USER MOD reduce.3.24.130724 H: found=0, std=0, add=942, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 944 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 114 THR OG1 : rot -88:sc= 0.531 USER MOD Set 1.2: A 117 GLN :FLIP amide:sc= 0.549 F(o=0.2,f=1.1) USER MOD Set 2.1: A 33 GLN : amide:sc= 0.845 K(o=1.3,f=-0.45) USER MOD Set 2.2: A 35 SER OG : rot 110:sc= 0.577 USER MOD Set 2.3: A 118 MET CE :methyl 166:sc= -0.113 (180deg=-0.626) USER MOD Set 3.1: A 15 ASN : amide:sc= -0.152 X(o=0.52,f=0.35) USER MOD Set 3.2: A 17 THR OG1 : rot 11:sc= 0.673 USER MOD Single : A 7 SER OG : rot 180:sc= 0.0229 USER MOD Single : A 8 LYS NZ :NH3+ -144:sc= 0.381 (180deg=-0.491!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= -0.245 USER MOD Single : A 13 ASN : amide:sc= 0.00716 X(o=0.0072,f=-0.02) USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.776 USER MOD Single : A 23 TYR OH : rot -161:sc= 0.341 USER MOD Single : A 25 TYR OH : rot 180:sc= -0.181 USER MOD Single : A 26 LYS NZ :NH3+ 179:sc= 1.06 (180deg=1.04) USER MOD Single : A 29 LYS NZ :NH3+ 163:sc= -0.0872 (180deg=-0.524) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ -174:sc= 1.28 (180deg=1.14) USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 SER OG : rot 84:sc= 0.527 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 THR OG1 : rot -51:sc= 1.13 USER MOD Single : A 49 LYS NZ :NH3+ -121:sc= 0.345 (180deg=-0.284) USER MOD Single : A 54 LYS NZ :NH3+ -170:sc=-0.00786 (180deg=-0.102) USER MOD Single : A 55 THR OG1 : rot 93:sc= 1.07 USER MOD Single : A 60 SER OG : rot -57:sc= 0.94 USER MOD Single : A 62 LYS NZ :NH3+ -171:sc=-0.00152 (180deg=-0.0834) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -0.244 K(o=-0.24,f=-1.2) USER MOD Single : A 72 LYS NZ :NH3+ -164:sc= -0.0506 (180deg=-0.339) USER MOD Single : A 74 THR OG1 : rot 148:sc= -2.15! USER MOD Single : A 75 TYR OH : rot -140:sc= -1.11 USER MOD Single : A 76 THR OG1 : rot -147:sc= 0.918 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : A 83 ASN : amide:sc= -0.58 K(o=-0.58,f=-3.8!) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 MET CE :methyl 145:sc= 0 (180deg=-1.47) USER MOD Single : A 90 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0644) USER MOD Single : A 94 LYS NZ :NH3+ -144:sc= -1.47! (180deg=-3.84!) USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 MET CE :methyl -159:sc= -0.0593 (180deg=-0.927) USER MOD Single : A 122 MET CE :methyl -172:sc= 0 (180deg=-0.0713) USER MOD Single : A 123 LYS NZ :NH3+ 167:sc= 0.555 (180deg=0.117) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 61 N GLU A 5 13.556 -0.063 13.403 1.00 0.00 N ATOM 62 CA GLU A 5 12.464 -0.071 12.443 1.00 0.00 C ATOM 63 C GLU A 5 12.679 1.034 11.421 1.00 0.00 C ATOM 64 O GLU A 5 12.603 2.223 11.747 1.00 0.00 O ATOM 65 CB GLU A 5 11.130 0.128 13.162 1.00 0.00 C ATOM 66 CG GLU A 5 10.706 -1.068 13.991 1.00 0.00 C ATOM 67 CD GLU A 5 10.012 -2.135 13.170 1.00 0.00 C ATOM 68 OE1 GLU A 5 10.681 -2.793 12.350 1.00 0.00 O ATOM 69 OE2 GLU A 5 8.795 -2.340 13.374 1.00 0.00 O ATOM 0 HA GLU A 5 12.442 -1.033 11.931 1.00 0.00 H new ATOM 0 HB2 GLU A 5 11.202 1.002 13.810 1.00 0.00 H new ATOM 0 HB3 GLU A 5 10.357 0.341 12.424 1.00 0.00 H new ATOM 0 HG2 GLU A 5 11.583 -1.500 14.473 1.00 0.00 H new ATOM 0 HG3 GLU A 5 10.038 -0.735 14.785 1.00 0.00 H new ATOM 76 N GLU A 6 12.975 0.646 10.195 1.00 0.00 N ATOM 77 CA GLU A 6 13.280 1.612 9.155 1.00 0.00 C ATOM 78 C GLU A 6 12.053 1.870 8.290 1.00 0.00 C ATOM 79 O GLU A 6 11.455 0.942 7.746 1.00 0.00 O ATOM 80 CB GLU A 6 14.452 1.115 8.311 1.00 0.00 C ATOM 81 CG GLU A 6 15.653 0.706 9.147 1.00 0.00 C ATOM 82 CD GLU A 6 16.837 0.281 8.308 1.00 0.00 C ATOM 83 OE1 GLU A 6 17.652 1.155 7.946 1.00 0.00 O ATOM 84 OE2 GLU A 6 16.971 -0.926 8.021 1.00 0.00 O ATOM 0 H GLU A 6 13.011 -0.328 9.895 1.00 0.00 H new ATOM 0 HA GLU A 6 13.565 2.556 9.619 1.00 0.00 H new ATOM 0 HB2 GLU A 6 14.127 0.265 7.712 1.00 0.00 H new ATOM 0 HB3 GLU A 6 14.750 1.899 7.615 1.00 0.00 H new ATOM 0 HG2 GLU A 6 15.947 1.540 9.784 1.00 0.00 H new ATOM 0 HG3 GLU A 6 15.368 -0.114 9.806 1.00 0.00 H new ATOM 91 N SER A 7 11.680 3.135 8.176 1.00 0.00 N ATOM 92 CA SER A 7 10.461 3.521 7.489 1.00 0.00 C ATOM 93 C SER A 7 10.735 4.037 6.079 1.00 0.00 C ATOM 94 O SER A 7 11.706 4.759 5.845 1.00 0.00 O ATOM 95 CB SER A 7 9.747 4.595 8.311 1.00 0.00 C ATOM 96 OG SER A 7 10.669 5.576 8.767 1.00 0.00 O ATOM 0 H SER A 7 12.212 3.918 8.556 1.00 0.00 H new ATOM 0 HA SER A 7 9.831 2.637 7.390 1.00 0.00 H new ATOM 0 HB2 SER A 7 8.974 5.069 7.706 1.00 0.00 H new ATOM 0 HB3 SER A 7 9.247 4.135 9.163 1.00 0.00 H new ATOM 0 HG SER A 7 10.193 6.255 9.289 1.00 0.00 H new ATOM 102 N LYS A 8 9.883 3.639 5.143 1.00 0.00 N ATOM 103 CA LYS A 8 9.911 4.174 3.788 1.00 0.00 C ATOM 104 C LYS A 8 8.496 4.480 3.314 1.00 0.00 C ATOM 105 O LYS A 8 7.692 3.574 3.107 1.00 0.00 O ATOM 106 CB LYS A 8 10.572 3.191 2.824 1.00 0.00 C ATOM 107 CG LYS A 8 12.076 3.356 2.679 1.00 0.00 C ATOM 108 CD LYS A 8 12.449 4.762 2.247 1.00 0.00 C ATOM 109 CE LYS A 8 13.859 4.814 1.676 1.00 0.00 C ATOM 110 NZ LYS A 8 13.929 4.201 0.321 1.00 0.00 N ATOM 0 H LYS A 8 9.157 2.940 5.300 1.00 0.00 H new ATOM 0 HA LYS A 8 10.496 5.094 3.802 1.00 0.00 H new ATOM 0 HB2 LYS A 8 10.363 2.176 3.162 1.00 0.00 H new ATOM 0 HB3 LYS A 8 10.112 3.301 1.842 1.00 0.00 H new ATOM 0 HG2 LYS A 8 12.560 3.127 3.628 1.00 0.00 H new ATOM 0 HG3 LYS A 8 12.452 2.639 1.949 1.00 0.00 H new ATOM 0 HD2 LYS A 8 11.739 5.114 1.499 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.375 5.437 3.099 1.00 0.00 H new ATOM 0 HE2 LYS A 8 14.192 5.851 1.624 1.00 0.00 H new ATOM 0 HE3 LYS A 8 14.542 4.293 2.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 14.837 3.705 0.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 13.148 3.524 0.206 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 13.851 4.945 -0.401 1.00 0.00 H new ATOM 124 N LYS A 9 8.194 5.759 3.162 1.00 0.00 N ATOM 125 CA LYS A 9 6.876 6.192 2.721 1.00 0.00 C ATOM 126 C LYS A 9 6.953 6.762 1.313 1.00 0.00 C ATOM 127 O LYS A 9 7.616 7.774 1.083 1.00 0.00 O ATOM 128 CB LYS A 9 6.332 7.260 3.675 1.00 0.00 C ATOM 129 CG LYS A 9 4.935 7.766 3.332 1.00 0.00 C ATOM 130 CD LYS A 9 4.636 9.065 4.065 1.00 0.00 C ATOM 131 CE LYS A 9 3.209 9.538 3.846 1.00 0.00 C ATOM 132 NZ LYS A 9 2.238 8.836 4.726 1.00 0.00 N ATOM 0 H LYS A 9 8.848 6.521 3.339 1.00 0.00 H new ATOM 0 HA LYS A 9 6.208 5.331 2.721 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.318 6.852 4.686 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.019 8.106 3.682 1.00 0.00 H new ATOM 0 HG2 LYS A 9 4.854 7.923 2.256 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.194 7.013 3.601 1.00 0.00 H new ATOM 0 HD2 LYS A 9 4.810 8.925 5.132 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.328 9.837 3.728 1.00 0.00 H new ATOM 0 HE2 LYS A 9 3.152 10.611 4.030 1.00 0.00 H new ATOM 0 HE3 LYS A 9 2.932 9.378 2.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 1.279 9.193 4.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 2.271 7.814 4.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 2.484 9.009 5.722 1.00 0.00 H new ATOM 146 N PHE A 10 6.298 6.112 0.371 1.00 0.00 N ATOM 147 CA PHE A 10 6.186 6.646 -0.973 1.00 0.00 C ATOM 148 C PHE A 10 4.722 6.931 -1.259 1.00 0.00 C ATOM 149 O PHE A 10 3.854 6.460 -0.527 1.00 0.00 O ATOM 150 CB PHE A 10 6.780 5.677 -2.016 1.00 0.00 C ATOM 151 CG PHE A 10 5.864 4.564 -2.464 1.00 0.00 C ATOM 152 CD1 PHE A 10 4.882 4.794 -3.419 1.00 0.00 C ATOM 153 CD2 PHE A 10 5.997 3.288 -1.949 1.00 0.00 C ATOM 154 CE1 PHE A 10 4.055 3.778 -3.844 1.00 0.00 C ATOM 155 CE2 PHE A 10 5.169 2.264 -2.372 1.00 0.00 C ATOM 156 CZ PHE A 10 4.197 2.512 -3.322 1.00 0.00 C ATOM 0 H PHE A 10 5.835 5.214 0.511 1.00 0.00 H new ATOM 0 HA PHE A 10 6.759 7.570 -1.044 1.00 0.00 H new ATOM 0 HB2 PHE A 10 7.079 6.252 -2.892 1.00 0.00 H new ATOM 0 HB3 PHE A 10 7.685 5.234 -1.601 1.00 0.00 H new ATOM 0 HD1 PHE A 10 4.765 5.784 -3.834 1.00 0.00 H new ATOM 0 HD2 PHE A 10 6.756 3.088 -1.208 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.296 3.974 -4.586 1.00 0.00 H new ATOM 0 HE2 PHE A 10 5.282 1.272 -1.960 1.00 0.00 H new ATOM 0 HZ PHE A 10 3.550 1.714 -3.655 1.00 0.00 H new ATOM 166 N SER A 11 4.438 7.694 -2.300 1.00 0.00 N ATOM 167 CA SER A 11 3.063 7.970 -2.670 1.00 0.00 C ATOM 168 C SER A 11 2.970 8.341 -4.141 1.00 0.00 C ATOM 169 O SER A 11 3.572 9.316 -4.591 1.00 0.00 O ATOM 170 CB SER A 11 2.470 9.075 -1.786 1.00 0.00 C ATOM 171 OG SER A 11 1.096 9.290 -2.067 1.00 0.00 O ATOM 0 H SER A 11 5.137 8.131 -2.900 1.00 0.00 H new ATOM 0 HA SER A 11 2.478 7.064 -2.510 1.00 0.00 H new ATOM 0 HB2 SER A 11 2.589 8.805 -0.737 1.00 0.00 H new ATOM 0 HB3 SER A 11 3.023 10.002 -1.941 1.00 0.00 H new ATOM 0 HG SER A 11 0.750 9.999 -1.485 1.00 0.00 H new ATOM 177 N ALA A 12 2.222 7.542 -4.883 1.00 0.00 N ATOM 178 CA ALA A 12 2.005 7.792 -6.293 1.00 0.00 C ATOM 179 C ALA A 12 0.578 8.259 -6.525 1.00 0.00 C ATOM 180 O ALA A 12 -0.377 7.498 -6.354 1.00 0.00 O ATOM 181 CB ALA A 12 2.305 6.541 -7.107 1.00 0.00 C ATOM 0 H ALA A 12 1.753 6.709 -4.527 1.00 0.00 H new ATOM 0 HA ALA A 12 2.684 8.579 -6.621 1.00 0.00 H new ATOM 0 HB1 ALA A 12 2.137 6.746 -8.164 1.00 0.00 H new ATOM 0 HB2 ALA A 12 3.344 6.248 -6.955 1.00 0.00 H new ATOM 0 HB3 ALA A 12 1.649 5.732 -6.786 1.00 0.00 H new ATOM 187 N ASN A 13 0.437 9.523 -6.880 1.00 0.00 N ATOM 188 CA ASN A 13 -0.873 10.105 -7.128 1.00 0.00 C ATOM 189 C ASN A 13 -1.245 9.915 -8.593 1.00 0.00 C ATOM 190 O ASN A 13 -0.938 10.758 -9.436 1.00 0.00 O ATOM 191 CB ASN A 13 -0.872 11.598 -6.778 1.00 0.00 C ATOM 192 CG ASN A 13 -0.325 11.872 -5.389 1.00 0.00 C ATOM 193 OD1 ASN A 13 0.885 12.024 -5.208 1.00 0.00 O ATOM 194 ND2 ASN A 13 -1.200 11.971 -4.404 1.00 0.00 N ATOM 0 H ASN A 13 1.216 10.170 -7.004 1.00 0.00 H new ATOM 0 HA ASN A 13 -1.608 9.603 -6.498 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -0.275 12.139 -7.513 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.889 11.984 -6.847 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -0.881 12.179 -3.458 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -2.194 11.839 -4.590 1.00 0.00 H new ATOM 201 N LEU A 14 -1.882 8.795 -8.898 1.00 0.00 N ATOM 202 CA LEU A 14 -2.189 8.449 -10.277 1.00 0.00 C ATOM 203 C LEU A 14 -3.625 7.965 -10.412 1.00 0.00 C ATOM 204 O LEU A 14 -4.178 7.397 -9.473 1.00 0.00 O ATOM 205 CB LEU A 14 -1.197 7.387 -10.789 1.00 0.00 C ATOM 206 CG LEU A 14 -0.977 6.166 -9.880 1.00 0.00 C ATOM 207 CD1 LEU A 14 -2.096 5.146 -10.031 1.00 0.00 C ATOM 208 CD2 LEU A 14 0.369 5.523 -10.175 1.00 0.00 C ATOM 0 H LEU A 14 -2.196 8.111 -8.210 1.00 0.00 H new ATOM 0 HA LEU A 14 -2.085 9.344 -10.890 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.545 7.033 -11.759 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.233 7.870 -10.953 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.985 6.515 -8.848 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -1.906 4.298 -9.374 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -3.047 5.607 -9.763 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -2.138 4.802 -11.064 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.511 4.660 -9.524 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.398 5.201 -11.216 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.165 6.246 -9.997 1.00 0.00 H new ATOM 220 N ASN A 15 -4.237 8.253 -11.564 1.00 0.00 N ATOM 221 CA ASN A 15 -5.576 7.745 -11.909 1.00 0.00 C ATOM 222 C ASN A 15 -6.682 8.412 -11.079 1.00 0.00 C ATOM 223 O ASN A 15 -7.860 8.347 -11.431 1.00 0.00 O ATOM 224 CB ASN A 15 -5.612 6.211 -11.746 1.00 0.00 C ATOM 225 CG ASN A 15 -7.004 5.615 -11.873 1.00 0.00 C ATOM 226 OD1 ASN A 15 -7.473 5.329 -12.974 1.00 0.00 O ATOM 227 ND2 ASN A 15 -7.654 5.390 -10.742 1.00 0.00 N ATOM 0 H ASN A 15 -3.823 8.843 -12.285 1.00 0.00 H new ATOM 0 HA ASN A 15 -5.772 7.999 -12.951 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -4.963 5.760 -12.497 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.202 5.949 -10.771 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -8.581 4.964 -10.762 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -7.228 5.643 -9.850 1.00 0.00 H new ATOM 234 N GLY A 16 -6.294 9.093 -10.014 1.00 0.00 N ATOM 235 CA GLY A 16 -7.258 9.617 -9.070 1.00 0.00 C ATOM 236 C GLY A 16 -7.178 8.863 -7.763 1.00 0.00 C ATOM 237 O GLY A 16 -7.995 9.049 -6.861 1.00 0.00 O ATOM 0 H GLY A 16 -5.321 9.294 -9.785 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -7.069 10.677 -8.898 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -8.263 9.535 -9.484 1.00 0.00 H new ATOM 241 N THR A 17 -6.192 7.990 -7.677 1.00 0.00 N ATOM 242 CA THR A 17 -5.944 7.232 -6.474 1.00 0.00 C ATOM 243 C THR A 17 -4.587 7.594 -5.884 1.00 0.00 C ATOM 244 O THR A 17 -3.558 7.477 -6.552 1.00 0.00 O ATOM 245 CB THR A 17 -6.001 5.719 -6.755 1.00 0.00 C ATOM 246 OG1 THR A 17 -5.339 5.422 -7.993 1.00 0.00 O ATOM 247 CG2 THR A 17 -7.438 5.228 -6.818 1.00 0.00 C ATOM 0 H THR A 17 -5.544 7.790 -8.439 1.00 0.00 H new ATOM 0 HA THR A 17 -6.724 7.483 -5.755 1.00 0.00 H new ATOM 0 HB THR A 17 -5.494 5.206 -5.937 1.00 0.00 H new ATOM 0 HG1 THR A 17 -4.852 6.214 -8.302 1.00 0.00 H new ATOM 0 HG21 THR A 17 -7.448 4.156 -7.018 1.00 0.00 H new ATOM 0 HG22 THR A 17 -7.932 5.424 -5.866 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.966 5.751 -7.615 1.00 0.00 H new ATOM 255 N GLU A 18 -4.590 8.064 -4.645 1.00 0.00 N ATOM 256 CA GLU A 18 -3.350 8.392 -3.960 1.00 0.00 C ATOM 257 C GLU A 18 -2.824 7.161 -3.249 1.00 0.00 C ATOM 258 O GLU A 18 -3.292 6.814 -2.165 1.00 0.00 O ATOM 259 CB GLU A 18 -3.547 9.515 -2.939 1.00 0.00 C ATOM 260 CG GLU A 18 -4.403 10.664 -3.432 1.00 0.00 C ATOM 261 CD GLU A 18 -4.176 11.933 -2.632 1.00 0.00 C ATOM 262 OE1 GLU A 18 -4.386 11.917 -1.402 1.00 0.00 O ATOM 263 OE2 GLU A 18 -3.764 12.948 -3.227 1.00 0.00 O ATOM 0 H GLU A 18 -5.434 8.226 -4.096 1.00 0.00 H new ATOM 0 HA GLU A 18 -2.636 8.734 -4.709 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.002 9.098 -2.041 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -2.570 9.903 -2.650 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.182 10.854 -4.482 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -5.454 10.383 -3.373 1.00 0.00 H new ATOM 270 N ILE A 19 -1.878 6.482 -3.868 1.00 0.00 N ATOM 271 CA ILE A 19 -1.305 5.293 -3.274 1.00 0.00 C ATOM 272 C ILE A 19 -0.070 5.653 -2.466 1.00 0.00 C ATOM 273 O ILE A 19 1.032 5.762 -3.005 1.00 0.00 O ATOM 274 CB ILE A 19 -0.948 4.236 -4.340 1.00 0.00 C ATOM 275 CG1 ILE A 19 -2.194 3.886 -5.156 1.00 0.00 C ATOM 276 CG2 ILE A 19 -0.367 2.988 -3.684 1.00 0.00 C ATOM 277 CD1 ILE A 19 -1.950 2.857 -6.235 1.00 0.00 C ATOM 0 H ILE A 19 -1.492 6.733 -4.778 1.00 0.00 H new ATOM 0 HA ILE A 19 -2.057 4.860 -2.614 1.00 0.00 H new ATOM 0 HB ILE A 19 -0.192 4.648 -5.008 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.966 3.515 -4.481 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.583 4.795 -5.616 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.121 2.254 -4.452 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.536 3.253 -3.133 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -1.099 2.563 -2.997 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -2.880 2.662 -6.769 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -1.202 3.233 -6.934 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -1.591 1.933 -5.782 1.00 0.00 H new ATOM 289 N ALA A 20 -0.273 5.891 -1.180 1.00 0.00 N ATOM 290 CA ALA A 20 0.828 6.155 -0.276 1.00 0.00 C ATOM 291 C ALA A 20 1.102 4.922 0.562 1.00 0.00 C ATOM 292 O ALA A 20 0.263 4.483 1.348 1.00 0.00 O ATOM 293 CB ALA A 20 0.546 7.361 0.607 1.00 0.00 C ATOM 0 H ALA A 20 -1.193 5.906 -0.741 1.00 0.00 H new ATOM 0 HA ALA A 20 1.714 6.390 -0.866 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.392 7.530 1.273 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.393 8.241 -0.017 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -0.350 7.177 1.199 1.00 0.00 H new ATOM 299 N ILE A 21 2.281 4.365 0.371 1.00 0.00 N ATOM 300 CA ILE A 21 2.673 3.146 1.043 1.00 0.00 C ATOM 301 C ILE A 21 3.886 3.397 1.922 1.00 0.00 C ATOM 302 O ILE A 21 4.898 3.929 1.467 1.00 0.00 O ATOM 303 CB ILE A 21 2.993 2.025 0.033 1.00 0.00 C ATOM 304 CG1 ILE A 21 1.729 1.604 -0.719 1.00 0.00 C ATOM 305 CG2 ILE A 21 3.624 0.834 0.733 1.00 0.00 C ATOM 306 CD1 ILE A 21 1.945 0.454 -1.683 1.00 0.00 C ATOM 0 H ILE A 21 2.992 4.745 -0.254 1.00 0.00 H new ATOM 0 HA ILE A 21 1.834 2.825 1.660 1.00 0.00 H new ATOM 0 HB ILE A 21 3.710 2.411 -0.691 1.00 0.00 H new ATOM 0 HG12 ILE A 21 0.964 1.321 0.004 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.343 2.461 -1.271 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.841 0.055 0.002 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.549 1.145 1.218 1.00 0.00 H new ATOM 0 HG23 ILE A 21 2.935 0.445 1.483 1.00 0.00 H new ATOM 0 HD11 ILE A 21 1.004 0.213 -2.178 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.686 0.740 -2.430 1.00 0.00 H new ATOM 0 HD13 ILE A 21 2.301 -0.418 -1.135 1.00 0.00 H new ATOM 318 N THR A 22 3.765 3.034 3.183 1.00 0.00 N ATOM 319 CA THR A 22 4.861 3.137 4.121 1.00 0.00 C ATOM 320 C THR A 22 5.264 1.747 4.594 1.00 0.00 C ATOM 321 O THR A 22 4.636 1.181 5.488 1.00 0.00 O ATOM 322 CB THR A 22 4.471 4.003 5.330 1.00 0.00 C ATOM 323 OG1 THR A 22 3.784 5.173 4.870 1.00 0.00 O ATOM 324 CG2 THR A 22 5.700 4.419 6.126 1.00 0.00 C ATOM 0 H THR A 22 2.905 2.660 3.584 1.00 0.00 H new ATOM 0 HA THR A 22 5.702 3.611 3.616 1.00 0.00 H new ATOM 0 HB THR A 22 3.823 3.416 5.981 1.00 0.00 H new ATOM 0 HG1 THR A 22 3.532 5.727 5.638 1.00 0.00 H new ATOM 0 HG21 THR A 22 5.394 5.030 6.975 1.00 0.00 H new ATOM 0 HG22 THR A 22 6.218 3.530 6.487 1.00 0.00 H new ATOM 0 HG23 THR A 22 6.370 4.995 5.487 1.00 0.00 H new ATOM 332 N TYR A 23 6.284 1.185 3.967 1.00 0.00 N ATOM 333 CA TYR A 23 6.761 -0.134 4.344 1.00 0.00 C ATOM 334 C TYR A 23 7.876 -0.027 5.371 1.00 0.00 C ATOM 335 O TYR A 23 8.818 0.753 5.214 1.00 0.00 O ATOM 336 CB TYR A 23 7.199 -0.954 3.115 1.00 0.00 C ATOM 337 CG TYR A 23 8.078 -0.219 2.121 1.00 0.00 C ATOM 338 CD1 TYR A 23 7.521 0.569 1.120 1.00 0.00 C ATOM 339 CD2 TYR A 23 9.461 -0.326 2.178 1.00 0.00 C ATOM 340 CE1 TYR A 23 8.319 1.235 0.207 1.00 0.00 C ATOM 341 CE2 TYR A 23 10.267 0.337 1.270 1.00 0.00 C ATOM 342 CZ TYR A 23 9.692 1.118 0.286 1.00 0.00 C ATOM 343 OH TYR A 23 10.490 1.792 -0.613 1.00 0.00 O ATOM 0 H TYR A 23 6.795 1.619 3.199 1.00 0.00 H new ATOM 0 HA TYR A 23 5.931 -0.671 4.803 1.00 0.00 H new ATOM 0 HB2 TYR A 23 7.733 -1.839 3.462 1.00 0.00 H new ATOM 0 HB3 TYR A 23 6.307 -1.303 2.596 1.00 0.00 H new ATOM 0 HD1 TYR A 23 6.447 0.663 1.054 1.00 0.00 H new ATOM 0 HD2 TYR A 23 9.915 -0.937 2.944 1.00 0.00 H new ATOM 0 HE1 TYR A 23 7.870 1.844 -0.564 1.00 0.00 H new ATOM 0 HE2 TYR A 23 11.341 0.244 1.330 1.00 0.00 H new ATOM 0 HH TYR A 23 11.383 1.389 -0.624 1.00 0.00 H new ATOM 353 N VAL A 24 7.733 -0.790 6.442 1.00 0.00 N ATOM 354 CA VAL A 24 8.706 -0.801 7.514 1.00 0.00 C ATOM 355 C VAL A 24 9.567 -2.047 7.413 1.00 0.00 C ATOM 356 O VAL A 24 9.058 -3.171 7.332 1.00 0.00 O ATOM 357 CB VAL A 24 8.031 -0.739 8.901 1.00 0.00 C ATOM 358 CG1 VAL A 24 9.067 -0.836 10.009 1.00 0.00 C ATOM 359 CG2 VAL A 24 7.229 0.544 9.043 1.00 0.00 C ATOM 0 H VAL A 24 6.941 -1.416 6.590 1.00 0.00 H new ATOM 0 HA VAL A 24 9.329 0.087 7.409 1.00 0.00 H new ATOM 0 HB VAL A 24 7.353 -1.588 8.988 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.569 -0.790 10.978 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.606 -1.780 9.922 1.00 0.00 H new ATOM 0 HG13 VAL A 24 9.770 -0.008 9.923 1.00 0.00 H new ATOM 0 HG21 VAL A 24 6.759 0.573 10.026 1.00 0.00 H new ATOM 0 HG22 VAL A 24 7.892 1.402 8.933 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.459 0.579 8.272 1.00 0.00 H new ATOM 369 N TYR A 25 10.864 -1.842 7.397 1.00 0.00 N ATOM 370 CA TYR A 25 11.798 -2.924 7.200 1.00 0.00 C ATOM 371 C TYR A 25 12.920 -2.859 8.220 1.00 0.00 C ATOM 372 O TYR A 25 13.205 -1.803 8.783 1.00 0.00 O ATOM 373 CB TYR A 25 12.369 -2.871 5.777 1.00 0.00 C ATOM 374 CG TYR A 25 12.979 -1.531 5.415 1.00 0.00 C ATOM 375 CD1 TYR A 25 12.187 -0.496 4.933 1.00 0.00 C ATOM 376 CD2 TYR A 25 14.340 -1.296 5.564 1.00 0.00 C ATOM 377 CE1 TYR A 25 12.730 0.730 4.617 1.00 0.00 C ATOM 378 CE2 TYR A 25 14.892 -0.070 5.245 1.00 0.00 C ATOM 379 CZ TYR A 25 14.083 0.940 4.773 1.00 0.00 C ATOM 380 OH TYR A 25 14.625 2.167 4.463 1.00 0.00 O ATOM 0 H TYR A 25 11.298 -0.927 7.519 1.00 0.00 H new ATOM 0 HA TYR A 25 11.269 -3.867 7.336 1.00 0.00 H new ATOM 0 HB2 TYR A 25 13.128 -3.646 5.670 1.00 0.00 H new ATOM 0 HB3 TYR A 25 11.575 -3.102 5.067 1.00 0.00 H new ATOM 0 HD1 TYR A 25 11.127 -0.656 4.804 1.00 0.00 H new ATOM 0 HD2 TYR A 25 14.977 -2.085 5.935 1.00 0.00 H new ATOM 0 HE1 TYR A 25 12.097 1.524 4.248 1.00 0.00 H new ATOM 0 HE2 TYR A 25 15.952 0.095 5.365 1.00 0.00 H new ATOM 0 HH TYR A 25 15.591 2.150 4.630 1.00 0.00 H new ATOM 390 N LYS A 26 13.531 -3.998 8.463 1.00 0.00 N ATOM 391 CA LYS A 26 14.730 -4.067 9.276 1.00 0.00 C ATOM 392 C LYS A 26 15.874 -4.600 8.423 1.00 0.00 C ATOM 393 O LYS A 26 15.974 -5.806 8.186 1.00 0.00 O ATOM 394 CB LYS A 26 14.527 -4.970 10.501 1.00 0.00 C ATOM 395 CG LYS A 26 13.672 -4.375 11.610 1.00 0.00 C ATOM 396 CD LYS A 26 13.771 -5.229 12.865 1.00 0.00 C ATOM 397 CE LYS A 26 13.010 -4.631 14.033 1.00 0.00 C ATOM 398 NZ LYS A 26 11.541 -4.733 13.855 1.00 0.00 N ATOM 0 H LYS A 26 13.214 -4.899 8.106 1.00 0.00 H new ATOM 0 HA LYS A 26 14.964 -3.066 9.639 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.070 -5.903 10.173 1.00 0.00 H new ATOM 0 HB3 LYS A 26 15.504 -5.222 10.913 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.000 -3.358 11.826 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.634 -4.312 11.285 1.00 0.00 H new ATOM 0 HD2 LYS A 26 13.383 -6.226 12.654 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.819 -5.346 13.140 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.299 -5.141 14.952 1.00 0.00 H new ATOM 0 HE3 LYS A 26 13.289 -3.584 14.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.062 -4.327 14.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 11.258 -4.211 13.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.272 -5.733 13.754 1.00 0.00 H new ATOM 412 N GLY A 27 16.708 -3.700 7.925 1.00 0.00 N ATOM 413 CA GLY A 27 17.783 -4.106 7.047 1.00 0.00 C ATOM 414 C GLY A 27 17.271 -4.436 5.661 1.00 0.00 C ATOM 415 O GLY A 27 16.742 -3.569 4.967 1.00 0.00 O ATOM 0 H GLY A 27 16.659 -2.699 8.113 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.523 -3.308 6.983 1.00 0.00 H new ATOM 0 HA3 GLY A 27 18.288 -4.976 7.466 1.00 0.00 H new ATOM 419 N ASP A 28 17.416 -5.695 5.261 1.00 0.00 N ATOM 420 CA ASP A 28 16.912 -6.150 3.969 1.00 0.00 C ATOM 421 C ASP A 28 15.576 -6.865 4.150 1.00 0.00 C ATOM 422 O ASP A 28 14.934 -7.283 3.186 1.00 0.00 O ATOM 423 CB ASP A 28 17.931 -7.080 3.286 1.00 0.00 C ATOM 424 CG ASP A 28 17.534 -7.470 1.867 1.00 0.00 C ATOM 425 OD1 ASP A 28 17.582 -6.605 0.968 1.00 0.00 O ATOM 426 OD2 ASP A 28 17.193 -8.654 1.641 1.00 0.00 O ATOM 0 H ASP A 28 17.878 -6.418 5.812 1.00 0.00 H new ATOM 0 HA ASP A 28 16.761 -5.281 3.329 1.00 0.00 H new ATOM 0 HB2 ASP A 28 18.903 -6.587 3.262 1.00 0.00 H new ATOM 0 HB3 ASP A 28 18.047 -7.983 3.885 1.00 0.00 H new ATOM 431 N LYS A 29 15.139 -6.987 5.398 1.00 0.00 N ATOM 432 CA LYS A 29 13.907 -7.693 5.695 1.00 0.00 C ATOM 433 C LYS A 29 12.754 -6.713 5.871 1.00 0.00 C ATOM 434 O LYS A 29 12.640 -6.067 6.910 1.00 0.00 O ATOM 435 CB LYS A 29 14.054 -8.534 6.966 1.00 0.00 C ATOM 436 CG LYS A 29 13.132 -9.739 6.999 1.00 0.00 C ATOM 437 CD LYS A 29 13.386 -10.604 8.222 1.00 0.00 C ATOM 438 CE LYS A 29 12.560 -11.882 8.184 1.00 0.00 C ATOM 439 NZ LYS A 29 12.825 -12.675 6.955 1.00 0.00 N ATOM 0 H LYS A 29 15.619 -6.607 6.214 1.00 0.00 H new ATOM 0 HA LYS A 29 13.693 -8.352 4.854 1.00 0.00 H new ATOM 0 HB2 LYS A 29 15.086 -8.873 7.052 1.00 0.00 H new ATOM 0 HB3 LYS A 29 13.851 -7.906 7.834 1.00 0.00 H new ATOM 0 HG2 LYS A 29 12.095 -9.404 6.998 1.00 0.00 H new ATOM 0 HG3 LYS A 29 13.276 -10.333 6.096 1.00 0.00 H new ATOM 0 HD2 LYS A 29 14.445 -10.856 8.277 1.00 0.00 H new ATOM 0 HD3 LYS A 29 13.145 -10.041 9.124 1.00 0.00 H new ATOM 0 HE2 LYS A 29 12.786 -12.487 9.062 1.00 0.00 H new ATOM 0 HE3 LYS A 29 11.500 -11.631 8.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 12.482 -13.648 7.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 12.331 -12.242 6.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 13.848 -12.691 6.766 1.00 0.00 H new ATOM 453 N VAL A 30 11.918 -6.587 4.852 1.00 0.00 N ATOM 454 CA VAL A 30 10.710 -5.783 4.975 1.00 0.00 C ATOM 455 C VAL A 30 9.666 -6.591 5.736 1.00 0.00 C ATOM 456 O VAL A 30 9.229 -7.641 5.273 1.00 0.00 O ATOM 457 CB VAL A 30 10.146 -5.356 3.603 1.00 0.00 C ATOM 458 CG1 VAL A 30 9.053 -4.312 3.773 1.00 0.00 C ATOM 459 CG2 VAL A 30 11.255 -4.822 2.707 1.00 0.00 C ATOM 0 H VAL A 30 12.050 -7.025 3.940 1.00 0.00 H new ATOM 0 HA VAL A 30 10.961 -4.869 5.513 1.00 0.00 H new ATOM 0 HB VAL A 30 9.712 -6.235 3.127 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.669 -4.025 2.794 1.00 0.00 H new ATOM 0 HG12 VAL A 30 8.243 -4.727 4.373 1.00 0.00 H new ATOM 0 HG13 VAL A 30 9.462 -3.435 4.274 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.835 -4.527 1.745 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.721 -3.958 3.180 1.00 0.00 H new ATOM 0 HG23 VAL A 30 12.004 -5.599 2.553 1.00 0.00 H new ATOM 469 N LEU A 31 9.289 -6.109 6.907 1.00 0.00 N ATOM 470 CA LEU A 31 8.497 -6.905 7.835 1.00 0.00 C ATOM 471 C LEU A 31 7.008 -6.619 7.704 1.00 0.00 C ATOM 472 O LEU A 31 6.182 -7.508 7.903 1.00 0.00 O ATOM 473 CB LEU A 31 8.989 -6.659 9.261 1.00 0.00 C ATOM 474 CG LEU A 31 10.462 -7.013 9.472 1.00 0.00 C ATOM 475 CD1 LEU A 31 10.925 -6.625 10.860 1.00 0.00 C ATOM 476 CD2 LEU A 31 10.696 -8.494 9.237 1.00 0.00 C ATOM 0 H LEU A 31 9.517 -5.172 7.240 1.00 0.00 H new ATOM 0 HA LEU A 31 8.630 -7.958 7.588 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.837 -5.609 9.513 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.381 -7.244 9.952 1.00 0.00 H new ATOM 0 HG LEU A 31 11.046 -6.446 8.747 1.00 0.00 H new ATOM 0 HD11 LEU A 31 11.976 -6.889 10.980 1.00 0.00 H new ATOM 0 HD12 LEU A 31 10.803 -5.551 10.997 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.330 -7.156 11.604 1.00 0.00 H new ATOM 0 HD21 LEU A 31 11.750 -8.725 9.392 1.00 0.00 H new ATOM 0 HD22 LEU A 31 10.091 -9.073 9.935 1.00 0.00 H new ATOM 0 HD23 LEU A 31 10.415 -8.749 8.215 1.00 0.00 H new ATOM 488 N LYS A 32 6.661 -5.390 7.355 1.00 0.00 N ATOM 489 CA LYS A 32 5.266 -5.040 7.131 1.00 0.00 C ATOM 490 C LYS A 32 5.146 -3.771 6.305 1.00 0.00 C ATOM 491 O LYS A 32 6.108 -3.021 6.157 1.00 0.00 O ATOM 492 CB LYS A 32 4.504 -4.909 8.455 1.00 0.00 C ATOM 493 CG LYS A 32 5.180 -4.029 9.493 1.00 0.00 C ATOM 494 CD LYS A 32 4.391 -4.029 10.792 1.00 0.00 C ATOM 495 CE LYS A 32 4.282 -5.435 11.356 1.00 0.00 C ATOM 496 NZ LYS A 32 3.276 -5.534 12.443 1.00 0.00 N ATOM 0 H LYS A 32 7.320 -4.623 7.221 1.00 0.00 H new ATOM 0 HA LYS A 32 4.809 -5.852 6.566 1.00 0.00 H new ATOM 0 HB2 LYS A 32 3.512 -4.508 8.249 1.00 0.00 H new ATOM 0 HB3 LYS A 32 4.364 -5.904 8.878 1.00 0.00 H new ATOM 0 HG2 LYS A 32 6.193 -4.387 9.677 1.00 0.00 H new ATOM 0 HG3 LYS A 32 5.266 -3.011 9.114 1.00 0.00 H new ATOM 0 HD2 LYS A 32 4.877 -3.378 11.518 1.00 0.00 H new ATOM 0 HD3 LYS A 32 3.394 -3.624 10.617 1.00 0.00 H new ATOM 0 HE2 LYS A 32 4.016 -6.125 10.555 1.00 0.00 H new ATOM 0 HE3 LYS A 32 5.255 -5.747 11.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 3.239 -6.512 12.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 3.541 -4.897 13.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 2.341 -5.263 12.077 1.00 0.00 H new ATOM 510 N GLN A 33 3.958 -3.541 5.770 1.00 0.00 N ATOM 511 CA GLN A 33 3.749 -2.474 4.813 1.00 0.00 C ATOM 512 C GLN A 33 2.373 -1.834 4.990 1.00 0.00 C ATOM 513 O GLN A 33 1.346 -2.465 4.730 1.00 0.00 O ATOM 514 CB GLN A 33 3.878 -3.045 3.403 1.00 0.00 C ATOM 515 CG GLN A 33 3.932 -1.998 2.315 1.00 0.00 C ATOM 516 CD GLN A 33 4.032 -2.611 0.934 1.00 0.00 C ATOM 517 OE1 GLN A 33 5.122 -2.895 0.451 1.00 0.00 O ATOM 518 NE2 GLN A 33 2.896 -2.797 0.280 1.00 0.00 N ATOM 0 H GLN A 33 3.122 -4.084 5.986 1.00 0.00 H new ATOM 0 HA GLN A 33 4.500 -1.701 4.977 1.00 0.00 H new ATOM 0 HB2 GLN A 33 4.780 -3.654 3.351 1.00 0.00 H new ATOM 0 HB3 GLN A 33 3.034 -3.708 3.213 1.00 0.00 H new ATOM 0 HG2 GLN A 33 3.040 -1.374 2.370 1.00 0.00 H new ATOM 0 HG3 GLN A 33 4.789 -1.345 2.484 1.00 0.00 H new ATOM 0 HE21 GLN A 33 2.009 -2.547 0.717 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.908 -3.190 -0.661 1.00 0.00 H new ATOM 527 N SER A 34 2.358 -0.586 5.432 1.00 0.00 N ATOM 528 CA SER A 34 1.117 0.164 5.553 1.00 0.00 C ATOM 529 C SER A 34 0.783 0.821 4.213 1.00 0.00 C ATOM 530 O SER A 34 1.355 1.845 3.848 1.00 0.00 O ATOM 531 CB SER A 34 1.241 1.219 6.658 1.00 0.00 C ATOM 532 OG SER A 34 1.632 0.625 7.888 1.00 0.00 O ATOM 0 H SER A 34 3.192 -0.071 5.713 1.00 0.00 H new ATOM 0 HA SER A 34 0.309 -0.516 5.822 1.00 0.00 H new ATOM 0 HB2 SER A 34 1.972 1.973 6.366 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.288 1.732 6.785 1.00 0.00 H new ATOM 0 HG SER A 34 1.706 1.318 8.577 1.00 0.00 H new ATOM 538 N SER A 35 -0.127 0.208 3.471 1.00 0.00 N ATOM 539 CA SER A 35 -0.450 0.655 2.125 1.00 0.00 C ATOM 540 C SER A 35 -1.850 1.256 2.079 1.00 0.00 C ATOM 541 O SER A 35 -2.838 0.533 2.115 1.00 0.00 O ATOM 542 CB SER A 35 -0.366 -0.536 1.173 1.00 0.00 C ATOM 543 OG SER A 35 0.785 -1.314 1.459 1.00 0.00 O ATOM 0 H SER A 35 -0.658 -0.606 3.781 1.00 0.00 H new ATOM 0 HA SER A 35 0.262 1.424 1.824 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.261 -1.150 1.268 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.329 -0.184 0.142 1.00 0.00 H new ATOM 0 HG SER A 35 0.512 -2.170 1.850 1.00 0.00 H new ATOM 549 N GLU A 36 -1.940 2.572 2.011 1.00 0.00 N ATOM 550 CA GLU A 36 -3.239 3.226 1.990 1.00 0.00 C ATOM 551 C GLU A 36 -3.518 3.838 0.624 1.00 0.00 C ATOM 552 O GLU A 36 -2.910 4.842 0.238 1.00 0.00 O ATOM 553 CB GLU A 36 -3.316 4.297 3.075 1.00 0.00 C ATOM 554 CG GLU A 36 -4.656 5.015 3.129 1.00 0.00 C ATOM 555 CD GLU A 36 -4.655 6.188 4.086 1.00 0.00 C ATOM 556 OE1 GLU A 36 -4.724 5.964 5.312 1.00 0.00 O ATOM 557 OE2 GLU A 36 -4.590 7.344 3.611 1.00 0.00 O ATOM 0 H GLU A 36 -1.140 3.204 1.970 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.000 2.471 2.188 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -3.121 3.836 4.043 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.527 5.030 2.907 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -4.915 5.367 2.130 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -5.430 4.308 3.429 1.00 0.00 H new ATOM 564 N THR A 37 -4.433 3.224 -0.107 1.00 0.00 N ATOM 565 CA THR A 37 -4.842 3.735 -1.401 1.00 0.00 C ATOM 566 C THR A 37 -6.059 4.644 -1.244 1.00 0.00 C ATOM 567 O THR A 37 -7.127 4.206 -0.818 1.00 0.00 O ATOM 568 CB THR A 37 -5.163 2.585 -2.375 1.00 0.00 C ATOM 569 OG1 THR A 37 -4.029 1.718 -2.496 1.00 0.00 O ATOM 570 CG2 THR A 37 -5.553 3.115 -3.747 1.00 0.00 C ATOM 0 H THR A 37 -4.908 2.367 0.177 1.00 0.00 H new ATOM 0 HA THR A 37 -4.015 4.311 -1.816 1.00 0.00 H new ATOM 0 HB THR A 37 -6.009 2.028 -1.972 1.00 0.00 H new ATOM 0 HG1 THR A 37 -4.240 0.988 -3.115 1.00 0.00 H new ATOM 0 HG21 THR A 37 -5.773 2.279 -4.411 1.00 0.00 H new ATOM 0 HG22 THR A 37 -6.436 3.748 -3.655 1.00 0.00 H new ATOM 0 HG23 THR A 37 -4.730 3.698 -4.159 1.00 0.00 H new ATOM 578 N LYS A 38 -5.880 5.916 -1.558 1.00 0.00 N ATOM 579 CA LYS A 38 -6.940 6.898 -1.404 1.00 0.00 C ATOM 580 C LYS A 38 -7.666 7.122 -2.723 1.00 0.00 C ATOM 581 O LYS A 38 -7.110 7.700 -3.655 1.00 0.00 O ATOM 582 CB LYS A 38 -6.351 8.209 -0.899 1.00 0.00 C ATOM 583 CG LYS A 38 -7.390 9.234 -0.490 1.00 0.00 C ATOM 584 CD LYS A 38 -6.732 10.540 -0.086 1.00 0.00 C ATOM 585 CE LYS A 38 -5.752 10.346 1.060 1.00 0.00 C ATOM 586 NZ LYS A 38 -4.880 11.534 1.242 1.00 0.00 N ATOM 0 H LYS A 38 -5.006 6.294 -1.923 1.00 0.00 H new ATOM 0 HA LYS A 38 -7.663 6.523 -0.679 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -5.705 8.001 -0.046 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -5.721 8.637 -1.679 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -8.079 9.409 -1.317 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -7.981 8.848 0.341 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -6.210 10.965 -0.943 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -7.498 11.258 0.208 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -6.302 10.154 1.981 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -5.136 9.468 0.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -4.159 11.328 1.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -4.414 11.764 0.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -5.456 12.343 1.550 1.00 0.00 H new ATOM 600 N ILE A 39 -8.906 6.666 -2.795 1.00 0.00 N ATOM 601 CA ILE A 39 -9.691 6.775 -4.018 1.00 0.00 C ATOM 602 C ILE A 39 -10.573 8.019 -3.973 1.00 0.00 C ATOM 603 O ILE A 39 -11.398 8.169 -3.069 1.00 0.00 O ATOM 604 CB ILE A 39 -10.599 5.536 -4.247 1.00 0.00 C ATOM 605 CG1 ILE A 39 -9.800 4.227 -4.221 1.00 0.00 C ATOM 606 CG2 ILE A 39 -11.346 5.659 -5.567 1.00 0.00 C ATOM 607 CD1 ILE A 39 -9.587 3.668 -2.831 1.00 0.00 C ATOM 0 H ILE A 39 -9.393 6.216 -2.020 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.979 6.840 -4.841 1.00 0.00 H new ATOM 0 HB ILE A 39 -11.316 5.507 -3.427 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -10.319 3.483 -4.826 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -8.829 4.396 -4.687 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -11.977 4.782 -5.711 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.967 6.555 -5.552 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -10.629 5.728 -6.385 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -9.015 2.743 -2.895 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -9.040 4.392 -2.227 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -10.553 3.466 -2.368 1.00 0.00 H new ATOM 619 N GLN A 40 -10.384 8.920 -4.933 1.00 0.00 N ATOM 620 CA GLN A 40 -11.256 10.080 -5.063 1.00 0.00 C ATOM 621 C GLN A 40 -12.605 9.632 -5.614 1.00 0.00 C ATOM 622 O GLN A 40 -12.670 8.684 -6.398 1.00 0.00 O ATOM 623 CB GLN A 40 -10.650 11.121 -6.011 1.00 0.00 C ATOM 624 CG GLN A 40 -9.227 11.549 -5.672 1.00 0.00 C ATOM 625 CD GLN A 40 -9.111 12.258 -4.337 1.00 0.00 C ATOM 626 OE1 GLN A 40 -9.286 13.472 -4.253 1.00 0.00 O ATOM 627 NE2 GLN A 40 -8.783 11.515 -3.292 1.00 0.00 N ATOM 0 H GLN A 40 -9.639 8.869 -5.628 1.00 0.00 H new ATOM 0 HA GLN A 40 -11.376 10.534 -4.079 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -10.661 10.718 -7.024 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -11.289 12.004 -6.013 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -8.583 10.669 -5.664 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -8.857 12.208 -6.458 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -8.647 10.510 -3.403 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -8.667 11.947 -2.375 1.00 0.00 H new ATOM 636 N PHE A 41 -13.680 10.303 -5.215 1.00 0.00 N ATOM 637 CA PHE A 41 -15.007 9.967 -5.726 1.00 0.00 C ATOM 638 C PHE A 41 -15.081 10.181 -7.232 1.00 0.00 C ATOM 639 O PHE A 41 -15.812 9.481 -7.928 1.00 0.00 O ATOM 640 CB PHE A 41 -16.096 10.783 -5.023 1.00 0.00 C ATOM 641 CG PHE A 41 -16.554 10.188 -3.715 1.00 0.00 C ATOM 642 CD1 PHE A 41 -15.706 9.396 -2.956 1.00 0.00 C ATOM 643 CD2 PHE A 41 -17.839 10.422 -3.247 1.00 0.00 C ATOM 644 CE1 PHE A 41 -16.130 8.848 -1.759 1.00 0.00 C ATOM 645 CE2 PHE A 41 -18.267 9.876 -2.051 1.00 0.00 C ATOM 646 CZ PHE A 41 -17.409 9.090 -1.304 1.00 0.00 C ATOM 0 H PHE A 41 -13.662 11.074 -4.547 1.00 0.00 H new ATOM 0 HA PHE A 41 -15.181 8.912 -5.515 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -15.722 11.791 -4.842 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -16.954 10.876 -5.689 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -14.702 9.205 -3.304 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -18.513 11.038 -3.824 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -15.459 8.230 -1.180 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -19.271 10.063 -1.700 1.00 0.00 H new ATOM 0 HZ PHE A 41 -17.740 8.667 -0.367 1.00 0.00 H new ATOM 656 N ALA A 42 -14.298 11.129 -7.733 1.00 0.00 N ATOM 657 CA ALA A 42 -14.257 11.412 -9.164 1.00 0.00 C ATOM 658 C ALA A 42 -13.430 10.368 -9.916 1.00 0.00 C ATOM 659 O ALA A 42 -13.468 10.297 -11.141 1.00 0.00 O ATOM 660 CB ALA A 42 -13.695 12.802 -9.404 1.00 0.00 C ATOM 0 H ALA A 42 -13.682 11.716 -7.170 1.00 0.00 H new ATOM 0 HA ALA A 42 -15.277 11.367 -9.546 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -13.668 13.004 -10.475 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.328 13.540 -8.911 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -12.685 12.861 -8.998 1.00 0.00 H new ATOM 666 N SER A 43 -12.676 9.566 -9.174 1.00 0.00 N ATOM 667 CA SER A 43 -11.870 8.505 -9.764 1.00 0.00 C ATOM 668 C SER A 43 -12.706 7.242 -9.936 1.00 0.00 C ATOM 669 O SER A 43 -12.564 6.514 -10.919 1.00 0.00 O ATOM 670 CB SER A 43 -10.651 8.214 -8.880 1.00 0.00 C ATOM 671 OG SER A 43 -9.799 7.239 -9.464 1.00 0.00 O ATOM 0 H SER A 43 -12.606 9.631 -8.158 1.00 0.00 H new ATOM 0 HA SER A 43 -11.524 8.833 -10.744 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.092 9.135 -8.717 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.985 7.867 -7.902 1.00 0.00 H new ATOM 0 HG SER A 43 -9.192 7.673 -10.099 1.00 0.00 H new ATOM 677 N ILE A 44 -13.580 6.996 -8.971 1.00 0.00 N ATOM 678 CA ILE A 44 -14.435 5.819 -8.991 1.00 0.00 C ATOM 679 C ILE A 44 -15.762 6.122 -9.696 1.00 0.00 C ATOM 680 O ILE A 44 -16.368 5.242 -10.314 1.00 0.00 O ATOM 681 CB ILE A 44 -14.693 5.305 -7.549 1.00 0.00 C ATOM 682 CG1 ILE A 44 -15.679 4.134 -7.550 1.00 0.00 C ATOM 683 CG2 ILE A 44 -15.201 6.429 -6.658 1.00 0.00 C ATOM 684 CD1 ILE A 44 -15.952 3.569 -6.170 1.00 0.00 C ATOM 0 H ILE A 44 -13.716 7.600 -8.160 1.00 0.00 H new ATOM 0 HA ILE A 44 -13.921 5.037 -9.550 1.00 0.00 H new ATOM 0 HB ILE A 44 -13.744 4.949 -7.147 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -16.620 4.463 -7.992 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -15.288 3.341 -8.187 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -15.375 6.046 -5.652 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -14.459 7.226 -6.619 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -16.134 6.821 -7.063 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -16.659 2.743 -6.248 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -15.020 3.209 -5.733 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -16.373 4.348 -5.535 1.00 0.00 H new ATOM 696 N GLY A 45 -16.193 7.377 -9.623 1.00 0.00 N ATOM 697 CA GLY A 45 -17.457 7.766 -10.219 1.00 0.00 C ATOM 698 C GLY A 45 -18.614 7.547 -9.269 1.00 0.00 C ATOM 699 O GLY A 45 -19.721 7.205 -9.690 1.00 0.00 O ATOM 0 H GLY A 45 -15.688 8.133 -9.161 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -17.416 8.817 -10.506 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -17.621 7.192 -11.131 1.00 0.00 H new ATOM 703 N ALA A 46 -18.354 7.744 -7.985 1.00 0.00 N ATOM 704 CA ALA A 46 -19.367 7.543 -6.963 1.00 0.00 C ATOM 705 C ALA A 46 -20.064 8.856 -6.634 1.00 0.00 C ATOM 706 O ALA A 46 -19.662 9.921 -7.107 1.00 0.00 O ATOM 707 CB ALA A 46 -18.749 6.938 -5.710 1.00 0.00 C ATOM 0 H ALA A 46 -17.447 8.044 -7.627 1.00 0.00 H new ATOM 0 HA ALA A 46 -20.111 6.847 -7.350 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -19.523 6.795 -4.956 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -18.298 5.976 -5.955 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -17.983 7.609 -5.321 1.00 0.00 H new ATOM 713 N THR A 47 -21.116 8.776 -5.838 1.00 0.00 N ATOM 714 CA THR A 47 -21.879 9.955 -5.463 1.00 0.00 C ATOM 715 C THR A 47 -21.852 10.163 -3.947 1.00 0.00 C ATOM 716 O THR A 47 -21.492 11.237 -3.460 1.00 0.00 O ATOM 717 CB THR A 47 -23.335 9.829 -5.946 1.00 0.00 C ATOM 718 OG1 THR A 47 -23.351 9.295 -7.279 1.00 0.00 O ATOM 719 CG2 THR A 47 -24.030 11.180 -5.933 1.00 0.00 C ATOM 0 H THR A 47 -21.463 7.904 -5.437 1.00 0.00 H new ATOM 0 HA THR A 47 -21.418 10.819 -5.941 1.00 0.00 H new ATOM 0 HB THR A 47 -23.868 9.160 -5.270 1.00 0.00 H new ATOM 0 HG1 THR A 47 -24.278 9.213 -7.587 1.00 0.00 H new ATOM 0 HG21 THR A 47 -25.057 11.064 -6.278 1.00 0.00 H new ATOM 0 HG22 THR A 47 -24.031 11.579 -4.919 1.00 0.00 H new ATOM 0 HG23 THR A 47 -23.501 11.868 -6.593 1.00 0.00 H new ATOM 727 N THR A 48 -22.222 9.127 -3.208 1.00 0.00 N ATOM 728 CA THR A 48 -22.235 9.184 -1.755 1.00 0.00 C ATOM 729 C THR A 48 -21.265 8.164 -1.179 1.00 0.00 C ATOM 730 O THR A 48 -20.666 7.381 -1.919 1.00 0.00 O ATOM 731 CB THR A 48 -23.641 8.894 -1.192 1.00 0.00 C ATOM 732 OG1 THR A 48 -24.076 7.588 -1.598 1.00 0.00 O ATOM 733 CG2 THR A 48 -24.643 9.937 -1.660 1.00 0.00 C ATOM 0 H THR A 48 -22.519 8.231 -3.595 1.00 0.00 H new ATOM 0 HA THR A 48 -21.937 10.193 -1.468 1.00 0.00 H new ATOM 0 HB THR A 48 -23.584 8.935 -0.104 1.00 0.00 H new ATOM 0 HG1 THR A 48 -23.974 7.496 -2.568 1.00 0.00 H new ATOM 0 HG21 THR A 48 -25.626 9.708 -1.248 1.00 0.00 H new ATOM 0 HG22 THR A 48 -24.328 10.923 -1.319 1.00 0.00 H new ATOM 0 HG23 THR A 48 -24.695 9.929 -2.749 1.00 0.00 H new ATOM 741 N LYS A 49 -21.124 8.165 0.141 1.00 0.00 N ATOM 742 CA LYS A 49 -20.296 7.178 0.822 1.00 0.00 C ATOM 743 C LYS A 49 -20.927 5.796 0.702 1.00 0.00 C ATOM 744 O LYS A 49 -20.244 4.781 0.795 1.00 0.00 O ATOM 745 CB LYS A 49 -20.130 7.541 2.297 1.00 0.00 C ATOM 746 CG LYS A 49 -19.526 8.916 2.525 1.00 0.00 C ATOM 747 CD LYS A 49 -19.407 9.233 4.006 1.00 0.00 C ATOM 748 CE LYS A 49 -18.933 10.662 4.235 1.00 0.00 C ATOM 749 NZ LYS A 49 -19.912 11.663 3.730 1.00 0.00 N ATOM 0 H LYS A 49 -21.573 8.839 0.761 1.00 0.00 H new ATOM 0 HA LYS A 49 -19.313 7.169 0.350 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -21.104 7.497 2.784 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -19.499 6.793 2.777 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -18.541 8.963 2.061 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -20.144 9.671 2.039 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -20.373 9.087 4.489 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -18.709 8.538 4.473 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -18.768 10.823 5.300 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -17.974 10.810 3.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -19.456 12.264 3.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -20.723 11.171 3.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -20.242 12.254 4.519 1.00 0.00 H new ATOM 763 N GLU A 50 -22.239 5.774 0.482 1.00 0.00 N ATOM 764 CA GLU A 50 -22.982 4.528 0.361 1.00 0.00 C ATOM 765 C GLU A 50 -22.587 3.784 -0.907 1.00 0.00 C ATOM 766 O GLU A 50 -22.094 2.656 -0.849 1.00 0.00 O ATOM 767 CB GLU A 50 -24.488 4.806 0.360 1.00 0.00 C ATOM 768 CG GLU A 50 -24.984 5.449 1.643 1.00 0.00 C ATOM 769 CD GLU A 50 -24.812 4.549 2.848 1.00 0.00 C ATOM 770 OE1 GLU A 50 -23.695 4.492 3.401 1.00 0.00 O ATOM 771 OE2 GLU A 50 -25.795 3.900 3.258 1.00 0.00 O ATOM 0 H GLU A 50 -22.811 6.613 0.384 1.00 0.00 H new ATOM 0 HA GLU A 50 -22.738 3.901 1.219 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -24.729 5.457 -0.480 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -25.023 3.869 0.202 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -24.445 6.381 1.810 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -26.038 5.706 1.533 1.00 0.00 H new ATOM 778 N ASP A 51 -22.778 4.430 -2.051 1.00 0.00 N ATOM 779 CA ASP A 51 -22.490 3.800 -3.335 1.00 0.00 C ATOM 780 C ASP A 51 -20.987 3.700 -3.574 1.00 0.00 C ATOM 781 O ASP A 51 -20.536 2.943 -4.436 1.00 0.00 O ATOM 782 CB ASP A 51 -23.181 4.541 -4.486 1.00 0.00 C ATOM 783 CG ASP A 51 -22.742 5.982 -4.629 1.00 0.00 C ATOM 784 OD1 ASP A 51 -23.356 6.861 -3.989 1.00 0.00 O ATOM 785 OD2 ASP A 51 -21.792 6.245 -5.388 1.00 0.00 O ATOM 0 H ASP A 51 -23.129 5.385 -2.117 1.00 0.00 H new ATOM 0 HA ASP A 51 -22.892 2.787 -3.303 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -22.980 4.014 -5.419 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -24.259 4.512 -4.330 1.00 0.00 H new ATOM 790 N ALA A 52 -20.214 4.453 -2.805 1.00 0.00 N ATOM 791 CA ALA A 52 -18.764 4.326 -2.839 1.00 0.00 C ATOM 792 C ALA A 52 -18.326 3.079 -2.077 1.00 0.00 C ATOM 793 O ALA A 52 -17.582 2.249 -2.604 1.00 0.00 O ATOM 794 CB ALA A 52 -18.098 5.563 -2.255 1.00 0.00 C ATOM 0 H ALA A 52 -20.564 5.155 -2.153 1.00 0.00 H new ATOM 0 HA ALA A 52 -18.453 4.231 -3.879 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -17.015 5.445 -2.291 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -18.387 6.440 -2.835 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -18.414 5.692 -1.220 1.00 0.00 H new ATOM 800 N ALA A 53 -18.815 2.944 -0.843 1.00 0.00 N ATOM 801 CA ALA A 53 -18.446 1.821 0.013 1.00 0.00 C ATOM 802 C ALA A 53 -18.814 0.492 -0.619 1.00 0.00 C ATOM 803 O ALA A 53 -18.001 -0.415 -0.674 1.00 0.00 O ATOM 804 CB ALA A 53 -19.105 1.931 1.377 1.00 0.00 C ATOM 0 H ALA A 53 -19.468 3.601 -0.416 1.00 0.00 H new ATOM 0 HA ALA A 53 -17.364 1.861 0.135 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -18.812 1.081 1.993 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -18.789 2.855 1.860 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -20.188 1.936 1.258 1.00 0.00 H new ATOM 810 N LYS A 54 -20.035 0.395 -1.126 1.00 0.00 N ATOM 811 CA LYS A 54 -20.547 -0.865 -1.660 1.00 0.00 C ATOM 812 C LYS A 54 -19.788 -1.298 -2.916 1.00 0.00 C ATOM 813 O LYS A 54 -19.974 -2.411 -3.408 1.00 0.00 O ATOM 814 CB LYS A 54 -22.043 -0.741 -1.947 1.00 0.00 C ATOM 815 CG LYS A 54 -22.840 -0.335 -0.721 1.00 0.00 C ATOM 816 CD LYS A 54 -24.317 -0.164 -1.026 1.00 0.00 C ATOM 817 CE LYS A 54 -25.051 0.455 0.154 1.00 0.00 C ATOM 818 NZ LYS A 54 -24.924 -0.366 1.389 1.00 0.00 N ATOM 0 H LYS A 54 -20.692 1.173 -1.180 1.00 0.00 H new ATOM 0 HA LYS A 54 -20.392 -1.638 -0.907 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -22.198 -0.006 -2.737 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -22.418 -1.694 -2.321 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -22.717 -1.089 0.056 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -22.442 0.599 -0.325 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -24.439 0.467 -1.906 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -24.757 -1.132 -1.265 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -24.657 1.454 0.342 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -26.106 0.571 -0.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -25.572 -0.002 2.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -25.165 -1.355 1.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -23.946 -0.316 1.740 1.00 0.00 H new ATOM 832 N THR A 55 -18.930 -0.423 -3.422 1.00 0.00 N ATOM 833 CA THR A 55 -18.105 -0.744 -4.573 1.00 0.00 C ATOM 834 C THR A 55 -16.702 -1.171 -4.130 1.00 0.00 C ATOM 835 O THR A 55 -16.088 -2.049 -4.735 1.00 0.00 O ATOM 836 CB THR A 55 -18.014 0.458 -5.533 1.00 0.00 C ATOM 837 OG1 THR A 55 -19.337 0.889 -5.886 1.00 0.00 O ATOM 838 CG2 THR A 55 -17.246 0.094 -6.797 1.00 0.00 C ATOM 0 H THR A 55 -18.789 0.516 -3.051 1.00 0.00 H new ATOM 0 HA THR A 55 -18.573 -1.575 -5.101 1.00 0.00 H new ATOM 0 HB THR A 55 -17.481 1.262 -5.026 1.00 0.00 H new ATOM 0 HG1 THR A 55 -19.623 1.601 -5.276 1.00 0.00 H new ATOM 0 HG21 THR A 55 -17.198 0.961 -7.456 1.00 0.00 H new ATOM 0 HG22 THR A 55 -16.236 -0.217 -6.532 1.00 0.00 H new ATOM 0 HG23 THR A 55 -17.754 -0.723 -7.309 1.00 0.00 H new ATOM 846 N LEU A 56 -16.213 -0.567 -3.050 1.00 0.00 N ATOM 847 CA LEU A 56 -14.879 -0.872 -2.538 1.00 0.00 C ATOM 848 C LEU A 56 -14.917 -2.066 -1.588 1.00 0.00 C ATOM 849 O LEU A 56 -13.927 -2.776 -1.429 1.00 0.00 O ATOM 850 CB LEU A 56 -14.291 0.347 -1.822 1.00 0.00 C ATOM 851 CG LEU A 56 -14.098 1.587 -2.701 1.00 0.00 C ATOM 852 CD1 LEU A 56 -13.556 2.742 -1.877 1.00 0.00 C ATOM 853 CD2 LEU A 56 -13.164 1.278 -3.862 1.00 0.00 C ATOM 0 H LEU A 56 -16.720 0.136 -2.512 1.00 0.00 H new ATOM 0 HA LEU A 56 -14.244 -1.127 -3.386 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.943 0.609 -0.989 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -13.327 0.069 -1.396 1.00 0.00 H new ATOM 0 HG LEU A 56 -15.068 1.876 -3.107 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -13.425 3.615 -2.516 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -14.258 2.980 -1.078 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -12.596 2.461 -1.445 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -13.039 2.170 -4.476 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -12.194 0.964 -3.475 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.589 0.478 -4.468 1.00 0.00 H new ATOM 865 N GLU A 57 -16.078 -2.285 -0.977 1.00 0.00 N ATOM 866 CA GLU A 57 -16.284 -3.384 -0.034 1.00 0.00 C ATOM 867 C GLU A 57 -15.772 -4.728 -0.577 1.00 0.00 C ATOM 868 O GLU A 57 -14.971 -5.386 0.086 1.00 0.00 O ATOM 869 CB GLU A 57 -17.766 -3.497 0.344 1.00 0.00 C ATOM 870 CG GLU A 57 -18.175 -2.604 1.504 1.00 0.00 C ATOM 871 CD GLU A 57 -17.647 -3.109 2.829 1.00 0.00 C ATOM 872 OE1 GLU A 57 -18.110 -4.176 3.290 1.00 0.00 O ATOM 873 OE2 GLU A 57 -16.767 -2.451 3.418 1.00 0.00 O ATOM 0 H GLU A 57 -16.905 -1.705 -1.121 1.00 0.00 H new ATOM 0 HA GLU A 57 -15.700 -3.151 0.857 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -18.373 -3.247 -0.526 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.988 -4.533 0.600 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -17.806 -1.593 1.330 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -19.262 -2.543 1.548 1.00 0.00 H new ATOM 880 N PRO A 58 -16.215 -5.168 -1.782 1.00 0.00 N ATOM 881 CA PRO A 58 -15.764 -6.440 -2.360 1.00 0.00 C ATOM 882 C PRO A 58 -14.281 -6.428 -2.740 1.00 0.00 C ATOM 883 O PRO A 58 -13.667 -7.484 -2.895 1.00 0.00 O ATOM 884 CB PRO A 58 -16.635 -6.605 -3.609 1.00 0.00 C ATOM 885 CG PRO A 58 -17.067 -5.228 -3.962 1.00 0.00 C ATOM 886 CD PRO A 58 -17.195 -4.491 -2.660 1.00 0.00 C ATOM 0 HA PRO A 58 -15.863 -7.257 -1.646 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -16.074 -7.063 -4.423 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -17.492 -7.249 -3.410 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -16.339 -4.745 -4.614 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -18.016 -5.242 -4.498 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -16.966 -3.431 -2.774 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -18.206 -4.557 -2.259 1.00 0.00 H new ATOM 894 N LEU A 59 -13.709 -5.237 -2.880 1.00 0.00 N ATOM 895 CA LEU A 59 -12.301 -5.111 -3.244 1.00 0.00 C ATOM 896 C LEU A 59 -11.426 -5.290 -2.014 1.00 0.00 C ATOM 897 O LEU A 59 -10.474 -6.069 -2.027 1.00 0.00 O ATOM 898 CB LEU A 59 -12.027 -3.754 -3.896 1.00 0.00 C ATOM 899 CG LEU A 59 -12.792 -3.490 -5.196 1.00 0.00 C ATOM 900 CD1 LEU A 59 -12.379 -2.157 -5.792 1.00 0.00 C ATOM 901 CD2 LEU A 59 -12.561 -4.612 -6.197 1.00 0.00 C ATOM 0 H LEU A 59 -14.194 -4.350 -2.748 1.00 0.00 H new ATOM 0 HA LEU A 59 -12.061 -5.891 -3.967 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -12.274 -2.969 -3.182 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -10.959 -3.675 -4.099 1.00 0.00 H new ATOM 0 HG LEU A 59 -13.856 -3.454 -4.963 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -12.932 -1.984 -6.715 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -12.598 -1.358 -5.083 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -11.310 -2.170 -6.006 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -13.114 -4.403 -7.112 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -11.497 -4.684 -6.424 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -12.906 -5.555 -5.773 1.00 0.00 H new ATOM 913 N SER A 60 -11.765 -4.587 -0.946 1.00 0.00 N ATOM 914 CA SER A 60 -11.060 -4.735 0.317 1.00 0.00 C ATOM 915 C SER A 60 -11.252 -6.150 0.868 1.00 0.00 C ATOM 916 O SER A 60 -10.380 -6.699 1.542 1.00 0.00 O ATOM 917 CB SER A 60 -11.571 -3.701 1.320 1.00 0.00 C ATOM 918 OG SER A 60 -11.615 -2.410 0.739 1.00 0.00 O ATOM 0 H SER A 60 -12.525 -3.907 -0.928 1.00 0.00 H new ATOM 0 HA SER A 60 -9.995 -4.570 0.151 1.00 0.00 H new ATOM 0 HB2 SER A 60 -12.566 -3.983 1.664 1.00 0.00 H new ATOM 0 HB3 SER A 60 -10.923 -3.688 2.196 1.00 0.00 H new ATOM 0 HG SER A 60 -10.725 -2.170 0.407 1.00 0.00 H new ATOM 924 N ALA A 61 -12.393 -6.747 0.535 1.00 0.00 N ATOM 925 CA ALA A 61 -12.747 -8.096 0.972 1.00 0.00 C ATOM 926 C ALA A 61 -11.874 -9.163 0.313 1.00 0.00 C ATOM 927 O ALA A 61 -12.097 -10.356 0.504 1.00 0.00 O ATOM 928 CB ALA A 61 -14.214 -8.372 0.696 1.00 0.00 C ATOM 0 H ALA A 61 -13.103 -6.306 -0.049 1.00 0.00 H new ATOM 0 HA ALA A 61 -12.567 -8.147 2.046 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -14.463 -9.380 1.027 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -14.828 -7.651 1.236 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.406 -8.283 -0.373 1.00 0.00 H new ATOM 934 N LYS A 62 -10.915 -8.749 -0.501 1.00 0.00 N ATOM 935 CA LYS A 62 -9.980 -9.695 -1.090 1.00 0.00 C ATOM 936 C LYS A 62 -8.952 -10.148 -0.058 1.00 0.00 C ATOM 937 O LYS A 62 -8.478 -11.285 -0.102 1.00 0.00 O ATOM 938 CB LYS A 62 -9.282 -9.084 -2.310 1.00 0.00 C ATOM 939 CG LYS A 62 -10.214 -8.816 -3.481 1.00 0.00 C ATOM 940 CD LYS A 62 -9.501 -8.069 -4.596 1.00 0.00 C ATOM 941 CE LYS A 62 -10.435 -7.788 -5.761 1.00 0.00 C ATOM 942 NZ LYS A 62 -10.867 -9.034 -6.451 1.00 0.00 N ATOM 0 H LYS A 62 -10.764 -7.776 -0.767 1.00 0.00 H new ATOM 0 HA LYS A 62 -10.544 -10.567 -1.421 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -8.807 -8.148 -2.014 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -8.488 -9.755 -2.636 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -10.602 -9.760 -3.863 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -11.071 -8.234 -3.141 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -9.104 -7.130 -4.211 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -8.650 -8.656 -4.943 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -11.313 -7.253 -5.399 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -9.935 -7.134 -6.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -11.375 -8.789 -7.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -10.032 -9.608 -6.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -11.496 -9.577 -5.826 1.00 0.00 H new ATOM 956 N TYR A 63 -8.627 -9.267 0.882 1.00 0.00 N ATOM 957 CA TYR A 63 -7.642 -9.579 1.914 1.00 0.00 C ATOM 958 C TYR A 63 -8.237 -10.515 2.959 1.00 0.00 C ATOM 959 O TYR A 63 -7.716 -11.602 3.204 1.00 0.00 O ATOM 960 CB TYR A 63 -7.143 -8.294 2.577 1.00 0.00 C ATOM 961 CG TYR A 63 -6.410 -7.375 1.627 1.00 0.00 C ATOM 962 CD1 TYR A 63 -5.039 -7.494 1.448 1.00 0.00 C ATOM 963 CD2 TYR A 63 -7.086 -6.397 0.910 1.00 0.00 C ATOM 964 CE1 TYR A 63 -4.361 -6.665 0.580 1.00 0.00 C ATOM 965 CE2 TYR A 63 -6.416 -5.562 0.037 1.00 0.00 C ATOM 966 CZ TYR A 63 -5.053 -5.699 -0.125 1.00 0.00 C ATOM 967 OH TYR A 63 -4.380 -4.871 -0.993 1.00 0.00 O ATOM 0 H TYR A 63 -9.030 -8.333 0.952 1.00 0.00 H new ATOM 0 HA TYR A 63 -6.797 -10.081 1.442 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -7.992 -7.761 3.004 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -6.481 -8.553 3.403 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -4.495 -8.248 1.997 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -8.153 -6.287 1.037 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -3.294 -6.770 0.452 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -6.956 -4.807 -0.515 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.013 -4.249 -1.409 1.00 0.00 H new ATOM 977 N LYS A 64 -9.335 -10.081 3.557 1.00 0.00 N ATOM 978 CA LYS A 64 -10.066 -10.878 4.540 1.00 0.00 C ATOM 979 C LYS A 64 -9.260 -11.133 5.809 1.00 0.00 C ATOM 980 O LYS A 64 -9.269 -10.325 6.736 1.00 0.00 O ATOM 981 CB LYS A 64 -10.528 -12.206 3.925 1.00 0.00 C ATOM 982 CG LYS A 64 -11.629 -12.044 2.897 1.00 0.00 C ATOM 983 CD LYS A 64 -11.717 -13.244 1.968 1.00 0.00 C ATOM 984 CE LYS A 64 -10.427 -13.427 1.187 1.00 0.00 C ATOM 985 NZ LYS A 64 -10.599 -14.326 0.016 1.00 0.00 N ATOM 0 H LYS A 64 -9.748 -9.166 3.377 1.00 0.00 H new ATOM 0 HA LYS A 64 -10.939 -10.293 4.829 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -9.675 -12.697 3.458 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -10.878 -12.864 4.721 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -12.583 -11.908 3.405 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -11.449 -11.143 2.311 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -11.925 -14.143 2.549 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -12.549 -13.112 1.276 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -10.070 -12.455 0.847 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -9.661 -13.835 1.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -9.693 -14.420 -0.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -10.914 -15.262 0.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -11.311 -13.925 -0.628 1.00 0.00 H new ATOM 999 N ASN A 65 -8.563 -12.252 5.842 1.00 0.00 N ATOM 1000 CA ASN A 65 -7.856 -12.670 7.039 1.00 0.00 C ATOM 1001 C ASN A 65 -6.615 -13.466 6.655 1.00 0.00 C ATOM 1002 O ASN A 65 -6.282 -14.471 7.281 1.00 0.00 O ATOM 1003 CB ASN A 65 -8.788 -13.506 7.929 1.00 0.00 C ATOM 1004 CG ASN A 65 -8.209 -13.776 9.307 1.00 0.00 C ATOM 1005 OD1 ASN A 65 -7.407 -12.997 9.824 1.00 0.00 O ATOM 1006 ND2 ASN A 65 -8.617 -14.880 9.915 1.00 0.00 N ATOM 0 H ASN A 65 -8.470 -12.890 5.052 1.00 0.00 H new ATOM 0 HA ASN A 65 -7.541 -11.791 7.600 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -9.740 -12.987 8.037 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -8.996 -14.456 7.436 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -8.266 -15.110 10.845 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -9.283 -15.500 9.454 1.00 0.00 H new ATOM 1013 N ILE A 66 -5.939 -13.004 5.606 1.00 0.00 N ATOM 1014 CA ILE A 66 -4.687 -13.630 5.158 1.00 0.00 C ATOM 1015 C ILE A 66 -3.694 -13.732 6.312 1.00 0.00 C ATOM 1016 O ILE A 66 -3.028 -14.749 6.499 1.00 0.00 O ATOM 1017 CB ILE A 66 -4.002 -12.820 4.035 1.00 0.00 C ATOM 1018 CG1 ILE A 66 -4.943 -12.606 2.854 1.00 0.00 C ATOM 1019 CG2 ILE A 66 -2.731 -13.522 3.573 1.00 0.00 C ATOM 1020 CD1 ILE A 66 -4.370 -11.682 1.802 1.00 0.00 C ATOM 0 H ILE A 66 -6.232 -12.201 5.049 1.00 0.00 H new ATOM 0 HA ILE A 66 -4.958 -14.618 4.784 1.00 0.00 H new ATOM 0 HB ILE A 66 -3.740 -11.843 4.441 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -5.170 -13.570 2.398 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -5.885 -12.195 3.217 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.260 -12.939 2.782 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -2.042 -13.617 4.412 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -2.980 -14.513 3.194 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -5.086 -11.569 0.988 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.168 -10.707 2.245 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.443 -12.103 1.414 1.00 0.00 H new ATOM 1032 N ALA A 67 -3.634 -12.663 7.084 1.00 0.00 N ATOM 1033 CA ALA A 67 -2.672 -12.506 8.162 1.00 0.00 C ATOM 1034 C ALA A 67 -3.083 -11.302 8.987 1.00 0.00 C ATOM 1035 O ALA A 67 -4.275 -11.035 9.137 1.00 0.00 O ATOM 1036 CB ALA A 67 -1.269 -12.310 7.595 1.00 0.00 C ATOM 0 H ALA A 67 -4.262 -11.866 6.979 1.00 0.00 H new ATOM 0 HA ALA A 67 -2.657 -13.399 8.786 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -0.559 -12.194 8.414 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -0.994 -13.178 6.996 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.251 -11.418 6.969 1.00 0.00 H new ATOM 1042 N GLY A 68 -2.113 -10.567 9.501 1.00 0.00 N ATOM 1043 CA GLY A 68 -2.410 -9.307 10.149 1.00 0.00 C ATOM 1044 C GLY A 68 -2.705 -8.206 9.140 1.00 0.00 C ATOM 1045 O GLY A 68 -2.198 -7.092 9.261 1.00 0.00 O ATOM 0 H GLY A 68 -1.125 -10.819 9.482 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -3.267 -9.432 10.811 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.566 -9.012 10.773 1.00 0.00 H new ATOM 1049 N VAL A 69 -3.524 -8.526 8.139 1.00 0.00 N ATOM 1050 CA VAL A 69 -3.893 -7.570 7.107 1.00 0.00 C ATOM 1051 C VAL A 69 -5.194 -6.880 7.469 1.00 0.00 C ATOM 1052 O VAL A 69 -6.257 -7.498 7.505 1.00 0.00 O ATOM 1053 CB VAL A 69 -4.007 -8.215 5.703 1.00 0.00 C ATOM 1054 CG1 VAL A 69 -2.625 -8.428 5.110 1.00 0.00 C ATOM 1055 CG2 VAL A 69 -4.769 -9.529 5.754 1.00 0.00 C ATOM 0 H VAL A 69 -3.945 -9.448 8.025 1.00 0.00 H new ATOM 0 HA VAL A 69 -3.089 -6.836 7.057 1.00 0.00 H new ATOM 0 HB VAL A 69 -4.567 -7.531 5.065 1.00 0.00 H new ATOM 0 HG11 VAL A 69 -2.718 -8.882 4.123 1.00 0.00 H new ATOM 0 HG12 VAL A 69 -2.115 -7.469 5.021 1.00 0.00 H new ATOM 0 HG13 VAL A 69 -2.048 -9.087 5.759 1.00 0.00 H new ATOM 0 HG21 VAL A 69 -4.830 -9.953 4.752 1.00 0.00 H new ATOM 0 HG22 VAL A 69 -4.250 -10.225 6.412 1.00 0.00 H new ATOM 0 HG23 VAL A 69 -5.775 -9.352 6.135 1.00 0.00 H new ATOM 1065 N GLU A 70 -5.090 -5.602 7.767 1.00 0.00 N ATOM 1066 CA GLU A 70 -6.238 -4.810 8.163 1.00 0.00 C ATOM 1067 C GLU A 70 -6.646 -3.884 7.026 1.00 0.00 C ATOM 1068 O GLU A 70 -5.916 -2.948 6.700 1.00 0.00 O ATOM 1069 CB GLU A 70 -5.892 -3.990 9.409 1.00 0.00 C ATOM 1070 CG GLU A 70 -5.269 -4.817 10.526 1.00 0.00 C ATOM 1071 CD GLU A 70 -4.829 -3.972 11.705 1.00 0.00 C ATOM 1072 OE1 GLU A 70 -3.704 -3.432 11.672 1.00 0.00 O ATOM 1073 OE2 GLU A 70 -5.600 -3.858 12.681 1.00 0.00 O ATOM 0 H GLU A 70 -4.212 -5.084 7.742 1.00 0.00 H new ATOM 0 HA GLU A 70 -7.071 -5.474 8.392 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -5.203 -3.193 9.130 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -6.798 -3.512 9.783 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -5.989 -5.561 10.866 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -4.410 -5.361 10.134 1.00 0.00 H new ATOM 1080 N GLU A 71 -7.782 -4.163 6.401 1.00 0.00 N ATOM 1081 CA GLU A 71 -8.303 -3.282 5.369 1.00 0.00 C ATOM 1082 C GLU A 71 -9.315 -2.312 5.984 1.00 0.00 C ATOM 1083 O GLU A 71 -10.478 -2.645 6.226 1.00 0.00 O ATOM 1084 CB GLU A 71 -8.899 -4.074 4.182 1.00 0.00 C ATOM 1085 CG GLU A 71 -10.143 -4.908 4.488 1.00 0.00 C ATOM 1086 CD GLU A 71 -9.876 -6.100 5.384 1.00 0.00 C ATOM 1087 OE1 GLU A 71 -9.872 -5.923 6.620 1.00 0.00 O ATOM 1088 OE2 GLU A 71 -9.693 -7.218 4.863 1.00 0.00 O ATOM 0 H GLU A 71 -8.355 -4.986 6.589 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.478 -2.701 4.956 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -9.145 -3.369 3.388 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -8.128 -4.738 3.791 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -10.889 -4.270 4.961 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -10.573 -5.260 3.550 1.00 0.00 H new ATOM 1095 N LYS A 72 -8.838 -1.117 6.282 1.00 0.00 N ATOM 1096 CA LYS A 72 -9.643 -0.116 6.957 1.00 0.00 C ATOM 1097 C LYS A 72 -10.154 0.923 5.971 1.00 0.00 C ATOM 1098 O LYS A 72 -9.400 1.780 5.505 1.00 0.00 O ATOM 1099 CB LYS A 72 -8.827 0.556 8.061 1.00 0.00 C ATOM 1100 CG LYS A 72 -8.394 -0.402 9.158 1.00 0.00 C ATOM 1101 CD LYS A 72 -7.513 0.285 10.185 1.00 0.00 C ATOM 1102 CE LYS A 72 -7.214 -0.628 11.363 1.00 0.00 C ATOM 1103 NZ LYS A 72 -8.448 -0.994 12.112 1.00 0.00 N ATOM 0 H LYS A 72 -7.888 -0.815 6.065 1.00 0.00 H new ATOM 0 HA LYS A 72 -10.504 -0.612 7.405 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -7.943 1.016 7.620 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -9.418 1.359 8.502 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -9.275 -0.814 9.651 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -7.854 -1.240 8.717 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -6.579 0.593 9.716 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.005 1.190 10.541 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -6.725 -1.534 11.005 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -6.514 -0.133 12.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -8.188 -1.380 13.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -9.039 -0.148 12.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -8.980 -1.710 11.576 1.00 0.00 H new ATOM 1117 N LEU A 73 -11.431 0.828 5.643 1.00 0.00 N ATOM 1118 CA LEU A 73 -12.065 1.774 4.738 1.00 0.00 C ATOM 1119 C LEU A 73 -12.533 3.007 5.501 1.00 0.00 C ATOM 1120 O LEU A 73 -13.510 2.955 6.246 1.00 0.00 O ATOM 1121 CB LEU A 73 -13.246 1.113 4.025 1.00 0.00 C ATOM 1122 CG LEU A 73 -12.870 0.046 2.996 1.00 0.00 C ATOM 1123 CD1 LEU A 73 -14.105 -0.692 2.508 1.00 0.00 C ATOM 1124 CD2 LEU A 73 -12.143 0.678 1.822 1.00 0.00 C ATOM 0 H LEU A 73 -12.054 0.100 5.992 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.334 2.084 3.992 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.895 0.660 4.774 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -13.828 1.887 3.526 1.00 0.00 H new ATOM 0 HG LEU A 73 -12.207 -0.672 3.478 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.813 -1.446 1.777 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -14.597 -1.176 3.352 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.792 0.016 2.045 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -11.882 -0.094 1.098 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -12.790 1.416 1.348 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -11.235 1.166 2.176 1.00 0.00 H new ATOM 1136 N THR A 74 -11.821 4.105 5.326 1.00 0.00 N ATOM 1137 CA THR A 74 -12.159 5.348 5.998 1.00 0.00 C ATOM 1138 C THR A 74 -12.764 6.339 5.013 1.00 0.00 C ATOM 1139 O THR A 74 -12.185 6.623 3.965 1.00 0.00 O ATOM 1140 CB THR A 74 -10.922 5.960 6.686 1.00 0.00 C ATOM 1141 OG1 THR A 74 -9.764 5.788 5.860 1.00 0.00 O ATOM 1142 CG2 THR A 74 -10.683 5.307 8.035 1.00 0.00 C ATOM 0 H THR A 74 -11.001 4.162 4.722 1.00 0.00 H new ATOM 0 HA THR A 74 -12.898 5.125 6.767 1.00 0.00 H new ATOM 0 HB THR A 74 -11.106 7.024 6.836 1.00 0.00 H new ATOM 0 HG1 THR A 74 -9.154 6.544 5.990 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.806 5.752 8.505 1.00 0.00 H new ATOM 0 HG22 THR A 74 -11.553 5.460 8.673 1.00 0.00 H new ATOM 0 HG23 THR A 74 -10.518 4.238 7.898 1.00 0.00 H new ATOM 1150 N TYR A 75 -13.942 6.845 5.339 1.00 0.00 N ATOM 1151 CA TYR A 75 -14.672 7.711 4.426 1.00 0.00 C ATOM 1152 C TYR A 75 -14.753 9.128 4.967 1.00 0.00 C ATOM 1153 O TYR A 75 -15.337 9.368 6.022 1.00 0.00 O ATOM 1154 CB TYR A 75 -16.080 7.159 4.193 1.00 0.00 C ATOM 1155 CG TYR A 75 -16.090 5.742 3.667 1.00 0.00 C ATOM 1156 CD1 TYR A 75 -16.032 5.486 2.305 1.00 0.00 C ATOM 1157 CD2 TYR A 75 -16.144 4.660 4.536 1.00 0.00 C ATOM 1158 CE1 TYR A 75 -16.026 4.191 1.822 1.00 0.00 C ATOM 1159 CE2 TYR A 75 -16.136 3.362 4.063 1.00 0.00 C ATOM 1160 CZ TYR A 75 -16.077 3.133 2.704 1.00 0.00 C ATOM 1161 OH TYR A 75 -16.063 1.843 2.225 1.00 0.00 O ATOM 0 H TYR A 75 -14.413 6.672 6.227 1.00 0.00 H new ATOM 0 HA TYR A 75 -14.134 7.737 3.478 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -16.636 7.195 5.130 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -16.603 7.804 3.487 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -15.991 6.312 1.611 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -16.193 4.836 5.600 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -15.982 4.009 0.758 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -16.176 2.532 4.753 1.00 0.00 H new ATOM 0 HH TYR A 75 -16.686 1.294 2.745 1.00 0.00 H new ATOM 1171 N THR A 76 -14.161 10.064 4.245 1.00 0.00 N ATOM 1172 CA THR A 76 -14.205 11.460 4.635 1.00 0.00 C ATOM 1173 C THR A 76 -15.472 12.120 4.107 1.00 0.00 C ATOM 1174 O THR A 76 -16.352 12.512 4.877 1.00 0.00 O ATOM 1175 CB THR A 76 -12.963 12.214 4.121 1.00 0.00 C ATOM 1176 OG1 THR A 76 -12.727 11.885 2.742 1.00 0.00 O ATOM 1177 CG2 THR A 76 -11.736 11.868 4.953 1.00 0.00 C ATOM 0 H THR A 76 -13.644 9.881 3.385 1.00 0.00 H new ATOM 0 HA THR A 76 -14.210 11.506 5.724 1.00 0.00 H new ATOM 0 HB THR A 76 -13.149 13.284 4.211 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.764 11.900 2.562 1.00 0.00 H new ATOM 0 HG21 THR A 76 -10.872 12.412 4.571 1.00 0.00 H new ATOM 0 HG22 THR A 76 -11.910 12.147 5.992 1.00 0.00 H new ATOM 0 HG23 THR A 76 -11.546 10.796 4.892 1.00 0.00 H new ATOM 1185 N ASP A 77 -15.552 12.215 2.789 1.00 0.00 N ATOM 1186 CA ASP A 77 -16.721 12.763 2.102 1.00 0.00 C ATOM 1187 C ASP A 77 -16.492 12.782 0.594 1.00 0.00 C ATOM 1188 O ASP A 77 -17.286 12.243 -0.171 1.00 0.00 O ATOM 1189 CB ASP A 77 -17.031 14.179 2.594 1.00 0.00 C ATOM 1190 CG ASP A 77 -18.340 14.715 2.051 1.00 0.00 C ATOM 1191 OD1 ASP A 77 -19.363 14.002 2.135 1.00 0.00 O ATOM 1192 OD2 ASP A 77 -18.362 15.863 1.575 1.00 0.00 O ATOM 0 H ASP A 77 -14.808 11.914 2.160 1.00 0.00 H new ATOM 0 HA ASP A 77 -17.573 12.121 2.327 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -17.067 14.181 3.683 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -16.221 14.846 2.301 1.00 0.00 H new ATOM 1197 N THR A 78 -15.388 13.392 0.182 1.00 0.00 N ATOM 1198 CA THR A 78 -15.064 13.523 -1.233 1.00 0.00 C ATOM 1199 C THR A 78 -14.174 12.368 -1.709 1.00 0.00 C ATOM 1200 O THR A 78 -13.978 12.160 -2.911 1.00 0.00 O ATOM 1201 CB THR A 78 -14.368 14.876 -1.494 1.00 0.00 C ATOM 1202 OG1 THR A 78 -15.173 15.934 -0.956 1.00 0.00 O ATOM 1203 CG2 THR A 78 -14.149 15.120 -2.980 1.00 0.00 C ATOM 0 H THR A 78 -14.699 13.805 0.811 1.00 0.00 H new ATOM 0 HA THR A 78 -15.995 13.484 -1.799 1.00 0.00 H new ATOM 0 HB THR A 78 -13.393 14.852 -1.008 1.00 0.00 H new ATOM 0 HG1 THR A 78 -14.733 16.795 -1.118 1.00 0.00 H new ATOM 0 HG21 THR A 78 -13.657 16.082 -3.122 1.00 0.00 H new ATOM 0 HG22 THR A 78 -13.523 14.328 -3.390 1.00 0.00 H new ATOM 0 HG23 THR A 78 -15.110 15.125 -3.493 1.00 0.00 H new ATOM 1211 N TYR A 79 -13.647 11.599 -0.766 1.00 0.00 N ATOM 1212 CA TYR A 79 -12.773 10.490 -1.107 1.00 0.00 C ATOM 1213 C TYR A 79 -12.828 9.396 -0.050 1.00 0.00 C ATOM 1214 O TYR A 79 -13.274 9.622 1.080 1.00 0.00 O ATOM 1215 CB TYR A 79 -11.333 10.982 -1.302 1.00 0.00 C ATOM 1216 CG TYR A 79 -10.736 11.706 -0.111 1.00 0.00 C ATOM 1217 CD1 TYR A 79 -10.059 11.009 0.881 1.00 0.00 C ATOM 1218 CD2 TYR A 79 -10.833 13.090 0.011 1.00 0.00 C ATOM 1219 CE1 TYR A 79 -9.493 11.666 1.956 1.00 0.00 C ATOM 1220 CE2 TYR A 79 -10.272 13.752 1.087 1.00 0.00 C ATOM 1221 CZ TYR A 79 -9.602 13.035 2.055 1.00 0.00 C ATOM 1222 OH TYR A 79 -9.034 13.688 3.126 1.00 0.00 O ATOM 0 H TYR A 79 -13.809 11.723 0.233 1.00 0.00 H new ATOM 0 HA TYR A 79 -13.125 10.062 -2.046 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -10.702 10.126 -1.541 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -11.306 11.649 -2.164 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -9.974 9.935 0.811 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -11.355 13.655 -0.747 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -8.967 11.108 2.716 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -10.358 14.825 1.169 1.00 0.00 H new ATOM 0 HH TYR A 79 -9.199 14.651 3.047 1.00 0.00 H new ATOM 1232 N ALA A 80 -12.380 8.210 -0.431 1.00 0.00 N ATOM 1233 CA ALA A 80 -12.352 7.070 0.466 1.00 0.00 C ATOM 1234 C ALA A 80 -10.937 6.523 0.570 1.00 0.00 C ATOM 1235 O ALA A 80 -10.262 6.330 -0.441 1.00 0.00 O ATOM 1236 CB ALA A 80 -13.307 5.993 -0.018 1.00 0.00 C ATOM 0 H ALA A 80 -12.027 8.013 -1.368 1.00 0.00 H new ATOM 0 HA ALA A 80 -12.674 7.393 1.456 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -13.275 5.144 0.665 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -14.320 6.393 -0.052 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -13.012 5.667 -1.016 1.00 0.00 H new ATOM 1242 N GLN A 81 -10.489 6.283 1.788 1.00 0.00 N ATOM 1243 CA GLN A 81 -9.138 5.806 2.025 1.00 0.00 C ATOM 1244 C GLN A 81 -9.142 4.328 2.372 1.00 0.00 C ATOM 1245 O GLN A 81 -9.636 3.931 3.430 1.00 0.00 O ATOM 1246 CB GLN A 81 -8.493 6.599 3.159 1.00 0.00 C ATOM 1247 CG GLN A 81 -8.272 8.064 2.837 1.00 0.00 C ATOM 1248 CD GLN A 81 -7.988 8.891 4.072 1.00 0.00 C ATOM 1249 OE1 GLN A 81 -8.899 9.455 4.678 1.00 0.00 O ATOM 1250 NE2 GLN A 81 -6.727 8.952 4.469 1.00 0.00 N ATOM 0 H GLN A 81 -11.044 6.411 2.634 1.00 0.00 H new ATOM 0 HA GLN A 81 -8.561 5.948 1.111 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -9.122 6.523 4.046 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -7.535 6.143 3.408 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -7.439 8.158 2.141 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -9.154 8.459 2.334 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -6.001 8.470 3.938 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -6.481 9.481 5.306 1.00 0.00 H new ATOM 1259 N GLU A 82 -8.608 3.516 1.474 1.00 0.00 N ATOM 1260 CA GLU A 82 -8.444 2.099 1.738 1.00 0.00 C ATOM 1261 C GLU A 82 -7.101 1.872 2.416 1.00 0.00 C ATOM 1262 O GLU A 82 -6.070 1.714 1.757 1.00 0.00 O ATOM 1263 CB GLU A 82 -8.543 1.285 0.443 1.00 0.00 C ATOM 1264 CG GLU A 82 -8.456 -0.220 0.657 1.00 0.00 C ATOM 1265 CD GLU A 82 -8.573 -1.007 -0.633 1.00 0.00 C ATOM 1266 OE1 GLU A 82 -7.631 -0.956 -1.451 1.00 0.00 O ATOM 1267 OE2 GLU A 82 -9.605 -1.690 -0.822 1.00 0.00 O ATOM 0 H GLU A 82 -8.281 3.816 0.556 1.00 0.00 H new ATOM 0 HA GLU A 82 -9.244 1.763 2.397 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.486 1.519 -0.051 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -7.744 1.594 -0.232 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.508 -0.459 1.138 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -9.247 -0.531 1.340 1.00 0.00 H new ATOM 1274 N ASN A 83 -7.110 1.918 3.738 1.00 0.00 N ATOM 1275 CA ASN A 83 -5.897 1.727 4.514 1.00 0.00 C ATOM 1276 C ASN A 83 -5.634 0.245 4.680 1.00 0.00 C ATOM 1277 O ASN A 83 -6.262 -0.419 5.500 1.00 0.00 O ATOM 1278 CB ASN A 83 -6.013 2.405 5.886 1.00 0.00 C ATOM 1279 CG ASN A 83 -4.716 2.369 6.685 1.00 0.00 C ATOM 1280 OD1 ASN A 83 -3.907 1.449 6.566 1.00 0.00 O ATOM 1281 ND2 ASN A 83 -4.504 3.385 7.501 1.00 0.00 N ATOM 0 H ASN A 83 -7.946 2.086 4.297 1.00 0.00 H new ATOM 0 HA ASN A 83 -5.063 2.186 3.983 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -6.318 3.442 5.747 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -6.800 1.916 6.460 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -3.649 3.423 8.056 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -5.195 4.132 7.576 1.00 0.00 H new ATOM 1288 N VAL A 84 -4.720 -0.272 3.883 1.00 0.00 N ATOM 1289 CA VAL A 84 -4.395 -1.686 3.923 1.00 0.00 C ATOM 1290 C VAL A 84 -3.110 -1.914 4.710 1.00 0.00 C ATOM 1291 O VAL A 84 -2.014 -1.617 4.234 1.00 0.00 O ATOM 1292 CB VAL A 84 -4.236 -2.278 2.507 1.00 0.00 C ATOM 1293 CG1 VAL A 84 -4.064 -3.784 2.577 1.00 0.00 C ATOM 1294 CG2 VAL A 84 -5.422 -1.910 1.627 1.00 0.00 C ATOM 0 H VAL A 84 -4.188 0.266 3.199 1.00 0.00 H new ATOM 0 HA VAL A 84 -5.225 -2.193 4.416 1.00 0.00 H new ATOM 0 HB VAL A 84 -3.340 -1.850 2.058 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -3.953 -4.185 1.569 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -3.175 -4.022 3.162 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -4.940 -4.229 3.050 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -5.286 -2.339 0.634 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -6.338 -2.302 2.069 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -5.493 -0.825 1.547 1.00 0.00 H new ATOM 1304 N THR A 85 -3.248 -2.429 5.917 1.00 0.00 N ATOM 1305 CA THR A 85 -2.099 -2.700 6.754 1.00 0.00 C ATOM 1306 C THR A 85 -1.659 -4.144 6.561 1.00 0.00 C ATOM 1307 O THR A 85 -2.304 -5.067 7.053 1.00 0.00 O ATOM 1308 CB THR A 85 -2.416 -2.433 8.237 1.00 0.00 C ATOM 1309 OG1 THR A 85 -2.968 -1.116 8.380 1.00 0.00 O ATOM 1310 CG2 THR A 85 -1.162 -2.556 9.092 1.00 0.00 C ATOM 0 H THR A 85 -4.146 -2.668 6.338 1.00 0.00 H new ATOM 0 HA THR A 85 -1.290 -2.031 6.461 1.00 0.00 H new ATOM 0 HB THR A 85 -3.138 -3.176 8.575 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.171 -0.947 9.324 1.00 0.00 H new ATOM 0 HG21 THR A 85 -1.412 -2.363 10.135 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.754 -3.562 8.997 1.00 0.00 H new ATOM 0 HG23 THR A 85 -0.420 -1.831 8.757 1.00 0.00 H new ATOM 1318 N ILE A 86 -0.586 -4.335 5.810 1.00 0.00 N ATOM 1319 CA ILE A 86 -0.115 -5.670 5.474 1.00 0.00 C ATOM 1320 C ILE A 86 1.082 -6.053 6.335 1.00 0.00 C ATOM 1321 O ILE A 86 1.928 -5.217 6.636 1.00 0.00 O ATOM 1322 CB ILE A 86 0.287 -5.756 3.981 1.00 0.00 C ATOM 1323 CG1 ILE A 86 -0.888 -5.338 3.092 1.00 0.00 C ATOM 1324 CG2 ILE A 86 0.754 -7.162 3.620 1.00 0.00 C ATOM 1325 CD1 ILE A 86 -0.553 -5.298 1.615 1.00 0.00 C ATOM 0 H ILE A 86 -0.023 -3.579 5.420 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.934 -6.363 5.665 1.00 0.00 H new ATOM 0 HB ILE A 86 1.118 -5.071 3.812 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.715 -6.031 3.249 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -1.235 -4.353 3.403 1.00 0.00 H new ATOM 0 HG21 ILE A 86 1.030 -7.194 2.566 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.618 -7.426 4.230 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -0.052 -7.872 3.806 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -1.434 -4.994 1.050 1.00 0.00 H new ATOM 0 HD12 ILE A 86 0.252 -4.584 1.444 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.236 -6.288 1.287 1.00 0.00 H new ATOM 1337 N ASP A 87 1.130 -7.308 6.752 1.00 0.00 N ATOM 1338 CA ASP A 87 2.301 -7.846 7.434 1.00 0.00 C ATOM 1339 C ASP A 87 2.985 -8.860 6.527 1.00 0.00 C ATOM 1340 O ASP A 87 2.346 -9.787 6.038 1.00 0.00 O ATOM 1341 CB ASP A 87 1.904 -8.492 8.762 1.00 0.00 C ATOM 1342 CG ASP A 87 3.073 -9.168 9.452 1.00 0.00 C ATOM 1343 OD1 ASP A 87 3.786 -8.492 10.222 1.00 0.00 O ATOM 1344 OD2 ASP A 87 3.271 -10.383 9.235 1.00 0.00 O ATOM 0 H ASP A 87 0.370 -7.977 6.631 1.00 0.00 H new ATOM 0 HA ASP A 87 2.994 -7.034 7.654 1.00 0.00 H new ATOM 0 HB2 ASP A 87 1.487 -7.731 9.422 1.00 0.00 H new ATOM 0 HB3 ASP A 87 1.117 -9.226 8.585 1.00 0.00 H new ATOM 1349 N MET A 88 4.282 -8.684 6.314 1.00 0.00 N ATOM 1350 CA MET A 88 5.014 -9.475 5.328 1.00 0.00 C ATOM 1351 C MET A 88 5.520 -10.782 5.925 1.00 0.00 C ATOM 1352 O MET A 88 6.112 -11.602 5.223 1.00 0.00 O ATOM 1353 CB MET A 88 6.206 -8.685 4.782 1.00 0.00 C ATOM 1354 CG MET A 88 5.838 -7.409 4.042 1.00 0.00 C ATOM 1355 SD MET A 88 4.964 -7.716 2.495 1.00 0.00 S ATOM 1356 CE MET A 88 4.937 -6.064 1.798 1.00 0.00 C ATOM 0 H MET A 88 4.852 -7.999 6.811 1.00 0.00 H new ATOM 0 HA MET A 88 4.320 -9.702 4.519 1.00 0.00 H new ATOM 0 HB2 MET A 88 6.866 -8.430 5.611 1.00 0.00 H new ATOM 0 HB3 MET A 88 6.773 -9.328 4.109 1.00 0.00 H new ATOM 0 HG2 MET A 88 5.216 -6.789 4.687 1.00 0.00 H new ATOM 0 HG3 MET A 88 6.745 -6.842 3.834 1.00 0.00 H new ATOM 0 HE1 MET A 88 5.032 -6.125 0.714 1.00 0.00 H new ATOM 0 HE2 MET A 88 3.996 -5.577 2.053 1.00 0.00 H new ATOM 0 HE3 MET A 88 5.767 -5.485 2.203 1.00 0.00 H new ATOM 1366 N GLU A 89 5.291 -10.980 7.215 1.00 0.00 N ATOM 1367 CA GLU A 89 5.821 -12.150 7.895 1.00 0.00 C ATOM 1368 C GLU A 89 4.814 -13.289 7.885 1.00 0.00 C ATOM 1369 O GLU A 89 5.156 -14.434 7.593 1.00 0.00 O ATOM 1370 CB GLU A 89 6.204 -11.818 9.339 1.00 0.00 C ATOM 1371 CG GLU A 89 7.239 -10.713 9.467 1.00 0.00 C ATOM 1372 CD GLU A 89 7.892 -10.698 10.833 1.00 0.00 C ATOM 1373 OE1 GLU A 89 7.314 -10.115 11.774 1.00 0.00 O ATOM 1374 OE2 GLU A 89 8.988 -11.281 10.974 1.00 0.00 O ATOM 0 H GLU A 89 4.747 -10.352 7.806 1.00 0.00 H new ATOM 0 HA GLU A 89 6.715 -12.464 7.355 1.00 0.00 H new ATOM 0 HB2 GLU A 89 5.306 -11.525 9.884 1.00 0.00 H new ATOM 0 HB3 GLU A 89 6.588 -12.719 9.818 1.00 0.00 H new ATOM 0 HG2 GLU A 89 8.004 -10.843 8.702 1.00 0.00 H new ATOM 0 HG3 GLU A 89 6.764 -9.749 9.282 1.00 0.00 H new ATOM 1381 N LYS A 90 3.572 -12.970 8.201 1.00 0.00 N ATOM 1382 CA LYS A 90 2.542 -13.989 8.320 1.00 0.00 C ATOM 1383 C LYS A 90 1.644 -14.010 7.083 1.00 0.00 C ATOM 1384 O LYS A 90 0.700 -14.798 7.003 1.00 0.00 O ATOM 1385 CB LYS A 90 1.717 -13.738 9.588 1.00 0.00 C ATOM 1386 CG LYS A 90 0.802 -14.891 9.983 1.00 0.00 C ATOM 1387 CD LYS A 90 0.143 -14.638 11.330 1.00 0.00 C ATOM 1388 CE LYS A 90 -0.744 -15.797 11.750 1.00 0.00 C ATOM 1389 NZ LYS A 90 -1.925 -15.941 10.863 1.00 0.00 N ATOM 0 H LYS A 90 3.252 -12.018 8.379 1.00 0.00 H new ATOM 0 HA LYS A 90 3.021 -14.966 8.394 1.00 0.00 H new ATOM 0 HB2 LYS A 90 2.397 -13.531 10.414 1.00 0.00 H new ATOM 0 HB3 LYS A 90 1.111 -12.844 9.442 1.00 0.00 H new ATOM 0 HG2 LYS A 90 0.035 -15.027 9.221 1.00 0.00 H new ATOM 0 HG3 LYS A 90 1.377 -15.816 10.025 1.00 0.00 H new ATOM 0 HD2 LYS A 90 0.911 -14.476 12.086 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -0.451 -13.726 11.278 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.165 -16.720 11.736 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.078 -15.645 12.777 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.572 -16.652 11.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -2.417 -15.028 10.789 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -1.614 -16.245 9.918 1.00 0.00 H new ATOM 1403 N VAL A 91 1.937 -13.154 6.111 1.00 0.00 N ATOM 1404 CA VAL A 91 1.120 -13.075 4.903 1.00 0.00 C ATOM 1405 C VAL A 91 1.331 -14.305 4.015 1.00 0.00 C ATOM 1406 O VAL A 91 2.354 -14.990 4.106 1.00 0.00 O ATOM 1407 CB VAL A 91 1.405 -11.789 4.086 1.00 0.00 C ATOM 1408 CG1 VAL A 91 2.724 -11.886 3.339 1.00 0.00 C ATOM 1409 CG2 VAL A 91 0.275 -11.489 3.114 1.00 0.00 C ATOM 0 H VAL A 91 2.727 -12.509 6.133 1.00 0.00 H new ATOM 0 HA VAL A 91 0.082 -13.043 5.233 1.00 0.00 H new ATOM 0 HB VAL A 91 1.474 -10.967 4.799 1.00 0.00 H new ATOM 0 HG11 VAL A 91 2.892 -10.967 2.777 1.00 0.00 H new ATOM 0 HG12 VAL A 91 3.536 -12.029 4.052 1.00 0.00 H new ATOM 0 HG13 VAL A 91 2.692 -12.731 2.652 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.506 -10.581 2.557 1.00 0.00 H new ATOM 0 HG22 VAL A 91 0.161 -12.322 2.420 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -0.653 -11.349 3.668 1.00 0.00 H new ATOM 1419 N ASP A 92 0.345 -14.583 3.177 1.00 0.00 N ATOM 1420 CA ASP A 92 0.425 -15.673 2.219 1.00 0.00 C ATOM 1421 C ASP A 92 0.209 -15.120 0.819 1.00 0.00 C ATOM 1422 O ASP A 92 -0.851 -14.569 0.517 1.00 0.00 O ATOM 1423 CB ASP A 92 -0.618 -16.743 2.543 1.00 0.00 C ATOM 1424 CG ASP A 92 -0.575 -17.914 1.582 1.00 0.00 C ATOM 1425 OD1 ASP A 92 0.266 -18.817 1.772 1.00 0.00 O ATOM 1426 OD2 ASP A 92 -1.390 -17.947 0.641 1.00 0.00 O ATOM 0 H ASP A 92 -0.531 -14.061 3.142 1.00 0.00 H new ATOM 0 HA ASP A 92 1.410 -16.137 2.275 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.457 -17.106 3.558 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.611 -16.295 2.519 1.00 0.00 H new ATOM 1431 N PHE A 93 1.213 -15.253 -0.031 1.00 0.00 N ATOM 1432 CA PHE A 93 1.175 -14.647 -1.355 1.00 0.00 C ATOM 1433 C PHE A 93 0.276 -15.440 -2.294 1.00 0.00 C ATOM 1434 O PHE A 93 -0.180 -14.928 -3.315 1.00 0.00 O ATOM 1435 CB PHE A 93 2.583 -14.531 -1.936 1.00 0.00 C ATOM 1436 CG PHE A 93 3.498 -13.671 -1.110 1.00 0.00 C ATOM 1437 CD1 PHE A 93 3.491 -12.293 -1.252 1.00 0.00 C ATOM 1438 CD2 PHE A 93 4.359 -14.241 -0.186 1.00 0.00 C ATOM 1439 CE1 PHE A 93 4.327 -11.500 -0.490 1.00 0.00 C ATOM 1440 CE2 PHE A 93 5.198 -13.453 0.578 1.00 0.00 C ATOM 1441 CZ PHE A 93 5.181 -12.080 0.427 1.00 0.00 C ATOM 0 H PHE A 93 2.066 -15.775 0.170 1.00 0.00 H new ATOM 0 HA PHE A 93 0.759 -13.645 -1.253 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.015 -15.528 -2.025 1.00 0.00 H new ATOM 0 HB3 PHE A 93 2.520 -14.119 -2.943 1.00 0.00 H new ATOM 0 HD1 PHE A 93 2.824 -11.833 -1.967 1.00 0.00 H new ATOM 0 HD2 PHE A 93 4.374 -15.314 -0.062 1.00 0.00 H new ATOM 0 HE1 PHE A 93 4.313 -10.427 -0.611 1.00 0.00 H new ATOM 0 HE2 PHE A 93 5.867 -13.910 1.293 1.00 0.00 H new ATOM 0 HZ PHE A 93 5.834 -11.462 1.025 1.00 0.00 H new ATOM 1451 N LYS A 94 0.021 -16.691 -1.935 1.00 0.00 N ATOM 1452 CA LYS A 94 -0.930 -17.518 -2.665 1.00 0.00 C ATOM 1453 C LYS A 94 -2.335 -16.933 -2.529 1.00 0.00 C ATOM 1454 O LYS A 94 -3.133 -16.969 -3.463 1.00 0.00 O ATOM 1455 CB LYS A 94 -0.886 -18.955 -2.138 1.00 0.00 C ATOM 1456 CG LYS A 94 -1.922 -19.884 -2.756 1.00 0.00 C ATOM 1457 CD LYS A 94 -1.862 -21.287 -2.155 1.00 0.00 C ATOM 1458 CE LYS A 94 -2.394 -21.342 -0.721 1.00 0.00 C ATOM 1459 NZ LYS A 94 -1.512 -20.643 0.250 1.00 0.00 N ATOM 0 H LYS A 94 0.461 -17.156 -1.141 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.661 -17.532 -3.721 1.00 0.00 H new ATOM 0 HB2 LYS A 94 0.107 -19.366 -2.320 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.030 -18.937 -1.058 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -2.918 -19.467 -2.606 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -1.760 -19.943 -3.832 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -2.440 -21.969 -2.778 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.831 -21.639 -2.169 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -3.387 -20.894 -0.690 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -2.504 -22.384 -0.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -1.514 -21.158 1.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -0.543 -20.606 -0.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.862 -19.675 0.402 1.00 0.00 H new ATOM 1473 N ALA A 95 -2.622 -16.388 -1.353 1.00 0.00 N ATOM 1474 CA ALA A 95 -3.884 -15.701 -1.111 1.00 0.00 C ATOM 1475 C ALA A 95 -3.902 -14.334 -1.791 1.00 0.00 C ATOM 1476 O ALA A 95 -4.968 -13.807 -2.109 1.00 0.00 O ATOM 1477 CB ALA A 95 -4.130 -15.555 0.382 1.00 0.00 C ATOM 0 H ALA A 95 -1.995 -16.409 -0.549 1.00 0.00 H new ATOM 0 HA ALA A 95 -4.685 -16.303 -1.540 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -5.076 -15.040 0.546 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -4.169 -16.542 0.842 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -3.321 -14.978 0.829 1.00 0.00 H new ATOM 1483 N LEU A 96 -2.717 -13.779 -2.027 1.00 0.00 N ATOM 1484 CA LEU A 96 -2.575 -12.475 -2.676 1.00 0.00 C ATOM 1485 C LEU A 96 -2.634 -12.600 -4.200 1.00 0.00 C ATOM 1486 O LEU A 96 -2.522 -11.600 -4.915 1.00 0.00 O ATOM 1487 CB LEU A 96 -1.254 -11.810 -2.270 1.00 0.00 C ATOM 1488 CG LEU A 96 -1.187 -11.280 -0.837 1.00 0.00 C ATOM 1489 CD1 LEU A 96 0.202 -10.743 -0.532 1.00 0.00 C ATOM 1490 CD2 LEU A 96 -2.226 -10.191 -0.622 1.00 0.00 C ATOM 0 H LEU A 96 -1.830 -14.216 -1.776 1.00 0.00 H new ATOM 0 HA LEU A 96 -3.409 -11.856 -2.345 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.449 -12.531 -2.408 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -1.061 -10.982 -2.953 1.00 0.00 H new ATOM 0 HG LEU A 96 -1.400 -12.105 -0.158 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.231 -10.370 0.492 1.00 0.00 H new ATOM 0 HD12 LEU A 96 0.935 -11.542 -0.648 1.00 0.00 H new ATOM 0 HD13 LEU A 96 0.438 -9.932 -1.221 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -2.164 -9.826 0.403 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -2.039 -9.368 -1.312 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -3.221 -10.597 -0.803 1.00 0.00 H new ATOM 1502 N GLN A 97 -2.810 -13.828 -4.678 1.00 0.00 N ATOM 1503 CA GLN A 97 -2.833 -14.128 -6.109 1.00 0.00 C ATOM 1504 C GLN A 97 -3.829 -13.248 -6.863 1.00 0.00 C ATOM 1505 O GLN A 97 -3.481 -12.613 -7.859 1.00 0.00 O ATOM 1506 CB GLN A 97 -3.185 -15.602 -6.300 1.00 0.00 C ATOM 1507 CG GLN A 97 -3.229 -16.063 -7.747 1.00 0.00 C ATOM 1508 CD GLN A 97 -3.630 -17.518 -7.858 1.00 0.00 C ATOM 1509 OE1 GLN A 97 -4.376 -18.033 -7.025 1.00 0.00 O ATOM 1510 NE2 GLN A 97 -3.150 -18.192 -8.888 1.00 0.00 N ATOM 0 H GLN A 97 -2.941 -14.647 -4.084 1.00 0.00 H new ATOM 0 HA GLN A 97 -1.845 -13.918 -6.519 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -2.456 -16.208 -5.762 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -4.156 -15.792 -5.843 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -3.935 -15.447 -8.304 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -2.250 -15.919 -8.205 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -2.534 -17.730 -9.557 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -3.395 -19.174 -9.014 1.00 0.00 H new ATOM 1519 N GLY A 98 -5.064 -13.209 -6.386 1.00 0.00 N ATOM 1520 CA GLY A 98 -6.086 -12.418 -7.041 1.00 0.00 C ATOM 1521 C GLY A 98 -6.256 -11.051 -6.412 1.00 0.00 C ATOM 1522 O GLY A 98 -7.272 -10.386 -6.619 1.00 0.00 O ATOM 0 H GLY A 98 -5.378 -13.712 -5.556 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -5.830 -12.300 -8.094 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -7.035 -12.953 -7.002 1.00 0.00 H new ATOM 1526 N ILE A 99 -5.266 -10.628 -5.644 1.00 0.00 N ATOM 1527 CA ILE A 99 -5.328 -9.344 -4.966 1.00 0.00 C ATOM 1528 C ILE A 99 -4.309 -8.374 -5.546 1.00 0.00 C ATOM 1529 O ILE A 99 -4.591 -7.189 -5.731 1.00 0.00 O ATOM 1530 CB ILE A 99 -5.060 -9.498 -3.456 1.00 0.00 C ATOM 1531 CG1 ILE A 99 -5.994 -10.546 -2.848 1.00 0.00 C ATOM 1532 CG2 ILE A 99 -5.229 -8.162 -2.750 1.00 0.00 C ATOM 1533 CD1 ILE A 99 -5.726 -10.804 -1.384 1.00 0.00 C ATOM 0 H ILE A 99 -4.409 -11.155 -5.474 1.00 0.00 H new ATOM 0 HA ILE A 99 -6.334 -8.951 -5.116 1.00 0.00 H new ATOM 0 HB ILE A 99 -4.032 -9.835 -3.321 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -7.026 -10.217 -2.969 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -5.890 -11.480 -3.400 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -5.037 -8.287 -1.684 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -4.525 -7.440 -3.164 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -6.247 -7.800 -2.895 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -6.422 -11.557 -1.014 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -4.704 -11.162 -1.259 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -5.858 -9.880 -0.822 1.00 0.00 H new ATOM 1648 N ASP A 108 9.698 -11.570 -7.151 1.00 0.00 N ATOM 1649 CA ASP A 108 9.536 -10.563 -6.128 1.00 0.00 C ATOM 1650 C ASP A 108 8.570 -11.077 -5.070 1.00 0.00 C ATOM 1651 O ASP A 108 8.955 -11.344 -3.933 1.00 0.00 O ATOM 1652 CB ASP A 108 9.011 -9.278 -6.777 1.00 0.00 C ATOM 1653 CG ASP A 108 8.744 -8.167 -5.788 1.00 0.00 C ATOM 1654 OD1 ASP A 108 7.643 -8.137 -5.218 1.00 0.00 O ATOM 1655 OD2 ASP A 108 9.629 -7.311 -5.612 1.00 0.00 O ATOM 0 HA ASP A 108 10.490 -10.347 -5.647 1.00 0.00 H new ATOM 0 HB2 ASP A 108 9.735 -8.931 -7.514 1.00 0.00 H new ATOM 0 HB3 ASP A 108 8.090 -9.503 -7.316 1.00 0.00 H new ATOM 1660 N ALA A 109 7.328 -11.286 -5.480 1.00 0.00 N ATOM 1661 CA ALA A 109 6.285 -11.717 -4.562 1.00 0.00 C ATOM 1662 C ALA A 109 6.336 -13.222 -4.309 1.00 0.00 C ATOM 1663 O ALA A 109 6.031 -13.682 -3.209 1.00 0.00 O ATOM 1664 CB ALA A 109 4.923 -11.319 -5.106 1.00 0.00 C ATOM 0 H ALA A 109 7.018 -11.164 -6.444 1.00 0.00 H new ATOM 0 HA ALA A 109 6.454 -11.221 -3.606 1.00 0.00 H new ATOM 0 HB1 ALA A 109 4.146 -11.644 -4.414 1.00 0.00 H new ATOM 0 HB2 ALA A 109 4.878 -10.236 -5.218 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.766 -11.791 -6.076 1.00 0.00 H new ATOM 1670 N LYS A 110 6.733 -13.986 -5.323 1.00 0.00 N ATOM 1671 CA LYS A 110 6.726 -15.447 -5.224 1.00 0.00 C ATOM 1672 C LYS A 110 7.809 -15.959 -4.278 1.00 0.00 C ATOM 1673 O LYS A 110 7.617 -16.965 -3.593 1.00 0.00 O ATOM 1674 CB LYS A 110 6.913 -16.098 -6.600 1.00 0.00 C ATOM 1675 CG LYS A 110 5.778 -15.834 -7.575 1.00 0.00 C ATOM 1676 CD LYS A 110 6.019 -16.541 -8.902 1.00 0.00 C ATOM 1677 CE LYS A 110 4.887 -16.290 -9.884 1.00 0.00 C ATOM 1678 NZ LYS A 110 5.098 -16.999 -11.177 1.00 0.00 N ATOM 0 H LYS A 110 7.062 -13.623 -6.218 1.00 0.00 H new ATOM 0 HA LYS A 110 5.752 -15.724 -4.822 1.00 0.00 H new ATOM 0 HB2 LYS A 110 7.844 -15.736 -7.037 1.00 0.00 H new ATOM 0 HB3 LYS A 110 7.020 -17.175 -6.468 1.00 0.00 H new ATOM 0 HG2 LYS A 110 4.837 -16.175 -7.143 1.00 0.00 H new ATOM 0 HG3 LYS A 110 5.681 -14.761 -7.743 1.00 0.00 H new ATOM 0 HD2 LYS A 110 6.959 -16.196 -9.333 1.00 0.00 H new ATOM 0 HD3 LYS A 110 6.122 -17.613 -8.731 1.00 0.00 H new ATOM 0 HE2 LYS A 110 3.946 -16.616 -9.442 1.00 0.00 H new ATOM 0 HE3 LYS A 110 4.799 -15.219 -10.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 4.302 -16.800 -11.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 5.983 -16.670 -11.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 5.156 -18.023 -11.006 1.00 0.00 H new ATOM 1692 N LYS A 111 8.943 -15.273 -4.240 1.00 0.00 N ATOM 1693 CA LYS A 111 10.078 -15.747 -3.456 1.00 0.00 C ATOM 1694 C LYS A 111 10.176 -15.043 -2.109 1.00 0.00 C ATOM 1695 O LYS A 111 10.771 -15.573 -1.167 1.00 0.00 O ATOM 1696 CB LYS A 111 11.378 -15.583 -4.244 1.00 0.00 C ATOM 1697 CG LYS A 111 11.478 -16.534 -5.426 1.00 0.00 C ATOM 1698 CD LYS A 111 12.821 -16.431 -6.130 1.00 0.00 C ATOM 1699 CE LYS A 111 12.976 -17.523 -7.177 1.00 0.00 C ATOM 1700 NZ LYS A 111 14.285 -17.454 -7.878 1.00 0.00 N ATOM 0 H LYS A 111 9.102 -14.396 -4.736 1.00 0.00 H new ATOM 0 HA LYS A 111 9.916 -16.806 -3.257 1.00 0.00 H new ATOM 0 HB2 LYS A 111 11.452 -14.556 -4.603 1.00 0.00 H new ATOM 0 HB3 LYS A 111 12.224 -15.750 -3.578 1.00 0.00 H new ATOM 0 HG2 LYS A 111 11.327 -17.557 -5.081 1.00 0.00 H new ATOM 0 HG3 LYS A 111 10.680 -16.316 -6.135 1.00 0.00 H new ATOM 0 HD2 LYS A 111 12.913 -15.453 -6.603 1.00 0.00 H new ATOM 0 HD3 LYS A 111 13.625 -16.508 -5.398 1.00 0.00 H new ATOM 0 HE2 LYS A 111 12.873 -18.498 -6.700 1.00 0.00 H new ATOM 0 HE3 LYS A 111 12.171 -17.439 -7.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 14.343 -18.218 -8.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 14.374 -16.535 -8.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 15.055 -17.560 -7.187 1.00 0.00 H new ATOM 1714 N GLY A 112 9.595 -13.861 -2.008 1.00 0.00 N ATOM 1715 CA GLY A 112 9.606 -13.148 -0.749 1.00 0.00 C ATOM 1716 C GLY A 112 9.987 -11.697 -0.916 1.00 0.00 C ATOM 1717 O GLY A 112 10.965 -11.376 -1.595 1.00 0.00 O ATOM 0 H GLY A 112 9.117 -13.382 -2.772 1.00 0.00 H new ATOM 0 HA2 GLY A 112 8.620 -13.212 -0.289 1.00 0.00 H new ATOM 0 HA3 GLY A 112 10.307 -13.629 -0.067 1.00 0.00 H new ATOM 1721 N ILE A 113 9.212 -10.821 -0.298 1.00 0.00 N ATOM 1722 CA ILE A 113 9.433 -9.392 -0.414 1.00 0.00 C ATOM 1723 C ILE A 113 10.579 -8.948 0.486 1.00 0.00 C ATOM 1724 O ILE A 113 10.462 -8.956 1.714 1.00 0.00 O ATOM 1725 CB ILE A 113 8.161 -8.594 -0.052 1.00 0.00 C ATOM 1726 CG1 ILE A 113 6.972 -9.062 -0.900 1.00 0.00 C ATOM 1727 CG2 ILE A 113 8.396 -7.101 -0.233 1.00 0.00 C ATOM 1728 CD1 ILE A 113 7.220 -9.007 -2.394 1.00 0.00 C ATOM 0 H ILE A 113 8.421 -11.078 0.292 1.00 0.00 H new ATOM 0 HA ILE A 113 9.690 -9.189 -1.454 1.00 0.00 H new ATOM 0 HB ILE A 113 7.927 -8.778 0.996 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.721 -10.085 -0.621 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.105 -8.445 -0.663 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.489 -6.556 0.027 1.00 0.00 H new ATOM 0 HG22 ILE A 113 9.211 -6.780 0.416 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.657 -6.897 -1.271 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.332 -9.354 -2.923 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.441 -7.981 -2.689 1.00 0.00 H new ATOM 0 HD13 ILE A 113 8.066 -9.647 -2.646 1.00 0.00 H new ATOM 1740 N THR A 114 11.689 -8.580 -0.126 1.00 0.00 N ATOM 1741 CA THR A 114 12.824 -8.071 0.616 1.00 0.00 C ATOM 1742 C THR A 114 13.060 -6.613 0.260 1.00 0.00 C ATOM 1743 O THR A 114 12.326 -6.038 -0.551 1.00 0.00 O ATOM 1744 CB THR A 114 14.104 -8.883 0.341 1.00 0.00 C ATOM 1745 OG1 THR A 114 14.462 -8.791 -1.041 1.00 0.00 O ATOM 1746 CG2 THR A 114 13.912 -10.342 0.726 1.00 0.00 C ATOM 0 H THR A 114 11.828 -8.625 -1.136 1.00 0.00 H new ATOM 0 HA THR A 114 12.592 -8.164 1.677 1.00 0.00 H new ATOM 0 HB THR A 114 14.907 -8.465 0.948 1.00 0.00 H new ATOM 0 HG1 THR A 114 14.007 -9.498 -1.544 1.00 0.00 H new ATOM 0 HG21 THR A 114 14.829 -10.896 0.523 1.00 0.00 H new ATOM 0 HG22 THR A 114 13.675 -10.410 1.788 1.00 0.00 H new ATOM 0 HG23 THR A 114 13.095 -10.767 0.144 1.00 0.00 H new ATOM 1754 N MET A 115 14.079 -6.020 0.860 1.00 0.00 N ATOM 1755 CA MET A 115 14.377 -4.612 0.649 1.00 0.00 C ATOM 1756 C MET A 115 14.821 -4.380 -0.793 1.00 0.00 C ATOM 1757 O MET A 115 14.407 -3.412 -1.433 1.00 0.00 O ATOM 1758 CB MET A 115 15.457 -4.156 1.635 1.00 0.00 C ATOM 1759 CG MET A 115 15.278 -2.732 2.133 1.00 0.00 C ATOM 1760 SD MET A 115 15.626 -1.498 0.875 1.00 0.00 S ATOM 1761 CE MET A 115 14.913 -0.046 1.637 1.00 0.00 C ATOM 0 H MET A 115 14.717 -6.494 1.500 1.00 0.00 H new ATOM 0 HA MET A 115 13.477 -4.023 0.826 1.00 0.00 H new ATOM 0 HB2 MET A 115 15.462 -4.831 2.491 1.00 0.00 H new ATOM 0 HB3 MET A 115 16.432 -4.242 1.155 1.00 0.00 H new ATOM 0 HG2 MET A 115 14.255 -2.603 2.487 1.00 0.00 H new ATOM 0 HG3 MET A 115 15.934 -2.567 2.987 1.00 0.00 H new ATOM 0 HE1 MET A 115 14.705 0.702 0.872 1.00 0.00 H new ATOM 0 HE2 MET A 115 13.985 -0.318 2.140 1.00 0.00 H new ATOM 0 HE3 MET A 115 15.614 0.364 2.364 1.00 0.00 H new ATOM 1771 N ALA A 116 15.646 -5.291 -1.303 1.00 0.00 N ATOM 1772 CA ALA A 116 16.123 -5.224 -2.683 1.00 0.00 C ATOM 1773 C ALA A 116 14.962 -5.206 -3.675 1.00 0.00 C ATOM 1774 O ALA A 116 14.892 -4.337 -4.547 1.00 0.00 O ATOM 1775 CB ALA A 116 17.043 -6.398 -2.976 1.00 0.00 C ATOM 0 H ALA A 116 16.001 -6.090 -0.777 1.00 0.00 H new ATOM 0 HA ALA A 116 16.678 -4.293 -2.800 1.00 0.00 H new ATOM 0 HB1 ALA A 116 17.392 -6.338 -4.007 1.00 0.00 H new ATOM 0 HB2 ALA A 116 17.898 -6.368 -2.301 1.00 0.00 H new ATOM 0 HB3 ALA A 116 16.499 -7.331 -2.831 1.00 0.00 H new ATOM 1781 N GLN A 117 14.057 -6.172 -3.533 1.00 0.00 N ATOM 1782 CA GLN A 117 12.882 -6.266 -4.395 1.00 0.00 C ATOM 1783 C GLN A 117 12.052 -4.994 -4.341 1.00 0.00 C ATOM 1784 O GLN A 117 11.936 -4.297 -5.339 1.00 0.00 O ATOM 1785 CB GLN A 117 12.023 -7.474 -4.011 1.00 0.00 C ATOM 1786 CG GLN A 117 12.437 -8.768 -4.696 1.00 0.00 C ATOM 1787 CD GLN A 117 13.612 -9.451 -4.031 1.00 0.00 C ATOM 1788 OE1 GLN A 117 13.319 -10.377 -3.133 1.00 0.00 O flip ATOM 1789 NE2 GLN A 117 14.770 -9.168 -4.340 1.00 0.00 N flip ATOM 0 H GLN A 117 14.116 -6.904 -2.825 1.00 0.00 H new ATOM 0 HA GLN A 117 13.235 -6.397 -5.418 1.00 0.00 H new ATOM 0 HB2 GLN A 117 12.073 -7.614 -2.931 1.00 0.00 H new ATOM 0 HB3 GLN A 117 10.983 -7.261 -4.257 1.00 0.00 H new ATOM 0 HG2 GLN A 117 11.588 -9.452 -4.708 1.00 0.00 H new ATOM 0 HG3 GLN A 117 12.690 -8.556 -5.735 1.00 0.00 H new ATOM 0 HE21 GLN A 117 14.950 -8.446 -5.038 1.00 0.00 H new ATOM 0 HE22 GLN A 117 15.549 -9.655 -3.898 1.00 0.00 H new ATOM 1798 N MET A 118 11.513 -4.693 -3.170 1.00 0.00 N ATOM 1799 CA MET A 118 10.653 -3.526 -2.968 1.00 0.00 C ATOM 1800 C MET A 118 11.244 -2.253 -3.582 1.00 0.00 C ATOM 1801 O MET A 118 10.549 -1.506 -4.268 1.00 0.00 O ATOM 1802 CB MET A 118 10.406 -3.330 -1.472 1.00 0.00 C ATOM 1803 CG MET A 118 9.460 -2.185 -1.142 1.00 0.00 C ATOM 1804 SD MET A 118 7.873 -2.318 -1.986 1.00 0.00 S ATOM 1805 CE MET A 118 7.408 -4.003 -1.594 1.00 0.00 C ATOM 0 H MET A 118 11.657 -5.250 -2.327 1.00 0.00 H new ATOM 0 HA MET A 118 9.709 -3.714 -3.479 1.00 0.00 H new ATOM 0 HB2 MET A 118 10.000 -4.253 -1.058 1.00 0.00 H new ATOM 0 HB3 MET A 118 11.361 -3.152 -0.978 1.00 0.00 H new ATOM 0 HG2 MET A 118 9.292 -2.159 -0.065 1.00 0.00 H new ATOM 0 HG3 MET A 118 9.932 -1.241 -1.414 1.00 0.00 H new ATOM 0 HE1 MET A 118 6.354 -4.154 -1.829 1.00 0.00 H new ATOM 0 HE2 MET A 118 8.013 -4.693 -2.182 1.00 0.00 H new ATOM 0 HE3 MET A 118 7.573 -4.189 -0.533 1.00 0.00 H new ATOM 1815 N GLU A 119 12.529 -2.016 -3.347 1.00 0.00 N ATOM 1816 CA GLU A 119 13.198 -0.840 -3.895 1.00 0.00 C ATOM 1817 C GLU A 119 13.204 -0.852 -5.419 1.00 0.00 C ATOM 1818 O GLU A 119 12.611 0.018 -6.059 1.00 0.00 O ATOM 1819 CB GLU A 119 14.632 -0.754 -3.376 1.00 0.00 C ATOM 1820 CG GLU A 119 14.732 -0.215 -1.964 1.00 0.00 C ATOM 1821 CD GLU A 119 14.389 1.254 -1.885 1.00 0.00 C ATOM 1822 OE1 GLU A 119 15.272 2.086 -2.178 1.00 0.00 O ATOM 1823 OE2 GLU A 119 13.240 1.587 -1.540 1.00 0.00 O ATOM 0 H GLU A 119 13.128 -2.619 -2.783 1.00 0.00 H new ATOM 0 HA GLU A 119 12.638 0.035 -3.566 1.00 0.00 H new ATOM 0 HB2 GLU A 119 15.083 -1.746 -3.411 1.00 0.00 H new ATOM 0 HB3 GLU A 119 15.213 -0.116 -4.042 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.062 -0.778 -1.314 1.00 0.00 H new ATOM 0 HG3 GLU A 119 15.744 -0.370 -1.589 1.00 0.00 H new ATOM 1830 N LEU A 120 13.861 -1.847 -5.996 1.00 0.00 N ATOM 1831 CA LEU A 120 14.029 -1.922 -7.443 1.00 0.00 C ATOM 1832 C LEU A 120 12.682 -2.019 -8.151 1.00 0.00 C ATOM 1833 O LEU A 120 12.492 -1.472 -9.236 1.00 0.00 O ATOM 1834 CB LEU A 120 14.900 -3.130 -7.800 1.00 0.00 C ATOM 1835 CG LEU A 120 16.337 -3.077 -7.269 1.00 0.00 C ATOM 1836 CD1 LEU A 120 17.093 -4.343 -7.645 1.00 0.00 C ATOM 1837 CD2 LEU A 120 17.058 -1.846 -7.802 1.00 0.00 C ATOM 0 H LEU A 120 14.289 -2.618 -5.483 1.00 0.00 H new ATOM 0 HA LEU A 120 14.519 -1.008 -7.779 1.00 0.00 H new ATOM 0 HB2 LEU A 120 14.420 -4.030 -7.415 1.00 0.00 H new ATOM 0 HB3 LEU A 120 14.934 -3.226 -8.885 1.00 0.00 H new ATOM 0 HG LEU A 120 16.299 -3.010 -6.182 1.00 0.00 H new ATOM 0 HD11 LEU A 120 18.111 -4.287 -7.259 1.00 0.00 H new ATOM 0 HD12 LEU A 120 16.589 -5.209 -7.215 1.00 0.00 H new ATOM 0 HD13 LEU A 120 17.121 -4.441 -8.730 1.00 0.00 H new ATOM 0 HD21 LEU A 120 18.077 -1.825 -7.415 1.00 0.00 H new ATOM 0 HD22 LEU A 120 17.085 -1.883 -8.891 1.00 0.00 H new ATOM 0 HD23 LEU A 120 16.530 -0.948 -7.482 1.00 0.00 H new ATOM 1849 N VAL A 121 11.749 -2.693 -7.511 1.00 0.00 N ATOM 1850 CA VAL A 121 10.443 -2.958 -8.082 1.00 0.00 C ATOM 1851 C VAL A 121 9.531 -1.724 -8.039 1.00 0.00 C ATOM 1852 O VAL A 121 8.836 -1.427 -9.014 1.00 0.00 O ATOM 1853 CB VAL A 121 9.803 -4.168 -7.362 1.00 0.00 C ATOM 1854 CG1 VAL A 121 8.317 -3.996 -7.151 1.00 0.00 C ATOM 1855 CG2 VAL A 121 10.077 -5.444 -8.138 1.00 0.00 C ATOM 0 H VAL A 121 11.876 -3.075 -6.574 1.00 0.00 H new ATOM 0 HA VAL A 121 10.570 -3.201 -9.137 1.00 0.00 H new ATOM 0 HB VAL A 121 10.262 -4.234 -6.376 1.00 0.00 H new ATOM 0 HG11 VAL A 121 7.918 -4.873 -6.642 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.136 -3.110 -6.543 1.00 0.00 H new ATOM 0 HG13 VAL A 121 7.823 -3.881 -8.116 1.00 0.00 H new ATOM 0 HG21 VAL A 121 9.622 -6.289 -7.621 1.00 0.00 H new ATOM 0 HG22 VAL A 121 9.653 -5.359 -9.139 1.00 0.00 H new ATOM 0 HG23 VAL A 121 11.153 -5.601 -8.212 1.00 0.00 H new ATOM 1865 N MET A 122 9.547 -0.986 -6.936 1.00 0.00 N ATOM 1866 CA MET A 122 8.709 0.205 -6.819 1.00 0.00 C ATOM 1867 C MET A 122 9.214 1.324 -7.718 1.00 0.00 C ATOM 1868 O MET A 122 8.424 2.100 -8.261 1.00 0.00 O ATOM 1869 CB MET A 122 8.622 0.666 -5.364 1.00 0.00 C ATOM 1870 CG MET A 122 7.330 0.242 -4.684 1.00 0.00 C ATOM 1871 SD MET A 122 6.831 -1.433 -5.130 1.00 0.00 S ATOM 1872 CE MET A 122 5.262 -1.567 -4.281 1.00 0.00 C ATOM 0 H MET A 122 10.123 -1.186 -6.118 1.00 0.00 H new ATOM 0 HA MET A 122 7.705 -0.057 -7.151 1.00 0.00 H new ATOM 0 HB2 MET A 122 9.468 0.261 -4.809 1.00 0.00 H new ATOM 0 HB3 MET A 122 8.706 1.752 -5.327 1.00 0.00 H new ATOM 0 HG2 MET A 122 7.455 0.305 -3.603 1.00 0.00 H new ATOM 0 HG3 MET A 122 6.536 0.938 -4.954 1.00 0.00 H new ATOM 0 HE1 MET A 122 4.900 -2.593 -4.345 1.00 0.00 H new ATOM 0 HE2 MET A 122 5.390 -1.292 -3.234 1.00 0.00 H new ATOM 0 HE3 MET A 122 4.538 -0.898 -4.746 1.00 0.00 H new ATOM 1882 N LYS A 123 10.525 1.402 -7.894 1.00 0.00 N ATOM 1883 CA LYS A 123 11.095 2.367 -8.825 1.00 0.00 C ATOM 1884 C LYS A 123 10.846 1.919 -10.263 1.00 0.00 C ATOM 1885 O LYS A 123 10.792 2.739 -11.179 1.00 0.00 O ATOM 1886 CB LYS A 123 12.595 2.571 -8.572 1.00 0.00 C ATOM 1887 CG LYS A 123 12.910 3.542 -7.434 1.00 0.00 C ATOM 1888 CD LYS A 123 12.537 2.979 -6.070 1.00 0.00 C ATOM 1889 CE LYS A 123 12.817 3.975 -4.956 1.00 0.00 C ATOM 1890 NZ LYS A 123 12.594 3.381 -3.610 1.00 0.00 N ATOM 0 H LYS A 123 11.207 0.817 -7.412 1.00 0.00 H new ATOM 0 HA LYS A 123 10.602 3.326 -8.664 1.00 0.00 H new ATOM 0 HB2 LYS A 123 13.049 1.606 -8.348 1.00 0.00 H new ATOM 0 HB3 LYS A 123 13.060 2.937 -9.487 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.974 3.780 -7.447 1.00 0.00 H new ATOM 0 HG3 LYS A 123 12.372 4.476 -7.598 1.00 0.00 H new ATOM 0 HD2 LYS A 123 11.480 2.712 -6.063 1.00 0.00 H new ATOM 0 HD3 LYS A 123 13.098 2.062 -5.889 1.00 0.00 H new ATOM 0 HE2 LYS A 123 13.847 4.325 -5.032 1.00 0.00 H new ATOM 0 HE3 LYS A 123 12.174 4.847 -5.079 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 13.000 4.005 -2.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 11.573 3.273 -3.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 13.053 2.449 -3.561 1.00 0.00 H new ATOM 1904 N ALA A 124 10.673 0.615 -10.444 1.00 0.00 N ATOM 1905 CA ALA A 124 10.326 0.054 -11.744 1.00 0.00 C ATOM 1906 C ALA A 124 8.916 0.477 -12.146 1.00 0.00 C ATOM 1907 O ALA A 124 8.687 0.939 -13.266 1.00 0.00 O ATOM 1908 CB ALA A 124 10.435 -1.465 -11.703 1.00 0.00 C ATOM 0 H ALA A 124 10.768 -0.078 -9.701 1.00 0.00 H new ATOM 0 HA ALA A 124 11.025 0.435 -12.489 1.00 0.00 H new ATOM 0 HB1 ALA A 124 10.174 -1.875 -12.679 1.00 0.00 H new ATOM 0 HB2 ALA A 124 11.457 -1.750 -11.451 1.00 0.00 H new ATOM 0 HB3 ALA A 124 9.753 -1.859 -10.950 1.00 0.00 H new ATOM 1914 N ALA A 125 7.977 0.326 -11.215 1.00 0.00 N ATOM 1915 CA ALA A 125 6.586 0.705 -11.450 1.00 0.00 C ATOM 1916 C ALA A 125 6.458 2.204 -11.693 1.00 0.00 C ATOM 1917 O ALA A 125 5.616 2.650 -12.472 1.00 0.00 O ATOM 1918 CB ALA A 125 5.717 0.296 -10.271 1.00 0.00 C ATOM 0 H ALA A 125 8.155 -0.058 -10.287 1.00 0.00 H new ATOM 0 HA ALA A 125 6.245 0.182 -12.343 1.00 0.00 H new ATOM 0 HB1 ALA A 125 4.684 0.586 -10.463 1.00 0.00 H new ATOM 0 HB2 ALA A 125 5.772 -0.784 -10.136 1.00 0.00 H new ATOM 0 HB3 ALA A 125 6.072 0.793 -9.368 1.00 0.00 H new ATOM 1924 N GLY A 126 7.306 2.972 -11.023 1.00 0.00 N ATOM 1925 CA GLY A 126 7.270 4.414 -11.159 1.00 0.00 C ATOM 1926 C GLY A 126 6.682 5.079 -9.937 1.00 0.00 C ATOM 1927 O GLY A 126 6.008 6.105 -10.036 1.00 0.00 O ATOM 0 H GLY A 126 8.021 2.620 -10.386 1.00 0.00 H new ATOM 0 HA2 GLY A 126 8.280 4.789 -11.326 1.00 0.00 H new ATOM 0 HA3 GLY A 126 6.682 4.682 -12.037 1.00 0.00 H new ATOM 1931 N PHE A 127 6.924 4.487 -8.782 1.00 0.00 N ATOM 1932 CA PHE A 127 6.434 5.036 -7.533 1.00 0.00 C ATOM 1933 C PHE A 127 7.480 5.957 -6.917 1.00 0.00 C ATOM 1934 O PHE A 127 8.637 5.570 -6.750 1.00 0.00 O ATOM 1935 CB PHE A 127 6.082 3.912 -6.558 1.00 0.00 C ATOM 1936 CG PHE A 127 4.979 3.003 -7.037 1.00 0.00 C ATOM 1937 CD1 PHE A 127 3.831 3.525 -7.609 1.00 0.00 C ATOM 1938 CD2 PHE A 127 5.084 1.628 -6.897 1.00 0.00 C ATOM 1939 CE1 PHE A 127 2.810 2.697 -8.033 1.00 0.00 C ATOM 1940 CE2 PHE A 127 4.067 0.793 -7.321 1.00 0.00 C ATOM 1941 CZ PHE A 127 2.929 1.328 -7.890 1.00 0.00 C ATOM 0 H PHE A 127 7.458 3.624 -8.684 1.00 0.00 H new ATOM 0 HA PHE A 127 5.533 5.614 -7.738 1.00 0.00 H new ATOM 0 HB2 PHE A 127 6.975 3.315 -6.371 1.00 0.00 H new ATOM 0 HB3 PHE A 127 5.788 4.351 -5.605 1.00 0.00 H new ATOM 0 HD1 PHE A 127 3.733 4.594 -7.725 1.00 0.00 H new ATOM 0 HD2 PHE A 127 5.971 1.204 -6.451 1.00 0.00 H new ATOM 0 HE1 PHE A 127 1.920 3.119 -8.476 1.00 0.00 H new ATOM 0 HE2 PHE A 127 4.163 -0.277 -7.207 1.00 0.00 H new ATOM 0 HZ PHE A 127 2.133 0.678 -8.223 1.00 0.00 H new ATOM 1951 N LYS A 128 7.073 7.172 -6.578 1.00 0.00 N ATOM 1952 CA LYS A 128 7.999 8.156 -6.041 1.00 0.00 C ATOM 1953 C LYS A 128 7.837 8.263 -4.530 1.00 0.00 C ATOM 1954 O LYS A 128 6.717 8.239 -4.010 1.00 0.00 O ATOM 1955 CB LYS A 128 7.781 9.522 -6.704 1.00 0.00 C ATOM 1956 CG LYS A 128 8.873 10.531 -6.388 1.00 0.00 C ATOM 1957 CD LYS A 128 8.678 11.825 -7.157 1.00 0.00 C ATOM 1958 CE LYS A 128 9.823 12.790 -6.906 1.00 0.00 C ATOM 1959 NZ LYS A 128 9.682 14.038 -7.697 1.00 0.00 N ATOM 0 H LYS A 128 6.111 7.498 -6.665 1.00 0.00 H new ATOM 0 HA LYS A 128 9.016 7.830 -6.260 1.00 0.00 H new ATOM 0 HB2 LYS A 128 7.723 9.388 -7.784 1.00 0.00 H new ATOM 0 HB3 LYS A 128 6.821 9.925 -6.381 1.00 0.00 H new ATOM 0 HG2 LYS A 128 8.877 10.740 -5.318 1.00 0.00 H new ATOM 0 HG3 LYS A 128 9.846 10.104 -6.633 1.00 0.00 H new ATOM 0 HD2 LYS A 128 8.607 11.610 -8.223 1.00 0.00 H new ATOM 0 HD3 LYS A 128 7.737 12.289 -6.862 1.00 0.00 H new ATOM 0 HE2 LYS A 128 9.864 13.036 -5.845 1.00 0.00 H new ATOM 0 HE3 LYS A 128 10.767 12.306 -7.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 10.484 14.669 -7.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 9.669 13.807 -8.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 8.794 14.514 -7.439 1.00 0.00 H new ATOM 1973 N GLU A 129 8.957 8.375 -3.833 1.00 0.00 N ATOM 1974 CA GLU A 129 8.952 8.414 -2.381 1.00 0.00 C ATOM 1975 C GLU A 129 8.645 9.802 -1.850 1.00 0.00 C ATOM 1976 O GLU A 129 8.975 10.813 -2.470 1.00 0.00 O ATOM 1977 CB GLU A 129 10.298 7.964 -1.822 1.00 0.00 C ATOM 1978 CG GLU A 129 10.577 6.484 -1.984 1.00 0.00 C ATOM 1979 CD GLU A 129 11.848 6.075 -1.277 1.00 0.00 C ATOM 1980 OE1 GLU A 129 12.100 6.582 -0.169 1.00 0.00 O ATOM 1981 OE2 GLU A 129 12.594 5.234 -1.815 1.00 0.00 O ATOM 0 H GLU A 129 9.884 8.441 -4.253 1.00 0.00 H new ATOM 0 HA GLU A 129 8.166 7.732 -2.055 1.00 0.00 H new ATOM 0 HB2 GLU A 129 11.090 8.527 -2.316 1.00 0.00 H new ATOM 0 HB3 GLU A 129 10.341 8.216 -0.762 1.00 0.00 H new ATOM 0 HG2 GLU A 129 9.739 5.910 -1.588 1.00 0.00 H new ATOM 0 HG3 GLU A 129 10.656 6.242 -3.044 1.00 0.00 H new ATOM 1988 N VAL A 130 8.004 9.831 -0.694 1.00 0.00 N ATOM 1989 CA VAL A 130 7.834 11.059 0.060 1.00 0.00 C ATOM 1990 C VAL A 130 8.970 11.151 1.070 1.00 0.00 C ATOM 1991 O VAL A 130 9.364 12.238 1.494 1.00 0.00 O ATOM 1992 CB VAL A 130 6.475 11.093 0.796 1.00 0.00 C ATOM 1993 CG1 VAL A 130 6.256 12.431 1.487 1.00 0.00 C ATOM 1994 CG2 VAL A 130 5.338 10.798 -0.169 1.00 0.00 C ATOM 0 H VAL A 130 7.590 9.009 -0.255 1.00 0.00 H new ATOM 0 HA VAL A 130 7.852 11.905 -0.627 1.00 0.00 H new ATOM 0 HB VAL A 130 6.490 10.319 1.563 1.00 0.00 H new ATOM 0 HG11 VAL A 130 5.292 12.424 1.996 1.00 0.00 H new ATOM 0 HG12 VAL A 130 7.050 12.599 2.215 1.00 0.00 H new ATOM 0 HG13 VAL A 130 6.269 13.230 0.746 1.00 0.00 H new ATOM 0 HG21 VAL A 130 4.389 10.826 0.367 1.00 0.00 H new ATOM 0 HG22 VAL A 130 5.330 11.547 -0.961 1.00 0.00 H new ATOM 0 HG23 VAL A 130 5.479 9.809 -0.606 1.00 0.00 H new ATOM 2004 N LYS A 131 9.498 9.971 1.412 1.00 0.00 N ATOM 2005 CA LYS A 131 10.639 9.821 2.316 1.00 0.00 C ATOM 2006 C LYS A 131 10.266 10.191 3.746 1.00 0.00 C ATOM 2007 O LYS A 131 10.255 11.360 4.125 1.00 0.00 O ATOM 2008 CB LYS A 131 11.839 10.636 1.822 1.00 0.00 C ATOM 2009 CG LYS A 131 12.302 10.215 0.433 1.00 0.00 C ATOM 2010 CD LYS A 131 13.447 11.072 -0.081 1.00 0.00 C ATOM 2011 CE LYS A 131 14.687 10.939 0.787 1.00 0.00 C ATOM 2012 NZ LYS A 131 15.876 11.566 0.154 1.00 0.00 N ATOM 0 H LYS A 131 9.139 9.082 1.063 1.00 0.00 H new ATOM 0 HA LYS A 131 10.928 8.770 2.318 1.00 0.00 H new ATOM 0 HB2 LYS A 131 11.574 11.693 1.808 1.00 0.00 H new ATOM 0 HB3 LYS A 131 12.664 10.524 2.525 1.00 0.00 H new ATOM 0 HG2 LYS A 131 12.616 9.172 0.459 1.00 0.00 H new ATOM 0 HG3 LYS A 131 11.464 10.279 -0.261 1.00 0.00 H new ATOM 0 HD2 LYS A 131 13.687 10.782 -1.104 1.00 0.00 H new ATOM 0 HD3 LYS A 131 13.135 12.116 -0.111 1.00 0.00 H new ATOM 0 HE2 LYS A 131 14.504 11.404 1.756 1.00 0.00 H new ATOM 0 HE3 LYS A 131 14.889 9.884 0.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 16.701 11.454 0.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 16.067 11.105 -0.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 15.694 12.578 -0.000 1.00 0.00 H new