USER MOD reduce.3.24.130724 H: found=0, std=0, add=1098, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1101 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 14 TYR OH : rot -82:sc= 0.587 USER MOD Set 1.2: A 107 ASN : amide:sc= -0.432 X(o=0.15,f=0.04) USER MOD Set 2.1: A 3 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 CYS SG : rot -120:sc= -0.793 USER MOD Single : A 15 ASN : amide:sc= -0.862 K(o=-0.86,f=-3.7) USER MOD Single : A 22 SER OG : rot -126:sc= 0.634 USER MOD Single : A 28 THR OG1 : rot -140:sc= -1.29 USER MOD Single : A 30 LYS NZ :NH3+ 174:sc= 1.25 (180deg=1.21) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.272 X(o=-0.27,f=-0.0061) USER MOD Single : A 45 TYR OH : rot -69:sc= 1.17 USER MOD Single : A 46 GLN : amide:sc= -0.0224 X(o=-0.022,f=0) USER MOD Single : A 47 HIS : no HD1:sc= -0.127 X(o=-0.13,f=-0.36) USER MOD Single : A 50 GLN : amide:sc= -0.0382 X(o=-0.038,f=0) USER MOD Single : A 51 GLN : amide:sc= -0.213 X(o=-0.21,f=-0.24) USER MOD Single : A 52 CYS SG : rot 143:sc= 0.932 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.0811 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 52:sc= 0.209 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0.0546 USER MOD Single : A 75 LYS NZ :NH3+ -162:sc= 0.607 (180deg=0.401) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.0879 X(o=-0.088,f=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 THR OG1 : rot 180:sc= 0.0374 USER MOD Single : A 96 THR OG1 : rot 39:sc= 0.621 USER MOD Single : A 98 LYS NZ :NH3+ -97:sc= -0.181 (180deg=-1.07) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0543) USER MOD Single : A 106 GLN : amide:sc= -0.0712 X(o=-0.071,f=0) USER MOD Single : A 110 LYS NZ :NH3+ -144:sc= -0.098 (180deg=-1.31) USER MOD Single : A 115 SER OG : rot 64:sc= 1.11 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= -0.0811 X(o=-0.081,f=0) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -0.11 K(o=-0.11,f=-1.4!) USER MOD Single : A 141 THR OG1 : rot -49:sc= 0.512 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 2 -3.590 -20.475 -11.344 1.00 0.00 N ATOM 2 CA ALA A 2 -4.985 -19.969 -11.268 1.00 0.00 C ATOM 3 C ALA A 2 -5.091 -18.795 -10.293 1.00 0.00 C ATOM 4 O ALA A 2 -5.651 -18.925 -9.204 1.00 0.00 O ATOM 5 CB ALA A 2 -5.933 -21.090 -10.862 1.00 0.00 C ATOM 0 HA ALA A 2 -5.272 -19.611 -12.257 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -6.951 -20.705 -10.810 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -5.885 -21.892 -11.599 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -5.642 -21.477 -9.886 1.00 0.00 H new ATOM 13 N THR A 3 -4.544 -17.649 -10.696 1.00 0.00 N ATOM 14 CA THR A 3 -4.573 -16.448 -9.863 1.00 0.00 C ATOM 15 C THR A 3 -5.770 -15.573 -10.221 1.00 0.00 C ATOM 16 O THR A 3 -6.004 -15.278 -11.395 1.00 0.00 O ATOM 17 CB THR A 3 -3.273 -15.650 -10.022 1.00 0.00 C ATOM 18 OG1 THR A 3 -2.192 -16.503 -10.366 1.00 0.00 O ATOM 19 CG2 THR A 3 -2.879 -14.892 -8.773 1.00 0.00 C ATOM 0 H THR A 3 -4.076 -17.527 -11.594 1.00 0.00 H new ATOM 0 HA THR A 3 -4.668 -16.760 -8.823 1.00 0.00 H new ATOM 0 HB THR A 3 -3.475 -14.932 -10.817 1.00 0.00 H new ATOM 0 HG1 THR A 3 -1.374 -15.972 -10.464 1.00 0.00 H new ATOM 0 HG21 THR A 3 -1.951 -14.349 -8.954 1.00 0.00 H new ATOM 0 HG22 THR A 3 -3.667 -14.186 -8.512 1.00 0.00 H new ATOM 0 HG23 THR A 3 -2.734 -15.594 -7.952 1.00 0.00 H new ATOM 27 N LYS A 4 -6.529 -15.166 -9.207 1.00 0.00 N ATOM 28 CA LYS A 4 -7.707 -14.329 -9.417 1.00 0.00 C ATOM 29 C LYS A 4 -7.761 -13.193 -8.396 1.00 0.00 C ATOM 30 O LYS A 4 -6.882 -13.073 -7.541 1.00 0.00 O ATOM 31 CB LYS A 4 -8.980 -15.175 -9.331 1.00 0.00 C ATOM 32 CG LYS A 4 -8.914 -16.461 -10.141 1.00 0.00 C ATOM 33 CD LYS A 4 -10.175 -17.294 -9.976 1.00 0.00 C ATOM 34 CE LYS A 4 -9.857 -18.781 -9.917 1.00 0.00 C ATOM 35 NZ LYS A 4 -10.718 -19.575 -10.839 1.00 0.00 N ATOM 0 H LYS A 4 -6.349 -15.402 -8.231 1.00 0.00 H new ATOM 0 HA LYS A 4 -7.638 -13.890 -10.412 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -9.171 -15.423 -8.287 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -9.825 -14.580 -9.678 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -8.772 -16.221 -11.195 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -8.048 -17.045 -9.827 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -10.693 -16.995 -9.065 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -10.853 -17.098 -10.807 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -8.810 -18.938 -10.175 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -9.992 -19.140 -8.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -10.468 -20.582 -10.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -11.717 -19.447 -10.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -10.571 -19.251 -11.816 1.00 0.00 H new ATOM 49 N ILE A 5 -8.798 -12.364 -8.491 1.00 0.00 N ATOM 50 CA ILE A 5 -8.971 -11.241 -7.576 1.00 0.00 C ATOM 51 C ILE A 5 -10.451 -10.982 -7.306 1.00 0.00 C ATOM 52 O ILE A 5 -11.264 -10.939 -8.233 1.00 0.00 O ATOM 53 CB ILE A 5 -8.308 -9.957 -8.127 1.00 0.00 C ATOM 54 CG1 ILE A 5 -8.412 -8.819 -7.110 1.00 0.00 C ATOM 55 CG2 ILE A 5 -8.940 -9.552 -9.453 1.00 0.00 C ATOM 56 CD1 ILE A 5 -7.266 -7.833 -7.186 1.00 0.00 C ATOM 0 H ILE A 5 -9.532 -12.450 -9.194 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.481 -11.508 -6.640 1.00 0.00 H new ATOM 0 HB ILE A 5 -7.252 -10.165 -8.302 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -9.350 -8.286 -7.268 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.451 -9.242 -6.106 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -8.459 -8.647 -9.824 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -8.810 -10.355 -10.178 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -10.004 -9.364 -9.307 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.406 -7.054 -6.437 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -6.326 -8.352 -6.998 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -7.239 -7.382 -8.178 1.00 0.00 H new ATOM 68 N ASP A 6 -10.796 -10.810 -6.032 1.00 0.00 N ATOM 69 CA ASP A 6 -12.178 -10.556 -5.641 1.00 0.00 C ATOM 70 C ASP A 6 -12.562 -9.107 -5.924 1.00 0.00 C ATOM 71 O ASP A 6 -12.042 -8.183 -5.294 1.00 0.00 O ATOM 72 CB ASP A 6 -12.384 -10.876 -4.159 1.00 0.00 C ATOM 73 CG ASP A 6 -13.840 -11.121 -3.816 1.00 0.00 C ATOM 74 OD1 ASP A 6 -14.638 -10.165 -3.896 1.00 0.00 O ATOM 75 OD2 ASP A 6 -14.182 -12.270 -3.469 1.00 0.00 O ATOM 0 H ASP A 6 -10.137 -10.842 -5.254 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.822 -11.207 -6.232 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -11.799 -11.757 -3.896 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.006 -10.050 -3.556 1.00 0.00 H new ATOM 80 N LYS A 7 -13.472 -8.914 -6.877 1.00 0.00 N ATOM 81 CA LYS A 7 -13.927 -7.576 -7.245 1.00 0.00 C ATOM 82 C LYS A 7 -14.721 -6.936 -6.111 1.00 0.00 C ATOM 83 O LYS A 7 -14.511 -5.771 -5.781 1.00 0.00 O ATOM 84 CB LYS A 7 -14.781 -7.632 -8.515 1.00 0.00 C ATOM 85 CG LYS A 7 -13.972 -7.523 -9.799 1.00 0.00 C ATOM 86 CD LYS A 7 -14.384 -8.580 -10.812 1.00 0.00 C ATOM 87 CE LYS A 7 -15.615 -8.153 -11.598 1.00 0.00 C ATOM 88 NZ LYS A 7 -15.399 -8.243 -13.069 1.00 0.00 N ATOM 0 H LYS A 7 -13.908 -9.668 -7.408 1.00 0.00 H new ATOM 0 HA LYS A 7 -13.046 -6.963 -7.436 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -15.340 -8.568 -8.526 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -15.512 -6.824 -8.487 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -14.107 -6.532 -10.232 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -12.911 -7.630 -9.572 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -13.559 -8.767 -11.500 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -14.588 -9.519 -10.297 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -16.460 -8.781 -11.317 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -15.877 -7.129 -11.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -16.262 -7.943 -13.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -14.609 -7.624 -13.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -15.174 -9.225 -13.327 1.00 0.00 H new ATOM 102 N GLU A 8 -15.633 -7.707 -5.518 1.00 0.00 N ATOM 103 CA GLU A 8 -16.461 -7.217 -4.420 1.00 0.00 C ATOM 104 C GLU A 8 -15.604 -6.773 -3.233 1.00 0.00 C ATOM 105 O GLU A 8 -15.779 -5.669 -2.716 1.00 0.00 O ATOM 106 CB GLU A 8 -17.452 -8.298 -3.977 1.00 0.00 C ATOM 107 CG GLU A 8 -18.625 -7.759 -3.176 1.00 0.00 C ATOM 108 CD GLU A 8 -19.545 -8.857 -2.679 1.00 0.00 C ATOM 109 OE1 GLU A 8 -19.090 -9.692 -1.868 1.00 0.00 O ATOM 110 OE2 GLU A 8 -20.720 -8.883 -3.100 1.00 0.00 O ATOM 0 H GLU A 8 -15.816 -8.675 -5.782 1.00 0.00 H new ATOM 0 HA GLU A 8 -17.015 -6.351 -4.781 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -17.832 -8.814 -4.859 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -16.924 -9.039 -3.377 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -18.249 -7.192 -2.324 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -19.194 -7.065 -3.794 1.00 0.00 H new ATOM 117 N ALA A 9 -14.679 -7.636 -2.809 1.00 0.00 N ATOM 118 CA ALA A 9 -13.797 -7.333 -1.685 1.00 0.00 C ATOM 119 C ALA A 9 -12.957 -6.088 -1.959 1.00 0.00 C ATOM 120 O ALA A 9 -12.994 -5.123 -1.193 1.00 0.00 O ATOM 121 CB ALA A 9 -12.899 -8.526 -1.386 1.00 0.00 C ATOM 0 H ALA A 9 -14.523 -8.552 -3.230 1.00 0.00 H new ATOM 0 HA ALA A 9 -14.418 -7.130 -0.813 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -12.246 -8.288 -0.546 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -13.514 -9.390 -1.134 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -12.294 -8.755 -2.263 1.00 0.00 H new ATOM 127 N CYS A 10 -12.200 -6.118 -3.055 1.00 0.00 N ATOM 128 CA CYS A 10 -11.347 -4.998 -3.436 1.00 0.00 C ATOM 129 C CYS A 10 -12.160 -3.716 -3.625 1.00 0.00 C ATOM 130 O CYS A 10 -11.780 -2.656 -3.123 1.00 0.00 O ATOM 131 CB CYS A 10 -10.590 -5.333 -4.720 1.00 0.00 C ATOM 132 SG CYS A 10 -9.167 -6.422 -4.473 1.00 0.00 S ATOM 0 H CYS A 10 -12.162 -6.911 -3.696 1.00 0.00 H new ATOM 0 HA CYS A 10 -10.634 -4.827 -2.629 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -11.277 -5.804 -5.422 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -10.249 -4.406 -5.181 1.00 0.00 H new ATOM 0 HG CYS A 10 -8.086 -5.820 -4.871 1.00 0.00 H new ATOM 138 N ARG A 11 -13.277 -3.818 -4.345 1.00 0.00 N ATOM 139 CA ARG A 11 -14.141 -2.663 -4.595 1.00 0.00 C ATOM 140 C ARG A 11 -14.664 -2.086 -3.281 1.00 0.00 C ATOM 141 O ARG A 11 -14.570 -0.881 -3.048 1.00 0.00 O ATOM 142 CB ARG A 11 -15.312 -3.049 -5.505 1.00 0.00 C ATOM 143 CG ARG A 11 -16.093 -1.857 -6.043 1.00 0.00 C ATOM 144 CD ARG A 11 -15.724 -1.553 -7.489 1.00 0.00 C ATOM 145 NE ARG A 11 -16.423 -0.371 -7.998 1.00 0.00 N ATOM 146 CZ ARG A 11 -17.677 -0.378 -8.455 1.00 0.00 C ATOM 147 NH1 ARG A 11 -18.389 -1.502 -8.461 1.00 0.00 N ATOM 148 NH2 ARG A 11 -18.226 0.747 -8.905 1.00 0.00 N ATOM 0 H ARG A 11 -13.605 -4.687 -4.765 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.547 -1.900 -5.098 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.931 -3.630 -6.345 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -15.992 -3.697 -4.951 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -17.162 -2.060 -5.974 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -15.895 -0.982 -5.424 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -14.648 -1.397 -7.563 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -15.965 -2.413 -8.113 1.00 0.00 H new ATOM 0 HE ARG A 11 -15.919 0.516 -8.004 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -17.977 -2.368 -8.114 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -19.347 -1.497 -8.812 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -17.689 1.614 -8.901 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -19.184 0.743 -9.254 1.00 0.00 H new ATOM 162 N ALA A 12 -15.203 -2.956 -2.424 1.00 0.00 N ATOM 163 CA ALA A 12 -15.731 -2.535 -1.128 1.00 0.00 C ATOM 164 C ALA A 12 -14.686 -1.744 -0.345 1.00 0.00 C ATOM 165 O ALA A 12 -14.978 -0.674 0.186 1.00 0.00 O ATOM 166 CB ALA A 12 -16.192 -3.742 -0.322 1.00 0.00 C ATOM 0 H ALA A 12 -15.285 -3.956 -2.606 1.00 0.00 H new ATOM 0 HA ALA A 12 -16.588 -1.886 -1.307 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -16.582 -3.410 0.640 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -16.975 -4.267 -0.869 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -15.349 -4.414 -0.159 1.00 0.00 H new ATOM 172 N ALA A 13 -13.466 -2.277 -0.286 1.00 0.00 N ATOM 173 CA ALA A 13 -12.371 -1.620 0.426 1.00 0.00 C ATOM 174 C ALA A 13 -12.096 -0.225 -0.136 1.00 0.00 C ATOM 175 O ALA A 13 -11.743 0.692 0.609 1.00 0.00 O ATOM 176 CB ALA A 13 -11.114 -2.476 0.366 1.00 0.00 C ATOM 0 H ALA A 13 -13.211 -3.163 -0.723 1.00 0.00 H new ATOM 0 HA ALA A 13 -12.670 -1.504 1.468 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -10.307 -1.975 0.900 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -11.310 -3.443 0.829 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -10.824 -2.624 -0.674 1.00 0.00 H new ATOM 182 N TYR A 14 -12.258 -0.071 -1.452 1.00 0.00 N ATOM 183 CA TYR A 14 -12.026 1.211 -2.114 1.00 0.00 C ATOM 184 C TYR A 14 -13.044 2.259 -1.667 1.00 0.00 C ATOM 185 O TYR A 14 -12.676 3.285 -1.094 1.00 0.00 O ATOM 186 CB TYR A 14 -12.085 1.045 -3.635 1.00 0.00 C ATOM 187 CG TYR A 14 -11.305 2.098 -4.392 1.00 0.00 C ATOM 188 CD1 TYR A 14 -11.810 3.383 -4.556 1.00 0.00 C ATOM 189 CD2 TYR A 14 -10.063 1.808 -4.942 1.00 0.00 C ATOM 190 CE1 TYR A 14 -11.098 4.346 -5.245 1.00 0.00 C ATOM 191 CE2 TYR A 14 -9.345 2.766 -5.631 1.00 0.00 C ATOM 192 CZ TYR A 14 -9.866 4.033 -5.780 1.00 0.00 C ATOM 193 OH TYR A 14 -9.152 4.990 -6.463 1.00 0.00 O ATOM 0 H TYR A 14 -12.549 -0.820 -2.080 1.00 0.00 H new ATOM 0 HA TYR A 14 -11.032 1.556 -1.829 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -11.700 0.060 -3.899 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -13.126 1.077 -3.955 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -12.774 3.632 -4.138 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -9.651 0.816 -4.829 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -11.504 5.339 -5.364 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -8.380 2.523 -6.051 1.00 0.00 H new ATOM 0 HH TYR A 14 -9.482 5.049 -7.384 1.00 0.00 H new ATOM 203 N ASN A 15 -14.323 2.001 -1.943 1.00 0.00 N ATOM 204 CA ASN A 15 -15.390 2.928 -1.580 1.00 0.00 C ATOM 205 C ASN A 15 -15.514 3.091 -0.062 1.00 0.00 C ATOM 206 O ASN A 15 -15.863 4.168 0.419 1.00 0.00 O ATOM 207 CB ASN A 15 -16.726 2.471 -2.175 1.00 0.00 C ATOM 208 CG ASN A 15 -17.028 1.006 -1.911 1.00 0.00 C ATOM 209 OD1 ASN A 15 -17.188 0.588 -0.764 1.00 0.00 O ATOM 210 ND2 ASN A 15 -17.112 0.217 -2.978 1.00 0.00 N ATOM 0 H ASN A 15 -14.643 1.157 -2.417 1.00 0.00 H new ATOM 0 HA ASN A 15 -15.129 3.901 -1.996 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -17.529 3.081 -1.761 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -16.716 2.645 -3.251 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -17.316 -0.776 -2.863 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -16.972 0.605 -3.911 1.00 0.00 H new ATOM 217 N LEU A 16 -15.226 2.023 0.685 1.00 0.00 N ATOM 218 CA LEU A 16 -15.308 2.062 2.145 1.00 0.00 C ATOM 219 C LEU A 16 -14.335 3.091 2.723 1.00 0.00 C ATOM 220 O LEU A 16 -14.716 3.926 3.544 1.00 0.00 O ATOM 221 CB LEU A 16 -15.015 0.677 2.733 1.00 0.00 C ATOM 222 CG LEU A 16 -15.143 0.575 4.255 1.00 0.00 C ATOM 223 CD1 LEU A 16 -15.874 -0.699 4.649 1.00 0.00 C ATOM 224 CD2 LEU A 16 -13.771 0.625 4.912 1.00 0.00 C ATOM 0 H LEU A 16 -14.935 1.123 0.303 1.00 0.00 H new ATOM 0 HA LEU A 16 -16.321 2.357 2.416 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -15.694 -0.044 2.278 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -14.004 0.386 2.449 1.00 0.00 H new ATOM 0 HG LEU A 16 -15.725 1.427 4.605 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -15.954 -0.752 5.735 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -16.872 -0.696 4.211 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -15.320 -1.564 4.284 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -13.883 0.551 5.994 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -13.165 -0.206 4.552 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -13.282 1.566 4.661 1.00 0.00 H new ATOM 236 N VAL A 17 -13.078 3.024 2.283 1.00 0.00 N ATOM 237 CA VAL A 17 -12.049 3.953 2.748 1.00 0.00 C ATOM 238 C VAL A 17 -12.225 5.327 2.099 1.00 0.00 C ATOM 239 O VAL A 17 -11.920 6.355 2.708 1.00 0.00 O ATOM 240 CB VAL A 17 -10.631 3.418 2.441 1.00 0.00 C ATOM 241 CG1 VAL A 17 -9.565 4.351 3.000 1.00 0.00 C ATOM 242 CG2 VAL A 17 -10.458 2.011 2.997 1.00 0.00 C ATOM 0 H VAL A 17 -12.749 2.336 1.606 1.00 0.00 H new ATOM 0 HA VAL A 17 -12.162 4.048 3.828 1.00 0.00 H new ATOM 0 HB VAL A 17 -10.511 3.378 1.358 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -8.577 3.953 2.771 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -9.672 5.338 2.549 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.682 4.431 4.081 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -9.454 1.651 2.771 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -10.604 2.026 4.077 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -11.192 1.347 2.541 1.00 0.00 H new ATOM 252 N ARG A 18 -12.724 5.333 0.862 1.00 0.00 N ATOM 253 CA ARG A 18 -12.950 6.572 0.122 1.00 0.00 C ATOM 254 C ARG A 18 -14.203 7.311 0.612 1.00 0.00 C ATOM 255 O ARG A 18 -14.491 8.414 0.144 1.00 0.00 O ATOM 256 CB ARG A 18 -13.077 6.269 -1.375 1.00 0.00 C ATOM 257 CG ARG A 18 -12.840 7.476 -2.271 1.00 0.00 C ATOM 258 CD ARG A 18 -13.688 7.410 -3.533 1.00 0.00 C ATOM 259 NE ARG A 18 -14.541 8.589 -3.685 1.00 0.00 N ATOM 260 CZ ARG A 18 -15.597 8.649 -4.500 1.00 0.00 C ATOM 261 NH1 ARG A 18 -15.941 7.597 -5.238 1.00 0.00 N ATOM 262 NH2 ARG A 18 -16.313 9.764 -4.576 1.00 0.00 N ATOM 0 H ARG A 18 -12.980 4.488 0.351 1.00 0.00 H new ATOM 0 HA ARG A 18 -12.093 7.222 0.296 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -12.365 5.487 -1.639 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -14.073 5.872 -1.572 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -13.073 8.389 -1.722 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -11.786 7.527 -2.542 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -13.037 7.320 -4.402 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -14.309 6.515 -3.505 1.00 0.00 H new ATOM 0 HE ARG A 18 -14.315 9.417 -3.134 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -15.397 6.736 -5.184 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -16.749 7.651 -5.858 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -16.056 10.574 -4.012 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -17.120 9.811 -5.198 1.00 0.00 H new ATOM 276 N ASP A 19 -14.948 6.709 1.548 1.00 0.00 N ATOM 277 CA ASP A 19 -16.162 7.329 2.076 1.00 0.00 C ATOM 278 C ASP A 19 -15.828 8.529 2.960 1.00 0.00 C ATOM 279 O ASP A 19 -15.810 8.423 4.189 1.00 0.00 O ATOM 280 CB ASP A 19 -16.989 6.310 2.867 1.00 0.00 C ATOM 281 CG ASP A 19 -18.468 6.644 2.863 1.00 0.00 C ATOM 282 OD1 ASP A 19 -18.881 7.523 3.648 1.00 0.00 O ATOM 283 OD2 ASP A 19 -19.214 6.027 2.074 1.00 0.00 O ATOM 0 H ASP A 19 -14.730 5.798 1.951 1.00 0.00 H new ATOM 0 HA ASP A 19 -16.751 7.680 1.228 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -16.842 5.317 2.442 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -16.630 6.273 3.895 1.00 0.00 H new ATOM 288 N ASP A 20 -15.562 9.669 2.320 1.00 0.00 N ATOM 289 CA ASP A 20 -15.225 10.900 3.035 1.00 0.00 C ATOM 290 C ASP A 20 -14.073 10.677 4.018 1.00 0.00 C ATOM 291 O ASP A 20 -13.948 11.395 5.012 1.00 0.00 O ATOM 292 CB ASP A 20 -16.457 11.431 3.778 1.00 0.00 C ATOM 293 CG ASP A 20 -17.659 11.595 2.865 1.00 0.00 C ATOM 294 OD1 ASP A 20 -17.565 12.380 1.899 1.00 0.00 O ATOM 295 OD2 ASP A 20 -18.690 10.938 3.116 1.00 0.00 O ATOM 0 H ASP A 20 -15.574 9.765 1.305 1.00 0.00 H new ATOM 0 HA ASP A 20 -14.901 11.638 2.301 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -16.711 10.748 4.589 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -16.217 12.392 4.234 1.00 0.00 H new ATOM 300 N GLY A 21 -13.236 9.673 3.739 1.00 0.00 N ATOM 301 CA GLY A 21 -12.116 9.372 4.611 1.00 0.00 C ATOM 302 C GLY A 21 -12.568 8.827 5.953 1.00 0.00 C ATOM 303 O GLY A 21 -12.486 9.522 6.967 1.00 0.00 O ATOM 0 H GLY A 21 -13.318 9.066 2.924 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -11.465 8.645 4.126 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -11.526 10.275 4.767 1.00 0.00 H new ATOM 307 N SER A 22 -13.047 7.583 5.959 1.00 0.00 N ATOM 308 CA SER A 22 -13.516 6.944 7.184 1.00 0.00 C ATOM 309 C SER A 22 -12.357 6.711 8.158 1.00 0.00 C ATOM 310 O SER A 22 -11.248 7.210 7.944 1.00 0.00 O ATOM 311 CB SER A 22 -14.216 5.621 6.846 1.00 0.00 C ATOM 312 OG SER A 22 -13.407 4.801 6.020 1.00 0.00 O ATOM 0 H SER A 22 -13.120 6.998 5.126 1.00 0.00 H new ATOM 0 HA SER A 22 -14.231 7.607 7.671 1.00 0.00 H new ATOM 0 HB2 SER A 22 -14.454 5.089 7.767 1.00 0.00 H new ATOM 0 HB3 SER A 22 -15.161 5.826 6.343 1.00 0.00 H new ATOM 0 HG SER A 22 -13.909 4.549 5.217 1.00 0.00 H new ATOM 318 N ALA A 23 -12.608 5.952 9.226 1.00 0.00 N ATOM 319 CA ALA A 23 -11.576 5.662 10.220 1.00 0.00 C ATOM 320 C ALA A 23 -10.629 4.562 9.729 1.00 0.00 C ATOM 321 O ALA A 23 -10.407 3.565 10.419 1.00 0.00 O ATOM 322 CB ALA A 23 -12.216 5.268 11.545 1.00 0.00 C ATOM 0 H ALA A 23 -13.515 5.529 9.424 1.00 0.00 H new ATOM 0 HA ALA A 23 -10.986 6.566 10.372 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -11.436 5.055 12.276 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -12.838 6.087 11.906 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -12.832 4.380 11.402 1.00 0.00 H new ATOM 328 N VAL A 24 -10.076 4.757 8.530 1.00 0.00 N ATOM 329 CA VAL A 24 -9.156 3.795 7.931 1.00 0.00 C ATOM 330 C VAL A 24 -8.202 4.502 6.971 1.00 0.00 C ATOM 331 O VAL A 24 -8.576 4.834 5.845 1.00 0.00 O ATOM 332 CB VAL A 24 -9.918 2.685 7.170 1.00 0.00 C ATOM 333 CG1 VAL A 24 -8.951 1.657 6.603 1.00 0.00 C ATOM 334 CG2 VAL A 24 -10.940 2.012 8.076 1.00 0.00 C ATOM 0 H VAL A 24 -10.253 5.580 7.953 1.00 0.00 H new ATOM 0 HA VAL A 24 -8.589 3.335 8.740 1.00 0.00 H new ATOM 0 HB VAL A 24 -10.449 3.150 6.340 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -9.510 0.886 6.072 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -8.263 2.146 5.914 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -8.387 1.201 7.416 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -11.464 1.235 7.519 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -10.431 1.566 8.930 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -11.658 2.753 8.428 1.00 0.00 H new ATOM 344 N ILE A 25 -6.973 4.737 7.426 1.00 0.00 N ATOM 345 CA ILE A 25 -5.971 5.415 6.605 1.00 0.00 C ATOM 346 C ILE A 25 -5.224 4.432 5.699 1.00 0.00 C ATOM 347 O ILE A 25 -4.741 4.812 4.631 1.00 0.00 O ATOM 348 CB ILE A 25 -4.950 6.189 7.470 1.00 0.00 C ATOM 349 CG1 ILE A 25 -4.143 5.230 8.350 1.00 0.00 C ATOM 350 CG2 ILE A 25 -5.660 7.229 8.328 1.00 0.00 C ATOM 351 CD1 ILE A 25 -2.655 5.267 8.075 1.00 0.00 C ATOM 0 H ILE A 25 -6.647 4.469 8.355 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.515 6.126 5.983 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.258 6.702 6.802 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -4.317 5.477 9.397 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.508 4.214 8.197 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -4.927 7.765 8.931 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -6.186 7.934 7.684 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -6.376 6.733 8.983 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -2.146 4.564 8.734 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -2.470 4.991 7.037 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -2.276 6.273 8.256 1.00 0.00 H new ATOM 363 N TRP A 26 -5.133 3.170 6.128 1.00 0.00 N ATOM 364 CA TRP A 26 -4.447 2.144 5.348 1.00 0.00 C ATOM 365 C TRP A 26 -5.218 0.825 5.364 1.00 0.00 C ATOM 366 O TRP A 26 -5.955 0.532 6.308 1.00 0.00 O ATOM 367 CB TRP A 26 -3.021 1.924 5.881 1.00 0.00 C ATOM 368 CG TRP A 26 -2.965 1.264 7.232 1.00 0.00 C ATOM 369 CD1 TRP A 26 -2.671 1.863 8.422 1.00 0.00 C ATOM 370 CD2 TRP A 26 -3.203 -0.120 7.529 1.00 0.00 C ATOM 371 NE1 TRP A 26 -2.719 0.942 9.439 1.00 0.00 N ATOM 372 CE2 TRP A 26 -3.044 -0.281 8.918 1.00 0.00 C ATOM 373 CE3 TRP A 26 -3.539 -1.238 6.759 1.00 0.00 C ATOM 374 CZ2 TRP A 26 -3.210 -1.511 9.549 1.00 0.00 C ATOM 375 CZ3 TRP A 26 -3.704 -2.456 7.389 1.00 0.00 C ATOM 376 CH2 TRP A 26 -3.542 -2.583 8.769 1.00 0.00 C ATOM 0 H TRP A 26 -5.526 2.838 7.009 1.00 0.00 H new ATOM 0 HA TRP A 26 -4.392 2.495 4.318 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -2.468 1.314 5.167 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -2.513 2.887 5.938 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -2.435 2.910 8.546 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -2.541 1.138 10.424 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -3.667 -1.151 5.690 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.081 -1.614 10.616 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -3.963 -3.325 6.803 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -3.682 -3.549 9.231 1.00 0.00 H new ATOM 387 N VAL A 27 -5.021 0.026 4.317 1.00 0.00 N ATOM 388 CA VAL A 27 -5.668 -1.279 4.201 1.00 0.00 C ATOM 389 C VAL A 27 -4.684 -2.301 3.640 1.00 0.00 C ATOM 390 O VAL A 27 -3.761 -1.941 2.907 1.00 0.00 O ATOM 391 CB VAL A 27 -6.914 -1.242 3.293 1.00 0.00 C ATOM 392 CG1 VAL A 27 -7.779 -2.473 3.520 1.00 0.00 C ATOM 393 CG2 VAL A 27 -7.718 0.031 3.519 1.00 0.00 C ATOM 0 H VAL A 27 -4.414 0.262 3.532 1.00 0.00 H new ATOM 0 HA VAL A 27 -5.988 -1.562 5.204 1.00 0.00 H new ATOM 0 HB VAL A 27 -6.577 -1.246 2.257 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -8.653 -2.428 2.870 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.203 -3.370 3.292 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -8.102 -2.504 4.561 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -8.591 0.031 2.866 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -8.043 0.077 4.559 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -7.097 0.898 3.294 1.00 0.00 H new ATOM 403 N THR A 28 -4.881 -3.572 3.977 1.00 0.00 N ATOM 404 CA THR A 28 -3.992 -4.622 3.482 1.00 0.00 C ATOM 405 C THR A 28 -4.529 -5.218 2.188 1.00 0.00 C ATOM 406 O THR A 28 -5.690 -5.010 1.835 1.00 0.00 O ATOM 407 CB THR A 28 -3.806 -5.729 4.526 1.00 0.00 C ATOM 408 OG1 THR A 28 -3.779 -5.194 5.834 1.00 0.00 O ATOM 409 CG2 THR A 28 -2.533 -6.525 4.331 1.00 0.00 C ATOM 0 H THR A 28 -5.635 -3.898 4.581 1.00 0.00 H new ATOM 0 HA THR A 28 -3.022 -4.165 3.286 1.00 0.00 H new ATOM 0 HB THR A 28 -4.660 -6.393 4.392 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.098 -5.659 6.364 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.462 -7.292 5.102 1.00 0.00 H new ATOM 0 HG22 THR A 28 -2.546 -6.998 3.349 1.00 0.00 H new ATOM 0 HG23 THR A 28 -1.673 -5.859 4.401 1.00 0.00 H new ATOM 417 N PHE A 29 -3.680 -5.966 1.490 1.00 0.00 N ATOM 418 CA PHE A 29 -4.066 -6.607 0.240 1.00 0.00 C ATOM 419 C PHE A 29 -3.287 -7.903 0.050 1.00 0.00 C ATOM 420 O PHE A 29 -2.127 -7.889 -0.367 1.00 0.00 O ATOM 421 CB PHE A 29 -3.840 -5.661 -0.944 1.00 0.00 C ATOM 422 CG PHE A 29 -5.009 -4.758 -1.215 1.00 0.00 C ATOM 423 CD1 PHE A 29 -5.153 -3.561 -0.528 1.00 0.00 C ATOM 424 CD2 PHE A 29 -5.969 -5.107 -2.151 1.00 0.00 C ATOM 425 CE1 PHE A 29 -6.230 -2.732 -0.773 1.00 0.00 C ATOM 426 CE2 PHE A 29 -7.048 -4.281 -2.399 1.00 0.00 C ATOM 427 CZ PHE A 29 -7.179 -3.092 -1.709 1.00 0.00 C ATOM 0 H PHE A 29 -2.716 -6.143 1.772 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.129 -6.845 0.285 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -2.957 -5.052 -0.750 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -3.631 -6.251 -1.836 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -4.415 -3.275 0.206 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -5.873 -6.036 -2.693 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -6.330 -1.802 -0.233 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -7.789 -4.565 -3.132 1.00 0.00 H new ATOM 0 HZ PHE A 29 -8.022 -2.445 -1.901 1.00 0.00 H new ATOM 437 N LYS A 30 -3.931 -9.020 0.373 1.00 0.00 N ATOM 438 CA LYS A 30 -3.307 -10.332 0.255 1.00 0.00 C ATOM 439 C LYS A 30 -4.261 -11.331 -0.394 1.00 0.00 C ATOM 440 O LYS A 30 -5.482 -11.187 -0.302 1.00 0.00 O ATOM 441 CB LYS A 30 -2.870 -10.838 1.633 1.00 0.00 C ATOM 442 CG LYS A 30 -3.979 -10.821 2.678 1.00 0.00 C ATOM 443 CD LYS A 30 -4.733 -12.141 2.714 1.00 0.00 C ATOM 444 CE LYS A 30 -3.882 -13.256 3.305 1.00 0.00 C ATOM 445 NZ LYS A 30 -4.663 -14.118 4.235 1.00 0.00 N ATOM 0 H LYS A 30 -4.890 -9.042 0.720 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.427 -10.235 -0.381 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -2.494 -11.856 1.533 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -2.041 -10.226 1.988 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -3.552 -10.618 3.660 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -4.674 -10.010 2.459 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -5.643 -12.025 3.303 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -5.040 -12.413 1.704 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -3.474 -13.867 2.500 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -3.035 -12.823 3.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -4.077 -14.923 4.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -4.945 -13.563 5.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -5.513 -14.471 3.750 1.00 0.00 H new ATOM 459 N TYR A 31 -3.699 -12.341 -1.051 1.00 0.00 N ATOM 460 CA TYR A 31 -4.504 -13.357 -1.717 1.00 0.00 C ATOM 461 C TYR A 31 -4.691 -14.588 -0.833 1.00 0.00 C ATOM 462 O TYR A 31 -3.723 -15.151 -0.317 1.00 0.00 O ATOM 463 CB TYR A 31 -3.869 -13.755 -3.056 1.00 0.00 C ATOM 464 CG TYR A 31 -2.497 -14.382 -2.926 1.00 0.00 C ATOM 465 CD1 TYR A 31 -2.354 -15.750 -2.734 1.00 0.00 C ATOM 466 CD2 TYR A 31 -1.348 -13.604 -2.994 1.00 0.00 C ATOM 467 CE1 TYR A 31 -1.104 -16.325 -2.610 1.00 0.00 C ATOM 468 CE2 TYR A 31 -0.095 -14.173 -2.874 1.00 0.00 C ATOM 469 CZ TYR A 31 0.022 -15.533 -2.682 1.00 0.00 C ATOM 470 OH TYR A 31 1.270 -16.102 -2.558 1.00 0.00 O ATOM 0 H TYR A 31 -2.692 -12.477 -1.136 1.00 0.00 H new ATOM 0 HA TYR A 31 -5.488 -12.928 -1.907 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -4.530 -14.456 -3.566 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -3.794 -12.870 -3.688 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -3.234 -16.374 -2.681 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -1.436 -12.538 -3.143 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -1.009 -17.390 -2.457 1.00 0.00 H new ATOM 0 HE2 TYR A 31 0.789 -13.555 -2.930 1.00 0.00 H new ATOM 0 HH TYR A 31 1.956 -15.406 -2.633 1.00 0.00 H new ATOM 480 N ASP A 32 -5.945 -15.004 -0.674 1.00 0.00 N ATOM 481 CA ASP A 32 -6.273 -16.175 0.129 1.00 0.00 C ATOM 482 C ASP A 32 -6.460 -17.387 -0.776 1.00 0.00 C ATOM 483 O ASP A 32 -7.435 -17.464 -1.532 1.00 0.00 O ATOM 484 CB ASP A 32 -7.539 -15.926 0.955 1.00 0.00 C ATOM 485 CG ASP A 32 -7.354 -16.291 2.415 1.00 0.00 C ATOM 486 OD1 ASP A 32 -6.752 -15.485 3.155 1.00 0.00 O ATOM 487 OD2 ASP A 32 -7.812 -17.379 2.818 1.00 0.00 O ATOM 0 H ASP A 32 -6.753 -14.544 -1.094 1.00 0.00 H new ATOM 0 HA ASP A 32 -5.450 -16.369 0.817 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.820 -14.876 0.878 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.362 -16.507 0.539 1.00 0.00 H new ATOM 492 N GLY A 33 -5.509 -18.317 -0.717 1.00 0.00 N ATOM 493 CA GLY A 33 -5.573 -19.505 -1.552 1.00 0.00 C ATOM 494 C GLY A 33 -5.110 -19.233 -2.974 1.00 0.00 C ATOM 495 O GLY A 33 -4.264 -19.953 -3.507 1.00 0.00 O ATOM 0 H GLY A 33 -4.694 -18.269 -0.105 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -4.955 -20.289 -1.114 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.597 -19.879 -1.570 1.00 0.00 H new ATOM 499 N SER A 34 -5.668 -18.186 -3.584 1.00 0.00 N ATOM 500 CA SER A 34 -5.317 -17.804 -4.950 1.00 0.00 C ATOM 501 C SER A 34 -5.930 -16.454 -5.333 1.00 0.00 C ATOM 502 O SER A 34 -5.336 -15.695 -6.101 1.00 0.00 O ATOM 503 CB SER A 34 -5.773 -18.878 -5.942 1.00 0.00 C ATOM 504 OG SER A 34 -7.177 -19.071 -5.884 1.00 0.00 O ATOM 0 H SER A 34 -6.369 -17.585 -3.149 1.00 0.00 H new ATOM 0 HA SER A 34 -4.232 -17.710 -4.993 1.00 0.00 H new ATOM 0 HB2 SER A 34 -5.485 -18.588 -6.953 1.00 0.00 H new ATOM 0 HB3 SER A 34 -5.265 -19.817 -5.723 1.00 0.00 H new ATOM 0 HG SER A 34 -7.439 -19.761 -6.529 1.00 0.00 H new ATOM 510 N THR A 35 -7.123 -16.161 -4.802 1.00 0.00 N ATOM 511 CA THR A 35 -7.804 -14.904 -5.104 1.00 0.00 C ATOM 512 C THR A 35 -7.301 -13.769 -4.213 1.00 0.00 C ATOM 513 O THR A 35 -7.195 -13.921 -2.994 1.00 0.00 O ATOM 514 CB THR A 35 -9.325 -15.062 -4.955 1.00 0.00 C ATOM 515 OG1 THR A 35 -9.986 -13.827 -5.192 1.00 0.00 O ATOM 516 CG2 THR A 35 -9.756 -15.564 -3.590 1.00 0.00 C ATOM 0 H THR A 35 -7.631 -16.775 -4.166 1.00 0.00 H new ATOM 0 HA THR A 35 -7.577 -14.647 -6.139 1.00 0.00 H new ATOM 0 HB THR A 35 -9.606 -15.810 -5.697 1.00 0.00 H new ATOM 0 HG1 THR A 35 -10.953 -13.950 -5.094 1.00 0.00 H new ATOM 0 HG21 THR A 35 -10.842 -15.650 -3.560 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.309 -16.541 -3.404 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.427 -14.862 -2.824 1.00 0.00 H new ATOM 524 N ILE A 36 -7.000 -12.631 -4.835 1.00 0.00 N ATOM 525 CA ILE A 36 -6.512 -11.457 -4.113 1.00 0.00 C ATOM 526 C ILE A 36 -7.664 -10.707 -3.448 1.00 0.00 C ATOM 527 O ILE A 36 -8.716 -10.505 -4.057 1.00 0.00 O ATOM 528 CB ILE A 36 -5.762 -10.488 -5.050 1.00 0.00 C ATOM 529 CG1 ILE A 36 -4.679 -11.229 -5.836 1.00 0.00 C ATOM 530 CG2 ILE A 36 -5.151 -9.342 -4.254 1.00 0.00 C ATOM 531 CD1 ILE A 36 -4.040 -10.392 -6.921 1.00 0.00 C ATOM 0 H ILE A 36 -7.086 -12.496 -5.842 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.823 -11.819 -3.350 1.00 0.00 H new ATOM 0 HB ILE A 36 -6.479 -10.073 -5.759 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -3.906 -11.565 -5.145 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -5.114 -12.121 -6.286 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.626 -8.668 -4.931 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -5.941 -8.795 -3.738 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.449 -9.741 -3.522 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.282 -10.982 -7.436 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -4.802 -10.077 -7.634 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.575 -9.513 -6.476 1.00 0.00 H new ATOM 543 N VAL A 37 -7.457 -10.300 -2.198 1.00 0.00 N ATOM 544 CA VAL A 37 -8.479 -9.572 -1.449 1.00 0.00 C ATOM 545 C VAL A 37 -7.849 -8.633 -0.419 1.00 0.00 C ATOM 546 O VAL A 37 -6.720 -8.852 0.023 1.00 0.00 O ATOM 547 CB VAL A 37 -9.443 -10.541 -0.728 1.00 0.00 C ATOM 548 CG1 VAL A 37 -10.327 -11.262 -1.733 1.00 0.00 C ATOM 549 CG2 VAL A 37 -8.670 -11.539 0.126 1.00 0.00 C ATOM 0 H VAL A 37 -6.592 -10.462 -1.682 1.00 0.00 H new ATOM 0 HA VAL A 37 -9.041 -8.982 -2.173 1.00 0.00 H new ATOM 0 HB VAL A 37 -10.083 -9.956 -0.067 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -10.999 -11.940 -1.206 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -10.913 -10.532 -2.292 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -9.704 -11.832 -2.423 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -9.370 -12.211 0.624 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -8.000 -12.119 -0.509 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -8.087 -11.003 0.875 1.00 0.00 H new ATOM 559 N PRO A 38 -8.576 -7.572 -0.018 1.00 0.00 N ATOM 560 CA PRO A 38 -8.078 -6.608 0.970 1.00 0.00 C ATOM 561 C PRO A 38 -7.947 -7.227 2.362 1.00 0.00 C ATOM 562 O PRO A 38 -8.495 -8.300 2.625 1.00 0.00 O ATOM 563 CB PRO A 38 -9.143 -5.507 0.966 1.00 0.00 C ATOM 564 CG PRO A 38 -10.383 -6.176 0.483 1.00 0.00 C ATOM 565 CD PRO A 38 -9.934 -7.234 -0.487 1.00 0.00 C ATOM 0 HA PRO A 38 -7.080 -6.247 0.723 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -9.282 -5.088 1.963 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -8.858 -4.683 0.311 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -10.936 -6.617 1.312 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -11.049 -5.461 -0.000 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -10.593 -8.102 -0.469 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -9.925 -6.862 -1.512 1.00 0.00 H new ATOM 573 N GLY A 39 -7.219 -6.548 3.249 1.00 0.00 N ATOM 574 CA GLY A 39 -7.029 -7.045 4.591 1.00 0.00 C ATOM 575 C GLY A 39 -7.226 -5.972 5.641 1.00 0.00 C ATOM 576 O GLY A 39 -7.991 -5.031 5.437 1.00 0.00 O ATOM 0 H GLY A 39 -6.758 -5.659 3.054 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -7.728 -7.861 4.775 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.025 -7.458 4.683 1.00 0.00 H new ATOM 580 N GLU A 40 -6.525 -6.130 6.760 1.00 0.00 N ATOM 581 CA GLU A 40 -6.595 -5.205 7.895 1.00 0.00 C ATOM 582 C GLU A 40 -6.868 -3.767 7.463 1.00 0.00 C ATOM 583 O GLU A 40 -6.278 -3.268 6.505 1.00 0.00 O ATOM 584 CB GLU A 40 -5.304 -5.269 8.714 1.00 0.00 C ATOM 585 CG GLU A 40 -5.195 -6.508 9.589 1.00 0.00 C ATOM 586 CD GLU A 40 -4.705 -7.722 8.822 1.00 0.00 C ATOM 587 OE1 GLU A 40 -3.529 -7.724 8.401 1.00 0.00 O ATOM 588 OE2 GLU A 40 -5.500 -8.667 8.636 1.00 0.00 O ATOM 0 H GLU A 40 -5.885 -6.910 6.909 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.436 -5.523 8.511 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.452 -5.239 8.035 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.240 -4.383 9.345 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.514 -6.306 10.416 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.170 -6.727 10.025 1.00 0.00 H new ATOM 595 N GLN A 41 -7.769 -3.115 8.191 1.00 0.00 N ATOM 596 CA GLN A 41 -8.145 -1.731 7.914 1.00 0.00 C ATOM 597 C GLN A 41 -8.091 -0.903 9.195 1.00 0.00 C ATOM 598 O GLN A 41 -9.072 -0.830 9.938 1.00 0.00 O ATOM 599 CB GLN A 41 -9.554 -1.664 7.310 1.00 0.00 C ATOM 600 CG GLN A 41 -9.849 -2.760 6.298 1.00 0.00 C ATOM 601 CD GLN A 41 -11.333 -3.039 6.158 1.00 0.00 C ATOM 602 OE1 GLN A 41 -11.894 -3.853 6.891 1.00 0.00 O ATOM 603 NE2 GLN A 41 -11.979 -2.364 5.213 1.00 0.00 N ATOM 0 H GLN A 41 -8.257 -3.528 8.986 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.436 -1.322 7.194 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.286 -1.722 8.116 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.686 -0.695 6.829 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.444 -2.472 5.328 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.338 -3.674 6.599 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -11.475 -1.698 4.627 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.979 -2.512 5.074 1.00 0.00 H new ATOM 612 N GLY A 42 -6.938 -0.292 9.459 1.00 0.00 N ATOM 613 CA GLY A 42 -6.781 0.507 10.663 1.00 0.00 C ATOM 614 C GLY A 42 -6.063 1.819 10.421 1.00 0.00 C ATOM 615 O GLY A 42 -5.414 2.004 9.391 1.00 0.00 O ATOM 0 H GLY A 42 -6.112 -0.336 8.862 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.765 0.711 11.086 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.229 -0.070 11.405 1.00 0.00 H new ATOM 619 N ALA A 43 -6.175 2.725 11.388 1.00 0.00 N ATOM 620 CA ALA A 43 -5.525 4.028 11.305 1.00 0.00 C ATOM 621 C ALA A 43 -4.108 3.963 11.876 1.00 0.00 C ATOM 622 O ALA A 43 -3.252 4.779 11.529 1.00 0.00 O ATOM 623 CB ALA A 43 -6.345 5.078 12.041 1.00 0.00 C ATOM 0 H ALA A 43 -6.713 2.579 12.242 1.00 0.00 H new ATOM 0 HA ALA A 43 -5.459 4.311 10.254 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.846 6.045 11.970 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -7.336 5.147 11.592 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -6.441 4.796 13.089 1.00 0.00 H new ATOM 629 N GLU A 44 -3.870 2.982 12.750 1.00 0.00 N ATOM 630 CA GLU A 44 -2.560 2.801 13.369 1.00 0.00 C ATOM 631 C GLU A 44 -1.647 1.976 12.467 1.00 0.00 C ATOM 632 O GLU A 44 -1.919 0.802 12.202 1.00 0.00 O ATOM 633 CB GLU A 44 -2.704 2.119 14.732 1.00 0.00 C ATOM 634 CG GLU A 44 -2.548 3.070 15.907 1.00 0.00 C ATOM 635 CD GLU A 44 -1.346 2.736 16.770 1.00 0.00 C ATOM 636 OE1 GLU A 44 -0.209 2.788 16.253 1.00 0.00 O ATOM 637 OE2 GLU A 44 -1.541 2.421 17.962 1.00 0.00 O ATOM 0 H GLU A 44 -4.570 2.301 13.044 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.112 3.784 13.511 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -3.682 1.642 14.789 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -1.958 1.328 14.814 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -2.451 4.090 15.534 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -3.450 3.038 16.518 1.00 0.00 H new ATOM 644 N TYR A 45 -0.570 2.598 11.994 1.00 0.00 N ATOM 645 CA TYR A 45 0.382 1.925 11.114 1.00 0.00 C ATOM 646 C TYR A 45 1.137 0.811 11.836 1.00 0.00 C ATOM 647 O TYR A 45 1.645 -0.111 11.195 1.00 0.00 O ATOM 648 CB TYR A 45 1.374 2.929 10.536 1.00 0.00 C ATOM 649 CG TYR A 45 2.121 2.410 9.330 1.00 0.00 C ATOM 650 CD1 TYR A 45 1.520 2.373 8.080 1.00 0.00 C ATOM 651 CD2 TYR A 45 3.430 1.968 9.442 1.00 0.00 C ATOM 652 CE1 TYR A 45 2.204 1.911 6.973 1.00 0.00 C ATOM 653 CE2 TYR A 45 4.122 1.501 8.341 1.00 0.00 C ATOM 654 CZ TYR A 45 3.506 1.477 7.108 1.00 0.00 C ATOM 655 OH TYR A 45 4.193 1.020 6.008 1.00 0.00 O ATOM 0 H TYR A 45 -0.334 3.568 12.205 1.00 0.00 H new ATOM 0 HA TYR A 45 -0.191 1.472 10.305 1.00 0.00 H new ATOM 0 HB2 TYR A 45 0.840 3.838 10.259 1.00 0.00 H new ATOM 0 HB3 TYR A 45 2.092 3.204 11.308 1.00 0.00 H new ATOM 0 HD1 TYR A 45 0.500 2.711 7.971 1.00 0.00 H new ATOM 0 HD2 TYR A 45 3.917 1.989 10.406 1.00 0.00 H new ATOM 0 HE1 TYR A 45 1.722 1.890 6.007 1.00 0.00 H new ATOM 0 HE2 TYR A 45 5.140 1.157 8.446 1.00 0.00 H new ATOM 0 HH TYR A 45 3.814 0.164 5.718 1.00 0.00 H new ATOM 665 N GLN A 46 1.204 0.891 13.169 1.00 0.00 N ATOM 666 CA GLN A 46 1.892 -0.125 13.964 1.00 0.00 C ATOM 667 C GLN A 46 1.460 -1.528 13.537 1.00 0.00 C ATOM 668 O GLN A 46 2.273 -2.454 13.501 1.00 0.00 O ATOM 669 CB GLN A 46 1.604 0.080 15.454 1.00 0.00 C ATOM 670 CG GLN A 46 2.651 -0.537 16.368 1.00 0.00 C ATOM 671 CD GLN A 46 3.309 0.487 17.275 1.00 0.00 C ATOM 672 OE1 GLN A 46 3.250 0.376 18.498 1.00 0.00 O ATOM 673 NE2 GLN A 46 3.941 1.491 16.676 1.00 0.00 N ATOM 0 H GLN A 46 0.791 1.647 13.716 1.00 0.00 H new ATOM 0 HA GLN A 46 2.964 -0.024 13.793 1.00 0.00 H new ATOM 0 HB2 GLN A 46 1.539 1.149 15.659 1.00 0.00 H new ATOM 0 HB3 GLN A 46 0.630 -0.349 15.689 1.00 0.00 H new ATOM 0 HG2 GLN A 46 2.185 -1.311 16.978 1.00 0.00 H new ATOM 0 HG3 GLN A 46 3.415 -1.025 15.762 1.00 0.00 H new ATOM 0 HE21 GLN A 46 3.965 1.544 15.658 1.00 0.00 H new ATOM 0 HE22 GLN A 46 4.402 2.209 17.235 1.00 0.00 H new ATOM 682 N HIS A 47 0.175 -1.667 13.205 1.00 0.00 N ATOM 683 CA HIS A 47 -0.377 -2.946 12.769 1.00 0.00 C ATOM 684 C HIS A 47 0.250 -3.401 11.454 1.00 0.00 C ATOM 685 O HIS A 47 0.511 -4.589 11.267 1.00 0.00 O ATOM 686 CB HIS A 47 -1.894 -2.842 12.607 1.00 0.00 C ATOM 687 CG HIS A 47 -2.661 -3.175 13.850 1.00 0.00 C ATOM 688 ND1 HIS A 47 -2.068 -3.327 15.088 1.00 0.00 N ATOM 689 CD2 HIS A 47 -3.985 -3.385 14.041 1.00 0.00 C ATOM 690 CE1 HIS A 47 -2.995 -3.618 15.983 1.00 0.00 C ATOM 691 NE2 HIS A 47 -4.165 -3.658 15.374 1.00 0.00 N ATOM 0 H HIS A 47 -0.503 -0.905 13.231 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.144 -3.686 13.535 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.148 -1.829 12.296 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.211 -3.510 11.806 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -4.756 -3.345 13.285 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.824 -3.793 17.035 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.059 -3.859 15.822 1.00 0.00 H new ATOM 700 N PHE A 48 0.492 -2.456 10.543 1.00 0.00 N ATOM 701 CA PHE A 48 1.086 -2.787 9.255 1.00 0.00 C ATOM 702 C PHE A 48 2.532 -3.246 9.421 1.00 0.00 C ATOM 703 O PHE A 48 2.963 -4.205 8.781 1.00 0.00 O ATOM 704 CB PHE A 48 1.021 -1.590 8.305 1.00 0.00 C ATOM 705 CG PHE A 48 1.363 -1.952 6.890 1.00 0.00 C ATOM 706 CD1 PHE A 48 0.489 -2.709 6.128 1.00 0.00 C ATOM 707 CD2 PHE A 48 2.562 -1.552 6.328 1.00 0.00 C ATOM 708 CE1 PHE A 48 0.806 -3.059 4.830 1.00 0.00 C ATOM 709 CE2 PHE A 48 2.884 -1.896 5.031 1.00 0.00 C ATOM 710 CZ PHE A 48 2.005 -2.652 4.281 1.00 0.00 C ATOM 0 H PHE A 48 0.287 -1.466 10.675 1.00 0.00 H new ATOM 0 HA PHE A 48 0.511 -3.607 8.825 1.00 0.00 H new ATOM 0 HB2 PHE A 48 0.019 -1.163 8.334 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.707 -0.818 8.654 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -0.451 -3.029 6.553 1.00 0.00 H new ATOM 0 HD2 PHE A 48 3.255 -0.963 6.911 1.00 0.00 H new ATOM 0 HE1 PHE A 48 0.117 -3.650 4.246 1.00 0.00 H new ATOM 0 HE2 PHE A 48 3.822 -1.574 4.603 1.00 0.00 H new ATOM 0 HZ PHE A 48 2.255 -2.924 3.266 1.00 0.00 H new ATOM 720 N ILE A 49 3.274 -2.557 10.289 1.00 0.00 N ATOM 721 CA ILE A 49 4.674 -2.895 10.546 1.00 0.00 C ATOM 722 C ILE A 49 4.799 -4.290 11.161 1.00 0.00 C ATOM 723 O ILE A 49 5.683 -5.064 10.790 1.00 0.00 O ATOM 724 CB ILE A 49 5.339 -1.871 11.492 1.00 0.00 C ATOM 725 CG1 ILE A 49 5.140 -0.444 10.972 1.00 0.00 C ATOM 726 CG2 ILE A 49 6.821 -2.176 11.653 1.00 0.00 C ATOM 727 CD1 ILE A 49 5.263 0.614 12.047 1.00 0.00 C ATOM 0 H ILE A 49 2.929 -1.761 10.826 1.00 0.00 H new ATOM 0 HA ILE A 49 5.184 -2.874 9.583 1.00 0.00 H new ATOM 0 HB ILE A 49 4.862 -1.950 12.469 1.00 0.00 H new ATOM 0 HG12 ILE A 49 5.874 -0.245 10.192 1.00 0.00 H new ATOM 0 HG13 ILE A 49 4.156 -0.368 10.510 1.00 0.00 H new ATOM 0 HG21 ILE A 49 7.272 -1.444 12.323 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.944 -3.175 12.071 1.00 0.00 H new ATOM 0 HG23 ILE A 49 7.310 -2.128 10.680 1.00 0.00 H new ATOM 0 HD11 ILE A 49 5.111 1.599 11.607 1.00 0.00 H new ATOM 0 HD12 ILE A 49 4.511 0.440 12.816 1.00 0.00 H new ATOM 0 HD13 ILE A 49 6.256 0.566 12.493 1.00 0.00 H new ATOM 739 N GLN A 50 3.911 -4.595 12.107 1.00 0.00 N ATOM 740 CA GLN A 50 3.914 -5.887 12.790 1.00 0.00 C ATOM 741 C GLN A 50 3.462 -7.016 11.863 1.00 0.00 C ATOM 742 O GLN A 50 4.024 -8.112 11.891 1.00 0.00 O ATOM 743 CB GLN A 50 3.009 -5.827 14.025 1.00 0.00 C ATOM 744 CG GLN A 50 3.369 -6.843 15.098 1.00 0.00 C ATOM 745 CD GLN A 50 4.219 -6.248 16.207 1.00 0.00 C ATOM 746 OE1 GLN A 50 5.383 -6.612 16.373 1.00 0.00 O ATOM 747 NE2 GLN A 50 3.642 -5.329 16.974 1.00 0.00 N ATOM 0 H GLN A 50 3.176 -3.960 12.419 1.00 0.00 H new ATOM 0 HA GLN A 50 4.938 -6.100 13.098 1.00 0.00 H new ATOM 0 HB2 GLN A 50 3.060 -4.826 14.453 1.00 0.00 H new ATOM 0 HB3 GLN A 50 1.976 -5.989 13.716 1.00 0.00 H new ATOM 0 HG2 GLN A 50 2.454 -7.252 15.527 1.00 0.00 H new ATOM 0 HG3 GLN A 50 3.906 -7.674 14.640 1.00 0.00 H new ATOM 0 HE21 GLN A 50 2.674 -5.056 16.802 1.00 0.00 H new ATOM 0 HE22 GLN A 50 4.167 -4.897 17.734 1.00 0.00 H new ATOM 756 N GLN A 51 2.443 -6.746 11.046 1.00 0.00 N ATOM 757 CA GLN A 51 1.920 -7.748 10.119 1.00 0.00 C ATOM 758 C GLN A 51 2.883 -7.998 8.957 1.00 0.00 C ATOM 759 O GLN A 51 2.982 -9.121 8.460 1.00 0.00 O ATOM 760 CB GLN A 51 0.555 -7.310 9.579 1.00 0.00 C ATOM 761 CG GLN A 51 -0.619 -7.892 10.352 1.00 0.00 C ATOM 762 CD GLN A 51 -0.857 -7.185 11.673 1.00 0.00 C ATOM 763 OE1 GLN A 51 -1.741 -6.334 11.782 1.00 0.00 O ATOM 764 NE2 GLN A 51 -0.068 -7.530 12.687 1.00 0.00 N ATOM 0 H GLN A 51 1.966 -5.845 11.008 1.00 0.00 H new ATOM 0 HA GLN A 51 1.809 -8.681 10.671 1.00 0.00 H new ATOM 0 HB2 GLN A 51 0.494 -6.222 9.607 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.474 -7.607 8.533 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.520 -7.826 9.742 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -0.437 -8.950 10.538 1.00 0.00 H new ATOM 0 HE21 GLN A 51 0.652 -8.240 12.554 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -0.183 -7.085 13.597 1.00 0.00 H new ATOM 773 N CYS A 52 3.584 -6.948 8.523 1.00 0.00 N ATOM 774 CA CYS A 52 4.531 -7.060 7.414 1.00 0.00 C ATOM 775 C CYS A 52 5.830 -7.732 7.855 1.00 0.00 C ATOM 776 O CYS A 52 6.820 -7.062 8.157 1.00 0.00 O ATOM 777 CB CYS A 52 4.831 -5.680 6.822 1.00 0.00 C ATOM 778 SG CYS A 52 3.690 -5.173 5.513 1.00 0.00 S ATOM 0 H CYS A 52 3.513 -6.012 8.923 1.00 0.00 H new ATOM 0 HA CYS A 52 4.069 -7.683 6.649 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.802 -4.940 7.621 1.00 0.00 H new ATOM 0 HB3 CYS A 52 5.846 -5.680 6.424 1.00 0.00 H new ATOM 0 HG CYS A 52 3.464 -3.896 5.605 1.00 0.00 H new ATOM 784 N THR A 53 5.820 -9.062 7.879 1.00 0.00 N ATOM 785 CA THR A 53 6.998 -9.835 8.268 1.00 0.00 C ATOM 786 C THR A 53 7.975 -9.944 7.098 1.00 0.00 C ATOM 787 O THR A 53 7.600 -9.721 5.945 1.00 0.00 O ATOM 788 CB THR A 53 6.593 -11.236 8.749 1.00 0.00 C ATOM 789 OG1 THR A 53 5.278 -11.564 8.322 1.00 0.00 O ATOM 790 CG2 THR A 53 6.640 -11.390 10.256 1.00 0.00 C ATOM 0 H THR A 53 5.008 -9.629 7.633 1.00 0.00 H new ATOM 0 HA THR A 53 7.490 -9.315 9.090 1.00 0.00 H new ATOM 0 HB THR A 53 7.326 -11.910 8.306 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.045 -12.461 8.640 1.00 0.00 H new ATOM 0 HG21 THR A 53 6.342 -12.403 10.528 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.654 -11.203 10.609 1.00 0.00 H new ATOM 0 HG23 THR A 53 5.957 -10.676 10.716 1.00 0.00 H new ATOM 798 N ASP A 54 9.226 -10.290 7.395 1.00 0.00 N ATOM 799 CA ASP A 54 10.251 -10.427 6.359 1.00 0.00 C ATOM 800 C ASP A 54 10.224 -11.815 5.709 1.00 0.00 C ATOM 801 O ASP A 54 11.159 -12.188 5.000 1.00 0.00 O ATOM 802 CB ASP A 54 11.640 -10.151 6.945 1.00 0.00 C ATOM 803 CG ASP A 54 12.675 -9.859 5.872 1.00 0.00 C ATOM 804 OD1 ASP A 54 12.457 -8.924 5.072 1.00 0.00 O ATOM 805 OD2 ASP A 54 13.703 -10.568 5.833 1.00 0.00 O ATOM 0 H ASP A 54 9.555 -10.480 8.342 1.00 0.00 H new ATOM 0 HA ASP A 54 10.032 -9.692 5.584 1.00 0.00 H new ATOM 0 HB2 ASP A 54 11.581 -9.304 7.629 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.961 -11.012 7.531 1.00 0.00 H new ATOM 810 N ASP A 55 9.155 -12.578 5.950 1.00 0.00 N ATOM 811 CA ASP A 55 9.020 -13.914 5.385 1.00 0.00 C ATOM 812 C ASP A 55 7.670 -14.075 4.699 1.00 0.00 C ATOM 813 O ASP A 55 6.923 -15.014 4.981 1.00 0.00 O ATOM 814 CB ASP A 55 9.181 -14.962 6.483 1.00 0.00 C ATOM 815 CG ASP A 55 8.827 -14.436 7.864 1.00 0.00 C ATOM 816 OD1 ASP A 55 7.622 -14.391 8.192 1.00 0.00 O ATOM 817 OD2 ASP A 55 9.754 -14.066 8.613 1.00 0.00 O ATOM 0 H ASP A 55 8.371 -12.288 6.535 1.00 0.00 H new ATOM 0 HA ASP A 55 9.802 -14.056 4.639 1.00 0.00 H new ATOM 0 HB2 ASP A 55 8.549 -15.820 6.254 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.211 -15.318 6.489 1.00 0.00 H new ATOM 822 N VAL A 56 7.369 -13.145 3.799 1.00 0.00 N ATOM 823 CA VAL A 56 6.102 -13.148 3.056 1.00 0.00 C ATOM 824 C VAL A 56 5.942 -11.862 2.250 1.00 0.00 C ATOM 825 O VAL A 56 6.406 -10.800 2.663 1.00 0.00 O ATOM 826 CB VAL A 56 4.867 -13.290 3.983 1.00 0.00 C ATOM 827 CG1 VAL A 56 4.423 -14.743 4.082 1.00 0.00 C ATOM 828 CG2 VAL A 56 5.146 -12.710 5.366 1.00 0.00 C ATOM 0 H VAL A 56 7.988 -12.370 3.561 1.00 0.00 H new ATOM 0 HA VAL A 56 6.146 -14.013 2.395 1.00 0.00 H new ATOM 0 HB VAL A 56 4.052 -12.718 3.540 1.00 0.00 H new ATOM 0 HG11 VAL A 56 3.555 -14.814 4.738 1.00 0.00 H new ATOM 0 HG12 VAL A 56 4.160 -15.111 3.091 1.00 0.00 H new ATOM 0 HG13 VAL A 56 5.236 -15.345 4.489 1.00 0.00 H new ATOM 0 HG21 VAL A 56 4.262 -12.824 5.993 1.00 0.00 H new ATOM 0 HG22 VAL A 56 5.984 -13.239 5.820 1.00 0.00 H new ATOM 0 HG23 VAL A 56 5.392 -11.652 5.274 1.00 0.00 H new ATOM 838 N ARG A 57 5.271 -11.961 1.106 1.00 0.00 N ATOM 839 CA ARG A 57 5.040 -10.801 0.246 1.00 0.00 C ATOM 840 C ARG A 57 3.562 -10.421 0.237 1.00 0.00 C ATOM 841 O ARG A 57 2.696 -11.272 0.019 1.00 0.00 O ATOM 842 CB ARG A 57 5.517 -11.086 -1.181 1.00 0.00 C ATOM 843 CG ARG A 57 4.958 -12.375 -1.768 1.00 0.00 C ATOM 844 CD ARG A 57 4.106 -12.108 -2.997 1.00 0.00 C ATOM 845 NE ARG A 57 2.738 -11.725 -2.647 1.00 0.00 N ATOM 846 CZ ARG A 57 1.836 -11.302 -3.533 1.00 0.00 C ATOM 847 NH1 ARG A 57 2.155 -11.205 -4.817 1.00 0.00 N ATOM 848 NH2 ARG A 57 0.614 -10.974 -3.132 1.00 0.00 N ATOM 0 H ARG A 57 4.877 -12.832 0.752 1.00 0.00 H new ATOM 0 HA ARG A 57 5.612 -9.964 0.647 1.00 0.00 H new ATOM 0 HB2 ARG A 57 5.233 -10.252 -1.823 1.00 0.00 H new ATOM 0 HB3 ARG A 57 6.606 -11.137 -1.187 1.00 0.00 H new ATOM 0 HG2 ARG A 57 5.779 -13.041 -2.032 1.00 0.00 H new ATOM 0 HG3 ARG A 57 4.360 -12.889 -1.015 1.00 0.00 H new ATOM 0 HD2 ARG A 57 4.563 -11.315 -3.589 1.00 0.00 H new ATOM 0 HD3 ARG A 57 4.083 -13.000 -3.622 1.00 0.00 H new ATOM 0 HE ARG A 57 2.458 -11.785 -1.668 1.00 0.00 H new ATOM 0 HH11 ARG A 57 3.093 -11.454 -5.130 1.00 0.00 H new ATOM 0 HH12 ARG A 57 1.462 -10.881 -5.492 1.00 0.00 H new ATOM 0 HH21 ARG A 57 0.365 -11.045 -2.146 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -0.076 -10.650 -3.810 1.00 0.00 H new ATOM 862 N LEU A 58 3.278 -9.144 0.483 1.00 0.00 N ATOM 863 CA LEU A 58 1.901 -8.659 0.512 1.00 0.00 C ATOM 864 C LEU A 58 1.788 -7.263 -0.094 1.00 0.00 C ATOM 865 O LEU A 58 2.793 -6.634 -0.431 1.00 0.00 O ATOM 866 CB LEU A 58 1.372 -8.635 1.953 1.00 0.00 C ATOM 867 CG LEU A 58 1.895 -9.746 2.869 1.00 0.00 C ATOM 868 CD1 LEU A 58 2.082 -9.226 4.286 1.00 0.00 C ATOM 869 CD2 LEU A 58 0.949 -10.937 2.853 1.00 0.00 C ATOM 0 H LEU A 58 3.982 -8.428 0.665 1.00 0.00 H new ATOM 0 HA LEU A 58 1.300 -9.344 -0.086 1.00 0.00 H new ATOM 0 HB2 LEU A 58 1.625 -7.673 2.398 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.284 -8.696 1.923 1.00 0.00 H new ATOM 0 HG LEU A 58 2.865 -10.074 2.496 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.454 -10.029 4.922 1.00 0.00 H new ATOM 0 HD12 LEU A 58 2.799 -8.405 4.281 1.00 0.00 H new ATOM 0 HD13 LEU A 58 1.127 -8.870 4.672 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.335 -11.717 3.509 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -0.035 -10.624 3.201 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.868 -11.324 1.837 1.00 0.00 H new ATOM 881 N PHE A 59 0.554 -6.782 -0.217 1.00 0.00 N ATOM 882 CA PHE A 59 0.291 -5.457 -0.767 1.00 0.00 C ATOM 883 C PHE A 59 -0.336 -4.559 0.295 1.00 0.00 C ATOM 884 O PHE A 59 -0.764 -5.036 1.349 1.00 0.00 O ATOM 885 CB PHE A 59 -0.632 -5.553 -1.983 1.00 0.00 C ATOM 886 CG PHE A 59 0.055 -6.053 -3.222 1.00 0.00 C ATOM 887 CD1 PHE A 59 0.314 -7.403 -3.390 1.00 0.00 C ATOM 888 CD2 PHE A 59 0.443 -5.171 -4.218 1.00 0.00 C ATOM 889 CE1 PHE A 59 0.946 -7.865 -4.528 1.00 0.00 C ATOM 890 CE2 PHE A 59 1.075 -5.627 -5.359 1.00 0.00 C ATOM 891 CZ PHE A 59 1.326 -6.975 -5.515 1.00 0.00 C ATOM 0 H PHE A 59 -0.284 -7.294 0.059 1.00 0.00 H new ATOM 0 HA PHE A 59 1.239 -5.022 -1.083 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -1.464 -6.217 -1.746 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -1.057 -4.570 -2.185 1.00 0.00 H new ATOM 0 HD1 PHE A 59 0.018 -8.103 -2.622 1.00 0.00 H new ATOM 0 HD2 PHE A 59 0.249 -4.115 -4.101 1.00 0.00 H new ATOM 0 HE1 PHE A 59 1.143 -8.920 -4.646 1.00 0.00 H new ATOM 0 HE2 PHE A 59 1.372 -4.929 -6.128 1.00 0.00 H new ATOM 0 HZ PHE A 59 1.818 -7.334 -6.407 1.00 0.00 H new ATOM 901 N ALA A 60 -0.387 -3.259 0.019 1.00 0.00 N ATOM 902 CA ALA A 60 -0.959 -2.304 0.959 1.00 0.00 C ATOM 903 C ALA A 60 -1.535 -1.092 0.239 1.00 0.00 C ATOM 904 O ALA A 60 -1.103 -0.747 -0.862 1.00 0.00 O ATOM 905 CB ALA A 60 0.090 -1.866 1.967 1.00 0.00 C ATOM 0 H ALA A 60 -0.040 -2.845 -0.846 1.00 0.00 H new ATOM 0 HA ALA A 60 -1.775 -2.800 1.485 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -0.350 -1.153 2.664 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.451 -2.735 2.517 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.923 -1.396 1.444 1.00 0.00 H new ATOM 911 N PHE A 61 -2.512 -0.450 0.872 1.00 0.00 N ATOM 912 CA PHE A 61 -3.153 0.724 0.300 1.00 0.00 C ATOM 913 C PHE A 61 -3.338 1.816 1.350 1.00 0.00 C ATOM 914 O PHE A 61 -4.156 1.679 2.261 1.00 0.00 O ATOM 915 CB PHE A 61 -4.506 0.347 -0.304 1.00 0.00 C ATOM 916 CG PHE A 61 -4.821 1.096 -1.562 1.00 0.00 C ATOM 917 CD1 PHE A 61 -4.435 0.597 -2.793 1.00 0.00 C ATOM 918 CD2 PHE A 61 -5.499 2.302 -1.512 1.00 0.00 C ATOM 919 CE1 PHE A 61 -4.719 1.287 -3.955 1.00 0.00 C ATOM 920 CE2 PHE A 61 -5.788 2.997 -2.669 1.00 0.00 C ATOM 921 CZ PHE A 61 -5.397 2.489 -3.894 1.00 0.00 C ATOM 0 H PHE A 61 -2.876 -0.726 1.784 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.505 1.111 -0.486 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.518 -0.723 -0.513 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.289 0.537 0.430 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.906 -0.343 -2.846 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -5.805 2.703 -0.557 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -4.411 0.887 -4.910 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -6.319 3.936 -2.617 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.621 3.031 -4.801 1.00 0.00 H new ATOM 931 N VAL A 62 -2.578 2.899 1.211 1.00 0.00 N ATOM 932 CA VAL A 62 -2.661 4.019 2.141 1.00 0.00 C ATOM 933 C VAL A 62 -3.170 5.271 1.434 1.00 0.00 C ATOM 934 O VAL A 62 -2.581 5.722 0.449 1.00 0.00 O ATOM 935 CB VAL A 62 -1.296 4.324 2.794 1.00 0.00 C ATOM 936 CG1 VAL A 62 -1.455 5.328 3.928 1.00 0.00 C ATOM 937 CG2 VAL A 62 -0.641 3.044 3.299 1.00 0.00 C ATOM 0 H VAL A 62 -1.897 3.024 0.462 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.362 3.730 2.924 1.00 0.00 H new ATOM 0 HB VAL A 62 -0.647 4.763 2.036 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -0.481 5.529 4.375 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -1.874 6.255 3.537 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -2.124 4.919 4.685 1.00 0.00 H new ATOM 0 HG21 VAL A 62 0.320 3.282 3.755 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -1.287 2.572 4.039 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -0.486 2.361 2.464 1.00 0.00 H new ATOM 947 N ARG A 63 -4.270 5.825 1.941 1.00 0.00 N ATOM 948 CA ARG A 63 -4.865 7.025 1.360 1.00 0.00 C ATOM 949 C ARG A 63 -4.564 8.250 2.218 1.00 0.00 C ATOM 950 O ARG A 63 -5.119 8.407 3.309 1.00 0.00 O ATOM 951 CB ARG A 63 -6.377 6.845 1.210 1.00 0.00 C ATOM 952 CG ARG A 63 -7.033 7.887 0.317 1.00 0.00 C ATOM 953 CD ARG A 63 -8.548 7.786 0.367 1.00 0.00 C ATOM 954 NE ARG A 63 -9.177 9.085 0.606 1.00 0.00 N ATOM 955 CZ ARG A 63 -9.281 9.658 1.807 1.00 0.00 C ATOM 956 NH1 ARG A 63 -8.792 9.055 2.888 1.00 0.00 N ATOM 957 NH2 ARG A 63 -9.874 10.841 1.928 1.00 0.00 N ATOM 0 H ARG A 63 -4.767 5.461 2.754 1.00 0.00 H new ATOM 0 HA ARG A 63 -4.427 7.181 0.374 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.577 5.854 0.803 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.838 6.884 2.197 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.723 8.884 0.630 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.692 7.755 -0.710 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -8.915 7.373 -0.573 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.839 7.092 1.155 1.00 0.00 H new ATOM 0 HE ARG A 63 -9.561 9.585 -0.196 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -8.333 8.148 2.802 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -8.876 9.500 3.802 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -10.249 11.310 1.104 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -9.954 11.280 2.845 1.00 0.00 H new ATOM 971 N PHE A 64 -3.682 9.115 1.721 1.00 0.00 N ATOM 972 CA PHE A 64 -3.302 10.328 2.442 1.00 0.00 C ATOM 973 C PHE A 64 -3.980 11.558 1.842 1.00 0.00 C ATOM 974 O PHE A 64 -4.410 11.541 0.688 1.00 0.00 O ATOM 975 CB PHE A 64 -1.782 10.507 2.417 1.00 0.00 C ATOM 976 CG PHE A 64 -1.110 10.095 3.696 1.00 0.00 C ATOM 977 CD1 PHE A 64 -0.671 8.792 3.874 1.00 0.00 C ATOM 978 CD2 PHE A 64 -0.916 11.009 4.718 1.00 0.00 C ATOM 979 CE1 PHE A 64 -0.052 8.410 5.050 1.00 0.00 C ATOM 980 CE2 PHE A 64 -0.299 10.633 5.896 1.00 0.00 C ATOM 981 CZ PHE A 64 0.134 9.332 6.061 1.00 0.00 C ATOM 0 H PHE A 64 -3.217 8.998 0.821 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.633 10.222 3.475 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.369 9.924 1.594 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.550 11.553 2.214 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -0.814 8.068 3.086 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -1.251 12.028 4.593 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.285 7.392 5.178 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.156 11.355 6.686 1.00 0.00 H new ATOM 0 HZ PHE A 64 0.618 9.036 6.980 1.00 0.00 H new ATOM 991 N THR A 65 -4.068 12.625 2.634 1.00 0.00 N ATOM 992 CA THR A 65 -4.687 13.868 2.181 1.00 0.00 C ATOM 993 C THR A 65 -4.032 15.075 2.848 1.00 0.00 C ATOM 994 O THR A 65 -3.918 15.134 4.073 1.00 0.00 O ATOM 995 CB THR A 65 -6.196 13.851 2.464 1.00 0.00 C ATOM 996 OG1 THR A 65 -6.799 15.070 2.066 1.00 0.00 O ATOM 997 CG2 THR A 65 -6.539 13.626 3.924 1.00 0.00 C ATOM 0 H THR A 65 -3.719 12.653 3.592 1.00 0.00 H new ATOM 0 HA THR A 65 -4.537 13.951 1.105 1.00 0.00 H new ATOM 0 HB THR A 65 -6.581 13.011 1.886 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.760 15.036 2.254 1.00 0.00 H new ATOM 0 HG21 THR A 65 -7.622 13.626 4.048 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.137 12.666 4.248 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.105 14.424 4.527 1.00 0.00 H new ATOM 1005 N THR A 66 -3.596 16.034 2.030 1.00 0.00 N ATOM 1006 CA THR A 66 -2.947 17.240 2.537 1.00 0.00 C ATOM 1007 C THR A 66 -3.798 18.479 2.261 1.00 0.00 C ATOM 1008 O THR A 66 -3.644 19.136 1.230 1.00 0.00 O ATOM 1009 CB THR A 66 -1.561 17.406 1.911 1.00 0.00 C ATOM 1010 OG1 THR A 66 -1.618 17.264 0.502 1.00 0.00 O ATOM 1011 CG2 THR A 66 -0.543 16.413 2.431 1.00 0.00 C ATOM 0 H THR A 66 -3.681 15.997 1.014 1.00 0.00 H new ATOM 0 HA THR A 66 -2.837 17.132 3.616 1.00 0.00 H new ATOM 0 HB THR A 66 -1.243 18.410 2.192 1.00 0.00 H new ATOM 0 HG1 THR A 66 -2.308 17.859 0.141 1.00 0.00 H new ATOM 0 HG21 THR A 66 0.417 16.588 1.945 1.00 0.00 H new ATOM 0 HG22 THR A 66 -0.432 16.536 3.508 1.00 0.00 H new ATOM 0 HG23 THR A 66 -0.880 15.399 2.215 1.00 0.00 H new ATOM 1019 N GLY A 67 -4.692 18.789 3.196 1.00 0.00 N ATOM 1020 CA GLY A 67 -5.555 19.950 3.048 1.00 0.00 C ATOM 1021 C GLY A 67 -6.144 20.409 4.368 1.00 0.00 C ATOM 1022 O GLY A 67 -5.960 19.759 5.398 1.00 0.00 O ATOM 0 H GLY A 67 -4.835 18.257 4.054 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -4.986 20.767 2.604 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -6.363 19.712 2.357 1.00 0.00 H new ATOM 1026 N ASP A 68 -6.869 21.528 4.333 1.00 0.00 N ATOM 1027 CA ASP A 68 -7.499 22.073 5.534 1.00 0.00 C ATOM 1028 C ASP A 68 -8.637 23.026 5.173 1.00 0.00 C ATOM 1029 O ASP A 68 -8.474 24.247 5.209 1.00 0.00 O ATOM 1030 CB ASP A 68 -6.465 22.796 6.403 1.00 0.00 C ATOM 1031 CG ASP A 68 -6.827 22.772 7.876 1.00 0.00 C ATOM 1032 OD1 ASP A 68 -7.909 23.286 8.232 1.00 0.00 O ATOM 1033 OD2 ASP A 68 -6.028 22.238 8.675 1.00 0.00 O ATOM 0 H ASP A 68 -7.034 22.073 3.487 1.00 0.00 H new ATOM 0 HA ASP A 68 -7.915 21.240 6.100 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -5.489 22.331 6.264 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -6.375 23.830 6.071 1.00 0.00 H new ATOM 1038 N ALA A 69 -9.791 22.456 4.827 1.00 0.00 N ATOM 1039 CA ALA A 69 -10.975 23.238 4.459 1.00 0.00 C ATOM 1040 C ALA A 69 -10.648 24.363 3.474 1.00 0.00 C ATOM 1041 O ALA A 69 -11.291 25.414 3.476 1.00 0.00 O ATOM 1042 CB ALA A 69 -11.629 23.806 5.702 1.00 0.00 C ATOM 0 H ALA A 69 -9.933 21.447 4.793 1.00 0.00 H new ATOM 0 HA ALA A 69 -11.667 22.562 3.957 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -12.508 24.385 5.418 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -11.929 22.991 6.360 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -10.922 24.451 6.223 1.00 0.00 H new ATOM 1048 N MET A 70 -9.650 24.128 2.637 1.00 0.00 N ATOM 1049 CA MET A 70 -9.231 25.110 1.636 1.00 0.00 C ATOM 1050 C MET A 70 -8.663 24.432 0.388 1.00 0.00 C ATOM 1051 O MET A 70 -8.846 24.920 -0.728 1.00 0.00 O ATOM 1052 CB MET A 70 -8.196 26.074 2.230 1.00 0.00 C ATOM 1053 CG MET A 70 -6.962 25.389 2.795 1.00 0.00 C ATOM 1054 SD MET A 70 -5.435 26.242 2.355 1.00 0.00 S ATOM 1055 CE MET A 70 -4.628 26.332 3.949 1.00 0.00 C ATOM 0 H MET A 70 -9.110 23.263 2.627 1.00 0.00 H new ATOM 0 HA MET A 70 -10.115 25.675 1.339 1.00 0.00 H new ATOM 0 HB2 MET A 70 -7.886 26.778 1.458 1.00 0.00 H new ATOM 0 HB3 MET A 70 -8.669 26.656 3.021 1.00 0.00 H new ATOM 0 HG2 MET A 70 -7.045 25.336 3.881 1.00 0.00 H new ATOM 0 HG3 MET A 70 -6.920 24.363 2.428 1.00 0.00 H new ATOM 0 HE1 MET A 70 -3.667 26.835 3.842 1.00 0.00 H new ATOM 0 HE2 MET A 70 -5.255 26.891 4.643 1.00 0.00 H new ATOM 0 HE3 MET A 70 -4.469 25.325 4.334 1.00 0.00 H new ATOM 1065 N SER A 71 -7.976 23.305 0.581 1.00 0.00 N ATOM 1066 CA SER A 71 -7.386 22.561 -0.527 1.00 0.00 C ATOM 1067 C SER A 71 -7.141 21.109 -0.127 1.00 0.00 C ATOM 1068 O SER A 71 -6.022 20.726 0.217 1.00 0.00 O ATOM 1069 CB SER A 71 -6.072 23.216 -0.970 1.00 0.00 C ATOM 1070 OG SER A 71 -5.838 23.017 -2.354 1.00 0.00 O ATOM 0 H SER A 71 -7.816 22.888 1.498 1.00 0.00 H new ATOM 0 HA SER A 71 -8.085 22.578 -1.363 1.00 0.00 H new ATOM 0 HB2 SER A 71 -6.105 24.284 -0.754 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.244 22.800 -0.396 1.00 0.00 H new ATOM 0 HG SER A 71 -4.995 23.447 -2.608 1.00 0.00 H new ATOM 1076 N LYS A 72 -8.202 20.304 -0.169 1.00 0.00 N ATOM 1077 CA LYS A 72 -8.106 18.895 0.192 1.00 0.00 C ATOM 1078 C LYS A 72 -7.524 18.079 -0.959 1.00 0.00 C ATOM 1079 O LYS A 72 -8.237 17.715 -1.898 1.00 0.00 O ATOM 1080 CB LYS A 72 -9.485 18.348 0.581 1.00 0.00 C ATOM 1081 CG LYS A 72 -9.742 18.348 2.081 1.00 0.00 C ATOM 1082 CD LYS A 72 -10.355 17.034 2.539 1.00 0.00 C ATOM 1083 CE LYS A 72 -11.406 17.251 3.620 1.00 0.00 C ATOM 1084 NZ LYS A 72 -12.537 16.286 3.502 1.00 0.00 N ATOM 0 H LYS A 72 -9.135 20.605 -0.449 1.00 0.00 H new ATOM 0 HA LYS A 72 -7.438 18.809 1.049 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -10.254 18.944 0.089 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -9.582 17.330 0.205 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -8.806 18.519 2.612 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -10.409 19.171 2.337 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -10.808 16.527 1.687 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -9.571 16.379 2.919 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -10.943 17.148 4.601 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -11.790 18.269 3.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -13.229 16.469 4.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -12.996 16.401 2.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -12.176 15.315 3.591 1.00 0.00 H new ATOM 1098 N ARG A 73 -6.225 17.799 -0.881 1.00 0.00 N ATOM 1099 CA ARG A 73 -5.544 17.028 -1.916 1.00 0.00 C ATOM 1100 C ARG A 73 -5.367 15.577 -1.482 1.00 0.00 C ATOM 1101 O ARG A 73 -4.596 15.285 -0.568 1.00 0.00 O ATOM 1102 CB ARG A 73 -4.182 17.648 -2.238 1.00 0.00 C ATOM 1103 CG ARG A 73 -3.779 17.504 -3.697 1.00 0.00 C ATOM 1104 CD ARG A 73 -4.020 18.789 -4.474 1.00 0.00 C ATOM 1105 NE ARG A 73 -3.018 19.810 -4.169 1.00 0.00 N ATOM 1106 CZ ARG A 73 -3.173 21.110 -4.436 1.00 0.00 C ATOM 1107 NH1 ARG A 73 -4.285 21.554 -5.012 1.00 0.00 N ATOM 1108 NH2 ARG A 73 -2.208 21.966 -4.125 1.00 0.00 N ATOM 0 H ARG A 73 -5.624 18.095 -0.112 1.00 0.00 H new ATOM 0 HA ARG A 73 -6.162 17.049 -2.814 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -4.203 18.706 -1.978 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -3.422 17.181 -1.612 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -2.725 17.233 -3.759 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -4.344 16.691 -4.153 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -4.005 18.575 -5.543 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -5.013 19.174 -4.240 1.00 0.00 H new ATOM 0 HE ARG A 73 -2.149 19.512 -3.726 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -5.030 20.901 -5.254 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -4.394 22.548 -5.212 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -1.352 21.631 -3.684 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -2.323 22.959 -4.327 1.00 0.00 H new ATOM 1122 N SER A 74 -6.089 14.673 -2.142 1.00 0.00 N ATOM 1123 CA SER A 74 -6.014 13.250 -1.826 1.00 0.00 C ATOM 1124 C SER A 74 -4.906 12.570 -2.624 1.00 0.00 C ATOM 1125 O SER A 74 -4.701 12.869 -3.801 1.00 0.00 O ATOM 1126 CB SER A 74 -7.357 12.567 -2.109 1.00 0.00 C ATOM 1127 OG SER A 74 -8.043 13.201 -3.177 1.00 0.00 O ATOM 0 H SER A 74 -6.733 14.902 -2.899 1.00 0.00 H new ATOM 0 HA SER A 74 -5.783 13.154 -0.765 1.00 0.00 H new ATOM 0 HB2 SER A 74 -7.190 11.518 -2.353 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.976 12.590 -1.212 1.00 0.00 H new ATOM 0 HG SER A 74 -8.895 12.743 -3.336 1.00 0.00 H new ATOM 1133 N LYS A 75 -4.194 11.652 -1.973 1.00 0.00 N ATOM 1134 CA LYS A 75 -3.104 10.925 -2.615 1.00 0.00 C ATOM 1135 C LYS A 75 -3.236 9.423 -2.379 1.00 0.00 C ATOM 1136 O LYS A 75 -3.266 8.967 -1.235 1.00 0.00 O ATOM 1137 CB LYS A 75 -1.754 11.415 -2.088 1.00 0.00 C ATOM 1138 CG LYS A 75 -1.233 12.652 -2.800 1.00 0.00 C ATOM 1139 CD LYS A 75 0.280 12.755 -2.699 1.00 0.00 C ATOM 1140 CE LYS A 75 0.858 13.611 -3.816 1.00 0.00 C ATOM 1141 NZ LYS A 75 0.940 12.868 -5.104 1.00 0.00 N ATOM 0 H LYS A 75 -4.354 11.395 -0.999 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.160 11.114 -3.687 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.846 11.631 -1.024 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.022 10.614 -2.188 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -1.528 12.621 -3.849 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.689 13.542 -2.367 1.00 0.00 H new ATOM 0 HD2 LYS A 75 0.553 13.182 -1.734 1.00 0.00 H new ATOM 0 HD3 LYS A 75 0.717 11.757 -2.741 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.240 14.499 -3.949 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.853 13.954 -3.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.599 13.355 -5.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 1.280 11.901 -4.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.002 12.828 -5.542 1.00 0.00 H new ATOM 1155 N PHE A 76 -3.313 8.662 -3.468 1.00 0.00 N ATOM 1156 CA PHE A 76 -3.438 7.211 -3.382 1.00 0.00 C ATOM 1157 C PHE A 76 -2.070 6.550 -3.516 1.00 0.00 C ATOM 1158 O PHE A 76 -1.404 6.682 -4.546 1.00 0.00 O ATOM 1159 CB PHE A 76 -4.386 6.689 -4.466 1.00 0.00 C ATOM 1160 CG PHE A 76 -5.837 6.957 -4.178 1.00 0.00 C ATOM 1161 CD1 PHE A 76 -6.296 8.253 -3.997 1.00 0.00 C ATOM 1162 CD2 PHE A 76 -6.742 5.913 -4.089 1.00 0.00 C ATOM 1163 CE1 PHE A 76 -7.629 8.500 -3.732 1.00 0.00 C ATOM 1164 CE2 PHE A 76 -8.076 6.154 -3.824 1.00 0.00 C ATOM 1165 CZ PHE A 76 -8.520 7.449 -3.645 1.00 0.00 C ATOM 0 H PHE A 76 -3.291 9.027 -4.420 1.00 0.00 H new ATOM 0 HA PHE A 76 -3.853 6.959 -2.406 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.123 7.148 -5.419 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.239 5.615 -4.579 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -5.603 9.079 -4.064 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -6.401 4.898 -4.228 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -7.974 9.514 -3.593 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.771 5.330 -3.757 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.563 7.640 -3.437 1.00 0.00 H new ATOM 1175 N ALA A 77 -1.651 5.848 -2.464 1.00 0.00 N ATOM 1176 CA ALA A 77 -0.357 5.174 -2.459 1.00 0.00 C ATOM 1177 C ALA A 77 -0.513 3.666 -2.288 1.00 0.00 C ATOM 1178 O ALA A 77 -1.323 3.201 -1.482 1.00 0.00 O ATOM 1179 CB ALA A 77 0.528 5.741 -1.357 1.00 0.00 C ATOM 0 H ALA A 77 -2.190 5.732 -1.606 1.00 0.00 H new ATOM 0 HA ALA A 77 0.116 5.353 -3.424 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.491 5.230 -1.364 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.682 6.807 -1.526 1.00 0.00 H new ATOM 0 HB3 ALA A 77 0.046 5.593 -0.391 1.00 0.00 H new ATOM 1185 N LEU A 78 0.275 2.909 -3.048 1.00 0.00 N ATOM 1186 CA LEU A 78 0.240 1.451 -2.986 1.00 0.00 C ATOM 1187 C LEU A 78 1.590 0.906 -2.525 1.00 0.00 C ATOM 1188 O LEU A 78 2.535 0.812 -3.311 1.00 0.00 O ATOM 1189 CB LEU A 78 -0.128 0.870 -4.354 1.00 0.00 C ATOM 1190 CG LEU A 78 -0.304 -0.651 -4.392 1.00 0.00 C ATOM 1191 CD1 LEU A 78 -1.702 -1.036 -3.934 1.00 0.00 C ATOM 1192 CD2 LEU A 78 -0.032 -1.183 -5.793 1.00 0.00 C ATOM 0 H LEU A 78 0.948 3.284 -3.716 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.520 1.152 -2.264 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.054 1.335 -4.691 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.647 1.148 -5.069 1.00 0.00 H new ATOM 0 HG LEU A 78 0.416 -1.101 -3.709 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.810 -2.120 -3.967 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.860 -0.687 -2.914 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.440 -0.578 -4.593 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.161 -2.265 -5.803 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.729 -0.728 -6.497 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.989 -0.937 -6.084 1.00 0.00 H new ATOM 1204 N ILE A 79 1.673 0.556 -1.242 1.00 0.00 N ATOM 1205 CA ILE A 79 2.909 0.027 -0.671 1.00 0.00 C ATOM 1206 C ILE A 79 3.008 -1.481 -0.879 1.00 0.00 C ATOM 1207 O ILE A 79 2.228 -2.248 -0.316 1.00 0.00 O ATOM 1208 CB ILE A 79 3.019 0.336 0.839 1.00 0.00 C ATOM 1209 CG1 ILE A 79 2.754 1.821 1.105 1.00 0.00 C ATOM 1210 CG2 ILE A 79 4.391 -0.063 1.366 1.00 0.00 C ATOM 1211 CD1 ILE A 79 2.685 2.167 2.576 1.00 0.00 C ATOM 0 H ILE A 79 0.900 0.629 -0.580 1.00 0.00 H new ATOM 0 HA ILE A 79 3.730 0.520 -1.191 1.00 0.00 H new ATOM 0 HB ILE A 79 2.264 -0.248 1.365 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.541 2.412 0.637 1.00 0.00 H new ATOM 0 HG13 ILE A 79 1.816 2.106 0.628 1.00 0.00 H new ATOM 0 HG21 ILE A 79 4.451 0.162 2.431 1.00 0.00 H new ATOM 0 HG22 ILE A 79 4.544 -1.131 1.211 1.00 0.00 H new ATOM 0 HG23 ILE A 79 5.162 0.495 0.834 1.00 0.00 H new ATOM 0 HD11 ILE A 79 2.495 3.234 2.690 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.879 1.603 3.045 1.00 0.00 H new ATOM 0 HD13 ILE A 79 3.631 1.914 3.054 1.00 0.00 H new ATOM 1223 N THR A 80 3.981 -1.897 -1.687 1.00 0.00 N ATOM 1224 CA THR A 80 4.193 -3.313 -1.966 1.00 0.00 C ATOM 1225 C THR A 80 5.330 -3.863 -1.109 1.00 0.00 C ATOM 1226 O THR A 80 6.497 -3.543 -1.334 1.00 0.00 O ATOM 1227 CB THR A 80 4.508 -3.528 -3.449 1.00 0.00 C ATOM 1228 OG1 THR A 80 3.661 -2.737 -4.267 1.00 0.00 O ATOM 1229 CG2 THR A 80 4.355 -4.969 -3.890 1.00 0.00 C ATOM 0 H THR A 80 4.634 -1.272 -2.159 1.00 0.00 H new ATOM 0 HA THR A 80 3.276 -3.848 -1.720 1.00 0.00 H new ATOM 0 HB THR A 80 5.552 -3.236 -3.565 1.00 0.00 H new ATOM 0 HG1 THR A 80 3.881 -2.889 -5.210 1.00 0.00 H new ATOM 0 HG21 THR A 80 4.593 -5.052 -4.950 1.00 0.00 H new ATOM 0 HG22 THR A 80 5.034 -5.599 -3.315 1.00 0.00 H new ATOM 0 HG23 THR A 80 3.328 -5.294 -3.722 1.00 0.00 H new ATOM 1237 N TRP A 81 4.984 -4.691 -0.126 1.00 0.00 N ATOM 1238 CA TRP A 81 5.980 -5.281 0.762 1.00 0.00 C ATOM 1239 C TRP A 81 6.331 -6.700 0.320 1.00 0.00 C ATOM 1240 O TRP A 81 5.461 -7.462 -0.103 1.00 0.00 O ATOM 1241 CB TRP A 81 5.471 -5.293 2.207 1.00 0.00 C ATOM 1242 CG TRP A 81 6.400 -5.988 3.153 1.00 0.00 C ATOM 1243 CD1 TRP A 81 6.211 -7.206 3.739 1.00 0.00 C ATOM 1244 CD2 TRP A 81 7.668 -5.511 3.614 1.00 0.00 C ATOM 1245 NE1 TRP A 81 7.284 -7.514 4.537 1.00 0.00 N ATOM 1246 CE2 TRP A 81 8.191 -6.490 4.478 1.00 0.00 C ATOM 1247 CE3 TRP A 81 8.411 -4.350 3.379 1.00 0.00 C ATOM 1248 CZ2 TRP A 81 9.425 -6.343 5.107 1.00 0.00 C ATOM 1249 CZ3 TRP A 81 9.634 -4.206 4.006 1.00 0.00 C ATOM 1250 CH2 TRP A 81 10.131 -5.198 4.861 1.00 0.00 C ATOM 0 H TRP A 81 4.023 -4.968 0.075 1.00 0.00 H new ATOM 0 HA TRP A 81 6.881 -4.670 0.710 1.00 0.00 H new ATOM 0 HB2 TRP A 81 5.323 -4.266 2.542 1.00 0.00 H new ATOM 0 HB3 TRP A 81 4.497 -5.782 2.239 1.00 0.00 H new ATOM 0 HD1 TRP A 81 5.345 -7.835 3.596 1.00 0.00 H new ATOM 0 HE1 TRP A 81 7.389 -8.368 5.085 1.00 0.00 H new ATOM 0 HE3 TRP A 81 8.036 -3.581 2.720 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 9.811 -7.107 5.766 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 10.217 -3.313 3.834 1.00 0.00 H new ATOM 0 HH2 TRP A 81 11.091 -5.056 5.335 1.00 0.00 H new ATOM 1261 N ILE A 82 7.612 -7.048 0.424 1.00 0.00 N ATOM 1262 CA ILE A 82 8.076 -8.376 0.036 1.00 0.00 C ATOM 1263 C ILE A 82 9.118 -8.908 1.019 1.00 0.00 C ATOM 1264 O ILE A 82 10.311 -8.633 0.879 1.00 0.00 O ATOM 1265 CB ILE A 82 8.676 -8.377 -1.389 1.00 0.00 C ATOM 1266 CG1 ILE A 82 7.704 -7.741 -2.389 1.00 0.00 C ATOM 1267 CG2 ILE A 82 9.022 -9.799 -1.814 1.00 0.00 C ATOM 1268 CD1 ILE A 82 8.249 -7.665 -3.799 1.00 0.00 C ATOM 0 H ILE A 82 8.345 -6.430 0.773 1.00 0.00 H new ATOM 0 HA ILE A 82 7.203 -9.028 0.050 1.00 0.00 H new ATOM 0 HB ILE A 82 9.590 -7.782 -1.378 1.00 0.00 H new ATOM 0 HG12 ILE A 82 6.777 -8.315 -2.397 1.00 0.00 H new ATOM 0 HG13 ILE A 82 7.454 -6.736 -2.050 1.00 0.00 H new ATOM 0 HG21 ILE A 82 9.444 -9.786 -2.819 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.750 -10.219 -1.120 1.00 0.00 H new ATOM 0 HG23 ILE A 82 8.120 -10.411 -1.807 1.00 0.00 H new ATOM 0 HD11 ILE A 82 7.507 -7.204 -4.451 1.00 0.00 H new ATOM 0 HD12 ILE A 82 9.160 -7.066 -3.805 1.00 0.00 H new ATOM 0 HD13 ILE A 82 8.473 -8.670 -4.157 1.00 0.00 H new ATOM 1280 N GLY A 83 8.662 -9.680 2.007 1.00 0.00 N ATOM 1281 CA GLY A 83 9.568 -10.250 2.989 1.00 0.00 C ATOM 1282 C GLY A 83 10.559 -11.199 2.346 1.00 0.00 C ATOM 1283 O GLY A 83 10.176 -12.275 1.888 1.00 0.00 O ATOM 0 H GLY A 83 7.680 -9.920 2.143 1.00 0.00 H new ATOM 0 HA2 GLY A 83 10.106 -9.450 3.497 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.995 -10.781 3.749 1.00 0.00 H new ATOM 1287 N GLU A 84 11.825 -10.774 2.300 1.00 0.00 N ATOM 1288 CA GLU A 84 12.916 -11.546 1.688 1.00 0.00 C ATOM 1289 C GLU A 84 12.769 -13.053 1.840 1.00 0.00 C ATOM 1290 O GLU A 84 13.068 -13.799 0.907 1.00 0.00 O ATOM 1291 CB GLU A 84 14.256 -11.144 2.284 1.00 0.00 C ATOM 1292 CG GLU A 84 14.711 -9.743 1.903 1.00 0.00 C ATOM 1293 CD GLU A 84 15.483 -9.712 0.597 1.00 0.00 C ATOM 1294 OE1 GLU A 84 14.915 -10.115 -0.440 1.00 0.00 O ATOM 1295 OE2 GLU A 84 16.657 -9.284 0.611 1.00 0.00 O ATOM 0 H GLU A 84 12.126 -9.880 2.688 1.00 0.00 H new ATOM 0 HA GLU A 84 12.866 -11.311 0.625 1.00 0.00 H new ATOM 0 HB2 GLU A 84 14.193 -11.211 3.370 1.00 0.00 H new ATOM 0 HB3 GLU A 84 15.013 -11.860 1.964 1.00 0.00 H new ATOM 0 HG2 GLU A 84 13.840 -9.093 1.821 1.00 0.00 H new ATOM 0 HG3 GLU A 84 15.336 -9.340 2.699 1.00 0.00 H new ATOM 1302 N ASN A 85 12.321 -13.513 3.007 1.00 0.00 N ATOM 1303 CA ASN A 85 12.157 -14.943 3.253 1.00 0.00 C ATOM 1304 C ASN A 85 10.951 -15.508 2.502 1.00 0.00 C ATOM 1305 O ASN A 85 10.200 -16.332 3.026 1.00 0.00 O ATOM 1306 CB ASN A 85 12.034 -15.206 4.753 1.00 0.00 C ATOM 1307 CG ASN A 85 13.353 -15.013 5.466 1.00 0.00 C ATOM 1308 OD1 ASN A 85 14.003 -15.978 5.867 1.00 0.00 O ATOM 1309 ND2 ASN A 85 13.753 -13.759 5.632 1.00 0.00 N ATOM 0 H ASN A 85 12.066 -12.917 3.795 1.00 0.00 H new ATOM 0 HA ASN A 85 13.042 -15.455 2.876 1.00 0.00 H new ATOM 0 HB2 ASN A 85 11.288 -14.535 5.180 1.00 0.00 H new ATOM 0 HB3 ASN A 85 11.678 -16.223 4.916 1.00 0.00 H new ATOM 0 HD21 ASN A 85 14.633 -13.563 6.109 1.00 0.00 H new ATOM 0 HD22 ASN A 85 13.181 -12.991 5.282 1.00 0.00 H new ATOM 1316 N VAL A 86 10.795 -15.071 1.257 1.00 0.00 N ATOM 1317 CA VAL A 86 9.706 -15.534 0.402 1.00 0.00 C ATOM 1318 C VAL A 86 10.203 -16.618 -0.550 1.00 0.00 C ATOM 1319 O VAL A 86 11.291 -16.503 -1.119 1.00 0.00 O ATOM 1320 CB VAL A 86 9.085 -14.386 -0.428 1.00 0.00 C ATOM 1321 CG1 VAL A 86 8.115 -13.572 0.415 1.00 0.00 C ATOM 1322 CG2 VAL A 86 10.169 -13.495 -1.020 1.00 0.00 C ATOM 0 H VAL A 86 11.414 -14.392 0.814 1.00 0.00 H new ATOM 0 HA VAL A 86 8.937 -15.935 1.062 1.00 0.00 H new ATOM 0 HB VAL A 86 8.527 -14.830 -1.252 1.00 0.00 H new ATOM 0 HG11 VAL A 86 7.691 -12.771 -0.190 1.00 0.00 H new ATOM 0 HG12 VAL A 86 7.314 -14.218 0.774 1.00 0.00 H new ATOM 0 HG13 VAL A 86 8.644 -13.143 1.266 1.00 0.00 H new ATOM 0 HG21 VAL A 86 9.707 -12.696 -1.599 1.00 0.00 H new ATOM 0 HG22 VAL A 86 10.764 -13.063 -0.216 1.00 0.00 H new ATOM 0 HG23 VAL A 86 10.813 -14.088 -1.670 1.00 0.00 H new ATOM 1332 N SER A 87 9.408 -17.669 -0.720 1.00 0.00 N ATOM 1333 CA SER A 87 9.782 -18.770 -1.605 1.00 0.00 C ATOM 1334 C SER A 87 9.830 -18.316 -3.063 1.00 0.00 C ATOM 1335 O SER A 87 9.327 -17.243 -3.407 1.00 0.00 O ATOM 1336 CB SER A 87 8.809 -19.941 -1.448 1.00 0.00 C ATOM 1337 OG SER A 87 9.202 -20.792 -0.384 1.00 0.00 O ATOM 0 H SER A 87 8.505 -17.783 -0.260 1.00 0.00 H new ATOM 0 HA SER A 87 10.780 -19.101 -1.319 1.00 0.00 H new ATOM 0 HB2 SER A 87 7.805 -19.561 -1.262 1.00 0.00 H new ATOM 0 HB3 SER A 87 8.767 -20.510 -2.377 1.00 0.00 H new ATOM 0 HG SER A 87 8.563 -21.531 -0.303 1.00 0.00 H new ATOM 1343 N GLY A 88 10.441 -19.142 -3.912 1.00 0.00 N ATOM 1344 CA GLY A 88 10.553 -18.818 -5.327 1.00 0.00 C ATOM 1345 C GLY A 88 9.209 -18.554 -5.983 1.00 0.00 C ATOM 1346 O GLY A 88 9.100 -17.687 -6.850 1.00 0.00 O ATOM 0 H GLY A 88 10.861 -20.032 -3.644 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.187 -17.939 -5.444 1.00 0.00 H new ATOM 0 HA3 GLY A 88 11.049 -19.640 -5.844 1.00 0.00 H new ATOM 1350 N LEU A 89 8.185 -19.300 -5.565 1.00 0.00 N ATOM 1351 CA LEU A 89 6.842 -19.141 -6.117 1.00 0.00 C ATOM 1352 C LEU A 89 6.279 -17.753 -5.804 1.00 0.00 C ATOM 1353 O LEU A 89 5.575 -17.163 -6.625 1.00 0.00 O ATOM 1354 CB LEU A 89 5.908 -20.221 -5.563 1.00 0.00 C ATOM 1355 CG LEU A 89 5.933 -21.550 -6.324 1.00 0.00 C ATOM 1356 CD1 LEU A 89 5.800 -22.722 -5.363 1.00 0.00 C ATOM 1357 CD2 LEU A 89 4.825 -21.591 -7.367 1.00 0.00 C ATOM 0 H LEU A 89 8.262 -20.020 -4.846 1.00 0.00 H new ATOM 0 HA LEU A 89 6.909 -19.248 -7.200 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.172 -20.410 -4.523 1.00 0.00 H new ATOM 0 HB3 LEU A 89 4.888 -19.836 -5.568 1.00 0.00 H new ATOM 0 HG LEU A 89 6.892 -21.631 -6.835 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.820 -23.656 -5.924 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.628 -22.707 -4.654 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.857 -22.644 -4.822 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.859 -22.543 -7.897 1.00 0.00 H new ATOM 0 HD22 LEU A 89 3.858 -21.484 -6.875 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.963 -20.775 -8.077 1.00 0.00 H new ATOM 1369 N GLN A 90 6.600 -17.237 -4.615 1.00 0.00 N ATOM 1370 CA GLN A 90 6.136 -15.917 -4.193 1.00 0.00 C ATOM 1371 C GLN A 90 6.687 -14.823 -5.108 1.00 0.00 C ATOM 1372 O GLN A 90 5.996 -13.847 -5.405 1.00 0.00 O ATOM 1373 CB GLN A 90 6.552 -15.642 -2.747 1.00 0.00 C ATOM 1374 CG GLN A 90 5.385 -15.622 -1.774 1.00 0.00 C ATOM 1375 CD GLN A 90 5.006 -17.008 -1.291 1.00 0.00 C ATOM 1376 OE1 GLN A 90 4.133 -17.659 -1.867 1.00 0.00 O ATOM 1377 NE2 GLN A 90 5.661 -17.470 -0.232 1.00 0.00 N ATOM 0 H GLN A 90 7.181 -17.716 -3.927 1.00 0.00 H new ATOM 0 HA GLN A 90 5.048 -15.908 -4.260 1.00 0.00 H new ATOM 0 HB2 GLN A 90 7.265 -16.404 -2.431 1.00 0.00 H new ATOM 0 HB3 GLN A 90 7.069 -14.683 -2.702 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.642 -15.000 -0.917 1.00 0.00 H new ATOM 0 HG3 GLN A 90 4.523 -15.161 -2.256 1.00 0.00 H new ATOM 0 HE21 GLN A 90 6.377 -16.897 0.215 1.00 0.00 H new ATOM 0 HE22 GLN A 90 5.448 -18.398 0.135 1.00 0.00 H new ATOM 1386 N ARG A 91 7.933 -14.998 -5.555 1.00 0.00 N ATOM 1387 CA ARG A 91 8.579 -14.032 -6.443 1.00 0.00 C ATOM 1388 C ARG A 91 7.740 -13.805 -7.699 1.00 0.00 C ATOM 1389 O ARG A 91 7.530 -12.665 -8.116 1.00 0.00 O ATOM 1390 CB ARG A 91 9.978 -14.523 -6.829 1.00 0.00 C ATOM 1391 CG ARG A 91 10.932 -13.406 -7.221 1.00 0.00 C ATOM 1392 CD ARG A 91 12.172 -13.395 -6.339 1.00 0.00 C ATOM 1393 NE ARG A 91 13.265 -14.177 -6.917 1.00 0.00 N ATOM 1394 CZ ARG A 91 14.340 -14.573 -6.233 1.00 0.00 C ATOM 1395 NH1 ARG A 91 14.471 -14.267 -4.944 1.00 0.00 N ATOM 1396 NH2 ARG A 91 15.287 -15.277 -6.840 1.00 0.00 N ATOM 0 H ARG A 91 8.514 -15.801 -5.315 1.00 0.00 H new ATOM 0 HA ARG A 91 8.668 -13.085 -5.911 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.404 -15.075 -5.991 1.00 0.00 H new ATOM 0 HB3 ARG A 91 9.891 -15.223 -7.660 1.00 0.00 H new ATOM 0 HG2 ARG A 91 11.227 -13.527 -8.263 1.00 0.00 H new ATOM 0 HG3 ARG A 91 10.421 -12.446 -7.144 1.00 0.00 H new ATOM 0 HD2 ARG A 91 12.502 -12.367 -6.190 1.00 0.00 H new ATOM 0 HD3 ARG A 91 11.921 -13.794 -5.356 1.00 0.00 H new ATOM 0 HE ARG A 91 13.201 -14.435 -7.902 1.00 0.00 H new ATOM 0 HH11 ARG A 91 13.746 -13.726 -4.472 1.00 0.00 H new ATOM 0 HH12 ARG A 91 15.296 -14.574 -4.428 1.00 0.00 H new ATOM 0 HH21 ARG A 91 15.192 -15.514 -7.827 1.00 0.00 H new ATOM 0 HH22 ARG A 91 16.110 -15.581 -6.319 1.00 0.00 H new ATOM 1410 N ALA A 92 7.256 -14.899 -8.287 1.00 0.00 N ATOM 1411 CA ALA A 92 6.429 -14.830 -9.490 1.00 0.00 C ATOM 1412 C ALA A 92 5.052 -14.244 -9.181 1.00 0.00 C ATOM 1413 O ALA A 92 4.481 -13.519 -9.998 1.00 0.00 O ATOM 1414 CB ALA A 92 6.285 -16.212 -10.110 1.00 0.00 C ATOM 0 H ALA A 92 7.424 -15.846 -7.948 1.00 0.00 H new ATOM 0 HA ALA A 92 6.925 -14.170 -10.202 1.00 0.00 H new ATOM 0 HB1 ALA A 92 5.667 -16.147 -11.005 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.270 -16.596 -10.376 1.00 0.00 H new ATOM 0 HB3 ALA A 92 5.815 -16.885 -9.393 1.00 0.00 H new ATOM 1420 N LYS A 93 4.527 -14.564 -7.997 1.00 0.00 N ATOM 1421 CA LYS A 93 3.216 -14.074 -7.570 1.00 0.00 C ATOM 1422 C LYS A 93 3.133 -12.551 -7.656 1.00 0.00 C ATOM 1423 O LYS A 93 2.117 -12.003 -8.090 1.00 0.00 O ATOM 1424 CB LYS A 93 2.923 -14.528 -6.138 1.00 0.00 C ATOM 1425 CG LYS A 93 2.180 -15.852 -6.058 1.00 0.00 C ATOM 1426 CD LYS A 93 0.711 -15.698 -6.430 1.00 0.00 C ATOM 1427 CE LYS A 93 0.425 -16.249 -7.819 1.00 0.00 C ATOM 1428 NZ LYS A 93 0.201 -17.723 -7.799 1.00 0.00 N ATOM 0 H LYS A 93 4.992 -15.163 -7.315 1.00 0.00 H new ATOM 0 HA LYS A 93 2.470 -14.494 -8.244 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.864 -14.616 -5.594 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.335 -13.760 -5.636 1.00 0.00 H new ATOM 0 HG2 LYS A 93 2.650 -16.574 -6.725 1.00 0.00 H new ATOM 0 HG3 LYS A 93 2.259 -16.253 -5.048 1.00 0.00 H new ATOM 0 HD2 LYS A 93 0.093 -16.217 -5.697 1.00 0.00 H new ATOM 0 HD3 LYS A 93 0.434 -14.645 -6.391 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -0.454 -15.754 -8.232 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.260 -16.018 -8.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 0.010 -18.058 -8.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.049 -18.198 -7.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -0.612 -17.942 -7.189 1.00 0.00 H new ATOM 1442 N THR A 94 4.205 -11.874 -7.239 1.00 0.00 N ATOM 1443 CA THR A 94 4.254 -10.410 -7.269 1.00 0.00 C ATOM 1444 C THR A 94 4.034 -9.880 -8.686 1.00 0.00 C ATOM 1445 O THR A 94 3.352 -8.871 -8.878 1.00 0.00 O ATOM 1446 CB THR A 94 5.594 -9.905 -6.721 1.00 0.00 C ATOM 1447 OG1 THR A 94 6.049 -10.731 -5.663 1.00 0.00 O ATOM 1448 CG2 THR A 94 5.530 -8.485 -6.197 1.00 0.00 C ATOM 0 H THR A 94 5.050 -12.315 -6.877 1.00 0.00 H new ATOM 0 HA THR A 94 3.450 -10.037 -6.635 1.00 0.00 H new ATOM 0 HB THR A 94 6.280 -9.934 -7.568 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.906 -10.392 -5.329 1.00 0.00 H new ATOM 0 HG21 THR A 94 6.511 -8.190 -5.824 1.00 0.00 H new ATOM 0 HG22 THR A 94 5.231 -7.813 -7.002 1.00 0.00 H new ATOM 0 HG23 THR A 94 4.802 -8.428 -5.387 1.00 0.00 H new ATOM 1456 N GLY A 95 4.608 -10.567 -9.675 1.00 0.00 N ATOM 1457 CA GLY A 95 4.456 -10.151 -11.060 1.00 0.00 C ATOM 1458 C GLY A 95 3.014 -10.233 -11.534 1.00 0.00 C ATOM 1459 O GLY A 95 2.492 -9.277 -12.109 1.00 0.00 O ATOM 0 H GLY A 95 5.175 -11.404 -9.540 1.00 0.00 H new ATOM 0 HA2 GLY A 95 4.814 -9.128 -11.171 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.081 -10.778 -11.696 1.00 0.00 H new ATOM 1463 N THR A 96 2.370 -11.376 -11.287 1.00 0.00 N ATOM 1464 CA THR A 96 0.976 -11.580 -11.685 1.00 0.00 C ATOM 1465 C THR A 96 0.044 -10.651 -10.908 1.00 0.00 C ATOM 1466 O THR A 96 -0.877 -10.063 -11.481 1.00 0.00 O ATOM 1467 CB THR A 96 0.558 -13.039 -11.464 1.00 0.00 C ATOM 1468 OG1 THR A 96 1.265 -13.612 -10.376 1.00 0.00 O ATOM 1469 CG2 THR A 96 0.787 -13.917 -12.675 1.00 0.00 C ATOM 0 H THR A 96 2.792 -12.174 -10.813 1.00 0.00 H new ATOM 0 HA THR A 96 0.896 -11.346 -12.746 1.00 0.00 H new ATOM 0 HB THR A 96 -0.512 -13.001 -11.258 1.00 0.00 H new ATOM 0 HG1 THR A 96 1.365 -12.946 -9.664 1.00 0.00 H new ATOM 0 HG21 THR A 96 0.470 -14.936 -12.451 1.00 0.00 H new ATOM 0 HG22 THR A 96 0.209 -13.534 -13.516 1.00 0.00 H new ATOM 0 HG23 THR A 96 1.846 -13.915 -12.931 1.00 0.00 H new ATOM 1477 N ASP A 97 0.290 -10.525 -9.604 1.00 0.00 N ATOM 1478 CA ASP A 97 -0.524 -9.670 -8.742 1.00 0.00 C ATOM 1479 C ASP A 97 -0.475 -8.213 -9.204 1.00 0.00 C ATOM 1480 O ASP A 97 -1.477 -7.501 -9.128 1.00 0.00 O ATOM 1481 CB ASP A 97 -0.052 -9.779 -7.289 1.00 0.00 C ATOM 1482 CG ASP A 97 -0.783 -10.866 -6.519 1.00 0.00 C ATOM 1483 OD1 ASP A 97 -0.894 -11.997 -7.041 1.00 0.00 O ATOM 1484 OD2 ASP A 97 -1.239 -10.587 -5.389 1.00 0.00 O ATOM 0 H ASP A 97 1.049 -11.006 -9.121 1.00 0.00 H new ATOM 0 HA ASP A 97 -1.557 -10.012 -8.807 1.00 0.00 H new ATOM 0 HB2 ASP A 97 1.018 -9.984 -7.273 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -0.201 -8.822 -6.789 1.00 0.00 H new ATOM 1489 N LYS A 98 0.690 -7.780 -9.693 1.00 0.00 N ATOM 1490 CA LYS A 98 0.860 -6.411 -10.178 1.00 0.00 C ATOM 1491 C LYS A 98 -0.167 -6.085 -11.263 1.00 0.00 C ATOM 1492 O LYS A 98 -0.642 -4.953 -11.359 1.00 0.00 O ATOM 1493 CB LYS A 98 2.277 -6.212 -10.726 1.00 0.00 C ATOM 1494 CG LYS A 98 2.611 -4.760 -11.037 1.00 0.00 C ATOM 1495 CD LYS A 98 4.047 -4.421 -10.665 1.00 0.00 C ATOM 1496 CE LYS A 98 4.230 -4.350 -9.156 1.00 0.00 C ATOM 1497 NZ LYS A 98 4.907 -5.563 -8.618 1.00 0.00 N ATOM 0 H LYS A 98 1.528 -8.358 -9.763 1.00 0.00 H new ATOM 0 HA LYS A 98 0.704 -5.734 -9.338 1.00 0.00 H new ATOM 0 HB2 LYS A 98 2.995 -6.594 -10.001 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.394 -6.805 -11.633 1.00 0.00 H new ATOM 0 HG2 LYS A 98 2.456 -4.570 -12.099 1.00 0.00 H new ATOM 0 HG3 LYS A 98 1.930 -4.105 -10.493 1.00 0.00 H new ATOM 0 HD2 LYS A 98 4.719 -5.173 -11.079 1.00 0.00 H new ATOM 0 HD3 LYS A 98 4.324 -3.466 -11.112 1.00 0.00 H new ATOM 0 HE2 LYS A 98 4.815 -3.466 -8.903 1.00 0.00 H new ATOM 0 HE3 LYS A 98 3.257 -4.236 -8.678 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 4.193 -6.228 -8.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 5.454 -6.020 -9.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 5.547 -5.289 -7.845 1.00 0.00 H new ATOM 1511 N THR A 99 -0.509 -7.087 -12.074 1.00 0.00 N ATOM 1512 CA THR A 99 -1.482 -6.916 -13.150 1.00 0.00 C ATOM 1513 C THR A 99 -2.907 -6.885 -12.597 1.00 0.00 C ATOM 1514 O THR A 99 -3.698 -6.009 -12.947 1.00 0.00 O ATOM 1515 CB THR A 99 -1.338 -8.049 -14.173 1.00 0.00 C ATOM 1516 OG1 THR A 99 -0.010 -8.109 -14.666 1.00 0.00 O ATOM 1517 CG2 THR A 99 -2.262 -7.918 -15.365 1.00 0.00 C ATOM 0 H THR A 99 -0.124 -8.029 -12.004 1.00 0.00 H new ATOM 0 HA THR A 99 -1.286 -5.963 -13.642 1.00 0.00 H new ATOM 0 HB THR A 99 -1.607 -8.956 -13.631 1.00 0.00 H new ATOM 0 HG1 THR A 99 0.065 -8.838 -15.316 1.00 0.00 H new ATOM 0 HG21 THR A 99 -2.102 -8.756 -16.044 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.297 -7.920 -15.025 1.00 0.00 H new ATOM 0 HG23 THR A 99 -2.053 -6.984 -15.886 1.00 0.00 H new ATOM 1525 N LEU A 100 -3.224 -7.848 -11.729 1.00 0.00 N ATOM 1526 CA LEU A 100 -4.547 -7.940 -11.123 1.00 0.00 C ATOM 1527 C LEU A 100 -4.868 -6.689 -10.305 1.00 0.00 C ATOM 1528 O LEU A 100 -5.946 -6.110 -10.442 1.00 0.00 O ATOM 1529 CB LEU A 100 -4.628 -9.185 -10.236 1.00 0.00 C ATOM 1530 CG LEU A 100 -4.631 -10.520 -10.988 1.00 0.00 C ATOM 1531 CD1 LEU A 100 -4.704 -11.687 -10.014 1.00 0.00 C ATOM 1532 CD2 LEU A 100 -5.792 -10.576 -11.971 1.00 0.00 C ATOM 0 H LEU A 100 -2.576 -8.577 -11.431 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.284 -8.018 -11.922 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.784 -9.176 -9.546 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.534 -9.124 -9.632 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.699 -10.598 -11.547 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -4.705 -12.625 -10.569 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.841 -11.660 -9.349 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.618 -11.613 -9.425 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -5.778 -11.531 -12.496 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.732 -10.473 -11.430 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.698 -9.764 -12.692 1.00 0.00 H new ATOM 1544 N VAL A 101 -3.922 -6.274 -9.461 1.00 0.00 N ATOM 1545 CA VAL A 101 -4.098 -5.088 -8.626 1.00 0.00 C ATOM 1546 C VAL A 101 -4.211 -3.830 -9.488 1.00 0.00 C ATOM 1547 O VAL A 101 -5.027 -2.950 -9.207 1.00 0.00 O ATOM 1548 CB VAL A 101 -2.934 -4.925 -7.622 1.00 0.00 C ATOM 1549 CG1 VAL A 101 -3.170 -3.739 -6.698 1.00 0.00 C ATOM 1550 CG2 VAL A 101 -2.741 -6.201 -6.813 1.00 0.00 C ATOM 0 H VAL A 101 -3.025 -6.744 -9.339 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.022 -5.223 -8.064 1.00 0.00 H new ATOM 0 HB VAL A 101 -2.024 -4.734 -8.191 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -2.336 -3.648 -6.002 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -3.250 -2.827 -7.290 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -4.093 -3.891 -6.139 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -1.917 -6.066 -6.112 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -3.654 -6.424 -6.261 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -2.513 -7.028 -7.486 1.00 0.00 H new ATOM 1560 N LYS A 102 -3.399 -3.759 -10.544 1.00 0.00 N ATOM 1561 CA LYS A 102 -3.418 -2.615 -11.455 1.00 0.00 C ATOM 1562 C LYS A 102 -4.810 -2.419 -12.053 1.00 0.00 C ATOM 1563 O LYS A 102 -5.313 -1.298 -12.115 1.00 0.00 O ATOM 1564 CB LYS A 102 -2.396 -2.807 -12.579 1.00 0.00 C ATOM 1565 CG LYS A 102 -1.084 -2.072 -12.351 1.00 0.00 C ATOM 1566 CD LYS A 102 -0.243 -2.028 -13.618 1.00 0.00 C ATOM 1567 CE LYS A 102 0.799 -3.136 -13.641 1.00 0.00 C ATOM 1568 NZ LYS A 102 0.619 -4.049 -14.805 1.00 0.00 N ATOM 0 H LYS A 102 -2.721 -4.480 -10.789 1.00 0.00 H new ATOM 0 HA LYS A 102 -3.155 -1.726 -10.882 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -2.190 -3.871 -12.692 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -2.834 -2.466 -13.517 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.289 -1.056 -12.013 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -0.523 -2.565 -11.557 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -0.892 -2.121 -14.489 1.00 0.00 H new ATOM 0 HD3 LYS A 102 0.253 -1.060 -13.692 1.00 0.00 H new ATOM 0 HE2 LYS A 102 1.795 -2.696 -13.677 1.00 0.00 H new ATOM 0 HE3 LYS A 102 0.737 -3.711 -12.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 1.272 -4.854 -14.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -0.361 -4.398 -14.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 0.820 -3.533 -15.685 1.00 0.00 H new ATOM 1582 N GLU A 103 -5.427 -3.519 -12.490 1.00 0.00 N ATOM 1583 CA GLU A 103 -6.764 -3.468 -13.081 1.00 0.00 C ATOM 1584 C GLU A 103 -7.779 -2.899 -12.091 1.00 0.00 C ATOM 1585 O GLU A 103 -8.636 -2.096 -12.463 1.00 0.00 O ATOM 1586 CB GLU A 103 -7.202 -4.867 -13.530 1.00 0.00 C ATOM 1587 CG GLU A 103 -6.791 -5.208 -14.954 1.00 0.00 C ATOM 1588 CD GLU A 103 -6.829 -6.698 -15.234 1.00 0.00 C ATOM 1589 OE1 GLU A 103 -7.923 -7.217 -15.539 1.00 0.00 O ATOM 1590 OE2 GLU A 103 -5.764 -7.345 -15.150 1.00 0.00 O ATOM 0 H GLU A 103 -5.022 -4.454 -12.445 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.723 -2.810 -13.949 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -6.777 -5.607 -12.851 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -8.286 -4.943 -13.446 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -7.453 -4.695 -15.651 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -5.784 -4.834 -15.136 1.00 0.00 H new ATOM 1597 N VAL A 104 -7.676 -3.320 -10.830 1.00 0.00 N ATOM 1598 CA VAL A 104 -8.583 -2.853 -9.786 1.00 0.00 C ATOM 1599 C VAL A 104 -8.293 -1.401 -9.403 1.00 0.00 C ATOM 1600 O VAL A 104 -9.215 -0.626 -9.141 1.00 0.00 O ATOM 1601 CB VAL A 104 -8.494 -3.738 -8.524 1.00 0.00 C ATOM 1602 CG1 VAL A 104 -9.557 -3.341 -7.509 1.00 0.00 C ATOM 1603 CG2 VAL A 104 -8.626 -5.209 -8.894 1.00 0.00 C ATOM 0 H VAL A 104 -6.972 -3.984 -10.509 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.591 -2.918 -10.195 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.516 -3.585 -8.067 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -9.475 -3.978 -6.628 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -9.412 -2.300 -7.219 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -10.546 -3.460 -7.952 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -8.561 -5.818 -7.992 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -9.588 -5.378 -9.377 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -7.823 -5.486 -9.578 1.00 0.00 H new ATOM 1613 N VAL A 105 -7.011 -1.039 -9.375 1.00 0.00 N ATOM 1614 CA VAL A 105 -6.603 0.316 -9.026 1.00 0.00 C ATOM 1615 C VAL A 105 -5.718 0.915 -10.118 1.00 0.00 C ATOM 1616 O VAL A 105 -4.541 0.569 -10.239 1.00 0.00 O ATOM 1617 CB VAL A 105 -5.849 0.352 -7.679 1.00 0.00 C ATOM 1618 CG1 VAL A 105 -5.607 1.789 -7.237 1.00 0.00 C ATOM 1619 CG2 VAL A 105 -6.620 -0.416 -6.613 1.00 0.00 C ATOM 0 H VAL A 105 -6.238 -1.668 -9.591 1.00 0.00 H new ATOM 0 HA VAL A 105 -7.512 0.910 -8.932 1.00 0.00 H new ATOM 0 HB VAL A 105 -4.881 -0.130 -7.815 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -5.075 1.792 -6.286 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -5.010 2.305 -7.989 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -6.563 2.299 -7.119 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -6.073 -0.379 -5.671 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -7.603 0.035 -6.479 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -6.736 -1.454 -6.925 1.00 0.00 H new ATOM 1629 N GLN A 106 -6.301 1.812 -10.912 1.00 0.00 N ATOM 1630 CA GLN A 106 -5.580 2.468 -12.004 1.00 0.00 C ATOM 1631 C GLN A 106 -5.323 3.940 -11.687 1.00 0.00 C ATOM 1632 O GLN A 106 -4.247 4.467 -11.977 1.00 0.00 O ATOM 1633 CB GLN A 106 -6.378 2.348 -13.306 1.00 0.00 C ATOM 1634 CG GLN A 106 -6.015 1.125 -14.135 1.00 0.00 C ATOM 1635 CD GLN A 106 -7.176 0.612 -14.965 1.00 0.00 C ATOM 1636 OE1 GLN A 106 -7.139 0.651 -16.194 1.00 0.00 O ATOM 1637 NE2 GLN A 106 -8.217 0.126 -14.295 1.00 0.00 N ATOM 0 H GLN A 106 -7.274 2.102 -10.819 1.00 0.00 H new ATOM 0 HA GLN A 106 -4.618 1.970 -12.122 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -7.441 2.312 -13.068 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -6.215 3.244 -13.905 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -5.184 1.373 -14.795 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -5.670 0.332 -13.472 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -8.206 0.113 -13.275 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -9.026 -0.233 -14.801 1.00 0.00 H new ATOM 1646 N ASN A 107 -6.319 4.599 -11.095 1.00 0.00 N ATOM 1647 CA ASN A 107 -6.207 6.014 -10.742 1.00 0.00 C ATOM 1648 C ASN A 107 -5.566 6.189 -9.364 1.00 0.00 C ATOM 1649 O ASN A 107 -6.258 6.312 -8.352 1.00 0.00 O ATOM 1650 CB ASN A 107 -7.582 6.697 -10.782 1.00 0.00 C ATOM 1651 CG ASN A 107 -8.641 5.962 -9.974 1.00 0.00 C ATOM 1652 OD1 ASN A 107 -8.835 6.236 -8.790 1.00 0.00 O ATOM 1653 ND2 ASN A 107 -9.341 5.030 -10.613 1.00 0.00 N ATOM 0 H ASN A 107 -7.214 4.175 -10.850 1.00 0.00 H new ATOM 0 HA ASN A 107 -5.562 6.490 -11.481 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -7.486 7.714 -10.403 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -7.913 6.773 -11.818 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -10.069 4.513 -10.121 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -9.150 4.832 -11.595 1.00 0.00 H new ATOM 1660 N PHE A 108 -4.236 6.204 -9.334 1.00 0.00 N ATOM 1661 CA PHE A 108 -3.495 6.367 -8.085 1.00 0.00 C ATOM 1662 C PHE A 108 -2.378 7.398 -8.242 1.00 0.00 C ATOM 1663 O PHE A 108 -1.954 7.701 -9.358 1.00 0.00 O ATOM 1664 CB PHE A 108 -2.912 5.024 -7.630 1.00 0.00 C ATOM 1665 CG PHE A 108 -2.144 4.303 -8.701 1.00 0.00 C ATOM 1666 CD1 PHE A 108 -0.879 4.729 -9.070 1.00 0.00 C ATOM 1667 CD2 PHE A 108 -2.690 3.201 -9.341 1.00 0.00 C ATOM 1668 CE1 PHE A 108 -0.172 4.070 -10.057 1.00 0.00 C ATOM 1669 CE2 PHE A 108 -1.989 2.538 -10.328 1.00 0.00 C ATOM 1670 CZ PHE A 108 -0.728 2.973 -10.687 1.00 0.00 C ATOM 0 H PHE A 108 -3.648 6.105 -10.161 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.189 6.727 -7.326 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.255 5.194 -6.777 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -3.724 4.384 -7.285 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -0.440 5.586 -8.581 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -3.676 2.857 -9.064 1.00 0.00 H new ATOM 0 HE1 PHE A 108 0.814 4.412 -10.336 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -2.426 1.681 -10.819 1.00 0.00 H new ATOM 0 HZ PHE A 108 -0.177 2.456 -11.459 1.00 0.00 H new ATOM 1680 N ALA A 109 -1.903 7.930 -7.116 1.00 0.00 N ATOM 1681 CA ALA A 109 -0.833 8.925 -7.130 1.00 0.00 C ATOM 1682 C ALA A 109 0.497 8.293 -7.528 1.00 0.00 C ATOM 1683 O ALA A 109 1.183 8.785 -8.425 1.00 0.00 O ATOM 1684 CB ALA A 109 -0.714 9.606 -5.774 1.00 0.00 C ATOM 0 H ALA A 109 -2.242 7.689 -6.185 1.00 0.00 H new ATOM 0 HA ALA A 109 -1.087 9.679 -7.875 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.088 10.343 -5.806 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -1.654 10.103 -5.533 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -0.491 8.860 -5.011 1.00 0.00 H new ATOM 1690 N LYS A 110 0.857 7.198 -6.853 1.00 0.00 N ATOM 1691 CA LYS A 110 2.108 6.496 -7.136 1.00 0.00 C ATOM 1692 C LYS A 110 2.206 5.198 -6.334 1.00 0.00 C ATOM 1693 O LYS A 110 1.501 5.015 -5.340 1.00 0.00 O ATOM 1694 CB LYS A 110 3.309 7.394 -6.825 1.00 0.00 C ATOM 1695 CG LYS A 110 3.380 7.844 -5.374 1.00 0.00 C ATOM 1696 CD LYS A 110 4.798 8.218 -4.974 1.00 0.00 C ATOM 1697 CE LYS A 110 5.181 9.598 -5.489 1.00 0.00 C ATOM 1698 NZ LYS A 110 5.590 9.569 -6.923 1.00 0.00 N ATOM 0 H LYS A 110 0.299 6.780 -6.108 1.00 0.00 H new ATOM 0 HA LYS A 110 2.116 6.246 -8.197 1.00 0.00 H new ATOM 0 HB2 LYS A 110 4.225 6.859 -7.075 1.00 0.00 H new ATOM 0 HB3 LYS A 110 3.269 8.274 -7.467 1.00 0.00 H new ATOM 0 HG2 LYS A 110 2.721 8.700 -5.225 1.00 0.00 H new ATOM 0 HG3 LYS A 110 3.017 7.046 -4.727 1.00 0.00 H new ATOM 0 HD2 LYS A 110 4.888 8.197 -3.888 1.00 0.00 H new ATOM 0 HD3 LYS A 110 5.494 7.477 -5.366 1.00 0.00 H new ATOM 0 HE2 LYS A 110 4.337 10.277 -5.367 1.00 0.00 H new ATOM 0 HE3 LYS A 110 5.999 9.995 -4.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 6.359 10.252 -7.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 5.920 8.614 -7.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 4.777 9.820 -7.521 1.00 0.00 H new ATOM 1712 N GLU A 111 3.089 4.303 -6.772 1.00 0.00 N ATOM 1713 CA GLU A 111 3.287 3.021 -6.100 1.00 0.00 C ATOM 1714 C GLU A 111 4.735 2.553 -6.227 1.00 0.00 C ATOM 1715 O GLU A 111 5.411 2.856 -7.212 1.00 0.00 O ATOM 1716 CB GLU A 111 2.346 1.964 -6.685 1.00 0.00 C ATOM 1717 CG GLU A 111 2.526 1.742 -8.179 1.00 0.00 C ATOM 1718 CD GLU A 111 1.948 0.421 -8.646 1.00 0.00 C ATOM 1719 OE1 GLU A 111 2.510 -0.635 -8.282 1.00 0.00 O ATOM 1720 OE2 GLU A 111 0.933 0.442 -9.375 1.00 0.00 O ATOM 0 H GLU A 111 3.680 4.443 -7.591 1.00 0.00 H new ATOM 0 HA GLU A 111 3.060 3.157 -5.043 1.00 0.00 H new ATOM 0 HB2 GLU A 111 2.507 1.020 -6.165 1.00 0.00 H new ATOM 0 HB3 GLU A 111 1.315 2.262 -6.493 1.00 0.00 H new ATOM 0 HG2 GLU A 111 2.048 2.556 -8.724 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.588 1.776 -8.422 1.00 0.00 H new ATOM 1727 N PHE A 112 5.202 1.808 -5.228 1.00 0.00 N ATOM 1728 CA PHE A 112 6.568 1.289 -5.232 1.00 0.00 C ATOM 1729 C PHE A 112 6.695 0.065 -4.328 1.00 0.00 C ATOM 1730 O PHE A 112 5.859 -0.167 -3.454 1.00 0.00 O ATOM 1731 CB PHE A 112 7.568 2.369 -4.796 1.00 0.00 C ATOM 1732 CG PHE A 112 7.123 3.181 -3.612 1.00 0.00 C ATOM 1733 CD1 PHE A 112 7.403 2.761 -2.322 1.00 0.00 C ATOM 1734 CD2 PHE A 112 6.432 4.368 -3.791 1.00 0.00 C ATOM 1735 CE1 PHE A 112 7.001 3.510 -1.232 1.00 0.00 C ATOM 1736 CE2 PHE A 112 6.027 5.122 -2.707 1.00 0.00 C ATOM 1737 CZ PHE A 112 6.311 4.692 -1.425 1.00 0.00 C ATOM 0 H PHE A 112 4.656 1.550 -4.406 1.00 0.00 H new ATOM 0 HA PHE A 112 6.801 0.990 -6.254 1.00 0.00 H new ATOM 0 HB2 PHE A 112 8.519 1.893 -4.558 1.00 0.00 H new ATOM 0 HB3 PHE A 112 7.749 3.041 -5.635 1.00 0.00 H new ATOM 0 HD1 PHE A 112 7.941 1.838 -2.166 1.00 0.00 H new ATOM 0 HD2 PHE A 112 6.207 4.708 -4.791 1.00 0.00 H new ATOM 0 HE1 PHE A 112 7.226 3.172 -0.231 1.00 0.00 H new ATOM 0 HE2 PHE A 112 5.489 6.046 -2.861 1.00 0.00 H new ATOM 0 HZ PHE A 112 5.994 5.278 -0.575 1.00 0.00 H new ATOM 1747 N VAL A 113 7.752 -0.714 -4.552 1.00 0.00 N ATOM 1748 CA VAL A 113 8.003 -1.917 -3.767 1.00 0.00 C ATOM 1749 C VAL A 113 9.094 -1.673 -2.725 1.00 0.00 C ATOM 1750 O VAL A 113 10.064 -0.957 -2.983 1.00 0.00 O ATOM 1751 CB VAL A 113 8.410 -3.103 -4.672 1.00 0.00 C ATOM 1752 CG1 VAL A 113 9.694 -2.792 -5.435 1.00 0.00 C ATOM 1753 CG2 VAL A 113 8.560 -4.383 -3.859 1.00 0.00 C ATOM 0 H VAL A 113 8.449 -0.531 -5.274 1.00 0.00 H new ATOM 0 HA VAL A 113 7.073 -2.168 -3.257 1.00 0.00 H new ATOM 0 HB VAL A 113 7.614 -3.257 -5.400 1.00 0.00 H new ATOM 0 HG11 VAL A 113 9.958 -3.642 -6.064 1.00 0.00 H new ATOM 0 HG12 VAL A 113 9.542 -1.912 -6.060 1.00 0.00 H new ATOM 0 HG13 VAL A 113 10.500 -2.600 -4.727 1.00 0.00 H new ATOM 0 HG21 VAL A 113 8.847 -5.202 -4.519 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.329 -4.243 -3.099 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.612 -4.621 -3.377 1.00 0.00 H new ATOM 1763 N ILE A 114 8.925 -2.268 -1.546 1.00 0.00 N ATOM 1764 CA ILE A 114 9.892 -2.115 -0.463 1.00 0.00 C ATOM 1765 C ILE A 114 10.201 -3.460 0.191 1.00 0.00 C ATOM 1766 O ILE A 114 9.313 -4.295 0.369 1.00 0.00 O ATOM 1767 CB ILE A 114 9.385 -1.135 0.619 1.00 0.00 C ATOM 1768 CG1 ILE A 114 8.932 0.187 -0.011 1.00 0.00 C ATOM 1769 CG2 ILE A 114 10.468 -0.881 1.657 1.00 0.00 C ATOM 1770 CD1 ILE A 114 7.611 0.690 0.531 1.00 0.00 C ATOM 0 H ILE A 114 8.127 -2.861 -1.317 1.00 0.00 H new ATOM 0 HA ILE A 114 10.801 -1.710 -0.909 1.00 0.00 H new ATOM 0 HB ILE A 114 8.527 -1.591 1.113 1.00 0.00 H new ATOM 0 HG12 ILE A 114 9.698 0.943 0.160 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.848 0.057 -1.090 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.094 -0.189 2.411 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.744 -1.822 2.133 1.00 0.00 H new ATOM 0 HG23 ILE A 114 11.343 -0.450 1.171 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.351 1.629 0.042 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.833 -0.048 0.337 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.697 0.852 1.605 1.00 0.00 H new ATOM 1782 N SER A 115 11.467 -3.655 0.555 1.00 0.00 N ATOM 1783 CA SER A 115 11.905 -4.892 1.199 1.00 0.00 C ATOM 1784 C SER A 115 12.817 -4.592 2.392 1.00 0.00 C ATOM 1785 O SER A 115 13.715 -5.372 2.715 1.00 0.00 O ATOM 1786 CB SER A 115 12.623 -5.789 0.189 1.00 0.00 C ATOM 1787 OG SER A 115 12.609 -7.145 0.601 1.00 0.00 O ATOM 0 H SER A 115 12.210 -2.970 0.414 1.00 0.00 H new ATOM 0 HA SER A 115 11.024 -5.417 1.569 1.00 0.00 H new ATOM 0 HB2 SER A 115 12.144 -5.698 -0.786 1.00 0.00 H new ATOM 0 HB3 SER A 115 13.653 -5.454 0.070 1.00 0.00 H new ATOM 0 HG SER A 115 11.684 -7.468 0.631 1.00 0.00 H new ATOM 1793 N ASP A 116 12.574 -3.454 3.044 1.00 0.00 N ATOM 1794 CA ASP A 116 13.360 -3.042 4.201 1.00 0.00 C ATOM 1795 C ASP A 116 12.485 -2.311 5.215 1.00 0.00 C ATOM 1796 O ASP A 116 11.662 -1.474 4.848 1.00 0.00 O ATOM 1797 CB ASP A 116 14.518 -2.143 3.767 1.00 0.00 C ATOM 1798 CG ASP A 116 15.442 -1.804 4.917 1.00 0.00 C ATOM 1799 OD1 ASP A 116 16.212 -2.691 5.342 1.00 0.00 O ATOM 1800 OD2 ASP A 116 15.391 -0.655 5.395 1.00 0.00 O ATOM 0 H ASP A 116 11.835 -2.800 2.786 1.00 0.00 H new ATOM 0 HA ASP A 116 13.765 -3.937 4.672 1.00 0.00 H new ATOM 0 HB2 ASP A 116 15.087 -2.640 2.981 1.00 0.00 H new ATOM 0 HB3 ASP A 116 14.120 -1.223 3.339 1.00 0.00 H new ATOM 1805 N ARG A 117 12.668 -2.640 6.493 1.00 0.00 N ATOM 1806 CA ARG A 117 11.893 -2.022 7.569 1.00 0.00 C ATOM 1807 C ARG A 117 12.076 -0.503 7.597 1.00 0.00 C ATOM 1808 O ARG A 117 11.130 0.234 7.882 1.00 0.00 O ATOM 1809 CB ARG A 117 12.291 -2.617 8.922 1.00 0.00 C ATOM 1810 CG ARG A 117 11.263 -3.585 9.486 1.00 0.00 C ATOM 1811 CD ARG A 117 11.913 -4.634 10.373 1.00 0.00 C ATOM 1812 NE ARG A 117 12.554 -5.695 9.595 1.00 0.00 N ATOM 1813 CZ ARG A 117 13.473 -6.528 10.086 1.00 0.00 C ATOM 1814 NH1 ARG A 117 13.870 -6.425 11.351 1.00 0.00 N ATOM 1815 NH2 ARG A 117 13.998 -7.469 9.309 1.00 0.00 N ATOM 0 H ARG A 117 13.347 -3.332 6.809 1.00 0.00 H new ATOM 0 HA ARG A 117 10.841 -2.232 7.376 1.00 0.00 H new ATOM 0 HB2 ARG A 117 13.245 -3.134 8.816 1.00 0.00 H new ATOM 0 HB3 ARG A 117 12.445 -1.807 9.635 1.00 0.00 H new ATOM 0 HG2 ARG A 117 10.518 -3.033 10.059 1.00 0.00 H new ATOM 0 HG3 ARG A 117 10.736 -4.075 8.667 1.00 0.00 H new ATOM 0 HD2 ARG A 117 12.655 -4.157 11.014 1.00 0.00 H new ATOM 0 HD3 ARG A 117 11.159 -5.071 11.028 1.00 0.00 H new ATOM 0 HE ARG A 117 12.282 -5.804 8.618 1.00 0.00 H new ATOM 0 HH11 ARG A 117 13.471 -5.705 11.954 1.00 0.00 H new ATOM 0 HH12 ARG A 117 14.573 -7.066 11.719 1.00 0.00 H new ATOM 0 HH21 ARG A 117 13.698 -7.554 8.338 1.00 0.00 H new ATOM 0 HH22 ARG A 117 14.701 -8.106 9.684 1.00 0.00 H new ATOM 1829 N LYS A 118 13.290 -0.037 7.298 1.00 0.00 N ATOM 1830 CA LYS A 118 13.577 1.399 7.294 1.00 0.00 C ATOM 1831 C LYS A 118 12.861 2.093 6.137 1.00 0.00 C ATOM 1832 O LYS A 118 12.260 3.154 6.318 1.00 0.00 O ATOM 1833 CB LYS A 118 15.087 1.649 7.207 1.00 0.00 C ATOM 1834 CG LYS A 118 15.494 3.087 7.500 1.00 0.00 C ATOM 1835 CD LYS A 118 16.596 3.552 6.560 1.00 0.00 C ATOM 1836 CE LYS A 118 16.685 5.069 6.502 1.00 0.00 C ATOM 1837 NZ LYS A 118 17.893 5.585 7.203 1.00 0.00 N ATOM 0 H LYS A 118 14.085 -0.628 7.057 1.00 0.00 H new ATOM 0 HA LYS A 118 13.208 1.818 8.230 1.00 0.00 H new ATOM 0 HB2 LYS A 118 15.595 0.988 7.909 1.00 0.00 H new ATOM 0 HB3 LYS A 118 15.433 1.380 6.209 1.00 0.00 H new ATOM 0 HG2 LYS A 118 14.627 3.740 7.399 1.00 0.00 H new ATOM 0 HG3 LYS A 118 15.835 3.168 8.532 1.00 0.00 H new ATOM 0 HD2 LYS A 118 17.551 3.144 6.890 1.00 0.00 H new ATOM 0 HD3 LYS A 118 16.410 3.160 5.560 1.00 0.00 H new ATOM 0 HE2 LYS A 118 16.705 5.391 5.461 1.00 0.00 H new ATOM 0 HE3 LYS A 118 15.792 5.502 6.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 17.915 6.623 7.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 17.862 5.300 8.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 18.747 5.193 6.757 1.00 0.00 H new ATOM 1851 N GLU A 119 12.920 1.484 4.952 1.00 0.00 N ATOM 1852 CA GLU A 119 12.269 2.040 3.766 1.00 0.00 C ATOM 1853 C GLU A 119 10.749 1.872 3.840 1.00 0.00 C ATOM 1854 O GLU A 119 9.999 2.697 3.316 1.00 0.00 O ATOM 1855 CB GLU A 119 12.802 1.365 2.498 1.00 0.00 C ATOM 1856 CG GLU A 119 14.317 1.407 2.372 1.00 0.00 C ATOM 1857 CD GLU A 119 14.818 0.688 1.134 1.00 0.00 C ATOM 1858 OE1 GLU A 119 14.526 -0.518 0.988 1.00 0.00 O ATOM 1859 OE2 GLU A 119 15.501 1.331 0.309 1.00 0.00 O ATOM 0 H GLU A 119 13.412 0.606 4.788 1.00 0.00 H new ATOM 0 HA GLU A 119 12.498 3.105 3.730 1.00 0.00 H new ATOM 0 HB2 GLU A 119 12.474 0.326 2.486 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.361 1.849 1.627 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.647 2.445 2.343 1.00 0.00 H new ATOM 0 HG3 GLU A 119 14.764 0.954 3.257 1.00 0.00 H new ATOM 1866 N LEU A 120 10.305 0.797 4.494 1.00 0.00 N ATOM 1867 CA LEU A 120 8.882 0.510 4.643 1.00 0.00 C ATOM 1868 C LEU A 120 8.235 1.448 5.665 1.00 0.00 C ATOM 1869 O LEU A 120 7.040 1.742 5.578 1.00 0.00 O ATOM 1870 CB LEU A 120 8.691 -0.958 5.058 1.00 0.00 C ATOM 1871 CG LEU A 120 7.452 -1.252 5.905 1.00 0.00 C ATOM 1872 CD1 LEU A 120 6.191 -1.129 5.065 1.00 0.00 C ATOM 1873 CD2 LEU A 120 7.546 -2.636 6.531 1.00 0.00 C ATOM 0 H LEU A 120 10.917 0.108 4.931 1.00 0.00 H new ATOM 0 HA LEU A 120 8.391 0.677 3.684 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.645 -1.568 4.156 1.00 0.00 H new ATOM 0 HB3 LEU A 120 9.573 -1.277 5.614 1.00 0.00 H new ATOM 0 HG LEU A 120 7.403 -0.517 6.708 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.319 -1.342 5.684 1.00 0.00 H new ATOM 0 HD12 LEU A 120 6.116 -0.117 4.668 1.00 0.00 H new ATOM 0 HD13 LEU A 120 6.232 -1.840 4.240 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.655 -2.826 7.130 1.00 0.00 H new ATOM 0 HD22 LEU A 120 7.622 -3.387 5.744 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.429 -2.688 7.168 1.00 0.00 H new ATOM 1885 N GLU A 121 9.033 1.908 6.634 1.00 0.00 N ATOM 1886 CA GLU A 121 8.553 2.806 7.679 1.00 0.00 C ATOM 1887 C GLU A 121 7.696 3.931 7.099 1.00 0.00 C ATOM 1888 O GLU A 121 8.064 4.560 6.103 1.00 0.00 O ATOM 1889 CB GLU A 121 9.737 3.392 8.451 1.00 0.00 C ATOM 1890 CG GLU A 121 9.349 4.001 9.790 1.00 0.00 C ATOM 1891 CD GLU A 121 10.502 4.719 10.467 1.00 0.00 C ATOM 1892 OE1 GLU A 121 11.083 5.632 9.843 1.00 0.00 O ATOM 1893 OE2 GLU A 121 10.823 4.369 11.621 1.00 0.00 O ATOM 0 H GLU A 121 10.021 1.668 6.713 1.00 0.00 H new ATOM 0 HA GLU A 121 7.929 2.226 8.359 1.00 0.00 H new ATOM 0 HB2 GLU A 121 10.475 2.608 8.618 1.00 0.00 H new ATOM 0 HB3 GLU A 121 10.217 4.156 7.839 1.00 0.00 H new ATOM 0 HG2 GLU A 121 8.528 4.702 9.641 1.00 0.00 H new ATOM 0 HG3 GLU A 121 8.980 3.214 10.448 1.00 0.00 H new ATOM 1900 N GLU A 122 6.550 4.166 7.730 1.00 0.00 N ATOM 1901 CA GLU A 122 5.612 5.203 7.293 1.00 0.00 C ATOM 1902 C GLU A 122 6.298 6.556 7.103 1.00 0.00 C ATOM 1903 O GLU A 122 5.900 7.338 6.238 1.00 0.00 O ATOM 1904 CB GLU A 122 4.469 5.341 8.300 1.00 0.00 C ATOM 1905 CG GLU A 122 3.227 6.002 7.723 1.00 0.00 C ATOM 1906 CD GLU A 122 2.002 5.813 8.599 1.00 0.00 C ATOM 1907 OE1 GLU A 122 2.093 6.078 9.817 1.00 0.00 O ATOM 1908 OE2 GLU A 122 0.951 5.400 8.066 1.00 0.00 O ATOM 0 H GLU A 122 6.243 3.649 8.554 1.00 0.00 H new ATOM 0 HA GLU A 122 5.215 4.893 6.326 1.00 0.00 H new ATOM 0 HB2 GLU A 122 4.204 4.352 8.674 1.00 0.00 H new ATOM 0 HB3 GLU A 122 4.816 5.922 9.154 1.00 0.00 H new ATOM 0 HG2 GLU A 122 3.415 7.068 7.593 1.00 0.00 H new ATOM 0 HG3 GLU A 122 3.028 5.591 6.733 1.00 0.00 H new ATOM 1915 N ASN A 123 7.328 6.829 7.905 1.00 0.00 N ATOM 1916 CA ASN A 123 8.063 8.087 7.807 1.00 0.00 C ATOM 1917 C ASN A 123 8.608 8.273 6.393 1.00 0.00 C ATOM 1918 O ASN A 123 8.558 9.370 5.833 1.00 0.00 O ATOM 1919 CB ASN A 123 9.213 8.114 8.817 1.00 0.00 C ATOM 1920 CG ASN A 123 8.782 8.617 10.183 1.00 0.00 C ATOM 1921 OD1 ASN A 123 8.760 9.822 10.434 1.00 0.00 O ATOM 1922 ND2 ASN A 123 8.438 7.695 11.077 1.00 0.00 N ATOM 0 H ASN A 123 7.670 6.196 8.628 1.00 0.00 H new ATOM 0 HA ASN A 123 7.378 8.904 8.033 1.00 0.00 H new ATOM 0 HB2 ASN A 123 9.626 7.110 8.918 1.00 0.00 H new ATOM 0 HB3 ASN A 123 10.011 8.750 8.435 1.00 0.00 H new ATOM 0 HD21 ASN A 123 8.142 7.976 12.012 1.00 0.00 H new ATOM 0 HD22 ASN A 123 8.470 6.706 10.828 1.00 0.00 H new ATOM 1929 N PHE A 124 9.117 7.183 5.824 1.00 0.00 N ATOM 1930 CA PHE A 124 9.666 7.198 4.473 1.00 0.00 C ATOM 1931 C PHE A 124 8.557 7.362 3.436 1.00 0.00 C ATOM 1932 O PHE A 124 8.676 8.164 2.508 1.00 0.00 O ATOM 1933 CB PHE A 124 10.436 5.903 4.211 1.00 0.00 C ATOM 1934 CG PHE A 124 11.203 5.913 2.921 1.00 0.00 C ATOM 1935 CD1 PHE A 124 10.585 5.557 1.732 1.00 0.00 C ATOM 1936 CD2 PHE A 124 12.538 6.282 2.895 1.00 0.00 C ATOM 1937 CE1 PHE A 124 11.285 5.569 0.542 1.00 0.00 C ATOM 1938 CE2 PHE A 124 13.243 6.295 1.707 1.00 0.00 C ATOM 1939 CZ PHE A 124 12.616 5.938 0.528 1.00 0.00 C ATOM 0 H PHE A 124 9.160 6.273 6.282 1.00 0.00 H new ATOM 0 HA PHE A 124 10.344 8.047 4.387 1.00 0.00 H new ATOM 0 HB2 PHE A 124 11.128 5.728 5.035 1.00 0.00 H new ATOM 0 HB3 PHE A 124 9.735 5.068 4.201 1.00 0.00 H new ATOM 0 HD1 PHE A 124 9.545 5.267 1.737 1.00 0.00 H new ATOM 0 HD2 PHE A 124 13.033 6.562 3.813 1.00 0.00 H new ATOM 0 HE1 PHE A 124 10.792 5.290 -0.378 1.00 0.00 H new ATOM 0 HE2 PHE A 124 14.284 6.584 1.699 1.00 0.00 H new ATOM 0 HZ PHE A 124 13.165 5.948 -0.402 1.00 0.00 H new ATOM 1949 N ILE A 125 7.482 6.593 3.605 1.00 0.00 N ATOM 1950 CA ILE A 125 6.342 6.638 2.690 1.00 0.00 C ATOM 1951 C ILE A 125 5.703 8.026 2.670 1.00 0.00 C ATOM 1952 O ILE A 125 5.408 8.566 1.601 1.00 0.00 O ATOM 1953 CB ILE A 125 5.262 5.598 3.071 1.00 0.00 C ATOM 1954 CG1 ILE A 125 5.895 4.232 3.376 1.00 0.00 C ATOM 1955 CG2 ILE A 125 4.230 5.472 1.959 1.00 0.00 C ATOM 1956 CD1 ILE A 125 6.741 3.682 2.248 1.00 0.00 C ATOM 0 H ILE A 125 7.377 5.928 4.371 1.00 0.00 H new ATOM 0 HA ILE A 125 6.730 6.401 1.699 1.00 0.00 H new ATOM 0 HB ILE A 125 4.760 5.946 3.974 1.00 0.00 H new ATOM 0 HG12 ILE A 125 6.512 4.320 4.270 1.00 0.00 H new ATOM 0 HG13 ILE A 125 5.103 3.519 3.604 1.00 0.00 H new ATOM 0 HG21 ILE A 125 3.477 4.736 2.243 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.751 6.437 1.796 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.722 5.152 1.041 1.00 0.00 H new ATOM 0 HD11 ILE A 125 7.153 2.716 2.540 1.00 0.00 H new ATOM 0 HD12 ILE A 125 6.125 3.560 1.357 1.00 0.00 H new ATOM 0 HD13 ILE A 125 7.556 4.374 2.033 1.00 0.00 H new ATOM 1968 N LYS A 126 5.490 8.594 3.857 1.00 0.00 N ATOM 1969 CA LYS A 126 4.882 9.916 3.987 1.00 0.00 C ATOM 1970 C LYS A 126 5.719 10.992 3.293 1.00 0.00 C ATOM 1971 O LYS A 126 5.174 11.914 2.685 1.00 0.00 O ATOM 1972 CB LYS A 126 4.700 10.270 5.464 1.00 0.00 C ATOM 1973 CG LYS A 126 3.840 11.501 5.691 1.00 0.00 C ATOM 1974 CD LYS A 126 3.630 11.770 7.173 1.00 0.00 C ATOM 1975 CE LYS A 126 2.247 12.341 7.441 1.00 0.00 C ATOM 1976 NZ LYS A 126 2.288 13.489 8.388 1.00 0.00 N ATOM 0 H LYS A 126 5.731 8.156 4.746 1.00 0.00 H new ATOM 0 HA LYS A 126 3.908 9.881 3.499 1.00 0.00 H new ATOM 0 HB2 LYS A 126 4.250 9.422 5.980 1.00 0.00 H new ATOM 0 HB3 LYS A 126 5.679 10.433 5.914 1.00 0.00 H new ATOM 0 HG2 LYS A 126 4.312 12.367 5.227 1.00 0.00 H new ATOM 0 HG3 LYS A 126 2.874 11.366 5.204 1.00 0.00 H new ATOM 0 HD2 LYS A 126 3.759 10.845 7.734 1.00 0.00 H new ATOM 0 HD3 LYS A 126 4.389 12.467 7.529 1.00 0.00 H new ATOM 0 HE2 LYS A 126 1.800 12.663 6.501 1.00 0.00 H new ATOM 0 HE3 LYS A 126 1.605 11.559 7.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 1.324 13.847 8.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 2.690 13.177 9.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 2.879 14.247 7.990 1.00 0.00 H new ATOM 1990 N SER A 127 7.043 10.867 3.384 1.00 0.00 N ATOM 1991 CA SER A 127 7.948 11.830 2.761 1.00 0.00 C ATOM 1992 C SER A 127 7.899 11.709 1.239 1.00 0.00 C ATOM 1993 O SER A 127 7.877 12.716 0.529 1.00 0.00 O ATOM 1994 CB SER A 127 9.380 11.621 3.262 1.00 0.00 C ATOM 1995 OG SER A 127 10.079 12.852 3.340 1.00 0.00 O ATOM 0 H SER A 127 7.511 10.110 3.882 1.00 0.00 H new ATOM 0 HA SER A 127 7.623 12.833 3.039 1.00 0.00 H new ATOM 0 HB2 SER A 127 9.360 11.148 4.244 1.00 0.00 H new ATOM 0 HB3 SER A 127 9.907 10.942 2.592 1.00 0.00 H new ATOM 0 HG SER A 127 10.990 12.691 3.664 1.00 0.00 H new ATOM 2001 N GLU A 128 7.877 10.469 0.751 1.00 0.00 N ATOM 2002 CA GLU A 128 7.825 10.199 -0.684 1.00 0.00 C ATOM 2003 C GLU A 128 6.555 10.778 -1.307 1.00 0.00 C ATOM 2004 O GLU A 128 6.599 11.372 -2.387 1.00 0.00 O ATOM 2005 CB GLU A 128 7.894 8.690 -0.935 1.00 0.00 C ATOM 2006 CG GLU A 128 8.332 8.321 -2.344 1.00 0.00 C ATOM 2007 CD GLU A 128 9.439 7.282 -2.357 1.00 0.00 C ATOM 2008 OE1 GLU A 128 10.591 7.638 -2.028 1.00 0.00 O ATOM 2009 OE2 GLU A 128 9.155 6.115 -2.694 1.00 0.00 O ATOM 0 H GLU A 128 7.895 9.632 1.333 1.00 0.00 H new ATOM 0 HA GLU A 128 8.683 10.681 -1.153 1.00 0.00 H new ATOM 0 HB2 GLU A 128 8.586 8.244 -0.221 1.00 0.00 H new ATOM 0 HB3 GLU A 128 6.913 8.254 -0.744 1.00 0.00 H new ATOM 0 HG2 GLU A 128 7.475 7.940 -2.899 1.00 0.00 H new ATOM 0 HG3 GLU A 128 8.674 9.218 -2.861 1.00 0.00 H new ATOM 2016 N LEU A 129 5.425 10.601 -0.622 1.00 0.00 N ATOM 2017 CA LEU A 129 4.143 11.107 -1.106 1.00 0.00 C ATOM 2018 C LEU A 129 4.127 12.634 -1.137 1.00 0.00 C ATOM 2019 O LEU A 129 3.652 13.237 -2.101 1.00 0.00 O ATOM 2020 CB LEU A 129 2.998 10.592 -0.230 1.00 0.00 C ATOM 2021 CG LEU A 129 1.948 9.757 -0.965 1.00 0.00 C ATOM 2022 CD1 LEU A 129 2.549 8.446 -1.446 1.00 0.00 C ATOM 2023 CD2 LEU A 129 0.747 9.498 -0.067 1.00 0.00 C ATOM 0 H LEU A 129 5.373 10.110 0.271 1.00 0.00 H new ATOM 0 HA LEU A 129 4.006 10.742 -2.124 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.419 9.991 0.576 1.00 0.00 H new ATOM 0 HB3 LEU A 129 2.503 11.445 0.233 1.00 0.00 H new ATOM 0 HG LEU A 129 1.610 10.319 -1.836 1.00 0.00 H new ATOM 0 HD11 LEU A 129 1.787 7.866 -1.966 1.00 0.00 H new ATOM 0 HD12 LEU A 129 3.375 8.652 -2.126 1.00 0.00 H new ATOM 0 HD13 LEU A 129 2.916 7.879 -0.591 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.011 8.903 -0.607 1.00 0.00 H new ATOM 0 HD22 LEU A 129 1.068 8.958 0.823 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.301 10.448 0.227 1.00 0.00 H new ATOM 2035 N LYS A 130 4.649 13.254 -0.078 1.00 0.00 N ATOM 2036 CA LYS A 130 4.695 14.712 0.013 1.00 0.00 C ATOM 2037 C LYS A 130 5.593 15.305 -1.074 1.00 0.00 C ATOM 2038 O LYS A 130 5.340 16.409 -1.559 1.00 0.00 O ATOM 2039 CB LYS A 130 5.190 15.143 1.397 1.00 0.00 C ATOM 2040 CG LYS A 130 4.929 16.610 1.704 1.00 0.00 C ATOM 2041 CD LYS A 130 5.555 17.025 3.026 1.00 0.00 C ATOM 2042 CE LYS A 130 5.385 18.516 3.277 1.00 0.00 C ATOM 2043 NZ LYS A 130 5.246 18.828 4.728 1.00 0.00 N ATOM 0 H LYS A 130 5.045 12.769 0.727 1.00 0.00 H new ATOM 0 HA LYS A 130 3.684 15.090 -0.137 1.00 0.00 H new ATOM 0 HB2 LYS A 130 4.704 14.529 2.155 1.00 0.00 H new ATOM 0 HB3 LYS A 130 6.260 14.950 1.468 1.00 0.00 H new ATOM 0 HG2 LYS A 130 5.331 17.228 0.901 1.00 0.00 H new ATOM 0 HG3 LYS A 130 3.854 16.790 1.737 1.00 0.00 H new ATOM 0 HD2 LYS A 130 5.097 16.463 3.840 1.00 0.00 H new ATOM 0 HD3 LYS A 130 6.616 16.774 3.023 1.00 0.00 H new ATOM 0 HE2 LYS A 130 6.244 19.052 2.872 1.00 0.00 H new ATOM 0 HE3 LYS A 130 4.505 18.875 2.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 5.133 19.854 4.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 4.412 18.338 5.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 6.097 18.509 5.235 1.00 0.00 H new ATOM 2057 N LYS A 131 6.640 14.565 -1.449 1.00 0.00 N ATOM 2058 CA LYS A 131 7.581 15.013 -2.479 1.00 0.00 C ATOM 2059 C LYS A 131 6.845 15.512 -3.722 1.00 0.00 C ATOM 2060 O LYS A 131 7.130 16.601 -4.223 1.00 0.00 O ATOM 2061 CB LYS A 131 8.533 13.874 -2.858 1.00 0.00 C ATOM 2062 CG LYS A 131 10.004 14.229 -2.706 1.00 0.00 C ATOM 2063 CD LYS A 131 10.433 14.225 -1.247 1.00 0.00 C ATOM 2064 CE LYS A 131 11.178 15.500 -0.880 1.00 0.00 C ATOM 2065 NZ LYS A 131 11.367 15.634 0.591 1.00 0.00 N ATOM 0 H LYS A 131 6.858 13.650 -1.053 1.00 0.00 H new ATOM 0 HA LYS A 131 8.157 15.842 -2.069 1.00 0.00 H new ATOM 0 HB2 LYS A 131 8.312 13.006 -2.237 1.00 0.00 H new ATOM 0 HB3 LYS A 131 8.344 13.583 -3.891 1.00 0.00 H new ATOM 0 HG2 LYS A 131 10.610 13.517 -3.266 1.00 0.00 H new ATOM 0 HG3 LYS A 131 10.188 15.213 -3.137 1.00 0.00 H new ATOM 0 HD2 LYS A 131 9.555 14.119 -0.609 1.00 0.00 H new ATOM 0 HD3 LYS A 131 11.071 13.362 -1.057 1.00 0.00 H new ATOM 0 HE2 LYS A 131 12.151 15.506 -1.372 1.00 0.00 H new ATOM 0 HE3 LYS A 131 10.626 16.362 -1.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 11.879 16.516 0.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 10.439 15.655 1.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 11.916 14.825 0.946 1.00 0.00 H new ATOM 2079 N ALA A 132 5.897 14.712 -4.210 1.00 0.00 N ATOM 2080 CA ALA A 132 5.119 15.074 -5.391 1.00 0.00 C ATOM 2081 C ALA A 132 3.669 15.387 -5.017 1.00 0.00 C ATOM 2082 O ALA A 132 2.735 14.963 -5.700 1.00 0.00 O ATOM 2083 CB ALA A 132 5.178 13.956 -6.423 1.00 0.00 C ATOM 0 H ALA A 132 5.650 13.809 -3.804 1.00 0.00 H new ATOM 0 HA ALA A 132 5.554 15.974 -5.826 1.00 0.00 H new ATOM 0 HB1 ALA A 132 4.594 14.238 -7.299 1.00 0.00 H new ATOM 0 HB2 ALA A 132 6.214 13.786 -6.717 1.00 0.00 H new ATOM 0 HB3 ALA A 132 4.769 13.042 -5.993 1.00 0.00 H new ATOM 2089 N GLY A 133 3.492 16.133 -3.925 1.00 0.00 N ATOM 2090 CA GLY A 133 2.158 16.490 -3.471 1.00 0.00 C ATOM 2091 C GLY A 133 2.067 17.927 -2.992 1.00 0.00 C ATOM 2092 O GLY A 133 1.183 18.672 -3.418 1.00 0.00 O ATOM 0 H GLY A 133 4.251 16.496 -3.348 1.00 0.00 H new ATOM 0 HA2 GLY A 133 1.449 16.337 -4.284 1.00 0.00 H new ATOM 0 HA3 GLY A 133 1.863 15.822 -2.661 1.00 0.00 H new ATOM 2096 N GLY A 134 2.981 18.317 -2.103 1.00 0.00 N ATOM 2097 CA GLY A 134 2.984 19.673 -1.579 1.00 0.00 C ATOM 2098 C GLY A 134 3.873 20.608 -2.383 1.00 0.00 C ATOM 2099 O GLY A 134 4.253 20.295 -3.512 1.00 0.00 O ATOM 0 H GLY A 134 3.720 17.716 -1.737 1.00 0.00 H new ATOM 0 HA2 GLY A 134 1.965 20.060 -1.576 1.00 0.00 H new ATOM 0 HA3 GLY A 134 3.322 19.658 -0.543 1.00 0.00 H new ATOM 2103 N ALA A 135 4.203 21.758 -1.797 1.00 0.00 N ATOM 2104 CA ALA A 135 5.052 22.747 -2.463 1.00 0.00 C ATOM 2105 C ALA A 135 6.350 22.976 -1.688 1.00 0.00 C ATOM 2106 O ALA A 135 6.883 24.088 -1.668 1.00 0.00 O ATOM 2107 CB ALA A 135 4.295 24.058 -2.627 1.00 0.00 C ATOM 0 H ALA A 135 3.896 22.029 -0.863 1.00 0.00 H new ATOM 0 HA ALA A 135 5.315 22.361 -3.448 1.00 0.00 H new ATOM 0 HB1 ALA A 135 4.935 24.788 -3.123 1.00 0.00 H new ATOM 0 HB2 ALA A 135 3.402 23.890 -3.229 1.00 0.00 H new ATOM 0 HB3 ALA A 135 4.006 24.436 -1.646 1.00 0.00 H new ATOM 2113 N ASN A 136 6.858 21.916 -1.053 1.00 0.00 N ATOM 2114 CA ASN A 136 8.093 21.994 -0.277 1.00 0.00 C ATOM 2115 C ASN A 136 8.048 23.163 0.708 1.00 0.00 C ATOM 2116 O ASN A 136 8.990 23.951 0.802 1.00 0.00 O ATOM 2117 CB ASN A 136 9.299 22.128 -1.209 1.00 0.00 C ATOM 2118 CG ASN A 136 9.500 20.896 -2.072 1.00 0.00 C ATOM 2119 OD1 ASN A 136 10.353 20.058 -1.785 1.00 0.00 O ATOM 2120 ND2 ASN A 136 8.710 20.778 -3.134 1.00 0.00 N ATOM 0 H ASN A 136 6.429 20.991 -1.063 1.00 0.00 H new ATOM 0 HA ASN A 136 8.193 21.072 0.296 1.00 0.00 H new ATOM 0 HB2 ASN A 136 9.165 23.000 -1.850 1.00 0.00 H new ATOM 0 HB3 ASN A 136 10.196 22.303 -0.615 1.00 0.00 H new ATOM 0 HD21 ASN A 136 8.798 19.968 -3.748 1.00 0.00 H new ATOM 0 HD22 ASN A 136 8.015 21.497 -3.335 1.00 0.00 H new ATOM 2127 N TYR A 137 6.937 23.268 1.439 1.00 0.00 N ATOM 2128 CA TYR A 137 6.753 24.339 2.415 1.00 0.00 C ATOM 2129 C TYR A 137 7.689 24.175 3.612 1.00 0.00 C ATOM 2130 O TYR A 137 8.047 25.158 4.262 1.00 0.00 O ATOM 2131 CB TYR A 137 5.300 24.377 2.892 1.00 0.00 C ATOM 2132 CG TYR A 137 4.845 25.750 3.330 1.00 0.00 C ATOM 2133 CD1 TYR A 137 4.422 26.691 2.401 1.00 0.00 C ATOM 2134 CD2 TYR A 137 4.839 26.105 4.673 1.00 0.00 C ATOM 2135 CE1 TYR A 137 4.006 27.948 2.797 1.00 0.00 C ATOM 2136 CE2 TYR A 137 4.423 27.359 5.078 1.00 0.00 C ATOM 2137 CZ TYR A 137 4.008 28.277 4.136 1.00 0.00 C ATOM 2138 OH TYR A 137 3.593 29.527 4.533 1.00 0.00 O ATOM 0 H TYR A 137 6.150 22.622 1.372 1.00 0.00 H new ATOM 0 HA TYR A 137 6.997 25.280 1.922 1.00 0.00 H new ATOM 0 HB2 TYR A 137 4.653 24.028 2.088 1.00 0.00 H new ATOM 0 HB3 TYR A 137 5.180 23.681 3.722 1.00 0.00 H new ATOM 0 HD1 TYR A 137 4.418 26.436 1.351 1.00 0.00 H new ATOM 0 HD2 TYR A 137 5.165 25.389 5.413 1.00 0.00 H new ATOM 0 HE1 TYR A 137 3.681 28.669 2.061 1.00 0.00 H new ATOM 0 HE2 TYR A 137 4.423 27.619 6.126 1.00 0.00 H new ATOM 0 HH TYR A 137 3.654 29.597 5.509 1.00 0.00 H new ATOM 2148 N ASP A 138 8.082 22.934 3.901 1.00 0.00 N ATOM 2149 CA ASP A 138 8.975 22.653 5.020 1.00 0.00 C ATOM 2150 C ASP A 138 10.299 23.398 4.862 1.00 0.00 C ATOM 2151 O ASP A 138 10.714 23.727 3.751 1.00 0.00 O ATOM 2152 CB ASP A 138 9.236 21.149 5.132 1.00 0.00 C ATOM 2153 CG ASP A 138 9.503 20.692 6.557 1.00 0.00 C ATOM 2154 OD1 ASP A 138 10.112 21.460 7.335 1.00 0.00 O ATOM 2155 OD2 ASP A 138 9.104 19.557 6.894 1.00 0.00 O ATOM 0 H ASP A 138 7.795 22.109 3.374 1.00 0.00 H new ATOM 0 HA ASP A 138 8.488 22.999 5.932 1.00 0.00 H new ATOM 0 HB2 ASP A 138 8.376 20.607 4.739 1.00 0.00 H new ATOM 0 HB3 ASP A 138 10.090 20.888 4.507 1.00 0.00 H new ATOM 2160 N ALA A 139 10.951 23.655 5.988 1.00 0.00 N ATOM 2161 CA ALA A 139 12.232 24.358 6.000 1.00 0.00 C ATOM 2162 C ALA A 139 13.368 23.448 6.472 1.00 0.00 C ATOM 2163 O ALA A 139 14.540 23.720 6.203 1.00 0.00 O ATOM 2164 CB ALA A 139 12.146 25.595 6.882 1.00 0.00 C ATOM 0 H ALA A 139 10.613 23.386 6.912 1.00 0.00 H new ATOM 0 HA ALA A 139 12.454 24.664 4.977 1.00 0.00 H new ATOM 0 HB1 ALA A 139 13.107 26.109 6.882 1.00 0.00 H new ATOM 0 HB2 ALA A 139 11.376 26.264 6.497 1.00 0.00 H new ATOM 0 HB3 ALA A 139 11.893 25.299 7.900 1.00 0.00 H new ATOM 2170 N GLN A 140 13.020 22.366 7.176 1.00 0.00 N ATOM 2171 CA GLN A 140 14.016 21.423 7.681 1.00 0.00 C ATOM 2172 C GLN A 140 14.286 20.288 6.691 1.00 0.00 C ATOM 2173 O GLN A 140 14.905 19.282 7.042 1.00 0.00 O ATOM 2174 CB GLN A 140 13.555 20.844 9.019 1.00 0.00 C ATOM 2175 CG GLN A 140 14.223 21.482 10.229 1.00 0.00 C ATOM 2176 CD GLN A 140 13.521 22.745 10.697 1.00 0.00 C ATOM 2177 OE1 GLN A 140 12.311 22.899 10.529 1.00 0.00 O ATOM 2178 NE2 GLN A 140 14.280 23.660 11.292 1.00 0.00 N ATOM 0 H GLN A 140 12.057 22.124 7.407 1.00 0.00 H new ATOM 0 HA GLN A 140 14.948 21.972 7.817 1.00 0.00 H new ATOM 0 HB2 GLN A 140 12.475 20.968 9.105 1.00 0.00 H new ATOM 0 HB3 GLN A 140 13.755 19.773 9.029 1.00 0.00 H new ATOM 0 HG2 GLN A 140 14.246 20.761 11.047 1.00 0.00 H new ATOM 0 HG3 GLN A 140 15.258 21.718 9.983 1.00 0.00 H new ATOM 0 HE21 GLN A 140 15.279 23.494 11.412 1.00 0.00 H new ATOM 0 HE22 GLN A 140 13.863 24.528 11.629 1.00 0.00 H new ATOM 2187 N THR A 141 13.826 20.462 5.460 1.00 0.00 N ATOM 2188 CA THR A 141 14.018 19.459 4.412 1.00 0.00 C ATOM 2189 C THR A 141 13.889 20.089 3.021 1.00 0.00 C ATOM 2190 O THR A 141 13.220 19.549 2.137 1.00 0.00 O ATOM 2191 CB THR A 141 13.014 18.311 4.587 1.00 0.00 C ATOM 2192 OG1 THR A 141 13.252 17.277 3.644 1.00 0.00 O ATOM 2193 CG2 THR A 141 11.568 18.743 4.439 1.00 0.00 C ATOM 0 H THR A 141 13.314 21.291 5.158 1.00 0.00 H new ATOM 0 HA THR A 141 15.026 19.055 4.502 1.00 0.00 H new ATOM 0 HB THR A 141 13.167 17.957 5.606 1.00 0.00 H new ATOM 0 HG1 THR A 141 13.333 17.664 2.747 1.00 0.00 H new ATOM 0 HG21 THR A 141 10.915 17.881 4.575 1.00 0.00 H new ATOM 0 HG22 THR A 141 11.335 19.497 5.191 1.00 0.00 H new ATOM 0 HG23 THR A 141 11.413 19.162 3.445 1.00 0.00 H new ATOM 2201 N GLU A 142 14.542 21.233 2.836 1.00 0.00 N ATOM 2202 CA GLU A 142 14.511 21.941 1.561 1.00 0.00 C ATOM 2203 C GLU A 142 15.638 21.468 0.648 1.00 0.00 C ATOM 2204 O GLU A 142 15.334 20.937 -0.440 1.00 0.00 O ATOM 2205 CB GLU A 142 14.618 23.451 1.791 1.00 0.00 C ATOM 2206 CG GLU A 142 13.277 24.135 2.001 1.00 0.00 C ATOM 2207 CD GLU A 142 13.347 25.637 1.799 1.00 0.00 C ATOM 2208 OE1 GLU A 142 13.794 26.340 2.730 1.00 0.00 O ATOM 2209 OE2 GLU A 142 12.954 26.110 0.711 1.00 0.00 O ATOM 0 H GLU A 142 15.101 21.690 3.556 1.00 0.00 H new ATOM 0 HA GLU A 142 13.561 21.723 1.073 1.00 0.00 H new ATOM 0 HB2 GLU A 142 15.249 23.633 2.661 1.00 0.00 H new ATOM 0 HB3 GLU A 142 15.117 23.905 0.935 1.00 0.00 H new ATOM 0 HG2 GLU A 142 12.547 23.713 1.310 1.00 0.00 H new ATOM 0 HG3 GLU A 142 12.920 23.924 3.009 1.00 0.00 H new TER 2216 GLU A 142