 -16.737 1.00 1.42 H new ATOM 0 HD13 LEU A 34 -0.006 -6.667 -16.298 1.00 1.42 H new ATOM 0 HD21 LEU A 34 -2.880 -6.892 -15.214 1.00 1.39 H new ATOM 0 HD22 LEU A 34 -1.455 -7.546 -14.373 1.00 1.39 H new ATOM 0 HD23 LEU A 34 -2.539 -6.410 -13.535 1.00 1.39 H new ATOM 503 N THR A 35 -0.879 -2.372 -13.289 1.00 0.30 N ATOM 504 CA THR A 35 -1.784 -1.228 -13.243 1.00 0.33 C ATOM 505 C THR A 35 -1.520 -0.365 -12.012 1.00 0.34 C ATOM 506 O THR A 35 -1.095 -0.866 -10.971 1.00 0.44 O ATOM 507 CB THR A 35 -3.239 -1.703 -13.241 1.00 0.39 C ATOM 508 OG1 THR A 35 -3.496 -2.527 -12.118 1.00 0.97 O ATOM 509 CG2 THR A 35 -3.616 -2.484 -14.482 1.00 0.93 C ATOM 0 H THR A 35 -0.789 -2.877 -12.407 1.00 0.30 H new ATOM 0 HA THR A 35 -1.604 -0.623 -14.131 1.00 0.33 H new ATOM 0 HB THR A 35 -3.840 -0.794 -13.209 1.00 0.39 H new ATOM 0 HG1 THR A 35 -4.444 -2.467 -11.878 1.00 0.97 H new ATOM 0 HG21 THR A 35 -4.660 -2.791 -14.416 1.00 0.93 H new ATOM 0 HG22 THR A 35 -3.477 -1.857 -15.363 1.00 0.93 H new ATOM 0 HG23 THR A 35 -2.983 -3.368 -14.562 1.00 0.93 H new ATOM 517 N VAL A 36 -1.782 0.932 -12.144 1.00 0.33 N ATOM 518 CA VAL A 36 -1.577 1.874 -11.047 1.00 0.39 C ATOM 519 C VAL A 36 -2.847 2.678 -10.777 1.00 0.36 C ATOM 520 O VAL A 36 -3.579 3.026 -11.705 1.00 0.38 O ATOM 521 CB VAL A 36 -0.418 2.845 -11.350 1.00 0.51 C ATOM 522 CG1 VAL A 36 -0.188 3.790 -10.180 1.00 1.05 C ATOM 523 CG2 VAL A 36 0.852 2.074 -11.680 1.00 1.21 C ATOM 0 H VAL A 36 -2.137 1.356 -13.001 1.00 0.33 H new ATOM 0 HA VAL A 36 -1.324 1.288 -10.163 1.00 0.39 H new ATOM 0 HB VAL A 36 -0.690 3.443 -12.220 1.00 0.51 H new ATOM 0 HG11 VAL A 36 0.634 4.466 -10.415 1.00 1.05 H new ATOM 0 HG12 VAL A 36 -1.093 4.369 -9.996 1.00 1.05 H new ATOM 0 HG13 VAL A 36 0.060 3.213 -9.289 1.00 1.05 H new ATOM 0 HG21 VAL A 36 1.659 2.776 -11.891 1.00 1.21 H new ATOM 0 HG22 VAL A 36 1.128 1.448 -10.832 1.00 1.21 H new ATOM 0 HG23 VAL A 36 0.680 1.446 -12.554 1.00 1.21 H new ATOM 533 N SER A 37 -3.102 2.972 -9.505 1.00 0.35 N ATOM 534 CA SER A 37 -4.283 3.736 -9.119 1.00 0.35 C ATOM 535 C SER A 37 -4.065 5.232 -9.367 1.00 0.40 C ATOM 536 O SER A 37 -3.395 5.612 -10.327 1.00 0.72 O ATOM 537 CB SER A 37 -4.623 3.468 -7.649 1.00 0.36 C ATOM 538 OG SER A 37 -5.868 4.048 -7.294 1.00 1.35 O ATOM 0 H SER A 37 -2.507 2.693 -8.725 1.00 0.35 H new ATOM 0 HA SER A 37 -5.125 3.416 -9.733 1.00 0.35 H new ATOM 0 HB2 SER A 37 -4.656 2.393 -7.471 1.00 0.36 H new ATOM 0 HB3 SER A 37 -3.836 3.872 -7.012 1.00 0.36 H new ATOM 0 HG SER A 37 -5.986 4.000 -6.322 1.00 1.35 H new ATOM 544 N SER A 38 -4.632 6.078 -8.506 1.00 0.43 N ATOM 545 CA SER A 38 -4.492 7.524 -8.655 1.00 0.45 C ATOM 546 C SER A 38 -4.092 8.170 -7.326 1.00 0.47 C ATOM 547 O SER A 38 -3.542 7.505 -6.450 1.00 0.70 O ATOM 548 CB SER A 38 -5.805 8.124 -9.170 1.00 0.50 C ATOM 549 OG SER A 38 -5.651 9.494 -9.502 1.00 1.19 O ATOM 0 H SER A 38 -5.189 5.787 -7.703 1.00 0.43 H new ATOM 0 HA SER A 38 -3.703 7.726 -9.379 1.00 0.45 H new ATOM 0 HB2 SER A 38 -6.141 7.571 -10.047 1.00 0.50 H new ATOM 0 HB3 SER A 38 -6.579 8.017 -8.410 1.00 0.50 H new ATOM 0 HG SER A 38 -6.504 9.849 -9.829 1.00 1.19 H new ATOM 555 N PHE A 39 -4.372 9.465 -7.177 1.00 0.38 N ATOM 556 CA PHE A 39 -4.043 10.184 -5.954 1.00 0.43 C ATOM 557 C PHE A 39 -5.242 10.237 -5.016 1.00 0.40 C ATOM 558 O PHE A 39 -6.380 10.410 -5.454 1.00 0.65 O ATOM 559 CB PHE A 39 -3.542 11.597 -6.287 1.00 0.59 C ATOM 560 CG PHE A 39 -4.309 12.288 -7.387 1.00 1.42 C ATOM 561 CD1 PHE A 39 -5.671 12.508 -7.256 1.00 1.93 C ATOM 562 CD2 PHE A 39 -3.675 12.720 -8.541 1.00 2.21 C ATOM 563 CE1 PHE A 39 -6.386 13.141 -8.256 1.00 2.75 C ATOM 564 CE2 PHE A 39 -4.383 13.354 -9.544 1.00 3.01 C ATOM 565 CZ PHE A 39 -5.704 13.561 -9.428 1.00 3.17 C ATOM 0 H PHE A 39 -4.826 10.035 -7.891 1.00 0.38 H new ATOM 0 HA PHE A 39 -3.244 9.648 -5.441 1.00 0.43 H new ATOM 0 HB2 PHE A 39 -3.592 12.209 -5.386 1.00 0.59 H new ATOM 0 HB3 PHE A 39 -2.492 11.539 -6.574 1.00 0.59 H new ATOM 0 HD1 PHE A 39 -6.180 12.181 -6.362 1.00 1.93 H new ATOM 0 HD2 PHE A 39 -2.613 12.559 -8.658 1.00 2.21 H new ATOM 0 HE1 PHE A 39 -7.447 13.313 -8.147 1.00 2.75 H new ATOM 0 HE2 PHE A 39 -3.867 13.687 -10.432 1.00 3.01 H new ATOM 0 HZ PHE A 39 -6.247 14.046 -10.225 1.00 3.17 H new ATOM 575 N TYR A 40 -4.991 10.061 -3.722 1.00 0.38 N ATOM 576 CA TYR A 40 -6.067 10.072 -2.736 1.00 0.37 C ATOM 577 C TYR A 40 -5.667 10.819 -1.470 1.00 0.40 C ATOM 578 O TYR A 40 -4.757 10.406 -0.752 1.00 0.53 O ATOM 579 CB TYR A 40 -6.478 8.644 -2.365 1.00 0.44 C ATOM 580 CG TYR A 40 -6.943 7.807 -3.535 1.00 0.49 C ATOM 581 CD1 TYR A 40 -6.034 7.257 -4.430 1.00 0.49 C ATOM 582 CD2 TYR A 40 -8.295 7.574 -3.749 1.00 0.59 C ATOM 583 CE1 TYR A 40 -6.457 6.496 -5.502 1.00 0.57 C ATOM 584 CE2 TYR A 40 -8.726 6.811 -4.819 1.00 0.67 C ATOM 585 CZ TYR A 40 -7.804 6.276 -5.692 1.00 0.66 C ATOM 586 OH TYR A 40 -8.231 5.518 -6.758 1.00 0.76 O ATOM 0 H TYR A 40 -4.060 9.910 -3.334 1.00 0.38 H new ATOM 0 HA TYR A 40 -6.910 10.590 -3.194 1.00 0.37 H new ATOM 0 HB2 TYR A 40 -5.632 8.146 -1.891 1.00 0.44 H new ATOM 0 HB3 TYR A 40 -7.277 8.689 -1.625 1.00 0.44 H new ATOM 0 HD1 TYR A 40 -4.977 7.428 -4.285 1.00 0.49 H new ATOM 0 HD2 TYR A 40 -9.021 7.995 -3.069 1.00 0.59 H new ATOM 0 HE1 TYR A 40 -5.736 6.076 -6.188 1.00 0.57 H new ATOM 0 HE2 TYR A 40 -9.781 6.635 -4.970 1.00 0.67 H new ATOM 0 HH TYR A 40 -7.505 4.930 -7.053 1.00 0.76 H new ATOM 596 N ARG A 41 -6.378 11.903 -1.185 1.00 0.43 N ATOM 597 CA ARG A 41 -6.129 12.687 0.016 1.00 0.50 C ATOM 598 C ARG A 41 -6.890 12.047 1.176 1.00 0.54 C ATOM 599 O ARG A 41 -8.121 12.035 1.182 1.00 0.67 O ATOM 600 CB ARG A 41 -6.573 14.139 -0.200 1.00 0.66 C ATOM 601 CG ARG A 41 -6.111 15.092 0.884 1.00 0.69 C ATOM 602 CD ARG A 41 -6.604 16.508 0.632 1.00 0.94 C ATOM 603 NE ARG A 41 -8.062 16.600 0.643 1.00 1.56 N ATOM 604 CZ ARG A 41 -8.730 17.734 0.442 1.00 2.07 C ATOM 605 NH1 ARG A 41 -8.070 18.861 0.205 1.00 2.32 N ATOM 606 NH2 ARG A 41 -10.056 17.743 0.474 1.00 2.95 N ATOM 0 H ARG A 41 -7.133 12.259 -1.771 1.00 0.43 H new ATOM 0 HA ARG A 41 -5.064 12.699 0.246 1.00 0.50 H new ATOM 0 HB2 ARG A 41 -6.192 14.486 -1.161 1.00 0.66 H new ATOM 0 HB3 ARG A 41 -7.661 14.171 -0.258 1.00 0.66 H new ATOM 0 HG2 ARG A 41 -6.474 14.747 1.852 1.00 0.69 H new ATOM 0 HG3 ARG A 41 -5.022 15.088 0.932 1.00 0.69 H new ATOM 0 HD2 ARG A 41 -6.195 17.173 1.393 1.00 0.94 H new ATOM 0 HD3 ARG A 41 -6.228 16.855 -0.330 1.00 0.94 H new ATOM 0 HE ARG A 41 -8.597 15.749 0.814 1.00 1.56 H new ATOM 0 HH11 ARG A 41 -7.050 18.859 0.177 1.00 2.32 H new ATOM 0 HH12 ARG A 41 -8.582 19.729 0.051 1.00 2.32 H new ATOM 0 HH21 ARG A 41 -10.568 16.879 0.653 1.00 2.95 H new ATOM 0 HH22 ARG A 41 -10.564 18.614 0.320 1.00 2.95 H new ATOM 620 N THR A 42 -6.160 11.487 2.139 1.00 0.61 N ATOM 621 CA THR A 42 -6.799 10.812 3.284 1.00 0.73 C ATOM 622 C THR A 42 -5.793 10.515 4.396 1.00 0.84 C ATOM 623 O THR A 42 -4.789 9.842 4.163 1.00 1.10 O ATOM 624 CB THR A 42 -7.475 9.518 2.824 1.00 0.81 C ATOM 625 OG1 THR A 42 -8.000 8.806 3.932 1.00 1.30 O ATOM 626 CG2 THR A 42 -6.549 8.588 2.074 1.00 1.28 C ATOM 0 H THR A 42 -5.140 11.483 2.157 1.00 0.61 H new ATOM 0 HA THR A 42 -7.553 11.487 3.689 1.00 0.73 H new ATOM 0 HB THR A 42 -8.267 9.833 2.145 1.00 0.81 H new ATOM 0 HG1 THR A 42 -8.429 7.983 3.618 1.00 1.30 H new ATOM 0 HG21 THR A 42 -7.095 7.692 1.778 1.00 1.28 H new ATOM 0 HG22 THR A 42 -6.169 9.092 1.185 1.00 1.28 H new ATOM 0 HG23 THR A 42 -5.714 8.309 2.717 1.00 1.28 H new ATOM 634 N PRO A 43 -6.064 11.009 5.625 1.00 0.74 N ATOM 635 CA PRO A 43 -5.207 10.835 6.801 1.00 0.86 C ATOM 636 C PRO A 43 -4.305 9.604 6.751 1.00 0.90 C ATOM 637 O PRO A 43 -4.788 8.479 6.623 1.00 0.94 O ATOM 638 CB PRO A 43 -6.240 10.721 7.912 1.00 0.98 C ATOM 639 CG PRO A 43 -7.334 11.656 7.498 1.00 0.87 C ATOM 640 CD PRO A 43 -7.265 11.780 5.987 1.00 0.71 C ATOM 0 HA PRO A 43 -4.489 11.648 6.913 1.00 0.86 H new ATOM 0 HB2 PRO A 43 -6.606 9.699 8.011 1.00 0.98 H new ATOM 0 HB3 PRO A 43 -5.819 11.004 8.877 1.00 0.98 H new ATOM 0 HG2 PRO A 43 -8.306 11.274 7.809 1.00 0.87 H new ATOM 0 HG3 PRO A 43 -7.208 12.630 7.971 1.00 0.87 H new ATOM 0 HD2 PRO A 43 -8.158 11.375 5.511 1.00 0.71 H new ATOM 0 HD3 PRO A 43 -7.181 12.821 5.675 1.00 0.71 H new ATOM 648 N PRO A 44 -2.968 9.800 6.856 1.00 0.98 N ATOM 649 CA PRO A 44 -2.018 8.688 6.827 1.00 1.12 C ATOM 650 C PRO A 44 -2.094 7.833 8.084 1.00 1.19 C ATOM 651 O PRO A 44 -1.401 6.821 8.203 1.00 2.06 O ATOM 652 CB PRO A 44 -0.655 9.374 6.722 1.00 1.28 C ATOM 653 CG PRO A 44 -0.857 10.736 7.289 1.00 1.18 C ATOM 654 CD PRO A 44 -2.284 11.106 7.015 1.00 1.03 C ATOM 0 HA PRO A 44 -2.221 8.003 6.004 1.00 1.12 H new ATOM 0 HB2 PRO A 44 0.106 8.825 7.278 1.00 1.28 H new ATOM 0 HB3 PRO A 44 -0.319 9.425 5.686 1.00 1.28 H new ATOM 0 HG2 PRO A 44 -0.653 10.744 8.360 1.00 1.18 H new ATOM 0 HG3 PRO A 44 -0.176 11.452 6.829 1.00 1.18 H new ATOM 0 HD2 PRO A 44 -2.711 11.683 7.835 1.00 1.03 H new ATOM 0 HD3 PRO A 44 -2.373 11.715 6.116 1.00 1.03 H new ATOM 662 N LEU A 45 -2.945 8.251 9.014 1.00 0.99 N ATOM 663 CA LEU A 45 -3.138 7.540 10.274 1.00 1.03 C ATOM 664 C LEU A 45 -1.829 7.411 11.044 1.00 1.08 C ATOM 665 O LEU A 45 -1.008 6.541 10.754 1.00 1.32 O ATOM 666 CB LEU A 45 -3.740 6.155 10.021 1.00 1.15 C ATOM 667 CG LEU A 45 -5.080 6.151 9.281 1.00 1.53 C ATOM 668 CD1 LEU A 45 -5.549 4.726 9.038 1.00 1.83 C ATOM 669 CD2 LEU A 45 -6.128 6.931 10.064 1.00 2.21 C ATOM 0 H LEU A 45 -3.519 9.089 8.917 1.00 0.99 H new ATOM 0 HA LEU A 45 -3.831 8.122 10.881 1.00 1.03 H new ATOM 0 HB2 LEU A 45 -3.025 5.565 9.448 1.00 1.15 H new ATOM 0 HB3 LEU A 45 -3.871 5.653 10.980 1.00 1.15 H new ATOM 0 HG LEU A 45 -4.940 6.638 8.316 1.00 1.53 H new ATOM 0 HD11 LEU A 45 -6.503 4.742 8.511 1.00 1.83 H new ATOM 0 HD12 LEU A 45 -4.810 4.198 8.435 1.00 1.83 H new ATOM 0 HD13 LEU A 45 -5.671 4.215 9.993 1.00 1.83 H new ATOM 0 HD21 LEU A 45 -7.073 6.916 9.521 1.00 2.21 H new ATOM 0 HD22 LEU A 45 -6.265 6.474 11.044 1.00 2.21 H new ATOM 0 HD23 LEU A 45 -5.797 7.962 10.188 1.00 2.21 H new ATOM 681 N GLY A 46 -1.649 8.280 12.035 1.00 1.09 N ATOM 682 CA GLY A 46 -0.444 8.247 12.840 1.00 1.18 C ATOM 683 C GLY A 46 0.104 9.635 13.122 1.00 1.11 C ATOM 684 O GLY A 46 -0.660 10.589 13.265 1.00 1.19 O ATOM 0 H GLY A 46 -2.317 9.006 12.294 1.00 1.09 H new ATOM 0 HA2 GLY A 46 -0.655 7.744 13.784 1.00 1.18 H new ATOM 0 HA3 GLY A 46 0.316 7.657 12.327 1.00 1.18 H new ATOM 688 N PRO A 47 1.435 9.773 13.222 1.00 1.12 N ATOM 689 CA PRO A 47 2.090 11.044 13.501 1.00 1.16 C ATOM 690 C PRO A 47 2.539 11.780 12.235 1.00 1.14 C ATOM 691 O PRO A 47 1.784 11.886 11.275 1.00 1.99 O ATOM 692 CB PRO A 47 3.287 10.586 14.316 1.00 1.36 C ATOM 693 CG PRO A 47 3.669 9.264 13.730 1.00 1.39 C ATOM 694 CD PRO A 47 2.425 8.691 13.092 1.00 1.26 C ATOM 0 HA PRO A 47 1.437 11.761 13.999 1.00 1.16 H new ATOM 0 HB2 PRO A 47 4.108 11.300 14.248 1.00 1.36 H new ATOM 0 HB3 PRO A 47 3.033 10.492 15.372 1.00 1.36 H new ATOM 0 HG2 PRO A 47 4.462 9.384 12.991 1.00 1.39 H new ATOM 0 HG3 PRO A 47 4.050 8.595 14.502 1.00 1.39 H new ATOM 0 HD2 PRO A 47 2.595 8.428 12.048 1.00 1.26 H new ATOM 0 HD3 PRO A 47 2.096 7.784 13.600 1.00 1.26 H new ATOM 702 N GLN A 48 3.771 12.298 12.250 1.00 0.95 N ATOM 703 CA GLN A 48 4.335 13.030 11.111 1.00 0.84 C ATOM 704 C GLN A 48 3.546 14.303 10.808 1.00 0.90 C ATOM 705 O GLN A 48 3.907 15.069 9.912 1.00 1.04 O ATOM 706 CB GLN A 48 4.393 12.141 9.876 1.00 0.83 C ATOM 707 CG GLN A 48 3.281 12.400 8.879 1.00 1.00 C ATOM 708 CD GLN A 48 2.779 11.136 8.251 1.00 1.29 C ATOM 709 OE1 GLN A 48 3.378 10.604 7.320 1.00 2.23 O ATOM 710 NE2 GLN A 48 1.678 10.635 8.783 1.00 1.15 N ATOM 0 H GLN A 48 4.403 12.223 13.047 1.00 0.95 H new ATOM 0 HA GLN A 48 5.349 13.323 11.384 1.00 0.84 H new ATOM 0 HB2 GLN A 48 5.353 12.287 9.381 1.00 0.83 H new ATOM 0 HB3 GLN A 48 4.351 11.098 10.189 1.00 0.83 H new ATOM 0 HG2 GLN A 48 2.457 12.907 9.380 1.00 1.00 H new ATOM 0 HG3 GLN A 48 3.642 13.072 8.101 1.00 1.00 H new ATOM 0 HE21 GLN A 48 1.220 11.118 9.556 1.00 1.15 H new ATOM 0 HE22 GLN A 48 1.287 9.765 8.421 1.00 1.15 H new ATOM 719 N ASP A 49 2.467 14.495 11.560 1.00 0.99 N ATOM 720 CA ASP A 49 1.566 15.648 11.426 1.00 1.16 C ATOM 721 C ASP A 49 0.434 15.348 10.444 1.00 1.20 C ATOM 722 O ASP A 49 -0.545 16.093 10.365 1.00 1.33 O ATOM 723 CB ASP A 49 2.320 16.913 10.995 1.00 1.28 C ATOM 724 CG ASP A 49 1.417 18.127 10.907 1.00 1.51 C ATOM 725 OD1 ASP A 49 0.820 18.498 11.940 1.00 1.81 O ATOM 726 OD2 ASP A 49 1.302 18.705 9.806 1.00 1.70 O ATOM 0 H ASP A 49 2.184 13.846 12.294 1.00 0.99 H new ATOM 0 HA ASP A 49 1.136 15.833 12.410 1.00 1.16 H new ATOM 0 HB2 ASP A 49 3.123 17.113 11.705 1.00 1.28 H new ATOM 0 HB3 ASP A 49 2.787 16.741 10.025 1.00 1.28 H new ATOM 731 N GLN A 50 0.566 14.245 9.705 1.00 1.19 N ATOM 732 CA GLN A 50 -0.453 13.835 8.736 1.00 1.31 C ATOM 733 C GLN A 50 -0.794 14.991 7.790 1.00 1.33 C ATOM 734 O GLN A 50 -1.853 15.607 7.908 1.00 1.40 O ATOM 735 CB GLN A 50 -1.715 13.376 9.464 1.00 1.42 C ATOM 736 CG GLN A 50 -1.441 12.557 10.715 1.00 1.67 C ATOM 737 CD GLN A 50 -1.496 11.060 10.475 1.00 1.43 C ATOM 738 OE1 GLN A 50 -2.566 10.499 10.252 1.00 2.03 O ATOM 739 NE2 GLN A 50 -0.337 10.414 10.498 1.00 1.24 N ATOM 0 H GLN A 50 1.369 13.619 9.759 1.00 1.19 H new ATOM 0 HA GLN A 50 -0.055 13.007 8.149 1.00 1.31 H new ATOM 0 HB2 GLN A 50 -2.304 14.252 9.737 1.00 1.42 H new ATOM 0 HB3 GLN A 50 -2.322 12.784 8.780 1.00 1.42 H new ATOM 0 HG2 GLN A 50 -0.458 12.820 11.105 1.00 1.67 H new ATOM 0 HG3 GLN A 50 -2.169 12.822 11.481 1.00 1.67 H new ATOM 0 HE21 GLN A 50 0.527 10.923 10.688 1.00 1.24 H new ATOM 0 HE22 GLN A 50 -0.310 9.409 10.326 1.00 1.24 H new ATOM 748 N PRO A 51 0.120 15.324 6.864 1.00 1.35 N ATOM 749 CA PRO A 51 -0.042 16.420 5.923 1.00 1.46 C ATOM 750 C PRO A 51 -0.458 15.995 4.511 1.00 1.54 C ATOM 751 O PRO A 51 0.311 15.369 3.780 1.00 2.26 O ATOM 752 CB PRO A 51 1.366 16.984 5.889 1.00 1.52 C ATOM 753 CG PRO A 51 2.258 15.791 6.064 1.00 1.53 C ATOM 754 CD PRO A 51 1.422 14.691 6.681 1.00 1.37 C ATOM 0 HA PRO A 51 -0.836 17.102 6.229 1.00 1.46 H new ATOM 0 HB2 PRO A 51 1.566 17.493 4.946 1.00 1.52 H new ATOM 0 HB3 PRO A 51 1.520 17.714 6.684 1.00 1.52 H new ATOM 0 HG2 PRO A 51 2.666 15.472 5.105 1.00 1.53 H new ATOM 0 HG3 PRO A 51 3.105 16.035 6.705 1.00 1.53 H new ATOM 0 HD2 PRO A 51 1.358 13.820 6.029 1.00 1.37 H new ATOM 0 HD3 PRO A 51 1.841 14.350 7.628 1.00 1.37 H new ATOM 762 N ASP A 52 -1.675 16.379 4.148 1.00 1.24 N ATOM 763 CA ASP A 52 -2.264 16.107 2.825 1.00 1.23 C ATOM 764 C ASP A 52 -2.607 14.653 2.642 1.00 0.91 C ATOM 765 O ASP A 52 -3.560 14.327 1.941 1.00 1.55 O ATOM 766 CB ASP A 52 -1.346 16.487 1.685 1.00 1.67 C ATOM 767 CG ASP A 52 -0.744 17.875 1.829 1.00 2.16 C ATOM 768 OD1 ASP A 52 -0.023 18.107 2.820 1.00 2.56 O ATOM 769 OD2 ASP A 52 -0.995 18.729 0.953 1.00 2.69 O ATOM 0 H ASP A 52 -2.298 16.897 4.768 1.00 1.24 H new ATOM 0 HA ASP A 52 -3.165 16.720 2.799 1.00 1.23 H new ATOM 0 HB2 ASP A 52 -0.541 15.755 1.618 1.00 1.67 H new ATOM 0 HB3 ASP A 52 -1.902 16.436 0.749 1.00 1.67 H new ATOM 774 N TYR A 53 -1.835 13.781 3.272 1.00 0.76 N ATOM 775 CA TYR A 53 -2.074 12.357 3.184 1.00 1.08 C ATOM 776 C TYR A 53 -2.405 11.890 1.765 1.00 0.87 C ATOM 777 O TYR A 53 -3.565 11.893 1.364 1.00 0.98 O ATOM 778 CB TYR A 53 -3.216 11.987 4.123 1.00 1.83 C ATOM 779 CG TYR A 53 -3.999 13.162 4.701 1.00 2.62 C ATOM 780 CD1 TYR A 53 -3.572 13.811 5.858 1.00 3.32 C ATOM 781 CD2 TYR A 53 -5.154 13.631 4.086 1.00 3.26 C ATOM 782 CE1 TYR A 53 -4.272 14.881 6.381 1.00 4.46 C ATOM 783 CE2 TYR A 53 -5.858 14.702 4.603 1.00 4.34 C ATOM 784 CZ TYR A 53 -5.441 15.295 5.770 1.00 4.90 C ATOM 785 OH TYR A 53 -6.114 16.389 6.266 1.00 6.13 O ATOM 0 H TYR A 53 -1.036 14.040 3.851 1.00 0.76 H new ATOM 0 HA TYR A 53 -1.151 11.854 3.473 1.00 1.08 H new ATOM 0 HB2 TYR A 53 -3.910 11.340 3.586 1.00 1.83 H new ATOM 0 HB3 TYR A 53 -2.809 11.403 4.949 1.00 1.83 H new ATOM 0 HD1 TYR A 53 -2.676 13.471 6.356 1.00 3.32 H new ATOM 0 HD2 TYR A 53 -5.508 13.149 3.187 1.00 3.26 H new ATOM 0 HE1 TYR A 53 -3.909 15.391 7.261 1.00 4.46 H new ATOM 0 HE2 TYR A 53 -6.734 15.072 4.091 1.00 4.34 H new ATOM 0 HH TYR A 53 -6.915 16.553 5.726 1.00 6.13 H new ATOM 795 N LEU A 54 -1.396 11.460 1.011 1.00 0.72 N ATOM 796 CA LEU A 54 -1.637 10.969 -0.342 1.00 0.59 C ATOM 797 C LEU A 54 -1.326 9.478 -0.431 1.00 0.61 C ATOM 798 O LEU A 54 -0.177 9.065 -0.279 1.00 0.88 O ATOM 799 CB LEU A 54 -0.803 11.729 -1.372 1.00 0.60 C ATOM 800 CG LEU A 54 -1.205 11.473 -2.826 1.00 0.54 C ATOM 801 CD1 LEU A 54 -2.460 12.258 -3.170 1.00 0.92 C ATOM 802 CD2 LEU A 54 -0.067 11.827 -3.767 1.00 1.10 C ATOM 0 H LEU A 54 -0.420 11.441 1.308 1.00 0.72 H new ATOM 0 HA LEU A 54 -2.691 11.134 -0.566 1.00 0.59 H new ATOM 0 HB2 LEU A 54 -0.882 12.797 -1.169 1.00 0.60 H new ATOM 0 HB3 LEU A 54 0.245 11.457 -1.245 1.00 0.60 H new ATOM 0 HG LEU A 54 -1.421 10.411 -2.947 1.00 0.54 H new ATOM 0 HD11 LEU A 54 -2.736 12.067 -4.207 1.00 0.92 H new ATOM 0 HD12 LEU A 54 -3.274 11.948 -2.515 1.00 0.92 H new ATOM 0 HD13 LEU A 54 -2.272 13.323 -3.035 1.00 0.92 H new ATOM 0 HD21 LEU A 54 -0.373 11.638 -4.796 1.00 1.10 H new ATOM 0 HD22 LEU A 54 0.186 12.881 -3.652 1.00 1.10 H new ATOM 0 HD23 LEU A 54 0.804 11.217 -3.530 1.00 1.10 H new ATOM 814 N ASN A 55 -2.357 8.680 -0.681 1.00 0.50 N ATOM 815 CA ASN A 55 -2.199 7.236 -0.792 1.00 0.58 C ATOM 816 C ASN A 55 -2.507 6.768 -2.207 1.00 0.57 C ATOM 817 O ASN A 55 -3.219 7.444 -2.950 1.00 0.70 O ATOM 818 CB ASN A 55 -3.124 6.527 0.194 1.00 0.82 C ATOM 819 CG ASN A 55 -2.975 5.018 0.151 1.00 1.80 C ATOM 820 OD1 ASN A 55 -1.931 4.476 0.507 1.00 2.63 O ATOM 821 ND2 ASN A 55 -4.019 4.335 -0.295 1.00 2.49 N ATOM 0 H ASN A 55 -3.313 9.010 -0.811 1.00 0.50 H new ATOM 0 HA ASN A 55 -1.164 6.988 -0.557 1.00 0.58 H new ATOM 0 HB2 ASN A 55 -2.913 6.881 1.203 1.00 0.82 H new ATOM 0 HB3 ASN A 55 -4.158 6.793 -0.027 1.00 0.82 H new ATOM 0 HD21 ASN A 55 -3.976 3.318 -0.353 1.00 2.49 H new ATOM 0 HD22 ASN A 55 -4.866 4.827 -0.580 1.00 2.49 H new ATOM 828 N ALA A 56 -1.969 5.611 -2.576 1.00 0.51 N ATOM 829 CA ALA A 56 -2.196 5.066 -3.910 1.00 0.57 C ATOM 830 C ALA A 56 -1.717 3.624 -4.026 1.00 0.54 C ATOM 831 O ALA A 56 -0.514 3.369 -4.088 1.00 0.75 O ATOM 832 CB ALA A 56 -1.500 5.930 -4.951 1.00 0.61 C ATOM 0 H ALA A 56 -1.377 5.036 -1.976 1.00 0.51 H new ATOM 0 HA ALA A 56 -3.271 5.072 -4.089 1.00 0.57 H new ATOM 0 HB1 ALA A 56 -1.675 5.515 -5.944 1.00 0.61 H new ATOM 0 HB2 ALA A 56 -1.897 6.944 -4.906 1.00 0.61 H new ATOM 0 HB3 ALA A 56 -0.429 5.950 -4.750 1.00 0.61 H new ATOM 838 N ALA A 57 -2.660 2.685 -4.076 1.00 0.31 N ATOM 839 CA ALA A 57 -2.312 1.277 -4.212 1.00 0.29 C ATOM 840 C ALA A 57 -1.801 0.995 -5.621 1.00 0.29 C ATOM 841 O ALA A 57 -1.849 1.870 -6.487 1.00 0.39 O ATOM 842 CB ALA A 57 -3.517 0.406 -3.896 1.00 0.33 C ATOM 0 H ALA A 57 -3.661 2.873 -4.025 1.00 0.31 H new ATOM 0 HA ALA A 57 -1.519 1.039 -3.503 1.00 0.29 H new ATOM 0 HB1 ALA A 57 -3.244 -0.644 -4.001 1.00 0.33 H new ATOM 0 HB2 ALA A 57 -3.845 0.595 -2.874 1.00 0.33 H new ATOM 0 HB3 ALA A 57 -4.327 0.641 -4.586 1.00 0.33 H new ATOM 848 N VAL A 58 -1.316 -0.223 -5.855 1.00 0.26 N ATOM 849 CA VAL A 58 -0.809 -0.587 -7.177 1.00 0.27 C ATOM 850 C VAL A 58 -0.535 -2.082 -7.297 1.00 0.27 C ATOM 851 O VAL A 58 0.249 -2.645 -6.531 1.00 0.28 O ATOM 852 CB VAL A 58 0.471 0.200 -7.516 1.00 0.31 C ATOM 853 CG1 VAL A 58 1.535 -0.012 -6.449 1.00 1.20 C ATOM 854 CG2 VAL A 58 0.995 -0.192 -8.889 1.00 0.98 C ATOM 0 H VAL A 58 -1.263 -0.965 -5.158 1.00 0.26 H new ATOM 0 HA VAL A 58 -1.591 -0.327 -7.890 1.00 0.27 H new ATOM 0 HB VAL A 58 0.222 1.261 -7.538 1.00 0.31 H new ATOM 0 HG11 VAL A 58 2.430 0.553 -6.710 1.00 1.20 H new ATOM 0 HG12 VAL A 58 1.157 0.330 -5.486 1.00 1.20 H new ATOM 0 HG13 VAL A 58 1.781 -1.072 -6.386 1.00 1.20 H new ATOM 0 HG21 VAL A 58 1.899 0.375 -9.109 1.00 0.98 H new ATOM 0 HG22 VAL A 58 1.223 -1.258 -8.901 1.00 0.98 H new ATOM 0 HG23 VAL A 58 0.238 0.025 -9.643 1.00 0.98 H new ATOM 864 N ALA A 59 -1.186 -2.720 -8.268 1.00 0.28 N ATOM 865 CA ALA A 59 -1.015 -4.149 -8.495 1.00 0.29 C ATOM 866 C ALA A 59 0.290 -4.438 -9.235 1.00 0.31 C ATOM 867 O ALA A 59 0.463 -4.036 -10.386 1.00 0.50 O ATOM 868 CB ALA A 59 -2.197 -4.687 -9.287 1.00 0.31 C ATOM 0 H ALA A 59 -1.837 -2.267 -8.909 1.00 0.28 H new ATOM 0 HA ALA A 59 -0.969 -4.648 -7.527 1.00 0.29 H new ATOM 0 HB1 ALA A 59 -2.066 -5.756 -9.455 1.00 0.31 H new ATOM 0 HB2 ALA A 59 -3.117 -4.518 -8.728 1.00 0.31 H new ATOM 0 HB3 ALA A 59 -2.256 -4.173 -10.247 1.00 0.31 H new ATOM 874 N LEU A 60 1.209 -5.133 -8.564 1.00 0.28 N ATOM 875 CA LEU A 60 2.505 -5.471 -9.157 1.00 0.28 C ATOM 876 C LEU A 60 2.546 -6.920 -9.618 1.00 0.30 C ATOM 877 O LEU A 60 2.421 -7.844 -8.814 1.00 0.33 O ATOM 878 CB LEU A 60 3.639 -5.235 -8.154 1.00 0.29 C ATOM 879 CG LEU A 60 5.045 -5.628 -8.641 1.00 0.29 C ATOM 880 CD1 LEU A 60 5.441 -4.800 -9.850 1.00 0.35 C ATOM 881 CD2 LEU A 60 6.058 -5.448 -7.526 1.00 0.31 C ATOM 0 H LEU A 60 1.081 -5.473 -7.611 1.00 0.28 H new ATOM 0 HA LEU A 60 2.640 -4.822 -10.022 1.00 0.28 H new ATOM 0 HB2 LEU A 60 3.649 -4.179 -7.885 1.00 0.29 H new ATOM 0 HB3 LEU A 60 3.419 -5.794 -7.245 1.00 0.29 H new ATOM 0 HG LEU A 60 5.028 -6.678 -8.932 1.00 0.29 H new ATOM 0 HD11 LEU A 60 6.438 -5.092 -10.180 1.00 0.35 H new ATOM 0 HD12 LEU A 60 4.728 -4.969 -10.656 1.00 0.35 H new ATOM 0 HD13 LEU A 60 5.442 -3.743 -9.583 1.00 0.35 H new ATOM 0 HD21 LEU A 60 7.048 -5.730 -7.885 1.00 0.31 H new ATOM 0 HD22 LEU A 60 6.070 -4.405 -7.210 1.00 0.31 H new ATOM 0 HD23 LEU A 60 5.785 -6.080 -6.681 1.00 0.31 H new ATOM 893 N GLU A 61 2.758 -7.112 -10.912 1.00 0.32 N ATOM 894 CA GLU A 61 2.861 -8.448 -11.475 1.00 0.36 C ATOM 895 C GLU A 61 4.278 -8.961 -11.254 1.00 0.34 C ATOM 896 O GLU A 61 5.175 -8.690 -12.051 1.00 0.36 O ATOM 897 CB GLU A 61 2.529 -8.412 -12.966 1.00 0.43 C ATOM 898 CG GLU A 61 2.376 -9.790 -13.590 1.00 0.52 C ATOM 899 CD GLU A 61 1.972 -9.731 -15.052 1.00 1.37 C ATOM 900 OE1 GLU A 61 1.805 -8.609 -15.578 1.00 1.88 O ATOM 901 OE2 GLU A 61 1.821 -10.805 -15.670 1.00 2.11 O ATOM 0 H GLU A 61 2.862 -6.358 -11.591 1.00 0.32 H new ATOM 0 HA GLU A 61 2.153 -9.117 -10.986 1.00 0.36 H new ATOM 0 HB2 GLU A 61 1.605 -7.853 -13.110 1.00 0.43 H new ATOM 0 HB3 GLU A 61 3.315 -7.870 -13.492 1.00 0.43 H new ATOM 0 HG2 GLU A 61 3.318 -10.332 -13.499 1.00 0.52 H new ATOM 0 HG3 GLU A 61 1.628 -10.355 -13.033 1.00 0.52 H new ATOM 908 N THR A 62 4.480 -9.663 -10.144 1.00 0.34 N ATOM 909 CA THR A 62 5.806 -10.161 -9.796 1.00 0.35 C ATOM 910 C THR A 62 5.802 -11.642 -9.430 1.00 0.39 C ATOM 911 O THR A 62 4.762 -12.226 -9.124 1.00 0.61 O ATOM 912 CB THR A 62 6.351 -9.351 -8.614 1.00 0.40 C ATOM 913 OG1 THR A 62 7.564 -9.899 -8.137 1.00 0.43 O ATOM 914 CG2 THR A 62 5.390 -9.280 -7.450 1.00 0.52 C ATOM 0 H THR A 62 3.748 -9.899 -9.474 1.00 0.34 H new ATOM 0 HA THR A 62 6.439 -10.046 -10.676 1.00 0.35 H new ATOM 0 HB THR A 62 6.506 -8.345 -9.004 1.00 0.40 H new ATOM 0 HG1 THR A 62 8.201 -9.978 -8.878 1.00 0.43 H new ATOM 0 HG21 THR A 62 5.835 -8.693 -6.646 1.00 0.52 H new ATOM 0 HG22 THR A 62 4.462 -8.808 -7.773 1.00 0.52 H new ATOM 0 HG23 THR A 62 5.179 -10.287 -7.090 1.00 0.52 H new ATOM 922 N SER A 63 6.999 -12.222 -9.429 1.00 0.37 N ATOM 923 CA SER A 63 7.202 -13.616 -9.061 1.00 0.48 C ATOM 924 C SER A 63 8.014 -13.638 -7.776 1.00 0.42 C ATOM 925 O SER A 63 8.163 -14.666 -7.118 1.00 0.45 O ATOM 926 CB SER A 63 7.934 -14.372 -10.174 1.00 0.69 C ATOM 927 OG SER A 63 7.190 -14.349 -11.379 1.00 1.22 O ATOM 0 H SER A 63 7.858 -11.734 -9.685 1.00 0.37 H new ATOM 0 HA SER A 63 6.242 -14.110 -8.913 1.00 0.48 H new ATOM 0 HB2 SER A 63 8.914 -13.924 -10.339 1.00 0.69 H new ATOM 0 HB3 SER A 63 8.103 -15.404 -9.867 1.00 0.69 H new ATOM 0 HG SER A 63 7.679 -14.837 -12.075 1.00 1.22 H new ATOM 933 N LEU A 64 8.503 -12.452 -7.432 1.00 0.37 N ATOM 934 CA LEU A 64 9.282 -12.222 -6.224 1.00 0.35 C ATOM 935 C LEU A 64 8.474 -11.324 -5.350 1.00 0.50 C ATOM 936 O LEU A 64 8.403 -10.124 -5.623 1.00 0.82 O ATOM 937 CB LEU A 64 10.577 -11.498 -6.568 1.00 0.49 C ATOM 938 CG LEU A 64 11.582 -11.303 -5.442 1.00 0.48 C ATOM 939 CD1 LEU A 64 11.539 -12.475 -4.469 1.00 0.90 C ATOM 940 CD2 LEU A 64 12.982 -11.160 -6.010 1.00 0.84 C ATOM 0 H LEU A 64 8.367 -11.612 -7.994 1.00 0.37 H new ATOM 0 HA LEU A 64 9.516 -13.170 -5.740 1.00 0.35 H new ATOM 0 HB2 LEU A 64 11.070 -12.048 -7.370 1.00 0.49 H new ATOM 0 HB3 LEU A 64 10.320 -10.516 -6.966 1.00 0.49 H new ATOM 0 HG LEU A 64 11.317 -10.393 -4.903 1.00 0.48 H new ATOM 0 HD11 LEU A 64 12.266 -12.314 -3.673 1.00 0.90 H new ATOM 0 HD12 LEU A 64 10.541 -12.554 -4.039 1.00 0.90 H new ATOM 0 HD13 LEU A 64 11.780 -13.397 -4.999 1.00 0.90 H new ATOM 0 HD21 LEU A 64 13.693 -11.021 -5.195 1.00 0.84 H new ATOM 0 HD22 LEU A 64 13.242 -12.059 -6.569 1.00 0.84 H new ATOM 0 HD23 LEU A 64 13.019 -10.297 -6.675 1.00 0.84 H new ATOM 952 N ALA A 65 7.808 -11.846 -4.339 1.00 0.58 N ATOM 953 CA ALA A 65 6.999 -10.936 -3.590 1.00 0.89 C ATOM 954 C ALA A 65 6.507 -11.356 -2.232 1.00 0.60 C ATOM 955 O ALA A 65 6.624 -10.588 -1.275 1.00 0.59 O ATOM 956 CB ALA A 65 5.795 -10.586 -4.411 1.00 1.41 C ATOM 0 H ALA A 65 7.811 -12.821 -4.040 1.00 0.58 H new ATOM 0 HA ALA A 65 7.682 -10.111 -3.386 1.00 0.89 H new ATOM 0 HB1 ALA A 65 5.165 -9.892 -3.855 1.00 1.41 H new ATOM 0 HB2 ALA A 65 6.113 -10.120 -5.344 1.00 1.41 H new ATOM 0 HB3 ALA A 65 5.230 -11.491 -4.632 1.00 1.41 H new ATOM 962 N PRO A 66 5.855 -12.506 -2.116 1.00 0.50 N ATOM 963 CA PRO A 66 5.266 -12.889 -0.862 1.00 0.40 C ATOM 964 C PRO A 66 6.224 -12.933 0.284 1.00 0.41 C ATOM 965 O PRO A 66 5.837 -13.250 1.402 1.00 0.62 O ATOM 966 CB PRO A 66 4.663 -14.260 -1.107 1.00 0.47 C ATOM 967 CG PRO A 66 4.501 -14.365 -2.580 1.00 0.75 C ATOM 968 CD PRO A 66 5.556 -13.472 -3.187 1.00 0.64 C ATOM 0 HA PRO A 66 4.532 -12.141 -0.562 1.00 0.40 H new ATOM 0 HB2 PRO A 66 5.313 -15.048 -0.727 1.00 0.47 H new ATOM 0 HB3 PRO A 66 3.705 -14.364 -0.598 1.00 0.47 H new ATOM 0 HG2 PRO A 66 4.626 -15.396 -2.912 1.00 0.75 H new ATOM 0 HG3 PRO A 66 3.503 -14.050 -2.885 1.00 0.75 H new ATOM 0 HD2 PRO A 66 6.442 -14.038 -3.475 1.00 0.64 H new ATOM 0 HD3 PRO A 66 5.190 -12.974 -4.085 1.00 0.64 H new ATOM 976 N GLU A 67 7.464 -12.649 0.008 1.00 0.40 N ATOM 977 CA GLU A 67 8.471 -12.663 1.048 1.00 0.44 C ATOM 978 C GLU A 67 9.438 -11.533 0.831 1.00 0.37 C ATOM 979 O GLU A 67 9.801 -10.811 1.760 1.00 0.40 O ATOM 980 CB GLU A 67 9.207 -13.997 1.048 1.00 0.57 C ATOM 981 CG GLU A 67 8.452 -15.066 0.296 1.00 0.65 C ATOM 982 CD GLU A 67 9.123 -16.427 0.349 1.00 0.80 C ATOM 983 OE1 GLU A 67 10.191 -16.538 0.988 1.00 1.28 O ATOM 984 OE2 GLU A 67 8.581 -17.379 -0.250 1.00 1.19 O ATOM 0 H GLU A 67 7.808 -12.405 -0.921 1.00 0.40 H new ATOM 0 HA GLU A 67 7.987 -12.535 2.016 1.00 0.44 H new ATOM 0 HB2 GLU A 67 10.192 -13.866 0.599 1.00 0.57 H new ATOM 0 HB3 GLU A 67 9.366 -14.322 2.076 1.00 0.57 H new ATOM 0 HG2 GLU A 67 7.446 -15.148 0.708 1.00 0.65 H new ATOM 0 HG3 GLU A 67 8.346 -14.762 -0.745 1.00 0.65 H new ATOM 991 N GLU A 68 9.855 -11.389 -0.410 1.00 0.34 N ATOM 992 CA GLU A 68 10.792 -10.342 -0.756 1.00 0.31 C ATOM 993 C GLU A 68 10.116 -9.037 -1.168 1.00 0.29 C ATOM 994 O GLU A 68 10.623 -7.971 -0.845 1.00 0.30 O ATOM 995 CB GLU A 68 11.751 -10.791 -1.844 1.00 0.37 C ATOM 996 CG GLU A 68 13.038 -9.987 -1.852 1.00 0.34 C ATOM 997 CD GLU A 68 13.942 -10.324 -0.681 1.00 0.53 C ATOM 998 OE1 GLU A 68 14.323 -11.506 -0.548 1.00 1.21 O ATOM 999 OE2 GLU A 68 14.264 -9.406 0.102 1.00 1.02 O ATOM 0 H GLU A 68 9.563 -11.978 -1.189 1.00 0.34 H new ATOM 0 HA GLU A 68 11.352 -10.141 0.157 1.00 0.31 H new ATOM 0 HB2 GLU A 68 11.986 -11.846 -1.704 1.00 0.37 H new ATOM 0 HB3 GLU A 68 11.263 -10.699 -2.814 1.00 0.37 H new ATOM 0 HG2 GLU A 68 13.572 -10.172 -2.784 1.00 0.34 H new ATOM 0 HG3 GLU A 68 12.798 -8.924 -1.828 1.00 0.34 H new ATOM 1006 N LEU A 69 8.997 -9.098 -1.914 1.00 0.32 N ATOM 1007 CA LEU A 69 8.350 -7.845 -2.359 1.00 0.36 C ATOM 1008 C LEU A 69 8.117 -6.895 -1.202 1.00 0.35 C ATOM 1009 O LEU A 69 8.677 -5.803 -1.194 1.00 0.41 O ATOM 1010 CB LEU A 69 7.046 -8.125 -3.093 1.00 0.42 C ATOM 1011 CG LEU A 69 6.202 -6.940 -3.569 1.00 0.54 C ATOM 1012 CD1 LEU A 69 5.585 -6.175 -2.412 1.00 1.08 C ATOM 1013 CD2 LEU A 69 7.029 -6.015 -4.444 1.00 1.51 C ATOM 0 H LEU A 69 8.537 -9.958 -2.212 1.00 0.32 H new ATOM 0 HA LEU A 69 9.035 -7.362 -3.056 1.00 0.36 H new ATOM 0 HB2 LEU A 69 7.282 -8.734 -3.965 1.00 0.42 H new ATOM 0 HB3 LEU A 69 6.422 -8.733 -2.438 1.00 0.42 H new ATOM 0 HG LEU A 69 5.381 -7.344 -4.161 1.00 0.54 H new ATOM 0 HD11 LEU A 69 4.996 -5.344 -2.799 1.00 1.08 H new ATOM 0 HD12 LEU A 69 4.941 -6.841 -1.838 1.00 1.08 H new ATOM 0 HD13 LEU A 69 6.375 -5.790 -1.767 1.00 1.08 H new ATOM 0 HD21 LEU A 69 6.413 -5.178 -4.773 1.00 1.51 H new ATOM 0 HD22 LEU A 69 7.878 -5.638 -3.874 1.00 1.51 H new ATOM 0 HD23 LEU A 69 7.390 -6.564 -5.314 1.00 1.51 H new ATOM 1025 N LEU A 70 7.285 -7.281 -0.231 1.00 0.33 N ATOM 1026 CA LEU A 70 7.037 -6.384 0.898 1.00 0.39 C ATOM 1027 C LEU A 70 8.363 -5.901 1.477 1.00 0.42 C ATOM 1028 O LEU A 70 8.458 -4.795 2.005 1.00 0.61 O ATOM 1029 CB LEU A 70 6.194 -7.055 1.983 1.00 0.44 C ATOM 1030 CG LEU A 70 5.909 -6.180 3.212 1.00 0.58 C ATOM 1031 CD1 LEU A 70 4.609 -6.596 3.875 1.00 1.16 C ATOM 1032 CD2 LEU A 70 7.054 -6.262 4.212 1.00 1.01 C ATOM 0 H LEU A 70 6.790 -8.172 -0.202 1.00 0.33 H new ATOM 0 HA LEU A 70 6.470 -5.529 0.529 1.00 0.39 H new ATOM 0 HB2 LEU A 70 5.244 -7.363 1.546 1.00 0.44 H new ATOM 0 HB3 LEU A 70 6.703 -7.961 2.310 1.00 0.44 H new ATOM 0 HG LEU A 70 5.816 -5.148 2.875 1.00 0.58 H new ATOM 0 HD11 LEU A 70 4.425 -5.964 4.744 1.00 1.16 H new ATOM 0 HD12 LEU A 70 3.788 -6.487 3.166 1.00 1.16 H new ATOM 0 HD13 LEU A 70 4.679 -7.637 4.192 1.00 1.16 H new ATOM 0 HD21 LEU A 70 6.830 -5.634 5.074 1.00 1.01 H new ATOM 0 HD22 LEU A 70 7.179 -7.295 4.538 1.00 1.01 H new ATOM 0 HD23 LEU A 70 7.974 -5.916 3.741 1.00 1.01 H new ATOM 1044 N ASN A 71 9.384 -6.741 1.360 1.00 0.31 N ATOM 1045 CA ASN A 71 10.717 -6.415 1.858 1.00 0.35 C ATOM 1046 C ASN A 71 11.413 -5.415 0.930 1.00 0.38 C ATOM 1047 O ASN A 71 12.174 -4.559 1.382 1.00 0.45 O ATOM 1048 CB ASN A 71 11.558 -7.689 1.984 1.00 0.36 C ATOM 1049 CG ASN A 71 12.905 -7.462 2.656 1.00 1.06 C ATOM 1050 OD1 ASN A 71 13.735 -8.369 2.714 1.00 1.87 O ATOM 1051 ND2 ASN A 71 13.126 -6.261 3.182 1.00 1.53 N ATOM 0 H ASN A 71 9.314 -7.659 0.922 1.00 0.31 H new ATOM 0 HA ASN A 71 10.614 -5.957 2.842 1.00 0.35 H new ATOM 0 HB2 ASN A 71 10.997 -8.431 2.553 1.00 0.36 H new ATOM 0 HB3 ASN A 71 11.722 -8.107 0.991 1.00 0.36 H new ATOM 0 HD21 ASN A 71 14.009 -6.066 3.654 1.00 1.53 H new ATOM 0 HD22 ASN A 71 12.413 -5.535 3.113 1.00 1.53 H new ATOM 1058 N HIS A 72 11.141 -5.526 -0.370 1.00 0.35 N ATOM 1059 CA HIS A 72 11.730 -4.633 -1.362 1.00 0.42 C ATOM 1060 C HIS A 72 11.014 -3.290 -1.376 1.00 0.41 C ATOM 1061 O HIS A 72 11.611 -2.260 -1.683 1.00 0.43 O ATOM 1062 CB HIS A 72 11.697 -5.273 -2.753 1.00 0.51 C ATOM 1063 CG HIS A 72 12.895 -6.115 -3.035 1.00 1.07 C ATOM 1064 ND1 HIS A 72 14.185 -5.690 -2.798 1.00 2.09 N ATOM 1065 CD2 HIS A 72 13.000 -7.360 -3.545 1.00 1.39 C ATOM 1066 CE1 HIS A 72 15.031 -6.639 -3.150 1.00 2.99 C ATOM 1067 NE2 HIS A 72 14.338 -7.663 -3.605 1.00 2.56 N ATOM 0 H HIS A 72 10.514 -6.229 -0.760 1.00 0.35 H new ATOM 0 HA HIS A 72 12.770 -4.462 -1.086 1.00 0.42 H new ATOM 0 HB2 HIS A 72 10.800 -5.885 -2.844 1.00 0.51 H new ATOM 0 HB3 HIS A 72 11.625 -4.489 -3.506 1.00 0.51 H new ATOM 0 HD1 HIS A 72 14.445 -4.783 -2.411 1.00 2.09 H new ATOM 0 HD2 HIS A 72 12.184 -7.999 -3.849 1.00 1.39 H new ATOM 0 HE1 HIS A 72 16.107 -6.586 -3.078 1.00 2.99 H new ATOM 1076 N THR A 73 9.736 -3.304 -1.016 1.00 0.45 N ATOM 1077 CA THR A 73 8.957 -2.079 -0.963 1.00 0.49 C ATOM 1078 C THR A 73 9.455 -1.227 0.191 1.00 0.46 C ATOM 1079 O THR A 73 9.546 -0.003 0.085 1.00 0.47 O ATOM 1080 CB THR A 73 7.474 -2.395 -0.801 1.00 0.58 C ATOM 1081 OG1 THR A 73 7.255 -3.223 0.326 1.00 0.62 O ATOM 1082 CG2 THR A 73 6.881 -3.087 -2.006 1.00 0.66 C ATOM 0 H THR A 73 9.222 -4.147 -0.758 1.00 0.45 H new ATOM 0 HA THR A 73 9.079 -1.529 -1.896 1.00 0.49 H new ATOM 0 HB THR A 73 6.983 -1.430 -0.677 1.00 0.58 H new ATOM 0 HG1 THR A 73 6.698 -2.748 0.978 1.00 0.62 H new ATOM 0 HG21 THR A 73 5.824 -3.285 -1.828 1.00 0.66 H new ATOM 0 HG22 THR A 73 6.988 -2.448 -2.882 1.00 0.66 H new ATOM 0 HG23 THR A 73 7.402 -4.029 -2.178 1.00 0.66 H new ATOM 1090 N GLN A 74 9.814 -1.894 1.284 1.00 0.49 N ATOM 1091 CA GLN A 74 10.347 -1.213 2.451 1.00 0.49 C ATOM 1092 C GLN A 74 11.669 -0.550 2.086 1.00 0.43 C ATOM 1093 O GLN A 74 12.080 0.434 2.699 1.00 0.45 O ATOM 1094 CB GLN A 74 10.555 -2.203 3.601 1.00 0.60 C ATOM 1095 CG GLN A 74 9.265 -2.826 4.108 1.00 0.65 C ATOM 1096 CD GLN A 74 8.273 -1.795 4.611 1.00 0.87 C ATOM 1097 OE1 GLN A 74 8.552 -1.057 5.554 1.00 1.66 O ATOM 1098 NE2 GLN A 74 7.105 -1.741 3.979 1.00 1.05 N ATOM 0 H GLN A 74 9.744 -2.907 1.382 1.00 0.49 H new ATOM 0 HA GLN A 74 9.636 -0.454 2.777 1.00 0.49 H new ATOM 0 HB2 GLN A 74 11.226 -2.996 3.270 1.00 0.60 H new ATOM 0 HB3 GLN A 74 11.050 -1.690 4.426 1.00 0.60 H new ATOM 0 HG2 GLN A 74 8.806 -3.404 3.306 1.00 0.65 H new ATOM 0 HG3 GLN A 74 9.496 -3.524 4.912 1.00 0.65 H new ATOM 0 HE21 GLN A 74 6.916 -2.373 3.201 1.00 1.05 H new ATOM 0 HE22 GLN A 74 6.397 -1.067 4.272 1.00 1.05 H new ATOM 1107 N ARG A 75 12.321 -1.100 1.063 1.00 0.44 N ATOM 1108 CA ARG A 75 13.590 -0.570 0.583 1.00 0.46 C ATOM 1109 C ARG A 75 13.373 0.756 -0.125 1.00 0.43 C ATOM 1110 O ARG A 75 14.283 1.578 -0.211 1.00 0.52 O ATOM 1111 CB ARG A 75 14.260 -1.557 -0.377 1.00 0.59 C ATOM 1112 CG ARG A 75 15.566 -1.046 -0.966 1.00 1.17 C ATOM 1113 CD ARG A 75 16.194 -2.066 -1.900 1.00 1.93 C ATOM 1114 NE ARG A 75 17.452 -1.590 -2.471 1.00 2.51 N ATOM 1115 CZ ARG A 75 18.547 -1.342 -1.756 1.00 2.97 C ATOM 1116 NH1 ARG A 75 18.548 -1.546 -0.444 1.00 3.08 N ATOM 1117 NH2 ARG A 75 19.644 -0.899 -2.354 1.00 3.82 N ATOM 0 H ARG A 75 11.987 -1.916 0.550 1.00 0.44 H new ATOM 0 HA ARG A 75 14.240 -0.417 1.444 1.00 0.46 H new ATOM 0 HB2 ARG A 75 14.451 -2.491 0.151 1.00 0.59 H new ATOM 0 HB3 ARG A 75 13.570 -1.785 -1.189 1.00 0.59 H new ATOM 0 HG2 ARG A 75 15.383 -0.119 -1.509 1.00 1.17 H new ATOM 0 HG3 ARG A 75 16.262 -0.812 -0.161 1.00 1.17 H new ATOM 0 HD2 ARG A 75 16.372 -2.993 -1.356 1.00 1.93 H new ATOM 0 HD3 ARG A 75 15.496 -2.297 -2.705 1.00 1.93 H new ATOM 0 HE ARG A 75 17.494 -1.439 -3.479 1.00 2.51 H new ATOM 0 HH11 ARG A 75 17.708 -1.894 0.019 1.00 3.08 H new ATOM 0 HH12 ARG A 75 19.389 -1.355 0.101 1.00 3.08 H new ATOM 0 HH21 ARG A 75 19.649 -0.748 -3.363 1.00 3.82 H new ATOM 0 HH22 ARG A 75 20.483 -0.709 -1.805 1.00 3.82 H new ATOM 1131 N ILE A 76 12.158 0.960 -0.630 1.00 0.43 N ATOM 1132 CA ILE A 76 11.836 2.193 -1.324 1.00 0.48 C ATOM 1133 C ILE A 76 11.828 3.344 -0.346 1.00 0.49 C ATOM 1134 O ILE A 76 12.095 4.486 -0.708 1.00 0.60 O ATOM 1135 CB ILE A 76 10.482 2.113 -2.056 1.00 0.53 C ATOM 1136 CG1 ILE A 76 10.451 0.848 -2.924 1.00 0.62 C ATOM 1137 CG2 ILE A 76 10.274 3.363 -2.904 1.00 0.64 C ATOM 1138 CD1 ILE A 76 9.304 0.796 -3.910 1.00 1.42 C ATOM 0 H ILE A 76 11.390 0.291 -0.570 1.00 0.43 H new ATOM 0 HA ILE A 76 12.605 2.355 -2.080 1.00 0.48 H new ATOM 0 HB ILE A 76 9.671 2.060 -1.329 1.00 0.53 H new ATOM 0 HG12 ILE A 76 11.390 0.775 -3.473 1.00 0.62 H new ATOM 0 HG13 ILE A 76 10.394 -0.024 -2.272 1.00 0.62 H new ATOM 0 HG21 ILE A 76 9.315 3.299 -3.418 1.00 0.64 H new ATOM 0 HG22 ILE A 76 10.283 4.244 -2.262 1.00 0.64 H new ATOM 0 HG23 ILE A 76 11.075 3.441 -3.639 1.00 0.64 H new ATOM 0 HD11 ILE A 76 9.358 -0.130 -4.482 1.00 1.42 H new ATOM 0 HD12 ILE A 76 8.358 0.835 -3.370 1.00 1.42 H new ATOM 0 HD13 ILE A 76 9.369 1.646 -4.589 1.00 1.42 H new ATOM 1150 N GLU A 77 11.547 3.023 0.906 1.00 0.45 N ATOM 1151 CA GLU A 77 11.529 4.012 1.964 1.00 0.52 C ATOM 1152 C GLU A 77 12.941 4.538 2.205 1.00 0.52 C ATOM 1153 O GLU A 77 13.133 5.670 2.645 1.00 0.71 O ATOM 1154 CB GLU A 77 10.978 3.385 3.240 1.00 0.59 C ATOM 1155 CG GLU A 77 9.550 2.883 3.109 1.00 0.95 C ATOM 1156 CD GLU A 77 9.041 2.242 4.384 1.00 1.15 C ATOM 1157 OE1 GLU A 77 9.656 1.253 4.837 1.00 1.52 O ATOM 1158 OE2 GLU A 77 8.029 2.727 4.931 1.00 1.59 O ATOM 0 H GLU A 77 11.327 2.076 1.213 1.00 0.45 H new ATOM 0 HA GLU A 77 10.889 4.844 1.671 1.00 0.52 H new ATOM 0 HB2 GLU A 77 11.620 2.554 3.532 1.00 0.59 H new ATOM 0 HB3 GLU A 77 11.023 4.120 4.044 1.00 0.59 H new ATOM 0 HG2 GLU A 77 8.899 3.715 2.839 1.00 0.95 H new ATOM 0 HG3 GLU A 77 9.496 2.159 2.296 1.00 0.95 H new ATOM 1165 N LEU A 78 13.919 3.692 1.905 1.00 0.47 N ATOM 1166 CA LEU A 78 15.326 4.035 2.073 1.00 0.56 C ATOM 1167 C LEU A 78 15.872 4.732 0.829 1.00 0.57 C ATOM 1168 O LEU A 78 16.433 5.825 0.912 1.00 0.66 O ATOM 1169 CB LEU A 78 16.143 2.775 2.362 1.00 0.63 C ATOM 1170 CG LEU A 78 15.724 1.996 3.611 1.00 0.71 C ATOM 1171 CD1 LEU A 78 16.516 0.705 3.726 1.00 0.83 C ATOM 1172 CD2 LEU A 78 15.912 2.845 4.862 1.00 0.84 C ATOM 0 H LEU A 78 13.760 2.753 1.540 1.00 0.47 H new ATOM 0 HA LEU A 78 15.409 4.721 2.916 1.00 0.56 H new ATOM 0 HB2 LEU A 78 16.074 2.112 1.500 1.00 0.63 H new ATOM 0 HB3 LEU A 78 17.191 3.057 2.464 1.00 0.63 H new ATOM 0 HG LEU A 78 14.667 1.747 3.518 1.00 0.71 H new ATOM 0 HD11 LEU A 78 16.204 0.165 4.620 1.00 0.83 H new ATOM 0 HD12 LEU A 78 16.334 0.087 2.847 1.00 0.83 H new ATOM 0 HD13 LEU A 78 17.579 0.935 3.794 1.00 0.83 H new ATOM 0 HD21 LEU A 78 15.608 2.273 5.739 1.00 0.84 H new ATOM 0 HD22 LEU A 78 16.961 3.126 4.957 1.00 0.84 H new ATOM 0 HD23 LEU A 78 15.301 3.745 4.786 1.00 0.84 H new ATOM 1184 N GLN A 79 15.712 4.081 -0.322 1.00 0.56 N ATOM 1185 CA GLN A 79 16.197 4.628 -1.589 1.00 0.63 C ATOM 1186 C GLN A 79 15.490 5.935 -1.949 1.00 0.66 C ATOM 1187 O GLN A 79 15.903 6.630 -2.878 1.00 0.84 O ATOM 1188 CB GLN A 79 16.002 3.605 -2.713 1.00 0.67 C ATOM 1189 CG GLN A 79 14.570 3.112 -2.830 1.00 0.93 C ATOM 1190 CD GLN A 79 14.335 2.178 -4.005 1.00 1.22 C ATOM 1191 OE1 GLN A 79 13.244 1.633 -4.164 1.00 1.95 O ATOM 1192 NE2 GLN A 79 15.349 1.992 -4.841 1.00 1.30 N ATOM 0 H GLN A 79 15.251 3.175 -0.404 1.00 0.56 H new ATOM 0 HA GLN A 79 17.259 4.843 -1.470 1.00 0.63 H new ATOM 0 HB2 GLN A 79 16.304 4.053 -3.660 1.00 0.67 H new ATOM 0 HB3 GLN A 79 16.660 2.753 -2.539 1.00 0.67 H new ATOM 0 HG2 GLN A 79 14.297 2.597 -1.909 1.00 0.93 H new ATOM 0 HG3 GLN A 79 13.907 3.972 -2.923 1.00 0.93 H new ATOM 0 HE21 GLN A 79 16.239 2.462 -4.676 1.00 1.30 H new ATOM 0 HE22 GLN A 79 15.238 1.379 -5.649 1.00 1.30 H new ATOM 1201 N GLN A 80 14.429 6.269 -1.219 1.00 0.54 N ATOM 1202 CA GLN A 80 13.679 7.491 -1.477 1.00 0.59 C ATOM 1203 C GLN A 80 14.223 8.656 -0.662 1.00 0.68 C ATOM 1204 O GLN A 80 13.932 9.819 -0.952 1.00 0.78 O ATOM 1205 CB GLN A 80 12.204 7.278 -1.142 1.00 0.54 C ATOM 1206 CG GLN A 80 11.326 7.060 -2.362 1.00 0.99 C ATOM 1207 CD GLN A 80 11.253 8.285 -3.251 1.00 0.98 C ATOM 1208 OE1 GLN A 80 12.256 8.730 -3.806 1.00 1.68 O ATOM 1209 NE2 GLN A 80 10.055 8.842 -3.382 1.00 0.74 N ATOM 0 H GLN A 80 14.071 5.710 -0.445 1.00 0.54 H new ATOM 0 HA GLN A 80 13.785 7.733 -2.535 1.00 0.59 H new ATOM 0 HB2 GLN A 80 12.112 6.417 -0.480 1.00 0.54 H new ATOM 0 HB3 GLN A 80 11.837 8.144 -0.591 1.00 0.54 H new ATOM 0 HG2 GLN A 80 11.713 6.219 -2.938 1.00 0.99 H new ATOM 0 HG3 GLN A 80 10.321 6.789 -2.039 1.00 0.99 H new ATOM 0 HE21 GLN A 80 9.250 8.439 -2.903 1.00 0.74 H new ATOM 0 HE22 GLN A 80 9.940 9.673 -3.962 1.00 0.74 H new ATOM 1218 N GLY A 81 14.999 8.343 0.365 1.00 0.74 N ATOM 1219 CA GLY A 81 15.549 9.373 1.211 1.00 0.88 C ATOM 1220 C GLY A 81 14.541 9.818 2.238 1.00 0.89 C ATOM 1221 O GLY A 81 14.290 11.013 2.394 1.00 0.99 O ATOM 0 H GLY A 81 15.256 7.391 0.625 1.00 0.74 H new ATOM 0 HA2 GLY A 81 16.443 9.000 1.711 1.00 0.88 H new ATOM 0 HA3 GLY A 81 15.855 10.224 0.603 1.00 0.88 H new ATOM 1225 N ARG A 82 13.951 8.849 2.935 1.00 0.95 N ATOM 1226 CA ARG A 82 12.953 9.151 3.949 1.00 1.07 C ATOM 1227 C ARG A 82 13.528 10.126 4.959 1.00 1.09 C ATOM 1228 O ARG A 82 14.732 10.383 4.973 1.00 1.50 O ATOM 1229 CB ARG A 82 12.468 7.878 4.643 1.00 1.34 C ATOM 1230 CG ARG A 82 13.518 7.200 5.503 1.00 1.78 C ATOM 1231 CD ARG A 82 12.967 5.940 6.149 1.00 2.05 C ATOM 1232 NE ARG A 82 13.922 5.341 7.076 1.00 2.68 N ATOM 1233 CZ ARG A 82 13.675 4.242 7.784 1.00 3.14 C ATOM 1234 NH1 ARG A 82 12.504 3.627 7.677 1.00 3.20 N ATOM 1235 NH2 ARG A 82 14.598 3.761 8.604 1.00 3.90 N ATOM 0 H ARG A 82 14.148 7.855 2.815 1.00 0.95 H new ATOM 0 HA ARG A 82 12.092 9.609 3.462 1.00 1.07 H new ATOM 0 HB2 ARG A 82 11.607 8.122 5.265 1.00 1.34 H new ATOM 0 HB3 ARG A 82 12.124 7.173 3.886 1.00 1.34 H new ATOM 0 HG2 ARG A 82 14.386 6.950 4.893 1.00 1.78 H new ATOM 0 HG3 ARG A 82 13.860 7.889 6.276 1.00 1.78 H new ATOM 0 HD2 ARG A 82 12.046 6.178 6.680 1.00 2.05 H new ATOM 0 HD3 ARG A 82 12.711 5.217 5.374 1.00 2.05 H new ATOM 0 HE ARG A 82 14.831 5.791 7.187 1.00 2.68 H new ATOM 0 HH11 ARG A 82 11.789 3.997 7.050 1.00 3.20 H new ATOM 0 HH12 ARG A 82 12.319 2.785 8.222 1.00 3.20 H new ATOM 0 HH21 ARG A 82 15.498 4.233 8.692 1.00 3.90 H new ATOM 0 HH22 ARG A 82 14.409 2.918 9.147 1.00 3.90 H new ATOM 1249 N VAL A 83 12.665 10.694 5.775 1.00 1.01 N ATOM 1250 CA VAL A 83 13.097 11.674 6.752 1.00 1.24 C ATOM 1251 C VAL A 83 12.862 11.193 8.179 1.00 1.17 C ATOM 1252 O VAL A 83 11.739 10.859 8.561 1.00 1.65 O ATOM 1253 CB VAL A 83 12.374 13.001 6.497 1.00 1.94 C ATOM 1254 CG1 VAL A 83 13.003 14.125 7.302 1.00 2.77 C ATOM 1255 CG2 VAL A 83 12.392 13.305 5.003 1.00 2.45 C ATOM 0 H VAL A 83 11.664 10.496 5.782 1.00 1.01 H new ATOM 0 HA VAL A 83 14.171 11.820 6.640 1.00 1.24 H new ATOM 0 HB VAL A 83 11.338 12.916 6.824 1.00 1.94 H new ATOM 0 HG11 VAL A 83 12.472 15.056 7.104 1.00 2.77 H new ATOM 0 HG12 VAL A 83 12.940 13.891 8.365 1.00 2.77 H new ATOM 0 HG13 VAL A 83 14.049 14.236 7.016 1.00 2.77 H new ATOM 0 HG21 VAL A 83 11.879 14.248 4.817 1.00 2.45 H new ATOM 0 HG22 VAL A 83 13.424 13.380 4.659 1.00 2.45 H new ATOM 0 HG23 VAL A 83 11.887 12.505 4.463 1.00 2.45 H new ATOM 1265 N ARG A 84 13.941 11.153 8.955 1.00 1.26 N ATOM 1266 CA ARG A 84 13.889 10.705 10.341 1.00 1.64 C ATOM 1267 C ARG A 84 12.895 11.517 11.164 1.00 1.64 C ATOM 1268 O ARG A 84 13.203 12.614 11.631 1.00 2.28 O ATOM 1269 CB ARG A 84 15.280 10.775 10.981 1.00 2.64 C ATOM 1270 CG ARG A 84 16.200 9.618 10.607 1.00 3.46 C ATOM 1271 CD ARG A 84 16.538 9.606 9.124 1.00 4.08 C ATOM 1272 NE ARG A 84 17.455 8.519 8.777 1.00 4.79 N ATOM 1273 CZ ARG A 84 18.697 8.419 9.246 1.00 5.36 C ATOM 1274 NH1 ARG A 84 19.183 9.346 10.062 1.00 5.36 N ATOM 1275 NH2 ARG A 84 19.458 7.391 8.893 1.00 6.26 N ATOM 0 H ARG A 84 14.872 11.429 8.642 1.00 1.26 H new ATOM 0 HA ARG A 84 13.548 9.670 10.334 1.00 1.64 H new ATOM 0 HB2 ARG A 84 15.755 11.711 10.689 1.00 2.64 H new ATOM 0 HB3 ARG A 84 15.168 10.799 12.065 1.00 2.64 H new ATOM 0 HG2 ARG A 84 17.121 9.687 11.187 1.00 3.46 H new ATOM 0 HG3 ARG A 84 15.723 8.676 10.876 1.00 3.46 H new ATOM 0 HD2 ARG A 84 15.620 9.505 8.544 1.00 4.08 H new ATOM 0 HD3 ARG A 84 16.986 10.560 8.847 1.00 4.08 H new ATOM 0 HE ARG A 84 17.123 7.796 8.139 1.00 4.79 H new ATOM 0 HH11 ARG A 84 18.604 10.141 10.333 1.00 5.36 H new ATOM 0 HH12 ARG A 84 20.135 9.264 10.418 1.00 5.36 H new ATOM 0 HH21 ARG A 84 19.091 6.678 8.263 1.00 6.26 H new ATOM 0 HH22 ARG A 84 20.410 7.314 9.252 1.00 6.26 H new ATOM 1289 N LYS A 85 11.709 10.952 11.347 1.00 1.79 N ATOM 1290 CA LYS A 85 10.656 11.587 12.125 1.00 2.53 C ATOM 1291 C LYS A 85 9.920 10.525 12.935 1.00 2.61 C ATOM 1292 O LYS A 85 9.983 9.342 12.601 1.00 3.08 O ATOM 1293 CB LYS A 85 9.680 12.327 11.204 1.00 3.13 C ATOM 1294 CG LYS A 85 8.586 13.083 11.944 1.00 3.58 C ATOM 1295 CD LYS A 85 9.162 14.180 12.827 1.00 4.39 C ATOM 1296 CE LYS A 85 8.064 14.955 13.540 1.00 5.02 C ATOM 1297 NZ LYS A 85 7.139 15.615 12.579 1.00 5.50 N ATOM 0 H LYS A 85 11.451 10.044 10.961 1.00 1.79 H new ATOM 0 HA LYS A 85 11.100 12.316 12.803 1.00 2.53 H new ATOM 0 HB2 LYS A 85 10.240 13.030 10.587 1.00 3.13 H new ATOM 0 HB3 LYS A 85 9.217 11.608 10.528 1.00 3.13 H new ATOM 0 HG2 LYS A 85 7.894 13.520 11.224 1.00 3.58 H new ATOM 0 HG3 LYS A 85 8.012 12.387 12.555 1.00 3.58 H new ATOM 0 HD2 LYS A 85 9.835 13.740 13.563 1.00 4.39 H new ATOM 0 HD3 LYS A 85 9.756 14.863 12.220 1.00 4.39 H new ATOM 0 HE2 LYS A 85 7.499 14.278 14.181 1.00 5.02 H new ATOM 0 HE3 LYS A 85 8.513 15.708 14.188 1.00 5.02 H new ATOM 0 HZ1 LYS A 85 6.771 16.493 12.998 1.00 5.50 H new ATOM 0 HZ2 LYS A 85 7.651 15.838 11.702 1.00 5.50 H new ATOM 0 HZ3 LYS A 85 6.347 14.976 12.364 1.00 5.50 H new ATOM 1311 N ALA A 86 9.236 10.937 13.998 1.00 2.48 N ATOM 1312 CA ALA A 86 8.511 9.985 14.833 1.00 2.58 C ATOM 1313 C ALA A 86 7.621 9.091 13.976 1.00 2.00 C ATOM 1314 O ALA A 86 6.650 9.554 13.379 1.00 1.95 O ATOM 1315 CB ALA A 86 7.684 10.719 15.877 1.00 3.19 C ATOM 0 H ALA A 86 9.168 11.909 14.299 1.00 2.48 H new ATOM 0 HA ALA A 86 9.236 9.354 15.348 1.00 2.58 H new ATOM 0 HB1 ALA A 86 7.149 9.995 16.492 1.00 3.19 H new ATOM 0 HB2 ALA A 86 8.342 11.316 16.509 1.00 3.19 H new ATOM 0 HB3 ALA A 86 6.967 11.373 15.380 1.00 3.19 H new ATOM 1321 N GLU A 87 7.963 7.807 13.919 1.00 2.01 N ATOM 1322 CA GLU A 87 7.200 6.843 13.136 1.00 1.67 C ATOM 1323 C GLU A 87 6.747 5.669 13.993 1.00 1.90 C ATOM 1324 O GLU A 87 7.472 4.685 14.141 1.00 2.39 O ATOM 1325 CB GLU A 87 8.036 6.335 11.957 1.00 2.04 C ATOM 1326 CG GLU A 87 7.329 5.278 11.120 1.00 2.47 C ATOM 1327 CD GLU A 87 8.208 4.723 10.016 1.00 3.23 C ATOM 1328 OE1 GLU A 87 8.639 5.512 9.148 1.00 3.80 O ATOM 1329 OE2 GLU A 87 8.465 3.503 10.020 1.00 3.66 O ATOM 0 H GLU A 87 8.766 7.410 14.407 1.00 2.01 H new ATOM 0 HA GLU A 87 6.313 7.350 12.756 1.00 1.67 H new ATOM 0 HB2 GLU A 87 8.297 7.178 11.317 1.00 2.04 H new ATOM 0 HB3 GLU A 87 8.970 5.921 12.336 1.00 2.04 H new ATOM 0 HG2 GLU A 87 7.007 4.462 11.768 1.00 2.47 H new ATOM 0 HG3 GLU A 87 6.430 5.710 10.681 1.00 2.47 H new ATOM 1336 N ARG A 88 5.545 5.765 14.550 1.00 1.97 N ATOM 1337 CA ARG A 88 5.015 4.688 15.377 1.00 2.47 C ATOM 1338 C ARG A 88 3.980 3.885 14.596 1.00 2.28 C ATOM 1339 O ARG A 88 4.121 2.673 14.423 1.00 2.54 O ATOM 1340 CB ARG A 88 4.396 5.250 16.658 1.00 2.97 C ATOM 1341 CG ARG A 88 3.980 4.184 17.665 1.00 3.30 C ATOM 1342 CD ARG A 88 5.178 3.423 18.221 1.00 3.95 C ATOM 1343 NE ARG A 88 5.804 2.563 17.221 1.00 4.47 N ATOM 1344 CZ ARG A 88 6.898 1.840 17.447 1.00 5.01 C ATOM 1345 NH1 ARG A 88 7.490 1.881 18.632 1.00 5.17 N ATOM 1346 NH2 ARG A 88 7.400 1.076 16.487 1.00 5.74 N ATOM 0 H ARG A 88 4.925 6.568 14.446 1.00 1.97 H new ATOM 0 HA ARG A 88 5.836 4.027 15.653 1.00 2.47 H new ATOM 0 HB2 ARG A 88 5.112 5.922 17.131 1.00 2.97 H new ATOM 0 HB3 ARG A 88 3.523 5.848 16.396 1.00 2.97 H new ATOM 0 HG2 ARG A 88 3.436 4.653 18.485 1.00 3.30 H new ATOM 0 HG3 ARG A 88 3.295 3.483 17.188 1.00 3.30 H new ATOM 0 HD2 ARG A 88 5.914 4.134 18.597 1.00 3.95 H new ATOM 0 HD3 ARG A 88 4.858 2.817 19.069 1.00 3.95 H new ATOM 0 HE ARG A 88 5.378 2.514 16.296 1.00 4.47 H new ATOM 0 HH11 ARG A 88 7.107 2.468 19.373 1.00 5.17 H new ATOM 0 HH12 ARG A 88 8.328 1.326 18.803 1.00 5.17 H new ATOM 0 HH21 ARG A 88 6.948 1.042 15.573 1.00 5.74 H new ATOM 0 HH22 ARG A 88 8.239 0.522 16.662 1.00 5.74 H new ATOM 1360 N TRP A 89 2.947 4.570 14.114 1.00 1.98 N ATOM 1361 CA TRP A 89 1.897 3.922 13.338 1.00 1.91 C ATOM 1362 C TRP A 89 1.773 4.550 11.948 1.00 1.60 C ATOM 1363 O TRP A 89 1.312 3.905 11.006 1.00 1.71 O ATOM 1364 CB TRP A 89 0.551 4.014 14.060 1.00 2.11 C ATOM 1365 CG TRP A 89 0.568 3.450 15.449 1.00 2.00 C ATOM 1366 CD1 TRP A 89 0.461 2.136 15.803 1.00 2.28 C ATOM 1367 CD2 TRP A 89 0.674 4.188 16.673 1.00 2.29 C ATOM 1368 NE1 TRP A 89 0.510 2.010 17.169 1.00 2.69 N ATOM 1369 CE2 TRP A 89 0.638 3.255 17.726 1.00 2.74 C ATOM 1370 CE3 TRP A 89 0.803 5.546 16.979 1.00 2.65 C ATOM 1371 CZ2 TRP A 89 0.724 3.639 19.063 1.00 3.44 C ATOM 1372 CZ3 TRP A 89 0.888 5.924 18.306 1.00 3.33 C ATOM 1373 CH2 TRP A 89 0.847 4.973 19.333 1.00 3.70 C ATOM 0 H TRP A 89 2.816 5.573 14.247 1.00 1.98 H new ATOM 0 HA TRP A 89 2.172 2.873 13.228 1.00 1.91 H new ATOM 0 HB2 TRP A 89 0.245 5.059 14.106 1.00 2.11 H new ATOM 0 HB3 TRP A 89 -0.202 3.487 13.473 1.00 2.11 H new ATOM 0 HD1 TRP A 89 0.353 1.315 15.109 1.00 2.28 H new ATOM 0 HE1 TRP A 89 0.459 1.132 17.685 1.00 2.69 H new ATOM 0 HE3 TRP A 89 0.836 6.286 16.193 1.00 2.65 H new ATOM 0 HZ2 TRP A 89 0.694 2.908 19.858 1.00 3.44 H new ATOM 0 HZ3 TRP A 89 0.988 6.970 18.555 1.00 3.33 H new ATOM 0 HH2 TRP A 89 0.914 5.301 20.360 1.00 3.70 H new ATOM 1384 N GLY A 90 2.161 5.819 11.836 1.00 1.35 N ATOM 1385 CA GLY A 90 2.064 6.522 10.569 1.00 1.15 C ATOM 1386 C GLY A 90 3.240 6.282 9.637 1.00 1.08 C ATOM 1387 O GLY A 90 4.165 5.540 9.971 1.00 1.29 O ATOM 0 H GLY A 90 2.542 6.373 12.603 1.00 1.35 H new ATOM 0 HA2 GLY A 90 1.147 6.217 10.065 1.00 1.15 H new ATOM 0 HA3 GLY A 90 1.981 7.591 10.764 1.00 1.15 H new ATOM 1391 N PRO A 91 3.216 6.907 8.443 1.00 0.96 N ATOM 1392 CA PRO A 91 4.265 6.769 7.429 1.00 1.07 C ATOM 1393 C PRO A 91 5.481 7.654 7.699 1.00 1.17 C ATOM 1394 O PRO A 91 6.619 7.213 7.552 1.00 1.60 O ATOM 1395 CB PRO A 91 3.570 7.232 6.130 1.00 1.09 C ATOM 1396 CG PRO A 91 2.149 7.510 6.498 1.00 1.09 C ATOM 1397 CD PRO A 91 2.151 7.789 7.968 1.00 0.91 C ATOM 0 HA PRO A 91 4.652 5.751 7.400 1.00 1.07 H new ATOM 0 HB2 PRO A 91 4.050 8.124 5.728 1.00 1.09 H new ATOM 0 HB3 PRO A 91 3.630 6.463 5.360 1.00 1.09 H new ATOM 0 HG2 PRO A 91 1.761 8.362 5.940 1.00 1.09 H new ATOM 0 HG3 PRO A 91 1.511 6.658 6.263 1.00 1.09 H new ATOM 0 HD2 PRO A 91 2.362 8.836 8.184 1.00 0.91 H new ATOM 0 HD3 PRO A 91 1.191 7.555 8.429 1.00 0.91 H new ATOM 1405 N ARG A 92 5.224 8.911 8.064 1.00 0.93 N ATOM 1406 CA ARG A 92 6.286 9.885 8.327 1.00 1.03 C ATOM 1407 C ARG A 92 6.998 10.259 7.020 1.00 1.13 C ATOM 1408 O ARG A 92 7.911 11.082 7.006 1.00 1.95 O ATOM 1409 CB ARG A 92 7.244 9.359 9.421 1.00 1.21 C ATOM 1410 CG ARG A 92 8.731 9.488 9.123 1.00 1.04 C ATOM 1411 CD ARG A 92 9.200 8.367 8.216 1.00 1.71 C ATOM 1412 NE ARG A 92 10.653 8.327 8.082 1.00 2.57 N ATOM 1413 CZ ARG A 92 11.480 8.016 9.077 1.00 3.53 C ATOM 1414 NH1 ARG A 92 11.000 7.702 10.273 1.00 3.96 N ATOM 1415 NH2 ARG A 92 12.790 8.011 8.870 1.00 4.39 N ATOM 0 H ARG A 92 4.281 9.281 8.185 1.00 0.93 H new ATOM 0 HA ARG A 92 5.853 10.805 8.718 1.00 1.03 H new ATOM 0 HB2 ARG A 92 7.032 9.891 10.348 1.00 1.21 H new ATOM 0 HB3 ARG A 92 7.019 8.307 9.598 1.00 1.21 H new ATOM 0 HG2 ARG A 92 8.929 10.450 8.651 1.00 1.04 H new ATOM 0 HG3 ARG A 92 9.296 9.468 10.055 1.00 1.04 H new ATOM 0 HD2 ARG A 92 8.848 7.414 8.610 1.00 1.71 H new ATOM 0 HD3 ARG A 92 8.751 8.489 7.230 1.00 1.71 H new ATOM 0 HE ARG A 92 11.058 8.550 7.173 1.00 2.57 H new ATOM 0 HH11 ARG A 92 9.993 7.698 10.433 1.00 3.96 H new ATOM 0 HH12 ARG A 92 11.638 7.464 11.032 1.00 3.96 H new ATOM 0 HH21 ARG A 92 13.162 8.245 7.950 1.00 4.39 H new ATOM 0 HH22 ARG A 92 13.426 7.773 9.631 1.00 4.39 H new ATOM 1429 N THR A 93 6.513 9.661 5.925 1.00 0.94 N ATOM 1430 CA THR A 93 7.010 9.889 4.556 1.00 0.91 C ATOM 1431 C THR A 93 6.476 8.807 3.621 1.00 0.83 C ATOM 1432 O THR A 93 5.381 8.927 3.078 1.00 1.08 O ATOM 1433 CB THR A 93 8.543 9.920 4.467 1.00 1.02 C ATOM 1434 OG1 THR A 93 9.132 9.103 5.458 1.00 1.52 O ATOM 1435 CG2 THR A 93 9.141 11.308 4.575 1.00 1.47 C ATOM 0 H THR A 93 5.746 8.989 5.963 1.00 0.94 H new ATOM 0 HA THR A 93 6.647 10.872 4.255 1.00 0.91 H new ATOM 0 HB THR A 93 8.767 9.539 3.471 1.00 1.02 H new ATOM 0 HG1 THR A 93 9.824 9.610 5.932 1.00 1.52 H new ATOM 0 HG21 THR A 93 10.227 11.243 4.503 1.00 1.47 H new ATOM 0 HG22 THR A 93 8.760 11.932 3.766 1.00 1.47 H new ATOM 0 HG23 THR A 93 8.867 11.749 5.533 1.00 1.47 H new ATOM 1443 N LEU A 94 7.258 7.745 3.451 1.00 0.68 N ATOM 1444 CA LEU A 94 6.877 6.627 2.595 1.00 0.64 C ATOM 1445 C LEU A 94 6.537 5.416 3.452 1.00 0.56 C ATOM 1446 O LEU A 94 7.063 5.255 4.552 1.00 0.71 O ATOM 1447 CB LEU A 94 8.022 6.294 1.637 1.00 0.72 C ATOM 1448 CG LEU A 94 7.701 5.242 0.580 1.00 1.00 C ATOM 1449 CD1 LEU A 94 6.642 5.760 -0.378 1.00 1.44 C ATOM 1450 CD2 LEU A 94 8.961 4.854 -0.178 1.00 1.87 C ATOM 0 H LEU A 94 8.168 7.636 3.900 1.00 0.68 H new ATOM 0 HA LEU A 94 5.999 6.903 2.011 1.00 0.64 H new ATOM 0 HB2 LEU A 94 8.330 7.210 1.133 1.00 0.72 H new ATOM 0 HB3 LEU A 94 8.875 5.950 2.222 1.00 0.72 H new ATOM 0 HG LEU A 94 7.310 4.355 1.079 1.00 1.00 H new ATOM 0 HD11 LEU A 94 6.424 4.998 -1.126 1.00 1.44 H new ATOM 0 HD12 LEU A 94 5.733 5.995 0.176 1.00 1.44 H new ATOM 0 HD13 LEU A 94 7.008 6.660 -0.873 1.00 1.44 H new ATOM 0 HD21 LEU A 94 8.717 4.103 -0.929 1.00 1.87 H new ATOM 0 HD22 LEU A 94 9.377 5.735 -0.668 1.00 1.87 H new ATOM 0 HD23 LEU A 94 9.694 4.446 0.519 1.00 1.87 H new ATOM 1462 N ASP A 95 5.650 4.572 2.946 1.00 0.52 N ATOM 1463 CA ASP A 95 5.233 3.383 3.672 1.00 0.53 C ATOM 1464 C ASP A 95 4.411 2.472 2.774 1.00 0.46 C ATOM 1465 O ASP A 95 3.187 2.588 2.716 1.00 0.59 O ATOM 1466 CB ASP A 95 4.421 3.774 4.911 1.00 0.73 C ATOM 1467 CG ASP A 95 4.028 2.575 5.754 1.00 1.16 C ATOM 1468 OD1 ASP A 95 3.293 1.703 5.246 1.00 1.64 O ATOM 1469 OD2 ASP A 95 4.456 2.509 6.926 1.00 1.72 O ATOM 0 H ASP A 95 5.205 4.689 2.035 1.00 0.52 H new ATOM 0 HA ASP A 95 6.125 2.844 3.992 1.00 0.53 H new ATOM 0 HB2 ASP A 95 5.004 4.466 5.519 1.00 0.73 H new ATOM 0 HB3 ASP A 95 3.521 4.304 4.599 1.00 0.73 H new ATOM 1474 N LEU A 96 5.085 1.572 2.076 1.00 0.38 N ATOM 1475 CA LEU A 96 4.402 0.648 1.185 1.00 0.36 C ATOM 1476 C LEU A 96 4.708 -0.797 1.560 1.00 0.40 C ATOM 1477 O LEU A 96 5.824 -1.280 1.374 1.00 0.53 O ATOM 1478 CB LEU A 96 4.773 0.921 -0.281 1.00 0.43 C ATOM 1479 CG LEU A 96 6.258 0.807 -0.635 1.00 0.52 C ATOM 1480 CD1 LEU A 96 6.442 0.831 -2.145 1.00 0.97 C ATOM 1481 CD2 LEU A 96 7.059 1.930 0.005 1.00 0.89 C ATOM 0 H LEU A 96 6.098 1.462 2.109 1.00 0.38 H new ATOM 0 HA LEU A 96 3.329 0.807 1.297 1.00 0.36 H new ATOM 0 HB2 LEU A 96 4.217 0.226 -0.910 1.00 0.43 H new ATOM 0 HB3 LEU A 96 4.436 1.925 -0.539 1.00 0.43 H new ATOM 0 HG LEU A 96 6.627 -0.142 -0.245 1.00 0.52 H new ATOM 0 HD11 LEU A 96 7.502 0.749 -2.384 1.00 0.97 H new ATOM 0 HD12 LEU A 96 5.904 -0.006 -2.590 1.00 0.97 H new ATOM 0 HD13 LEU A 96 6.051 1.767 -2.544 1.00 0.97 H new ATOM 0 HD21 LEU A 96 8.110 1.825 -0.263 1.00 0.89 H new ATOM 0 HD22 LEU A 96 6.688 2.891 -0.352 1.00 0.89 H new ATOM 0 HD23 LEU A 96 6.954 1.880 1.089 1.00 0.89 H new ATOM 1493 N ASP A 97 3.703 -1.480 2.092 1.00 0.38 N ATOM 1494 CA ASP A 97 3.845 -2.871 2.497 1.00 0.44 C ATOM 1495 C ASP A 97 2.732 -3.711 1.893 1.00 0.39 C ATOM 1496 O ASP A 97 1.632 -3.212 1.654 1.00 0.40 O ATOM 1497 CB ASP A 97 3.817 -2.994 4.023 1.00 0.55 C ATOM 1498 CG ASP A 97 2.537 -2.456 4.630 1.00 1.14 C ATOM 1499 OD1 ASP A 97 2.215 -1.273 4.391 1.00 1.45 O ATOM 1500 OD2 ASP A 97 1.861 -3.214 5.356 1.00 1.93 O ATOM 0 H ASP A 97 2.775 -1.089 2.254 1.00 0.38 H new ATOM 0 HA ASP A 97 4.806 -3.236 2.134 1.00 0.44 H new ATOM 0 HB2 ASP A 97 3.934 -4.041 4.301 1.00 0.55 H new ATOM 0 HB3 ASP A 97 4.667 -2.456 4.442 1.00 0.55 H new ATOM 1505 N ILE A 98 3.021 -4.983 1.646 1.00 0.39 N ATOM 1506 CA ILE A 98 2.030 -5.878 1.069 1.00 0.36 C ATOM 1507 C ILE A 98 0.738 -5.862 1.869 1.00 0.35 C ATOM 1508 O ILE A 98 0.701 -6.252 3.037 1.00 0.53 O ATOM 1509 CB ILE A 98 2.562 -7.325 0.941 1.00 0.36 C ATOM 1510 CG1 ILE A 98 3.298 -7.496 -0.386 1.00 0.48 C ATOM 1511 CG2 ILE A 98 1.432 -8.345 1.055 1.00 0.44 C ATOM 1512 CD1 ILE A 98 2.455 -7.158 -1.600 1.00 1.20 C ATOM 0 H ILE A 98 3.926 -5.414 1.835 1.00 0.39 H new ATOM 0 HA ILE A 98 1.821 -5.508 0.065 1.00 0.36 H new ATOM 0 HB ILE A 98 3.257 -7.504 1.762 1.00 0.36 H new ATOM 0 HG12 ILE A 98 4.185 -6.863 -0.383 1.00 0.48 H new ATOM 0 HG13 ILE A 98 3.643 -8.527 -0.470 1.00 0.48 H new ATOM 0 HG21 ILE A 98 1.840 -9.352 0.961 1.00 0.44 H new ATOM 0 HG22 ILE A 98 0.944 -8.240 2.024 1.00 0.44 H new ATOM 0 HG23 ILE A 98 0.705 -8.172 0.262 1.00 0.44 H new ATOM 0 HD11 ILE A 98 3.045 -7.303 -2.505 1.00 1.20 H new ATOM 0 HD12 ILE A 98 1.581 -7.809 -1.629 1.00 1.20 H new ATOM 0 HD13 ILE A 98 2.132 -6.119 -1.541 1.00 1.20 H new ATOM 1524 N MET A 99 -0.321 -5.409 1.216 1.00 0.32 N ATOM 1525 CA MET A 99 -1.638 -5.336 1.828 1.00 0.36 C ATOM 1526 C MET A 99 -2.484 -6.511 1.368 1.00 0.33 C ATOM 1527 O MET A 99 -3.379 -6.971 2.071 1.00 0.37 O ATOM 1528 CB MET A 99 -2.328 -4.021 1.453 1.00 0.43 C ATOM 1529 CG MET A 99 -1.586 -2.770 1.910 1.00 0.68 C ATOM 1530 SD MET A 99 -1.848 -2.377 3.654 1.00 1.56 S ATOM 1531 CE MET A 99 -0.911 -3.666 4.468 1.00 2.37 C ATOM 0 H MET A 99 -0.292 -5.083 0.250 1.00 0.32 H new ATOM 0 HA MET A 99 -1.524 -5.375 2.911 1.00 0.36 H new ATOM 0 HB2 MET A 99 -2.448 -3.983 0.370 1.00 0.43 H new ATOM 0 HB3 MET A 99 -3.329 -4.014 1.885 1.00 0.43 H new ATOM 0 HG2 MET A 99 -0.519 -2.904 1.732 1.00 0.68 H new ATOM 0 HG3 MET A 99 -1.907 -1.924 1.302 1.00 0.68 H new ATOM 0 HE1 MET A 99 -0.564 -3.307 5.437 1.00 2.37 H new ATOM 0 HE2 MET A 99 -1.545 -4.541 4.611 1.00 2.37 H new ATOM 0 HE3 MET A 99 -0.053 -3.936 3.852 1.00 2.37 H new ATOM 1541 N LEU A 100 -2.183 -6.997 0.174 1.00 0.30 N ATOM 1542 CA LEU A 100 -2.901 -8.118 -0.396 1.00 0.30 C ATOM 1543 C LEU A 100 -2.033 -8.810 -1.434 1.00 0.31 C ATOM 1544 O LEU A 100 -1.304 -8.153 -2.174 1.00 0.58 O ATOM 1545 CB LEU A 100 -4.215 -7.639 -1.028 1.00 0.30 C ATOM 1546 CG LEU A 100 -5.484 -8.125 -0.327 1.00 0.37 C ATOM 1547 CD1 LEU A 100 -6.722 -7.611 -1.045 1.00 0.40 C ATOM 1548 CD2 LEU A 100 -5.506 -9.643 -0.252 1.00 0.43 C ATOM 0 H LEU A 100 -1.441 -6.627 -0.420 1.00 0.30 H new ATOM 0 HA LEU A 100 -3.139 -8.830 0.395 1.00 0.30 H new ATOM 0 HB2 LEU A 100 -4.219 -6.549 -1.039 1.00 0.30 H new ATOM 0 HB3 LEU A 100 -4.243 -7.969 -2.067 1.00 0.30 H new ATOM 0 HG LEU A 100 -5.486 -7.730 0.689 1.00 0.37 H new ATOM 0 HD11 LEU A 100 -7.615 -7.967 -0.531 1.00 0.40 H new ATOM 0 HD12 LEU A 100 -6.715 -6.521 -1.047 1.00 0.40 H new ATOM 0 HD13 LEU A 100 -6.725 -7.976 -2.072 1.00 0.40 H new ATOM 0 HD21 LEU A 100 -6.417 -9.969 0.250 1.00 0.43 H new ATOM 0 HD22 LEU A 100 -5.479 -10.058 -1.260 1.00 0.43 H new ATOM 0 HD23 LEU A 100 -4.638 -9.992 0.307 1.00 0.43 H new ATOM 1560 N PHE A 101 -2.099 -10.133 -1.480 1.00 0.36 N ATOM 1561 CA PHE A 101 -1.305 -10.882 -2.438 1.00 0.36 C ATOM 1562 C PHE A 101 -1.954 -12.223 -2.758 1.00 0.38 C ATOM 1563 O PHE A 101 -1.690 -13.224 -2.090 1.00 0.88 O ATOM 1564 CB PHE A 101 0.116 -11.100 -1.920 1.00 0.46 C ATOM 1565 CG PHE A 101 1.068 -11.455 -3.020 1.00 0.70 C ATOM 1566 CD1 PHE A 101 1.194 -12.766 -3.444 1.00 1.10 C ATOM 1567 CD2 PHE A 101 1.819 -10.475 -3.645 1.00 1.13 C ATOM 1568 CE1 PHE A 101 2.050 -13.094 -4.478 1.00 1.59 C ATOM 1569 CE2 PHE A 101 2.679 -10.797 -4.673 1.00 1.59 C ATOM 1570 CZ PHE A 101 2.793 -12.108 -5.094 1.00 1.75 C ATOM 0 H PHE A 101 -2.687 -10.703 -0.872 1.00 0.36 H new ATOM 0 HA PHE A 101 -1.255 -10.293 -3.354 1.00 0.36 H new ATOM 0 HB2 PHE A 101 0.462 -10.195 -1.420 1.00 0.46 H new ATOM 0 HB3 PHE A 101 0.112 -11.895 -1.174 1.00 0.46 H new ATOM 0 HD1 PHE A 101 0.617 -13.541 -2.962 1.00 1.10 H new ATOM 0 HD2 PHE A 101 1.730 -9.448 -3.324 1.00 1.13 H new ATOM 0 HE1 PHE A 101 2.137 -14.120 -4.803 1.00 1.59 H new ATOM 0 HE2 PHE A 101 3.264 -10.024 -5.150 1.00 1.59 H new ATOM 0 HZ PHE A 101 3.462 -12.360 -5.903 1.00 1.75 H new ATOM 1580 N GLY A 102 -2.801 -12.238 -3.784 1.00 0.58 N ATOM 1581 CA GLY A 102 -3.470 -13.463 -4.179 1.00 0.60 C ATOM 1582 C GLY A 102 -4.222 -14.109 -3.030 1.00 0.73 C ATOM 1583 O GLY A 102 -5.377 -13.776 -2.768 1.00 1.49 O ATOM 0 H GLY A 102 -3.035 -11.422 -4.349 1.00 0.58 H new ATOM 0 HA2 GLY A 102 -4.166 -13.248 -4.990 1.00 0.60 H new ATOM 0 HA3 GLY A 102 -2.734 -14.166 -4.569 1.00 0.60 H new ATOM 1587 N ASN A 103 -3.558 -15.034 -2.344 1.00 0.56 N ATOM 1588 CA ASN A 103 -4.165 -15.733 -1.215 1.00 0.58 C ATOM 1589 C ASN A 103 -3.107 -16.212 -0.222 1.00 0.52 C ATOM 1590 O ASN A 103 -3.423 -16.931 0.725 1.00 0.67 O ATOM 1591 CB ASN A 103 -4.952 -16.944 -1.705 1.00 0.76 C ATOM 1592 CG ASN A 103 -4.065 -17.926 -2.435 1.00 0.85 C ATOM 1593 OD1 ASN A 103 -3.890 -17.843 -3.652 1.00 1.55 O ATOM 1594 ND2 ASN A 103 -3.463 -18.836 -1.682 1.00 0.90 N ATOM 0 H ASN A 103 -2.600 -15.317 -2.549 1.00 0.56 H new ATOM 0 HA ASN A 103 -4.829 -15.028 -0.716 1.00 0.58 H new ATOM 0 HB2 ASN A 103 -5.423 -17.440 -0.856 1.00 0.76 H new ATOM 0 HB3 ASN A 103 -5.753 -16.615 -2.367 1.00 0.76 H new ATOM 0 HD21 ASN A 103 -2.823 -19.507 -2.107 1.00 0.90 H new ATOM 0 HD22 ASN A 103 -3.640 -18.865 -0.678 1.00 0.90 H new ATOM 1601 N GLU A 104 -1.853 -15.832 -0.455 1.00 0.43 N ATOM 1602 CA GLU A 104 -0.757 -16.250 0.413 1.00 0.42 C ATOM 1603 C GLU A 104 -1.073 -15.983 1.876 1.00 0.42 C ATOM 1604 O GLU A 104 -1.793 -15.040 2.204 1.00 0.58 O ATOM 1605 CB GLU A 104 0.530 -15.519 0.057 1.00 0.51 C ATOM 1606 CG GLU A 104 0.747 -15.331 -1.428 1.00 0.56 C ATOM 1607 CD GLU A 104 0.742 -16.636 -2.206 1.00 1.57 C ATOM 1608 OE1 GLU A 104 -0.317 -17.301 -2.235 1.00 2.29 O ATOM 1609 OE2 GLU A 104 1.789 -16.993 -2.783 1.00 2.14 O ATOM 0 H GLU A 104 -1.572 -15.238 -1.235 1.00 0.43 H new ATOM 0 HA GLU A 104 -0.628 -17.322 0.261 1.00 0.42 H new ATOM 0 HB2 GLU A 104 0.524 -14.541 0.538 1.00 0.51 H new ATOM 0 HB3 GLU A 104 1.374 -16.072 0.469 1.00 0.51 H new ATOM 0 HG2 GLU A 104 -0.032 -14.678 -1.822 1.00 0.56 H new ATOM 0 HG3 GLU A 104 1.699 -14.824 -1.588 1.00 0.56 H new ATOM 1616 N VAL A 105 -0.504 -16.803 2.748 1.00 0.50 N ATOM 1617 CA VAL A 105 -0.687 -16.651 4.183 1.00 0.56 C ATOM 1618 C VAL A 105 0.550 -17.154 4.916 1.00 0.61 C ATOM 1619 O VAL A 105 0.603 -18.301 5.364 1.00 0.72 O ATOM 1620 CB VAL A 105 -1.935 -17.409 4.689 1.00 0.66 C ATOM 1621 CG1 VAL A 105 -2.063 -17.289 6.198 1.00 0.80 C ATOM 1622 CG2 VAL A 105 -3.186 -16.885 4.003 1.00 0.67 C ATOM 0 H VAL A 105 0.093 -17.586 2.483 1.00 0.50 H new ATOM 0 HA VAL A 105 -0.836 -15.591 4.387 1.00 0.56 H new ATOM 0 HB VAL A 105 -1.820 -18.464 4.441 1.00 0.66 H new ATOM 0 HG11 VAL A 105 -2.948 -17.830 6.532 1.00 0.80 H new ATOM 0 HG12 VAL A 105 -1.178 -17.712 6.673 1.00 0.80 H new ATOM 0 HG13 VAL A 105 -2.155 -16.238 6.473 1.00 0.80 H new ATOM 0 HG21 VAL A 105 -4.057 -17.429 4.370 1.00 0.67 H new ATOM 0 HG22 VAL A 105 -3.303 -15.823 4.221 1.00 0.67 H new ATOM 0 HG23 VAL A 105 -3.097 -17.027 2.926 1.00 0.67 H new ATOM 1632 N ILE A 106 1.548 -16.283 5.016 1.00 0.58 N ATOM 1633 CA ILE A 106 2.800 -16.607 5.664 1.00 0.64 C ATOM 1634 C ILE A 106 3.485 -15.348 6.177 1.00 0.61 C ATOM 1635 O ILE A 106 3.647 -14.374 5.440 1.00 0.57 O ATOM 1636 CB ILE A 106 3.749 -17.320 4.691 1.00 0.74 C ATOM 1637 CG1 ILE A 106 3.727 -16.630 3.325 1.00 0.76 C ATOM 1638 CG2 ILE A 106 3.389 -18.796 4.565 1.00 1.31 C ATOM 1639 CD1 ILE A 106 4.679 -17.236 2.315 1.00 1.45 C ATOM 0 H ILE A 106 1.505 -15.333 4.647 1.00 0.58 H new ATOM 0 HA ILE A 106 2.572 -17.266 6.502 1.00 0.64 H new ATOM 0 HB ILE A 106 4.762 -17.258 5.089 1.00 0.74 H new ATOM 0 HG12 ILE A 106 2.714 -16.671 2.925 1.00 0.76 H new ATOM 0 HG13 ILE A 106 3.975 -15.577 3.457 1.00 0.76 H new ATOM 0 HG21 ILE A 106 4.075 -19.280 3.870 1.00 1.31 H new ATOM 0 HG22 ILE A 106 3.465 -19.274 5.542 1.00 1.31 H new ATOM 0 HG23 ILE A 106 2.369 -18.891 4.193 1.00 1.31 H new ATOM 0 HD11 ILE A 106 4.605 -16.692 1.373 1.00 1.45 H new ATOM 0 HD12 ILE A 106 5.700 -17.171 2.692 1.00 1.45 H new ATOM 0 HD13 ILE A 106 4.419 -18.282 2.152 1.00 1.45 H new ATOM 1651 N ASN A 107 3.894 -15.373 7.439 1.00 0.84 N ATOM 1652 CA ASN A 107 4.574 -14.233 8.040 1.00 0.90 C ATOM 1653 C ASN A 107 6.050 -14.539 8.235 1.00 0.91 C ATOM 1654 O ASN A 107 6.424 -15.315 9.115 1.00 1.02 O ATOM 1655 CB ASN A 107 3.933 -13.875 9.384 1.00 1.09 C ATOM 1656 CG ASN A 107 2.476 -13.457 9.266 1.00 1.00 C ATOM 1657 OD1 ASN A 107 1.828 -13.156 10.267 1.00 1.28 O ATOM 1658 ND2 ASN A 107 1.947 -13.431 8.044 1.00 1.21 N ATOM 0 H ASN A 107 3.767 -16.168 8.065 1.00 0.84 H new ATOM 0 HA ASN A 107 4.477 -13.382 7.366 1.00 0.90 H new ATOM 0 HB2 ASN A 107 4.004 -14.733 10.052 1.00 1.09 H new ATOM 0 HB3 ASN A 107 4.499 -13.065 9.844 1.00 1.09 H new ATOM 0 HD21 ASN A 107 0.974 -13.155 7.915 1.00 1.21 H new ATOM 0 HD22 ASN A 107 2.515 -13.687 7.237 1.00 1.21 H new ATOM 1665 N THR A 108 6.890 -13.925 7.408 1.00 0.86 N ATOM 1666 CA THR A 108 8.330 -14.137 7.498 1.00 0.89 C ATOM 1667 C THR A 108 8.967 -13.087 8.404 1.00 0.91 C ATOM 1668 O THR A 108 8.495 -12.858 9.518 1.00 1.16 O ATOM 1669 CB THR A 108 8.962 -14.105 6.104 1.00 0.90 C ATOM 1670 OG1 THR A 108 8.762 -12.844 5.491 1.00 1.07 O ATOM 1671 CG2 THR A 108 8.412 -15.164 5.174 1.00 0.92 C ATOM 0 H THR A 108 6.601 -13.280 6.672 1.00 0.86 H new ATOM 0 HA THR A 108 8.511 -15.120 7.934 1.00 0.89 H new ATOM 0 HB THR A 108 10.023 -14.301 6.262 1.00 0.90 H new ATOM 0 HG1 THR A 108 9.202 -12.832 4.615 1.00 1.07 H new ATOM 0 HG21 THR A 108 8.902 -15.086 4.204 1.00 0.92 H new ATOM 0 HG22 THR A 108 8.598 -16.151 5.596 1.00 0.92 H new ATOM 0 HG23 THR A 108 7.339 -15.019 5.051 1.00 0.92 H new ATOM 1679 N GLU A 109 10.032 -12.446 7.929 1.00 0.83 N ATOM 1680 CA GLU A 109 10.705 -11.420 8.714 1.00 0.86 C ATOM 1681 C GLU A 109 9.871 -10.144 8.739 1.00 0.73 C ATOM 1682 O GLU A 109 9.079 -9.928 9.657 1.00 0.87 O ATOM 1683 CB GLU A 109 12.097 -11.135 8.143 1.00 0.95 C ATOM 1684 CG GLU A 109 13.021 -12.340 8.167 1.00 1.22 C ATOM 1685 CD GLU A 109 14.398 -12.029 7.615 1.00 1.93 C ATOM 1686 OE1 GLU A 109 15.077 -11.144 8.176 1.00 2.60 O ATOM 1687 OE2 GLU A 109 14.797 -12.671 6.619 1.00 2.37 O ATOM 0 H GLU A 109 10.443 -12.618 7.012 1.00 0.83 H new ATOM 0 HA GLU A 109 10.819 -11.784 9.735 1.00 0.86 H new ATOM 0 HB2 GLU A 109 11.995 -10.786 7.115 1.00 0.95 H new ATOM 0 HB3 GLU A 109 12.555 -10.325 8.711 1.00 0.95 H new ATOM 0 HG2 GLU A 109 13.117 -12.699 9.192 1.00 1.22 H new ATOM 0 HG3 GLU A 109 12.575 -13.147 7.586 1.00 1.22 H new ATOM 1694 N ARG A 110 10.039 -9.313 7.717 1.00 0.63 N ATOM 1695 CA ARG A 110 9.290 -8.068 7.609 1.00 0.64 C ATOM 1696 C ARG A 110 8.033 -8.277 6.777 1.00 0.66 C ATOM 1697 O ARG A 110 7.028 -7.592 6.964 1.00 0.77 O ATOM 1698 CB ARG A 110 10.150 -6.982 6.963 1.00 0.63 C ATOM 1699 CG ARG A 110 11.374 -6.585 7.778 1.00 0.86 C ATOM 1700 CD ARG A 110 11.001 -5.761 9.003 1.00 1.64 C ATOM 1701 NE ARG A 110 10.225 -6.524 9.978 1.00 2.22 N ATOM 1702 CZ ARG A 110 10.701 -7.563 10.657 1.00 2.77 C ATOM 1703 NH1 ARG A 110 11.955 -7.963 10.473 1.00 3.01 N ATOM 1704 NH2 ARG A 110 9.929 -8.198 11.525 1.00 3.68 N ATOM 0 H ARG A 110 10.690 -9.480 6.949 1.00 0.63 H new ATOM 0 HA ARG A 110 9.009 -7.752 8.614 1.00 0.64 H new ATOM 0 HB2 ARG A 110 10.477 -7.329 5.983 1.00 0.63 H new ATOM 0 HB3 ARG A 110 9.535 -6.097 6.799 1.00 0.63 H new ATOM 0 HG2 ARG A 110 11.906 -7.482 8.093 1.00 0.86 H new ATOM 0 HG3 ARG A 110 12.057 -6.013 7.151 1.00 0.86 H new ATOM 0 HD2 ARG A 110 11.910 -5.390 9.477 1.00 1.64 H new ATOM 0 HD3 ARG A 110 10.427 -4.889 8.689 1.00 1.64 H new ATOM 0 HE ARG A 110 9.260 -6.242 10.148 1.00 2.22 H new ATOM 0 HH11 ARG A 110 12.555 -7.472 9.810 1.00 3.01 H new ATOM 0 HH12 ARG A 110 12.318 -8.761 10.995 1.00 3.01 H new ATOM 0 HH21 ARG A 110 8.968 -7.890 11.673 1.00 3.68 H new ATOM 0 HH22 ARG A 110 10.295 -8.995 12.045 1.00 3.68 H new ATOM 1718 N LEU A 111 8.110 -9.222 5.848 1.00 0.62 N ATOM 1719 CA LEU A 111 6.995 -9.526 4.965 1.00 0.63 C ATOM 1720 C LEU A 111 5.746 -9.949 5.736 1.00 0.56 C ATOM 1721 O LEU A 111 5.804 -10.768 6.652 1.00 0.66 O ATOM 1722 CB LEU A 111 7.401 -10.608 3.942 1.00 0.73 C ATOM 1723 CG LEU A 111 6.262 -11.239 3.132 1.00 0.94 C ATOM 1724 CD1 LEU A 111 5.420 -12.182 3.983 1.00 1.15 C ATOM 1725 CD2 LEU A 111 5.387 -10.174 2.489 1.00 1.64 C ATOM 0 H LEU A 111 8.940 -9.793 5.688 1.00 0.62 H new ATOM 0 HA LEU A 111 6.743 -8.610 4.430 1.00 0.63 H new ATOM 0 HB2 LEU A 111 8.114 -10.169 3.245 1.00 0.73 H new ATOM 0 HB3 LEU A 111 7.924 -11.403 4.474 1.00 0.73 H new ATOM 0 HG LEU A 111 6.722 -11.828 2.339 1.00 0.94 H new ATOM 0 HD11 LEU A 111 4.624 -12.609 3.373 1.00 1.15 H new ATOM 0 HD12 LEU A 111 6.050 -12.983 4.370 1.00 1.15 H new ATOM 0 HD13 LEU A 111 4.983 -11.629 4.815 1.00 1.15 H new ATOM 0 HD21 LEU A 111 4.589 -10.653 1.922 1.00 1.64 H new ATOM 0 HD22 LEU A 111 4.953 -9.543 3.264 1.00 1.64 H new ATOM 0 HD23 LEU A 111 5.991 -9.562 1.819 1.00 1.64 H new ATOM 1737 N THR A 112 4.617 -9.395 5.311 1.00 0.46 N ATOM 1738 CA THR A 112 3.319 -9.699 5.889 1.00 0.42 C ATOM 1739 C THR A 112 2.268 -9.739 4.786 1.00 0.39 C ATOM 1740 O THR A 112 2.195 -8.829 3.962 1.00 0.43 O ATOM 1741 CB THR A 112 2.927 -8.650 6.930 1.00 0.45 C ATOM 1742 OG1 THR A 112 3.391 -7.367 6.557 1.00 0.65 O ATOM 1743 CG2 THR A 112 3.434 -8.948 8.325 1.00 0.68 C ATOM 0 H THR A 112 4.579 -8.717 4.550 1.00 0.46 H new ATOM 0 HA THR A 112 3.378 -10.670 6.381 1.00 0.42 H new ATOM 0 HB THR A 112 1.838 -8.679 6.957 1.00 0.45 H new ATOM 0 HG1 THR A 112 3.127 -6.713 7.237 1.00 0.65 H new ATOM 0 HG21 THR A 112 3.114 -8.158 9.005 1.00 0.68 H new ATOM 0 HG22 THR A 112 3.030 -9.903 8.663 1.00 0.68 H new ATOM 0 HG23 THR A 112 4.523 -8.998 8.313 1.00 0.68 H new ATOM 1751 N VAL A 113 1.439 -10.774 4.784 1.00 0.36 N ATOM 1752 CA VAL A 113 0.385 -10.884 3.789 1.00 0.38 C ATOM 1753 C VAL A 113 -0.814 -10.080 4.326 1.00 0.32 C ATOM 1754 O VAL A 113 -0.691 -9.536 5.423 1.00 0.30 O ATOM 1755 CB VAL A 113 0.054 -12.381 3.521 1.00 0.45 C ATOM 1756 CG1 VAL A 113 -1.204 -12.834 4.248 1.00 1.52 C ATOM 1757 CG2 VAL A 113 -0.030 -12.661 2.026 1.00 1.18 C ATOM 0 H VAL A 113 1.476 -11.542 5.454 1.00 0.36 H new ATOM 0 HA VAL A 113 0.683 -10.476 2.823 1.00 0.38 H new ATOM 0 HB VAL A 113 0.875 -12.971 3.928 1.00 0.45 H new ATOM 0 HG11 VAL A 113 -1.392 -13.885 4.029 1.00 1.52 H new ATOM 0 HG12 VAL A 113 -1.070 -12.706 5.322 1.00 1.52 H new ATOM 0 HG13 VAL A 113 -2.052 -12.236 3.914 1.00 1.52 H new ATOM 0 HG21 VAL A 113 -0.262 -13.714 1.865 1.00 1.18 H new ATOM 0 HG22 VAL A 113 -0.813 -12.045 1.584 1.00 1.18 H new ATOM 0 HG23 VAL A 113 0.925 -12.425 1.557 1.00 1.18 H new ATOM 1767 N PRO A 114 -1.974 -9.959 3.616 1.00 0.35 N ATOM 1768 CA PRO A 114 -3.124 -9.201 4.089 1.00 0.36 C ATOM 1769 C PRO A 114 -3.061 -8.871 5.577 1.00 0.33 C ATOM 1770 O PRO A 114 -3.345 -9.710 6.432 1.00 0.35 O ATOM 1771 CB PRO A 114 -4.253 -10.159 3.742 1.00 0.43 C ATOM 1772 CG PRO A 114 -3.798 -10.819 2.464 1.00 0.46 C ATOM 1773 CD PRO A 114 -2.311 -10.533 2.314 1.00 0.42 C ATOM 0 HA PRO A 114 -3.218 -8.212 3.641 1.00 0.36 H new ATOM 0 HB2 PRO A 114 -4.412 -10.891 4.534 1.00 0.43 H new ATOM 0 HB3 PRO A 114 -5.196 -9.630 3.603 1.00 0.43 H new ATOM 0 HG2 PRO A 114 -3.982 -11.893 2.499 1.00 0.46 H new ATOM 0 HG3 PRO A 114 -4.353 -10.429 1.611 1.00 0.46 H new ATOM 0 HD2 PRO A 114 -1.741 -11.439 2.109 1.00 0.42 H new ATOM 0 HD3 PRO A 114 -2.110 -9.838 1.498 1.00 0.42 H new ATOM 1781 N HIS A 115 -2.652 -7.636 5.868 1.00 0.33 N ATOM 1782 CA HIS A 115 -2.501 -7.157 7.229 1.00 0.33 C ATOM 1783 C HIS A 115 -3.848 -6.759 7.809 1.00 0.34 C ATOM 1784 O HIS A 115 -4.444 -5.775 7.376 1.00 0.46 O ATOM 1785 CB HIS A 115 -1.555 -5.952 7.231 1.00 0.39 C ATOM 1786 CG HIS A 115 -1.014 -5.589 8.577 1.00 0.44 C ATOM 1787 ND1 HIS A 115 -1.807 -5.403 9.690 1.00 0.97 N ATOM 1788 CD2 HIS A 115 0.259 -5.351 8.979 1.00 0.76 C ATOM 1789 CE1 HIS A 115 -1.046 -5.067 10.717 1.00 0.87 C ATOM 1790 NE2 HIS A 115 0.209 -5.031 10.313 1.00 0.67 N ATOM 0 H HIS A 115 -2.417 -6.942 5.158 1.00 0.33 H new ATOM 0 HA HIS A 115 -2.087 -7.955 7.846 1.00 0.33 H new ATOM 0 HB2 HIS A 115 -0.720 -6.161 6.562 1.00 0.39 H new ATOM 0 HB3 HIS A 115 -2.083 -5.091 6.822 1.00 0.39 H new ATOM 0 HD2 HIS A 115 1.146 -5.403 8.365 1.00 0.76 H new ATOM 0 HE1 HIS A 115 -1.393 -4.857 11.718 1.00 0.87 H new ATOM 0 HE2 HIS A 115 1.013 -4.802 10.898 1.00 0.67 H new ATOM 1799 N TYR A 116 -4.317 -7.527 8.789 1.00 0.34 N ATOM 1800 CA TYR A 116 -5.593 -7.244 9.436 1.00 0.42 C ATOM 1801 C TYR A 116 -5.692 -5.770 9.812 1.00 0.43 C ATOM 1802 O TYR A 116 -5.252 -5.361 10.888 1.00 0.49 O ATOM 1803 CB TYR A 116 -5.778 -8.132 10.676 1.00 0.52 C ATOM 1804 CG TYR A 116 -4.488 -8.500 11.398 1.00 0.70 C ATOM 1805 CD1 TYR A 116 -3.459 -7.579 11.582 1.00 1.13 C ATOM 1806 CD2 TYR A 116 -4.310 -9.782 11.905 1.00 0.89 C ATOM 1807 CE1 TYR A 116 -2.297 -7.928 12.244 1.00 1.64 C ATOM 1808 CE2 TYR A 116 -3.150 -10.138 12.568 1.00 1.31 C ATOM 1809 CZ TYR A 116 -2.148 -9.207 12.735 1.00 1.68 C ATOM 1810 OH TYR A 116 -0.994 -9.555 13.397 1.00 2.22 O ATOM 0 H TYR A 116 -3.833 -8.348 9.151 1.00 0.34 H new ATOM 0 HA TYR A 116 -6.392 -7.470 8.729 1.00 0.42 H new ATOM 0 HB2 TYR A 116 -6.437 -7.619 11.377 1.00 0.52 H new ATOM 0 HB3 TYR A 116 -6.284 -9.050 10.376 1.00 0.52 H new ATOM 0 HD1 TYR A 116 -3.571 -6.575 11.201 1.00 1.13 H new ATOM 0 HD2 TYR A 116 -5.093 -10.515 11.779 1.00 0.89 H new ATOM 0 HE1 TYR A 116 -1.509 -7.201 12.376 1.00 1.64 H new ATOM 0 HE2 TYR A 116 -3.030 -11.140 12.953 1.00 1.31 H new ATOM 0 HH TYR A 116 -1.049 -10.492 13.680 1.00 2.22 H new ATOM 1820 N ASP A 117 -6.251 -4.968 8.904 1.00 0.42 N ATOM 1821 CA ASP A 117 -6.373 -3.533 9.129 1.00 0.50 C ATOM 1822 C ASP A 117 -7.133 -2.863 7.986 1.00 0.52 C ATOM 1823 O ASP A 117 -8.146 -2.197 8.191 1.00 0.73 O ATOM 1824 CB ASP A 117 -4.972 -2.927 9.218 1.00 0.52 C ATOM 1825 CG ASP A 117 -4.962 -1.563 9.883 1.00 0.67 C ATOM 1826 OD1 ASP A 117 -6.045 -1.094 10.290 1.00 1.07 O ATOM 1827 OD2 ASP A 117 -3.871 -0.968 9.998 1.00 0.87 O ATOM 0 H ASP A 117 -6.624 -5.289 8.011 1.00 0.42 H new ATOM 0 HA ASP A 117 -6.924 -3.369 10.055 1.00 0.50 H new ATOM 0 HB2 ASP A 117 -4.324 -3.603 9.776 1.00 0.52 H new ATOM 0 HB3 ASP A 117 -4.554 -2.840 8.215 1.00 0.52 H new ATOM 1832 N MET A 118 -6.595 -3.040 6.787 1.00 0.38 N ATOM 1833 CA MET A 118 -7.145 -2.466 5.562 1.00 0.39 C ATOM 1834 C MET A 118 -8.647 -2.690 5.408 1.00 0.38 C ATOM 1835 O MET A 118 -9.383 -1.788 5.007 1.00 0.45 O ATOM 1836 CB MET A 118 -6.426 -3.094 4.373 1.00 0.44 C ATOM 1837 CG MET A 118 -6.657 -4.590 4.248 1.00 0.48 C ATOM 1838 SD MET A 118 -5.404 -5.398 3.247 1.00 1.29 S ATOM 1839 CE MET A 118 -3.961 -5.128 4.274 1.00 2.05 C ATOM 0 H MET A 118 -5.752 -3.594 6.634 1.00 0.38 H new ATOM 0 HA MET A 118 -6.991 -1.388 5.609 1.00 0.39 H new ATOM 0 HB2 MET A 118 -6.759 -2.605 3.457 1.00 0.44 H new ATOM 0 HB3 MET A 118 -5.356 -2.906 4.464 1.00 0.44 H new ATOM 0 HG2 MET A 118 -6.667 -5.037 5.242 1.00 0.48 H new ATOM 0 HG3 MET A 118 -7.639 -4.767 3.809 1.00 0.48 H new ATOM 0 HE1 MET A 118 -3.218 -5.898 4.067 1.00 2.05 H new ATOM 0 HE2 MET A 118 -3.538 -4.147 4.056 1.00 2.05 H new ATOM 0 HE3 MET A 118 -4.248 -5.174 5.324 1.00 2.05 H new ATOM 1849 N LYS A 119 -9.082 -3.905 5.696 1.00 0.40 N ATOM 1850 CA LYS A 119 -10.484 -4.286 5.558 1.00 0.47 C ATOM 1851 C LYS A 119 -11.368 -3.634 6.613 1.00 0.50 C ATOM 1852 O LYS A 119 -12.536 -3.987 6.760 1.00 0.80 O ATOM 1853 CB LYS A 119 -10.607 -5.804 5.588 1.00 0.57 C ATOM 1854 CG LYS A 119 -9.737 -6.465 6.640 1.00 0.69 C ATOM 1855 CD LYS A 119 -9.840 -7.981 6.560 1.00 0.80 C ATOM 1856 CE LYS A 119 -8.860 -8.662 7.503 1.00 1.02 C ATOM 1857 NZ LYS A 119 -7.450 -8.338 7.162 1.00 1.93 N ATOM 0 H LYS A 119 -8.478 -4.656 6.031 1.00 0.40 H new ATOM 0 HA LYS A 119 -10.841 -3.919 4.596 1.00 0.47 H new ATOM 0 HB2 LYS A 119 -11.648 -6.072 5.769 1.00 0.57 H new ATOM 0 HB3 LYS A 119 -10.342 -6.201 4.608 1.00 0.57 H new ATOM 0 HG2 LYS A 119 -8.700 -6.160 6.503 1.00 0.69 H new ATOM 0 HG3 LYS A 119 -10.040 -6.128 7.631 1.00 0.69 H new ATOM 0 HD2 LYS A 119 -10.856 -8.290 6.806 1.00 0.80 H new ATOM 0 HD3 LYS A 119 -9.646 -8.305 5.538 1.00 0.80 H new ATOM 0 HE2 LYS A 119 -9.067 -8.352 8.527 1.00 1.02 H new ATOM 0 HE3 LYS A 119 -9.005 -9.741 7.461 1.00 1.02 H new ATOM 0 HZ1 LYS A 119 -6.812 -8.834 7.816 1.00 1.93 H new ATOM 0 HZ2 LYS A 119 -7.250 -8.641 6.187 1.00 1.93 H new ATOM 0 HZ3 LYS A 119 -7.300 -7.312 7.243 1.00 1.93 H new ATOM 1871 N ASN A 120 -10.813 -2.663 7.319 1.00 0.49 N ATOM 1872 CA ASN A 120 -11.554 -1.929 8.332 1.00 0.52 C ATOM 1873 C ASN A 120 -11.492 -0.444 8.008 1.00 0.56 C ATOM 1874 O ASN A 120 -11.837 0.406 8.830 1.00 0.74 O ATOM 1875 CB ASN A 120 -10.962 -2.189 9.720 1.00 0.53 C ATOM 1876 CG ASN A 120 -10.884 -3.664 10.049 1.00 1.17 C ATOM 1877 OD1 ASN A 120 -11.885 -4.379 10.004 1.00 2.11 O ATOM 1878 ND2 ASN A 120 -9.690 -4.120 10.393 1.00 1.30 N ATOM 0 H ASN A 120 -9.844 -2.363 7.208 1.00 0.49 H new ATOM 0 HA ASN A 120 -12.592 -2.263 8.336 1.00 0.52 H new ATOM 0 HB2 ASN A 120 -9.964 -1.755 9.773 1.00 0.53 H new ATOM 0 HB3 ASN A 120 -11.569 -1.684 10.471 1.00 0.53 H new ATOM 0 HD21 ASN A 120 -9.570 -5.103 10.636 1.00 1.30 H new ATOM 0 HD22 ASN A 120 -8.890 -3.488 10.416 1.00 1.30 H new ATOM 1885 N ARG A 121 -11.019 -0.148 6.797 1.00 0.49 N ATOM 1886 CA ARG A 121 -10.863 1.226 6.332 1.00 0.58 C ATOM 1887 C ARG A 121 -11.059 1.310 4.818 1.00 0.63 C ATOM 1888 O ARG A 121 -11.399 0.322 4.168 1.00 1.07 O ATOM 1889 CB ARG A 121 -9.454 1.717 6.674 1.00 0.64 C ATOM 1890 CG ARG A 121 -9.031 1.439 8.108 1.00 0.91 C ATOM 1891 CD ARG A 121 -9.253 2.648 9.003 1.00 1.24 C ATOM 1892 NE ARG A 121 -10.656 3.054 9.037 1.00 1.84 N ATOM 1893 CZ ARG A 121 -11.106 4.100 9.725 1.00 2.55 C ATOM 1894 NH1 ARG A 121 -10.267 4.845 10.432 1.00 2.86 N ATOM 1895 NH2 ARG A 121 -12.398 4.401 9.706 1.00 3.50 N ATOM 0 H ARG A 121 -10.735 -0.852 6.115 1.00 0.49 H new ATOM 0 HA ARG A 121 -11.613 1.846 6.823 1.00 0.58 H new ATOM 0 HB2 ARG A 121 -8.742 1.244 5.998 1.00 0.64 H new ATOM 0 HB3 ARG A 121 -9.401 2.790 6.492 1.00 0.64 H new ATOM 0 HG2 ARG A 121 -9.595 0.590 8.496 1.00 0.91 H new ATOM 0 HG3 ARG A 121 -7.978 1.159 8.129 1.00 0.91 H new ATOM 0 HD2 ARG A 121 -8.918 2.417 10.014 1.00 1.24 H new ATOM 0 HD3 ARG A 121 -8.644 3.479 8.647 1.00 1.24 H new ATOM 0 HE ARG A 121 -11.329 2.504 8.503 1.00 1.84 H new ATOM 0 HH11 ARG A 121 -9.273 4.617 10.450 1.00 2.86 H new ATOM 0 HH12 ARG A 121 -10.616 5.646 10.958 1.00 2.86 H new ATOM 0 HH21 ARG A 121 -13.047 3.830 9.164 1.00 3.50 H new ATOM 0 HH22 ARG A 121 -12.743 5.203 10.234 1.00 3.50 H new ATOM 1909 N GLY A 122 -10.803 2.494 4.261 1.00 0.62 N ATOM 1910 CA GLY A 122 -10.911 2.695 2.827 1.00 0.61 C ATOM 1911 C GLY A 122 -9.592 3.172 2.261 1.00 0.56 C ATOM 1912 O GLY A 122 -9.404 3.222 1.051 1.00 0.70 O ATOM 0 H GLY A 122 -10.521 3.323 4.784 1.00 0.62 H new ATOM 0 HA2 GLY A 122 -11.206 1.763 2.344 1.00 0.61 H new ATOM 0 HA3 GLY A 122 -11.691 3.426 2.613 1.00 0.61 H new ATOM 1916 N PHE A 123 -8.673 3.501 3.163 1.00 0.52 N ATOM 1917 CA PHE A 123 -7.347 3.967 2.792 1.00 0.58 C ATOM 1918 C PHE A 123 -6.623 2.891 1.999 1.00 0.42 C ATOM 1919 O PHE A 123 -5.963 3.172 1.002 1.00 0.43 O ATOM 1920 CB PHE A 123 -6.567 4.323 4.064 1.00 0.84 C ATOM 1921 CG PHE A 123 -5.151 4.775 3.838 1.00 1.19 C ATOM 1922 CD1 PHE A 123 -4.860 6.115 3.628 1.00 2.11 C ATOM 1923 CD2 PHE A 123 -4.115 3.860 3.823 1.00 1.62 C ATOM 1924 CE1 PHE A 123 -3.561 6.529 3.409 1.00 3.16 C ATOM 1925 CE2 PHE A 123 -2.814 4.267 3.600 1.00 2.59 C ATOM 1926 CZ PHE A 123 -2.532 5.621 3.450 1.00 3.31 C ATOM 0 H PHE A 123 -8.829 3.451 4.170 1.00 0.52 H new ATOM 0 HA PHE A 123 -7.428 4.855 2.165 1.00 0.58 H new ATOM 0 HB2 PHE A 123 -7.104 5.111 4.592 1.00 0.84 H new ATOM 0 HB3 PHE A 123 -6.554 3.452 4.719 1.00 0.84 H new ATOM 0 HD1 PHE A 123 -5.658 6.842 3.636 1.00 2.11 H new ATOM 0 HD2 PHE A 123 -4.325 2.814 3.988 1.00 1.62 H new ATOM 0 HE1 PHE A 123 -3.354 7.569 3.205 1.00 3.16 H new ATOM 0 HE2 PHE A 123 -2.020 3.538 3.542 1.00 2.59 H new ATOM 0 HZ PHE A 123 -1.509 5.956 3.366 1.00 3.31 H new ATOM 1936 N MET A 124 -6.757 1.657 2.460 1.00 0.37 N ATOM 1937 CA MET A 124 -6.122 0.518 1.805 1.00 0.38 C ATOM 1938 C MET A 124 -7.021 -0.116 0.743 1.00 0.38 C ATOM 1939 O MET A 124 -6.553 -0.521 -0.320 1.00 0.57 O ATOM 1940 CB MET A 124 -5.741 -0.544 2.839 1.00 0.50 C ATOM 1941 CG MET A 124 -4.785 -0.053 3.915 1.00 0.90 C ATOM 1942 SD MET A 124 -5.561 1.080 5.082 1.00 1.99 S ATOM 1943 CE MET A 124 -4.205 1.373 6.215 1.00 2.44 C ATOM 0 H MET A 124 -7.301 1.416 3.288 1.00 0.37 H new ATOM 0 HA MET A 124 -5.228 0.897 1.309 1.00 0.38 H new ATOM 0 HB2 MET A 124 -6.649 -0.912 3.316 1.00 0.50 H new ATOM 0 HB3 MET A 124 -5.286 -1.390 2.324 1.00 0.50 H new ATOM 0 HG2 MET A 124 -4.387 -0.910 4.459 1.00 0.90 H new ATOM 0 HG3 MET A 124 -3.939 0.445 3.442 1.00 0.90 H new ATOM 0 HE1 MET A 124 -4.499 2.125 6.947 1.00 2.44 H new ATOM 0 HE2 MET A 124 -3.953 0.445 6.729 1.00 2.44 H new ATOM 0 HE3 MET A 124 -3.337 1.727 5.659 1.00 2.44 H new ATOM 1953 N LEU A 125 -8.302 -0.254 1.070 1.00 0.37 N ATOM 1954 CA LEU A 125 -9.271 -0.902 0.185 1.00 0.41 C ATOM 1955 C LEU A 125 -9.674 -0.060 -1.029 1.00 0.34 C ATOM 1956 O LEU A 125 -9.618 -0.546 -2.157 1.00 0.40 O ATOM 1957 CB LEU A 125 -10.517 -1.273 0.981 1.00 0.53 C ATOM 1958 CG LEU A 125 -10.278 -2.167 2.197 1.00 0.61 C ATOM 1959 CD1 LEU A 125 -11.592 -2.448 2.905 1.00 0.85 C ATOM 1960 CD2 LEU A 125 -9.603 -3.468 1.789 1.00 0.76 C ATOM 0 H LEU A 125 -8.698 0.077 1.950 1.00 0.37 H new ATOM 0 HA LEU A 125 -8.776 -1.789 -0.210 1.00 0.41 H new ATOM 0 HB2 LEU A 125 -11.000 -0.355 1.316 1.00 0.53 H new ATOM 0 HB3 LEU A 125 -11.217 -1.776 0.314 1.00 0.53 H new ATOM 0 HG LEU A 125 -9.613 -1.644 2.884 1.00 0.61 H new ATOM 0 HD11 LEU A 125 -11.410 -3.086 3.770 1.00 0.85 H new ATOM 0 HD12 LEU A 125 -12.036 -1.509 3.234 1.00 0.85 H new ATOM 0 HD13 LEU A 125 -12.274 -2.952 2.220 1.00 0.85 H new ATOM 0 HD21 LEU A 125 -9.443 -4.087 2.672 1.00 0.76 H new ATOM 0 HD22 LEU A 125 -10.238 -4.001 1.082 1.00 0.76 H new ATOM 0 HD23 LEU A 125 -8.643 -3.249 1.321 1.00 0.76 H new ATOM 1972 N TRP A 126 -10.115 1.180 -0.806 1.00 0.31 N ATOM 1973 CA TRP A 126 -10.553 2.040 -1.910 1.00 0.32 C ATOM 1974 C TRP A 126 -9.533 2.035 -3.063 1.00 0.29 C ATOM 1975 O TRP A 126 -9.880 1.715 -4.199 1.00 0.31 O ATOM 1976 CB TRP A 126 -10.807 3.463 -1.414 1.00 0.38 C ATOM 1977 CG TRP A 126 -11.202 4.445 -2.482 1.00 0.46 C ATOM 1978 CD1 TRP A 126 -10.990 5.784 -2.433 1.00 0.46 C ATOM 1979 CD2 TRP A 126 -11.870 4.190 -3.735 1.00 0.93 C ATOM 1980 NE1 TRP A 126 -11.478 6.388 -3.566 1.00 0.54 N ATOM 1981 CE2 TRP A 126 -12.020 5.433 -4.381 1.00 0.94 C ATOM 1982 CE3 TRP A 126 -12.352 3.043 -4.374 1.00 1.45 C ATOM 1983 CZ2 TRP A 126 -12.627 5.558 -5.628 1.00 1.42 C ATOM 1984 CZ3 TRP A 126 -12.955 3.169 -5.612 1.00 1.96 C ATOM 1985 CH2 TRP A 126 -13.087 4.419 -6.227 1.00 1.93 C ATOM 0 H TRP A 126 -10.178 1.608 0.118 1.00 0.31 H new ATOM 0 HA TRP A 126 -11.489 1.638 -2.297 1.00 0.32 H new ATOM 0 HB2 TRP A 126 -11.593 3.434 -0.659 1.00 0.38 H new ATOM 0 HB3 TRP A 126 -9.905 3.827 -0.922 1.00 0.38 H new ATOM 0 HD1 TRP A 126 -10.506 6.302 -1.618 1.00 0.46 H new ATOM 0 HE1 TRP A 126 -11.442 7.387 -3.767 1.00 0.54 H new ATOM 0 HE3 TRP A 126 -12.255 2.074 -3.908 1.00 1.45 H new ATOM 0 HZ2 TRP A 126 -12.731 6.521 -6.105 1.00 1.42 H new ATOM 0 HZ3 TRP A 126 -13.330 2.288 -6.112 1.00 1.96 H new ATOM 0 HH2 TRP A 126 -13.562 4.485 -7.195 1.00 1.93 H new ATOM 1996 N PRO A 127 -8.253 2.381 -2.800 1.00 0.28 N ATOM 1997 CA PRO A 127 -7.210 2.405 -3.839 1.00 0.29 C ATOM 1998 C PRO A 127 -6.965 1.030 -4.461 1.00 0.28 C ATOM 1999 O PRO A 127 -6.887 0.898 -5.682 1.00 0.31 O ATOM 2000 CB PRO A 127 -5.959 2.880 -3.092 1.00 0.30 C ATOM 2001 CG PRO A 127 -6.478 3.541 -1.863 1.00 0.31 C ATOM 2002 CD PRO A 127 -7.713 2.777 -1.489 1.00 0.29 C ATOM 0 HA PRO A 127 -7.494 3.047 -4.673 1.00 0.29 H new ATOM 0 HB2 PRO A 127 -5.304 2.044 -2.845 1.00 0.30 H new ATOM 0 HB3 PRO A 127 -5.376 3.573 -3.698 1.00 0.30 H new ATOM 0 HG2 PRO A 127 -5.741 3.512 -1.061 1.00 0.31 H new ATOM 0 HG3 PRO A 127 -6.707 4.590 -2.048 1.00 0.31 H new ATOM 0 HD2 PRO A 127 -7.482 1.912 -0.867 1.00 0.29 H new ATOM 0 HD3 PRO A 127 -8.417 3.393 -0.929 1.00 0.29 H new ATOM 2010 N LEU A 128 -6.840 0.013 -3.611 1.00 0.25 N ATOM 2011 CA LEU A 128 -6.602 -1.353 -4.073 1.00 0.26 C ATOM 2012 C LEU A 128 -7.736 -1.815 -4.974 1.00 0.27 C ATOM 2013 O LEU A 128 -7.552 -2.647 -5.862 1.00 0.29 O ATOM 2014 CB LEU A 128 -6.513 -2.300 -2.881 1.00 0.26 C ATOM 2015 CG LEU A 128 -5.427 -3.359 -2.966 1.00 0.29 C ATOM 2016 CD1 LEU A 128 -4.059 -2.727 -2.766 1.00 0.30 C ATOM 2017 CD2 LEU A 128 -5.673 -4.449 -1.932 1.00 0.44 C ATOM 0 H LEU A 128 -6.900 0.109 -2.597 1.00 0.25 H new ATOM 0 HA LEU A 128 -5.665 -1.364 -4.630 1.00 0.26 H new ATOM 0 HB2 LEU A 128 -6.349 -1.708 -1.981 1.00 0.26 H new ATOM 0 HB3 LEU A 128 -7.475 -2.799 -2.764 1.00 0.26 H new ATOM 0 HG LEU A 128 -5.454 -3.813 -3.957 1.00 0.29 H new ATOM 0 HD11 LEU A 128 -3.290 -3.497 -2.829 1.00 0.30 H new ATOM 0 HD12 LEU A 128 -3.888 -1.978 -3.539 1.00 0.30 H new ATOM 0 HD13 LEU A 128 -4.017 -2.252 -1.786 1.00 0.30 H new ATOM 0 HD21 LEU A 128 -4.888 -5.202 -2.003 1.00 0.44 H new ATOM 0 HD22 LEU A 128 -5.667 -4.012 -0.934 1.00 0.44 H new ATOM 0 HD23 LEU A 128 -6.641 -4.915 -2.118 1.00 0.44 H new ATOM 2029 N PHE A 129 -8.911 -1.262 -4.720 1.00 0.28 N ATOM 2030 CA PHE A 129 -10.112 -1.591 -5.477 1.00 0.30 C ATOM 2031 C PHE A 129 -9.947 -1.200 -6.948 1.00 0.30 C ATOM 2032 O PHE A 129 -10.738 -1.593 -7.800 1.00 0.32 O ATOM 2033 CB PHE A 129 -11.313 -0.854 -4.874 1.00 0.36 C ATOM 2034 CG PHE A 129 -12.627 -1.183 -5.523 1.00 0.42 C ATOM 2035 CD1 PHE A 129 -13.213 -2.423 -5.345 1.00 0.47 C ATOM 2036 CD2 PHE A 129 -13.282 -0.241 -6.302 1.00 0.48 C ATOM 2037 CE1 PHE A 129 -14.428 -2.722 -5.933 1.00 0.55 C ATOM 2038 CE2 PHE A 129 -14.496 -0.533 -6.892 1.00 0.56 C ATOM 2039 CZ PHE A 129 -15.070 -1.775 -6.707 1.00 0.58 C ATOM 0 H PHE A 129 -9.061 -0.572 -3.984 1.00 0.28 H new ATOM 0 HA PHE A 129 -10.278 -2.667 -5.423 1.00 0.30 H new ATOM 0 HB2 PHE A 129 -11.375 -1.092 -3.812 1.00 0.36 H new ATOM 0 HB3 PHE A 129 -11.142 0.220 -4.950 1.00 0.36 H new ATOM 0 HD1 PHE A 129 -12.716 -3.166 -4.740 1.00 0.47 H new ATOM 0 HD2 PHE A 129 -12.838 0.732 -6.449 1.00 0.48 H new ATOM 0 HE1 PHE A 129 -14.875 -3.695 -5.787 1.00 0.55 H new ATOM 0 HE2 PHE A 129 -14.996 0.209 -7.497 1.00 0.56 H new ATOM 0 HZ PHE A 129 -16.020 -2.006 -7.167 1.00 0.58 H new ATOM 2049 N GLU A 130 -8.923 -0.399 -7.230 1.00 0.29 N ATOM 2050 CA GLU A 130 -8.664 0.065 -8.588 1.00 0.31 C ATOM 2051 C GLU A 130 -7.482 -0.663 -9.220 1.00 0.29 C ATOM 2052 O GLU A 130 -7.463 -0.886 -10.430 1.00 0.32 O ATOM 2053 CB GLU A 130 -8.405 1.575 -8.588 1.00 0.36 C ATOM 2054 CG GLU A 130 -8.181 2.161 -9.975 1.00 0.93 C ATOM 2055 CD GLU A 130 -9.399 2.040 -10.873 1.00 1.41 C ATOM 2056 OE1 GLU A 130 -9.814 0.898 -11.164 1.00 2.43 O ATOM 2057 OE2 GLU A 130 -9.939 3.089 -11.284 1.00 1.52 O ATOM 0 H GLU A 130 -8.259 -0.058 -6.535 1.00 0.29 H new ATOM 0 HA GLU A 130 -9.549 -0.155 -9.185 1.00 0.31 H new ATOM 0 HB2 GLU A 130 -9.252 2.079 -8.123 1.00 0.36 H new ATOM 0 HB3 GLU A 130 -7.532 1.784 -7.970 1.00 0.36 H new ATOM 0 HG2 GLU A 130 -7.909 3.212 -9.880 1.00 0.93 H new ATOM 0 HG3 GLU A 130 -7.338 1.655 -10.445 1.00 0.93 H new ATOM 2064 N ILE A 131 -6.490 -1.019 -8.406 1.00 0.26 N ATOM 2065 CA ILE A 131 -5.308 -1.705 -8.923 1.00 0.27 C ATOM 2066 C ILE A 131 -5.644 -3.137 -9.296 1.00 0.27 C ATOM 2067 O ILE A 131 -5.055 -3.705 -10.218 1.00 0.30 O ATOM 2068 CB ILE A 131 -4.163 -1.695 -7.893 1.00 0.27 C ATOM 2069 CG1 ILE A 131 -4.401 -2.734 -6.784 1.00 0.29 C ATOM 2070 CG2 ILE A 131 -4.044 -0.305 -7.296 1.00 0.32 C ATOM 2071 CD1 ILE A 131 -3.214 -2.919 -5.867 1.00 0.59 C ATOM 0 H ILE A 131 -6.480 -0.847 -7.401 1.00 0.26 H new ATOM 0 HA ILE A 131 -4.979 -1.169 -9.813 1.00 0.27 H new ATOM 0 HB ILE A 131 -3.234 -1.960 -8.398 1.00 0.27 H new ATOM 0 HG12 ILE A 131 -5.264 -2.430 -6.192 1.00 0.29 H new ATOM 0 HG13 ILE A 131 -4.650 -3.692 -7.241 1.00 0.29 H new ATOM 0 HG21 ILE A 131 -3.235 -0.291 -6.566 1.00 0.32 H new ATOM 0 HG22 ILE A 131 -3.831 0.414 -8.087 1.00 0.32 H new ATOM 0 HG23 ILE A 131 -4.980 -0.038 -6.806 1.00 0.32 H new ATOM 0 HD11 ILE A 131 -3.452 -3.666 -5.109 1.00 0.59 H new ATOM 0 HD12 ILE A 131 -2.354 -3.253 -6.448 1.00 0.59 H new ATOM 0 HD13 ILE A 131 -2.978 -1.972 -5.382 1.00 0.59 H new ATOM 2083 N ALA A 132 -6.620 -3.692 -8.587 1.00 0.24 N ATOM 2084 CA ALA A 132 -7.090 -5.052 -8.836 1.00 0.25 C ATOM 2085 C ALA A 132 -8.030 -5.520 -7.729 1.00 0.23 C ATOM 2086 O ALA A 132 -7.601 -6.124 -6.749 1.00 0.28 O ATOM 2087 CB ALA A 132 -5.925 -6.022 -8.988 1.00 0.30 C ATOM 0 H ALA A 132 -7.106 -3.216 -7.827 1.00 0.24 H new ATOM 0 HA ALA A 132 -7.644 -5.038 -9.774 1.00 0.25 H new ATOM 0 HB1 ALA A 132 -6.309 -7.025 -9.172 1.00 0.30 H new ATOM 0 HB2 ALA A 132 -5.301 -5.712 -9.826 1.00 0.30 H new ATOM 0 HB3 ALA A 132 -5.331 -6.023 -8.074 1.00 0.30 H new ATOM 2093 N PRO A 133 -9.329 -5.237 -7.864 1.00 0.25 N ATOM 2094 CA PRO A 133 -10.330 -5.617 -6.879 1.00 0.31 C ATOM 2095 C PRO A 133 -10.987 -6.953 -7.201 1.00 0.35 C ATOM 2096 O PRO A 133 -12.043 -7.286 -6.665 1.00 0.45 O ATOM 2097 CB PRO A 133 -11.317 -4.479 -7.020 1.00 0.37 C ATOM 2098 CG PRO A 133 -11.350 -4.236 -8.492 1.00 0.37 C ATOM 2099 CD PRO A 133 -9.947 -4.502 -8.988 1.00 0.29 C ATOM 0 HA PRO A 133 -9.926 -5.756 -5.876 1.00 0.31 H new ATOM 0 HB2 PRO A 133 -12.300 -4.749 -6.634 1.00 0.37 H new ATOM 0 HB3 PRO A 133 -10.992 -3.594 -6.473 1.00 0.37 H new ATOM 0 HG2 PRO A 133 -12.068 -4.895 -8.980 1.00 0.37 H new ATOM 0 HG3 PRO A 133 -11.655 -3.213 -8.712 1.00 0.37 H new ATOM 0 HD2 PRO A 133 -9.948 -5.093 -9.904 1.00 0.29 H new ATOM 0 HD3 PRO A 133 -9.414 -3.577 -9.206 1.00 0.29 H new ATOM 2107 N GLU A 134 -10.345 -7.718 -8.076 1.00 0.32 N ATOM 2108 CA GLU A 134 -10.850 -9.029 -8.470 1.00 0.37 C ATOM 2109 C GLU A 134 -10.165 -10.079 -7.625 1.00 0.37 C ATOM 2110 O GLU A 134 -10.019 -11.238 -8.016 1.00 0.52 O ATOM 2111 CB GLU A 134 -10.584 -9.281 -9.955 1.00 0.44 C ATOM 2112 CG GLU A 134 -9.106 -9.270 -10.315 1.00 0.46 C ATOM 2113 CD GLU A 134 -8.865 -9.479 -11.797 1.00 0.54 C ATOM 2114 OE1 GLU A 134 -9.268 -10.538 -12.321 1.00 1.14 O ATOM 2115 OE2 GLU A 134 -8.270 -8.583 -12.433 1.00 0.87 O ATOM 0 H GLU A 134 -9.470 -7.452 -8.528 1.00 0.32 H new ATOM 0 HA GLU A 134 -11.928 -9.072 -8.313 1.00 0.37 H new ATOM 0 HB2 GLU A 134 -11.011 -10.244 -10.235 1.00 0.44 H new ATOM 0 HB3 GLU A 134 -11.099 -8.521 -10.543 1.00 0.44 H new ATOM 0 HG2 GLU A 134 -8.669 -8.319 -10.010 1.00 0.46 H new ATOM 0 HG3 GLU A 134 -8.593 -10.051 -9.754 1.00 0.46 H new ATOM 2122 N LEU A 135 -9.719 -9.627 -6.467 1.00 0.30 N ATOM 2123 CA LEU A 135 -9.005 -10.455 -5.522 1.00 0.35 C ATOM 2124 C LEU A 135 -9.949 -11.049 -4.493 1.00 0.34 C ATOM 2125 O LEU A 135 -10.893 -10.397 -4.067 1.00 0.39 O ATOM 2126 CB LEU A 135 -7.967 -9.586 -4.826 1.00 0.41 C ATOM 2127 CG LEU A 135 -6.791 -10.321 -4.192 1.00 0.69 C ATOM 2128 CD1 LEU A 135 -7.191 -10.925 -2.855 1.00 1.27 C ATOM 2129 CD2 LEU A 135 -6.257 -11.405 -5.121 1.00 1.41 C ATOM 0 H LEU A 135 -9.846 -8.664 -6.156 1.00 0.30 H new ATOM 0 HA LEU A 135 -8.528 -11.281 -6.050 1.00 0.35 H new ATOM 0 HB2 LEU A 135 -7.575 -8.873 -5.551 1.00 0.41 H new ATOM 0 HB3 LEU A 135 -8.469 -9.008 -4.050 1.00 0.41 H new ATOM 0 HG LEU A 135 -5.997 -9.594 -4.022 1.00 0.69 H new ATOM 0 HD11 LEU A 135 -6.337 -11.445 -2.420 1.00 1.27 H new ATOM 0 HD12 LEU A 135 -7.515 -10.133 -2.180 1.00 1.27 H new ATOM 0 HD13 LEU A 135 -8.008 -11.631 -3.005 1.00 1.27 H new ATOM 0 HD21 LEU A 135 -5.419 -11.913 -4.644 1.00 1.41 H new ATOM 0 HD22 LEU A 135 -7.047 -12.126 -5.330 1.00 1.41 H new ATOM 0 HD23 LEU A 135 -5.923 -10.952 -6.054 1.00 1.41 H new ATOM 2141 N VAL A 136 -9.675 -12.279 -4.081 1.00 0.36 N ATOM 2142 CA VAL A 136 -10.500 -12.942 -3.084 1.00 0.38 C ATOM 2143 C VAL A 136 -9.642 -13.658 -2.045 1.00 0.42 C ATOM 2144 O VAL A 136 -8.871 -14.560 -2.372 1.00 0.53 O ATOM 2145 CB VAL A 136 -11.491 -13.933 -3.728 1.00 0.41 C ATOM 2146 CG1 VAL A 136 -10.770 -14.870 -4.686 1.00 0.46 C ATOM 2147 CG2 VAL A 136 -12.234 -14.721 -2.659 1.00 0.44 C ATOM 0 H VAL A 136 -8.891 -12.835 -4.421 1.00 0.36 H new ATOM 0 HA VAL A 136 -11.077 -12.165 -2.583 1.00 0.38 H new ATOM 0 HB VAL A 136 -12.222 -13.361 -4.299 1.00 0.41 H new ATOM 0 HG11 VAL A 136 -11.488 -15.560 -5.129 1.00 0.46 H new ATOM 0 HG12 VAL A 136 -10.293 -14.288 -5.474 1.00 0.46 H new ATOM 0 HG13 VAL A 136 -10.012 -15.434 -4.142 1.00 0.46 H new ATOM 0 HG21 VAL A 136 -12.928 -15.414 -3.134 1.00 0.44 H new ATOM 0 HG22 VAL A 136 -11.519 -15.280 -2.056 1.00 0.44 H new ATOM 0 HG23 VAL A 136 -12.788 -14.034 -2.020 1.00 0.44 H new ATOM 2157 N PHE A 137 -9.789 -13.240 -0.790 1.00 0.46 N ATOM 2158 CA PHE A 137 -9.041 -13.824 0.313 1.00 0.53 C ATOM 2159 C PHE A 137 -9.248 -15.330 0.369 1.00 0.57 C ATOM 2160 O PHE A 137 -10.300 -15.829 -0.035 1.00 0.60 O ATOM 2161 CB PHE A 137 -9.490 -13.192 1.636 1.00 0.59 C ATOM 2162 CG PHE A 137 -9.018 -11.776 1.838 1.00 0.58 C ATOM 2163 CD1 PHE A 137 -9.189 -10.818 0.850 1.00 0.55 C ATOM 2164 CD2 PHE A 137 -8.406 -11.404 3.026 1.00 0.66 C ATOM 2165 CE1 PHE A 137 -8.759 -9.521 1.041 1.00 0.59 C ATOM 2166 CE2 PHE A 137 -7.973 -10.106 3.221 1.00 0.68 C ATOM 2167 CZ PHE A 137 -8.151 -9.164 2.227 1.00 0.64 C ATOM 0 H PHE A 137 -10.426 -12.493 -0.513 1.00 0.46 H new ATOM 0 HA PHE A 137 -7.981 -13.626 0.154 1.00 0.53 H new ATOM 0 HB2 PHE A 137 -10.579 -13.210 1.683 1.00 0.59 H new ATOM 0 HB3 PHE A 137 -9.126 -13.805 2.460 1.00 0.59 H new ATOM 0 HD1 PHE A 137 -9.665 -11.091 -0.081 1.00 0.55 H new ATOM 0 HD2 PHE A 137 -8.266 -12.137 3.807 1.00 0.66 H new ATOM 0 HE1 PHE A 137 -8.898 -8.786 0.263 1.00 0.59 H new ATOM 0 HE2 PHE A 137 -7.496 -9.829 4.150 1.00 0.68 H new ATOM 0 HZ PHE A 137 -7.815 -8.149 2.378 1.00 0.64 H new ATOM 2177 N PRO A 138 -8.258 -16.082 0.886 1.00 0.60 N ATOM 2178 CA PRO A 138 -8.360 -17.536 1.008 1.00 0.66 C ATOM 2179 C PRO A 138 -9.662 -17.931 1.692 1.00 0.73 C ATOM 2180 O PRO A 138 -10.149 -19.052 1.548 1.00 0.78 O ATOM 2181 CB PRO A 138 -7.157 -17.925 1.883 1.00 0.70 C ATOM 2182 CG PRO A 138 -6.589 -16.640 2.396 1.00 0.75 C ATOM 2183 CD PRO A 138 -6.981 -15.581 1.409 1.00 0.62 C ATOM 0 HA PRO A 138 -8.357 -18.035 0.039 1.00 0.66 H new ATOM 0 HB2 PRO A 138 -7.465 -18.571 2.705 1.00 0.70 H new ATOM 0 HB3 PRO A 138 -6.416 -18.476 1.305 1.00 0.70 H new ATOM 0 HG2 PRO A 138 -6.980 -16.411 3.387 1.00 0.75 H new ATOM 0 HG3 PRO A 138 -5.505 -16.704 2.488 1.00 0.75 H new ATOM 0 HD2 PRO A 138 -7.093 -14.606 1.884 1.00 0.62 H new ATOM 0 HD3 PRO A 138 -6.237 -15.468 0.620 1.00 0.62 H new ATOM 2191 N ASP A 139 -10.217 -16.976 2.431 1.00 0.77 N ATOM 2192 CA ASP A 139 -11.468 -17.172 3.150 1.00 0.87 C ATOM 2193 C ASP A 139 -12.631 -17.328 2.177 1.00 0.80 C ATOM 2194 O ASP A 139 -13.241 -18.393 2.088 1.00 1.03 O ATOM 2195 CB ASP A 139 -11.722 -15.979 4.071 1.00 0.92 C ATOM 2196 CG ASP A 139 -12.808 -16.252 5.092 1.00 1.33 C ATOM 2197 OD1 ASP A 139 -13.956 -16.520 4.680 1.00 1.72 O ATOM 2198 OD2 ASP A 139 -12.511 -16.197 6.304 1.00 1.91 O ATOM 0 H ASP A 139 -9.812 -16.047 2.547 1.00 0.77 H new ATOM 0 HA ASP A 139 -11.390 -18.083 3.743 1.00 0.87 H new ATOM 0 HB2 ASP A 139 -10.798 -15.721 4.589 1.00 0.92 H new ATOM 0 HB3 ASP A 139 -12.003 -15.114 3.470 1.00 0.92 H new ATOM 2203 N GLY A 140 -12.931 -16.256 1.446 1.00 0.59 N ATOM 2204 CA GLY A 140 -14.020 -16.290 0.484 1.00 0.59 C ATOM 2205 C GLY A 140 -14.604 -14.919 0.196 1.00 0.61 C ATOM 2206 O GLY A 140 -15.746 -14.811 -0.253 1.00 0.95 O ATOM 0 H GLY A 140 -12.439 -15.364 1.503 1.00 0.59 H new ATOM 0 HA2 GLY A 140 -13.661 -16.728 -0.447 1.00 0.59 H new ATOM 0 HA3 GLY A 140 -14.808 -16.942 0.860 1.00 0.59 H new ATOM 2210 N GLU A 141 -13.826 -13.865 0.446 1.00 0.51 N ATOM 2211 CA GLU A 141 -14.288 -12.502 0.199 1.00 0.62 C ATOM 2212 C GLU A 141 -13.359 -11.779 -0.770 1.00 0.53 C ATOM 2213 O GLU A 141 -12.231 -12.203 -0.985 1.00 0.59 O ATOM 2214 CB GLU A 141 -14.390 -11.711 1.503 1.00 0.86 C ATOM 2215 CG GLU A 141 -13.061 -11.468 2.194 1.00 1.38 C ATOM 2216 CD GLU A 141 -12.586 -12.672 2.986 1.00 2.15 C ATOM 2217 OE1 GLU A 141 -13.283 -13.707 2.968 1.00 2.53 O ATOM 2218 OE2 GLU A 141 -11.510 -12.584 3.613 1.00 2.76 O ATOM 0 H GLU A 141 -12.878 -13.930 0.817 1.00 0.51 H new ATOM 0 HA GLU A 141 -15.280 -12.569 -0.248 1.00 0.62 H new ATOM 0 HB2 GLU A 141 -14.859 -10.749 1.295 1.00 0.86 H new ATOM 0 HB3 GLU A 141 -15.049 -12.245 2.187 1.00 0.86 H new ATOM 0 HG2 GLU A 141 -12.310 -11.209 1.448 1.00 1.38 H new ATOM 0 HG3 GLU A 141 -13.154 -10.612 2.862 1.00 1.38 H new ATOM 2225 N MET A 142 -13.848 -10.687 -1.348 1.00 0.48 N ATOM 2226 CA MET A 142 -13.065 -9.903 -2.304 1.00 0.41 C ATOM 2227 C MET A 142 -12.974 -8.448 -1.869 1.00 0.37 C ATOM 2228 O MET A 142 -13.716 -8.027 -0.986 1.00 0.39 O ATOM 2229 CB MET A 142 -13.714 -9.982 -3.687 1.00 0.42 C ATOM 2230 CG MET A 142 -13.930 -11.404 -4.178 1.00 0.49 C ATOM 2231 SD MET A 142 -14.670 -11.471 -5.822 1.00 0.55 S ATOM 2232 CE MET A 142 -13.404 -10.665 -6.802 1.00 1.68 C ATOM 0 H MET A 142 -14.784 -10.322 -1.173 1.00 0.48 H new ATOM 0 HA MET A 142 -12.057 -10.316 -2.343 1.00 0.41 H new ATOM 0 HB2 MET A 142 -14.674 -9.467 -3.658 1.00 0.42 H new ATOM 0 HB3 MET A 142 -13.088 -9.450 -4.404 1.00 0.42 H new ATOM 0 HG2 MET A 142 -12.974 -11.927 -4.193 1.00 0.49 H new ATOM 0 HG3 MET A 142 -14.572 -11.933 -3.474 1.00 0.49 H new ATOM 0 HE1 MET A 142 -13.283 -11.195 -7.747 1.00 1.68 H new ATOM 0 HE2 MET A 142 -13.698 -9.634 -6.999 1.00 1.68 H new ATOM 0 HE3 MET A 142 -12.460 -10.675 -6.257 1.00 1.68 H new ATOM 2242 N LEU A 143 -12.081 -7.666 -2.491 1.00 0.38 N ATOM 2243 CA LEU A 143 -11.962 -6.264 -2.130 1.00 0.39 C ATOM 2244 C LEU A 143 -13.298 -5.576 -2.378 1.00 0.41 C ATOM 2245 O LEU A 143 -13.632 -4.579 -1.741 1.00 0.50 O ATOM 2246 CB LEU A 143 -10.857 -5.594 -2.949 1.00 0.44 C ATOM 2247 CG LEU A 143 -10.052 -4.523 -2.209 1.00 0.51 C ATOM 2248 CD1 LEU A 143 -10.964 -3.465 -1.615 1.00 1.38 C ATOM 2249 CD2 LEU A 143 -9.192 -5.156 -1.126 1.00 1.56 C ATOM 0 H LEU A 143 -11.449 -7.979 -3.228 1.00 0.38 H new ATOM 0 HA LEU A 143 -11.698 -6.180 -1.076 1.00 0.39 H new ATOM 0 HB2 LEU A 143 -10.170 -6.364 -3.300 1.00 0.44 H new ATOM 0 HB3 LEU A 143 -11.306 -5.141 -3.833 1.00 0.44 H new ATOM 0 HG LEU A 143 -9.398 -4.035 -2.931 1.00 0.51 H new ATOM 0 HD11 LEU A 143 -10.364 -2.718 -1.096 1.00 1.38 H new ATOM 0 HD12 LEU A 143 -11.532 -2.985 -2.412 1.00 1.38 H new ATOM 0 HD13 LEU A 143 -11.652 -3.932 -0.910 1.00 1.38 H new ATOM 0 HD21 LEU A 143 -8.627 -4.380 -0.610 1.00 1.56 H new ATOM 0 HD22 LEU A 143 -9.831 -5.675 -0.411 1.00 1.56 H new ATOM 0 HD23 LEU A 143 -8.501 -5.867 -1.579 1.00 1.56 H new ATOM 2261 N ARG A 144 -14.065 -6.142 -3.305 1.00 0.39 N ATOM 2262 CA ARG A 144 -15.379 -5.618 -3.644 1.00 0.47 C ATOM 2263 C ARG A 144 -16.388 -5.973 -2.561 1.00 0.49 C ATOM 2264 O ARG A 144 -17.112 -5.111 -2.068 1.00 0.56 O ATOM 2265 CB ARG A 144 -15.838 -6.168 -4.997 1.00 0.54 C ATOM 2266 CG ARG A 144 -17.259 -5.773 -5.373 1.00 0.77 C ATOM 2267 CD ARG A 144 -17.482 -4.273 -5.241 1.00 0.88 C ATOM 2268 NE ARG A 144 -18.764 -3.856 -5.803 1.00 1.47 N ATOM 2269 CZ ARG A 144 -19.073 -3.946 -7.094 1.00 2.12 C ATOM 2270 NH1 ARG A 144 -18.187 -4.412 -7.963 1.00 2.68 N ATOM 2271 NH2 ARG A 144 -20.271 -3.564 -7.519 1.00 2.83 N ATOM 0 H ARG A 144 -13.794 -6.969 -3.837 1.00 0.39 H new ATOM 0 HA ARG A 144 -15.311 -4.532 -3.713 1.00 0.47 H new ATOM 0 HB2 ARG A 144 -15.156 -5.816 -5.771 1.00 0.54 H new ATOM 0 HB3 ARG A 144 -15.766 -7.255 -4.979 1.00 0.54 H new ATOM 0 HG2 ARG A 144 -17.463 -6.082 -6.398 1.00 0.77 H new ATOM 0 HG3 ARG A 144 -17.965 -6.303 -4.734 1.00 0.77 H new ATOM 0 HD2 ARG A 144 -17.440 -3.992 -4.189 1.00 0.88 H new ATOM 0 HD3 ARG A 144 -16.675 -3.741 -5.746 1.00 0.88 H new ATOM 0 HE ARG A 144 -19.464 -3.473 -5.168 1.00 1.47 H new ATOM 0 HH11 ARG A 144 -17.263 -4.704 -7.643 1.00 2.68 H new ATOM 0 HH12 ARG A 144 -18.429 -4.479 -8.952 1.00 2.68 H new ATOM 0 HH21 ARG A 144 -20.956 -3.201 -6.856 1.00 2.83 H new ATOM 0 HH22 ARG A 144 -20.507 -3.633 -8.509 1.00 2.83 H new ATOM 2285 N GLN A 145 -16.420 -7.249 -2.186 1.00 0.47 N ATOM 2286 CA GLN A 145 -17.331 -7.712 -1.148 1.00 0.52 C ATOM 2287 C GLN A 145 -17.035 -7.001 0.166 1.00 0.48 C ATOM 2288 O GLN A 145 -17.947 -6.656 0.918 1.00 0.56 O ATOM 2289 CB GLN A 145 -17.210 -9.232 -0.980 1.00 0.57 C ATOM 2290 CG GLN A 145 -18.033 -9.807 0.166 1.00 0.64 C ATOM 2291 CD GLN A 145 -17.313 -9.773 1.508 1.00 0.60 C ATOM 2292 OE1 GLN A 145 -17.825 -10.281 2.505 1.00 0.67 O ATOM 2293 NE2 GLN A 145 -16.131 -9.167 1.545 1.00 0.52 N ATOM 0 H GLN A 145 -15.827 -7.977 -2.585 1.00 0.47 H new ATOM 0 HA GLN A 145 -18.354 -7.477 -1.443 1.00 0.52 H new ATOM 0 HB2 GLN A 145 -17.517 -9.713 -1.909 1.00 0.57 H new ATOM 0 HB3 GLN A 145 -16.162 -9.485 -0.821 1.00 0.57 H new ATOM 0 HG2 GLN A 145 -18.966 -9.249 0.249 1.00 0.64 H new ATOM 0 HG3 GLN A 145 -18.298 -10.838 -0.069 1.00 0.64 H new ATOM 0 HE21 GLN A 145 -15.741 -8.758 0.696 1.00 0.52 H new ATOM 0 HE22 GLN A 145 -15.614 -9.111 2.422 1.00 0.52 H new ATOM 2302 N ILE A 146 -15.750 -6.777 0.425 1.00 0.40 N ATOM 2303 CA ILE A 146 -15.322 -6.100 1.639 1.00 0.40 C ATOM 2304 C ILE A 146 -15.749 -4.642 1.609 1.00 0.43 C ATOM 2305 O ILE A 146 -16.479 -4.186 2.487 1.00 0.53 O ATOM 2306 CB ILE A 146 -13.792 -6.183 1.826 1.00 0.42 C ATOM 2307 CG1 ILE A 146 -13.350 -7.646 1.929 1.00 0.43 C ATOM 2308 CG2 ILE A 146 -13.365 -5.407 3.063 1.00 0.50 C ATOM 2309 CD1 ILE A 146 -11.849 -7.824 2.026 1.00 0.78 C ATOM 0 H ILE A 146 -14.988 -7.056 -0.193 1.00 0.40 H new ATOM 0 HA ILE A 146 -15.799 -6.605 2.479 1.00 0.40 H new ATOM 0 HB ILE A 146 -13.309 -5.735 0.957 1.00 0.42 H new ATOM 0 HG12 ILE A 146 -13.818 -8.097 2.804 1.00 0.43 H new ATOM 0 HG13 ILE A 146 -13.716 -8.189 1.057 1.00 0.43 H new ATOM 0 HG21 ILE A 146 -12.284 -5.476 3.180 1.00 0.50 H new ATOM 0 HG22 ILE A 146 -13.652 -4.361 2.954 1.00 0.50 H new ATOM 0 HG23 ILE A 146 -13.853 -5.827 3.943 1.00 0.50 H new ATOM 0 HD11 ILE A 146 -11.612 -8.886 2.096 1.00 0.78 H new ATOM 0 HD12 ILE A 146 -11.375 -7.404 1.139 1.00 0.78 H new ATOM 0 HD13 ILE A 146 -11.478 -7.310 2.913 1.00 0.78 H new ATOM 2321 N LEU A 147 -15.297 -3.914 0.587 1.00 0.42 N ATOM 2322 CA LEU A 147 -15.645 -2.508 0.449 1.00 0.50 C ATOM 2323 C LEU A 147 -17.150 -2.306 0.310 1.00 0.59 C ATOM 2324 O LEU A 147 -17.660 -1.218 0.567 1.00 0.72 O ATOM 2325 CB LEU A 147 -14.917 -1.893 -0.739 1.00 0.55 C ATOM 2326 CG LEU A 147 -13.515 -1.375 -0.426 1.00 0.61 C ATOM 2327 CD1 LEU A 147 -12.851 -0.829 -1.677 1.00 0.76 C ATOM 2328 CD2 LEU A 147 -13.582 -0.305 0.655 1.00 0.62 C ATOM 0 H LEU A 147 -14.693 -4.276 -0.151 1.00 0.42 H new ATOM 0 HA LEU A 147 -15.328 -2.003 1.361 1.00 0.50 H new ATOM 0 HB2 LEU A 147 -14.846 -2.639 -1.531 1.00 0.55 H new ATOM 0 HB3 LEU A 147 -15.516 -1.070 -1.129 1.00 0.55 H new ATOM 0 HG LEU A 147 -12.912 -2.206 -0.059 1.00 0.61 H new ATOM 0 HD11 LEU A 147 -11.853 -0.466 -1.430 1.00 0.76 H new ATOM 0 HD12 LEU A 147 -12.775 -1.620 -2.423 1.00 0.76 H new ATOM 0 HD13 LEU A 147 -13.447 -0.009 -2.077 1.00 0.76 H new ATOM 0 HD21 LEU A 147 -12.577 0.058 0.871 1.00 0.62 H new ATOM 0 HD22 LEU A 147 -14.200 0.523 0.309 1.00 0.62 H new ATOM 0 HD23 LEU A 147 -14.017 -0.729 1.560 1.00 0.62 H new ATOM 2340 N HIS A 148 -17.856 -3.360 -0.075 1.00 0.59 N ATOM 2341 CA HIS A 148 -19.303 -3.286 -0.216 1.00 0.73 C ATOM 2342 C HIS A 148 -19.922 -2.927 1.130 1.00 0.79 C ATOM 2343 O HIS A 148 -21.057 -2.455 1.211 1.00 0.90 O ATOM 2344 CB HIS A 148 -19.856 -4.621 -0.723 1.00 0.77 C ATOM 2345 CG HIS A 148 -21.333 -4.618 -0.974 1.00 0.93 C ATOM 2346 ND1 HIS A 148 -22.268 -4.435 0.024 1.00 1.36 N ATOM 2347 CD2 HIS A 148 -22.036 -4.776 -2.119 1.00 1.58 C ATOM 2348 CE1 HIS A 148 -23.482 -4.483 -0.497 1.00 1.28 C ATOM 2349 NE2 HIS A 148 -23.368 -4.688 -1.797 1.00 1.34 N ATOM 0 H HIS A 148 -17.453 -4.271 -0.294 1.00 0.59 H new ATOM 0 HA HIS A 148 -19.557 -2.515 -0.944 1.00 0.73 H new ATOM 0 HB2 HIS A 148 -19.342 -4.887 -1.647 1.00 0.77 H new ATOM 0 HB3 HIS A 148 -19.624 -5.398 0.006 1.00 0.77 H new ATOM 0 HD1 HIS A 148 -22.056 -4.286 1.010 1.00 1.36 H new ATOM 0 HD2 HIS A 148 -21.625 -4.941 -3.104 1.00 1.58 H new ATOM 0 HE1 HIS A 148 -24.408 -4.373 0.047 1.00 1.28 H new ATOM 2358 N THR A 149 -19.151 -3.166 2.184 1.00 0.77 N ATOM 2359 CA THR A 149 -19.584 -2.894 3.548 1.00 0.88 C ATOM 2360 C THR A 149 -18.717 -1.807 4.200 1.00 0.86 C ATOM 2361 O THR A 149 -18.993 -1.365 5.316 1.00 0.94 O ATOM 2362 CB THR A 149 -19.515 -4.197 4.357 1.00 0.90 C ATOM 2363 OG1 THR A 149 -20.413 -5.156 3.828 1.00 1.10 O ATOM 2364 CG2 THR A 149 -19.842 -4.029 5.826 1.00 1.18 C ATOM 0 H THR A 149 -18.210 -3.553 2.117 1.00 0.77 H new ATOM 0 HA THR A 149 -20.609 -2.524 3.531 1.00 0.88 H new ATOM 0 HB THR A 149 -18.478 -4.524 4.276 1.00 0.90 H new ATOM 0 HG1 THR A 149 -20.356 -5.982 4.353 1.00 1.10 H new ATOM 0 HG21 THR A 149 -19.771 -4.994 6.327 1.00 1.18 H new ATOM 0 HG22 THR A 149 -19.136 -3.332 6.279 1.00 1.18 H new ATOM 0 HG23 THR A 149 -20.854 -3.639 5.931 1.00 1.18 H new ATOM 2372 N ARG A 150 -17.663 -1.388 3.503 1.00 0.86 N ATOM 2373 CA ARG A 150 -16.752 -0.366 4.026 1.00 0.93 C ATOM 2374 C ARG A 150 -17.091 1.027 3.515 1.00 0.95 C ATOM 2375 O ARG A 150 -17.014 2.004 4.263 1.00 1.05 O ATOM 2376 CB ARG A 150 -15.316 -0.695 3.627 1.00 0.99 C ATOM 2377 CG ARG A 150 -14.935 -2.136 3.887 1.00 0.96 C ATOM 2378 CD ARG A 150 -15.065 -2.496 5.360 1.00 1.26 C ATOM 2379 NE ARG A 150 -15.027 -3.940 5.578 1.00 2.01 N ATOM 2380 CZ ARG A 150 -15.245 -4.515 6.758 1.00 2.55 C ATOM 2381 NH1 ARG A 150 -15.508 -3.770 7.825 1.00 2.55 N ATOM 2382 NH2 ARG A 150 -15.199 -5.834 6.873 1.00 3.55 N ATOM 0 H ARG A 150 -17.417 -1.738 2.577 1.00 0.86 H new ATOM 0 HA ARG A 150 -16.862 -0.369 5.110 1.00 0.93 H new ATOM 0 HB2 ARG A 150 -15.182 -0.477 2.567 1.00 0.99 H new ATOM 0 HB3 ARG A 150 -14.636 -0.043 4.175 1.00 0.99 H new ATOM 0 HG2 ARG A 150 -15.571 -2.793 3.294 1.00 0.96 H new ATOM 0 HG3 ARG A 150 -13.909 -2.306 3.560 1.00 0.96 H new ATOM 0 HD2 ARG A 150 -14.258 -2.024 5.921 1.00 1.26 H new ATOM 0 HD3 ARG A 150 -16.001 -2.095 5.749 1.00 1.26 H new ATOM 0 HE ARG A 150 -14.822 -4.542 4.780 1.00 2.01 H new ATOM 0 HH11 ARG A 150 -15.543 -2.754 7.741 1.00 2.55 H new ATOM 0 HH12 ARG A 150 -15.675 -4.214 8.728 1.00 2.55 H new ATOM 0 HH21 ARG A 150 -14.996 -6.410 6.056 1.00 3.55 H new ATOM 0 HH22 ARG A 150 -15.366 -6.273 7.778 1.00 3.55 H new ATOM 2396 N ALA A 151 -17.433 1.109 2.230 1.00 0.94 N ATOM 2397 CA ALA A 151 -17.756 2.377 1.579 1.00 1.04 C ATOM 2398 C ALA A 151 -16.480 3.127 1.204 1.00 1.11 C ATOM 2399 O ALA A 151 -16.117 4.122 1.832 1.00 1.59 O ATOM 2400 CB ALA A 151 -18.651 3.240 2.458 1.00 1.61 C ATOM 0 H ALA A 151 -17.494 0.300 1.612 1.00 0.94 H new ATOM 0 HA ALA A 151 -18.307 2.153 0.666 1.00 1.04 H new ATOM 0 HB1 ALA A 151 -18.872 4.176 1.944 1.00 1.61 H new ATOM 0 HB2 ALA A 151 -19.581 2.709 2.662 1.00 1.61 H new ATOM 0 HB3 ALA A 151 -18.141 3.454 3.397 1.00 1.61 H new ATOM 2406 N PHE A 152 -15.804 2.627 0.169 1.00 1.09 N ATOM 2407 CA PHE A 152 -14.556 3.216 -0.327 1.00 1.61 C ATOM 2408 C PHE A 152 -14.752 4.625 -0.848 1.00 1.38 C ATOM 2409 O PHE A 152 -13.838 5.261 -1.374 1.00 1.90 O ATOM 2410 CB PHE A 152 -13.996 2.340 -1.435 1.00 2.51 C ATOM 2411 CG PHE A 152 -15.020 2.028 -2.493 1.00 3.40 C ATOM 2412 CD1 PHE A 152 -15.467 3.019 -3.341 1.00 4.44 C ATOM 2413 CD2 PHE A 152 -15.528 0.749 -2.637 1.00 3.42 C ATOM 2414 CE1 PHE A 152 -16.405 2.748 -4.319 1.00 5.41 C ATOM 2415 CE2 PHE A 152 -16.467 0.466 -3.612 1.00 4.40 C ATOM 2416 CZ PHE A 152 -16.914 1.440 -4.438 1.00 5.37 C ATOM 0 H PHE A 152 -16.105 1.802 -0.350 1.00 1.09 H new ATOM 0 HA PHE A 152 -13.859 3.271 0.510 1.00 1.61 H new ATOM 0 HB2 PHE A 152 -13.144 2.841 -1.895 1.00 2.51 H new ATOM 0 HB3 PHE A 152 -13.625 1.409 -1.006 1.00 2.51 H new ATOM 0 HD1 PHE A 152 -15.078 4.022 -3.239 1.00 4.44 H new ATOM 0 HD2 PHE A 152 -15.187 -0.038 -1.980 1.00 3.42 H new ATOM 0 HE1 PHE A 152 -16.743 3.529 -4.984 1.00 5.41 H new ATOM 0 HE2 PHE A 152 -16.846 -0.540 -3.715 1.00 4.40 H new ATOM 0 HZ PHE A 152 -17.659 1.215 -5.187 1.00 5.37 H new ATOM 2426 N ASP A 153 -15.951 5.079 -0.683 1.00 1.04 N ATOM 2427 CA ASP A 153 -16.362 6.414 -1.108 1.00 1.18 C ATOM 2428 C ASP A 153 -15.482 7.478 -0.466 1.00 1.01 C ATOM 2429 O ASP A 153 -15.445 8.626 -0.913 1.00 1.40 O ATOM 2430 CB ASP A 153 -17.827 6.661 -0.747 1.00 1.46 C ATOM 2431 CG ASP A 153 -18.763 5.670 -1.412 1.00 2.05 C ATOM 2432 OD1 ASP A 153 -18.614 4.454 -1.167 1.00 2.54 O ATOM 2433 OD2 ASP A 153 -19.646 6.110 -2.180 1.00 2.52 O ATOM 0 H ASP A 153 -16.697 4.540 -0.245 1.00 1.04 H new ATOM 0 HA ASP A 153 -16.249 6.476 -2.190 1.00 1.18 H new ATOM 0 HB2 ASP A 153 -17.947 6.600 0.335 1.00 1.46 H new ATOM 0 HB3 ASP A 153 -18.105 7.673 -1.042 1.00 1.46 H new ATOM 2438 N LYS A 154 -14.771 7.085 0.583 1.00 0.68 N ATOM 2439 CA LYS A 154 -13.882 7.987 1.298 1.00 0.59 C ATOM 2440 C LYS A 154 -12.672 8.353 0.440 1.00 0.52 C ATOM 2441 O LYS A 154 -12.732 8.309 -0.789 1.00 0.67 O ATOM 2442 CB LYS A 154 -13.420 7.331 2.600 1.00 0.63 C ATOM 2443 CG LYS A 154 -14.564 6.926 3.517 1.00 0.79 C ATOM 2444 CD LYS A 154 -14.057 6.324 4.818 1.00 0.93 C ATOM 2445 CE LYS A 154 -13.251 5.057 4.572 1.00 0.94 C ATOM 2446 NZ LYS A 154 -12.727 4.474 5.839 1.00 1.77 N ATOM 0 H LYS A 154 -14.795 6.137 0.959 1.00 0.68 H new ATOM 0 HA LYS A 154 -14.428 8.902 1.526 1.00 0.59 H new ATOM 0 HB2 LYS A 154 -12.827 6.448 2.362 1.00 0.63 H new ATOM 0 HB3 LYS A 154 -12.765 8.021 3.132 1.00 0.63 H new ATOM 0 HG2 LYS A 154 -15.181 7.798 3.736 1.00 0.79 H new ATOM 0 HG3 LYS A 154 -15.201 6.204 3.006 1.00 0.79 H new ATOM 0 HD2 LYS A 154 -13.438 7.054 5.341 1.00 0.93 H new ATOM 0 HD3 LYS A 154 -14.902 6.098 5.469 1.00 0.93 H new ATOM 0 HE2 LYS A 154 -13.877 4.322 4.066 1.00 0.94 H new ATOM 0 HE3 LYS A 154 -12.419 5.281 3.904 1.00 0.94 H new ATOM 0 HZ1 LYS A 154 -12.648 3.442 5.740 1.00 1.77 H new ATOM 0 HZ2 LYS A 154 -11.789 4.875 6.044 1.00 1.77 H new ATOM 0 HZ3 LYS A 154 -13.377 4.698 6.619 1.00 1.77 H new ATOM 2460 N LEU A 155 -11.573 8.704 1.103 1.00 0.55 N ATOM 2461 CA LEU A 155 -10.333 9.074 0.424 1.00 0.57 C ATOM 2462 C LEU A 155 -10.589 10.084 -0.691 1.00 0.51 C ATOM 2463 O LEU A 155 -10.474 9.750 -1.872 1.00 0.61 O ATOM 2464 CB LEU A 155 -9.644 7.850 -0.188 1.00 0.67 C ATOM 2465 CG LEU A 155 -9.454 6.625 0.715 1.00 0.81 C ATOM 2466 CD1 LEU A 155 -10.773 5.910 0.954 1.00 1.81 C ATOM 2467 CD2 LEU A 155 -8.440 5.687 0.084 1.00 1.95 C ATOM 0 H LEU A 155 -11.516 8.740 2.121 1.00 0.55 H new ATOM 0 HA LEU A 155 -9.688 9.518 1.182 1.00 0.57 H new ATOM 0 HB2 LEU A 155 -10.219 7.540 -1.060 1.00 0.67 H new ATOM 0 HB3 LEU A 155 -8.663 8.160 -0.547 1.00 0.67 H new ATOM 0 HG LEU A 155 -9.083 6.957 1.685 1.00 0.81 H new ATOM 0 HD11 LEU A 155 -10.607 5.046 1.597 1.00 1.81 H new ATOM 0 HD12 LEU A 155 -11.474 6.592 1.435 1.00 1.81 H new ATOM 0 HD13 LEU A 155 -11.185 5.579 0.001 1.00 1.81 H new ATOM 0 HD21 LEU A 155 -8.303 4.815 0.724 1.00 1.95 H new ATOM 0 HD22 LEU A 155 -8.800 5.366 -0.894 1.00 1.95 H new ATOM 0 HD23 LEU A 155 -7.488 6.205 -0.032 1.00 1.95 H new ATOM 2479 N ASN A 156 -10.917 11.317 -0.329 1.00 0.54 N ATOM 2480 CA ASN A 156 -11.158 12.348 -1.326 1.00 0.54 C ATOM 2481 C ASN A 156 -9.869 12.644 -2.074 1.00 0.53 C ATOM 2482 O ASN A 156 -8.837 12.896 -1.465 1.00 0.75 O ATOM 2483 CB ASN A 156 -11.687 13.615 -0.667 1.00 0.63 C ATOM 2484 CG ASN A 156 -11.788 14.771 -1.637 1.00 1.07 C ATOM 2485 OD1 ASN A 156 -12.525 14.712 -2.622 1.00 2.09 O ATOM 2486 ND2 ASN A 156 -11.041 15.831 -1.363 1.00 1.34 N ATOM 0 H ASN A 156 -11.021 11.625 0.638 1.00 0.54 H new ATOM 0 HA ASN A 156 -11.909 11.990 -2.031 1.00 0.54 H new ATOM 0 HB2 ASN A 156 -12.670 13.416 -0.240 1.00 0.63 H new ATOM 0 HB3 ASN A 156 -11.031 13.893 0.158 1.00 0.63 H new ATOM 0 HD21 ASN A 156 -11.062 16.643 -1.980 1.00 1.34 H new ATOM 0 HD22 ASN A 156 -10.445 15.835 -0.535 1.00 1.34 H new ATOM 2493 N LYS A 157 -9.933 12.584 -3.397 1.00 0.46 N ATOM 2494 CA LYS A 157 -8.768 12.818 -4.239 1.00 0.46 C ATOM 2495 C LYS A 157 -8.041 14.110 -3.875 1.00 0.48 C ATOM 2496 O LYS A 157 -8.670 15.122 -3.567 1.00 0.64 O ATOM 2497 CB LYS A 157 -9.208 12.865 -5.699 1.00 0.54 C ATOM 2498 CG LYS A 157 -9.709 11.537 -6.271 1.00 0.60 C ATOM 2499 CD LYS A 157 -10.207 10.560 -5.214 1.00 1.33 C ATOM 2500 CE LYS A 157 -10.762 9.296 -5.845 1.00 1.77 C ATOM 2501 NZ LYS A 157 -11.893 9.585 -6.771 1.00 2.30 N ATOM 0 H LYS A 157 -10.787 12.373 -3.914 1.00 0.46 H new ATOM 0 HA LYS A 157 -8.068 11.998 -4.078 1.00 0.46 H new ATOM 0 HB2 LYS A 157 -10.000 13.607 -5.800 1.00 0.54 H new ATOM 0 HB3 LYS A 157 -8.369 13.210 -6.304 1.00 0.54 H new ATOM 0 HG2 LYS A 157 -10.516 11.737 -6.976 1.00 0.60 H new ATOM 0 HG3 LYS A 157 -8.903 11.068 -6.835 1.00 0.60 H new ATOM 0 HD2 LYS A 157 -9.390 10.303 -4.540 1.00 1.33 H new ATOM 0 HD3 LYS A 157 -10.980 11.037 -4.611 1.00 1.33 H new ATOM 0 HE2 LYS A 157 -9.969 8.784 -6.390 1.00 1.77 H new ATOM 0 HE3 LYS A 157 -11.099 8.617 -5.061 1.00 1.77 H new ATOM 0 HZ1 LYS A 157 -12.434 8.713 -6.941 1.00 2.30 H new ATOM 0 HZ2 LYS A 157 -12.516 10.301 -6.346 1.00 2.30 H new ATOM 0 HZ3 LYS A 157 -11.520 9.943 -7.674 1.00 2.30 H new ATOM 2515 N TRP A 158 -6.709 14.050 -3.935 1.00 0.45 N ATOM 2516 CA TRP A 158 -5.844 15.192 -3.639 1.00 0.54 C ATOM 2517 C TRP A 158 -6.490 16.509 -4.068 1.00 0.75 C ATOM 2518 O TRP A 158 -6.750 16.673 -5.279 1.00 1.21 O ATOM 2519 CB TRP A 158 -4.505 15.003 -4.364 1.00 0.62 C ATOM 2520 CG TRP A 158 -3.599 16.197 -4.311 1.00 0.71 C ATOM 2521 CD1 TRP A 158 -3.585 17.253 -5.177 1.00 0.98 C ATOM 2522 CD2 TRP A 158 -2.547 16.433 -3.371 1.00 0.72 C ATOM 2523 NE1 TRP A 158 -2.607 18.146 -4.814 1.00 1.04 N ATOM 2524 CE2 TRP A 158 -1.952 17.663 -3.712 1.00 0.89 C ATOM 2525 CE3 TRP A 158 -2.056 15.731 -2.268 1.00 0.81 C ATOM 2526 CZ2 TRP A 158 -0.891 18.202 -2.990 1.00 1.01 C ATOM 2527 CZ3 TRP A 158 -1.001 16.266 -1.554 1.00 1.03 C ATOM 2528 CH2 TRP A 158 -0.429 17.491 -1.917 1.00 1.07 C ATOM 2529 OXT TRP A 158 -6.730 17.364 -3.190 1.00 1.47 O ATOM 0 H TRP A 158 -6.199 13.205 -4.191 1.00 0.45 H new ATOM 0 HA TRP A 158 -5.685 15.239 -2.562 1.00 0.54 H new ATOM 0 HB2 TRP A 158 -3.987 14.149 -3.928 1.00 0.62 H new ATOM 0 HB3 TRP A 158 -4.702 14.757 -5.408 1.00 0.62 H new ATOM 0 HD1 TRP A 158 -4.246 17.369 -6.023 1.00 0.98 H new ATOM 0 HE1 TRP A 158 -2.402 19.026 -5.288 1.00 1.04 H new ATOM 0 HE3 TRP A 158 -2.493 14.787 -1.978 1.00 0.81 H new ATOM 0 HZ2 TRP A 158 -0.449 19.147 -3.267 1.00 1.01 H new ATOM 0 HZ3 TRP A 158 -0.611 15.730 -0.701 1.00 1.03 H new ATOM 0 HH2 TRP A 158 0.394 17.883 -1.338 1.00 1.07 H new TER 2540 TRP A 158