USER MOD reduce.3.24.130724 H: found=0, std=0, add=1046, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1044 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 98 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: A 101 LYS NZ :NH3+ -134:sc= -1.32 (180deg=-3.71!) USER MOD Set 2.1: A 95 HIS : no HD1:sc= -0.0239 K(o=-0.046,f=-0.88) USER MOD Set 2.2: A 99 THR OG1 : rot 180:sc= -0.0225 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=-0.035) USER MOD Single : A 9 THR OG1 : rot -160:sc= 0.00757 USER MOD Single : A 21 THR OG1 : rot -100:sc= -1.06 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -67:sc= 0.831 USER MOD Single : A 28 LYS NZ :NH3+ 141:sc= -0.287 (180deg=-1.96!) USER MOD Single : A 31 ASN : amide:sc= -1.02 K(o=-1,f=-1.9!) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc=-0.00759 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -151:sc= -4.47! (180deg=-6.47!) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 89:sc= 0.361 USER MOD Single : A 56 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0438) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 61 ASN : amide:sc= -1.27 K(o=-1.3,f=-4.8!) USER MOD Single : A 62 TYR OH : rot 180:sc= -0.0981 USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.179 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ -171:sc= -0.721 (180deg=-0.825) USER MOD Single : A 76 CYS SG : rot -7:sc= -3.79 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 78 ASN : amide:sc= 0.141 K(o=0.14,f=-2) USER MOD Single : A 82 TYR OH : rot 0:sc= 0.629 USER MOD Single : A 83 ASN :FLIP amide:sc= -0.198 F(o=-0.85,f=-0.2) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 75:sc= 0.666 USER MOD Single : A 105 HIS :FLIP no HD1:sc= -2.06 F(o=-3.1,f=-2.1) USER MOD Single : A 117 ASN : amide:sc= -0.797 K(o=-0.8,f=-1.9!) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 CYS SG : rot 140:sc= -1.39 USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 SER OG : rot -22:sc= 0.598 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.661 27.065 4.655 1.00 0.00 N ATOM 2 CA GLY A 1 -15.413 26.551 4.122 1.00 0.00 C ATOM 3 C GLY A 1 -14.373 26.321 5.201 1.00 0.00 C ATOM 4 O GLY A 1 -13.902 27.267 5.830 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.339 27.205 3.879 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.053 26.386 5.338 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.487 27.973 5.131 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.603 25.614 3.599 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.020 27.252 3.386 1.00 0.00 H new ATOM 8 N SER A 2 -14.015 25.059 5.415 1.00 0.00 N ATOM 9 CA SER A 2 -13.029 24.706 6.429 1.00 0.00 C ATOM 10 C SER A 2 -11.612 24.945 5.916 1.00 0.00 C ATOM 11 O SER A 2 -11.294 24.629 4.769 1.00 0.00 O ATOM 12 CB SER A 2 -13.193 23.243 6.844 1.00 0.00 C ATOM 13 OG SER A 2 -14.485 23.005 7.375 1.00 0.00 O ATOM 0 H SER A 2 -14.393 24.264 4.900 1.00 0.00 H new ATOM 0 HA SER A 2 -13.195 25.343 7.298 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.026 22.596 5.983 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.438 22.986 7.587 1.00 0.00 H new ATOM 0 HG SER A 2 -14.565 22.062 7.631 1.00 0.00 H new ATOM 19 N SER A 3 -10.765 25.505 6.773 1.00 0.00 N ATOM 20 CA SER A 3 -9.383 25.791 6.405 1.00 0.00 C ATOM 21 C SER A 3 -8.506 24.556 6.587 1.00 0.00 C ATOM 22 O SER A 3 -8.339 24.057 7.699 1.00 0.00 O ATOM 23 CB SER A 3 -8.837 26.946 7.248 1.00 0.00 C ATOM 24 OG SER A 3 -9.582 28.132 7.030 1.00 0.00 O ATOM 0 H SER A 3 -11.011 25.770 7.727 1.00 0.00 H new ATOM 0 HA SER A 3 -9.365 26.077 5.353 1.00 0.00 H new ATOM 0 HB2 SER A 3 -8.873 26.679 8.304 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.790 27.119 6.999 1.00 0.00 H new ATOM 0 HG SER A 3 -9.215 28.855 7.581 1.00 0.00 H new ATOM 30 N GLY A 4 -7.948 24.066 5.484 1.00 0.00 N ATOM 31 CA GLY A 4 -7.095 22.893 5.542 1.00 0.00 C ATOM 32 C GLY A 4 -5.707 23.158 4.993 1.00 0.00 C ATOM 33 O GLY A 4 -5.525 24.028 4.142 1.00 0.00 O ATOM 0 H GLY A 4 -8.071 24.460 4.551 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.015 22.556 6.576 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -7.557 22.083 4.978 1.00 0.00 H new ATOM 37 N SER A 5 -4.726 22.406 5.482 1.00 0.00 N ATOM 38 CA SER A 5 -3.346 22.568 5.039 1.00 0.00 C ATOM 39 C SER A 5 -2.683 21.211 4.821 1.00 0.00 C ATOM 40 O SER A 5 -2.907 20.269 5.581 1.00 0.00 O ATOM 41 CB SER A 5 -2.551 23.378 6.064 1.00 0.00 C ATOM 42 OG SER A 5 -2.451 22.685 7.296 1.00 0.00 O ATOM 0 H SER A 5 -4.861 21.679 6.185 1.00 0.00 H new ATOM 0 HA SER A 5 -3.355 23.105 4.091 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.553 23.582 5.676 1.00 0.00 H new ATOM 0 HB3 SER A 5 -3.034 24.342 6.224 1.00 0.00 H new ATOM 0 HG SER A 5 -1.937 23.223 7.933 1.00 0.00 H new ATOM 48 N SER A 6 -1.867 21.119 3.776 1.00 0.00 N ATOM 49 CA SER A 6 -1.173 19.878 3.454 1.00 0.00 C ATOM 50 C SER A 6 0.048 19.690 4.349 1.00 0.00 C ATOM 51 O SER A 6 0.417 20.583 5.110 1.00 0.00 O ATOM 52 CB SER A 6 -0.749 19.872 1.984 1.00 0.00 C ATOM 53 OG SER A 6 0.093 20.974 1.692 1.00 0.00 O ATOM 0 H SER A 6 -1.670 21.890 3.138 1.00 0.00 H new ATOM 0 HA SER A 6 -1.860 19.050 3.629 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.228 18.942 1.756 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.633 19.907 1.347 1.00 0.00 H new ATOM 0 HG SER A 6 0.352 20.947 0.747 1.00 0.00 H new ATOM 59 N GLY A 7 0.672 18.520 4.249 1.00 0.00 N ATOM 60 CA GLY A 7 1.846 18.235 5.054 1.00 0.00 C ATOM 61 C GLY A 7 1.532 17.347 6.242 1.00 0.00 C ATOM 62 O GLY A 7 2.191 16.331 6.457 1.00 0.00 O ATOM 0 H GLY A 7 0.386 17.765 3.626 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.600 17.752 4.433 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.276 19.172 5.408 1.00 0.00 H new ATOM 66 N ASN A 8 0.523 17.733 7.017 1.00 0.00 N ATOM 67 CA ASN A 8 0.125 16.966 8.192 1.00 0.00 C ATOM 68 C ASN A 8 -0.884 15.884 7.819 1.00 0.00 C ATOM 69 O ASN A 8 -0.692 14.707 8.123 1.00 0.00 O ATOM 70 CB ASN A 8 -0.472 17.892 9.254 1.00 0.00 C ATOM 71 CG ASN A 8 0.373 19.130 9.481 1.00 0.00 C ATOM 72 OD1 ASN A 8 1.599 19.054 9.558 1.00 0.00 O ATOM 73 ND2 ASN A 8 -0.282 20.281 9.590 1.00 0.00 N ATOM 0 H ASN A 8 -0.033 18.572 6.852 1.00 0.00 H new ATOM 0 HA ASN A 8 1.014 16.484 8.599 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -1.475 18.191 8.950 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -0.573 17.347 10.193 1.00 0.00 H new ATOM 0 HD21 ASN A 8 0.233 21.148 9.744 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -1.299 20.297 9.520 1.00 0.00 H new ATOM 80 N THR A 9 -1.963 16.292 7.156 1.00 0.00 N ATOM 81 CA THR A 9 -3.003 15.360 6.741 1.00 0.00 C ATOM 82 C THR A 9 -2.402 14.048 6.251 1.00 0.00 C ATOM 83 O THR A 9 -2.831 12.967 6.657 1.00 0.00 O ATOM 84 CB THR A 9 -3.881 15.958 5.625 1.00 0.00 C ATOM 85 OG1 THR A 9 -4.174 17.329 5.914 1.00 0.00 O ATOM 86 CG2 THR A 9 -5.178 15.176 5.480 1.00 0.00 C ATOM 0 H THR A 9 -2.138 17.262 6.895 1.00 0.00 H new ATOM 0 HA THR A 9 -3.623 15.168 7.617 1.00 0.00 H new ATOM 0 HB THR A 9 -3.330 15.895 4.686 1.00 0.00 H new ATOM 0 HG1 THR A 9 -4.961 17.610 5.403 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.782 15.616 4.686 1.00 0.00 H new ATOM 0 HG22 THR A 9 -4.952 14.139 5.231 1.00 0.00 H new ATOM 0 HG23 THR A 9 -5.731 15.211 6.419 1.00 0.00 H new ATOM 94 N LEU A 10 -1.406 14.148 5.378 1.00 0.00 N ATOM 95 CA LEU A 10 -0.744 12.968 4.832 1.00 0.00 C ATOM 96 C LEU A 10 -0.265 12.047 5.950 1.00 0.00 C ATOM 97 O LEU A 10 -0.482 10.836 5.906 1.00 0.00 O ATOM 98 CB LEU A 10 0.438 13.382 3.955 1.00 0.00 C ATOM 99 CG LEU A 10 0.124 13.632 2.479 1.00 0.00 C ATOM 100 CD1 LEU A 10 -0.342 12.349 1.808 1.00 0.00 C ATOM 101 CD2 LEU A 10 -0.926 14.724 2.335 1.00 0.00 C ATOM 0 H LEU A 10 -1.039 15.035 5.033 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.467 12.425 4.223 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.873 14.290 4.372 1.00 0.00 H new ATOM 0 HB3 LEU A 10 1.200 12.605 4.017 1.00 0.00 H new ATOM 0 HG LEU A 10 1.036 13.966 1.984 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -0.561 12.546 0.759 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.442 11.595 1.880 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -1.242 11.985 2.304 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -1.137 14.889 1.278 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -1.840 14.419 2.845 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.554 15.647 2.779 1.00 0.00 H new ATOM 113 N ARG A 11 0.385 12.630 6.952 1.00 0.00 N ATOM 114 CA ARG A 11 0.894 11.862 8.082 1.00 0.00 C ATOM 115 C ARG A 11 -0.166 10.896 8.604 1.00 0.00 C ATOM 116 O ARG A 11 0.094 9.705 8.768 1.00 0.00 O ATOM 117 CB ARG A 11 1.341 12.801 9.204 1.00 0.00 C ATOM 118 CG ARG A 11 1.877 12.075 10.427 1.00 0.00 C ATOM 119 CD ARG A 11 1.624 12.868 11.700 1.00 0.00 C ATOM 120 NE ARG A 11 1.838 12.061 12.899 1.00 0.00 N ATOM 121 CZ ARG A 11 1.278 12.328 14.074 1.00 0.00 C ATOM 122 NH1 ARG A 11 0.476 13.376 14.207 1.00 0.00 N ATOM 123 NH2 ARG A 11 1.521 11.547 15.119 1.00 0.00 N ATOM 0 H ARG A 11 0.572 13.631 7.004 1.00 0.00 H new ATOM 0 HA ARG A 11 1.751 11.283 7.739 1.00 0.00 H new ATOM 0 HB2 ARG A 11 2.112 13.469 8.821 1.00 0.00 H new ATOM 0 HB3 ARG A 11 0.498 13.424 9.502 1.00 0.00 H new ATOM 0 HG2 ARG A 11 1.404 11.096 10.507 1.00 0.00 H new ATOM 0 HG3 ARG A 11 2.947 11.904 10.310 1.00 0.00 H new ATOM 0 HD2 ARG A 11 2.284 13.735 11.724 1.00 0.00 H new ATOM 0 HD3 ARG A 11 0.601 13.246 11.695 1.00 0.00 H new ATOM 0 HE ARG A 11 2.451 11.248 12.830 1.00 0.00 H new ATOM 0 HH11 ARG A 11 0.288 13.979 13.406 1.00 0.00 H new ATOM 0 HH12 ARG A 11 0.047 13.579 15.110 1.00 0.00 H new ATOM 0 HH21 ARG A 11 2.138 10.741 15.021 1.00 0.00 H new ATOM 0 HH22 ARG A 11 1.091 11.753 16.021 1.00 0.00 H new ATOM 137 N GLU A 12 -1.360 11.420 8.864 1.00 0.00 N ATOM 138 CA GLU A 12 -2.458 10.604 9.369 1.00 0.00 C ATOM 139 C GLU A 12 -2.693 9.393 8.470 1.00 0.00 C ATOM 140 O GLU A 12 -2.586 8.248 8.912 1.00 0.00 O ATOM 141 CB GLU A 12 -3.738 11.436 9.467 1.00 0.00 C ATOM 142 CG GLU A 12 -3.667 12.540 10.509 1.00 0.00 C ATOM 143 CD GLU A 12 -3.583 12.001 11.925 1.00 0.00 C ATOM 144 OE1 GLU A 12 -2.516 11.467 12.293 1.00 0.00 O ATOM 145 OE2 GLU A 12 -4.584 12.114 12.663 1.00 0.00 O ATOM 0 H GLU A 12 -1.591 12.405 8.733 1.00 0.00 H new ATOM 0 HA GLU A 12 -2.187 10.250 10.364 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -3.949 11.879 8.494 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.573 10.777 9.705 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -2.797 13.167 10.310 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.547 13.177 10.418 1.00 0.00 H new ATOM 152 N LEU A 13 -3.015 9.654 7.208 1.00 0.00 N ATOM 153 CA LEU A 13 -3.267 8.586 6.246 1.00 0.00 C ATOM 154 C LEU A 13 -2.123 7.577 6.242 1.00 0.00 C ATOM 155 O LEU A 13 -2.350 6.367 6.210 1.00 0.00 O ATOM 156 CB LEU A 13 -3.453 9.170 4.845 1.00 0.00 C ATOM 157 CG LEU A 13 -4.234 8.304 3.856 1.00 0.00 C ATOM 158 CD1 LEU A 13 -5.730 8.509 4.032 1.00 0.00 C ATOM 159 CD2 LEU A 13 -3.816 8.617 2.426 1.00 0.00 C ATOM 0 H LEU A 13 -3.108 10.595 6.827 1.00 0.00 H new ATOM 0 HA LEU A 13 -4.180 8.070 6.542 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -3.962 10.130 4.938 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -2.468 9.371 4.423 1.00 0.00 H new ATOM 0 HG LEU A 13 -4.005 7.258 4.060 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -6.269 7.885 3.320 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -6.018 8.234 5.047 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -5.977 9.556 3.856 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.382 7.991 1.736 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -4.015 9.667 2.210 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -2.751 8.417 2.306 1.00 0.00 H new ATOM 171 N ARG A 14 -0.894 8.082 6.275 1.00 0.00 N ATOM 172 CA ARG A 14 0.284 7.224 6.276 1.00 0.00 C ATOM 173 C ARG A 14 0.150 6.117 7.316 1.00 0.00 C ATOM 174 O ARG A 14 0.337 4.938 7.012 1.00 0.00 O ATOM 175 CB ARG A 14 1.542 8.050 6.553 1.00 0.00 C ATOM 176 CG ARG A 14 2.826 7.238 6.508 1.00 0.00 C ATOM 177 CD ARG A 14 4.017 8.101 6.122 1.00 0.00 C ATOM 178 NE ARG A 14 4.373 9.047 7.176 1.00 0.00 N ATOM 179 CZ ARG A 14 4.976 8.695 8.306 1.00 0.00 C ATOM 180 NH1 ARG A 14 5.289 7.426 8.527 1.00 0.00 N ATOM 181 NH2 ARG A 14 5.267 9.614 9.218 1.00 0.00 N ATOM 0 H ARG A 14 -0.689 9.081 6.301 1.00 0.00 H new ATOM 0 HA ARG A 14 0.369 6.764 5.291 1.00 0.00 H new ATOM 0 HB2 ARG A 14 1.606 8.856 5.822 1.00 0.00 H new ATOM 0 HB3 ARG A 14 1.451 8.517 7.534 1.00 0.00 H new ATOM 0 HG2 ARG A 14 3.005 6.784 7.483 1.00 0.00 H new ATOM 0 HG3 ARG A 14 2.718 6.424 5.792 1.00 0.00 H new ATOM 0 HD2 ARG A 14 4.873 7.462 5.905 1.00 0.00 H new ATOM 0 HD3 ARG A 14 3.787 8.647 5.207 1.00 0.00 H new ATOM 0 HE ARG A 14 4.146 10.032 7.037 1.00 0.00 H new ATOM 0 HH11 ARG A 14 5.067 6.717 7.828 1.00 0.00 H new ATOM 0 HH12 ARG A 14 5.752 7.159 9.396 1.00 0.00 H new ATOM 0 HH21 ARG A 14 5.028 10.591 9.052 1.00 0.00 H new ATOM 0 HH22 ARG A 14 5.730 9.343 10.085 1.00 0.00 H new ATOM 195 N LEU A 15 -0.174 6.503 8.545 1.00 0.00 N ATOM 196 CA LEU A 15 -0.333 5.543 9.632 1.00 0.00 C ATOM 197 C LEU A 15 -1.635 4.762 9.483 1.00 0.00 C ATOM 198 O LEU A 15 -1.658 3.540 9.630 1.00 0.00 O ATOM 199 CB LEU A 15 -0.308 6.262 10.982 1.00 0.00 C ATOM 200 CG LEU A 15 0.949 7.078 11.285 1.00 0.00 C ATOM 201 CD1 LEU A 15 0.637 8.194 12.270 1.00 0.00 C ATOM 202 CD2 LEU A 15 2.051 6.179 11.826 1.00 0.00 C ATOM 0 H LEU A 15 -0.332 7.474 8.814 1.00 0.00 H new ATOM 0 HA LEU A 15 0.498 4.840 9.587 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -1.170 6.927 11.033 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.433 5.519 11.769 1.00 0.00 H new ATOM 0 HG LEU A 15 1.299 7.529 10.356 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.544 8.764 12.473 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -0.119 8.854 11.844 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.262 7.765 13.199 1.00 0.00 H new ATOM 0 HD21 LEU A 15 2.938 6.777 12.036 1.00 0.00 H new ATOM 0 HD22 LEU A 15 1.711 5.699 12.744 1.00 0.00 H new ATOM 0 HD23 LEU A 15 2.294 5.416 11.086 1.00 0.00 H new ATOM 214 N PHE A 16 -2.716 5.476 9.188 1.00 0.00 N ATOM 215 CA PHE A 16 -4.022 4.850 9.018 1.00 0.00 C ATOM 216 C PHE A 16 -3.933 3.653 8.075 1.00 0.00 C ATOM 217 O PHE A 16 -4.309 2.536 8.434 1.00 0.00 O ATOM 218 CB PHE A 16 -5.031 5.865 8.477 1.00 0.00 C ATOM 219 CG PHE A 16 -6.295 5.238 7.962 1.00 0.00 C ATOM 220 CD1 PHE A 16 -7.066 4.428 8.781 1.00 0.00 C ATOM 221 CD2 PHE A 16 -6.713 5.459 6.660 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.229 3.849 8.309 1.00 0.00 C ATOM 223 CE2 PHE A 16 -7.876 4.883 6.183 1.00 0.00 C ATOM 224 CZ PHE A 16 -8.635 4.078 7.009 1.00 0.00 C ATOM 0 H PHE A 16 -2.714 6.488 9.062 1.00 0.00 H new ATOM 0 HA PHE A 16 -4.358 4.498 9.993 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -5.282 6.573 9.267 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -4.565 6.436 7.674 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -6.755 4.247 9.799 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.124 6.089 6.010 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -8.820 3.218 8.956 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -8.190 5.063 5.165 1.00 0.00 H new ATOM 0 HZ PHE A 16 -9.545 3.628 6.639 1.00 0.00 H new ATOM 234 N LEU A 17 -3.433 3.895 6.868 1.00 0.00 N ATOM 235 CA LEU A 17 -3.294 2.838 5.872 1.00 0.00 C ATOM 236 C LEU A 17 -2.292 1.784 6.333 1.00 0.00 C ATOM 237 O LEU A 17 -2.672 0.677 6.713 1.00 0.00 O ATOM 238 CB LEU A 17 -2.851 3.428 4.532 1.00 0.00 C ATOM 239 CG LEU A 17 -3.781 4.476 3.920 1.00 0.00 C ATOM 240 CD1 LEU A 17 -3.123 5.138 2.720 1.00 0.00 C ATOM 241 CD2 LEU A 17 -5.108 3.846 3.523 1.00 0.00 C ATOM 0 H LEU A 17 -3.117 4.813 6.556 1.00 0.00 H new ATOM 0 HA LEU A 17 -4.265 2.359 5.748 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.867 3.877 4.663 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -2.736 2.612 3.819 1.00 0.00 H new ATOM 0 HG LEU A 17 -3.976 5.242 4.670 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -3.800 5.881 2.298 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -2.200 5.625 3.034 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -2.897 4.383 1.967 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -5.757 4.607 3.089 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -4.932 3.059 2.790 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -5.587 3.420 4.405 1.00 0.00 H new ATOM 253 N ARG A 18 -1.011 2.137 6.297 1.00 0.00 N ATOM 254 CA ARG A 18 0.045 1.222 6.711 1.00 0.00 C ATOM 255 C ARG A 18 -0.402 0.378 7.901 1.00 0.00 C ATOM 256 O ARG A 18 -0.198 -0.836 7.926 1.00 0.00 O ATOM 257 CB ARG A 18 1.311 2.001 7.073 1.00 0.00 C ATOM 258 CG ARG A 18 2.583 1.174 6.981 1.00 0.00 C ATOM 259 CD ARG A 18 3.680 1.738 7.870 1.00 0.00 C ATOM 260 NE ARG A 18 4.672 0.727 8.224 1.00 0.00 N ATOM 261 CZ ARG A 18 5.737 0.974 8.978 1.00 0.00 C ATOM 262 NH1 ARG A 18 5.946 2.192 9.457 1.00 0.00 N ATOM 263 NH2 ARG A 18 6.595 0.001 9.256 1.00 0.00 N ATOM 0 H ARG A 18 -0.680 3.050 5.985 1.00 0.00 H new ATOM 0 HA ARG A 18 0.262 0.556 5.876 1.00 0.00 H new ATOM 0 HB2 ARG A 18 1.399 2.862 6.411 1.00 0.00 H new ATOM 0 HB3 ARG A 18 1.212 2.388 8.087 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.371 0.145 7.271 1.00 0.00 H new ATOM 0 HG3 ARG A 18 2.928 1.149 5.947 1.00 0.00 H new ATOM 0 HD2 ARG A 18 4.172 2.565 7.358 1.00 0.00 H new ATOM 0 HD3 ARG A 18 3.237 2.145 8.779 1.00 0.00 H new ATOM 0 HE ARG A 18 4.540 -0.221 7.873 1.00 0.00 H new ATOM 0 HH11 ARG A 18 5.288 2.943 9.247 1.00 0.00 H new ATOM 0 HH12 ARG A 18 6.765 2.379 10.036 1.00 0.00 H new ATOM 0 HH21 ARG A 18 6.437 -0.938 8.890 1.00 0.00 H new ATOM 0 HH22 ARG A 18 7.413 0.192 9.835 1.00 0.00 H new ATOM 277 N ASP A 19 -1.013 1.029 8.885 1.00 0.00 N ATOM 278 CA ASP A 19 -1.490 0.338 10.078 1.00 0.00 C ATOM 279 C ASP A 19 -2.489 -0.754 9.710 1.00 0.00 C ATOM 280 O ASP A 19 -2.443 -1.859 10.251 1.00 0.00 O ATOM 281 CB ASP A 19 -2.135 1.332 11.045 1.00 0.00 C ATOM 282 CG ASP A 19 -2.605 0.672 12.326 1.00 0.00 C ATOM 283 OD1 ASP A 19 -2.724 -0.571 12.344 1.00 0.00 O ATOM 284 OD2 ASP A 19 -2.853 1.398 13.311 1.00 0.00 O ATOM 0 H ASP A 19 -1.190 2.034 8.880 1.00 0.00 H new ATOM 0 HA ASP A 19 -0.633 -0.128 10.566 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -1.418 2.117 11.286 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -2.982 1.813 10.556 1.00 0.00 H new ATOM 289 N VAL A 20 -3.391 -0.438 8.787 1.00 0.00 N ATOM 290 CA VAL A 20 -4.402 -1.392 8.347 1.00 0.00 C ATOM 291 C VAL A 20 -3.762 -2.587 7.649 1.00 0.00 C ATOM 292 O VAL A 20 -3.892 -3.726 8.099 1.00 0.00 O ATOM 293 CB VAL A 20 -5.415 -0.736 7.390 1.00 0.00 C ATOM 294 CG1 VAL A 20 -6.390 -1.772 6.852 1.00 0.00 C ATOM 295 CG2 VAL A 20 -6.157 0.391 8.093 1.00 0.00 C ATOM 0 H VAL A 20 -3.442 0.472 8.329 1.00 0.00 H new ATOM 0 HA VAL A 20 -4.925 -1.733 9.240 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.870 -0.312 6.546 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.098 -1.290 6.178 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -5.841 -2.542 6.311 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -6.931 -2.227 7.681 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -6.869 0.844 7.403 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -6.691 -0.007 8.956 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -5.443 1.145 8.425 1.00 0.00 H new ATOM 305 N THR A 21 -3.069 -2.321 6.546 1.00 0.00 N ATOM 306 CA THR A 21 -2.408 -3.374 5.785 1.00 0.00 C ATOM 307 C THR A 21 -1.541 -4.243 6.688 1.00 0.00 C ATOM 308 O THR A 21 -1.686 -5.465 6.717 1.00 0.00 O ATOM 309 CB THR A 21 -1.534 -2.789 4.660 1.00 0.00 C ATOM 310 OG1 THR A 21 -2.335 -1.989 3.783 1.00 0.00 O ATOM 311 CG2 THR A 21 -0.859 -3.899 3.867 1.00 0.00 C ATOM 0 H THR A 21 -2.951 -1.384 6.160 1.00 0.00 H new ATOM 0 HA THR A 21 -3.194 -3.986 5.343 1.00 0.00 H new ATOM 0 HB THR A 21 -0.763 -2.168 5.115 1.00 0.00 H new ATOM 0 HG1 THR A 21 -2.557 -2.506 2.980 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.247 -3.462 3.078 1.00 0.00 H new ATOM 0 HG22 THR A 21 -0.227 -4.489 4.532 1.00 0.00 H new ATOM 0 HG23 THR A 21 -1.618 -4.542 3.423 1.00 0.00 H new ATOM 319 N LYS A 22 -0.637 -3.605 7.425 1.00 0.00 N ATOM 320 CA LYS A 22 0.254 -4.320 8.331 1.00 0.00 C ATOM 321 C LYS A 22 -0.467 -5.490 8.993 1.00 0.00 C ATOM 322 O LYS A 22 -0.080 -6.646 8.822 1.00 0.00 O ATOM 323 CB LYS A 22 0.796 -3.369 9.401 1.00 0.00 C ATOM 324 CG LYS A 22 1.781 -4.024 10.353 1.00 0.00 C ATOM 325 CD LYS A 22 3.183 -4.060 9.767 1.00 0.00 C ATOM 326 CE LYS A 22 3.903 -2.735 9.963 1.00 0.00 C ATOM 327 NZ LYS A 22 4.538 -2.642 11.307 1.00 0.00 N ATOM 0 H LYS A 22 -0.502 -2.594 7.412 1.00 0.00 H new ATOM 0 HA LYS A 22 1.086 -4.713 7.747 1.00 0.00 H new ATOM 0 HB2 LYS A 22 1.282 -2.525 8.912 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -0.039 -2.967 9.975 1.00 0.00 H new ATOM 0 HG2 LYS A 22 1.794 -3.479 11.297 1.00 0.00 H new ATOM 0 HG3 LYS A 22 1.453 -5.039 10.576 1.00 0.00 H new ATOM 0 HD2 LYS A 22 3.755 -4.859 10.238 1.00 0.00 H new ATOM 0 HD3 LYS A 22 3.128 -4.292 8.703 1.00 0.00 H new ATOM 0 HE2 LYS A 22 4.665 -2.618 9.192 1.00 0.00 H new ATOM 0 HE3 LYS A 22 3.195 -1.915 9.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 5.018 -1.724 11.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 3.808 -2.728 12.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 5.232 -3.409 11.417 1.00 0.00 H new ATOM 341 N ARG A 23 -1.517 -5.182 9.747 1.00 0.00 N ATOM 342 CA ARG A 23 -2.292 -6.208 10.433 1.00 0.00 C ATOM 343 C ARG A 23 -2.587 -7.381 9.502 1.00 0.00 C ATOM 344 O ARG A 23 -2.386 -8.541 9.865 1.00 0.00 O ATOM 345 CB ARG A 23 -3.602 -5.620 10.961 1.00 0.00 C ATOM 346 CG ARG A 23 -4.437 -6.611 11.756 1.00 0.00 C ATOM 347 CD ARG A 23 -5.412 -5.901 12.682 1.00 0.00 C ATOM 348 NE ARG A 23 -6.625 -6.684 12.904 1.00 0.00 N ATOM 349 CZ ARG A 23 -7.764 -6.164 13.348 1.00 0.00 C ATOM 350 NH1 ARG A 23 -7.846 -4.868 13.615 1.00 0.00 N ATOM 351 NH2 ARG A 23 -8.825 -6.942 13.525 1.00 0.00 N ATOM 0 H ARG A 23 -1.850 -4.230 9.898 1.00 0.00 H new ATOM 0 HA ARG A 23 -1.701 -6.573 11.273 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -3.376 -4.760 11.591 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -4.191 -5.253 10.120 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -4.988 -7.256 11.071 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -3.780 -7.254 12.341 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -4.927 -5.705 13.638 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -5.678 -4.934 12.256 1.00 0.00 H new ATOM 0 HE ARG A 23 -6.596 -7.684 12.707 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -7.033 -4.267 13.480 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -8.722 -4.472 13.956 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -8.766 -7.939 13.320 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -9.699 -6.542 13.866 1.00 0.00 H new ATOM 365 N LEU A 24 -3.065 -7.071 8.302 1.00 0.00 N ATOM 366 CA LEU A 24 -3.388 -8.098 7.319 1.00 0.00 C ATOM 367 C LEU A 24 -2.173 -8.971 7.023 1.00 0.00 C ATOM 368 O LEU A 24 -2.238 -10.196 7.117 1.00 0.00 O ATOM 369 CB LEU A 24 -3.895 -7.455 6.027 1.00 0.00 C ATOM 370 CG LEU A 24 -4.993 -6.402 6.187 1.00 0.00 C ATOM 371 CD1 LEU A 24 -5.285 -5.728 4.855 1.00 0.00 C ATOM 372 CD2 LEU A 24 -6.256 -7.032 6.757 1.00 0.00 C ATOM 0 H LEU A 24 -3.237 -6.116 7.987 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.173 -8.729 7.736 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -3.049 -6.994 5.518 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.268 -8.244 5.374 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.643 -5.642 6.885 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.069 -4.982 4.989 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.381 -5.243 4.487 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.615 -6.476 4.134 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -7.027 -6.269 6.864 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -6.609 -7.812 6.083 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -6.037 -7.467 7.732 1.00 0.00 H new ATOM 384 N ALA A 25 -1.064 -8.330 6.667 1.00 0.00 N ATOM 385 CA ALA A 25 0.168 -9.047 6.362 1.00 0.00 C ATOM 386 C ALA A 25 0.617 -9.896 7.547 1.00 0.00 C ATOM 387 O ALA A 25 0.587 -11.126 7.490 1.00 0.00 O ATOM 388 CB ALA A 25 1.264 -8.069 5.966 1.00 0.00 C ATOM 0 H ALA A 25 -0.994 -7.316 6.583 1.00 0.00 H new ATOM 0 HA ALA A 25 -0.028 -9.715 5.523 1.00 0.00 H new ATOM 0 HB1 ALA A 25 2.178 -8.618 5.741 1.00 0.00 H new ATOM 0 HB2 ALA A 25 0.951 -7.509 5.085 1.00 0.00 H new ATOM 0 HB3 ALA A 25 1.449 -7.378 6.788 1.00 0.00 H new ATOM 394 N THR A 26 1.034 -9.232 8.620 1.00 0.00 N ATOM 395 CA THR A 26 1.491 -9.926 9.818 1.00 0.00 C ATOM 396 C THR A 26 0.611 -11.132 10.125 1.00 0.00 C ATOM 397 O THR A 26 1.108 -12.237 10.342 1.00 0.00 O ATOM 398 CB THR A 26 1.503 -8.988 11.040 1.00 0.00 C ATOM 399 OG1 THR A 26 0.252 -8.299 11.140 1.00 0.00 O ATOM 400 CG2 THR A 26 2.637 -7.980 10.938 1.00 0.00 C ATOM 0 H THR A 26 1.065 -8.214 8.684 1.00 0.00 H new ATOM 0 HA THR A 26 2.508 -10.264 9.619 1.00 0.00 H new ATOM 0 HB THR A 26 1.657 -9.593 11.934 1.00 0.00 H new ATOM 0 HG1 THR A 26 0.157 -7.681 10.385 1.00 0.00 H new ATOM 0 HG21 THR A 26 2.625 -7.329 11.812 1.00 0.00 H new ATOM 0 HG22 THR A 26 3.590 -8.508 10.892 1.00 0.00 H new ATOM 0 HG23 THR A 26 2.510 -7.380 10.037 1.00 0.00 H new ATOM 408 N ASP A 27 -0.699 -10.913 10.141 1.00 0.00 N ATOM 409 CA ASP A 27 -1.650 -11.983 10.419 1.00 0.00 C ATOM 410 C ASP A 27 -1.425 -13.167 9.484 1.00 0.00 C ATOM 411 O ASP A 27 -1.343 -13.003 8.267 1.00 0.00 O ATOM 412 CB ASP A 27 -3.084 -11.470 10.277 1.00 0.00 C ATOM 413 CG ASP A 27 -3.609 -10.857 11.561 1.00 0.00 C ATOM 414 OD1 ASP A 27 -3.585 -11.548 12.601 1.00 0.00 O ATOM 415 OD2 ASP A 27 -4.046 -9.688 11.525 1.00 0.00 O ATOM 0 H ASP A 27 -1.127 -10.004 9.965 1.00 0.00 H new ATOM 0 HA ASP A 27 -1.492 -12.318 11.444 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -3.124 -10.727 9.480 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -3.733 -12.293 9.978 1.00 0.00 H new ATOM 420 N LYS A 28 -1.326 -14.360 10.061 1.00 0.00 N ATOM 421 CA LYS A 28 -1.110 -15.572 9.280 1.00 0.00 C ATOM 422 C LYS A 28 -2.218 -15.759 8.248 1.00 0.00 C ATOM 423 O LYS A 28 -1.975 -16.248 7.145 1.00 0.00 O ATOM 424 CB LYS A 28 -1.047 -16.792 10.202 1.00 0.00 C ATOM 425 CG LYS A 28 -0.512 -18.041 9.523 1.00 0.00 C ATOM 426 CD LYS A 28 -0.606 -19.255 10.432 1.00 0.00 C ATOM 427 CE LYS A 28 0.572 -19.325 11.391 1.00 0.00 C ATOM 428 NZ LYS A 28 0.377 -18.442 12.575 1.00 0.00 N ATOM 0 H LYS A 28 -1.392 -14.513 11.067 1.00 0.00 H new ATOM 0 HA LYS A 28 -0.161 -15.471 8.754 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.417 -16.557 11.060 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -2.046 -16.998 10.587 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -1.073 -18.227 8.607 1.00 0.00 H new ATOM 0 HG3 LYS A 28 0.527 -17.882 9.233 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -1.536 -19.215 10.999 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -0.639 -20.162 9.828 1.00 0.00 H new ATOM 0 HE2 LYS A 28 0.709 -20.354 11.724 1.00 0.00 H new ATOM 0 HE3 LYS A 28 1.484 -19.035 10.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 0.735 -18.919 13.427 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 0.896 -17.552 12.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -0.636 -18.237 12.692 1.00 0.00 H new ATOM 442 N ARG A 29 -3.434 -15.365 8.614 1.00 0.00 N ATOM 443 CA ARG A 29 -4.578 -15.489 7.719 1.00 0.00 C ATOM 444 C ARG A 29 -4.253 -14.924 6.340 1.00 0.00 C ATOM 445 O ARG A 29 -4.436 -15.594 5.324 1.00 0.00 O ATOM 446 CB ARG A 29 -5.792 -14.766 8.306 1.00 0.00 C ATOM 447 CG ARG A 29 -6.618 -15.628 9.246 1.00 0.00 C ATOM 448 CD ARG A 29 -7.665 -16.431 8.490 1.00 0.00 C ATOM 449 NE ARG A 29 -8.884 -15.660 8.260 1.00 0.00 N ATOM 450 CZ ARG A 29 -9.725 -15.308 9.226 1.00 0.00 C ATOM 451 NH1 ARG A 29 -9.480 -15.655 10.482 1.00 0.00 N ATOM 452 NH2 ARG A 29 -10.814 -14.607 8.937 1.00 0.00 N ATOM 0 H ARG A 29 -3.652 -14.958 9.523 1.00 0.00 H new ATOM 0 HA ARG A 29 -4.811 -16.548 7.612 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -5.452 -13.880 8.843 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -6.428 -14.420 7.491 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -5.961 -16.306 9.791 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -7.108 -14.995 9.986 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -7.254 -16.753 7.533 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -7.907 -17.333 9.053 1.00 0.00 H new ATOM 0 HE ARG A 29 -9.102 -15.376 7.305 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -8.644 -16.194 10.708 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -10.128 -15.383 11.222 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -11.006 -14.338 7.972 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -11.459 -14.337 9.680 1.00 0.00 H new ATOM 466 N PHE A 30 -3.771 -13.685 6.312 1.00 0.00 N ATOM 467 CA PHE A 30 -3.422 -13.029 5.058 1.00 0.00 C ATOM 468 C PHE A 30 -1.914 -12.829 4.949 1.00 0.00 C ATOM 469 O PHE A 30 -1.443 -11.748 4.600 1.00 0.00 O ATOM 470 CB PHE A 30 -4.136 -11.679 4.948 1.00 0.00 C ATOM 471 CG PHE A 30 -5.601 -11.749 5.269 1.00 0.00 C ATOM 472 CD1 PHE A 30 -6.483 -12.387 4.412 1.00 0.00 C ATOM 473 CD2 PHE A 30 -6.098 -11.174 6.429 1.00 0.00 C ATOM 474 CE1 PHE A 30 -7.832 -12.453 4.705 1.00 0.00 C ATOM 475 CE2 PHE A 30 -7.446 -11.237 6.727 1.00 0.00 C ATOM 476 CZ PHE A 30 -8.314 -11.876 5.863 1.00 0.00 C ATOM 0 H PHE A 30 -3.614 -13.116 7.144 1.00 0.00 H new ATOM 0 HA PHE A 30 -3.745 -13.672 4.239 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -3.658 -10.968 5.622 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -4.012 -11.292 3.936 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -6.112 -12.838 3.504 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -5.424 -10.671 7.107 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -8.508 -12.955 4.029 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -7.820 -10.787 7.635 1.00 0.00 H new ATOM 0 HZ PHE A 30 -9.368 -11.924 6.093 1.00 0.00 H new ATOM 486 N ASN A 31 -1.160 -13.881 5.253 1.00 0.00 N ATOM 487 CA ASN A 31 0.296 -13.822 5.191 1.00 0.00 C ATOM 488 C ASN A 31 0.811 -14.450 3.900 1.00 0.00 C ATOM 489 O ASN A 31 1.872 -14.079 3.397 1.00 0.00 O ATOM 490 CB ASN A 31 0.907 -14.536 6.398 1.00 0.00 C ATOM 491 CG ASN A 31 2.406 -14.327 6.495 1.00 0.00 C ATOM 492 OD1 ASN A 31 3.141 -14.573 5.538 1.00 0.00 O ATOM 493 ND2 ASN A 31 2.867 -13.872 7.654 1.00 0.00 N ATOM 0 H ASN A 31 -1.533 -14.784 5.545 1.00 0.00 H new ATOM 0 HA ASN A 31 0.594 -12.774 5.208 1.00 0.00 H new ATOM 0 HB2 ASN A 31 0.433 -14.173 7.310 1.00 0.00 H new ATOM 0 HB3 ASN A 31 0.695 -15.603 6.331 1.00 0.00 H new ATOM 0 HD21 ASN A 31 3.867 -13.713 7.778 1.00 0.00 H new ATOM 0 HD22 ASN A 31 2.221 -13.682 8.420 1.00 0.00 H new ATOM 500 N ILE A 32 0.053 -15.403 3.368 1.00 0.00 N ATOM 501 CA ILE A 32 0.432 -16.081 2.135 1.00 0.00 C ATOM 502 C ILE A 32 0.530 -15.097 0.974 1.00 0.00 C ATOM 503 O ILE A 32 1.256 -15.331 0.007 1.00 0.00 O ATOM 504 CB ILE A 32 -0.573 -17.190 1.770 1.00 0.00 C ATOM 505 CG1 ILE A 32 -1.923 -16.579 1.389 1.00 0.00 C ATOM 506 CG2 ILE A 32 -0.733 -18.162 2.929 1.00 0.00 C ATOM 507 CD1 ILE A 32 -2.776 -17.487 0.531 1.00 0.00 C ATOM 0 H ILE A 32 -0.827 -15.723 3.772 1.00 0.00 H new ATOM 0 HA ILE A 32 1.409 -16.531 2.310 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.189 -17.740 0.911 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.471 -16.332 2.298 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.752 -15.644 0.856 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.446 -18.940 2.656 1.00 0.00 H new ATOM 0 HG22 ILE A 32 0.231 -18.617 3.158 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.098 -17.626 3.805 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.718 -16.989 0.299 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -2.248 -17.714 -0.395 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -2.978 -18.413 1.070 1.00 0.00 H new ATOM 519 N PHE A 33 -0.204 -13.994 1.077 1.00 0.00 N ATOM 520 CA PHE A 33 -0.200 -12.973 0.036 1.00 0.00 C ATOM 521 C PHE A 33 1.021 -12.067 0.168 1.00 0.00 C ATOM 522 O PHE A 33 1.654 -11.712 -0.826 1.00 0.00 O ATOM 523 CB PHE A 33 -1.479 -12.137 0.108 1.00 0.00 C ATOM 524 CG PHE A 33 -2.720 -12.909 -0.236 1.00 0.00 C ATOM 525 CD1 PHE A 33 -3.098 -13.087 -1.557 1.00 0.00 C ATOM 526 CD2 PHE A 33 -3.509 -13.458 0.762 1.00 0.00 C ATOM 527 CE1 PHE A 33 -4.239 -13.798 -1.877 1.00 0.00 C ATOM 528 CE2 PHE A 33 -4.651 -14.170 0.448 1.00 0.00 C ATOM 529 CZ PHE A 33 -5.018 -14.339 -0.873 1.00 0.00 C ATOM 0 H PHE A 33 -0.809 -13.784 1.871 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.156 -13.475 -0.931 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -1.581 -11.730 1.114 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -1.388 -11.289 -0.571 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -2.494 -12.665 -2.346 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -3.228 -13.328 1.797 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -4.521 -13.930 -2.911 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -5.256 -14.594 1.235 1.00 0.00 H new ATOM 0 HZ PHE A 33 -5.912 -14.893 -1.120 1.00 0.00 H new ATOM 539 N SER A 34 1.345 -11.697 1.403 1.00 0.00 N ATOM 540 CA SER A 34 2.487 -10.829 1.666 1.00 0.00 C ATOM 541 C SER A 34 3.666 -11.196 0.770 1.00 0.00 C ATOM 542 O SER A 34 4.420 -10.328 0.328 1.00 0.00 O ATOM 543 CB SER A 34 2.900 -10.925 3.136 1.00 0.00 C ATOM 544 OG SER A 34 3.795 -9.882 3.484 1.00 0.00 O ATOM 0 H SER A 34 0.833 -11.985 2.237 1.00 0.00 H new ATOM 0 HA SER A 34 2.191 -9.803 1.446 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.015 -10.875 3.770 1.00 0.00 H new ATOM 0 HB3 SER A 34 3.371 -11.890 3.322 1.00 0.00 H new ATOM 0 HG SER A 34 4.043 -9.965 4.429 1.00 0.00 H new ATOM 550 N LYS A 35 3.820 -12.489 0.505 1.00 0.00 N ATOM 551 CA LYS A 35 4.905 -12.974 -0.339 1.00 0.00 C ATOM 552 C LYS A 35 4.384 -13.387 -1.712 1.00 0.00 C ATOM 553 O LYS A 35 3.196 -13.650 -1.898 1.00 0.00 O ATOM 554 CB LYS A 35 5.608 -14.158 0.329 1.00 0.00 C ATOM 555 CG LYS A 35 6.725 -13.749 1.273 1.00 0.00 C ATOM 556 CD LYS A 35 7.786 -14.831 1.384 1.00 0.00 C ATOM 557 CE LYS A 35 7.267 -16.045 2.139 1.00 0.00 C ATOM 558 NZ LYS A 35 8.318 -17.088 2.302 1.00 0.00 N ATOM 0 H LYS A 35 3.206 -13.220 0.863 1.00 0.00 H new ATOM 0 HA LYS A 35 5.620 -12.162 -0.471 1.00 0.00 H new ATOM 0 HB2 LYS A 35 4.872 -14.742 0.882 1.00 0.00 H new ATOM 0 HB3 LYS A 35 6.017 -14.810 -0.443 1.00 0.00 H new ATOM 0 HG2 LYS A 35 7.182 -12.825 0.919 1.00 0.00 H new ATOM 0 HG3 LYS A 35 6.311 -13.542 2.260 1.00 0.00 H new ATOM 0 HD2 LYS A 35 8.107 -15.131 0.386 1.00 0.00 H new ATOM 0 HD3 LYS A 35 8.663 -14.432 1.894 1.00 0.00 H new ATOM 0 HE2 LYS A 35 6.907 -15.736 3.120 1.00 0.00 H new ATOM 0 HE3 LYS A 35 6.416 -16.468 1.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 7.925 -17.899 2.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 8.644 -17.402 1.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 9.120 -16.693 2.833 1.00 0.00 H new ATOM 572 N PRO A 36 5.292 -13.446 -2.697 1.00 0.00 N ATOM 573 CA PRO A 36 4.947 -13.829 -4.069 1.00 0.00 C ATOM 574 C PRO A 36 4.581 -15.304 -4.185 1.00 0.00 C ATOM 575 O PRO A 36 5.423 -16.181 -3.990 1.00 0.00 O ATOM 576 CB PRO A 36 6.229 -13.533 -4.853 1.00 0.00 C ATOM 577 CG PRO A 36 7.320 -13.625 -3.843 1.00 0.00 C ATOM 578 CD PRO A 36 6.726 -13.146 -2.547 1.00 0.00 C ATOM 0 HA PRO A 36 4.073 -13.290 -4.435 1.00 0.00 H new ATOM 0 HB2 PRO A 36 6.375 -14.251 -5.660 1.00 0.00 H new ATOM 0 HB3 PRO A 36 6.194 -12.544 -5.310 1.00 0.00 H new ATOM 0 HG2 PRO A 36 7.682 -14.649 -3.752 1.00 0.00 H new ATOM 0 HG3 PRO A 36 8.172 -13.010 -4.132 1.00 0.00 H new ATOM 0 HD2 PRO A 36 7.158 -13.665 -1.691 1.00 0.00 H new ATOM 0 HD3 PRO A 36 6.900 -12.081 -2.395 1.00 0.00 H new ATOM 586 N VAL A 37 3.319 -15.572 -4.505 1.00 0.00 N ATOM 587 CA VAL A 37 2.841 -16.942 -4.649 1.00 0.00 C ATOM 588 C VAL A 37 2.985 -17.427 -6.087 1.00 0.00 C ATOM 589 O VAL A 37 2.043 -17.962 -6.670 1.00 0.00 O ATOM 590 CB VAL A 37 1.367 -17.070 -4.221 1.00 0.00 C ATOM 591 CG1 VAL A 37 1.188 -16.621 -2.779 1.00 0.00 C ATOM 592 CG2 VAL A 37 0.471 -16.268 -5.153 1.00 0.00 C ATOM 0 H VAL A 37 2.609 -14.858 -4.669 1.00 0.00 H new ATOM 0 HA VAL A 37 3.456 -17.562 -3.997 1.00 0.00 H new ATOM 0 HB VAL A 37 1.077 -18.119 -4.288 1.00 0.00 H new ATOM 0 HG11 VAL A 37 0.140 -16.719 -2.495 1.00 0.00 H new ATOM 0 HG12 VAL A 37 1.801 -17.242 -2.126 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.495 -15.580 -2.681 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -0.567 -16.369 -4.836 1.00 0.00 H new ATOM 0 HG22 VAL A 37 0.759 -15.217 -5.120 1.00 0.00 H new ATOM 0 HG23 VAL A 37 0.578 -16.642 -6.171 1.00 0.00 H new ATOM 602 N SER A 38 4.172 -17.236 -6.654 1.00 0.00 N ATOM 603 CA SER A 38 4.440 -17.650 -8.026 1.00 0.00 C ATOM 604 C SER A 38 5.776 -18.380 -8.122 1.00 0.00 C ATOM 605 O SER A 38 6.560 -18.390 -7.173 1.00 0.00 O ATOM 606 CB SER A 38 4.441 -16.436 -8.957 1.00 0.00 C ATOM 607 OG SER A 38 4.351 -16.834 -10.314 1.00 0.00 O ATOM 0 H SER A 38 4.964 -16.797 -6.184 1.00 0.00 H new ATOM 0 HA SER A 38 3.649 -18.334 -8.334 1.00 0.00 H new ATOM 0 HB2 SER A 38 3.604 -15.784 -8.710 1.00 0.00 H new ATOM 0 HB3 SER A 38 5.352 -15.857 -8.804 1.00 0.00 H new ATOM 0 HG SER A 38 4.352 -16.040 -10.889 1.00 0.00 H new ATOM 613 N ASP A 39 6.028 -18.991 -9.275 1.00 0.00 N ATOM 614 CA ASP A 39 7.269 -19.724 -9.497 1.00 0.00 C ATOM 615 C ASP A 39 8.401 -18.773 -9.871 1.00 0.00 C ATOM 616 O ASP A 39 9.505 -18.863 -9.332 1.00 0.00 O ATOM 617 CB ASP A 39 7.079 -20.769 -10.597 1.00 0.00 C ATOM 618 CG ASP A 39 6.230 -21.940 -10.143 1.00 0.00 C ATOM 619 OD1 ASP A 39 5.042 -21.723 -9.826 1.00 0.00 O ATOM 620 OD2 ASP A 39 6.754 -23.073 -10.103 1.00 0.00 O ATOM 0 H ASP A 39 5.389 -18.993 -10.070 1.00 0.00 H new ATOM 0 HA ASP A 39 7.535 -20.230 -8.569 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.612 -20.300 -11.463 1.00 0.00 H new ATOM 0 HB3 ASP A 39 8.054 -21.134 -10.919 1.00 0.00 H new ATOM 625 N TYR A 40 8.121 -17.863 -10.798 1.00 0.00 N ATOM 626 CA TYR A 40 9.117 -16.898 -11.247 1.00 0.00 C ATOM 627 C TYR A 40 8.731 -15.482 -10.830 1.00 0.00 C ATOM 628 O TYR A 40 7.748 -15.279 -10.116 1.00 0.00 O ATOM 629 CB TYR A 40 9.277 -16.968 -12.766 1.00 0.00 C ATOM 630 CG TYR A 40 10.677 -16.655 -13.243 1.00 0.00 C ATOM 631 CD1 TYR A 40 11.786 -17.207 -12.614 1.00 0.00 C ATOM 632 CD2 TYR A 40 10.891 -15.808 -14.324 1.00 0.00 C ATOM 633 CE1 TYR A 40 13.068 -16.923 -13.046 1.00 0.00 C ATOM 634 CE2 TYR A 40 12.169 -15.520 -14.763 1.00 0.00 C ATOM 635 CZ TYR A 40 13.254 -16.079 -14.121 1.00 0.00 C ATOM 636 OH TYR A 40 14.528 -15.795 -14.555 1.00 0.00 O ATOM 0 H TYR A 40 7.212 -17.774 -11.253 1.00 0.00 H new ATOM 0 HA TYR A 40 10.067 -17.150 -10.776 1.00 0.00 H new ATOM 0 HB2 TYR A 40 9.001 -17.966 -13.106 1.00 0.00 H new ATOM 0 HB3 TYR A 40 8.580 -16.269 -13.229 1.00 0.00 H new ATOM 0 HD1 TYR A 40 11.644 -17.869 -11.773 1.00 0.00 H new ATOM 0 HD2 TYR A 40 10.044 -15.368 -14.829 1.00 0.00 H new ATOM 0 HE1 TYR A 40 13.919 -17.359 -12.545 1.00 0.00 H new ATOM 0 HE2 TYR A 40 12.318 -14.860 -15.605 1.00 0.00 H new ATOM 0 HH TYR A 40 14.484 -15.186 -15.322 1.00 0.00 H new ATOM 646 N LEU A 41 9.511 -14.506 -11.281 1.00 0.00 N ATOM 647 CA LEU A 41 9.252 -13.108 -10.956 1.00 0.00 C ATOM 648 C LEU A 41 9.081 -12.277 -12.224 1.00 0.00 C ATOM 649 O LEU A 41 8.614 -11.140 -12.173 1.00 0.00 O ATOM 650 CB LEU A 41 10.394 -12.540 -10.111 1.00 0.00 C ATOM 651 CG LEU A 41 11.677 -12.191 -10.865 1.00 0.00 C ATOM 652 CD1 LEU A 41 12.150 -13.375 -11.693 1.00 0.00 C ATOM 653 CD2 LEU A 41 11.461 -10.971 -11.750 1.00 0.00 C ATOM 0 H LEU A 41 10.328 -14.657 -11.873 1.00 0.00 H new ATOM 0 HA LEU A 41 8.326 -13.059 -10.384 1.00 0.00 H new ATOM 0 HB2 LEU A 41 10.036 -11.641 -9.609 1.00 0.00 H new ATOM 0 HB3 LEU A 41 10.639 -13.264 -9.333 1.00 0.00 H new ATOM 0 HG LEU A 41 12.451 -11.953 -10.135 1.00 0.00 H new ATOM 0 HD11 LEU A 41 13.064 -13.107 -12.222 1.00 0.00 H new ATOM 0 HD12 LEU A 41 12.346 -14.223 -11.037 1.00 0.00 H new ATOM 0 HD13 LEU A 41 11.379 -13.645 -12.415 1.00 0.00 H new ATOM 0 HD21 LEU A 41 12.385 -10.737 -12.279 1.00 0.00 H new ATOM 0 HD22 LEU A 41 10.672 -11.181 -12.472 1.00 0.00 H new ATOM 0 HD23 LEU A 41 11.171 -10.121 -11.133 1.00 0.00 H new ATOM 665 N GLU A 42 9.461 -12.855 -13.360 1.00 0.00 N ATOM 666 CA GLU A 42 9.347 -12.167 -14.641 1.00 0.00 C ATOM 667 C GLU A 42 8.068 -12.574 -15.365 1.00 0.00 C ATOM 668 O GLU A 42 7.441 -11.762 -16.046 1.00 0.00 O ATOM 669 CB GLU A 42 10.563 -12.474 -15.518 1.00 0.00 C ATOM 670 CG GLU A 42 10.260 -12.451 -17.007 1.00 0.00 C ATOM 671 CD GLU A 42 9.953 -11.057 -17.518 1.00 0.00 C ATOM 672 OE1 GLU A 42 9.191 -10.332 -16.843 1.00 0.00 O ATOM 673 OE2 GLU A 42 10.473 -10.690 -18.592 1.00 0.00 O ATOM 0 H GLU A 42 9.850 -13.796 -13.419 1.00 0.00 H new ATOM 0 HA GLU A 42 9.308 -11.095 -14.448 1.00 0.00 H new ATOM 0 HB2 GLU A 42 11.347 -11.748 -15.304 1.00 0.00 H new ATOM 0 HB3 GLU A 42 10.955 -13.455 -15.251 1.00 0.00 H new ATOM 0 HG2 GLU A 42 11.112 -12.855 -17.554 1.00 0.00 H new ATOM 0 HG3 GLU A 42 9.412 -13.104 -17.212 1.00 0.00 H new ATOM 680 N VAL A 43 7.685 -13.838 -15.214 1.00 0.00 N ATOM 681 CA VAL A 43 6.480 -14.354 -15.852 1.00 0.00 C ATOM 682 C VAL A 43 5.238 -13.623 -15.355 1.00 0.00 C ATOM 683 O VAL A 43 4.168 -13.716 -15.956 1.00 0.00 O ATOM 684 CB VAL A 43 6.311 -15.863 -15.596 1.00 0.00 C ATOM 685 CG1 VAL A 43 6.150 -16.138 -14.108 1.00 0.00 C ATOM 686 CG2 VAL A 43 5.125 -16.407 -16.378 1.00 0.00 C ATOM 0 H VAL A 43 8.192 -14.524 -14.655 1.00 0.00 H new ATOM 0 HA VAL A 43 6.593 -14.185 -16.923 1.00 0.00 H new ATOM 0 HB VAL A 43 7.210 -16.375 -15.941 1.00 0.00 H new ATOM 0 HG11 VAL A 43 6.032 -17.210 -13.947 1.00 0.00 H new ATOM 0 HG12 VAL A 43 7.033 -15.786 -13.575 1.00 0.00 H new ATOM 0 HG13 VAL A 43 5.269 -15.616 -13.735 1.00 0.00 H new ATOM 0 HG21 VAL A 43 5.021 -17.475 -16.185 1.00 0.00 H new ATOM 0 HG22 VAL A 43 4.217 -15.892 -16.067 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.287 -16.245 -17.444 1.00 0.00 H new ATOM 696 N ILE A 44 5.389 -12.895 -14.253 1.00 0.00 N ATOM 697 CA ILE A 44 4.279 -12.146 -13.676 1.00 0.00 C ATOM 698 C ILE A 44 4.116 -10.792 -14.358 1.00 0.00 C ATOM 699 O ILE A 44 5.031 -9.969 -14.356 1.00 0.00 O ATOM 700 CB ILE A 44 4.475 -11.927 -12.164 1.00 0.00 C ATOM 701 CG1 ILE A 44 4.514 -13.270 -11.432 1.00 0.00 C ATOM 702 CG2 ILE A 44 3.366 -11.046 -11.609 1.00 0.00 C ATOM 703 CD1 ILE A 44 5.314 -13.236 -10.149 1.00 0.00 C ATOM 0 H ILE A 44 6.268 -12.808 -13.743 1.00 0.00 H new ATOM 0 HA ILE A 44 3.379 -12.740 -13.836 1.00 0.00 H new ATOM 0 HB ILE A 44 5.428 -11.422 -12.005 1.00 0.00 H new ATOM 0 HG12 ILE A 44 3.494 -13.581 -11.206 1.00 0.00 H new ATOM 0 HG13 ILE A 44 4.938 -14.024 -12.095 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.518 -10.900 -10.540 1.00 0.00 H new ATOM 0 HG22 ILE A 44 3.382 -10.080 -12.113 1.00 0.00 H new ATOM 0 HG23 ILE A 44 2.402 -11.526 -11.776 1.00 0.00 H new ATOM 0 HD11 ILE A 44 5.298 -14.222 -9.684 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.344 -12.955 -10.370 1.00 0.00 H new ATOM 0 HD13 ILE A 44 4.877 -12.506 -9.467 1.00 0.00 H new ATOM 715 N LYS A 45 2.943 -10.568 -14.941 1.00 0.00 N ATOM 716 CA LYS A 45 2.656 -9.312 -15.625 1.00 0.00 C ATOM 717 C LYS A 45 2.615 -8.151 -14.637 1.00 0.00 C ATOM 718 O LYS A 45 3.445 -7.245 -14.696 1.00 0.00 O ATOM 719 CB LYS A 45 1.324 -9.408 -16.372 1.00 0.00 C ATOM 720 CG LYS A 45 1.434 -10.079 -17.729 1.00 0.00 C ATOM 721 CD LYS A 45 2.120 -9.178 -18.743 1.00 0.00 C ATOM 722 CE LYS A 45 2.651 -9.973 -19.926 1.00 0.00 C ATOM 723 NZ LYS A 45 1.628 -10.122 -20.998 1.00 0.00 N ATOM 0 H LYS A 45 2.176 -11.240 -14.954 1.00 0.00 H new ATOM 0 HA LYS A 45 3.455 -9.127 -16.342 1.00 0.00 H new ATOM 0 HB2 LYS A 45 0.613 -9.962 -15.759 1.00 0.00 H new ATOM 0 HB3 LYS A 45 0.918 -8.405 -16.504 1.00 0.00 H new ATOM 0 HG2 LYS A 45 1.993 -11.010 -17.631 1.00 0.00 H new ATOM 0 HG3 LYS A 45 0.439 -10.341 -18.088 1.00 0.00 H new ATOM 0 HD2 LYS A 45 1.416 -8.424 -19.096 1.00 0.00 H new ATOM 0 HD3 LYS A 45 2.941 -8.647 -18.262 1.00 0.00 H new ATOM 0 HE2 LYS A 45 3.532 -9.476 -20.331 1.00 0.00 H new ATOM 0 HE3 LYS A 45 2.969 -10.959 -19.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 2.028 -10.669 -21.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 0.797 -10.619 -20.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 1.343 -9.182 -21.339 1.00 0.00 H new ATOM 737 N GLU A 46 1.645 -8.187 -13.728 1.00 0.00 N ATOM 738 CA GLU A 46 1.498 -7.137 -12.727 1.00 0.00 C ATOM 739 C GLU A 46 1.739 -7.686 -11.324 1.00 0.00 C ATOM 740 O GLU A 46 0.806 -8.006 -10.586 1.00 0.00 O ATOM 741 CB GLU A 46 0.103 -6.514 -12.810 1.00 0.00 C ATOM 742 CG GLU A 46 -0.103 -5.645 -14.040 1.00 0.00 C ATOM 743 CD GLU A 46 0.845 -4.463 -14.084 1.00 0.00 C ATOM 744 OE1 GLU A 46 1.958 -4.616 -14.629 1.00 0.00 O ATOM 745 OE2 GLU A 46 0.474 -3.385 -13.575 1.00 0.00 O ATOM 0 H GLU A 46 0.950 -8.931 -13.664 1.00 0.00 H new ATOM 0 HA GLU A 46 2.244 -6.369 -12.931 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -0.642 -7.310 -12.809 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -0.071 -5.913 -11.917 1.00 0.00 H new ATOM 0 HG2 GLU A 46 0.036 -6.251 -14.936 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -1.131 -5.283 -14.056 1.00 0.00 H new ATOM 752 N PRO A 47 3.020 -7.798 -10.944 1.00 0.00 N ATOM 753 CA PRO A 47 3.415 -8.308 -9.628 1.00 0.00 C ATOM 754 C PRO A 47 3.065 -7.340 -8.503 1.00 0.00 C ATOM 755 O PRO A 47 3.637 -6.255 -8.405 1.00 0.00 O ATOM 756 CB PRO A 47 4.933 -8.462 -9.748 1.00 0.00 C ATOM 757 CG PRO A 47 5.331 -7.488 -10.802 1.00 0.00 C ATOM 758 CD PRO A 47 4.183 -7.435 -11.772 1.00 0.00 C ATOM 0 HA PRO A 47 2.898 -9.234 -9.378 1.00 0.00 H new ATOM 0 HB2 PRO A 47 5.429 -8.246 -8.802 1.00 0.00 H new ATOM 0 HB3 PRO A 47 5.207 -9.480 -10.026 1.00 0.00 H new ATOM 0 HG2 PRO A 47 5.524 -6.505 -10.372 1.00 0.00 H new ATOM 0 HG3 PRO A 47 6.248 -7.804 -11.299 1.00 0.00 H new ATOM 0 HD2 PRO A 47 4.071 -6.443 -12.209 1.00 0.00 H new ATOM 0 HD3 PRO A 47 4.322 -8.133 -12.598 1.00 0.00 H new ATOM 766 N MET A 48 2.122 -7.741 -7.656 1.00 0.00 N ATOM 767 CA MET A 48 1.698 -6.908 -6.536 1.00 0.00 C ATOM 768 C MET A 48 1.802 -7.673 -5.220 1.00 0.00 C ATOM 769 O MET A 48 1.455 -8.851 -5.147 1.00 0.00 O ATOM 770 CB MET A 48 0.261 -6.427 -6.747 1.00 0.00 C ATOM 771 CG MET A 48 -0.115 -5.238 -5.878 1.00 0.00 C ATOM 772 SD MET A 48 0.159 -3.659 -6.705 1.00 0.00 S ATOM 773 CE MET A 48 1.894 -3.795 -7.128 1.00 0.00 C ATOM 0 H MET A 48 1.638 -8.636 -7.724 1.00 0.00 H new ATOM 0 HA MET A 48 2.360 -6.043 -6.487 1.00 0.00 H new ATOM 0 HB2 MET A 48 0.127 -6.158 -7.795 1.00 0.00 H new ATOM 0 HB3 MET A 48 -0.423 -7.250 -6.539 1.00 0.00 H new ATOM 0 HG2 MET A 48 -1.164 -5.318 -5.594 1.00 0.00 H new ATOM 0 HG3 MET A 48 0.467 -5.267 -4.957 1.00 0.00 H new ATOM 0 HE1 MET A 48 2.341 -2.801 -7.157 1.00 0.00 H new ATOM 0 HE2 MET A 48 2.405 -4.401 -6.379 1.00 0.00 H new ATOM 0 HE3 MET A 48 1.994 -4.266 -8.106 1.00 0.00 H new ATOM 783 N ASP A 49 2.284 -6.994 -4.184 1.00 0.00 N ATOM 784 CA ASP A 49 2.433 -7.610 -2.871 1.00 0.00 C ATOM 785 C ASP A 49 2.283 -6.571 -1.764 1.00 0.00 C ATOM 786 O ASP A 49 2.530 -5.383 -1.974 1.00 0.00 O ATOM 787 CB ASP A 49 3.794 -8.299 -2.759 1.00 0.00 C ATOM 788 CG ASP A 49 4.148 -9.088 -4.004 1.00 0.00 C ATOM 789 OD1 ASP A 49 4.601 -8.470 -4.990 1.00 0.00 O ATOM 790 OD2 ASP A 49 3.972 -10.324 -3.992 1.00 0.00 O ATOM 0 H ASP A 49 2.578 -6.018 -4.228 1.00 0.00 H new ATOM 0 HA ASP A 49 1.646 -8.355 -2.755 1.00 0.00 H new ATOM 0 HB2 ASP A 49 4.564 -7.549 -2.577 1.00 0.00 H new ATOM 0 HB3 ASP A 49 3.790 -8.967 -1.898 1.00 0.00 H new ATOM 795 N LEU A 50 1.874 -7.026 -0.584 1.00 0.00 N ATOM 796 CA LEU A 50 1.688 -6.136 0.557 1.00 0.00 C ATOM 797 C LEU A 50 2.952 -5.324 0.825 1.00 0.00 C ATOM 798 O LEU A 50 2.883 -4.133 1.128 1.00 0.00 O ATOM 799 CB LEU A 50 1.312 -6.942 1.801 1.00 0.00 C ATOM 800 CG LEU A 50 -0.048 -7.638 1.764 1.00 0.00 C ATOM 801 CD1 LEU A 50 -0.181 -8.614 2.923 1.00 0.00 C ATOM 802 CD2 LEU A 50 -1.173 -6.614 1.796 1.00 0.00 C ATOM 0 H LEU A 50 1.665 -8.006 -0.393 1.00 0.00 H new ATOM 0 HA LEU A 50 0.878 -5.446 0.321 1.00 0.00 H new ATOM 0 HB2 LEU A 50 2.080 -7.698 1.966 1.00 0.00 H new ATOM 0 HB3 LEU A 50 1.332 -6.274 2.662 1.00 0.00 H new ATOM 0 HG LEU A 50 -0.121 -8.200 0.833 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -1.156 -9.100 2.880 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.603 -9.368 2.856 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.086 -8.075 3.865 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.134 -7.128 1.769 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.102 -6.024 2.710 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.090 -5.955 0.932 1.00 0.00 H new ATOM 814 N SER A 51 4.104 -5.977 0.709 1.00 0.00 N ATOM 815 CA SER A 51 5.383 -5.316 0.941 1.00 0.00 C ATOM 816 C SER A 51 5.464 -4.003 0.168 1.00 0.00 C ATOM 817 O SER A 51 6.055 -3.029 0.635 1.00 0.00 O ATOM 818 CB SER A 51 6.537 -6.234 0.532 1.00 0.00 C ATOM 819 OG SER A 51 6.622 -7.359 1.390 1.00 0.00 O ATOM 0 H SER A 51 4.178 -6.962 0.456 1.00 0.00 H new ATOM 0 HA SER A 51 5.463 -5.096 2.006 1.00 0.00 H new ATOM 0 HB2 SER A 51 6.394 -6.567 -0.496 1.00 0.00 H new ATOM 0 HB3 SER A 51 7.475 -5.679 0.560 1.00 0.00 H new ATOM 0 HG SER A 51 7.366 -7.931 1.107 1.00 0.00 H new ATOM 825 N THR A 52 4.866 -3.985 -1.019 1.00 0.00 N ATOM 826 CA THR A 52 4.870 -2.793 -1.859 1.00 0.00 C ATOM 827 C THR A 52 3.821 -1.790 -1.395 1.00 0.00 C ATOM 828 O THR A 52 3.932 -0.593 -1.661 1.00 0.00 O ATOM 829 CB THR A 52 4.610 -3.146 -3.335 1.00 0.00 C ATOM 830 OG1 THR A 52 5.220 -2.170 -4.187 1.00 0.00 O ATOM 831 CG2 THR A 52 3.117 -3.213 -3.620 1.00 0.00 C ATOM 0 H THR A 52 4.373 -4.782 -1.421 1.00 0.00 H new ATOM 0 HA THR A 52 5.860 -2.346 -1.769 1.00 0.00 H new ATOM 0 HB THR A 52 5.046 -4.125 -3.534 1.00 0.00 H new ATOM 0 HG1 THR A 52 5.051 -2.403 -5.124 1.00 0.00 H new ATOM 0 HG21 THR A 52 2.958 -3.464 -4.669 1.00 0.00 H new ATOM 0 HG22 THR A 52 2.660 -3.977 -2.991 1.00 0.00 H new ATOM 0 HG23 THR A 52 2.662 -2.246 -3.405 1.00 0.00 H new ATOM 839 N VAL A 53 2.802 -2.285 -0.699 1.00 0.00 N ATOM 840 CA VAL A 53 1.733 -1.430 -0.196 1.00 0.00 C ATOM 841 C VAL A 53 2.215 -0.579 0.974 1.00 0.00 C ATOM 842 O VAL A 53 1.954 0.624 1.028 1.00 0.00 O ATOM 843 CB VAL A 53 0.516 -2.260 0.255 1.00 0.00 C ATOM 844 CG1 VAL A 53 -0.582 -1.352 0.786 1.00 0.00 C ATOM 845 CG2 VAL A 53 0.003 -3.117 -0.892 1.00 0.00 C ATOM 0 H VAL A 53 2.694 -3.273 -0.471 1.00 0.00 H new ATOM 0 HA VAL A 53 1.435 -0.779 -1.018 1.00 0.00 H new ATOM 0 HB VAL A 53 0.828 -2.923 1.062 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.433 -1.956 1.100 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.205 -0.785 1.638 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.895 -0.663 0.002 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -0.857 -3.697 -0.557 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.294 -2.475 -1.721 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.791 -3.794 -1.221 1.00 0.00 H new ATOM 855 N ILE A 54 2.919 -1.209 1.907 1.00 0.00 N ATOM 856 CA ILE A 54 3.439 -0.509 3.075 1.00 0.00 C ATOM 857 C ILE A 54 4.518 0.494 2.680 1.00 0.00 C ATOM 858 O ILE A 54 4.470 1.661 3.070 1.00 0.00 O ATOM 859 CB ILE A 54 4.020 -1.491 4.109 1.00 0.00 C ATOM 860 CG1 ILE A 54 2.924 -2.421 4.634 1.00 0.00 C ATOM 861 CG2 ILE A 54 4.672 -0.731 5.254 1.00 0.00 C ATOM 862 CD1 ILE A 54 2.700 -3.641 3.769 1.00 0.00 C ATOM 0 H ILE A 54 3.143 -2.204 1.877 1.00 0.00 H new ATOM 0 HA ILE A 54 2.599 0.022 3.523 1.00 0.00 H new ATOM 0 HB ILE A 54 4.783 -2.099 3.622 1.00 0.00 H new ATOM 0 HG12 ILE A 54 3.185 -2.743 5.642 1.00 0.00 H new ATOM 0 HG13 ILE A 54 1.991 -1.863 4.709 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.078 -1.439 5.976 1.00 0.00 H new ATOM 0 HG22 ILE A 54 5.477 -0.108 4.865 1.00 0.00 H new ATOM 0 HG23 ILE A 54 3.929 -0.101 5.742 1.00 0.00 H new ATOM 0 HD11 ILE A 54 1.910 -4.254 4.202 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.408 -3.328 2.767 1.00 0.00 H new ATOM 0 HD13 ILE A 54 3.621 -4.222 3.714 1.00 0.00 H new ATOM 874 N THR A 55 5.491 0.031 1.901 1.00 0.00 N ATOM 875 CA THR A 55 6.582 0.887 1.452 1.00 0.00 C ATOM 876 C THR A 55 6.052 2.116 0.722 1.00 0.00 C ATOM 877 O THR A 55 6.510 3.235 0.955 1.00 0.00 O ATOM 878 CB THR A 55 7.545 0.126 0.520 1.00 0.00 C ATOM 879 OG1 THR A 55 8.163 -0.953 1.230 1.00 0.00 O ATOM 880 CG2 THR A 55 8.615 1.058 -0.028 1.00 0.00 C ATOM 0 H THR A 55 5.546 -0.932 1.568 1.00 0.00 H new ATOM 0 HA THR A 55 7.124 1.203 2.343 1.00 0.00 H new ATOM 0 HB THR A 55 6.969 -0.272 -0.315 1.00 0.00 H new ATOM 0 HG1 THR A 55 7.606 -1.756 1.155 1.00 0.00 H new ATOM 0 HG21 THR A 55 9.283 0.499 -0.683 1.00 0.00 H new ATOM 0 HG22 THR A 55 8.143 1.862 -0.592 1.00 0.00 H new ATOM 0 HG23 THR A 55 9.187 1.481 0.798 1.00 0.00 H new ATOM 888 N LYS A 56 5.083 1.902 -0.162 1.00 0.00 N ATOM 889 CA LYS A 56 4.489 2.992 -0.926 1.00 0.00 C ATOM 890 C LYS A 56 3.964 4.083 0.002 1.00 0.00 C ATOM 891 O LYS A 56 4.290 5.259 -0.160 1.00 0.00 O ATOM 892 CB LYS A 56 3.353 2.466 -1.806 1.00 0.00 C ATOM 893 CG LYS A 56 3.809 2.010 -3.180 1.00 0.00 C ATOM 894 CD LYS A 56 2.643 1.899 -4.147 1.00 0.00 C ATOM 895 CE LYS A 56 2.961 0.959 -5.300 1.00 0.00 C ATOM 896 NZ LYS A 56 4.157 1.407 -6.067 1.00 0.00 N ATOM 0 H LYS A 56 4.692 0.982 -0.367 1.00 0.00 H new ATOM 0 HA LYS A 56 5.263 3.421 -1.562 1.00 0.00 H new ATOM 0 HB2 LYS A 56 2.868 1.632 -1.298 1.00 0.00 H new ATOM 0 HB3 LYS A 56 2.603 3.248 -1.923 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.543 2.714 -3.573 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.307 1.044 -3.097 1.00 0.00 H new ATOM 0 HD2 LYS A 56 1.762 1.539 -3.616 1.00 0.00 H new ATOM 0 HD3 LYS A 56 2.399 2.887 -4.538 1.00 0.00 H new ATOM 0 HE2 LYS A 56 3.133 -0.045 -4.913 1.00 0.00 H new ATOM 0 HE3 LYS A 56 2.102 0.900 -5.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 4.281 0.800 -6.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 4.025 2.393 -6.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 5.001 1.342 -5.463 1.00 0.00 H new ATOM 910 N ILE A 57 3.151 3.685 0.975 1.00 0.00 N ATOM 911 CA ILE A 57 2.583 4.629 1.930 1.00 0.00 C ATOM 912 C ILE A 57 3.667 5.507 2.545 1.00 0.00 C ATOM 913 O ILE A 57 3.531 6.730 2.604 1.00 0.00 O ATOM 914 CB ILE A 57 1.826 3.903 3.058 1.00 0.00 C ATOM 915 CG1 ILE A 57 0.680 3.070 2.478 1.00 0.00 C ATOM 916 CG2 ILE A 57 1.299 4.905 4.073 1.00 0.00 C ATOM 917 CD1 ILE A 57 0.319 1.869 3.324 1.00 0.00 C ATOM 0 H ILE A 57 2.871 2.715 1.123 1.00 0.00 H new ATOM 0 HA ILE A 57 1.882 5.254 1.377 1.00 0.00 H new ATOM 0 HB ILE A 57 2.518 3.231 3.566 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.200 3.704 2.367 1.00 0.00 H new ATOM 0 HG13 ILE A 57 0.957 2.731 1.480 1.00 0.00 H new ATOM 0 HG21 ILE A 57 0.767 4.376 4.864 1.00 0.00 H new ATOM 0 HG22 ILE A 57 2.133 5.459 4.505 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.619 5.600 3.579 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.500 1.325 2.853 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.185 1.214 3.414 1.00 0.00 H new ATOM 0 HD13 ILE A 57 0.011 2.202 4.315 1.00 0.00 H new ATOM 929 N ASP A 58 4.744 4.877 3.000 1.00 0.00 N ATOM 930 CA ASP A 58 5.855 5.601 3.608 1.00 0.00 C ATOM 931 C ASP A 58 6.615 6.409 2.560 1.00 0.00 C ATOM 932 O ASP A 58 7.422 7.276 2.895 1.00 0.00 O ATOM 933 CB ASP A 58 6.804 4.628 4.308 1.00 0.00 C ATOM 934 CG ASP A 58 7.601 5.291 5.414 1.00 0.00 C ATOM 935 OD1 ASP A 58 7.989 6.466 5.244 1.00 0.00 O ATOM 936 OD2 ASP A 58 7.836 4.635 6.450 1.00 0.00 O ATOM 0 H ASP A 58 4.872 3.866 2.960 1.00 0.00 H new ATOM 0 HA ASP A 58 5.447 6.291 4.346 1.00 0.00 H new ATOM 0 HB2 ASP A 58 6.229 3.801 4.724 1.00 0.00 H new ATOM 0 HB3 ASP A 58 7.490 4.203 3.575 1.00 0.00 H new ATOM 941 N LYS A 59 6.353 6.117 1.291 1.00 0.00 N ATOM 942 CA LYS A 59 7.012 6.815 0.193 1.00 0.00 C ATOM 943 C LYS A 59 6.129 7.937 -0.346 1.00 0.00 C ATOM 944 O LYS A 59 6.252 8.334 -1.505 1.00 0.00 O ATOM 945 CB LYS A 59 7.352 5.834 -0.931 1.00 0.00 C ATOM 946 CG LYS A 59 8.462 4.861 -0.574 1.00 0.00 C ATOM 947 CD LYS A 59 9.824 5.534 -0.601 1.00 0.00 C ATOM 948 CE LYS A 59 10.842 4.766 0.229 1.00 0.00 C ATOM 949 NZ LYS A 59 12.191 5.392 0.169 1.00 0.00 N ATOM 0 H LYS A 59 5.688 5.401 0.997 1.00 0.00 H new ATOM 0 HA LYS A 59 7.934 7.254 0.575 1.00 0.00 H new ATOM 0 HB2 LYS A 59 6.457 5.270 -1.193 1.00 0.00 H new ATOM 0 HB3 LYS A 59 7.645 6.397 -1.817 1.00 0.00 H new ATOM 0 HG2 LYS A 59 8.279 4.447 0.418 1.00 0.00 H new ATOM 0 HG3 LYS A 59 8.454 4.026 -1.274 1.00 0.00 H new ATOM 0 HD2 LYS A 59 10.174 5.608 -1.631 1.00 0.00 H new ATOM 0 HD3 LYS A 59 9.736 6.552 -0.220 1.00 0.00 H new ATOM 0 HE2 LYS A 59 10.507 4.723 1.265 1.00 0.00 H new ATOM 0 HE3 LYS A 59 10.902 3.738 -0.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 12.856 4.840 0.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 12.522 5.410 -0.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 12.139 6.364 0.535 1.00 0.00 H new ATOM 963 N HIS A 60 5.240 8.444 0.502 1.00 0.00 N ATOM 964 CA HIS A 60 4.339 9.522 0.111 1.00 0.00 C ATOM 965 C HIS A 60 3.762 9.270 -1.279 1.00 0.00 C ATOM 966 O HIS A 60 3.671 10.183 -2.098 1.00 0.00 O ATOM 967 CB HIS A 60 5.072 10.863 0.137 1.00 0.00 C ATOM 968 CG HIS A 60 5.536 11.265 1.502 1.00 0.00 C ATOM 969 ND1 HIS A 60 6.517 12.212 1.715 1.00 0.00 N ATOM 970 CD2 HIS A 60 5.148 10.845 2.729 1.00 0.00 C ATOM 971 CE1 HIS A 60 6.713 12.355 3.014 1.00 0.00 C ATOM 972 NE2 HIS A 60 5.894 11.537 3.651 1.00 0.00 N ATOM 0 H HIS A 60 5.124 8.126 1.464 1.00 0.00 H new ATOM 0 HA HIS A 60 3.517 9.553 0.826 1.00 0.00 H new ATOM 0 HB2 HIS A 60 5.933 10.810 -0.529 1.00 0.00 H new ATOM 0 HB3 HIS A 60 4.412 11.636 -0.256 1.00 0.00 H new ATOM 0 HD2 HIS A 60 4.392 10.104 2.943 1.00 0.00 H new ATOM 0 HE1 HIS A 60 7.422 13.026 3.476 1.00 0.00 H new ATOM 0 HE2 HIS A 60 5.827 11.436 4.664 1.00 0.00 H new ATOM 981 N ASN A 61 3.375 8.025 -1.538 1.00 0.00 N ATOM 982 CA ASN A 61 2.809 7.653 -2.829 1.00 0.00 C ATOM 983 C ASN A 61 1.290 7.795 -2.819 1.00 0.00 C ATOM 984 O ASN A 61 0.708 8.416 -3.709 1.00 0.00 O ATOM 985 CB ASN A 61 3.196 6.216 -3.184 1.00 0.00 C ATOM 986 CG ASN A 61 4.606 6.115 -3.734 1.00 0.00 C ATOM 987 OD1 ASN A 61 5.464 5.450 -3.153 1.00 0.00 O ATOM 988 ND2 ASN A 61 4.851 6.777 -4.858 1.00 0.00 N ATOM 0 H ASN A 61 3.443 7.257 -0.870 1.00 0.00 H new ATOM 0 HA ASN A 61 3.214 8.328 -3.583 1.00 0.00 H new ATOM 0 HB2 ASN A 61 3.110 5.590 -2.296 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.493 5.825 -3.920 1.00 0.00 H new ATOM 0 HD21 ASN A 61 5.781 6.747 -5.275 1.00 0.00 H new ATOM 0 HD22 ASN A 61 4.109 7.315 -5.305 1.00 0.00 H new ATOM 995 N TYR A 62 0.655 7.216 -1.806 1.00 0.00 N ATOM 996 CA TYR A 62 -0.797 7.276 -1.680 1.00 0.00 C ATOM 997 C TYR A 62 -1.238 8.616 -1.100 1.00 0.00 C ATOM 998 O TYR A 62 -0.785 9.022 -0.028 1.00 0.00 O ATOM 999 CB TYR A 62 -1.301 6.134 -0.796 1.00 0.00 C ATOM 1000 CG TYR A 62 -1.169 4.770 -1.435 1.00 0.00 C ATOM 1001 CD1 TYR A 62 -1.716 4.512 -2.686 1.00 0.00 C ATOM 1002 CD2 TYR A 62 -0.497 3.740 -0.789 1.00 0.00 C ATOM 1003 CE1 TYR A 62 -1.599 3.267 -3.273 1.00 0.00 C ATOM 1004 CE2 TYR A 62 -0.374 2.493 -1.369 1.00 0.00 C ATOM 1005 CZ TYR A 62 -0.927 2.261 -2.611 1.00 0.00 C ATOM 1006 OH TYR A 62 -0.807 1.020 -3.194 1.00 0.00 O ATOM 0 H TYR A 62 1.122 6.700 -1.060 1.00 0.00 H new ATOM 0 HA TYR A 62 -1.227 7.172 -2.676 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.747 6.141 0.143 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.348 6.311 -0.550 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.241 5.298 -3.208 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -0.063 3.918 0.184 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -2.032 3.082 -4.245 1.00 0.00 H new ATOM 0 HE2 TYR A 62 0.152 1.704 -0.853 1.00 0.00 H new ATOM 0 HH TYR A 62 -0.305 0.426 -2.598 1.00 0.00 H new ATOM 1016 N LEU A 63 -2.125 9.300 -1.814 1.00 0.00 N ATOM 1017 CA LEU A 63 -2.630 10.595 -1.372 1.00 0.00 C ATOM 1018 C LEU A 63 -3.997 10.449 -0.712 1.00 0.00 C ATOM 1019 O LEU A 63 -4.247 11.009 0.357 1.00 0.00 O ATOM 1020 CB LEU A 63 -2.722 11.560 -2.555 1.00 0.00 C ATOM 1021 CG LEU A 63 -1.404 11.889 -3.257 1.00 0.00 C ATOM 1022 CD1 LEU A 63 -1.648 12.218 -4.722 1.00 0.00 C ATOM 1023 CD2 LEU A 63 -0.701 13.043 -2.558 1.00 0.00 C ATOM 0 H LEU A 63 -2.510 8.979 -2.702 1.00 0.00 H new ATOM 0 HA LEU A 63 -1.933 10.998 -0.637 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -3.407 11.137 -3.290 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -3.166 12.492 -2.204 1.00 0.00 H new ATOM 0 HG LEU A 63 -0.758 11.013 -3.206 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -0.699 12.450 -5.206 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.107 11.362 -5.216 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -2.313 13.079 -4.796 1.00 0.00 H new ATOM 0 HD21 LEU A 63 0.235 13.263 -3.071 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -1.342 13.925 -2.577 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.492 12.769 -1.524 1.00 0.00 H new ATOM 1035 N THR A 64 -4.882 9.692 -1.354 1.00 0.00 N ATOM 1036 CA THR A 64 -6.223 9.472 -0.830 1.00 0.00 C ATOM 1037 C THR A 64 -6.354 8.080 -0.222 1.00 0.00 C ATOM 1038 O THR A 64 -5.443 7.260 -0.324 1.00 0.00 O ATOM 1039 CB THR A 64 -7.291 9.642 -1.927 1.00 0.00 C ATOM 1040 OG1 THR A 64 -6.942 8.860 -3.075 1.00 0.00 O ATOM 1041 CG2 THR A 64 -7.428 11.104 -2.326 1.00 0.00 C ATOM 0 H THR A 64 -4.693 9.221 -2.239 1.00 0.00 H new ATOM 0 HA THR A 64 -6.386 10.222 -0.056 1.00 0.00 H new ATOM 0 HB THR A 64 -8.246 9.299 -1.530 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.626 8.972 -3.767 1.00 0.00 H new ATOM 0 HG21 THR A 64 -8.188 11.200 -3.102 1.00 0.00 H new ATOM 0 HG22 THR A 64 -7.721 11.693 -1.457 1.00 0.00 H new ATOM 0 HG23 THR A 64 -6.474 11.468 -2.706 1.00 0.00 H new ATOM 1049 N ALA A 65 -7.494 7.821 0.411 1.00 0.00 N ATOM 1050 CA ALA A 65 -7.745 6.527 1.033 1.00 0.00 C ATOM 1051 C ALA A 65 -8.271 5.521 0.015 1.00 0.00 C ATOM 1052 O ALA A 65 -8.196 4.310 0.226 1.00 0.00 O ATOM 1053 CB ALA A 65 -8.726 6.677 2.186 1.00 0.00 C ATOM 0 H ALA A 65 -8.258 8.490 0.506 1.00 0.00 H new ATOM 0 HA ALA A 65 -6.799 6.149 1.422 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -8.904 5.703 2.641 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -8.311 7.355 2.931 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -9.667 7.081 1.813 1.00 0.00 H new ATOM 1059 N LYS A 66 -8.806 6.029 -1.090 1.00 0.00 N ATOM 1060 CA LYS A 66 -9.345 5.176 -2.142 1.00 0.00 C ATOM 1061 C LYS A 66 -8.228 4.630 -3.026 1.00 0.00 C ATOM 1062 O LYS A 66 -8.253 3.465 -3.425 1.00 0.00 O ATOM 1063 CB LYS A 66 -10.349 5.955 -2.995 1.00 0.00 C ATOM 1064 CG LYS A 66 -11.467 5.094 -3.557 1.00 0.00 C ATOM 1065 CD LYS A 66 -12.716 5.913 -3.836 1.00 0.00 C ATOM 1066 CE LYS A 66 -12.708 6.480 -5.248 1.00 0.00 C ATOM 1067 NZ LYS A 66 -13.321 5.539 -6.226 1.00 0.00 N ATOM 0 H LYS A 66 -8.878 7.029 -1.280 1.00 0.00 H new ATOM 0 HA LYS A 66 -9.854 4.336 -1.669 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -10.784 6.752 -2.392 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -9.819 6.432 -3.820 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -11.131 4.616 -4.477 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -11.703 4.297 -2.852 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -13.599 5.289 -3.698 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -12.786 6.728 -3.116 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -13.251 7.425 -5.263 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -11.682 6.697 -5.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -13.297 5.961 -7.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -12.787 4.646 -6.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -14.308 5.351 -5.956 1.00 0.00 H new ATOM 1081 N ASP A 67 -7.250 5.477 -3.326 1.00 0.00 N ATOM 1082 CA ASP A 67 -6.123 5.078 -4.161 1.00 0.00 C ATOM 1083 C ASP A 67 -5.372 3.907 -3.536 1.00 0.00 C ATOM 1084 O ASP A 67 -4.650 3.182 -4.221 1.00 0.00 O ATOM 1085 CB ASP A 67 -5.171 6.258 -4.367 1.00 0.00 C ATOM 1086 CG ASP A 67 -4.392 6.153 -5.664 1.00 0.00 C ATOM 1087 OD1 ASP A 67 -5.026 6.161 -6.740 1.00 0.00 O ATOM 1088 OD2 ASP A 67 -3.148 6.065 -5.602 1.00 0.00 O ATOM 0 H ASP A 67 -7.215 6.444 -3.004 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.513 4.762 -5.128 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -5.742 7.187 -4.363 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -4.474 6.309 -3.531 1.00 0.00 H new ATOM 1093 N PHE A 68 -5.546 3.727 -2.231 1.00 0.00 N ATOM 1094 CA PHE A 68 -4.884 2.645 -1.513 1.00 0.00 C ATOM 1095 C PHE A 68 -5.623 1.325 -1.715 1.00 0.00 C ATOM 1096 O PHE A 68 -5.009 0.259 -1.776 1.00 0.00 O ATOM 1097 CB PHE A 68 -4.799 2.971 -0.020 1.00 0.00 C ATOM 1098 CG PHE A 68 -4.685 1.755 0.854 1.00 0.00 C ATOM 1099 CD1 PHE A 68 -3.449 1.184 1.111 1.00 0.00 C ATOM 1100 CD2 PHE A 68 -5.814 1.182 1.418 1.00 0.00 C ATOM 1101 CE1 PHE A 68 -3.340 0.065 1.915 1.00 0.00 C ATOM 1102 CE2 PHE A 68 -5.711 0.063 2.223 1.00 0.00 C ATOM 1103 CZ PHE A 68 -4.473 -0.497 2.471 1.00 0.00 C ATOM 0 H PHE A 68 -6.140 4.317 -1.649 1.00 0.00 H new ATOM 0 HA PHE A 68 -3.875 2.542 -1.913 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -3.938 3.616 0.154 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -5.684 3.536 0.271 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -2.560 1.618 0.678 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -6.785 1.615 1.226 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.370 -0.369 2.108 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -6.598 -0.373 2.658 1.00 0.00 H new ATOM 0 HZ PHE A 68 -4.391 -1.372 3.098 1.00 0.00 H new ATOM 1113 N LEU A 69 -6.945 1.404 -1.819 1.00 0.00 N ATOM 1114 CA LEU A 69 -7.769 0.217 -2.015 1.00 0.00 C ATOM 1115 C LEU A 69 -7.469 -0.440 -3.358 1.00 0.00 C ATOM 1116 O LEU A 69 -7.169 -1.632 -3.425 1.00 0.00 O ATOM 1117 CB LEU A 69 -9.253 0.583 -1.934 1.00 0.00 C ATOM 1118 CG LEU A 69 -9.863 0.605 -0.532 1.00 0.00 C ATOM 1119 CD1 LEU A 69 -11.238 1.255 -0.559 1.00 0.00 C ATOM 1120 CD2 LEU A 69 -9.949 -0.805 0.034 1.00 0.00 C ATOM 0 H LEU A 69 -7.469 2.278 -1.771 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.532 -0.494 -1.223 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.389 1.567 -2.383 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.815 -0.126 -2.542 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.216 1.197 0.116 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.657 1.262 0.447 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -11.149 2.279 -0.922 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.894 0.691 -1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.385 -0.770 1.032 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.574 -1.420 -0.614 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -8.949 -1.236 0.090 1.00 0.00 H new ATOM 1132 N LYS A 70 -7.548 0.346 -4.426 1.00 0.00 N ATOM 1133 CA LYS A 70 -7.281 -0.157 -5.768 1.00 0.00 C ATOM 1134 C LYS A 70 -6.146 -1.176 -5.752 1.00 0.00 C ATOM 1135 O LYS A 70 -6.243 -2.237 -6.369 1.00 0.00 O ATOM 1136 CB LYS A 70 -6.929 0.999 -6.708 1.00 0.00 C ATOM 1137 CG LYS A 70 -8.140 1.773 -7.200 1.00 0.00 C ATOM 1138 CD LYS A 70 -8.540 2.863 -6.220 1.00 0.00 C ATOM 1139 CE LYS A 70 -9.309 3.979 -6.912 1.00 0.00 C ATOM 1140 NZ LYS A 70 -9.073 5.299 -6.265 1.00 0.00 N ATOM 0 H LYS A 70 -7.795 1.335 -4.388 1.00 0.00 H new ATOM 0 HA LYS A 70 -8.183 -0.650 -6.130 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -6.256 1.684 -6.192 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -6.386 0.605 -7.567 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -7.919 2.218 -8.170 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -8.976 1.089 -7.346 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -9.153 2.434 -5.427 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -7.648 3.273 -5.746 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -9.012 4.030 -7.959 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -10.375 3.751 -6.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -9.726 6.003 -6.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -9.235 5.218 -5.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -8.092 5.600 -6.437 1.00 0.00 H new ATOM 1154 N ASP A 71 -5.072 -0.847 -5.042 1.00 0.00 N ATOM 1155 CA ASP A 71 -3.920 -1.735 -4.943 1.00 0.00 C ATOM 1156 C ASP A 71 -4.322 -3.084 -4.354 1.00 0.00 C ATOM 1157 O ASP A 71 -3.930 -4.135 -4.862 1.00 0.00 O ATOM 1158 CB ASP A 71 -2.828 -1.095 -4.084 1.00 0.00 C ATOM 1159 CG ASP A 71 -1.666 -2.035 -3.829 1.00 0.00 C ATOM 1160 OD1 ASP A 71 -1.874 -3.068 -3.160 1.00 0.00 O ATOM 1161 OD2 ASP A 71 -0.549 -1.737 -4.300 1.00 0.00 O ATOM 0 H ASP A 71 -4.976 0.028 -4.527 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.532 -1.899 -5.948 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -2.462 -0.195 -4.578 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -3.255 -0.784 -3.131 1.00 0.00 H new ATOM 1166 N ILE A 72 -5.104 -3.046 -3.281 1.00 0.00 N ATOM 1167 CA ILE A 72 -5.559 -4.265 -2.624 1.00 0.00 C ATOM 1168 C ILE A 72 -6.391 -5.122 -3.571 1.00 0.00 C ATOM 1169 O ILE A 72 -6.285 -6.349 -3.571 1.00 0.00 O ATOM 1170 CB ILE A 72 -6.392 -3.950 -1.368 1.00 0.00 C ATOM 1171 CG1 ILE A 72 -5.530 -3.241 -0.321 1.00 0.00 C ATOM 1172 CG2 ILE A 72 -6.988 -5.227 -0.794 1.00 0.00 C ATOM 1173 CD1 ILE A 72 -4.160 -3.859 -0.149 1.00 0.00 C ATOM 0 H ILE A 72 -5.436 -2.184 -2.848 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.666 -4.817 -2.329 1.00 0.00 H new ATOM 0 HB ILE A 72 -7.208 -3.285 -1.649 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -5.415 -2.195 -0.605 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -6.050 -3.256 0.637 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -7.574 -4.988 0.093 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -7.632 -5.695 -1.539 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -6.186 -5.914 -0.525 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.604 -3.306 0.608 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.266 -4.897 0.165 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.621 -3.819 -1.096 1.00 0.00 H new ATOM 1185 N ASP A 73 -7.218 -4.468 -4.379 1.00 0.00 N ATOM 1186 CA ASP A 73 -8.068 -5.170 -5.335 1.00 0.00 C ATOM 1187 C ASP A 73 -7.225 -5.907 -6.371 1.00 0.00 C ATOM 1188 O ASP A 73 -7.648 -6.926 -6.920 1.00 0.00 O ATOM 1189 CB ASP A 73 -9.010 -4.187 -6.031 1.00 0.00 C ATOM 1190 CG ASP A 73 -9.821 -4.842 -7.131 1.00 0.00 C ATOM 1191 OD1 ASP A 73 -10.747 -5.613 -6.806 1.00 0.00 O ATOM 1192 OD2 ASP A 73 -9.529 -4.585 -8.318 1.00 0.00 O ATOM 0 H ASP A 73 -7.318 -3.453 -4.392 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.661 -5.902 -4.787 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -9.686 -3.753 -5.294 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -8.428 -3.367 -6.452 1.00 0.00 H new ATOM 1197 N LEU A 74 -6.033 -5.385 -6.637 1.00 0.00 N ATOM 1198 CA LEU A 74 -5.131 -5.993 -7.609 1.00 0.00 C ATOM 1199 C LEU A 74 -4.529 -7.284 -7.061 1.00 0.00 C ATOM 1200 O LEU A 74 -4.444 -8.289 -7.767 1.00 0.00 O ATOM 1201 CB LEU A 74 -4.015 -5.015 -7.980 1.00 0.00 C ATOM 1202 CG LEU A 74 -3.049 -5.480 -9.070 1.00 0.00 C ATOM 1203 CD1 LEU A 74 -3.805 -5.802 -10.350 1.00 0.00 C ATOM 1204 CD2 LEU A 74 -1.986 -4.422 -9.328 1.00 0.00 C ATOM 0 H LEU A 74 -5.668 -4.542 -6.193 1.00 0.00 H new ATOM 0 HA LEU A 74 -5.708 -6.233 -8.502 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -4.472 -4.079 -8.303 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.439 -4.795 -7.081 1.00 0.00 H new ATOM 0 HG LEU A 74 -2.553 -6.388 -8.726 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -3.102 -6.131 -11.115 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -4.528 -6.595 -10.156 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -4.328 -4.911 -10.698 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -1.307 -4.770 -10.107 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -2.464 -3.497 -9.650 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -1.424 -4.240 -8.412 1.00 0.00 H new ATOM 1216 N ILE A 75 -4.116 -7.249 -5.799 1.00 0.00 N ATOM 1217 CA ILE A 75 -3.526 -8.416 -5.156 1.00 0.00 C ATOM 1218 C ILE A 75 -4.490 -9.598 -5.172 1.00 0.00 C ATOM 1219 O ILE A 75 -4.239 -10.608 -5.832 1.00 0.00 O ATOM 1220 CB ILE A 75 -3.125 -8.115 -3.700 1.00 0.00 C ATOM 1221 CG1 ILE A 75 -2.094 -6.986 -3.655 1.00 0.00 C ATOM 1222 CG2 ILE A 75 -2.578 -9.367 -3.031 1.00 0.00 C ATOM 1223 CD1 ILE A 75 -1.726 -6.559 -2.251 1.00 0.00 C ATOM 0 H ILE A 75 -4.179 -6.425 -5.201 1.00 0.00 H new ATOM 0 HA ILE A 75 -2.632 -8.671 -5.725 1.00 0.00 H new ATOM 0 HB ILE A 75 -4.012 -7.793 -3.154 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -1.192 -7.307 -4.176 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -2.486 -6.125 -4.197 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.299 -9.138 -2.003 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -3.342 -10.145 -3.035 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -1.701 -9.717 -3.575 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.991 -5.755 -2.296 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.618 -6.207 -1.732 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -1.304 -7.407 -1.712 1.00 0.00 H new ATOM 1235 N CYS A 76 -5.593 -9.465 -4.444 1.00 0.00 N ATOM 1236 CA CYS A 76 -6.596 -10.522 -4.375 1.00 0.00 C ATOM 1237 C CYS A 76 -6.791 -11.176 -5.739 1.00 0.00 C ATOM 1238 O CYS A 76 -6.733 -12.399 -5.867 1.00 0.00 O ATOM 1239 CB CYS A 76 -7.926 -9.959 -3.871 1.00 0.00 C ATOM 1240 SG CYS A 76 -8.485 -8.483 -4.753 1.00 0.00 S ATOM 0 H CYS A 76 -5.816 -8.636 -3.893 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.242 -11.280 -3.676 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -8.691 -10.731 -3.956 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -7.829 -9.721 -2.812 1.00 0.00 H new ATOM 0 HG CYS A 76 -7.557 -8.091 -5.574 1.00 0.00 H new ATOM 1246 N SER A 77 -7.024 -10.353 -6.757 1.00 0.00 N ATOM 1247 CA SER A 77 -7.234 -10.851 -8.111 1.00 0.00 C ATOM 1248 C SER A 77 -6.003 -11.603 -8.610 1.00 0.00 C ATOM 1249 O SER A 77 -6.105 -12.726 -9.101 1.00 0.00 O ATOM 1250 CB SER A 77 -7.558 -9.695 -9.058 1.00 0.00 C ATOM 1251 OG SER A 77 -7.722 -10.156 -10.388 1.00 0.00 O ATOM 0 H SER A 77 -7.072 -9.338 -6.669 1.00 0.00 H new ATOM 0 HA SER A 77 -8.077 -11.542 -8.091 1.00 0.00 H new ATOM 0 HB2 SER A 77 -8.469 -9.195 -8.728 1.00 0.00 H new ATOM 0 HB3 SER A 77 -6.758 -8.956 -9.022 1.00 0.00 H new ATOM 0 HG SER A 77 -7.930 -9.398 -10.974 1.00 0.00 H new ATOM 1257 N ASN A 78 -4.840 -10.973 -8.479 1.00 0.00 N ATOM 1258 CA ASN A 78 -3.589 -11.581 -8.917 1.00 0.00 C ATOM 1259 C ASN A 78 -3.506 -13.037 -8.471 1.00 0.00 C ATOM 1260 O ASN A 78 -3.320 -13.938 -9.288 1.00 0.00 O ATOM 1261 CB ASN A 78 -2.396 -10.798 -8.364 1.00 0.00 C ATOM 1262 CG ASN A 78 -2.083 -9.563 -9.187 1.00 0.00 C ATOM 1263 OD1 ASN A 78 -2.919 -9.087 -9.955 1.00 0.00 O ATOM 1264 ND2 ASN A 78 -0.874 -9.038 -9.029 1.00 0.00 N ATOM 0 H ASN A 78 -4.738 -10.043 -8.073 1.00 0.00 H new ATOM 0 HA ASN A 78 -3.562 -11.551 -10.006 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.604 -10.503 -7.336 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -1.520 -11.446 -8.339 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -0.606 -8.206 -9.556 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -0.213 -9.466 -8.381 1.00 0.00 H new ATOM 1271 N ALA A 79 -3.646 -13.260 -7.168 1.00 0.00 N ATOM 1272 CA ALA A 79 -3.590 -14.607 -6.613 1.00 0.00 C ATOM 1273 C ALA A 79 -4.394 -15.585 -7.463 1.00 0.00 C ATOM 1274 O ALA A 79 -3.830 -16.458 -8.124 1.00 0.00 O ATOM 1275 CB ALA A 79 -4.100 -14.608 -5.179 1.00 0.00 C ATOM 0 H ALA A 79 -3.799 -12.525 -6.477 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.550 -14.933 -6.618 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -4.053 -15.620 -4.777 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.481 -13.947 -4.572 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -5.132 -14.258 -5.160 1.00 0.00 H new ATOM 1281 N LEU A 80 -5.714 -15.434 -7.441 1.00 0.00 N ATOM 1282 CA LEU A 80 -6.596 -16.305 -8.210 1.00 0.00 C ATOM 1283 C LEU A 80 -5.950 -16.704 -9.533 1.00 0.00 C ATOM 1284 O LEU A 80 -5.790 -17.889 -9.823 1.00 0.00 O ATOM 1285 CB LEU A 80 -7.932 -15.607 -8.472 1.00 0.00 C ATOM 1286 CG LEU A 80 -8.938 -15.630 -7.322 1.00 0.00 C ATOM 1287 CD1 LEU A 80 -9.854 -14.418 -7.389 1.00 0.00 C ATOM 1288 CD2 LEU A 80 -9.751 -16.917 -7.350 1.00 0.00 C ATOM 0 H LEU A 80 -6.197 -14.717 -6.899 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.773 -17.208 -7.626 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.731 -14.568 -8.732 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.396 -16.069 -9.343 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.387 -15.592 -6.382 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -10.563 -14.452 -6.562 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -9.259 -13.508 -7.319 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -10.398 -14.424 -8.334 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -10.462 -16.916 -6.524 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -10.291 -16.986 -8.294 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -9.082 -17.772 -7.252 1.00 0.00 H new ATOM 1300 N GLU A 81 -5.578 -15.706 -10.329 1.00 0.00 N ATOM 1301 CA GLU A 81 -4.948 -15.955 -11.621 1.00 0.00 C ATOM 1302 C GLU A 81 -3.671 -16.774 -11.454 1.00 0.00 C ATOM 1303 O GLU A 81 -3.557 -17.880 -11.983 1.00 0.00 O ATOM 1304 CB GLU A 81 -4.631 -14.632 -12.321 1.00 0.00 C ATOM 1305 CG GLU A 81 -4.653 -14.725 -13.837 1.00 0.00 C ATOM 1306 CD GLU A 81 -3.892 -13.595 -14.503 1.00 0.00 C ATOM 1307 OE1 GLU A 81 -4.035 -12.439 -14.055 1.00 0.00 O ATOM 1308 OE2 GLU A 81 -3.153 -13.869 -15.472 1.00 0.00 O ATOM 0 H GLU A 81 -5.702 -14.719 -10.103 1.00 0.00 H new ATOM 0 HA GLU A 81 -5.646 -16.524 -12.234 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -5.352 -13.880 -12.001 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -3.648 -14.288 -12.001 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -4.223 -15.678 -14.145 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -5.687 -14.715 -14.183 1.00 0.00 H new ATOM 1315 N TYR A 82 -2.714 -16.222 -10.717 1.00 0.00 N ATOM 1316 CA TYR A 82 -1.444 -16.899 -10.482 1.00 0.00 C ATOM 1317 C TYR A 82 -1.548 -17.860 -9.302 1.00 0.00 C ATOM 1318 O TYR A 82 -1.376 -17.467 -8.150 1.00 0.00 O ATOM 1319 CB TYR A 82 -0.337 -15.876 -10.224 1.00 0.00 C ATOM 1320 CG TYR A 82 -0.028 -15.003 -11.420 1.00 0.00 C ATOM 1321 CD1 TYR A 82 -0.725 -13.820 -11.639 1.00 0.00 C ATOM 1322 CD2 TYR A 82 0.958 -15.360 -12.331 1.00 0.00 C ATOM 1323 CE1 TYR A 82 -0.447 -13.019 -12.730 1.00 0.00 C ATOM 1324 CE2 TYR A 82 1.243 -14.565 -13.424 1.00 0.00 C ATOM 1325 CZ TYR A 82 0.538 -13.396 -13.619 1.00 0.00 C ATOM 1326 OH TYR A 82 0.818 -12.602 -14.707 1.00 0.00 O ATOM 0 H TYR A 82 -2.793 -15.308 -10.272 1.00 0.00 H new ATOM 0 HA TYR A 82 -1.198 -17.474 -11.375 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -0.628 -15.241 -9.387 1.00 0.00 H new ATOM 0 HB3 TYR A 82 0.570 -16.402 -9.925 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -1.497 -13.522 -10.945 1.00 0.00 H new ATOM 0 HD2 TYR A 82 1.512 -16.275 -12.182 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -0.998 -12.103 -12.886 1.00 0.00 H new ATOM 0 HE2 TYR A 82 2.014 -14.857 -14.122 1.00 0.00 H new ATOM 0 HH TYR A 82 0.231 -11.817 -14.699 1.00 0.00 H new ATOM 1336 N ASN A 83 -1.832 -19.124 -9.600 1.00 0.00 N ATOM 1337 CA ASN A 83 -1.960 -20.144 -8.565 1.00 0.00 C ATOM 1338 C ASN A 83 -1.860 -21.543 -9.165 1.00 0.00 C ATOM 1339 O ASN A 83 -2.617 -21.917 -10.061 1.00 0.00 O ATOM 1340 CB ASN A 83 -3.291 -19.986 -7.827 1.00 0.00 C ATOM 1341 CG ASN A 83 -3.229 -20.511 -6.406 1.00 0.00 C ATOM 1342 OD1 ASN A 83 -2.998 -19.614 -5.454 1.00 0.00 O flip ATOM 1343 ND2 ASN A 83 -3.387 -21.708 -6.166 1.00 0.00 N flip ATOM 0 H ASN A 83 -1.978 -19.466 -10.550 1.00 0.00 H new ATOM 0 HA ASN A 83 -1.142 -20.013 -7.857 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -3.572 -18.933 -7.811 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -4.072 -20.515 -8.373 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -3.562 -22.362 -6.929 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -3.343 -22.046 -5.204 1.00 0.00 H new ATOM 1350 N PRO A 84 -0.904 -22.336 -8.659 1.00 0.00 N ATOM 1351 CA PRO A 84 -0.683 -23.707 -9.128 1.00 0.00 C ATOM 1352 C PRO A 84 -1.813 -24.648 -8.725 1.00 0.00 C ATOM 1353 O PRO A 84 -2.111 -24.804 -7.541 1.00 0.00 O ATOM 1354 CB PRO A 84 0.622 -24.113 -8.438 1.00 0.00 C ATOM 1355 CG PRO A 84 0.686 -23.260 -7.218 1.00 0.00 C ATOM 1356 CD PRO A 84 0.034 -21.956 -7.590 1.00 0.00 C ATOM 0 HA PRO A 84 -0.641 -23.763 -10.216 1.00 0.00 H new ATOM 0 HB2 PRO A 84 0.621 -25.172 -8.181 1.00 0.00 H new ATOM 0 HB3 PRO A 84 1.482 -23.943 -9.086 1.00 0.00 H new ATOM 0 HG2 PRO A 84 0.167 -23.732 -6.384 1.00 0.00 H new ATOM 0 HG3 PRO A 84 1.718 -23.105 -6.904 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -0.484 -21.509 -6.741 1.00 0.00 H new ATOM 0 HD3 PRO A 84 0.765 -21.226 -7.938 1.00 0.00 H new ATOM 1364 N ASP A 85 -2.440 -25.272 -9.717 1.00 0.00 N ATOM 1365 CA ASP A 85 -3.537 -26.198 -9.464 1.00 0.00 C ATOM 1366 C ASP A 85 -3.022 -27.628 -9.335 1.00 0.00 C ATOM 1367 O ASP A 85 -3.052 -28.400 -10.294 1.00 0.00 O ATOM 1368 CB ASP A 85 -4.571 -26.115 -10.588 1.00 0.00 C ATOM 1369 CG ASP A 85 -3.932 -26.080 -11.962 1.00 0.00 C ATOM 1370 OD1 ASP A 85 -3.363 -25.029 -12.326 1.00 0.00 O ATOM 1371 OD2 ASP A 85 -3.998 -27.104 -12.674 1.00 0.00 O ATOM 0 H ASP A 85 -2.207 -25.153 -10.703 1.00 0.00 H new ATOM 0 HA ASP A 85 -4.010 -25.915 -8.524 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -5.242 -26.972 -10.524 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -5.181 -25.222 -10.451 1.00 0.00 H new ATOM 1376 N LYS A 86 -2.548 -27.976 -8.143 1.00 0.00 N ATOM 1377 CA LYS A 86 -2.026 -29.313 -7.887 1.00 0.00 C ATOM 1378 C LYS A 86 -2.718 -29.945 -6.684 1.00 0.00 C ATOM 1379 O LYS A 86 -3.232 -31.061 -6.767 1.00 0.00 O ATOM 1380 CB LYS A 86 -0.515 -29.255 -7.649 1.00 0.00 C ATOM 1381 CG LYS A 86 0.299 -29.150 -8.927 1.00 0.00 C ATOM 1382 CD LYS A 86 0.495 -30.509 -9.577 1.00 0.00 C ATOM 1383 CE LYS A 86 1.310 -30.402 -10.857 1.00 0.00 C ATOM 1384 NZ LYS A 86 1.073 -31.559 -11.764 1.00 0.00 N ATOM 0 H LYS A 86 -2.515 -27.350 -7.339 1.00 0.00 H new ATOM 0 HA LYS A 86 -2.226 -29.929 -8.764 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -0.289 -28.399 -7.013 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -0.207 -30.148 -7.104 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -0.203 -28.481 -9.625 1.00 0.00 H new ATOM 0 HG3 LYS A 86 1.271 -28.708 -8.705 1.00 0.00 H new ATOM 0 HD2 LYS A 86 0.998 -31.178 -8.879 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -0.476 -30.951 -9.799 1.00 0.00 H new ATOM 0 HE2 LYS A 86 1.054 -29.477 -11.374 1.00 0.00 H new ATOM 0 HE3 LYS A 86 2.370 -30.346 -10.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 1.646 -31.449 -12.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 1.341 -32.440 -11.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 0.066 -31.598 -12.021 1.00 0.00 H new ATOM 1398 N ASP A 87 -2.727 -29.226 -5.567 1.00 0.00 N ATOM 1399 CA ASP A 87 -3.358 -29.716 -4.347 1.00 0.00 C ATOM 1400 C ASP A 87 -4.789 -29.201 -4.231 1.00 0.00 C ATOM 1401 O ASP A 87 -5.135 -28.135 -4.741 1.00 0.00 O ATOM 1402 CB ASP A 87 -2.548 -29.290 -3.122 1.00 0.00 C ATOM 1403 CG ASP A 87 -1.827 -27.973 -3.334 1.00 0.00 C ATOM 1404 OD1 ASP A 87 -2.507 -26.963 -3.609 1.00 0.00 O ATOM 1405 OD2 ASP A 87 -0.583 -27.954 -3.225 1.00 0.00 O ATOM 0 H ASP A 87 -2.304 -28.302 -5.481 1.00 0.00 H new ATOM 0 HA ASP A 87 -3.386 -30.805 -4.393 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -3.213 -29.203 -2.263 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -1.820 -30.065 -2.884 1.00 0.00 H new ATOM 1410 N PRO A 88 -5.643 -29.975 -3.545 1.00 0.00 N ATOM 1411 CA PRO A 88 -7.051 -29.618 -3.346 1.00 0.00 C ATOM 1412 C PRO A 88 -7.220 -28.429 -2.406 1.00 0.00 C ATOM 1413 O PRO A 88 -8.272 -27.791 -2.379 1.00 0.00 O ATOM 1414 CB PRO A 88 -7.653 -30.880 -2.725 1.00 0.00 C ATOM 1415 CG PRO A 88 -6.505 -31.562 -2.063 1.00 0.00 C ATOM 1416 CD PRO A 88 -5.300 -31.259 -2.910 1.00 0.00 C ATOM 0 HA PRO A 88 -7.530 -29.315 -4.277 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -8.435 -30.633 -2.006 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -8.107 -31.517 -3.484 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -6.368 -31.197 -1.045 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -6.675 -32.637 -1.996 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -4.395 -31.180 -2.308 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -5.123 -32.039 -3.651 1.00 0.00 H new ATOM 1424 N GLY A 89 -6.176 -28.136 -1.636 1.00 0.00 N ATOM 1425 CA GLY A 89 -6.230 -27.023 -0.706 1.00 0.00 C ATOM 1426 C GLY A 89 -6.409 -25.690 -1.405 1.00 0.00 C ATOM 1427 O GLY A 89 -7.099 -24.805 -0.900 1.00 0.00 O ATOM 0 H GLY A 89 -5.295 -28.649 -1.640 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -7.053 -27.177 -0.008 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.313 -27.001 -0.118 1.00 0.00 H new ATOM 1431 N ASP A 90 -5.785 -25.546 -2.569 1.00 0.00 N ATOM 1432 CA ASP A 90 -5.878 -24.311 -3.338 1.00 0.00 C ATOM 1433 C ASP A 90 -7.302 -23.764 -3.318 1.00 0.00 C ATOM 1434 O ASP A 90 -7.514 -22.557 -3.199 1.00 0.00 O ATOM 1435 CB ASP A 90 -5.431 -24.549 -4.781 1.00 0.00 C ATOM 1436 CG ASP A 90 -6.524 -25.167 -5.632 1.00 0.00 C ATOM 1437 OD1 ASP A 90 -6.944 -26.302 -5.326 1.00 0.00 O ATOM 1438 OD2 ASP A 90 -6.959 -24.513 -6.603 1.00 0.00 O ATOM 0 H ASP A 90 -5.209 -26.269 -3.000 1.00 0.00 H new ATOM 0 HA ASP A 90 -5.219 -23.575 -2.878 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -5.122 -23.602 -5.223 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -4.559 -25.202 -4.785 1.00 0.00 H new ATOM 1443 N LYS A 91 -8.276 -24.660 -3.436 1.00 0.00 N ATOM 1444 CA LYS A 91 -9.681 -24.269 -3.431 1.00 0.00 C ATOM 1445 C LYS A 91 -9.910 -23.076 -2.509 1.00 0.00 C ATOM 1446 O LYS A 91 -10.478 -22.063 -2.919 1.00 0.00 O ATOM 1447 CB LYS A 91 -10.557 -25.443 -2.990 1.00 0.00 C ATOM 1448 CG LYS A 91 -10.942 -26.376 -4.126 1.00 0.00 C ATOM 1449 CD LYS A 91 -12.135 -25.845 -4.903 1.00 0.00 C ATOM 1450 CE LYS A 91 -12.547 -26.801 -6.012 1.00 0.00 C ATOM 1451 NZ LYS A 91 -13.278 -26.100 -7.105 1.00 0.00 N ATOM 0 H LYS A 91 -8.118 -25.663 -3.536 1.00 0.00 H new ATOM 0 HA LYS A 91 -9.955 -23.980 -4.446 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -10.028 -26.013 -2.226 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -11.464 -25.055 -2.527 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.094 -26.500 -4.799 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -11.177 -27.362 -3.725 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -12.974 -25.691 -4.224 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -11.889 -24.873 -5.331 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.661 -27.287 -6.421 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -13.179 -27.587 -5.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -13.542 -26.785 -7.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -14.137 -25.658 -6.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -12.666 -25.367 -7.517 1.00 0.00 H new ATOM 1465 N ILE A 92 -9.464 -23.202 -1.264 1.00 0.00 N ATOM 1466 CA ILE A 92 -9.619 -22.132 -0.286 1.00 0.00 C ATOM 1467 C ILE A 92 -9.133 -20.800 -0.847 1.00 0.00 C ATOM 1468 O ILE A 92 -9.899 -19.841 -0.947 1.00 0.00 O ATOM 1469 CB ILE A 92 -8.849 -22.441 1.012 1.00 0.00 C ATOM 1470 CG1 ILE A 92 -9.398 -23.710 1.666 1.00 0.00 C ATOM 1471 CG2 ILE A 92 -8.936 -21.264 1.972 1.00 0.00 C ATOM 1472 CD1 ILE A 92 -9.151 -23.777 3.157 1.00 0.00 C ATOM 0 H ILE A 92 -8.993 -24.034 -0.909 1.00 0.00 H new ATOM 0 HA ILE A 92 -10.683 -22.062 -0.060 1.00 0.00 H new ATOM 0 HB ILE A 92 -7.800 -22.607 0.765 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -10.470 -23.770 1.481 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -8.943 -24.580 1.191 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -8.387 -21.497 2.884 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -8.503 -20.380 1.504 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -9.980 -21.070 2.216 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -9.567 -24.703 3.553 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -8.079 -23.749 3.350 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -9.629 -22.927 3.644 1.00 0.00 H new ATOM 1484 N ILE A 93 -7.857 -20.748 -1.212 1.00 0.00 N ATOM 1485 CA ILE A 93 -7.270 -19.534 -1.766 1.00 0.00 C ATOM 1486 C ILE A 93 -8.296 -18.746 -2.573 1.00 0.00 C ATOM 1487 O ILE A 93 -8.551 -17.573 -2.296 1.00 0.00 O ATOM 1488 CB ILE A 93 -6.061 -19.852 -2.665 1.00 0.00 C ATOM 1489 CG1 ILE A 93 -5.037 -20.694 -1.901 1.00 0.00 C ATOM 1490 CG2 ILE A 93 -5.426 -18.567 -3.173 1.00 0.00 C ATOM 1491 CD1 ILE A 93 -4.547 -20.040 -0.628 1.00 0.00 C ATOM 0 H ILE A 93 -7.209 -21.532 -1.134 1.00 0.00 H new ATOM 0 HA ILE A 93 -6.935 -18.932 -0.921 1.00 0.00 H new ATOM 0 HB ILE A 93 -6.407 -20.427 -3.524 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -5.482 -21.659 -1.657 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -4.184 -20.891 -2.550 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -4.573 -18.809 -3.807 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -6.159 -18.003 -3.750 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -5.091 -17.967 -2.327 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -3.824 -20.693 -0.139 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -4.073 -19.088 -0.867 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -5.391 -19.867 0.040 1.00 0.00 H new ATOM 1503 N ARG A 94 -8.883 -19.398 -3.571 1.00 0.00 N ATOM 1504 CA ARG A 94 -9.883 -18.758 -4.418 1.00 0.00 C ATOM 1505 C ARG A 94 -10.779 -17.834 -3.598 1.00 0.00 C ATOM 1506 O ARG A 94 -10.901 -16.645 -3.897 1.00 0.00 O ATOM 1507 CB ARG A 94 -10.734 -19.815 -5.125 1.00 0.00 C ATOM 1508 CG ARG A 94 -11.803 -19.228 -6.032 1.00 0.00 C ATOM 1509 CD ARG A 94 -12.979 -20.178 -6.193 1.00 0.00 C ATOM 1510 NE ARG A 94 -14.209 -19.472 -6.546 1.00 0.00 N ATOM 1511 CZ ARG A 94 -14.403 -18.875 -7.716 1.00 0.00 C ATOM 1512 NH1 ARG A 94 -13.455 -18.898 -8.642 1.00 0.00 N ATOM 1513 NH2 ARG A 94 -15.549 -18.253 -7.962 1.00 0.00 N ATOM 0 H ARG A 94 -8.684 -20.369 -3.813 1.00 0.00 H new ATOM 0 HA ARG A 94 -9.361 -18.161 -5.166 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -10.082 -20.459 -5.715 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -11.212 -20.446 -4.375 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -12.152 -18.281 -5.619 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -11.373 -19.010 -7.010 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -12.749 -20.913 -6.965 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -13.131 -20.728 -5.264 1.00 0.00 H new ATOM 0 HE ARG A 94 -14.959 -19.436 -5.856 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -12.573 -19.375 -8.457 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -13.608 -18.438 -9.540 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -16.281 -18.233 -7.252 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -15.698 -17.794 -8.861 1.00 0.00 H new ATOM 1527 N HIS A 95 -11.404 -18.387 -2.564 1.00 0.00 N ATOM 1528 CA HIS A 95 -12.288 -17.612 -1.701 1.00 0.00 C ATOM 1529 C HIS A 95 -11.491 -16.633 -0.845 1.00 0.00 C ATOM 1530 O HIS A 95 -11.850 -15.461 -0.729 1.00 0.00 O ATOM 1531 CB HIS A 95 -13.106 -18.543 -0.805 1.00 0.00 C ATOM 1532 CG HIS A 95 -14.206 -17.848 -0.065 1.00 0.00 C ATOM 1533 ND1 HIS A 95 -14.004 -17.166 1.117 1.00 0.00 N ATOM 1534 CD2 HIS A 95 -15.525 -17.730 -0.345 1.00 0.00 C ATOM 1535 CE1 HIS A 95 -15.152 -16.660 1.532 1.00 0.00 C ATOM 1536 NE2 HIS A 95 -16.091 -16.988 0.663 1.00 0.00 N ATOM 0 H HIS A 95 -11.315 -19.369 -2.303 1.00 0.00 H new ATOM 0 HA HIS A 95 -12.967 -17.042 -2.336 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -13.535 -19.337 -1.416 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -12.440 -19.019 -0.086 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -16.037 -18.143 -1.202 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -15.298 -16.077 2.429 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -17.076 -16.732 0.730 1.00 0.00 H new ATOM 1545 N ARG A 96 -10.410 -17.122 -0.247 1.00 0.00 N ATOM 1546 CA ARG A 96 -9.563 -16.291 0.600 1.00 0.00 C ATOM 1547 C ARG A 96 -9.334 -14.923 -0.036 1.00 0.00 C ATOM 1548 O ARG A 96 -9.535 -13.889 0.601 1.00 0.00 O ATOM 1549 CB ARG A 96 -8.221 -16.980 0.851 1.00 0.00 C ATOM 1550 CG ARG A 96 -7.614 -16.659 2.206 1.00 0.00 C ATOM 1551 CD ARG A 96 -8.054 -17.658 3.265 1.00 0.00 C ATOM 1552 NE ARG A 96 -9.293 -17.249 3.922 1.00 0.00 N ATOM 1553 CZ ARG A 96 -9.707 -17.744 5.083 1.00 0.00 C ATOM 1554 NH1 ARG A 96 -8.985 -18.661 5.712 1.00 0.00 N ATOM 1555 NH2 ARG A 96 -10.846 -17.322 5.617 1.00 0.00 N ATOM 0 H ARG A 96 -10.100 -18.090 -0.333 1.00 0.00 H new ATOM 0 HA ARG A 96 -10.073 -16.149 1.553 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -8.355 -18.059 0.769 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -7.520 -16.686 0.070 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -6.527 -16.664 2.129 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -7.908 -15.654 2.508 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -8.193 -18.636 2.805 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -7.267 -17.766 4.011 1.00 0.00 H new ATOM 0 HE ARG A 96 -9.872 -16.545 3.464 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -8.109 -18.988 5.305 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -9.305 -19.039 6.603 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -11.404 -16.617 5.136 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -11.163 -17.703 6.509 1.00 0.00 H new ATOM 1569 N ALA A 97 -8.911 -14.926 -1.296 1.00 0.00 N ATOM 1570 CA ALA A 97 -8.655 -13.686 -2.019 1.00 0.00 C ATOM 1571 C ALA A 97 -9.777 -12.678 -1.793 1.00 0.00 C ATOM 1572 O ALA A 97 -9.536 -11.559 -1.336 1.00 0.00 O ATOM 1573 CB ALA A 97 -8.486 -13.966 -3.505 1.00 0.00 C ATOM 0 H ALA A 97 -8.738 -15.773 -1.837 1.00 0.00 H new ATOM 0 HA ALA A 97 -7.731 -13.255 -1.635 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -8.296 -13.031 -4.032 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.646 -14.644 -3.654 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -9.395 -14.423 -3.895 1.00 0.00 H new ATOM 1579 N CYS A 98 -11.001 -13.079 -2.116 1.00 0.00 N ATOM 1580 CA CYS A 98 -12.160 -12.209 -1.949 1.00 0.00 C ATOM 1581 C CYS A 98 -12.281 -11.736 -0.505 1.00 0.00 C ATOM 1582 O CYS A 98 -12.357 -10.536 -0.237 1.00 0.00 O ATOM 1583 CB CYS A 98 -13.436 -12.940 -2.368 1.00 0.00 C ATOM 1584 SG CYS A 98 -14.924 -11.913 -2.322 1.00 0.00 S ATOM 0 H CYS A 98 -11.217 -14.001 -2.495 1.00 0.00 H new ATOM 0 HA CYS A 98 -12.024 -11.336 -2.587 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -13.305 -13.326 -3.379 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -13.581 -13.800 -1.714 1.00 0.00 H new ATOM 0 HG CYS A 98 -15.950 -12.619 -2.695 1.00 0.00 H new ATOM 1590 N THR A 99 -12.301 -12.686 0.425 1.00 0.00 N ATOM 1591 CA THR A 99 -12.416 -12.367 1.842 1.00 0.00 C ATOM 1592 C THR A 99 -11.462 -11.243 2.232 1.00 0.00 C ATOM 1593 O THR A 99 -11.851 -10.295 2.916 1.00 0.00 O ATOM 1594 CB THR A 99 -12.126 -13.599 2.721 1.00 0.00 C ATOM 1595 OG1 THR A 99 -12.913 -14.711 2.280 1.00 0.00 O ATOM 1596 CG2 THR A 99 -12.429 -13.304 4.182 1.00 0.00 C ATOM 0 H THR A 99 -12.239 -13.684 0.221 1.00 0.00 H new ATOM 0 HA THR A 99 -13.443 -12.043 2.010 1.00 0.00 H new ATOM 0 HB THR A 99 -11.068 -13.844 2.628 1.00 0.00 H new ATOM 0 HG1 THR A 99 -12.722 -15.490 2.842 1.00 0.00 H new ATOM 0 HG21 THR A 99 -12.217 -14.188 4.783 1.00 0.00 H new ATOM 0 HG22 THR A 99 -11.807 -12.476 4.522 1.00 0.00 H new ATOM 0 HG23 THR A 99 -13.480 -13.036 4.289 1.00 0.00 H new ATOM 1604 N LEU A 100 -10.214 -11.355 1.793 1.00 0.00 N ATOM 1605 CA LEU A 100 -9.203 -10.347 2.096 1.00 0.00 C ATOM 1606 C LEU A 100 -9.676 -8.959 1.675 1.00 0.00 C ATOM 1607 O LEU A 100 -9.500 -7.983 2.404 1.00 0.00 O ATOM 1608 CB LEU A 100 -7.889 -10.686 1.391 1.00 0.00 C ATOM 1609 CG LEU A 100 -6.859 -9.558 1.312 1.00 0.00 C ATOM 1610 CD1 LEU A 100 -6.195 -9.345 2.663 1.00 0.00 C ATOM 1611 CD2 LEU A 100 -5.817 -9.861 0.245 1.00 0.00 C ATOM 0 H LEU A 100 -9.877 -12.133 1.226 1.00 0.00 H new ATOM 0 HA LEU A 100 -9.039 -10.344 3.174 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.433 -11.532 1.904 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -8.118 -11.014 0.377 1.00 0.00 H new ATOM 0 HG LEU A 100 -7.376 -8.639 1.036 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -5.465 -8.539 2.587 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.951 -9.082 3.403 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.692 -10.262 2.970 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -5.092 -9.048 0.203 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.305 -10.791 0.491 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -6.307 -9.961 -0.724 1.00 0.00 H new ATOM 1623 N LYS A 101 -10.279 -8.878 0.494 1.00 0.00 N ATOM 1624 CA LYS A 101 -10.781 -7.611 -0.025 1.00 0.00 C ATOM 1625 C LYS A 101 -11.924 -7.085 0.838 1.00 0.00 C ATOM 1626 O LYS A 101 -11.827 -6.006 1.423 1.00 0.00 O ATOM 1627 CB LYS A 101 -11.255 -7.780 -1.470 1.00 0.00 C ATOM 1628 CG LYS A 101 -11.328 -6.474 -2.242 1.00 0.00 C ATOM 1629 CD LYS A 101 -11.519 -6.716 -3.730 1.00 0.00 C ATOM 1630 CE LYS A 101 -12.890 -7.303 -4.028 1.00 0.00 C ATOM 1631 NZ LYS A 101 -12.947 -8.760 -3.728 1.00 0.00 N ATOM 0 H LYS A 101 -10.432 -9.676 -0.123 1.00 0.00 H new ATOM 0 HA LYS A 101 -9.966 -6.888 0.001 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -10.580 -8.461 -1.988 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -12.240 -8.247 -1.468 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -12.153 -5.871 -1.862 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -10.414 -5.903 -2.080 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -11.399 -5.777 -4.271 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -10.746 -7.394 -4.092 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -13.644 -6.781 -3.439 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -13.135 -7.138 -5.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -13.406 -9.259 -4.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -11.982 -9.126 -3.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -13.493 -8.914 -2.856 1.00 0.00 H new ATOM 1645 N ASP A 102 -13.005 -7.854 0.913 1.00 0.00 N ATOM 1646 CA ASP A 102 -14.165 -7.466 1.706 1.00 0.00 C ATOM 1647 C ASP A 102 -13.735 -6.879 3.047 1.00 0.00 C ATOM 1648 O ASP A 102 -14.213 -5.820 3.456 1.00 0.00 O ATOM 1649 CB ASP A 102 -15.081 -8.670 1.933 1.00 0.00 C ATOM 1650 CG ASP A 102 -16.524 -8.266 2.159 1.00 0.00 C ATOM 1651 OD1 ASP A 102 -17.108 -7.625 1.261 1.00 0.00 O ATOM 1652 OD2 ASP A 102 -17.069 -8.590 3.235 1.00 0.00 O ATOM 0 H ASP A 102 -13.102 -8.749 0.434 1.00 0.00 H new ATOM 0 HA ASP A 102 -14.712 -6.702 1.154 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -15.024 -9.334 1.070 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -14.726 -9.235 2.795 1.00 0.00 H new ATOM 1657 N THR A 103 -12.831 -7.575 3.729 1.00 0.00 N ATOM 1658 CA THR A 103 -12.338 -7.125 5.025 1.00 0.00 C ATOM 1659 C THR A 103 -11.728 -5.731 4.927 1.00 0.00 C ATOM 1660 O THR A 103 -12.182 -4.797 5.586 1.00 0.00 O ATOM 1661 CB THR A 103 -11.286 -8.095 5.594 1.00 0.00 C ATOM 1662 OG1 THR A 103 -11.838 -9.412 5.696 1.00 0.00 O ATOM 1663 CG2 THR A 103 -10.807 -7.633 6.961 1.00 0.00 C ATOM 0 H THR A 103 -12.425 -8.453 3.405 1.00 0.00 H new ATOM 0 HA THR A 103 -13.196 -7.097 5.697 1.00 0.00 H new ATOM 0 HB THR A 103 -10.434 -8.111 4.915 1.00 0.00 H new ATOM 0 HG1 THR A 103 -11.893 -9.814 4.804 1.00 0.00 H new ATOM 0 HG21 THR A 103 -10.065 -8.334 7.342 1.00 0.00 H new ATOM 0 HG22 THR A 103 -10.360 -6.643 6.874 1.00 0.00 H new ATOM 0 HG23 THR A 103 -11.652 -7.591 7.648 1.00 0.00 H new ATOM 1671 N ALA A 104 -10.696 -5.599 4.100 1.00 0.00 N ATOM 1672 CA ALA A 104 -10.025 -4.319 3.914 1.00 0.00 C ATOM 1673 C ALA A 104 -11.025 -3.221 3.566 1.00 0.00 C ATOM 1674 O ALA A 104 -11.147 -2.228 4.285 1.00 0.00 O ATOM 1675 CB ALA A 104 -8.964 -4.431 2.829 1.00 0.00 C ATOM 0 H ALA A 104 -10.307 -6.363 3.548 1.00 0.00 H new ATOM 0 HA ALA A 104 -9.541 -4.051 4.853 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -8.471 -3.467 2.701 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -8.227 -5.180 3.117 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -9.433 -4.726 1.890 1.00 0.00 H new ATOM 1681 N HIS A 105 -11.738 -3.404 2.460 1.00 0.00 N ATOM 1682 CA HIS A 105 -12.728 -2.429 2.017 1.00 0.00 C ATOM 1683 C HIS A 105 -13.654 -2.035 3.164 1.00 0.00 C ATOM 1684 O HIS A 105 -13.985 -0.862 3.333 1.00 0.00 O ATOM 1685 CB HIS A 105 -13.547 -2.992 0.856 1.00 0.00 C ATOM 1686 CG HIS A 105 -12.838 -2.930 -0.462 1.00 0.00 C ATOM 1687 ND1 HIS A 105 -11.742 -3.587 -0.910 1.00 0.00 N flip ATOM 1688 CD2 HIS A 105 -13.245 -2.116 -1.498 1.00 0.00 C flip ATOM 1689 CE1 HIS A 105 -11.510 -3.162 -2.195 1.00 0.00 C flip ATOM 1690 NE2 HIS A 105 -12.431 -2.275 -2.526 1.00 0.00 N flip ATOM 0 H HIS A 105 -11.649 -4.219 1.853 1.00 0.00 H new ATOM 0 HA HIS A 105 -12.198 -1.539 1.679 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -13.804 -4.029 1.073 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -14.484 -2.440 0.782 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -14.096 -1.452 -1.473 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -10.705 -3.498 -2.832 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -12.502 -1.794 -3.423 1.00 0.00 H new ATOM 1699 N ALA A 106 -14.068 -3.024 3.950 1.00 0.00 N ATOM 1700 CA ALA A 106 -14.955 -2.781 5.081 1.00 0.00 C ATOM 1701 C ALA A 106 -14.277 -1.907 6.131 1.00 0.00 C ATOM 1702 O ALA A 106 -14.934 -1.125 6.819 1.00 0.00 O ATOM 1703 CB ALA A 106 -15.399 -4.100 5.696 1.00 0.00 C ATOM 0 H ALA A 106 -13.803 -4.001 3.824 1.00 0.00 H new ATOM 0 HA ALA A 106 -15.834 -2.249 4.715 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -16.061 -3.904 6.539 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -15.929 -4.690 4.948 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -14.525 -4.653 6.041 1.00 0.00 H new ATOM 1709 N ILE A 107 -12.961 -2.046 6.250 1.00 0.00 N ATOM 1710 CA ILE A 107 -12.196 -1.269 7.217 1.00 0.00 C ATOM 1711 C ILE A 107 -12.060 0.183 6.771 1.00 0.00 C ATOM 1712 O ILE A 107 -12.137 1.103 7.586 1.00 0.00 O ATOM 1713 CB ILE A 107 -10.791 -1.862 7.430 1.00 0.00 C ATOM 1714 CG1 ILE A 107 -10.891 -3.263 8.038 1.00 0.00 C ATOM 1715 CG2 ILE A 107 -9.960 -0.950 8.321 1.00 0.00 C ATOM 1716 CD1 ILE A 107 -9.614 -4.064 7.924 1.00 0.00 C ATOM 0 H ILE A 107 -12.403 -2.689 5.689 1.00 0.00 H new ATOM 0 HA ILE A 107 -12.745 -1.308 8.158 1.00 0.00 H new ATOM 0 HB ILE A 107 -10.296 -1.941 6.462 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -11.162 -3.175 9.090 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -11.697 -3.807 7.545 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -8.970 -1.383 8.462 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -9.864 0.029 7.851 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -10.450 -0.842 9.289 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -9.759 -5.045 8.376 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -9.352 -4.183 6.873 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -8.809 -3.541 8.441 1.00 0.00 H new ATOM 1728 N ILE A 108 -11.860 0.381 5.472 1.00 0.00 N ATOM 1729 CA ILE A 108 -11.717 1.721 4.917 1.00 0.00 C ATOM 1730 C ILE A 108 -13.025 2.499 5.014 1.00 0.00 C ATOM 1731 O ILE A 108 -13.058 3.617 5.527 1.00 0.00 O ATOM 1732 CB ILE A 108 -11.267 1.676 3.445 1.00 0.00 C ATOM 1733 CG1 ILE A 108 -9.867 1.067 3.336 1.00 0.00 C ATOM 1734 CG2 ILE A 108 -11.291 3.072 2.841 1.00 0.00 C ATOM 1735 CD1 ILE A 108 -8.910 1.555 4.400 1.00 0.00 C ATOM 0 H ILE A 108 -11.793 -0.370 4.785 1.00 0.00 H new ATOM 0 HA ILE A 108 -10.952 2.226 5.507 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.961 1.048 2.887 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -9.946 -0.018 3.400 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -9.454 1.299 2.354 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -10.970 3.024 1.800 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -12.304 3.473 2.891 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -10.616 3.721 3.399 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.938 1.081 4.260 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.801 2.637 4.323 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -9.300 1.299 5.385 1.00 0.00 H new ATOM 1747 N ALA A 109 -14.102 1.897 4.518 1.00 0.00 N ATOM 1748 CA ALA A 109 -15.414 2.532 4.552 1.00 0.00 C ATOM 1749 C ALA A 109 -15.822 2.873 5.981 1.00 0.00 C ATOM 1750 O ALA A 109 -16.225 3.999 6.270 1.00 0.00 O ATOM 1751 CB ALA A 109 -16.453 1.628 3.905 1.00 0.00 C ATOM 0 H ALA A 109 -14.091 0.972 4.089 1.00 0.00 H new ATOM 0 HA ALA A 109 -15.356 3.463 3.988 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -17.428 2.114 3.937 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -16.176 1.439 2.868 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -16.501 0.683 4.446 1.00 0.00 H new ATOM 1757 N ALA A 110 -15.717 1.892 6.872 1.00 0.00 N ATOM 1758 CA ALA A 110 -16.074 2.089 8.271 1.00 0.00 C ATOM 1759 C ALA A 110 -15.222 3.183 8.907 1.00 0.00 C ATOM 1760 O ALA A 110 -15.741 4.201 9.361 1.00 0.00 O ATOM 1761 CB ALA A 110 -15.925 0.786 9.043 1.00 0.00 C ATOM 0 H ALA A 110 -15.387 0.953 6.649 1.00 0.00 H new ATOM 0 HA ALA A 110 -17.116 2.406 8.312 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -16.195 0.948 10.086 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.582 0.030 8.612 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -14.891 0.445 8.985 1.00 0.00 H new ATOM 1767 N GLU A 111 -13.911 2.964 8.934 1.00 0.00 N ATOM 1768 CA GLU A 111 -12.987 3.931 9.516 1.00 0.00 C ATOM 1769 C GLU A 111 -13.097 5.280 8.810 1.00 0.00 C ATOM 1770 O GLU A 111 -13.566 6.260 9.389 1.00 0.00 O ATOM 1771 CB GLU A 111 -11.550 3.413 9.430 1.00 0.00 C ATOM 1772 CG GLU A 111 -11.288 2.197 10.303 1.00 0.00 C ATOM 1773 CD GLU A 111 -9.843 2.102 10.752 1.00 0.00 C ATOM 1774 OE1 GLU A 111 -9.278 3.138 11.159 1.00 0.00 O ATOM 1775 OE2 GLU A 111 -9.277 0.990 10.696 1.00 0.00 O ATOM 0 H GLU A 111 -13.465 2.126 8.560 1.00 0.00 H new ATOM 0 HA GLU A 111 -13.254 4.066 10.564 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -11.325 3.161 8.394 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.867 4.212 9.719 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -11.935 2.237 11.179 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.553 1.295 9.752 1.00 0.00 H new ATOM 1782 N LEU A 112 -12.659 5.322 7.556 1.00 0.00 N ATOM 1783 CA LEU A 112 -12.707 6.550 6.770 1.00 0.00 C ATOM 1784 C LEU A 112 -14.002 7.312 7.029 1.00 0.00 C ATOM 1785 O LEU A 112 -15.026 6.719 7.370 1.00 0.00 O ATOM 1786 CB LEU A 112 -12.579 6.230 5.280 1.00 0.00 C ATOM 1787 CG LEU A 112 -12.294 7.418 4.360 1.00 0.00 C ATOM 1788 CD1 LEU A 112 -10.834 7.831 4.459 1.00 0.00 C ATOM 1789 CD2 LEU A 112 -12.658 7.078 2.922 1.00 0.00 C ATOM 0 H LEU A 112 -12.267 4.520 7.062 1.00 0.00 H new ATOM 0 HA LEU A 112 -11.870 7.179 7.073 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -11.781 5.498 5.153 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -13.503 5.754 4.950 1.00 0.00 H new ATOM 0 HG LEU A 112 -12.910 8.258 4.681 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.650 8.678 3.798 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.605 8.116 5.486 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.199 6.996 4.165 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -12.449 7.935 2.281 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -12.068 6.224 2.590 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -13.718 6.832 2.864 1.00 0.00 H new ATOM 1801 N ASP A 113 -13.951 8.629 6.863 1.00 0.00 N ATOM 1802 CA ASP A 113 -15.121 9.473 7.075 1.00 0.00 C ATOM 1803 C ASP A 113 -15.355 10.388 5.878 1.00 0.00 C ATOM 1804 O ASP A 113 -14.436 10.719 5.128 1.00 0.00 O ATOM 1805 CB ASP A 113 -14.950 10.308 8.346 1.00 0.00 C ATOM 1806 CG ASP A 113 -15.379 9.559 9.592 1.00 0.00 C ATOM 1807 OD1 ASP A 113 -16.574 9.212 9.695 1.00 0.00 O ATOM 1808 OD2 ASP A 113 -14.519 9.320 10.465 1.00 0.00 O ATOM 0 H ASP A 113 -13.111 9.135 6.582 1.00 0.00 H new ATOM 0 HA ASP A 113 -15.990 8.825 7.189 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -13.906 10.604 8.445 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -15.534 11.224 8.257 1.00 0.00 H new ATOM 1813 N PRO A 114 -16.615 10.808 5.691 1.00 0.00 N ATOM 1814 CA PRO A 114 -17.000 11.691 4.586 1.00 0.00 C ATOM 1815 C PRO A 114 -16.451 13.103 4.753 1.00 0.00 C ATOM 1816 O PRO A 114 -16.691 13.975 3.918 1.00 0.00 O ATOM 1817 CB PRO A 114 -18.529 11.700 4.655 1.00 0.00 C ATOM 1818 CG PRO A 114 -18.846 11.385 6.076 1.00 0.00 C ATOM 1819 CD PRO A 114 -17.762 10.454 6.545 1.00 0.00 C ATOM 0 HA PRO A 114 -16.605 11.344 3.631 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -18.933 12.670 4.365 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -18.960 10.961 3.980 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -18.871 12.292 6.681 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -19.827 10.917 6.163 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -17.536 10.600 7.601 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -18.048 9.409 6.421 1.00 0.00 H new ATOM 1827 N GLU A 115 -15.712 13.321 5.836 1.00 0.00 N ATOM 1828 CA GLU A 115 -15.129 14.629 6.112 1.00 0.00 C ATOM 1829 C GLU A 115 -13.607 14.577 6.017 1.00 0.00 C ATOM 1830 O GLU A 115 -12.964 15.553 5.629 1.00 0.00 O ATOM 1831 CB GLU A 115 -15.548 15.117 7.500 1.00 0.00 C ATOM 1832 CG GLU A 115 -14.896 14.349 8.638 1.00 0.00 C ATOM 1833 CD GLU A 115 -15.631 14.517 9.953 1.00 0.00 C ATOM 1834 OE1 GLU A 115 -15.709 15.661 10.448 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -16.130 13.504 10.487 1.00 0.00 O ATOM 0 H GLU A 115 -15.503 12.609 6.536 1.00 0.00 H new ATOM 0 HA GLU A 115 -15.499 15.328 5.362 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -15.297 16.173 7.595 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.631 15.037 7.592 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -14.857 13.290 8.381 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -13.866 14.687 8.756 1.00 0.00 H new ATOM 1842 N PHE A 116 -13.036 13.431 6.375 1.00 0.00 N ATOM 1843 CA PHE A 116 -11.590 13.251 6.332 1.00 0.00 C ATOM 1844 C PHE A 116 -11.123 12.932 4.915 1.00 0.00 C ATOM 1845 O PHE A 116 -10.063 13.384 4.483 1.00 0.00 O ATOM 1846 CB PHE A 116 -11.165 12.132 7.285 1.00 0.00 C ATOM 1847 CG PHE A 116 -9.679 11.920 7.337 1.00 0.00 C ATOM 1848 CD1 PHE A 116 -8.833 12.948 7.720 1.00 0.00 C ATOM 1849 CD2 PHE A 116 -9.129 10.693 7.003 1.00 0.00 C ATOM 1850 CE1 PHE A 116 -7.465 12.756 7.769 1.00 0.00 C ATOM 1851 CE2 PHE A 116 -7.762 10.496 7.050 1.00 0.00 C ATOM 1852 CZ PHE A 116 -6.929 11.529 7.433 1.00 0.00 C ATOM 0 H PHE A 116 -13.553 12.613 6.698 1.00 0.00 H new ATOM 0 HA PHE A 116 -11.124 14.184 6.648 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -11.526 12.363 8.287 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -11.646 11.203 6.979 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -9.247 13.910 7.983 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -9.776 9.882 6.703 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -6.816 13.565 8.070 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -7.345 9.535 6.787 1.00 0.00 H new ATOM 0 HZ PHE A 116 -5.860 11.377 7.470 1.00 0.00 H new ATOM 1862 N ASN A 117 -11.923 12.150 4.197 1.00 0.00 N ATOM 1863 CA ASN A 117 -11.592 11.768 2.829 1.00 0.00 C ATOM 1864 C ASN A 117 -11.482 12.998 1.933 1.00 0.00 C ATOM 1865 O ASN A 117 -10.547 13.123 1.141 1.00 0.00 O ATOM 1866 CB ASN A 117 -12.649 10.812 2.274 1.00 0.00 C ATOM 1867 CG ASN A 117 -12.289 10.287 0.898 1.00 0.00 C ATOM 1868 OD1 ASN A 117 -11.494 9.356 0.764 1.00 0.00 O ATOM 1869 ND2 ASN A 117 -12.874 10.884 -0.134 1.00 0.00 N ATOM 0 H ASN A 117 -12.805 11.769 4.540 1.00 0.00 H new ATOM 0 HA ASN A 117 -10.626 11.262 2.843 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -12.772 9.973 2.959 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -13.609 11.326 2.224 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -12.671 10.575 -1.084 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -13.527 11.652 0.024 1.00 0.00 H new ATOM 1876 N LYS A 118 -12.444 13.906 2.063 1.00 0.00 N ATOM 1877 CA LYS A 118 -12.456 15.128 1.268 1.00 0.00 C ATOM 1878 C LYS A 118 -11.170 15.923 1.472 1.00 0.00 C ATOM 1879 O LYS A 118 -10.645 16.525 0.534 1.00 0.00 O ATOM 1880 CB LYS A 118 -13.665 15.990 1.638 1.00 0.00 C ATOM 1881 CG LYS A 118 -14.965 15.208 1.727 1.00 0.00 C ATOM 1882 CD LYS A 118 -16.173 16.129 1.692 1.00 0.00 C ATOM 1883 CE LYS A 118 -15.965 17.354 2.569 1.00 0.00 C ATOM 1884 NZ LYS A 118 -17.191 18.196 2.646 1.00 0.00 N ATOM 0 H LYS A 118 -13.226 13.818 2.712 1.00 0.00 H new ATOM 0 HA LYS A 118 -12.526 14.847 0.217 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -13.476 16.474 2.596 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -13.777 16.782 0.897 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -15.022 14.500 0.900 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -14.978 14.625 2.648 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -16.363 16.443 0.666 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -17.056 15.585 2.028 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -15.678 17.038 3.572 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -15.141 17.948 2.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -17.008 19.021 3.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -17.451 18.519 1.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -17.971 17.637 3.047 1.00 0.00 H new ATOM 1898 N LEU A 119 -10.668 15.921 2.702 1.00 0.00 N ATOM 1899 CA LEU A 119 -9.442 16.641 3.028 1.00 0.00 C ATOM 1900 C LEU A 119 -8.248 16.049 2.286 1.00 0.00 C ATOM 1901 O LEU A 119 -7.366 16.776 1.829 1.00 0.00 O ATOM 1902 CB LEU A 119 -9.190 16.601 4.537 1.00 0.00 C ATOM 1903 CG LEU A 119 -10.083 17.501 5.391 1.00 0.00 C ATOM 1904 CD1 LEU A 119 -10.018 17.086 6.852 1.00 0.00 C ATOM 1905 CD2 LEU A 119 -9.679 18.959 5.230 1.00 0.00 C ATOM 0 H LEU A 119 -11.091 15.429 3.489 1.00 0.00 H new ATOM 0 HA LEU A 119 -9.564 17.677 2.713 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -9.312 15.573 4.878 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.151 16.876 4.719 1.00 0.00 H new ATOM 0 HG LEU A 119 -11.112 17.390 5.049 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -10.660 17.738 7.444 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -10.356 16.055 6.953 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.991 17.167 7.208 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -10.325 19.586 5.845 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -8.643 19.086 5.545 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -9.779 19.251 4.185 1.00 0.00 H new ATOM 1917 N CYS A 120 -8.229 14.726 2.168 1.00 0.00 N ATOM 1918 CA CYS A 120 -7.144 14.036 1.479 1.00 0.00 C ATOM 1919 C CYS A 120 -7.149 14.364 -0.010 1.00 0.00 C ATOM 1920 O CYS A 120 -6.207 14.964 -0.526 1.00 0.00 O ATOM 1921 CB CYS A 120 -7.264 12.524 1.681 1.00 0.00 C ATOM 1922 SG CYS A 120 -6.785 11.959 3.330 1.00 0.00 S ATOM 0 H CYS A 120 -8.952 14.110 2.540 1.00 0.00 H new ATOM 0 HA CYS A 120 -6.201 14.379 1.904 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -8.294 12.224 1.491 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -6.643 12.019 0.941 1.00 0.00 H new ATOM 0 HG CYS A 120 -7.606 11.032 3.726 1.00 0.00 H new ATOM 1928 N GLU A 121 -8.216 13.965 -0.695 1.00 0.00 N ATOM 1929 CA GLU A 121 -8.342 14.215 -2.126 1.00 0.00 C ATOM 1930 C GLU A 121 -8.035 15.674 -2.453 1.00 0.00 C ATOM 1931 O GLU A 121 -7.664 16.003 -3.579 1.00 0.00 O ATOM 1932 CB GLU A 121 -9.751 13.860 -2.607 1.00 0.00 C ATOM 1933 CG GLU A 121 -10.851 14.609 -1.875 1.00 0.00 C ATOM 1934 CD GLU A 121 -12.203 14.464 -2.546 1.00 0.00 C ATOM 1935 OE1 GLU A 121 -12.792 13.366 -2.460 1.00 0.00 O ATOM 1936 OE2 GLU A 121 -12.671 15.447 -3.157 1.00 0.00 O ATOM 0 H GLU A 121 -9.005 13.468 -0.282 1.00 0.00 H new ATOM 0 HA GLU A 121 -7.619 13.584 -2.643 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -9.826 14.073 -3.673 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -9.909 12.789 -2.484 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -10.917 14.241 -0.851 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -10.590 15.666 -1.818 1.00 0.00 H new ATOM 1943 N GLU A 122 -8.192 16.542 -1.459 1.00 0.00 N ATOM 1944 CA GLU A 122 -7.933 17.966 -1.641 1.00 0.00 C ATOM 1945 C GLU A 122 -6.452 18.219 -1.909 1.00 0.00 C ATOM 1946 O GLU A 122 -6.091 18.878 -2.884 1.00 0.00 O ATOM 1947 CB GLU A 122 -8.380 18.750 -0.406 1.00 0.00 C ATOM 1948 CG GLU A 122 -8.784 20.183 -0.708 1.00 0.00 C ATOM 1949 CD GLU A 122 -10.031 20.269 -1.566 1.00 0.00 C ATOM 1950 OE1 GLU A 122 -11.102 19.823 -1.101 1.00 0.00 O ATOM 1951 OE2 GLU A 122 -9.938 20.780 -2.701 1.00 0.00 O ATOM 0 H GLU A 122 -8.497 16.285 -0.520 1.00 0.00 H new ATOM 0 HA GLU A 122 -8.504 18.306 -2.505 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -9.221 18.234 0.057 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -7.570 18.756 0.323 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -8.955 20.713 0.229 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -7.963 20.689 -1.216 1.00 0.00 H new ATOM 1958 N ILE A 123 -5.600 17.690 -1.037 1.00 0.00 N ATOM 1959 CA ILE A 123 -4.159 17.858 -1.180 1.00 0.00 C ATOM 1960 C ILE A 123 -3.664 17.268 -2.496 1.00 0.00 C ATOM 1961 O ILE A 123 -2.714 17.770 -3.097 1.00 0.00 O ATOM 1962 CB ILE A 123 -3.397 17.198 -0.016 1.00 0.00 C ATOM 1963 CG1 ILE A 123 -3.845 17.795 1.320 1.00 0.00 C ATOM 1964 CG2 ILE A 123 -1.897 17.367 -0.201 1.00 0.00 C ATOM 1965 CD1 ILE A 123 -3.745 16.828 2.478 1.00 0.00 C ATOM 0 H ILE A 123 -5.882 17.142 -0.225 1.00 0.00 H new ATOM 0 HA ILE A 123 -3.964 18.930 -1.170 1.00 0.00 H new ATOM 0 HB ILE A 123 -3.625 16.132 -0.011 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.238 18.674 1.538 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.877 18.135 1.229 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -1.372 16.895 0.630 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -1.591 16.899 -1.136 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -1.651 18.429 -0.229 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -4.079 17.319 3.392 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -4.374 15.960 2.282 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.710 16.507 2.596 1.00 0.00 H new ATOM 1977 N LYS A 124 -4.317 16.199 -2.941 1.00 0.00 N ATOM 1978 CA LYS A 124 -3.947 15.540 -4.188 1.00 0.00 C ATOM 1979 C LYS A 124 -3.979 16.524 -5.353 1.00 0.00 C ATOM 1980 O LYS A 124 -3.386 16.276 -6.402 1.00 0.00 O ATOM 1981 CB LYS A 124 -4.890 14.369 -4.469 1.00 0.00 C ATOM 1982 CG LYS A 124 -4.615 13.669 -5.789 1.00 0.00 C ATOM 1983 CD LYS A 124 -5.006 12.202 -5.735 1.00 0.00 C ATOM 1984 CE LYS A 124 -6.487 12.009 -6.018 1.00 0.00 C ATOM 1985 NZ LYS A 124 -6.754 11.820 -7.471 1.00 0.00 N ATOM 0 H LYS A 124 -5.105 15.771 -2.456 1.00 0.00 H new ATOM 0 HA LYS A 124 -2.930 15.162 -4.083 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -4.807 13.644 -3.659 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -5.918 14.733 -4.467 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -5.168 14.165 -6.587 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -3.556 13.755 -6.034 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -4.419 11.641 -6.463 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -4.767 11.797 -4.752 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -6.852 11.143 -5.466 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -7.042 12.875 -5.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -7.775 11.692 -7.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -6.429 12.657 -7.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -6.245 10.979 -7.811 1.00 0.00 H new ATOM 1999 N GLU A 125 -4.675 17.640 -5.160 1.00 0.00 N ATOM 2000 CA GLU A 125 -4.783 18.661 -6.196 1.00 0.00 C ATOM 2001 C GLU A 125 -3.618 19.643 -6.116 1.00 0.00 C ATOM 2002 O GLU A 125 -3.634 20.695 -6.755 1.00 0.00 O ATOM 2003 CB GLU A 125 -6.109 19.413 -6.065 1.00 0.00 C ATOM 2004 CG GLU A 125 -7.250 18.775 -6.839 1.00 0.00 C ATOM 2005 CD GLU A 125 -6.990 18.731 -8.332 1.00 0.00 C ATOM 2006 OE1 GLU A 125 -6.980 19.808 -8.965 1.00 0.00 O ATOM 2007 OE2 GLU A 125 -6.796 17.620 -8.868 1.00 0.00 O ATOM 0 H GLU A 125 -5.172 17.860 -4.297 1.00 0.00 H new ATOM 0 HA GLU A 125 -4.750 18.164 -7.165 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -6.383 19.469 -5.011 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -5.972 20.437 -6.414 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -7.411 17.761 -6.472 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -8.168 19.332 -6.650 1.00 0.00 H new ATOM 2014 N SER A 126 -2.609 19.292 -5.326 1.00 0.00 N ATOM 2015 CA SER A 126 -1.437 20.144 -5.158 1.00 0.00 C ATOM 2016 C SER A 126 -1.842 21.539 -4.691 1.00 0.00 C ATOM 2017 O SER A 126 -1.283 22.541 -5.136 1.00 0.00 O ATOM 2018 CB SER A 126 -0.657 20.239 -6.470 1.00 0.00 C ATOM 2019 OG SER A 126 -1.297 21.114 -7.382 1.00 0.00 O ATOM 0 H SER A 126 -2.579 18.424 -4.792 1.00 0.00 H new ATOM 0 HA SER A 126 -0.799 19.696 -4.396 1.00 0.00 H new ATOM 0 HB2 SER A 126 0.354 20.593 -6.270 1.00 0.00 H new ATOM 0 HB3 SER A 126 -0.566 19.248 -6.915 1.00 0.00 H new ATOM 0 HG SER A 126 -2.244 21.198 -7.145 1.00 0.00 H new ATOM 2025 N GLY A 127 -2.820 21.595 -3.792 1.00 0.00 N ATOM 2026 CA GLY A 127 -3.284 22.871 -3.280 1.00 0.00 C ATOM 2027 C GLY A 127 -4.796 22.958 -3.225 1.00 0.00 C ATOM 2028 O GLY A 127 -5.489 22.729 -4.217 1.00 0.00 O ATOM 0 H GLY A 127 -3.299 20.780 -3.409 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -2.878 23.028 -2.281 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -2.900 23.673 -3.910 1.00 0.00 H new ATOM 2032 N PRO A 128 -5.331 23.294 -2.042 1.00 0.00 N ATOM 2033 CA PRO A 128 -6.777 23.417 -1.833 1.00 0.00 C ATOM 2034 C PRO A 128 -7.366 24.625 -2.553 1.00 0.00 C ATOM 2035 O PRO A 128 -7.363 25.737 -2.024 1.00 0.00 O ATOM 2036 CB PRO A 128 -6.903 23.584 -0.316 1.00 0.00 C ATOM 2037 CG PRO A 128 -5.597 24.159 0.111 1.00 0.00 C ATOM 2038 CD PRO A 128 -4.566 23.580 -0.817 1.00 0.00 C ATOM 0 HA PRO A 128 -7.321 22.559 -2.228 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -7.730 24.245 -0.058 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -7.094 22.629 0.173 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -5.611 25.247 0.049 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -5.378 23.902 1.147 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -3.755 24.283 -1.005 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -4.116 22.677 -0.404 1.00 0.00 H new ATOM 2046 N SER A 129 -7.871 24.399 -3.761 1.00 0.00 N ATOM 2047 CA SER A 129 -8.461 25.471 -4.555 1.00 0.00 C ATOM 2048 C SER A 129 -9.148 24.911 -5.797 1.00 0.00 C ATOM 2049 O SER A 129 -8.571 24.110 -6.532 1.00 0.00 O ATOM 2050 CB SER A 129 -7.387 26.481 -4.965 1.00 0.00 C ATOM 2051 OG SER A 129 -7.971 27.690 -5.420 1.00 0.00 O ATOM 0 H SER A 129 -7.884 23.484 -4.212 1.00 0.00 H new ATOM 0 HA SER A 129 -9.209 25.975 -3.942 1.00 0.00 H new ATOM 0 HB2 SER A 129 -6.733 26.686 -4.117 1.00 0.00 H new ATOM 0 HB3 SER A 129 -6.764 26.055 -5.752 1.00 0.00 H new ATOM 0 HG SER A 129 -7.264 28.319 -5.674 1.00 0.00 H new ATOM 2057 N SER A 130 -10.386 25.340 -6.025 1.00 0.00 N ATOM 2058 CA SER A 130 -11.155 24.880 -7.175 1.00 0.00 C ATOM 2059 C SER A 130 -11.232 25.965 -8.246 1.00 0.00 C ATOM 2060 O SER A 130 -10.693 27.058 -8.078 1.00 0.00 O ATOM 2061 CB SER A 130 -12.565 24.473 -6.743 1.00 0.00 C ATOM 2062 OG SER A 130 -13.182 25.499 -5.985 1.00 0.00 O ATOM 0 H SER A 130 -10.877 26.005 -5.428 1.00 0.00 H new ATOM 0 HA SER A 130 -10.648 24.012 -7.597 1.00 0.00 H new ATOM 0 HB2 SER A 130 -13.169 24.253 -7.623 1.00 0.00 H new ATOM 0 HB3 SER A 130 -12.518 23.558 -6.152 1.00 0.00 H new ATOM 0 HG SER A 130 -14.083 25.215 -5.722 1.00 0.00 H new ATOM 2068 N GLY A 131 -11.908 25.653 -9.347 1.00 0.00 N ATOM 2069 CA GLY A 131 -12.044 26.609 -10.430 1.00 0.00 C ATOM 2070 C GLY A 131 -13.063 27.689 -10.125 1.00 0.00 C ATOM 2071 O GLY A 131 -13.036 28.765 -10.723 1.00 0.00 O ATOM 0 H GLY A 131 -12.364 24.755 -9.508 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -11.077 27.071 -10.626 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -12.337 26.084 -11.339 1.00 0.00 H new TER 2075 GLY A 131