USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1080 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 65 THR OG1 : rot 161:sc= 0.588 USER MOD Set 1.2: A 67 THR OG1 : rot 80:sc= 0.459 USER MOD Set 2.1: A 50 MET CE :methyl -173:sc= -1.13 (180deg=-1.2) USER MOD Set 2.2: A 62 HIS : no HD1:sc= -7.07! C(o=-8.2!,f=-12!) USER MOD Set 3.1: A 39 LYS NZ :NH3+ 159:sc= 1.37 (180deg=0.217) USER MOD Set 3.2: A 43 ASN : amide:sc= -2.13! C(o=-0.76!,f=-10!) USER MOD Single : A 1 GLY N :NH3+ -139:sc= 0.0304 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 144:sc= -0.662 (180deg=-2.48!) USER MOD Single : A 11 TYR OH : rot 173:sc= 0.454 USER MOD Single : A 12 SER OG : rot 38:sc= 0.0443 USER MOD Single : A 13 GLN : amide:sc= -0.853 K(o=-0.85,f=-0.16) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 17:sc= 0.0336 USER MOD Single : A 26 GLN : amide:sc= 0.588 K(o=0.59,f=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -4.6! C(o=-4.6!,f=-4.2!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= -1.66! C(o=-1.7!,f=-8.4!) USER MOD Single : A 45 LYS NZ :NH3+ 178:sc= 1.23 (180deg=1.2) USER MOD Single : A 48 MET CE :methyl -123:sc= -0.0177 (180deg=-2.64) USER MOD Single : A 54 GLN : amide:sc= -0.145 K(o=-0.14,f=-0.73) USER MOD Single : A 57 LYS NZ :NH3+ -170:sc= 0.212 (180deg=-0.00161) USER MOD Single : A 59 CYS SG : rot -29:sc= -0.312 USER MOD Single : A 61 ASN : amide:sc= 1.01 K(o=1,f=-5.9!) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 MET CE :methyl -159:sc= -0.127 (180deg=-1.33) USER MOD Single : A 69 ASN : amide:sc= -0.0035 X(o=-0.0035,f=0) USER MOD Single : A 71 LYS NZ :NH3+ 167:sc= -0.0102 (180deg=-0.144) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 80:sc= 0.207 USER MOD Single : A 81 MET CE :methyl 176:sc= -0.32 (180deg=-0.385) USER MOD Single : A 85 SER OG : rot 180:sc= -0.193 USER MOD Single : A 88 SER OG : rot -120:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -134:sc= 0.734 (180deg=-0.0766) USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 LYS NZ :NH3+ -167:sc= -0.373 (180deg=-0.416) USER MOD Single : A 102 LYS NZ :NH3+ -163:sc= -0.0837 (180deg=-0.419) USER MOD Single : A 103 THR OG1 : rot -173:sc= -0.451 USER MOD Single : A 111 LYS NZ :NH3+ 179:sc= 0.733 (180deg=0.68) USER MOD Single : A 112 GLN : amide:sc= -3.91! K(o=-3.9!,f=-0.3) USER MOD Single : A 113 LYS NZ :NH3+ 170:sc= 1.26 (180deg=1.09) USER MOD Single : A 117 CYS SG : rot 85:sc= 0.564 USER MOD Single : A 118 GLN : amide:sc= -1.12 K(o=-1.1,f=-3.3) USER MOD Single : A 127 GLN : amide:sc= -0.181 K(o=-0.18,f=-0.89) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0.0414 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -17.443 -11.884 -17.716 1.00 0.00 N ATOM 2 CA GLY A 1 -16.200 -11.210 -17.374 1.00 0.00 C ATOM 3 C GLY A 1 -15.992 -11.206 -15.894 1.00 0.00 C ATOM 4 O GLY A 1 -16.242 -12.218 -15.240 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.296 -12.477 -18.558 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.744 -12.482 -16.920 1.00 0.00 H new ATOM 0 H3 GLY A 1 -18.178 -11.176 -17.915 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.363 -11.709 -17.863 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -16.221 -10.186 -17.746 1.00 0.00 H new ATOM 10 N SER A 2 -15.566 -10.063 -15.373 1.00 0.00 N ATOM 11 CA SER A 2 -15.323 -9.852 -13.959 1.00 0.00 C ATOM 12 C SER A 2 -14.216 -10.750 -13.410 1.00 0.00 C ATOM 13 O SER A 2 -14.463 -11.819 -12.824 1.00 0.00 O ATOM 14 CB SER A 2 -16.617 -9.951 -13.150 1.00 0.00 C ATOM 15 OG SER A 2 -17.577 -9.018 -13.656 1.00 0.00 O ATOM 0 H SER A 2 -15.376 -9.237 -15.941 1.00 0.00 H new ATOM 0 HA SER A 2 -14.954 -8.832 -13.848 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.016 -10.964 -13.207 1.00 0.00 H new ATOM 0 HB3 SER A 2 -16.416 -9.746 -12.098 1.00 0.00 H new ATOM 0 HG SER A 2 -18.405 -9.086 -13.136 1.00 0.00 H new ATOM 21 N GLY A 3 -13.000 -10.341 -13.645 1.00 0.00 N ATOM 22 CA GLY A 3 -11.861 -11.075 -13.161 1.00 0.00 C ATOM 23 C GLY A 3 -11.068 -10.223 -12.232 1.00 0.00 C ATOM 24 O GLY A 3 -9.835 -10.286 -12.215 1.00 0.00 O ATOM 0 H GLY A 3 -12.770 -9.498 -14.172 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -12.191 -11.979 -12.648 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -11.239 -11.392 -13.998 1.00 0.00 H new ATOM 28 N GLU A 4 -11.796 -9.423 -11.453 1.00 0.00 N ATOM 29 CA GLU A 4 -11.252 -8.452 -10.555 1.00 0.00 C ATOM 30 C GLU A 4 -10.480 -7.411 -11.330 1.00 0.00 C ATOM 31 O GLU A 4 -9.252 -7.505 -11.540 1.00 0.00 O ATOM 32 CB GLU A 4 -10.459 -9.076 -9.409 1.00 0.00 C ATOM 33 CG GLU A 4 -9.942 -8.060 -8.402 1.00 0.00 C ATOM 34 CD GLU A 4 -9.233 -8.667 -7.225 1.00 0.00 C ATOM 35 OE1 GLU A 4 -8.368 -9.560 -7.409 1.00 0.00 O ATOM 36 OE2 GLU A 4 -9.473 -8.215 -6.078 1.00 0.00 O ATOM 0 H GLU A 4 -12.816 -9.449 -11.443 1.00 0.00 H new ATOM 0 HA GLU A 4 -12.079 -7.945 -10.058 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -11.091 -9.798 -8.892 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -9.615 -9.629 -9.821 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.261 -7.376 -8.909 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -10.780 -7.465 -8.040 1.00 0.00 H new ATOM 43 N GLU A 5 -11.219 -6.478 -11.829 1.00 0.00 N ATOM 44 CA GLU A 5 -10.743 -5.440 -12.578 1.00 0.00 C ATOM 45 C GLU A 5 -11.654 -4.300 -12.315 1.00 0.00 C ATOM 46 O GLU A 5 -12.882 -4.493 -12.187 1.00 0.00 O ATOM 47 CB GLU A 5 -10.705 -5.747 -14.062 1.00 0.00 C ATOM 48 CG GLU A 5 -12.063 -5.783 -14.669 1.00 0.00 C ATOM 49 CD GLU A 5 -12.823 -7.088 -14.498 1.00 0.00 C ATOM 50 OE1 GLU A 5 -12.582 -8.037 -15.270 1.00 0.00 O ATOM 51 OE2 GLU A 5 -13.698 -7.177 -13.629 1.00 0.00 O ATOM 0 H GLU A 5 -12.230 -6.448 -11.698 1.00 0.00 H new ATOM 0 HA GLU A 5 -9.711 -5.227 -12.299 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -10.103 -4.994 -14.571 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -10.214 -6.708 -14.219 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -12.657 -4.978 -14.236 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -11.971 -5.574 -15.735 1.00 0.00 H new ATOM 58 N ASP A 6 -11.038 -3.196 -12.154 1.00 0.00 N ATOM 59 CA ASP A 6 -11.650 -1.856 -11.880 1.00 0.00 C ATOM 60 C ASP A 6 -10.621 -0.893 -11.325 1.00 0.00 C ATOM 61 O ASP A 6 -10.799 0.293 -11.322 1.00 0.00 O ATOM 62 CB ASP A 6 -12.873 -2.019 -10.957 1.00 0.00 C ATOM 63 CG ASP A 6 -13.461 -0.780 -10.324 1.00 0.00 C ATOM 64 OD1 ASP A 6 -12.983 -0.349 -9.251 1.00 0.00 O ATOM 65 OD2 ASP A 6 -14.449 -0.231 -10.894 1.00 0.00 O ATOM 0 H ASP A 6 -10.020 -3.146 -12.204 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.001 -1.421 -12.815 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -13.661 -2.505 -11.532 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.596 -2.703 -10.155 1.00 0.00 H new ATOM 70 N GLU A 7 -9.522 -1.396 -11.007 1.00 0.00 N ATOM 71 CA GLU A 7 -8.503 -0.671 -10.424 1.00 0.00 C ATOM 72 C GLU A 7 -7.499 -0.286 -11.439 1.00 0.00 C ATOM 73 O GLU A 7 -7.158 -1.036 -12.366 1.00 0.00 O ATOM 74 CB GLU A 7 -7.947 -1.401 -9.174 1.00 0.00 C ATOM 75 CG GLU A 7 -7.346 -2.798 -9.422 1.00 0.00 C ATOM 76 CD GLU A 7 -8.336 -3.834 -9.913 1.00 0.00 C ATOM 77 OE1 GLU A 7 -8.546 -3.916 -11.140 1.00 0.00 O ATOM 78 OE2 GLU A 7 -8.894 -4.583 -9.094 1.00 0.00 O ATOM 0 H GLU A 7 -9.294 -2.379 -11.154 1.00 0.00 H new ATOM 0 HA GLU A 7 -8.886 0.273 -10.036 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -7.180 -0.772 -8.721 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -8.752 -1.497 -8.445 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -6.542 -2.708 -10.153 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -6.896 -3.155 -8.495 1.00 0.00 H new ATOM 85 N LYS A 8 -7.059 0.888 -11.262 1.00 0.00 N ATOM 86 CA LYS A 8 -6.219 1.538 -12.193 1.00 0.00 C ATOM 87 C LYS A 8 -4.835 1.844 -11.613 1.00 0.00 C ATOM 88 O LYS A 8 -4.683 1.949 -10.395 1.00 0.00 O ATOM 89 CB LYS A 8 -6.909 2.785 -12.764 1.00 0.00 C ATOM 90 CG LYS A 8 -7.418 3.763 -11.705 1.00 0.00 C ATOM 91 CD LYS A 8 -8.279 4.902 -12.284 1.00 0.00 C ATOM 92 CE LYS A 8 -7.487 5.974 -13.057 1.00 0.00 C ATOM 93 NZ LYS A 8 -6.876 5.503 -14.325 1.00 0.00 N ATOM 0 H LYS A 8 -7.276 1.450 -10.439 1.00 0.00 H new ATOM 0 HA LYS A 8 -6.044 0.852 -13.021 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -6.209 3.306 -13.417 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -7.748 2.470 -13.384 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -8.003 3.215 -10.967 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -6.565 4.194 -11.180 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -9.028 4.472 -12.949 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.817 5.384 -11.468 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -8.153 6.808 -13.279 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -6.698 6.359 -12.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -6.913 6.265 -15.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -5.885 5.237 -14.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -7.401 4.677 -14.678 1.00 0.00 H new ATOM 107 N VAL A 9 -3.855 2.025 -12.488 1.00 0.00 N ATOM 108 CA VAL A 9 -2.478 2.185 -12.107 1.00 0.00 C ATOM 109 C VAL A 9 -2.169 3.638 -11.828 1.00 0.00 C ATOM 110 O VAL A 9 -2.322 4.516 -12.699 1.00 0.00 O ATOM 111 CB VAL A 9 -1.502 1.691 -13.224 1.00 0.00 C ATOM 112 CG1 VAL A 9 -0.048 1.750 -12.757 1.00 0.00 C ATOM 113 CG2 VAL A 9 -1.851 0.290 -13.700 1.00 0.00 C ATOM 0 H VAL A 9 -4.008 2.064 -13.496 1.00 0.00 H new ATOM 0 HA VAL A 9 -2.332 1.583 -11.210 1.00 0.00 H new ATOM 0 HB VAL A 9 -1.619 2.369 -14.069 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.605 1.400 -13.556 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.210 2.777 -12.501 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.079 1.115 -11.880 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -1.149 -0.016 -14.476 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -1.791 -0.404 -12.862 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -2.863 0.285 -14.104 1.00 0.00 H new ATOM 123 N LEU A 10 -1.768 3.887 -10.633 1.00 0.00 N ATOM 124 CA LEU A 10 -1.304 5.214 -10.245 1.00 0.00 C ATOM 125 C LEU A 10 0.161 5.399 -10.591 1.00 0.00 C ATOM 126 O LEU A 10 0.531 6.357 -11.265 1.00 0.00 O ATOM 127 CB LEU A 10 -1.540 5.525 -8.761 1.00 0.00 C ATOM 128 CG LEU A 10 -2.992 5.666 -8.296 1.00 0.00 C ATOM 129 CD1 LEU A 10 -3.028 6.066 -6.829 1.00 0.00 C ATOM 130 CD2 LEU A 10 -3.745 6.689 -9.146 1.00 0.00 C ATOM 0 H LEU A 10 -1.744 3.195 -9.884 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.902 5.923 -10.818 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -1.072 4.736 -8.172 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.018 6.452 -8.523 1.00 0.00 H new ATOM 0 HG LEU A 10 -3.487 4.703 -8.416 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -4.064 6.165 -6.504 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -2.531 5.302 -6.231 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.515 7.019 -6.699 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -4.773 6.769 -8.793 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -3.257 7.660 -9.064 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -3.742 6.369 -10.188 1.00 0.00 H new ATOM 142 N TYR A 11 0.976 4.484 -10.134 1.00 0.00 N ATOM 143 CA TYR A 11 2.413 4.525 -10.377 1.00 0.00 C ATOM 144 C TYR A 11 3.024 3.144 -10.198 1.00 0.00 C ATOM 145 O TYR A 11 2.479 2.308 -9.459 1.00 0.00 O ATOM 146 CB TYR A 11 3.135 5.576 -9.491 1.00 0.00 C ATOM 147 CG TYR A 11 3.076 5.341 -7.992 1.00 0.00 C ATOM 148 CD1 TYR A 11 1.995 5.774 -7.238 1.00 0.00 C ATOM 149 CD2 TYR A 11 4.123 4.708 -7.331 1.00 0.00 C ATOM 150 CE1 TYR A 11 1.954 5.581 -5.872 1.00 0.00 C ATOM 151 CE2 TYR A 11 4.090 4.508 -5.968 1.00 0.00 C ATOM 152 CZ TYR A 11 3.003 4.948 -5.242 1.00 0.00 C ATOM 153 OH TYR A 11 2.966 4.754 -3.884 1.00 0.00 O ATOM 0 H TYR A 11 0.671 3.683 -9.580 1.00 0.00 H new ATOM 0 HA TYR A 11 2.557 4.839 -11.411 1.00 0.00 H new ATOM 0 HB2 TYR A 11 4.182 5.616 -9.791 1.00 0.00 H new ATOM 0 HB3 TYR A 11 2.705 6.555 -9.702 1.00 0.00 H new ATOM 0 HD1 TYR A 11 1.171 6.271 -7.729 1.00 0.00 H new ATOM 0 HD2 TYR A 11 4.978 4.367 -7.896 1.00 0.00 H new ATOM 0 HE1 TYR A 11 1.104 5.924 -5.300 1.00 0.00 H new ATOM 0 HE2 TYR A 11 4.910 4.010 -5.472 1.00 0.00 H new ATOM 0 HH TYR A 11 3.724 4.195 -3.613 1.00 0.00 H new ATOM 163 N SER A 12 4.089 2.887 -10.926 1.00 0.00 N ATOM 164 CA SER A 12 4.799 1.671 -10.884 1.00 0.00 C ATOM 165 C SER A 12 6.304 1.938 -10.689 1.00 0.00 C ATOM 166 O SER A 12 6.898 2.695 -11.462 1.00 0.00 O ATOM 167 CB SER A 12 4.525 0.964 -12.198 1.00 0.00 C ATOM 168 OG SER A 12 4.640 1.857 -13.311 1.00 0.00 O ATOM 0 H SER A 12 4.483 3.561 -11.583 1.00 0.00 H new ATOM 0 HA SER A 12 4.481 1.050 -10.046 1.00 0.00 H new ATOM 0 HB2 SER A 12 5.225 0.138 -12.320 1.00 0.00 H new ATOM 0 HB3 SER A 12 3.524 0.533 -12.178 1.00 0.00 H new ATOM 0 HG SER A 12 5.382 2.479 -13.156 1.00 0.00 H new ATOM 174 N GLN A 13 6.894 1.362 -9.642 1.00 0.00 N ATOM 175 CA GLN A 13 8.339 1.509 -9.364 1.00 0.00 C ATOM 176 C GLN A 13 8.966 0.332 -8.676 1.00 0.00 C ATOM 177 O GLN A 13 8.302 -0.429 -8.015 1.00 0.00 O ATOM 178 CB GLN A 13 8.752 2.887 -8.818 1.00 0.00 C ATOM 179 CG GLN A 13 7.947 3.363 -7.626 1.00 0.00 C ATOM 180 CD GLN A 13 8.397 2.804 -6.299 1.00 0.00 C ATOM 181 OE1 GLN A 13 9.242 3.390 -5.631 1.00 0.00 O ATOM 182 NE2 GLN A 13 7.832 1.698 -5.901 1.00 0.00 N ATOM 0 H GLN A 13 6.398 0.784 -8.964 1.00 0.00 H new ATOM 0 HA GLN A 13 8.799 1.490 -10.352 1.00 0.00 H new ATOM 0 HB2 GLN A 13 9.805 2.851 -8.537 1.00 0.00 H new ATOM 0 HB3 GLN A 13 8.661 3.622 -9.618 1.00 0.00 H new ATOM 0 HG2 GLN A 13 7.996 4.451 -7.582 1.00 0.00 H new ATOM 0 HG3 GLN A 13 6.901 3.097 -7.781 1.00 0.00 H new ATOM 0 HE21 GLN A 13 7.133 1.242 -6.488 1.00 0.00 H new ATOM 0 HE22 GLN A 13 8.089 1.289 -5.003 1.00 0.00 H new ATOM 191 N ARG A 14 10.245 0.230 -8.820 1.00 0.00 N ATOM 192 CA ARG A 14 10.986 -0.934 -8.424 1.00 0.00 C ATOM 193 C ARG A 14 11.248 -1.005 -6.938 1.00 0.00 C ATOM 194 O ARG A 14 11.864 -0.125 -6.333 1.00 0.00 O ATOM 195 CB ARG A 14 12.253 -1.113 -9.266 1.00 0.00 C ATOM 196 CG ARG A 14 11.936 -1.308 -10.746 1.00 0.00 C ATOM 197 CD ARG A 14 13.176 -1.549 -11.587 1.00 0.00 C ATOM 198 NE ARG A 14 13.867 -2.804 -11.242 1.00 0.00 N ATOM 199 CZ ARG A 14 14.662 -3.489 -12.077 1.00 0.00 C ATOM 200 NH1 ARG A 14 14.777 -3.123 -13.358 1.00 0.00 N ATOM 201 NH2 ARG A 14 15.310 -4.563 -11.641 1.00 0.00 N ATOM 0 H ARG A 14 10.823 0.967 -9.225 1.00 0.00 H new ATOM 0 HA ARG A 14 10.345 -1.790 -8.633 1.00 0.00 H new ATOM 0 HB2 ARG A 14 12.894 -0.240 -9.145 1.00 0.00 H new ATOM 0 HB3 ARG A 14 12.813 -1.973 -8.899 1.00 0.00 H new ATOM 0 HG2 ARG A 14 11.256 -2.153 -10.859 1.00 0.00 H new ATOM 0 HG3 ARG A 14 11.415 -0.427 -11.120 1.00 0.00 H new ATOM 0 HD2 ARG A 14 12.896 -1.572 -12.640 1.00 0.00 H new ATOM 0 HD3 ARG A 14 13.864 -0.714 -11.458 1.00 0.00 H new ATOM 0 HE ARG A 14 13.731 -3.178 -10.303 1.00 0.00 H new ATOM 0 HH11 ARG A 14 14.258 -2.317 -13.707 1.00 0.00 H new ATOM 0 HH12 ARG A 14 15.384 -3.650 -13.986 1.00 0.00 H new ATOM 0 HH21 ARG A 14 15.203 -4.865 -10.673 1.00 0.00 H new ATOM 0 HH22 ARG A 14 15.915 -5.086 -12.274 1.00 0.00 H new ATOM 215 N VAL A 15 10.787 -2.083 -6.393 1.00 0.00 N ATOM 216 CA VAL A 15 10.800 -2.368 -4.992 1.00 0.00 C ATOM 217 C VAL A 15 11.332 -3.796 -4.798 1.00 0.00 C ATOM 218 O VAL A 15 11.553 -4.525 -5.777 1.00 0.00 O ATOM 219 CB VAL A 15 9.327 -2.316 -4.453 1.00 0.00 C ATOM 220 CG1 VAL A 15 8.515 -3.526 -4.929 1.00 0.00 C ATOM 221 CG2 VAL A 15 9.267 -2.176 -2.943 1.00 0.00 C ATOM 0 H VAL A 15 10.367 -2.832 -6.943 1.00 0.00 H new ATOM 0 HA VAL A 15 11.423 -1.646 -4.464 1.00 0.00 H new ATOM 0 HB VAL A 15 8.873 -1.418 -4.872 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.500 -3.459 -4.538 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.484 -3.538 -6.019 1.00 0.00 H new ATOM 0 HG13 VAL A 15 8.983 -4.442 -4.569 1.00 0.00 H new ATOM 0 HG21 VAL A 15 8.226 -2.145 -2.622 1.00 0.00 H new ATOM 0 HG22 VAL A 15 9.765 -3.027 -2.479 1.00 0.00 H new ATOM 0 HG23 VAL A 15 9.767 -1.255 -2.643 1.00 0.00 H new ATOM 231 N LYS A 16 11.542 -4.172 -3.577 1.00 0.00 N ATOM 232 CA LYS A 16 11.869 -5.518 -3.215 1.00 0.00 C ATOM 233 C LYS A 16 10.831 -5.947 -2.207 1.00 0.00 C ATOM 234 O LYS A 16 10.566 -5.181 -1.265 1.00 0.00 O ATOM 235 CB LYS A 16 13.251 -5.556 -2.579 1.00 0.00 C ATOM 236 CG LYS A 16 14.336 -4.974 -3.456 1.00 0.00 C ATOM 237 CD LYS A 16 15.682 -5.075 -2.792 1.00 0.00 C ATOM 238 CE LYS A 16 16.778 -4.598 -3.715 1.00 0.00 C ATOM 239 NZ LYS A 16 18.104 -4.755 -3.105 1.00 0.00 N ATOM 0 H LYS A 16 11.490 -3.536 -2.781 1.00 0.00 H new ATOM 0 HA LYS A 16 11.877 -6.176 -4.084 1.00 0.00 H new ATOM 0 HB2 LYS A 16 13.224 -5.008 -1.637 1.00 0.00 H new ATOM 0 HB3 LYS A 16 13.504 -6.589 -2.340 1.00 0.00 H new ATOM 0 HG2 LYS A 16 14.358 -5.500 -4.410 1.00 0.00 H new ATOM 0 HG3 LYS A 16 14.111 -3.930 -3.673 1.00 0.00 H new ATOM 0 HD2 LYS A 16 15.686 -4.480 -1.879 1.00 0.00 H new ATOM 0 HD3 LYS A 16 15.871 -6.108 -2.501 1.00 0.00 H new ATOM 0 HE2 LYS A 16 16.738 -5.159 -4.649 1.00 0.00 H new ATOM 0 HE3 LYS A 16 16.614 -3.550 -3.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 18.832 -4.418 -3.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 18.150 -4.200 -2.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 18.270 -5.759 -2.889 1.00 0.00 H new ATOM 253 N LEU A 17 10.237 -7.133 -2.354 1.00 0.00 N ATOM 254 CA LEU A 17 9.216 -7.514 -1.426 1.00 0.00 C ATOM 255 C LEU A 17 9.814 -8.507 -0.494 1.00 0.00 C ATOM 256 O LEU A 17 10.696 -9.237 -0.877 1.00 0.00 O ATOM 257 CB LEU A 17 7.989 -8.105 -2.145 1.00 0.00 C ATOM 258 CG LEU A 17 6.875 -8.651 -1.251 1.00 0.00 C ATOM 259 CD1 LEU A 17 6.332 -7.572 -0.321 1.00 0.00 C ATOM 260 CD2 LEU A 17 5.771 -9.227 -2.100 1.00 0.00 C ATOM 0 H LEU A 17 10.447 -7.813 -3.085 1.00 0.00 H new ATOM 0 HA LEU A 17 8.861 -6.639 -0.882 1.00 0.00 H new ATOM 0 HB2 LEU A 17 7.565 -7.333 -2.787 1.00 0.00 H new ATOM 0 HB3 LEU A 17 8.330 -8.910 -2.797 1.00 0.00 H new ATOM 0 HG LEU A 17 7.292 -9.442 -0.628 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.542 -7.992 0.301 1.00 0.00 H new ATOM 0 HD12 LEU A 17 7.136 -7.201 0.315 1.00 0.00 H new ATOM 0 HD13 LEU A 17 5.929 -6.750 -0.913 1.00 0.00 H new ATOM 0 HD21 LEU A 17 4.981 -9.614 -1.456 1.00 0.00 H new ATOM 0 HD22 LEU A 17 5.364 -8.448 -2.745 1.00 0.00 H new ATOM 0 HD23 LEU A 17 6.168 -10.036 -2.713 1.00 0.00 H new ATOM 272 N PHE A 18 9.376 -8.494 0.710 1.00 0.00 N ATOM 273 CA PHE A 18 9.878 -9.355 1.754 1.00 0.00 C ATOM 274 C PHE A 18 8.750 -10.010 2.504 1.00 0.00 C ATOM 275 O PHE A 18 7.743 -9.385 2.767 1.00 0.00 O ATOM 276 CB PHE A 18 10.697 -8.547 2.758 1.00 0.00 C ATOM 277 CG PHE A 18 12.071 -8.123 2.322 1.00 0.00 C ATOM 278 CD1 PHE A 18 12.248 -7.132 1.376 1.00 0.00 C ATOM 279 CD2 PHE A 18 13.191 -8.716 2.879 1.00 0.00 C ATOM 280 CE1 PHE A 18 13.507 -6.745 0.991 1.00 0.00 C ATOM 281 CE2 PHE A 18 14.456 -8.329 2.500 1.00 0.00 C ATOM 282 CZ PHE A 18 14.613 -7.341 1.553 1.00 0.00 C ATOM 0 H PHE A 18 8.633 -7.868 1.022 1.00 0.00 H new ATOM 0 HA PHE A 18 10.496 -10.116 1.277 1.00 0.00 H new ATOM 0 HB2 PHE A 18 10.131 -7.652 3.017 1.00 0.00 H new ATOM 0 HB3 PHE A 18 10.796 -9.137 3.669 1.00 0.00 H new ATOM 0 HD1 PHE A 18 11.385 -6.656 0.934 1.00 0.00 H new ATOM 0 HD2 PHE A 18 13.070 -9.492 3.620 1.00 0.00 H new ATOM 0 HE1 PHE A 18 13.630 -5.972 0.247 1.00 0.00 H new ATOM 0 HE2 PHE A 18 15.322 -8.798 2.943 1.00 0.00 H new ATOM 0 HZ PHE A 18 15.604 -7.034 1.252 1.00 0.00 H new ATOM 292 N ARG A 19 8.922 -11.257 2.825 1.00 0.00 N ATOM 293 CA ARG A 19 8.015 -11.975 3.648 1.00 0.00 C ATOM 294 C ARG A 19 8.728 -12.392 4.846 1.00 0.00 C ATOM 295 O ARG A 19 9.925 -12.629 4.849 1.00 0.00 O ATOM 296 CB ARG A 19 7.426 -13.170 2.989 1.00 0.00 C ATOM 297 CG ARG A 19 6.239 -13.830 3.680 1.00 0.00 C ATOM 298 CD ARG A 19 5.772 -15.010 2.861 1.00 0.00 C ATOM 299 NE ARG A 19 4.476 -15.525 3.284 1.00 0.00 N ATOM 300 CZ ARG A 19 3.651 -16.220 2.491 1.00 0.00 C ATOM 301 NH1 ARG A 19 4.041 -16.570 1.270 1.00 0.00 N ATOM 302 NH2 ARG A 19 2.452 -16.578 2.921 1.00 0.00 N ATOM 0 H ARG A 19 9.719 -11.811 2.511 1.00 0.00 H new ATOM 0 HA ARG A 19 7.182 -11.310 3.875 1.00 0.00 H new ATOM 0 HB2 ARG A 19 7.116 -12.884 1.984 1.00 0.00 H new ATOM 0 HB3 ARG A 19 8.212 -13.917 2.879 1.00 0.00 H new ATOM 0 HG2 ARG A 19 6.523 -14.157 4.680 1.00 0.00 H new ATOM 0 HG3 ARG A 19 5.428 -13.112 3.798 1.00 0.00 H new ATOM 0 HD2 ARG A 19 5.715 -14.717 1.813 1.00 0.00 H new ATOM 0 HD3 ARG A 19 6.512 -15.807 2.929 1.00 0.00 H new ATOM 0 HE ARG A 19 4.179 -15.345 4.243 1.00 0.00 H new ATOM 0 HH11 ARG A 19 4.969 -16.309 0.937 1.00 0.00 H new ATOM 0 HH12 ARG A 19 3.412 -17.100 0.666 1.00 0.00 H new ATOM 0 HH21 ARG A 19 2.151 -16.325 3.862 1.00 0.00 H new ATOM 0 HH22 ARG A 19 1.829 -17.107 2.311 1.00 0.00 H new ATOM 316 N PHE A 20 8.011 -12.452 5.807 1.00 0.00 N ATOM 317 CA PHE A 20 8.477 -12.751 7.102 1.00 0.00 C ATOM 318 C PHE A 20 8.318 -14.216 7.305 1.00 0.00 C ATOM 319 O PHE A 20 7.205 -14.761 7.266 1.00 0.00 O ATOM 320 CB PHE A 20 7.673 -12.046 8.162 1.00 0.00 C ATOM 321 CG PHE A 20 8.362 -11.947 9.502 1.00 0.00 C ATOM 322 CD1 PHE A 20 9.245 -10.910 9.761 1.00 0.00 C ATOM 323 CD2 PHE A 20 8.121 -12.881 10.500 1.00 0.00 C ATOM 324 CE1 PHE A 20 9.877 -10.807 10.985 1.00 0.00 C ATOM 325 CE2 PHE A 20 8.751 -12.784 11.726 1.00 0.00 C ATOM 326 CZ PHE A 20 9.629 -11.745 11.968 1.00 0.00 C ATOM 0 H PHE A 20 7.005 -12.291 5.762 1.00 0.00 H new ATOM 0 HA PHE A 20 9.514 -12.426 7.186 1.00 0.00 H new ATOM 0 HB2 PHE A 20 7.436 -11.041 7.813 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.726 -12.570 8.291 1.00 0.00 H new ATOM 0 HD1 PHE A 20 9.441 -10.173 8.996 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.433 -13.693 10.316 1.00 0.00 H new ATOM 0 HE1 PHE A 20 10.564 -9.995 11.173 1.00 0.00 H new ATOM 0 HE2 PHE A 20 8.557 -13.519 12.493 1.00 0.00 H new ATOM 0 HZ PHE A 20 10.121 -11.666 12.926 1.00 0.00 H new ATOM 336 N ASP A 21 9.387 -14.842 7.459 1.00 0.00 N ATOM 337 CA ASP A 21 9.391 -16.225 7.798 1.00 0.00 C ATOM 338 C ASP A 21 9.426 -16.258 9.228 1.00 0.00 C ATOM 339 O ASP A 21 10.371 -15.890 9.802 1.00 0.00 O ATOM 340 CB ASP A 21 10.587 -16.992 7.322 1.00 0.00 C ATOM 341 CG ASP A 21 10.209 -18.413 6.959 1.00 0.00 C ATOM 342 OD1 ASP A 21 9.998 -19.233 7.865 1.00 0.00 O ATOM 343 OD2 ASP A 21 10.156 -18.739 5.761 1.00 0.00 O ATOM 0 H ASP A 21 10.313 -14.427 7.358 1.00 0.00 H new ATOM 0 HA ASP A 21 8.523 -16.687 7.328 1.00 0.00 H new ATOM 0 HB2 ASP A 21 11.022 -16.494 6.455 1.00 0.00 H new ATOM 0 HB3 ASP A 21 11.351 -17.002 8.100 1.00 0.00 H new ATOM 348 N ALA A 22 8.397 -16.616 9.762 1.00 0.00 N ATOM 349 CA ALA A 22 8.225 -16.752 11.189 1.00 0.00 C ATOM 350 C ALA A 22 9.070 -17.896 11.688 1.00 0.00 C ATOM 351 O ALA A 22 9.555 -17.883 12.813 1.00 0.00 O ATOM 352 CB ALA A 22 6.771 -16.959 11.540 1.00 0.00 C ATOM 0 H ALA A 22 7.558 -16.853 9.233 1.00 0.00 H new ATOM 0 HA ALA A 22 8.550 -15.833 11.676 1.00 0.00 H new ATOM 0 HB1 ALA A 22 6.668 -17.059 12.621 1.00 0.00 H new ATOM 0 HB2 ALA A 22 6.189 -16.104 11.197 1.00 0.00 H new ATOM 0 HB3 ALA A 22 6.405 -17.864 11.056 1.00 0.00 H new ATOM 358 N GLU A 23 9.286 -18.872 10.817 1.00 0.00 N ATOM 359 CA GLU A 23 10.137 -19.979 11.131 1.00 0.00 C ATOM 360 C GLU A 23 11.588 -19.565 11.036 1.00 0.00 C ATOM 361 O GLU A 23 12.445 -20.159 11.664 1.00 0.00 O ATOM 362 CB GLU A 23 9.861 -21.174 10.246 1.00 0.00 C ATOM 363 CG GLU A 23 8.477 -21.748 10.430 1.00 0.00 C ATOM 364 CD GLU A 23 8.106 -21.949 11.880 1.00 0.00 C ATOM 365 OE1 GLU A 23 8.646 -22.861 12.528 1.00 0.00 O ATOM 366 OE2 GLU A 23 7.244 -21.200 12.390 1.00 0.00 O ATOM 0 H GLU A 23 8.874 -18.907 9.885 1.00 0.00 H new ATOM 0 HA GLU A 23 9.921 -20.283 12.155 1.00 0.00 H new ATOM 0 HB2 GLU A 23 9.990 -20.883 9.204 1.00 0.00 H new ATOM 0 HB3 GLU A 23 10.599 -21.949 10.454 1.00 0.00 H new ATOM 0 HG2 GLU A 23 7.750 -21.083 9.964 1.00 0.00 H new ATOM 0 HG3 GLU A 23 8.415 -22.704 9.910 1.00 0.00 H new ATOM 373 N VAL A 24 11.872 -18.518 10.250 1.00 0.00 N ATOM 374 CA VAL A 24 13.245 -18.006 10.219 1.00 0.00 C ATOM 375 C VAL A 24 13.341 -16.867 11.166 1.00 0.00 C ATOM 376 O VAL A 24 14.422 -16.417 11.560 1.00 0.00 O ATOM 377 CB VAL A 24 13.679 -17.479 8.829 1.00 0.00 C ATOM 378 CG1 VAL A 24 15.163 -17.141 8.776 1.00 0.00 C ATOM 379 CG2 VAL A 24 13.371 -18.481 7.834 1.00 0.00 C ATOM 0 H VAL A 24 11.204 -18.029 9.654 1.00 0.00 H new ATOM 0 HA VAL A 24 13.896 -18.840 10.481 1.00 0.00 H new ATOM 0 HB VAL A 24 13.132 -16.557 8.631 1.00 0.00 H new ATOM 0 HG11 VAL A 24 15.418 -16.776 7.781 1.00 0.00 H new ATOM 0 HG12 VAL A 24 15.387 -16.371 9.514 1.00 0.00 H new ATOM 0 HG13 VAL A 24 15.748 -18.034 8.995 1.00 0.00 H new ATOM 0 HG21 VAL A 24 13.672 -18.121 6.850 1.00 0.00 H new ATOM 0 HG22 VAL A 24 13.909 -19.400 8.065 1.00 0.00 H new ATOM 0 HG23 VAL A 24 12.299 -18.678 7.836 1.00 0.00 H new ATOM 389 N SER A 25 12.170 -16.480 11.602 1.00 0.00 N ATOM 390 CA SER A 25 11.930 -15.250 12.261 1.00 0.00 C ATOM 391 C SER A 25 12.491 -14.139 11.462 1.00 0.00 C ATOM 392 O SER A 25 12.885 -13.104 12.015 1.00 0.00 O ATOM 393 CB SER A 25 12.501 -15.295 13.599 1.00 0.00 C ATOM 394 OG SER A 25 11.685 -16.036 14.491 1.00 0.00 O ATOM 0 H SER A 25 11.330 -17.048 11.496 1.00 0.00 H new ATOM 0 HA SER A 25 10.858 -15.081 12.359 1.00 0.00 H new ATOM 0 HB2 SER A 25 13.494 -15.743 13.556 1.00 0.00 H new ATOM 0 HB3 SER A 25 12.625 -14.280 13.976 1.00 0.00 H new ATOM 0 HG SER A 25 11.052 -16.582 13.979 1.00 0.00 H new ATOM 400 N GLN A 26 12.467 -14.267 10.144 1.00 0.00 N ATOM 401 CA GLN A 26 13.145 -13.245 9.472 1.00 0.00 C ATOM 402 C GLN A 26 12.409 -12.762 8.239 1.00 0.00 C ATOM 403 O GLN A 26 11.649 -13.491 7.633 1.00 0.00 O ATOM 404 CB GLN A 26 14.562 -13.661 9.078 1.00 0.00 C ATOM 405 CG GLN A 26 15.467 -12.497 8.669 1.00 0.00 C ATOM 406 CD GLN A 26 16.717 -12.922 7.931 1.00 0.00 C ATOM 407 OE1 GLN A 26 17.756 -13.213 8.535 1.00 0.00 O ATOM 408 NE2 GLN A 26 16.654 -12.886 6.627 1.00 0.00 N ATOM 0 H GLN A 26 12.025 -15.001 9.590 1.00 0.00 H new ATOM 0 HA GLN A 26 13.197 -12.421 10.184 1.00 0.00 H new ATOM 0 HB2 GLN A 26 15.021 -14.186 9.916 1.00 0.00 H new ATOM 0 HB3 GLN A 26 14.504 -14.369 8.251 1.00 0.00 H new ATOM 0 HG2 GLN A 26 14.900 -11.813 8.038 1.00 0.00 H new ATOM 0 HG3 GLN A 26 15.755 -11.942 9.562 1.00 0.00 H new ATOM 0 HE21 GLN A 26 15.778 -12.641 6.165 1.00 0.00 H new ATOM 0 HE22 GLN A 26 17.481 -13.103 6.070 1.00 0.00 H new ATOM 417 N TRP A 27 12.671 -11.546 7.888 1.00 0.00 N ATOM 418 CA TRP A 27 12.257 -10.948 6.718 1.00 0.00 C ATOM 419 C TRP A 27 13.165 -11.465 5.577 1.00 0.00 C ATOM 420 O TRP A 27 14.390 -11.335 5.627 1.00 0.00 O ATOM 421 CB TRP A 27 12.392 -9.431 6.941 1.00 0.00 C ATOM 422 CG TRP A 27 13.721 -8.986 7.547 1.00 0.00 C ATOM 423 CD1 TRP A 27 14.808 -8.503 6.875 1.00 0.00 C ATOM 424 CD2 TRP A 27 14.094 -8.991 8.946 1.00 0.00 C ATOM 425 NE1 TRP A 27 15.823 -8.223 7.757 1.00 0.00 N ATOM 426 CE2 TRP A 27 15.412 -8.511 9.029 1.00 0.00 C ATOM 427 CE3 TRP A 27 13.438 -9.360 10.130 1.00 0.00 C ATOM 428 CZ2 TRP A 27 16.089 -8.389 10.240 1.00 0.00 C ATOM 429 CZ3 TRP A 27 14.110 -9.239 11.328 1.00 0.00 C ATOM 430 CH2 TRP A 27 15.421 -8.758 11.375 1.00 0.00 C ATOM 0 H TRP A 27 13.223 -10.921 8.475 1.00 0.00 H new ATOM 0 HA TRP A 27 11.227 -11.178 6.447 1.00 0.00 H new ATOM 0 HB2 TRP A 27 12.258 -8.925 5.985 1.00 0.00 H new ATOM 0 HB3 TRP A 27 11.583 -9.101 7.593 1.00 0.00 H new ATOM 0 HD1 TRP A 27 14.861 -8.362 5.806 1.00 0.00 H new ATOM 0 HE1 TRP A 27 16.741 -7.857 7.503 1.00 0.00 H new ATOM 0 HE3 TRP A 27 12.425 -9.732 10.104 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 17.102 -8.017 10.281 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 13.615 -9.521 12.245 1.00 0.00 H new ATOM 0 HH2 TRP A 27 15.919 -8.676 12.330 1.00 0.00 H new ATOM 441 N LYS A 28 12.581 -12.123 4.637 1.00 0.00 N ATOM 442 CA LYS A 28 13.302 -12.655 3.505 1.00 0.00 C ATOM 443 C LYS A 28 12.611 -12.176 2.290 1.00 0.00 C ATOM 444 O LYS A 28 11.380 -12.117 2.269 1.00 0.00 O ATOM 445 CB LYS A 28 13.336 -14.196 3.567 1.00 0.00 C ATOM 446 CG LYS A 28 14.219 -14.871 2.525 1.00 0.00 C ATOM 447 CD LYS A 28 15.690 -14.583 2.776 1.00 0.00 C ATOM 448 CE LYS A 28 16.571 -15.198 1.703 1.00 0.00 C ATOM 449 NZ LYS A 28 17.999 -14.922 1.953 1.00 0.00 N ATOM 0 H LYS A 28 11.579 -12.316 4.621 1.00 0.00 H new ATOM 0 HA LYS A 28 14.339 -12.319 3.503 1.00 0.00 H new ATOM 0 HB2 LYS A 28 13.678 -14.496 4.558 1.00 0.00 H new ATOM 0 HB3 LYS A 28 12.318 -14.570 3.454 1.00 0.00 H new ATOM 0 HG2 LYS A 28 14.049 -15.947 2.544 1.00 0.00 H new ATOM 0 HG3 LYS A 28 13.943 -14.522 1.530 1.00 0.00 H new ATOM 0 HD2 LYS A 28 15.850 -13.505 2.806 1.00 0.00 H new ATOM 0 HD3 LYS A 28 15.977 -14.975 3.752 1.00 0.00 H new ATOM 0 HE2 LYS A 28 16.408 -16.275 1.670 1.00 0.00 H new ATOM 0 HE3 LYS A 28 16.288 -14.803 0.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 18.573 -15.356 1.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 18.158 -13.894 1.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 18.274 -15.321 2.873 1.00 0.00 H new ATOM 463 N GLU A 29 13.365 -11.810 1.286 1.00 0.00 N ATOM 464 CA GLU A 29 12.818 -11.273 0.163 1.00 0.00 C ATOM 465 C GLU A 29 11.988 -12.279 -0.556 1.00 0.00 C ATOM 466 O GLU A 29 12.303 -13.473 -0.617 1.00 0.00 O ATOM 467 CB GLU A 29 13.814 -10.556 -0.784 1.00 0.00 C ATOM 468 CG GLU A 29 15.016 -11.372 -1.238 1.00 0.00 C ATOM 469 CD GLU A 29 16.116 -11.416 -0.215 1.00 0.00 C ATOM 470 OE1 GLU A 29 16.021 -12.180 0.749 1.00 0.00 O ATOM 471 OE2 GLU A 29 17.086 -10.661 -0.360 1.00 0.00 O ATOM 0 H GLU A 29 14.381 -11.895 1.268 1.00 0.00 H new ATOM 0 HA GLU A 29 12.173 -10.469 0.517 1.00 0.00 H new ATOM 0 HB2 GLU A 29 13.269 -10.227 -1.669 1.00 0.00 H new ATOM 0 HB3 GLU A 29 14.178 -9.659 -0.283 1.00 0.00 H new ATOM 0 HG2 GLU A 29 14.694 -12.389 -1.461 1.00 0.00 H new ATOM 0 HG3 GLU A 29 15.406 -10.950 -2.164 1.00 0.00 H new ATOM 478 N ARG A 30 10.926 -11.807 -1.034 1.00 0.00 N ATOM 479 CA ARG A 30 10.017 -12.612 -1.794 1.00 0.00 C ATOM 480 C ARG A 30 10.461 -12.529 -3.208 1.00 0.00 C ATOM 481 O ARG A 30 10.290 -13.445 -3.999 1.00 0.00 O ATOM 482 CB ARG A 30 8.556 -12.152 -1.700 1.00 0.00 C ATOM 483 CG ARG A 30 7.933 -12.267 -0.327 1.00 0.00 C ATOM 484 CD ARG A 30 6.412 -12.164 -0.401 1.00 0.00 C ATOM 485 NE ARG A 30 5.820 -13.316 -1.097 1.00 0.00 N ATOM 486 CZ ARG A 30 4.515 -13.458 -1.421 1.00 0.00 C ATOM 487 NH1 ARG A 30 3.642 -12.476 -1.181 1.00 0.00 N ATOM 488 NH2 ARG A 30 4.097 -14.588 -1.987 1.00 0.00 N ATOM 0 H ARG A 30 10.634 -10.836 -0.921 1.00 0.00 H new ATOM 0 HA ARG A 30 10.037 -13.626 -1.395 1.00 0.00 H new ATOM 0 HB2 ARG A 30 8.497 -11.112 -2.022 1.00 0.00 H new ATOM 0 HB3 ARG A 30 7.961 -12.737 -2.402 1.00 0.00 H new ATOM 0 HG2 ARG A 30 8.214 -13.218 0.124 1.00 0.00 H new ATOM 0 HG3 ARG A 30 8.322 -11.480 0.319 1.00 0.00 H new ATOM 0 HD2 ARG A 30 6.003 -12.099 0.607 1.00 0.00 H new ATOM 0 HD3 ARG A 30 6.135 -11.245 -0.918 1.00 0.00 H new ATOM 0 HE ARG A 30 6.449 -14.075 -1.358 1.00 0.00 H new ATOM 0 HH11 ARG A 30 3.957 -11.608 -0.749 1.00 0.00 H new ATOM 0 HH12 ARG A 30 2.660 -12.595 -1.430 1.00 0.00 H new ATOM 0 HH21 ARG A 30 4.760 -15.340 -2.174 1.00 0.00 H new ATOM 0 HH22 ARG A 30 3.114 -14.701 -2.234 1.00 0.00 H new ATOM 502 N GLY A 31 11.041 -11.399 -3.505 1.00 0.00 N ATOM 503 CA GLY A 31 11.538 -11.120 -4.761 1.00 0.00 C ATOM 504 C GLY A 31 11.877 -9.681 -4.852 1.00 0.00 C ATOM 505 O GLY A 31 11.946 -8.984 -3.839 1.00 0.00 O ATOM 0 H GLY A 31 11.169 -10.642 -2.834 1.00 0.00 H new ATOM 0 HA2 GLY A 31 12.423 -11.726 -4.956 1.00 0.00 H new ATOM 0 HA3 GLY A 31 10.801 -11.379 -5.521 1.00 0.00 H new ATOM 509 N LEU A 32 11.993 -9.247 -6.031 1.00 0.00 N ATOM 510 CA LEU A 32 12.410 -7.931 -6.413 1.00 0.00 C ATOM 511 C LEU A 32 11.529 -7.596 -7.596 1.00 0.00 C ATOM 512 O LEU A 32 11.178 -8.507 -8.357 1.00 0.00 O ATOM 513 CB LEU A 32 13.875 -7.967 -6.923 1.00 0.00 C ATOM 514 CG LEU A 32 14.917 -8.754 -6.096 1.00 0.00 C ATOM 515 CD1 LEU A 32 16.255 -8.771 -6.813 1.00 0.00 C ATOM 516 CD2 LEU A 32 15.091 -8.176 -4.710 1.00 0.00 C ATOM 0 H LEU A 32 11.787 -9.835 -6.838 1.00 0.00 H new ATOM 0 HA LEU A 32 12.341 -7.225 -5.586 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.867 -8.383 -7.931 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.224 -6.938 -7.006 1.00 0.00 H new ATOM 0 HG LEU A 32 14.544 -9.773 -5.991 1.00 0.00 H new ATOM 0 HD11 LEU A 32 16.979 -9.329 -6.219 1.00 0.00 H new ATOM 0 HD12 LEU A 32 16.140 -9.248 -7.786 1.00 0.00 H new ATOM 0 HD13 LEU A 32 16.608 -7.749 -6.949 1.00 0.00 H new ATOM 0 HD21 LEU A 32 15.832 -8.759 -4.163 1.00 0.00 H new ATOM 0 HD22 LEU A 32 15.427 -7.142 -4.787 1.00 0.00 H new ATOM 0 HD23 LEU A 32 14.139 -8.210 -4.180 1.00 0.00 H new ATOM 528 N GLY A 33 11.139 -6.370 -7.771 1.00 0.00 N ATOM 529 CA GLY A 33 10.332 -6.088 -8.921 1.00 0.00 C ATOM 530 C GLY A 33 9.778 -4.705 -8.952 1.00 0.00 C ATOM 531 O GLY A 33 10.372 -3.796 -8.437 1.00 0.00 O ATOM 0 H GLY A 33 11.353 -5.579 -7.163 1.00 0.00 H new ATOM 0 HA2 GLY A 33 10.929 -6.249 -9.819 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.507 -6.799 -8.956 1.00 0.00 H new ATOM 535 N ASN A 34 8.654 -4.574 -9.569 1.00 0.00 N ATOM 536 CA ASN A 34 7.952 -3.338 -9.757 1.00 0.00 C ATOM 537 C ASN A 34 6.716 -3.372 -8.999 1.00 0.00 C ATOM 538 O ASN A 34 5.900 -4.303 -9.095 1.00 0.00 O ATOM 539 CB ASN A 34 7.663 -3.103 -11.211 1.00 0.00 C ATOM 540 CG ASN A 34 6.878 -1.841 -11.477 1.00 0.00 C ATOM 541 OD1 ASN A 34 7.445 -0.767 -11.633 1.00 0.00 O ATOM 542 ND2 ASN A 34 5.581 -1.971 -11.595 1.00 0.00 N ATOM 0 H ASN A 34 8.167 -5.369 -9.982 1.00 0.00 H new ATOM 0 HA ASN A 34 8.577 -2.518 -9.403 1.00 0.00 H new ATOM 0 HB2 ASN A 34 8.605 -3.056 -11.757 1.00 0.00 H new ATOM 0 HB3 ASN A 34 7.109 -3.955 -11.605 1.00 0.00 H new ATOM 0 HD21 ASN A 34 5.006 -1.160 -11.825 1.00 0.00 H new ATOM 0 HD22 ASN A 34 5.145 -2.883 -11.457 1.00 0.00 H new ATOM 549 N LEU A 35 6.605 -2.402 -8.218 1.00 0.00 N ATOM 550 CA LEU A 35 5.504 -2.199 -7.429 1.00 0.00 C ATOM 551 C LEU A 35 4.593 -1.311 -8.163 1.00 0.00 C ATOM 552 O LEU A 35 4.962 -0.193 -8.514 1.00 0.00 O ATOM 553 CB LEU A 35 5.892 -1.635 -6.039 1.00 0.00 C ATOM 554 CG LEU A 35 4.790 -1.366 -4.975 1.00 0.00 C ATOM 555 CD1 LEU A 35 5.442 -1.175 -3.620 1.00 0.00 C ATOM 556 CD2 LEU A 35 3.984 -0.108 -5.287 1.00 0.00 C ATOM 0 H LEU A 35 7.325 -1.688 -8.109 1.00 0.00 H new ATOM 0 HA LEU A 35 5.003 -3.145 -7.223 1.00 0.00 H new ATOM 0 HB2 LEU A 35 6.608 -2.327 -5.596 1.00 0.00 H new ATOM 0 HB3 LEU A 35 6.418 -0.695 -6.206 1.00 0.00 H new ATOM 0 HG LEU A 35 4.117 -2.223 -4.981 1.00 0.00 H new ATOM 0 HD11 LEU A 35 4.674 -0.986 -2.870 1.00 0.00 H new ATOM 0 HD12 LEU A 35 5.996 -2.075 -3.353 1.00 0.00 H new ATOM 0 HD13 LEU A 35 6.125 -0.327 -3.661 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.227 0.039 -4.517 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.650 0.754 -5.310 1.00 0.00 H new ATOM 0 HD23 LEU A 35 3.499 -0.218 -6.257 1.00 0.00 H new ATOM 568 N LYS A 36 3.444 -1.780 -8.408 1.00 0.00 N ATOM 569 CA LYS A 36 2.494 -1.002 -9.028 1.00 0.00 C ATOM 570 C LYS A 36 1.336 -0.814 -8.094 1.00 0.00 C ATOM 571 O LYS A 36 1.054 -1.669 -7.250 1.00 0.00 O ATOM 572 CB LYS A 36 2.093 -1.562 -10.397 1.00 0.00 C ATOM 573 CG LYS A 36 1.536 -2.975 -10.391 1.00 0.00 C ATOM 574 CD LYS A 36 1.221 -3.443 -11.805 1.00 0.00 C ATOM 575 CE LYS A 36 0.678 -4.860 -11.817 1.00 0.00 C ATOM 576 NZ LYS A 36 0.325 -5.317 -13.173 1.00 0.00 N ATOM 0 H LYS A 36 3.143 -2.727 -8.177 1.00 0.00 H new ATOM 0 HA LYS A 36 2.912 -0.020 -9.248 1.00 0.00 H new ATOM 0 HB2 LYS A 36 1.348 -0.899 -10.837 1.00 0.00 H new ATOM 0 HB3 LYS A 36 2.966 -1.538 -11.049 1.00 0.00 H new ATOM 0 HG2 LYS A 36 2.257 -3.652 -9.932 1.00 0.00 H new ATOM 0 HG3 LYS A 36 0.632 -3.011 -9.782 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.493 -2.770 -12.258 1.00 0.00 H new ATOM 0 HD3 LYS A 36 2.123 -3.393 -12.415 1.00 0.00 H new ATOM 0 HE2 LYS A 36 1.421 -5.534 -11.392 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -0.203 -4.913 -11.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -0.041 -6.290 -13.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.404 -4.691 -13.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 1.170 -5.293 -13.778 1.00 0.00 H new ATOM 590 N ILE A 37 0.697 0.272 -8.217 1.00 0.00 N ATOM 591 CA ILE A 37 -0.407 0.579 -7.383 1.00 0.00 C ATOM 592 C ILE A 37 -1.624 0.535 -8.188 1.00 0.00 C ATOM 593 O ILE A 37 -1.728 1.237 -9.211 1.00 0.00 O ATOM 594 CB ILE A 37 -0.271 2.015 -6.818 1.00 0.00 C ATOM 595 CG1 ILE A 37 0.872 2.078 -5.826 1.00 0.00 C ATOM 596 CG2 ILE A 37 -1.589 2.521 -6.187 1.00 0.00 C ATOM 597 CD1 ILE A 37 0.568 1.436 -4.490 1.00 0.00 C ATOM 0 H ILE A 37 0.920 0.991 -8.906 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.442 -0.140 -6.564 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.050 2.681 -7.652 1.00 0.00 H new ATOM 0 HG12 ILE A 37 1.744 1.590 -6.261 1.00 0.00 H new ATOM 0 HG13 ILE A 37 1.140 3.122 -5.663 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.445 3.532 -5.805 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.375 2.527 -6.942 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.877 1.861 -5.369 1.00 0.00 H new ATOM 0 HD11 ILE A 37 1.437 1.524 -3.838 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.283 1.938 -4.030 1.00 0.00 H new ATOM 0 HD13 ILE A 37 0.331 0.383 -4.638 1.00 0.00 H new ATOM 609 N LEU A 38 -2.539 -0.280 -7.780 1.00 0.00 N ATOM 610 CA LEU A 38 -3.801 -0.227 -8.410 1.00 0.00 C ATOM 611 C LEU A 38 -4.754 0.331 -7.406 1.00 0.00 C ATOM 612 O LEU A 38 -4.719 -0.019 -6.238 1.00 0.00 O ATOM 613 CB LEU A 38 -4.261 -1.614 -8.906 1.00 0.00 C ATOM 614 CG LEU A 38 -3.459 -2.240 -10.056 1.00 0.00 C ATOM 615 CD1 LEU A 38 -3.844 -3.698 -10.245 1.00 0.00 C ATOM 616 CD2 LEU A 38 -3.727 -1.492 -11.335 1.00 0.00 C ATOM 0 H LEU A 38 -2.437 -0.969 -7.035 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.754 0.401 -9.300 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.236 -2.302 -8.061 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.301 -1.534 -9.222 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.400 -2.179 -9.806 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.265 -4.124 -11.064 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.637 -4.251 -9.329 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.907 -3.766 -10.478 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.155 -1.942 -12.146 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.790 -1.542 -11.570 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.430 -0.450 -11.216 1.00 0.00 H new ATOM 628 N LYS A 39 -5.525 1.241 -7.806 1.00 0.00 N ATOM 629 CA LYS A 39 -6.527 1.734 -6.948 1.00 0.00 C ATOM 630 C LYS A 39 -7.809 1.664 -7.691 1.00 0.00 C ATOM 631 O LYS A 39 -7.861 2.013 -8.877 1.00 0.00 O ATOM 632 CB LYS A 39 -6.178 3.143 -6.383 1.00 0.00 C ATOM 633 CG LYS A 39 -6.331 4.353 -7.308 1.00 0.00 C ATOM 634 CD LYS A 39 -7.730 4.942 -7.207 1.00 0.00 C ATOM 635 CE LYS A 39 -7.864 6.244 -7.973 1.00 0.00 C ATOM 636 NZ LYS A 39 -9.189 6.852 -7.749 1.00 0.00 N ATOM 0 H LYS A 39 -5.491 1.672 -8.730 1.00 0.00 H new ATOM 0 HA LYS A 39 -6.613 1.124 -6.049 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -6.802 3.314 -5.506 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -5.144 3.116 -6.038 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -5.593 5.111 -7.046 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -6.131 4.056 -8.337 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -8.453 4.222 -7.590 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -7.975 5.113 -6.159 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -7.084 6.937 -7.659 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -7.719 6.061 -9.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -9.146 7.868 -7.968 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -9.890 6.394 -8.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -9.466 6.723 -6.755 1.00 0.00 H new ATOM 650 N ASN A 40 -8.801 1.167 -7.046 1.00 0.00 N ATOM 651 CA ASN A 40 -10.091 0.951 -7.672 1.00 0.00 C ATOM 652 C ASN A 40 -10.767 2.208 -8.143 1.00 0.00 C ATOM 653 O ASN A 40 -10.578 3.291 -7.596 1.00 0.00 O ATOM 654 CB ASN A 40 -11.033 0.099 -6.813 1.00 0.00 C ATOM 655 CG ASN A 40 -10.742 -1.390 -6.948 1.00 0.00 C ATOM 656 OD1 ASN A 40 -9.900 -1.953 -6.255 1.00 0.00 O ATOM 657 ND2 ASN A 40 -11.441 -2.032 -7.831 1.00 0.00 N ATOM 0 H ASN A 40 -8.759 0.892 -6.065 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.860 0.381 -8.572 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -10.936 0.394 -5.768 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -12.065 0.294 -7.105 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -11.298 -3.033 -7.965 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -12.134 -1.536 -8.392 1.00 0.00 H new ATOM 664 N GLU A 41 -11.478 2.046 -9.225 1.00 0.00 N ATOM 665 CA GLU A 41 -12.282 3.059 -9.887 1.00 0.00 C ATOM 666 C GLU A 41 -13.402 3.435 -8.920 1.00 0.00 C ATOM 667 O GLU A 41 -13.857 4.572 -8.871 1.00 0.00 O ATOM 668 CB GLU A 41 -12.842 2.367 -11.112 1.00 0.00 C ATOM 669 CG GLU A 41 -13.147 3.167 -12.346 1.00 0.00 C ATOM 670 CD GLU A 41 -14.420 3.966 -12.261 1.00 0.00 C ATOM 671 OE1 GLU A 41 -15.510 3.385 -12.444 1.00 0.00 O ATOM 672 OE2 GLU A 41 -14.365 5.191 -12.051 1.00 0.00 O ATOM 0 H GLU A 41 -11.520 1.147 -9.706 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.736 3.960 -10.165 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.136 1.587 -11.396 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -13.764 1.869 -10.811 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -12.317 3.846 -12.540 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -13.212 2.490 -13.198 1.00 0.00 H new ATOM 679 N VAL A 42 -13.776 2.456 -8.098 1.00 0.00 N ATOM 680 CA VAL A 42 -14.728 2.584 -7.063 1.00 0.00 C ATOM 681 C VAL A 42 -14.065 3.346 -5.899 1.00 0.00 C ATOM 682 O VAL A 42 -14.718 4.037 -5.105 1.00 0.00 O ATOM 683 CB VAL A 42 -15.073 1.139 -6.625 1.00 0.00 C ATOM 684 CG1 VAL A 42 -15.694 1.109 -5.298 1.00 0.00 C ATOM 685 CG2 VAL A 42 -15.960 0.439 -7.635 1.00 0.00 C ATOM 0 H VAL A 42 -13.387 1.515 -8.162 1.00 0.00 H new ATOM 0 HA VAL A 42 -15.624 3.122 -7.373 1.00 0.00 H new ATOM 0 HB VAL A 42 -14.128 0.598 -6.573 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -15.921 0.078 -5.026 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -15.008 1.535 -4.566 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -16.615 1.692 -5.314 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -16.178 -0.571 -7.289 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -16.892 0.993 -7.747 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -15.449 0.391 -8.597 1.00 0.00 H new ATOM 695 N ASN A 43 -12.742 3.251 -5.898 1.00 0.00 N ATOM 696 CA ASN A 43 -11.827 3.747 -4.913 1.00 0.00 C ATOM 697 C ASN A 43 -12.181 3.137 -3.570 1.00 0.00 C ATOM 698 O ASN A 43 -12.054 3.747 -2.504 1.00 0.00 O ATOM 699 CB ASN A 43 -11.873 5.250 -4.932 1.00 0.00 C ATOM 700 CG ASN A 43 -10.670 5.943 -4.294 1.00 0.00 C ATOM 701 OD1 ASN A 43 -9.699 6.263 -4.998 1.00 0.00 O ATOM 702 ND2 ASN A 43 -10.706 6.189 -3.008 1.00 0.00 N ATOM 0 H ASN A 43 -12.252 2.781 -6.659 1.00 0.00 H new ATOM 0 HA ASN A 43 -10.797 3.460 -5.125 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -11.958 5.582 -5.967 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -12.776 5.577 -4.417 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -9.920 6.657 -2.556 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -11.520 5.913 -2.458 1.00 0.00 H new ATOM 709 N GLY A 44 -12.610 1.894 -3.650 1.00 0.00 N ATOM 710 CA GLY A 44 -12.975 1.163 -2.459 1.00 0.00 C ATOM 711 C GLY A 44 -11.813 0.353 -1.972 1.00 0.00 C ATOM 712 O GLY A 44 -11.445 0.404 -0.802 1.00 0.00 O ATOM 0 H GLY A 44 -12.713 1.374 -4.521 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -13.295 1.857 -1.682 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -13.821 0.509 -2.670 1.00 0.00 H new ATOM 716 N LYS A 45 -11.239 -0.389 -2.877 1.00 0.00 N ATOM 717 CA LYS A 45 -10.074 -1.184 -2.614 1.00 0.00 C ATOM 718 C LYS A 45 -8.869 -0.506 -3.237 1.00 0.00 C ATOM 719 O LYS A 45 -8.906 -0.083 -4.401 1.00 0.00 O ATOM 720 CB LYS A 45 -10.252 -2.574 -3.224 1.00 0.00 C ATOM 721 CG LYS A 45 -11.366 -3.397 -2.597 1.00 0.00 C ATOM 722 CD LYS A 45 -11.831 -4.518 -3.522 1.00 0.00 C ATOM 723 CE LYS A 45 -10.728 -5.483 -3.923 1.00 0.00 C ATOM 724 NZ LYS A 45 -11.222 -6.513 -4.878 1.00 0.00 N ATOM 0 H LYS A 45 -11.575 -0.459 -3.837 1.00 0.00 H new ATOM 0 HA LYS A 45 -9.929 -1.283 -1.538 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -10.452 -2.467 -4.290 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -9.314 -3.122 -3.129 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -11.018 -3.823 -1.656 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -12.209 -2.748 -2.360 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -12.627 -5.076 -3.029 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -12.261 -4.078 -4.422 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -9.906 -4.929 -4.377 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -10.330 -5.972 -3.034 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -10.436 -7.134 -5.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -11.966 -7.080 -4.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -11.610 -6.046 -5.722 1.00 0.00 H new ATOM 738 N LEU A 46 -7.841 -0.339 -2.476 1.00 0.00 N ATOM 739 CA LEU A 46 -6.654 0.190 -2.960 1.00 0.00 C ATOM 740 C LEU A 46 -5.627 -0.887 -2.782 1.00 0.00 C ATOM 741 O LEU A 46 -5.770 -1.725 -1.915 1.00 0.00 O ATOM 742 CB LEU A 46 -6.206 1.374 -2.141 1.00 0.00 C ATOM 743 CG LEU A 46 -7.234 2.476 -1.712 1.00 0.00 C ATOM 744 CD1 LEU A 46 -8.056 3.008 -2.881 1.00 0.00 C ATOM 745 CD2 LEU A 46 -8.119 2.043 -0.538 1.00 0.00 C ATOM 0 H LEU A 46 -7.822 -0.577 -1.484 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.783 0.512 -3.993 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -5.754 0.983 -1.230 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -5.415 1.872 -2.701 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.631 3.310 -1.353 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -8.750 3.768 -2.522 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.390 3.447 -3.624 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -8.616 2.190 -3.334 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -8.810 2.848 -0.287 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -8.684 1.154 -0.817 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -7.493 1.819 0.326 1.00 0.00 H new ATOM 757 N ARG A 47 -4.633 -0.876 -3.580 1.00 0.00 N ATOM 758 CA ARG A 47 -3.561 -1.892 -3.503 1.00 0.00 C ATOM 759 C ARG A 47 -2.204 -1.409 -3.938 1.00 0.00 C ATOM 760 O ARG A 47 -2.062 -0.533 -4.778 1.00 0.00 O ATOM 761 CB ARG A 47 -3.812 -3.113 -4.391 1.00 0.00 C ATOM 762 CG ARG A 47 -4.524 -2.882 -5.695 1.00 0.00 C ATOM 763 CD ARG A 47 -6.009 -3.081 -5.577 1.00 0.00 C ATOM 764 NE ARG A 47 -6.302 -4.492 -5.415 1.00 0.00 N ATOM 765 CZ ARG A 47 -7.431 -5.085 -5.752 1.00 0.00 C ATOM 766 NH1 ARG A 47 -8.471 -4.372 -6.165 1.00 0.00 N ATOM 767 NH2 ARG A 47 -7.518 -6.392 -5.665 1.00 0.00 N ATOM 0 H ARG A 47 -4.503 -0.182 -4.316 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.576 -2.134 -2.440 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -2.849 -3.575 -4.609 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -4.389 -3.836 -3.815 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -4.322 -1.869 -6.042 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -4.127 -3.562 -6.449 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -6.394 -2.520 -4.726 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -6.509 -2.696 -6.466 1.00 0.00 H new ATOM 0 HE ARG A 47 -5.573 -5.076 -5.005 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -8.402 -3.356 -6.224 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -9.340 -4.840 -6.423 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -6.719 -6.936 -5.340 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -8.385 -6.864 -5.922 1.00 0.00 H new ATOM 781 N MET A 48 -1.245 -2.035 -3.349 1.00 0.00 N ATOM 782 CA MET A 48 0.108 -2.062 -3.730 1.00 0.00 C ATOM 783 C MET A 48 0.360 -3.512 -4.070 1.00 0.00 C ATOM 784 O MET A 48 0.183 -4.402 -3.228 1.00 0.00 O ATOM 785 CB MET A 48 1.035 -1.704 -2.552 1.00 0.00 C ATOM 786 CG MET A 48 0.693 -0.422 -1.843 1.00 0.00 C ATOM 787 SD MET A 48 1.978 0.131 -0.734 1.00 0.00 S ATOM 788 CE MET A 48 1.406 1.800 -0.434 1.00 0.00 C ATOM 0 H MET A 48 -1.414 -2.590 -2.510 1.00 0.00 H new ATOM 0 HA MET A 48 0.301 -1.356 -4.538 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.011 -2.519 -1.829 1.00 0.00 H new ATOM 0 HB3 MET A 48 2.058 -1.636 -2.922 1.00 0.00 H new ATOM 0 HG2 MET A 48 0.501 0.355 -2.583 1.00 0.00 H new ATOM 0 HG3 MET A 48 -0.230 -0.561 -1.280 1.00 0.00 H new ATOM 0 HE1 MET A 48 2.188 2.508 -0.709 1.00 0.00 H new ATOM 0 HE2 MET A 48 0.516 1.993 -1.033 1.00 0.00 H new ATOM 0 HE3 MET A 48 1.165 1.918 0.623 1.00 0.00 H new ATOM 798 N LEU A 49 0.721 -3.751 -5.252 1.00 0.00 N ATOM 799 CA LEU A 49 1.074 -5.059 -5.698 1.00 0.00 C ATOM 800 C LEU A 49 2.377 -5.010 -6.391 1.00 0.00 C ATOM 801 O LEU A 49 2.737 -3.989 -6.965 1.00 0.00 O ATOM 802 CB LEU A 49 0.110 -5.671 -6.644 1.00 0.00 C ATOM 803 CG LEU A 49 -0.331 -4.892 -7.889 1.00 0.00 C ATOM 804 CD1 LEU A 49 -0.994 -5.839 -8.843 1.00 0.00 C ATOM 805 CD2 LEU A 49 -1.326 -3.805 -7.525 1.00 0.00 C ATOM 0 H LEU A 49 0.788 -3.035 -5.975 1.00 0.00 H new ATOM 0 HA LEU A 49 1.091 -5.670 -4.795 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.541 -6.612 -6.985 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.789 -5.918 -6.079 1.00 0.00 H new ATOM 0 HG LEU A 49 0.548 -4.432 -8.340 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.312 -5.296 -9.733 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.290 -6.621 -9.128 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.863 -6.290 -8.363 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.623 -3.267 -8.425 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -2.205 -4.256 -7.065 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.865 -3.110 -6.823 1.00 0.00 H new ATOM 817 N MET A 50 3.089 -6.070 -6.371 1.00 0.00 N ATOM 818 CA MET A 50 4.309 -6.114 -6.906 1.00 0.00 C ATOM 819 C MET A 50 4.528 -7.436 -7.471 1.00 0.00 C ATOM 820 O MET A 50 4.176 -8.491 -6.905 1.00 0.00 O ATOM 821 CB MET A 50 5.338 -5.763 -5.913 1.00 0.00 C ATOM 822 CG MET A 50 5.251 -6.571 -4.649 1.00 0.00 C ATOM 823 SD MET A 50 5.828 -5.681 -3.196 1.00 0.00 S ATOM 824 CE MET A 50 4.503 -4.501 -2.979 1.00 0.00 C ATOM 0 H MET A 50 2.785 -6.949 -5.952 1.00 0.00 H new ATOM 0 HA MET A 50 4.385 -5.374 -7.703 1.00 0.00 H new ATOM 0 HB2 MET A 50 6.323 -5.903 -6.357 1.00 0.00 H new ATOM 0 HB3 MET A 50 5.247 -4.705 -5.666 1.00 0.00 H new ATOM 0 HG2 MET A 50 4.217 -6.877 -4.492 1.00 0.00 H new ATOM 0 HG3 MET A 50 5.839 -7.481 -4.766 1.00 0.00 H new ATOM 0 HE1 MET A 50 4.770 -3.794 -2.194 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.339 -3.962 -3.912 1.00 0.00 H new ATOM 0 HE3 MET A 50 3.590 -5.026 -2.699 1.00 0.00 H new ATOM 834 N ARG A 51 5.004 -7.341 -8.554 1.00 0.00 N ATOM 835 CA ARG A 51 5.396 -8.409 -9.408 1.00 0.00 C ATOM 836 C ARG A 51 6.857 -8.483 -9.346 1.00 0.00 C ATOM 837 O ARG A 51 7.547 -7.481 -9.151 1.00 0.00 O ATOM 838 CB ARG A 51 4.969 -8.124 -10.845 1.00 0.00 C ATOM 839 CG ARG A 51 5.291 -9.167 -11.909 1.00 0.00 C ATOM 840 CD ARG A 51 4.855 -8.741 -13.311 1.00 0.00 C ATOM 841 NE ARG A 51 5.748 -7.758 -13.937 1.00 0.00 N ATOM 842 CZ ARG A 51 5.808 -7.508 -15.262 1.00 0.00 C ATOM 843 NH1 ARG A 51 4.972 -8.106 -16.101 1.00 0.00 N ATOM 844 NH2 ARG A 51 6.684 -6.649 -15.727 1.00 0.00 N ATOM 0 H ARG A 51 5.178 -6.430 -8.978 1.00 0.00 H new ATOM 0 HA ARG A 51 4.930 -9.343 -9.093 1.00 0.00 H new ATOM 0 HB2 ARG A 51 3.890 -7.967 -10.848 1.00 0.00 H new ATOM 0 HB3 ARG A 51 5.429 -7.184 -11.149 1.00 0.00 H new ATOM 0 HG2 ARG A 51 6.364 -9.358 -11.910 1.00 0.00 H new ATOM 0 HG3 ARG A 51 4.800 -10.105 -11.651 1.00 0.00 H new ATOM 0 HD2 ARG A 51 4.799 -9.624 -13.948 1.00 0.00 H new ATOM 0 HD3 ARG A 51 3.850 -8.322 -13.257 1.00 0.00 H new ATOM 0 HE ARG A 51 6.368 -7.226 -13.326 1.00 0.00 H new ATOM 0 HH11 ARG A 51 4.276 -8.762 -15.746 1.00 0.00 H new ATOM 0 HH12 ARG A 51 5.026 -7.910 -17.101 1.00 0.00 H new ATOM 0 HH21 ARG A 51 7.319 -6.171 -15.087 1.00 0.00 H new ATOM 0 HH22 ARG A 51 6.730 -6.459 -16.728 1.00 0.00 H new ATOM 858 N ARG A 52 7.316 -9.643 -9.481 1.00 0.00 N ATOM 859 CA ARG A 52 8.649 -9.883 -9.525 1.00 0.00 C ATOM 860 C ARG A 52 8.929 -9.746 -10.953 1.00 0.00 C ATOM 861 O ARG A 52 8.320 -10.398 -11.769 1.00 0.00 O ATOM 862 CB ARG A 52 8.931 -11.247 -8.904 1.00 0.00 C ATOM 863 CG ARG A 52 8.571 -11.298 -7.418 1.00 0.00 C ATOM 864 CD ARG A 52 9.000 -12.596 -6.745 1.00 0.00 C ATOM 865 NE ARG A 52 8.252 -13.782 -7.173 1.00 0.00 N ATOM 866 CZ ARG A 52 8.642 -15.046 -6.910 1.00 0.00 C ATOM 867 NH1 ARG A 52 9.799 -15.277 -6.295 1.00 0.00 N ATOM 868 NH2 ARG A 52 7.867 -16.065 -7.258 1.00 0.00 N ATOM 0 H ARG A 52 6.736 -10.477 -9.566 1.00 0.00 H new ATOM 0 HA ARG A 52 9.296 -9.218 -8.952 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.365 -12.010 -9.438 1.00 0.00 H new ATOM 0 HB3 ARG A 52 9.987 -11.488 -9.028 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.041 -10.458 -6.907 1.00 0.00 H new ATOM 0 HG3 ARG A 52 7.494 -11.176 -7.307 1.00 0.00 H new ATOM 0 HD2 ARG A 52 10.059 -12.760 -6.943 1.00 0.00 H new ATOM 0 HD3 ARG A 52 8.891 -12.484 -5.666 1.00 0.00 H new ATOM 0 HE ARG A 52 7.389 -13.644 -7.699 1.00 0.00 H new ATOM 0 HH11 ARG A 52 10.395 -14.496 -6.020 1.00 0.00 H new ATOM 0 HH12 ARG A 52 10.090 -16.235 -6.098 1.00 0.00 H new ATOM 0 HH21 ARG A 52 6.976 -15.892 -7.724 1.00 0.00 H new ATOM 0 HH22 ARG A 52 8.162 -17.021 -7.059 1.00 0.00 H new ATOM 882 N GLU A 53 9.804 -8.871 -11.235 1.00 0.00 N ATOM 883 CA GLU A 53 10.022 -8.369 -12.590 1.00 0.00 C ATOM 884 C GLU A 53 10.490 -9.323 -13.557 1.00 0.00 C ATOM 885 O GLU A 53 9.815 -9.541 -14.571 1.00 0.00 O ATOM 886 CB GLU A 53 10.715 -7.016 -12.646 1.00 0.00 C ATOM 887 CG GLU A 53 9.804 -5.858 -12.319 1.00 0.00 C ATOM 888 CD GLU A 53 8.566 -5.837 -13.172 1.00 0.00 C ATOM 889 OE1 GLU A 53 8.660 -5.481 -14.366 1.00 0.00 O ATOM 890 OE2 GLU A 53 7.481 -6.196 -12.681 1.00 0.00 O ATOM 0 H GLU A 53 10.420 -8.453 -10.538 1.00 0.00 H new ATOM 0 HA GLU A 53 9.007 -8.179 -12.939 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.553 -7.017 -11.949 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.130 -6.871 -13.643 1.00 0.00 H new ATOM 0 HG2 GLU A 53 9.516 -5.912 -11.269 1.00 0.00 H new ATOM 0 HG3 GLU A 53 10.349 -4.923 -12.452 1.00 0.00 H new ATOM 897 N GLN A 54 11.562 -9.925 -13.316 1.00 0.00 N ATOM 898 CA GLN A 54 11.988 -10.872 -14.254 1.00 0.00 C ATOM 899 C GLN A 54 11.280 -12.204 -14.033 1.00 0.00 C ATOM 900 O GLN A 54 11.378 -13.127 -14.843 1.00 0.00 O ATOM 901 CB GLN A 54 13.505 -10.996 -14.397 1.00 0.00 C ATOM 902 CG GLN A 54 14.192 -9.838 -15.136 1.00 0.00 C ATOM 903 CD GLN A 54 14.132 -8.505 -14.415 1.00 0.00 C ATOM 904 OE1 GLN A 54 14.116 -8.442 -13.184 1.00 0.00 O ATOM 905 NE2 GLN A 54 14.079 -7.440 -15.167 1.00 0.00 N ATOM 0 H GLN A 54 12.158 -9.792 -12.499 1.00 0.00 H new ATOM 0 HA GLN A 54 11.685 -10.496 -15.231 1.00 0.00 H new ATOM 0 HB2 GLN A 54 13.941 -11.080 -13.402 1.00 0.00 H new ATOM 0 HB3 GLN A 54 13.729 -11.924 -14.922 1.00 0.00 H new ATOM 0 HG2 GLN A 54 15.237 -10.100 -15.302 1.00 0.00 H new ATOM 0 HG3 GLN A 54 13.731 -9.726 -16.118 1.00 0.00 H new ATOM 0 HE21 GLN A 54 14.094 -7.532 -16.183 1.00 0.00 H new ATOM 0 HE22 GLN A 54 14.022 -6.516 -14.739 1.00 0.00 H new ATOM 914 N VAL A 55 10.549 -12.274 -12.941 1.00 0.00 N ATOM 915 CA VAL A 55 9.811 -13.428 -12.567 1.00 0.00 C ATOM 916 C VAL A 55 8.347 -13.353 -13.124 1.00 0.00 C ATOM 917 O VAL A 55 7.594 -14.337 -13.089 1.00 0.00 O ATOM 918 CB VAL A 55 9.823 -13.424 -11.006 1.00 0.00 C ATOM 919 CG1 VAL A 55 8.771 -14.327 -10.418 1.00 0.00 C ATOM 920 CG2 VAL A 55 11.197 -13.845 -10.495 1.00 0.00 C ATOM 0 H VAL A 55 10.459 -11.501 -12.281 1.00 0.00 H new ATOM 0 HA VAL A 55 10.242 -14.344 -12.972 1.00 0.00 H new ATOM 0 HB VAL A 55 9.597 -12.406 -10.688 1.00 0.00 H new ATOM 0 HG11 VAL A 55 8.823 -14.286 -9.330 1.00 0.00 H new ATOM 0 HG12 VAL A 55 7.785 -13.999 -10.746 1.00 0.00 H new ATOM 0 HG13 VAL A 55 8.942 -15.350 -10.752 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.197 -13.840 -9.405 1.00 0.00 H new ATOM 0 HG22 VAL A 55 11.427 -14.849 -10.853 1.00 0.00 H new ATOM 0 HG23 VAL A 55 11.951 -13.148 -10.861 1.00 0.00 H new ATOM 930 N LEU A 56 8.027 -12.206 -13.738 1.00 0.00 N ATOM 931 CA LEU A 56 6.805 -11.848 -14.397 1.00 0.00 C ATOM 932 C LEU A 56 5.518 -12.086 -13.547 1.00 0.00 C ATOM 933 O LEU A 56 4.385 -11.884 -14.002 1.00 0.00 O ATOM 934 CB LEU A 56 6.803 -12.755 -15.548 1.00 0.00 C ATOM 935 CG LEU A 56 5.570 -12.783 -16.348 1.00 0.00 C ATOM 936 CD1 LEU A 56 5.374 -11.505 -17.160 1.00 0.00 C ATOM 937 CD2 LEU A 56 5.396 -14.046 -17.157 1.00 0.00 C ATOM 0 H LEU A 56 8.700 -11.441 -13.778 1.00 0.00 H new ATOM 0 HA LEU A 56 6.778 -10.783 -14.625 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.630 -12.480 -16.202 1.00 0.00 H new ATOM 0 HB3 LEU A 56 7.002 -13.765 -15.189 1.00 0.00 H new ATOM 0 HG LEU A 56 4.752 -12.810 -15.628 1.00 0.00 H new ATOM 0 HD11 LEU A 56 4.450 -11.576 -17.733 1.00 0.00 H new ATOM 0 HD12 LEU A 56 5.318 -10.650 -16.486 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.214 -11.375 -17.842 1.00 0.00 H new ATOM 0 HD21 LEU A 56 4.464 -13.992 -17.720 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.232 -14.153 -17.848 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.366 -14.906 -16.488 1.00 0.00 H new ATOM 949 N LYS A 57 5.679 -12.372 -12.338 1.00 0.00 N ATOM 950 CA LYS A 57 4.538 -12.626 -11.531 1.00 0.00 C ATOM 951 C LYS A 57 4.369 -11.828 -10.219 1.00 0.00 C ATOM 952 O LYS A 57 5.148 -11.993 -9.279 1.00 0.00 O ATOM 953 CB LYS A 57 4.419 -14.086 -11.329 1.00 0.00 C ATOM 954 CG LYS A 57 3.073 -14.479 -10.765 1.00 0.00 C ATOM 955 CD LYS A 57 2.981 -15.945 -10.433 1.00 0.00 C ATOM 956 CE LYS A 57 1.612 -16.263 -9.862 1.00 0.00 C ATOM 957 NZ LYS A 57 1.306 -15.437 -8.664 1.00 0.00 N ATOM 0 H LYS A 57 6.579 -12.442 -11.864 1.00 0.00 H new ATOM 0 HA LYS A 57 3.700 -12.227 -12.102 1.00 0.00 H new ATOM 0 HB2 LYS A 57 4.575 -14.596 -12.280 1.00 0.00 H new ATOM 0 HB3 LYS A 57 5.206 -14.422 -10.654 1.00 0.00 H new ATOM 0 HG2 LYS A 57 2.877 -13.895 -9.866 1.00 0.00 H new ATOM 0 HG3 LYS A 57 2.295 -14.225 -11.485 1.00 0.00 H new ATOM 0 HD2 LYS A 57 3.158 -16.541 -11.328 1.00 0.00 H new ATOM 0 HD3 LYS A 57 3.755 -16.213 -9.714 1.00 0.00 H new ATOM 0 HE2 LYS A 57 0.852 -16.092 -10.624 1.00 0.00 H new ATOM 0 HE3 LYS A 57 1.566 -17.319 -9.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 0.445 -15.797 -8.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 2.101 -15.487 -7.996 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 1.158 -14.449 -8.952 1.00 0.00 H new ATOM 971 N VAL A 58 3.459 -10.869 -10.232 1.00 0.00 N ATOM 972 CA VAL A 58 2.816 -10.366 -9.004 1.00 0.00 C ATOM 973 C VAL A 58 2.230 -11.501 -8.151 1.00 0.00 C ATOM 974 O VAL A 58 1.672 -12.489 -8.660 1.00 0.00 O ATOM 975 CB VAL A 58 1.687 -9.327 -9.329 1.00 0.00 C ATOM 976 CG1 VAL A 58 0.559 -9.940 -10.146 1.00 0.00 C ATOM 977 CG2 VAL A 58 1.139 -8.715 -8.058 1.00 0.00 C ATOM 0 H VAL A 58 3.138 -10.411 -11.085 1.00 0.00 H new ATOM 0 HA VAL A 58 3.602 -9.873 -8.432 1.00 0.00 H new ATOM 0 HB VAL A 58 2.142 -8.543 -9.934 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.199 -9.182 -10.346 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.955 -10.315 -11.090 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.111 -10.762 -9.588 1.00 0.00 H new ATOM 0 HG21 VAL A 58 0.357 -7.997 -8.307 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.723 -9.500 -7.426 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.941 -8.206 -7.524 1.00 0.00 H new ATOM 987 N CYS A 59 2.422 -11.382 -6.872 1.00 0.00 N ATOM 988 CA CYS A 59 1.806 -12.290 -5.945 1.00 0.00 C ATOM 989 C CYS A 59 1.278 -11.536 -4.733 1.00 0.00 C ATOM 990 O CYS A 59 0.499 -12.090 -3.952 1.00 0.00 O ATOM 991 CB CYS A 59 2.778 -13.394 -5.511 1.00 0.00 C ATOM 992 SG CYS A 59 2.046 -14.647 -4.420 1.00 0.00 S ATOM 0 H CYS A 59 3.003 -10.662 -6.442 1.00 0.00 H new ATOM 0 HA CYS A 59 0.968 -12.767 -6.453 1.00 0.00 H new ATOM 0 HB2 CYS A 59 3.169 -13.888 -6.401 1.00 0.00 H new ATOM 0 HB3 CYS A 59 3.626 -12.936 -5.001 1.00 0.00 H new ATOM 0 HG CYS A 59 1.086 -14.111 -3.726 1.00 0.00 H new ATOM 998 N ALA A 60 1.559 -10.238 -4.644 1.00 0.00 N ATOM 999 CA ALA A 60 1.274 -9.535 -3.490 1.00 0.00 C ATOM 1000 C ALA A 60 0.330 -8.535 -3.808 1.00 0.00 C ATOM 1001 O ALA A 60 0.554 -7.752 -4.674 1.00 0.00 O ATOM 1002 CB ALA A 60 2.471 -8.831 -2.971 1.00 0.00 C ATOM 0 H ALA A 60 1.987 -9.687 -5.388 1.00 0.00 H new ATOM 0 HA ALA A 60 0.912 -10.243 -2.744 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.209 -8.289 -2.063 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.252 -9.558 -2.747 1.00 0.00 H new ATOM 0 HB3 ALA A 60 2.834 -8.128 -3.721 1.00 0.00 H new ATOM 1008 N ASN A 61 -0.706 -8.598 -3.176 1.00 0.00 N ATOM 1009 CA ASN A 61 -1.675 -7.565 -3.220 1.00 0.00 C ATOM 1010 C ASN A 61 -1.921 -7.109 -1.832 1.00 0.00 C ATOM 1011 O ASN A 61 -2.594 -7.769 -1.048 1.00 0.00 O ATOM 1012 CB ASN A 61 -2.940 -8.012 -3.844 1.00 0.00 C ATOM 1013 CG ASN A 61 -4.081 -6.976 -3.804 1.00 0.00 C ATOM 1014 OD1 ASN A 61 -4.268 -6.208 -4.730 1.00 0.00 O ATOM 1015 ND2 ASN A 61 -4.828 -6.936 -2.717 1.00 0.00 N ATOM 0 H ASN A 61 -0.957 -9.383 -2.575 1.00 0.00 H new ATOM 0 HA ASN A 61 -1.295 -6.750 -3.836 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -2.743 -8.275 -4.883 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -3.275 -8.920 -3.343 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -5.580 -6.252 -2.640 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -4.653 -7.589 -1.954 1.00 0.00 H new ATOM 1022 N HIS A 62 -1.284 -6.092 -1.520 1.00 0.00 N ATOM 1023 CA HIS A 62 -1.411 -5.426 -0.255 1.00 0.00 C ATOM 1024 C HIS A 62 -2.303 -4.209 -0.431 1.00 0.00 C ATOM 1025 O HIS A 62 -2.031 -3.379 -1.251 1.00 0.00 O ATOM 1026 CB HIS A 62 -0.035 -4.918 0.180 1.00 0.00 C ATOM 1027 CG HIS A 62 1.042 -5.910 0.153 1.00 0.00 C ATOM 1028 ND1 HIS A 62 2.212 -5.700 -0.518 1.00 0.00 N ATOM 1029 CD2 HIS A 62 1.126 -7.116 0.680 1.00 0.00 C ATOM 1030 CE1 HIS A 62 2.969 -6.751 -0.405 1.00 0.00 C ATOM 1031 NE2 HIS A 62 2.337 -7.633 0.312 1.00 0.00 N ATOM 0 H HIS A 62 -0.613 -5.646 -2.146 1.00 0.00 H new ATOM 0 HA HIS A 62 -1.824 -6.116 0.480 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.246 -4.085 -0.465 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.116 -4.524 1.193 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.378 -7.604 1.288 1.00 0.00 H new ATOM 0 HE1 HIS A 62 3.953 -6.871 -0.833 1.00 0.00 H new ATOM 0 HE2 HIS A 62 2.687 -8.559 0.559 1.00 0.00 H new ATOM 1039 N TRP A 63 -3.334 -4.112 0.329 1.00 0.00 N ATOM 1040 CA TRP A 63 -4.183 -2.946 0.329 1.00 0.00 C ATOM 1041 C TRP A 63 -3.563 -1.932 1.259 1.00 0.00 C ATOM 1042 O TRP A 63 -3.054 -2.287 2.310 1.00 0.00 O ATOM 1043 CB TRP A 63 -5.577 -3.296 0.884 1.00 0.00 C ATOM 1044 CG TRP A 63 -6.222 -4.488 0.243 1.00 0.00 C ATOM 1045 CD1 TRP A 63 -6.882 -4.539 -0.952 1.00 0.00 C ATOM 1046 CD2 TRP A 63 -6.279 -5.808 0.790 1.00 0.00 C ATOM 1047 NE1 TRP A 63 -7.328 -5.818 -1.182 1.00 0.00 N ATOM 1048 CE2 TRP A 63 -6.973 -6.612 -0.125 1.00 0.00 C ATOM 1049 CE3 TRP A 63 -5.803 -6.384 1.968 1.00 0.00 C ATOM 1050 CZ2 TRP A 63 -7.202 -7.964 0.100 1.00 0.00 C ATOM 1051 CZ3 TRP A 63 -6.034 -7.722 2.188 1.00 0.00 C ATOM 1052 CH2 TRP A 63 -6.727 -8.500 1.259 1.00 0.00 C ATOM 0 H TRP A 63 -3.626 -4.841 0.980 1.00 0.00 H new ATOM 0 HA TRP A 63 -4.282 -2.567 -0.688 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -5.492 -3.477 1.955 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -6.231 -2.433 0.758 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -7.031 -3.700 -1.616 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.841 -6.126 -2.008 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -5.264 -5.791 2.692 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.737 -8.568 -0.618 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -5.672 -8.179 3.097 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -6.890 -9.548 1.463 1.00 0.00 H new ATOM 1063 N ILE A 64 -3.590 -0.696 0.877 1.00 0.00 N ATOM 1064 CA ILE A 64 -3.034 0.335 1.651 1.00 0.00 C ATOM 1065 C ILE A 64 -4.177 0.989 2.420 1.00 0.00 C ATOM 1066 O ILE A 64 -5.093 1.563 1.833 1.00 0.00 O ATOM 1067 CB ILE A 64 -2.168 1.300 0.724 1.00 0.00 C ATOM 1068 CG1 ILE A 64 -1.765 2.636 1.384 1.00 0.00 C ATOM 1069 CG2 ILE A 64 -2.814 1.528 -0.649 1.00 0.00 C ATOM 1070 CD1 ILE A 64 -2.877 3.639 1.428 1.00 0.00 C ATOM 0 H ILE A 64 -4.009 -0.383 0.001 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.321 -0.020 2.395 1.00 0.00 H new ATOM 0 HB ILE A 64 -1.235 0.758 0.572 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -1.421 2.441 2.400 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -0.923 3.062 0.839 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -2.185 2.192 -1.241 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.920 0.573 -1.164 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -3.797 1.981 -0.518 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -2.524 4.553 1.905 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.206 3.862 0.413 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.712 3.232 1.998 1.00 0.00 H new ATOM 1082 N THR A 65 -4.187 0.771 3.707 1.00 0.00 N ATOM 1083 CA THR A 65 -5.244 1.257 4.544 1.00 0.00 C ATOM 1084 C THR A 65 -4.747 1.699 5.903 1.00 0.00 C ATOM 1085 O THR A 65 -3.677 1.300 6.351 1.00 0.00 O ATOM 1086 CB THR A 65 -6.381 0.200 4.675 1.00 0.00 C ATOM 1087 OG1 THR A 65 -7.403 0.627 5.586 1.00 0.00 O ATOM 1088 CG2 THR A 65 -5.844 -1.169 5.084 1.00 0.00 C ATOM 0 H THR A 65 -3.462 0.252 4.202 1.00 0.00 H new ATOM 0 HA THR A 65 -5.654 2.142 4.058 1.00 0.00 H new ATOM 0 HB THR A 65 -6.827 0.104 3.685 1.00 0.00 H new ATOM 0 HG1 THR A 65 -8.222 0.114 5.423 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.671 -1.875 5.164 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.137 -1.521 4.333 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.341 -1.089 6.048 1.00 0.00 H new ATOM 1096 N THR A 66 -5.568 2.500 6.549 1.00 0.00 N ATOM 1097 CA THR A 66 -5.345 2.991 7.898 1.00 0.00 C ATOM 1098 C THR A 66 -5.654 1.890 8.918 1.00 0.00 C ATOM 1099 O THR A 66 -5.456 2.054 10.126 1.00 0.00 O ATOM 1100 CB THR A 66 -6.245 4.184 8.174 1.00 0.00 C ATOM 1101 OG1 THR A 66 -7.622 3.814 7.991 1.00 0.00 O ATOM 1102 CG2 THR A 66 -5.925 5.293 7.244 1.00 0.00 C ATOM 0 H THR A 66 -6.438 2.840 6.139 1.00 0.00 H new ATOM 0 HA THR A 66 -4.301 3.290 7.988 1.00 0.00 H new ATOM 0 HB THR A 66 -6.081 4.507 9.202 1.00 0.00 H new ATOM 0 HG1 THR A 66 -8.196 4.588 8.172 1.00 0.00 H new ATOM 0 HG21 THR A 66 -6.577 6.142 7.452 1.00 0.00 H new ATOM 0 HG22 THR A 66 -4.885 5.592 7.378 1.00 0.00 H new ATOM 0 HG23 THR A 66 -6.077 4.962 6.217 1.00 0.00 H new ATOM 1110 N THR A 67 -6.141 0.775 8.397 1.00 0.00 N ATOM 1111 CA THR A 67 -6.524 -0.410 9.146 1.00 0.00 C ATOM 1112 C THR A 67 -5.256 -1.247 9.397 1.00 0.00 C ATOM 1113 O THR A 67 -5.266 -2.345 9.970 1.00 0.00 O ATOM 1114 CB THR A 67 -7.542 -1.201 8.273 1.00 0.00 C ATOM 1115 OG1 THR A 67 -8.649 -0.344 7.948 1.00 0.00 O ATOM 1116 CG2 THR A 67 -8.056 -2.454 8.961 1.00 0.00 C ATOM 0 H THR A 67 -6.287 0.667 7.393 1.00 0.00 H new ATOM 0 HA THR A 67 -6.979 -0.162 10.105 1.00 0.00 H new ATOM 0 HB THR A 67 -7.021 -1.521 7.371 1.00 0.00 H new ATOM 0 HG1 THR A 67 -8.401 0.242 7.203 1.00 0.00 H new ATOM 0 HG21 THR A 67 -8.762 -2.965 8.306 1.00 0.00 H new ATOM 0 HG22 THR A 67 -7.220 -3.117 9.181 1.00 0.00 H new ATOM 0 HG23 THR A 67 -8.556 -2.180 9.890 1.00 0.00 H new ATOM 1124 N MET A 68 -4.173 -0.681 8.996 1.00 0.00 N ATOM 1125 CA MET A 68 -2.954 -1.269 9.012 1.00 0.00 C ATOM 1126 C MET A 68 -1.981 -0.184 9.374 1.00 0.00 C ATOM 1127 O MET A 68 -2.311 1.010 9.336 1.00 0.00 O ATOM 1128 CB MET A 68 -2.686 -1.739 7.625 1.00 0.00 C ATOM 1129 CG MET A 68 -1.402 -2.492 7.439 1.00 0.00 C ATOM 1130 SD MET A 68 -0.978 -2.629 5.703 1.00 0.00 S ATOM 1131 CE MET A 68 -2.408 -3.505 5.074 1.00 0.00 C ATOM 0 H MET A 68 -4.154 0.271 8.630 1.00 0.00 H new ATOM 0 HA MET A 68 -2.882 -2.104 9.709 1.00 0.00 H new ATOM 0 HB2 MET A 68 -3.511 -2.378 7.310 1.00 0.00 H new ATOM 0 HB3 MET A 68 -2.680 -0.875 6.961 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.599 -1.985 7.973 1.00 0.00 H new ATOM 0 HG3 MET A 68 -1.495 -3.487 7.873 1.00 0.00 H new ATOM 0 HE1 MET A 68 -2.153 -3.989 4.131 1.00 0.00 H new ATOM 0 HE2 MET A 68 -2.719 -4.260 5.796 1.00 0.00 H new ATOM 0 HE3 MET A 68 -3.224 -2.801 4.911 1.00 0.00 H new ATOM 1141 N ASN A 69 -0.852 -0.588 9.719 1.00 0.00 N ATOM 1142 CA ASN A 69 0.215 0.258 10.127 1.00 0.00 C ATOM 1143 C ASN A 69 1.521 -0.263 9.568 1.00 0.00 C ATOM 1144 O ASN A 69 1.690 -1.476 9.404 1.00 0.00 O ATOM 1145 CB ASN A 69 0.247 0.232 11.636 1.00 0.00 C ATOM 1146 CG ASN A 69 1.402 1.003 12.271 1.00 0.00 C ATOM 1147 OD1 ASN A 69 1.311 2.215 12.479 1.00 0.00 O ATOM 1148 ND2 ASN A 69 2.457 0.314 12.628 1.00 0.00 N ATOM 0 H ASN A 69 -0.605 -1.578 9.734 1.00 0.00 H new ATOM 0 HA ASN A 69 0.073 1.275 9.762 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -0.692 0.640 12.011 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.298 -0.806 11.965 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.236 0.779 13.094 1.00 0.00 H new ATOM 0 HD22 ASN A 69 2.499 -0.688 12.441 1.00 0.00 H new ATOM 1155 N LEU A 70 2.400 0.646 9.233 1.00 0.00 N ATOM 1156 CA LEU A 70 3.673 0.376 8.847 1.00 0.00 C ATOM 1157 C LEU A 70 4.606 0.463 10.033 1.00 0.00 C ATOM 1158 O LEU A 70 4.551 1.363 10.864 1.00 0.00 O ATOM 1159 CB LEU A 70 4.043 1.176 7.612 1.00 0.00 C ATOM 1160 CG LEU A 70 3.811 2.677 7.555 1.00 0.00 C ATOM 1161 CD1 LEU A 70 4.578 3.357 8.630 1.00 0.00 C ATOM 1162 CD2 LEU A 70 4.327 3.102 6.238 1.00 0.00 C ATOM 0 H LEU A 70 2.187 1.643 9.238 1.00 0.00 H new ATOM 0 HA LEU A 70 3.774 -0.656 8.511 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.105 1.010 7.430 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.503 0.737 6.773 1.00 0.00 H new ATOM 0 HG LEU A 70 2.759 2.927 7.690 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.403 4.432 8.578 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.253 2.983 9.601 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.642 3.156 8.501 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.193 4.178 6.125 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.387 2.859 6.167 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.782 2.583 5.449 1.00 0.00 H new ATOM 1174 N LYS A 71 5.360 -0.501 10.109 1.00 0.00 N ATOM 1175 CA LYS A 71 6.227 -0.813 11.212 1.00 0.00 C ATOM 1176 C LYS A 71 7.643 -0.836 10.700 1.00 0.00 C ATOM 1177 O LYS A 71 7.884 -1.362 9.624 1.00 0.00 O ATOM 1178 CB LYS A 71 5.837 -2.210 11.727 1.00 0.00 C ATOM 1179 CG LYS A 71 6.649 -2.740 12.894 1.00 0.00 C ATOM 1180 CD LYS A 71 6.286 -4.192 13.183 1.00 0.00 C ATOM 1181 CE LYS A 71 7.019 -4.723 14.402 1.00 0.00 C ATOM 1182 NZ LYS A 71 6.600 -4.049 15.643 1.00 0.00 N ATOM 0 H LYS A 71 5.430 -1.186 9.357 1.00 0.00 H new ATOM 0 HA LYS A 71 6.140 -0.080 12.014 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.788 -2.187 12.021 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.921 -2.916 10.901 1.00 0.00 H new ATOM 0 HG2 LYS A 71 7.713 -2.663 12.669 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.465 -2.130 13.779 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.211 -4.274 13.341 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.528 -4.807 12.316 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.838 -5.794 14.494 1.00 0.00 H new ATOM 0 HE3 LYS A 71 8.092 -4.591 14.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 6.953 -4.582 16.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 6.989 -3.085 15.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 5.562 -4.004 15.680 1.00 0.00 H new ATOM 1196 N PRO A 72 8.591 -0.264 11.423 1.00 0.00 N ATOM 1197 CA PRO A 72 9.972 -0.223 10.976 1.00 0.00 C ATOM 1198 C PRO A 72 10.652 -1.593 11.028 1.00 0.00 C ATOM 1199 O PRO A 72 10.191 -2.526 11.717 1.00 0.00 O ATOM 1200 CB PRO A 72 10.633 0.755 11.935 1.00 0.00 C ATOM 1201 CG PRO A 72 9.816 0.666 13.180 1.00 0.00 C ATOM 1202 CD PRO A 72 8.410 0.399 12.730 1.00 0.00 C ATOM 0 HA PRO A 72 10.049 0.078 9.931 1.00 0.00 H new ATOM 0 HB2 PRO A 72 11.673 0.486 12.122 1.00 0.00 H new ATOM 0 HB3 PRO A 72 10.633 1.768 11.532 1.00 0.00 H new ATOM 0 HG2 PRO A 72 10.177 -0.133 13.828 1.00 0.00 H new ATOM 0 HG3 PRO A 72 9.874 1.592 13.752 1.00 0.00 H new ATOM 0 HD2 PRO A 72 7.877 -0.239 13.434 1.00 0.00 H new ATOM 0 HD3 PRO A 72 7.836 1.321 12.637 1.00 0.00 H new ATOM 1210 N LEU A 73 11.729 -1.707 10.306 1.00 0.00 N ATOM 1211 CA LEU A 73 12.472 -2.932 10.212 1.00 0.00 C ATOM 1212 C LEU A 73 13.626 -2.901 11.175 1.00 0.00 C ATOM 1213 O LEU A 73 14.074 -1.829 11.595 1.00 0.00 O ATOM 1214 CB LEU A 73 13.084 -3.021 8.833 1.00 0.00 C ATOM 1215 CG LEU A 73 12.805 -4.246 7.981 1.00 0.00 C ATOM 1216 CD1 LEU A 73 13.234 -5.520 8.667 1.00 0.00 C ATOM 1217 CD2 LEU A 73 11.360 -4.299 7.578 1.00 0.00 C ATOM 0 H LEU A 73 12.122 -0.942 9.758 1.00 0.00 H new ATOM 0 HA LEU A 73 11.802 -3.765 10.423 1.00 0.00 H new ATOM 0 HB2 LEU A 73 12.755 -2.147 8.270 1.00 0.00 H new ATOM 0 HB3 LEU A 73 14.165 -2.939 8.947 1.00 0.00 H new ATOM 0 HG LEU A 73 13.405 -4.158 7.075 1.00 0.00 H new ATOM 0 HD11 LEU A 73 13.016 -6.372 8.022 1.00 0.00 H new ATOM 0 HD12 LEU A 73 14.305 -5.482 8.869 1.00 0.00 H new ATOM 0 HD13 LEU A 73 12.692 -5.628 9.606 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.185 -5.185 6.968 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.735 -4.343 8.470 1.00 0.00 H new ATOM 0 HD23 LEU A 73 11.110 -3.408 7.003 1.00 0.00 H new ATOM 1229 N SER A 74 14.122 -4.049 11.495 1.00 0.00 N ATOM 1230 CA SER A 74 15.328 -4.152 12.228 1.00 0.00 C ATOM 1231 C SER A 74 16.461 -3.928 11.303 1.00 0.00 C ATOM 1232 O SER A 74 16.453 -4.451 10.170 1.00 0.00 O ATOM 1233 CB SER A 74 15.506 -5.526 12.773 1.00 0.00 C ATOM 1234 OG SER A 74 14.537 -5.846 13.762 1.00 0.00 O ATOM 0 H SER A 74 13.696 -4.943 11.252 1.00 0.00 H new ATOM 0 HA SER A 74 15.294 -3.424 13.038 1.00 0.00 H new ATOM 0 HB2 SER A 74 15.442 -6.248 11.959 1.00 0.00 H new ATOM 0 HB3 SER A 74 16.504 -5.617 13.203 1.00 0.00 H new ATOM 0 HG SER A 74 14.692 -6.757 14.089 1.00 0.00 H new ATOM 1240 N GLY A 75 17.395 -3.131 11.710 1.00 0.00 N ATOM 1241 CA GLY A 75 18.574 -3.010 10.940 1.00 0.00 C ATOM 1242 C GLY A 75 18.445 -2.099 9.701 1.00 0.00 C ATOM 1243 O GLY A 75 19.452 -1.655 9.147 1.00 0.00 O ATOM 0 H GLY A 75 17.360 -2.565 12.558 1.00 0.00 H new ATOM 0 HA2 GLY A 75 19.370 -2.623 11.577 1.00 0.00 H new ATOM 0 HA3 GLY A 75 18.882 -4.003 10.613 1.00 0.00 H new ATOM 1247 N SER A 76 17.221 -1.829 9.273 1.00 0.00 N ATOM 1248 CA SER A 76 16.961 -0.983 8.147 1.00 0.00 C ATOM 1249 C SER A 76 17.062 0.446 8.516 1.00 0.00 C ATOM 1250 O SER A 76 17.001 0.849 9.688 1.00 0.00 O ATOM 1251 CB SER A 76 15.586 -1.266 7.585 1.00 0.00 C ATOM 1252 OG SER A 76 15.468 -0.709 6.291 1.00 0.00 O ATOM 0 H SER A 76 16.379 -2.202 9.712 1.00 0.00 H new ATOM 0 HA SER A 76 17.714 -1.198 7.389 1.00 0.00 H new ATOM 0 HB2 SER A 76 15.415 -2.342 7.544 1.00 0.00 H new ATOM 0 HB3 SER A 76 14.823 -0.847 8.241 1.00 0.00 H new ATOM 0 HG SER A 76 15.900 -1.300 5.640 1.00 0.00 H new ATOM 1258 N ASP A 77 17.180 1.187 7.506 1.00 0.00 N ATOM 1259 CA ASP A 77 17.285 2.539 7.512 1.00 0.00 C ATOM 1260 C ASP A 77 15.931 3.022 7.283 1.00 0.00 C ATOM 1261 O ASP A 77 15.352 3.712 8.122 1.00 0.00 O ATOM 1262 CB ASP A 77 18.234 3.006 6.370 1.00 0.00 C ATOM 1263 CG ASP A 77 18.030 2.240 5.062 1.00 0.00 C ATOM 1264 OD1 ASP A 77 18.395 1.056 5.003 1.00 0.00 O ATOM 1265 OD2 ASP A 77 17.442 2.768 4.116 1.00 0.00 O ATOM 0 H ASP A 77 17.206 0.802 6.562 1.00 0.00 H new ATOM 0 HA ASP A 77 17.700 2.920 8.445 1.00 0.00 H new ATOM 0 HB2 ASP A 77 18.077 4.069 6.189 1.00 0.00 H new ATOM 0 HB3 ASP A 77 19.268 2.887 6.695 1.00 0.00 H new ATOM 1270 N ARG A 78 15.352 2.537 6.206 1.00 0.00 N ATOM 1271 CA ARG A 78 14.094 3.034 5.771 1.00 0.00 C ATOM 1272 C ARG A 78 13.190 2.022 5.035 1.00 0.00 C ATOM 1273 O ARG A 78 12.272 2.401 4.321 1.00 0.00 O ATOM 1274 CB ARG A 78 14.236 4.359 5.016 1.00 0.00 C ATOM 1275 CG ARG A 78 14.519 5.587 5.879 1.00 0.00 C ATOM 1276 CD ARG A 78 13.406 5.859 6.882 1.00 0.00 C ATOM 1277 NE ARG A 78 13.677 7.062 7.661 1.00 0.00 N ATOM 1278 CZ ARG A 78 13.671 7.154 8.993 1.00 0.00 C ATOM 1279 NH1 ARG A 78 13.442 6.083 9.759 1.00 0.00 N ATOM 1280 NH2 ARG A 78 13.914 8.311 9.558 1.00 0.00 N ATOM 0 H ARG A 78 15.745 1.797 5.624 1.00 0.00 H new ATOM 0 HA ARG A 78 13.548 3.229 6.694 1.00 0.00 H new ATOM 0 HB2 ARG A 78 15.041 4.256 4.288 1.00 0.00 H new ATOM 0 HB3 ARG A 78 13.319 4.536 4.455 1.00 0.00 H new ATOM 0 HG2 ARG A 78 15.459 5.444 6.413 1.00 0.00 H new ATOM 0 HG3 ARG A 78 14.646 6.458 5.236 1.00 0.00 H new ATOM 0 HD2 ARG A 78 12.458 5.970 6.355 1.00 0.00 H new ATOM 0 HD3 ARG A 78 13.301 5.006 7.552 1.00 0.00 H new ATOM 0 HE ARG A 78 13.891 7.912 7.140 1.00 0.00 H new ATOM 0 HH11 ARG A 78 13.268 5.175 9.328 1.00 0.00 H new ATOM 0 HH12 ARG A 78 13.441 6.173 10.775 1.00 0.00 H new ATOM 0 HH21 ARG A 78 14.105 9.130 8.981 1.00 0.00 H new ATOM 0 HH22 ARG A 78 13.912 8.393 10.575 1.00 0.00 H new ATOM 1294 N ALA A 79 13.340 0.782 5.331 1.00 0.00 N ATOM 1295 CA ALA A 79 12.457 -0.222 4.800 1.00 0.00 C ATOM 1296 C ALA A 79 11.560 -0.585 5.965 1.00 0.00 C ATOM 1297 O ALA A 79 12.029 -0.734 7.081 1.00 0.00 O ATOM 1298 CB ALA A 79 13.236 -1.466 4.397 1.00 0.00 C ATOM 0 H ALA A 79 14.072 0.423 5.945 1.00 0.00 H new ATOM 0 HA ALA A 79 11.921 0.139 3.922 1.00 0.00 H new ATOM 0 HB1 ALA A 79 12.549 -2.212 3.998 1.00 0.00 H new ATOM 0 HB2 ALA A 79 13.970 -1.205 3.635 1.00 0.00 H new ATOM 0 HB3 ALA A 79 13.748 -1.873 5.269 1.00 0.00 H new ATOM 1304 N TRP A 80 10.287 -0.678 5.722 1.00 0.00 N ATOM 1305 CA TRP A 80 9.297 -0.851 6.759 1.00 0.00 C ATOM 1306 C TRP A 80 8.379 -1.906 6.277 1.00 0.00 C ATOM 1307 O TRP A 80 8.338 -2.187 5.034 1.00 0.00 O ATOM 1308 CB TRP A 80 8.470 0.447 7.076 1.00 0.00 C ATOM 1309 CG TRP A 80 9.260 1.651 7.583 1.00 0.00 C ATOM 1310 CD1 TRP A 80 10.407 2.176 7.067 1.00 0.00 C ATOM 1311 CD2 TRP A 80 8.910 2.503 8.679 1.00 0.00 C ATOM 1312 NE1 TRP A 80 10.806 3.262 7.788 1.00 0.00 N ATOM 1313 CE2 TRP A 80 9.908 3.491 8.779 1.00 0.00 C ATOM 1314 CE3 TRP A 80 7.863 2.522 9.592 1.00 0.00 C ATOM 1315 CZ2 TRP A 80 9.882 4.483 9.752 1.00 0.00 C ATOM 1316 CZ3 TRP A 80 7.838 3.509 10.553 1.00 0.00 C ATOM 1317 CH2 TRP A 80 8.841 4.476 10.626 1.00 0.00 C ATOM 0 H TRP A 80 9.893 -0.636 4.782 1.00 0.00 H new ATOM 0 HA TRP A 80 9.806 -1.108 7.688 1.00 0.00 H new ATOM 0 HB2 TRP A 80 7.940 0.743 6.171 1.00 0.00 H new ATOM 0 HB3 TRP A 80 7.714 0.197 7.821 1.00 0.00 H new ATOM 0 HD1 TRP A 80 10.928 1.785 6.205 1.00 0.00 H new ATOM 0 HE1 TRP A 80 11.645 3.814 7.611 1.00 0.00 H new ATOM 0 HE3 TRP A 80 7.083 1.777 9.549 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 10.659 5.231 9.811 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 7.026 3.535 11.264 1.00 0.00 H new ATOM 0 HH2 TRP A 80 8.789 5.235 11.393 1.00 0.00 H new ATOM 1328 N MET A 81 7.645 -2.454 7.171 1.00 0.00 N ATOM 1329 CA MET A 81 6.815 -3.520 6.921 1.00 0.00 C ATOM 1330 C MET A 81 5.501 -3.131 7.340 1.00 0.00 C ATOM 1331 O MET A 81 5.337 -2.251 8.156 1.00 0.00 O ATOM 1332 CB MET A 81 7.218 -4.801 7.657 1.00 0.00 C ATOM 1333 CG MET A 81 7.299 -4.719 9.175 1.00 0.00 C ATOM 1334 SD MET A 81 7.541 -6.340 9.957 1.00 0.00 S ATOM 1335 CE MET A 81 9.114 -6.849 9.257 1.00 0.00 C ATOM 0 H MET A 81 7.622 -2.138 8.141 1.00 0.00 H new ATOM 0 HA MET A 81 6.870 -3.755 5.858 1.00 0.00 H new ATOM 0 HB2 MET A 81 6.505 -5.583 7.396 1.00 0.00 H new ATOM 0 HB3 MET A 81 8.191 -5.118 7.281 1.00 0.00 H new ATOM 0 HG2 MET A 81 8.121 -4.060 9.455 1.00 0.00 H new ATOM 0 HG3 MET A 81 6.384 -4.269 9.559 1.00 0.00 H new ATOM 0 HE1 MET A 81 9.421 -7.795 9.703 1.00 0.00 H new ATOM 0 HE2 MET A 81 9.010 -6.973 8.179 1.00 0.00 H new ATOM 0 HE3 MET A 81 9.867 -6.089 9.464 1.00 0.00 H new ATOM 1345 N TRP A 82 4.611 -3.706 6.774 1.00 0.00 N ATOM 1346 CA TRP A 82 3.287 -3.483 7.058 1.00 0.00 C ATOM 1347 C TRP A 82 2.666 -4.804 7.130 1.00 0.00 C ATOM 1348 O TRP A 82 3.182 -5.763 6.525 1.00 0.00 O ATOM 1349 CB TRP A 82 2.604 -2.530 6.069 1.00 0.00 C ATOM 1350 CG TRP A 82 2.633 -2.941 4.626 1.00 0.00 C ATOM 1351 CD1 TRP A 82 1.637 -3.555 3.942 1.00 0.00 C ATOM 1352 CD2 TRP A 82 3.693 -2.742 3.687 1.00 0.00 C ATOM 1353 NE1 TRP A 82 2.005 -3.741 2.645 1.00 0.00 N ATOM 1354 CE2 TRP A 82 3.256 -3.260 2.458 1.00 0.00 C ATOM 1355 CE3 TRP A 82 4.965 -2.177 3.762 1.00 0.00 C ATOM 1356 CZ2 TRP A 82 4.032 -3.230 1.317 1.00 0.00 C ATOM 1357 CZ3 TRP A 82 5.735 -2.150 2.626 1.00 0.00 C ATOM 1358 CH2 TRP A 82 5.262 -2.674 1.418 1.00 0.00 C ATOM 0 H TRP A 82 4.766 -4.400 6.043 1.00 0.00 H new ATOM 0 HA TRP A 82 3.175 -2.957 8.006 1.00 0.00 H new ATOM 0 HB2 TRP A 82 1.563 -2.411 6.371 1.00 0.00 H new ATOM 0 HB3 TRP A 82 3.075 -1.551 6.156 1.00 0.00 H new ATOM 0 HD1 TRP A 82 0.689 -3.853 4.365 1.00 0.00 H new ATOM 0 HE1 TRP A 82 1.427 -4.176 1.925 1.00 0.00 H new ATOM 0 HE3 TRP A 82 5.336 -1.770 4.691 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 3.673 -3.634 0.382 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 6.723 -1.717 2.665 1.00 0.00 H new ATOM 0 HH2 TRP A 82 5.895 -2.634 0.544 1.00 0.00 H new ATOM 1369 N LEU A 83 1.658 -4.942 7.864 1.00 0.00 N ATOM 1370 CA LEU A 83 1.103 -6.223 7.918 1.00 0.00 C ATOM 1371 C LEU A 83 -0.098 -6.268 7.032 1.00 0.00 C ATOM 1372 O LEU A 83 -1.029 -5.503 7.192 1.00 0.00 O ATOM 1373 CB LEU A 83 0.756 -6.667 9.339 1.00 0.00 C ATOM 1374 CG LEU A 83 -0.190 -5.757 10.165 1.00 0.00 C ATOM 1375 CD1 LEU A 83 -0.812 -6.559 11.279 1.00 0.00 C ATOM 1376 CD2 LEU A 83 0.572 -4.589 10.786 1.00 0.00 C ATOM 0 H LEU A 83 1.206 -4.218 8.422 1.00 0.00 H new ATOM 0 HA LEU A 83 1.854 -6.930 7.565 1.00 0.00 H new ATOM 0 HB2 LEU A 83 0.303 -7.657 9.281 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.688 -6.775 9.894 1.00 0.00 H new ATOM 0 HG LEU A 83 -0.954 -5.369 9.492 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -1.477 -5.920 11.860 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.382 -7.387 10.857 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.028 -6.951 11.927 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.117 -3.969 11.359 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.350 -4.972 11.446 1.00 0.00 H new ATOM 0 HD23 LEU A 83 1.028 -3.991 9.997 1.00 0.00 H new ATOM 1388 N ALA A 84 -0.103 -7.191 6.152 1.00 0.00 N ATOM 1389 CA ALA A 84 -1.137 -7.266 5.160 1.00 0.00 C ATOM 1390 C ALA A 84 -1.466 -8.663 4.843 1.00 0.00 C ATOM 1391 O ALA A 84 -0.633 -9.557 5.011 1.00 0.00 O ATOM 1392 CB ALA A 84 -0.697 -6.583 3.871 1.00 0.00 C ATOM 0 H ALA A 84 0.603 -7.924 6.086 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.012 -6.765 5.573 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.495 -6.651 3.132 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -0.477 -5.534 4.072 1.00 0.00 H new ATOM 0 HB3 ALA A 84 0.197 -7.074 3.486 1.00 0.00 H new ATOM 1398 N SER A 85 -2.659 -8.872 4.410 1.00 0.00 N ATOM 1399 CA SER A 85 -3.003 -10.052 3.816 1.00 0.00 C ATOM 1400 C SER A 85 -2.708 -9.938 2.391 1.00 0.00 C ATOM 1401 O SER A 85 -3.335 -9.202 1.633 1.00 0.00 O ATOM 1402 CB SER A 85 -4.396 -10.363 4.088 1.00 0.00 C ATOM 1403 OG SER A 85 -4.998 -9.308 4.867 1.00 0.00 O ATOM 0 H SER A 85 -3.418 -8.193 4.475 1.00 0.00 H new ATOM 0 HA SER A 85 -2.427 -10.884 4.220 1.00 0.00 H new ATOM 0 HB2 SER A 85 -4.938 -10.488 3.151 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.467 -11.308 4.626 1.00 0.00 H new ATOM 0 HG SER A 85 -5.937 -9.527 5.043 1.00 0.00 H new ATOM 1409 N ASP A 86 -1.705 -10.599 2.067 1.00 0.00 N ATOM 1410 CA ASP A 86 -1.184 -10.568 0.790 1.00 0.00 C ATOM 1411 C ASP A 86 -1.679 -11.742 0.015 1.00 0.00 C ATOM 1412 O ASP A 86 -1.515 -12.857 0.425 1.00 0.00 O ATOM 1413 CB ASP A 86 0.338 -10.418 0.879 1.00 0.00 C ATOM 1414 CG ASP A 86 1.230 -10.784 -0.287 1.00 0.00 C ATOM 1415 OD1 ASP A 86 0.913 -11.647 -1.114 1.00 0.00 O ATOM 1416 OD2 ASP A 86 2.327 -10.178 -0.357 1.00 0.00 O ATOM 0 H ASP A 86 -1.197 -11.206 2.710 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.529 -9.702 0.225 1.00 0.00 H new ATOM 0 HB2 ASP A 86 0.542 -9.375 1.121 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.667 -11.013 1.731 1.00 0.00 H new ATOM 1421 N PHE A 87 -2.345 -11.452 -1.063 1.00 0.00 N ATOM 1422 CA PHE A 87 -2.901 -12.432 -1.963 1.00 0.00 C ATOM 1423 C PHE A 87 -3.299 -11.700 -3.186 1.00 0.00 C ATOM 1424 O PHE A 87 -4.349 -11.064 -3.211 1.00 0.00 O ATOM 1425 CB PHE A 87 -4.143 -13.062 -1.352 1.00 0.00 C ATOM 1426 CG PHE A 87 -4.925 -14.078 -2.168 1.00 0.00 C ATOM 1427 CD1 PHE A 87 -4.559 -15.399 -2.220 1.00 0.00 C ATOM 1428 CD2 PHE A 87 -6.073 -13.684 -2.846 1.00 0.00 C ATOM 1429 CE1 PHE A 87 -5.307 -16.315 -2.932 1.00 0.00 C ATOM 1430 CE2 PHE A 87 -6.819 -14.587 -3.562 1.00 0.00 C ATOM 1431 CZ PHE A 87 -6.437 -15.904 -3.604 1.00 0.00 C ATOM 0 H PHE A 87 -2.526 -10.492 -1.355 1.00 0.00 H new ATOM 0 HA PHE A 87 -2.176 -13.219 -2.170 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -3.844 -13.545 -0.422 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -4.826 -12.255 -1.087 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -3.673 -15.727 -1.697 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -6.383 -12.650 -2.809 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -5.007 -17.352 -2.962 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -7.703 -14.262 -4.090 1.00 0.00 H new ATOM 0 HZ PHE A 87 -7.022 -16.618 -4.164 1.00 0.00 H new ATOM 1441 N SER A 88 -2.422 -11.646 -4.151 1.00 0.00 N ATOM 1442 CA SER A 88 -2.816 -11.057 -5.431 1.00 0.00 C ATOM 1443 C SER A 88 -3.839 -12.001 -6.018 1.00 0.00 C ATOM 1444 O SER A 88 -4.857 -11.613 -6.595 1.00 0.00 O ATOM 1445 CB SER A 88 -1.598 -10.881 -6.351 1.00 0.00 C ATOM 1446 OG SER A 88 -1.930 -10.268 -7.578 1.00 0.00 O ATOM 0 H SER A 88 -1.461 -11.985 -4.096 1.00 0.00 H new ATOM 0 HA SER A 88 -3.237 -10.059 -5.308 1.00 0.00 H new ATOM 0 HB2 SER A 88 -0.845 -10.280 -5.841 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.150 -11.855 -6.545 1.00 0.00 H new ATOM 0 HG SER A 88 -1.703 -10.871 -8.317 1.00 0.00 H new ATOM 1452 N ASP A 89 -3.537 -13.252 -5.762 1.00 0.00 N ATOM 1453 CA ASP A 89 -4.295 -14.427 -6.052 1.00 0.00 C ATOM 1454 C ASP A 89 -3.320 -15.528 -5.760 1.00 0.00 C ATOM 1455 O ASP A 89 -3.327 -16.592 -6.368 1.00 0.00 O ATOM 1456 CB ASP A 89 -4.712 -14.436 -7.513 1.00 0.00 C ATOM 1457 CG ASP A 89 -5.580 -15.618 -7.923 1.00 0.00 C ATOM 1458 OD1 ASP A 89 -6.746 -15.713 -7.474 1.00 0.00 O ATOM 1459 OD2 ASP A 89 -5.126 -16.444 -8.753 1.00 0.00 O ATOM 0 H ASP A 89 -2.660 -13.486 -5.296 1.00 0.00 H new ATOM 0 HA ASP A 89 -5.218 -14.511 -5.478 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -5.253 -13.514 -7.727 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -3.815 -14.430 -8.132 1.00 0.00 H new ATOM 1464 N GLY A 90 -2.502 -15.291 -4.724 1.00 0.00 N ATOM 1465 CA GLY A 90 -1.390 -16.147 -4.544 1.00 0.00 C ATOM 1466 C GLY A 90 -1.600 -17.059 -3.459 1.00 0.00 C ATOM 1467 O GLY A 90 -1.869 -18.248 -3.642 1.00 0.00 O ATOM 0 H GLY A 90 -2.606 -14.540 -4.041 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -1.208 -16.707 -5.461 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -0.498 -15.551 -4.352 1.00 0.00 H new ATOM 1471 N ASP A 91 -1.531 -16.505 -2.353 1.00 0.00 N ATOM 1472 CA ASP A 91 -1.623 -17.240 -1.104 1.00 0.00 C ATOM 1473 C ASP A 91 -2.062 -16.351 -0.016 1.00 0.00 C ATOM 1474 O ASP A 91 -1.351 -15.455 0.366 1.00 0.00 O ATOM 1475 CB ASP A 91 -0.278 -17.794 -0.824 1.00 0.00 C ATOM 1476 CG ASP A 91 -0.050 -18.322 0.595 1.00 0.00 C ATOM 1477 OD1 ASP A 91 -0.893 -19.087 1.107 1.00 0.00 O ATOM 1478 OD2 ASP A 91 1.007 -18.011 1.202 1.00 0.00 O ATOM 0 H ASP A 91 -1.405 -15.500 -2.234 1.00 0.00 H new ATOM 0 HA ASP A 91 -2.357 -18.043 -1.178 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -0.088 -18.605 -1.527 1.00 0.00 H new ATOM 0 HB3 ASP A 91 0.461 -17.019 -1.025 1.00 0.00 H new ATOM 1483 N ALA A 92 -3.228 -16.606 0.472 1.00 0.00 N ATOM 1484 CA ALA A 92 -3.846 -15.725 1.438 1.00 0.00 C ATOM 1485 C ALA A 92 -3.393 -16.006 2.838 1.00 0.00 C ATOM 1486 O ALA A 92 -3.820 -16.977 3.479 1.00 0.00 O ATOM 1487 CB ALA A 92 -5.356 -15.786 1.348 1.00 0.00 C ATOM 0 H ALA A 92 -3.787 -17.422 0.223 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.523 -14.714 1.188 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -5.792 -15.113 2.086 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -5.673 -15.484 0.350 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -5.691 -16.805 1.543 1.00 0.00 H new ATOM 1493 N LYS A 93 -2.476 -15.211 3.273 1.00 0.00 N ATOM 1494 CA LYS A 93 -1.990 -15.192 4.568 1.00 0.00 C ATOM 1495 C LYS A 93 -1.859 -13.753 5.008 1.00 0.00 C ATOM 1496 O LYS A 93 -1.623 -12.876 4.169 1.00 0.00 O ATOM 1497 CB LYS A 93 -0.625 -15.812 4.563 1.00 0.00 C ATOM 1498 CG LYS A 93 -0.557 -17.334 4.604 1.00 0.00 C ATOM 1499 CD LYS A 93 -1.201 -17.930 5.862 1.00 0.00 C ATOM 1500 CE LYS A 93 -0.511 -17.487 7.159 1.00 0.00 C ATOM 1501 NZ LYS A 93 0.923 -17.852 7.199 1.00 0.00 N ATOM 0 H LYS A 93 -2.029 -14.517 2.673 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.657 -15.735 5.238 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -0.102 -15.473 3.668 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.074 -15.425 5.420 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.054 -17.738 3.722 1.00 0.00 H new ATOM 0 HG3 LYS A 93 0.486 -17.647 4.554 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.251 -17.639 5.898 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -1.174 -19.018 5.796 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -0.609 -16.407 7.267 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -1.021 -17.940 8.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.149 -18.271 8.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 1.127 -18.541 6.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 1.502 -17.000 7.054 1.00 0.00 H new ATOM 1515 N LEU A 94 -2.036 -13.486 6.273 1.00 0.00 N ATOM 1516 CA LEU A 94 -1.690 -12.181 6.770 1.00 0.00 C ATOM 1517 C LEU A 94 -0.316 -12.295 7.320 1.00 0.00 C ATOM 1518 O LEU A 94 -0.034 -13.124 8.187 1.00 0.00 O ATOM 1519 CB LEU A 94 -2.676 -11.567 7.794 1.00 0.00 C ATOM 1520 CG LEU A 94 -2.752 -12.163 9.226 1.00 0.00 C ATOM 1521 CD1 LEU A 94 -3.700 -11.347 10.085 1.00 0.00 C ATOM 1522 CD2 LEU A 94 -3.189 -13.618 9.223 1.00 0.00 C ATOM 0 H LEU A 94 -2.409 -14.136 6.965 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.748 -11.473 5.943 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.431 -10.509 7.892 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -3.675 -11.624 7.362 1.00 0.00 H new ATOM 0 HG LEU A 94 -1.746 -12.121 9.643 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -3.744 -11.776 11.086 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -3.343 -10.319 10.146 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.695 -11.359 9.641 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -3.227 -13.989 10.247 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.177 -13.700 8.771 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -2.477 -14.211 8.649 1.00 0.00 H new ATOM 1534 N GLU A 95 0.511 -11.487 6.825 1.00 0.00 N ATOM 1535 CA GLU A 95 1.852 -11.557 6.999 1.00 0.00 C ATOM 1536 C GLU A 95 2.279 -10.213 7.273 1.00 0.00 C ATOM 1537 O GLU A 95 1.577 -9.233 6.994 1.00 0.00 O ATOM 1538 CB GLU A 95 2.488 -12.024 5.690 1.00 0.00 C ATOM 1539 CG GLU A 95 2.045 -13.386 5.148 1.00 0.00 C ATOM 1540 CD GLU A 95 2.501 -14.566 5.965 1.00 0.00 C ATOM 1541 OE1 GLU A 95 3.628 -15.024 5.762 1.00 0.00 O ATOM 1542 OE2 GLU A 95 1.725 -15.104 6.764 1.00 0.00 O ATOM 0 H GLU A 95 0.225 -10.700 6.242 1.00 0.00 H new ATOM 0 HA GLU A 95 2.131 -12.243 7.799 1.00 0.00 H new ATOM 0 HB2 GLU A 95 2.283 -11.273 4.927 1.00 0.00 H new ATOM 0 HB3 GLU A 95 3.569 -12.050 5.829 1.00 0.00 H new ATOM 0 HG2 GLU A 95 0.957 -13.402 5.088 1.00 0.00 H new ATOM 0 HG3 GLU A 95 2.422 -13.498 4.131 1.00 0.00 H new ATOM 1549 N GLN A 96 3.382 -10.157 7.782 1.00 0.00 N ATOM 1550 CA GLN A 96 3.983 -8.984 8.026 1.00 0.00 C ATOM 1551 C GLN A 96 5.061 -8.981 7.021 1.00 0.00 C ATOM 1552 O GLN A 96 5.944 -9.823 7.029 1.00 0.00 O ATOM 1553 CB GLN A 96 4.526 -8.852 9.444 1.00 0.00 C ATOM 1554 CG GLN A 96 3.496 -9.066 10.537 1.00 0.00 C ATOM 1555 CD GLN A 96 4.051 -8.767 11.905 1.00 0.00 C ATOM 1556 OE1 GLN A 96 4.610 -9.631 12.563 1.00 0.00 O ATOM 1557 NE2 GLN A 96 3.880 -7.550 12.358 1.00 0.00 N ATOM 0 H GLN A 96 3.925 -10.975 8.057 1.00 0.00 H new ATOM 0 HA GLN A 96 3.297 -8.140 7.955 1.00 0.00 H new ATOM 0 HB2 GLN A 96 5.334 -9.572 9.578 1.00 0.00 H new ATOM 0 HB3 GLN A 96 4.961 -7.859 9.562 1.00 0.00 H new ATOM 0 HG2 GLN A 96 2.632 -8.429 10.350 1.00 0.00 H new ATOM 0 HG3 GLN A 96 3.144 -10.097 10.506 1.00 0.00 H new ATOM 0 HE21 GLN A 96 3.409 -6.853 11.782 1.00 0.00 H new ATOM 0 HE22 GLN A 96 4.218 -7.299 13.287 1.00 0.00 H new ATOM 1566 N LEU A 97 4.949 -8.122 6.166 1.00 0.00 N ATOM 1567 CA LEU A 97 5.788 -8.075 5.043 1.00 0.00 C ATOM 1568 C LEU A 97 6.393 -6.737 4.808 1.00 0.00 C ATOM 1569 O LEU A 97 5.789 -5.697 5.070 1.00 0.00 O ATOM 1570 CB LEU A 97 5.028 -8.636 3.872 1.00 0.00 C ATOM 1571 CG LEU A 97 3.545 -8.299 3.822 1.00 0.00 C ATOM 1572 CD1 LEU A 97 3.291 -6.873 3.390 1.00 0.00 C ATOM 1573 CD2 LEU A 97 2.812 -9.297 2.975 1.00 0.00 C ATOM 0 H LEU A 97 4.249 -7.381 6.196 1.00 0.00 H new ATOM 0 HA LEU A 97 6.666 -8.697 5.214 1.00 0.00 H new ATOM 0 HB2 LEU A 97 5.494 -8.276 2.955 1.00 0.00 H new ATOM 0 HB3 LEU A 97 5.135 -9.721 3.880 1.00 0.00 H new ATOM 0 HG LEU A 97 3.151 -8.369 4.836 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.218 -6.684 3.371 1.00 0.00 H new ATOM 0 HD12 LEU A 97 3.767 -6.190 4.093 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.705 -6.715 2.394 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.752 -9.043 2.949 1.00 0.00 H new ATOM 0 HD22 LEU A 97 3.215 -9.280 1.962 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.936 -10.294 3.398 1.00 0.00 H new ATOM 1585 N ALA A 98 7.570 -6.771 4.310 1.00 0.00 N ATOM 1586 CA ALA A 98 8.369 -5.600 4.187 1.00 0.00 C ATOM 1587 C ALA A 98 8.690 -5.304 2.770 1.00 0.00 C ATOM 1588 O ALA A 98 8.544 -6.152 1.902 1.00 0.00 O ATOM 1589 CB ALA A 98 9.645 -5.750 4.988 1.00 0.00 C ATOM 0 H ALA A 98 8.018 -7.622 3.970 1.00 0.00 H new ATOM 0 HA ALA A 98 7.792 -4.763 4.581 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.247 -4.847 4.885 1.00 0.00 H new ATOM 0 HB2 ALA A 98 9.399 -5.905 6.039 1.00 0.00 H new ATOM 0 HB3 ALA A 98 10.209 -6.606 4.618 1.00 0.00 H new ATOM 1595 N ALA A 99 9.100 -4.094 2.534 1.00 0.00 N ATOM 1596 CA ALA A 99 9.546 -3.703 1.237 1.00 0.00 C ATOM 1597 C ALA A 99 10.667 -2.733 1.395 1.00 0.00 C ATOM 1598 O ALA A 99 10.520 -1.697 2.086 1.00 0.00 O ATOM 1599 CB ALA A 99 8.428 -3.110 0.414 1.00 0.00 C ATOM 0 H ALA A 99 9.134 -3.354 3.235 1.00 0.00 H new ATOM 0 HA ALA A 99 9.892 -4.585 0.698 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.810 -2.825 -0.567 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.634 -3.847 0.294 1.00 0.00 H new ATOM 0 HB3 ALA A 99 8.032 -2.229 0.919 1.00 0.00 H new ATOM 1605 N LYS A 100 11.748 -3.044 0.773 1.00 0.00 N ATOM 1606 CA LYS A 100 12.930 -2.322 0.831 1.00 0.00 C ATOM 1607 C LYS A 100 13.124 -1.741 -0.492 1.00 0.00 C ATOM 1608 O LYS A 100 12.761 -2.301 -1.522 1.00 0.00 O ATOM 1609 CB LYS A 100 14.083 -3.248 1.171 1.00 0.00 C ATOM 1610 CG LYS A 100 15.530 -2.731 1.027 1.00 0.00 C ATOM 1611 CD LYS A 100 15.921 -1.634 2.006 1.00 0.00 C ATOM 1612 CE LYS A 100 17.383 -1.250 1.788 1.00 0.00 C ATOM 1613 NZ LYS A 100 17.834 -0.172 2.679 1.00 0.00 N ATOM 0 H LYS A 100 11.815 -3.868 0.175 1.00 0.00 H new ATOM 0 HA LYS A 100 12.887 -1.548 1.597 1.00 0.00 H new ATOM 0 HB2 LYS A 100 13.951 -3.571 2.204 1.00 0.00 H new ATOM 0 HB3 LYS A 100 13.987 -4.135 0.545 1.00 0.00 H new ATOM 0 HG2 LYS A 100 16.214 -3.570 1.153 1.00 0.00 H new ATOM 0 HG3 LYS A 100 15.667 -2.357 0.012 1.00 0.00 H new ATOM 0 HD2 LYS A 100 15.281 -0.763 1.866 1.00 0.00 H new ATOM 0 HD3 LYS A 100 15.773 -1.977 3.030 1.00 0.00 H new ATOM 0 HE2 LYS A 100 18.010 -2.128 1.943 1.00 0.00 H new ATOM 0 HE3 LYS A 100 17.520 -0.939 0.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 18.748 0.195 2.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 17.132 0.595 2.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 17.942 -0.542 3.645 1.00 0.00 H new ATOM 1627 N PHE A 101 13.600 -0.651 -0.426 1.00 0.00 N ATOM 1628 CA PHE A 101 13.917 0.163 -1.548 1.00 0.00 C ATOM 1629 C PHE A 101 15.409 0.320 -1.674 1.00 0.00 C ATOM 1630 O PHE A 101 16.148 -0.092 -0.791 1.00 0.00 O ATOM 1631 CB PHE A 101 13.208 1.484 -1.424 1.00 0.00 C ATOM 1632 CG PHE A 101 11.731 1.360 -1.606 1.00 0.00 C ATOM 1633 CD1 PHE A 101 10.904 1.058 -0.535 1.00 0.00 C ATOM 1634 CD2 PHE A 101 11.174 1.529 -2.852 1.00 0.00 C ATOM 1635 CE1 PHE A 101 9.553 0.928 -0.714 1.00 0.00 C ATOM 1636 CE2 PHE A 101 9.827 1.404 -3.036 1.00 0.00 C ATOM 1637 CZ PHE A 101 9.013 1.103 -1.969 1.00 0.00 C ATOM 0 H PHE A 101 13.823 -0.206 0.464 1.00 0.00 H new ATOM 0 HA PHE A 101 13.572 -0.314 -2.465 1.00 0.00 H new ATOM 0 HB2 PHE A 101 13.415 1.913 -0.444 1.00 0.00 H new ATOM 0 HB3 PHE A 101 13.605 2.177 -2.166 1.00 0.00 H new ATOM 0 HD1 PHE A 101 11.329 0.924 0.449 1.00 0.00 H new ATOM 0 HD2 PHE A 101 11.809 1.763 -3.694 1.00 0.00 H new ATOM 0 HE1 PHE A 101 8.914 0.690 0.124 1.00 0.00 H new ATOM 0 HE2 PHE A 101 9.401 1.541 -4.019 1.00 0.00 H new ATOM 0 HZ PHE A 101 7.948 1.004 -2.116 1.00 0.00 H new ATOM 1647 N LYS A 102 15.847 0.883 -2.767 1.00 0.00 N ATOM 1648 CA LYS A 102 17.271 1.020 -3.054 1.00 0.00 C ATOM 1649 C LYS A 102 17.997 1.878 -2.021 1.00 0.00 C ATOM 1650 O LYS A 102 19.013 1.476 -1.475 1.00 0.00 O ATOM 1651 CB LYS A 102 17.518 1.564 -4.472 1.00 0.00 C ATOM 1652 CG LYS A 102 17.182 0.624 -5.613 1.00 0.00 C ATOM 1653 CD LYS A 102 15.685 0.471 -5.807 1.00 0.00 C ATOM 1654 CE LYS A 102 15.380 -0.451 -6.952 1.00 0.00 C ATOM 1655 NZ LYS A 102 15.958 0.029 -8.227 1.00 0.00 N ATOM 0 H LYS A 102 15.237 1.263 -3.491 1.00 0.00 H new ATOM 0 HA LYS A 102 17.687 0.014 -2.995 1.00 0.00 H new ATOM 0 HB2 LYS A 102 16.935 2.477 -4.596 1.00 0.00 H new ATOM 0 HB3 LYS A 102 18.568 1.843 -4.555 1.00 0.00 H new ATOM 0 HG2 LYS A 102 17.630 0.998 -6.534 1.00 0.00 H new ATOM 0 HG3 LYS A 102 17.623 -0.353 -5.418 1.00 0.00 H new ATOM 0 HD2 LYS A 102 15.235 0.083 -4.893 1.00 0.00 H new ATOM 0 HD3 LYS A 102 15.238 1.447 -5.993 1.00 0.00 H new ATOM 0 HE2 LYS A 102 15.770 -1.444 -6.730 1.00 0.00 H new ATOM 0 HE3 LYS A 102 14.300 -0.549 -7.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 15.498 -0.458 -9.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 15.805 1.054 -8.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 16.978 -0.171 -8.243 1.00 0.00 H new ATOM 1669 N THR A 103 17.461 3.031 -1.749 1.00 0.00 N ATOM 1670 CA THR A 103 18.063 3.982 -0.838 1.00 0.00 C ATOM 1671 C THR A 103 16.988 4.446 0.117 1.00 0.00 C ATOM 1672 O THR A 103 15.805 4.183 -0.153 1.00 0.00 O ATOM 1673 CB THR A 103 18.549 5.197 -1.646 1.00 0.00 C ATOM 1674 OG1 THR A 103 17.430 5.744 -2.368 1.00 0.00 O ATOM 1675 CG2 THR A 103 19.621 4.793 -2.634 1.00 0.00 C ATOM 0 H THR A 103 16.581 3.350 -2.155 1.00 0.00 H new ATOM 0 HA THR A 103 18.897 3.529 -0.301 1.00 0.00 H new ATOM 0 HB THR A 103 18.968 5.934 -0.961 1.00 0.00 H new ATOM 0 HG1 THR A 103 17.744 6.449 -2.972 1.00 0.00 H new ATOM 0 HG21 THR A 103 19.949 5.669 -3.194 1.00 0.00 H new ATOM 0 HG22 THR A 103 20.469 4.367 -2.097 1.00 0.00 H new ATOM 0 HG23 THR A 103 19.219 4.051 -3.324 1.00 0.00 H new ATOM 1683 N PRO A 104 17.320 5.185 1.229 1.00 0.00 N ATOM 1684 CA PRO A 104 16.306 5.734 2.118 1.00 0.00 C ATOM 1685 C PRO A 104 15.521 6.816 1.443 1.00 0.00 C ATOM 1686 O PRO A 104 14.682 7.355 1.983 1.00 0.00 O ATOM 1687 CB PRO A 104 17.071 6.334 3.286 1.00 0.00 C ATOM 1688 CG PRO A 104 18.425 5.725 3.202 1.00 0.00 C ATOM 1689 CD PRO A 104 18.671 5.505 1.730 1.00 0.00 C ATOM 0 HA PRO A 104 15.601 4.961 2.424 1.00 0.00 H new ATOM 0 HB2 PRO A 104 17.120 7.420 3.211 1.00 0.00 H new ATOM 0 HB3 PRO A 104 16.590 6.101 4.236 1.00 0.00 H new ATOM 0 HG2 PRO A 104 19.180 6.383 3.633 1.00 0.00 H new ATOM 0 HG3 PRO A 104 18.469 4.786 3.753 1.00 0.00 H new ATOM 0 HD2 PRO A 104 19.083 6.392 1.250 1.00 0.00 H new ATOM 0 HD3 PRO A 104 19.374 4.691 1.552 1.00 0.00 H new ATOM 1697 N GLU A 105 15.888 7.156 0.293 1.00 0.00 N ATOM 1698 CA GLU A 105 15.147 8.100 -0.488 1.00 0.00 C ATOM 1699 C GLU A 105 13.877 7.419 -0.918 1.00 0.00 C ATOM 1700 O GLU A 105 12.793 7.853 -0.617 1.00 0.00 O ATOM 1701 CB GLU A 105 15.930 8.576 -1.700 1.00 0.00 C ATOM 1702 CG GLU A 105 15.229 9.660 -2.492 1.00 0.00 C ATOM 1703 CD GLU A 105 15.851 9.885 -3.836 1.00 0.00 C ATOM 1704 OE1 GLU A 105 17.064 10.208 -3.914 1.00 0.00 O ATOM 1705 OE2 GLU A 105 15.149 9.722 -4.854 1.00 0.00 O ATOM 0 H GLU A 105 16.724 6.795 -0.166 1.00 0.00 H new ATOM 0 HA GLU A 105 14.938 8.987 0.110 1.00 0.00 H new ATOM 0 HB2 GLU A 105 16.900 8.949 -1.371 1.00 0.00 H new ATOM 0 HB3 GLU A 105 16.121 7.726 -2.355 1.00 0.00 H new ATOM 0 HG2 GLU A 105 14.181 9.390 -2.621 1.00 0.00 H new ATOM 0 HG3 GLU A 105 15.251 10.591 -1.925 1.00 0.00 H new ATOM 1712 N LEU A 106 14.062 6.267 -1.548 1.00 0.00 N ATOM 1713 CA LEU A 106 12.970 5.502 -2.094 1.00 0.00 C ATOM 1714 C LEU A 106 12.247 4.855 -0.986 1.00 0.00 C ATOM 1715 O LEU A 106 11.026 4.790 -0.959 1.00 0.00 O ATOM 1716 CB LEU A 106 13.452 4.483 -3.143 1.00 0.00 C ATOM 1717 CG LEU A 106 13.750 5.024 -4.555 1.00 0.00 C ATOM 1718 CD1 LEU A 106 14.931 5.977 -4.573 1.00 0.00 C ATOM 1719 CD2 LEU A 106 13.970 3.880 -5.521 1.00 0.00 C ATOM 0 H LEU A 106 14.979 5.843 -1.691 1.00 0.00 H new ATOM 0 HA LEU A 106 12.290 6.171 -2.622 1.00 0.00 H new ATOM 0 HB2 LEU A 106 14.357 4.008 -2.764 1.00 0.00 H new ATOM 0 HB3 LEU A 106 12.696 3.703 -3.231 1.00 0.00 H new ATOM 0 HG LEU A 106 12.878 5.596 -4.873 1.00 0.00 H new ATOM 0 HD11 LEU A 106 15.099 6.329 -5.591 1.00 0.00 H new ATOM 0 HD12 LEU A 106 14.722 6.828 -3.924 1.00 0.00 H new ATOM 0 HD13 LEU A 106 15.822 5.459 -4.217 1.00 0.00 H new ATOM 0 HD21 LEU A 106 14.179 4.278 -6.514 1.00 0.00 H new ATOM 0 HD22 LEU A 106 14.814 3.278 -5.186 1.00 0.00 H new ATOM 0 HD23 LEU A 106 13.075 3.259 -5.560 1.00 0.00 H new ATOM 1731 N ALA A 107 13.021 4.434 -0.040 1.00 0.00 N ATOM 1732 CA ALA A 107 12.532 3.802 1.109 1.00 0.00 C ATOM 1733 C ALA A 107 11.818 4.814 1.985 1.00 0.00 C ATOM 1734 O ALA A 107 10.673 4.580 2.350 1.00 0.00 O ATOM 1735 CB ALA A 107 13.705 3.158 1.815 1.00 0.00 C ATOM 0 H ALA A 107 14.036 4.530 -0.060 1.00 0.00 H new ATOM 0 HA ALA A 107 11.804 3.030 0.861 1.00 0.00 H new ATOM 0 HB1 ALA A 107 13.356 2.656 2.717 1.00 0.00 H new ATOM 0 HB2 ALA A 107 14.173 2.430 1.153 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.432 3.924 2.085 1.00 0.00 H new ATOM 1741 N GLU A 108 12.433 5.980 2.249 1.00 0.00 N ATOM 1742 CA GLU A 108 11.766 6.928 3.174 1.00 0.00 C ATOM 1743 C GLU A 108 10.547 7.578 2.542 1.00 0.00 C ATOM 1744 O GLU A 108 9.455 7.575 3.129 1.00 0.00 O ATOM 1745 CB GLU A 108 12.718 7.969 3.780 1.00 0.00 C ATOM 1746 CG GLU A 108 12.102 8.787 4.907 1.00 0.00 C ATOM 1747 CD GLU A 108 13.065 9.751 5.530 1.00 0.00 C ATOM 1748 OE1 GLU A 108 13.950 9.322 6.279 1.00 0.00 O ATOM 1749 OE2 GLU A 108 12.951 10.966 5.295 1.00 0.00 O ATOM 0 H GLU A 108 13.330 6.281 1.868 1.00 0.00 H new ATOM 0 HA GLU A 108 11.419 6.322 4.011 1.00 0.00 H new ATOM 0 HB2 GLU A 108 13.605 7.460 4.157 1.00 0.00 H new ATOM 0 HB3 GLU A 108 13.049 8.646 2.992 1.00 0.00 H new ATOM 0 HG2 GLU A 108 11.245 9.338 4.521 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.727 8.111 5.675 1.00 0.00 H new ATOM 1756 N GLU A 109 10.718 8.069 1.322 1.00 0.00 N ATOM 1757 CA GLU A 109 9.640 8.738 0.581 1.00 0.00 C ATOM 1758 C GLU A 109 8.442 7.860 0.430 1.00 0.00 C ATOM 1759 O GLU A 109 7.314 8.339 0.495 1.00 0.00 O ATOM 1760 CB GLU A 109 10.091 9.203 -0.805 1.00 0.00 C ATOM 1761 CG GLU A 109 10.711 10.579 -0.842 1.00 0.00 C ATOM 1762 CD GLU A 109 9.695 11.644 -0.519 1.00 0.00 C ATOM 1763 OE1 GLU A 109 8.752 11.851 -1.328 1.00 0.00 O ATOM 1764 OE2 GLU A 109 9.821 12.306 0.518 1.00 0.00 O ATOM 0 H GLU A 109 11.601 8.019 0.814 1.00 0.00 H new ATOM 0 HA GLU A 109 9.373 9.612 1.175 1.00 0.00 H new ATOM 0 HB2 GLU A 109 10.811 8.485 -1.197 1.00 0.00 H new ATOM 0 HB3 GLU A 109 9.231 9.189 -1.475 1.00 0.00 H new ATOM 0 HG2 GLU A 109 11.534 10.629 -0.129 1.00 0.00 H new ATOM 0 HG3 GLU A 109 11.134 10.764 -1.830 1.00 0.00 H new ATOM 1771 N PHE A 110 8.663 6.581 0.224 1.00 0.00 N ATOM 1772 CA PHE A 110 7.570 5.676 0.057 1.00 0.00 C ATOM 1773 C PHE A 110 6.816 5.506 1.345 1.00 0.00 C ATOM 1774 O PHE A 110 5.628 5.625 1.359 1.00 0.00 O ATOM 1775 CB PHE A 110 8.041 4.326 -0.412 1.00 0.00 C ATOM 1776 CG PHE A 110 6.926 3.455 -0.924 1.00 0.00 C ATOM 1777 CD1 PHE A 110 6.456 3.613 -2.217 1.00 0.00 C ATOM 1778 CD2 PHE A 110 6.347 2.484 -0.118 1.00 0.00 C ATOM 1779 CE1 PHE A 110 5.436 2.821 -2.696 1.00 0.00 C ATOM 1780 CE2 PHE A 110 5.329 1.692 -0.596 1.00 0.00 C ATOM 1781 CZ PHE A 110 4.872 1.863 -1.885 1.00 0.00 C ATOM 0 H PHE A 110 9.588 6.155 0.170 1.00 0.00 H new ATOM 0 HA PHE A 110 6.913 6.106 -0.699 1.00 0.00 H new ATOM 0 HB2 PHE A 110 8.780 4.460 -1.202 1.00 0.00 H new ATOM 0 HB3 PHE A 110 8.542 3.817 0.411 1.00 0.00 H new ATOM 0 HD1 PHE A 110 6.894 4.365 -2.857 1.00 0.00 H new ATOM 0 HD2 PHE A 110 6.699 2.349 0.894 1.00 0.00 H new ATOM 0 HE1 PHE A 110 5.079 2.952 -3.707 1.00 0.00 H new ATOM 0 HE2 PHE A 110 4.888 0.937 0.038 1.00 0.00 H new ATOM 0 HZ PHE A 110 4.070 1.244 -2.259 1.00 0.00 H new ATOM 1791 N LYS A 111 7.527 5.258 2.424 1.00 0.00 N ATOM 1792 CA LYS A 111 6.880 4.949 3.721 1.00 0.00 C ATOM 1793 C LYS A 111 6.067 6.118 4.267 1.00 0.00 C ATOM 1794 O LYS A 111 4.952 5.939 4.760 1.00 0.00 O ATOM 1795 CB LYS A 111 7.892 4.482 4.762 1.00 0.00 C ATOM 1796 CG LYS A 111 8.794 3.365 4.282 1.00 0.00 C ATOM 1797 CD LYS A 111 8.033 2.163 3.752 1.00 0.00 C ATOM 1798 CE LYS A 111 9.007 1.144 3.197 1.00 0.00 C ATOM 1799 NZ LYS A 111 8.331 -0.085 2.716 1.00 0.00 N ATOM 0 H LYS A 111 8.547 5.259 2.449 1.00 0.00 H new ATOM 0 HA LYS A 111 6.187 4.132 3.519 1.00 0.00 H new ATOM 0 HB2 LYS A 111 8.508 5.330 5.062 1.00 0.00 H new ATOM 0 HB3 LYS A 111 7.357 4.147 5.650 1.00 0.00 H new ATOM 0 HG2 LYS A 111 9.447 3.747 3.498 1.00 0.00 H new ATOM 0 HG3 LYS A 111 9.435 3.047 5.104 1.00 0.00 H new ATOM 0 HD2 LYS A 111 7.440 1.716 4.550 1.00 0.00 H new ATOM 0 HD3 LYS A 111 7.337 2.476 2.974 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.567 1.591 2.376 1.00 0.00 H new ATOM 0 HE3 LYS A 111 9.729 0.879 3.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 9.039 -0.743 2.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 7.831 -0.539 3.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 7.648 0.163 1.972 1.00 0.00 H new ATOM 1813 N GLN A 112 6.610 7.297 4.166 1.00 0.00 N ATOM 1814 CA GLN A 112 5.919 8.504 4.616 1.00 0.00 C ATOM 1815 C GLN A 112 4.689 8.745 3.769 1.00 0.00 C ATOM 1816 O GLN A 112 3.610 9.052 4.273 1.00 0.00 O ATOM 1817 CB GLN A 112 6.805 9.668 4.432 1.00 0.00 C ATOM 1818 CG GLN A 112 8.194 9.610 5.120 1.00 0.00 C ATOM 1819 CD GLN A 112 8.220 9.549 6.673 1.00 0.00 C ATOM 1820 OE1 GLN A 112 9.140 10.094 7.298 1.00 0.00 O ATOM 1821 NE2 GLN A 112 7.319 8.828 7.306 1.00 0.00 N ATOM 0 H GLN A 112 7.537 7.464 3.775 1.00 0.00 H new ATOM 0 HA GLN A 112 5.644 8.374 5.663 1.00 0.00 H new ATOM 0 HB2 GLN A 112 6.962 9.809 3.363 1.00 0.00 H new ATOM 0 HB3 GLN A 112 6.283 10.553 4.797 1.00 0.00 H new ATOM 0 HG2 GLN A 112 8.722 8.736 4.740 1.00 0.00 H new ATOM 0 HG3 GLN A 112 8.762 10.486 4.808 1.00 0.00 H new ATOM 0 HE21 GLN A 112 6.564 8.382 6.784 1.00 0.00 H new ATOM 0 HE22 GLN A 112 7.375 8.715 8.318 1.00 0.00 H new ATOM 1830 N LYS A 113 4.864 8.587 2.469 1.00 0.00 N ATOM 1831 CA LYS A 113 3.799 8.798 1.508 1.00 0.00 C ATOM 1832 C LYS A 113 2.783 7.711 1.688 1.00 0.00 C ATOM 1833 O LYS A 113 1.616 7.880 1.407 1.00 0.00 O ATOM 1834 CB LYS A 113 4.366 8.682 0.112 1.00 0.00 C ATOM 1835 CG LYS A 113 3.722 9.582 -0.945 1.00 0.00 C ATOM 1836 CD LYS A 113 3.925 11.077 -0.643 1.00 0.00 C ATOM 1837 CE LYS A 113 5.410 11.462 -0.518 1.00 0.00 C ATOM 1838 NZ LYS A 113 6.195 11.164 -1.739 1.00 0.00 N ATOM 0 H LYS A 113 5.751 8.308 2.050 1.00 0.00 H new ATOM 0 HA LYS A 113 3.351 9.781 1.654 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.432 8.907 0.153 1.00 0.00 H new ATOM 0 HB3 LYS A 113 4.271 7.646 -0.213 1.00 0.00 H new ATOM 0 HG2 LYS A 113 4.145 9.351 -1.922 1.00 0.00 H new ATOM 0 HG3 LYS A 113 2.655 9.367 -1.001 1.00 0.00 H new ATOM 0 HD2 LYS A 113 3.466 11.669 -1.435 1.00 0.00 H new ATOM 0 HD3 LYS A 113 3.409 11.330 0.283 1.00 0.00 H new ATOM 0 HE2 LYS A 113 5.485 12.527 -0.296 1.00 0.00 H new ATOM 0 HE3 LYS A 113 5.847 10.929 0.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 7.138 11.595 -1.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 6.293 10.134 -1.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 5.705 11.553 -2.570 1.00 0.00 H new ATOM 1852 N PHE A 114 3.264 6.608 2.173 1.00 0.00 N ATOM 1853 CA PHE A 114 2.438 5.393 2.363 1.00 0.00 C ATOM 1854 C PHE A 114 1.393 5.655 3.435 1.00 0.00 C ATOM 1855 O PHE A 114 0.195 5.513 3.189 1.00 0.00 O ATOM 1856 CB PHE A 114 3.348 4.209 2.803 1.00 0.00 C ATOM 1857 CG PHE A 114 2.732 2.815 2.912 1.00 0.00 C ATOM 1858 CD1 PHE A 114 1.496 2.593 3.504 1.00 0.00 C ATOM 1859 CD2 PHE A 114 3.436 1.724 2.450 1.00 0.00 C ATOM 1860 CE1 PHE A 114 0.979 1.323 3.623 1.00 0.00 C ATOM 1861 CE2 PHE A 114 2.921 0.453 2.563 1.00 0.00 C ATOM 1862 CZ PHE A 114 1.690 0.253 3.150 1.00 0.00 C ATOM 0 H PHE A 114 4.237 6.496 2.457 1.00 0.00 H new ATOM 0 HA PHE A 114 1.942 5.140 1.426 1.00 0.00 H new ATOM 0 HB2 PHE A 114 4.178 4.150 2.099 1.00 0.00 H new ATOM 0 HB3 PHE A 114 3.772 4.461 3.775 1.00 0.00 H new ATOM 0 HD1 PHE A 114 0.929 3.433 3.878 1.00 0.00 H new ATOM 0 HD2 PHE A 114 4.404 1.868 1.994 1.00 0.00 H new ATOM 0 HE1 PHE A 114 0.016 1.171 4.088 1.00 0.00 H new ATOM 0 HE2 PHE A 114 3.483 -0.391 2.191 1.00 0.00 H new ATOM 0 HZ PHE A 114 1.287 -0.745 3.237 1.00 0.00 H new ATOM 1872 N GLU A 115 1.844 6.085 4.598 1.00 0.00 N ATOM 1873 CA GLU A 115 0.945 6.366 5.700 1.00 0.00 C ATOM 1874 C GLU A 115 0.087 7.607 5.366 1.00 0.00 C ATOM 1875 O GLU A 115 -1.062 7.718 5.801 1.00 0.00 O ATOM 1876 CB GLU A 115 1.738 6.560 6.993 1.00 0.00 C ATOM 1877 CG GLU A 115 2.670 7.743 6.983 1.00 0.00 C ATOM 1878 CD GLU A 115 3.396 7.911 8.272 1.00 0.00 C ATOM 1879 OE1 GLU A 115 2.746 7.929 9.339 1.00 0.00 O ATOM 1880 OE2 GLU A 115 4.628 8.026 8.254 1.00 0.00 O ATOM 0 H GLU A 115 2.830 6.247 4.804 1.00 0.00 H new ATOM 0 HA GLU A 115 0.274 5.520 5.850 1.00 0.00 H new ATOM 0 HB2 GLU A 115 1.037 6.673 7.820 1.00 0.00 H new ATOM 0 HB3 GLU A 115 2.318 5.658 7.187 1.00 0.00 H new ATOM 0 HG2 GLU A 115 3.393 7.624 6.176 1.00 0.00 H new ATOM 0 HG3 GLU A 115 2.100 8.648 6.770 1.00 0.00 H new ATOM 1887 N GLU A 116 0.671 8.525 4.563 1.00 0.00 N ATOM 1888 CA GLU A 116 -0.004 9.716 4.087 1.00 0.00 C ATOM 1889 C GLU A 116 -1.219 9.313 3.296 1.00 0.00 C ATOM 1890 O GLU A 116 -2.331 9.712 3.606 1.00 0.00 O ATOM 1891 CB GLU A 116 0.906 10.527 3.170 1.00 0.00 C ATOM 1892 CG GLU A 116 0.374 11.905 2.788 1.00 0.00 C ATOM 1893 CD GLU A 116 0.647 12.920 3.865 1.00 0.00 C ATOM 1894 OE1 GLU A 116 1.777 13.465 3.888 1.00 0.00 O ATOM 1895 OE2 GLU A 116 -0.230 13.195 4.709 1.00 0.00 O ATOM 0 H GLU A 116 1.633 8.443 4.234 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.280 10.320 4.951 1.00 0.00 H new ATOM 0 HB2 GLU A 116 1.873 10.650 3.659 1.00 0.00 H new ATOM 0 HB3 GLU A 116 1.080 9.956 2.258 1.00 0.00 H new ATOM 0 HG2 GLU A 116 0.836 12.229 1.856 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -0.699 11.845 2.607 1.00 0.00 H new ATOM 1902 N CYS A 117 -0.990 8.471 2.296 1.00 0.00 N ATOM 1903 CA CYS A 117 -1.972 7.971 1.467 1.00 0.00 C ATOM 1904 C CYS A 117 -3.008 7.222 2.237 1.00 0.00 C ATOM 1905 O CYS A 117 -4.168 7.259 1.876 1.00 0.00 O ATOM 1906 CB CYS A 117 -1.340 7.138 0.434 1.00 0.00 C ATOM 1907 SG CYS A 117 -0.343 8.061 -0.756 1.00 0.00 S ATOM 0 H CYS A 117 -0.057 8.129 2.067 1.00 0.00 H new ATOM 0 HA CYS A 117 -2.495 8.796 0.983 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -0.709 6.394 0.920 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -2.117 6.595 -0.104 1.00 0.00 H new ATOM 0 HG CYS A 117 0.855 8.229 -0.280 1.00 0.00 H new ATOM 1913 N GLN A 118 -2.588 6.540 3.316 1.00 0.00 N ATOM 1914 CA GLN A 118 -3.543 5.815 4.135 1.00 0.00 C ATOM 1915 C GLN A 118 -4.587 6.783 4.623 1.00 0.00 C ATOM 1916 O GLN A 118 -5.755 6.560 4.445 1.00 0.00 O ATOM 1917 CB GLN A 118 -2.872 5.200 5.381 1.00 0.00 C ATOM 1918 CG GLN A 118 -1.907 4.065 5.151 1.00 0.00 C ATOM 1919 CD GLN A 118 -1.255 3.647 6.460 1.00 0.00 C ATOM 1920 OE1 GLN A 118 -1.845 3.780 7.524 1.00 0.00 O ATOM 1921 NE2 GLN A 118 -0.046 3.158 6.402 1.00 0.00 N ATOM 0 H GLN A 118 -1.618 6.482 3.626 1.00 0.00 H new ATOM 0 HA GLN A 118 -3.970 5.018 3.527 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -2.341 5.994 5.906 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -3.658 4.846 6.048 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -2.432 3.217 4.712 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -1.141 4.370 4.437 1.00 0.00 H new ATOM 0 HE21 GLN A 118 0.421 3.059 5.501 1.00 0.00 H new ATOM 0 HE22 GLN A 118 0.431 2.875 7.258 1.00 0.00 H new ATOM 1930 N ARG A 119 -4.137 7.889 5.190 1.00 0.00 N ATOM 1931 CA ARG A 119 -5.043 8.871 5.742 1.00 0.00 C ATOM 1932 C ARG A 119 -5.796 9.640 4.701 1.00 0.00 C ATOM 1933 O ARG A 119 -7.009 9.823 4.748 1.00 0.00 O ATOM 1934 CB ARG A 119 -4.290 9.833 6.624 1.00 0.00 C ATOM 1935 CG ARG A 119 -3.492 9.171 7.720 1.00 0.00 C ATOM 1936 CD ARG A 119 -4.323 8.256 8.596 1.00 0.00 C ATOM 1937 NE ARG A 119 -3.504 7.602 9.631 1.00 0.00 N ATOM 1938 CZ ARG A 119 -3.975 6.791 10.591 1.00 0.00 C ATOM 1939 NH1 ARG A 119 -5.282 6.573 10.702 1.00 0.00 N ATOM 1940 NH2 ARG A 119 -3.135 6.212 11.441 1.00 0.00 N ATOM 0 H ARG A 119 -3.149 8.126 5.278 1.00 0.00 H new ATOM 0 HA ARG A 119 -5.778 8.313 6.322 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -3.615 10.424 6.005 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -4.999 10.527 7.075 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -2.681 8.597 7.273 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -3.033 9.940 8.342 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -5.119 8.830 9.070 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -4.803 7.497 7.978 1.00 0.00 H new ATOM 0 HE ARG A 119 -2.500 7.780 9.617 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -5.931 7.023 10.056 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -5.636 5.956 11.433 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -2.133 6.384 11.364 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -3.492 5.596 12.171 1.00 0.00 H new ATOM 1954 N LEU A 120 -5.048 10.074 3.805 1.00 0.00 N ATOM 1955 CA LEU A 120 -5.444 10.987 2.777 1.00 0.00 C ATOM 1956 C LEU A 120 -6.276 10.456 1.635 1.00 0.00 C ATOM 1957 O LEU A 120 -7.362 10.979 1.427 1.00 0.00 O ATOM 1958 CB LEU A 120 -4.280 11.900 2.316 1.00 0.00 C ATOM 1959 CG LEU A 120 -4.110 13.238 3.056 1.00 0.00 C ATOM 1960 CD1 LEU A 120 -3.790 13.039 4.523 1.00 0.00 C ATOM 1961 CD2 LEU A 120 -3.048 14.093 2.383 1.00 0.00 C ATOM 0 H LEU A 120 -4.067 9.802 3.736 1.00 0.00 H new ATOM 0 HA LEU A 120 -6.179 11.604 3.294 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -3.350 11.339 2.412 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -4.416 12.114 1.256 1.00 0.00 H new ATOM 0 HG LEU A 120 -5.064 13.762 3.002 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -3.678 14.010 5.006 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -4.600 12.487 5.000 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -2.861 12.477 4.620 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -2.944 15.035 2.922 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.096 13.563 2.391 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.342 14.295 1.353 1.00 0.00 H new ATOM 1973 N LEU A 121 -5.880 9.306 1.043 1.00 0.00 N ATOM 1974 CA LEU A 121 -6.453 8.782 -0.263 1.00 0.00 C ATOM 1975 C LEU A 121 -7.939 8.523 -0.143 1.00 0.00 C ATOM 1976 O LEU A 121 -8.697 8.466 -1.115 1.00 0.00 O ATOM 1977 CB LEU A 121 -5.679 7.518 -0.723 1.00 0.00 C ATOM 1978 CG LEU A 121 -6.160 6.777 -1.990 1.00 0.00 C ATOM 1979 CD1 LEU A 121 -6.171 7.687 -3.213 1.00 0.00 C ATOM 1980 CD2 LEU A 121 -5.268 5.574 -2.247 1.00 0.00 C ATOM 0 H LEU A 121 -5.159 8.702 1.438 1.00 0.00 H new ATOM 0 HA LEU A 121 -6.326 9.547 -1.030 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -4.640 7.806 -0.882 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -5.689 6.805 0.101 1.00 0.00 H new ATOM 0 HG LEU A 121 -7.185 6.449 -1.816 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -6.516 7.125 -4.081 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -6.842 8.528 -3.035 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -5.164 8.060 -3.398 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -5.609 5.053 -3.141 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -4.240 5.907 -2.391 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -5.314 4.898 -1.393 1.00 0.00 H new ATOM 1992 N LEU A 122 -8.296 8.370 1.045 1.00 0.00 N ATOM 1993 CA LEU A 122 -9.613 8.128 1.496 1.00 0.00 C ATOM 1994 C LEU A 122 -10.605 9.275 1.286 1.00 0.00 C ATOM 1995 O LEU A 122 -11.739 9.055 0.862 1.00 0.00 O ATOM 1996 CB LEU A 122 -9.428 8.126 2.934 1.00 0.00 C ATOM 1997 CG LEU A 122 -8.669 6.944 3.554 1.00 0.00 C ATOM 1998 CD1 LEU A 122 -8.751 7.011 5.054 1.00 0.00 C ATOM 1999 CD2 LEU A 122 -9.196 5.599 3.055 1.00 0.00 C ATOM 0 H LEU A 122 -7.627 8.411 1.813 1.00 0.00 H new ATOM 0 HA LEU A 122 -10.006 7.250 0.984 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -8.903 9.042 3.206 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -10.413 8.173 3.399 1.00 0.00 H new ATOM 0 HG LEU A 122 -7.627 7.021 3.243 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -8.210 6.169 5.486 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.307 7.944 5.401 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -9.795 6.969 5.364 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -8.630 4.791 3.520 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -10.250 5.501 3.317 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -9.085 5.544 1.972 1.00 0.00 H new ATOM 2011 N ASP A 123 -10.169 10.476 1.565 1.00 0.00 N ATOM 2012 CA ASP A 123 -11.102 11.612 1.678 1.00 0.00 C ATOM 2013 C ASP A 123 -10.932 12.553 0.546 1.00 0.00 C ATOM 2014 O ASP A 123 -11.860 13.238 0.124 1.00 0.00 O ATOM 2015 CB ASP A 123 -10.798 12.366 2.957 1.00 0.00 C ATOM 2016 CG ASP A 123 -11.955 13.194 3.444 1.00 0.00 C ATOM 2017 OD1 ASP A 123 -12.774 12.659 4.245 1.00 0.00 O ATOM 2018 OD2 ASP A 123 -12.071 14.380 3.085 1.00 0.00 O ATOM 0 H ASP A 123 -9.189 10.711 1.720 1.00 0.00 H new ATOM 0 HA ASP A 123 -12.120 11.223 1.674 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -10.517 11.654 3.733 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -9.938 13.015 2.793 1.00 0.00 H new ATOM 2023 N ILE A 124 -9.754 12.550 0.052 1.00 0.00 N ATOM 2024 CA ILE A 124 -9.325 13.402 -0.975 1.00 0.00 C ATOM 2025 C ILE A 124 -9.968 13.032 -2.302 1.00 0.00 C ATOM 2026 O ILE A 124 -10.346 11.869 -2.505 1.00 0.00 O ATOM 2027 CB ILE A 124 -7.768 13.424 -1.044 1.00 0.00 C ATOM 2028 CG1 ILE A 124 -7.143 12.001 -1.203 1.00 0.00 C ATOM 2029 CG2 ILE A 124 -7.213 14.099 0.202 1.00 0.00 C ATOM 2030 CD1 ILE A 124 -7.238 11.394 -2.595 1.00 0.00 C ATOM 0 H ILE A 124 -9.025 11.914 0.376 1.00 0.00 H new ATOM 0 HA ILE A 124 -9.652 14.417 -0.751 1.00 0.00 H new ATOM 0 HB ILE A 124 -7.494 13.988 -1.936 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.092 12.051 -0.919 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -7.632 11.328 -0.498 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.124 14.114 0.153 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -7.588 15.121 0.260 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -7.529 13.546 1.087 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -6.774 10.408 -2.594 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -8.286 11.302 -2.881 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -6.722 12.037 -3.308 1.00 0.00 H new ATOM 2042 N PRO A 125 -10.216 14.023 -3.159 1.00 0.00 N ATOM 2043 CA PRO A 125 -10.768 13.787 -4.484 1.00 0.00 C ATOM 2044 C PRO A 125 -9.927 12.736 -5.205 1.00 0.00 C ATOM 2045 O PRO A 125 -8.683 12.810 -5.241 1.00 0.00 O ATOM 2046 CB PRO A 125 -10.655 15.159 -5.147 1.00 0.00 C ATOM 2047 CG PRO A 125 -10.782 16.101 -4.002 1.00 0.00 C ATOM 2048 CD PRO A 125 -10.033 15.446 -2.880 1.00 0.00 C ATOM 0 HA PRO A 125 -11.790 13.408 -4.489 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -9.703 15.279 -5.664 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -11.441 15.315 -5.886 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -10.359 17.076 -4.244 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -11.827 16.264 -3.738 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -8.980 15.726 -2.879 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -10.438 15.723 -1.907 1.00 0.00 H new ATOM 2056 N LEU A 126 -10.623 11.789 -5.776 1.00 0.00 N ATOM 2057 CA LEU A 126 -10.082 10.531 -6.294 1.00 0.00 C ATOM 2058 C LEU A 126 -9.338 10.704 -7.626 1.00 0.00 C ATOM 2059 O LEU A 126 -9.444 9.833 -8.504 1.00 0.00 O ATOM 2060 CB LEU A 126 -11.268 9.570 -6.506 1.00 0.00 C ATOM 2061 CG LEU A 126 -12.318 9.505 -5.378 1.00 0.00 C ATOM 2062 CD1 LEU A 126 -13.400 8.495 -5.712 1.00 0.00 C ATOM 2063 CD2 LEU A 126 -11.685 9.196 -4.031 1.00 0.00 C ATOM 0 H LEU A 126 -11.632 11.864 -5.905 1.00 0.00 H new ATOM 0 HA LEU A 126 -9.359 10.146 -5.575 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -11.776 9.855 -7.427 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -10.870 8.567 -6.658 1.00 0.00 H new ATOM 0 HG LEU A 126 -12.776 10.491 -5.300 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -14.131 8.464 -4.904 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -13.895 8.785 -6.638 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -12.952 7.509 -5.834 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -12.459 9.159 -3.265 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -11.177 8.233 -4.080 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -10.964 9.974 -3.781 1.00 0.00 H new ATOM 2075 N GLN A 127 -8.517 11.763 -7.727 1.00 0.00 N ATOM 2076 CA GLN A 127 -7.810 12.153 -8.928 1.00 0.00 C ATOM 2077 C GLN A 127 -8.786 12.610 -9.998 1.00 0.00 C ATOM 2078 O GLN A 127 -8.486 12.630 -11.185 1.00 0.00 O ATOM 2079 CB GLN A 127 -6.904 11.046 -9.398 1.00 0.00 C ATOM 2080 CG GLN A 127 -5.633 10.883 -8.577 1.00 0.00 C ATOM 2081 CD GLN A 127 -4.698 12.075 -8.710 1.00 0.00 C ATOM 2082 OE1 GLN A 127 -4.666 12.747 -9.745 1.00 0.00 O ATOM 2083 NE2 GLN A 127 -3.949 12.355 -7.682 1.00 0.00 N ATOM 0 H GLN A 127 -8.330 12.383 -6.939 1.00 0.00 H new ATOM 0 HA GLN A 127 -7.169 13.005 -8.702 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -7.457 10.107 -9.379 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -6.630 11.233 -10.436 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -5.897 10.747 -7.528 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -5.112 9.980 -8.894 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -4.000 11.779 -6.842 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -3.311 13.150 -7.717 1.00 0.00 H new ATOM 2092 N THR A 128 -9.936 12.997 -9.539 1.00 0.00 N ATOM 2093 CA THR A 128 -10.990 13.538 -10.341 1.00 0.00 C ATOM 2094 C THR A 128 -10.623 15.026 -10.580 1.00 0.00 C ATOM 2095 O THR A 128 -9.940 15.607 -9.722 1.00 0.00 O ATOM 2096 CB THR A 128 -12.268 13.416 -9.485 1.00 0.00 C ATOM 2097 OG1 THR A 128 -12.202 12.157 -8.782 1.00 0.00 O ATOM 2098 CG2 THR A 128 -13.524 13.406 -10.334 1.00 0.00 C ATOM 0 H THR A 128 -10.176 12.942 -8.549 1.00 0.00 H new ATOM 0 HA THR A 128 -11.135 13.038 -11.299 1.00 0.00 H new ATOM 0 HB THR A 128 -12.317 14.273 -8.813 1.00 0.00 H new ATOM 0 HG1 THR A 128 -13.002 12.050 -8.226 1.00 0.00 H new ATOM 0 HG21 THR A 128 -14.398 13.319 -9.689 1.00 0.00 H new ATOM 0 HG22 THR A 128 -13.585 14.333 -10.904 1.00 0.00 H new ATOM 0 HG23 THR A 128 -13.493 12.559 -11.020 1.00 0.00 H new ATOM 2106 N PRO A 129 -11.020 15.661 -11.728 1.00 0.00 N ATOM 2107 CA PRO A 129 -10.654 17.051 -12.039 1.00 0.00 C ATOM 2108 C PRO A 129 -10.967 18.007 -10.897 1.00 0.00 C ATOM 2109 O PRO A 129 -12.078 18.018 -10.332 1.00 0.00 O ATOM 2110 CB PRO A 129 -11.494 17.390 -13.268 1.00 0.00 C ATOM 2111 CG PRO A 129 -12.525 16.353 -13.271 1.00 0.00 C ATOM 2112 CD PRO A 129 -11.834 15.115 -12.802 1.00 0.00 C ATOM 0 HA PRO A 129 -9.582 17.152 -12.206 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -11.928 18.387 -13.196 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -10.898 17.367 -14.181 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -13.351 16.617 -12.611 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -12.944 16.217 -14.268 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -12.534 14.357 -12.449 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -11.233 14.653 -13.585 1.00 0.00 H new ATOM 2120 N LYS A 130 -10.001 18.781 -10.580 1.00 0.00 N ATOM 2121 CA LYS A 130 -10.033 19.665 -9.459 1.00 0.00 C ATOM 2122 C LYS A 130 -9.236 20.911 -9.801 1.00 0.00 C ATOM 2123 O LYS A 130 -8.002 20.909 -9.652 1.00 0.00 O ATOM 2124 CB LYS A 130 -9.429 18.947 -8.249 1.00 0.00 C ATOM 2125 CG LYS A 130 -9.469 19.728 -6.945 1.00 0.00 C ATOM 2126 CD LYS A 130 -8.883 18.910 -5.805 1.00 0.00 C ATOM 2127 CE LYS A 130 -7.399 18.617 -6.008 1.00 0.00 C ATOM 2128 NZ LYS A 130 -6.842 17.773 -4.931 1.00 0.00 N ATOM 2129 OXT LYS A 130 -9.830 21.894 -10.266 1.00 0.00 O ATOM 0 H LYS A 130 -9.129 18.825 -11.108 1.00 0.00 H new ATOM 0 HA LYS A 130 -11.056 19.955 -9.220 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -9.957 18.004 -8.105 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -8.391 18.700 -8.474 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -8.910 20.657 -7.056 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -10.498 20.001 -6.711 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -9.020 19.447 -4.867 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -9.428 17.970 -5.717 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -7.257 18.119 -6.967 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -6.848 19.556 -6.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -5.832 17.601 -5.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -6.952 18.258 -4.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -7.349 16.865 -4.904 1.00 0.00 H new TER 2143 LYS A 130