USER MOD reduce.3.24.130724 H: found=0, std=0, add=1086, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1086 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 95 ASN : amide:sc= -2.25 X(o=-2.2,f=-1.8) USER MOD Set 1.2: A 103 LYS NZ :NH3+ -112:sc= 0.0169 (180deg=0) USER MOD Set 2.1: A 65 ASN : amide:sc= -0.0271 K(o=-0.73,f=-2.4) USER MOD Set 2.2: A 69 GLN :FLIP amide:sc= -0.699 F(o=-1.6,f=-0.73) USER MOD Set 3.1: A 26 SER OG : rot -44:sc=-0.000252 USER MOD Set 3.2: A 66 HIS : no HD1:sc= 0 X(o=-0.00025,f=-0.027) USER MOD Set 4.1: A 13 ASN : amide:sc= 0.705 K(o=1.7,f=-0.56) USER MOD Set 4.2: A 46 TYR OH : rot 18:sc= 0.969 USER MOD Set 5.1: A 9 THR OG1 : rot 95:sc= 0.682 USER MOD Set 5.2: A 42 MET CE :methyl -168:sc= -0.545 (180deg=-0.0851) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=-0.003) USER MOD Single : A 10 THR OG1 : rot 75:sc= 1.26 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot -5:sc= -0.265 USER MOD Single : A 18 SER OG : rot 31:sc= 0.112 USER MOD Single : A 19 GLN : amide:sc= -0.572 X(o=-0.57,f=-0.4) USER MOD Single : A 21 SER OG : rot -127:sc= 1.52 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 81:sc= 1.18 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 GLN : amide:sc= -0.424 K(o=-0.42,f=-2!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00288) USER MOD Single : A 47 MET CE :methyl -121:sc= -5.14! (180deg=-7.72!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.0913 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 70 GLN : amide:sc= -0.117 X(o=-0.12,f=-0.049) USER MOD Single : A 72 LYS NZ :NH3+ 159:sc= -0.0455 (180deg=-0.379) USER MOD Single : A 74 GLN : amide:sc= -0.405 X(o=-0.41,f=-0.41) USER MOD Single : A 75 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00692) USER MOD Single : A 78 GLN : amide:sc= -0.022 X(o=-0.022,f=-0.022) USER MOD Single : A 80 GLN : amide:sc= -2.88 K(o=-2.9,f=-3.5!) USER MOD Single : A 82 SER OG : rot -40:sc= -0.864 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 104 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0128) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0.0342 X(o=0.034,f=-0.094) USER MOD Single : A 114 LYS NZ :NH3+ -121:sc= -4.13! (180deg=-5.84!) USER MOD Single : A 117 ASN : amide:sc= -0.129 K(o=-0.13,f=-1.4!) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ -147:sc= -0.29 (180deg=-1.47!) USER MOD Single : A 122 GLN : amide:sc= -0.352 X(o=-0.35,f=-0.34) USER MOD Single : A 125 ASN : amide:sc= -0.277 X(o=-0.28,f=0) USER MOD Single : A 130 SER OG : rot 169:sc= 1.27 USER MOD ----------------------------------------------------------------- ATOM 42 N SER A 5 0.232 -6.188 2.111 1.00 41.10 N ATOM 43 CA SER A 5 -0.114 -6.097 3.525 1.00 41.34 C ATOM 44 C SER A 5 -0.228 -7.485 4.146 1.00 32.25 C ATOM 45 O SER A 5 -0.037 -7.655 5.350 1.00 1.11 O ATOM 46 CB SER A 5 -1.430 -5.336 3.701 1.00 23.43 C ATOM 47 OG SER A 5 -1.214 -3.936 3.699 1.00 42.13 O ATOM 0 HA SER A 5 0.682 -5.555 4.035 1.00 41.34 H new ATOM 0 HB2 SER A 5 -2.118 -5.602 2.898 1.00 23.43 H new ATOM 0 HB3 SER A 5 -1.903 -5.633 4.637 1.00 23.43 H new ATOM 0 HG SER A 5 -2.070 -3.473 3.811 1.00 42.13 H new ATOM 53 N GLU A 6 -0.542 -8.475 3.316 1.00 44.20 N ATOM 54 CA GLU A 6 -0.682 -9.849 3.784 1.00 14.54 C ATOM 55 C GLU A 6 0.664 -10.412 4.229 1.00 20.50 C ATOM 56 O GLU A 6 0.733 -11.230 5.146 1.00 71.41 O ATOM 57 CB GLU A 6 -1.277 -10.728 2.683 1.00 74.04 C ATOM 58 CG GLU A 6 -1.683 -12.112 3.161 1.00 24.10 C ATOM 59 CD GLU A 6 -2.843 -12.076 4.136 1.00 55.41 C ATOM 60 OE1 GLU A 6 -4.005 -12.085 3.677 1.00 2.02 O ATOM 61 OE2 GLU A 6 -2.590 -12.038 5.358 1.00 22.03 O ATOM 0 H GLU A 6 -0.704 -8.351 2.317 1.00 44.20 H new ATOM 0 HA GLU A 6 -1.356 -9.847 4.641 1.00 14.54 H new ATOM 0 HB2 GLU A 6 -2.149 -10.228 2.262 1.00 74.04 H new ATOM 0 HB3 GLU A 6 -0.549 -10.830 1.878 1.00 74.04 H new ATOM 0 HG2 GLU A 6 -1.955 -12.724 2.301 1.00 24.10 H new ATOM 0 HG3 GLU A 6 -0.828 -12.593 3.637 1.00 24.10 H new ATOM 68 N GLN A 7 1.731 -9.969 3.572 1.00 73.13 N ATOM 69 CA GLN A 7 3.075 -10.430 3.898 1.00 31.42 C ATOM 70 C GLN A 7 3.480 -9.979 5.298 1.00 62.54 C ATOM 71 O GLN A 7 3.899 -10.789 6.125 1.00 22.30 O ATOM 72 CB GLN A 7 4.080 -9.908 2.870 1.00 31.21 C ATOM 73 CG GLN A 7 4.553 -10.969 1.889 1.00 3.41 C ATOM 74 CD GLN A 7 5.918 -10.657 1.307 1.00 70.41 C ATOM 75 OE1 GLN A 7 6.923 -10.654 2.018 1.00 21.12 O ATOM 76 NE2 GLN A 7 5.961 -10.394 0.006 1.00 12.32 N ATOM 0 H GLN A 7 1.691 -9.291 2.811 1.00 73.13 H new ATOM 0 HA GLN A 7 3.074 -11.520 3.873 1.00 31.42 H new ATOM 0 HB2 GLN A 7 3.626 -9.088 2.314 1.00 31.21 H new ATOM 0 HB3 GLN A 7 4.944 -9.498 3.394 1.00 31.21 H new ATOM 0 HG2 GLN A 7 4.589 -11.935 2.393 1.00 3.41 H new ATOM 0 HG3 GLN A 7 3.829 -11.059 1.079 1.00 3.41 H new ATOM 0 HE21 GLN A 7 5.103 -10.407 -0.546 1.00 12.32 H new ATOM 0 HE22 GLN A 7 6.852 -10.179 -0.442 1.00 12.32 H new ATOM 85 N PHE A 8 3.353 -8.682 5.556 1.00 61.12 N ATOM 86 CA PHE A 8 3.708 -8.123 6.855 1.00 14.21 C ATOM 87 C PHE A 8 2.907 -8.789 7.970 1.00 10.45 C ATOM 88 O PHE A 8 3.461 -9.188 8.996 1.00 55.43 O ATOM 89 CB PHE A 8 3.463 -6.612 6.868 1.00 70.51 C ATOM 90 CG PHE A 8 3.875 -5.949 8.151 1.00 65.22 C ATOM 91 CD1 PHE A 8 5.155 -6.120 8.654 1.00 43.42 C ATOM 92 CD2 PHE A 8 2.984 -5.155 8.853 1.00 32.05 C ATOM 93 CE1 PHE A 8 5.537 -5.511 9.834 1.00 20.15 C ATOM 94 CE2 PHE A 8 3.360 -4.544 10.035 1.00 40.54 C ATOM 95 CZ PHE A 8 4.639 -4.721 10.525 1.00 32.11 C ATOM 0 H PHE A 8 3.007 -7.998 4.883 1.00 61.12 H new ATOM 0 HA PHE A 8 4.767 -8.314 7.028 1.00 14.21 H new ATOM 0 HB2 PHE A 8 4.008 -6.156 6.041 1.00 70.51 H new ATOM 0 HB3 PHE A 8 2.404 -6.422 6.694 1.00 70.51 H new ATOM 0 HD1 PHE A 8 5.862 -6.736 8.118 1.00 43.42 H new ATOM 0 HD2 PHE A 8 1.983 -5.011 8.473 1.00 32.05 H new ATOM 0 HE1 PHE A 8 6.537 -5.653 10.216 1.00 20.15 H new ATOM 0 HE2 PHE A 8 2.655 -3.929 10.574 1.00 40.54 H new ATOM 0 HZ PHE A 8 4.936 -4.243 11.447 1.00 32.11 H new ATOM 105 N THR A 9 1.599 -8.905 7.764 1.00 52.23 N ATOM 106 CA THR A 9 0.721 -9.520 8.751 1.00 54.22 C ATOM 107 C THR A 9 1.046 -10.998 8.931 1.00 22.02 C ATOM 108 O THR A 9 1.276 -11.463 10.048 1.00 1.44 O ATOM 109 CB THR A 9 -0.760 -9.377 8.352 1.00 73.02 C ATOM 110 OG1 THR A 9 -0.979 -8.107 7.727 1.00 31.21 O ATOM 111 CG2 THR A 9 -1.664 -9.512 9.568 1.00 1.11 C ATOM 0 H THR A 9 1.124 -8.581 6.922 1.00 52.23 H new ATOM 0 HA THR A 9 0.888 -8.997 9.692 1.00 54.22 H new ATOM 0 HB THR A 9 -1.002 -10.174 7.649 1.00 73.02 H new ATOM 0 HG1 THR A 9 -0.919 -8.207 6.754 1.00 31.21 H new ATOM 0 HG21 THR A 9 -2.705 -9.407 9.261 1.00 1.11 H new ATOM 0 HG22 THR A 9 -1.517 -10.491 10.024 1.00 1.11 H new ATOM 0 HG23 THR A 9 -1.419 -8.734 10.291 1.00 1.11 H new ATOM 119 N THR A 10 1.065 -11.735 7.825 1.00 42.44 N ATOM 120 CA THR A 10 1.362 -13.161 7.861 1.00 44.12 C ATOM 121 C THR A 10 2.732 -13.422 8.478 1.00 52.34 C ATOM 122 O THR A 10 2.930 -14.415 9.178 1.00 0.41 O ATOM 123 CB THR A 10 1.321 -13.779 6.451 1.00 60.34 C ATOM 124 OG1 THR A 10 0.016 -13.618 5.883 1.00 44.41 O ATOM 125 CG2 THR A 10 1.680 -15.257 6.497 1.00 51.10 C ATOM 0 H THR A 10 0.878 -11.367 6.892 1.00 42.44 H new ATOM 0 HA THR A 10 0.594 -13.628 8.477 1.00 44.12 H new ATOM 0 HB THR A 10 2.053 -13.262 5.831 1.00 60.34 H new ATOM 0 HG1 THR A 10 -0.109 -12.685 5.609 1.00 44.41 H new ATOM 0 HG21 THR A 10 1.644 -15.672 5.490 1.00 51.10 H new ATOM 0 HG22 THR A 10 2.685 -15.375 6.902 1.00 51.10 H new ATOM 0 HG23 THR A 10 0.968 -15.785 7.132 1.00 51.10 H new ATOM 133 N LYS A 11 3.675 -12.524 8.214 1.00 40.22 N ATOM 134 CA LYS A 11 5.027 -12.655 8.745 1.00 53.14 C ATOM 135 C LYS A 11 5.058 -12.343 10.237 1.00 32.14 C ATOM 136 O LYS A 11 5.839 -12.929 10.988 1.00 3.32 O ATOM 137 CB LYS A 11 5.983 -11.722 7.998 1.00 53.21 C ATOM 138 CG LYS A 11 6.371 -12.225 6.618 1.00 35.54 C ATOM 139 CD LYS A 11 7.535 -13.200 6.687 1.00 14.44 C ATOM 140 CE LYS A 11 8.235 -13.327 5.343 1.00 2.13 C ATOM 141 NZ LYS A 11 9.149 -12.180 5.084 1.00 64.54 N ATOM 0 H LYS A 11 3.528 -11.697 7.635 1.00 40.22 H new ATOM 0 HA LYS A 11 5.349 -13.686 8.601 1.00 53.14 H new ATOM 0 HB2 LYS A 11 5.517 -10.741 7.900 1.00 53.21 H new ATOM 0 HB3 LYS A 11 6.886 -11.588 8.594 1.00 53.21 H new ATOM 0 HG2 LYS A 11 5.514 -12.712 6.153 1.00 35.54 H new ATOM 0 HG3 LYS A 11 6.640 -11.380 5.984 1.00 35.54 H new ATOM 0 HD2 LYS A 11 8.248 -12.864 7.440 1.00 14.44 H new ATOM 0 HD3 LYS A 11 7.174 -14.178 7.004 1.00 14.44 H new ATOM 0 HE2 LYS A 11 8.803 -14.257 5.315 1.00 2.13 H new ATOM 0 HE3 LYS A 11 7.490 -13.384 4.549 1.00 2.13 H new ATOM 0 HZ1 LYS A 11 9.607 -12.303 4.159 1.00 64.54 H new ATOM 0 HZ2 LYS A 11 8.604 -11.294 5.085 1.00 64.54 H new ATOM 0 HZ3 LYS A 11 9.875 -12.140 5.827 1.00 64.54 H new ATOM 155 N LEU A 12 4.203 -11.419 10.662 1.00 72.31 N ATOM 156 CA LEU A 12 4.131 -11.031 12.066 1.00 2.23 C ATOM 157 C LEU A 12 3.515 -12.144 12.908 1.00 2.53 C ATOM 158 O LEU A 12 3.884 -12.335 14.066 1.00 32.52 O ATOM 159 CB LEU A 12 3.313 -9.747 12.220 1.00 62.34 C ATOM 160 CG LEU A 12 4.062 -8.439 11.960 1.00 73.40 C ATOM 161 CD1 LEU A 12 3.093 -7.343 11.546 1.00 54.02 C ATOM 162 CD2 LEU A 12 4.848 -8.021 13.194 1.00 52.21 C ATOM 0 H LEU A 12 3.550 -10.925 10.054 1.00 72.31 H new ATOM 0 HA LEU A 12 5.146 -10.852 12.420 1.00 2.23 H new ATOM 0 HB2 LEU A 12 2.463 -9.797 11.539 1.00 62.34 H new ATOM 0 HB3 LEU A 12 2.909 -9.716 13.232 1.00 62.34 H new ATOM 0 HG LEU A 12 4.766 -8.601 11.143 1.00 73.40 H new ATOM 0 HD11 LEU A 12 3.644 -6.420 11.365 1.00 54.02 H new ATOM 0 HD12 LEU A 12 2.575 -7.641 10.635 1.00 54.02 H new ATOM 0 HD13 LEU A 12 2.365 -7.182 12.341 1.00 54.02 H new ATOM 0 HD21 LEU A 12 5.375 -7.089 12.991 1.00 52.21 H new ATOM 0 HD22 LEU A 12 4.163 -7.877 14.030 1.00 52.21 H new ATOM 0 HD23 LEU A 12 5.570 -8.798 13.446 1.00 52.21 H new ATOM 174 N ASN A 13 2.576 -12.875 12.317 1.00 23.31 N ATOM 175 CA ASN A 13 1.910 -13.971 13.013 1.00 42.45 C ATOM 176 C ASN A 13 2.743 -15.247 12.941 1.00 1.20 C ATOM 177 O ASN A 13 2.363 -16.282 13.490 1.00 51.24 O ATOM 178 CB ASN A 13 0.526 -14.218 12.410 1.00 15.53 C ATOM 179 CG ASN A 13 -0.450 -13.100 12.726 1.00 21.11 C ATOM 180 OD1 ASN A 13 -0.781 -12.860 13.887 1.00 2.43 O ATOM 181 ND2 ASN A 13 -0.916 -12.411 11.691 1.00 64.33 N ATOM 0 H ASN A 13 2.259 -12.729 11.359 1.00 23.31 H new ATOM 0 HA ASN A 13 1.799 -13.690 14.060 1.00 42.45 H new ATOM 0 HB2 ASN A 13 0.617 -14.322 11.329 1.00 15.53 H new ATOM 0 HB3 ASN A 13 0.130 -15.160 12.789 1.00 15.53 H new ATOM 0 HD21 ASN A 13 -1.576 -11.648 11.842 1.00 64.33 H new ATOM 0 HD22 ASN A 13 -0.614 -12.645 10.745 1.00 64.33 H new ATOM 188 N THR A 14 3.883 -15.166 12.261 1.00 32.12 N ATOM 189 CA THR A 14 4.770 -16.313 12.117 1.00 33.50 C ATOM 190 C THR A 14 6.094 -16.078 12.834 1.00 22.10 C ATOM 191 O THR A 14 6.690 -17.008 13.380 1.00 44.34 O ATOM 192 CB THR A 14 5.050 -16.624 10.635 1.00 74.45 C ATOM 193 OG1 THR A 14 5.579 -15.465 9.982 1.00 1.33 O ATOM 194 CG2 THR A 14 3.781 -17.075 9.927 1.00 34.32 C ATOM 0 H THR A 14 4.213 -14.317 11.801 1.00 32.12 H new ATOM 0 HA THR A 14 4.261 -17.164 12.569 1.00 33.50 H new ATOM 0 HB THR A 14 5.780 -17.432 10.589 1.00 74.45 H new ATOM 0 HG1 THR A 14 5.572 -14.707 10.604 1.00 1.33 H new ATOM 0 HG21 THR A 14 4.004 -17.289 8.882 1.00 34.32 H new ATOM 0 HG22 THR A 14 3.396 -17.975 10.407 1.00 34.32 H new ATOM 0 HG23 THR A 14 3.032 -16.285 9.984 1.00 34.32 H new ATOM 202 N LEU A 15 6.550 -14.830 12.830 1.00 32.34 N ATOM 203 CA LEU A 15 7.805 -14.472 13.482 1.00 60.31 C ATOM 204 C LEU A 15 7.811 -14.925 14.938 1.00 10.05 C ATOM 205 O LEU A 15 6.796 -14.840 15.628 1.00 33.14 O ATOM 206 CB LEU A 15 8.030 -12.961 13.405 1.00 75.13 C ATOM 207 CG LEU A 15 7.508 -12.144 14.587 1.00 12.20 C ATOM 208 CD1 LEU A 15 8.569 -12.037 15.671 1.00 14.35 C ATOM 209 CD2 LEU A 15 7.071 -10.760 14.128 1.00 73.54 C ATOM 0 H LEU A 15 6.070 -14.049 12.383 1.00 32.34 H new ATOM 0 HA LEU A 15 8.615 -14.981 12.959 1.00 60.31 H new ATOM 0 HB2 LEU A 15 9.100 -12.778 13.307 1.00 75.13 H new ATOM 0 HB3 LEU A 15 7.558 -12.589 12.495 1.00 75.13 H new ATOM 0 HG LEU A 15 6.641 -12.657 15.004 1.00 12.20 H new ATOM 0 HD11 LEU A 15 8.180 -11.452 16.504 1.00 14.35 H new ATOM 0 HD12 LEU A 15 8.834 -13.035 16.020 1.00 14.35 H new ATOM 0 HD13 LEU A 15 9.455 -11.547 15.266 1.00 14.35 H new ATOM 0 HD21 LEU A 15 6.702 -10.193 14.983 1.00 73.54 H new ATOM 0 HD22 LEU A 15 7.920 -10.239 13.685 1.00 73.54 H new ATOM 0 HD23 LEU A 15 6.278 -10.856 13.387 1.00 73.54 H new ATOM 221 N GLU A 16 8.962 -15.404 15.399 1.00 3.13 N ATOM 222 CA GLU A 16 9.100 -15.868 16.775 1.00 72.43 C ATOM 223 C GLU A 16 10.020 -14.947 17.571 1.00 75.02 C ATOM 224 O GLU A 16 10.641 -14.041 17.015 1.00 73.02 O ATOM 225 CB GLU A 16 9.644 -17.298 16.802 1.00 64.14 C ATOM 226 CG GLU A 16 8.801 -18.255 17.626 1.00 35.43 C ATOM 227 CD GLU A 16 9.616 -19.384 18.226 1.00 65.34 C ATOM 228 OE1 GLU A 16 10.590 -19.092 18.950 1.00 5.55 O ATOM 229 OE2 GLU A 16 9.282 -20.560 17.970 1.00 53.31 O ATOM 0 H GLU A 16 9.812 -15.481 14.840 1.00 3.13 H new ATOM 0 HA GLU A 16 8.113 -15.853 17.237 1.00 72.43 H new ATOM 0 HB2 GLU A 16 9.709 -17.672 15.780 1.00 64.14 H new ATOM 0 HB3 GLU A 16 10.658 -17.284 17.202 1.00 64.14 H new ATOM 0 HG2 GLU A 16 8.309 -17.702 18.426 1.00 35.43 H new ATOM 0 HG3 GLU A 16 8.015 -18.674 16.998 1.00 35.43 H new ATOM 236 N ASP A 17 10.101 -15.185 18.875 1.00 34.11 N ATOM 237 CA ASP A 17 10.944 -14.378 19.749 1.00 43.23 C ATOM 238 C ASP A 17 12.398 -14.836 19.676 1.00 54.35 C ATOM 239 O ASP A 17 12.839 -15.662 20.473 1.00 22.45 O ATOM 240 CB ASP A 17 10.444 -14.457 21.192 1.00 52.31 C ATOM 241 CG ASP A 17 8.931 -14.495 21.279 1.00 53.44 C ATOM 242 OD1 ASP A 17 8.349 -15.571 21.029 1.00 23.14 O ATOM 243 OD2 ASP A 17 8.328 -13.447 21.595 1.00 72.40 O ATOM 0 H ASP A 17 9.593 -15.931 19.351 1.00 34.11 H new ATOM 0 HA ASP A 17 10.890 -13.343 19.410 1.00 43.23 H new ATOM 0 HB2 ASP A 17 10.855 -15.348 21.668 1.00 52.31 H new ATOM 0 HB3 ASP A 17 10.816 -13.597 21.750 1.00 52.31 H new ATOM 248 N SER A 18 13.136 -14.294 18.712 1.00 12.43 N ATOM 249 CA SER A 18 14.538 -14.650 18.531 1.00 21.15 C ATOM 250 C SER A 18 15.323 -13.484 17.939 1.00 41.21 C ATOM 251 O SER A 18 14.784 -12.685 17.173 1.00 22.31 O ATOM 252 CB SER A 18 14.662 -15.876 17.625 1.00 52.04 C ATOM 253 OG SER A 18 14.652 -17.074 18.382 1.00 42.30 O ATOM 0 H SER A 18 12.786 -13.607 18.045 1.00 12.43 H new ATOM 0 HA SER A 18 14.956 -14.887 19.509 1.00 21.15 H new ATOM 0 HB2 SER A 18 13.840 -15.888 16.909 1.00 52.04 H new ATOM 0 HB3 SER A 18 15.585 -15.814 17.049 1.00 52.04 H new ATOM 0 HG SER A 18 14.112 -16.946 19.190 1.00 42.30 H new ATOM 259 N GLN A 19 16.599 -13.393 18.300 1.00 61.43 N ATOM 260 CA GLN A 19 17.459 -12.325 17.805 1.00 54.33 C ATOM 261 C GLN A 19 17.457 -12.287 16.280 1.00 14.40 C ATOM 262 O GLN A 19 17.358 -11.219 15.677 1.00 15.52 O ATOM 263 CB GLN A 19 18.887 -12.510 18.320 1.00 32.11 C ATOM 264 CG GLN A 19 19.718 -11.238 18.279 1.00 64.22 C ATOM 265 CD GLN A 19 19.036 -10.072 18.965 1.00 14.15 C ATOM 266 OE1 GLN A 19 19.106 -9.927 20.186 1.00 23.43 O ATOM 267 NE2 GLN A 19 18.369 -9.231 18.183 1.00 60.43 N ATOM 0 H GLN A 19 17.060 -14.046 18.934 1.00 61.43 H new ATOM 0 HA GLN A 19 17.067 -11.377 18.175 1.00 54.33 H new ATOM 0 HB2 GLN A 19 18.850 -12.877 19.346 1.00 32.11 H new ATOM 0 HB3 GLN A 19 19.382 -13.277 17.725 1.00 32.11 H new ATOM 0 HG2 GLN A 19 20.681 -11.422 18.756 1.00 64.22 H new ATOM 0 HG3 GLN A 19 19.922 -10.975 17.241 1.00 64.22 H new ATOM 0 HE21 GLN A 19 18.336 -9.388 17.176 1.00 60.43 H new ATOM 0 HE22 GLN A 19 17.889 -8.428 18.590 1.00 60.43 H new ATOM 276 N GLU A 20 17.567 -13.459 15.663 1.00 20.24 N ATOM 277 CA GLU A 20 17.579 -13.558 14.209 1.00 61.33 C ATOM 278 C GLU A 20 16.174 -13.381 13.640 1.00 63.24 C ATOM 279 O GLU A 20 15.998 -12.826 12.555 1.00 33.22 O ATOM 280 CB GLU A 20 18.152 -14.908 13.772 1.00 34.51 C ATOM 281 CG GLU A 20 19.659 -15.012 13.935 1.00 33.15 C ATOM 282 CD GLU A 20 20.237 -16.237 13.254 1.00 74.04 C ATOM 283 OE1 GLU A 20 20.239 -16.276 12.006 1.00 72.54 O ATOM 284 OE2 GLU A 20 20.687 -17.156 13.969 1.00 30.31 O ATOM 0 H GLU A 20 17.649 -14.353 16.148 1.00 20.24 H new ATOM 0 HA GLU A 20 18.212 -12.760 13.821 1.00 61.33 H new ATOM 0 HB2 GLU A 20 17.677 -15.699 14.352 1.00 34.51 H new ATOM 0 HB3 GLU A 20 17.895 -15.081 12.727 1.00 34.51 H new ATOM 0 HG2 GLU A 20 20.128 -14.118 13.524 1.00 33.15 H new ATOM 0 HG3 GLU A 20 19.905 -15.041 14.997 1.00 33.15 H new ATOM 291 N SER A 21 15.178 -13.858 14.379 1.00 1.24 N ATOM 292 CA SER A 21 13.789 -13.757 13.948 1.00 50.45 C ATOM 293 C SER A 21 13.397 -12.301 13.715 1.00 10.54 C ATOM 294 O SER A 21 12.843 -11.955 12.672 1.00 52.45 O ATOM 295 CB SER A 21 12.862 -14.386 14.989 1.00 72.42 C ATOM 296 OG SER A 21 11.507 -14.309 14.579 1.00 5.32 O ATOM 0 H SER A 21 15.307 -14.319 15.280 1.00 1.24 H new ATOM 0 HA SER A 21 13.687 -14.298 13.007 1.00 50.45 H new ATOM 0 HB2 SER A 21 13.139 -15.429 15.145 1.00 72.42 H new ATOM 0 HB3 SER A 21 12.985 -13.877 15.945 1.00 72.42 H new ATOM 0 HG SER A 21 10.974 -13.891 15.287 1.00 5.32 H new ATOM 302 N ILE A 22 13.689 -11.452 14.696 1.00 73.53 N ATOM 303 CA ILE A 22 13.368 -10.034 14.599 1.00 41.14 C ATOM 304 C ILE A 22 14.163 -9.366 13.482 1.00 41.21 C ATOM 305 O ILE A 22 13.663 -8.472 12.799 1.00 71.33 O ATOM 306 CB ILE A 22 13.650 -9.301 15.923 1.00 1.04 C ATOM 307 CG1 ILE A 22 12.804 -9.896 17.051 1.00 71.02 C ATOM 308 CG2 ILE A 22 13.373 -7.812 15.775 1.00 73.53 C ATOM 309 CD1 ILE A 22 11.317 -9.685 16.867 1.00 64.04 C ATOM 0 H ILE A 22 14.147 -11.722 15.566 1.00 73.53 H new ATOM 0 HA ILE A 22 12.303 -9.966 14.375 1.00 41.14 H new ATOM 0 HB ILE A 22 14.702 -9.431 16.175 1.00 1.04 H new ATOM 0 HG12 ILE A 22 13.005 -10.965 17.120 1.00 71.02 H new ATOM 0 HG13 ILE A 22 13.111 -9.452 17.998 1.00 71.02 H new ATOM 0 HG21 ILE A 22 13.577 -7.308 16.720 1.00 73.53 H new ATOM 0 HG22 ILE A 22 14.015 -7.398 14.997 1.00 73.53 H new ATOM 0 HG23 ILE A 22 12.329 -7.662 15.502 1.00 73.53 H new ATOM 0 HD11 ILE A 22 10.780 -10.132 17.703 1.00 64.04 H new ATOM 0 HD12 ILE A 22 11.103 -8.617 16.828 1.00 64.04 H new ATOM 0 HD13 ILE A 22 10.995 -10.153 15.937 1.00 64.04 H new ATOM 321 N SER A 23 15.404 -9.807 13.301 1.00 51.32 N ATOM 322 CA SER A 23 16.270 -9.250 12.268 1.00 73.32 C ATOM 323 C SER A 23 15.734 -9.575 10.877 1.00 70.52 C ATOM 324 O SER A 23 15.730 -8.725 9.987 1.00 61.34 O ATOM 325 CB SER A 23 17.692 -9.793 12.418 1.00 3.44 C ATOM 326 OG SER A 23 18.604 -9.064 11.614 1.00 13.23 O ATOM 0 H SER A 23 15.832 -10.548 13.856 1.00 51.32 H new ATOM 0 HA SER A 23 16.288 -8.167 12.388 1.00 73.32 H new ATOM 0 HB2 SER A 23 17.998 -9.737 13.463 1.00 3.44 H new ATOM 0 HB3 SER A 23 17.714 -10.846 12.136 1.00 3.44 H new ATOM 0 HG SER A 23 19.506 -9.430 11.729 1.00 13.23 H new ATOM 332 N SER A 24 15.282 -10.813 10.698 1.00 42.32 N ATOM 333 CA SER A 24 14.747 -11.253 9.415 1.00 64.03 C ATOM 334 C SER A 24 13.614 -10.340 8.956 1.00 5.22 C ATOM 335 O SER A 24 13.579 -9.906 7.805 1.00 25.11 O ATOM 336 CB SER A 24 14.246 -12.695 9.515 1.00 64.11 C ATOM 337 OG SER A 24 15.224 -13.535 10.103 1.00 25.11 O ATOM 0 H SER A 24 15.276 -11.528 11.425 1.00 42.32 H new ATOM 0 HA SER A 24 15.550 -11.205 8.679 1.00 64.03 H new ATOM 0 HB2 SER A 24 13.332 -12.725 10.108 1.00 64.11 H new ATOM 0 HB3 SER A 24 13.994 -13.065 8.521 1.00 64.11 H new ATOM 0 HG SER A 24 15.198 -13.435 11.078 1.00 25.11 H new ATOM 343 N ALA A 25 12.689 -10.052 9.866 1.00 25.42 N ATOM 344 CA ALA A 25 11.556 -9.190 9.557 1.00 0.41 C ATOM 345 C ALA A 25 11.987 -7.730 9.460 1.00 23.24 C ATOM 346 O ALA A 25 11.609 -7.022 8.528 1.00 40.34 O ATOM 347 CB ALA A 25 10.467 -9.352 10.608 1.00 45.22 C ATOM 0 H ALA A 25 12.703 -10.404 10.823 1.00 25.42 H new ATOM 0 HA ALA A 25 11.158 -9.489 8.588 1.00 0.41 H new ATOM 0 HB1 ALA A 25 9.627 -8.702 10.364 1.00 45.22 H new ATOM 0 HB2 ALA A 25 10.131 -10.389 10.627 1.00 45.22 H new ATOM 0 HB3 ALA A 25 10.863 -9.082 11.587 1.00 45.22 H new ATOM 353 N SER A 26 12.780 -7.287 10.430 1.00 4.35 N ATOM 354 CA SER A 26 13.259 -5.910 10.457 1.00 45.32 C ATOM 355 C SER A 26 13.943 -5.547 9.142 1.00 61.21 C ATOM 356 O SER A 26 13.743 -4.458 8.604 1.00 43.21 O ATOM 357 CB SER A 26 14.230 -5.707 11.622 1.00 71.10 C ATOM 358 OG SER A 26 15.512 -6.227 11.314 1.00 32.24 O ATOM 0 H SER A 26 13.104 -7.862 11.208 1.00 4.35 H new ATOM 0 HA SER A 26 12.398 -5.255 10.593 1.00 45.32 H new ATOM 0 HB2 SER A 26 14.311 -4.644 11.851 1.00 71.10 H new ATOM 0 HB3 SER A 26 13.840 -6.197 12.514 1.00 71.10 H new ATOM 0 HG SER A 26 15.416 -7.105 10.890 1.00 32.24 H new ATOM 364 N LYS A 27 14.751 -6.469 8.629 1.00 43.41 N ATOM 365 CA LYS A 27 15.465 -6.249 7.377 1.00 60.45 C ATOM 366 C LYS A 27 14.491 -5.959 6.239 1.00 2.20 C ATOM 367 O LYS A 27 14.718 -5.059 5.431 1.00 52.45 O ATOM 368 CB LYS A 27 16.319 -7.472 7.031 1.00 12.35 C ATOM 369 CG LYS A 27 17.548 -7.623 7.911 1.00 32.00 C ATOM 370 CD LYS A 27 18.015 -9.068 7.973 1.00 13.30 C ATOM 371 CE LYS A 27 19.459 -9.167 8.441 1.00 75.31 C ATOM 372 NZ LYS A 27 20.420 -8.935 7.328 1.00 53.35 N ATOM 0 H LYS A 27 14.928 -7.376 9.061 1.00 43.41 H new ATOM 0 HA LYS A 27 16.115 -5.384 7.506 1.00 60.45 H new ATOM 0 HB2 LYS A 27 15.707 -8.369 7.119 1.00 12.35 H new ATOM 0 HB3 LYS A 27 16.634 -7.402 5.990 1.00 12.35 H new ATOM 0 HG2 LYS A 27 18.352 -6.996 7.526 1.00 32.00 H new ATOM 0 HG3 LYS A 27 17.322 -7.269 8.917 1.00 32.00 H new ATOM 0 HD2 LYS A 27 17.372 -9.630 8.650 1.00 13.30 H new ATOM 0 HD3 LYS A 27 17.918 -9.525 6.988 1.00 13.30 H new ATOM 0 HE2 LYS A 27 19.635 -8.437 9.231 1.00 75.31 H new ATOM 0 HE3 LYS A 27 19.634 -10.153 8.872 1.00 75.31 H new ATOM 0 HZ1 LYS A 27 21.393 -9.011 7.688 1.00 53.35 H new ATOM 0 HZ2 LYS A 27 20.269 -9.647 6.585 1.00 53.35 H new ATOM 0 HZ3 LYS A 27 20.270 -7.985 6.933 1.00 53.35 H new ATOM 386 N TRP A 28 13.408 -6.725 6.184 1.00 51.01 N ATOM 387 CA TRP A 28 12.399 -6.548 5.146 1.00 51.03 C ATOM 388 C TRP A 28 11.708 -5.196 5.283 1.00 43.44 C ATOM 389 O TRP A 28 11.451 -4.515 4.289 1.00 63.04 O ATOM 390 CB TRP A 28 11.364 -7.672 5.214 1.00 21.35 C ATOM 391 CG TRP A 28 10.356 -7.620 4.107 1.00 15.10 C ATOM 392 CD1 TRP A 28 10.607 -7.677 2.766 1.00 62.00 C ATOM 393 CD2 TRP A 28 8.936 -7.498 4.246 1.00 12.20 C ATOM 394 NE1 TRP A 28 9.429 -7.598 2.063 1.00 43.22 N ATOM 395 CE2 TRP A 28 8.389 -7.488 2.948 1.00 64.23 C ATOM 396 CE3 TRP A 28 8.073 -7.398 5.341 1.00 52.14 C ATOM 397 CZ2 TRP A 28 7.020 -7.381 2.717 1.00 25.43 C ATOM 398 CZ3 TRP A 28 6.714 -7.292 5.110 1.00 4.42 C ATOM 399 CH2 TRP A 28 6.199 -7.285 3.807 1.00 12.23 C ATOM 0 H TRP A 28 13.206 -7.475 6.846 1.00 51.01 H new ATOM 0 HA TRP A 28 12.900 -6.583 4.179 1.00 51.03 H new ATOM 0 HB2 TRP A 28 11.879 -8.632 5.182 1.00 21.35 H new ATOM 0 HB3 TRP A 28 10.845 -7.620 6.171 1.00 21.35 H new ATOM 0 HD1 TRP A 28 11.587 -7.770 2.323 1.00 62.00 H new ATOM 0 HE1 TRP A 28 9.343 -7.618 1.047 1.00 43.22 H new ATOM 0 HE3 TRP A 28 8.461 -7.403 6.349 1.00 52.14 H new ATOM 0 HZ2 TRP A 28 6.621 -7.374 1.714 1.00 25.43 H new ATOM 0 HZ3 TRP A 28 6.038 -7.213 5.948 1.00 4.42 H new ATOM 0 HH2 TRP A 28 5.132 -7.202 3.660 1.00 12.23 H new ATOM 410 N LEU A 29 11.410 -4.811 6.519 1.00 42.03 N ATOM 411 CA LEU A 29 10.749 -3.538 6.785 1.00 30.35 C ATOM 412 C LEU A 29 11.687 -2.368 6.507 1.00 61.33 C ATOM 413 O LEU A 29 11.251 -1.296 6.086 1.00 44.24 O ATOM 414 CB LEU A 29 10.267 -3.486 8.236 1.00 11.32 C ATOM 415 CG LEU A 29 8.995 -4.274 8.550 1.00 71.32 C ATOM 416 CD1 LEU A 29 9.022 -4.784 9.982 1.00 2.35 C ATOM 417 CD2 LEU A 29 7.762 -3.415 8.311 1.00 40.22 C ATOM 0 H LEU A 29 11.615 -5.362 7.353 1.00 42.03 H new ATOM 0 HA LEU A 29 9.890 -3.456 6.119 1.00 30.35 H new ATOM 0 HB2 LEU A 29 11.067 -3.856 8.877 1.00 11.32 H new ATOM 0 HB3 LEU A 29 10.100 -2.443 8.505 1.00 11.32 H new ATOM 0 HG LEU A 29 8.950 -5.133 7.881 1.00 71.32 H new ATOM 0 HD11 LEU A 29 8.108 -5.342 10.187 1.00 2.35 H new ATOM 0 HD12 LEU A 29 9.884 -5.436 10.120 1.00 2.35 H new ATOM 0 HD13 LEU A 29 9.093 -3.940 10.668 1.00 2.35 H new ATOM 0 HD21 LEU A 29 6.866 -3.993 8.540 1.00 40.22 H new ATOM 0 HD22 LEU A 29 7.801 -2.536 8.954 1.00 40.22 H new ATOM 0 HD23 LEU A 29 7.734 -3.100 7.268 1.00 40.22 H new ATOM 429 N LEU A 30 12.977 -2.582 6.742 1.00 31.01 N ATOM 430 CA LEU A 30 13.978 -1.546 6.514 1.00 2.11 C ATOM 431 C LEU A 30 13.928 -1.048 5.073 1.00 1.33 C ATOM 432 O LEU A 30 14.150 0.134 4.806 1.00 52.05 O ATOM 433 CB LEU A 30 15.376 -2.080 6.833 1.00 74.54 C ATOM 434 CG LEU A 30 16.314 -1.116 7.558 1.00 10.34 C ATOM 435 CD1 LEU A 30 16.358 0.225 6.843 1.00 42.51 C ATOM 436 CD2 LEU A 30 15.879 -0.936 9.006 1.00 62.24 C ATOM 0 H LEU A 30 13.354 -3.463 7.090 1.00 31.01 H new ATOM 0 HA LEU A 30 13.756 -0.709 7.176 1.00 2.11 H new ATOM 0 HB2 LEU A 30 15.270 -2.978 7.441 1.00 74.54 H new ATOM 0 HB3 LEU A 30 15.849 -2.382 5.899 1.00 74.54 H new ATOM 0 HG LEU A 30 17.317 -1.542 7.551 1.00 10.34 H new ATOM 0 HD11 LEU A 30 17.031 0.898 7.374 1.00 42.51 H new ATOM 0 HD12 LEU A 30 16.717 0.082 5.824 1.00 42.51 H new ATOM 0 HD13 LEU A 30 15.358 0.657 6.818 1.00 42.51 H new ATOM 0 HD21 LEU A 30 16.558 -0.246 9.507 1.00 62.24 H new ATOM 0 HD22 LEU A 30 14.867 -0.533 9.034 1.00 62.24 H new ATOM 0 HD23 LEU A 30 15.900 -1.900 9.515 1.00 62.24 H new ATOM 448 N LEU A 31 13.634 -1.955 4.149 1.00 35.31 N ATOM 449 CA LEU A 31 13.552 -1.608 2.735 1.00 75.04 C ATOM 450 C LEU A 31 12.123 -1.239 2.346 1.00 23.42 C ATOM 451 O LEU A 31 11.786 -1.186 1.164 1.00 61.41 O ATOM 452 CB LEU A 31 14.041 -2.774 1.874 1.00 45.22 C ATOM 453 CG LEU A 31 15.272 -3.520 2.392 1.00 53.25 C ATOM 454 CD1 LEU A 31 15.591 -4.708 1.497 1.00 2.42 C ATOM 455 CD2 LEU A 31 16.466 -2.581 2.482 1.00 70.05 C ATOM 0 H LEU A 31 13.448 -2.937 4.353 1.00 35.31 H new ATOM 0 HA LEU A 31 14.191 -0.742 2.562 1.00 75.04 H new ATOM 0 HB2 LEU A 31 13.225 -3.489 1.769 1.00 45.22 H new ATOM 0 HB3 LEU A 31 14.263 -2.395 0.877 1.00 45.22 H new ATOM 0 HG LEU A 31 15.053 -3.893 3.392 1.00 53.25 H new ATOM 0 HD11 LEU A 31 16.469 -5.227 1.881 1.00 2.42 H new ATOM 0 HD12 LEU A 31 14.742 -5.392 1.484 1.00 2.42 H new ATOM 0 HD13 LEU A 31 15.790 -4.357 0.484 1.00 2.42 H new ATOM 0 HD21 LEU A 31 17.333 -3.129 2.852 1.00 70.05 H new ATOM 0 HD22 LEU A 31 16.687 -2.178 1.494 1.00 70.05 H new ATOM 0 HD23 LEU A 31 16.235 -1.763 3.165 1.00 70.05 H new ATOM 467 N GLN A 32 11.290 -0.984 3.350 1.00 40.44 N ATOM 468 CA GLN A 32 9.899 -0.618 3.112 1.00 34.21 C ATOM 469 C GLN A 32 9.639 0.829 3.517 1.00 1.10 C ATOM 470 O GLN A 32 8.523 1.188 3.894 1.00 5.23 O ATOM 471 CB GLN A 32 8.965 -1.552 3.885 1.00 41.41 C ATOM 472 CG GLN A 32 9.059 -3.004 3.447 1.00 34.43 C ATOM 473 CD GLN A 32 7.995 -3.378 2.434 1.00 61.23 C ATOM 474 OE1 GLN A 32 6.858 -2.911 2.509 1.00 62.15 O ATOM 475 NE2 GLN A 32 8.359 -4.225 1.478 1.00 45.23 N ATOM 0 H GLN A 32 11.554 -1.024 4.334 1.00 40.44 H new ATOM 0 HA GLN A 32 9.701 -0.718 2.045 1.00 34.21 H new ATOM 0 HB2 GLN A 32 9.197 -1.486 4.948 1.00 41.41 H new ATOM 0 HB3 GLN A 32 7.938 -1.209 3.761 1.00 41.41 H new ATOM 0 HG2 GLN A 32 10.044 -3.187 3.018 1.00 34.43 H new ATOM 0 HG3 GLN A 32 8.967 -3.650 4.320 1.00 34.43 H new ATOM 0 HE21 GLN A 32 9.312 -4.588 1.454 1.00 45.23 H new ATOM 0 HE22 GLN A 32 7.686 -4.513 0.768 1.00 45.23 H new ATOM 484 N TYR A 33 10.676 1.656 3.437 1.00 71.54 N ATOM 485 CA TYR A 33 10.561 3.064 3.797 1.00 31.55 C ATOM 486 C TYR A 33 9.421 3.730 3.034 1.00 52.23 C ATOM 487 O TYR A 33 8.811 4.685 3.516 1.00 72.15 O ATOM 488 CB TYR A 33 11.875 3.793 3.514 1.00 51.41 C ATOM 489 CG TYR A 33 12.475 3.459 2.167 1.00 53.12 C ATOM 490 CD1 TYR A 33 11.957 4.005 0.999 1.00 73.32 C ATOM 491 CD2 TYR A 33 13.560 2.598 2.062 1.00 5.33 C ATOM 492 CE1 TYR A 33 12.501 3.701 -0.234 1.00 1.40 C ATOM 493 CE2 TYR A 33 14.112 2.290 0.834 1.00 44.52 C ATOM 494 CZ TYR A 33 13.579 2.844 -0.311 1.00 51.13 C ATOM 495 OH TYR A 33 14.125 2.541 -1.537 1.00 60.44 O ATOM 0 H TYR A 33 11.606 1.375 3.126 1.00 71.54 H new ATOM 0 HA TYR A 33 10.343 3.124 4.863 1.00 31.55 H new ATOM 0 HB2 TYR A 33 11.704 4.868 3.569 1.00 51.41 H new ATOM 0 HB3 TYR A 33 12.594 3.544 4.294 1.00 51.41 H new ATOM 0 HD1 TYR A 33 11.115 4.679 1.056 1.00 73.32 H new ATOM 0 HD2 TYR A 33 13.979 2.162 2.957 1.00 5.33 H new ATOM 0 HE1 TYR A 33 12.085 4.132 -1.132 1.00 1.40 H new ATOM 0 HE2 TYR A 33 14.956 1.619 0.771 1.00 44.52 H new ATOM 0 HH TYR A 33 14.878 1.925 -1.417 1.00 60.44 H new ATOM 505 N ARG A 34 9.139 3.219 1.840 1.00 53.22 N ATOM 506 CA ARG A 34 8.073 3.764 1.008 1.00 53.21 C ATOM 507 C ARG A 34 6.710 3.550 1.661 1.00 43.51 C ATOM 508 O ARG A 34 5.790 4.347 1.475 1.00 30.14 O ATOM 509 CB ARG A 34 8.094 3.114 -0.377 1.00 22.04 C ATOM 510 CG ARG A 34 9.454 3.167 -1.053 1.00 62.13 C ATOM 511 CD ARG A 34 9.352 2.839 -2.535 1.00 4.02 C ATOM 512 NE ARG A 34 8.486 3.776 -3.245 1.00 3.44 N ATOM 513 CZ ARG A 34 7.947 3.524 -4.432 1.00 34.22 C ATOM 514 NH1 ARG A 34 8.182 2.369 -5.039 1.00 25.34 N ATOM 515 NH2 ARG A 34 7.169 4.427 -5.014 1.00 52.33 N ATOM 0 H ARG A 34 9.634 2.428 1.427 1.00 53.22 H new ATOM 0 HA ARG A 34 8.242 4.836 0.902 1.00 53.21 H new ATOM 0 HB2 ARG A 34 7.783 2.073 -0.286 1.00 22.04 H new ATOM 0 HB3 ARG A 34 7.362 3.611 -1.013 1.00 22.04 H new ATOM 0 HG2 ARG A 34 9.885 4.160 -0.928 1.00 62.13 H new ATOM 0 HG3 ARG A 34 10.130 2.462 -0.569 1.00 62.13 H new ATOM 0 HD2 ARG A 34 10.347 2.857 -2.979 1.00 4.02 H new ATOM 0 HD3 ARG A 34 8.967 1.826 -2.656 1.00 4.02 H new ATOM 0 HE ARG A 34 8.284 4.674 -2.805 1.00 3.44 H new ATOM 0 HH11 ARG A 34 8.778 1.671 -4.594 1.00 25.34 H new ATOM 0 HH12 ARG A 34 7.767 2.178 -5.951 1.00 25.34 H new ATOM 0 HH21 ARG A 34 6.984 5.316 -4.550 1.00 52.33 H new ATOM 0 HH22 ARG A 34 6.756 4.232 -5.926 1.00 52.33 H new ATOM 529 N ASP A 35 6.589 2.470 2.425 1.00 43.51 N ATOM 530 CA ASP A 35 5.340 2.152 3.106 1.00 32.11 C ATOM 531 C ASP A 35 5.390 2.590 4.567 1.00 61.44 C ATOM 532 O ASP A 35 5.046 1.824 5.466 1.00 31.04 O ATOM 533 CB ASP A 35 5.055 0.652 3.020 1.00 64.51 C ATOM 534 CG ASP A 35 5.684 0.012 1.798 1.00 44.34 C ATOM 535 OD1 ASP A 35 6.874 -0.361 1.869 1.00 63.11 O ATOM 536 OD2 ASP A 35 4.987 -0.115 0.770 1.00 32.50 O ATOM 0 H ASP A 35 7.341 1.800 2.588 1.00 43.51 H new ATOM 0 HA ASP A 35 4.536 2.696 2.610 1.00 32.11 H new ATOM 0 HB2 ASP A 35 5.431 0.162 3.918 1.00 64.51 H new ATOM 0 HB3 ASP A 35 3.977 0.491 2.997 1.00 64.51 H new ATOM 541 N ALA A 36 5.822 3.826 4.794 1.00 64.40 N ATOM 542 CA ALA A 36 5.917 4.365 6.145 1.00 50.33 C ATOM 543 C ALA A 36 4.545 4.429 6.808 1.00 63.22 C ATOM 544 O ALA A 36 4.302 3.814 7.846 1.00 31.41 O ATOM 545 CB ALA A 36 6.557 5.746 6.118 1.00 72.52 C ATOM 0 H ALA A 36 6.112 4.473 4.060 1.00 64.40 H new ATOM 0 HA ALA A 36 6.545 3.696 6.733 1.00 50.33 H new ATOM 0 HB1 ALA A 36 6.622 6.137 7.133 1.00 72.52 H new ATOM 0 HB2 ALA A 36 7.558 5.675 5.692 1.00 72.52 H new ATOM 0 HB3 ALA A 36 5.950 6.416 5.509 1.00 72.52 H new ATOM 551 N PRO A 37 3.626 5.191 6.196 1.00 22.23 N ATOM 552 CA PRO A 37 2.263 5.353 6.711 1.00 60.34 C ATOM 553 C PRO A 37 1.438 4.078 6.577 1.00 74.35 C ATOM 554 O PRO A 37 0.570 3.797 7.404 1.00 3.11 O ATOM 555 CB PRO A 37 1.681 6.461 5.830 1.00 2.51 C ATOM 556 CG PRO A 37 2.462 6.389 4.564 1.00 62.44 C ATOM 557 CD PRO A 37 3.847 5.952 4.956 1.00 51.45 C ATOM 0 HA PRO A 37 2.254 5.587 7.776 1.00 60.34 H new ATOM 0 HB2 PRO A 37 0.618 6.305 5.648 1.00 2.51 H new ATOM 0 HB3 PRO A 37 1.783 7.438 6.303 1.00 2.51 H new ATOM 0 HG2 PRO A 37 2.012 5.681 3.868 1.00 62.44 H new ATOM 0 HG3 PRO A 37 2.485 7.357 4.064 1.00 62.44 H new ATOM 0 HD2 PRO A 37 4.308 5.336 4.183 1.00 51.45 H new ATOM 0 HD3 PRO A 37 4.506 6.805 5.120 1.00 51.45 H new ATOM 565 N LYS A 38 1.713 3.308 5.529 1.00 33.43 N ATOM 566 CA LYS A 38 0.997 2.061 5.287 1.00 62.51 C ATOM 567 C LYS A 38 1.302 1.038 6.376 1.00 24.54 C ATOM 568 O LYS A 38 0.394 0.511 7.020 1.00 43.41 O ATOM 569 CB LYS A 38 1.374 1.491 3.917 1.00 35.54 C ATOM 570 CG LYS A 38 1.088 2.438 2.765 1.00 72.21 C ATOM 571 CD LYS A 38 -0.349 2.316 2.286 1.00 30.10 C ATOM 572 CE LYS A 38 -1.246 3.352 2.945 1.00 10.51 C ATOM 573 NZ LYS A 38 -1.238 4.644 2.204 1.00 15.10 N ATOM 0 H LYS A 38 2.427 3.526 4.834 1.00 33.43 H new ATOM 0 HA LYS A 38 -0.072 2.275 5.304 1.00 62.51 H new ATOM 0 HB2 LYS A 38 2.435 1.241 3.916 1.00 35.54 H new ATOM 0 HB3 LYS A 38 0.828 0.562 3.757 1.00 35.54 H new ATOM 0 HG2 LYS A 38 1.282 3.464 3.079 1.00 72.21 H new ATOM 0 HG3 LYS A 38 1.767 2.224 1.940 1.00 72.21 H new ATOM 0 HD2 LYS A 38 -0.384 2.438 1.203 1.00 30.10 H new ATOM 0 HD3 LYS A 38 -0.723 1.316 2.506 1.00 30.10 H new ATOM 0 HE2 LYS A 38 -2.265 2.969 2.997 1.00 10.51 H new ATOM 0 HE3 LYS A 38 -0.916 3.519 3.970 1.00 10.51 H new ATOM 0 HZ1 LYS A 38 -1.861 5.324 2.685 1.00 15.10 H new ATOM 0 HZ2 LYS A 38 -0.270 5.022 2.176 1.00 15.10 H new ATOM 0 HZ3 LYS A 38 -1.578 4.490 1.233 1.00 15.10 H new ATOM 587 N VAL A 39 2.587 0.761 6.579 1.00 33.11 N ATOM 588 CA VAL A 39 3.012 -0.197 7.593 1.00 75.22 C ATOM 589 C VAL A 39 2.653 0.289 8.993 1.00 64.23 C ATOM 590 O VAL A 39 2.253 -0.498 9.850 1.00 13.41 O ATOM 591 CB VAL A 39 4.529 -0.453 7.523 1.00 52.25 C ATOM 592 CG1 VAL A 39 4.961 -1.409 8.624 1.00 0.40 C ATOM 593 CG2 VAL A 39 4.915 -0.994 6.154 1.00 13.31 C ATOM 0 H VAL A 39 3.351 1.187 6.054 1.00 33.11 H new ATOM 0 HA VAL A 39 2.485 -1.129 7.389 1.00 75.22 H new ATOM 0 HB VAL A 39 5.047 0.494 7.674 1.00 52.25 H new ATOM 0 HG11 VAL A 39 6.036 -1.578 8.558 1.00 0.40 H new ATOM 0 HG12 VAL A 39 4.720 -0.978 9.596 1.00 0.40 H new ATOM 0 HG13 VAL A 39 4.437 -2.358 8.508 1.00 0.40 H new ATOM 0 HG21 VAL A 39 5.990 -1.169 6.122 1.00 13.31 H new ATOM 0 HG22 VAL A 39 4.389 -1.931 5.972 1.00 13.31 H new ATOM 0 HG23 VAL A 39 4.642 -0.270 5.386 1.00 13.31 H new ATOM 603 N ALA A 40 2.800 1.591 9.217 1.00 63.52 N ATOM 604 CA ALA A 40 2.490 2.182 10.512 1.00 12.51 C ATOM 605 C ALA A 40 1.015 2.007 10.857 1.00 72.24 C ATOM 606 O ALA A 40 0.670 1.635 11.978 1.00 64.12 O ATOM 607 CB ALA A 40 2.864 3.657 10.522 1.00 41.22 C ATOM 0 H ALA A 40 3.132 2.256 8.518 1.00 63.52 H new ATOM 0 HA ALA A 40 3.078 1.664 11.270 1.00 12.51 H new ATOM 0 HB1 ALA A 40 2.627 4.086 11.496 1.00 41.22 H new ATOM 0 HB2 ALA A 40 3.932 3.763 10.329 1.00 41.22 H new ATOM 0 HB3 ALA A 40 2.302 4.180 9.749 1.00 41.22 H new ATOM 613 N GLU A 41 0.149 2.278 9.885 1.00 35.42 N ATOM 614 CA GLU A 41 -1.290 2.151 10.088 1.00 61.50 C ATOM 615 C GLU A 41 -1.681 0.692 10.310 1.00 12.44 C ATOM 616 O GLU A 41 -2.447 0.376 11.220 1.00 15.50 O ATOM 617 CB GLU A 41 -2.049 2.716 8.886 1.00 62.14 C ATOM 618 CG GLU A 41 -3.542 2.436 8.922 1.00 42.12 C ATOM 619 CD GLU A 41 -4.233 3.106 10.094 1.00 64.12 C ATOM 620 OE1 GLU A 41 -4.054 2.635 11.236 1.00 33.14 O ATOM 621 OE2 GLU A 41 -4.952 4.102 9.868 1.00 64.24 O ATOM 0 H GLU A 41 0.418 2.586 8.951 1.00 35.42 H new ATOM 0 HA GLU A 41 -1.557 2.721 10.978 1.00 61.50 H new ATOM 0 HB2 GLU A 41 -1.891 3.794 8.841 1.00 62.14 H new ATOM 0 HB3 GLU A 41 -1.631 2.294 7.972 1.00 62.14 H new ATOM 0 HG2 GLU A 41 -3.995 2.781 7.992 1.00 42.12 H new ATOM 0 HG3 GLU A 41 -3.705 1.360 8.976 1.00 42.12 H new ATOM 628 N MET A 42 -1.149 -0.191 9.472 1.00 34.33 N ATOM 629 CA MET A 42 -1.442 -1.616 9.577 1.00 13.05 C ATOM 630 C MET A 42 -0.935 -2.179 10.901 1.00 23.11 C ATOM 631 O MET A 42 -1.677 -2.834 11.633 1.00 61.54 O ATOM 632 CB MET A 42 -0.809 -2.376 8.410 1.00 34.13 C ATOM 633 CG MET A 42 -1.651 -3.541 7.916 1.00 74.20 C ATOM 634 SD MET A 42 -0.665 -5.006 7.551 1.00 2.42 S ATOM 635 CE MET A 42 -0.429 -5.673 9.196 1.00 22.24 C ATOM 0 H MET A 42 -0.513 0.054 8.713 1.00 34.33 H new ATOM 0 HA MET A 42 -2.524 -1.743 9.539 1.00 13.05 H new ATOM 0 HB2 MET A 42 -0.641 -1.684 7.585 1.00 34.13 H new ATOM 0 HB3 MET A 42 0.168 -2.749 8.717 1.00 34.13 H new ATOM 0 HG2 MET A 42 -2.398 -3.789 8.670 1.00 74.20 H new ATOM 0 HG3 MET A 42 -2.191 -3.239 7.019 1.00 74.20 H new ATOM 0 HE1 MET A 42 0.332 -6.453 9.167 1.00 22.24 H new ATOM 0 HE2 MET A 42 -0.108 -4.878 9.868 1.00 22.24 H new ATOM 0 HE3 MET A 42 -1.367 -6.095 9.556 1.00 22.24 H new ATOM 645 N TRP A 43 0.333 -1.920 11.202 1.00 55.32 N ATOM 646 CA TRP A 43 0.939 -2.402 12.438 1.00 54.41 C ATOM 647 C TRP A 43 0.150 -1.926 13.653 1.00 54.44 C ATOM 648 O TRP A 43 -0.196 -2.717 14.530 1.00 12.02 O ATOM 649 CB TRP A 43 2.389 -1.926 12.538 1.00 31.11 C ATOM 650 CG TRP A 43 3.111 -2.470 13.734 1.00 41.15 C ATOM 651 CD1 TRP A 43 3.721 -3.687 13.839 1.00 62.22 C ATOM 652 CD2 TRP A 43 3.296 -1.816 14.994 1.00 43.35 C ATOM 653 NE1 TRP A 43 4.275 -3.829 15.088 1.00 35.25 N ATOM 654 CE2 TRP A 43 4.029 -2.695 15.816 1.00 54.35 C ATOM 655 CE3 TRP A 43 2.917 -0.573 15.507 1.00 50.43 C ATOM 656 CZ2 TRP A 43 4.386 -2.368 17.121 1.00 30.40 C ATOM 657 CZ3 TRP A 43 3.272 -0.250 16.803 1.00 62.43 C ATOM 658 CH2 TRP A 43 4.001 -1.145 17.598 1.00 43.23 C ATOM 0 H TRP A 43 0.961 -1.379 10.607 1.00 55.32 H new ATOM 0 HA TRP A 43 0.922 -3.492 12.421 1.00 54.41 H new ATOM 0 HB2 TRP A 43 2.924 -2.220 11.635 1.00 31.11 H new ATOM 0 HB3 TRP A 43 2.405 -0.837 12.577 1.00 31.11 H new ATOM 0 HD1 TRP A 43 3.762 -4.429 13.055 1.00 62.22 H new ATOM 0 HE1 TRP A 43 4.787 -4.647 15.420 1.00 35.25 H new ATOM 0 HE3 TRP A 43 2.356 0.123 14.901 1.00 50.43 H new ATOM 0 HZ2 TRP A 43 4.947 -3.056 17.736 1.00 30.40 H new ATOM 0 HZ3 TRP A 43 2.983 0.708 17.210 1.00 62.43 H new ATOM 0 HH2 TRP A 43 4.264 -0.864 18.607 1.00 43.23 H new ATOM 669 N LYS A 44 -0.133 -0.628 13.698 1.00 21.10 N ATOM 670 CA LYS A 44 -0.883 -0.046 14.805 1.00 61.13 C ATOM 671 C LYS A 44 -2.261 -0.689 14.926 1.00 63.20 C ATOM 672 O LYS A 44 -2.590 -1.281 15.953 1.00 74.30 O ATOM 673 CB LYS A 44 -1.029 1.465 14.610 1.00 22.22 C ATOM 674 CG LYS A 44 -1.767 2.156 15.744 1.00 61.52 C ATOM 675 CD LYS A 44 -3.219 2.422 15.384 1.00 61.44 C ATOM 676 CE LYS A 44 -3.339 3.487 14.305 1.00 13.41 C ATOM 677 NZ LYS A 44 -3.496 4.849 14.886 1.00 12.44 N ATOM 0 H LYS A 44 0.146 0.041 12.980 1.00 21.10 H new ATOM 0 HA LYS A 44 -0.331 -0.236 15.725 1.00 61.13 H new ATOM 0 HB2 LYS A 44 -0.038 1.907 14.510 1.00 22.22 H new ATOM 0 HB3 LYS A 44 -1.558 1.653 13.676 1.00 22.22 H new ATOM 0 HG2 LYS A 44 -1.721 1.537 16.640 1.00 61.52 H new ATOM 0 HG3 LYS A 44 -1.272 3.098 15.981 1.00 61.52 H new ATOM 0 HD2 LYS A 44 -3.685 1.499 15.039 1.00 61.44 H new ATOM 0 HD3 LYS A 44 -3.763 2.740 16.273 1.00 61.44 H new ATOM 0 HE2 LYS A 44 -2.453 3.463 13.670 1.00 13.41 H new ATOM 0 HE3 LYS A 44 -4.194 3.263 13.667 1.00 13.41 H new ATOM 0 HZ1 LYS A 44 -3.558 5.549 14.119 1.00 12.44 H new ATOM 0 HZ2 LYS A 44 -4.364 4.885 15.458 1.00 12.44 H new ATOM 0 HZ3 LYS A 44 -2.676 5.066 15.488 1.00 12.44 H new ATOM 691 N GLU A 45 -3.060 -0.569 13.870 1.00 22.34 N ATOM 692 CA GLU A 45 -4.402 -1.140 13.860 1.00 24.11 C ATOM 693 C GLU A 45 -4.367 -2.619 14.235 1.00 4.12 C ATOM 694 O GLU A 45 -5.319 -3.148 14.809 1.00 2.44 O ATOM 695 CB GLU A 45 -5.043 -0.967 12.482 1.00 61.43 C ATOM 696 CG GLU A 45 -5.838 0.320 12.337 1.00 24.50 C ATOM 697 CD GLU A 45 -7.274 0.174 12.801 1.00 61.51 C ATOM 698 OE1 GLU A 45 -7.613 -0.896 13.350 1.00 55.31 O ATOM 699 OE2 GLU A 45 -8.058 1.127 12.615 1.00 41.31 O ATOM 0 H GLU A 45 -2.802 -0.082 13.012 1.00 22.34 H new ATOM 0 HA GLU A 45 -5.001 -0.609 14.601 1.00 24.11 H new ATOM 0 HB2 GLU A 45 -4.262 -0.989 11.722 1.00 61.43 H new ATOM 0 HB3 GLU A 45 -5.701 -1.814 12.288 1.00 61.43 H new ATOM 0 HG2 GLU A 45 -5.353 1.109 12.912 1.00 24.50 H new ATOM 0 HG3 GLU A 45 -5.827 0.633 11.293 1.00 24.50 H new ATOM 706 N TYR A 46 -3.263 -3.280 13.906 1.00 62.50 N ATOM 707 CA TYR A 46 -3.104 -4.699 14.205 1.00 41.30 C ATOM 708 C TYR A 46 -2.822 -4.914 15.689 1.00 64.43 C ATOM 709 O TYR A 46 -3.309 -5.870 16.292 1.00 64.11 O ATOM 710 CB TYR A 46 -1.971 -5.294 13.367 1.00 32.30 C ATOM 711 CG TYR A 46 -1.529 -6.663 13.832 1.00 31.33 C ATOM 712 CD1 TYR A 46 -2.127 -7.814 13.334 1.00 33.43 C ATOM 713 CD2 TYR A 46 -0.514 -6.806 14.770 1.00 13.14 C ATOM 714 CE1 TYR A 46 -1.727 -9.067 13.757 1.00 73.42 C ATOM 715 CE2 TYR A 46 -0.107 -8.055 15.198 1.00 42.24 C ATOM 716 CZ TYR A 46 -0.716 -9.182 14.688 1.00 34.32 C ATOM 717 OH TYR A 46 -0.314 -10.428 15.112 1.00 33.23 O ATOM 0 H TYR A 46 -2.465 -2.857 13.432 1.00 62.50 H new ATOM 0 HA TYR A 46 -4.036 -5.205 13.954 1.00 41.30 H new ATOM 0 HB2 TYR A 46 -2.294 -5.359 12.328 1.00 32.30 H new ATOM 0 HB3 TYR A 46 -1.117 -4.617 13.393 1.00 32.30 H new ATOM 0 HD1 TYR A 46 -2.918 -7.728 12.604 1.00 33.43 H new ATOM 0 HD2 TYR A 46 -0.035 -5.925 15.172 1.00 13.14 H new ATOM 0 HE1 TYR A 46 -2.203 -9.952 13.361 1.00 73.42 H new ATOM 0 HE2 TYR A 46 0.684 -8.148 15.928 1.00 42.24 H new ATOM 0 HH TYR A 46 -0.625 -11.106 14.476 1.00 33.23 H new ATOM 727 N MET A 47 -2.032 -4.018 16.270 1.00 5.13 N ATOM 728 CA MET A 47 -1.685 -4.108 17.684 1.00 31.10 C ATOM 729 C MET A 47 -2.885 -3.764 18.561 1.00 71.32 C ATOM 730 O MET A 47 -2.999 -4.242 19.690 1.00 24.14 O ATOM 731 CB MET A 47 -0.519 -3.172 18.006 1.00 64.10 C ATOM 732 CG MET A 47 0.780 -3.562 17.320 1.00 45.35 C ATOM 733 SD MET A 47 1.676 -4.850 18.208 1.00 61.23 S ATOM 734 CE MET A 47 2.649 -3.865 19.344 1.00 15.30 C ATOM 0 H MET A 47 -1.620 -3.221 15.784 1.00 5.13 H new ATOM 0 HA MET A 47 -1.386 -5.135 17.894 1.00 31.10 H new ATOM 0 HB2 MET A 47 -0.786 -2.157 17.711 1.00 64.10 H new ATOM 0 HB3 MET A 47 -0.361 -3.159 19.084 1.00 64.10 H new ATOM 0 HG2 MET A 47 0.563 -3.907 16.309 1.00 45.35 H new ATOM 0 HG3 MET A 47 1.415 -2.681 17.227 1.00 45.35 H new ATOM 0 HE1 MET A 47 3.709 -4.063 19.182 1.00 15.30 H new ATOM 0 HE2 MET A 47 2.448 -2.807 19.173 1.00 15.30 H new ATOM 0 HE3 MET A 47 2.384 -4.124 20.369 1.00 15.30 H new ATOM 744 N LEU A 48 -3.778 -2.933 18.034 1.00 22.34 N ATOM 745 CA LEU A 48 -4.970 -2.525 18.770 1.00 61.23 C ATOM 746 C LEU A 48 -6.160 -3.408 18.410 1.00 35.31 C ATOM 747 O LEU A 48 -7.305 -2.956 18.415 1.00 54.11 O ATOM 748 CB LEU A 48 -5.299 -1.061 18.474 1.00 1.23 C ATOM 749 CG LEU A 48 -4.438 -0.021 19.193 1.00 34.33 C ATOM 750 CD1 LEU A 48 -3.053 0.048 18.571 1.00 63.55 C ATOM 751 CD2 LEU A 48 -5.110 1.344 19.157 1.00 23.12 C ATOM 0 H LEU A 48 -3.699 -2.529 17.101 1.00 22.34 H new ATOM 0 HA LEU A 48 -4.766 -2.637 19.835 1.00 61.23 H new ATOM 0 HB2 LEU A 48 -5.208 -0.899 17.400 1.00 1.23 H new ATOM 0 HB3 LEU A 48 -6.342 -0.884 18.736 1.00 1.23 H new ATOM 0 HG LEU A 48 -4.331 -0.324 20.235 1.00 34.33 H new ATOM 0 HD11 LEU A 48 -2.455 0.793 19.096 1.00 63.55 H new ATOM 0 HD12 LEU A 48 -2.570 -0.926 18.650 1.00 63.55 H new ATOM 0 HD13 LEU A 48 -3.139 0.326 17.521 1.00 63.55 H new ATOM 0 HD21 LEU A 48 -4.484 2.072 19.673 1.00 23.12 H new ATOM 0 HD22 LEU A 48 -5.248 1.654 18.121 1.00 23.12 H new ATOM 0 HD23 LEU A 48 -6.080 1.285 19.651 1.00 23.12 H new ATOM 763 N ARG A 49 -5.882 -4.670 18.101 1.00 73.54 N ATOM 764 CA ARG A 49 -6.930 -5.617 17.740 1.00 73.53 C ATOM 765 C ARG A 49 -7.054 -6.718 18.789 1.00 23.04 C ATOM 766 O ARG A 49 -6.081 -7.103 19.438 1.00 23.01 O ATOM 767 CB ARG A 49 -6.640 -6.234 16.370 1.00 32.42 C ATOM 768 CG ARG A 49 -7.308 -5.501 15.218 1.00 31.42 C ATOM 769 CD ARG A 49 -6.742 -5.939 13.876 1.00 21.14 C ATOM 770 NE ARG A 49 -7.772 -6.007 12.843 1.00 11.15 N ATOM 771 CZ ARG A 49 -7.522 -6.314 11.576 1.00 74.54 C ATOM 772 NH1 ARG A 49 -6.283 -6.582 11.186 1.00 14.34 N ATOM 773 NH2 ARG A 49 -8.513 -6.356 10.694 1.00 13.21 N ATOM 0 H ARG A 49 -4.940 -5.061 18.093 1.00 73.54 H new ATOM 0 HA ARG A 49 -7.874 -5.074 17.694 1.00 73.53 H new ATOM 0 HB2 ARG A 49 -5.562 -6.245 16.207 1.00 32.42 H new ATOM 0 HB3 ARG A 49 -6.973 -7.272 16.371 1.00 32.42 H new ATOM 0 HG2 ARG A 49 -8.382 -5.688 15.240 1.00 31.42 H new ATOM 0 HG3 ARG A 49 -7.169 -4.427 15.340 1.00 31.42 H new ATOM 0 HD2 ARG A 49 -5.963 -5.242 13.566 1.00 21.14 H new ATOM 0 HD3 ARG A 49 -6.271 -6.916 13.983 1.00 21.14 H new ATOM 0 HE ARG A 49 -8.736 -5.808 13.110 1.00 11.15 H new ATOM 0 HH11 ARG A 49 -5.518 -6.553 11.860 1.00 14.34 H new ATOM 0 HH12 ARG A 49 -6.095 -6.818 10.212 1.00 14.34 H new ATOM 0 HH21 ARG A 49 -9.468 -6.152 10.990 1.00 13.21 H new ATOM 0 HH22 ARG A 49 -8.320 -6.592 9.721 1.00 13.21 H new ATOM 787 N PRO A 50 -8.279 -7.237 18.962 1.00 45.11 N ATOM 788 CA PRO A 50 -8.558 -8.300 19.932 1.00 74.14 C ATOM 789 C PRO A 50 -7.944 -9.634 19.522 1.00 21.34 C ATOM 790 O PRO A 50 -7.346 -10.330 20.343 1.00 65.45 O ATOM 791 CB PRO A 50 -10.086 -8.391 19.927 1.00 74.22 C ATOM 792 CG PRO A 50 -10.492 -7.881 18.587 1.00 31.02 C ATOM 793 CD PRO A 50 -9.484 -6.826 18.223 1.00 33.13 C ATOM 0 HA PRO A 50 -8.133 -8.081 20.911 1.00 74.14 H new ATOM 0 HB2 PRO A 50 -10.422 -9.417 20.078 1.00 74.22 H new ATOM 0 HB3 PRO A 50 -10.521 -7.792 20.727 1.00 74.22 H new ATOM 0 HG2 PRO A 50 -10.500 -8.684 17.850 1.00 31.02 H new ATOM 0 HG3 PRO A 50 -11.499 -7.465 18.616 1.00 31.02 H new ATOM 0 HD2 PRO A 50 -9.305 -6.795 17.148 1.00 33.13 H new ATOM 0 HD3 PRO A 50 -9.818 -5.832 18.520 1.00 33.13 H new ATOM 801 N SER A 51 -8.095 -9.985 18.249 1.00 12.32 N ATOM 802 CA SER A 51 -7.558 -11.238 17.732 1.00 3.31 C ATOM 803 C SER A 51 -6.092 -11.402 18.121 1.00 3.35 C ATOM 804 O SER A 51 -5.646 -12.498 18.459 1.00 21.42 O ATOM 805 CB SER A 51 -7.702 -11.289 16.210 1.00 63.41 C ATOM 806 OG SER A 51 -7.033 -10.201 15.597 1.00 0.41 O ATOM 0 H SER A 51 -8.585 -9.419 17.556 1.00 12.32 H new ATOM 0 HA SER A 51 -8.127 -12.058 18.172 1.00 3.31 H new ATOM 0 HB2 SER A 51 -7.295 -12.228 15.835 1.00 63.41 H new ATOM 0 HB3 SER A 51 -8.758 -11.269 15.941 1.00 63.41 H new ATOM 0 HG SER A 51 -7.139 -10.258 14.624 1.00 0.41 H new ATOM 812 N VAL A 52 -5.346 -10.302 18.072 1.00 71.34 N ATOM 813 CA VAL A 52 -3.930 -10.322 18.420 1.00 74.23 C ATOM 814 C VAL A 52 -3.734 -10.581 19.909 1.00 14.13 C ATOM 815 O VAL A 52 -4.224 -9.828 20.750 1.00 74.31 O ATOM 816 CB VAL A 52 -3.242 -8.996 18.045 1.00 23.40 C ATOM 817 CG1 VAL A 52 -1.779 -9.019 18.461 1.00 44.54 C ATOM 818 CG2 VAL A 52 -3.377 -8.729 16.554 1.00 62.24 C ATOM 0 H VAL A 52 -5.699 -9.386 17.795 1.00 71.34 H new ATOM 0 HA VAL A 52 -3.475 -11.133 17.851 1.00 74.23 H new ATOM 0 HB VAL A 52 -3.735 -8.185 18.581 1.00 23.40 H new ATOM 0 HG11 VAL A 52 -1.308 -8.074 18.188 1.00 44.54 H new ATOM 0 HG12 VAL A 52 -1.710 -9.161 19.539 1.00 44.54 H new ATOM 0 HG13 VAL A 52 -1.269 -9.838 17.954 1.00 44.54 H new ATOM 0 HG21 VAL A 52 -2.885 -7.788 16.307 1.00 62.24 H new ATOM 0 HG22 VAL A 52 -2.910 -9.540 15.995 1.00 62.24 H new ATOM 0 HG23 VAL A 52 -4.433 -8.667 16.290 1.00 62.24 H new ATOM 828 N ASN A 53 -3.014 -11.651 20.229 1.00 45.14 N ATOM 829 CA ASN A 53 -2.752 -12.010 21.618 1.00 51.42 C ATOM 830 C ASN A 53 -1.617 -11.168 22.193 1.00 50.34 C ATOM 831 O ASN A 53 -1.111 -10.256 21.537 1.00 14.35 O ATOM 832 CB ASN A 53 -2.405 -13.496 21.726 1.00 51.21 C ATOM 833 CG ASN A 53 -3.513 -14.388 21.201 1.00 53.14 C ATOM 834 OD1 ASN A 53 -4.593 -14.466 21.787 1.00 52.34 O ATOM 835 ND2 ASN A 53 -3.250 -15.067 20.090 1.00 3.12 N ATOM 0 H ASN A 53 -2.601 -12.285 19.545 1.00 45.14 H new ATOM 0 HA ASN A 53 -3.655 -11.812 22.195 1.00 51.42 H new ATOM 0 HB2 ASN A 53 -1.489 -13.694 21.170 1.00 51.21 H new ATOM 0 HB3 ASN A 53 -2.205 -13.745 22.768 1.00 51.21 H new ATOM 0 HD21 ASN A 53 -3.957 -15.683 19.690 1.00 3.12 H new ATOM 0 HD22 ASN A 53 -2.341 -14.972 19.637 1.00 3.12 H new ATOM 842 N THR A 54 -1.220 -11.480 23.422 1.00 23.23 N ATOM 843 CA THR A 54 -0.145 -10.753 24.086 1.00 32.23 C ATOM 844 C THR A 54 1.201 -11.041 23.431 1.00 75.42 C ATOM 845 O THR A 54 1.954 -10.123 23.108 1.00 11.44 O ATOM 846 CB THR A 54 -0.063 -11.114 25.581 1.00 21.25 C ATOM 847 OG1 THR A 54 -1.135 -11.997 25.932 1.00 4.21 O ATOM 848 CG2 THR A 54 -0.126 -9.863 26.445 1.00 75.25 C ATOM 0 H THR A 54 -1.627 -12.232 23.978 1.00 23.23 H new ATOM 0 HA THR A 54 -0.374 -9.692 23.988 1.00 32.23 H new ATOM 0 HB THR A 54 0.890 -11.612 25.759 1.00 21.25 H new ATOM 0 HG1 THR A 54 -1.074 -12.223 26.884 1.00 4.21 H new ATOM 0 HG21 THR A 54 -0.066 -10.144 27.497 1.00 75.25 H new ATOM 0 HG22 THR A 54 0.708 -9.207 26.197 1.00 75.25 H new ATOM 0 HG23 THR A 54 -1.065 -9.341 26.262 1.00 75.25 H new ATOM 856 N ARG A 55 1.496 -12.322 23.236 1.00 62.34 N ATOM 857 CA ARG A 55 2.752 -12.731 22.618 1.00 3.05 C ATOM 858 C ARG A 55 2.970 -12.003 21.295 1.00 31.21 C ATOM 859 O ARG A 55 4.043 -11.452 21.047 1.00 33.44 O ATOM 860 CB ARG A 55 2.764 -14.243 22.389 1.00 70.41 C ATOM 861 CG ARG A 55 1.528 -14.760 21.670 1.00 44.10 C ATOM 862 CD ARG A 55 1.472 -16.279 21.681 1.00 31.51 C ATOM 863 NE ARG A 55 2.697 -16.877 21.155 1.00 14.44 N ATOM 864 CZ ARG A 55 3.003 -18.162 21.288 1.00 22.25 C ATOM 865 NH1 ARG A 55 2.179 -18.981 21.926 1.00 35.34 N ATOM 866 NH2 ARG A 55 4.137 -18.631 20.782 1.00 33.14 N ATOM 0 H ARG A 55 0.883 -13.094 23.497 1.00 62.34 H new ATOM 0 HA ARG A 55 3.564 -12.467 23.296 1.00 3.05 H new ATOM 0 HB2 ARG A 55 3.648 -14.507 21.809 1.00 70.41 H new ATOM 0 HB3 ARG A 55 2.852 -14.747 23.351 1.00 70.41 H new ATOM 0 HG2 ARG A 55 0.634 -14.358 22.147 1.00 44.10 H new ATOM 0 HG3 ARG A 55 1.528 -14.402 20.640 1.00 44.10 H new ATOM 0 HD2 ARG A 55 1.307 -16.628 22.700 1.00 31.51 H new ATOM 0 HD3 ARG A 55 0.621 -16.614 21.088 1.00 31.51 H new ATOM 0 HE ARG A 55 3.353 -16.274 20.658 1.00 14.44 H new ATOM 0 HH11 ARG A 55 1.307 -18.625 22.317 1.00 35.34 H new ATOM 0 HH12 ARG A 55 2.417 -19.968 22.026 1.00 35.34 H new ATOM 0 HH21 ARG A 55 4.774 -18.004 20.291 1.00 33.14 H new ATOM 0 HH22 ARG A 55 4.371 -19.618 20.885 1.00 33.14 H new ATOM 880 N ARG A 56 1.945 -12.006 20.449 1.00 42.12 N ATOM 881 CA ARG A 56 2.025 -11.348 19.150 1.00 0.33 C ATOM 882 C ARG A 56 2.437 -9.887 19.306 1.00 50.32 C ATOM 883 O ARG A 56 3.303 -9.394 18.583 1.00 65.21 O ATOM 884 CB ARG A 56 0.680 -11.435 18.427 1.00 70.22 C ATOM 885 CG ARG A 56 0.253 -12.858 18.106 1.00 73.04 C ATOM 886 CD ARG A 56 1.228 -13.531 17.152 1.00 12.31 C ATOM 887 NE ARG A 56 0.828 -14.899 16.836 1.00 22.41 N ATOM 888 CZ ARG A 56 1.662 -15.817 16.360 1.00 24.22 C ATOM 889 NH1 ARG A 56 2.935 -15.514 16.147 1.00 43.00 N ATOM 890 NH2 ARG A 56 1.224 -17.042 16.097 1.00 14.51 N ATOM 0 H ARG A 56 1.050 -12.456 20.640 1.00 42.12 H new ATOM 0 HA ARG A 56 2.782 -11.860 18.557 1.00 0.33 H new ATOM 0 HB2 ARG A 56 -0.086 -10.965 19.044 1.00 70.22 H new ATOM 0 HB3 ARG A 56 0.737 -10.864 17.500 1.00 70.22 H new ATOM 0 HG2 ARG A 56 0.187 -13.436 19.028 1.00 73.04 H new ATOM 0 HG3 ARG A 56 -0.743 -12.849 17.663 1.00 73.04 H new ATOM 0 HD2 ARG A 56 1.294 -12.951 16.232 1.00 12.31 H new ATOM 0 HD3 ARG A 56 2.223 -13.538 17.596 1.00 12.31 H new ATOM 0 HE ARG A 56 -0.145 -15.164 16.989 1.00 22.41 H new ATOM 0 HH11 ARG A 56 3.276 -14.574 16.349 1.00 43.00 H new ATOM 0 HH12 ARG A 56 3.573 -16.221 15.781 1.00 43.00 H new ATOM 0 HH21 ARG A 56 0.246 -17.280 16.260 1.00 14.51 H new ATOM 0 HH22 ARG A 56 1.866 -17.746 15.732 1.00 14.51 H new ATOM 904 N LYS A 57 1.810 -9.198 20.253 1.00 33.23 N ATOM 905 CA LYS A 57 2.110 -7.794 20.505 1.00 3.24 C ATOM 906 C LYS A 57 3.555 -7.620 20.964 1.00 34.53 C ATOM 907 O LYS A 57 4.293 -6.795 20.426 1.00 41.33 O ATOM 908 CB LYS A 57 1.157 -7.228 21.561 1.00 63.51 C ATOM 909 CG LYS A 57 -0.257 -7.014 21.051 1.00 73.32 C ATOM 910 CD LYS A 57 -1.250 -6.893 22.195 1.00 51.24 C ATOM 911 CE LYS A 57 -2.686 -6.942 21.694 1.00 24.33 C ATOM 912 NZ LYS A 57 -3.665 -6.935 22.816 1.00 3.43 N ATOM 0 H LYS A 57 1.090 -9.590 20.860 1.00 33.23 H new ATOM 0 HA LYS A 57 1.975 -7.247 19.572 1.00 3.24 H new ATOM 0 HB2 LYS A 57 1.128 -7.907 22.413 1.00 63.51 H new ATOM 0 HB3 LYS A 57 1.551 -6.278 21.923 1.00 63.51 H new ATOM 0 HG2 LYS A 57 -0.292 -6.112 20.441 1.00 73.32 H new ATOM 0 HG3 LYS A 57 -0.542 -7.846 20.407 1.00 73.32 H new ATOM 0 HD2 LYS A 57 -1.085 -7.700 22.909 1.00 51.24 H new ATOM 0 HD3 LYS A 57 -1.081 -5.957 22.728 1.00 51.24 H new ATOM 0 HE2 LYS A 57 -2.873 -6.088 21.043 1.00 24.33 H new ATOM 0 HE3 LYS A 57 -2.830 -7.839 21.092 1.00 24.33 H new ATOM 0 HZ1 LYS A 57 -4.632 -6.969 22.434 1.00 3.43 H new ATOM 0 HZ2 LYS A 57 -3.503 -7.764 23.423 1.00 3.43 H new ATOM 0 HZ3 LYS A 57 -3.545 -6.067 23.376 1.00 3.43 H new ATOM 926 N LEU A 58 3.952 -8.404 21.961 1.00 70.13 N ATOM 927 CA LEU A 58 5.309 -8.338 22.491 1.00 23.32 C ATOM 928 C LEU A 58 6.338 -8.442 21.370 1.00 71.53 C ATOM 929 O LEU A 58 7.339 -7.725 21.362 1.00 23.15 O ATOM 930 CB LEU A 58 5.534 -9.457 23.510 1.00 4.55 C ATOM 931 CG LEU A 58 6.880 -9.441 24.237 1.00 34.43 C ATOM 932 CD1 LEU A 58 7.966 -10.048 23.363 1.00 73.13 C ATOM 933 CD2 LEU A 58 7.250 -8.023 24.644 1.00 42.41 C ATOM 0 H LEU A 58 3.354 -9.092 22.418 1.00 70.13 H new ATOM 0 HA LEU A 58 5.433 -7.374 22.984 1.00 23.32 H new ATOM 0 HB2 LEU A 58 4.740 -9.408 24.255 1.00 4.55 H new ATOM 0 HB3 LEU A 58 5.431 -10.414 22.998 1.00 4.55 H new ATOM 0 HG LEU A 58 6.790 -10.044 25.140 1.00 34.43 H new ATOM 0 HD11 LEU A 58 8.916 -10.028 23.897 1.00 73.13 H new ATOM 0 HD12 LEU A 58 7.706 -11.079 23.123 1.00 73.13 H new ATOM 0 HD13 LEU A 58 8.055 -9.473 22.442 1.00 73.13 H new ATOM 0 HD21 LEU A 58 8.210 -8.031 25.160 1.00 42.41 H new ATOM 0 HD22 LEU A 58 7.321 -7.396 23.755 1.00 42.41 H new ATOM 0 HD23 LEU A 58 6.484 -7.624 25.309 1.00 42.41 H new ATOM 945 N LEU A 59 6.084 -9.338 20.422 1.00 33.22 N ATOM 946 CA LEU A 59 6.986 -9.535 19.293 1.00 4.12 C ATOM 947 C LEU A 59 6.987 -8.315 18.378 1.00 61.15 C ATOM 948 O LEU A 59 8.043 -7.801 18.012 1.00 64.54 O ATOM 949 CB LEU A 59 6.582 -10.780 18.502 1.00 31.34 C ATOM 950 CG LEU A 59 7.239 -12.092 18.934 1.00 52.03 C ATOM 951 CD1 LEU A 59 6.750 -13.243 18.069 1.00 34.51 C ATOM 952 CD2 LEU A 59 8.755 -11.977 18.865 1.00 74.35 C ATOM 0 H LEU A 59 5.260 -9.940 20.413 1.00 33.22 H new ATOM 0 HA LEU A 59 7.994 -9.673 19.685 1.00 4.12 H new ATOM 0 HB2 LEU A 59 5.501 -10.897 18.575 1.00 31.34 H new ATOM 0 HB3 LEU A 59 6.814 -10.609 17.451 1.00 31.34 H new ATOM 0 HG LEU A 59 6.957 -12.295 19.967 1.00 52.03 H new ATOM 0 HD11 LEU A 59 7.228 -14.168 18.391 1.00 34.51 H new ATOM 0 HD12 LEU A 59 5.669 -13.339 18.169 1.00 34.51 H new ATOM 0 HD13 LEU A 59 7.002 -13.048 17.027 1.00 34.51 H new ATOM 0 HD21 LEU A 59 9.206 -12.919 19.176 1.00 74.35 H new ATOM 0 HD22 LEU A 59 9.057 -11.750 17.842 1.00 74.35 H new ATOM 0 HD23 LEU A 59 9.090 -11.179 19.527 1.00 74.35 H new ATOM 964 N GLY A 60 5.794 -7.855 18.012 1.00 3.33 N ATOM 965 CA GLY A 60 5.680 -6.697 17.144 1.00 32.33 C ATOM 966 C GLY A 60 6.448 -5.501 17.669 1.00 2.31 C ATOM 967 O GLY A 60 7.067 -4.765 16.900 1.00 44.25 O ATOM 0 H GLY A 60 4.905 -8.263 18.301 1.00 3.33 H new ATOM 0 HA2 GLY A 60 6.048 -6.954 16.151 1.00 32.33 H new ATOM 0 HA3 GLY A 60 4.629 -6.430 17.035 1.00 32.33 H new ATOM 971 N LEU A 61 6.408 -5.304 18.982 1.00 1.42 N ATOM 972 CA LEU A 61 7.105 -4.186 19.610 1.00 60.13 C ATOM 973 C LEU A 61 8.609 -4.280 19.373 1.00 71.12 C ATOM 974 O LEU A 61 9.259 -3.287 19.046 1.00 24.01 O ATOM 975 CB LEU A 61 6.815 -4.157 21.111 1.00 14.13 C ATOM 976 CG LEU A 61 6.778 -2.773 21.761 1.00 72.20 C ATOM 977 CD1 LEU A 61 8.139 -2.101 21.663 1.00 35.10 C ATOM 978 CD2 LEU A 61 5.706 -1.908 21.114 1.00 60.44 C ATOM 0 H LEU A 61 5.901 -5.903 19.633 1.00 1.42 H new ATOM 0 HA LEU A 61 6.741 -3.263 19.158 1.00 60.13 H new ATOM 0 HB2 LEU A 61 5.855 -4.644 21.285 1.00 14.13 H new ATOM 0 HB3 LEU A 61 7.572 -4.755 21.619 1.00 14.13 H new ATOM 0 HG LEU A 61 6.531 -2.894 22.816 1.00 72.20 H new ATOM 0 HD11 LEU A 61 8.094 -1.117 22.131 1.00 35.10 H new ATOM 0 HD12 LEU A 61 8.884 -2.712 22.173 1.00 35.10 H new ATOM 0 HD13 LEU A 61 8.416 -1.992 20.615 1.00 35.10 H new ATOM 0 HD21 LEU A 61 5.694 -0.927 21.589 1.00 60.44 H new ATOM 0 HD22 LEU A 61 5.922 -1.794 20.052 1.00 60.44 H new ATOM 0 HD23 LEU A 61 4.732 -2.382 21.237 1.00 60.44 H new ATOM 990 N TYR A 62 9.155 -5.480 19.538 1.00 55.15 N ATOM 991 CA TYR A 62 10.582 -5.704 19.342 1.00 50.21 C ATOM 992 C TYR A 62 10.971 -5.494 17.882 1.00 62.13 C ATOM 993 O TYR A 62 12.056 -4.993 17.581 1.00 15.14 O ATOM 994 CB TYR A 62 10.963 -7.117 19.785 1.00 63.20 C ATOM 995 CG TYR A 62 11.418 -7.198 21.225 1.00 72.52 C ATOM 996 CD1 TYR A 62 12.439 -6.383 21.698 1.00 35.25 C ATOM 997 CD2 TYR A 62 10.828 -8.091 22.111 1.00 13.21 C ATOM 998 CE1 TYR A 62 12.858 -6.454 23.013 1.00 73.31 C ATOM 999 CE2 TYR A 62 11.239 -8.168 23.427 1.00 3.35 C ATOM 1000 CZ TYR A 62 12.255 -7.348 23.874 1.00 53.34 C ATOM 1001 OH TYR A 62 12.669 -7.422 25.184 1.00 73.22 O ATOM 0 H TYR A 62 8.631 -6.312 19.807 1.00 55.15 H new ATOM 0 HA TYR A 62 11.125 -4.981 19.951 1.00 50.21 H new ATOM 0 HB2 TYR A 62 10.106 -7.776 19.646 1.00 63.20 H new ATOM 0 HB3 TYR A 62 11.759 -7.489 19.140 1.00 63.20 H new ATOM 0 HD1 TYR A 62 12.913 -5.682 21.027 1.00 35.25 H new ATOM 0 HD2 TYR A 62 10.034 -8.736 21.764 1.00 13.21 H new ATOM 0 HE1 TYR A 62 13.653 -5.813 23.365 1.00 73.31 H new ATOM 0 HE2 TYR A 62 10.768 -8.866 24.103 1.00 3.35 H new ATOM 0 HH TYR A 62 12.142 -8.100 25.656 1.00 73.22 H new ATOM 1011 N LEU A 63 10.078 -5.881 16.977 1.00 4.31 N ATOM 1012 CA LEU A 63 10.326 -5.735 15.547 1.00 61.31 C ATOM 1013 C LEU A 63 10.371 -4.263 15.149 1.00 61.51 C ATOM 1014 O LEU A 63 11.353 -3.796 14.573 1.00 71.14 O ATOM 1015 CB LEU A 63 9.243 -6.459 14.745 1.00 33.15 C ATOM 1016 CG LEU A 63 9.359 -6.367 13.224 1.00 41.24 C ATOM 1017 CD1 LEU A 63 10.666 -6.984 12.750 1.00 74.32 C ATOM 1018 CD2 LEU A 63 8.173 -7.047 12.556 1.00 53.42 C ATOM 0 H LEU A 63 9.176 -6.298 17.208 1.00 4.31 H new ATOM 0 HA LEU A 63 11.295 -6.182 15.324 1.00 61.31 H new ATOM 0 HB2 LEU A 63 9.253 -7.512 15.027 1.00 33.15 H new ATOM 0 HB3 LEU A 63 8.273 -6.060 15.040 1.00 33.15 H new ATOM 0 HG LEU A 63 9.354 -5.314 12.942 1.00 41.24 H new ATOM 0 HD11 LEU A 63 10.731 -6.909 11.665 1.00 74.32 H new ATOM 0 HD12 LEU A 63 11.504 -6.453 13.201 1.00 74.32 H new ATOM 0 HD13 LEU A 63 10.701 -8.033 13.044 1.00 74.32 H new ATOM 0 HD21 LEU A 63 8.273 -6.971 11.473 1.00 53.42 H new ATOM 0 HD22 LEU A 63 8.145 -8.097 12.845 1.00 53.42 H new ATOM 0 HD23 LEU A 63 7.250 -6.560 12.870 1.00 53.42 H new ATOM 1030 N MET A 64 9.303 -3.538 15.462 1.00 34.14 N ATOM 1031 CA MET A 64 9.222 -2.118 15.140 1.00 21.14 C ATOM 1032 C MET A 64 10.333 -1.339 15.837 1.00 43.22 C ATOM 1033 O MET A 64 10.804 -0.322 15.328 1.00 31.50 O ATOM 1034 CB MET A 64 7.858 -1.557 15.547 1.00 30.52 C ATOM 1035 CG MET A 64 7.769 -1.182 17.017 1.00 3.53 C ATOM 1036 SD MET A 64 8.149 0.556 17.314 1.00 21.00 S ATOM 1037 CE MET A 64 7.380 0.802 18.913 1.00 42.32 C ATOM 0 H MET A 64 8.481 -3.910 15.938 1.00 34.14 H new ATOM 0 HA MET A 64 9.345 -2.008 14.063 1.00 21.14 H new ATOM 0 HB2 MET A 64 7.641 -0.676 14.942 1.00 30.52 H new ATOM 0 HB3 MET A 64 7.089 -2.296 15.322 1.00 30.52 H new ATOM 0 HG2 MET A 64 6.765 -1.398 17.383 1.00 3.53 H new ATOM 0 HG3 MET A 64 8.458 -1.804 17.589 1.00 3.53 H new ATOM 0 HE1 MET A 64 7.529 1.833 19.234 1.00 42.32 H new ATOM 0 HE2 MET A 64 6.312 0.596 18.839 1.00 42.32 H new ATOM 0 HE3 MET A 64 7.830 0.127 19.641 1.00 42.32 H new ATOM 1047 N ASN A 65 10.747 -1.822 17.003 1.00 25.45 N ATOM 1048 CA ASN A 65 11.803 -1.170 17.770 1.00 51.01 C ATOM 1049 C ASN A 65 13.149 -1.304 17.065 1.00 43.12 C ATOM 1050 O ASN A 65 13.872 -0.322 16.892 1.00 24.13 O ATOM 1051 CB ASN A 65 11.888 -1.771 19.174 1.00 21.13 C ATOM 1052 CG ASN A 65 12.811 -0.985 20.085 1.00 41.52 C ATOM 1053 OD1 ASN A 65 13.037 0.208 19.878 1.00 64.22 O ATOM 1054 ND2 ASN A 65 13.349 -1.651 21.100 1.00 45.34 N ATOM 0 H ASN A 65 10.368 -2.663 17.438 1.00 25.45 H new ATOM 0 HA ASN A 65 11.558 -0.111 17.850 1.00 51.01 H new ATOM 0 HB2 ASN A 65 10.891 -1.804 19.613 1.00 21.13 H new ATOM 0 HB3 ASN A 65 12.240 -2.800 19.105 1.00 21.13 H new ATOM 0 HD21 ASN A 65 13.978 -1.175 21.747 1.00 45.34 H new ATOM 0 HD22 ASN A 65 13.133 -2.639 21.233 1.00 45.34 H new ATOM 1061 N HIS A 66 13.479 -2.526 16.659 1.00 45.24 N ATOM 1062 CA HIS A 66 14.739 -2.788 15.971 1.00 74.53 C ATOM 1063 C HIS A 66 14.772 -2.092 14.614 1.00 40.23 C ATOM 1064 O HIS A 66 15.829 -1.666 14.149 1.00 45.01 O ATOM 1065 CB HIS A 66 14.941 -4.293 15.790 1.00 71.23 C ATOM 1066 CG HIS A 66 16.356 -4.674 15.482 1.00 61.54 C ATOM 1067 ND1 HIS A 66 17.340 -4.755 16.444 1.00 4.00 N ATOM 1068 CD2 HIS A 66 16.950 -5.000 14.310 1.00 63.12 C ATOM 1069 CE1 HIS A 66 18.479 -5.112 15.877 1.00 1.23 C ATOM 1070 NE2 HIS A 66 18.269 -5.267 14.583 1.00 63.45 N ATOM 0 H HIS A 66 12.893 -3.350 16.794 1.00 45.24 H new ATOM 0 HA HIS A 66 15.549 -2.391 16.583 1.00 74.53 H new ATOM 0 HB2 HIS A 66 14.625 -4.806 16.698 1.00 71.23 H new ATOM 0 HB3 HIS A 66 14.295 -4.644 14.985 1.00 71.23 H new ATOM 0 HD2 HIS A 66 16.475 -5.042 13.341 1.00 63.12 H new ATOM 0 HE1 HIS A 66 19.421 -5.253 16.386 1.00 1.23 H new ATOM 0 HE2 HIS A 66 18.973 -5.541 13.897 1.00 63.45 H new ATOM 1078 N VAL A 67 13.608 -1.980 13.982 1.00 14.25 N ATOM 1079 CA VAL A 67 13.503 -1.335 12.679 1.00 5.21 C ATOM 1080 C VAL A 67 13.768 0.163 12.784 1.00 25.14 C ATOM 1081 O VAL A 67 14.640 0.700 12.100 1.00 74.21 O ATOM 1082 CB VAL A 67 12.114 -1.556 12.053 1.00 71.34 C ATOM 1083 CG1 VAL A 67 11.990 -0.792 10.743 1.00 24.13 C ATOM 1084 CG2 VAL A 67 11.856 -3.040 11.840 1.00 65.44 C ATOM 0 H VAL A 67 12.724 -2.328 14.352 1.00 14.25 H new ATOM 0 HA VAL A 67 14.258 -1.791 12.039 1.00 5.21 H new ATOM 0 HB VAL A 67 11.360 -1.174 12.741 1.00 71.34 H new ATOM 0 HG11 VAL A 67 11.002 -0.961 10.316 1.00 24.13 H new ATOM 0 HG12 VAL A 67 12.128 0.273 10.929 1.00 24.13 H new ATOM 0 HG13 VAL A 67 12.751 -1.141 10.045 1.00 24.13 H new ATOM 0 HG21 VAL A 67 10.870 -3.178 11.397 1.00 65.44 H new ATOM 0 HG22 VAL A 67 12.614 -3.449 11.172 1.00 65.44 H new ATOM 0 HG23 VAL A 67 11.899 -3.558 12.798 1.00 65.44 H new ATOM 1094 N VAL A 68 13.011 0.833 13.647 1.00 3.12 N ATOM 1095 CA VAL A 68 13.165 2.270 13.844 1.00 30.51 C ATOM 1096 C VAL A 68 14.556 2.607 14.368 1.00 24.40 C ATOM 1097 O VAL A 68 15.116 3.653 14.041 1.00 21.32 O ATOM 1098 CB VAL A 68 12.112 2.817 14.826 1.00 41.32 C ATOM 1099 CG1 VAL A 68 10.708 2.513 14.327 1.00 34.34 C ATOM 1100 CG2 VAL A 68 12.330 2.241 16.216 1.00 20.35 C ATOM 0 H VAL A 68 12.285 0.404 14.221 1.00 3.12 H new ATOM 0 HA VAL A 68 13.023 2.740 12.871 1.00 30.51 H new ATOM 0 HB VAL A 68 12.224 3.900 14.886 1.00 41.32 H new ATOM 0 HG11 VAL A 68 9.977 2.907 15.034 1.00 34.34 H new ATOM 0 HG12 VAL A 68 10.559 2.979 13.353 1.00 34.34 H new ATOM 0 HG13 VAL A 68 10.580 1.434 14.236 1.00 34.34 H new ATOM 0 HG21 VAL A 68 11.577 2.638 16.897 1.00 20.35 H new ATOM 0 HG22 VAL A 68 12.247 1.155 16.177 1.00 20.35 H new ATOM 0 HG23 VAL A 68 13.323 2.516 16.572 1.00 20.35 H new ATOM 1110 N GLN A 69 15.109 1.713 15.182 1.00 33.11 N ATOM 1111 CA GLN A 69 16.436 1.916 15.752 1.00 55.34 C ATOM 1112 C GLN A 69 17.500 1.935 14.659 1.00 13.53 C ATOM 1113 O GLN A 69 18.351 2.823 14.626 1.00 44.11 O ATOM 1114 CB GLN A 69 16.751 0.818 16.768 1.00 21.23 C ATOM 1115 CG GLN A 69 16.409 1.197 18.200 1.00 52.31 C ATOM 1116 CD GLN A 69 16.628 0.057 19.174 1.00 20.13 C ATOM 1117 OE1 GLN A 69 15.762 -0.041 20.176 1.00 54.14 O flip ATOM 1118 NE2 GLN A 69 17.566 -0.728 19.029 1.00 10.12 N flip ATOM 0 H GLN A 69 14.659 0.841 15.461 1.00 33.11 H new ATOM 0 HA GLN A 69 16.443 2.881 16.258 1.00 55.34 H new ATOM 0 HB2 GLN A 69 16.201 -0.083 16.498 1.00 21.23 H new ATOM 0 HB3 GLN A 69 17.812 0.574 16.709 1.00 21.23 H new ATOM 0 HG2 GLN A 69 17.018 2.049 18.501 1.00 52.31 H new ATOM 0 HG3 GLN A 69 15.368 1.516 18.248 1.00 52.31 H new ATOM 0 HE21 GLN A 69 18.208 -0.616 18.244 1.00 10.12 H new ATOM 0 HE22 GLN A 69 17.701 -1.490 19.693 1.00 10.12 H new ATOM 1127 N GLN A 70 17.444 0.951 13.768 1.00 21.45 N ATOM 1128 CA GLN A 70 18.405 0.855 12.676 1.00 75.25 C ATOM 1129 C GLN A 70 18.103 1.887 11.594 1.00 62.00 C ATOM 1130 O GLN A 70 19.007 2.362 10.907 1.00 52.11 O ATOM 1131 CB GLN A 70 18.386 -0.552 12.074 1.00 1.42 C ATOM 1132 CG GLN A 70 19.385 -1.501 12.716 1.00 12.12 C ATOM 1133 CD GLN A 70 20.816 -1.197 12.321 1.00 43.14 C ATOM 1134 OE1 GLN A 70 21.662 -0.920 13.171 1.00 2.14 O ATOM 1135 NE2 GLN A 70 21.096 -1.247 11.023 1.00 32.44 N ATOM 0 H GLN A 70 16.744 0.209 13.781 1.00 21.45 H new ATOM 0 HA GLN A 70 19.397 1.057 13.079 1.00 75.25 H new ATOM 0 HB2 GLN A 70 17.384 -0.969 12.176 1.00 1.42 H new ATOM 0 HB3 GLN A 70 18.596 -0.484 11.006 1.00 1.42 H new ATOM 0 HG2 GLN A 70 19.291 -1.442 13.800 1.00 12.12 H new ATOM 0 HG3 GLN A 70 19.143 -2.525 12.430 1.00 12.12 H new ATOM 0 HE21 GLN A 70 20.364 -1.481 10.352 1.00 32.44 H new ATOM 0 HE22 GLN A 70 22.043 -1.052 10.698 1.00 32.44 H new ATOM 1144 N ALA A 71 16.827 2.229 11.448 1.00 3.15 N ATOM 1145 CA ALA A 71 16.407 3.206 10.452 1.00 43.23 C ATOM 1146 C ALA A 71 17.241 4.480 10.546 1.00 35.22 C ATOM 1147 O ALA A 71 17.669 5.031 9.532 1.00 63.40 O ATOM 1148 CB ALA A 71 14.929 3.527 10.617 1.00 61.30 C ATOM 0 H ALA A 71 16.066 1.843 12.007 1.00 3.15 H new ATOM 0 HA ALA A 71 16.565 2.772 9.465 1.00 43.23 H new ATOM 0 HB1 ALA A 71 14.629 4.258 9.866 1.00 61.30 H new ATOM 0 HB2 ALA A 71 14.343 2.617 10.491 1.00 61.30 H new ATOM 0 HB3 ALA A 71 14.754 3.936 11.612 1.00 61.30 H new ATOM 1154 N LYS A 72 17.466 4.944 11.771 1.00 42.15 N ATOM 1155 CA LYS A 72 18.249 6.153 11.999 1.00 52.03 C ATOM 1156 C LYS A 72 19.620 6.046 11.339 1.00 53.44 C ATOM 1157 O LYS A 72 20.107 7.004 10.740 1.00 3.30 O ATOM 1158 CB LYS A 72 18.412 6.404 13.500 1.00 53.15 C ATOM 1159 CG LYS A 72 17.325 7.286 14.090 1.00 21.33 C ATOM 1160 CD LYS A 72 17.749 7.874 15.426 1.00 73.41 C ATOM 1161 CE LYS A 72 18.738 9.014 15.244 1.00 40.40 C ATOM 1162 NZ LYS A 72 18.116 10.185 14.566 1.00 12.44 N ATOM 0 H LYS A 72 17.117 4.501 12.621 1.00 42.15 H new ATOM 0 HA LYS A 72 17.715 6.992 11.552 1.00 52.03 H new ATOM 0 HB2 LYS A 72 18.415 5.447 14.022 1.00 53.15 H new ATOM 0 HB3 LYS A 72 19.382 6.868 13.679 1.00 53.15 H new ATOM 0 HG2 LYS A 72 17.091 8.092 13.394 1.00 21.33 H new ATOM 0 HG3 LYS A 72 16.413 6.703 14.221 1.00 21.33 H new ATOM 0 HD2 LYS A 72 16.871 8.235 15.961 1.00 73.41 H new ATOM 0 HD3 LYS A 72 18.199 7.095 16.041 1.00 73.41 H new ATOM 0 HE2 LYS A 72 19.123 9.320 16.217 1.00 40.40 H new ATOM 0 HE3 LYS A 72 19.590 8.666 14.659 1.00 40.40 H new ATOM 0 HZ1 LYS A 72 18.672 11.040 14.769 1.00 12.44 H new ATOM 0 HZ2 LYS A 72 18.096 10.021 13.539 1.00 12.44 H new ATOM 0 HZ3 LYS A 72 17.145 10.313 14.915 1.00 12.44 H new ATOM 1176 N GLY A 73 20.236 4.874 11.451 1.00 63.31 N ATOM 1177 CA GLY A 73 21.544 4.664 10.859 1.00 64.33 C ATOM 1178 C GLY A 73 21.464 4.306 9.388 1.00 44.22 C ATOM 1179 O GLY A 73 22.485 4.059 8.747 1.00 45.11 O ATOM 0 H GLY A 73 19.853 4.066 11.941 1.00 63.31 H new ATOM 0 HA2 GLY A 73 22.142 5.567 10.978 1.00 64.33 H new ATOM 0 HA3 GLY A 73 22.059 3.867 11.396 1.00 64.33 H new ATOM 1183 N GLN A 74 20.248 4.277 8.853 1.00 61.01 N ATOM 1184 CA GLN A 74 20.040 3.944 7.449 1.00 55.34 C ATOM 1185 C GLN A 74 19.434 5.123 6.694 1.00 42.30 C ATOM 1186 O GLN A 74 18.882 4.960 5.606 1.00 42.45 O ATOM 1187 CB GLN A 74 19.130 2.721 7.322 1.00 13.21 C ATOM 1188 CG GLN A 74 19.710 1.619 6.450 1.00 14.22 C ATOM 1189 CD GLN A 74 21.120 1.238 6.853 1.00 65.11 C ATOM 1190 OE1 GLN A 74 22.045 1.288 6.041 1.00 20.51 O ATOM 1191 NE2 GLN A 74 21.294 0.854 8.112 1.00 13.33 N ATOM 0 H GLN A 74 19.392 4.480 9.370 1.00 61.01 H new ATOM 0 HA GLN A 74 21.010 3.714 7.009 1.00 55.34 H new ATOM 0 HB2 GLN A 74 18.933 2.320 8.316 1.00 13.21 H new ATOM 0 HB3 GLN A 74 18.171 3.033 6.908 1.00 13.21 H new ATOM 0 HG2 GLN A 74 19.069 0.739 6.509 1.00 14.22 H new ATOM 0 HG3 GLN A 74 19.709 1.945 5.410 1.00 14.22 H new ATOM 0 HE21 GLN A 74 20.500 0.827 8.751 1.00 13.33 H new ATOM 0 HE22 GLN A 74 22.222 0.586 8.440 1.00 13.33 H new ATOM 1200 N LYS A 75 19.541 6.311 7.279 1.00 13.51 N ATOM 1201 CA LYS A 75 19.005 7.519 6.663 1.00 51.34 C ATOM 1202 C LYS A 75 17.504 7.388 6.423 1.00 2.21 C ATOM 1203 O LYS A 75 17.014 7.673 5.330 1.00 33.21 O ATOM 1204 CB LYS A 75 19.721 7.802 5.340 1.00 75.13 C ATOM 1205 CG LYS A 75 21.064 8.489 5.510 1.00 42.42 C ATOM 1206 CD LYS A 75 22.175 7.486 5.772 1.00 72.02 C ATOM 1207 CE LYS A 75 22.647 6.828 4.484 1.00 35.23 C ATOM 1208 NZ LYS A 75 23.544 7.722 3.701 1.00 74.32 N ATOM 0 H LYS A 75 19.995 6.463 8.180 1.00 13.51 H new ATOM 0 HA LYS A 75 19.174 8.351 7.346 1.00 51.34 H new ATOM 0 HB2 LYS A 75 19.868 6.862 4.808 1.00 75.13 H new ATOM 0 HB3 LYS A 75 19.080 8.425 4.716 1.00 75.13 H new ATOM 0 HG2 LYS A 75 21.296 9.064 4.613 1.00 42.42 H new ATOM 0 HG3 LYS A 75 21.009 9.197 6.337 1.00 42.42 H new ATOM 0 HD2 LYS A 75 23.014 7.988 6.254 1.00 72.02 H new ATOM 0 HD3 LYS A 75 21.821 6.722 6.464 1.00 72.02 H new ATOM 0 HE2 LYS A 75 23.173 5.903 4.720 1.00 35.23 H new ATOM 0 HE3 LYS A 75 21.783 6.558 3.877 1.00 35.23 H new ATOM 0 HZ1 LYS A 75 23.884 7.219 2.857 1.00 74.32 H new ATOM 0 HZ2 LYS A 75 23.019 8.572 3.410 1.00 74.32 H new ATOM 0 HZ3 LYS A 75 24.356 8.001 4.289 1.00 74.32 H new ATOM 1222 N ILE A 76 16.781 6.957 7.451 1.00 0.41 N ATOM 1223 CA ILE A 76 15.336 6.792 7.352 1.00 23.30 C ATOM 1224 C ILE A 76 14.615 7.603 8.423 1.00 22.01 C ATOM 1225 O ILE A 76 14.831 7.402 9.619 1.00 43.14 O ATOM 1226 CB ILE A 76 14.929 5.312 7.483 1.00 11.35 C ATOM 1227 CG1 ILE A 76 15.869 4.427 6.663 1.00 50.03 C ATOM 1228 CG2 ILE A 76 13.487 5.118 7.039 1.00 40.44 C ATOM 1229 CD1 ILE A 76 15.891 4.772 5.190 1.00 62.30 C ATOM 0 H ILE A 76 17.172 6.716 8.362 1.00 0.41 H new ATOM 0 HA ILE A 76 15.043 7.155 6.367 1.00 23.30 H new ATOM 0 HB ILE A 76 15.008 5.020 8.530 1.00 11.35 H new ATOM 0 HG12 ILE A 76 16.879 4.514 7.064 1.00 50.03 H new ATOM 0 HG13 ILE A 76 15.569 3.386 6.780 1.00 50.03 H new ATOM 0 HG21 ILE A 76 13.214 4.067 7.137 1.00 40.44 H new ATOM 0 HG22 ILE A 76 12.830 5.724 7.663 1.00 40.44 H new ATOM 0 HG23 ILE A 76 13.382 5.424 5.998 1.00 40.44 H new ATOM 0 HD11 ILE A 76 16.578 4.105 4.670 1.00 62.30 H new ATOM 0 HD12 ILE A 76 14.890 4.657 4.774 1.00 62.30 H new ATOM 0 HD13 ILE A 76 16.221 5.803 5.063 1.00 62.30 H new ATOM 1241 N ILE A 77 13.757 8.518 7.986 1.00 12.43 N ATOM 1242 CA ILE A 77 13.001 9.358 8.908 1.00 64.22 C ATOM 1243 C ILE A 77 11.500 9.151 8.735 1.00 5.13 C ATOM 1244 O ILE A 77 10.703 9.614 9.550 1.00 1.22 O ATOM 1245 CB ILE A 77 13.329 10.849 8.708 1.00 1.42 C ATOM 1246 CG1 ILE A 77 14.844 11.059 8.657 1.00 71.32 C ATOM 1247 CG2 ILE A 77 12.712 11.681 9.822 1.00 15.14 C ATOM 1248 CD1 ILE A 77 15.554 10.650 9.928 1.00 31.33 C ATOM 0 H ILE A 77 13.568 8.697 7.000 1.00 12.43 H new ATOM 0 HA ILE A 77 13.292 9.062 9.916 1.00 64.22 H new ATOM 0 HB ILE A 77 12.904 11.174 7.759 1.00 1.42 H new ATOM 0 HG12 ILE A 77 15.254 10.490 7.822 1.00 71.32 H new ATOM 0 HG13 ILE A 77 15.050 12.111 8.457 1.00 71.32 H new ATOM 0 HG21 ILE A 77 12.953 12.733 9.667 1.00 15.14 H new ATOM 0 HG22 ILE A 77 11.630 11.552 9.816 1.00 15.14 H new ATOM 0 HG23 ILE A 77 13.111 11.356 10.783 1.00 15.14 H new ATOM 0 HD11 ILE A 77 16.624 10.827 9.820 1.00 31.33 H new ATOM 0 HD12 ILE A 77 15.172 11.237 10.763 1.00 31.33 H new ATOM 0 HD13 ILE A 77 15.378 9.591 10.118 1.00 31.33 H new ATOM 1260 N GLN A 78 11.124 8.451 7.670 1.00 53.40 N ATOM 1261 CA GLN A 78 9.718 8.182 7.391 1.00 11.35 C ATOM 1262 C GLN A 78 9.156 7.154 8.368 1.00 5.54 C ATOM 1263 O GLN A 78 8.042 7.304 8.871 1.00 44.03 O ATOM 1264 CB GLN A 78 9.547 7.685 5.955 1.00 31.11 C ATOM 1265 CG GLN A 78 10.283 8.529 4.927 1.00 22.22 C ATOM 1266 CD GLN A 78 9.887 9.991 4.981 1.00 55.04 C ATOM 1267 OE1 GLN A 78 8.722 10.338 4.780 1.00 3.11 O ATOM 1268 NE2 GLN A 78 10.855 10.858 5.252 1.00 21.12 N ATOM 0 H GLN A 78 11.772 8.060 6.987 1.00 53.40 H new ATOM 0 HA GLN A 78 9.165 9.113 7.514 1.00 11.35 H new ATOM 0 HB2 GLN A 78 9.903 6.657 5.891 1.00 31.11 H new ATOM 0 HB3 GLN A 78 8.485 7.671 5.708 1.00 31.11 H new ATOM 0 HG2 GLN A 78 11.357 8.441 5.092 1.00 22.22 H new ATOM 0 HG3 GLN A 78 10.081 8.138 3.930 1.00 22.22 H new ATOM 0 HE21 GLN A 78 11.806 10.527 5.412 1.00 21.12 H new ATOM 0 HE22 GLN A 78 10.647 11.855 5.300 1.00 21.12 H new ATOM 1277 N PHE A 79 9.935 6.110 8.633 1.00 12.42 N ATOM 1278 CA PHE A 79 9.515 5.056 9.549 1.00 14.42 C ATOM 1279 C PHE A 79 9.488 5.565 10.988 1.00 73.23 C ATOM 1280 O PHE A 79 8.637 5.164 11.782 1.00 43.31 O ATOM 1281 CB PHE A 79 10.452 3.852 9.439 1.00 3.34 C ATOM 1282 CG PHE A 79 9.904 2.741 8.591 1.00 72.10 C ATOM 1283 CD1 PHE A 79 8.704 2.129 8.918 1.00 43.32 C ATOM 1284 CD2 PHE A 79 10.588 2.307 7.467 1.00 42.31 C ATOM 1285 CE1 PHE A 79 8.197 1.106 8.139 1.00 54.40 C ATOM 1286 CE2 PHE A 79 10.085 1.285 6.684 1.00 3.31 C ATOM 1287 CZ PHE A 79 8.889 0.683 7.021 1.00 13.32 C ATOM 0 H PHE A 79 10.860 5.972 8.226 1.00 12.42 H new ATOM 0 HA PHE A 79 8.507 4.749 9.272 1.00 14.42 H new ATOM 0 HB2 PHE A 79 11.404 4.180 9.023 1.00 3.34 H new ATOM 0 HB3 PHE A 79 10.656 3.468 10.439 1.00 3.34 H new ATOM 0 HD1 PHE A 79 8.159 2.455 9.791 1.00 43.32 H new ATOM 0 HD2 PHE A 79 11.525 2.773 7.200 1.00 42.31 H new ATOM 0 HE1 PHE A 79 7.261 0.638 8.404 1.00 54.40 H new ATOM 0 HE2 PHE A 79 10.627 0.958 5.809 1.00 3.31 H new ATOM 0 HZ PHE A 79 8.495 -0.117 6.412 1.00 13.32 H new ATOM 1297 N GLN A 80 10.425 6.449 11.314 1.00 20.32 N ATOM 1298 CA GLN A 80 10.510 7.011 12.657 1.00 73.11 C ATOM 1299 C GLN A 80 9.239 7.779 13.007 1.00 63.24 C ATOM 1300 O GLN A 80 8.675 7.605 14.087 1.00 53.12 O ATOM 1301 CB GLN A 80 11.725 7.933 12.771 1.00 71.11 C ATOM 1302 CG GLN A 80 13.005 7.322 12.225 1.00 43.35 C ATOM 1303 CD GLN A 80 14.251 7.983 12.782 1.00 71.24 C ATOM 1304 OE1 GLN A 80 15.134 8.401 12.032 1.00 11.01 O ATOM 1305 NE2 GLN A 80 14.329 8.081 14.104 1.00 74.44 N ATOM 0 H GLN A 80 11.136 6.791 10.667 1.00 20.32 H new ATOM 0 HA GLN A 80 10.621 6.187 13.362 1.00 73.11 H new ATOM 0 HB2 GLN A 80 11.518 8.860 12.237 1.00 71.11 H new ATOM 0 HB3 GLN A 80 11.875 8.195 13.818 1.00 71.11 H new ATOM 0 HG2 GLN A 80 13.025 6.258 12.462 1.00 43.35 H new ATOM 0 HG3 GLN A 80 13.009 7.406 11.138 1.00 43.35 H new ATOM 0 HE21 GLN A 80 13.574 7.721 14.688 1.00 74.44 H new ATOM 0 HE22 GLN A 80 15.144 8.516 14.536 1.00 74.44 H new ATOM 1314 N ASP A 81 8.795 8.628 12.087 1.00 43.13 N ATOM 1315 CA ASP A 81 7.591 9.423 12.297 1.00 33.44 C ATOM 1316 C ASP A 81 6.341 8.556 12.181 1.00 72.05 C ATOM 1317 O ASP A 81 5.350 8.781 12.876 1.00 61.13 O ATOM 1318 CB ASP A 81 7.527 10.570 11.288 1.00 65.33 C ATOM 1319 CG ASP A 81 6.359 11.501 11.542 1.00 75.01 C ATOM 1320 OD1 ASP A 81 5.818 11.482 12.668 1.00 61.22 O ATOM 1321 OD2 ASP A 81 5.985 12.250 10.615 1.00 33.23 O ATOM 0 H ASP A 81 9.251 8.783 11.188 1.00 43.13 H new ATOM 0 HA ASP A 81 7.631 9.839 13.304 1.00 33.44 H new ATOM 0 HB2 ASP A 81 8.456 11.138 11.329 1.00 65.33 H new ATOM 0 HB3 ASP A 81 7.449 10.160 10.281 1.00 65.33 H new ATOM 1326 N SER A 82 6.394 7.565 11.296 1.00 43.31 N ATOM 1327 CA SER A 82 5.265 6.668 11.084 1.00 33.21 C ATOM 1328 C SER A 82 5.023 5.799 12.315 1.00 61.13 C ATOM 1329 O SER A 82 3.890 5.653 12.773 1.00 11.34 O ATOM 1330 CB SER A 82 5.512 5.782 9.861 1.00 10.42 C ATOM 1331 OG SER A 82 6.407 4.727 10.168 1.00 13.21 O ATOM 0 H SER A 82 7.207 7.364 10.714 1.00 43.31 H new ATOM 0 HA SER A 82 4.378 7.276 10.910 1.00 33.21 H new ATOM 0 HB2 SER A 82 4.566 5.370 9.510 1.00 10.42 H new ATOM 0 HB3 SER A 82 5.919 6.384 9.048 1.00 10.42 H new ATOM 0 HG SER A 82 7.126 5.065 10.742 1.00 13.21 H new ATOM 1337 N PHE A 83 6.097 5.223 12.845 1.00 42.12 N ATOM 1338 CA PHE A 83 6.003 4.367 14.022 1.00 45.33 C ATOM 1339 C PHE A 83 5.873 5.202 15.292 1.00 4.23 C ATOM 1340 O PHE A 83 5.388 4.723 16.316 1.00 30.01 O ATOM 1341 CB PHE A 83 7.232 3.460 14.118 1.00 73.13 C ATOM 1342 CG PHE A 83 7.103 2.191 13.324 1.00 43.31 C ATOM 1343 CD1 PHE A 83 5.992 1.376 13.470 1.00 4.31 C ATOM 1344 CD2 PHE A 83 8.094 1.814 12.432 1.00 70.52 C ATOM 1345 CE1 PHE A 83 5.871 0.208 12.741 1.00 51.42 C ATOM 1346 CE2 PHE A 83 7.978 0.647 11.700 1.00 52.25 C ATOM 1347 CZ PHE A 83 6.866 -0.157 11.855 1.00 34.01 C ATOM 0 H PHE A 83 7.042 5.333 12.478 1.00 42.12 H new ATOM 0 HA PHE A 83 5.111 3.749 13.921 1.00 45.33 H new ATOM 0 HB2 PHE A 83 8.107 4.009 13.771 1.00 73.13 H new ATOM 0 HB3 PHE A 83 7.408 3.209 15.164 1.00 73.13 H new ATOM 0 HD1 PHE A 83 5.211 1.657 14.162 1.00 4.31 H new ATOM 0 HD2 PHE A 83 8.966 2.438 12.307 1.00 70.52 H new ATOM 0 HE1 PHE A 83 5.000 -0.418 12.864 1.00 51.42 H new ATOM 0 HE2 PHE A 83 8.757 0.364 11.007 1.00 52.25 H new ATOM 0 HZ PHE A 83 6.774 -1.069 11.285 1.00 34.01 H new ATOM 1357 N GLY A 84 6.312 6.455 15.218 1.00 40.24 N ATOM 1358 CA GLY A 84 6.237 7.337 16.368 1.00 50.24 C ATOM 1359 C GLY A 84 4.840 7.881 16.591 1.00 33.33 C ATOM 1360 O GLY A 84 4.456 8.181 17.722 1.00 55.33 O ATOM 0 H GLY A 84 6.718 6.875 14.382 1.00 40.24 H new ATOM 0 HA2 GLY A 84 6.560 6.797 17.258 1.00 50.24 H new ATOM 0 HA3 GLY A 84 6.929 8.168 16.231 1.00 50.24 H new ATOM 1364 N LYS A 85 4.077 8.009 15.511 1.00 13.21 N ATOM 1365 CA LYS A 85 2.714 8.521 15.593 1.00 73.30 C ATOM 1366 C LYS A 85 1.756 7.440 16.084 1.00 54.11 C ATOM 1367 O LYS A 85 0.608 7.724 16.429 1.00 64.31 O ATOM 1368 CB LYS A 85 2.258 9.038 14.227 1.00 45.53 C ATOM 1369 CG LYS A 85 2.184 7.959 13.161 1.00 34.32 C ATOM 1370 CD LYS A 85 1.140 8.287 12.107 1.00 34.00 C ATOM 1371 CE LYS A 85 -0.266 7.981 12.601 1.00 52.24 C ATOM 1372 NZ LYS A 85 -1.305 8.624 11.749 1.00 71.52 N ATOM 0 H LYS A 85 4.379 7.765 14.568 1.00 13.21 H new ATOM 0 HA LYS A 85 2.704 9.344 16.308 1.00 73.30 H new ATOM 0 HB2 LYS A 85 1.277 9.501 14.332 1.00 45.53 H new ATOM 0 HB3 LYS A 85 2.944 9.818 13.896 1.00 45.53 H new ATOM 0 HG2 LYS A 85 3.159 7.848 12.686 1.00 34.32 H new ATOM 0 HG3 LYS A 85 1.945 7.003 13.626 1.00 34.32 H new ATOM 0 HD2 LYS A 85 1.211 9.341 11.839 1.00 34.00 H new ATOM 0 HD3 LYS A 85 1.342 7.713 11.202 1.00 34.00 H new ATOM 0 HE2 LYS A 85 -0.421 6.902 12.611 1.00 52.24 H new ATOM 0 HE3 LYS A 85 -0.373 8.328 13.629 1.00 52.24 H new ATOM 0 HZ1 LYS A 85 -2.249 8.392 12.118 1.00 71.52 H new ATOM 0 HZ2 LYS A 85 -1.173 9.656 11.760 1.00 71.52 H new ATOM 0 HZ3 LYS A 85 -1.219 8.274 10.773 1.00 71.52 H new ATOM 1386 N VAL A 86 2.234 6.200 16.114 1.00 3.31 N ATOM 1387 CA VAL A 86 1.421 5.078 16.566 1.00 71.45 C ATOM 1388 C VAL A 86 2.059 4.384 17.764 1.00 72.43 C ATOM 1389 O VAL A 86 1.453 3.508 18.382 1.00 45.34 O ATOM 1390 CB VAL A 86 1.213 4.047 15.440 1.00 71.00 C ATOM 1391 CG1 VAL A 86 0.321 4.620 14.349 1.00 31.02 C ATOM 1392 CG2 VAL A 86 2.552 3.605 14.868 1.00 14.53 C ATOM 0 H VAL A 86 3.181 5.947 15.830 1.00 3.31 H new ATOM 0 HA VAL A 86 0.454 5.486 16.859 1.00 71.45 H new ATOM 0 HB VAL A 86 0.717 3.172 15.860 1.00 71.00 H new ATOM 0 HG11 VAL A 86 0.186 3.878 13.563 1.00 31.02 H new ATOM 0 HG12 VAL A 86 -0.649 4.882 14.772 1.00 31.02 H new ATOM 0 HG13 VAL A 86 0.786 5.512 13.930 1.00 31.02 H new ATOM 0 HG21 VAL A 86 2.386 2.877 14.074 1.00 14.53 H new ATOM 0 HG22 VAL A 86 3.078 4.470 14.463 1.00 14.53 H new ATOM 0 HG23 VAL A 86 3.153 3.151 15.656 1.00 14.53 H new ATOM 1402 N ALA A 87 3.285 4.781 18.087 1.00 62.12 N ATOM 1403 CA ALA A 87 4.005 4.199 19.213 1.00 72.01 C ATOM 1404 C ALA A 87 3.345 4.570 20.537 1.00 60.22 C ATOM 1405 O ALA A 87 2.998 3.699 21.333 1.00 32.45 O ATOM 1406 CB ALA A 87 5.458 4.650 19.201 1.00 51.04 C ATOM 0 H ALA A 87 3.801 5.504 17.585 1.00 62.12 H new ATOM 0 HA ALA A 87 3.972 3.114 19.112 1.00 72.01 H new ATOM 0 HB1 ALA A 87 5.983 4.208 20.047 1.00 51.04 H new ATOM 0 HB2 ALA A 87 5.931 4.329 18.273 1.00 51.04 H new ATOM 0 HB3 ALA A 87 5.502 5.737 19.274 1.00 51.04 H new ATOM 1412 N ALA A 88 3.176 5.868 20.765 1.00 11.11 N ATOM 1413 CA ALA A 88 2.557 6.354 21.992 1.00 74.40 C ATOM 1414 C ALA A 88 1.166 5.756 22.179 1.00 50.34 C ATOM 1415 O ALA A 88 0.710 5.563 23.305 1.00 23.21 O ATOM 1416 CB ALA A 88 2.483 7.873 21.981 1.00 42.35 C ATOM 0 H ALA A 88 3.459 6.602 20.116 1.00 11.11 H new ATOM 0 HA ALA A 88 3.176 6.038 22.832 1.00 74.40 H new ATOM 0 HB1 ALA A 88 2.018 8.221 22.903 1.00 42.35 H new ATOM 0 HB2 ALA A 88 3.489 8.286 21.903 1.00 42.35 H new ATOM 0 HB3 ALA A 88 1.889 8.202 21.129 1.00 42.35 H new ATOM 1422 N GLU A 89 0.497 5.467 21.067 1.00 51.32 N ATOM 1423 CA GLU A 89 -0.843 4.893 21.110 1.00 41.32 C ATOM 1424 C GLU A 89 -0.784 3.395 21.390 1.00 30.55 C ATOM 1425 O GLU A 89 -1.330 2.916 22.385 1.00 61.24 O ATOM 1426 CB GLU A 89 -1.573 5.148 19.790 1.00 73.25 C ATOM 1427 CG GLU A 89 -3.087 5.098 19.912 1.00 60.20 C ATOM 1428 CD GLU A 89 -3.629 6.139 20.872 1.00 54.04 C ATOM 1429 OE1 GLU A 89 -3.887 7.277 20.427 1.00 12.42 O ATOM 1430 OE2 GLU A 89 -3.796 5.816 22.066 1.00 3.23 O ATOM 0 H GLU A 89 0.861 5.621 20.126 1.00 51.32 H new ATOM 0 HA GLU A 89 -1.392 5.375 21.919 1.00 41.32 H new ATOM 0 HB2 GLU A 89 -1.280 6.125 19.405 1.00 73.25 H new ATOM 0 HB3 GLU A 89 -1.251 4.408 19.058 1.00 73.25 H new ATOM 0 HG2 GLU A 89 -3.532 5.249 18.929 1.00 60.20 H new ATOM 0 HG3 GLU A 89 -3.388 4.106 20.249 1.00 60.20 H new ATOM 1437 N VAL A 90 -0.118 2.659 20.506 1.00 22.44 N ATOM 1438 CA VAL A 90 0.014 1.214 20.658 1.00 14.41 C ATOM 1439 C VAL A 90 0.635 0.857 22.004 1.00 54.51 C ATOM 1440 O VAL A 90 0.074 0.073 22.770 1.00 21.41 O ATOM 1441 CB VAL A 90 0.872 0.608 19.532 1.00 34.41 C ATOM 1442 CG1 VAL A 90 1.053 -0.888 19.745 1.00 13.43 C ATOM 1443 CG2 VAL A 90 0.245 0.889 18.175 1.00 71.22 C ATOM 0 H VAL A 90 0.339 3.039 19.677 1.00 22.44 H new ATOM 0 HA VAL A 90 -0.991 0.797 20.603 1.00 14.41 H new ATOM 0 HB VAL A 90 1.856 1.076 19.556 1.00 34.41 H new ATOM 0 HG11 VAL A 90 1.662 -1.299 18.940 1.00 13.43 H new ATOM 0 HG12 VAL A 90 1.549 -1.062 20.700 1.00 13.43 H new ATOM 0 HG13 VAL A 90 0.078 -1.376 19.748 1.00 13.43 H new ATOM 0 HG21 VAL A 90 0.864 0.454 17.391 1.00 71.22 H new ATOM 0 HG22 VAL A 90 -0.752 0.449 18.137 1.00 71.22 H new ATOM 0 HG23 VAL A 90 0.172 1.966 18.024 1.00 71.22 H new ATOM 1453 N LEU A 91 1.795 1.439 22.286 1.00 21.24 N ATOM 1454 CA LEU A 91 2.494 1.183 23.541 1.00 34.03 C ATOM 1455 C LEU A 91 1.561 1.377 24.733 1.00 61.52 C ATOM 1456 O LEU A 91 1.657 0.664 25.731 1.00 33.01 O ATOM 1457 CB LEU A 91 3.705 2.108 23.671 1.00 12.25 C ATOM 1458 CG LEU A 91 4.852 1.854 22.693 1.00 30.31 C ATOM 1459 CD1 LEU A 91 5.620 3.139 22.425 1.00 20.32 C ATOM 1460 CD2 LEU A 91 5.782 0.776 23.231 1.00 45.33 C ATOM 0 H LEU A 91 2.272 2.091 21.663 1.00 21.24 H new ATOM 0 HA LEU A 91 2.835 0.148 23.534 1.00 34.03 H new ATOM 0 HB2 LEU A 91 3.367 3.136 23.544 1.00 12.25 H new ATOM 0 HB3 LEU A 91 4.094 2.024 24.686 1.00 12.25 H new ATOM 0 HG LEU A 91 4.430 1.505 21.751 1.00 30.31 H new ATOM 0 HD11 LEU A 91 6.433 2.938 21.727 1.00 20.32 H new ATOM 0 HD12 LEU A 91 4.948 3.882 21.996 1.00 20.32 H new ATOM 0 HD13 LEU A 91 6.031 3.519 23.360 1.00 20.32 H new ATOM 0 HD21 LEU A 91 6.593 0.608 22.522 1.00 45.33 H new ATOM 0 HD22 LEU A 91 6.196 1.097 24.187 1.00 45.33 H new ATOM 0 HD23 LEU A 91 5.224 -0.150 23.370 1.00 45.33 H new ATOM 1472 N GLY A 92 0.657 2.345 24.619 1.00 2.14 N ATOM 1473 CA GLY A 92 -0.281 2.614 25.693 1.00 31.54 C ATOM 1474 C GLY A 92 -1.414 1.608 25.738 1.00 34.21 C ATOM 1475 O GLY A 92 -1.961 1.325 26.804 1.00 1.55 O ATOM 0 H GLY A 92 0.558 2.948 23.802 1.00 2.14 H new ATOM 0 HA2 GLY A 92 0.249 2.603 26.645 1.00 31.54 H new ATOM 0 HA3 GLY A 92 -0.693 3.616 25.569 1.00 31.54 H new ATOM 1479 N ARG A 93 -1.770 1.067 24.577 1.00 25.12 N ATOM 1480 CA ARG A 93 -2.847 0.089 24.488 1.00 53.21 C ATOM 1481 C ARG A 93 -2.358 -1.298 24.896 1.00 54.45 C ATOM 1482 O ARG A 93 -3.109 -2.087 25.471 1.00 42.44 O ATOM 1483 CB ARG A 93 -3.409 0.046 23.066 1.00 62.05 C ATOM 1484 CG ARG A 93 -4.581 0.988 22.845 1.00 61.04 C ATOM 1485 CD ARG A 93 -5.804 0.550 23.635 1.00 52.13 C ATOM 1486 NE ARG A 93 -6.988 1.332 23.288 1.00 32.43 N ATOM 1487 CZ ARG A 93 -8.169 1.176 23.875 1.00 35.45 C ATOM 1488 NH1 ARG A 93 -8.323 0.272 24.833 1.00 32.33 N ATOM 1489 NH2 ARG A 93 -9.200 1.925 23.505 1.00 30.02 N ATOM 0 H ARG A 93 -1.328 1.290 23.685 1.00 25.12 H new ATOM 0 HA ARG A 93 -3.637 0.393 25.175 1.00 53.21 H new ATOM 0 HB2 ARG A 93 -2.615 0.297 22.363 1.00 62.05 H new ATOM 0 HB3 ARG A 93 -3.725 -0.972 22.840 1.00 62.05 H new ATOM 0 HG2 ARG A 93 -4.298 1.998 23.141 1.00 61.04 H new ATOM 0 HG3 ARG A 93 -4.826 1.023 21.783 1.00 61.04 H new ATOM 0 HD2 ARG A 93 -5.999 -0.506 23.446 1.00 52.13 H new ATOM 0 HD3 ARG A 93 -5.602 0.651 24.701 1.00 52.13 H new ATOM 0 HE ARG A 93 -6.903 2.036 22.555 1.00 32.43 H new ATOM 0 HH11 ARG A 93 -7.533 -0.306 25.121 1.00 32.33 H new ATOM 0 HH12 ARG A 93 -9.231 0.154 25.282 1.00 32.33 H new ATOM 0 HH21 ARG A 93 -9.086 2.622 22.769 1.00 30.02 H new ATOM 0 HH22 ARG A 93 -10.106 1.804 23.957 1.00 30.02 H new ATOM 1503 N ILE A 94 -1.097 -1.587 24.593 1.00 33.14 N ATOM 1504 CA ILE A 94 -0.509 -2.878 24.929 1.00 41.21 C ATOM 1505 C ILE A 94 -0.015 -2.899 26.371 1.00 12.45 C ATOM 1506 O ILE A 94 -0.019 -3.941 27.025 1.00 73.15 O ATOM 1507 CB ILE A 94 0.664 -3.223 23.992 1.00 53.42 C ATOM 1508 CG1 ILE A 94 1.824 -2.249 24.211 1.00 34.33 C ATOM 1509 CG2 ILE A 94 0.208 -3.194 22.541 1.00 41.45 C ATOM 1510 CD1 ILE A 94 3.019 -2.525 23.327 1.00 64.01 C ATOM 0 H ILE A 94 -0.463 -0.946 24.116 1.00 33.14 H new ATOM 0 HA ILE A 94 -1.294 -3.624 24.806 1.00 41.21 H new ATOM 0 HB ILE A 94 1.011 -4.230 24.224 1.00 53.42 H new ATOM 0 HG12 ILE A 94 1.474 -1.233 24.028 1.00 34.33 H new ATOM 0 HG13 ILE A 94 2.135 -2.296 25.254 1.00 34.33 H new ATOM 0 HG21 ILE A 94 1.048 -3.440 21.891 1.00 41.45 H new ATOM 0 HG22 ILE A 94 -0.589 -3.923 22.395 1.00 41.45 H new ATOM 0 HG23 ILE A 94 -0.162 -2.198 22.296 1.00 41.45 H new ATOM 0 HD11 ILE A 94 3.802 -1.797 23.536 1.00 64.01 H new ATOM 0 HD12 ILE A 94 3.394 -3.529 23.526 1.00 64.01 H new ATOM 0 HD13 ILE A 94 2.723 -2.449 22.281 1.00 64.01 H new ATOM 1522 N ASN A 95 0.408 -1.739 26.863 1.00 1.40 N ATOM 1523 CA ASN A 95 0.904 -1.623 28.230 1.00 50.13 C ATOM 1524 C ASN A 95 -0.202 -1.923 29.237 1.00 50.11 C ATOM 1525 O ASN A 95 0.058 -2.442 30.322 1.00 60.12 O ATOM 1526 CB ASN A 95 1.465 -0.221 28.474 1.00 51.51 C ATOM 1527 CG ASN A 95 1.808 0.019 29.932 1.00 52.35 C ATOM 1528 OD1 ASN A 95 2.956 -0.144 30.346 1.00 55.13 O ATOM 1529 ND2 ASN A 95 0.811 0.409 30.717 1.00 34.43 N ATOM 0 H ASN A 95 0.417 -0.866 26.336 1.00 1.40 H new ATOM 0 HA ASN A 95 1.701 -2.354 28.364 1.00 50.13 H new ATOM 0 HB2 ASN A 95 2.358 -0.079 27.865 1.00 51.51 H new ATOM 0 HB3 ASN A 95 0.736 0.521 28.148 1.00 51.51 H new ATOM 0 HD21 ASN A 95 0.981 0.587 31.707 1.00 34.43 H new ATOM 0 HD22 ASN A 95 -0.125 0.531 30.330 1.00 34.43 H new ATOM 1536 N GLN A 96 -1.436 -1.593 28.869 1.00 43.44 N ATOM 1537 CA GLN A 96 -2.581 -1.827 29.740 1.00 0.32 C ATOM 1538 C GLN A 96 -3.098 -3.253 29.588 1.00 74.33 C ATOM 1539 O GLN A 96 -3.525 -3.875 30.560 1.00 62.51 O ATOM 1540 CB GLN A 96 -3.699 -0.830 29.428 1.00 65.13 C ATOM 1541 CG GLN A 96 -4.130 -0.837 27.970 1.00 43.20 C ATOM 1542 CD GLN A 96 -5.301 0.088 27.703 1.00 3.34 C ATOM 1543 OE1 GLN A 96 -5.148 1.310 27.676 1.00 61.23 O ATOM 1544 NE2 GLN A 96 -6.479 -0.490 27.505 1.00 34.23 N ATOM 0 H GLN A 96 -1.668 -1.163 27.974 1.00 43.44 H new ATOM 0 HA GLN A 96 -2.256 -1.686 30.771 1.00 0.32 H new ATOM 0 HB2 GLN A 96 -4.562 -1.056 30.055 1.00 65.13 H new ATOM 0 HB3 GLN A 96 -3.365 0.173 29.695 1.00 65.13 H new ATOM 0 HG2 GLN A 96 -3.288 -0.540 27.345 1.00 43.20 H new ATOM 0 HG3 GLN A 96 -4.400 -1.852 27.680 1.00 43.20 H new ATOM 0 HE21 GLN A 96 -6.560 -1.506 27.536 1.00 34.23 H new ATOM 0 HE22 GLN A 96 -7.303 0.082 27.322 1.00 34.23 H new ATOM 1553 N GLU A 97 -3.058 -3.764 28.361 1.00 23.52 N ATOM 1554 CA GLU A 97 -3.524 -5.118 28.083 1.00 51.35 C ATOM 1555 C GLU A 97 -2.487 -6.150 28.514 1.00 22.32 C ATOM 1556 O GLU A 97 -2.799 -7.330 28.677 1.00 72.13 O ATOM 1557 CB GLU A 97 -3.830 -5.279 26.592 1.00 14.41 C ATOM 1558 CG GLU A 97 -5.019 -4.457 26.123 1.00 52.22 C ATOM 1559 CD GLU A 97 -6.342 -5.164 26.345 1.00 22.52 C ATOM 1560 OE1 GLU A 97 -6.907 -5.031 27.451 1.00 25.22 O ATOM 1561 OE2 GLU A 97 -6.812 -5.851 25.414 1.00 22.23 O ATOM 0 H GLU A 97 -2.708 -3.262 27.545 1.00 23.52 H new ATOM 0 HA GLU A 97 -4.437 -5.285 28.655 1.00 51.35 H new ATOM 0 HB2 GLU A 97 -2.950 -4.992 26.016 1.00 14.41 H new ATOM 0 HB3 GLU A 97 -4.020 -6.331 26.380 1.00 14.41 H new ATOM 0 HG2 GLU A 97 -5.028 -3.504 26.651 1.00 52.22 H new ATOM 0 HG3 GLU A 97 -4.905 -4.233 25.062 1.00 52.22 H new ATOM 1568 N PHE A 98 -1.251 -5.698 28.698 1.00 41.24 N ATOM 1569 CA PHE A 98 -0.166 -6.582 29.109 1.00 52.43 C ATOM 1570 C PHE A 98 -0.186 -6.801 30.619 1.00 41.24 C ATOM 1571 O PHE A 98 -0.528 -5.910 31.396 1.00 14.13 O ATOM 1572 CB PHE A 98 1.183 -5.999 28.684 1.00 24.11 C ATOM 1573 CG PHE A 98 1.585 -6.375 27.286 1.00 4.45 C ATOM 1574 CD1 PHE A 98 0.626 -6.670 26.331 1.00 0.52 C ATOM 1575 CD2 PHE A 98 2.922 -6.432 26.928 1.00 64.12 C ATOM 1576 CE1 PHE A 98 0.993 -7.016 25.045 1.00 64.13 C ATOM 1577 CE2 PHE A 98 3.296 -6.778 25.643 1.00 52.34 C ATOM 1578 CZ PHE A 98 2.330 -7.069 24.700 1.00 72.14 C ATOM 0 H PHE A 98 -0.976 -4.724 28.569 1.00 41.24 H new ATOM 0 HA PHE A 98 -0.308 -7.545 28.618 1.00 52.43 H new ATOM 0 HB2 PHE A 98 1.141 -4.913 28.762 1.00 24.11 H new ATOM 0 HB3 PHE A 98 1.952 -6.339 29.378 1.00 24.11 H new ATOM 0 HD1 PHE A 98 -0.420 -6.629 26.595 1.00 0.52 H new ATOM 0 HD2 PHE A 98 3.681 -6.203 27.661 1.00 64.12 H new ATOM 0 HE1 PHE A 98 0.236 -7.245 24.310 1.00 64.13 H new ATOM 0 HE2 PHE A 98 4.342 -6.821 25.377 1.00 52.34 H new ATOM 0 HZ PHE A 98 2.619 -7.338 23.695 1.00 72.14 H new ATOM 1588 N PRO A 99 0.190 -8.016 31.045 1.00 53.15 N ATOM 1589 CA PRO A 99 0.224 -8.382 32.464 1.00 51.24 C ATOM 1590 C PRO A 99 1.337 -7.665 33.220 1.00 12.24 C ATOM 1591 O PRO A 99 2.178 -6.996 32.620 1.00 53.24 O ATOM 1592 CB PRO A 99 0.483 -9.890 32.435 1.00 74.21 C ATOM 1593 CG PRO A 99 1.176 -10.131 31.139 1.00 60.04 C ATOM 1594 CD PRO A 99 0.610 -9.126 30.173 1.00 25.25 C ATOM 0 HA PRO A 99 -0.695 -8.104 32.979 1.00 51.24 H new ATOM 0 HB2 PRO A 99 1.100 -10.202 33.278 1.00 74.21 H new ATOM 0 HB3 PRO A 99 -0.448 -10.453 32.496 1.00 74.21 H new ATOM 0 HG2 PRO A 99 2.254 -10.007 31.244 1.00 60.04 H new ATOM 0 HG3 PRO A 99 1.005 -11.149 30.788 1.00 60.04 H new ATOM 0 HD2 PRO A 99 1.354 -8.805 29.444 1.00 25.25 H new ATOM 0 HD3 PRO A 99 -0.230 -9.536 29.612 1.00 25.25 H new ATOM 1602 N ARG A 100 1.336 -7.809 34.542 1.00 70.35 N ATOM 1603 CA ARG A 100 2.346 -7.174 35.380 1.00 34.52 C ATOM 1604 C ARG A 100 3.737 -7.709 35.054 1.00 2.33 C ATOM 1605 O ARG A 100 4.744 -7.053 35.325 1.00 73.33 O ATOM 1606 CB ARG A 100 2.031 -7.408 36.859 1.00 63.20 C ATOM 1607 CG ARG A 100 1.122 -6.350 37.463 1.00 23.30 C ATOM 1608 CD ARG A 100 1.230 -6.324 38.980 1.00 51.54 C ATOM 1609 NE ARG A 100 0.168 -5.527 39.590 1.00 64.33 N ATOM 1610 CZ ARG A 100 0.164 -4.199 39.609 1.00 64.14 C ATOM 1611 NH1 ARG A 100 1.160 -3.522 39.054 1.00 41.13 N ATOM 1612 NH2 ARG A 100 -0.837 -3.546 40.183 1.00 54.50 N ATOM 0 H ARG A 100 0.647 -8.359 35.055 1.00 70.35 H new ATOM 0 HA ARG A 100 2.331 -6.103 35.177 1.00 34.52 H new ATOM 0 HB2 ARG A 100 1.562 -8.385 36.972 1.00 63.20 H new ATOM 0 HB3 ARG A 100 2.965 -7.436 37.421 1.00 63.20 H new ATOM 0 HG2 ARG A 100 1.384 -5.371 37.062 1.00 23.30 H new ATOM 0 HG3 ARG A 100 0.090 -6.547 37.174 1.00 23.30 H new ATOM 0 HD2 ARG A 100 1.185 -7.343 39.364 1.00 51.54 H new ATOM 0 HD3 ARG A 100 2.200 -5.917 39.268 1.00 51.54 H new ATOM 0 HE ARG A 100 -0.613 -6.018 40.025 1.00 64.33 H new ATOM 0 HH11 ARG A 100 1.931 -4.021 38.611 1.00 41.13 H new ATOM 0 HH12 ARG A 100 1.155 -2.502 39.070 1.00 41.13 H new ATOM 0 HH21 ARG A 100 -1.605 -4.064 40.611 1.00 54.50 H new ATOM 0 HH22 ARG A 100 -0.839 -2.526 40.197 1.00 54.50 H new ATOM 1626 N ASP A 101 3.786 -8.902 34.473 1.00 72.12 N ATOM 1627 CA ASP A 101 5.054 -9.525 34.109 1.00 14.44 C ATOM 1628 C ASP A 101 5.646 -8.865 32.868 1.00 64.40 C ATOM 1629 O ASP A 101 6.818 -8.486 32.853 1.00 1.42 O ATOM 1630 CB ASP A 101 4.859 -11.022 33.864 1.00 42.43 C ATOM 1631 CG ASP A 101 4.558 -11.783 35.139 1.00 32.43 C ATOM 1632 OD1 ASP A 101 4.846 -11.250 36.231 1.00 41.33 O ATOM 1633 OD2 ASP A 101 4.034 -12.914 35.046 1.00 4.33 O ATOM 0 H ASP A 101 2.962 -9.458 34.244 1.00 72.12 H new ATOM 0 HA ASP A 101 5.750 -9.389 34.937 1.00 14.44 H new ATOM 0 HB2 ASP A 101 4.043 -11.168 33.156 1.00 42.43 H new ATOM 0 HB3 ASP A 101 5.758 -11.432 33.403 1.00 42.43 H new ATOM 1638 N LEU A 102 4.831 -8.734 31.828 1.00 53.32 N ATOM 1639 CA LEU A 102 5.274 -8.121 30.580 1.00 24.24 C ATOM 1640 C LEU A 102 5.547 -6.633 30.771 1.00 14.42 C ATOM 1641 O LEU A 102 6.370 -6.045 30.068 1.00 34.55 O ATOM 1642 CB LEU A 102 4.223 -8.323 29.488 1.00 71.11 C ATOM 1643 CG LEU A 102 4.026 -9.760 29.003 1.00 11.12 C ATOM 1644 CD1 LEU A 102 3.068 -9.798 27.823 1.00 71.43 C ATOM 1645 CD2 LEU A 102 5.362 -10.384 28.629 1.00 61.43 C ATOM 0 H LEU A 102 3.859 -9.044 31.823 1.00 53.32 H new ATOM 0 HA LEU A 102 6.202 -8.605 30.276 1.00 24.24 H new ATOM 0 HB2 LEU A 102 3.267 -7.952 29.858 1.00 71.11 H new ATOM 0 HB3 LEU A 102 4.495 -7.706 28.632 1.00 71.11 H new ATOM 0 HG LEU A 102 3.591 -10.342 29.816 1.00 11.12 H new ATOM 0 HD11 LEU A 102 2.940 -10.828 27.491 1.00 71.43 H new ATOM 0 HD12 LEU A 102 2.103 -9.391 28.125 1.00 71.43 H new ATOM 0 HD13 LEU A 102 3.474 -9.202 27.006 1.00 71.43 H new ATOM 0 HD21 LEU A 102 5.203 -11.406 28.286 1.00 61.43 H new ATOM 0 HD22 LEU A 102 5.825 -9.802 27.832 1.00 61.43 H new ATOM 0 HD23 LEU A 102 6.017 -10.391 29.500 1.00 61.43 H new ATOM 1657 N LYS A 103 4.851 -6.027 31.728 1.00 23.32 N ATOM 1658 CA LYS A 103 5.019 -4.608 32.015 1.00 4.34 C ATOM 1659 C LYS A 103 6.484 -4.277 32.286 1.00 53.01 C ATOM 1660 O LYS A 103 6.982 -3.232 31.868 1.00 5.30 O ATOM 1661 CB LYS A 103 4.164 -4.205 33.219 1.00 51.03 C ATOM 1662 CG LYS A 103 2.675 -4.164 32.920 1.00 22.53 C ATOM 1663 CD LYS A 103 2.195 -2.745 32.669 1.00 2.25 C ATOM 1664 CE LYS A 103 2.253 -1.905 33.936 1.00 11.13 C ATOM 1665 NZ LYS A 103 2.655 -0.500 33.652 1.00 3.42 N ATOM 0 H LYS A 103 4.165 -6.498 32.318 1.00 23.32 H new ATOM 0 HA LYS A 103 4.693 -4.045 31.140 1.00 4.34 H new ATOM 0 HB2 LYS A 103 4.344 -4.907 34.033 1.00 51.03 H new ATOM 0 HB3 LYS A 103 4.483 -3.223 33.569 1.00 51.03 H new ATOM 0 HG2 LYS A 103 2.461 -4.781 32.047 1.00 22.53 H new ATOM 0 HG3 LYS A 103 2.123 -4.593 33.756 1.00 22.53 H new ATOM 0 HD2 LYS A 103 2.810 -2.283 31.896 1.00 2.25 H new ATOM 0 HD3 LYS A 103 1.172 -2.767 32.292 1.00 2.25 H new ATOM 0 HE2 LYS A 103 1.277 -1.912 34.422 1.00 11.13 H new ATOM 0 HE3 LYS A 103 2.960 -2.351 34.635 1.00 11.13 H new ATOM 0 HZ1 LYS A 103 3.597 -0.320 34.054 1.00 3.42 H new ATOM 0 HZ2 LYS A 103 2.683 -0.348 32.624 1.00 3.42 H new ATOM 0 HZ3 LYS A 103 1.966 0.151 34.080 1.00 3.42 H new ATOM 1679 N LYS A 104 7.169 -5.175 32.986 1.00 13.42 N ATOM 1680 CA LYS A 104 8.577 -4.980 33.310 1.00 31.44 C ATOM 1681 C LYS A 104 9.442 -5.081 32.058 1.00 24.45 C ATOM 1682 O LYS A 104 10.343 -4.269 31.846 1.00 12.12 O ATOM 1683 CB LYS A 104 9.031 -6.015 34.342 1.00 24.13 C ATOM 1684 CG LYS A 104 10.199 -5.551 35.195 1.00 22.04 C ATOM 1685 CD LYS A 104 9.725 -4.916 36.492 1.00 21.51 C ATOM 1686 CE LYS A 104 10.881 -4.307 37.270 1.00 45.24 C ATOM 1687 NZ LYS A 104 11.345 -3.028 36.663 1.00 33.01 N ATOM 0 H LYS A 104 6.772 -6.045 33.340 1.00 13.42 H new ATOM 0 HA LYS A 104 8.693 -3.981 33.730 1.00 31.44 H new ATOM 0 HB2 LYS A 104 8.191 -6.260 34.993 1.00 24.13 H new ATOM 0 HB3 LYS A 104 9.311 -6.933 33.825 1.00 24.13 H new ATOM 0 HG2 LYS A 104 10.846 -6.399 35.419 1.00 22.04 H new ATOM 0 HG3 LYS A 104 10.797 -4.833 34.635 1.00 22.04 H new ATOM 0 HD2 LYS A 104 8.987 -4.145 36.272 1.00 21.51 H new ATOM 0 HD3 LYS A 104 9.228 -5.667 37.106 1.00 21.51 H new ATOM 0 HE2 LYS A 104 10.572 -4.129 38.300 1.00 45.24 H new ATOM 0 HE3 LYS A 104 11.709 -5.015 37.303 1.00 45.24 H new ATOM 0 HZ1 LYS A 104 12.063 -2.593 37.276 1.00 33.01 H new ATOM 0 HZ2 LYS A 104 11.757 -3.217 35.727 1.00 33.01 H new ATOM 0 HZ3 LYS A 104 10.538 -2.379 36.561 1.00 33.01 H new ATOM 1701 N LYS A 105 9.163 -6.083 31.231 1.00 43.20 N ATOM 1702 CA LYS A 105 9.914 -6.289 29.998 1.00 31.11 C ATOM 1703 C LYS A 105 9.706 -5.126 29.034 1.00 42.15 C ATOM 1704 O LYS A 105 10.611 -4.760 28.282 1.00 71.11 O ATOM 1705 CB LYS A 105 9.490 -7.600 29.332 1.00 51.11 C ATOM 1706 CG LYS A 105 10.182 -8.825 29.904 1.00 45.22 C ATOM 1707 CD LYS A 105 10.376 -9.900 28.848 1.00 74.12 C ATOM 1708 CE LYS A 105 10.361 -11.292 29.461 1.00 74.24 C ATOM 1709 NZ LYS A 105 10.708 -12.341 28.462 1.00 32.35 N ATOM 0 H LYS A 105 8.422 -6.765 31.392 1.00 43.20 H new ATOM 0 HA LYS A 105 10.973 -6.343 30.251 1.00 31.11 H new ATOM 0 HB2 LYS A 105 8.412 -7.720 29.438 1.00 51.11 H new ATOM 0 HB3 LYS A 105 9.700 -7.540 28.264 1.00 51.11 H new ATOM 0 HG2 LYS A 105 11.150 -8.538 30.315 1.00 45.22 H new ATOM 0 HG3 LYS A 105 9.592 -9.226 30.728 1.00 45.22 H new ATOM 0 HD2 LYS A 105 9.588 -9.822 28.099 1.00 74.12 H new ATOM 0 HD3 LYS A 105 11.323 -9.738 28.332 1.00 74.12 H new ATOM 0 HE2 LYS A 105 11.068 -11.332 30.290 1.00 74.24 H new ATOM 0 HE3 LYS A 105 9.373 -11.496 29.874 1.00 74.24 H new ATOM 0 HZ1 LYS A 105 10.687 -13.275 28.918 1.00 32.35 H new ATOM 0 HZ2 LYS A 105 10.019 -12.320 27.683 1.00 32.35 H new ATOM 0 HZ3 LYS A 105 11.661 -12.161 28.086 1.00 32.35 H new ATOM 1723 N LEU A 106 8.511 -4.547 29.061 1.00 72.34 N ATOM 1724 CA LEU A 106 8.185 -3.424 28.189 1.00 13.53 C ATOM 1725 C LEU A 106 8.743 -2.120 28.751 1.00 53.45 C ATOM 1726 O LEU A 106 9.274 -1.291 28.011 1.00 12.13 O ATOM 1727 CB LEU A 106 6.669 -3.310 28.016 1.00 62.22 C ATOM 1728 CG LEU A 106 6.144 -1.943 27.575 1.00 64.31 C ATOM 1729 CD1 LEU A 106 6.759 -1.539 26.244 1.00 64.41 C ATOM 1730 CD2 LEU A 106 4.626 -1.960 27.479 1.00 32.55 C ATOM 0 H LEU A 106 7.752 -4.837 29.677 1.00 72.34 H new ATOM 0 HA LEU A 106 8.643 -3.606 27.217 1.00 13.53 H new ATOM 0 HB2 LEU A 106 6.350 -4.052 27.284 1.00 62.22 H new ATOM 0 HB3 LEU A 106 6.195 -3.571 28.962 1.00 62.22 H new ATOM 0 HG LEU A 106 6.433 -1.206 28.324 1.00 64.31 H new ATOM 0 HD11 LEU A 106 6.374 -0.564 25.946 1.00 64.41 H new ATOM 0 HD12 LEU A 106 7.843 -1.485 26.345 1.00 64.41 H new ATOM 0 HD13 LEU A 106 6.502 -2.278 25.485 1.00 64.41 H new ATOM 0 HD21 LEU A 106 4.270 -0.979 27.164 1.00 32.55 H new ATOM 0 HD22 LEU A 106 4.316 -2.709 26.751 1.00 32.55 H new ATOM 0 HD23 LEU A 106 4.203 -2.204 28.453 1.00 32.55 H new ATOM 1742 N SER A 107 8.620 -1.946 30.063 1.00 43.34 N ATOM 1743 CA SER A 107 9.111 -0.742 30.723 1.00 0.22 C ATOM 1744 C SER A 107 10.572 -0.483 30.366 1.00 33.55 C ATOM 1745 O SER A 107 10.987 0.663 30.194 1.00 33.24 O ATOM 1746 CB SER A 107 8.960 -0.869 32.240 1.00 34.22 C ATOM 1747 OG SER A 107 9.412 0.302 32.898 1.00 35.30 O ATOM 0 H SER A 107 8.185 -2.623 30.690 1.00 43.34 H new ATOM 0 HA SER A 107 8.515 0.102 30.375 1.00 0.22 H new ATOM 0 HB2 SER A 107 7.915 -1.050 32.491 1.00 34.22 H new ATOM 0 HB3 SER A 107 9.526 -1.730 32.594 1.00 34.22 H new ATOM 0 HG SER A 107 9.303 0.196 33.866 1.00 35.30 H new ATOM 1753 N ARG A 108 11.346 -1.558 30.257 1.00 5.32 N ATOM 1754 CA ARG A 108 12.761 -1.449 29.922 1.00 2.54 C ATOM 1755 C ARG A 108 12.948 -1.187 28.431 1.00 43.22 C ATOM 1756 O ARG A 108 13.946 -0.600 28.013 1.00 4.31 O ATOM 1757 CB ARG A 108 13.502 -2.725 30.324 1.00 62.21 C ATOM 1758 CG ARG A 108 13.061 -3.955 29.548 1.00 70.33 C ATOM 1759 CD ARG A 108 14.080 -5.079 29.658 1.00 41.44 C ATOM 1760 NE ARG A 108 15.389 -4.682 29.145 1.00 31.31 N ATOM 1761 CZ ARG A 108 16.461 -5.465 29.185 1.00 64.03 C ATOM 1762 NH1 ARG A 108 16.381 -6.680 29.710 1.00 54.22 N ATOM 1763 NH2 ARG A 108 17.618 -5.033 28.698 1.00 72.21 N ATOM 0 H ARG A 108 11.017 -2.514 30.396 1.00 5.32 H new ATOM 0 HA ARG A 108 13.176 -0.607 30.476 1.00 2.54 H new ATOM 0 HB2 ARG A 108 14.572 -2.576 30.175 1.00 62.21 H new ATOM 0 HB3 ARG A 108 13.350 -2.903 31.388 1.00 62.21 H new ATOM 0 HG2 ARG A 108 12.097 -4.298 29.925 1.00 70.33 H new ATOM 0 HG3 ARG A 108 12.918 -3.693 28.500 1.00 70.33 H new ATOM 0 HD2 ARG A 108 14.176 -5.381 30.701 1.00 41.44 H new ATOM 0 HD3 ARG A 108 13.722 -5.948 29.106 1.00 41.44 H new ATOM 0 HE ARG A 108 15.485 -3.753 28.734 1.00 31.31 H new ATOM 0 HH11 ARG A 108 15.494 -7.016 30.085 1.00 54.22 H new ATOM 0 HH12 ARG A 108 17.206 -7.278 29.739 1.00 54.22 H new ATOM 0 HH21 ARG A 108 17.684 -4.099 28.293 1.00 72.21 H new ATOM 0 HH22 ARG A 108 18.441 -5.635 28.729 1.00 72.21 H new ATOM 1777 N VAL A 109 11.981 -1.627 27.632 1.00 22.21 N ATOM 1778 CA VAL A 109 12.039 -1.440 26.187 1.00 34.42 C ATOM 1779 C VAL A 109 11.732 0.004 25.807 1.00 31.22 C ATOM 1780 O VAL A 109 12.467 0.625 25.040 1.00 62.25 O ATOM 1781 CB VAL A 109 11.050 -2.372 25.461 1.00 11.11 C ATOM 1782 CG1 VAL A 109 11.005 -2.050 23.975 1.00 3.43 C ATOM 1783 CG2 VAL A 109 11.426 -3.828 25.688 1.00 31.32 C ATOM 0 H VAL A 109 11.148 -2.115 27.961 1.00 22.21 H new ATOM 0 HA VAL A 109 13.054 -1.686 25.876 1.00 34.42 H new ATOM 0 HB VAL A 109 10.054 -2.209 25.874 1.00 11.11 H new ATOM 0 HG11 VAL A 109 10.301 -2.718 23.479 1.00 3.43 H new ATOM 0 HG12 VAL A 109 10.684 -1.018 23.836 1.00 3.43 H new ATOM 0 HG13 VAL A 109 11.997 -2.183 23.544 1.00 3.43 H new ATOM 0 HG21 VAL A 109 10.717 -4.472 25.168 1.00 31.32 H new ATOM 0 HG22 VAL A 109 12.430 -4.009 25.304 1.00 31.32 H new ATOM 0 HG23 VAL A 109 11.401 -4.048 26.755 1.00 31.32 H new ATOM 1793 N VAL A 110 10.641 0.534 26.350 1.00 35.13 N ATOM 1794 CA VAL A 110 10.236 1.906 26.070 1.00 44.41 C ATOM 1795 C VAL A 110 11.363 2.885 26.381 1.00 41.45 C ATOM 1796 O VAL A 110 11.528 3.895 25.697 1.00 70.32 O ATOM 1797 CB VAL A 110 8.989 2.301 26.883 1.00 42.54 C ATOM 1798 CG1 VAL A 110 9.222 2.066 28.367 1.00 23.12 C ATOM 1799 CG2 VAL A 110 8.618 3.752 26.616 1.00 11.55 C ATOM 0 H VAL A 110 10.021 0.033 26.987 1.00 35.13 H new ATOM 0 HA VAL A 110 9.998 1.955 25.008 1.00 44.41 H new ATOM 0 HB VAL A 110 8.156 1.672 26.567 1.00 42.54 H new ATOM 0 HG11 VAL A 110 8.330 2.351 28.925 1.00 23.12 H new ATOM 0 HG12 VAL A 110 9.436 1.011 28.539 1.00 23.12 H new ATOM 0 HG13 VAL A 110 10.067 2.667 28.702 1.00 23.12 H new ATOM 0 HG21 VAL A 110 7.735 4.015 27.198 1.00 11.55 H new ATOM 0 HG22 VAL A 110 9.447 4.398 26.903 1.00 11.55 H new ATOM 0 HG23 VAL A 110 8.406 3.884 25.555 1.00 11.55 H new ATOM 1809 N ASN A 111 12.137 2.579 27.417 1.00 53.11 N ATOM 1810 CA ASN A 111 13.249 3.432 27.819 1.00 41.41 C ATOM 1811 C ASN A 111 14.315 3.486 26.729 1.00 51.44 C ATOM 1812 O ASN A 111 14.975 4.509 26.542 1.00 21.12 O ATOM 1813 CB ASN A 111 13.864 2.923 29.124 1.00 10.10 C ATOM 1814 CG ASN A 111 13.219 3.544 30.348 1.00 11.00 C ATOM 1815 OD1 ASN A 111 13.199 4.765 30.500 1.00 13.55 O ATOM 1816 ND2 ASN A 111 12.688 2.703 31.228 1.00 60.12 N ATOM 0 H ASN A 111 12.014 1.746 27.993 1.00 53.11 H new ATOM 0 HA ASN A 111 12.863 4.439 27.976 1.00 41.41 H new ATOM 0 HB2 ASN A 111 13.761 1.839 29.173 1.00 10.10 H new ATOM 0 HB3 ASN A 111 14.932 3.142 29.129 1.00 10.10 H new ATOM 0 HD21 ASN A 111 12.240 3.062 32.071 1.00 60.12 H new ATOM 0 HD22 ASN A 111 12.728 1.698 31.061 1.00 60.12 H new ATOM 1823 N ILE A 112 14.476 2.380 26.011 1.00 23.44 N ATOM 1824 CA ILE A 112 15.460 2.302 24.939 1.00 62.42 C ATOM 1825 C ILE A 112 15.307 3.467 23.967 1.00 64.41 C ATOM 1826 O ILE A 112 16.292 4.088 23.565 1.00 64.40 O ATOM 1827 CB ILE A 112 15.340 0.979 24.160 1.00 60.53 C ATOM 1828 CG1 ILE A 112 15.530 -0.212 25.101 1.00 23.34 C ATOM 1829 CG2 ILE A 112 16.358 0.935 23.030 1.00 53.04 C ATOM 1830 CD1 ILE A 112 15.220 -1.546 24.459 1.00 62.20 C ATOM 0 H ILE A 112 13.937 1.525 26.152 1.00 23.44 H new ATOM 0 HA ILE A 112 16.443 2.350 25.408 1.00 62.42 H new ATOM 0 HB ILE A 112 14.342 0.920 23.726 1.00 60.53 H new ATOM 0 HG12 ILE A 112 16.559 -0.221 25.459 1.00 23.34 H new ATOM 0 HG13 ILE A 112 14.890 -0.081 25.974 1.00 23.34 H new ATOM 0 HG21 ILE A 112 16.261 -0.006 22.489 1.00 53.04 H new ATOM 0 HG22 ILE A 112 16.180 1.766 22.347 1.00 53.04 H new ATOM 0 HG23 ILE A 112 17.364 1.014 23.443 1.00 53.04 H new ATOM 0 HD11 ILE A 112 15.377 -2.344 25.185 1.00 62.20 H new ATOM 0 HD12 ILE A 112 14.182 -1.557 24.126 1.00 62.20 H new ATOM 0 HD13 ILE A 112 15.877 -1.699 23.603 1.00 62.20 H new ATOM 1842 N LEU A 113 14.067 3.760 23.594 1.00 74.42 N ATOM 1843 CA LEU A 113 13.783 4.852 22.670 1.00 44.42 C ATOM 1844 C LEU A 113 14.451 6.144 23.133 1.00 74.44 C ATOM 1845 O LEU A 113 14.858 6.972 22.318 1.00 74.24 O ATOM 1846 CB LEU A 113 12.273 5.062 22.544 1.00 23.22 C ATOM 1847 CG LEU A 113 11.548 4.142 21.561 1.00 14.43 C ATOM 1848 CD1 LEU A 113 12.018 4.404 20.139 1.00 53.22 C ATOM 1849 CD2 LEU A 113 11.764 2.684 21.936 1.00 21.54 C ATOM 0 H LEU A 113 13.241 3.256 23.917 1.00 74.42 H new ATOM 0 HA LEU A 113 14.188 4.584 21.694 1.00 44.42 H new ATOM 0 HB2 LEU A 113 11.825 4.933 23.529 1.00 23.22 H new ATOM 0 HB3 LEU A 113 12.094 6.095 22.244 1.00 23.22 H new ATOM 0 HG LEU A 113 10.480 4.355 21.614 1.00 14.43 H new ATOM 0 HD11 LEU A 113 11.491 3.740 19.454 1.00 53.22 H new ATOM 0 HD12 LEU A 113 11.810 5.440 19.872 1.00 53.22 H new ATOM 0 HD13 LEU A 113 13.090 4.220 20.070 1.00 53.22 H new ATOM 0 HD21 LEU A 113 11.241 2.044 21.225 1.00 21.54 H new ATOM 0 HD22 LEU A 113 12.830 2.456 21.913 1.00 21.54 H new ATOM 0 HD23 LEU A 113 11.377 2.505 22.939 1.00 21.54 H new ATOM 1861 N LYS A 114 14.562 6.308 24.446 1.00 15.14 N ATOM 1862 CA LYS A 114 15.183 7.496 25.019 1.00 14.34 C ATOM 1863 C LYS A 114 16.692 7.480 24.801 1.00 1.30 C ATOM 1864 O LYS A 114 17.290 8.501 24.463 1.00 12.55 O ATOM 1865 CB LYS A 114 14.874 7.587 26.516 1.00 50.14 C ATOM 1866 CG LYS A 114 13.443 7.218 26.865 1.00 74.11 C ATOM 1867 CD LYS A 114 12.445 8.110 26.145 1.00 2.34 C ATOM 1868 CE LYS A 114 11.017 7.630 26.352 1.00 20.31 C ATOM 1869 NZ LYS A 114 10.277 7.518 25.064 1.00 5.14 N ATOM 0 H LYS A 114 14.230 5.633 25.134 1.00 15.14 H new ATOM 0 HA LYS A 114 14.770 8.370 24.515 1.00 14.34 H new ATOM 0 HB2 LYS A 114 15.553 6.929 27.059 1.00 50.14 H new ATOM 0 HB3 LYS A 114 15.072 8.603 26.858 1.00 50.14 H new ATOM 0 HG2 LYS A 114 13.260 6.177 26.599 1.00 74.11 H new ATOM 0 HG3 LYS A 114 13.297 7.302 27.942 1.00 74.11 H new ATOM 0 HD2 LYS A 114 12.542 9.133 26.508 1.00 2.34 H new ATOM 0 HD3 LYS A 114 12.673 8.127 25.079 1.00 2.34 H new ATOM 0 HE2 LYS A 114 11.028 6.660 26.850 1.00 20.31 H new ATOM 0 HE3 LYS A 114 10.494 8.321 27.013 1.00 20.31 H new ATOM 0 HZ1 LYS A 114 9.438 8.132 25.091 1.00 5.14 H new ATOM 0 HZ2 LYS A 114 10.896 7.812 24.281 1.00 5.14 H new ATOM 0 HZ3 LYS A 114 9.980 6.532 24.919 1.00 5.14 H new ATOM 1883 N GLU A 115 17.301 6.315 24.995 1.00 63.43 N ATOM 1884 CA GLU A 115 18.741 6.167 24.818 1.00 42.32 C ATOM 1885 C GLU A 115 19.141 6.429 23.368 1.00 32.54 C ATOM 1886 O GLU A 115 20.053 7.209 23.096 1.00 51.20 O ATOM 1887 CB GLU A 115 19.188 4.765 25.237 1.00 41.22 C ATOM 1888 CG GLU A 115 19.422 4.622 26.731 1.00 14.03 C ATOM 1889 CD GLU A 115 20.801 5.088 27.154 1.00 44.45 C ATOM 1890 OE1 GLU A 115 21.645 5.324 26.264 1.00 63.05 O ATOM 1891 OE2 GLU A 115 21.037 5.218 28.373 1.00 63.52 O ATOM 0 H GLU A 115 16.820 5.460 25.275 1.00 63.43 H new ATOM 0 HA GLU A 115 19.236 6.902 25.452 1.00 42.32 H new ATOM 0 HB2 GLU A 115 18.433 4.044 24.925 1.00 41.22 H new ATOM 0 HB3 GLU A 115 20.107 4.513 24.708 1.00 41.22 H new ATOM 0 HG2 GLU A 115 18.668 5.196 27.269 1.00 14.03 H new ATOM 0 HG3 GLU A 115 19.292 3.578 27.017 1.00 14.03 H new ATOM 1898 N ARG A 116 18.452 5.769 22.443 1.00 52.12 N ATOM 1899 CA ARG A 116 18.735 5.928 21.022 1.00 63.04 C ATOM 1900 C ARG A 116 18.163 7.241 20.496 1.00 13.34 C ATOM 1901 O ARG A 116 18.547 7.714 19.428 1.00 71.24 O ATOM 1902 CB ARG A 116 18.156 4.754 20.230 1.00 42.11 C ATOM 1903 CG ARG A 116 18.455 3.397 20.846 1.00 5.21 C ATOM 1904 CD ARG A 116 19.949 3.192 21.043 1.00 44.03 C ATOM 1905 NE ARG A 116 20.296 1.779 21.165 1.00 23.34 N ATOM 1906 CZ ARG A 116 21.537 1.339 21.342 1.00 3.34 C ATOM 1907 NH1 ARG A 116 22.544 2.199 21.417 1.00 20.25 N ATOM 1908 NH2 ARG A 116 21.773 0.038 21.445 1.00 21.43 N ATOM 0 H ARG A 116 17.694 5.119 22.652 1.00 52.12 H new ATOM 0 HA ARG A 116 19.817 5.946 20.894 1.00 63.04 H new ATOM 0 HB2 ARG A 116 17.076 4.878 20.151 1.00 42.11 H new ATOM 0 HB3 ARG A 116 18.555 4.779 19.216 1.00 42.11 H new ATOM 0 HG2 ARG A 116 17.945 3.311 21.806 1.00 5.21 H new ATOM 0 HG3 ARG A 116 18.060 2.610 20.204 1.00 5.21 H new ATOM 0 HD2 ARG A 116 20.489 3.626 20.201 1.00 44.03 H new ATOM 0 HD3 ARG A 116 20.273 3.723 21.938 1.00 44.03 H new ATOM 0 HE ARG A 116 19.544 1.092 21.111 1.00 23.34 H new ATOM 0 HH11 ARG A 116 22.366 3.200 21.339 1.00 20.25 H new ATOM 0 HH12 ARG A 116 23.496 1.859 21.553 1.00 20.25 H new ATOM 0 HH21 ARG A 116 21.001 -0.626 21.388 1.00 21.43 H new ATOM 0 HH22 ARG A 116 22.726 -0.298 21.581 1.00 21.43 H new ATOM 1922 N ASN A 117 17.241 7.825 21.256 1.00 24.01 N ATOM 1923 CA ASN A 117 16.615 9.083 20.867 1.00 51.12 C ATOM 1924 C ASN A 117 15.976 8.968 19.486 1.00 45.51 C ATOM 1925 O ASN A 117 16.190 9.817 18.620 1.00 44.22 O ATOM 1926 CB ASN A 117 17.646 10.213 20.872 1.00 1.40 C ATOM 1927 CG ASN A 117 17.000 11.585 20.885 1.00 10.35 C ATOM 1928 OD1 ASN A 117 15.901 11.761 21.412 1.00 3.23 O ATOM 1929 ND2 ASN A 117 17.681 12.566 20.304 1.00 63.30 N ATOM 0 H ASN A 117 16.912 7.447 22.144 1.00 24.01 H new ATOM 0 HA ASN A 117 15.833 9.311 21.592 1.00 51.12 H new ATOM 0 HB2 ASN A 117 18.290 10.109 21.745 1.00 1.40 H new ATOM 0 HB3 ASN A 117 18.284 10.123 19.993 1.00 1.40 H new ATOM 0 HD21 ASN A 117 17.296 13.510 20.282 1.00 63.30 H new ATOM 0 HD22 ASN A 117 18.589 12.375 19.879 1.00 63.30 H new ATOM 1936 N ILE A 118 15.192 7.914 19.289 1.00 51.45 N ATOM 1937 CA ILE A 118 14.521 7.690 18.014 1.00 22.00 C ATOM 1938 C ILE A 118 13.386 8.687 17.807 1.00 3.20 C ATOM 1939 O ILE A 118 13.398 9.469 16.856 1.00 42.00 O ATOM 1940 CB ILE A 118 13.957 6.260 17.919 1.00 12.20 C ATOM 1941 CG1 ILE A 118 15.027 5.239 18.309 1.00 64.11 C ATOM 1942 CG2 ILE A 118 13.442 5.986 16.514 1.00 44.13 C ATOM 1943 CD1 ILE A 118 16.207 5.209 17.363 1.00 42.23 C ATOM 0 H ILE A 118 15.006 7.202 19.995 1.00 51.45 H new ATOM 0 HA ILE A 118 15.270 7.829 17.234 1.00 22.00 H new ATOM 0 HB ILE A 118 13.123 6.167 18.615 1.00 12.20 H new ATOM 0 HG12 ILE A 118 15.383 5.464 19.314 1.00 64.11 H new ATOM 0 HG13 ILE A 118 14.576 4.248 18.345 1.00 64.11 H new ATOM 0 HG21 ILE A 118 13.047 4.972 16.463 1.00 44.13 H new ATOM 0 HG22 ILE A 118 12.652 6.696 16.271 1.00 44.13 H new ATOM 0 HG23 ILE A 118 14.258 6.094 15.800 1.00 44.13 H new ATOM 0 HD11 ILE A 118 16.926 4.463 17.701 1.00 42.23 H new ATOM 0 HD12 ILE A 118 15.863 4.954 16.361 1.00 42.23 H new ATOM 0 HD13 ILE A 118 16.684 6.189 17.345 1.00 42.23 H new ATOM 1955 N PHE A 119 12.407 8.656 18.705 1.00 61.41 N ATOM 1956 CA PHE A 119 11.264 9.557 18.622 1.00 42.53 C ATOM 1957 C PHE A 119 11.613 10.931 19.187 1.00 11.13 C ATOM 1958 O PHE A 119 12.614 11.091 19.886 1.00 73.30 O ATOM 1959 CB PHE A 119 10.069 8.971 19.376 1.00 10.31 C ATOM 1960 CG PHE A 119 9.659 7.612 18.886 1.00 22.22 C ATOM 1961 CD1 PHE A 119 9.482 7.373 17.533 1.00 52.00 C ATOM 1962 CD2 PHE A 119 9.452 6.573 19.779 1.00 71.31 C ATOM 1963 CE1 PHE A 119 9.104 6.123 17.080 1.00 51.22 C ATOM 1964 CE2 PHE A 119 9.074 5.321 19.332 1.00 63.54 C ATOM 1965 CZ PHE A 119 8.901 5.095 17.980 1.00 2.40 C ATOM 0 H PHE A 119 12.382 8.016 19.499 1.00 61.41 H new ATOM 0 HA PHE A 119 10.999 9.672 17.571 1.00 42.53 H new ATOM 0 HB2 PHE A 119 10.314 8.907 20.436 1.00 10.31 H new ATOM 0 HB3 PHE A 119 9.223 9.652 19.285 1.00 10.31 H new ATOM 0 HD1 PHE A 119 9.641 8.172 16.824 1.00 52.00 H new ATOM 0 HD2 PHE A 119 9.588 6.743 20.837 1.00 71.31 H new ATOM 0 HE1 PHE A 119 8.967 5.950 16.023 1.00 51.22 H new ATOM 0 HE2 PHE A 119 8.914 4.520 20.039 1.00 63.54 H new ATOM 0 HZ PHE A 119 8.608 4.117 17.628 1.00 2.40 H new ATOM 1975 N SER A 120 10.780 11.920 18.879 1.00 1.22 N ATOM 1976 CA SER A 120 11.002 13.282 19.352 1.00 32.55 C ATOM 1977 C SER A 120 10.346 13.497 20.713 1.00 54.32 C ATOM 1978 O SER A 120 9.717 12.593 21.263 1.00 23.21 O ATOM 1979 CB SER A 120 10.452 14.291 18.343 1.00 63.14 C ATOM 1980 OG SER A 120 11.330 14.439 17.240 1.00 23.12 O ATOM 0 H SER A 120 9.945 11.804 18.304 1.00 1.22 H new ATOM 0 HA SER A 120 12.076 13.434 19.457 1.00 32.55 H new ATOM 0 HB2 SER A 120 9.474 13.963 17.992 1.00 63.14 H new ATOM 0 HB3 SER A 120 10.309 15.256 18.830 1.00 63.14 H new ATOM 0 HG SER A 120 10.955 15.088 16.608 1.00 23.12 H new ATOM 1986 N LYS A 121 10.496 14.703 21.251 1.00 63.04 N ATOM 1987 CA LYS A 121 9.919 15.041 22.546 1.00 55.21 C ATOM 1988 C LYS A 121 8.395 14.977 22.496 1.00 64.32 C ATOM 1989 O LYS A 121 7.759 14.429 23.395 1.00 21.44 O ATOM 1990 CB LYS A 121 10.366 16.439 22.978 1.00 45.32 C ATOM 1991 CG LYS A 121 10.335 16.651 24.482 1.00 72.44 C ATOM 1992 CD LYS A 121 11.589 16.110 25.147 1.00 22.22 C ATOM 1993 CE LYS A 121 12.709 17.139 25.146 1.00 50.23 C ATOM 1994 NZ LYS A 121 13.527 17.067 23.903 1.00 13.32 N ATOM 0 H LYS A 121 11.013 15.463 20.809 1.00 63.04 H new ATOM 0 HA LYS A 121 10.273 14.311 23.274 1.00 55.21 H new ATOM 0 HB2 LYS A 121 11.379 16.615 22.616 1.00 45.32 H new ATOM 0 HB3 LYS A 121 9.724 17.180 22.502 1.00 45.32 H new ATOM 0 HG2 LYS A 121 10.237 17.715 24.698 1.00 72.44 H new ATOM 0 HG3 LYS A 121 9.458 16.158 24.902 1.00 72.44 H new ATOM 0 HD2 LYS A 121 11.362 15.819 26.173 1.00 22.22 H new ATOM 0 HD3 LYS A 121 11.919 15.211 24.627 1.00 22.22 H new ATOM 0 HE2 LYS A 121 12.284 18.138 25.244 1.00 50.23 H new ATOM 0 HE3 LYS A 121 13.350 16.979 26.013 1.00 50.23 H new ATOM 0 HZ1 LYS A 121 14.514 17.312 24.122 1.00 13.32 H new ATOM 0 HZ2 LYS A 121 13.487 16.102 23.517 1.00 13.32 H new ATOM 0 HZ3 LYS A 121 13.152 17.736 23.201 1.00 13.32 H new ATOM 2008 N GLN A 122 7.818 15.538 21.439 1.00 42.54 N ATOM 2009 CA GLN A 122 6.370 15.543 21.272 1.00 13.32 C ATOM 2010 C GLN A 122 5.816 14.122 21.280 1.00 1.32 C ATOM 2011 O GLN A 122 4.681 13.889 21.697 1.00 43.32 O ATOM 2012 CB GLN A 122 5.987 16.245 19.968 1.00 63.12 C ATOM 2013 CG GLN A 122 6.007 17.762 20.064 1.00 25.13 C ATOM 2014 CD GLN A 122 7.413 18.323 20.149 1.00 24.31 C ATOM 2015 OE1 GLN A 122 7.791 18.934 21.149 1.00 50.21 O ATOM 2016 NE2 GLN A 122 8.198 18.117 19.097 1.00 35.34 N ATOM 0 H GLN A 122 8.331 15.995 20.685 1.00 42.54 H new ATOM 0 HA GLN A 122 5.936 16.088 22.110 1.00 13.32 H new ATOM 0 HB2 GLN A 122 6.672 15.930 19.181 1.00 63.12 H new ATOM 0 HB3 GLN A 122 4.990 15.921 19.670 1.00 63.12 H new ATOM 0 HG2 GLN A 122 5.504 18.184 19.194 1.00 25.13 H new ATOM 0 HG3 GLN A 122 5.442 18.074 20.942 1.00 25.13 H new ATOM 0 HE21 GLN A 122 7.844 17.605 18.289 1.00 35.34 H new ATOM 0 HE22 GLN A 122 9.155 18.471 19.098 1.00 35.34 H new ATOM 2025 N VAL A 123 6.625 13.175 20.817 1.00 72.34 N ATOM 2026 CA VAL A 123 6.216 11.776 20.771 1.00 63.20 C ATOM 2027 C VAL A 123 6.337 11.123 22.143 1.00 13.14 C ATOM 2028 O VAL A 123 5.385 10.525 22.644 1.00 35.50 O ATOM 2029 CB VAL A 123 7.060 10.977 19.759 1.00 14.52 C ATOM 2030 CG1 VAL A 123 6.631 9.518 19.740 1.00 53.31 C ATOM 2031 CG2 VAL A 123 6.950 11.592 18.372 1.00 12.41 C ATOM 0 H VAL A 123 7.567 13.351 20.468 1.00 72.34 H new ATOM 0 HA VAL A 123 5.173 11.762 20.455 1.00 63.20 H new ATOM 0 HB VAL A 123 8.104 11.019 20.069 1.00 14.52 H new ATOM 0 HG11 VAL A 123 7.238 8.970 19.020 1.00 53.31 H new ATOM 0 HG12 VAL A 123 6.766 9.086 20.732 1.00 53.31 H new ATOM 0 HG13 VAL A 123 5.581 9.451 19.455 1.00 53.31 H new ATOM 0 HG21 VAL A 123 7.552 11.016 17.670 1.00 12.41 H new ATOM 0 HG22 VAL A 123 5.908 11.582 18.051 1.00 12.41 H new ATOM 0 HG23 VAL A 123 7.311 12.620 18.400 1.00 12.41 H new ATOM 2041 N VAL A 124 7.514 11.243 22.748 1.00 23.14 N ATOM 2042 CA VAL A 124 7.760 10.666 24.065 1.00 52.03 C ATOM 2043 C VAL A 124 6.741 11.166 25.082 1.00 34.44 C ATOM 2044 O VAL A 124 6.167 10.382 25.837 1.00 31.23 O ATOM 2045 CB VAL A 124 9.177 10.999 24.568 1.00 70.11 C ATOM 2046 CG1 VAL A 124 9.392 10.440 25.966 1.00 1.54 C ATOM 2047 CG2 VAL A 124 10.224 10.462 23.604 1.00 40.13 C ATOM 0 H VAL A 124 8.313 11.735 22.347 1.00 23.14 H new ATOM 0 HA VAL A 124 7.665 9.585 23.960 1.00 52.03 H new ATOM 0 HB VAL A 124 9.282 12.083 24.616 1.00 70.11 H new ATOM 0 HG11 VAL A 124 10.399 10.685 26.305 1.00 1.54 H new ATOM 0 HG12 VAL A 124 8.663 10.877 26.649 1.00 1.54 H new ATOM 0 HG13 VAL A 124 9.269 9.357 25.948 1.00 1.54 H new ATOM 0 HG21 VAL A 124 11.219 10.706 23.975 1.00 40.13 H new ATOM 0 HG22 VAL A 124 10.123 9.380 23.523 1.00 40.13 H new ATOM 0 HG23 VAL A 124 10.081 10.915 22.623 1.00 40.13 H new ATOM 2057 N ASN A 125 6.520 12.476 25.096 1.00 10.14 N ATOM 2058 CA ASN A 125 5.569 13.081 26.022 1.00 42.30 C ATOM 2059 C ASN A 125 4.189 12.449 25.874 1.00 34.25 C ATOM 2060 O ASN A 125 3.395 12.441 26.815 1.00 34.43 O ATOM 2061 CB ASN A 125 5.480 14.590 25.780 1.00 31.55 C ATOM 2062 CG ASN A 125 6.492 15.367 26.600 1.00 50.15 C ATOM 2063 OD1 ASN A 125 6.144 16.327 27.288 1.00 64.14 O ATOM 2064 ND2 ASN A 125 7.752 14.955 26.529 1.00 64.05 N ATOM 0 H ASN A 125 6.986 13.139 24.477 1.00 10.14 H new ATOM 0 HA ASN A 125 5.924 12.902 27.037 1.00 42.30 H new ATOM 0 HB2 ASN A 125 5.639 14.796 24.721 1.00 31.55 H new ATOM 0 HB3 ASN A 125 4.476 14.936 26.024 1.00 31.55 H new ATOM 0 HD21 ASN A 125 8.477 15.439 27.058 1.00 64.05 H new ATOM 0 HD22 ASN A 125 7.995 14.154 25.946 1.00 64.05 H new ATOM 2071 N ASP A 126 3.910 11.920 24.688 1.00 22.33 N ATOM 2072 CA ASP A 126 2.626 11.283 24.417 1.00 5.13 C ATOM 2073 C ASP A 126 2.551 9.909 25.076 1.00 3.44 C ATOM 2074 O ASP A 126 1.519 9.533 25.633 1.00 5.13 O ATOM 2075 CB ASP A 126 2.406 11.152 22.909 1.00 23.35 C ATOM 2076 CG ASP A 126 0.977 10.786 22.563 1.00 74.32 C ATOM 2077 OD1 ASP A 126 0.133 10.755 23.483 1.00 53.34 O ATOM 2078 OD2 ASP A 126 0.702 10.529 21.372 1.00 74.22 O ATOM 0 H ASP A 126 4.556 11.920 23.898 1.00 22.33 H new ATOM 0 HA ASP A 126 1.841 11.911 24.838 1.00 5.13 H new ATOM 0 HB2 ASP A 126 2.665 12.093 22.424 1.00 23.35 H new ATOM 0 HB3 ASP A 126 3.079 10.393 22.511 1.00 23.35 H new ATOM 2083 N ILE A 127 3.650 9.165 25.008 1.00 11.22 N ATOM 2084 CA ILE A 127 3.708 7.834 25.598 1.00 31.43 C ATOM 2085 C ILE A 127 3.392 7.879 27.089 1.00 34.23 C ATOM 2086 O ILE A 127 2.627 7.059 27.596 1.00 20.13 O ATOM 2087 CB ILE A 127 5.092 7.189 25.398 1.00 60.22 C ATOM 2088 CG1 ILE A 127 5.410 7.066 23.906 1.00 23.43 C ATOM 2089 CG2 ILE A 127 5.143 5.825 26.070 1.00 4.13 C ATOM 2090 CD1 ILE A 127 6.889 7.141 23.596 1.00 72.13 C ATOM 0 H ILE A 127 4.512 9.462 24.550 1.00 11.22 H new ATOM 0 HA ILE A 127 2.957 7.230 25.088 1.00 31.43 H new ATOM 0 HB ILE A 127 5.845 7.828 25.860 1.00 60.22 H new ATOM 0 HG12 ILE A 127 5.017 6.119 23.536 1.00 23.43 H new ATOM 0 HG13 ILE A 127 4.893 7.859 23.366 1.00 23.43 H new ATOM 0 HG21 ILE A 127 6.127 5.382 25.920 1.00 4.13 H new ATOM 0 HG22 ILE A 127 4.955 5.938 27.138 1.00 4.13 H new ATOM 0 HG23 ILE A 127 4.383 5.176 25.635 1.00 4.13 H new ATOM 0 HD11 ILE A 127 7.041 7.047 22.521 1.00 72.13 H new ATOM 0 HD12 ILE A 127 7.284 8.099 23.936 1.00 72.13 H new ATOM 0 HD13 ILE A 127 7.410 6.332 24.108 1.00 72.13 H new ATOM 2102 N GLU A 128 3.984 8.844 27.785 1.00 23.04 N ATOM 2103 CA GLU A 128 3.764 8.996 29.219 1.00 44.41 C ATOM 2104 C GLU A 128 2.287 9.232 29.521 1.00 42.44 C ATOM 2105 O GLU A 128 1.718 8.607 30.415 1.00 31.11 O ATOM 2106 CB GLU A 128 4.599 10.156 29.765 1.00 44.40 C ATOM 2107 CG GLU A 128 6.090 10.005 29.513 1.00 61.21 C ATOM 2108 CD GLU A 128 6.702 8.865 30.303 1.00 25.32 C ATOM 2109 OE1 GLU A 128 6.508 8.827 31.536 1.00 21.04 O ATOM 2110 OE2 GLU A 128 7.376 8.011 29.689 1.00 33.14 O ATOM 0 H GLU A 128 4.619 9.532 27.380 1.00 23.04 H new ATOM 0 HA GLU A 128 4.074 8.073 29.708 1.00 44.41 H new ATOM 0 HB2 GLU A 128 4.255 11.085 29.311 1.00 44.40 H new ATOM 0 HB3 GLU A 128 4.427 10.242 30.838 1.00 44.40 H new ATOM 0 HG2 GLU A 128 6.260 9.837 28.449 1.00 61.21 H new ATOM 0 HG3 GLU A 128 6.595 10.935 29.774 1.00 61.21 H new ATOM 2117 N ARG A 129 1.673 10.140 28.768 1.00 23.22 N ATOM 2118 CA ARG A 129 0.264 10.460 28.956 1.00 55.44 C ATOM 2119 C ARG A 129 -0.611 9.235 28.705 1.00 43.13 C ATOM 2120 O ARG A 129 -1.591 9.005 29.412 1.00 34.41 O ATOM 2121 CB ARG A 129 -0.152 11.597 28.020 1.00 62.25 C ATOM 2122 CG ARG A 129 0.626 12.884 28.241 1.00 20.43 C ATOM 2123 CD ARG A 129 0.016 13.718 29.357 1.00 51.25 C ATOM 2124 NE ARG A 129 0.992 14.620 29.962 1.00 41.10 N ATOM 2125 CZ ARG A 129 0.662 15.643 30.742 1.00 3.24 C ATOM 2126 NH1 ARG A 129 -0.612 15.893 31.011 1.00 62.40 N ATOM 2127 NH2 ARG A 129 1.608 16.419 31.256 1.00 22.04 N ATOM 0 H ARG A 129 2.130 10.666 28.023 1.00 23.22 H new ATOM 0 HA ARG A 129 0.125 10.779 29.989 1.00 55.44 H new ATOM 0 HB2 ARG A 129 -0.018 11.274 26.988 1.00 62.25 H new ATOM 0 HB3 ARG A 129 -1.215 11.797 28.155 1.00 62.25 H new ATOM 0 HG2 ARG A 129 1.661 12.647 28.486 1.00 20.43 H new ATOM 0 HG3 ARG A 129 0.642 13.464 27.318 1.00 20.43 H new ATOM 0 HD2 ARG A 129 -0.818 14.298 28.962 1.00 51.25 H new ATOM 0 HD3 ARG A 129 -0.390 13.057 30.123 1.00 51.25 H new ATOM 0 HE ARG A 129 1.981 14.455 29.775 1.00 41.10 H new ATOM 0 HH11 ARG A 129 -1.342 15.299 30.619 1.00 62.40 H new ATOM 0 HH12 ARG A 129 -0.862 16.680 31.610 1.00 62.40 H new ATOM 0 HH21 ARG A 129 2.589 16.230 31.052 1.00 22.04 H new ATOM 0 HH22 ARG A 129 1.354 17.204 31.855 1.00 22.04 H new ATOM 2141 N SER A 130 -0.248 8.453 27.693 1.00 53.12 N ATOM 2142 CA SER A 130 -1.002 7.254 27.346 1.00 62.04 C ATOM 2143 C SER A 130 -1.097 6.308 28.539 1.00 73.12 C ATOM 2144 O SER A 130 -2.184 6.054 29.059 1.00 34.41 O ATOM 2145 CB SER A 130 -0.345 6.538 26.164 1.00 73.12 C ATOM 2146 OG SER A 130 -0.872 6.999 24.932 1.00 74.43 O ATOM 0 H SER A 130 0.563 8.628 27.100 1.00 53.12 H new ATOM 0 HA SER A 130 -2.010 7.557 27.064 1.00 62.04 H new ATOM 0 HB2 SER A 130 0.732 6.704 26.187 1.00 73.12 H new ATOM 0 HB3 SER A 130 -0.504 5.463 26.252 1.00 73.12 H new ATOM 0 HG SER A 130 -0.317 6.669 24.195 1.00 74.43 H new ATOM 2152 N LEU A 131 0.048 5.789 28.967 1.00 1.34 N ATOM 2153 CA LEU A 131 0.096 4.871 30.100 1.00 72.33 C ATOM 2154 C LEU A 131 -0.613 5.464 31.313 1.00 55.23 C ATOM 2155 O LEU A 131 -1.290 4.755 32.057 1.00 2.00 O ATOM 2156 CB LEU A 131 1.547 4.541 30.454 1.00 40.42 C ATOM 2157 CG LEU A 131 2.202 3.428 29.635 1.00 13.11 C ATOM 2158 CD1 LEU A 131 2.156 3.759 28.151 1.00 1.35 C ATOM 2159 CD2 LEU A 131 3.637 3.205 30.090 1.00 74.02 C ATOM 0 H LEU A 131 0.956 5.988 28.547 1.00 1.34 H new ATOM 0 HA LEU A 131 -0.419 3.954 29.814 1.00 72.33 H new ATOM 0 HB2 LEU A 131 2.143 5.447 30.340 1.00 40.42 H new ATOM 0 HB3 LEU A 131 1.589 4.262 31.507 1.00 40.42 H new ATOM 0 HG LEU A 131 1.643 2.506 29.798 1.00 13.11 H new ATOM 0 HD11 LEU A 131 2.627 2.956 27.584 1.00 1.35 H new ATOM 0 HD12 LEU A 131 1.119 3.867 27.834 1.00 1.35 H new ATOM 0 HD13 LEU A 131 2.690 4.692 27.970 1.00 1.35 H new ATOM 0 HD21 LEU A 131 4.087 2.410 29.496 1.00 74.02 H new ATOM 0 HD22 LEU A 131 4.208 4.124 29.958 1.00 74.02 H new ATOM 0 HD23 LEU A 131 3.645 2.921 31.142 1.00 74.02 H new