USER MOD reduce.3.24.130724 H: found=0, std=0, add=781, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 778 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 38 THR OG1 : rot 180:sc= 0.419 USER MOD Set 1.2: A 41 ASN : amide:sc= 0.467 K(o=0.89,f=0.059) USER MOD Set 2.1: A 22 LYS NZ :NH3+ -114:sc= 0.409 (180deg=0) USER MOD Set 2.2: A 26 GLN : amide:sc= -0.923! C(o=-0.51!,f=-1.6!) USER MOD Single : A 1 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 THR OG1 : rot -50:sc= 0.0611 USER MOD Single : A 5 ASN : amide:sc= -2.54! K(o=-2.5!,f=-0.33) USER MOD Single : A 14 ASN : amide:sc= 0.39 X(o=0.39,f=0) USER MOD Single : A 16 HIS : no HD1:sc= -0.0643 K(o=-0.064,f=-3.5!) USER MOD Single : A 20 THR OG1 : rot 180:sc= -1.41 USER MOD Single : A 23 GLN : amide:sc= -2.75! K(o=-2.7!,f=-0.033) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 ASN : amide:sc= -2.21 K(o=-2.2,f=-0.62) USER MOD Single : A 36 SER OG : rot -29:sc= -1.27! USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot 74:sc= -1.22 USER MOD Single : A 53 LYS NZ :NH3+ 147:sc= 1.26 (180deg=1.05) USER MOD Single : A 54 LYS NZ :NH3+ -179:sc= 1.2 (180deg=1.13) USER MOD Single : A 56 HIS : no HD1:sc= -7.75! C(o=-5.9!,f=-19!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0103) USER MOD Single : A 69 LYS NZ :NH3+ 164:sc= -0.054 (180deg=-0.319) USER MOD Single : A 70 ASN : amide:sc= -0.0193 X(o=-0.019,f=-0.47) USER MOD Single : A 75 MET CE :methyl 145:sc= -2.2 (180deg=-4.47!) USER MOD Single : A 78 LYS NZ :NH3+ 174:sc= 0.53 (180deg=0.412) USER MOD Single : A 80 SER OG : rot 180:sc= 0.00232 USER MOD Single : A 81 LYS NZ :NH3+ -152:sc= 0 (180deg=-0.0205) USER MOD Single : A 85 LYS NZ :NH3+ 164:sc= -0.064 (180deg=-0.277) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0.784 (180deg=0.784) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -8.037 20.048 0.336 1.00 0.00 N ATOM 2 CA SER A 1 -7.802 20.714 1.634 1.00 0.00 C ATOM 3 C SER A 1 -6.611 20.079 2.341 1.00 0.00 C ATOM 4 O SER A 1 -5.693 20.768 2.796 1.00 0.00 O ATOM 5 CB SER A 1 -9.056 20.594 2.497 1.00 0.00 C ATOM 6 OG SER A 1 -10.210 20.977 1.767 1.00 0.00 O ATOM 0 H1 SER A 1 -8.851 20.489 -0.138 1.00 0.00 H new ATOM 0 H2 SER A 1 -7.193 20.147 -0.263 1.00 0.00 H new ATOM 0 H3 SER A 1 -8.233 19.039 0.494 1.00 0.00 H new ATOM 0 HA SER A 1 -7.581 21.768 1.466 1.00 0.00 H new ATOM 0 HB2 SER A 1 -9.165 19.567 2.846 1.00 0.00 H new ATOM 0 HB3 SER A 1 -8.955 21.222 3.382 1.00 0.00 H new ATOM 0 HG SER A 1 -11.002 20.891 2.338 1.00 0.00 H new ATOM 11 N ASN A 2 -6.625 18.757 2.418 1.00 0.00 N ATOM 12 CA ASN A 2 -5.529 18.006 3.010 1.00 0.00 C ATOM 13 C ASN A 2 -5.196 16.829 2.116 1.00 0.00 C ATOM 14 O ASN A 2 -5.801 16.664 1.056 1.00 0.00 O ATOM 15 CB ASN A 2 -5.899 17.482 4.406 1.00 0.00 C ATOM 16 CG ASN A 2 -6.258 18.581 5.385 1.00 0.00 C ATOM 17 OD1 ASN A 2 -7.421 18.974 5.495 1.00 0.00 O ATOM 18 ND2 ASN A 2 -5.268 19.077 6.108 1.00 0.00 N ATOM 0 H ASN A 2 -7.391 18.178 2.074 1.00 0.00 H new ATOM 0 HA ASN A 2 -4.672 18.672 3.108 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -6.741 16.795 4.317 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -5.062 16.909 4.805 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -5.453 19.814 6.789 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -4.319 18.723 5.985 1.00 0.00 H new ATOM 25 N THR A 3 -4.238 16.018 2.533 1.00 0.00 N ATOM 26 CA THR A 3 -3.998 14.749 1.882 1.00 0.00 C ATOM 27 C THR A 3 -5.237 13.873 2.074 1.00 0.00 C ATOM 28 O THR A 3 -6.041 14.110 2.983 1.00 0.00 O ATOM 29 CB THR A 3 -2.732 14.064 2.453 1.00 0.00 C ATOM 30 OG1 THR A 3 -2.347 12.954 1.642 1.00 0.00 O ATOM 31 CG2 THR A 3 -2.948 13.582 3.881 1.00 0.00 C ATOM 0 H THR A 3 -3.618 16.218 3.317 1.00 0.00 H new ATOM 0 HA THR A 3 -3.819 14.904 0.818 1.00 0.00 H new ATOM 0 HB THR A 3 -1.940 14.813 2.452 1.00 0.00 H new ATOM 0 HG1 THR A 3 -3.123 12.375 1.490 1.00 0.00 H new ATOM 0 HG21 THR A 3 -2.037 13.107 4.246 1.00 0.00 H new ATOM 0 HG22 THR A 3 -3.195 14.431 4.518 1.00 0.00 H new ATOM 0 HG23 THR A 3 -3.766 12.862 3.902 1.00 0.00 H new ATOM 39 N ARG A 4 -5.410 12.869 1.238 1.00 0.00 N ATOM 40 CA ARG A 4 -6.651 12.134 1.251 1.00 0.00 C ATOM 41 C ARG A 4 -6.569 10.913 2.134 1.00 0.00 C ATOM 42 O ARG A 4 -5.665 10.087 2.029 1.00 0.00 O ATOM 43 CB ARG A 4 -7.093 11.787 -0.159 1.00 0.00 C ATOM 44 CG ARG A 4 -6.092 10.954 -0.931 1.00 0.00 C ATOM 45 CD ARG A 4 -6.059 11.335 -2.397 1.00 0.00 C ATOM 46 NE ARG A 4 -7.326 11.060 -3.070 1.00 0.00 N ATOM 47 CZ ARG A 4 -7.844 11.828 -4.024 1.00 0.00 C ATOM 48 NH1 ARG A 4 -7.254 12.964 -4.367 1.00 0.00 N ATOM 49 NH2 ARG A 4 -8.970 11.458 -4.617 1.00 0.00 N ATOM 0 H ARG A 4 -4.721 12.551 0.556 1.00 0.00 H new ATOM 0 HA ARG A 4 -7.415 12.781 1.683 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -8.038 11.247 -0.110 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -7.282 12.710 -0.707 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -5.100 11.084 -0.499 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -6.346 9.898 -0.835 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -5.824 12.395 -2.489 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -5.259 10.787 -2.895 1.00 0.00 H new ATOM 0 HE ARG A 4 -7.845 10.228 -2.791 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -6.396 13.255 -3.898 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -7.658 13.547 -5.100 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -9.431 10.591 -4.340 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -9.376 12.040 -5.350 1.00 0.00 H new ATOM 63 N ASN A 5 -7.511 10.864 3.049 1.00 0.00 N ATOM 64 CA ASN A 5 -7.597 9.794 4.017 1.00 0.00 C ATOM 65 C ASN A 5 -8.412 8.638 3.458 1.00 0.00 C ATOM 66 O ASN A 5 -9.364 8.843 2.704 1.00 0.00 O ATOM 67 CB ASN A 5 -8.223 10.298 5.323 1.00 0.00 C ATOM 68 CG ASN A 5 -7.316 11.194 6.139 1.00 0.00 C ATOM 69 OD1 ASN A 5 -7.342 11.165 7.369 1.00 0.00 O ATOM 70 ND2 ASN A 5 -6.538 12.019 5.472 1.00 0.00 N ATOM 0 H ASN A 5 -8.242 11.569 3.143 1.00 0.00 H new ATOM 0 HA ASN A 5 -6.588 9.442 4.229 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -9.138 10.842 5.088 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -8.510 9.440 5.931 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -5.929 12.664 5.975 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -6.544 12.014 4.452 1.00 0.00 H new ATOM 77 N PHE A 6 -8.032 7.431 3.830 1.00 0.00 N ATOM 78 CA PHE A 6 -8.701 6.227 3.374 1.00 0.00 C ATOM 79 C PHE A 6 -9.057 5.351 4.564 1.00 0.00 C ATOM 80 O PHE A 6 -8.648 5.622 5.690 1.00 0.00 O ATOM 81 CB PHE A 6 -7.800 5.425 2.427 1.00 0.00 C ATOM 82 CG PHE A 6 -7.499 6.093 1.112 1.00 0.00 C ATOM 83 CD1 PHE A 6 -6.623 7.160 1.046 1.00 0.00 C ATOM 84 CD2 PHE A 6 -8.071 5.629 -0.060 1.00 0.00 C ATOM 85 CE1 PHE A 6 -6.324 7.755 -0.162 1.00 0.00 C ATOM 86 CE2 PHE A 6 -7.778 6.224 -1.275 1.00 0.00 C ATOM 87 CZ PHE A 6 -6.903 7.289 -1.324 1.00 0.00 C ATOM 0 H PHE A 6 -7.248 7.257 4.459 1.00 0.00 H new ATOM 0 HA PHE A 6 -9.604 6.526 2.842 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -6.858 5.218 2.935 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -8.273 4.463 2.228 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -6.167 7.532 1.951 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -8.754 4.793 -0.026 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -5.636 8.587 -0.198 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -8.233 5.855 -2.182 1.00 0.00 H new ATOM 0 HZ PHE A 6 -6.672 7.757 -2.270 1.00 0.00 H new ATOM 97 N VAL A 7 -9.834 4.317 4.303 1.00 0.00 N ATOM 98 CA VAL A 7 -10.089 3.278 5.280 1.00 0.00 C ATOM 99 C VAL A 7 -9.842 1.935 4.617 1.00 0.00 C ATOM 100 O VAL A 7 -10.143 1.766 3.436 1.00 0.00 O ATOM 101 CB VAL A 7 -11.541 3.297 5.812 1.00 0.00 C ATOM 102 CG1 VAL A 7 -11.687 2.365 7.000 1.00 0.00 C ATOM 103 CG2 VAL A 7 -11.982 4.692 6.194 1.00 0.00 C ATOM 0 H VAL A 7 -10.305 4.175 3.409 1.00 0.00 H new ATOM 0 HA VAL A 7 -9.426 3.450 6.128 1.00 0.00 H new ATOM 0 HB VAL A 7 -12.185 2.951 5.003 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -12.716 2.393 7.360 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -11.435 1.348 6.698 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -11.015 2.684 7.797 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -13.007 4.661 6.563 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -11.327 5.080 6.974 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -11.930 5.342 5.321 1.00 0.00 H new ATOM 113 N LEU A 8 -9.281 0.998 5.354 1.00 0.00 N ATOM 114 CA LEU A 8 -9.028 -0.333 4.807 1.00 0.00 C ATOM 115 C LEU A 8 -10.311 -1.146 4.744 1.00 0.00 C ATOM 116 O LEU A 8 -10.985 -1.313 5.760 1.00 0.00 O ATOM 117 CB LEU A 8 -8.018 -1.088 5.660 1.00 0.00 C ATOM 118 CG LEU A 8 -7.666 -2.485 5.160 1.00 0.00 C ATOM 119 CD1 LEU A 8 -6.410 -2.437 4.307 1.00 0.00 C ATOM 120 CD2 LEU A 8 -7.506 -3.444 6.330 1.00 0.00 C ATOM 0 H LEU A 8 -8.992 1.124 6.324 1.00 0.00 H new ATOM 0 HA LEU A 8 -8.630 -0.198 3.801 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.103 -0.499 5.719 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -8.411 -1.170 6.674 1.00 0.00 H new ATOM 0 HG LEU A 8 -8.481 -2.854 4.538 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.170 -3.441 3.956 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -6.577 -1.784 3.451 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -5.581 -2.052 4.901 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -7.255 -4.436 5.955 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -6.709 -3.091 6.984 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -8.440 -3.493 6.890 1.00 0.00 H new ATOM 132 N ARG A 9 -10.640 -1.654 3.559 1.00 0.00 N ATOM 133 CA ARG A 9 -11.771 -2.556 3.406 1.00 0.00 C ATOM 134 C ARG A 9 -11.275 -3.990 3.431 1.00 0.00 C ATOM 135 O ARG A 9 -10.325 -4.334 2.727 1.00 0.00 O ATOM 136 CB ARG A 9 -12.508 -2.289 2.087 1.00 0.00 C ATOM 137 CG ARG A 9 -13.254 -0.966 2.059 1.00 0.00 C ATOM 138 CD ARG A 9 -14.765 -1.160 2.079 1.00 0.00 C ATOM 139 NE ARG A 9 -15.260 -1.834 0.869 1.00 0.00 N ATOM 140 CZ ARG A 9 -16.509 -2.288 0.723 1.00 0.00 C ATOM 141 NH1 ARG A 9 -17.408 -2.094 1.677 1.00 0.00 N ATOM 142 NH2 ARG A 9 -16.872 -2.921 -0.387 1.00 0.00 N ATOM 0 H ARG A 9 -10.138 -1.455 2.694 1.00 0.00 H new ATOM 0 HA ARG A 9 -12.466 -2.388 4.228 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -11.788 -2.307 1.269 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -13.215 -3.098 1.906 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -12.955 -0.363 2.917 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -12.972 -0.410 1.165 1.00 0.00 H new ATOM 0 HD2 ARG A 9 -15.042 -1.745 2.956 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -15.252 -0.190 2.176 1.00 0.00 H new ATOM 0 HE ARG A 9 -14.610 -1.963 0.093 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -17.149 -1.596 2.528 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -18.359 -2.443 1.560 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -16.196 -3.064 -1.137 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -17.827 -3.264 -0.489 1.00 0.00 H new ATOM 156 N ASP A 10 -11.897 -4.827 4.247 1.00 0.00 N ATOM 157 CA ASP A 10 -11.498 -6.222 4.313 1.00 0.00 C ATOM 158 C ASP A 10 -12.249 -7.048 3.279 1.00 0.00 C ATOM 159 O ASP A 10 -12.915 -6.496 2.400 1.00 0.00 O ATOM 160 CB ASP A 10 -11.700 -6.805 5.721 1.00 0.00 C ATOM 161 CG ASP A 10 -13.130 -6.741 6.230 1.00 0.00 C ATOM 162 OD1 ASP A 10 -14.059 -6.534 5.426 1.00 0.00 O ATOM 163 OD2 ASP A 10 -13.325 -6.883 7.455 1.00 0.00 O ATOM 0 H ASP A 10 -12.668 -4.569 4.863 1.00 0.00 H new ATOM 0 HA ASP A 10 -10.433 -6.267 4.087 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -11.374 -7.845 5.720 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -11.055 -6.270 6.418 1.00 0.00 H new ATOM 168 N GLU A 11 -12.087 -8.363 3.371 1.00 0.00 N ATOM 169 CA GLU A 11 -12.742 -9.315 2.474 1.00 0.00 C ATOM 170 C GLU A 11 -14.201 -8.970 2.195 1.00 0.00 C ATOM 171 O GLU A 11 -14.644 -9.017 1.045 1.00 0.00 O ATOM 172 CB GLU A 11 -12.642 -10.724 3.051 1.00 0.00 C ATOM 173 CG GLU A 11 -11.218 -11.240 3.146 1.00 0.00 C ATOM 174 CD GLU A 11 -11.157 -12.639 3.712 1.00 0.00 C ATOM 175 OE1 GLU A 11 -11.728 -13.557 3.087 1.00 0.00 O ATOM 176 OE2 GLU A 11 -10.535 -12.827 4.777 1.00 0.00 O ATOM 0 H GLU A 11 -11.494 -8.804 4.074 1.00 0.00 H new ATOM 0 HA GLU A 11 -12.218 -9.260 1.520 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -13.091 -10.734 4.044 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -13.226 -11.404 2.431 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -10.762 -11.230 2.156 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -10.631 -10.570 3.774 1.00 0.00 H new ATOM 183 N ASP A 12 -14.952 -8.655 3.234 1.00 0.00 N ATOM 184 CA ASP A 12 -16.349 -8.266 3.069 1.00 0.00 C ATOM 185 C ASP A 12 -16.470 -6.794 2.699 1.00 0.00 C ATOM 186 O ASP A 12 -17.318 -6.409 1.890 1.00 0.00 O ATOM 187 CB ASP A 12 -17.139 -8.546 4.350 1.00 0.00 C ATOM 188 CG ASP A 12 -18.564 -8.038 4.270 1.00 0.00 C ATOM 189 OD1 ASP A 12 -19.400 -8.696 3.617 1.00 0.00 O ATOM 190 OD2 ASP A 12 -18.861 -6.982 4.865 1.00 0.00 O ATOM 0 H ASP A 12 -14.624 -8.659 4.200 1.00 0.00 H new ATOM 0 HA ASP A 12 -16.765 -8.861 2.256 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -17.148 -9.619 4.541 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -16.635 -8.076 5.195 1.00 0.00 H new ATOM 195 N GLY A 13 -15.609 -5.976 3.280 1.00 0.00 N ATOM 196 CA GLY A 13 -15.639 -4.564 2.985 1.00 0.00 C ATOM 197 C GLY A 13 -15.823 -3.712 4.222 1.00 0.00 C ATOM 198 O GLY A 13 -16.500 -2.684 4.189 1.00 0.00 O ATOM 0 H GLY A 13 -14.893 -6.264 3.947 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -14.711 -4.281 2.489 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -16.449 -4.361 2.285 1.00 0.00 H new ATOM 202 N ASN A 14 -15.223 -4.134 5.317 1.00 0.00 N ATOM 203 CA ASN A 14 -15.379 -3.435 6.583 1.00 0.00 C ATOM 204 C ASN A 14 -14.371 -2.312 6.690 1.00 0.00 C ATOM 205 O ASN A 14 -13.598 -2.070 5.766 1.00 0.00 O ATOM 206 CB ASN A 14 -15.202 -4.390 7.763 1.00 0.00 C ATOM 207 CG ASN A 14 -16.368 -5.342 7.930 1.00 0.00 C ATOM 208 OD1 ASN A 14 -17.293 -5.081 8.701 1.00 0.00 O ATOM 209 ND2 ASN A 14 -16.335 -6.453 7.215 1.00 0.00 N ATOM 0 H ASN A 14 -14.622 -4.957 5.359 1.00 0.00 H new ATOM 0 HA ASN A 14 -16.388 -3.023 6.614 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -14.287 -4.965 7.624 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -15.079 -3.810 8.678 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -17.093 -7.131 7.291 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -15.551 -6.633 6.588 1.00 0.00 H new ATOM 216 N GLU A 15 -14.395 -1.630 7.816 1.00 0.00 N ATOM 217 CA GLU A 15 -13.471 -0.550 8.085 1.00 0.00 C ATOM 218 C GLU A 15 -12.421 -1.016 9.075 1.00 0.00 C ATOM 219 O GLU A 15 -12.749 -1.374 10.206 1.00 0.00 O ATOM 220 CB GLU A 15 -14.213 0.644 8.676 1.00 0.00 C ATOM 221 CG GLU A 15 -15.346 1.163 7.805 1.00 0.00 C ATOM 222 CD GLU A 15 -15.994 2.409 8.375 1.00 0.00 C ATOM 223 OE1 GLU A 15 -16.702 2.303 9.396 1.00 0.00 O ATOM 224 OE2 GLU A 15 -15.789 3.503 7.810 1.00 0.00 O ATOM 0 H GLU A 15 -15.057 -1.810 8.571 1.00 0.00 H new ATOM 0 HA GLU A 15 -12.997 -0.253 7.149 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -14.616 0.362 9.649 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -13.502 1.452 8.848 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -14.963 1.381 6.808 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -16.100 0.384 7.694 1.00 0.00 H new ATOM 231 N HIS A 16 -11.167 -1.021 8.663 1.00 0.00 N ATOM 232 CA HIS A 16 -10.097 -1.421 9.563 1.00 0.00 C ATOM 233 C HIS A 16 -8.912 -0.516 9.434 1.00 0.00 C ATOM 234 O HIS A 16 -8.119 -0.616 8.506 1.00 0.00 O ATOM 235 CB HIS A 16 -9.624 -2.837 9.333 1.00 0.00 C ATOM 236 CG HIS A 16 -10.650 -3.896 9.549 1.00 0.00 C ATOM 237 ND1 HIS A 16 -11.384 -4.038 10.706 1.00 0.00 N ATOM 238 CD2 HIS A 16 -11.056 -4.875 8.727 1.00 0.00 C ATOM 239 CE1 HIS A 16 -12.199 -5.067 10.579 1.00 0.00 C ATOM 240 NE2 HIS A 16 -12.022 -5.593 9.383 1.00 0.00 N ATOM 0 H HIS A 16 -10.865 -0.757 7.725 1.00 0.00 H new ATOM 0 HA HIS A 16 -10.527 -1.354 10.562 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -9.253 -2.917 8.311 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -8.780 -3.032 9.994 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -10.688 -5.063 7.729 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -12.893 -5.419 11.327 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -12.521 -6.400 9.008 1.00 0.00 H new ATOM 249 N GLY A 17 -8.790 0.325 10.407 1.00 0.00 N ATOM 250 CA GLY A 17 -7.727 1.289 10.432 1.00 0.00 C ATOM 251 C GLY A 17 -7.952 2.406 9.442 1.00 0.00 C ATOM 252 O GLY A 17 -8.548 2.215 8.379 1.00 0.00 O ATOM 0 H GLY A 17 -9.420 0.368 11.208 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -7.640 1.706 11.435 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -6.782 0.793 10.210 1.00 0.00 H new ATOM 256 N VAL A 18 -7.496 3.578 9.801 1.00 0.00 N ATOM 257 CA VAL A 18 -7.512 4.703 8.889 1.00 0.00 C ATOM 258 C VAL A 18 -6.172 4.749 8.155 1.00 0.00 C ATOM 259 O VAL A 18 -5.185 4.181 8.627 1.00 0.00 O ATOM 260 CB VAL A 18 -7.773 6.032 9.651 1.00 0.00 C ATOM 261 CG1 VAL A 18 -7.966 7.205 8.699 1.00 0.00 C ATOM 262 CG2 VAL A 18 -8.983 5.892 10.561 1.00 0.00 C ATOM 0 H VAL A 18 -7.107 3.783 10.721 1.00 0.00 H new ATOM 0 HA VAL A 18 -8.322 4.581 8.169 1.00 0.00 H new ATOM 0 HB VAL A 18 -6.890 6.239 10.256 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -8.146 8.114 9.273 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -7.070 7.331 8.091 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -8.820 7.011 8.051 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -9.153 6.831 11.088 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -9.861 5.647 9.964 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -8.804 5.097 11.285 1.00 0.00 H new ATOM 272 N PHE A 19 -6.123 5.445 7.033 1.00 0.00 N ATOM 273 CA PHE A 19 -4.981 5.402 6.142 1.00 0.00 C ATOM 274 C PHE A 19 -4.906 6.743 5.434 1.00 0.00 C ATOM 275 O PHE A 19 -5.900 7.463 5.388 1.00 0.00 O ATOM 276 CB PHE A 19 -5.110 4.261 5.128 1.00 0.00 C ATOM 277 CG PHE A 19 -4.970 2.898 5.744 1.00 0.00 C ATOM 278 CD1 PHE A 19 -6.052 2.278 6.344 1.00 0.00 C ATOM 279 CD2 PHE A 19 -3.747 2.252 5.747 1.00 0.00 C ATOM 280 CE1 PHE A 19 -5.921 1.041 6.937 1.00 0.00 C ATOM 281 CE2 PHE A 19 -3.608 1.015 6.340 1.00 0.00 C ATOM 282 CZ PHE A 19 -4.696 0.408 6.939 1.00 0.00 C ATOM 0 H PHE A 19 -6.875 6.056 6.715 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.070 5.216 6.710 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -6.079 4.331 4.635 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -4.350 4.383 4.356 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -7.013 2.771 6.348 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -2.893 2.721 5.281 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -6.775 0.569 7.399 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -2.648 0.520 6.337 1.00 0.00 H new ATOM 0 HZ PHE A 19 -4.587 -0.559 7.407 1.00 0.00 H new ATOM 292 N THR A 20 -3.752 7.091 4.901 1.00 0.00 N ATOM 293 CA THR A 20 -3.580 8.388 4.266 1.00 0.00 C ATOM 294 C THR A 20 -2.720 8.281 3.021 1.00 0.00 C ATOM 295 O THR A 20 -1.963 7.327 2.860 1.00 0.00 O ATOM 296 CB THR A 20 -2.939 9.404 5.234 1.00 0.00 C ATOM 297 OG1 THR A 20 -1.746 8.850 5.807 1.00 0.00 O ATOM 298 CG2 THR A 20 -3.902 9.771 6.345 1.00 0.00 C ATOM 0 H THR A 20 -2.921 6.499 4.893 1.00 0.00 H new ATOM 0 HA THR A 20 -4.574 8.737 3.986 1.00 0.00 H new ATOM 0 HB THR A 20 -2.693 10.303 4.668 1.00 0.00 H new ATOM 0 HG1 THR A 20 -1.344 9.501 6.419 1.00 0.00 H new ATOM 0 HG21 THR A 20 -3.428 10.488 7.015 1.00 0.00 H new ATOM 0 HG22 THR A 20 -4.801 10.214 5.916 1.00 0.00 H new ATOM 0 HG23 THR A 20 -4.171 8.875 6.904 1.00 0.00 H new ATOM 306 N GLY A 21 -2.857 9.254 2.140 1.00 0.00 N ATOM 307 CA GLY A 21 -2.009 9.331 0.986 1.00 0.00 C ATOM 308 C GLY A 21 -2.423 10.481 0.113 1.00 0.00 C ATOM 309 O GLY A 21 -3.514 11.006 0.281 1.00 0.00 O ATOM 0 H GLY A 21 -3.551 9.998 2.210 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -0.971 9.456 1.296 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -2.064 8.399 0.423 1.00 0.00 H new ATOM 313 N LYS A 22 -1.563 10.911 -0.785 1.00 0.00 N ATOM 314 CA LYS A 22 -1.956 11.920 -1.756 1.00 0.00 C ATOM 315 C LYS A 22 -2.566 11.228 -2.966 1.00 0.00 C ATOM 316 O LYS A 22 -2.974 11.859 -3.938 1.00 0.00 O ATOM 317 CB LYS A 22 -0.775 12.804 -2.168 1.00 0.00 C ATOM 318 CG LYS A 22 0.447 12.033 -2.644 1.00 0.00 C ATOM 319 CD LYS A 22 1.329 11.609 -1.479 1.00 0.00 C ATOM 320 CE LYS A 22 1.951 12.798 -0.755 1.00 0.00 C ATOM 321 NZ LYS A 22 2.868 12.362 0.335 1.00 0.00 N ATOM 0 H LYS A 22 -0.600 10.586 -0.867 1.00 0.00 H new ATOM 0 HA LYS A 22 -2.694 12.579 -1.299 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -1.099 13.476 -2.963 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -0.490 13.427 -1.321 1.00 0.00 H new ATOM 0 HG2 LYS A 22 0.128 11.151 -3.200 1.00 0.00 H new ATOM 0 HG3 LYS A 22 1.024 12.652 -3.332 1.00 0.00 H new ATOM 0 HD2 LYS A 22 0.737 11.027 -0.773 1.00 0.00 H new ATOM 0 HD3 LYS A 22 2.121 10.956 -1.846 1.00 0.00 H new ATOM 0 HE2 LYS A 22 2.500 13.412 -1.469 1.00 0.00 H new ATOM 0 HE3 LYS A 22 1.162 13.423 -0.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 2.475 12.648 1.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 2.971 11.327 0.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 3.799 12.806 0.204 1.00 0.00 H new ATOM 335 N GLN A 23 -2.612 9.909 -2.870 1.00 0.00 N ATOM 336 CA GLN A 23 -3.169 9.049 -3.893 1.00 0.00 C ATOM 337 C GLN A 23 -3.475 7.694 -3.264 1.00 0.00 C ATOM 338 O GLN A 23 -2.860 7.352 -2.263 1.00 0.00 O ATOM 339 CB GLN A 23 -2.169 8.920 -5.053 1.00 0.00 C ATOM 340 CG GLN A 23 -2.544 7.893 -6.106 1.00 0.00 C ATOM 341 CD GLN A 23 -1.679 7.983 -7.348 1.00 0.00 C ATOM 342 OE1 GLN A 23 -2.000 8.704 -8.291 1.00 0.00 O ATOM 343 NE2 GLN A 23 -0.574 7.256 -7.354 1.00 0.00 N ATOM 0 H GLN A 23 -2.255 9.400 -2.062 1.00 0.00 H new ATOM 0 HA GLN A 23 -4.091 9.467 -4.296 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -2.066 9.892 -5.535 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -1.192 8.661 -4.645 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -2.457 6.894 -5.680 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -3.589 8.030 -6.385 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -0.344 6.671 -6.551 1.00 0.00 H new ATOM 0 HE22 GLN A 23 0.048 7.281 -8.162 1.00 0.00 H new ATOM 352 N PRO A 24 -4.465 6.942 -3.764 1.00 0.00 N ATOM 353 CA PRO A 24 -4.736 5.583 -3.294 1.00 0.00 C ATOM 354 C PRO A 24 -3.456 4.754 -3.102 1.00 0.00 C ATOM 355 O PRO A 24 -3.237 4.180 -2.044 1.00 0.00 O ATOM 356 CB PRO A 24 -5.593 4.973 -4.413 1.00 0.00 C ATOM 357 CG PRO A 24 -5.951 6.084 -5.351 1.00 0.00 C ATOM 358 CD PRO A 24 -5.446 7.375 -4.760 1.00 0.00 C ATOM 0 HA PRO A 24 -5.221 5.591 -2.318 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -5.043 4.190 -4.936 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -6.491 4.512 -4.002 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -5.505 5.914 -6.331 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -7.031 6.128 -5.495 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -4.991 8.012 -5.519 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -6.253 7.949 -4.304 1.00 0.00 H new ATOM 366 N ARG A 25 -2.731 4.589 -4.196 1.00 0.00 N ATOM 367 CA ARG A 25 -1.363 4.060 -4.168 1.00 0.00 C ATOM 368 C ARG A 25 -0.602 4.487 -2.910 1.00 0.00 C ATOM 369 O ARG A 25 0.084 3.672 -2.310 1.00 0.00 O ATOM 370 CB ARG A 25 -0.578 4.471 -5.414 1.00 0.00 C ATOM 371 CG ARG A 25 0.870 4.005 -5.391 1.00 0.00 C ATOM 372 CD ARG A 25 1.591 4.370 -6.675 1.00 0.00 C ATOM 373 NE ARG A 25 3.013 4.040 -6.622 1.00 0.00 N ATOM 374 CZ ARG A 25 3.715 3.607 -7.666 1.00 0.00 C ATOM 375 NH1 ARG A 25 3.117 3.397 -8.835 1.00 0.00 N ATOM 376 NH2 ARG A 25 5.014 3.379 -7.531 1.00 0.00 N ATOM 0 H ARG A 25 -3.067 4.816 -5.132 1.00 0.00 H new ATOM 0 HA ARG A 25 -1.456 2.974 -4.153 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.070 4.063 -6.297 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.602 5.557 -5.509 1.00 0.00 H new ATOM 0 HG2 ARG A 25 1.385 4.455 -4.542 1.00 0.00 H new ATOM 0 HG3 ARG A 25 0.904 2.925 -5.248 1.00 0.00 H new ATOM 0 HD2 ARG A 25 1.129 3.845 -7.511 1.00 0.00 H new ATOM 0 HD3 ARG A 25 1.474 5.437 -6.865 1.00 0.00 H new ATOM 0 HE ARG A 25 3.497 4.148 -5.731 1.00 0.00 H new ATOM 0 HH11 ARG A 25 2.116 3.568 -8.934 1.00 0.00 H new ATOM 0 HH12 ARG A 25 3.659 3.065 -9.633 1.00 0.00 H new ATOM 0 HH21 ARG A 25 5.468 3.536 -6.631 1.00 0.00 H new ATOM 0 HH22 ARG A 25 5.559 3.047 -8.327 1.00 0.00 H new ATOM 390 N GLN A 26 -0.734 5.748 -2.498 1.00 0.00 N ATOM 391 CA GLN A 26 -0.074 6.231 -1.318 1.00 0.00 C ATOM 392 C GLN A 26 -0.766 5.740 -0.045 1.00 0.00 C ATOM 393 O GLN A 26 -0.128 5.572 0.988 1.00 0.00 O ATOM 394 CB GLN A 26 -0.051 7.743 -1.360 1.00 0.00 C ATOM 395 CG GLN A 26 1.341 8.321 -1.506 1.00 0.00 C ATOM 396 CD GLN A 26 2.128 8.396 -0.218 1.00 0.00 C ATOM 397 OE1 GLN A 26 2.931 9.306 -0.026 1.00 0.00 O ATOM 398 NE2 GLN A 26 1.927 7.447 0.662 1.00 0.00 N ATOM 0 H GLN A 26 -1.300 6.447 -2.979 1.00 0.00 H new ATOM 0 HA GLN A 26 0.944 5.843 -1.298 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -0.667 8.085 -2.192 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -0.503 8.131 -0.447 1.00 0.00 H new ATOM 0 HG2 GLN A 26 1.898 7.717 -2.222 1.00 0.00 H new ATOM 0 HG3 GLN A 26 1.262 9.323 -1.927 1.00 0.00 H new ATOM 0 HE21 GLN A 26 1.252 6.707 0.469 1.00 0.00 H new ATOM 0 HE22 GLN A 26 2.445 7.448 1.541 1.00 0.00 H new ATOM 407 N ALA A 27 -2.073 5.535 -0.120 1.00 0.00 N ATOM 408 CA ALA A 27 -2.816 4.923 0.972 1.00 0.00 C ATOM 409 C ALA A 27 -2.321 3.506 1.198 1.00 0.00 C ATOM 410 O ALA A 27 -1.864 3.163 2.280 1.00 0.00 O ATOM 411 CB ALA A 27 -4.300 4.927 0.668 1.00 0.00 C ATOM 0 H ALA A 27 -2.642 5.784 -0.929 1.00 0.00 H new ATOM 0 HA ALA A 27 -2.654 5.502 1.881 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -4.842 4.466 1.494 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -4.642 5.954 0.538 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -4.486 4.364 -0.247 1.00 0.00 H new ATOM 417 N ALA A 28 -2.504 2.664 0.187 1.00 0.00 N ATOM 418 CA ALA A 28 -1.828 1.366 0.112 1.00 0.00 C ATOM 419 C ALA A 28 -0.360 1.440 0.554 1.00 0.00 C ATOM 420 O ALA A 28 0.137 0.533 1.223 1.00 0.00 O ATOM 421 CB ALA A 28 -1.929 0.854 -1.312 1.00 0.00 C ATOM 0 H ALA A 28 -3.121 2.857 -0.602 1.00 0.00 H new ATOM 0 HA ALA A 28 -2.321 0.680 0.801 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -1.431 -0.113 -1.387 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -2.978 0.744 -1.585 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -1.451 1.562 -1.988 1.00 0.00 H new ATOM 427 N LEU A 29 0.318 2.524 0.180 1.00 0.00 N ATOM 428 CA LEU A 29 1.712 2.760 0.565 1.00 0.00 C ATOM 429 C LEU A 29 1.856 2.865 2.076 1.00 0.00 C ATOM 430 O LEU A 29 2.960 2.838 2.611 1.00 0.00 O ATOM 431 CB LEU A 29 2.210 4.051 -0.072 1.00 0.00 C ATOM 432 CG LEU A 29 3.508 3.956 -0.849 1.00 0.00 C ATOM 433 CD1 LEU A 29 3.319 3.016 -2.008 1.00 0.00 C ATOM 434 CD2 LEU A 29 3.922 5.329 -1.344 1.00 0.00 C ATOM 0 H LEU A 29 -0.081 3.264 -0.398 1.00 0.00 H new ATOM 0 HA LEU A 29 2.305 1.915 0.216 1.00 0.00 H new ATOM 0 HB2 LEU A 29 1.436 4.423 -0.743 1.00 0.00 H new ATOM 0 HB3 LEU A 29 2.335 4.795 0.715 1.00 0.00 H new ATOM 0 HG LEU A 29 4.296 3.575 -0.200 1.00 0.00 H new ATOM 0 HD11 LEU A 29 4.249 2.942 -2.572 1.00 0.00 H new ATOM 0 HD12 LEU A 29 3.042 2.030 -1.635 1.00 0.00 H new ATOM 0 HD13 LEU A 29 2.529 3.394 -2.658 1.00 0.00 H new ATOM 0 HD21 LEU A 29 4.856 5.249 -1.901 1.00 0.00 H new ATOM 0 HD22 LEU A 29 3.145 5.731 -1.994 1.00 0.00 H new ATOM 0 HD23 LEU A 29 4.063 5.995 -0.493 1.00 0.00 H new ATOM 446 N LYS A 30 0.743 3.032 2.760 1.00 0.00 N ATOM 447 CA LYS A 30 0.739 2.994 4.193 1.00 0.00 C ATOM 448 C LYS A 30 0.569 1.565 4.651 1.00 0.00 C ATOM 449 O LYS A 30 1.412 1.051 5.369 1.00 0.00 O ATOM 450 CB LYS A 30 -0.375 3.872 4.744 1.00 0.00 C ATOM 451 CG LYS A 30 -0.126 5.347 4.516 1.00 0.00 C ATOM 452 CD LYS A 30 0.751 5.933 5.609 1.00 0.00 C ATOM 453 CE LYS A 30 1.049 7.406 5.374 1.00 0.00 C ATOM 454 NZ LYS A 30 1.741 8.015 6.541 1.00 0.00 N ATOM 0 H LYS A 30 -0.171 3.196 2.337 1.00 0.00 H new ATOM 0 HA LYS A 30 1.687 3.380 4.569 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -1.318 3.591 4.276 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -0.482 3.687 5.813 1.00 0.00 H new ATOM 0 HG2 LYS A 30 0.351 5.492 3.547 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -1.077 5.878 4.486 1.00 0.00 H new ATOM 0 HD2 LYS A 30 0.257 5.813 6.573 1.00 0.00 H new ATOM 0 HD3 LYS A 30 1.687 5.377 5.659 1.00 0.00 H new ATOM 0 HE2 LYS A 30 1.669 7.515 4.484 1.00 0.00 H new ATOM 0 HE3 LYS A 30 0.119 7.940 5.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 1.929 9.019 6.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 1.138 7.932 7.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 2.640 7.520 6.708 1.00 0.00 H new ATOM 468 N ALA A 31 -0.497 0.904 4.192 1.00 0.00 N ATOM 469 CA ALA A 31 -0.859 -0.429 4.669 1.00 0.00 C ATOM 470 C ALA A 31 0.275 -1.439 4.597 1.00 0.00 C ATOM 471 O ALA A 31 0.336 -2.364 5.410 1.00 0.00 O ATOM 472 CB ALA A 31 -2.049 -0.932 3.872 1.00 0.00 C ATOM 0 H ALA A 31 -1.129 1.277 3.483 1.00 0.00 H new ATOM 0 HA ALA A 31 -1.106 -0.331 5.726 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -2.326 -1.927 4.221 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -2.890 -0.252 4.007 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -1.786 -0.979 2.815 1.00 0.00 H new ATOM 478 N ALA A 32 1.170 -1.273 3.639 1.00 0.00 N ATOM 479 CA ALA A 32 2.269 -2.209 3.474 1.00 0.00 C ATOM 480 C ALA A 32 3.170 -2.247 4.712 1.00 0.00 C ATOM 481 O ALA A 32 3.764 -3.275 5.025 1.00 0.00 O ATOM 482 CB ALA A 32 3.083 -1.861 2.238 1.00 0.00 C ATOM 0 H ALA A 32 1.159 -0.505 2.968 1.00 0.00 H new ATOM 0 HA ALA A 32 1.839 -3.202 3.347 1.00 0.00 H new ATOM 0 HB1 ALA A 32 3.902 -2.572 2.130 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.444 -1.907 1.356 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.488 -0.854 2.341 1.00 0.00 H new ATOM 488 N ASN A 33 3.245 -1.125 5.420 1.00 0.00 N ATOM 489 CA ASN A 33 4.080 -0.976 6.618 1.00 0.00 C ATOM 490 C ASN A 33 3.669 -1.912 7.768 1.00 0.00 C ATOM 491 O ASN A 33 4.274 -1.869 8.840 1.00 0.00 O ATOM 492 CB ASN A 33 4.038 0.475 7.126 1.00 0.00 C ATOM 493 CG ASN A 33 2.865 0.775 8.064 1.00 0.00 C ATOM 494 OD1 ASN A 33 2.999 1.570 8.994 1.00 0.00 O ATOM 495 ND2 ASN A 33 1.706 0.172 7.821 1.00 0.00 N ATOM 0 H ASN A 33 2.724 -0.282 5.180 1.00 0.00 H new ATOM 0 HA ASN A 33 5.090 -1.249 6.312 1.00 0.00 H new ATOM 0 HB2 ASN A 33 4.971 0.694 7.646 1.00 0.00 H new ATOM 0 HB3 ASN A 33 3.986 1.147 6.270 1.00 0.00 H new ATOM 0 HD21 ASN A 33 0.898 0.364 8.413 1.00 0.00 H new ATOM 0 HD22 ASN A 33 1.625 -0.482 7.043 1.00 0.00 H new ATOM 502 N ARG A 34 2.667 -2.763 7.559 1.00 0.00 N ATOM 503 CA ARG A 34 2.003 -3.374 8.700 1.00 0.00 C ATOM 504 C ARG A 34 2.331 -4.855 8.778 1.00 0.00 C ATOM 505 O ARG A 34 2.820 -5.334 9.799 1.00 0.00 O ATOM 506 CB ARG A 34 0.493 -3.183 8.589 1.00 0.00 C ATOM 507 CG ARG A 34 -0.250 -3.415 9.891 1.00 0.00 C ATOM 508 CD ARG A 34 -1.749 -3.260 9.710 1.00 0.00 C ATOM 509 NE ARG A 34 -2.318 -4.338 8.897 1.00 0.00 N ATOM 510 CZ ARG A 34 -3.623 -4.510 8.689 1.00 0.00 C ATOM 511 NH1 ARG A 34 -4.507 -3.658 9.199 1.00 0.00 N ATOM 512 NH2 ARG A 34 -4.043 -5.543 7.970 1.00 0.00 N ATOM 0 H ARG A 34 2.309 -3.036 6.644 1.00 0.00 H new ATOM 0 HA ARG A 34 2.360 -2.889 9.608 1.00 0.00 H new ATOM 0 HB2 ARG A 34 0.289 -2.171 8.240 1.00 0.00 H new ATOM 0 HB3 ARG A 34 0.104 -3.865 7.833 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -0.029 -4.415 10.264 1.00 0.00 H new ATOM 0 HG3 ARG A 34 0.102 -2.709 10.643 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -2.233 -3.248 10.687 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -1.960 -2.300 9.238 1.00 0.00 H new ATOM 0 HE ARG A 34 -1.674 -4.999 8.462 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -4.188 -2.864 9.755 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -5.504 -3.798 9.034 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -3.368 -6.201 7.580 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -5.041 -5.679 7.808 1.00 0.00 H new ATOM 526 N GLY A 35 2.078 -5.586 7.701 1.00 0.00 N ATOM 527 CA GLY A 35 2.645 -6.911 7.606 1.00 0.00 C ATOM 528 C GLY A 35 3.917 -6.949 6.800 1.00 0.00 C ATOM 529 O GLY A 35 4.803 -7.759 7.072 1.00 0.00 O ATOM 0 H GLY A 35 1.504 -5.293 6.910 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.845 -7.288 8.609 1.00 0.00 H new ATOM 0 HA3 GLY A 35 1.914 -7.582 7.154 1.00 0.00 H new ATOM 533 N SER A 36 3.979 -6.095 5.786 1.00 0.00 N ATOM 534 CA SER A 36 5.152 -5.966 4.924 1.00 0.00 C ATOM 535 C SER A 36 5.277 -7.155 3.972 1.00 0.00 C ATOM 536 O SER A 36 6.151 -7.157 3.109 1.00 0.00 O ATOM 537 CB SER A 36 6.436 -5.790 5.761 1.00 0.00 C ATOM 538 OG SER A 36 7.588 -5.626 4.950 1.00 0.00 O ATOM 0 H SER A 36 3.214 -5.468 5.535 1.00 0.00 H new ATOM 0 HA SER A 36 5.019 -5.070 4.317 1.00 0.00 H new ATOM 0 HB2 SER A 36 6.327 -4.923 6.413 1.00 0.00 H new ATOM 0 HB3 SER A 36 6.569 -6.659 6.406 1.00 0.00 H new ATOM 0 HG SER A 36 7.461 -6.101 4.102 1.00 0.00 H new ATOM 544 N GLY A 37 4.377 -8.140 4.119 1.00 0.00 N ATOM 545 CA GLY A 37 4.394 -9.337 3.283 1.00 0.00 C ATOM 546 C GLY A 37 5.791 -9.815 2.970 1.00 0.00 C ATOM 547 O GLY A 37 6.672 -9.803 3.834 1.00 0.00 O ATOM 0 H GLY A 37 3.629 -8.125 4.812 1.00 0.00 H new ATOM 0 HA2 GLY A 37 3.847 -10.134 3.787 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.869 -9.130 2.351 1.00 0.00 H new ATOM 551 N THR A 38 5.977 -10.254 1.738 1.00 0.00 N ATOM 552 CA THR A 38 7.303 -10.458 1.173 1.00 0.00 C ATOM 553 C THR A 38 7.218 -10.228 -0.319 1.00 0.00 C ATOM 554 O THR A 38 6.119 -10.155 -0.863 1.00 0.00 O ATOM 555 CB THR A 38 7.889 -11.879 1.392 1.00 0.00 C ATOM 556 OG1 THR A 38 7.138 -12.841 0.651 1.00 0.00 O ATOM 557 CG2 THR A 38 7.901 -12.283 2.853 1.00 0.00 C ATOM 0 H THR A 38 5.214 -10.480 1.099 1.00 0.00 H new ATOM 0 HA THR A 38 7.964 -9.760 1.686 1.00 0.00 H new ATOM 0 HB THR A 38 8.921 -11.850 1.042 1.00 0.00 H new ATOM 0 HG1 THR A 38 7.517 -13.733 0.795 1.00 0.00 H new ATOM 0 HG21 THR A 38 8.320 -13.284 2.950 1.00 0.00 H new ATOM 0 HG22 THR A 38 8.509 -11.578 3.420 1.00 0.00 H new ATOM 0 HG23 THR A 38 6.882 -12.277 3.241 1.00 0.00 H new ATOM 565 N LYS A 39 8.349 -10.120 -0.982 1.00 0.00 N ATOM 566 CA LYS A 39 8.366 -10.042 -2.435 1.00 0.00 C ATOM 567 C LYS A 39 7.711 -11.280 -3.042 1.00 0.00 C ATOM 568 O LYS A 39 7.071 -11.218 -4.100 1.00 0.00 O ATOM 569 CB LYS A 39 9.803 -9.902 -2.937 1.00 0.00 C ATOM 570 CG LYS A 39 9.974 -10.325 -4.380 1.00 0.00 C ATOM 571 CD LYS A 39 9.406 -9.294 -5.336 1.00 0.00 C ATOM 572 CE LYS A 39 9.509 -9.759 -6.776 1.00 0.00 C ATOM 573 NZ LYS A 39 8.819 -8.827 -7.705 1.00 0.00 N ATOM 0 H LYS A 39 9.269 -10.084 -0.544 1.00 0.00 H new ATOM 0 HA LYS A 39 7.799 -9.164 -2.744 1.00 0.00 H new ATOM 0 HB2 LYS A 39 10.119 -8.864 -2.829 1.00 0.00 H new ATOM 0 HB3 LYS A 39 10.461 -10.503 -2.309 1.00 0.00 H new ATOM 0 HG2 LYS A 39 11.033 -10.475 -4.593 1.00 0.00 H new ATOM 0 HG3 LYS A 39 9.478 -11.282 -4.540 1.00 0.00 H new ATOM 0 HD2 LYS A 39 8.362 -9.102 -5.088 1.00 0.00 H new ATOM 0 HD3 LYS A 39 9.941 -8.352 -5.217 1.00 0.00 H new ATOM 0 HE2 LYS A 39 10.559 -9.842 -7.057 1.00 0.00 H new ATOM 0 HE3 LYS A 39 9.074 -10.754 -6.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 8.911 -9.177 -8.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 7.812 -8.767 -7.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 9.251 -7.883 -7.634 1.00 0.00 H new ATOM 587 N ALA A 40 7.843 -12.394 -2.347 1.00 0.00 N ATOM 588 CA ALA A 40 7.398 -13.669 -2.871 1.00 0.00 C ATOM 589 C ALA A 40 5.911 -13.879 -2.629 1.00 0.00 C ATOM 590 O ALA A 40 5.233 -14.553 -3.404 1.00 0.00 O ATOM 591 CB ALA A 40 8.190 -14.797 -2.240 1.00 0.00 C ATOM 0 H ALA A 40 8.256 -12.440 -1.416 1.00 0.00 H new ATOM 0 HA ALA A 40 7.568 -13.667 -3.948 1.00 0.00 H new ATOM 0 HB1 ALA A 40 7.847 -15.751 -2.641 1.00 0.00 H new ATOM 0 HB2 ALA A 40 9.249 -14.668 -2.465 1.00 0.00 H new ATOM 0 HB3 ALA A 40 8.044 -14.784 -1.160 1.00 0.00 H new ATOM 597 N ASN A 41 5.410 -13.290 -1.559 1.00 0.00 N ATOM 598 CA ASN A 41 4.024 -13.463 -1.170 1.00 0.00 C ATOM 599 C ASN A 41 3.501 -12.235 -0.426 1.00 0.00 C ATOM 600 O ASN A 41 3.262 -12.269 0.784 1.00 0.00 O ATOM 601 CB ASN A 41 3.851 -14.722 -0.316 1.00 0.00 C ATOM 602 CG ASN A 41 4.912 -14.881 0.761 1.00 0.00 C ATOM 603 OD1 ASN A 41 5.879 -15.622 0.592 1.00 0.00 O ATOM 604 ND2 ASN A 41 4.762 -14.157 1.856 1.00 0.00 N ATOM 0 H ASN A 41 5.948 -12.683 -0.940 1.00 0.00 H new ATOM 0 HA ASN A 41 3.437 -13.581 -2.081 1.00 0.00 H new ATOM 0 HB2 ASN A 41 2.868 -14.698 0.155 1.00 0.00 H new ATOM 0 HB3 ASN A 41 3.872 -15.597 -0.966 1.00 0.00 H new ATOM 0 HD21 ASN A 41 5.462 -14.202 2.597 1.00 0.00 H new ATOM 0 HD22 ASN A 41 3.946 -13.554 1.961 1.00 0.00 H new ATOM 611 N PRO A 42 3.322 -11.127 -1.146 1.00 0.00 N ATOM 612 CA PRO A 42 2.776 -9.893 -0.577 1.00 0.00 C ATOM 613 C PRO A 42 1.351 -10.097 -0.061 1.00 0.00 C ATOM 614 O PRO A 42 0.710 -11.100 -0.379 1.00 0.00 O ATOM 615 CB PRO A 42 2.787 -8.912 -1.757 1.00 0.00 C ATOM 616 CG PRO A 42 3.723 -9.501 -2.756 1.00 0.00 C ATOM 617 CD PRO A 42 3.648 -10.985 -2.571 1.00 0.00 C ATOM 0 HA PRO A 42 3.352 -9.541 0.279 1.00 0.00 H new ATOM 0 HB2 PRO A 42 1.788 -8.793 -2.177 1.00 0.00 H new ATOM 0 HB3 PRO A 42 3.120 -7.923 -1.442 1.00 0.00 H new ATOM 0 HG2 PRO A 42 3.438 -9.220 -3.770 1.00 0.00 H new ATOM 0 HG3 PRO A 42 4.739 -9.139 -2.598 1.00 0.00 H new ATOM 0 HD2 PRO A 42 2.883 -11.432 -3.206 1.00 0.00 H new ATOM 0 HD3 PRO A 42 4.592 -11.470 -2.819 1.00 0.00 H new ATOM 625 N ASP A 43 0.846 -9.144 0.711 1.00 0.00 N ATOM 626 CA ASP A 43 -0.476 -9.277 1.320 1.00 0.00 C ATOM 627 C ASP A 43 -1.522 -8.554 0.481 1.00 0.00 C ATOM 628 O ASP A 43 -1.214 -7.566 -0.187 1.00 0.00 O ATOM 629 CB ASP A 43 -0.486 -8.707 2.743 1.00 0.00 C ATOM 630 CG ASP A 43 0.272 -9.568 3.733 1.00 0.00 C ATOM 631 OD1 ASP A 43 -0.220 -10.668 4.068 1.00 0.00 O ATOM 632 OD2 ASP A 43 1.354 -9.148 4.193 1.00 0.00 O ATOM 0 H ASP A 43 1.328 -8.272 0.931 1.00 0.00 H new ATOM 0 HA ASP A 43 -0.716 -10.339 1.364 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -0.050 -7.708 2.731 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -1.518 -8.601 3.078 1.00 0.00 H new ATOM 637 N ILE A 44 -2.754 -9.051 0.512 1.00 0.00 N ATOM 638 CA ILE A 44 -3.838 -8.455 -0.258 1.00 0.00 C ATOM 639 C ILE A 44 -4.669 -7.492 0.571 1.00 0.00 C ATOM 640 O ILE A 44 -5.494 -7.889 1.401 1.00 0.00 O ATOM 641 CB ILE A 44 -4.748 -9.532 -0.897 1.00 0.00 C ATOM 642 CG1 ILE A 44 -3.983 -10.234 -2.006 1.00 0.00 C ATOM 643 CG2 ILE A 44 -6.023 -8.913 -1.459 1.00 0.00 C ATOM 644 CD1 ILE A 44 -3.503 -9.261 -3.055 1.00 0.00 C ATOM 0 H ILE A 44 -3.026 -9.865 1.063 1.00 0.00 H new ATOM 0 HA ILE A 44 -3.365 -7.886 -1.058 1.00 0.00 H new ATOM 0 HB ILE A 44 -5.034 -10.249 -0.128 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -3.129 -10.762 -1.581 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -4.623 -10.984 -2.471 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -6.642 -9.694 -1.901 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -6.574 -8.424 -0.656 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -5.765 -8.179 -2.222 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -2.960 -9.801 -3.831 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -4.359 -8.752 -3.498 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -2.842 -8.526 -2.595 1.00 0.00 H new ATOM 656 N ILE A 45 -4.411 -6.219 0.350 1.00 0.00 N ATOM 657 CA ILE A 45 -5.200 -5.156 0.947 1.00 0.00 C ATOM 658 C ILE A 45 -5.858 -4.313 -0.109 1.00 0.00 C ATOM 659 O ILE A 45 -5.286 -4.086 -1.175 1.00 0.00 O ATOM 660 CB ILE A 45 -4.346 -4.231 1.826 1.00 0.00 C ATOM 661 CG1 ILE A 45 -3.149 -3.655 1.055 1.00 0.00 C ATOM 662 CG2 ILE A 45 -3.878 -4.968 3.049 1.00 0.00 C ATOM 663 CD1 ILE A 45 -3.440 -2.335 0.387 1.00 0.00 C ATOM 0 H ILE A 45 -3.651 -5.891 -0.246 1.00 0.00 H new ATOM 0 HA ILE A 45 -5.953 -5.647 1.563 1.00 0.00 H new ATOM 0 HB ILE A 45 -4.971 -3.392 2.131 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -2.312 -3.528 1.742 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -2.835 -4.374 0.299 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -3.273 -4.303 3.665 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -4.741 -5.308 3.621 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -3.280 -5.828 2.749 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -2.550 -1.989 -0.138 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -4.256 -2.460 -0.325 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -3.725 -1.601 1.141 1.00 0.00 H new ATOM 675 N ARG A 46 -7.075 -3.878 0.122 1.00 0.00 N ATOM 676 CA ARG A 46 -7.615 -2.817 -0.704 1.00 0.00 C ATOM 677 C ARG A 46 -8.193 -1.684 0.137 1.00 0.00 C ATOM 678 O ARG A 46 -8.960 -1.916 1.071 1.00 0.00 O ATOM 679 CB ARG A 46 -8.719 -3.424 -1.554 1.00 0.00 C ATOM 680 CG ARG A 46 -9.627 -4.348 -0.758 1.00 0.00 C ATOM 681 CD ARG A 46 -10.692 -4.984 -1.626 1.00 0.00 C ATOM 682 NE ARG A 46 -12.020 -4.834 -1.035 1.00 0.00 N ATOM 683 CZ ARG A 46 -12.984 -5.752 -1.116 1.00 0.00 C ATOM 684 NH1 ARG A 46 -12.782 -6.881 -1.782 1.00 0.00 N ATOM 685 NH2 ARG A 46 -14.152 -5.539 -0.525 1.00 0.00 N ATOM 0 H ARG A 46 -7.696 -4.228 0.852 1.00 0.00 H new ATOM 0 HA ARG A 46 -6.818 -2.394 -1.316 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -9.315 -2.625 -1.994 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -8.274 -3.980 -2.379 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -9.028 -5.129 -0.289 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -10.103 -3.785 0.045 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -10.678 -4.527 -2.615 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -10.469 -6.042 -1.761 1.00 0.00 H new ATOM 0 HE ARG A 46 -12.223 -3.972 -0.528 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -11.885 -7.052 -2.236 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -13.524 -7.579 -1.840 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -14.312 -4.674 -0.009 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -14.890 -6.240 -0.586 1.00 0.00 H new ATOM 699 N LEU A 47 -7.827 -0.455 -0.193 1.00 0.00 N ATOM 700 CA LEU A 47 -8.331 0.701 0.542 1.00 0.00 C ATOM 701 C LEU A 47 -9.621 1.248 -0.062 1.00 0.00 C ATOM 702 O LEU A 47 -9.944 1.008 -1.226 1.00 0.00 O ATOM 703 CB LEU A 47 -7.294 1.839 0.637 1.00 0.00 C ATOM 704 CG LEU A 47 -6.076 1.601 1.528 1.00 0.00 C ATOM 705 CD1 LEU A 47 -6.512 1.195 2.915 1.00 0.00 C ATOM 706 CD2 LEU A 47 -5.132 0.577 0.918 1.00 0.00 C ATOM 0 H LEU A 47 -7.189 -0.230 -0.957 1.00 0.00 H new ATOM 0 HA LEU A 47 -8.538 0.336 1.548 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -6.938 2.057 -0.370 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -7.805 2.733 0.995 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.523 2.537 1.606 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -5.634 1.029 3.538 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -7.122 1.986 3.351 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -7.096 0.276 2.859 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.277 0.432 1.578 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.656 -0.370 0.790 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.785 0.934 -0.052 1.00 0.00 H new ATOM 718 N ARG A 48 -10.310 2.011 0.764 1.00 0.00 N ATOM 719 CA ARG A 48 -11.528 2.708 0.381 1.00 0.00 C ATOM 720 C ARG A 48 -11.327 4.172 0.695 1.00 0.00 C ATOM 721 O ARG A 48 -10.848 4.499 1.781 1.00 0.00 O ATOM 722 CB ARG A 48 -12.747 2.187 1.143 1.00 0.00 C ATOM 723 CG ARG A 48 -14.048 2.846 0.707 1.00 0.00 C ATOM 724 CD ARG A 48 -15.235 2.355 1.516 1.00 0.00 C ATOM 725 NE ARG A 48 -15.096 2.650 2.942 1.00 0.00 N ATOM 726 CZ ARG A 48 -15.957 3.406 3.626 1.00 0.00 C ATOM 727 NH1 ARG A 48 -16.973 3.991 3.003 1.00 0.00 N ATOM 728 NH2 ARG A 48 -15.800 3.586 4.930 1.00 0.00 N ATOM 0 H ARG A 48 -10.038 2.168 1.734 1.00 0.00 H new ATOM 0 HA ARG A 48 -11.717 2.545 -0.680 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -12.826 1.110 0.998 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -12.601 2.355 2.210 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -13.960 3.927 0.813 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -14.221 2.642 -0.350 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -16.146 2.819 1.138 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -15.345 1.279 1.379 1.00 0.00 H new ATOM 0 HE ARG A 48 -14.298 2.257 3.440 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -17.097 3.863 1.999 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -17.629 4.568 3.529 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -15.018 3.146 5.415 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -16.461 4.165 5.448 1.00 0.00 H new ATOM 742 N GLU A 49 -11.662 5.056 -0.226 1.00 0.00 N ATOM 743 CA GLU A 49 -11.378 6.467 0.001 1.00 0.00 C ATOM 744 C GLU A 49 -12.467 7.090 0.854 1.00 0.00 C ATOM 745 O GLU A 49 -13.291 7.867 0.381 1.00 0.00 O ATOM 746 CB GLU A 49 -11.230 7.189 -1.327 1.00 0.00 C ATOM 747 CG GLU A 49 -10.639 8.580 -1.211 1.00 0.00 C ATOM 748 CD GLU A 49 -10.332 9.190 -2.566 1.00 0.00 C ATOM 749 OE1 GLU A 49 -11.252 9.743 -3.210 1.00 0.00 O ATOM 750 OE2 GLU A 49 -9.168 9.114 -2.999 1.00 0.00 O ATOM 0 H GLU A 49 -12.117 4.837 -1.112 1.00 0.00 H new ATOM 0 HA GLU A 49 -10.436 6.562 0.542 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -10.599 6.591 -1.985 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -12.209 7.260 -1.801 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -11.335 9.224 -0.674 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -9.725 8.536 -0.619 1.00 0.00 H new ATOM 757 N ARG A 50 -12.409 6.711 2.119 1.00 0.00 N ATOM 758 CA ARG A 50 -13.318 7.150 3.187 1.00 0.00 C ATOM 759 C ARG A 50 -14.730 7.466 2.705 1.00 0.00 C ATOM 760 O ARG A 50 -15.583 6.580 2.668 1.00 0.00 O ATOM 761 CB ARG A 50 -12.734 8.318 3.975 1.00 0.00 C ATOM 762 CG ARG A 50 -11.534 7.911 4.810 1.00 0.00 C ATOM 763 CD ARG A 50 -11.337 8.825 6.004 1.00 0.00 C ATOM 764 NE ARG A 50 -12.562 8.976 6.785 1.00 0.00 N ATOM 765 CZ ARG A 50 -12.677 9.757 7.856 1.00 0.00 C ATOM 766 NH1 ARG A 50 -11.629 10.448 8.293 1.00 0.00 N ATOM 767 NH2 ARG A 50 -13.841 9.846 8.491 1.00 0.00 N ATOM 0 H ARG A 50 -11.699 6.060 2.454 1.00 0.00 H new ATOM 0 HA ARG A 50 -13.414 6.294 3.855 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -12.441 9.108 3.284 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -13.503 8.733 4.627 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -11.664 6.886 5.156 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -10.638 7.927 4.189 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -10.548 8.425 6.641 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -11.003 9.804 5.660 1.00 0.00 H new ATOM 0 HE ARG A 50 -13.383 8.448 6.490 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -10.735 10.380 7.807 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -11.719 11.046 9.114 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -14.646 9.316 8.157 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -13.930 10.445 9.312 1.00 0.00 H new ATOM 781 N GLY A 51 -14.975 8.712 2.325 1.00 0.00 N ATOM 782 CA GLY A 51 -16.305 9.111 1.911 1.00 0.00 C ATOM 783 C GLY A 51 -16.623 8.733 0.476 1.00 0.00 C ATOM 784 O GLY A 51 -17.177 9.537 -0.276 1.00 0.00 O ATOM 0 H GLY A 51 -14.276 9.454 2.296 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -17.038 8.649 2.572 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -16.406 10.190 2.027 1.00 0.00 H new ATOM 788 N THR A 52 -16.281 7.509 0.092 1.00 0.00 N ATOM 789 CA THR A 52 -16.575 7.015 -1.239 1.00 0.00 C ATOM 790 C THR A 52 -17.058 5.577 -1.169 1.00 0.00 C ATOM 791 O THR A 52 -16.919 4.909 -0.139 1.00 0.00 O ATOM 792 CB THR A 52 -15.345 7.079 -2.162 1.00 0.00 C ATOM 793 OG1 THR A 52 -14.257 6.358 -1.575 1.00 0.00 O ATOM 794 CG2 THR A 52 -14.923 8.518 -2.426 1.00 0.00 C ATOM 0 H THR A 52 -15.797 6.840 0.691 1.00 0.00 H new ATOM 0 HA THR A 52 -17.352 7.657 -1.653 1.00 0.00 H new ATOM 0 HB THR A 52 -15.616 6.624 -3.115 1.00 0.00 H new ATOM 0 HG1 THR A 52 -14.424 5.395 -1.650 1.00 0.00 H new ATOM 0 HG21 THR A 52 -14.052 8.527 -3.081 1.00 0.00 H new ATOM 0 HG22 THR A 52 -15.742 9.056 -2.904 1.00 0.00 H new ATOM 0 HG23 THR A 52 -14.673 9.003 -1.482 1.00 0.00 H new ATOM 802 N LYS A 53 -17.619 5.109 -2.264 1.00 0.00 N ATOM 803 CA LYS A 53 -18.080 3.741 -2.362 1.00 0.00 C ATOM 804 C LYS A 53 -17.204 3.001 -3.368 1.00 0.00 C ATOM 805 O LYS A 53 -17.668 2.137 -4.115 1.00 0.00 O ATOM 806 CB LYS A 53 -19.562 3.722 -2.774 1.00 0.00 C ATOM 807 CG LYS A 53 -20.235 2.357 -2.676 1.00 0.00 C ATOM 808 CD LYS A 53 -21.724 2.438 -3.000 1.00 0.00 C ATOM 809 CE LYS A 53 -21.970 3.042 -4.375 1.00 0.00 C ATOM 810 NZ LYS A 53 -23.420 3.192 -4.667 1.00 0.00 N ATOM 0 H LYS A 53 -17.768 5.663 -3.107 1.00 0.00 H new ATOM 0 HA LYS A 53 -18.001 3.239 -1.398 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -20.108 4.427 -2.147 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -19.644 4.079 -3.801 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -19.750 1.662 -3.362 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -20.102 1.957 -1.671 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -22.160 1.440 -2.958 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -22.229 3.039 -2.243 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -21.486 4.017 -4.435 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -21.511 2.411 -5.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -23.570 4.035 -5.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -23.761 2.350 -5.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -23.945 3.297 -3.775 1.00 0.00 H new ATOM 824 N LYS A 54 -15.917 3.337 -3.371 1.00 0.00 N ATOM 825 CA LYS A 54 -14.970 2.768 -4.318 1.00 0.00 C ATOM 826 C LYS A 54 -13.803 2.138 -3.561 1.00 0.00 C ATOM 827 O LYS A 54 -13.350 2.672 -2.544 1.00 0.00 O ATOM 828 CB LYS A 54 -14.441 3.855 -5.255 1.00 0.00 C ATOM 829 CG LYS A 54 -13.776 4.981 -4.498 1.00 0.00 C ATOM 830 CD LYS A 54 -13.227 6.066 -5.407 1.00 0.00 C ATOM 831 CE LYS A 54 -12.564 7.158 -4.581 1.00 0.00 C ATOM 832 NZ LYS A 54 -11.977 8.242 -5.409 1.00 0.00 N ATOM 0 H LYS A 54 -15.506 4.007 -2.721 1.00 0.00 H new ATOM 0 HA LYS A 54 -15.478 2.006 -4.909 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -13.728 3.416 -5.953 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -15.264 4.254 -5.849 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -14.496 5.422 -3.809 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -12.964 4.575 -3.894 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -12.505 5.637 -6.102 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -14.033 6.491 -6.006 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -13.299 7.587 -3.900 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -11.781 6.715 -3.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -11.526 8.946 -4.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -11.266 7.841 -6.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -12.728 8.700 -5.965 1.00 0.00 H new ATOM 846 N VAL A 55 -13.330 1.005 -4.043 1.00 0.00 N ATOM 847 CA VAL A 55 -12.203 0.323 -3.423 1.00 0.00 C ATOM 848 C VAL A 55 -11.070 0.069 -4.428 1.00 0.00 C ATOM 849 O VAL A 55 -11.319 -0.211 -5.598 1.00 0.00 O ATOM 850 CB VAL A 55 -12.663 -1.018 -2.814 1.00 0.00 C ATOM 851 CG1 VAL A 55 -11.492 -1.948 -2.596 1.00 0.00 C ATOM 852 CG2 VAL A 55 -13.393 -0.786 -1.504 1.00 0.00 C ATOM 0 H VAL A 55 -13.708 0.534 -4.865 1.00 0.00 H new ATOM 0 HA VAL A 55 -11.819 0.973 -2.636 1.00 0.00 H new ATOM 0 HB VAL A 55 -13.346 -1.487 -3.522 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -11.846 -2.885 -2.166 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -11.004 -2.148 -3.550 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -10.780 -1.483 -1.915 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -13.710 -1.743 -1.090 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -12.727 -0.288 -0.799 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -14.268 -0.160 -1.681 1.00 0.00 H new ATOM 862 N HIS A 56 -9.822 0.155 -3.960 1.00 0.00 N ATOM 863 CA HIS A 56 -8.664 -0.151 -4.798 1.00 0.00 C ATOM 864 C HIS A 56 -7.806 -1.249 -4.198 1.00 0.00 C ATOM 865 O HIS A 56 -7.249 -1.091 -3.111 1.00 0.00 O ATOM 866 CB HIS A 56 -7.795 1.079 -5.064 1.00 0.00 C ATOM 867 CG HIS A 56 -7.496 1.910 -3.859 1.00 0.00 C ATOM 868 ND1 HIS A 56 -6.330 1.792 -3.136 1.00 0.00 N ATOM 869 CD2 HIS A 56 -8.202 2.902 -3.274 1.00 0.00 C ATOM 870 CE1 HIS A 56 -6.329 2.673 -2.165 1.00 0.00 C ATOM 871 NE2 HIS A 56 -7.452 3.359 -2.224 1.00 0.00 N ATOM 0 H HIS A 56 -9.590 0.434 -3.007 1.00 0.00 H new ATOM 0 HA HIS A 56 -9.072 -0.497 -5.748 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -6.853 0.752 -5.505 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -8.293 1.705 -5.804 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -9.173 3.265 -3.577 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -5.541 2.813 -1.440 1.00 0.00 H new ATOM 0 HE2 HIS A 56 -7.720 4.111 -1.589 1.00 0.00 H new ATOM 880 N VAL A 57 -7.682 -2.344 -4.938 1.00 0.00 N ATOM 881 CA VAL A 57 -6.908 -3.497 -4.502 1.00 0.00 C ATOM 882 C VAL A 57 -5.439 -3.326 -4.847 1.00 0.00 C ATOM 883 O VAL A 57 -5.078 -3.185 -6.019 1.00 0.00 O ATOM 884 CB VAL A 57 -7.415 -4.799 -5.159 1.00 0.00 C ATOM 885 CG1 VAL A 57 -6.598 -5.999 -4.690 1.00 0.00 C ATOM 886 CG2 VAL A 57 -8.895 -5.006 -4.878 1.00 0.00 C ATOM 0 H VAL A 57 -8.114 -2.457 -5.855 1.00 0.00 H new ATOM 0 HA VAL A 57 -7.030 -3.567 -3.421 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.286 -4.706 -6.237 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -6.974 -6.904 -5.167 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -5.552 -5.855 -4.960 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -6.683 -6.097 -3.608 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.229 -5.929 -5.351 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.055 -5.071 -3.802 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.462 -4.167 -5.280 1.00 0.00 H new ATOM 896 N PHE A 58 -4.598 -3.334 -3.828 1.00 0.00 N ATOM 897 CA PHE A 58 -3.169 -3.272 -4.032 1.00 0.00 C ATOM 898 C PHE A 58 -2.486 -4.359 -3.199 1.00 0.00 C ATOM 899 O PHE A 58 -2.678 -4.431 -1.989 1.00 0.00 O ATOM 900 CB PHE A 58 -2.591 -1.921 -3.617 1.00 0.00 C ATOM 901 CG PHE A 58 -2.931 -0.716 -4.436 1.00 0.00 C ATOM 902 CD1 PHE A 58 -4.230 -0.242 -4.573 1.00 0.00 C ATOM 903 CD2 PHE A 58 -1.902 -0.007 -5.021 1.00 0.00 C ATOM 904 CE1 PHE A 58 -4.471 0.909 -5.283 1.00 0.00 C ATOM 905 CE2 PHE A 58 -2.147 1.149 -5.716 1.00 0.00 C ATOM 906 CZ PHE A 58 -3.437 1.605 -5.844 1.00 0.00 C ATOM 0 H PHE A 58 -4.885 -3.383 -2.850 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.986 -3.418 -5.097 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.908 -1.726 -2.593 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.505 -2.016 -3.602 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -5.051 -0.779 -4.121 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -0.888 -0.368 -4.930 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.484 1.266 -5.399 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.330 1.698 -6.161 1.00 0.00 H new ATOM 0 HZ PHE A 58 -3.634 2.516 -6.389 1.00 0.00 H new ATOM 916 N LYS A 59 -1.698 -5.198 -3.837 1.00 0.00 N ATOM 917 CA LYS A 59 -0.942 -6.223 -3.119 1.00 0.00 C ATOM 918 C LYS A 59 0.379 -5.643 -2.615 1.00 0.00 C ATOM 919 O LYS A 59 1.191 -5.169 -3.398 1.00 0.00 O ATOM 920 CB LYS A 59 -0.718 -7.423 -4.032 1.00 0.00 C ATOM 921 CG LYS A 59 0.082 -8.547 -3.402 1.00 0.00 C ATOM 922 CD LYS A 59 -0.340 -9.905 -3.937 1.00 0.00 C ATOM 923 CE LYS A 59 -0.641 -9.855 -5.421 1.00 0.00 C ATOM 924 NZ LYS A 59 -0.982 -11.194 -5.963 1.00 0.00 N ATOM 0 H LYS A 59 -1.559 -5.197 -4.847 1.00 0.00 H new ATOM 0 HA LYS A 59 -1.507 -6.559 -2.250 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -1.687 -7.813 -4.344 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -0.204 -7.088 -4.933 1.00 0.00 H new ATOM 0 HG2 LYS A 59 1.143 -8.392 -3.598 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -0.049 -8.525 -2.320 1.00 0.00 H new ATOM 0 HD2 LYS A 59 0.451 -10.631 -3.751 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -1.223 -10.250 -3.398 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -1.469 -9.169 -5.600 1.00 0.00 H new ATOM 0 HE3 LYS A 59 0.223 -9.457 -5.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -1.181 -11.116 -6.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -0.182 -11.842 -5.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -1.822 -11.563 -5.473 1.00 0.00 H new ATOM 938 N ALA A 60 0.595 -5.714 -1.308 1.00 0.00 N ATOM 939 CA ALA A 60 1.641 -4.925 -0.654 1.00 0.00 C ATOM 940 C ALA A 60 2.690 -5.796 0.043 1.00 0.00 C ATOM 941 O ALA A 60 2.371 -6.847 0.601 1.00 0.00 O ATOM 942 CB ALA A 60 1.001 -3.987 0.357 1.00 0.00 C ATOM 0 H ALA A 60 0.061 -6.310 -0.675 1.00 0.00 H new ATOM 0 HA ALA A 60 2.159 -4.360 -1.429 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.775 -3.397 0.847 1.00 0.00 H new ATOM 0 HB2 ALA A 60 0.306 -3.321 -0.154 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.462 -4.570 1.104 1.00 0.00 H new ATOM 948 N TRP A 61 3.934 -5.332 0.005 1.00 0.00 N ATOM 949 CA TRP A 61 5.051 -5.967 0.696 1.00 0.00 C ATOM 950 C TRP A 61 6.179 -4.955 0.789 1.00 0.00 C ATOM 951 O TRP A 61 6.061 -3.865 0.242 1.00 0.00 O ATOM 952 CB TRP A 61 5.546 -7.214 -0.051 1.00 0.00 C ATOM 953 CG TRP A 61 6.405 -6.919 -1.245 1.00 0.00 C ATOM 954 CD1 TRP A 61 7.769 -6.972 -1.298 1.00 0.00 C ATOM 955 CD2 TRP A 61 5.965 -6.530 -2.550 1.00 0.00 C ATOM 956 NE1 TRP A 61 8.206 -6.664 -2.559 1.00 0.00 N ATOM 957 CE2 TRP A 61 7.115 -6.378 -3.348 1.00 0.00 C ATOM 958 CE3 TRP A 61 4.710 -6.297 -3.124 1.00 0.00 C ATOM 959 CZ2 TRP A 61 7.043 -6.007 -4.689 1.00 0.00 C ATOM 960 CZ3 TRP A 61 4.641 -5.931 -4.449 1.00 0.00 C ATOM 961 CH2 TRP A 61 5.800 -5.788 -5.222 1.00 0.00 C ATOM 0 H TRP A 61 4.199 -4.494 -0.513 1.00 0.00 H new ATOM 0 HA TRP A 61 4.721 -6.286 1.685 1.00 0.00 H new ATOM 0 HB2 TRP A 61 6.110 -7.838 0.642 1.00 0.00 H new ATOM 0 HB3 TRP A 61 4.683 -7.796 -0.374 1.00 0.00 H new ATOM 0 HD1 TRP A 61 8.410 -7.221 -0.466 1.00 0.00 H new ATOM 0 HE1 TRP A 61 9.179 -6.649 -2.863 1.00 0.00 H new ATOM 0 HE3 TRP A 61 3.810 -6.403 -2.537 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 7.935 -5.896 -5.287 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 3.676 -5.751 -4.900 1.00 0.00 H new ATOM 0 HH2 TRP A 61 5.712 -5.499 -6.259 1.00 0.00 H new ATOM 972 N LYS A 62 7.268 -5.280 1.466 1.00 0.00 N ATOM 973 CA LYS A 62 8.415 -4.385 1.438 1.00 0.00 C ATOM 974 C LYS A 62 9.736 -5.152 1.394 1.00 0.00 C ATOM 975 O LYS A 62 10.142 -5.738 2.399 1.00 0.00 O ATOM 976 CB LYS A 62 8.371 -3.516 2.711 1.00 0.00 C ATOM 977 CG LYS A 62 7.228 -2.505 2.728 1.00 0.00 C ATOM 978 CD LYS A 62 6.772 -2.088 4.125 1.00 0.00 C ATOM 979 CE LYS A 62 7.902 -1.906 5.119 1.00 0.00 C ATOM 980 NZ LYS A 62 8.796 -0.770 4.774 1.00 0.00 N ATOM 0 H LYS A 62 7.383 -6.126 2.024 1.00 0.00 H new ATOM 0 HA LYS A 62 8.362 -3.774 0.537 1.00 0.00 H new ATOM 0 HB2 LYS A 62 8.281 -4.167 3.581 1.00 0.00 H new ATOM 0 HB3 LYS A 62 9.317 -2.983 2.808 1.00 0.00 H new ATOM 0 HG2 LYS A 62 7.539 -1.615 2.180 1.00 0.00 H new ATOM 0 HG3 LYS A 62 6.378 -2.928 2.193 1.00 0.00 H new ATOM 0 HD2 LYS A 62 6.215 -1.154 4.050 1.00 0.00 H new ATOM 0 HD3 LYS A 62 6.082 -2.840 4.509 1.00 0.00 H new ATOM 0 HE2 LYS A 62 7.483 -1.744 6.112 1.00 0.00 H new ATOM 0 HE3 LYS A 62 8.489 -2.823 5.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 9.587 -0.734 5.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 9.167 -0.900 3.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 8.260 0.120 4.821 1.00 0.00 H new ATOM 994 N GLU A 63 10.405 -5.132 0.218 1.00 0.00 N ATOM 995 CA GLU A 63 11.841 -5.418 0.083 1.00 0.00 C ATOM 996 C GLU A 63 12.307 -5.381 -1.390 1.00 0.00 C ATOM 997 O GLU A 63 12.309 -6.410 -2.065 1.00 0.00 O ATOM 998 CB GLU A 63 12.039 -6.820 0.542 1.00 0.00 C ATOM 999 CG GLU A 63 10.978 -7.711 -0.086 1.00 0.00 C ATOM 1000 CD GLU A 63 11.183 -9.184 0.187 1.00 0.00 C ATOM 1001 OE1 GLU A 63 12.146 -9.758 -0.364 1.00 0.00 O ATOM 1002 OE2 GLU A 63 10.369 -9.776 0.920 1.00 0.00 O ATOM 0 H GLU A 63 9.953 -4.914 -0.670 1.00 0.00 H new ATOM 0 HA GLU A 63 12.399 -4.674 0.652 1.00 0.00 H new ATOM 0 HB2 GLU A 63 13.034 -7.168 0.264 1.00 0.00 H new ATOM 0 HB3 GLU A 63 11.976 -6.871 1.629 1.00 0.00 H new ATOM 0 HG2 GLU A 63 9.998 -7.414 0.288 1.00 0.00 H new ATOM 0 HG3 GLU A 63 10.970 -7.548 -1.164 1.00 0.00 H new ATOM 1009 N ILE A 64 12.720 -4.263 -1.902 1.00 0.00 N ATOM 1010 CA ILE A 64 13.407 -4.233 -3.179 1.00 0.00 C ATOM 1011 C ILE A 64 13.999 -2.879 -3.468 1.00 0.00 C ATOM 1012 O ILE A 64 13.254 -1.971 -3.834 1.00 0.00 O ATOM 1013 CB ILE A 64 12.522 -4.754 -4.329 1.00 0.00 C ATOM 1014 CG1 ILE A 64 13.318 -4.970 -5.632 1.00 0.00 C ATOM 1015 CG2 ILE A 64 11.287 -3.894 -4.572 1.00 0.00 C ATOM 1016 CD1 ILE A 64 13.557 -3.721 -6.459 1.00 0.00 C ATOM 0 H ILE A 64 12.598 -3.351 -1.462 1.00 0.00 H new ATOM 0 HA ILE A 64 14.245 -4.926 -3.106 1.00 0.00 H new ATOM 0 HB ILE A 64 12.164 -5.729 -3.998 1.00 0.00 H new ATOM 0 HG12 ILE A 64 14.283 -5.410 -5.380 1.00 0.00 H new ATOM 0 HG13 ILE A 64 12.787 -5.697 -6.247 1.00 0.00 H new ATOM 0 HG21 ILE A 64 10.707 -4.314 -5.394 1.00 0.00 H new ATOM 0 HG22 ILE A 64 10.676 -3.872 -3.670 1.00 0.00 H new ATOM 0 HG23 ILE A 64 11.594 -2.880 -4.827 1.00 0.00 H new ATOM 0 HD11 ILE A 64 14.124 -3.980 -7.353 1.00 0.00 H new ATOM 0 HD12 ILE A 64 12.600 -3.288 -6.749 1.00 0.00 H new ATOM 0 HD13 ILE A 64 14.119 -2.996 -5.870 1.00 0.00 H new ATOM 1028 N VAL A 65 15.277 -2.665 -3.318 1.00 0.00 N ATOM 1029 CA VAL A 65 15.845 -1.476 -3.937 1.00 0.00 C ATOM 1030 C VAL A 65 17.230 -1.759 -4.474 1.00 0.00 C ATOM 1031 O VAL A 65 17.947 -2.616 -3.968 1.00 0.00 O ATOM 1032 CB VAL A 65 15.917 -0.230 -3.013 1.00 0.00 C ATOM 1033 CG1 VAL A 65 14.667 -0.089 -2.152 1.00 0.00 C ATOM 1034 CG2 VAL A 65 17.180 -0.223 -2.158 1.00 0.00 C ATOM 0 H VAL A 65 15.926 -3.258 -2.802 1.00 0.00 H new ATOM 0 HA VAL A 65 15.152 -1.232 -4.742 1.00 0.00 H new ATOM 0 HB VAL A 65 15.964 0.640 -3.668 1.00 0.00 H new ATOM 0 HG11 VAL A 65 14.758 0.795 -1.521 1.00 0.00 H new ATOM 0 HG12 VAL A 65 13.792 0.012 -2.794 1.00 0.00 H new ATOM 0 HG13 VAL A 65 14.556 -0.973 -1.525 1.00 0.00 H new ATOM 0 HG21 VAL A 65 17.188 0.666 -1.528 1.00 0.00 H new ATOM 0 HG22 VAL A 65 17.199 -1.113 -1.529 1.00 0.00 H new ATOM 0 HG23 VAL A 65 18.057 -0.217 -2.805 1.00 0.00 H new ATOM 1044 N ASP A 66 17.571 -1.075 -5.542 1.00 0.00 N ATOM 1045 CA ASP A 66 18.933 -1.101 -6.045 1.00 0.00 C ATOM 1046 C ASP A 66 19.667 0.153 -5.597 1.00 0.00 C ATOM 1047 O ASP A 66 19.892 1.077 -6.384 1.00 0.00 O ATOM 1048 CB ASP A 66 18.965 -1.231 -7.564 1.00 0.00 C ATOM 1049 CG ASP A 66 20.363 -1.514 -8.075 1.00 0.00 C ATOM 1050 OD1 ASP A 66 20.994 -2.469 -7.572 1.00 0.00 O ATOM 1051 OD2 ASP A 66 20.836 -0.781 -8.970 1.00 0.00 O ATOM 0 H ASP A 66 16.929 -0.494 -6.081 1.00 0.00 H new ATOM 0 HA ASP A 66 19.435 -1.977 -5.634 1.00 0.00 H new ATOM 0 HB2 ASP A 66 18.295 -2.033 -7.874 1.00 0.00 H new ATOM 0 HB3 ASP A 66 18.592 -0.312 -8.015 1.00 0.00 H new ATOM 1056 N ALA A 67 19.977 0.196 -4.307 1.00 0.00 N ATOM 1057 CA ALA A 67 20.638 1.347 -3.709 1.00 0.00 C ATOM 1058 C ALA A 67 21.926 1.701 -4.451 1.00 0.00 C ATOM 1059 O ALA A 67 22.727 0.825 -4.792 1.00 0.00 O ATOM 1060 CB ALA A 67 20.907 1.086 -2.243 1.00 0.00 C ATOM 0 H ALA A 67 19.779 -0.560 -3.651 1.00 0.00 H new ATOM 0 HA ALA A 67 19.972 2.206 -3.794 1.00 0.00 H new ATOM 0 HB1 ALA A 67 21.402 1.952 -1.804 1.00 0.00 H new ATOM 0 HB2 ALA A 67 19.964 0.906 -1.726 1.00 0.00 H new ATOM 0 HB3 ALA A 67 21.549 0.211 -2.141 1.00 0.00 H new ATOM 1066 N PRO A 68 22.131 3.007 -4.703 1.00 0.00 N ATOM 1067 CA PRO A 68 23.256 3.521 -5.486 1.00 0.00 C ATOM 1068 C PRO A 68 24.554 3.568 -4.702 1.00 0.00 C ATOM 1069 O PRO A 68 24.820 2.737 -3.854 1.00 0.00 O ATOM 1070 CB PRO A 68 22.819 4.953 -5.854 1.00 0.00 C ATOM 1071 CG PRO A 68 21.430 5.114 -5.327 1.00 0.00 C ATOM 1072 CD PRO A 68 21.275 4.103 -4.237 1.00 0.00 C ATOM 0 HA PRO A 68 23.463 2.880 -6.343 1.00 0.00 H new ATOM 0 HB2 PRO A 68 23.490 5.690 -5.413 1.00 0.00 H new ATOM 0 HB3 PRO A 68 22.846 5.103 -6.933 1.00 0.00 H new ATOM 0 HG2 PRO A 68 21.273 6.123 -4.946 1.00 0.00 H new ATOM 0 HG3 PRO A 68 20.694 4.952 -6.115 1.00 0.00 H new ATOM 0 HD2 PRO A 68 21.601 4.492 -3.272 1.00 0.00 H new ATOM 0 HD3 PRO A 68 20.238 3.787 -4.119 1.00 0.00 H new ATOM 1080 N LYS A 69 25.377 4.524 -5.042 1.00 0.00 N ATOM 1081 CA LYS A 69 26.602 4.790 -4.301 1.00 0.00 C ATOM 1082 C LYS A 69 26.346 5.883 -3.274 1.00 0.00 C ATOM 1083 O LYS A 69 26.790 5.799 -2.132 1.00 0.00 O ATOM 1084 CB LYS A 69 27.743 5.192 -5.243 1.00 0.00 C ATOM 1085 CG LYS A 69 28.392 4.019 -5.969 1.00 0.00 C ATOM 1086 CD LYS A 69 27.450 3.354 -6.962 1.00 0.00 C ATOM 1087 CE LYS A 69 27.136 4.259 -8.143 1.00 0.00 C ATOM 1088 NZ LYS A 69 28.356 4.601 -8.920 1.00 0.00 N ATOM 0 H LYS A 69 25.226 5.145 -5.837 1.00 0.00 H new ATOM 0 HA LYS A 69 26.906 3.877 -3.788 1.00 0.00 H new ATOM 0 HB2 LYS A 69 27.359 5.896 -5.982 1.00 0.00 H new ATOM 0 HB3 LYS A 69 28.506 5.717 -4.669 1.00 0.00 H new ATOM 0 HG2 LYS A 69 29.281 4.368 -6.494 1.00 0.00 H new ATOM 0 HG3 LYS A 69 28.723 3.282 -5.238 1.00 0.00 H new ATOM 0 HD2 LYS A 69 27.899 2.429 -7.324 1.00 0.00 H new ATOM 0 HD3 LYS A 69 26.523 3.083 -6.457 1.00 0.00 H new ATOM 0 HE2 LYS A 69 26.416 3.766 -8.796 1.00 0.00 H new ATOM 0 HE3 LYS A 69 26.666 5.175 -7.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 28.081 4.981 -9.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 28.908 5.315 -8.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 28.934 3.747 -9.053 1.00 0.00 H new ATOM 1102 N ASN A 70 25.607 6.900 -3.707 1.00 0.00 N ATOM 1103 CA ASN A 70 25.202 8.026 -2.853 1.00 0.00 C ATOM 1104 C ASN A 70 24.150 7.609 -1.816 1.00 0.00 C ATOM 1105 O ASN A 70 23.283 8.403 -1.444 1.00 0.00 O ATOM 1106 CB ASN A 70 24.635 9.165 -3.710 1.00 0.00 C ATOM 1107 CG ASN A 70 25.537 9.540 -4.874 1.00 0.00 C ATOM 1108 OD1 ASN A 70 26.752 9.352 -4.827 1.00 0.00 O ATOM 1109 ND2 ASN A 70 24.947 10.082 -5.929 1.00 0.00 N ATOM 0 H ASN A 70 25.267 6.972 -4.666 1.00 0.00 H new ATOM 0 HA ASN A 70 26.093 8.363 -2.323 1.00 0.00 H new ATOM 0 HB2 ASN A 70 23.658 8.871 -4.095 1.00 0.00 H new ATOM 0 HB3 ASN A 70 24.479 10.042 -3.082 1.00 0.00 H new ATOM 0 HD21 ASN A 70 25.503 10.359 -6.738 1.00 0.00 H new ATOM 0 HD22 ASN A 70 23.937 10.223 -5.932 1.00 0.00 H new ATOM 1116 N ARG A 71 24.217 6.357 -1.377 1.00 0.00 N ATOM 1117 CA ARG A 71 23.296 5.826 -0.378 1.00 0.00 C ATOM 1118 C ARG A 71 23.422 6.552 0.958 1.00 0.00 C ATOM 1119 O ARG A 71 24.415 7.232 1.230 1.00 0.00 O ATOM 1120 CB ARG A 71 23.588 4.354 -0.093 1.00 0.00 C ATOM 1121 CG ARG A 71 23.541 3.422 -1.284 1.00 0.00 C ATOM 1122 CD ARG A 71 24.018 2.039 -0.863 1.00 0.00 C ATOM 1123 NE ARG A 71 24.081 1.101 -1.972 1.00 0.00 N ATOM 1124 CZ ARG A 71 24.675 -0.086 -1.909 1.00 0.00 C ATOM 1125 NH1 ARG A 71 25.273 -0.472 -0.790 1.00 0.00 N ATOM 1126 NH2 ARG A 71 24.684 -0.881 -2.972 1.00 0.00 N ATOM 0 H ARG A 71 24.910 5.683 -1.703 1.00 0.00 H new ATOM 0 HA ARG A 71 22.298 5.963 -0.794 1.00 0.00 H new ATOM 0 HB2 ARG A 71 24.577 4.282 0.360 1.00 0.00 H new ATOM 0 HB3 ARG A 71 22.872 4.000 0.648 1.00 0.00 H new ATOM 0 HG2 ARG A 71 22.525 3.365 -1.675 1.00 0.00 H new ATOM 0 HG3 ARG A 71 24.170 3.807 -2.086 1.00 0.00 H new ATOM 0 HD2 ARG A 71 25.005 2.123 -0.408 1.00 0.00 H new ATOM 0 HD3 ARG A 71 23.348 1.646 -0.099 1.00 0.00 H new ATOM 0 HE ARG A 71 23.642 1.371 -2.852 1.00 0.00 H new ATOM 0 HH11 ARG A 71 25.277 0.143 0.024 1.00 0.00 H new ATOM 0 HH12 ARG A 71 25.728 -1.383 -0.743 1.00 0.00 H new ATOM 0 HH21 ARG A 71 24.235 -0.581 -3.837 1.00 0.00 H new ATOM 0 HH22 ARG A 71 25.140 -1.792 -2.924 1.00 0.00 H new ATOM 1140 N PRO A 72 22.400 6.394 1.808 1.00 0.00 N ATOM 1141 CA PRO A 72 22.480 6.711 3.231 1.00 0.00 C ATOM 1142 C PRO A 72 23.328 5.671 3.942 1.00 0.00 C ATOM 1143 O PRO A 72 23.368 4.510 3.534 1.00 0.00 O ATOM 1144 CB PRO A 72 21.024 6.613 3.714 1.00 0.00 C ATOM 1145 CG PRO A 72 20.201 6.547 2.477 1.00 0.00 C ATOM 1146 CD PRO A 72 21.072 5.896 1.448 1.00 0.00 C ATOM 0 HA PRO A 72 22.928 7.686 3.425 1.00 0.00 H new ATOM 0 HB2 PRO A 72 20.874 5.729 4.333 1.00 0.00 H new ATOM 0 HB3 PRO A 72 20.752 7.477 4.321 1.00 0.00 H new ATOM 0 HG2 PRO A 72 19.291 5.970 2.642 1.00 0.00 H new ATOM 0 HG3 PRO A 72 19.894 7.543 2.157 1.00 0.00 H new ATOM 0 HD2 PRO A 72 21.018 4.808 1.498 1.00 0.00 H new ATOM 0 HD3 PRO A 72 20.790 6.183 0.435 1.00 0.00 H new ATOM 1154 N ALA A 73 23.970 6.090 5.017 1.00 0.00 N ATOM 1155 CA ALA A 73 24.956 5.273 5.711 1.00 0.00 C ATOM 1156 C ALA A 73 24.362 3.978 6.264 1.00 0.00 C ATOM 1157 O ALA A 73 25.085 3.020 6.532 1.00 0.00 O ATOM 1158 CB ALA A 73 25.582 6.088 6.826 1.00 0.00 C ATOM 0 H ALA A 73 23.824 7.008 5.437 1.00 0.00 H new ATOM 0 HA ALA A 73 25.717 4.980 4.988 1.00 0.00 H new ATOM 0 HB1 ALA A 73 26.321 5.481 7.349 1.00 0.00 H new ATOM 0 HB2 ALA A 73 26.068 6.968 6.405 1.00 0.00 H new ATOM 0 HB3 ALA A 73 24.808 6.401 7.527 1.00 0.00 H new ATOM 1164 N TRP A 74 23.049 3.960 6.444 1.00 0.00 N ATOM 1165 CA TRP A 74 22.365 2.781 6.960 1.00 0.00 C ATOM 1166 C TRP A 74 21.957 1.824 5.844 1.00 0.00 C ATOM 1167 O TRP A 74 21.802 0.626 6.073 1.00 0.00 O ATOM 1168 CB TRP A 74 21.125 3.189 7.765 1.00 0.00 C ATOM 1169 CG TRP A 74 20.155 4.050 7.005 1.00 0.00 C ATOM 1170 CD1 TRP A 74 20.137 5.415 6.967 1.00 0.00 C ATOM 1171 CD2 TRP A 74 19.056 3.616 6.183 1.00 0.00 C ATOM 1172 NE1 TRP A 74 19.106 5.851 6.178 1.00 0.00 N ATOM 1173 CE2 TRP A 74 18.428 4.773 5.689 1.00 0.00 C ATOM 1174 CE3 TRP A 74 18.540 2.366 5.815 1.00 0.00 C ATOM 1175 CZ2 TRP A 74 17.320 4.725 4.855 1.00 0.00 C ATOM 1176 CZ3 TRP A 74 17.436 2.320 4.984 1.00 0.00 C ATOM 1177 CH2 TRP A 74 16.836 3.494 4.513 1.00 0.00 C ATOM 0 H TRP A 74 22.435 4.749 6.240 1.00 0.00 H new ATOM 0 HA TRP A 74 23.069 2.262 7.610 1.00 0.00 H new ATOM 0 HB2 TRP A 74 20.610 2.289 8.100 1.00 0.00 H new ATOM 0 HB3 TRP A 74 21.445 3.724 8.659 1.00 0.00 H new ATOM 0 HD1 TRP A 74 20.834 6.057 7.484 1.00 0.00 H new ATOM 0 HE1 TRP A 74 18.881 6.827 5.986 1.00 0.00 H new ATOM 0 HE3 TRP A 74 18.996 1.455 6.174 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 16.856 5.629 4.489 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 17.030 1.362 4.693 1.00 0.00 H new ATOM 0 HH2 TRP A 74 15.974 3.425 3.867 1.00 0.00 H new ATOM 1188 N MET A 75 21.778 2.350 4.642 1.00 0.00 N ATOM 1189 CA MET A 75 21.181 1.578 3.563 1.00 0.00 C ATOM 1190 C MET A 75 22.215 0.729 2.828 1.00 0.00 C ATOM 1191 O MET A 75 23.231 1.243 2.359 1.00 0.00 O ATOM 1192 CB MET A 75 20.485 2.514 2.575 1.00 0.00 C ATOM 1193 CG MET A 75 19.494 1.797 1.683 1.00 0.00 C ATOM 1194 SD MET A 75 18.807 2.845 0.382 1.00 0.00 S ATOM 1195 CE MET A 75 17.903 4.055 1.341 1.00 0.00 C ATOM 0 H MET A 75 22.036 3.304 4.390 1.00 0.00 H new ATOM 0 HA MET A 75 20.452 0.901 4.008 1.00 0.00 H new ATOM 0 HB2 MET A 75 19.968 3.298 3.128 1.00 0.00 H new ATOM 0 HB3 MET A 75 21.236 3.004 1.955 1.00 0.00 H new ATOM 0 HG2 MET A 75 19.984 0.938 1.225 1.00 0.00 H new ATOM 0 HG3 MET A 75 18.679 1.410 2.295 1.00 0.00 H new ATOM 0 HE1 MET A 75 17.959 5.025 0.848 1.00 0.00 H new ATOM 0 HE2 MET A 75 16.860 3.749 1.423 1.00 0.00 H new ATOM 0 HE3 MET A 75 18.339 4.129 2.337 1.00 0.00 H new ATOM 1205 N PRO A 76 21.969 -0.589 2.726 1.00 0.00 N ATOM 1206 CA PRO A 76 22.784 -1.490 1.939 1.00 0.00 C ATOM 1207 C PRO A 76 22.278 -1.631 0.513 1.00 0.00 C ATOM 1208 O PRO A 76 21.500 -0.810 0.037 1.00 0.00 O ATOM 1209 CB PRO A 76 22.632 -2.816 2.653 1.00 0.00 C ATOM 1210 CG PRO A 76 21.316 -2.762 3.322 1.00 0.00 C ATOM 1211 CD PRO A 76 20.881 -1.319 3.379 1.00 0.00 C ATOM 0 HA PRO A 76 23.811 -1.133 1.860 1.00 0.00 H new ATOM 0 HB2 PRO A 76 22.680 -3.647 1.949 1.00 0.00 H new ATOM 0 HB3 PRO A 76 23.433 -2.965 3.377 1.00 0.00 H new ATOM 0 HG2 PRO A 76 20.586 -3.359 2.775 1.00 0.00 H new ATOM 0 HG3 PRO A 76 21.382 -3.180 4.326 1.00 0.00 H new ATOM 0 HD2 PRO A 76 19.934 -1.168 2.862 1.00 0.00 H new ATOM 0 HD3 PRO A 76 20.739 -0.986 4.407 1.00 0.00 H new ATOM 1219 N GLU A 77 22.741 -2.691 -0.139 1.00 0.00 N ATOM 1220 CA GLU A 77 22.435 -2.949 -1.540 1.00 0.00 C ATOM 1221 C GLU A 77 20.951 -2.900 -1.811 1.00 0.00 C ATOM 1222 O GLU A 77 20.465 -2.009 -2.508 1.00 0.00 O ATOM 1223 CB GLU A 77 22.957 -4.310 -1.990 1.00 0.00 C ATOM 1224 CG GLU A 77 24.327 -4.680 -1.447 1.00 0.00 C ATOM 1225 CD GLU A 77 25.390 -3.658 -1.767 1.00 0.00 C ATOM 1226 OE1 GLU A 77 25.746 -3.507 -2.956 1.00 0.00 O ATOM 1227 OE2 GLU A 77 25.872 -2.994 -0.832 1.00 0.00 O ATOM 0 H GLU A 77 23.340 -3.396 0.290 1.00 0.00 H new ATOM 0 HA GLU A 77 22.933 -2.160 -2.103 1.00 0.00 H new ATOM 0 HB2 GLU A 77 22.243 -5.075 -1.686 1.00 0.00 H new ATOM 0 HB3 GLU A 77 22.997 -4.326 -3.079 1.00 0.00 H new ATOM 0 HG2 GLU A 77 24.262 -4.800 -0.366 1.00 0.00 H new ATOM 0 HG3 GLU A 77 24.625 -5.645 -1.857 1.00 0.00 H new ATOM 1234 N LYS A 78 20.228 -3.872 -1.290 1.00 0.00 N ATOM 1235 CA LYS A 78 18.807 -3.974 -1.572 1.00 0.00 C ATOM 1236 C LYS A 78 18.034 -3.841 -0.274 1.00 0.00 C ATOM 1237 O LYS A 78 18.423 -4.422 0.742 1.00 0.00 O ATOM 1238 CB LYS A 78 18.464 -5.317 -2.247 1.00 0.00 C ATOM 1239 CG LYS A 78 19.655 -6.064 -2.848 1.00 0.00 C ATOM 1240 CD LYS A 78 20.272 -5.338 -4.040 1.00 0.00 C ATOM 1241 CE LYS A 78 19.355 -5.334 -5.249 1.00 0.00 C ATOM 1242 NZ LYS A 78 20.048 -4.811 -6.459 1.00 0.00 N ATOM 0 H LYS A 78 20.596 -4.597 -0.674 1.00 0.00 H new ATOM 0 HA LYS A 78 18.531 -3.174 -2.259 1.00 0.00 H new ATOM 0 HB2 LYS A 78 17.983 -5.963 -1.512 1.00 0.00 H new ATOM 0 HB3 LYS A 78 17.735 -5.134 -3.036 1.00 0.00 H new ATOM 0 HG2 LYS A 78 20.416 -6.202 -2.080 1.00 0.00 H new ATOM 0 HG3 LYS A 78 19.334 -7.058 -3.161 1.00 0.00 H new ATOM 0 HD2 LYS A 78 20.502 -4.311 -3.758 1.00 0.00 H new ATOM 0 HD3 LYS A 78 21.216 -5.815 -4.304 1.00 0.00 H new ATOM 0 HE2 LYS A 78 19.000 -6.347 -5.441 1.00 0.00 H new ATOM 0 HE3 LYS A 78 18.477 -4.723 -5.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 19.428 -4.916 -7.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 20.275 -3.805 -6.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 20.926 -5.346 -6.614 1.00 0.00 H new ATOM 1256 N ILE A 79 16.924 -3.108 -0.293 1.00 0.00 N ATOM 1257 CA ILE A 79 16.253 -2.732 0.943 1.00 0.00 C ATOM 1258 C ILE A 79 14.763 -2.641 0.705 1.00 0.00 C ATOM 1259 O ILE A 79 14.298 -2.677 -0.427 1.00 0.00 O ATOM 1260 CB ILE A 79 16.759 -1.383 1.520 1.00 0.00 C ATOM 1261 CG1 ILE A 79 15.964 -0.196 0.978 1.00 0.00 C ATOM 1262 CG2 ILE A 79 18.227 -1.191 1.195 1.00 0.00 C ATOM 1263 CD1 ILE A 79 15.646 0.842 2.030 1.00 0.00 C ATOM 0 H ILE A 79 16.475 -2.766 -1.143 1.00 0.00 H new ATOM 0 HA ILE A 79 16.482 -3.506 1.675 1.00 0.00 H new ATOM 0 HB ILE A 79 16.619 -1.422 2.600 1.00 0.00 H new ATOM 0 HG12 ILE A 79 16.529 0.274 0.173 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.033 -0.559 0.543 1.00 0.00 H new ATOM 0 HG21 ILE A 79 18.569 -0.241 1.605 1.00 0.00 H new ATOM 0 HG22 ILE A 79 18.806 -2.005 1.632 1.00 0.00 H new ATOM 0 HG23 ILE A 79 18.363 -1.189 0.114 1.00 0.00 H new ATOM 0 HD11 ILE A 79 15.081 1.657 1.578 1.00 0.00 H new ATOM 0 HD12 ILE A 79 15.054 0.386 2.824 1.00 0.00 H new ATOM 0 HD13 ILE A 79 16.574 1.233 2.448 1.00 0.00 H new ATOM 1275 N SER A 80 14.034 -2.529 1.782 1.00 0.00 N ATOM 1276 CA SER A 80 12.591 -2.501 1.730 1.00 0.00 C ATOM 1277 C SER A 80 12.040 -1.081 1.810 1.00 0.00 C ATOM 1278 O SER A 80 12.678 -0.187 2.356 1.00 0.00 O ATOM 1279 CB SER A 80 12.058 -3.359 2.859 1.00 0.00 C ATOM 1280 OG SER A 80 12.615 -2.982 4.106 1.00 0.00 O ATOM 0 H SER A 80 14.421 -2.454 2.723 1.00 0.00 H new ATOM 0 HA SER A 80 12.262 -2.899 0.770 1.00 0.00 H new ATOM 0 HB2 SER A 80 10.972 -3.271 2.903 1.00 0.00 H new ATOM 0 HB3 SER A 80 12.285 -4.406 2.660 1.00 0.00 H new ATOM 0 HG SER A 80 12.250 -3.553 4.814 1.00 0.00 H new ATOM 1286 N LYS A 81 10.832 -0.895 1.279 1.00 0.00 N ATOM 1287 CA LYS A 81 10.103 0.376 1.256 1.00 0.00 C ATOM 1288 C LYS A 81 8.667 -0.078 1.074 1.00 0.00 C ATOM 1289 O LYS A 81 8.485 -1.148 0.506 1.00 0.00 O ATOM 1290 CB LYS A 81 10.435 1.274 0.052 1.00 0.00 C ATOM 1291 CG LYS A 81 11.884 1.329 -0.372 1.00 0.00 C ATOM 1292 CD LYS A 81 12.687 2.246 0.510 1.00 0.00 C ATOM 1293 CE LYS A 81 13.856 2.833 -0.258 1.00 0.00 C ATOM 1294 NZ LYS A 81 13.426 3.948 -1.142 1.00 0.00 N ATOM 0 H LYS A 81 10.313 -1.653 0.836 1.00 0.00 H new ATOM 0 HA LYS A 81 10.337 0.961 2.146 1.00 0.00 H new ATOM 0 HB2 LYS A 81 9.844 0.935 -0.799 1.00 0.00 H new ATOM 0 HB3 LYS A 81 10.109 2.288 0.283 1.00 0.00 H new ATOM 0 HG2 LYS A 81 12.311 0.327 -0.340 1.00 0.00 H new ATOM 0 HG3 LYS A 81 11.948 1.670 -1.405 1.00 0.00 H new ATOM 0 HD2 LYS A 81 12.051 3.048 0.885 1.00 0.00 H new ATOM 0 HD3 LYS A 81 13.053 1.697 1.378 1.00 0.00 H new ATOM 0 HE2 LYS A 81 14.608 3.194 0.443 1.00 0.00 H new ATOM 0 HE3 LYS A 81 14.326 2.054 -0.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 14.068 4.012 -1.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 12.457 3.772 -1.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 13.451 4.842 -0.611 1.00 0.00 H new ATOM 1308 N PRO A 82 7.638 0.634 1.567 1.00 0.00 N ATOM 1309 CA PRO A 82 6.247 0.215 1.335 1.00 0.00 C ATOM 1310 C PRO A 82 5.927 0.010 -0.144 1.00 0.00 C ATOM 1311 O PRO A 82 5.542 0.942 -0.846 1.00 0.00 O ATOM 1312 CB PRO A 82 5.426 1.376 1.877 1.00 0.00 C ATOM 1313 CG PRO A 82 6.302 2.057 2.865 1.00 0.00 C ATOM 1314 CD PRO A 82 7.727 1.821 2.426 1.00 0.00 C ATOM 0 HA PRO A 82 6.041 -0.743 1.812 1.00 0.00 H new ATOM 0 HB2 PRO A 82 5.134 2.057 1.077 1.00 0.00 H new ATOM 0 HB3 PRO A 82 4.508 1.022 2.346 1.00 0.00 H new ATOM 0 HG2 PRO A 82 6.082 3.124 2.905 1.00 0.00 H new ATOM 0 HG3 PRO A 82 6.136 1.660 3.866 1.00 0.00 H new ATOM 0 HD2 PRO A 82 8.125 2.678 1.883 1.00 0.00 H new ATOM 0 HD3 PRO A 82 8.385 1.649 3.278 1.00 0.00 H new ATOM 1322 N PHE A 83 6.110 -1.217 -0.605 1.00 0.00 N ATOM 1323 CA PHE A 83 5.712 -1.582 -1.944 1.00 0.00 C ATOM 1324 C PHE A 83 4.303 -2.080 -1.976 1.00 0.00 C ATOM 1325 O PHE A 83 3.832 -2.775 -1.078 1.00 0.00 O ATOM 1326 CB PHE A 83 6.626 -2.644 -2.529 1.00 0.00 C ATOM 1327 CG PHE A 83 8.056 -2.288 -2.384 1.00 0.00 C ATOM 1328 CD1 PHE A 83 8.491 -1.024 -2.746 1.00 0.00 C ATOM 1329 CD2 PHE A 83 8.952 -3.183 -1.843 1.00 0.00 C ATOM 1330 CE1 PHE A 83 9.807 -0.659 -2.576 1.00 0.00 C ATOM 1331 CE2 PHE A 83 10.260 -2.822 -1.661 1.00 0.00 C ATOM 1332 CZ PHE A 83 10.699 -1.557 -2.028 1.00 0.00 C ATOM 0 H PHE A 83 6.532 -1.974 -0.067 1.00 0.00 H new ATOM 0 HA PHE A 83 5.787 -0.678 -2.548 1.00 0.00 H new ATOM 0 HB2 PHE A 83 6.438 -3.597 -2.034 1.00 0.00 H new ATOM 0 HB3 PHE A 83 6.392 -2.782 -3.585 1.00 0.00 H new ATOM 0 HD1 PHE A 83 7.790 -0.318 -3.166 1.00 0.00 H new ATOM 0 HD2 PHE A 83 8.622 -4.172 -1.562 1.00 0.00 H new ATOM 0 HE1 PHE A 83 10.140 0.326 -2.870 1.00 0.00 H new ATOM 0 HE2 PHE A 83 10.955 -3.526 -1.229 1.00 0.00 H new ATOM 0 HZ PHE A 83 11.733 -1.278 -1.885 1.00 0.00 H new ATOM 1342 N VAL A 84 3.649 -1.712 -3.033 1.00 0.00 N ATOM 1343 CA VAL A 84 2.287 -2.121 -3.268 1.00 0.00 C ATOM 1344 C VAL A 84 2.073 -2.290 -4.745 1.00 0.00 C ATOM 1345 O VAL A 84 2.726 -1.624 -5.552 1.00 0.00 O ATOM 1346 CB VAL A 84 1.244 -1.133 -2.709 1.00 0.00 C ATOM 1347 CG1 VAL A 84 0.056 -1.903 -2.219 1.00 0.00 C ATOM 1348 CG2 VAL A 84 1.815 -0.278 -1.598 1.00 0.00 C ATOM 0 H VAL A 84 4.040 -1.117 -3.764 1.00 0.00 H new ATOM 0 HA VAL A 84 2.141 -3.062 -2.738 1.00 0.00 H new ATOM 0 HB VAL A 84 0.945 -0.457 -3.510 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.687 -1.212 -1.822 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.378 -2.467 -3.045 1.00 0.00 H new ATOM 0 HG13 VAL A 84 0.367 -2.592 -1.434 1.00 0.00 H new ATOM 0 HG21 VAL A 84 1.047 0.404 -1.233 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.150 -0.918 -0.782 1.00 0.00 H new ATOM 0 HG23 VAL A 84 2.659 0.297 -1.979 1.00 0.00 H new ATOM 1358 N LYS A 85 1.163 -3.157 -5.112 1.00 0.00 N ATOM 1359 CA LYS A 85 0.955 -3.466 -6.492 1.00 0.00 C ATOM 1360 C LYS A 85 -0.537 -3.489 -6.750 1.00 0.00 C ATOM 1361 O LYS A 85 -1.235 -4.434 -6.384 1.00 0.00 O ATOM 1362 CB LYS A 85 1.628 -4.812 -6.836 1.00 0.00 C ATOM 1363 CG LYS A 85 1.677 -5.159 -8.324 1.00 0.00 C ATOM 1364 CD LYS A 85 0.369 -5.762 -8.819 1.00 0.00 C ATOM 1365 CE LYS A 85 0.464 -6.223 -10.267 1.00 0.00 C ATOM 1366 NZ LYS A 85 1.494 -7.281 -10.457 1.00 0.00 N ATOM 0 H LYS A 85 0.555 -3.660 -4.466 1.00 0.00 H new ATOM 0 HA LYS A 85 1.409 -2.712 -7.135 1.00 0.00 H new ATOM 0 HB2 LYS A 85 2.647 -4.799 -6.450 1.00 0.00 H new ATOM 0 HB3 LYS A 85 1.099 -5.608 -6.312 1.00 0.00 H new ATOM 0 HG2 LYS A 85 1.900 -4.259 -8.898 1.00 0.00 H new ATOM 0 HG3 LYS A 85 2.490 -5.862 -8.505 1.00 0.00 H new ATOM 0 HD2 LYS A 85 0.098 -6.607 -8.187 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -0.428 -5.025 -8.725 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -0.506 -6.601 -10.590 1.00 0.00 H new ATOM 0 HE3 LYS A 85 0.701 -5.370 -10.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 1.344 -7.751 -11.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 2.441 -6.851 -10.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 1.418 -7.981 -9.692 1.00 0.00 H new ATOM 1380 N LYS A 86 -1.008 -2.426 -7.360 1.00 0.00 N ATOM 1381 CA LYS A 86 -2.401 -2.315 -7.705 1.00 0.00 C ATOM 1382 C LYS A 86 -2.706 -3.345 -8.762 1.00 0.00 C ATOM 1383 O LYS A 86 -2.098 -3.336 -9.834 1.00 0.00 O ATOM 1384 CB LYS A 86 -2.729 -0.905 -8.193 1.00 0.00 C ATOM 1385 CG LYS A 86 -4.134 -0.765 -8.736 1.00 0.00 C ATOM 1386 CD LYS A 86 -4.402 0.645 -9.223 1.00 0.00 C ATOM 1387 CE LYS A 86 -5.835 0.797 -9.691 1.00 0.00 C ATOM 1388 NZ LYS A 86 -6.088 2.131 -10.300 1.00 0.00 N ATOM 0 H LYS A 86 -0.440 -1.622 -7.628 1.00 0.00 H new ATOM 0 HA LYS A 86 -3.020 -2.498 -6.827 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -2.595 -0.204 -7.369 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -2.018 -0.624 -8.970 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -4.280 -1.468 -9.556 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -4.853 -1.026 -7.960 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -4.201 1.355 -8.420 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -3.722 0.886 -10.040 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -6.062 0.018 -10.419 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -6.509 0.651 -8.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -7.080 2.191 -10.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -5.897 2.875 -9.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -5.464 2.261 -11.122 1.00 0.00 H new ATOM 1402 N GLU A 87 -3.626 -4.245 -8.471 1.00 0.00 N ATOM 1403 CA GLU A 87 -3.841 -5.378 -9.336 1.00 0.00 C ATOM 1404 C GLU A 87 -5.293 -5.416 -9.776 1.00 0.00 C ATOM 1405 O GLU A 87 -5.642 -6.112 -10.729 1.00 0.00 O ATOM 1406 CB GLU A 87 -3.489 -6.686 -8.620 1.00 0.00 C ATOM 1407 CG GLU A 87 -4.364 -6.961 -7.411 1.00 0.00 C ATOM 1408 CD GLU A 87 -4.598 -8.440 -7.165 1.00 0.00 C ATOM 1409 OE1 GLU A 87 -3.646 -9.147 -6.775 1.00 0.00 O ATOM 1410 OE2 GLU A 87 -5.741 -8.908 -7.361 1.00 0.00 O ATOM 0 H GLU A 87 -4.229 -4.211 -7.649 1.00 0.00 H new ATOM 0 HA GLU A 87 -3.194 -5.274 -10.207 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.582 -7.514 -9.323 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -2.446 -6.651 -8.305 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -3.900 -6.522 -6.528 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -5.325 -6.465 -7.546 1.00 0.00 H new ATOM 1417 N ARG A 88 -6.142 -4.655 -9.088 1.00 0.00 N ATOM 1418 CA ARG A 88 -7.572 -4.751 -9.276 1.00 0.00 C ATOM 1419 C ARG A 88 -8.247 -3.564 -8.613 1.00 0.00 C ATOM 1420 O ARG A 88 -7.618 -2.794 -7.886 1.00 0.00 O ATOM 1421 CB ARG A 88 -8.079 -6.049 -8.645 1.00 0.00 C ATOM 1422 CG ARG A 88 -9.500 -6.440 -9.025 1.00 0.00 C ATOM 1423 CD ARG A 88 -10.036 -7.498 -8.077 1.00 0.00 C ATOM 1424 NE ARG A 88 -8.979 -8.415 -7.662 1.00 0.00 N ATOM 1425 CZ ARG A 88 -9.118 -9.732 -7.572 1.00 0.00 C ATOM 1426 NH1 ARG A 88 -10.295 -10.302 -7.804 1.00 0.00 N ATOM 1427 NH2 ARG A 88 -8.072 -10.476 -7.234 1.00 0.00 N ATOM 0 H ARG A 88 -5.854 -3.965 -8.394 1.00 0.00 H new ATOM 0 HA ARG A 88 -7.804 -4.751 -10.341 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -7.408 -6.859 -8.929 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -8.023 -5.954 -7.561 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -10.144 -5.561 -8.999 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -9.518 -6.818 -10.047 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -10.471 -7.018 -7.200 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -10.835 -8.056 -8.564 1.00 0.00 H new ATOM 0 HE ARG A 88 -8.071 -8.016 -7.425 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -11.100 -9.727 -8.053 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -10.394 -11.315 -7.733 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -7.172 -10.035 -7.046 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -8.168 -11.489 -7.162 1.00 0.00 H new ATOM 1441 N ILE A 89 -9.525 -3.445 -8.859 1.00 0.00 N ATOM 1442 CA ILE A 89 -10.343 -2.402 -8.312 1.00 0.00 C ATOM 1443 C ILE A 89 -11.650 -3.037 -7.882 1.00 0.00 C ATOM 1444 O ILE A 89 -12.195 -3.871 -8.603 1.00 0.00 O ATOM 1445 CB ILE A 89 -10.589 -1.303 -9.372 1.00 0.00 C ATOM 1446 CG1 ILE A 89 -9.361 -0.396 -9.508 1.00 0.00 C ATOM 1447 CG2 ILE A 89 -11.832 -0.481 -9.052 1.00 0.00 C ATOM 1448 CD1 ILE A 89 -9.040 0.388 -8.257 1.00 0.00 C ATOM 0 H ILE A 89 -10.037 -4.089 -9.462 1.00 0.00 H new ATOM 0 HA ILE A 89 -9.853 -1.929 -7.461 1.00 0.00 H new ATOM 0 HB ILE A 89 -10.760 -1.801 -10.327 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -8.498 -1.006 -9.774 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -9.525 0.301 -10.330 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -11.972 0.281 -9.819 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -12.704 -1.135 -9.027 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -11.710 -0.000 -8.081 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -8.159 1.006 -8.431 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -9.886 1.026 -8.000 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -8.843 -0.301 -7.436 1.00 0.00 H new ATOM 1460 N GLU A 90 -12.143 -2.683 -6.715 1.00 0.00 N ATOM 1461 CA GLU A 90 -13.356 -3.275 -6.213 1.00 0.00 C ATOM 1462 C GLU A 90 -14.417 -2.209 -6.068 1.00 0.00 C ATOM 1463 O GLU A 90 -14.128 -1.089 -5.654 1.00 0.00 O ATOM 1464 CB GLU A 90 -13.105 -3.967 -4.883 1.00 0.00 C ATOM 1465 CG GLU A 90 -12.592 -5.387 -5.026 1.00 0.00 C ATOM 1466 CD GLU A 90 -13.633 -6.320 -5.613 1.00 0.00 C ATOM 1467 OE1 GLU A 90 -14.789 -6.300 -5.136 1.00 0.00 O ATOM 1468 OE2 GLU A 90 -13.298 -7.080 -6.546 1.00 0.00 O ATOM 0 H GLU A 90 -11.720 -1.988 -6.099 1.00 0.00 H new ATOM 0 HA GLU A 90 -13.703 -4.027 -6.921 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -12.383 -3.385 -4.310 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -14.032 -3.980 -4.309 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -11.707 -5.388 -5.662 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -12.284 -5.759 -4.049 1.00 0.00 H new ATOM 1475 N LYS A 91 -15.636 -2.544 -6.416 1.00 0.00 N ATOM 1476 CA LYS A 91 -16.704 -1.571 -6.393 1.00 0.00 C ATOM 1477 C LYS A 91 -18.000 -2.186 -5.918 1.00 0.00 C ATOM 1478 O LYS A 91 -18.245 -3.379 -6.094 1.00 0.00 O ATOM 1479 CB LYS A 91 -16.920 -0.964 -7.784 1.00 0.00 C ATOM 1480 CG LYS A 91 -17.163 -2.001 -8.872 1.00 0.00 C ATOM 1481 CD LYS A 91 -18.119 -1.495 -9.945 1.00 0.00 C ATOM 1482 CE LYS A 91 -17.624 -0.216 -10.601 1.00 0.00 C ATOM 1483 NZ LYS A 91 -18.545 0.238 -11.677 1.00 0.00 N ATOM 0 H LYS A 91 -15.914 -3.478 -6.717 1.00 0.00 H new ATOM 0 HA LYS A 91 -16.407 -0.787 -5.696 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -17.771 -0.284 -7.746 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -16.047 -0.368 -8.050 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -16.213 -2.272 -9.332 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -17.570 -2.907 -8.424 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -18.248 -2.265 -10.706 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -19.099 -1.318 -9.501 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -17.529 0.567 -9.848 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -16.630 -0.381 -11.017 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -18.177 1.113 -12.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -18.616 -0.499 -12.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -19.487 0.419 -11.275 1.00 0.00 H new ATOM 1497 N LEU A 92 -18.803 -1.361 -5.280 1.00 0.00 N ATOM 1498 CA LEU A 92 -20.202 -1.668 -5.064 1.00 0.00 C ATOM 1499 C LEU A 92 -21.025 -0.535 -5.632 1.00 0.00 C ATOM 1500 O LEU A 92 -20.537 0.589 -5.743 1.00 0.00 O ATOM 1501 CB LEU A 92 -20.529 -1.877 -3.594 1.00 0.00 C ATOM 1502 CG LEU A 92 -20.024 -3.192 -3.006 1.00 0.00 C ATOM 1503 CD1 LEU A 92 -20.441 -3.311 -1.553 1.00 0.00 C ATOM 1504 CD2 LEU A 92 -20.551 -4.373 -3.811 1.00 0.00 C ATOM 0 H LEU A 92 -18.507 -0.463 -4.898 1.00 0.00 H new ATOM 0 HA LEU A 92 -20.437 -2.606 -5.567 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -20.105 -1.053 -3.021 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -21.611 -1.830 -3.467 1.00 0.00 H new ATOM 0 HG LEU A 92 -18.935 -3.201 -3.057 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -20.075 -4.253 -1.145 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -20.020 -2.482 -0.985 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -21.528 -3.284 -1.483 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -20.181 -5.302 -3.378 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -21.641 -4.371 -3.789 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -20.209 -4.292 -4.843 1.00 0.00 H new ATOM 1516 N GLU A 93 -22.257 -0.815 -5.996 1.00 0.00 N ATOM 1517 CA GLU A 93 -23.055 0.147 -6.710 1.00 0.00 C ATOM 1518 C GLU A 93 -24.470 0.174 -6.160 1.00 0.00 C ATOM 1519 O GLU A 93 -24.714 0.933 -5.202 1.00 0.00 O ATOM 1520 CB GLU A 93 -23.053 -0.205 -8.194 1.00 0.00 C ATOM 1521 CG GLU A 93 -21.667 -0.157 -8.821 1.00 0.00 C ATOM 1522 CD GLU A 93 -21.670 -0.434 -10.305 1.00 0.00 C ATOM 1523 OE1 GLU A 93 -21.948 -1.582 -10.706 1.00 0.00 O ATOM 1524 OE2 GLU A 93 -21.380 0.497 -11.083 1.00 0.00 O ATOM 1525 OXT GLU A 93 -25.326 -0.579 -6.668 1.00 0.00 O ATOM 0 H GLU A 93 -22.725 -1.702 -5.808 1.00 0.00 H new ATOM 0 HA GLU A 93 -22.630 1.142 -6.580 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -23.469 -1.204 -8.324 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -23.709 0.485 -8.725 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -21.230 0.826 -8.643 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -21.026 -0.886 -8.324 1.00 0.00 H new TER 1532 GLU A 93