USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 923 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 65 HIS : no HE2:sc= -0.54 K(o=-1.9,f=-9.7!) USER MOD Set 1.2: A 77 MET CE :methyl -150:sc= -1.32 (180deg=-2.78!) USER MOD Set 2.1: A 61 THR OG1 : rot 180:sc= 0.0468 USER MOD Set 2.2: A 62 SER OG : rot 180:sc= -0.715 USER MOD Set 2.3: A 82 SER OG : rot 81:sc= 0.0508 USER MOD Set 3.1: A 33 CYS SG : rot 170:sc= 0.0414 USER MOD Set 3.2: A 79 CYS SG : rot 80:sc= -1.73 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= -1.25 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00151) USER MOD Single : A 36 GLN : amide:sc= -0.294 K(o=-0.29,f=-2.6!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= -0.0102 X(o=-0.01,f=-0.014) USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= -0.0789 K(o=-0.079,f=-1.8!) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=-0.0034) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0.00539 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 7:sc= 0.759 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.283 K(o=-0.28,f=-2.3) USER MOD Single : A 98 CYS SG : rot 103:sc= 0.823 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=-0.094) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc=-0.00468 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 0.985 -12.277 25.353 1.00 0.00 N ATOM 2 CA GLY A 1 1.253 -11.025 26.040 1.00 0.00 C ATOM 3 C GLY A 1 0.552 -9.856 25.343 1.00 0.00 C ATOM 4 O GLY A 1 -0.652 -9.663 25.506 1.00 0.00 O ATOM 0 H1 GLY A 1 1.471 -13.054 25.845 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.039 -12.458 25.348 1.00 0.00 H new ATOM 0 H3 GLY A 1 1.331 -12.217 24.374 1.00 0.00 H new ATOM 0 HA2 GLY A 1 0.914 -11.093 27.074 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.328 -10.845 26.069 1.00 0.00 H new ATOM 8 N SER A 2 1.336 -9.107 24.581 1.00 0.00 N ATOM 9 CA SER A 2 0.806 -7.963 23.859 1.00 0.00 C ATOM 10 C SER A 2 0.111 -7.008 24.830 1.00 0.00 C ATOM 11 O SER A 2 -1.112 -7.030 24.960 1.00 0.00 O ATOM 12 CB SER A 2 -0.165 -8.406 22.763 1.00 0.00 C ATOM 13 OG SER A 2 0.236 -7.943 21.476 1.00 0.00 O ATOM 0 H SER A 2 2.334 -9.270 24.448 1.00 0.00 H new ATOM 0 HA SER A 2 1.637 -7.444 23.382 1.00 0.00 H new ATOM 0 HB2 SER A 2 -0.229 -9.494 22.753 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.163 -8.030 22.989 1.00 0.00 H new ATOM 0 HG SER A 2 -0.408 -8.248 20.803 1.00 0.00 H new ATOM 19 N SER A 3 0.920 -6.191 25.489 1.00 0.00 N ATOM 20 CA SER A 3 0.397 -5.229 26.444 1.00 0.00 C ATOM 21 C SER A 3 1.355 -4.043 26.570 1.00 0.00 C ATOM 22 O SER A 3 2.299 -4.084 27.357 1.00 0.00 O ATOM 23 CB SER A 3 0.173 -5.878 27.812 1.00 0.00 C ATOM 24 OG SER A 3 -0.362 -4.957 28.758 1.00 0.00 O ATOM 0 H SER A 3 1.934 -6.176 25.380 1.00 0.00 H new ATOM 0 HA SER A 3 -0.566 -4.873 26.078 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.506 -6.724 27.705 1.00 0.00 H new ATOM 0 HB3 SER A 3 1.118 -6.273 28.185 1.00 0.00 H new ATOM 0 HG SER A 3 -0.492 -5.409 29.618 1.00 0.00 H new ATOM 30 N GLY A 4 1.079 -3.014 25.782 1.00 0.00 N ATOM 31 CA GLY A 4 1.904 -1.818 25.796 1.00 0.00 C ATOM 32 C GLY A 4 1.406 -0.796 24.772 1.00 0.00 C ATOM 33 O GLY A 4 1.596 -0.973 23.570 1.00 0.00 O ATOM 0 H GLY A 4 0.295 -2.984 25.130 1.00 0.00 H new ATOM 0 HA2 GLY A 4 1.892 -1.375 26.792 1.00 0.00 H new ATOM 0 HA3 GLY A 4 2.938 -2.083 25.577 1.00 0.00 H new ATOM 37 N SER A 5 0.777 0.251 25.287 1.00 0.00 N ATOM 38 CA SER A 5 0.250 1.301 24.433 1.00 0.00 C ATOM 39 C SER A 5 0.933 2.631 24.757 1.00 0.00 C ATOM 40 O SER A 5 0.909 3.083 25.901 1.00 0.00 O ATOM 41 CB SER A 5 -1.266 1.430 24.591 1.00 0.00 C ATOM 42 OG SER A 5 -1.893 1.868 23.388 1.00 0.00 O ATOM 0 H SER A 5 0.621 0.394 26.285 1.00 0.00 H new ATOM 0 HA SER A 5 0.459 1.036 23.396 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.683 0.467 24.887 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.488 2.134 25.393 1.00 0.00 H new ATOM 0 HG SER A 5 -2.860 1.936 23.529 1.00 0.00 H new ATOM 48 N SER A 6 1.525 3.221 23.729 1.00 0.00 N ATOM 49 CA SER A 6 2.214 4.491 23.890 1.00 0.00 C ATOM 50 C SER A 6 1.884 5.418 22.719 1.00 0.00 C ATOM 51 O SER A 6 1.825 4.977 21.572 1.00 0.00 O ATOM 52 CB SER A 6 3.726 4.288 23.997 1.00 0.00 C ATOM 53 OG SER A 6 4.318 4.008 22.731 1.00 0.00 O ATOM 0 H SER A 6 1.542 2.844 22.782 1.00 0.00 H new ATOM 0 HA SER A 6 1.870 4.951 24.817 1.00 0.00 H new ATOM 0 HB2 SER A 6 4.183 5.182 24.421 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.934 3.468 24.684 1.00 0.00 H new ATOM 0 HG SER A 6 5.284 3.887 22.841 1.00 0.00 H new ATOM 59 N GLY A 7 1.677 6.684 23.048 1.00 0.00 N ATOM 60 CA GLY A 7 1.354 7.677 22.037 1.00 0.00 C ATOM 61 C GLY A 7 -0.080 7.501 21.533 1.00 0.00 C ATOM 62 O GLY A 7 -0.824 6.666 22.047 1.00 0.00 O ATOM 0 H GLY A 7 1.727 7.046 24.000 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.477 8.677 22.452 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.050 7.591 21.202 1.00 0.00 H new ATOM 66 N TYR A 8 -0.425 8.300 20.534 1.00 0.00 N ATOM 67 CA TYR A 8 -1.757 8.242 19.956 1.00 0.00 C ATOM 68 C TYR A 8 -1.691 7.944 18.456 1.00 0.00 C ATOM 69 O TYR A 8 -0.691 8.240 17.804 1.00 0.00 O ATOM 70 CB TYR A 8 -2.366 9.631 20.160 1.00 0.00 C ATOM 71 CG TYR A 8 -1.676 10.737 19.360 1.00 0.00 C ATOM 72 CD1 TYR A 8 -2.036 10.967 18.048 1.00 0.00 C ATOM 73 CD2 TYR A 8 -0.693 11.506 19.950 1.00 0.00 C ATOM 74 CE1 TYR A 8 -1.386 12.008 17.294 1.00 0.00 C ATOM 75 CE2 TYR A 8 -0.044 12.547 19.197 1.00 0.00 C ATOM 76 CZ TYR A 8 -0.422 12.747 17.906 1.00 0.00 C ATOM 77 OH TYR A 8 0.191 13.730 17.195 1.00 0.00 O ATOM 0 H TYR A 8 0.194 8.991 20.110 1.00 0.00 H new ATOM 0 HA TYR A 8 -2.345 7.454 20.426 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -3.419 9.599 19.882 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -2.324 9.883 21.220 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -2.806 10.366 17.586 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -0.411 11.326 20.977 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -1.658 12.197 16.266 1.00 0.00 H new ATOM 0 HE2 TYR A 8 0.726 13.156 19.647 1.00 0.00 H new ATOM 0 HH TYR A 8 0.857 14.176 17.760 1.00 0.00 H new ATOM 87 N PRO A 9 -2.797 7.345 17.940 1.00 0.00 N ATOM 88 CA PRO A 9 -2.874 7.002 16.530 1.00 0.00 C ATOM 89 C PRO A 9 -3.108 8.250 15.676 1.00 0.00 C ATOM 90 O PRO A 9 -3.990 9.054 15.973 1.00 0.00 O ATOM 91 CB PRO A 9 -4.007 5.994 16.432 1.00 0.00 C ATOM 92 CG PRO A 9 -4.822 6.157 17.704 1.00 0.00 C ATOM 93 CD PRO A 9 -4.000 6.978 18.683 1.00 0.00 C ATOM 0 HA PRO A 9 -1.946 6.576 16.148 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -4.619 6.180 15.550 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -3.620 4.979 16.344 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -5.768 6.654 17.490 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -5.063 5.183 18.130 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -4.546 7.861 19.015 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -3.754 6.401 19.575 1.00 0.00 H new ATOM 101 N ILE A 10 -2.303 8.371 14.631 1.00 0.00 N ATOM 102 CA ILE A 10 -2.412 9.507 13.731 1.00 0.00 C ATOM 103 C ILE A 10 -3.664 9.349 12.866 1.00 0.00 C ATOM 104 O ILE A 10 -4.396 10.313 12.645 1.00 0.00 O ATOM 105 CB ILE A 10 -1.123 9.675 12.922 1.00 0.00 C ATOM 106 CG1 ILE A 10 0.080 9.877 13.845 1.00 0.00 C ATOM 107 CG2 ILE A 10 -1.260 10.807 11.902 1.00 0.00 C ATOM 108 CD1 ILE A 10 1.388 9.554 13.119 1.00 0.00 C ATOM 0 H ILE A 10 -1.573 7.702 14.387 1.00 0.00 H new ATOM 0 HA ILE A 10 -2.529 10.431 14.297 1.00 0.00 H new ATOM 0 HB ILE A 10 -0.948 8.757 12.362 1.00 0.00 H new ATOM 0 HG12 ILE A 10 0.102 10.907 14.200 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -0.020 9.239 14.723 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -0.331 10.905 11.341 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -2.076 10.582 11.216 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -1.471 11.742 12.422 1.00 0.00 H new ATOM 0 HD11 ILE A 10 2.228 9.706 13.797 1.00 0.00 H new ATOM 0 HD12 ILE A 10 1.373 8.516 12.787 1.00 0.00 H new ATOM 0 HD13 ILE A 10 1.496 10.210 12.255 1.00 0.00 H new ATOM 120 N GLY A 11 -3.872 8.127 12.400 1.00 0.00 N ATOM 121 CA GLY A 11 -5.023 7.830 11.564 1.00 0.00 C ATOM 122 C GLY A 11 -5.148 6.325 11.317 1.00 0.00 C ATOM 123 O GLY A 11 -4.143 5.622 11.223 1.00 0.00 O ATOM 0 H GLY A 11 -3.263 7.330 12.585 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -5.930 8.200 12.043 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -4.930 8.352 10.612 1.00 0.00 H new ATOM 127 N GLU A 12 -6.390 5.876 11.217 1.00 0.00 N ATOM 128 CA GLU A 12 -6.660 4.467 10.983 1.00 0.00 C ATOM 129 C GLU A 12 -7.172 4.255 9.557 1.00 0.00 C ATOM 130 O GLU A 12 -7.589 5.205 8.895 1.00 0.00 O ATOM 131 CB GLU A 12 -7.653 3.920 12.009 1.00 0.00 C ATOM 132 CG GLU A 12 -7.176 4.198 13.436 1.00 0.00 C ATOM 133 CD GLU A 12 -8.095 5.201 14.136 1.00 0.00 C ATOM 134 OE1 GLU A 12 -7.872 6.414 13.931 1.00 0.00 O ATOM 135 OE2 GLU A 12 -9.000 4.733 14.861 1.00 0.00 O ATOM 0 H GLU A 12 -7.221 6.463 11.294 1.00 0.00 H new ATOM 0 HA GLU A 12 -5.728 3.915 11.100 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -8.631 4.376 11.853 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -7.776 2.846 11.865 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -7.150 3.267 14.002 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -6.158 4.586 13.414 1.00 0.00 H new ATOM 142 N ALA A 13 -7.125 3.004 9.125 1.00 0.00 N ATOM 143 CA ALA A 13 -7.580 2.655 7.789 1.00 0.00 C ATOM 144 C ALA A 13 -8.148 1.235 7.803 1.00 0.00 C ATOM 145 O ALA A 13 -7.516 0.314 8.318 1.00 0.00 O ATOM 146 CB ALA A 13 -6.424 2.811 6.800 1.00 0.00 C ATOM 0 H ALA A 13 -6.779 2.219 9.676 1.00 0.00 H new ATOM 0 HA ALA A 13 -8.377 3.325 7.467 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -6.765 2.549 5.798 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.076 3.844 6.807 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -5.606 2.151 7.089 1.00 0.00 H new ATOM 152 N SER A 14 -9.336 1.101 7.232 1.00 0.00 N ATOM 153 CA SER A 14 -9.997 -0.191 7.172 1.00 0.00 C ATOM 154 C SER A 14 -9.751 -0.843 5.810 1.00 0.00 C ATOM 155 O SER A 14 -9.778 -0.169 4.781 1.00 0.00 O ATOM 156 CB SER A 14 -11.499 -0.055 7.431 1.00 0.00 C ATOM 157 OG SER A 14 -11.801 1.083 8.234 1.00 0.00 O ATOM 0 H SER A 14 -9.858 1.867 6.806 1.00 0.00 H new ATOM 0 HA SER A 14 -9.577 -0.825 7.953 1.00 0.00 H new ATOM 0 HB2 SER A 14 -12.025 0.022 6.480 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.865 -0.955 7.925 1.00 0.00 H new ATOM 0 HG SER A 14 -12.769 1.136 8.375 1.00 0.00 H new ATOM 163 N ILE A 15 -9.515 -2.146 5.847 1.00 0.00 N ATOM 164 CA ILE A 15 -9.263 -2.896 4.628 1.00 0.00 C ATOM 165 C ILE A 15 -10.598 -3.314 4.007 1.00 0.00 C ATOM 166 O ILE A 15 -11.374 -4.040 4.626 1.00 0.00 O ATOM 167 CB ILE A 15 -8.320 -4.068 4.905 1.00 0.00 C ATOM 168 CG1 ILE A 15 -6.876 -3.585 5.058 1.00 0.00 C ATOM 169 CG2 ILE A 15 -8.453 -5.146 3.827 1.00 0.00 C ATOM 170 CD1 ILE A 15 -5.964 -4.722 5.524 1.00 0.00 C ATOM 0 H ILE A 15 -9.493 -2.702 6.702 1.00 0.00 H new ATOM 0 HA ILE A 15 -8.751 -2.272 3.895 1.00 0.00 H new ATOM 0 HB ILE A 15 -8.610 -4.523 5.852 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -6.517 -3.193 4.106 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -6.837 -2.765 5.775 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.772 -5.968 4.048 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -9.477 -5.519 3.809 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -8.205 -4.721 2.855 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.944 -4.352 5.625 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -6.311 -5.095 6.487 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.986 -5.530 4.792 1.00 0.00 H new ATOM 182 N LEU A 16 -10.824 -2.837 2.792 1.00 0.00 N ATOM 183 CA LEU A 16 -12.051 -3.152 2.081 1.00 0.00 C ATOM 184 C LEU A 16 -11.829 -4.395 1.216 1.00 0.00 C ATOM 185 O LEU A 16 -12.705 -5.253 1.120 1.00 0.00 O ATOM 186 CB LEU A 16 -12.542 -1.935 1.294 1.00 0.00 C ATOM 187 CG LEU A 16 -12.372 -0.579 1.981 1.00 0.00 C ATOM 188 CD1 LEU A 16 -12.822 0.561 1.065 1.00 0.00 C ATOM 189 CD2 LEU A 16 -13.097 -0.552 3.328 1.00 0.00 C ATOM 0 H LEU A 16 -10.178 -2.235 2.282 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.849 -3.391 2.785 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -12.013 -1.906 0.341 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.599 -2.076 1.068 1.00 0.00 H new ATOM 0 HG LEU A 16 -11.311 -0.430 2.183 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -12.690 1.514 1.578 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -12.223 0.554 0.154 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -13.873 0.429 0.809 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -12.960 0.423 3.795 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -14.160 -0.734 3.173 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -12.688 -1.326 3.977 1.00 0.00 H new ATOM 201 N ALA A 17 -10.653 -4.452 0.609 1.00 0.00 N ATOM 202 CA ALA A 17 -10.305 -5.575 -0.245 1.00 0.00 C ATOM 203 C ALA A 17 -8.821 -5.901 -0.071 1.00 0.00 C ATOM 204 O ALA A 17 -8.024 -5.026 0.262 1.00 0.00 O ATOM 205 CB ALA A 17 -10.664 -5.245 -1.695 1.00 0.00 C ATOM 0 H ALA A 17 -9.929 -3.739 0.692 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.873 -6.462 0.037 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -10.403 -6.088 -2.335 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -11.734 -5.050 -1.770 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.111 -4.361 -2.015 1.00 0.00 H new ATOM 211 N THR A 18 -8.494 -7.164 -0.305 1.00 0.00 N ATOM 212 CA THR A 18 -7.119 -7.617 -0.179 1.00 0.00 C ATOM 213 C THR A 18 -6.728 -8.476 -1.382 1.00 0.00 C ATOM 214 O THR A 18 -7.513 -9.305 -1.840 1.00 0.00 O ATOM 215 CB THR A 18 -6.982 -8.346 1.159 1.00 0.00 C ATOM 216 OG1 THR A 18 -7.715 -9.554 0.972 1.00 0.00 O ATOM 217 CG2 THR A 18 -7.721 -7.633 2.293 1.00 0.00 C ATOM 0 H THR A 18 -9.158 -7.888 -0.581 1.00 0.00 H new ATOM 0 HA THR A 18 -6.424 -6.777 -0.180 1.00 0.00 H new ATOM 0 HB THR A 18 -5.927 -8.438 1.416 1.00 0.00 H new ATOM 0 HG1 THR A 18 -7.677 -10.090 1.792 1.00 0.00 H new ATOM 0 HG21 THR A 18 -7.591 -8.192 3.220 1.00 0.00 H new ATOM 0 HG22 THR A 18 -7.317 -6.628 2.416 1.00 0.00 H new ATOM 0 HG23 THR A 18 -8.782 -7.570 2.053 1.00 0.00 H new ATOM 225 N PHE A 19 -5.513 -8.250 -1.861 1.00 0.00 N ATOM 226 CA PHE A 19 -5.008 -8.993 -3.003 1.00 0.00 C ATOM 227 C PHE A 19 -3.483 -8.903 -3.085 1.00 0.00 C ATOM 228 O PHE A 19 -2.852 -8.238 -2.265 1.00 0.00 O ATOM 229 CB PHE A 19 -5.613 -8.355 -4.255 1.00 0.00 C ATOM 230 CG PHE A 19 -5.248 -6.881 -4.441 1.00 0.00 C ATOM 231 CD1 PHE A 19 -3.968 -6.529 -4.737 1.00 0.00 C ATOM 232 CD2 PHE A 19 -6.203 -5.922 -4.310 1.00 0.00 C ATOM 233 CE1 PHE A 19 -3.629 -5.161 -4.909 1.00 0.00 C ATOM 234 CE2 PHE A 19 -5.865 -4.554 -4.483 1.00 0.00 C ATOM 235 CZ PHE A 19 -4.584 -4.202 -4.778 1.00 0.00 C ATOM 0 H PHE A 19 -4.864 -7.563 -1.479 1.00 0.00 H new ATOM 0 HA PHE A 19 -5.278 -10.045 -2.911 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -5.283 -8.914 -5.131 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -6.698 -8.447 -4.209 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -3.209 -7.290 -4.841 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -7.219 -6.201 -4.074 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -2.612 -4.882 -5.144 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -6.624 -3.793 -4.381 1.00 0.00 H new ATOM 0 HZ PHE A 19 -4.326 -3.161 -4.908 1.00 0.00 H new ATOM 245 N THR A 20 -2.935 -9.581 -4.083 1.00 0.00 N ATOM 246 CA THR A 20 -1.496 -9.586 -4.283 1.00 0.00 C ATOM 247 C THR A 20 -1.141 -8.929 -5.618 1.00 0.00 C ATOM 248 O THR A 20 -2.000 -8.770 -6.484 1.00 0.00 O ATOM 249 CB THR A 20 -1.007 -11.031 -4.167 1.00 0.00 C ATOM 250 OG1 THR A 20 -1.826 -11.594 -3.146 1.00 0.00 O ATOM 251 CG2 THR A 20 0.412 -11.126 -3.602 1.00 0.00 C ATOM 0 H THR A 20 -3.462 -10.131 -4.762 1.00 0.00 H new ATOM 0 HA THR A 20 -0.989 -8.995 -3.521 1.00 0.00 H new ATOM 0 HB THR A 20 -1.039 -11.504 -5.148 1.00 0.00 H new ATOM 0 HG1 THR A 20 -1.577 -12.532 -3.007 1.00 0.00 H new ATOM 0 HG21 THR A 20 0.710 -12.173 -3.541 1.00 0.00 H new ATOM 0 HG22 THR A 20 1.101 -10.591 -4.256 1.00 0.00 H new ATOM 0 HG23 THR A 20 0.438 -10.682 -2.607 1.00 0.00 H new ATOM 259 N VAL A 21 0.127 -8.565 -5.743 1.00 0.00 N ATOM 260 CA VAL A 21 0.606 -7.929 -6.959 1.00 0.00 C ATOM 261 C VAL A 21 1.873 -8.641 -7.437 1.00 0.00 C ATOM 262 O VAL A 21 2.520 -9.349 -6.666 1.00 0.00 O ATOM 263 CB VAL A 21 0.817 -6.432 -6.718 1.00 0.00 C ATOM 264 CG1 VAL A 21 -0.516 -5.682 -6.735 1.00 0.00 C ATOM 265 CG2 VAL A 21 1.567 -6.188 -5.408 1.00 0.00 C ATOM 0 H VAL A 21 0.837 -8.698 -5.023 1.00 0.00 H new ATOM 0 HA VAL A 21 -0.135 -8.016 -7.753 1.00 0.00 H new ATOM 0 HB VAL A 21 1.430 -6.044 -7.531 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -0.339 -4.621 -6.561 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -0.996 -5.816 -7.704 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -1.164 -6.074 -5.951 1.00 0.00 H new ATOM 0 HG21 VAL A 21 1.704 -5.117 -5.261 1.00 0.00 H new ATOM 0 HG22 VAL A 21 0.992 -6.598 -4.578 1.00 0.00 H new ATOM 0 HG23 VAL A 21 2.541 -6.676 -5.450 1.00 0.00 H new ATOM 275 N THR A 22 2.190 -8.430 -8.706 1.00 0.00 N ATOM 276 CA THR A 22 3.367 -9.044 -9.296 1.00 0.00 C ATOM 277 C THR A 22 4.314 -7.970 -9.836 1.00 0.00 C ATOM 278 O THR A 22 3.873 -7.005 -10.459 1.00 0.00 O ATOM 279 CB THR A 22 2.900 -10.034 -10.363 1.00 0.00 C ATOM 280 OG1 THR A 22 1.899 -10.807 -9.706 1.00 0.00 O ATOM 281 CG2 THR A 22 3.979 -11.056 -10.728 1.00 0.00 C ATOM 0 H THR A 22 1.652 -7.842 -9.342 1.00 0.00 H new ATOM 0 HA THR A 22 3.941 -9.595 -8.551 1.00 0.00 H new ATOM 0 HB THR A 22 2.601 -9.487 -11.257 1.00 0.00 H new ATOM 0 HG1 THR A 22 1.540 -11.474 -10.328 1.00 0.00 H new ATOM 0 HG21 THR A 22 3.595 -11.735 -11.490 1.00 0.00 H new ATOM 0 HG22 THR A 22 4.856 -10.537 -11.114 1.00 0.00 H new ATOM 0 HG23 THR A 22 4.256 -11.626 -9.841 1.00 0.00 H new ATOM 289 N GLU A 23 5.597 -8.173 -9.577 1.00 0.00 N ATOM 290 CA GLU A 23 6.610 -7.235 -10.029 1.00 0.00 C ATOM 291 C GLU A 23 7.830 -7.987 -10.564 1.00 0.00 C ATOM 292 O GLU A 23 8.673 -8.439 -9.790 1.00 0.00 O ATOM 293 CB GLU A 23 7.007 -6.273 -8.908 1.00 0.00 C ATOM 294 CG GLU A 23 5.802 -5.458 -8.433 1.00 0.00 C ATOM 295 CD GLU A 23 6.085 -3.957 -8.525 1.00 0.00 C ATOM 296 OE1 GLU A 23 6.568 -3.535 -9.598 1.00 0.00 O ATOM 297 OE2 GLU A 23 5.813 -3.265 -7.520 1.00 0.00 O ATOM 0 H GLU A 23 5.959 -8.974 -9.059 1.00 0.00 H new ATOM 0 HA GLU A 23 6.190 -6.641 -10.840 1.00 0.00 H new ATOM 0 HB2 GLU A 23 7.423 -6.835 -8.072 1.00 0.00 H new ATOM 0 HB3 GLU A 23 7.789 -5.601 -9.261 1.00 0.00 H new ATOM 0 HG2 GLU A 23 4.930 -5.705 -9.038 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.561 -5.724 -7.404 1.00 0.00 H new ATOM 304 N GLY A 24 7.886 -8.099 -11.883 1.00 0.00 N ATOM 305 CA GLY A 24 8.989 -8.789 -12.530 1.00 0.00 C ATOM 306 C GLY A 24 8.764 -10.302 -12.531 1.00 0.00 C ATOM 307 O GLY A 24 8.861 -10.947 -13.575 1.00 0.00 O ATOM 0 H GLY A 24 7.185 -7.723 -12.522 1.00 0.00 H new ATOM 0 HA2 GLY A 24 9.095 -8.433 -13.555 1.00 0.00 H new ATOM 0 HA3 GLY A 24 9.921 -8.557 -12.014 1.00 0.00 H new ATOM 311 N LYS A 25 8.466 -10.825 -11.351 1.00 0.00 N ATOM 312 CA LYS A 25 8.226 -12.251 -11.203 1.00 0.00 C ATOM 313 C LYS A 25 7.680 -12.529 -9.802 1.00 0.00 C ATOM 314 O LYS A 25 6.732 -13.297 -9.642 1.00 0.00 O ATOM 315 CB LYS A 25 9.490 -13.045 -11.539 1.00 0.00 C ATOM 316 CG LYS A 25 9.173 -14.209 -12.480 1.00 0.00 C ATOM 317 CD LYS A 25 10.374 -14.538 -13.369 1.00 0.00 C ATOM 318 CE LYS A 25 9.922 -14.928 -14.778 1.00 0.00 C ATOM 319 NZ LYS A 25 10.831 -15.946 -15.350 1.00 0.00 N ATOM 0 H LYS A 25 8.385 -10.287 -10.488 1.00 0.00 H new ATOM 0 HA LYS A 25 7.469 -12.585 -11.913 1.00 0.00 H new ATOM 0 HB2 LYS A 25 10.224 -12.387 -12.004 1.00 0.00 H new ATOM 0 HB3 LYS A 25 9.939 -13.426 -10.622 1.00 0.00 H new ATOM 0 HG2 LYS A 25 8.896 -15.087 -11.897 1.00 0.00 H new ATOM 0 HG3 LYS A 25 8.314 -13.955 -13.102 1.00 0.00 H new ATOM 0 HD2 LYS A 25 11.039 -13.676 -13.422 1.00 0.00 H new ATOM 0 HD3 LYS A 25 10.945 -15.354 -12.927 1.00 0.00 H new ATOM 0 HE2 LYS A 25 8.905 -15.318 -14.745 1.00 0.00 H new ATOM 0 HE3 LYS A 25 9.905 -14.046 -15.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 10.510 -16.200 -16.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.796 -15.561 -15.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 10.826 -16.793 -14.747 1.00 0.00 H new ATOM 333 N LYS A 26 8.301 -11.890 -8.821 1.00 0.00 N ATOM 334 CA LYS A 26 7.889 -12.059 -7.438 1.00 0.00 C ATOM 335 C LYS A 26 6.454 -11.554 -7.273 1.00 0.00 C ATOM 336 O LYS A 26 5.945 -10.829 -8.127 1.00 0.00 O ATOM 337 CB LYS A 26 8.889 -11.387 -6.495 1.00 0.00 C ATOM 338 CG LYS A 26 9.220 -12.296 -5.310 1.00 0.00 C ATOM 339 CD LYS A 26 8.962 -11.582 -3.982 1.00 0.00 C ATOM 340 CE LYS A 26 10.039 -10.529 -3.708 1.00 0.00 C ATOM 341 NZ LYS A 26 10.736 -10.820 -2.435 1.00 0.00 N ATOM 0 H LYS A 26 9.087 -11.254 -8.957 1.00 0.00 H new ATOM 0 HA LYS A 26 7.890 -13.115 -7.167 1.00 0.00 H new ATOM 0 HB2 LYS A 26 9.802 -11.146 -7.039 1.00 0.00 H new ATOM 0 HB3 LYS A 26 8.476 -10.446 -6.132 1.00 0.00 H new ATOM 0 HG2 LYS A 26 8.617 -13.202 -5.363 1.00 0.00 H new ATOM 0 HG3 LYS A 26 10.264 -12.604 -5.364 1.00 0.00 H new ATOM 0 HD2 LYS A 26 7.981 -11.107 -4.005 1.00 0.00 H new ATOM 0 HD3 LYS A 26 8.945 -12.310 -3.171 1.00 0.00 H new ATOM 0 HE2 LYS A 26 10.757 -10.513 -4.528 1.00 0.00 H new ATOM 0 HE3 LYS A 26 9.585 -9.539 -3.663 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.463 -10.096 -2.264 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 10.050 -10.812 -1.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.186 -11.756 -2.491 1.00 0.00 H new ATOM 355 N LYS A 27 5.842 -11.958 -6.170 1.00 0.00 N ATOM 356 CA LYS A 27 4.476 -11.556 -5.882 1.00 0.00 C ATOM 357 C LYS A 27 4.428 -10.870 -4.515 1.00 0.00 C ATOM 358 O LYS A 27 4.551 -11.527 -3.482 1.00 0.00 O ATOM 359 CB LYS A 27 3.528 -12.751 -6.004 1.00 0.00 C ATOM 360 CG LYS A 27 4.060 -13.954 -5.222 1.00 0.00 C ATOM 361 CD LYS A 27 2.967 -14.563 -4.341 1.00 0.00 C ATOM 362 CE LYS A 27 3.353 -14.494 -2.862 1.00 0.00 C ATOM 363 NZ LYS A 27 2.142 -14.491 -2.011 1.00 0.00 N ATOM 0 H LYS A 27 6.267 -12.560 -5.465 1.00 0.00 H new ATOM 0 HA LYS A 27 4.131 -10.829 -6.617 1.00 0.00 H new ATOM 0 HB2 LYS A 27 2.541 -12.477 -5.630 1.00 0.00 H new ATOM 0 HB3 LYS A 27 3.408 -13.019 -7.054 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.434 -14.707 -5.916 1.00 0.00 H new ATOM 0 HG3 LYS A 27 4.902 -13.646 -4.602 1.00 0.00 H new ATOM 0 HD2 LYS A 27 2.028 -14.032 -4.501 1.00 0.00 H new ATOM 0 HD3 LYS A 27 2.799 -15.601 -4.629 1.00 0.00 H new ATOM 0 HE2 LYS A 27 3.984 -15.345 -2.604 1.00 0.00 H new ATOM 0 HE3 LYS A 27 3.939 -13.594 -2.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 2.422 -14.478 -1.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 1.571 -13.648 -2.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 1.581 -15.345 -2.203 1.00 0.00 H new ATOM 377 N ILE A 28 4.248 -9.558 -4.553 1.00 0.00 N ATOM 378 CA ILE A 28 4.182 -8.776 -3.330 1.00 0.00 C ATOM 379 C ILE A 28 2.721 -8.631 -2.900 1.00 0.00 C ATOM 380 O ILE A 28 1.851 -8.363 -3.727 1.00 0.00 O ATOM 381 CB ILE A 28 4.906 -7.440 -3.508 1.00 0.00 C ATOM 382 CG1 ILE A 28 6.271 -7.640 -4.172 1.00 0.00 C ATOM 383 CG2 ILE A 28 5.020 -6.696 -2.176 1.00 0.00 C ATOM 384 CD1 ILE A 28 6.149 -7.603 -5.696 1.00 0.00 C ATOM 0 H ILE A 28 4.146 -9.017 -5.411 1.00 0.00 H new ATOM 0 HA ILE A 28 4.703 -9.289 -2.522 1.00 0.00 H new ATOM 0 HB ILE A 28 4.312 -6.816 -4.175 1.00 0.00 H new ATOM 0 HG12 ILE A 28 6.959 -6.862 -3.840 1.00 0.00 H new ATOM 0 HG13 ILE A 28 6.695 -8.595 -3.860 1.00 0.00 H new ATOM 0 HG21 ILE A 28 5.539 -5.750 -2.331 1.00 0.00 H new ATOM 0 HG22 ILE A 28 4.023 -6.503 -1.781 1.00 0.00 H new ATOM 0 HG23 ILE A 28 5.580 -7.305 -1.466 1.00 0.00 H new ATOM 0 HD11 ILE A 28 7.132 -7.747 -6.143 1.00 0.00 H new ATOM 0 HD12 ILE A 28 5.480 -8.397 -6.027 1.00 0.00 H new ATOM 0 HD13 ILE A 28 5.748 -6.638 -6.006 1.00 0.00 H new ATOM 396 N PRO A 29 2.491 -8.819 -1.573 1.00 0.00 N ATOM 397 CA PRO A 29 1.150 -8.711 -1.024 1.00 0.00 C ATOM 398 C PRO A 29 0.712 -7.248 -0.928 1.00 0.00 C ATOM 399 O PRO A 29 1.536 -6.363 -0.705 1.00 0.00 O ATOM 400 CB PRO A 29 1.223 -9.399 0.330 1.00 0.00 C ATOM 401 CG PRO A 29 2.698 -9.455 0.690 1.00 0.00 C ATOM 402 CD PRO A 29 3.497 -9.137 -0.564 1.00 0.00 C ATOM 0 HA PRO A 29 0.398 -9.183 -1.656 1.00 0.00 H new ATOM 0 HB2 PRO A 29 0.659 -8.845 1.080 1.00 0.00 H new ATOM 0 HB3 PRO A 29 0.794 -10.400 0.283 1.00 0.00 H new ATOM 0 HG2 PRO A 29 2.926 -8.739 1.479 1.00 0.00 H new ATOM 0 HG3 PRO A 29 2.961 -10.442 1.070 1.00 0.00 H new ATOM 0 HD2 PRO A 29 4.173 -8.298 -0.401 1.00 0.00 H new ATOM 0 HD3 PRO A 29 4.110 -9.985 -0.869 1.00 0.00 H new ATOM 410 N VAL A 30 -0.585 -7.040 -1.102 1.00 0.00 N ATOM 411 CA VAL A 30 -1.142 -5.699 -1.038 1.00 0.00 C ATOM 412 C VAL A 30 -2.518 -5.755 -0.370 1.00 0.00 C ATOM 413 O VAL A 30 -3.175 -6.795 -0.379 1.00 0.00 O ATOM 414 CB VAL A 30 -1.182 -5.082 -2.437 1.00 0.00 C ATOM 415 CG1 VAL A 30 -2.009 -3.794 -2.445 1.00 0.00 C ATOM 416 CG2 VAL A 30 0.232 -4.829 -2.965 1.00 0.00 C ATOM 0 H VAL A 30 -1.266 -7.777 -1.287 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.511 -5.051 -0.430 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.666 -5.795 -3.104 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.021 -3.376 -3.451 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -3.029 -4.015 -2.131 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -1.566 -3.073 -1.758 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.175 -4.390 -3.961 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.753 -4.144 -2.296 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.776 -5.772 -3.015 1.00 0.00 H new ATOM 426 N ALA A 31 -2.913 -4.623 0.194 1.00 0.00 N ATOM 427 CA ALA A 31 -4.198 -4.530 0.865 1.00 0.00 C ATOM 428 C ALA A 31 -4.827 -3.167 0.567 1.00 0.00 C ATOM 429 O ALA A 31 -4.294 -2.133 0.965 1.00 0.00 O ATOM 430 CB ALA A 31 -4.010 -4.769 2.364 1.00 0.00 C ATOM 0 H ALA A 31 -2.365 -3.762 0.200 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.880 -5.296 0.495 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -4.974 -4.699 2.867 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -3.588 -5.761 2.524 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -3.333 -4.017 2.770 1.00 0.00 H new ATOM 436 N ASP A 32 -5.951 -3.210 -0.132 1.00 0.00 N ATOM 437 CA ASP A 32 -6.658 -1.992 -0.489 1.00 0.00 C ATOM 438 C ASP A 32 -7.530 -1.550 0.688 1.00 0.00 C ATOM 439 O ASP A 32 -8.594 -2.121 0.925 1.00 0.00 O ATOM 440 CB ASP A 32 -7.572 -2.218 -1.695 1.00 0.00 C ATOM 441 CG ASP A 32 -6.974 -1.811 -3.044 1.00 0.00 C ATOM 442 OD1 ASP A 32 -5.732 -1.894 -3.162 1.00 0.00 O ATOM 443 OD2 ASP A 32 -7.772 -1.427 -3.926 1.00 0.00 O ATOM 0 H ASP A 32 -6.390 -4.070 -0.461 1.00 0.00 H new ATOM 0 HA ASP A 32 -5.916 -1.232 -0.736 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.839 -3.274 -1.737 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.496 -1.661 -1.541 1.00 0.00 H new ATOM 448 N CYS A 33 -7.048 -0.539 1.394 1.00 0.00 N ATOM 449 CA CYS A 33 -7.770 -0.014 2.541 1.00 0.00 C ATOM 450 C CYS A 33 -8.232 1.406 2.209 1.00 0.00 C ATOM 451 O CYS A 33 -7.735 2.020 1.266 1.00 0.00 O ATOM 452 CB CYS A 33 -6.920 -0.056 3.812 1.00 0.00 C ATOM 453 SG CYS A 33 -5.304 0.749 3.511 1.00 0.00 S ATOM 0 H CYS A 33 -6.165 -0.068 1.194 1.00 0.00 H new ATOM 0 HA CYS A 33 -8.639 -0.639 2.744 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -7.441 0.449 4.625 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -6.768 -1.089 4.124 1.00 0.00 H new ATOM 0 HG CYS A 33 -4.678 0.900 4.640 1.00 0.00 H new ATOM 459 N ARG A 34 -9.177 1.887 3.003 1.00 0.00 N ATOM 460 CA ARG A 34 -9.712 3.224 2.806 1.00 0.00 C ATOM 461 C ARG A 34 -9.615 4.031 4.102 1.00 0.00 C ATOM 462 O ARG A 34 -10.167 3.635 5.127 1.00 0.00 O ATOM 463 CB ARG A 34 -11.172 3.171 2.353 1.00 0.00 C ATOM 464 CG ARG A 34 -11.560 4.447 1.602 1.00 0.00 C ATOM 465 CD ARG A 34 -12.782 5.109 2.240 1.00 0.00 C ATOM 466 NE ARG A 34 -13.662 5.668 1.188 1.00 0.00 N ATOM 467 CZ ARG A 34 -14.446 4.927 0.393 1.00 0.00 C ATOM 468 NH1 ARG A 34 -14.464 3.593 0.525 1.00 0.00 N ATOM 469 NH2 ARG A 34 -15.211 5.519 -0.534 1.00 0.00 N ATOM 0 H ARG A 34 -9.586 1.375 3.784 1.00 0.00 H new ATOM 0 HA ARG A 34 -9.120 3.707 2.029 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -11.325 2.305 1.709 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -11.821 3.043 3.219 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -10.722 5.144 1.605 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -11.774 4.209 0.560 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -13.331 4.380 2.836 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -12.464 5.901 2.919 1.00 0.00 H new ATOM 0 HE ARG A 34 -13.672 6.680 1.061 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -13.881 3.142 1.230 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -15.061 3.029 -0.080 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -15.197 6.534 -0.635 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -15.808 4.955 -1.139 1.00 0.00 H new ATOM 483 N VAL A 35 -8.908 5.149 4.013 1.00 0.00 N ATOM 484 CA VAL A 35 -8.732 6.015 5.166 1.00 0.00 C ATOM 485 C VAL A 35 -10.099 6.520 5.634 1.00 0.00 C ATOM 486 O VAL A 35 -10.723 7.341 4.964 1.00 0.00 O ATOM 487 CB VAL A 35 -7.761 7.148 4.826 1.00 0.00 C ATOM 488 CG1 VAL A 35 -7.648 8.140 5.985 1.00 0.00 C ATOM 489 CG2 VAL A 35 -6.387 6.595 4.442 1.00 0.00 C ATOM 0 H VAL A 35 -8.451 5.474 3.161 1.00 0.00 H new ATOM 0 HA VAL A 35 -8.289 5.462 5.994 1.00 0.00 H new ATOM 0 HB VAL A 35 -8.160 7.684 3.965 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.952 8.935 5.717 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -8.628 8.570 6.192 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.284 7.623 6.873 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -5.716 7.421 4.205 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -5.979 6.023 5.276 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -6.486 5.947 3.571 1.00 0.00 H new ATOM 499 N GLN A 36 -10.523 6.007 6.779 1.00 0.00 N ATOM 500 CA GLN A 36 -11.804 6.395 7.344 1.00 0.00 C ATOM 501 C GLN A 36 -11.646 7.650 8.206 1.00 0.00 C ATOM 502 O GLN A 36 -12.490 8.543 8.169 1.00 0.00 O ATOM 503 CB GLN A 36 -12.418 5.249 8.151 1.00 0.00 C ATOM 504 CG GLN A 36 -12.733 4.053 7.251 1.00 0.00 C ATOM 505 CD GLN A 36 -14.237 3.943 6.992 1.00 0.00 C ATOM 506 OE1 GLN A 36 -15.057 4.507 7.697 1.00 0.00 O ATOM 507 NE2 GLN A 36 -14.552 3.188 5.944 1.00 0.00 N ATOM 0 H GLN A 36 -10.002 5.326 7.331 1.00 0.00 H new ATOM 0 HA GLN A 36 -12.486 6.624 6.525 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -11.729 4.944 8.939 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -13.330 5.591 8.640 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -12.204 4.157 6.304 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -12.373 3.137 7.719 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -13.816 2.744 5.396 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -15.530 3.053 5.688 1.00 0.00 H new ATOM 516 N LYS A 37 -10.559 7.676 8.962 1.00 0.00 N ATOM 517 CA LYS A 37 -10.279 8.806 9.832 1.00 0.00 C ATOM 518 C LYS A 37 -8.789 9.144 9.759 1.00 0.00 C ATOM 519 O LYS A 37 -7.946 8.248 9.735 1.00 0.00 O ATOM 520 CB LYS A 37 -10.777 8.526 11.251 1.00 0.00 C ATOM 521 CG LYS A 37 -12.302 8.625 11.327 1.00 0.00 C ATOM 522 CD LYS A 37 -12.909 7.331 11.871 1.00 0.00 C ATOM 523 CE LYS A 37 -14.425 7.461 12.032 1.00 0.00 C ATOM 524 NZ LYS A 37 -14.764 7.922 13.397 1.00 0.00 N ATOM 0 H LYS A 37 -9.861 6.933 8.990 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.823 9.689 9.496 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.458 7.531 11.563 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.328 9.237 11.945 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -12.584 9.461 11.968 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.706 8.832 10.336 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -12.681 6.506 11.196 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -12.457 7.090 12.833 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -14.816 8.165 11.297 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -14.901 6.500 11.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -15.797 8.005 13.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -14.408 7.236 14.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -14.326 8.849 13.569 1.00 0.00 H new ATOM 538 N GLY A 38 -8.509 10.439 9.725 1.00 0.00 N ATOM 539 CA GLY A 38 -7.135 10.906 9.655 1.00 0.00 C ATOM 540 C GLY A 38 -6.543 10.662 8.265 1.00 0.00 C ATOM 541 O GLY A 38 -7.261 10.689 7.267 1.00 0.00 O ATOM 0 H GLY A 38 -9.211 11.179 9.745 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -7.096 11.970 9.889 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.534 10.393 10.405 1.00 0.00 H new ATOM 545 N GLN A 39 -5.239 10.428 8.246 1.00 0.00 N ATOM 546 CA GLN A 39 -4.542 10.179 6.995 1.00 0.00 C ATOM 547 C GLN A 39 -3.397 9.188 7.214 1.00 0.00 C ATOM 548 O GLN A 39 -3.088 8.833 8.350 1.00 0.00 O ATOM 549 CB GLN A 39 -4.029 11.484 6.384 1.00 0.00 C ATOM 550 CG GLN A 39 -3.314 12.338 7.434 1.00 0.00 C ATOM 551 CD GLN A 39 -2.991 13.728 6.883 1.00 0.00 C ATOM 552 OE1 GLN A 39 -3.851 14.453 6.411 1.00 0.00 O ATOM 553 NE2 GLN A 39 -1.705 14.058 6.970 1.00 0.00 N ATOM 0 H GLN A 39 -4.647 10.406 9.076 1.00 0.00 H new ATOM 0 HA GLN A 39 -5.247 9.739 6.290 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -3.346 11.262 5.564 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -4.863 12.044 5.961 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -3.941 12.431 8.321 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -2.394 11.843 7.745 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -1.037 13.403 7.377 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -1.387 14.966 6.630 1.00 0.00 H new ATOM 562 N LEU A 40 -2.799 8.770 6.108 1.00 0.00 N ATOM 563 CA LEU A 40 -1.695 7.828 6.164 1.00 0.00 C ATOM 564 C LEU A 40 -0.435 8.491 5.604 1.00 0.00 C ATOM 565 O LEU A 40 -0.436 8.981 4.476 1.00 0.00 O ATOM 566 CB LEU A 40 -2.068 6.522 5.459 1.00 0.00 C ATOM 567 CG LEU A 40 -3.342 5.833 5.954 1.00 0.00 C ATOM 568 CD1 LEU A 40 -3.619 4.556 5.159 1.00 0.00 C ATOM 569 CD2 LEU A 40 -3.272 5.567 7.459 1.00 0.00 C ATOM 0 H LEU A 40 -3.059 9.067 5.167 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.480 7.555 7.197 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -2.179 6.726 4.394 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.237 5.825 5.565 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.182 6.506 5.785 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.530 4.086 5.531 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.743 4.803 4.105 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.782 3.867 5.274 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.189 5.077 7.785 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.420 4.923 7.675 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.157 6.512 7.990 1.00 0.00 H new ATOM 581 N GLU A 41 0.611 8.484 6.418 1.00 0.00 N ATOM 582 CA GLU A 41 1.874 9.078 6.017 1.00 0.00 C ATOM 583 C GLU A 41 2.910 7.987 5.739 1.00 0.00 C ATOM 584 O GLU A 41 3.187 7.155 6.601 1.00 0.00 O ATOM 585 CB GLU A 41 2.381 10.056 7.079 1.00 0.00 C ATOM 586 CG GLU A 41 1.376 11.187 7.308 1.00 0.00 C ATOM 587 CD GLU A 41 0.568 10.953 8.586 1.00 0.00 C ATOM 588 OE1 GLU A 41 0.128 9.798 8.775 1.00 0.00 O ATOM 589 OE2 GLU A 41 0.409 11.933 9.344 1.00 0.00 O ATOM 0 H GLU A 41 0.609 8.076 7.353 1.00 0.00 H new ATOM 0 HA GLU A 41 1.712 9.641 5.098 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.555 9.524 8.015 1.00 0.00 H new ATOM 0 HB3 GLU A 41 3.338 10.473 6.767 1.00 0.00 H new ATOM 0 HG2 GLU A 41 1.903 12.138 7.376 1.00 0.00 H new ATOM 0 HG3 GLU A 41 0.701 11.257 6.455 1.00 0.00 H new ATOM 596 N ARG A 42 3.453 8.026 4.531 1.00 0.00 N ATOM 597 CA ARG A 42 4.452 7.050 4.128 1.00 0.00 C ATOM 598 C ARG A 42 5.768 7.302 4.866 1.00 0.00 C ATOM 599 O ARG A 42 6.722 7.817 4.284 1.00 0.00 O ATOM 600 CB ARG A 42 4.701 7.109 2.620 1.00 0.00 C ATOM 601 CG ARG A 42 4.108 5.885 1.918 1.00 0.00 C ATOM 602 CD ARG A 42 5.105 4.724 1.905 1.00 0.00 C ATOM 603 NE ARG A 42 6.314 5.103 1.141 1.00 0.00 N ATOM 604 CZ ARG A 42 7.425 5.607 1.694 1.00 0.00 C ATOM 605 NH1 ARG A 42 7.487 5.797 3.019 1.00 0.00 N ATOM 606 NH2 ARG A 42 8.474 5.922 0.923 1.00 0.00 N ATOM 0 H ARG A 42 3.220 8.718 3.818 1.00 0.00 H new ATOM 0 HA ARG A 42 4.072 6.061 4.384 1.00 0.00 H new ATOM 0 HB2 ARG A 42 4.259 8.017 2.210 1.00 0.00 H new ATOM 0 HB3 ARG A 42 5.772 7.160 2.426 1.00 0.00 H new ATOM 0 HG2 ARG A 42 3.193 5.578 2.425 1.00 0.00 H new ATOM 0 HG3 ARG A 42 3.834 6.145 0.896 1.00 0.00 H new ATOM 0 HD2 ARG A 42 5.379 4.458 2.926 1.00 0.00 H new ATOM 0 HD3 ARG A 42 4.644 3.843 1.458 1.00 0.00 H new ATOM 0 HE ARG A 42 6.301 4.972 0.130 1.00 0.00 H new ATOM 0 HH11 ARG A 42 6.688 5.558 3.606 1.00 0.00 H new ATOM 0 HH12 ARG A 42 8.333 6.181 3.440 1.00 0.00 H new ATOM 0 HH21 ARG A 42 8.427 5.778 -0.086 1.00 0.00 H new ATOM 0 HH22 ARG A 42 9.320 6.306 1.345 1.00 0.00 H new ATOM 620 N HIS A 43 5.778 6.928 6.137 1.00 0.00 N ATOM 621 CA HIS A 43 6.962 7.107 6.960 1.00 0.00 C ATOM 622 C HIS A 43 6.700 6.555 8.363 1.00 0.00 C ATOM 623 O HIS A 43 7.507 5.796 8.896 1.00 0.00 O ATOM 624 CB HIS A 43 7.399 8.573 6.972 1.00 0.00 C ATOM 625 CG HIS A 43 8.560 8.860 7.894 1.00 0.00 C ATOM 626 ND1 HIS A 43 9.717 8.100 7.901 1.00 0.00 N ATOM 627 CD2 HIS A 43 8.732 9.832 8.836 1.00 0.00 C ATOM 628 CE1 HIS A 43 10.540 8.600 8.811 1.00 0.00 C ATOM 629 NE2 HIS A 43 9.927 9.672 9.390 1.00 0.00 N ATOM 0 H HIS A 43 4.985 6.502 6.617 1.00 0.00 H new ATOM 0 HA HIS A 43 7.793 6.544 6.535 1.00 0.00 H new ATOM 0 HB2 HIS A 43 7.671 8.869 5.959 1.00 0.00 H new ATOM 0 HB3 HIS A 43 6.552 9.192 7.268 1.00 0.00 H new ATOM 0 HD2 HIS A 43 8.017 10.601 9.088 1.00 0.00 H new ATOM 0 HE1 HIS A 43 11.524 8.225 9.052 1.00 0.00 H new ATOM 0 HE2 HIS A 43 10.322 10.255 10.128 1.00 0.00 H new ATOM 637 N LYS A 44 5.567 6.957 8.920 1.00 0.00 N ATOM 638 CA LYS A 44 5.188 6.512 10.250 1.00 0.00 C ATOM 639 C LYS A 44 5.176 4.983 10.288 1.00 0.00 C ATOM 640 O LYS A 44 5.627 4.332 9.346 1.00 0.00 O ATOM 641 CB LYS A 44 3.861 7.148 10.670 1.00 0.00 C ATOM 642 CG LYS A 44 3.945 8.675 10.622 1.00 0.00 C ATOM 643 CD LYS A 44 4.491 9.236 11.937 1.00 0.00 C ATOM 644 CE LYS A 44 4.750 10.740 11.826 1.00 0.00 C ATOM 645 NZ LYS A 44 6.184 11.001 11.569 1.00 0.00 N ATOM 0 H LYS A 44 4.899 7.586 8.474 1.00 0.00 H new ATOM 0 HA LYS A 44 5.921 6.844 10.985 1.00 0.00 H new ATOM 0 HB2 LYS A 44 3.064 6.803 10.011 1.00 0.00 H new ATOM 0 HB3 LYS A 44 3.603 6.826 11.679 1.00 0.00 H new ATOM 0 HG2 LYS A 44 4.588 8.982 9.797 1.00 0.00 H new ATOM 0 HG3 LYS A 44 2.957 9.091 10.428 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.781 9.044 12.741 1.00 0.00 H new ATOM 0 HD3 LYS A 44 5.416 8.722 12.199 1.00 0.00 H new ATOM 0 HE2 LYS A 44 4.148 11.160 11.021 1.00 0.00 H new ATOM 0 HE3 LYS A 44 4.443 11.237 12.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 6.343 12.026 11.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 6.752 10.617 12.351 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 6.466 10.543 10.679 1.00 0.00 H new ATOM 659 N LYS A 45 4.655 4.454 11.385 1.00 0.00 N ATOM 660 CA LYS A 45 4.579 3.013 11.558 1.00 0.00 C ATOM 661 C LYS A 45 3.145 2.548 11.298 1.00 0.00 C ATOM 662 O LYS A 45 2.223 3.362 11.251 1.00 0.00 O ATOM 663 CB LYS A 45 5.117 2.608 12.931 1.00 0.00 C ATOM 664 CG LYS A 45 6.644 2.696 12.969 1.00 0.00 C ATOM 665 CD LYS A 45 7.259 1.370 13.422 1.00 0.00 C ATOM 666 CE LYS A 45 8.405 1.605 14.408 1.00 0.00 C ATOM 667 NZ LYS A 45 9.678 1.093 13.854 1.00 0.00 N ATOM 0 H LYS A 45 4.281 4.997 12.163 1.00 0.00 H new ATOM 0 HA LYS A 45 5.216 2.508 10.831 1.00 0.00 H new ATOM 0 HB2 LYS A 45 4.693 3.256 13.698 1.00 0.00 H new ATOM 0 HB3 LYS A 45 4.802 1.591 13.164 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.021 2.957 11.980 1.00 0.00 H new ATOM 0 HG3 LYS A 45 6.949 3.493 13.647 1.00 0.00 H new ATOM 0 HD2 LYS A 45 6.493 0.751 13.890 1.00 0.00 H new ATOM 0 HD3 LYS A 45 7.627 0.821 12.555 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.497 2.670 14.621 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.187 1.108 15.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.445 1.260 14.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.592 0.072 13.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 9.892 1.586 12.964 1.00 0.00 H new ATOM 681 N PHE A 46 3.000 1.241 11.136 1.00 0.00 N ATOM 682 CA PHE A 46 1.694 0.658 10.882 1.00 0.00 C ATOM 683 C PHE A 46 1.606 -0.760 11.449 1.00 0.00 C ATOM 684 O PHE A 46 2.615 -1.331 11.861 1.00 0.00 O ATOM 685 CB PHE A 46 1.517 0.599 9.364 1.00 0.00 C ATOM 686 CG PHE A 46 1.629 1.959 8.671 1.00 0.00 C ATOM 687 CD1 PHE A 46 2.839 2.572 8.567 1.00 0.00 C ATOM 688 CD2 PHE A 46 0.518 2.555 8.160 1.00 0.00 C ATOM 689 CE1 PHE A 46 2.942 3.833 7.924 1.00 0.00 C ATOM 690 CE2 PHE A 46 0.622 3.817 7.517 1.00 0.00 C ATOM 691 CZ PHE A 46 1.832 4.429 7.412 1.00 0.00 C ATOM 0 H PHE A 46 3.766 0.569 11.176 1.00 0.00 H new ATOM 0 HA PHE A 46 0.920 1.260 11.359 1.00 0.00 H new ATOM 0 HB2 PHE A 46 2.267 -0.073 8.947 1.00 0.00 H new ATOM 0 HB3 PHE A 46 0.542 0.167 9.139 1.00 0.00 H new ATOM 0 HD1 PHE A 46 3.721 2.099 8.974 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -0.443 2.069 8.243 1.00 0.00 H new ATOM 0 HE1 PHE A 46 3.903 4.320 7.841 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -0.260 4.291 7.111 1.00 0.00 H new ATOM 0 HZ PHE A 46 1.911 5.388 6.922 1.00 0.00 H new ATOM 701 N LYS A 47 0.391 -1.288 11.453 1.00 0.00 N ATOM 702 CA LYS A 47 0.159 -2.629 11.962 1.00 0.00 C ATOM 703 C LYS A 47 -1.200 -3.129 11.469 1.00 0.00 C ATOM 704 O LYS A 47 -2.108 -2.335 11.228 1.00 0.00 O ATOM 705 CB LYS A 47 0.310 -2.657 13.485 1.00 0.00 C ATOM 706 CG LYS A 47 -0.498 -1.533 14.136 1.00 0.00 C ATOM 707 CD LYS A 47 -0.950 -1.927 15.543 1.00 0.00 C ATOM 708 CE LYS A 47 -1.114 -0.693 16.433 1.00 0.00 C ATOM 709 NZ LYS A 47 -2.227 -0.888 17.389 1.00 0.00 N ATOM 0 H LYS A 47 -0.444 -0.811 11.112 1.00 0.00 H new ATOM 0 HA LYS A 47 0.911 -3.318 11.577 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -0.025 -3.620 13.870 1.00 0.00 H new ATOM 0 HB3 LYS A 47 1.362 -2.555 13.752 1.00 0.00 H new ATOM 0 HG2 LYS A 47 0.106 -0.627 14.185 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -1.368 -1.303 13.522 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.895 -2.467 15.487 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -0.221 -2.605 15.986 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -0.188 -0.504 16.977 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -1.306 0.185 15.816 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -2.325 -0.042 17.985 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -3.111 -1.046 16.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -2.028 -1.713 17.990 1.00 0.00 H new ATOM 723 N LEU A 48 -1.297 -4.444 11.334 1.00 0.00 N ATOM 724 CA LEU A 48 -2.531 -5.059 10.874 1.00 0.00 C ATOM 725 C LEU A 48 -3.250 -5.700 12.063 1.00 0.00 C ATOM 726 O LEU A 48 -2.686 -6.551 12.749 1.00 0.00 O ATOM 727 CB LEU A 48 -2.249 -6.033 9.729 1.00 0.00 C ATOM 728 CG LEU A 48 -3.476 -6.658 9.062 1.00 0.00 C ATOM 729 CD1 LEU A 48 -4.202 -5.637 8.184 1.00 0.00 C ATOM 730 CD2 LEU A 48 -3.094 -7.917 8.280 1.00 0.00 C ATOM 0 H LEU A 48 -0.542 -5.100 11.535 1.00 0.00 H new ATOM 0 HA LEU A 48 -3.203 -4.305 10.463 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.673 -5.509 8.966 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.618 -6.836 10.109 1.00 0.00 H new ATOM 0 HG LEU A 48 -4.171 -6.963 9.844 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -5.070 -6.107 7.722 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.528 -4.796 8.797 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -3.526 -5.279 7.407 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -3.984 -8.341 7.816 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -2.370 -7.660 7.507 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -2.655 -8.648 8.959 1.00 0.00 H new ATOM 742 N ILE A 49 -4.485 -5.266 12.270 1.00 0.00 N ATOM 743 CA ILE A 49 -5.287 -5.786 13.364 1.00 0.00 C ATOM 744 C ILE A 49 -6.378 -6.700 12.802 1.00 0.00 C ATOM 745 O ILE A 49 -7.186 -6.273 11.978 1.00 0.00 O ATOM 746 CB ILE A 49 -5.826 -4.642 14.225 1.00 0.00 C ATOM 747 CG1 ILE A 49 -4.686 -3.891 14.916 1.00 0.00 C ATOM 748 CG2 ILE A 49 -6.867 -5.151 15.225 1.00 0.00 C ATOM 749 CD1 ILE A 49 -3.779 -3.208 13.891 1.00 0.00 C ATOM 0 H ILE A 49 -4.949 -4.560 11.699 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.674 -6.393 14.030 1.00 0.00 H new ATOM 0 HB ILE A 49 -6.330 -3.931 13.571 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -5.097 -3.146 15.597 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -4.101 -4.586 15.519 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.234 -4.318 15.824 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -7.699 -5.604 14.685 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.411 -5.895 15.878 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -2.977 -2.681 14.408 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -3.351 -3.959 13.227 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -4.362 -2.496 13.306 1.00 0.00 H new ATOM 761 N ARG A 50 -6.366 -7.939 13.269 1.00 0.00 N ATOM 762 CA ARG A 50 -7.345 -8.916 12.822 1.00 0.00 C ATOM 763 C ARG A 50 -8.039 -9.559 14.024 1.00 0.00 C ATOM 764 O ARG A 50 -7.418 -10.305 14.779 1.00 0.00 O ATOM 765 CB ARG A 50 -6.686 -10.009 11.978 1.00 0.00 C ATOM 766 CG ARG A 50 -7.736 -10.947 11.378 1.00 0.00 C ATOM 767 CD ARG A 50 -7.087 -12.219 10.832 1.00 0.00 C ATOM 768 NE ARG A 50 -6.480 -11.950 9.509 1.00 0.00 N ATOM 769 CZ ARG A 50 -5.978 -12.898 8.705 1.00 0.00 C ATOM 770 NH1 ARG A 50 -6.008 -14.182 9.085 1.00 0.00 N ATOM 771 NH2 ARG A 50 -5.447 -12.561 7.522 1.00 0.00 N ATOM 0 H ARG A 50 -5.694 -8.289 13.952 1.00 0.00 H new ATOM 0 HA ARG A 50 -8.080 -8.393 12.210 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -6.101 -9.553 11.179 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -5.992 -10.581 12.594 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -8.472 -11.208 12.138 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -8.271 -10.435 10.578 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -6.325 -12.575 11.525 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -7.833 -13.009 10.745 1.00 0.00 H new ATOM 0 HE ARG A 50 -6.441 -10.982 9.189 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -6.413 -14.438 9.986 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -5.626 -14.904 8.474 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.425 -11.583 7.233 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -5.065 -13.282 6.910 1.00 0.00 H new ATOM 785 N ASN A 51 -9.319 -9.247 14.165 1.00 0.00 N ATOM 786 CA ASN A 51 -10.105 -9.784 15.262 1.00 0.00 C ATOM 787 C ASN A 51 -9.801 -8.995 16.537 1.00 0.00 C ATOM 788 O ASN A 51 -10.367 -9.272 17.593 1.00 0.00 O ATOM 789 CB ASN A 51 -9.758 -11.252 15.520 1.00 0.00 C ATOM 790 CG ASN A 51 -10.965 -12.011 16.076 1.00 0.00 C ATOM 791 OD1 ASN A 51 -12.030 -11.459 16.298 1.00 0.00 O ATOM 792 ND2 ASN A 51 -10.740 -13.304 16.288 1.00 0.00 N ATOM 0 H ASN A 51 -9.832 -8.628 13.537 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.158 -9.704 14.993 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -9.426 -11.719 14.593 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -8.928 -11.315 16.224 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -11.483 -13.897 16.658 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -9.825 -13.703 16.081 1.00 0.00 H new ATOM 799 N GLY A 52 -8.907 -8.027 16.396 1.00 0.00 N ATOM 800 CA GLY A 52 -8.520 -7.196 17.523 1.00 0.00 C ATOM 801 C GLY A 52 -7.056 -7.430 17.900 1.00 0.00 C ATOM 802 O GLY A 52 -6.476 -6.659 18.663 1.00 0.00 O ATOM 0 H GLY A 52 -8.440 -7.800 15.518 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.672 -6.146 17.274 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.159 -7.416 18.378 1.00 0.00 H new ATOM 806 N GLN A 53 -6.500 -8.499 17.349 1.00 0.00 N ATOM 807 CA GLN A 53 -5.114 -8.845 17.618 1.00 0.00 C ATOM 808 C GLN A 53 -4.217 -8.376 16.470 1.00 0.00 C ATOM 809 O GLN A 53 -4.644 -8.346 15.317 1.00 0.00 O ATOM 810 CB GLN A 53 -4.960 -10.348 17.854 1.00 0.00 C ATOM 811 CG GLN A 53 -4.829 -11.102 16.529 1.00 0.00 C ATOM 812 CD GLN A 53 -5.155 -12.586 16.707 1.00 0.00 C ATOM 813 OE1 GLN A 53 -6.304 -12.994 16.750 1.00 0.00 O ATOM 814 NE2 GLN A 53 -4.084 -13.367 16.809 1.00 0.00 N ATOM 0 H GLN A 53 -6.984 -9.137 16.717 1.00 0.00 H new ATOM 0 HA GLN A 53 -4.803 -8.334 18.529 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -4.081 -10.534 18.471 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -5.822 -10.723 18.406 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -5.500 -10.665 15.790 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -3.816 -10.993 16.143 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -3.150 -12.960 16.765 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -4.196 -14.373 16.931 1.00 0.00 H new ATOM 823 N VAL A 54 -2.991 -8.021 16.826 1.00 0.00 N ATOM 824 CA VAL A 54 -2.031 -7.556 15.841 1.00 0.00 C ATOM 825 C VAL A 54 -1.311 -8.758 15.228 1.00 0.00 C ATOM 826 O VAL A 54 -0.914 -9.678 15.942 1.00 0.00 O ATOM 827 CB VAL A 54 -1.074 -6.547 16.479 1.00 0.00 C ATOM 828 CG1 VAL A 54 0.275 -6.538 15.756 1.00 0.00 C ATOM 829 CG2 VAL A 54 -1.691 -5.147 16.505 1.00 0.00 C ATOM 0 H VAL A 54 -2.641 -8.046 17.784 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.539 -7.034 15.030 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.900 -6.856 17.510 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.937 -5.812 16.229 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.724 -7.529 15.812 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.126 -6.266 14.711 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.990 -4.449 16.963 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.908 -4.826 15.486 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -2.614 -5.167 17.084 1.00 0.00 H new ATOM 839 N ILE A 55 -1.163 -8.713 13.912 1.00 0.00 N ATOM 840 CA ILE A 55 -0.497 -9.787 13.196 1.00 0.00 C ATOM 841 C ILE A 55 0.849 -9.286 12.670 1.00 0.00 C ATOM 842 O ILE A 55 1.855 -9.988 12.761 1.00 0.00 O ATOM 843 CB ILE A 55 -1.412 -10.352 12.107 1.00 0.00 C ATOM 844 CG1 ILE A 55 -2.245 -9.243 11.462 1.00 0.00 C ATOM 845 CG2 ILE A 55 -2.286 -11.481 12.656 1.00 0.00 C ATOM 846 CD1 ILE A 55 -3.556 -9.029 12.222 1.00 0.00 C ATOM 0 H ILE A 55 -1.493 -7.949 13.323 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.287 -10.620 13.867 1.00 0.00 H new ATOM 0 HB ILE A 55 -0.787 -10.782 11.324 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -1.673 -8.315 11.448 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -2.460 -9.501 10.425 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -2.926 -11.864 11.862 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -1.651 -12.284 13.030 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -2.905 -11.100 13.469 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -4.129 -8.235 11.743 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -4.136 -9.952 12.213 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -3.338 -8.747 13.252 1.00 0.00 H new ATOM 858 N TRP A 56 0.824 -8.076 12.131 1.00 0.00 N ATOM 859 CA TRP A 56 2.031 -7.473 11.590 1.00 0.00 C ATOM 860 C TRP A 56 2.202 -6.097 12.236 1.00 0.00 C ATOM 861 O TRP A 56 1.241 -5.337 12.349 1.00 0.00 O ATOM 862 CB TRP A 56 1.976 -7.414 10.062 1.00 0.00 C ATOM 863 CG TRP A 56 3.141 -6.651 9.427 1.00 0.00 C ATOM 864 CD1 TRP A 56 4.298 -7.145 8.966 1.00 0.00 C ATOM 865 CD2 TRP A 56 3.214 -5.227 9.201 1.00 0.00 C ATOM 866 NE1 TRP A 56 5.108 -6.149 8.461 1.00 0.00 N ATOM 867 CE2 TRP A 56 4.428 -4.945 8.608 1.00 0.00 C ATOM 868 CE3 TRP A 56 2.285 -4.211 9.487 1.00 0.00 C ATOM 869 CZ2 TRP A 56 4.825 -3.651 8.252 1.00 0.00 C ATOM 870 CZ3 TRP A 56 2.697 -2.923 9.124 1.00 0.00 C ATOM 871 CH2 TRP A 56 3.915 -2.623 8.527 1.00 0.00 C ATOM 0 H TRP A 56 -0.012 -7.497 12.057 1.00 0.00 H new ATOM 0 HA TRP A 56 2.905 -8.079 11.827 1.00 0.00 H new ATOM 0 HB2 TRP A 56 1.964 -8.431 9.669 1.00 0.00 H new ATOM 0 HB3 TRP A 56 1.040 -6.945 9.760 1.00 0.00 H new ATOM 0 HD1 TRP A 56 4.563 -8.192 8.987 1.00 0.00 H new ATOM 0 HE1 TRP A 56 6.035 -6.273 8.055 1.00 0.00 H new ATOM 0 HE3 TRP A 56 1.329 -4.408 9.950 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 5.782 -3.456 7.790 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 2.020 -2.105 9.322 1.00 0.00 H new ATOM 0 HH2 TRP A 56 4.159 -1.601 8.276 1.00 0.00 H new ATOM 882 N LYS A 57 3.431 -5.818 12.643 1.00 0.00 N ATOM 883 CA LYS A 57 3.741 -4.546 13.275 1.00 0.00 C ATOM 884 C LYS A 57 5.071 -4.021 12.730 1.00 0.00 C ATOM 885 O LYS A 57 6.065 -4.745 12.707 1.00 0.00 O ATOM 886 CB LYS A 57 3.711 -4.684 14.798 1.00 0.00 C ATOM 887 CG LYS A 57 4.730 -5.721 15.275 1.00 0.00 C ATOM 888 CD LYS A 57 4.150 -7.134 15.201 1.00 0.00 C ATOM 889 CE LYS A 57 3.803 -7.659 16.595 1.00 0.00 C ATOM 890 NZ LYS A 57 4.578 -8.884 16.896 1.00 0.00 N ATOM 0 H LYS A 57 4.225 -6.451 12.548 1.00 0.00 H new ATOM 0 HA LYS A 57 2.981 -3.803 13.030 1.00 0.00 H new ATOM 0 HB2 LYS A 57 3.926 -3.720 15.258 1.00 0.00 H new ATOM 0 HB3 LYS A 57 2.712 -4.976 15.121 1.00 0.00 H new ATOM 0 HG2 LYS A 57 5.629 -5.661 14.662 1.00 0.00 H new ATOM 0 HG3 LYS A 57 5.027 -5.499 16.300 1.00 0.00 H new ATOM 0 HD2 LYS A 57 3.256 -7.132 14.577 1.00 0.00 H new ATOM 0 HD3 LYS A 57 4.869 -7.801 14.726 1.00 0.00 H new ATOM 0 HE2 LYS A 57 4.016 -6.894 17.342 1.00 0.00 H new ATOM 0 HE3 LYS A 57 2.736 -7.873 16.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 4.330 -9.227 17.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 4.354 -9.618 16.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 5.595 -8.669 16.860 1.00 0.00 H new ATOM 904 N GLY A 58 5.046 -2.767 12.306 1.00 0.00 N ATOM 905 CA GLY A 58 6.237 -2.136 11.763 1.00 0.00 C ATOM 906 C GLY A 58 5.869 -1.019 10.785 1.00 0.00 C ATOM 907 O GLY A 58 4.753 -0.503 10.817 1.00 0.00 O ATOM 0 H GLY A 58 4.219 -2.170 12.327 1.00 0.00 H new ATOM 0 HA2 GLY A 58 6.840 -1.729 12.575 1.00 0.00 H new ATOM 0 HA3 GLY A 58 6.849 -2.882 11.255 1.00 0.00 H new ATOM 911 N SER A 59 6.829 -0.678 9.937 1.00 0.00 N ATOM 912 CA SER A 59 6.620 0.369 8.951 1.00 0.00 C ATOM 913 C SER A 59 6.330 -0.252 7.583 1.00 0.00 C ATOM 914 O SER A 59 6.661 -1.412 7.341 1.00 0.00 O ATOM 915 CB SER A 59 7.833 1.297 8.868 1.00 0.00 C ATOM 916 OG SER A 59 9.061 0.575 8.909 1.00 0.00 O ATOM 0 H SER A 59 7.753 -1.108 9.913 1.00 0.00 H new ATOM 0 HA SER A 59 5.762 0.966 9.261 1.00 0.00 H new ATOM 0 HB2 SER A 59 7.784 1.877 7.946 1.00 0.00 H new ATOM 0 HB3 SER A 59 7.803 2.008 9.694 1.00 0.00 H new ATOM 0 HG SER A 59 9.812 1.203 8.852 1.00 0.00 H new ATOM 922 N LEU A 60 5.717 0.548 6.724 1.00 0.00 N ATOM 923 CA LEU A 60 5.379 0.093 5.386 1.00 0.00 C ATOM 924 C LEU A 60 6.612 0.207 4.487 1.00 0.00 C ATOM 925 O LEU A 60 7.572 0.896 4.829 1.00 0.00 O ATOM 926 CB LEU A 60 4.158 0.846 4.855 1.00 0.00 C ATOM 927 CG LEU A 60 2.878 0.717 5.683 1.00 0.00 C ATOM 928 CD1 LEU A 60 1.745 1.545 5.074 1.00 0.00 C ATOM 929 CD2 LEU A 60 2.484 -0.751 5.858 1.00 0.00 C ATOM 0 H LEU A 60 5.445 1.510 6.928 1.00 0.00 H new ATOM 0 HA LEU A 60 5.092 -0.958 5.403 1.00 0.00 H new ATOM 0 HB2 LEU A 60 4.413 1.903 4.779 1.00 0.00 H new ATOM 0 HB3 LEU A 60 3.950 0.494 3.844 1.00 0.00 H new ATOM 0 HG LEU A 60 3.073 1.119 6.677 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.847 1.435 5.682 1.00 0.00 H new ATOM 0 HD12 LEU A 60 2.037 2.595 5.044 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.543 1.196 4.062 1.00 0.00 H new ATOM 0 HD21 LEU A 60 1.571 -0.815 6.450 1.00 0.00 H new ATOM 0 HD22 LEU A 60 2.314 -1.201 4.880 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.286 -1.284 6.369 1.00 0.00 H new ATOM 941 N THR A 61 6.544 -0.477 3.354 1.00 0.00 N ATOM 942 CA THR A 61 7.643 -0.461 2.403 1.00 0.00 C ATOM 943 C THR A 61 7.251 0.325 1.150 1.00 0.00 C ATOM 944 O THR A 61 8.115 0.831 0.435 1.00 0.00 O ATOM 945 CB THR A 61 8.039 -1.910 2.113 1.00 0.00 C ATOM 946 OG1 THR A 61 6.962 -2.413 1.328 1.00 0.00 O ATOM 947 CG2 THR A 61 8.025 -2.783 3.369 1.00 0.00 C ATOM 0 H THR A 61 5.745 -1.046 3.073 1.00 0.00 H new ATOM 0 HA THR A 61 8.513 0.052 2.812 1.00 0.00 H new ATOM 0 HB THR A 61 9.033 -1.933 1.667 1.00 0.00 H new ATOM 0 HG1 THR A 61 7.137 -3.348 1.094 1.00 0.00 H new ATOM 0 HG21 THR A 61 8.313 -3.801 3.108 1.00 0.00 H new ATOM 0 HG22 THR A 61 8.729 -2.382 4.098 1.00 0.00 H new ATOM 0 HG23 THR A 61 7.023 -2.788 3.797 1.00 0.00 H new ATOM 955 N SER A 62 5.948 0.403 0.922 1.00 0.00 N ATOM 956 CA SER A 62 5.432 1.118 -0.232 1.00 0.00 C ATOM 957 C SER A 62 3.956 1.460 -0.018 1.00 0.00 C ATOM 958 O SER A 62 3.269 0.803 0.762 1.00 0.00 O ATOM 959 CB SER A 62 5.606 0.297 -1.512 1.00 0.00 C ATOM 960 OG SER A 62 6.714 -0.595 -1.427 1.00 0.00 O ATOM 0 H SER A 62 5.234 -0.017 1.517 1.00 0.00 H new ATOM 0 HA SER A 62 6.000 2.041 -0.345 1.00 0.00 H new ATOM 0 HB2 SER A 62 4.696 -0.272 -1.704 1.00 0.00 H new ATOM 0 HB3 SER A 62 5.746 0.970 -2.358 1.00 0.00 H new ATOM 0 HG SER A 62 6.791 -1.102 -2.262 1.00 0.00 H new ATOM 966 N LEU A 63 3.512 2.489 -0.726 1.00 0.00 N ATOM 967 CA LEU A 63 2.130 2.927 -0.623 1.00 0.00 C ATOM 968 C LEU A 63 1.811 3.870 -1.784 1.00 0.00 C ATOM 969 O LEU A 63 2.540 4.831 -2.026 1.00 0.00 O ATOM 970 CB LEU A 63 1.862 3.534 0.755 1.00 0.00 C ATOM 971 CG LEU A 63 0.587 4.372 0.882 1.00 0.00 C ATOM 972 CD1 LEU A 63 -0.561 3.539 1.456 1.00 0.00 C ATOM 973 CD2 LEU A 63 0.843 5.638 1.702 1.00 0.00 C ATOM 0 H LEU A 63 4.085 3.032 -1.373 1.00 0.00 H new ATOM 0 HA LEU A 63 1.453 2.077 -0.708 1.00 0.00 H new ATOM 0 HB2 LEU A 63 1.815 2.725 1.484 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.713 4.159 1.027 1.00 0.00 H new ATOM 0 HG LEU A 63 0.286 4.690 -0.116 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.455 4.158 1.536 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -0.762 2.694 0.797 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.285 3.171 2.444 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.078 6.215 1.777 1.00 0.00 H new ATOM 0 HD22 LEU A 63 1.181 5.362 2.701 1.00 0.00 H new ATOM 0 HD23 LEU A 63 1.609 6.240 1.213 1.00 0.00 H new ATOM 985 N LYS A 64 0.721 3.564 -2.472 1.00 0.00 N ATOM 986 CA LYS A 64 0.297 4.373 -3.602 1.00 0.00 C ATOM 987 C LYS A 64 -1.223 4.542 -3.561 1.00 0.00 C ATOM 988 O LYS A 64 -1.940 3.640 -3.129 1.00 0.00 O ATOM 989 CB LYS A 64 0.814 3.776 -4.913 1.00 0.00 C ATOM 990 CG LYS A 64 2.318 3.508 -4.838 1.00 0.00 C ATOM 991 CD LYS A 64 2.923 3.380 -6.237 1.00 0.00 C ATOM 992 CE LYS A 64 4.112 2.417 -6.235 1.00 0.00 C ATOM 993 NZ LYS A 64 4.080 1.551 -7.434 1.00 0.00 N ATOM 0 H LYS A 64 0.118 2.767 -2.269 1.00 0.00 H new ATOM 0 HA LYS A 64 0.731 5.371 -3.540 1.00 0.00 H new ATOM 0 HB2 LYS A 64 0.286 2.847 -5.127 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.603 4.459 -5.736 1.00 0.00 H new ATOM 0 HG2 LYS A 64 2.809 4.318 -4.299 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.500 2.593 -4.274 1.00 0.00 H new ATOM 0 HD2 LYS A 64 2.164 3.025 -6.934 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.245 4.360 -6.589 1.00 0.00 H new ATOM 0 HE2 LYS A 64 5.044 2.981 -6.212 1.00 0.00 H new ATOM 0 HE3 LYS A 64 4.088 1.803 -5.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 4.894 0.904 -7.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 3.199 0.999 -7.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 4.125 2.141 -8.289 1.00 0.00 H new ATOM 1007 N HIS A 65 -1.670 5.703 -4.015 1.00 0.00 N ATOM 1008 CA HIS A 65 -3.092 6.002 -4.035 1.00 0.00 C ATOM 1009 C HIS A 65 -3.709 5.472 -5.331 1.00 0.00 C ATOM 1010 O HIS A 65 -4.643 4.672 -5.296 1.00 0.00 O ATOM 1011 CB HIS A 65 -3.336 7.498 -3.831 1.00 0.00 C ATOM 1012 CG HIS A 65 -4.688 7.971 -4.308 1.00 0.00 C ATOM 1013 ND1 HIS A 65 -5.832 7.199 -4.203 1.00 0.00 N ATOM 1014 CD2 HIS A 65 -5.067 9.144 -4.893 1.00 0.00 C ATOM 1015 CE1 HIS A 65 -6.848 7.886 -4.706 1.00 0.00 C ATOM 1016 NE2 HIS A 65 -6.372 9.091 -5.133 1.00 0.00 N ATOM 0 H HIS A 65 -1.073 6.449 -4.372 1.00 0.00 H new ATOM 0 HA HIS A 65 -3.585 5.497 -3.205 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -3.234 7.731 -2.771 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -2.561 8.057 -4.356 1.00 0.00 H new ATOM 0 HD1 HIS A 65 -5.884 6.261 -3.806 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -4.416 9.975 -5.122 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -7.873 7.551 -4.767 1.00 0.00 H new ATOM 1024 N HIS A 66 -3.163 5.939 -6.444 1.00 0.00 N ATOM 1025 CA HIS A 66 -3.648 5.522 -7.748 1.00 0.00 C ATOM 1026 C HIS A 66 -2.796 6.167 -8.843 1.00 0.00 C ATOM 1027 O HIS A 66 -2.787 7.388 -8.990 1.00 0.00 O ATOM 1028 CB HIS A 66 -5.139 5.833 -7.898 1.00 0.00 C ATOM 1029 CG HIS A 66 -5.714 5.451 -9.241 1.00 0.00 C ATOM 1030 ND1 HIS A 66 -6.612 6.250 -9.927 1.00 0.00 N ATOM 1031 CD2 HIS A 66 -5.509 4.348 -10.017 1.00 0.00 C ATOM 1032 CE1 HIS A 66 -6.927 5.645 -11.063 1.00 0.00 C ATOM 1033 NE2 HIS A 66 -6.243 4.467 -11.117 1.00 0.00 N ATOM 0 H HIS A 66 -2.389 6.603 -6.469 1.00 0.00 H new ATOM 0 HA HIS A 66 -3.549 4.441 -7.848 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -5.689 5.309 -7.116 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -5.295 6.900 -7.738 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -4.860 3.519 -9.777 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -7.606 6.019 -11.814 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -6.288 3.789 -11.877 1.00 0.00 H new ATOM 1041 N LYS A 67 -2.099 5.317 -9.584 1.00 0.00 N ATOM 1042 CA LYS A 67 -1.245 5.788 -10.661 1.00 0.00 C ATOM 1043 C LYS A 67 -0.539 7.072 -10.221 1.00 0.00 C ATOM 1044 O LYS A 67 -0.305 7.966 -11.033 1.00 0.00 O ATOM 1045 CB LYS A 67 -2.049 5.941 -11.954 1.00 0.00 C ATOM 1046 CG LYS A 67 -1.803 4.760 -12.895 1.00 0.00 C ATOM 1047 CD LYS A 67 -0.810 5.134 -13.996 1.00 0.00 C ATOM 1048 CE LYS A 67 -1.365 4.783 -15.378 1.00 0.00 C ATOM 1049 NZ LYS A 67 -1.087 5.872 -16.340 1.00 0.00 N ATOM 0 H LYS A 67 -2.109 4.305 -9.459 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.468 5.055 -10.880 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -3.111 6.009 -11.720 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -1.772 6.871 -12.451 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -1.420 3.912 -12.327 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -2.746 4.444 -13.342 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -0.593 6.201 -13.948 1.00 0.00 H new ATOM 0 HD3 LYS A 67 0.132 4.610 -13.835 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -0.917 3.854 -15.731 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -2.440 4.613 -15.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -1.470 5.618 -17.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -1.535 6.750 -16.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -0.060 6.015 -16.415 1.00 0.00 H new ATOM 1063 N ASP A 68 -0.217 7.122 -8.936 1.00 0.00 N ATOM 1064 CA ASP A 68 0.458 8.282 -8.379 1.00 0.00 C ATOM 1065 C ASP A 68 1.172 7.878 -7.087 1.00 0.00 C ATOM 1066 O ASP A 68 0.549 7.346 -6.170 1.00 0.00 O ATOM 1067 CB ASP A 68 -0.540 9.391 -8.041 1.00 0.00 C ATOM 1068 CG ASP A 68 -0.205 10.763 -8.629 1.00 0.00 C ATOM 1069 OD1 ASP A 68 0.257 10.786 -9.790 1.00 0.00 O ATOM 1070 OD2 ASP A 68 -0.419 11.759 -7.904 1.00 0.00 O ATOM 0 H ASP A 68 -0.411 6.378 -8.265 1.00 0.00 H new ATOM 0 HA ASP A 68 1.166 8.649 -9.122 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -1.527 9.092 -8.395 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -0.605 9.483 -6.957 1.00 0.00 H new ATOM 1075 N ASP A 69 2.469 8.147 -7.057 1.00 0.00 N ATOM 1076 CA ASP A 69 3.274 7.819 -5.893 1.00 0.00 C ATOM 1077 C ASP A 69 3.113 8.917 -4.840 1.00 0.00 C ATOM 1078 O ASP A 69 3.961 9.800 -4.725 1.00 0.00 O ATOM 1079 CB ASP A 69 4.757 7.727 -6.257 1.00 0.00 C ATOM 1080 CG ASP A 69 5.056 7.020 -7.581 1.00 0.00 C ATOM 1081 OD1 ASP A 69 4.209 6.194 -7.986 1.00 0.00 O ATOM 1082 OD2 ASP A 69 6.123 7.321 -8.157 1.00 0.00 O ATOM 0 H ASP A 69 2.982 8.588 -7.820 1.00 0.00 H new ATOM 0 HA ASP A 69 2.936 6.856 -5.510 1.00 0.00 H new ATOM 0 HB2 ASP A 69 5.168 8.736 -6.300 1.00 0.00 H new ATOM 0 HB3 ASP A 69 5.280 7.203 -5.457 1.00 0.00 H new ATOM 1087 N ILE A 70 2.018 8.826 -4.099 1.00 0.00 N ATOM 1088 CA ILE A 70 1.735 9.802 -3.060 1.00 0.00 C ATOM 1089 C ILE A 70 2.348 9.328 -1.741 1.00 0.00 C ATOM 1090 O ILE A 70 2.744 8.170 -1.617 1.00 0.00 O ATOM 1091 CB ILE A 70 0.232 10.074 -2.977 1.00 0.00 C ATOM 1092 CG1 ILE A 70 -0.053 11.324 -2.141 1.00 0.00 C ATOM 1093 CG2 ILE A 70 -0.519 8.850 -2.450 1.00 0.00 C ATOM 1094 CD1 ILE A 70 -1.390 11.955 -2.537 1.00 0.00 C ATOM 0 H ILE A 70 1.317 8.092 -4.197 1.00 0.00 H new ATOM 0 HA ILE A 70 2.196 10.760 -3.300 1.00 0.00 H new ATOM 0 HB ILE A 70 -0.136 10.268 -3.984 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -0.069 11.062 -1.083 1.00 0.00 H new ATOM 0 HG13 ILE A 70 0.750 12.048 -2.278 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.585 9.071 -2.401 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -0.354 8.006 -3.119 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.154 8.600 -1.454 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -1.569 12.841 -1.928 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.362 12.237 -3.589 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.193 11.236 -2.376 1.00 0.00 H new ATOM 1106 N SER A 71 2.408 10.247 -0.789 1.00 0.00 N ATOM 1107 CA SER A 71 2.966 9.937 0.516 1.00 0.00 C ATOM 1108 C SER A 71 1.884 10.061 1.591 1.00 0.00 C ATOM 1109 O SER A 71 1.840 9.264 2.527 1.00 0.00 O ATOM 1110 CB SER A 71 4.146 10.855 0.843 1.00 0.00 C ATOM 1111 OG SER A 71 4.497 10.804 2.223 1.00 0.00 O ATOM 0 H SER A 71 2.079 11.207 -0.895 1.00 0.00 H new ATOM 0 HA SER A 71 3.333 8.911 0.495 1.00 0.00 H new ATOM 0 HB2 SER A 71 5.007 10.567 0.239 1.00 0.00 H new ATOM 0 HB3 SER A 71 3.894 11.880 0.571 1.00 0.00 H new ATOM 0 HG SER A 71 5.255 11.402 2.390 1.00 0.00 H new ATOM 1117 N VAL A 72 1.039 11.067 1.421 1.00 0.00 N ATOM 1118 CA VAL A 72 -0.040 11.305 2.365 1.00 0.00 C ATOM 1119 C VAL A 72 -1.369 10.890 1.730 1.00 0.00 C ATOM 1120 O VAL A 72 -1.571 11.072 0.530 1.00 0.00 O ATOM 1121 CB VAL A 72 -0.025 12.766 2.818 1.00 0.00 C ATOM 1122 CG1 VAL A 72 -1.371 13.165 3.427 1.00 0.00 C ATOM 1123 CG2 VAL A 72 1.119 13.024 3.801 1.00 0.00 C ATOM 0 H VAL A 72 1.079 11.727 0.644 1.00 0.00 H new ATOM 0 HA VAL A 72 0.095 10.699 3.261 1.00 0.00 H new ATOM 0 HB VAL A 72 0.143 13.387 1.938 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -1.333 14.208 3.741 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -2.158 13.038 2.684 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -1.581 12.534 4.290 1.00 0.00 H new ATOM 0 HG21 VAL A 72 1.107 14.070 4.107 1.00 0.00 H new ATOM 0 HG22 VAL A 72 0.996 12.388 4.678 1.00 0.00 H new ATOM 0 HG23 VAL A 72 2.070 12.798 3.319 1.00 0.00 H new ATOM 1133 N ILE A 73 -2.239 10.339 2.563 1.00 0.00 N ATOM 1134 CA ILE A 73 -3.543 9.896 2.098 1.00 0.00 C ATOM 1135 C ILE A 73 -4.631 10.511 2.981 1.00 0.00 C ATOM 1136 O ILE A 73 -4.713 10.210 4.170 1.00 0.00 O ATOM 1137 CB ILE A 73 -3.597 8.369 2.029 1.00 0.00 C ATOM 1138 CG1 ILE A 73 -2.550 7.826 1.054 1.00 0.00 C ATOM 1139 CG2 ILE A 73 -5.007 7.885 1.684 1.00 0.00 C ATOM 1140 CD1 ILE A 73 -2.827 8.308 -0.371 1.00 0.00 C ATOM 0 H ILE A 73 -2.067 10.189 3.557 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.723 10.244 1.081 1.00 0.00 H new ATOM 0 HB ILE A 73 -3.353 7.974 3.015 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -1.556 8.149 1.364 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -2.554 6.736 1.080 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -5.018 6.796 1.641 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -5.706 8.225 2.449 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -5.304 8.289 0.716 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -2.069 7.908 -1.044 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -3.811 7.963 -0.687 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -2.799 9.397 -0.399 1.00 0.00 H new ATOM 1152 N LYS A 74 -5.438 11.362 2.364 1.00 0.00 N ATOM 1153 CA LYS A 74 -6.517 12.022 3.080 1.00 0.00 C ATOM 1154 C LYS A 74 -7.631 11.012 3.358 1.00 0.00 C ATOM 1155 O LYS A 74 -7.506 9.836 3.020 1.00 0.00 O ATOM 1156 CB LYS A 74 -6.987 13.262 2.316 1.00 0.00 C ATOM 1157 CG LYS A 74 -5.804 14.158 1.944 1.00 0.00 C ATOM 1158 CD LYS A 74 -6.121 14.997 0.704 1.00 0.00 C ATOM 1159 CE LYS A 74 -4.841 15.559 0.081 1.00 0.00 C ATOM 1160 NZ LYS A 74 -4.925 17.032 -0.037 1.00 0.00 N ATOM 0 H LYS A 74 -5.366 11.610 1.377 1.00 0.00 H new ATOM 0 HA LYS A 74 -6.167 12.385 4.046 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.516 12.958 1.413 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -7.695 13.823 2.926 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -5.563 14.815 2.780 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -4.923 13.544 1.757 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -6.648 14.386 -0.028 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -6.788 15.816 0.975 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -3.981 15.286 0.693 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -4.685 15.118 -0.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -4.048 17.397 -0.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -5.734 17.286 -0.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -5.052 17.449 0.907 1.00 0.00 H new ATOM 1174 N THR A 75 -8.696 11.507 3.971 1.00 0.00 N ATOM 1175 CA THR A 75 -9.832 10.662 4.299 1.00 0.00 C ATOM 1176 C THR A 75 -10.692 10.420 3.057 1.00 0.00 C ATOM 1177 O THR A 75 -10.846 11.309 2.221 1.00 0.00 O ATOM 1178 CB THR A 75 -10.596 11.322 5.448 1.00 0.00 C ATOM 1179 OG1 THR A 75 -9.695 11.251 6.550 1.00 0.00 O ATOM 1180 CG2 THR A 75 -11.802 10.496 5.900 1.00 0.00 C ATOM 0 H THR A 75 -8.796 12.483 4.249 1.00 0.00 H new ATOM 0 HA THR A 75 -9.509 9.675 4.630 1.00 0.00 H new ATOM 0 HB THR A 75 -10.929 12.313 5.140 1.00 0.00 H new ATOM 0 HG1 THR A 75 -8.830 10.907 6.244 1.00 0.00 H new ATOM 0 HG21 THR A 75 -12.309 11.009 6.717 1.00 0.00 H new ATOM 0 HG22 THR A 75 -12.492 10.373 5.065 1.00 0.00 H new ATOM 0 HG23 THR A 75 -11.465 9.517 6.240 1.00 0.00 H new ATOM 1188 N GLY A 76 -11.231 9.212 2.976 1.00 0.00 N ATOM 1189 CA GLY A 76 -12.072 8.842 1.850 1.00 0.00 C ATOM 1190 C GLY A 76 -11.225 8.494 0.624 1.00 0.00 C ATOM 1191 O GLY A 76 -11.762 8.219 -0.448 1.00 0.00 O ATOM 0 H GLY A 76 -11.102 8.477 3.672 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.694 7.989 2.121 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.746 9.664 1.609 1.00 0.00 H new ATOM 1195 N MET A 77 -9.915 8.517 0.824 1.00 0.00 N ATOM 1196 CA MET A 77 -8.989 8.207 -0.252 1.00 0.00 C ATOM 1197 C MET A 77 -8.530 6.749 -0.177 1.00 0.00 C ATOM 1198 O MET A 77 -8.104 6.282 0.878 1.00 0.00 O ATOM 1199 CB MET A 77 -7.773 9.130 -0.161 1.00 0.00 C ATOM 1200 CG MET A 77 -8.045 10.465 -0.857 1.00 0.00 C ATOM 1201 SD MET A 77 -7.184 10.524 -2.420 1.00 0.00 S ATOM 1202 CE MET A 77 -5.523 10.170 -1.873 1.00 0.00 C ATOM 0 H MET A 77 -9.473 8.745 1.715 1.00 0.00 H new ATOM 0 HA MET A 77 -9.501 8.359 -1.202 1.00 0.00 H new ATOM 0 HB2 MET A 77 -7.523 9.306 0.885 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.910 8.646 -0.618 1.00 0.00 H new ATOM 0 HG2 MET A 77 -9.116 10.590 -1.017 1.00 0.00 H new ATOM 0 HG3 MET A 77 -7.720 11.289 -0.222 1.00 0.00 H new ATOM 0 HE1 MET A 77 -4.810 10.661 -2.535 1.00 0.00 H new ATOM 0 HE2 MET A 77 -5.388 10.539 -0.856 1.00 0.00 H new ATOM 0 HE3 MET A 77 -5.355 9.093 -1.894 1.00 0.00 H new ATOM 1212 N ASP A 78 -8.633 6.071 -1.311 1.00 0.00 N ATOM 1213 CA ASP A 78 -8.233 4.676 -1.388 1.00 0.00 C ATOM 1214 C ASP A 78 -6.741 4.594 -1.714 1.00 0.00 C ATOM 1215 O ASP A 78 -6.243 5.345 -2.553 1.00 0.00 O ATOM 1216 CB ASP A 78 -9.000 3.943 -2.491 1.00 0.00 C ATOM 1217 CG ASP A 78 -10.436 4.422 -2.708 1.00 0.00 C ATOM 1218 OD1 ASP A 78 -11.166 4.505 -1.696 1.00 0.00 O ATOM 1219 OD2 ASP A 78 -10.773 4.696 -3.880 1.00 0.00 O ATOM 0 H ASP A 78 -8.988 6.462 -2.184 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.450 4.210 -0.427 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -8.452 4.051 -3.427 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -9.020 2.879 -2.254 1.00 0.00 H new ATOM 1224 N CYS A 79 -6.068 3.676 -1.036 1.00 0.00 N ATOM 1225 CA CYS A 79 -4.643 3.487 -1.243 1.00 0.00 C ATOM 1226 C CYS A 79 -4.294 2.039 -0.891 1.00 0.00 C ATOM 1227 O CYS A 79 -5.052 1.367 -0.194 1.00 0.00 O ATOM 1228 CB CYS A 79 -3.815 4.487 -0.433 1.00 0.00 C ATOM 1229 SG CYS A 79 -4.168 4.290 1.352 1.00 0.00 S ATOM 0 H CYS A 79 -6.484 3.055 -0.342 1.00 0.00 H new ATOM 0 HA CYS A 79 -4.397 3.675 -2.288 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -2.753 4.330 -0.622 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -4.048 5.504 -0.748 1.00 0.00 H new ATOM 0 HG CYS A 79 -3.499 3.277 1.817 1.00 0.00 H new ATOM 1235 N GLY A 80 -3.147 1.602 -1.391 1.00 0.00 N ATOM 1236 CA GLY A 80 -2.689 0.247 -1.138 1.00 0.00 C ATOM 1237 C GLY A 80 -1.326 0.250 -0.442 1.00 0.00 C ATOM 1238 O GLY A 80 -0.425 0.988 -0.838 1.00 0.00 O ATOM 0 H GLY A 80 -2.522 2.163 -1.970 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -3.417 -0.277 -0.518 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -2.620 -0.299 -2.079 1.00 0.00 H new ATOM 1242 N LEU A 81 -1.218 -0.584 0.582 1.00 0.00 N ATOM 1243 CA LEU A 81 0.019 -0.687 1.336 1.00 0.00 C ATOM 1244 C LEU A 81 0.527 -2.129 1.279 1.00 0.00 C ATOM 1245 O LEU A 81 -0.229 -3.046 0.962 1.00 0.00 O ATOM 1246 CB LEU A 81 -0.174 -0.159 2.758 1.00 0.00 C ATOM 1247 CG LEU A 81 -1.436 -0.632 3.484 1.00 0.00 C ATOM 1248 CD1 LEU A 81 -1.264 -2.059 4.008 1.00 0.00 C ATOM 1249 CD2 LEU A 81 -1.828 0.343 4.595 1.00 0.00 C ATOM 0 H LEU A 81 -1.968 -1.195 0.907 1.00 0.00 H new ATOM 0 HA LEU A 81 0.790 -0.059 0.890 1.00 0.00 H new ATOM 0 HB2 LEU A 81 0.693 -0.448 3.352 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -0.187 0.930 2.721 1.00 0.00 H new ATOM 0 HG LEU A 81 -2.257 -0.649 2.767 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -2.175 -2.371 4.520 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -1.068 -2.732 3.173 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.427 -2.092 4.705 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.728 -0.017 5.094 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -1.016 0.416 5.318 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -2.020 1.326 4.165 1.00 0.00 H new ATOM 1261 N SER A 82 1.805 -2.285 1.591 1.00 0.00 N ATOM 1262 CA SER A 82 2.423 -3.600 1.580 1.00 0.00 C ATOM 1263 C SER A 82 3.350 -3.753 2.787 1.00 0.00 C ATOM 1264 O SER A 82 4.008 -2.797 3.195 1.00 0.00 O ATOM 1265 CB SER A 82 3.199 -3.833 0.282 1.00 0.00 C ATOM 1266 OG SER A 82 4.057 -2.739 -0.031 1.00 0.00 O ATOM 0 H SER A 82 2.430 -1.522 1.853 1.00 0.00 H new ATOM 0 HA SER A 82 1.633 -4.349 1.639 1.00 0.00 H new ATOM 0 HB2 SER A 82 3.791 -4.744 0.372 1.00 0.00 H new ATOM 0 HB3 SER A 82 2.497 -3.989 -0.537 1.00 0.00 H new ATOM 0 HG SER A 82 4.881 -2.809 0.495 1.00 0.00 H new ATOM 1272 N LEU A 83 3.373 -4.964 3.326 1.00 0.00 N ATOM 1273 CA LEU A 83 4.209 -5.254 4.479 1.00 0.00 C ATOM 1274 C LEU A 83 5.500 -5.929 4.010 1.00 0.00 C ATOM 1275 O LEU A 83 5.484 -6.723 3.071 1.00 0.00 O ATOM 1276 CB LEU A 83 3.430 -6.068 5.514 1.00 0.00 C ATOM 1277 CG LEU A 83 1.963 -5.681 5.705 1.00 0.00 C ATOM 1278 CD1 LEU A 83 1.234 -6.706 6.577 1.00 0.00 C ATOM 1279 CD2 LEU A 83 1.839 -4.262 6.265 1.00 0.00 C ATOM 0 H LEU A 83 2.826 -5.755 2.986 1.00 0.00 H new ATOM 0 HA LEU A 83 4.496 -4.332 4.984 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.474 -7.119 5.228 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.937 -5.978 6.475 1.00 0.00 H new ATOM 0 HG LEU A 83 1.479 -5.686 4.728 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.193 -6.407 6.697 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.278 -7.685 6.101 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.712 -6.757 7.555 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.786 -4.011 6.391 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.344 -4.206 7.230 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.299 -3.556 5.573 1.00 0.00 H new ATOM 1291 N ASP A 84 6.587 -5.588 4.687 1.00 0.00 N ATOM 1292 CA ASP A 84 7.884 -6.151 4.352 1.00 0.00 C ATOM 1293 C ASP A 84 7.827 -7.673 4.495 1.00 0.00 C ATOM 1294 O ASP A 84 8.299 -8.400 3.622 1.00 0.00 O ATOM 1295 CB ASP A 84 8.971 -5.627 5.292 1.00 0.00 C ATOM 1296 CG ASP A 84 10.263 -6.447 5.308 1.00 0.00 C ATOM 1297 OD1 ASP A 84 10.215 -7.570 5.855 1.00 0.00 O ATOM 1298 OD2 ASP A 84 11.268 -5.933 4.772 1.00 0.00 O ATOM 0 H ASP A 84 6.596 -4.929 5.466 1.00 0.00 H new ATOM 0 HA ASP A 84 8.123 -5.862 3.329 1.00 0.00 H new ATOM 0 HB2 ASP A 84 9.212 -4.602 5.009 1.00 0.00 H new ATOM 0 HB3 ASP A 84 8.569 -5.591 6.304 1.00 0.00 H new ATOM 1303 N GLU A 85 7.246 -8.109 5.603 1.00 0.00 N ATOM 1304 CA GLU A 85 7.122 -9.532 5.872 1.00 0.00 C ATOM 1305 C GLU A 85 6.652 -10.270 4.617 1.00 0.00 C ATOM 1306 O GLU A 85 7.374 -11.108 4.079 1.00 0.00 O ATOM 1307 CB GLU A 85 6.174 -9.787 7.046 1.00 0.00 C ATOM 1308 CG GLU A 85 6.401 -11.178 7.641 1.00 0.00 C ATOM 1309 CD GLU A 85 7.601 -11.179 8.591 1.00 0.00 C ATOM 1310 OE1 GLU A 85 7.641 -10.276 9.455 1.00 0.00 O ATOM 1311 OE2 GLU A 85 8.450 -12.082 8.431 1.00 0.00 O ATOM 0 H GLU A 85 6.856 -7.503 6.325 1.00 0.00 H new ATOM 0 HA GLU A 85 8.103 -9.917 6.150 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.328 -9.029 7.814 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.141 -9.695 6.711 1.00 0.00 H new ATOM 0 HG2 GLU A 85 5.508 -11.498 8.177 1.00 0.00 H new ATOM 0 HG3 GLU A 85 6.567 -11.898 6.839 1.00 0.00 H new ATOM 1318 N GLU A 86 5.445 -9.933 4.188 1.00 0.00 N ATOM 1319 CA GLU A 86 4.871 -10.554 3.006 1.00 0.00 C ATOM 1320 C GLU A 86 4.107 -11.822 3.392 1.00 0.00 C ATOM 1321 O GLU A 86 3.288 -12.317 2.618 1.00 0.00 O ATOM 1322 CB GLU A 86 5.951 -10.859 1.967 1.00 0.00 C ATOM 1323 CG GLU A 86 6.378 -12.326 2.034 1.00 0.00 C ATOM 1324 CD GLU A 86 5.527 -13.188 1.099 1.00 0.00 C ATOM 1325 OE1 GLU A 86 5.226 -12.695 -0.009 1.00 0.00 O ATOM 1326 OE2 GLU A 86 5.198 -14.321 1.514 1.00 0.00 O ATOM 0 H GLU A 86 4.849 -9.238 4.637 1.00 0.00 H new ATOM 0 HA GLU A 86 4.169 -9.853 2.555 1.00 0.00 H new ATOM 0 HB2 GLU A 86 5.575 -10.631 0.969 1.00 0.00 H new ATOM 0 HB3 GLU A 86 6.815 -10.217 2.137 1.00 0.00 H new ATOM 0 HG2 GLU A 86 7.429 -12.415 1.760 1.00 0.00 H new ATOM 0 HG3 GLU A 86 6.283 -12.690 3.057 1.00 0.00 H new ATOM 1333 N LYS A 87 4.402 -12.312 4.587 1.00 0.00 N ATOM 1334 CA LYS A 87 3.753 -13.514 5.084 1.00 0.00 C ATOM 1335 C LYS A 87 2.425 -13.135 5.744 1.00 0.00 C ATOM 1336 O LYS A 87 1.509 -13.953 5.818 1.00 0.00 O ATOM 1337 CB LYS A 87 4.697 -14.291 6.003 1.00 0.00 C ATOM 1338 CG LYS A 87 5.602 -15.224 5.197 1.00 0.00 C ATOM 1339 CD LYS A 87 5.403 -16.681 5.618 1.00 0.00 C ATOM 1340 CE LYS A 87 6.747 -17.388 5.801 1.00 0.00 C ATOM 1341 NZ LYS A 87 7.019 -17.621 7.237 1.00 0.00 N ATOM 0 H LYS A 87 5.082 -11.899 5.226 1.00 0.00 H new ATOM 0 HA LYS A 87 3.519 -14.189 4.261 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.307 -13.594 6.577 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.116 -14.872 6.720 1.00 0.00 H new ATOM 0 HG2 LYS A 87 5.386 -15.116 4.134 1.00 0.00 H new ATOM 0 HG3 LYS A 87 6.644 -14.939 5.341 1.00 0.00 H new ATOM 0 HD2 LYS A 87 4.838 -16.720 6.549 1.00 0.00 H new ATOM 0 HD3 LYS A 87 4.813 -17.203 4.865 1.00 0.00 H new ATOM 0 HE2 LYS A 87 6.740 -18.338 5.267 1.00 0.00 H new ATOM 0 HE3 LYS A 87 7.544 -16.784 5.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 7.935 -18.102 7.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 7.046 -16.710 7.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 6.267 -18.216 7.641 1.00 0.00 H new ATOM 1355 N VAL A 88 2.363 -11.895 6.206 1.00 0.00 N ATOM 1356 CA VAL A 88 1.163 -11.398 6.857 1.00 0.00 C ATOM 1357 C VAL A 88 0.126 -11.031 5.794 1.00 0.00 C ATOM 1358 O VAL A 88 0.270 -10.023 5.104 1.00 0.00 O ATOM 1359 CB VAL A 88 1.514 -10.229 7.780 1.00 0.00 C ATOM 1360 CG1 VAL A 88 0.255 -9.637 8.417 1.00 0.00 C ATOM 1361 CG2 VAL A 88 2.521 -10.657 8.849 1.00 0.00 C ATOM 0 H VAL A 88 3.125 -11.219 6.142 1.00 0.00 H new ATOM 0 HA VAL A 88 0.722 -12.171 7.487 1.00 0.00 H new ATOM 0 HB VAL A 88 1.980 -9.452 7.174 1.00 0.00 H new ATOM 0 HG11 VAL A 88 0.532 -8.808 9.068 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.413 -9.276 7.635 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -0.252 -10.404 9.002 1.00 0.00 H new ATOM 0 HG21 VAL A 88 2.753 -9.807 9.491 1.00 0.00 H new ATOM 0 HG22 VAL A 88 2.094 -11.460 9.450 1.00 0.00 H new ATOM 0 HG23 VAL A 88 3.434 -11.009 8.369 1.00 0.00 H new ATOM 1371 N GLU A 89 -0.896 -11.868 5.696 1.00 0.00 N ATOM 1372 CA GLU A 89 -1.957 -11.644 4.728 1.00 0.00 C ATOM 1373 C GLU A 89 -3.084 -10.822 5.357 1.00 0.00 C ATOM 1374 O GLU A 89 -3.469 -11.062 6.500 1.00 0.00 O ATOM 1375 CB GLU A 89 -2.487 -12.970 4.178 1.00 0.00 C ATOM 1376 CG GLU A 89 -1.902 -13.262 2.795 1.00 0.00 C ATOM 1377 CD GLU A 89 -1.956 -14.759 2.482 1.00 0.00 C ATOM 1378 OE1 GLU A 89 -3.063 -15.228 2.140 1.00 0.00 O ATOM 1379 OE2 GLU A 89 -0.889 -15.401 2.592 1.00 0.00 O ATOM 0 H GLU A 89 -1.012 -12.703 6.271 1.00 0.00 H new ATOM 0 HA GLU A 89 -1.545 -11.080 3.891 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -2.233 -13.779 4.863 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -3.575 -12.934 4.117 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -2.456 -12.708 2.037 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -0.870 -12.915 2.752 1.00 0.00 H new ATOM 1386 N PHE A 90 -3.580 -9.868 4.583 1.00 0.00 N ATOM 1387 CA PHE A 90 -4.655 -9.009 5.049 1.00 0.00 C ATOM 1388 C PHE A 90 -6.020 -9.642 4.777 1.00 0.00 C ATOM 1389 O PHE A 90 -6.100 -10.755 4.259 1.00 0.00 O ATOM 1390 CB PHE A 90 -4.549 -7.697 4.269 1.00 0.00 C ATOM 1391 CG PHE A 90 -3.114 -7.289 3.928 1.00 0.00 C ATOM 1392 CD1 PHE A 90 -2.382 -6.569 4.820 1.00 0.00 C ATOM 1393 CD2 PHE A 90 -2.572 -7.647 2.734 1.00 0.00 C ATOM 1394 CE1 PHE A 90 -1.050 -6.191 4.503 1.00 0.00 C ATOM 1395 CE2 PHE A 90 -1.240 -7.268 2.417 1.00 0.00 C ATOM 1396 CZ PHE A 90 -0.508 -6.548 3.308 1.00 0.00 C ATOM 0 H PHE A 90 -3.257 -9.671 3.636 1.00 0.00 H new ATOM 0 HA PHE A 90 -4.566 -8.852 6.124 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -5.119 -7.789 3.344 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -5.013 -6.901 4.852 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.813 -6.285 5.769 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -3.154 -8.219 2.027 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.468 -5.620 5.211 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.809 -7.552 1.468 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.504 -6.259 3.067 1.00 0.00 H new ATOM 1406 N LYS A 91 -7.061 -8.905 5.137 1.00 0.00 N ATOM 1407 CA LYS A 91 -8.419 -9.381 4.938 1.00 0.00 C ATOM 1408 C LYS A 91 -9.393 -8.210 5.089 1.00 0.00 C ATOM 1409 O LYS A 91 -9.085 -7.225 5.758 1.00 0.00 O ATOM 1410 CB LYS A 91 -8.719 -10.554 5.874 1.00 0.00 C ATOM 1411 CG LYS A 91 -9.040 -10.060 7.287 1.00 0.00 C ATOM 1412 CD LYS A 91 -10.441 -10.498 7.715 1.00 0.00 C ATOM 1413 CE LYS A 91 -10.510 -12.015 7.898 1.00 0.00 C ATOM 1414 NZ LYS A 91 -11.855 -12.520 7.540 1.00 0.00 N ATOM 0 H LYS A 91 -6.991 -7.982 5.565 1.00 0.00 H new ATOM 0 HA LYS A 91 -8.541 -9.770 3.927 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.560 -11.128 5.486 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -7.862 -11.227 5.906 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -8.303 -10.450 7.989 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -8.969 -8.973 7.321 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -10.711 -10.003 8.648 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -11.168 -10.185 6.966 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -9.756 -12.497 7.275 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -10.281 -12.273 8.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -11.884 -13.551 7.670 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -12.568 -12.073 8.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -12.059 -12.290 6.546 1.00 0.00 H new ATOM 1428 N PRO A 92 -10.577 -8.360 4.438 1.00 0.00 N ATOM 1429 CA PRO A 92 -11.597 -7.327 4.493 1.00 0.00 C ATOM 1430 C PRO A 92 -12.303 -7.325 5.851 1.00 0.00 C ATOM 1431 O PRO A 92 -13.271 -8.057 6.052 1.00 0.00 O ATOM 1432 CB PRO A 92 -12.534 -7.636 3.337 1.00 0.00 C ATOM 1433 CG PRO A 92 -12.271 -9.087 2.965 1.00 0.00 C ATOM 1434 CD PRO A 92 -10.976 -9.513 3.636 1.00 0.00 C ATOM 0 HA PRO A 92 -11.184 -6.323 4.395 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -13.574 -7.489 3.627 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -12.343 -6.975 2.492 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -13.096 -9.720 3.291 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -12.194 -9.196 1.883 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -11.124 -10.396 4.258 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -10.213 -9.766 2.900 1.00 0.00 H new ATOM 1442 N GLY A 93 -11.792 -6.494 6.747 1.00 0.00 N ATOM 1443 CA GLY A 93 -12.361 -6.387 8.079 1.00 0.00 C ATOM 1444 C GLY A 93 -11.296 -5.980 9.100 1.00 0.00 C ATOM 1445 O GLY A 93 -11.621 -5.479 10.175 1.00 0.00 O ATOM 0 H GLY A 93 -10.989 -5.888 6.576 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -13.166 -5.653 8.076 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -12.801 -7.341 8.368 1.00 0.00 H new ATOM 1449 N ASP A 94 -10.046 -6.212 8.727 1.00 0.00 N ATOM 1450 CA ASP A 94 -8.931 -5.876 9.596 1.00 0.00 C ATOM 1451 C ASP A 94 -8.832 -4.354 9.726 1.00 0.00 C ATOM 1452 O ASP A 94 -9.680 -3.627 9.211 1.00 0.00 O ATOM 1453 CB ASP A 94 -7.610 -6.388 9.020 1.00 0.00 C ATOM 1454 CG ASP A 94 -7.511 -7.909 8.883 1.00 0.00 C ATOM 1455 OD1 ASP A 94 -8.419 -8.587 9.411 1.00 0.00 O ATOM 1456 OD2 ASP A 94 -6.529 -8.360 8.255 1.00 0.00 O ATOM 0 H ASP A 94 -9.781 -6.629 7.835 1.00 0.00 H new ATOM 0 HA ASP A 94 -9.106 -6.343 10.565 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -7.461 -5.939 8.038 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -6.795 -6.042 9.656 1.00 0.00 H new ATOM 1461 N GLN A 95 -7.788 -3.918 10.415 1.00 0.00 N ATOM 1462 CA GLN A 95 -7.567 -2.497 10.619 1.00 0.00 C ATOM 1463 C GLN A 95 -6.085 -2.159 10.438 1.00 0.00 C ATOM 1464 O GLN A 95 -5.230 -3.039 10.522 1.00 0.00 O ATOM 1465 CB GLN A 95 -8.065 -2.056 11.997 1.00 0.00 C ATOM 1466 CG GLN A 95 -9.506 -1.546 11.921 1.00 0.00 C ATOM 1467 CD GLN A 95 -9.801 -0.565 13.057 1.00 0.00 C ATOM 1468 OE1 GLN A 95 -8.984 0.265 13.423 1.00 0.00 O ATOM 1469 NE2 GLN A 95 -11.010 -0.705 13.593 1.00 0.00 N ATOM 0 H GLN A 95 -7.086 -4.524 10.839 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.139 -1.949 9.870 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -8.008 -2.893 12.693 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.418 -1.271 12.388 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -9.672 -1.057 10.961 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -10.197 -2.388 11.974 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -11.645 -1.420 13.239 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -11.302 -0.097 14.358 1.00 0.00 H new ATOM 1478 N VAL A 96 -5.828 -0.882 10.194 1.00 0.00 N ATOM 1479 CA VAL A 96 -4.465 -0.418 10.001 1.00 0.00 C ATOM 1480 C VAL A 96 -4.270 0.903 10.749 1.00 0.00 C ATOM 1481 O VAL A 96 -4.664 1.961 10.262 1.00 0.00 O ATOM 1482 CB VAL A 96 -4.156 -0.309 8.506 1.00 0.00 C ATOM 1483 CG1 VAL A 96 -2.902 0.535 8.266 1.00 0.00 C ATOM 1484 CG2 VAL A 96 -4.015 -1.694 7.873 1.00 0.00 C ATOM 0 H VAL A 96 -6.540 -0.155 10.126 1.00 0.00 H new ATOM 0 HA VAL A 96 -3.755 -1.134 10.415 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.995 0.194 8.026 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -2.704 0.597 7.196 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -3.056 1.538 8.665 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -2.051 0.073 8.766 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -3.796 -1.588 6.811 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.203 -2.235 8.359 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -4.946 -2.248 7.998 1.00 0.00 H new ATOM 1494 N ILE A 97 -3.661 0.797 11.922 1.00 0.00 N ATOM 1495 CA ILE A 97 -3.409 1.969 12.742 1.00 0.00 C ATOM 1496 C ILE A 97 -2.067 2.586 12.344 1.00 0.00 C ATOM 1497 O ILE A 97 -1.019 1.967 12.522 1.00 0.00 O ATOM 1498 CB ILE A 97 -3.507 1.615 14.228 1.00 0.00 C ATOM 1499 CG1 ILE A 97 -4.958 1.345 14.632 1.00 0.00 C ATOM 1500 CG2 ILE A 97 -2.862 2.699 15.094 1.00 0.00 C ATOM 1501 CD1 ILE A 97 -5.602 0.311 13.707 1.00 0.00 C ATOM 0 H ILE A 97 -3.335 -0.082 12.323 1.00 0.00 H new ATOM 0 HA ILE A 97 -4.173 2.727 12.568 1.00 0.00 H new ATOM 0 HB ILE A 97 -2.949 0.694 14.398 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.992 0.988 15.661 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -5.528 2.274 14.597 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -2.946 2.423 16.145 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -1.810 2.799 14.828 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -3.371 3.649 14.927 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -6.633 0.138 14.017 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -5.588 0.681 12.682 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.045 -0.624 13.762 1.00 0.00 H new ATOM 1513 N CYS A 98 -2.142 3.798 11.814 1.00 0.00 N ATOM 1514 CA CYS A 98 -0.946 4.505 11.390 1.00 0.00 C ATOM 1515 C CYS A 98 -0.515 5.442 12.520 1.00 0.00 C ATOM 1516 O CYS A 98 -1.052 6.540 12.659 1.00 0.00 O ATOM 1517 CB CYS A 98 -1.170 5.258 10.077 1.00 0.00 C ATOM 1518 SG CYS A 98 0.213 6.419 9.778 1.00 0.00 S ATOM 0 H CYS A 98 -3.013 4.308 11.669 1.00 0.00 H new ATOM 0 HA CYS A 98 -0.149 3.789 11.190 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -1.247 4.551 9.251 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -2.112 5.804 10.118 1.00 0.00 H new ATOM 0 HG CYS A 98 1.009 5.923 8.878 1.00 0.00 H new ATOM 1524 N TYR A 99 0.449 4.974 13.298 1.00 0.00 N ATOM 1525 CA TYR A 99 0.958 5.757 14.412 1.00 0.00 C ATOM 1526 C TYR A 99 2.476 5.612 14.536 1.00 0.00 C ATOM 1527 O TYR A 99 3.087 4.813 13.828 1.00 0.00 O ATOM 1528 CB TYR A 99 0.298 5.183 15.667 1.00 0.00 C ATOM 1529 CG TYR A 99 0.957 3.903 16.186 1.00 0.00 C ATOM 1530 CD1 TYR A 99 0.857 2.733 15.460 1.00 0.00 C ATOM 1531 CD2 TYR A 99 1.650 3.917 17.379 1.00 0.00 C ATOM 1532 CE1 TYR A 99 1.477 1.528 15.948 1.00 0.00 C ATOM 1533 CE2 TYR A 99 2.269 2.712 17.867 1.00 0.00 C ATOM 1534 CZ TYR A 99 2.152 1.577 17.127 1.00 0.00 C ATOM 1535 OH TYR A 99 2.737 0.439 17.588 1.00 0.00 O ATOM 0 H TYR A 99 0.892 4.063 13.180 1.00 0.00 H new ATOM 0 HA TYR A 99 0.737 6.815 14.270 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.321 5.936 16.454 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -0.751 4.978 15.452 1.00 0.00 H new ATOM 0 HD1 TYR A 99 0.314 2.721 14.526 1.00 0.00 H new ATOM 0 HD2 TYR A 99 1.728 4.832 17.947 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.407 0.606 15.390 1.00 0.00 H new ATOM 0 HE2 TYR A 99 2.814 2.710 18.800 1.00 0.00 H new ATOM 0 HH TYR A 99 3.185 0.623 18.440 1.00 0.00 H new ATOM 1545 N GLU A 100 3.041 6.398 15.441 1.00 0.00 N ATOM 1546 CA GLU A 100 4.476 6.367 15.667 1.00 0.00 C ATOM 1547 C GLU A 100 4.776 6.063 17.136 1.00 0.00 C ATOM 1548 O GLU A 100 4.005 6.434 18.020 1.00 0.00 O ATOM 1549 CB GLU A 100 5.128 7.682 15.235 1.00 0.00 C ATOM 1550 CG GLU A 100 4.701 8.832 16.151 1.00 0.00 C ATOM 1551 CD GLU A 100 5.804 9.887 16.255 1.00 0.00 C ATOM 1552 OE1 GLU A 100 6.979 9.473 16.353 1.00 0.00 O ATOM 1553 OE2 GLU A 100 5.447 11.085 16.235 1.00 0.00 O ATOM 0 H GLU A 100 2.531 7.060 16.026 1.00 0.00 H new ATOM 0 HA GLU A 100 4.903 5.571 15.057 1.00 0.00 H new ATOM 0 HB2 GLU A 100 6.213 7.579 15.257 1.00 0.00 H new ATOM 0 HB3 GLU A 100 4.850 7.909 14.206 1.00 0.00 H new ATOM 0 HG2 GLU A 100 3.790 9.290 15.766 1.00 0.00 H new ATOM 0 HG3 GLU A 100 4.468 8.445 17.143 1.00 0.00 H new ATOM 1560 N GLU A 101 5.897 5.391 17.351 1.00 0.00 N ATOM 1561 CA GLU A 101 6.308 5.033 18.698 1.00 0.00 C ATOM 1562 C GLU A 101 6.851 6.261 19.432 1.00 0.00 C ATOM 1563 O GLU A 101 7.241 7.243 18.802 1.00 0.00 O ATOM 1564 CB GLU A 101 7.344 3.907 18.675 1.00 0.00 C ATOM 1565 CG GLU A 101 6.672 2.548 18.465 1.00 0.00 C ATOM 1566 CD GLU A 101 6.614 1.758 19.773 1.00 0.00 C ATOM 1567 OE1 GLU A 101 7.678 1.653 20.421 1.00 0.00 O ATOM 1568 OE2 GLU A 101 5.507 1.275 20.096 1.00 0.00 O ATOM 0 H GLU A 101 6.534 5.085 16.615 1.00 0.00 H new ATOM 0 HA GLU A 101 5.434 4.668 19.237 1.00 0.00 H new ATOM 0 HB2 GLU A 101 8.065 4.087 17.878 1.00 0.00 H new ATOM 0 HB3 GLU A 101 7.900 3.901 19.612 1.00 0.00 H new ATOM 0 HG2 GLU A 101 5.663 2.693 18.078 1.00 0.00 H new ATOM 0 HG3 GLU A 101 7.222 1.978 17.716 1.00 0.00 H new ATOM 1575 N ASN A 102 6.857 6.167 20.753 1.00 0.00 N ATOM 1576 CA ASN A 102 7.345 7.258 21.580 1.00 0.00 C ATOM 1577 C ASN A 102 6.454 8.484 21.376 1.00 0.00 C ATOM 1578 O ASN A 102 5.671 8.536 20.428 1.00 0.00 O ATOM 1579 CB ASN A 102 8.775 7.644 21.194 1.00 0.00 C ATOM 1580 CG ASN A 102 9.785 7.065 22.187 1.00 0.00 C ATOM 1581 OD1 ASN A 102 9.712 7.282 23.385 1.00 0.00 O ATOM 1582 ND2 ASN A 102 10.730 6.317 21.623 1.00 0.00 N ATOM 0 H ASN A 102 6.531 5.352 21.272 1.00 0.00 H new ATOM 0 HA ASN A 102 7.328 6.928 22.619 1.00 0.00 H new ATOM 0 HB2 ASN A 102 8.996 7.280 20.191 1.00 0.00 H new ATOM 0 HB3 ASN A 102 8.868 8.730 21.166 1.00 0.00 H new ATOM 0 HD21 ASN A 102 11.451 5.885 22.201 1.00 0.00 H new ATOM 0 HD22 ASN A 102 10.733 6.175 20.613 1.00 0.00 H new ATOM 1589 N LYS A 103 6.602 9.441 22.280 1.00 0.00 N ATOM 1590 CA LYS A 103 5.819 10.663 22.212 1.00 0.00 C ATOM 1591 C LYS A 103 6.733 11.863 22.470 1.00 0.00 C ATOM 1592 O LYS A 103 7.456 11.895 23.465 1.00 0.00 O ATOM 1593 CB LYS A 103 4.622 10.587 23.161 1.00 0.00 C ATOM 1594 CG LYS A 103 3.675 11.770 22.946 1.00 0.00 C ATOM 1595 CD LYS A 103 3.214 12.353 24.283 1.00 0.00 C ATOM 1596 CE LYS A 103 3.376 13.874 24.302 1.00 0.00 C ATOM 1597 NZ LYS A 103 2.174 14.517 24.878 1.00 0.00 N ATOM 0 H LYS A 103 7.253 9.395 23.064 1.00 0.00 H new ATOM 0 HA LYS A 103 5.397 10.790 21.215 1.00 0.00 H new ATOM 0 HB2 LYS A 103 4.085 9.653 23.000 1.00 0.00 H new ATOM 0 HB3 LYS A 103 4.972 10.580 24.193 1.00 0.00 H new ATOM 0 HG2 LYS A 103 4.178 12.542 22.363 1.00 0.00 H new ATOM 0 HG3 LYS A 103 2.809 11.447 22.368 1.00 0.00 H new ATOM 0 HD2 LYS A 103 2.170 12.093 24.457 1.00 0.00 H new ATOM 0 HD3 LYS A 103 3.792 11.912 25.095 1.00 0.00 H new ATOM 0 HE2 LYS A 103 4.255 14.144 24.886 1.00 0.00 H new ATOM 0 HE3 LYS A 103 3.541 14.241 23.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 2.301 15.549 24.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 1.341 14.274 24.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 2.033 14.181 25.852 1.00 0.00 H new ATOM 1611 N VAL A 104 6.670 12.821 21.557 1.00 0.00 N ATOM 1612 CA VAL A 104 7.483 14.020 21.674 1.00 0.00 C ATOM 1613 C VAL A 104 6.732 15.060 22.508 1.00 0.00 C ATOM 1614 O VAL A 104 5.542 15.287 22.299 1.00 0.00 O ATOM 1615 CB VAL A 104 7.864 14.531 20.283 1.00 0.00 C ATOM 1616 CG1 VAL A 104 6.638 14.603 19.370 1.00 0.00 C ATOM 1617 CG2 VAL A 104 8.563 15.890 20.370 1.00 0.00 C ATOM 0 H VAL A 104 6.069 12.792 20.733 1.00 0.00 H new ATOM 0 HA VAL A 104 8.417 13.800 22.192 1.00 0.00 H new ATOM 0 HB VAL A 104 8.566 13.820 19.846 1.00 0.00 H new ATOM 0 HG11 VAL A 104 6.937 14.969 18.388 1.00 0.00 H new ATOM 0 HG12 VAL A 104 6.200 13.610 19.269 1.00 0.00 H new ATOM 0 HG13 VAL A 104 5.902 15.281 19.802 1.00 0.00 H new ATOM 0 HG21 VAL A 104 8.823 16.230 19.368 1.00 0.00 H new ATOM 0 HG22 VAL A 104 7.895 16.614 20.837 1.00 0.00 H new ATOM 0 HG23 VAL A 104 9.470 15.795 20.968 1.00 0.00 H new ATOM 1627 N PRO A 105 7.479 15.681 23.460 1.00 0.00 N ATOM 1628 CA PRO A 105 6.898 16.692 24.326 1.00 0.00 C ATOM 1629 C PRO A 105 6.698 18.010 23.575 1.00 0.00 C ATOM 1630 O PRO A 105 7.611 18.830 23.499 1.00 0.00 O ATOM 1631 CB PRO A 105 7.864 16.814 25.493 1.00 0.00 C ATOM 1632 CG PRO A 105 9.175 16.213 25.012 1.00 0.00 C ATOM 1633 CD PRO A 105 8.892 15.438 23.735 1.00 0.00 C ATOM 0 HA PRO A 105 5.902 16.422 24.677 1.00 0.00 H new ATOM 0 HB2 PRO A 105 7.995 17.856 25.784 1.00 0.00 H new ATOM 0 HB3 PRO A 105 7.489 16.283 26.368 1.00 0.00 H new ATOM 0 HG2 PRO A 105 9.909 16.997 24.828 1.00 0.00 H new ATOM 0 HG3 PRO A 105 9.595 15.555 25.773 1.00 0.00 H new ATOM 0 HD2 PRO A 105 9.520 15.784 22.914 1.00 0.00 H new ATOM 0 HD3 PRO A 105 9.093 14.375 23.864 1.00 0.00 H new ATOM 1641 N THR A 106 5.498 18.171 23.037 1.00 0.00 N ATOM 1642 CA THR A 106 5.166 19.375 22.294 1.00 0.00 C ATOM 1643 C THR A 106 4.167 20.228 23.078 1.00 0.00 C ATOM 1644 O THR A 106 4.076 21.436 22.866 1.00 0.00 O ATOM 1645 CB THR A 106 4.654 18.954 20.915 1.00 0.00 C ATOM 1646 OG1 THR A 106 4.557 20.178 20.192 1.00 0.00 O ATOM 1647 CG2 THR A 106 3.217 18.431 20.959 1.00 0.00 C ATOM 0 H THR A 106 4.743 17.488 23.101 1.00 0.00 H new ATOM 0 HA THR A 106 6.043 20.006 22.152 1.00 0.00 H new ATOM 0 HB THR A 106 5.308 18.184 20.504 1.00 0.00 H new ATOM 0 HG1 THR A 106 4.233 19.997 19.285 1.00 0.00 H new ATOM 0 HG21 THR A 106 2.903 18.146 19.955 1.00 0.00 H new ATOM 0 HG22 THR A 106 3.166 17.562 21.615 1.00 0.00 H new ATOM 0 HG23 THR A 106 2.557 19.211 21.338 1.00 0.00 H new ATOM 1655 N LYS A 107 3.443 19.566 23.969 1.00 0.00 N ATOM 1656 CA LYS A 107 2.454 20.248 24.786 1.00 0.00 C ATOM 1657 C LYS A 107 1.508 21.038 23.880 1.00 0.00 C ATOM 1658 O LYS A 107 1.708 21.097 22.668 1.00 0.00 O ATOM 1659 CB LYS A 107 3.140 21.104 25.853 1.00 0.00 C ATOM 1660 CG LYS A 107 2.520 20.861 27.231 1.00 0.00 C ATOM 1661 CD LYS A 107 2.851 22.006 28.191 1.00 0.00 C ATOM 1662 CE LYS A 107 3.679 21.505 29.376 1.00 0.00 C ATOM 1663 NZ LYS A 107 5.125 21.591 29.072 1.00 0.00 N ATOM 0 H LYS A 107 3.522 18.564 24.143 1.00 0.00 H new ATOM 0 HA LYS A 107 1.846 19.526 25.331 1.00 0.00 H new ATOM 0 HB2 LYS A 107 4.204 20.871 25.883 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.052 22.158 25.591 1.00 0.00 H new ATOM 0 HG2 LYS A 107 1.439 20.763 27.135 1.00 0.00 H new ATOM 0 HG3 LYS A 107 2.890 19.921 27.640 1.00 0.00 H new ATOM 0 HD2 LYS A 107 3.402 22.783 27.660 1.00 0.00 H new ATOM 0 HD3 LYS A 107 1.929 22.460 28.553 1.00 0.00 H new ATOM 0 HE2 LYS A 107 3.452 22.098 30.262 1.00 0.00 H new ATOM 0 HE3 LYS A 107 3.410 20.474 29.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 5.672 21.247 29.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 5.340 21.007 28.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 5.380 22.580 28.876 1.00 0.00 H new ATOM 1677 N THR A 108 0.496 21.625 24.503 1.00 0.00 N ATOM 1678 CA THR A 108 -0.482 22.408 23.768 1.00 0.00 C ATOM 1679 C THR A 108 -0.824 23.688 24.533 1.00 0.00 C ATOM 1680 O THR A 108 -1.016 23.658 25.747 1.00 0.00 O ATOM 1681 CB THR A 108 -1.697 21.517 23.501 1.00 0.00 C ATOM 1682 OG1 THR A 108 -2.374 21.469 24.754 1.00 0.00 O ATOM 1683 CG2 THR A 108 -1.308 20.062 23.231 1.00 0.00 C ATOM 0 H THR A 108 0.333 21.574 25.509 1.00 0.00 H new ATOM 0 HA THR A 108 -0.084 22.737 22.808 1.00 0.00 H new ATOM 0 HB THR A 108 -2.254 21.908 22.649 1.00 0.00 H new ATOM 0 HG1 THR A 108 -3.176 20.913 24.671 1.00 0.00 H new ATOM 0 HG21 THR A 108 -2.207 19.473 23.048 1.00 0.00 H new ATOM 0 HG22 THR A 108 -0.659 20.015 22.357 1.00 0.00 H new ATOM 0 HG23 THR A 108 -0.781 19.660 24.096 1.00 0.00 H new ATOM 1691 N SER A 109 -0.889 24.784 23.790 1.00 0.00 N ATOM 1692 CA SER A 109 -1.204 26.072 24.383 1.00 0.00 C ATOM 1693 C SER A 109 -2.257 26.794 23.539 1.00 0.00 C ATOM 1694 O SER A 109 -1.964 27.256 22.438 1.00 0.00 O ATOM 1695 CB SER A 109 0.051 26.937 24.520 1.00 0.00 C ATOM 1696 OG SER A 109 -0.206 28.139 25.242 1.00 0.00 O ATOM 0 H SER A 109 -0.729 24.806 22.783 1.00 0.00 H new ATOM 0 HA SER A 109 -1.605 25.900 25.382 1.00 0.00 H new ATOM 0 HB2 SER A 109 0.830 26.368 25.028 1.00 0.00 H new ATOM 0 HB3 SER A 109 0.432 27.184 23.529 1.00 0.00 H new ATOM 0 HG SER A 109 0.619 28.663 25.310 1.00 0.00 H new ATOM 1702 N TRP A 110 -3.460 26.867 24.088 1.00 0.00 N ATOM 1703 CA TRP A 110 -4.558 27.525 23.399 1.00 0.00 C ATOM 1704 C TRP A 110 -5.079 28.645 24.302 1.00 0.00 C ATOM 1705 O TRP A 110 -5.918 28.408 25.169 1.00 0.00 O ATOM 1706 CB TRP A 110 -5.642 26.518 23.009 1.00 0.00 C ATOM 1707 CG TRP A 110 -5.748 26.269 21.503 1.00 0.00 C ATOM 1708 CD1 TRP A 110 -4.852 25.681 20.699 1.00 0.00 C ATOM 1709 CD2 TRP A 110 -6.854 26.628 20.649 1.00 0.00 C ATOM 1710 NE1 TRP A 110 -5.297 25.635 19.394 1.00 0.00 N ATOM 1711 CE2 TRP A 110 -6.554 26.229 19.362 1.00 0.00 C ATOM 1712 CE3 TRP A 110 -8.068 27.268 20.952 1.00 0.00 C ATOM 1713 CZ2 TRP A 110 -7.417 26.426 18.277 1.00 0.00 C ATOM 1714 CZ3 TRP A 110 -8.920 27.457 19.857 1.00 0.00 C ATOM 1715 CH2 TRP A 110 -8.632 27.062 18.556 1.00 0.00 C ATOM 0 H TRP A 110 -3.699 26.482 25.002 1.00 0.00 H new ATOM 0 HA TRP A 110 -4.218 27.964 22.461 1.00 0.00 H new ATOM 0 HB2 TRP A 110 -5.441 25.571 23.510 1.00 0.00 H new ATOM 0 HB3 TRP A 110 -6.604 26.875 23.376 1.00 0.00 H new ATOM 0 HD1 TRP A 110 -3.901 25.292 21.031 1.00 0.00 H new ATOM 0 HE1 TRP A 110 -4.796 25.238 18.599 1.00 0.00 H new ATOM 0 HE3 TRP A 110 -8.324 27.589 21.951 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 -7.159 26.104 17.279 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 -9.867 27.944 20.036 1.00 0.00 H new ATOM 0 HH2 TRP A 110 -9.343 27.245 17.764 1.00 0.00 H new ATOM 1726 N ASP A 111 -4.560 29.841 24.066 1.00 0.00 N ATOM 1727 CA ASP A 111 -4.963 30.999 24.846 1.00 0.00 C ATOM 1728 C ASP A 111 -5.503 32.079 23.907 1.00 0.00 C ATOM 1729 O ASP A 111 -5.018 32.232 22.787 1.00 0.00 O ATOM 1730 CB ASP A 111 -3.776 31.587 25.611 1.00 0.00 C ATOM 1731 CG ASP A 111 -4.046 31.900 27.084 1.00 0.00 C ATOM 1732 OD1 ASP A 111 -4.163 30.926 27.859 1.00 0.00 O ATOM 1733 OD2 ASP A 111 -4.130 33.106 27.402 1.00 0.00 O ATOM 0 H ASP A 111 -3.864 30.033 23.346 1.00 0.00 H new ATOM 0 HA ASP A 111 -5.726 30.679 25.555 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -2.942 30.888 25.551 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -3.460 32.503 25.113 1.00 0.00 H new ATOM 1738 N PRO A 112 -6.526 32.820 24.411 1.00 0.00 N ATOM 1739 CA PRO A 112 -7.137 33.882 23.630 1.00 0.00 C ATOM 1740 C PRO A 112 -6.229 35.112 23.571 1.00 0.00 C ATOM 1741 O PRO A 112 -6.010 35.675 22.500 1.00 0.00 O ATOM 1742 CB PRO A 112 -8.467 34.157 24.313 1.00 0.00 C ATOM 1743 CG PRO A 112 -8.347 33.572 25.710 1.00 0.00 C ATOM 1744 CD PRO A 112 -7.125 32.667 25.734 1.00 0.00 C ATOM 0 HA PRO A 112 -7.290 33.603 22.588 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -8.671 35.227 24.354 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -9.290 33.696 23.766 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -8.248 34.367 26.449 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -9.244 33.009 25.966 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -6.430 32.961 26.520 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -7.403 31.631 25.926 1.00 0.00 H new ATOM 1752 N GLY A 113 -5.725 35.492 24.736 1.00 0.00 N ATOM 1753 CA GLY A 113 -4.846 36.645 24.831 1.00 0.00 C ATOM 1754 C GLY A 113 -5.596 37.936 24.498 1.00 0.00 C ATOM 1755 O GLY A 113 -6.405 38.411 25.294 1.00 0.00 O ATOM 0 H GLY A 113 -5.909 35.022 25.622 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -4.433 36.710 25.838 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -4.005 36.523 24.149 1.00 0.00 H new ATOM 1759 N PHE A 114 -5.302 38.467 23.321 1.00 0.00 N ATOM 1760 CA PHE A 114 -5.939 39.694 22.873 1.00 0.00 C ATOM 1761 C PHE A 114 -5.616 39.975 21.404 1.00 0.00 C ATOM 1762 O PHE A 114 -4.746 39.330 20.822 1.00 0.00 O ATOM 1763 CB PHE A 114 -5.378 40.828 23.732 1.00 0.00 C ATOM 1764 CG PHE A 114 -3.976 41.283 23.324 1.00 0.00 C ATOM 1765 CD1 PHE A 114 -3.813 42.118 22.263 1.00 0.00 C ATOM 1766 CD2 PHE A 114 -2.891 40.852 24.023 1.00 0.00 C ATOM 1767 CE1 PHE A 114 -2.511 42.540 21.884 1.00 0.00 C ATOM 1768 CE2 PHE A 114 -1.589 41.274 23.644 1.00 0.00 C ATOM 1769 CZ PHE A 114 -1.427 42.109 22.583 1.00 0.00 C ATOM 0 H PHE A 114 -4.631 38.070 22.663 1.00 0.00 H new ATOM 0 HA PHE A 114 -7.021 39.608 22.969 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -6.055 41.680 23.678 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -5.355 40.505 24.773 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -4.674 42.460 21.708 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -3.020 40.189 24.866 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -2.382 43.203 21.041 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -0.728 40.932 24.198 1.00 0.00 H new ATOM 0 HZ PHE A 114 -0.437 42.430 22.295 1.00 0.00 H new ATOM 1779 N SER A 115 -6.335 40.938 20.847 1.00 0.00 N ATOM 1780 CA SER A 115 -6.136 41.312 19.457 1.00 0.00 C ATOM 1781 C SER A 115 -6.644 42.736 19.221 1.00 0.00 C ATOM 1782 O SER A 115 -7.356 43.292 20.056 1.00 0.00 O ATOM 1783 CB SER A 115 -6.843 40.334 18.517 1.00 0.00 C ATOM 1784 OG SER A 115 -6.074 40.069 17.347 1.00 0.00 O ATOM 0 H SER A 115 -7.056 41.471 21.333 1.00 0.00 H new ATOM 0 HA SER A 115 -5.068 41.273 19.242 1.00 0.00 H new ATOM 0 HB2 SER A 115 -7.035 39.399 19.044 1.00 0.00 H new ATOM 0 HB3 SER A 115 -7.812 40.743 18.230 1.00 0.00 H new ATOM 0 HG SER A 115 -6.558 39.439 16.773 1.00 0.00 H new ATOM 1790 N GLY A 116 -6.258 43.286 18.079 1.00 0.00 N ATOM 1791 CA GLY A 116 -6.665 44.634 17.722 1.00 0.00 C ATOM 1792 C GLY A 116 -5.459 45.482 17.313 1.00 0.00 C ATOM 1793 O GLY A 116 -4.954 46.274 18.107 1.00 0.00 O ATOM 0 H GLY A 116 -5.667 42.822 17.389 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -7.382 44.596 16.902 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -7.172 45.100 18.567 1.00 0.00 H new ATOM 1797 N PRO A 117 -5.020 45.280 16.042 1.00 0.00 N ATOM 1798 CA PRO A 117 -3.882 46.017 15.518 1.00 0.00 C ATOM 1799 C PRO A 117 -4.266 47.462 15.193 1.00 0.00 C ATOM 1800 O PRO A 117 -5.263 47.706 14.516 1.00 0.00 O ATOM 1801 CB PRO A 117 -3.435 45.232 14.295 1.00 0.00 C ATOM 1802 CG PRO A 117 -4.614 44.353 13.910 1.00 0.00 C ATOM 1803 CD PRO A 117 -5.593 44.351 15.073 1.00 0.00 C ATOM 0 HA PRO A 117 -3.069 46.104 16.239 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -3.164 45.902 13.479 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -2.555 44.629 14.518 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -5.094 44.732 13.008 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -4.279 43.339 13.691 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -6.585 44.672 14.756 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -5.701 43.353 15.498 1.00 0.00 H new ATOM 1811 N SER A 118 -3.454 48.382 15.693 1.00 0.00 N ATOM 1812 CA SER A 118 -3.696 49.797 15.465 1.00 0.00 C ATOM 1813 C SER A 118 -2.390 50.497 15.085 1.00 0.00 C ATOM 1814 O SER A 118 -1.718 51.071 15.940 1.00 0.00 O ATOM 1815 CB SER A 118 -4.312 50.456 16.700 1.00 0.00 C ATOM 1816 OG SER A 118 -4.698 51.805 16.449 1.00 0.00 O ATOM 0 H SER A 118 -2.628 48.175 16.255 1.00 0.00 H new ATOM 0 HA SER A 118 -4.405 49.895 14.643 1.00 0.00 H new ATOM 0 HB2 SER A 118 -5.182 49.883 17.020 1.00 0.00 H new ATOM 0 HB3 SER A 118 -3.595 50.431 17.520 1.00 0.00 H new ATOM 0 HG SER A 118 -5.088 52.190 17.261 1.00 0.00 H new ATOM 1822 N SER A 119 -2.070 50.426 13.801 1.00 0.00 N ATOM 1823 CA SER A 119 -0.856 51.046 13.298 1.00 0.00 C ATOM 1824 C SER A 119 -1.129 51.711 11.947 1.00 0.00 C ATOM 1825 O SER A 119 -1.781 51.125 11.084 1.00 0.00 O ATOM 1826 CB SER A 119 0.273 50.021 13.166 1.00 0.00 C ATOM 1827 OG SER A 119 0.455 49.272 14.365 1.00 0.00 O ATOM 0 H SER A 119 -2.630 49.949 13.094 1.00 0.00 H new ATOM 0 HA SER A 119 -0.539 51.805 14.013 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.051 49.341 12.343 1.00 0.00 H new ATOM 0 HB3 SER A 119 1.201 50.534 12.914 1.00 0.00 H new ATOM 0 HG SER A 119 1.183 48.628 14.241 1.00 0.00 H new ATOM 1833 N GLY A 120 -0.616 52.924 11.806 1.00 0.00 N ATOM 1834 CA GLY A 120 -0.797 53.675 10.575 1.00 0.00 C ATOM 1835 C GLY A 120 -1.075 55.150 10.868 1.00 0.00 C ATOM 1836 O GLY A 120 -1.463 55.504 11.981 1.00 0.00 O ATOM 0 H GLY A 120 -0.075 53.406 12.524 1.00 0.00 H new ATOM 0 HA2 GLY A 120 0.096 53.586 9.956 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -1.624 53.252 10.005 1.00 0.00 H new TER 1840 GLY A 120