USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 839 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: B 151 C O2' : rot 16:sc= 0.13 USER MOD Set 1.2: B 152 U O3' : rot 160:sc= 0.0967 USER MOD Set 2.1: A 133 HIS : no HD1:sc= -0.0153 X(o=1,f=0.89) USER MOD Set 2.2: B 149 C O2' : rot 36:sc= 1.05 USER MOD Set 3.1: A 140 SER OG : rot 130:sc= 0.0469 USER MOD Set 3.2: A 144 GLN : amide:sc= 0.0475 X(o=0.094,f=0.58) USER MOD Set 4.1: A 53 SER OG : rot 180:sc= 0.0443 USER MOD Set 4.2: A 129 GLN : amide:sc= 0.717 K(o=0.76,f=-4.4!) USER MOD Set 5.1: A 65 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0156) USER MOD Set 5.2: A 127 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 87 ASN : amide:sc= 0.217 K(o=0.35,f=-1.8!) USER MOD Set 6.2: A 138 THR OG1 : rot 150:sc= 0.134 USER MOD Set 7.1: A 62 HIS : no HD1:sc= -1.2 X(o=-2.3,f=-2.7) USER MOD Set 7.2: A 96 GLN :FLIP amide:sc= -1.08 F(o=-3.2,f=-2.3) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0.451 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 78:sc= 1.24 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.0163 USER MOD Single : A 90 MET CE :methyl 152:sc= -0.226 (180deg=-0.391) USER MOD Single : A 92 LYS NZ :NH3+ 153:sc= 2.2 (180deg=1.35) USER MOD Single : A 94 LYS NZ :NH3+ -176:sc= 1.26 (180deg=1.21) USER MOD Single : A 95 ASN : amide:sc= 0.965 K(o=0.97,f=-0.2) USER MOD Single : A 101 MET CE :methyl -170:sc= -4.95! (180deg=-5.12!) USER MOD Single : A 102 ASN :FLIP amide:sc= -0.0794 F(o=-0.6,f=-0.079) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.845 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl 147:sc= -0.434 (180deg=-1.18) USER MOD Single : A 112 ASN : amide:sc= 0.201 X(o=0.2,f=0) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 180:sc= -0.23 USER MOD Single : A 115 THR OG1 : rot 77:sc= 0.725 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.00914 USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 131 SER OG : rot 51:sc= 1.48 USER MOD Single : A 132 ASN : amide:sc= 0.21 K(o=0.21,f=-4.5!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ -161:sc= 1.47 (180deg=1.03) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 147 C O2' : rot 24:sc= 0.571 USER MOD Single : B 147 C O5' : rot -160:sc= -0.597 USER MOD Single : B 148 U O2' : rot 21:sc= 0.128 USER MOD Single : B 150 U O2' : rot -60:sc= 1.07 USER MOD Single : B 152 U O2' : rot -17:sc= 0.0917 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 49 -10.714 3.322 15.715 1.00 0.00 N ATOM 2 CA GLY A 49 -11.815 3.730 14.813 1.00 0.00 C ATOM 3 C GLY A 49 -11.786 2.975 13.490 1.00 0.00 C ATOM 4 O GLY A 49 -10.953 2.092 13.277 1.00 0.00 O ATOM 0 HA2 GLY A 49 -12.771 3.556 15.308 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -11.746 4.801 14.620 1.00 0.00 H new ATOM 8 N ASP A 50 -12.700 3.320 12.582 1.00 0.00 N ATOM 9 CA ASP A 50 -12.914 2.673 11.273 1.00 0.00 C ATOM 10 C ASP A 50 -12.170 3.335 10.088 1.00 0.00 C ATOM 11 O ASP A 50 -12.231 2.846 8.959 1.00 0.00 O ATOM 12 CB ASP A 50 -14.429 2.611 11.002 1.00 0.00 C ATOM 13 CG ASP A 50 -15.056 4.001 10.789 1.00 0.00 C ATOM 14 OD1 ASP A 50 -15.102 4.797 11.760 1.00 0.00 O ATOM 15 OD2 ASP A 50 -15.513 4.303 9.660 1.00 0.00 O ATOM 0 H ASP A 50 -13.345 4.094 12.740 1.00 0.00 H new ATOM 0 HA ASP A 50 -12.481 1.675 11.339 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -14.611 1.997 10.120 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -14.923 2.119 11.840 1.00 0.00 H new ATOM 20 N SER A 51 -11.444 4.430 10.340 1.00 0.00 N ATOM 21 CA SER A 51 -10.828 5.341 9.355 1.00 0.00 C ATOM 22 C SER A 51 -9.768 4.736 8.413 1.00 0.00 C ATOM 23 O SER A 51 -9.305 5.430 7.505 1.00 0.00 O ATOM 24 CB SER A 51 -10.206 6.537 10.088 1.00 0.00 C ATOM 25 OG SER A 51 -11.145 7.139 10.968 1.00 0.00 O ATOM 0 H SER A 51 -11.256 4.727 11.298 1.00 0.00 H new ATOM 0 HA SER A 51 -11.654 5.622 8.702 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.333 6.209 10.652 1.00 0.00 H new ATOM 0 HB3 SER A 51 -9.859 7.272 9.362 1.00 0.00 H new ATOM 0 HG SER A 51 -10.725 7.898 11.425 1.00 0.00 H new ATOM 31 N ARG A 52 -9.376 3.465 8.597 1.00 0.00 N ATOM 32 CA ARG A 52 -8.475 2.717 7.693 1.00 0.00 C ATOM 33 C ARG A 52 -9.011 2.675 6.258 1.00 0.00 C ATOM 34 O ARG A 52 -8.273 2.957 5.314 1.00 0.00 O ATOM 35 CB ARG A 52 -8.269 1.279 8.204 1.00 0.00 C ATOM 36 CG ARG A 52 -7.489 1.161 9.520 1.00 0.00 C ATOM 37 CD ARG A 52 -6.031 1.624 9.387 1.00 0.00 C ATOM 38 NE ARG A 52 -5.223 1.151 10.524 1.00 0.00 N ATOM 39 CZ ARG A 52 -3.927 0.908 10.518 1.00 0.00 C ATOM 40 NH1 ARG A 52 -3.135 1.294 9.562 1.00 0.00 N ATOM 41 NH2 ARG A 52 -3.363 0.244 11.480 1.00 0.00 N ATOM 0 H ARG A 52 -9.682 2.912 9.397 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.521 3.244 7.686 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.246 0.813 8.336 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.745 0.709 7.437 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.986 1.755 10.287 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -7.508 0.125 9.857 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -5.609 1.248 8.455 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -5.994 2.712 9.337 1.00 0.00 H new ATOM 0 HE ARG A 52 -5.715 0.996 11.404 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -3.510 1.812 8.767 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -2.139 1.079 9.607 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -3.924 -0.100 12.259 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -2.359 0.066 11.457 1.00 0.00 H new ATOM 55 N SER A 53 -10.285 2.317 6.104 1.00 0.00 N ATOM 56 CA SER A 53 -10.988 2.260 4.817 1.00 0.00 C ATOM 57 C SER A 53 -11.362 3.658 4.309 1.00 0.00 C ATOM 58 O SER A 53 -11.871 4.488 5.067 1.00 0.00 O ATOM 59 CB SER A 53 -12.259 1.416 4.956 1.00 0.00 C ATOM 60 OG SER A 53 -11.910 0.077 5.278 1.00 0.00 O ATOM 0 H SER A 53 -10.876 2.051 6.892 1.00 0.00 H new ATOM 0 HA SER A 53 -10.312 1.806 4.093 1.00 0.00 H new ATOM 0 HB2 SER A 53 -12.901 1.832 5.733 1.00 0.00 H new ATOM 0 HB3 SER A 53 -12.827 1.441 4.026 1.00 0.00 H new ATOM 0 HG SER A 53 -12.724 -0.461 5.368 1.00 0.00 H new ATOM 66 N ALA A 54 -11.143 3.906 3.012 1.00 0.00 N ATOM 67 CA ALA A 54 -11.576 5.123 2.325 1.00 0.00 C ATOM 68 C ALA A 54 -13.117 5.257 2.214 1.00 0.00 C ATOM 69 O ALA A 54 -13.874 4.297 2.392 1.00 0.00 O ATOM 70 CB ALA A 54 -10.931 5.143 0.927 1.00 0.00 C ATOM 0 H ALA A 54 -10.651 3.253 2.402 1.00 0.00 H new ATOM 0 HA ALA A 54 -11.251 5.977 2.919 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -11.241 6.043 0.396 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -9.846 5.136 1.027 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.249 4.264 0.367 1.00 0.00 H new ATOM 76 N GLY A 55 -13.565 6.462 1.845 1.00 0.00 N ATOM 77 CA GLY A 55 -14.956 6.789 1.481 1.00 0.00 C ATOM 78 C GLY A 55 -15.063 7.986 0.524 1.00 0.00 C ATOM 79 O GLY A 55 -15.870 7.968 -0.408 1.00 0.00 O ATOM 0 H GLY A 55 -12.947 7.271 1.788 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -15.418 5.918 1.017 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -15.521 7.005 2.388 1.00 0.00 H new ATOM 83 N VAL A 56 -14.200 8.992 0.707 1.00 0.00 N ATOM 84 CA VAL A 56 -13.895 10.077 -0.251 1.00 0.00 C ATOM 85 C VAL A 56 -12.396 10.446 -0.162 1.00 0.00 C ATOM 86 O VAL A 56 -12.004 11.448 0.444 1.00 0.00 O ATOM 87 CB VAL A 56 -14.889 11.244 -0.113 1.00 0.00 C ATOM 88 CG1 VAL A 56 -14.956 11.909 1.272 1.00 0.00 C ATOM 89 CG2 VAL A 56 -14.681 12.311 -1.195 1.00 0.00 C ATOM 0 H VAL A 56 -13.664 9.082 1.570 1.00 0.00 H new ATOM 0 HA VAL A 56 -14.046 9.738 -1.276 1.00 0.00 H new ATOM 0 HB VAL A 56 -15.856 10.759 -0.251 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -15.688 12.717 1.253 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -15.251 11.170 2.017 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -13.977 12.313 1.530 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -15.405 13.114 -1.058 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -13.671 12.715 -1.118 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -14.819 11.863 -2.179 1.00 0.00 H new ATOM 99 N PRO A 57 -11.525 9.550 -0.664 1.00 0.00 N ATOM 100 CA PRO A 57 -10.084 9.521 -0.393 1.00 0.00 C ATOM 101 C PRO A 57 -9.271 10.298 -1.457 1.00 0.00 C ATOM 102 O PRO A 57 -9.845 10.973 -2.316 1.00 0.00 O ATOM 103 CB PRO A 57 -9.826 8.014 -0.374 1.00 0.00 C ATOM 104 CG PRO A 57 -10.624 7.556 -1.600 1.00 0.00 C ATOM 105 CD PRO A 57 -11.902 8.364 -1.427 1.00 0.00 C ATOM 0 HA PRO A 57 -9.775 10.017 0.527 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -8.766 7.778 -0.462 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -10.181 7.548 0.545 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -10.113 7.786 -2.535 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -10.810 6.482 -1.594 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -12.324 8.639 -2.394 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -12.661 7.786 -0.901 1.00 0.00 H new ATOM 113 N SER A 58 -7.935 10.232 -1.401 1.00 0.00 N ATOM 114 CA SER A 58 -7.029 10.863 -2.383 1.00 0.00 C ATOM 115 C SER A 58 -5.838 9.973 -2.777 1.00 0.00 C ATOM 116 O SER A 58 -5.715 8.827 -2.352 1.00 0.00 O ATOM 117 CB SER A 58 -6.580 12.250 -1.889 1.00 0.00 C ATOM 118 OG SER A 58 -6.064 13.025 -2.959 1.00 0.00 O ATOM 0 H SER A 58 -7.440 9.732 -0.662 1.00 0.00 H new ATOM 0 HA SER A 58 -7.600 10.995 -3.302 1.00 0.00 H new ATOM 0 HB2 SER A 58 -7.423 12.769 -1.433 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.819 12.137 -1.117 1.00 0.00 H new ATOM 0 HG SER A 58 -5.786 13.903 -2.623 1.00 0.00 H new ATOM 124 N ARG A 59 -4.981 10.520 -3.640 1.00 0.00 N ATOM 125 CA ARG A 59 -4.034 9.935 -4.607 1.00 0.00 C ATOM 126 C ARG A 59 -3.026 8.869 -4.159 1.00 0.00 C ATOM 127 O ARG A 59 -2.385 8.308 -5.048 1.00 0.00 O ATOM 128 CB ARG A 59 -3.279 11.121 -5.223 1.00 0.00 C ATOM 129 CG ARG A 59 -4.073 11.873 -6.315 1.00 0.00 C ATOM 130 CD ARG A 59 -3.726 13.368 -6.326 1.00 0.00 C ATOM 131 NE ARG A 59 -2.267 13.572 -6.301 1.00 0.00 N ATOM 132 CZ ARG A 59 -1.617 14.542 -5.695 1.00 0.00 C ATOM 133 NH1 ARG A 59 -2.182 15.669 -5.370 1.00 0.00 N ATOM 134 NH2 ARG A 59 -0.377 14.402 -5.354 1.00 0.00 N ATOM 0 H ARG A 59 -4.924 11.537 -3.687 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.659 9.350 -5.281 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -3.017 11.822 -4.431 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -2.344 10.760 -5.652 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.854 11.439 -7.291 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.142 11.747 -6.143 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -4.147 13.836 -7.216 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -4.180 13.857 -5.464 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.702 12.890 -6.806 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -3.167 15.826 -5.585 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -1.640 16.395 -4.901 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.112 13.529 -5.554 1.00 0.00 H new ATOM 0 HH22 ARG A 59 0.112 15.164 -4.885 1.00 0.00 H new ATOM 148 N VAL A 60 -2.866 8.541 -2.871 1.00 0.00 N ATOM 149 CA VAL A 60 -2.057 7.376 -2.451 1.00 0.00 C ATOM 150 C VAL A 60 -2.922 6.161 -2.135 1.00 0.00 C ATOM 151 O VAL A 60 -3.892 6.240 -1.390 1.00 0.00 O ATOM 152 CB VAL A 60 -0.969 7.682 -1.402 1.00 0.00 C ATOM 153 CG1 VAL A 60 -1.343 8.366 -0.083 1.00 0.00 C ATOM 154 CG2 VAL A 60 -0.151 6.426 -1.129 1.00 0.00 C ATOM 0 H VAL A 60 -3.283 9.061 -2.099 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.465 7.102 -3.325 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.403 8.472 -1.895 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.448 8.498 0.525 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.787 9.339 -0.291 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -2.060 7.748 0.457 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.617 6.646 -0.387 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.806 5.640 -0.752 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.322 6.092 -2.053 1.00 0.00 H new ATOM 164 N ILE A 61 -2.560 5.023 -2.725 1.00 0.00 N ATOM 165 CA ILE A 61 -3.069 3.668 -2.473 1.00 0.00 C ATOM 166 C ILE A 61 -1.995 2.890 -1.691 1.00 0.00 C ATOM 167 O ILE A 61 -0.820 3.238 -1.743 1.00 0.00 O ATOM 168 CB ILE A 61 -3.424 3.048 -3.850 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.622 3.773 -4.509 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.696 1.537 -3.847 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.503 3.767 -6.037 1.00 0.00 C ATOM 0 H ILE A 61 -1.845 5.020 -3.452 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.972 3.649 -1.863 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.515 3.194 -4.434 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.552 3.288 -4.212 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.670 4.801 -4.150 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.934 1.208 -4.859 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.811 1.009 -3.492 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.536 1.320 -3.188 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.359 4.284 -6.471 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.585 4.275 -6.332 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.480 2.738 -6.396 1.00 0.00 H new ATOM 183 N HIS A 62 -2.373 1.834 -0.974 1.00 0.00 N ATOM 184 CA HIS A 62 -1.497 0.966 -0.185 1.00 0.00 C ATOM 185 C HIS A 62 -1.727 -0.509 -0.555 1.00 0.00 C ATOM 186 O HIS A 62 -2.865 -0.933 -0.789 1.00 0.00 O ATOM 187 CB HIS A 62 -1.724 1.266 1.311 1.00 0.00 C ATOM 188 CG HIS A 62 -1.281 0.199 2.294 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.777 -1.085 2.408 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.424 0.390 3.343 1.00 0.00 C ATOM 191 CE1 HIS A 62 -1.189 -1.658 3.474 1.00 0.00 C ATOM 192 NE2 HIS A 62 -0.346 -0.805 4.069 1.00 0.00 N ATOM 0 H HIS A 62 -3.350 1.544 -0.924 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.449 1.167 -0.408 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.203 2.192 1.555 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.788 1.449 1.464 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.102 1.305 3.572 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.372 -2.670 3.805 1.00 0.00 H new ATOM 0 HE2 HIS A 62 0.236 -0.989 4.886 1.00 0.00 H new ATOM 200 N ILE A 63 -0.641 -1.289 -0.573 1.00 0.00 N ATOM 201 CA ILE A 63 -0.570 -2.699 -0.995 1.00 0.00 C ATOM 202 C ILE A 63 0.012 -3.560 0.143 1.00 0.00 C ATOM 203 O ILE A 63 0.975 -3.145 0.791 1.00 0.00 O ATOM 204 CB ILE A 63 0.282 -2.867 -2.287 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.213 -1.658 -3.257 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.126 -4.179 -2.990 1.00 0.00 C ATOM 207 CD1 ILE A 63 1.054 -1.801 -4.534 1.00 0.00 C ATOM 0 H ILE A 63 0.268 -0.935 -0.276 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.582 -3.034 -1.220 1.00 0.00 H new ATOM 0 HB ILE A 63 1.327 -2.912 -1.981 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.827 -1.498 -3.541 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.538 -0.765 -2.724 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.466 -4.305 -3.897 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.051 -5.021 -2.321 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.184 -4.139 -3.250 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.940 -0.907 -5.147 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.103 -1.927 -4.267 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.716 -2.671 -5.096 1.00 0.00 H new ATOM 219 N ARG A 64 -0.527 -4.768 0.362 1.00 0.00 N ATOM 220 CA ARG A 64 -0.012 -5.796 1.305 1.00 0.00 C ATOM 221 C ARG A 64 0.476 -7.057 0.574 1.00 0.00 C ATOM 222 O ARG A 64 0.299 -7.183 -0.639 1.00 0.00 O ATOM 223 CB ARG A 64 -1.025 -6.137 2.441 1.00 0.00 C ATOM 224 CG ARG A 64 -2.358 -5.384 2.404 1.00 0.00 C ATOM 225 CD ARG A 64 -3.339 -5.818 3.496 1.00 0.00 C ATOM 226 NE ARG A 64 -4.724 -5.426 3.156 1.00 0.00 N ATOM 227 CZ ARG A 64 -5.271 -4.223 3.102 1.00 0.00 C ATOM 228 NH1 ARG A 64 -4.629 -3.143 3.435 1.00 0.00 N ATOM 229 NH2 ARG A 64 -6.507 -4.079 2.725 1.00 0.00 N ATOM 0 H ARG A 64 -1.367 -5.077 -0.127 1.00 0.00 H new ATOM 0 HA ARG A 64 0.855 -5.351 1.793 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.234 -7.206 2.405 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.545 -5.938 3.399 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.165 -4.316 2.505 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -2.823 -5.534 1.430 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.286 -6.899 3.628 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.053 -5.367 4.446 1.00 0.00 H new ATOM 0 HE ARG A 64 -5.351 -6.198 2.929 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -3.662 -3.202 3.754 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -5.092 -2.236 3.377 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -7.061 -4.896 2.469 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -6.923 -3.149 2.685 1.00 0.00 H new ATOM 243 N LYS A 65 1.068 -7.997 1.323 1.00 0.00 N ATOM 244 CA LYS A 65 1.484 -9.362 0.925 1.00 0.00 C ATOM 245 C LYS A 65 2.698 -9.465 -0.016 1.00 0.00 C ATOM 246 O LYS A 65 3.090 -10.589 -0.318 1.00 0.00 O ATOM 247 CB LYS A 65 0.298 -10.163 0.327 1.00 0.00 C ATOM 248 CG LYS A 65 -1.024 -10.143 1.108 1.00 0.00 C ATOM 249 CD LYS A 65 -0.930 -10.704 2.532 1.00 0.00 C ATOM 250 CE LYS A 65 -1.932 -11.835 2.818 1.00 0.00 C ATOM 251 NZ LYS A 65 -1.706 -13.045 1.980 1.00 0.00 N ATOM 0 H LYS A 65 1.289 -7.815 2.302 1.00 0.00 H new ATOM 0 HA LYS A 65 1.816 -9.799 1.867 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.104 -9.782 -0.676 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.611 -11.201 0.219 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.386 -9.116 1.159 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -1.767 -10.716 0.554 1.00 0.00 H new ATOM 0 HD2 LYS A 65 0.081 -11.075 2.701 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.096 -9.895 3.243 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.866 -12.112 3.870 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -2.944 -11.467 2.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.308 -13.821 2.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.944 -12.831 0.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.707 -13.329 2.042 1.00 0.00 H new ATOM 265 N LEU A 66 3.270 -8.339 -0.468 1.00 0.00 N ATOM 266 CA LEU A 66 4.217 -8.138 -1.580 1.00 0.00 C ATOM 267 C LEU A 66 5.249 -9.271 -1.804 1.00 0.00 C ATOM 268 O LEU A 66 5.743 -9.837 -0.827 1.00 0.00 O ATOM 269 CB LEU A 66 4.954 -6.799 -1.349 1.00 0.00 C ATOM 270 CG LEU A 66 4.890 -5.821 -2.522 1.00 0.00 C ATOM 271 CD1 LEU A 66 3.497 -5.236 -2.728 1.00 0.00 C ATOM 272 CD2 LEU A 66 5.850 -4.672 -2.262 1.00 0.00 C ATOM 0 H LEU A 66 3.059 -7.450 -0.016 1.00 0.00 H new ATOM 0 HA LEU A 66 3.617 -8.136 -2.490 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.532 -6.316 -0.468 1.00 0.00 H new ATOM 0 HB3 LEU A 66 6.000 -7.010 -1.127 1.00 0.00 H new ATOM 0 HG LEU A 66 5.158 -6.379 -3.419 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.512 -4.549 -3.574 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.790 -6.041 -2.927 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.191 -4.699 -1.830 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.811 -3.969 -3.094 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.565 -4.161 -1.342 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.864 -5.060 -2.163 1.00 0.00 H new ATOM 284 N PRO A 67 5.652 -9.568 -3.061 1.00 0.00 N ATOM 285 CA PRO A 67 6.678 -10.566 -3.362 1.00 0.00 C ATOM 286 C PRO A 67 7.995 -10.393 -2.603 1.00 0.00 C ATOM 287 O PRO A 67 8.326 -9.339 -2.054 1.00 0.00 O ATOM 288 CB PRO A 67 6.923 -10.517 -4.875 1.00 0.00 C ATOM 289 CG PRO A 67 5.629 -9.927 -5.419 1.00 0.00 C ATOM 290 CD PRO A 67 5.163 -8.989 -4.301 1.00 0.00 C ATOM 0 HA PRO A 67 6.304 -11.534 -3.029 1.00 0.00 H new ATOM 0 HB2 PRO A 67 7.784 -9.896 -5.123 1.00 0.00 H new ATOM 0 HB3 PRO A 67 7.116 -11.509 -5.284 1.00 0.00 H new ATOM 0 HG2 PRO A 67 5.795 -9.388 -6.352 1.00 0.00 H new ATOM 0 HG3 PRO A 67 4.891 -10.702 -5.626 1.00 0.00 H new ATOM 0 HD2 PRO A 67 5.559 -7.984 -4.445 1.00 0.00 H new ATOM 0 HD3 PRO A 67 4.076 -8.905 -4.290 1.00 0.00 H new ATOM 298 N ILE A 68 8.782 -11.463 -2.652 1.00 0.00 N ATOM 299 CA ILE A 68 10.008 -11.729 -1.878 1.00 0.00 C ATOM 300 C ILE A 68 11.086 -10.657 -2.034 1.00 0.00 C ATOM 301 O ILE A 68 11.857 -10.392 -1.111 1.00 0.00 O ATOM 302 CB ILE A 68 10.566 -13.117 -2.275 1.00 0.00 C ATOM 303 CG1 ILE A 68 10.892 -13.230 -3.789 1.00 0.00 C ATOM 304 CG2 ILE A 68 9.529 -14.176 -1.870 1.00 0.00 C ATOM 305 CD1 ILE A 68 11.531 -14.560 -4.198 1.00 0.00 C ATOM 0 H ILE A 68 8.568 -12.235 -3.284 1.00 0.00 H new ATOM 0 HA ILE A 68 9.729 -11.711 -0.825 1.00 0.00 H new ATOM 0 HB ILE A 68 11.511 -13.271 -1.754 1.00 0.00 H new ATOM 0 HG12 ILE A 68 9.973 -13.092 -4.358 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.563 -12.417 -4.066 1.00 0.00 H new ATOM 0 HG21 ILE A 68 9.896 -15.166 -2.138 1.00 0.00 H new ATOM 0 HG22 ILE A 68 9.363 -14.130 -0.794 1.00 0.00 H new ATOM 0 HG23 ILE A 68 8.591 -13.984 -2.390 1.00 0.00 H new ATOM 0 HD11 ILE A 68 11.726 -14.555 -5.270 1.00 0.00 H new ATOM 0 HD12 ILE A 68 12.469 -14.694 -3.659 1.00 0.00 H new ATOM 0 HD13 ILE A 68 10.853 -15.379 -3.956 1.00 0.00 H new ATOM 317 N ASP A 69 11.126 -10.044 -3.213 1.00 0.00 N ATOM 318 CA ASP A 69 12.086 -9.022 -3.629 1.00 0.00 C ATOM 319 C ASP A 69 11.545 -8.240 -4.845 1.00 0.00 C ATOM 320 O ASP A 69 12.268 -7.974 -5.811 1.00 0.00 O ATOM 321 CB ASP A 69 13.460 -9.670 -3.905 1.00 0.00 C ATOM 322 CG ASP A 69 14.585 -8.634 -4.099 1.00 0.00 C ATOM 323 OD1 ASP A 69 14.487 -7.512 -3.540 1.00 0.00 O ATOM 324 OD2 ASP A 69 15.589 -8.954 -4.780 1.00 0.00 O ATOM 0 H ASP A 69 10.451 -10.258 -3.947 1.00 0.00 H new ATOM 0 HA ASP A 69 12.224 -8.300 -2.824 1.00 0.00 H new ATOM 0 HB2 ASP A 69 13.719 -10.328 -3.076 1.00 0.00 H new ATOM 0 HB3 ASP A 69 13.389 -10.293 -4.796 1.00 0.00 H new ATOM 329 N VAL A 70 10.244 -7.904 -4.827 1.00 0.00 N ATOM 330 CA VAL A 70 9.647 -7.055 -5.878 1.00 0.00 C ATOM 331 C VAL A 70 10.374 -5.701 -5.969 1.00 0.00 C ATOM 332 O VAL A 70 11.003 -5.250 -5.000 1.00 0.00 O ATOM 333 CB VAL A 70 8.114 -6.911 -5.702 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.674 -5.568 -5.127 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.395 -7.098 -7.042 1.00 0.00 C ATOM 0 H VAL A 70 9.589 -8.203 -4.104 1.00 0.00 H new ATOM 0 HA VAL A 70 9.788 -7.553 -6.837 1.00 0.00 H new ATOM 0 HB VAL A 70 7.843 -7.689 -4.988 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.588 -5.549 -5.036 1.00 0.00 H new ATOM 0 HG12 VAL A 70 8.123 -5.429 -4.144 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.996 -4.765 -5.790 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.320 -6.993 -6.896 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.741 -6.344 -7.749 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.612 -8.091 -7.436 1.00 0.00 H new ATOM 345 N THR A 71 10.270 -5.030 -7.117 1.00 0.00 N ATOM 346 CA THR A 71 10.984 -3.779 -7.404 1.00 0.00 C ATOM 347 C THR A 71 10.056 -2.632 -7.789 1.00 0.00 C ATOM 348 O THR A 71 8.952 -2.817 -8.318 1.00 0.00 O ATOM 349 CB THR A 71 12.097 -4.021 -8.443 1.00 0.00 C ATOM 350 OG1 THR A 71 12.883 -2.859 -8.599 1.00 0.00 O ATOM 351 CG2 THR A 71 11.581 -4.418 -9.831 1.00 0.00 C ATOM 0 H THR A 71 9.679 -5.343 -7.887 1.00 0.00 H new ATOM 0 HA THR A 71 11.457 -3.454 -6.477 1.00 0.00 H new ATOM 0 HB THR A 71 12.677 -4.855 -8.048 1.00 0.00 H new ATOM 0 HG1 THR A 71 13.587 -3.026 -9.260 1.00 0.00 H new ATOM 0 HG21 THR A 71 12.425 -4.570 -10.503 1.00 0.00 H new ATOM 0 HG22 THR A 71 11.007 -5.341 -9.755 1.00 0.00 H new ATOM 0 HG23 THR A 71 10.944 -3.625 -10.223 1.00 0.00 H new ATOM 359 N GLU A 72 10.537 -1.416 -7.549 1.00 0.00 N ATOM 360 CA GLU A 72 9.863 -0.181 -7.929 1.00 0.00 C ATOM 361 C GLU A 72 9.535 -0.151 -9.423 1.00 0.00 C ATOM 362 O GLU A 72 8.420 0.212 -9.792 1.00 0.00 O ATOM 363 CB GLU A 72 10.717 1.020 -7.478 1.00 0.00 C ATOM 364 CG GLU A 72 10.400 2.324 -8.217 1.00 0.00 C ATOM 365 CD GLU A 72 11.279 3.520 -7.785 1.00 0.00 C ATOM 366 OE1 GLU A 72 11.962 3.467 -6.734 1.00 0.00 O ATOM 367 OE2 GLU A 72 11.306 4.537 -8.521 1.00 0.00 O ATOM 0 H GLU A 72 11.426 -1.259 -7.074 1.00 0.00 H new ATOM 0 HA GLU A 72 8.900 -0.123 -7.421 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.571 1.176 -6.409 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.770 0.779 -7.624 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.525 2.163 -9.288 1.00 0.00 H new ATOM 0 HG3 GLU A 72 9.353 2.578 -8.053 1.00 0.00 H new ATOM 374 N GLY A 73 10.469 -0.585 -10.274 1.00 0.00 N ATOM 375 CA GLY A 73 10.289 -0.652 -11.727 1.00 0.00 C ATOM 376 C GLY A 73 9.040 -1.433 -12.152 1.00 0.00 C ATOM 377 O GLY A 73 8.352 -1.036 -13.088 1.00 0.00 O ATOM 0 H GLY A 73 11.388 -0.905 -9.967 1.00 0.00 H new ATOM 0 HA2 GLY A 73 10.228 0.361 -12.125 1.00 0.00 H new ATOM 0 HA3 GLY A 73 11.168 -1.117 -12.173 1.00 0.00 H new ATOM 381 N GLU A 74 8.706 -2.510 -11.439 1.00 0.00 N ATOM 382 CA GLU A 74 7.472 -3.284 -11.615 1.00 0.00 C ATOM 383 C GLU A 74 6.244 -2.528 -11.122 1.00 0.00 C ATOM 384 O GLU A 74 5.289 -2.358 -11.876 1.00 0.00 O ATOM 385 CB GLU A 74 7.617 -4.646 -10.910 1.00 0.00 C ATOM 386 CG GLU A 74 8.412 -5.599 -11.812 1.00 0.00 C ATOM 387 CD GLU A 74 7.595 -6.243 -12.958 1.00 0.00 C ATOM 388 OE1 GLU A 74 6.386 -5.958 -13.123 1.00 0.00 O ATOM 389 OE2 GLU A 74 8.178 -7.049 -13.721 1.00 0.00 O ATOM 0 H GLU A 74 9.304 -2.880 -10.700 1.00 0.00 H new ATOM 0 HA GLU A 74 7.319 -3.449 -12.681 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.126 -4.522 -9.954 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.634 -5.065 -10.696 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.250 -5.052 -12.245 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.834 -6.393 -11.195 1.00 0.00 H new ATOM 396 N VAL A 75 6.277 -2.037 -9.883 1.00 0.00 N ATOM 397 CA VAL A 75 5.132 -1.327 -9.284 1.00 0.00 C ATOM 398 C VAL A 75 4.740 -0.075 -10.088 1.00 0.00 C ATOM 399 O VAL A 75 3.568 0.115 -10.423 1.00 0.00 O ATOM 400 CB VAL A 75 5.412 -1.028 -7.803 1.00 0.00 C ATOM 401 CG1 VAL A 75 4.250 -0.301 -7.118 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.660 -2.348 -7.054 1.00 0.00 C ATOM 0 H VAL A 75 7.086 -2.115 -9.267 1.00 0.00 H new ATOM 0 HA VAL A 75 4.260 -1.979 -9.327 1.00 0.00 H new ATOM 0 HB VAL A 75 6.287 -0.379 -7.770 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.502 -0.115 -6.074 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.067 0.648 -7.622 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.353 -0.918 -7.170 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.859 -2.138 -6.003 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.779 -2.984 -7.137 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.518 -2.858 -7.491 1.00 0.00 H new ATOM 412 N ILE A 76 5.704 0.760 -10.486 1.00 0.00 N ATOM 413 CA ILE A 76 5.440 1.922 -11.336 1.00 0.00 C ATOM 414 C ILE A 76 5.059 1.527 -12.760 1.00 0.00 C ATOM 415 O ILE A 76 4.200 2.190 -13.336 1.00 0.00 O ATOM 416 CB ILE A 76 6.599 2.935 -11.330 1.00 0.00 C ATOM 417 CG1 ILE A 76 7.876 2.492 -12.079 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.933 3.303 -9.886 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.875 2.969 -13.531 1.00 0.00 C ATOM 0 H ILE A 76 6.685 0.650 -10.229 1.00 0.00 H new ATOM 0 HA ILE A 76 4.576 2.420 -10.896 1.00 0.00 H new ATOM 0 HB ILE A 76 6.241 3.798 -11.891 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.753 2.887 -11.567 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.954 1.405 -12.053 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.753 4.020 -9.874 1.00 0.00 H new ATOM 0 HG22 ILE A 76 6.057 3.745 -9.411 1.00 0.00 H new ATOM 0 HG23 ILE A 76 7.227 2.406 -9.341 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.789 2.638 -14.023 1.00 0.00 H new ATOM 0 HD12 ILE A 76 7.012 2.553 -14.050 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.823 4.057 -13.556 1.00 0.00 H new ATOM 431 N SER A 77 5.612 0.441 -13.324 1.00 0.00 N ATOM 432 CA SER A 77 5.171 -0.003 -14.662 1.00 0.00 C ATOM 433 C SER A 77 3.734 -0.522 -14.641 1.00 0.00 C ATOM 434 O SER A 77 3.062 -0.529 -15.674 1.00 0.00 O ATOM 435 CB SER A 77 6.085 -1.067 -15.276 1.00 0.00 C ATOM 436 OG SER A 77 7.365 -0.525 -15.540 1.00 0.00 O ATOM 0 H SER A 77 6.340 -0.130 -12.895 1.00 0.00 H new ATOM 0 HA SER A 77 5.225 0.886 -15.290 1.00 0.00 H new ATOM 0 HB2 SER A 77 6.175 -1.914 -14.596 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.645 -1.444 -16.199 1.00 0.00 H new ATOM 0 HG SER A 77 7.877 -0.474 -14.706 1.00 0.00 H new ATOM 442 N LEU A 78 3.240 -0.878 -13.452 1.00 0.00 N ATOM 443 CA LEU A 78 1.853 -1.243 -13.222 1.00 0.00 C ATOM 444 C LEU A 78 0.936 -0.064 -12.857 1.00 0.00 C ATOM 445 O LEU A 78 -0.278 -0.196 -12.994 1.00 0.00 O ATOM 446 CB LEU A 78 1.802 -2.351 -12.161 1.00 0.00 C ATOM 447 CG LEU A 78 2.245 -3.728 -12.671 1.00 0.00 C ATOM 448 CD1 LEU A 78 2.455 -4.686 -11.498 1.00 0.00 C ATOM 449 CD2 LEU A 78 1.167 -4.296 -13.598 1.00 0.00 C ATOM 0 H LEU A 78 3.812 -0.919 -12.608 1.00 0.00 H new ATOM 0 HA LEU A 78 1.453 -1.607 -14.169 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.436 -2.065 -11.322 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.784 -2.427 -11.779 1.00 0.00 H new ATOM 0 HG LEU A 78 3.184 -3.618 -13.213 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.769 -5.659 -11.875 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.224 -4.288 -10.836 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.522 -4.795 -10.946 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.479 -5.275 -13.962 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.230 -4.395 -13.049 1.00 0.00 H new ATOM 0 HD23 LEU A 78 1.023 -3.623 -14.444 1.00 0.00 H new ATOM 461 N GLY A 79 1.485 1.095 -12.473 1.00 0.00 N ATOM 462 CA GLY A 79 0.731 2.331 -12.261 1.00 0.00 C ATOM 463 C GLY A 79 0.820 3.348 -13.405 1.00 0.00 C ATOM 464 O GLY A 79 0.028 4.285 -13.462 1.00 0.00 O ATOM 0 H GLY A 79 2.485 1.199 -12.298 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.317 2.077 -12.101 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.087 2.804 -11.346 1.00 0.00 H new ATOM 468 N LEU A 80 1.745 3.182 -14.347 1.00 0.00 N ATOM 469 CA LEU A 80 1.968 4.139 -15.430 1.00 0.00 C ATOM 470 C LEU A 80 0.799 4.349 -16.418 1.00 0.00 C ATOM 471 O LEU A 80 0.502 5.510 -16.706 1.00 0.00 O ATOM 472 CB LEU A 80 3.289 3.807 -16.152 1.00 0.00 C ATOM 473 CG LEU A 80 4.467 4.660 -15.654 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.755 4.214 -16.345 1.00 0.00 C ATOM 475 CD2 LEU A 80 4.225 6.138 -15.975 1.00 0.00 C ATOM 0 H LEU A 80 2.366 2.374 -14.381 1.00 0.00 H new ATOM 0 HA LEU A 80 2.037 5.112 -14.943 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.523 2.752 -16.007 1.00 0.00 H new ATOM 0 HB3 LEU A 80 3.161 3.961 -17.224 1.00 0.00 H new ATOM 0 HG LEU A 80 4.556 4.531 -14.575 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.588 4.821 -15.989 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.946 3.166 -16.116 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.651 4.337 -17.423 1.00 0.00 H new ATOM 0 HD21 LEU A 80 5.067 6.731 -15.617 1.00 0.00 H new ATOM 0 HD22 LEU A 80 4.125 6.265 -17.053 1.00 0.00 H new ATOM 0 HD23 LEU A 80 3.311 6.472 -15.484 1.00 0.00 H new ATOM 487 N PRO A 81 0.109 3.302 -16.923 1.00 0.00 N ATOM 488 CA PRO A 81 -1.059 3.425 -17.813 1.00 0.00 C ATOM 489 C PRO A 81 -2.256 4.231 -17.316 1.00 0.00 C ATOM 490 O PRO A 81 -3.207 4.425 -18.078 1.00 0.00 O ATOM 491 CB PRO A 81 -1.475 1.990 -18.159 1.00 0.00 C ATOM 492 CG PRO A 81 -0.195 1.182 -17.971 1.00 0.00 C ATOM 493 CD PRO A 81 0.495 1.896 -16.811 1.00 0.00 C ATOM 0 HA PRO A 81 -0.740 4.021 -18.668 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.271 1.636 -17.504 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -1.847 1.917 -19.181 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.407 0.139 -17.734 1.00 0.00 H new ATOM 0 HG3 PRO A 81 0.420 1.186 -18.871 1.00 0.00 H new ATOM 0 HD2 PRO A 81 0.182 1.480 -15.854 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.577 1.782 -16.870 1.00 0.00 H new ATOM 501 N PHE A 82 -2.234 4.695 -16.066 1.00 0.00 N ATOM 502 CA PHE A 82 -3.433 5.171 -15.392 1.00 0.00 C ATOM 503 C PHE A 82 -3.511 6.691 -15.308 1.00 0.00 C ATOM 504 O PHE A 82 -4.571 7.282 -15.513 1.00 0.00 O ATOM 505 CB PHE A 82 -3.511 4.519 -14.004 1.00 0.00 C ATOM 506 CG PHE A 82 -3.584 3.016 -14.121 1.00 0.00 C ATOM 507 CD1 PHE A 82 -2.449 2.245 -14.450 1.00 0.00 C ATOM 508 CD2 PHE A 82 -4.845 2.412 -14.050 1.00 0.00 C ATOM 509 CE1 PHE A 82 -2.599 0.883 -14.764 1.00 0.00 C ATOM 510 CE2 PHE A 82 -4.999 1.065 -14.394 1.00 0.00 C ATOM 511 CZ PHE A 82 -3.876 0.303 -14.747 1.00 0.00 C ATOM 0 H PHE A 82 -1.388 4.750 -15.499 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.298 4.877 -15.986 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.638 4.800 -13.416 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.387 4.890 -13.472 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.469 2.699 -14.461 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -5.701 2.987 -13.729 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -1.735 0.286 -15.017 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -5.980 0.613 -14.388 1.00 0.00 H new ATOM 0 HZ PHE A 82 -3.995 -0.738 -15.008 1.00 0.00 H new ATOM 521 N GLY A 83 -2.363 7.307 -15.044 1.00 0.00 N ATOM 522 CA GLY A 83 -2.156 8.747 -15.077 1.00 0.00 C ATOM 523 C GLY A 83 -0.690 9.039 -15.342 1.00 0.00 C ATOM 524 O GLY A 83 -0.295 9.267 -16.483 1.00 0.00 O ATOM 0 H GLY A 83 -1.519 6.794 -14.791 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.774 9.197 -15.854 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.461 9.191 -14.130 1.00 0.00 H new ATOM 528 N LYS A 84 0.115 8.998 -14.270 1.00 0.00 N ATOM 529 CA LYS A 84 1.582 9.135 -14.348 1.00 0.00 C ATOM 530 C LYS A 84 2.407 8.444 -13.248 1.00 0.00 C ATOM 531 O LYS A 84 3.627 8.390 -13.353 1.00 0.00 O ATOM 532 CB LYS A 84 1.883 10.647 -14.456 1.00 0.00 C ATOM 533 CG LYS A 84 3.304 11.049 -14.887 1.00 0.00 C ATOM 534 CD LYS A 84 3.818 10.293 -16.124 1.00 0.00 C ATOM 535 CE LYS A 84 5.128 10.884 -16.665 1.00 0.00 C ATOM 536 NZ LYS A 84 6.268 10.687 -15.729 1.00 0.00 N ATOM 0 H LYS A 84 -0.232 8.868 -13.320 1.00 0.00 H new ATOM 0 HA LYS A 84 1.914 8.584 -15.228 1.00 0.00 H new ATOM 0 HB2 LYS A 84 1.179 11.082 -15.165 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.682 11.102 -13.486 1.00 0.00 H new ATOM 0 HG2 LYS A 84 3.321 12.119 -15.094 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.988 10.874 -14.056 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.973 9.245 -15.868 1.00 0.00 H new ATOM 0 HD3 LYS A 84 3.059 10.321 -16.906 1.00 0.00 H new ATOM 0 HE2 LYS A 84 5.364 10.421 -17.623 1.00 0.00 H new ATOM 0 HE3 LYS A 84 4.993 11.950 -16.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 7.129 11.103 -16.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 6.057 11.151 -14.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 6.416 9.670 -15.571 1.00 0.00 H new ATOM 550 N VAL A 85 1.739 7.932 -12.210 1.00 0.00 N ATOM 551 CA VAL A 85 2.189 7.836 -10.807 1.00 0.00 C ATOM 552 C VAL A 85 3.221 8.911 -10.361 1.00 0.00 C ATOM 553 O VAL A 85 4.398 8.875 -10.713 1.00 0.00 O ATOM 554 CB VAL A 85 2.686 6.456 -10.345 1.00 0.00 C ATOM 555 CG1 VAL A 85 1.837 5.322 -9.808 1.00 0.00 C ATOM 556 CG2 VAL A 85 3.778 5.820 -11.223 1.00 0.00 C ATOM 0 H VAL A 85 0.803 7.545 -12.330 1.00 0.00 H new ATOM 0 HA VAL A 85 1.243 8.032 -10.303 1.00 0.00 H new ATOM 0 HB VAL A 85 2.999 6.932 -9.416 1.00 0.00 H new ATOM 0 HG11 VAL A 85 2.476 4.473 -9.565 1.00 0.00 H new ATOM 0 HG12 VAL A 85 1.315 5.652 -8.910 1.00 0.00 H new ATOM 0 HG13 VAL A 85 1.108 5.024 -10.562 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.058 4.851 -10.811 1.00 0.00 H new ATOM 0 HG22 VAL A 85 3.399 5.688 -12.236 1.00 0.00 H new ATOM 0 HG23 VAL A 85 4.652 6.471 -11.245 1.00 0.00 H new ATOM 566 N THR A 86 2.813 9.859 -9.513 1.00 0.00 N ATOM 567 CA THR A 86 3.734 10.804 -8.852 1.00 0.00 C ATOM 568 C THR A 86 4.786 10.087 -7.998 1.00 0.00 C ATOM 569 O THR A 86 5.935 10.533 -7.976 1.00 0.00 O ATOM 570 CB THR A 86 2.942 11.838 -8.027 1.00 0.00 C ATOM 571 OG1 THR A 86 2.325 12.731 -8.922 1.00 0.00 O ATOM 572 CG2 THR A 86 3.758 12.694 -7.056 1.00 0.00 C ATOM 0 H THR A 86 1.834 9.998 -9.261 1.00 0.00 H new ATOM 0 HA THR A 86 4.281 11.334 -9.632 1.00 0.00 H new ATOM 0 HB THR A 86 2.255 11.247 -7.421 1.00 0.00 H new ATOM 0 HG1 THR A 86 1.813 13.398 -8.418 1.00 0.00 H new ATOM 0 HG21 THR A 86 3.095 13.383 -6.533 1.00 0.00 H new ATOM 0 HG22 THR A 86 4.255 12.049 -6.332 1.00 0.00 H new ATOM 0 HG23 THR A 86 4.506 13.261 -7.611 1.00 0.00 H new ATOM 580 N ASN A 87 4.446 8.979 -7.318 1.00 0.00 N ATOM 581 CA ASN A 87 5.430 8.194 -6.567 1.00 0.00 C ATOM 582 C ASN A 87 5.004 6.757 -6.194 1.00 0.00 C ATOM 583 O ASN A 87 3.877 6.321 -6.400 1.00 0.00 O ATOM 584 CB ASN A 87 5.815 8.990 -5.287 1.00 0.00 C ATOM 585 CG ASN A 87 7.310 9.007 -5.005 1.00 0.00 C ATOM 586 OD1 ASN A 87 8.062 8.134 -5.411 1.00 0.00 O ATOM 587 ND2 ASN A 87 7.774 9.990 -4.267 1.00 0.00 N ATOM 0 H ASN A 87 3.496 8.610 -7.275 1.00 0.00 H new ATOM 0 HA ASN A 87 6.279 8.052 -7.236 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.461 10.016 -5.388 1.00 0.00 H new ATOM 0 HB3 ASN A 87 5.297 8.557 -4.431 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.766 10.026 -4.031 1.00 0.00 H new ATOM 0 HD22 ASN A 87 7.143 10.717 -3.930 1.00 0.00 H new ATOM 594 N LEU A 88 5.909 6.032 -5.545 1.00 0.00 N ATOM 595 CA LEU A 88 5.638 4.902 -4.654 1.00 0.00 C ATOM 596 C LEU A 88 6.494 4.940 -3.371 1.00 0.00 C ATOM 597 O LEU A 88 7.416 5.745 -3.235 1.00 0.00 O ATOM 598 CB LEU A 88 5.810 3.602 -5.452 1.00 0.00 C ATOM 599 CG LEU A 88 7.237 3.031 -5.423 1.00 0.00 C ATOM 600 CD1 LEU A 88 7.207 1.732 -6.190 1.00 0.00 C ATOM 601 CD2 LEU A 88 8.319 3.920 -6.025 1.00 0.00 C ATOM 0 H LEU A 88 6.907 6.225 -5.629 1.00 0.00 H new ATOM 0 HA LEU A 88 4.610 4.963 -4.296 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.123 2.853 -5.058 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.524 3.784 -6.488 1.00 0.00 H new ATOM 0 HG LEU A 88 7.508 2.924 -4.373 1.00 0.00 H new ATOM 0 HD11 LEU A 88 8.203 1.290 -6.195 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.507 1.045 -5.714 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.889 1.922 -7.215 1.00 0.00 H new ATOM 0 HD21 LEU A 88 9.284 3.419 -5.951 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.090 4.113 -7.073 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.358 4.864 -5.482 1.00 0.00 H new ATOM 613 N LEU A 89 6.203 4.031 -2.439 1.00 0.00 N ATOM 614 CA LEU A 89 6.999 3.740 -1.244 1.00 0.00 C ATOM 615 C LEU A 89 6.972 2.236 -0.965 1.00 0.00 C ATOM 616 O LEU A 89 6.025 1.554 -1.352 1.00 0.00 O ATOM 617 CB LEU A 89 6.525 4.665 -0.105 1.00 0.00 C ATOM 618 CG LEU A 89 6.434 4.142 1.330 1.00 0.00 C ATOM 619 CD1 LEU A 89 5.843 5.280 2.145 1.00 0.00 C ATOM 620 CD2 LEU A 89 5.485 2.989 1.558 1.00 0.00 C ATOM 0 H LEU A 89 5.367 3.450 -2.499 1.00 0.00 H new ATOM 0 HA LEU A 89 8.058 3.965 -1.372 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.191 5.527 -0.092 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.535 5.031 -0.378 1.00 0.00 H new ATOM 0 HG LEU A 89 7.435 3.800 1.592 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.750 4.972 3.186 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.496 6.151 2.081 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.858 5.535 1.753 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.505 2.704 2.610 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.474 3.290 1.282 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.791 2.140 0.947 1.00 0.00 H new ATOM 632 N MET A 90 7.980 1.720 -0.256 1.00 0.00 N ATOM 633 CA MET A 90 8.089 0.300 0.099 1.00 0.00 C ATOM 634 C MET A 90 8.340 0.106 1.595 1.00 0.00 C ATOM 635 O MET A 90 9.445 0.337 2.087 1.00 0.00 O ATOM 636 CB MET A 90 9.163 -0.396 -0.755 1.00 0.00 C ATOM 637 CG MET A 90 8.872 -0.195 -2.241 1.00 0.00 C ATOM 638 SD MET A 90 9.467 -1.509 -3.331 1.00 0.00 S ATOM 639 CE MET A 90 8.009 -1.521 -4.400 1.00 0.00 C ATOM 0 H MET A 90 8.755 2.284 0.093 1.00 0.00 H new ATOM 0 HA MET A 90 7.131 -0.172 -0.121 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.147 0.006 -0.513 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.188 -1.461 -0.523 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.795 -0.096 -2.373 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.319 0.747 -2.558 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.292 -1.855 -5.398 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.262 -2.199 -3.989 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.593 -0.515 -4.459 1.00 0.00 H new ATOM 649 N LEU A 91 7.323 -0.372 2.321 1.00 0.00 N ATOM 650 CA LEU A 91 7.462 -0.922 3.679 1.00 0.00 C ATOM 651 C LEU A 91 8.018 -2.358 3.598 1.00 0.00 C ATOM 652 O LEU A 91 7.404 -3.318 4.076 1.00 0.00 O ATOM 653 CB LEU A 91 6.107 -0.907 4.424 1.00 0.00 C ATOM 654 CG LEU A 91 5.261 0.374 4.570 1.00 0.00 C ATOM 655 CD1 LEU A 91 6.112 1.623 4.783 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.251 0.531 3.437 1.00 0.00 C ATOM 0 H LEU A 91 6.363 -0.389 1.978 1.00 0.00 H new ATOM 0 HA LEU A 91 8.157 -0.298 4.241 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.473 -1.647 3.935 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.301 -1.271 5.433 1.00 0.00 H new ATOM 0 HG LEU A 91 4.679 0.255 5.484 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.463 2.493 4.879 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.704 1.510 5.691 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.778 1.759 3.931 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.679 1.447 3.584 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.778 0.581 2.484 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.573 -0.323 3.433 1.00 0.00 H new ATOM 668 N LYS A 92 9.159 -2.527 2.922 1.00 0.00 N ATOM 669 CA LYS A 92 9.594 -3.826 2.390 1.00 0.00 C ATOM 670 C LYS A 92 9.892 -4.871 3.475 1.00 0.00 C ATOM 671 O LYS A 92 9.648 -6.054 3.265 1.00 0.00 O ATOM 672 CB LYS A 92 10.760 -3.613 1.408 1.00 0.00 C ATOM 673 CG LYS A 92 11.016 -4.837 0.511 1.00 0.00 C ATOM 674 CD LYS A 92 11.823 -4.445 -0.738 1.00 0.00 C ATOM 675 CE LYS A 92 12.262 -5.692 -1.517 1.00 0.00 C ATOM 676 NZ LYS A 92 12.898 -5.341 -2.812 1.00 0.00 N ATOM 0 H LYS A 92 9.810 -1.766 2.727 1.00 0.00 H new ATOM 0 HA LYS A 92 8.759 -4.261 1.841 1.00 0.00 H new ATOM 0 HB2 LYS A 92 10.547 -2.747 0.781 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.665 -3.385 1.970 1.00 0.00 H new ATOM 0 HG2 LYS A 92 11.557 -5.598 1.074 1.00 0.00 H new ATOM 0 HG3 LYS A 92 10.065 -5.278 0.211 1.00 0.00 H new ATOM 0 HD2 LYS A 92 11.219 -3.804 -1.380 1.00 0.00 H new ATOM 0 HD3 LYS A 92 12.699 -3.867 -0.444 1.00 0.00 H new ATOM 0 HE2 LYS A 92 12.962 -6.269 -0.913 1.00 0.00 H new ATOM 0 HE3 LYS A 92 11.397 -6.330 -1.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 13.563 -6.092 -3.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 12.165 -5.243 -3.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 13.412 -4.442 -2.714 1.00 0.00 H new ATOM 690 N GLY A 93 10.280 -4.427 4.674 1.00 0.00 N ATOM 691 CA GLY A 93 10.445 -5.263 5.875 1.00 0.00 C ATOM 692 C GLY A 93 9.154 -5.894 6.433 1.00 0.00 C ATOM 693 O GLY A 93 9.238 -6.829 7.229 1.00 0.00 O ATOM 0 H GLY A 93 10.496 -3.445 4.845 1.00 0.00 H new ATOM 0 HA2 GLY A 93 11.148 -6.063 5.644 1.00 0.00 H new ATOM 0 HA3 GLY A 93 10.899 -4.656 6.658 1.00 0.00 H new ATOM 697 N LYS A 94 7.967 -5.428 6.001 1.00 0.00 N ATOM 698 CA LYS A 94 6.647 -6.045 6.259 1.00 0.00 C ATOM 699 C LYS A 94 5.994 -6.622 4.992 1.00 0.00 C ATOM 700 O LYS A 94 4.861 -7.090 5.045 1.00 0.00 O ATOM 701 CB LYS A 94 5.685 -5.046 6.942 1.00 0.00 C ATOM 702 CG LYS A 94 6.149 -4.561 8.330 1.00 0.00 C ATOM 703 CD LYS A 94 6.282 -3.038 8.481 1.00 0.00 C ATOM 704 CE LYS A 94 7.584 -2.499 7.884 1.00 0.00 C ATOM 705 NZ LYS A 94 7.795 -1.071 8.254 1.00 0.00 N ATOM 0 H LYS A 94 7.896 -4.579 5.441 1.00 0.00 H new ATOM 0 HA LYS A 94 6.835 -6.880 6.934 1.00 0.00 H new ATOM 0 HB2 LYS A 94 5.558 -4.180 6.292 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.706 -5.515 7.043 1.00 0.00 H new ATOM 0 HG2 LYS A 94 5.444 -4.924 9.078 1.00 0.00 H new ATOM 0 HG3 LYS A 94 7.113 -5.018 8.553 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.436 -2.553 7.995 1.00 0.00 H new ATOM 0 HD3 LYS A 94 6.235 -2.776 9.538 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.424 -3.097 8.237 1.00 0.00 H new ATOM 0 HE3 LYS A 94 7.557 -2.596 6.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 8.649 -0.712 7.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 6.972 -0.510 7.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 7.912 -0.993 9.284 1.00 0.00 H new ATOM 719 N ASN A 95 6.680 -6.566 3.846 1.00 0.00 N ATOM 720 CA ASN A 95 6.134 -6.824 2.509 1.00 0.00 C ATOM 721 C ASN A 95 4.849 -6.019 2.241 1.00 0.00 C ATOM 722 O ASN A 95 3.810 -6.564 1.859 1.00 0.00 O ATOM 723 CB ASN A 95 5.967 -8.335 2.279 1.00 0.00 C ATOM 724 CG ASN A 95 7.289 -9.093 2.300 1.00 0.00 C ATOM 725 OD1 ASN A 95 7.964 -9.211 3.312 1.00 0.00 O ATOM 726 ND2 ASN A 95 7.711 -9.646 1.189 1.00 0.00 N ATOM 0 H ASN A 95 7.672 -6.330 3.823 1.00 0.00 H new ATOM 0 HA ASN A 95 6.852 -6.467 1.770 1.00 0.00 H new ATOM 0 HB2 ASN A 95 5.309 -8.743 3.047 1.00 0.00 H new ATOM 0 HB3 ASN A 95 5.477 -8.498 1.319 1.00 0.00 H new ATOM 0 HD21 ASN A 95 8.589 -10.164 1.179 1.00 0.00 H new ATOM 0 HD22 ASN A 95 7.161 -9.558 0.335 1.00 0.00 H new ATOM 733 N GLN A 96 4.927 -4.699 2.417 1.00 0.00 N ATOM 734 CA GLN A 96 3.856 -3.761 2.082 1.00 0.00 C ATOM 735 C GLN A 96 4.410 -2.561 1.272 1.00 0.00 C ATOM 736 O GLN A 96 5.625 -2.372 1.185 1.00 0.00 O ATOM 737 CB GLN A 96 3.157 -3.321 3.368 1.00 0.00 C ATOM 738 CG GLN A 96 2.560 -4.471 4.197 1.00 0.00 C ATOM 739 CD GLN A 96 2.214 -4.001 5.591 1.00 0.00 C ATOM 740 OE1 GLN A 96 1.734 -2.792 5.719 1.00 0.00 O flip ATOM 741 NE2 GLN A 96 2.375 -4.687 6.589 1.00 0.00 N flip ATOM 0 H GLN A 96 5.753 -4.244 2.804 1.00 0.00 H new ATOM 0 HA GLN A 96 3.120 -4.251 1.444 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.871 -2.777 3.986 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.360 -2.623 3.112 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.666 -4.855 3.705 1.00 0.00 H new ATOM 0 HG3 GLN A 96 3.272 -5.294 4.252 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.749 -5.632 6.503 1.00 0.00 H new ATOM 0 HE22 GLN A 96 2.136 -4.315 7.508 1.00 0.00 H new ATOM 750 N ALA A 97 3.548 -1.729 0.684 1.00 0.00 N ATOM 751 CA ALA A 97 3.926 -0.566 -0.141 1.00 0.00 C ATOM 752 C ALA A 97 2.832 0.513 -0.155 1.00 0.00 C ATOM 753 O ALA A 97 1.680 0.254 0.192 1.00 0.00 O ATOM 754 CB ALA A 97 4.168 -1.070 -1.577 1.00 0.00 C ATOM 0 H ALA A 97 2.538 -1.844 0.767 1.00 0.00 H new ATOM 0 HA ALA A 97 4.822 -0.110 0.280 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.450 -0.232 -2.214 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.970 -1.809 -1.573 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.256 -1.527 -1.961 1.00 0.00 H new ATOM 760 N PHE A 98 3.189 1.706 -0.635 1.00 0.00 N ATOM 761 CA PHE A 98 2.280 2.753 -1.112 1.00 0.00 C ATOM 762 C PHE A 98 2.456 2.891 -2.633 1.00 0.00 C ATOM 763 O PHE A 98 3.552 2.653 -3.147 1.00 0.00 O ATOM 764 CB PHE A 98 2.611 4.126 -0.515 1.00 0.00 C ATOM 765 CG PHE A 98 2.231 4.439 0.922 1.00 0.00 C ATOM 766 CD1 PHE A 98 1.965 3.441 1.882 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.149 5.793 1.305 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.619 3.805 3.190 1.00 0.00 C ATOM 769 CE2 PHE A 98 1.756 6.158 2.590 1.00 0.00 C ATOM 770 CZ PHE A 98 1.494 5.161 3.526 1.00 0.00 C ATOM 0 H PHE A 98 4.168 1.983 -0.706 1.00 0.00 H new ATOM 0 HA PHE A 98 1.270 2.465 -0.820 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.688 4.267 -0.604 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.138 4.877 -1.147 1.00 0.00 H new ATOM 0 HD1 PHE A 98 2.028 2.398 1.610 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.396 6.562 0.588 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.449 3.044 3.937 1.00 0.00 H new ATOM 0 HE2 PHE A 98 1.656 7.200 2.857 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.190 5.436 4.525 1.00 0.00 H new ATOM 780 N ILE A 99 1.449 3.396 -3.343 1.00 0.00 N ATOM 781 CA ILE A 99 1.545 3.847 -4.734 1.00 0.00 C ATOM 782 C ILE A 99 0.728 5.141 -4.900 1.00 0.00 C ATOM 783 O ILE A 99 -0.496 5.157 -4.790 1.00 0.00 O ATOM 784 CB ILE A 99 1.228 2.676 -5.700 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.524 3.093 -7.149 1.00 0.00 C ATOM 786 CG2 ILE A 99 -0.170 2.067 -5.517 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.317 1.975 -8.181 1.00 0.00 C ATOM 0 H ILE A 99 0.512 3.507 -2.955 1.00 0.00 H new ATOM 0 HA ILE A 99 2.561 4.129 -5.011 1.00 0.00 H new ATOM 0 HB ILE A 99 1.896 1.856 -5.438 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.885 3.936 -7.410 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.554 3.443 -7.211 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.310 1.255 -6.231 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.268 1.679 -4.503 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.926 2.834 -5.687 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.547 2.352 -9.177 1.00 0.00 H new ATOM 0 HD12 ILE A 99 1.976 1.139 -7.948 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.280 1.639 -8.151 1.00 0.00 H new ATOM 799 N GLU A 100 1.442 6.261 -5.030 1.00 0.00 N ATOM 800 CA GLU A 100 0.981 7.658 -5.101 1.00 0.00 C ATOM 801 C GLU A 100 0.878 8.129 -6.544 1.00 0.00 C ATOM 802 O GLU A 100 1.772 7.903 -7.359 1.00 0.00 O ATOM 803 CB GLU A 100 2.001 8.528 -4.355 1.00 0.00 C ATOM 804 CG GLU A 100 2.036 10.042 -4.656 1.00 0.00 C ATOM 805 CD GLU A 100 0.801 10.826 -4.189 1.00 0.00 C ATOM 806 OE1 GLU A 100 0.287 10.536 -3.087 1.00 0.00 O ATOM 807 OE2 GLU A 100 0.392 11.777 -4.897 1.00 0.00 O ATOM 0 H GLU A 100 2.459 6.212 -5.095 1.00 0.00 H new ATOM 0 HA GLU A 100 -0.009 7.736 -4.651 1.00 0.00 H new ATOM 0 HB2 GLU A 100 1.822 8.406 -3.287 1.00 0.00 H new ATOM 0 HB3 GLU A 100 2.993 8.126 -4.560 1.00 0.00 H new ATOM 0 HG2 GLU A 100 2.920 10.471 -4.183 1.00 0.00 H new ATOM 0 HG3 GLU A 100 2.151 10.181 -5.731 1.00 0.00 H new ATOM 814 N MET A 101 -0.188 8.848 -6.871 1.00 0.00 N ATOM 815 CA MET A 101 -0.513 9.107 -8.265 1.00 0.00 C ATOM 816 C MET A 101 -0.859 10.557 -8.611 1.00 0.00 C ATOM 817 O MET A 101 -1.290 11.344 -7.780 1.00 0.00 O ATOM 818 CB MET A 101 -1.460 7.979 -8.670 1.00 0.00 C ATOM 819 CG MET A 101 -2.349 8.251 -9.880 1.00 0.00 C ATOM 820 SD MET A 101 -1.472 8.217 -11.448 1.00 0.00 S ATOM 821 CE MET A 101 -1.047 6.460 -11.403 1.00 0.00 C ATOM 0 H MET A 101 -0.835 9.258 -6.197 1.00 0.00 H new ATOM 0 HA MET A 101 0.358 9.064 -8.919 1.00 0.00 H new ATOM 0 HB2 MET A 101 -0.865 7.089 -8.874 1.00 0.00 H new ATOM 0 HB3 MET A 101 -2.100 7.746 -7.819 1.00 0.00 H new ATOM 0 HG2 MET A 101 -3.148 7.510 -9.905 1.00 0.00 H new ATOM 0 HG3 MET A 101 -2.822 9.226 -9.760 1.00 0.00 H new ATOM 0 HE1 MET A 101 -0.339 6.236 -12.201 1.00 0.00 H new ATOM 0 HE2 MET A 101 -0.597 6.219 -10.440 1.00 0.00 H new ATOM 0 HE3 MET A 101 -1.949 5.864 -11.541 1.00 0.00 H new ATOM 831 N ASN A 102 -0.563 10.939 -9.859 1.00 0.00 N ATOM 832 CA ASN A 102 -0.542 12.332 -10.319 1.00 0.00 C ATOM 833 C ASN A 102 -1.935 12.973 -10.451 1.00 0.00 C ATOM 834 O ASN A 102 -2.049 14.197 -10.524 1.00 0.00 O ATOM 835 CB ASN A 102 0.295 12.291 -11.613 1.00 0.00 C ATOM 836 CG ASN A 102 -0.106 13.223 -12.742 1.00 0.00 C ATOM 837 OD1 ASN A 102 -0.620 12.648 -13.807 1.00 0.00 O flip ATOM 838 ND2 ASN A 102 0.093 14.429 -12.714 1.00 0.00 N flip ATOM 0 H ASN A 102 -0.326 10.272 -10.594 1.00 0.00 H new ATOM 0 HA ASN A 102 -0.091 13.002 -9.587 1.00 0.00 H new ATOM 0 HB2 ASN A 102 1.330 12.509 -11.350 1.00 0.00 H new ATOM 0 HB3 ASN A 102 0.271 11.271 -11.996 1.00 0.00 H new ATOM 0 HD21 ASN A 102 0.492 14.861 -11.881 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.140 15.003 -13.524 1.00 0.00 H new ATOM 845 N THR A 103 -2.998 12.163 -10.452 1.00 0.00 N ATOM 846 CA THR A 103 -4.387 12.614 -10.633 1.00 0.00 C ATOM 847 C THR A 103 -5.332 11.771 -9.778 1.00 0.00 C ATOM 848 O THR A 103 -5.122 10.571 -9.582 1.00 0.00 O ATOM 849 CB THR A 103 -4.815 12.659 -12.127 1.00 0.00 C ATOM 850 OG1 THR A 103 -5.821 11.732 -12.449 1.00 0.00 O ATOM 851 CG2 THR A 103 -3.671 12.432 -13.126 1.00 0.00 C ATOM 0 H THR A 103 -2.919 11.154 -10.325 1.00 0.00 H new ATOM 0 HA THR A 103 -4.449 13.646 -10.287 1.00 0.00 H new ATOM 0 HB THR A 103 -5.186 13.679 -12.226 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.046 11.811 -13.399 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.061 12.480 -14.143 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.912 13.203 -12.991 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.227 11.452 -12.954 1.00 0.00 H new ATOM 859 N GLU A 104 -6.371 12.409 -9.238 1.00 0.00 N ATOM 860 CA GLU A 104 -7.389 11.750 -8.408 1.00 0.00 C ATOM 861 C GLU A 104 -8.181 10.708 -9.213 1.00 0.00 C ATOM 862 O GLU A 104 -8.487 9.628 -8.706 1.00 0.00 O ATOM 863 CB GLU A 104 -8.348 12.796 -7.815 1.00 0.00 C ATOM 864 CG GLU A 104 -7.617 13.883 -7.012 1.00 0.00 C ATOM 865 CD GLU A 104 -8.597 14.860 -6.327 1.00 0.00 C ATOM 866 OE1 GLU A 104 -9.555 15.342 -6.982 1.00 0.00 O ATOM 867 OE2 GLU A 104 -8.400 15.184 -5.131 1.00 0.00 O ATOM 0 H GLU A 104 -6.534 13.408 -9.364 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.875 11.231 -7.599 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.913 13.264 -8.622 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -9.070 12.296 -7.169 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -6.988 13.413 -6.256 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.956 14.440 -7.676 1.00 0.00 H new ATOM 874 N GLU A 105 -8.472 11.003 -10.484 1.00 0.00 N ATOM 875 CA GLU A 105 -9.183 10.097 -11.387 1.00 0.00 C ATOM 876 C GLU A 105 -8.325 8.922 -11.851 1.00 0.00 C ATOM 877 O GLU A 105 -8.822 7.799 -11.902 1.00 0.00 O ATOM 878 CB GLU A 105 -9.689 10.859 -12.622 1.00 0.00 C ATOM 879 CG GLU A 105 -10.788 11.884 -12.308 1.00 0.00 C ATOM 880 CD GLU A 105 -12.055 11.223 -11.727 1.00 0.00 C ATOM 881 OE1 GLU A 105 -12.806 10.564 -12.487 1.00 0.00 O ATOM 882 OE2 GLU A 105 -12.312 11.360 -10.507 1.00 0.00 O ATOM 0 H GLU A 105 -8.216 11.890 -10.919 1.00 0.00 H new ATOM 0 HA GLU A 105 -10.020 9.695 -10.816 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.849 11.372 -13.090 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.070 10.142 -13.349 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.406 12.618 -11.598 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -11.048 12.425 -13.218 1.00 0.00 H new ATOM 889 N ALA A 106 -7.041 9.148 -12.144 1.00 0.00 N ATOM 890 CA ALA A 106 -6.073 8.087 -12.386 1.00 0.00 C ATOM 891 C ALA A 106 -6.043 7.116 -11.222 1.00 0.00 C ATOM 892 O ALA A 106 -6.184 5.925 -11.430 1.00 0.00 O ATOM 893 CB ALA A 106 -4.687 8.664 -12.624 1.00 0.00 C ATOM 0 H ALA A 106 -6.645 10.085 -12.219 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.381 7.548 -13.282 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -3.981 7.853 -12.802 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.711 9.322 -13.493 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.374 9.232 -11.748 1.00 0.00 H new ATOM 899 N ALA A 107 -5.891 7.595 -9.991 1.00 0.00 N ATOM 900 CA ALA A 107 -5.849 6.708 -8.839 1.00 0.00 C ATOM 901 C ALA A 107 -7.188 6.039 -8.513 1.00 0.00 C ATOM 902 O ALA A 107 -7.201 4.854 -8.186 1.00 0.00 O ATOM 903 CB ALA A 107 -5.342 7.505 -7.668 1.00 0.00 C ATOM 0 H ALA A 107 -5.796 8.586 -9.769 1.00 0.00 H new ATOM 0 HA ALA A 107 -5.181 5.879 -9.074 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.298 6.867 -6.785 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -4.345 7.885 -7.891 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -6.015 8.341 -7.478 1.00 0.00 H new ATOM 909 N ASN A 108 -8.315 6.739 -8.664 1.00 0.00 N ATOM 910 CA ASN A 108 -9.640 6.121 -8.597 1.00 0.00 C ATOM 911 C ASN A 108 -9.750 4.969 -9.609 1.00 0.00 C ATOM 912 O ASN A 108 -10.085 3.847 -9.232 1.00 0.00 O ATOM 913 CB ASN A 108 -10.717 7.197 -8.806 1.00 0.00 C ATOM 914 CG ASN A 108 -12.115 6.601 -8.794 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.683 6.251 -9.820 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.712 6.453 -7.634 1.00 0.00 N ATOM 0 H ASN A 108 -8.335 7.744 -8.835 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.796 5.683 -7.611 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.636 7.951 -8.023 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.546 7.704 -9.755 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.647 6.047 -7.590 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.241 6.744 -6.777 1.00 0.00 H new ATOM 923 N THR A 109 -9.378 5.199 -10.869 1.00 0.00 N ATOM 924 CA THR A 109 -9.342 4.141 -11.876 1.00 0.00 C ATOM 925 C THR A 109 -8.267 3.099 -11.563 1.00 0.00 C ATOM 926 O THR A 109 -8.484 1.940 -11.873 1.00 0.00 O ATOM 927 CB THR A 109 -9.237 4.715 -13.307 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.191 4.088 -14.142 1.00 0.00 O ATOM 929 CG2 THR A 109 -7.884 4.541 -13.995 1.00 0.00 C ATOM 0 H THR A 109 -9.096 6.115 -11.217 1.00 0.00 H new ATOM 0 HA THR A 109 -10.294 3.612 -11.835 1.00 0.00 H new ATOM 0 HB THR A 109 -9.402 5.784 -13.175 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.124 4.455 -15.048 1.00 0.00 H new ATOM 0 HG21 THR A 109 -7.924 4.980 -14.992 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.111 5.039 -13.410 1.00 0.00 H new ATOM 0 HG23 THR A 109 -7.650 3.479 -14.075 1.00 0.00 H new ATOM 937 N MET A 110 -7.154 3.451 -10.895 1.00 0.00 N ATOM 938 CA MET A 110 -6.043 2.548 -10.595 1.00 0.00 C ATOM 939 C MET A 110 -6.457 1.542 -9.517 1.00 0.00 C ATOM 940 O MET A 110 -6.246 0.342 -9.655 1.00 0.00 O ATOM 941 CB MET A 110 -4.757 3.315 -10.176 1.00 0.00 C ATOM 942 CG MET A 110 -3.543 2.472 -10.593 1.00 0.00 C ATOM 943 SD MET A 110 -1.929 3.229 -10.315 1.00 0.00 S ATOM 944 CE MET A 110 -2.120 3.564 -8.565 1.00 0.00 C ATOM 0 H MET A 110 -7.005 4.396 -10.543 1.00 0.00 H new ATOM 0 HA MET A 110 -5.801 2.007 -11.510 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.724 4.293 -10.655 1.00 0.00 H new ATOM 0 HB3 MET A 110 -4.750 3.487 -9.100 1.00 0.00 H new ATOM 0 HG2 MET A 110 -3.578 1.526 -10.052 1.00 0.00 H new ATOM 0 HG3 MET A 110 -3.635 2.236 -11.653 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.153 3.473 -8.069 1.00 0.00 H new ATOM 0 HE2 MET A 110 -2.504 4.575 -8.428 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.819 2.849 -8.132 1.00 0.00 H new ATOM 954 N VAL A 111 -7.111 2.013 -8.456 1.00 0.00 N ATOM 955 CA VAL A 111 -7.644 1.163 -7.389 1.00 0.00 C ATOM 956 C VAL A 111 -8.814 0.307 -7.868 1.00 0.00 C ATOM 957 O VAL A 111 -8.885 -0.876 -7.544 1.00 0.00 O ATOM 958 CB VAL A 111 -8.007 2.014 -6.163 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.411 2.592 -6.128 1.00 0.00 C ATOM 960 CG2 VAL A 111 -7.817 1.181 -4.895 1.00 0.00 C ATOM 0 H VAL A 111 -7.288 3.007 -8.310 1.00 0.00 H new ATOM 0 HA VAL A 111 -6.864 0.462 -7.091 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.335 2.870 -6.228 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.543 3.171 -5.214 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.560 3.239 -6.993 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.139 1.781 -6.152 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -8.074 1.782 -4.023 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.464 0.305 -4.935 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.777 0.861 -4.822 1.00 0.00 H new ATOM 970 N ASN A 112 -9.712 0.868 -8.689 1.00 0.00 N ATOM 971 CA ASN A 112 -10.857 0.141 -9.240 1.00 0.00 C ATOM 972 C ASN A 112 -10.384 -0.924 -10.240 1.00 0.00 C ATOM 973 O ASN A 112 -10.799 -2.075 -10.141 1.00 0.00 O ATOM 974 CB ASN A 112 -11.848 1.132 -9.862 1.00 0.00 C ATOM 975 CG ASN A 112 -12.745 1.775 -8.810 1.00 0.00 C ATOM 976 OD1 ASN A 112 -13.936 1.509 -8.740 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.219 2.599 -7.930 1.00 0.00 N ATOM 0 H ASN A 112 -9.662 1.842 -8.989 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.378 -0.387 -8.441 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.299 1.909 -10.395 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.464 0.616 -10.598 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.804 3.007 -7.201 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.227 2.830 -7.977 1.00 0.00 H new ATOM 984 N TYR A 113 -9.427 -0.582 -11.107 1.00 0.00 N ATOM 985 CA TYR A 113 -8.642 -1.515 -11.915 1.00 0.00 C ATOM 986 C TYR A 113 -8.080 -2.658 -11.076 1.00 0.00 C ATOM 987 O TYR A 113 -8.237 -3.812 -11.452 1.00 0.00 O ATOM 988 CB TYR A 113 -7.505 -0.756 -12.618 1.00 0.00 C ATOM 989 CG TYR A 113 -6.416 -1.628 -13.203 1.00 0.00 C ATOM 990 CD1 TYR A 113 -6.581 -2.132 -14.504 1.00 0.00 C ATOM 991 CD2 TYR A 113 -5.231 -1.888 -12.481 1.00 0.00 C ATOM 992 CE1 TYR A 113 -5.605 -2.977 -15.065 1.00 0.00 C ATOM 993 CE2 TYR A 113 -4.267 -2.762 -13.027 1.00 0.00 C ATOM 994 CZ TYR A 113 -4.449 -3.301 -14.319 1.00 0.00 C ATOM 995 OH TYR A 113 -3.474 -4.084 -14.860 1.00 0.00 O ATOM 0 H TYR A 113 -9.169 0.391 -11.271 1.00 0.00 H new ATOM 0 HA TYR A 113 -9.303 -1.957 -12.661 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -7.933 -0.151 -13.417 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.053 -0.067 -11.904 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -7.459 -1.870 -15.075 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -5.064 -1.423 -11.521 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -5.739 -3.376 -16.060 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -3.388 -3.019 -12.455 1.00 0.00 H new ATOM 0 HH TYR A 113 -2.752 -4.204 -14.208 1.00 0.00 H new ATOM 1005 N TYR A 114 -7.518 -2.390 -9.899 1.00 0.00 N ATOM 1006 CA TYR A 114 -6.911 -3.416 -9.059 1.00 0.00 C ATOM 1007 C TYR A 114 -7.935 -4.202 -8.254 1.00 0.00 C ATOM 1008 O TYR A 114 -7.652 -5.304 -7.781 1.00 0.00 O ATOM 1009 CB TYR A 114 -5.859 -2.790 -8.159 1.00 0.00 C ATOM 1010 CG TYR A 114 -4.548 -2.459 -8.832 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -3.904 -3.410 -9.653 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -3.912 -1.245 -8.510 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -2.556 -3.194 -10.009 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -2.581 -1.020 -8.887 1.00 0.00 C ATOM 1015 CZ TYR A 114 -1.888 -2.019 -9.598 1.00 0.00 C ATOM 1016 OH TYR A 114 -0.568 -1.849 -9.869 1.00 0.00 O ATOM 0 H TYR A 114 -7.472 -1.452 -9.501 1.00 0.00 H new ATOM 0 HA TYR A 114 -6.431 -4.140 -9.718 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.269 -1.876 -7.730 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -5.662 -3.470 -7.331 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -4.432 -4.285 -10.001 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.453 -0.483 -7.969 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -2.032 -3.931 -10.599 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.092 -0.091 -8.635 1.00 0.00 H new ATOM 0 HH TYR A 114 -0.270 -0.985 -9.516 1.00 0.00 H new ATOM 1026 N THR A 115 -9.150 -3.663 -8.186 1.00 0.00 N ATOM 1027 CA THR A 115 -10.318 -4.321 -7.626 1.00 0.00 C ATOM 1028 C THR A 115 -11.005 -5.212 -8.690 1.00 0.00 C ATOM 1029 O THR A 115 -11.809 -6.091 -8.368 1.00 0.00 O ATOM 1030 CB THR A 115 -11.230 -3.262 -6.970 1.00 0.00 C ATOM 1031 OG1 THR A 115 -10.519 -2.620 -5.934 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.496 -3.823 -6.322 1.00 0.00 C ATOM 0 H THR A 115 -9.351 -2.725 -8.532 1.00 0.00 H new ATOM 0 HA THR A 115 -10.035 -5.012 -6.832 1.00 0.00 H new ATOM 0 HB THR A 115 -11.526 -2.599 -7.783 1.00 0.00 H new ATOM 0 HG1 THR A 115 -9.894 -1.971 -6.320 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.074 -3.008 -5.887 1.00 0.00 H new ATOM 0 HG22 THR A 115 -13.096 -4.332 -7.076 1.00 0.00 H new ATOM 0 HG23 THR A 115 -12.221 -4.530 -5.539 1.00 0.00 H new ATOM 1040 N SER A 116 -10.627 -5.031 -9.962 1.00 0.00 N ATOM 1041 CA SER A 116 -11.087 -5.727 -11.172 1.00 0.00 C ATOM 1042 C SER A 116 -10.142 -6.857 -11.607 1.00 0.00 C ATOM 1043 O SER A 116 -10.547 -8.008 -11.786 1.00 0.00 O ATOM 1044 CB SER A 116 -11.132 -4.696 -12.317 1.00 0.00 C ATOM 1045 OG SER A 116 -12.352 -4.764 -13.040 1.00 0.00 O ATOM 0 H SER A 116 -9.925 -4.327 -10.192 1.00 0.00 H new ATOM 0 HA SER A 116 -12.060 -6.167 -10.953 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.007 -3.693 -11.908 1.00 0.00 H new ATOM 0 HB3 SER A 116 -10.297 -4.870 -12.996 1.00 0.00 H new ATOM 0 HG SER A 116 -12.345 -4.095 -13.756 1.00 0.00 H new ATOM 1051 N VAL A 117 -8.874 -6.495 -11.814 1.00 0.00 N ATOM 1052 CA VAL A 117 -7.836 -7.223 -12.558 1.00 0.00 C ATOM 1053 C VAL A 117 -7.346 -8.488 -11.842 1.00 0.00 C ATOM 1054 O VAL A 117 -6.954 -9.462 -12.483 1.00 0.00 O ATOM 1055 CB VAL A 117 -6.639 -6.263 -12.790 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -5.857 -5.977 -11.536 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -5.700 -6.781 -13.872 1.00 0.00 C ATOM 0 H VAL A 117 -8.515 -5.617 -11.438 1.00 0.00 H new ATOM 0 HA VAL A 117 -8.276 -7.554 -13.499 1.00 0.00 H new ATOM 0 HB VAL A 117 -7.084 -5.325 -13.122 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.034 -5.300 -11.767 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.511 -5.515 -10.797 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.458 -6.909 -11.135 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -4.875 -6.080 -14.004 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.306 -7.754 -13.577 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -6.246 -6.880 -14.810 1.00 0.00 H new ATOM 1067 N THR A 118 -7.351 -8.418 -10.506 1.00 0.00 N ATOM 1068 CA THR A 118 -6.259 -8.733 -9.554 1.00 0.00 C ATOM 1069 C THR A 118 -4.984 -9.349 -10.171 1.00 0.00 C ATOM 1070 O THR A 118 -5.051 -10.466 -10.676 1.00 0.00 O ATOM 1071 CB THR A 118 -6.741 -9.561 -8.351 1.00 0.00 C ATOM 1072 OG1 THR A 118 -8.060 -9.226 -7.972 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.858 -9.228 -7.149 1.00 0.00 C ATOM 0 H THR A 118 -8.189 -8.113 -10.011 1.00 0.00 H new ATOM 0 HA THR A 118 -5.954 -7.748 -9.201 1.00 0.00 H new ATOM 0 HB THR A 118 -6.696 -10.611 -8.639 1.00 0.00 H new ATOM 0 HG1 THR A 118 -8.330 -9.775 -7.206 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.186 -9.807 -6.285 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.822 -9.475 -7.379 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.936 -8.164 -6.924 1.00 0.00 H new ATOM 1081 N PRO A 119 -3.807 -8.675 -10.164 1.00 0.00 N ATOM 1082 CA PRO A 119 -2.683 -8.966 -11.068 1.00 0.00 C ATOM 1083 C PRO A 119 -1.876 -10.240 -10.698 1.00 0.00 C ATOM 1084 O PRO A 119 -0.938 -10.614 -11.403 1.00 0.00 O ATOM 1085 CB PRO A 119 -1.803 -7.694 -11.061 1.00 0.00 C ATOM 1086 CG PRO A 119 -2.522 -6.692 -10.156 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.384 -7.591 -9.290 1.00 0.00 C ATOM 0 HA PRO A 119 -3.060 -9.198 -12.064 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -0.803 -7.913 -10.685 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -1.685 -7.295 -12.069 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -1.821 -6.107 -9.561 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -3.121 -5.985 -10.729 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -2.823 -7.970 -8.436 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -4.242 -7.049 -8.892 1.00 0.00 H new ATOM 1095 N VAL A 120 -2.275 -10.912 -9.609 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.813 -12.177 -9.008 1.00 0.00 C ATOM 1097 C VAL A 120 -0.344 -12.209 -8.579 1.00 0.00 C ATOM 1098 O VAL A 120 0.587 -12.267 -9.383 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.198 -13.410 -9.839 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -2.206 -14.666 -8.956 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -3.616 -13.269 -10.389 1.00 0.00 C ATOM 0 H VAL A 120 -3.036 -10.528 -9.050 1.00 0.00 H new ATOM 0 HA VAL A 120 -2.368 -12.225 -8.071 1.00 0.00 H new ATOM 0 HB VAL A 120 -1.469 -13.492 -10.646 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -2.481 -15.532 -9.558 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -1.214 -14.819 -8.532 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -2.930 -14.540 -8.151 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -3.869 -14.153 -10.975 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.319 -13.168 -9.562 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -3.674 -12.385 -11.024 1.00 0.00 H new ATOM 1111 N LEU A 121 -0.142 -12.206 -7.263 1.00 0.00 N ATOM 1112 CA LEU A 121 1.137 -12.336 -6.574 1.00 0.00 C ATOM 1113 C LEU A 121 1.589 -13.805 -6.616 1.00 0.00 C ATOM 1114 O LEU A 121 1.353 -14.567 -5.677 1.00 0.00 O ATOM 1115 CB LEU A 121 0.943 -11.770 -5.154 1.00 0.00 C ATOM 1116 CG LEU A 121 2.228 -11.355 -4.444 1.00 0.00 C ATOM 1117 CD1 LEU A 121 1.846 -10.562 -3.204 1.00 0.00 C ATOM 1118 CD2 LEU A 121 3.135 -12.510 -4.022 1.00 0.00 C ATOM 0 H LEU A 121 -0.918 -12.106 -6.609 1.00 0.00 H new ATOM 0 HA LEU A 121 1.938 -11.772 -7.051 1.00 0.00 H new ATOM 0 HB2 LEU A 121 0.282 -10.905 -5.211 1.00 0.00 H new ATOM 0 HB3 LEU A 121 0.436 -12.520 -4.547 1.00 0.00 H new ATOM 0 HG LEU A 121 2.803 -10.773 -5.164 1.00 0.00 H new ATOM 0 HD11 LEU A 121 2.749 -10.253 -2.677 1.00 0.00 H new ATOM 0 HD12 LEU A 121 1.277 -9.680 -3.497 1.00 0.00 H new ATOM 0 HD13 LEU A 121 1.238 -11.184 -2.547 1.00 0.00 H new ATOM 0 HD21 LEU A 121 4.021 -12.114 -3.526 1.00 0.00 H new ATOM 0 HD22 LEU A 121 2.597 -13.163 -3.335 1.00 0.00 H new ATOM 0 HD23 LEU A 121 3.435 -13.078 -4.903 1.00 0.00 H new ATOM 1130 N ARG A 122 2.166 -14.192 -7.763 1.00 0.00 N ATOM 1131 CA ARG A 122 2.625 -15.507 -8.292 1.00 0.00 C ATOM 1132 C ARG A 122 1.708 -16.743 -8.146 1.00 0.00 C ATOM 1133 O ARG A 122 1.933 -17.745 -8.826 1.00 0.00 O ATOM 1134 CB ARG A 122 4.111 -15.763 -7.933 1.00 0.00 C ATOM 1135 CG ARG A 122 4.443 -16.713 -6.767 1.00 0.00 C ATOM 1136 CD ARG A 122 3.792 -16.312 -5.443 1.00 0.00 C ATOM 1137 NE ARG A 122 4.299 -17.086 -4.299 1.00 0.00 N ATOM 1138 CZ ARG A 122 3.789 -17.085 -3.080 1.00 0.00 C ATOM 1139 NH1 ARG A 122 2.743 -16.367 -2.778 1.00 0.00 N ATOM 1140 NH2 ARG A 122 4.318 -17.809 -2.135 1.00 0.00 N ATOM 0 H ARG A 122 2.356 -13.475 -8.463 1.00 0.00 H new ATOM 0 HA ARG A 122 2.534 -15.377 -9.370 1.00 0.00 H new ATOM 0 HB2 ARG A 122 4.603 -16.152 -8.825 1.00 0.00 H new ATOM 0 HB3 ARG A 122 4.567 -14.798 -7.712 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.122 -17.721 -7.029 1.00 0.00 H new ATOM 0 HG3 ARG A 122 5.524 -16.747 -6.634 1.00 0.00 H new ATOM 0 HD2 ARG A 122 3.967 -15.251 -5.264 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.713 -16.448 -5.518 1.00 0.00 H new ATOM 0 HE ARG A 122 5.116 -17.675 -4.461 1.00 0.00 H new ATOM 0 HH11 ARG A 122 2.299 -15.788 -3.491 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.369 -16.384 -1.829 1.00 0.00 H new ATOM 0 HH21 ARG A 122 5.136 -18.386 -2.332 1.00 0.00 H new ATOM 0 HH22 ARG A 122 3.914 -17.799 -1.198 1.00 0.00 H new ATOM 1154 N GLY A 123 0.669 -16.676 -7.317 1.00 0.00 N ATOM 1155 CA GLY A 123 -0.298 -17.748 -7.041 1.00 0.00 C ATOM 1156 C GLY A 123 -1.379 -17.398 -6.006 1.00 0.00 C ATOM 1157 O GLY A 123 -2.082 -18.296 -5.539 1.00 0.00 O ATOM 0 H GLY A 123 0.464 -15.828 -6.788 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -0.787 -18.025 -7.975 1.00 0.00 H new ATOM 0 HA3 GLY A 123 0.246 -18.626 -6.693 1.00 0.00 H new ATOM 1161 N GLN A 124 -1.524 -16.121 -5.626 1.00 0.00 N ATOM 1162 CA GLN A 124 -2.526 -15.597 -4.697 1.00 0.00 C ATOM 1163 C GLN A 124 -2.999 -14.215 -5.184 1.00 0.00 C ATOM 1164 O GLN A 124 -2.244 -13.529 -5.883 1.00 0.00 O ATOM 1165 CB GLN A 124 -1.908 -15.470 -3.288 1.00 0.00 C ATOM 1166 CG GLN A 124 -2.637 -16.343 -2.262 1.00 0.00 C ATOM 1167 CD GLN A 124 -2.001 -16.243 -0.874 1.00 0.00 C ATOM 1168 OE1 GLN A 124 -2.001 -15.200 -0.228 1.00 0.00 O ATOM 1169 NE2 GLN A 124 -1.435 -17.315 -0.357 1.00 0.00 N ATOM 0 H GLN A 124 -0.909 -15.388 -5.980 1.00 0.00 H new ATOM 0 HA GLN A 124 -3.377 -16.277 -4.655 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -0.857 -15.756 -3.326 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -1.944 -14.428 -2.969 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -3.683 -16.040 -2.205 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -2.624 -17.381 -2.594 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -1.426 -18.190 -0.881 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -1.006 -17.270 0.567 1.00 0.00 H new ATOM 1178 N PRO A 125 -4.207 -13.765 -4.804 1.00 0.00 N ATOM 1179 CA PRO A 125 -4.641 -12.382 -4.982 1.00 0.00 C ATOM 1180 C PRO A 125 -3.678 -11.336 -4.399 1.00 0.00 C ATOM 1181 O PRO A 125 -2.801 -11.644 -3.589 1.00 0.00 O ATOM 1182 CB PRO A 125 -6.005 -12.306 -4.288 1.00 0.00 C ATOM 1183 CG PRO A 125 -6.543 -13.728 -4.399 1.00 0.00 C ATOM 1184 CD PRO A 125 -5.278 -14.567 -4.237 1.00 0.00 C ATOM 0 HA PRO A 125 -4.679 -12.141 -6.044 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.909 -11.994 -3.248 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -6.664 -11.589 -4.777 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -7.278 -13.946 -3.624 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -7.029 -13.905 -5.358 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -5.087 -14.791 -3.188 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -5.371 -15.521 -4.755 1.00 0.00 H new ATOM 1192 N ILE A 126 -3.892 -10.071 -4.776 1.00 0.00 N ATOM 1193 CA ILE A 126 -3.125 -8.901 -4.319 1.00 0.00 C ATOM 1194 C ILE A 126 -4.069 -7.941 -3.607 1.00 0.00 C ATOM 1195 O ILE A 126 -5.242 -7.798 -3.959 1.00 0.00 O ATOM 1196 CB ILE A 126 -2.325 -8.195 -5.442 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -1.859 -9.230 -6.490 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -1.151 -7.417 -4.805 1.00 0.00 C ATOM 1199 CD1 ILE A 126 -0.641 -8.847 -7.317 1.00 0.00 C ATOM 0 H ILE A 126 -4.632 -9.822 -5.433 1.00 0.00 H new ATOM 0 HA ILE A 126 -2.363 -9.256 -3.626 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.953 -7.478 -5.971 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.643 -10.166 -5.975 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -2.688 -9.425 -7.171 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.580 -6.916 -5.587 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.542 -6.675 -4.108 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -0.502 -8.111 -4.270 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -0.409 -9.650 -8.017 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -0.851 -7.932 -7.871 1.00 0.00 H new ATOM 0 HD13 ILE A 126 0.211 -8.684 -6.657 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.549 -7.326 -2.556 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.344 -6.770 -1.470 1.00 0.00 C ATOM 1213 C TYR A 127 -4.200 -5.248 -1.455 1.00 0.00 C ATOM 1214 O TYR A 127 -3.199 -4.737 -0.948 1.00 0.00 O ATOM 1215 CB TYR A 127 -3.872 -7.371 -0.142 1.00 0.00 C ATOM 1216 CG TYR A 127 -4.215 -8.807 0.199 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -4.004 -9.882 -0.692 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.668 -9.065 1.508 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -4.322 -11.195 -0.294 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -4.971 -10.372 1.910 1.00 0.00 C ATOM 1221 CZ TYR A 127 -4.820 -11.444 1.003 1.00 0.00 C ATOM 1222 OH TYR A 127 -5.071 -12.723 1.393 1.00 0.00 O ATOM 0 H TYR A 127 -2.545 -7.197 -2.431 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.396 -7.016 -1.615 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -2.786 -7.280 -0.112 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -4.267 -6.744 0.657 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -3.600 -9.698 -1.676 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -4.782 -8.249 2.206 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -4.184 -12.014 -0.984 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -5.320 -10.560 2.914 1.00 0.00 H new ATOM 0 HH TYR A 127 -5.408 -12.724 2.313 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.165 -4.524 -2.026 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.107 -3.073 -2.196 1.00 0.00 C ATOM 1234 C ILE A 128 -6.267 -2.329 -1.510 1.00 0.00 C ATOM 1235 O ILE A 128 -7.394 -2.825 -1.464 1.00 0.00 O ATOM 1236 CB ILE A 128 -4.978 -2.774 -3.713 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.692 -1.960 -3.917 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.224 -2.105 -4.323 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.388 -1.622 -5.375 1.00 0.00 C ATOM 0 H ILE A 128 -6.023 -4.938 -2.389 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.229 -2.682 -1.682 1.00 0.00 H new ATOM 0 HB ILE A 128 -4.911 -3.714 -4.260 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.769 -1.033 -3.349 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -2.853 -2.519 -3.503 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.058 -1.927 -5.386 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.087 -2.758 -4.195 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.410 -1.155 -3.821 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.464 -1.047 -5.430 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.276 -2.543 -5.946 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.207 -1.034 -5.791 1.00 0.00 H new ATOM 1251 N GLN A 129 -5.990 -1.111 -1.032 1.00 0.00 N ATOM 1252 CA GLN A 129 -6.968 -0.063 -0.679 1.00 0.00 C ATOM 1253 C GLN A 129 -6.340 1.324 -0.870 1.00 0.00 C ATOM 1254 O GLN A 129 -5.120 1.460 -0.824 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.398 -0.192 0.800 1.00 0.00 C ATOM 1256 CG GLN A 129 -8.682 -1.007 1.004 1.00 0.00 C ATOM 1257 CD GLN A 129 -8.971 -1.219 2.488 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -8.176 -1.794 3.223 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -10.115 -0.784 2.970 1.00 0.00 N ATOM 0 H GLN A 129 -5.029 -0.809 -0.871 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.836 -0.184 -1.328 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.590 -0.658 1.364 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.542 0.806 1.215 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.521 -0.491 0.537 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -8.586 -1.973 0.508 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -10.777 -0.305 2.359 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -10.340 -0.925 3.955 1.00 0.00 H new ATOM 1268 N PHE A 130 -7.146 2.383 -0.989 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.675 3.758 -0.763 1.00 0.00 C ATOM 1270 C PHE A 130 -5.998 3.926 0.624 1.00 0.00 C ATOM 1271 O PHE A 130 -6.289 3.202 1.580 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.836 4.741 -0.958 1.00 0.00 C ATOM 1273 CG PHE A 130 -8.030 5.238 -2.383 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -7.052 6.066 -2.961 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.212 4.967 -3.098 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.251 6.632 -4.234 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.426 5.558 -4.356 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.446 6.386 -4.930 1.00 0.00 C ATOM 0 H PHE A 130 -8.132 2.317 -1.241 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.904 3.981 -1.500 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.757 4.260 -0.629 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.676 5.602 -0.308 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -6.138 6.270 -2.422 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -9.955 4.304 -2.680 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.486 7.254 -4.675 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.350 5.374 -4.885 1.00 0.00 H new ATOM 0 HZ PHE A 130 -8.611 6.830 -5.900 1.00 0.00 H new ATOM 1288 N SER A 131 -5.065 4.873 0.730 1.00 0.00 N ATOM 1289 CA SER A 131 -4.217 5.075 1.908 1.00 0.00 C ATOM 1290 C SER A 131 -4.951 5.735 3.090 1.00 0.00 C ATOM 1291 O SER A 131 -5.970 6.415 2.930 1.00 0.00 O ATOM 1292 CB SER A 131 -2.962 5.870 1.510 1.00 0.00 C ATOM 1293 OG SER A 131 -2.168 6.272 2.613 1.00 0.00 O ATOM 0 H SER A 131 -4.872 5.538 -0.019 1.00 0.00 H new ATOM 0 HA SER A 131 -3.925 4.089 2.268 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.355 5.262 0.839 1.00 0.00 H new ATOM 0 HB3 SER A 131 -3.266 6.755 0.951 1.00 0.00 H new ATOM 0 HG SER A 131 -1.985 5.497 3.184 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.396 5.569 4.294 1.00 0.00 N ATOM 1300 CA ASN A 132 -4.734 6.303 5.516 1.00 0.00 C ATOM 1301 C ASN A 132 -4.321 7.800 5.441 1.00 0.00 C ATOM 1302 O ASN A 132 -4.756 8.594 6.281 1.00 0.00 O ATOM 1303 CB ASN A 132 -4.059 5.620 6.733 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.359 4.140 6.977 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -3.728 3.487 7.798 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -5.308 3.524 6.316 1.00 0.00 N ATOM 0 H ASN A 132 -3.659 4.882 4.450 1.00 0.00 H new ATOM 0 HA ASN A 132 -5.818 6.278 5.629 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -2.980 5.729 6.623 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -4.345 6.172 7.628 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -5.497 2.538 6.495 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -5.858 4.031 5.623 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.514 8.197 4.448 1.00 0.00 N ATOM 1314 CA HIS A 133 -2.998 9.556 4.219 1.00 0.00 C ATOM 1315 C HIS A 133 -3.455 10.157 2.874 1.00 0.00 C ATOM 1316 O HIS A 133 -4.189 9.536 2.097 1.00 0.00 O ATOM 1317 CB HIS A 133 -1.457 9.533 4.253 1.00 0.00 C ATOM 1318 CG HIS A 133 -0.842 8.793 5.408 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -0.631 9.266 6.686 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.331 7.530 5.340 1.00 0.00 C ATOM 1321 CE1 HIS A 133 0.012 8.306 7.374 1.00 0.00 C ATOM 1322 NE2 HIS A 133 0.228 7.238 6.588 1.00 0.00 N ATOM 0 H HIS A 133 -3.184 7.541 3.741 1.00 0.00 H new ATOM 0 HA HIS A 133 -3.402 10.184 5.013 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -1.098 9.086 3.326 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -1.097 10.562 4.271 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.354 6.876 4.481 1.00 0.00 H new ATOM 0 HE1 HIS A 133 0.311 8.382 8.409 1.00 0.00 H new ATOM 0 HE2 HIS A 133 0.708 6.378 6.852 1.00 0.00 H new ATOM 1330 N LYS A 134 -2.956 11.365 2.578 1.00 0.00 N ATOM 1331 CA LYS A 134 -2.957 12.022 1.261 1.00 0.00 C ATOM 1332 C LYS A 134 -1.539 12.520 0.936 1.00 0.00 C ATOM 1333 O LYS A 134 -0.822 12.950 1.839 1.00 0.00 O ATOM 1334 CB LYS A 134 -3.965 13.191 1.248 1.00 0.00 C ATOM 1335 CG LYS A 134 -5.387 12.787 1.667 1.00 0.00 C ATOM 1336 CD LYS A 134 -6.372 13.952 1.484 1.00 0.00 C ATOM 1337 CE LYS A 134 -7.787 13.519 1.894 1.00 0.00 C ATOM 1338 NZ LYS A 134 -8.765 14.630 1.730 1.00 0.00 N ATOM 0 H LYS A 134 -2.515 11.945 3.292 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.262 11.305 0.499 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -3.608 13.974 1.917 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -3.999 13.618 0.246 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -5.715 11.933 1.074 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -5.385 12.469 2.710 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -6.055 14.804 2.086 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -6.371 14.279 0.444 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -8.098 12.667 1.290 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -7.781 13.188 2.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -9.711 14.305 2.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -8.481 15.434 2.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -8.787 14.929 0.734 1.00 0.00 H new ATOM 1352 N GLU A 135 -1.170 12.510 -0.344 1.00 0.00 N ATOM 1353 CA GLU A 135 0.102 13.000 -0.914 1.00 0.00 C ATOM 1354 C GLU A 135 1.386 12.453 -0.248 1.00 0.00 C ATOM 1355 O GLU A 135 1.914 13.021 0.713 1.00 0.00 O ATOM 1356 CB GLU A 135 0.121 14.538 -1.013 1.00 0.00 C ATOM 1357 CG GLU A 135 -1.069 15.091 -1.809 1.00 0.00 C ATOM 1358 CD GLU A 135 -0.763 16.503 -2.335 1.00 0.00 C ATOM 1359 OE1 GLU A 135 -0.957 17.498 -1.595 1.00 0.00 O ATOM 1360 OE2 GLU A 135 -0.341 16.615 -3.512 1.00 0.00 O ATOM 0 H GLU A 135 -1.787 12.136 -1.065 1.00 0.00 H new ATOM 0 HA GLU A 135 0.126 12.582 -1.920 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.112 14.963 -0.010 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.050 14.857 -1.486 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -1.294 14.427 -2.644 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -1.956 15.118 -1.175 1.00 0.00 H new ATOM 1367 N LEU A 136 1.922 11.350 -0.779 1.00 0.00 N ATOM 1368 CA LEU A 136 3.194 10.738 -0.365 1.00 0.00 C ATOM 1369 C LEU A 136 4.410 11.651 -0.645 1.00 0.00 C ATOM 1370 O LEU A 136 4.523 12.248 -1.720 1.00 0.00 O ATOM 1371 CB LEU A 136 3.303 9.408 -1.130 1.00 0.00 C ATOM 1372 CG LEU A 136 4.617 8.622 -1.064 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.020 8.231 0.348 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.456 7.317 -1.836 1.00 0.00 C ATOM 0 H LEU A 136 1.468 10.839 -1.536 1.00 0.00 H new ATOM 0 HA LEU A 136 3.202 10.579 0.713 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.509 8.754 -0.769 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.094 9.613 -2.180 1.00 0.00 H new ATOM 0 HG LEU A 136 5.381 9.279 -1.480 1.00 0.00 H new ATOM 0 HD11 LEU A 136 5.959 7.678 0.318 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.147 9.129 0.952 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.244 7.605 0.788 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.387 6.752 -1.794 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.654 6.728 -1.392 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.212 7.537 -2.875 1.00 0.00 H new ATOM 1386 N LYS A 137 5.367 11.687 0.296 1.00 0.00 N ATOM 1387 CA LYS A 137 6.716 12.275 0.156 1.00 0.00 C ATOM 1388 C LYS A 137 7.803 11.311 0.663 1.00 0.00 C ATOM 1389 O LYS A 137 7.568 10.545 1.595 1.00 0.00 O ATOM 1390 CB LYS A 137 6.766 13.645 0.860 1.00 0.00 C ATOM 1391 CG LYS A 137 6.576 13.582 2.390 1.00 0.00 C ATOM 1392 CD LYS A 137 5.648 14.677 2.941 1.00 0.00 C ATOM 1393 CE LYS A 137 4.197 14.541 2.452 1.00 0.00 C ATOM 1394 NZ LYS A 137 3.497 13.361 3.022 1.00 0.00 N ATOM 0 H LYS A 137 5.217 11.288 1.223 1.00 0.00 H new ATOM 0 HA LYS A 137 6.925 12.437 -0.901 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.725 14.116 0.644 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.993 14.286 0.436 1.00 0.00 H new ATOM 0 HG2 LYS A 137 6.171 12.606 2.657 1.00 0.00 H new ATOM 0 HG3 LYS A 137 7.550 13.666 2.872 1.00 0.00 H new ATOM 0 HD2 LYS A 137 5.663 14.643 4.030 1.00 0.00 H new ATOM 0 HD3 LYS A 137 6.034 15.653 2.648 1.00 0.00 H new ATOM 0 HE2 LYS A 137 3.646 15.444 2.714 1.00 0.00 H new ATOM 0 HE3 LYS A 137 4.192 14.468 1.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 2.668 13.133 2.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 4.144 12.547 3.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 3.188 13.576 3.991 1.00 0.00 H new ATOM 1408 N THR A 138 8.980 11.338 0.034 1.00 0.00 N ATOM 1409 CA THR A 138 10.018 10.286 0.142 1.00 0.00 C ATOM 1410 C THR A 138 11.436 10.832 0.399 1.00 0.00 C ATOM 1411 O THR A 138 12.423 10.116 0.222 1.00 0.00 O ATOM 1412 CB THR A 138 9.980 9.373 -1.106 1.00 0.00 C ATOM 1413 OG1 THR A 138 10.117 10.120 -2.304 1.00 0.00 O ATOM 1414 CG2 THR A 138 8.664 8.601 -1.221 1.00 0.00 C ATOM 0 H THR A 138 9.253 12.105 -0.581 1.00 0.00 H new ATOM 0 HA THR A 138 9.776 9.698 1.027 1.00 0.00 H new ATOM 0 HB THR A 138 10.814 8.682 -0.979 1.00 0.00 H new ATOM 0 HG1 THR A 138 10.557 9.569 -2.985 1.00 0.00 H new ATOM 0 HG21 THR A 138 8.686 7.975 -2.113 1.00 0.00 H new ATOM 0 HG22 THR A 138 8.532 7.973 -0.340 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.835 9.305 -1.293 1.00 0.00 H new ATOM 1422 N ASP A 139 11.561 12.100 0.808 1.00 0.00 N ATOM 1423 CA ASP A 139 12.841 12.785 1.062 1.00 0.00 C ATOM 1424 C ASP A 139 13.692 12.130 2.179 1.00 0.00 C ATOM 1425 O ASP A 139 13.176 11.438 3.064 1.00 0.00 O ATOM 1426 CB ASP A 139 12.544 14.262 1.378 1.00 0.00 C ATOM 1427 CG ASP A 139 13.805 15.141 1.463 1.00 0.00 C ATOM 1428 OD1 ASP A 139 14.771 14.897 0.700 1.00 0.00 O ATOM 1429 OD2 ASP A 139 13.820 16.097 2.276 1.00 0.00 O ATOM 0 H ASP A 139 10.752 12.698 0.977 1.00 0.00 H new ATOM 0 HA ASP A 139 13.452 12.699 0.163 1.00 0.00 H new ATOM 0 HB2 ASP A 139 11.883 14.663 0.610 1.00 0.00 H new ATOM 0 HB3 ASP A 139 12.006 14.321 2.324 1.00 0.00 H new ATOM 1434 N SER A 140 15.011 12.354 2.140 1.00 0.00 N ATOM 1435 CA SER A 140 16.021 11.788 3.048 1.00 0.00 C ATOM 1436 C SER A 140 15.961 12.338 4.488 1.00 0.00 C ATOM 1437 O SER A 140 15.308 13.349 4.768 1.00 0.00 O ATOM 1438 CB SER A 140 17.421 12.027 2.467 1.00 0.00 C ATOM 1439 OG SER A 140 17.609 11.269 1.277 1.00 0.00 O ATOM 0 H SER A 140 15.426 12.967 1.438 1.00 0.00 H new ATOM 0 HA SER A 140 15.799 10.723 3.122 1.00 0.00 H new ATOM 0 HB2 SER A 140 17.555 13.087 2.253 1.00 0.00 H new ATOM 0 HB3 SER A 140 18.177 11.752 3.202 1.00 0.00 H new ATOM 0 HG SER A 140 17.949 11.853 0.567 1.00 0.00 H new ATOM 1445 N SER A 141 16.654 11.667 5.416 1.00 0.00 N ATOM 1446 CA SER A 141 16.723 12.023 6.843 1.00 0.00 C ATOM 1447 C SER A 141 17.545 13.302 7.124 1.00 0.00 C ATOM 1448 O SER A 141 18.389 13.691 6.302 1.00 0.00 O ATOM 1449 CB SER A 141 17.313 10.843 7.632 1.00 0.00 C ATOM 1450 OG SER A 141 18.655 10.596 7.241 1.00 0.00 O ATOM 0 H SER A 141 17.200 10.835 5.190 1.00 0.00 H new ATOM 0 HA SER A 141 15.704 12.237 7.165 1.00 0.00 H new ATOM 0 HB2 SER A 141 17.274 11.058 8.700 1.00 0.00 H new ATOM 0 HB3 SER A 141 16.710 9.950 7.465 1.00 0.00 H new ATOM 0 HG SER A 141 19.012 9.843 7.756 1.00 0.00 H new ATOM 1456 N PRO A 142 17.367 13.947 8.301 1.00 0.00 N ATOM 1457 CA PRO A 142 18.176 15.093 8.739 1.00 0.00 C ATOM 1458 C PRO A 142 19.690 14.833 8.826 1.00 0.00 C ATOM 1459 O PRO A 142 20.482 15.770 8.716 1.00 0.00 O ATOM 1460 CB PRO A 142 17.637 15.481 10.122 1.00 0.00 C ATOM 1461 CG PRO A 142 16.197 14.981 10.095 1.00 0.00 C ATOM 1462 CD PRO A 142 16.300 13.704 9.265 1.00 0.00 C ATOM 0 HA PRO A 142 18.083 15.881 7.992 1.00 0.00 H new ATOM 0 HB2 PRO A 142 18.210 15.012 10.922 1.00 0.00 H new ATOM 0 HB3 PRO A 142 17.685 16.558 10.284 1.00 0.00 H new ATOM 0 HG2 PRO A 142 15.819 14.783 11.098 1.00 0.00 H new ATOM 0 HG3 PRO A 142 15.525 15.707 9.638 1.00 0.00 H new ATOM 0 HD2 PRO A 142 16.529 12.845 9.895 1.00 0.00 H new ATOM 0 HD3 PRO A 142 15.358 13.487 8.761 1.00 0.00 H new ATOM 1470 N ASN A 143 20.112 13.577 9.017 1.00 0.00 N ATOM 1471 CA ASN A 143 21.524 13.193 9.104 1.00 0.00 C ATOM 1472 C ASN A 143 22.302 13.527 7.820 1.00 0.00 C ATOM 1473 O ASN A 143 23.398 14.086 7.891 1.00 0.00 O ATOM 1474 CB ASN A 143 21.611 11.698 9.447 1.00 0.00 C ATOM 1475 CG ASN A 143 23.054 11.235 9.595 1.00 0.00 C ATOM 1476 OD1 ASN A 143 23.644 10.662 8.691 1.00 0.00 O ATOM 1477 ND2 ASN A 143 23.674 11.481 10.727 1.00 0.00 N ATOM 0 H ASN A 143 19.472 12.789 9.117 1.00 0.00 H new ATOM 0 HA ASN A 143 21.996 13.775 9.895 1.00 0.00 H new ATOM 0 HB2 ASN A 143 21.071 11.506 10.374 1.00 0.00 H new ATOM 0 HB3 ASN A 143 21.121 11.117 8.666 1.00 0.00 H new ATOM 0 HD21 ASN A 143 24.645 11.194 10.849 1.00 0.00 H new ATOM 0 HD22 ASN A 143 23.184 11.959 11.483 1.00 0.00 H new ATOM 1484 N GLN A 144 21.725 13.245 6.646 1.00 0.00 N ATOM 1485 CA GLN A 144 22.347 13.471 5.334 1.00 0.00 C ATOM 1486 C GLN A 144 22.801 14.928 5.123 1.00 0.00 C ATOM 1487 O GLN A 144 23.862 15.179 4.547 1.00 0.00 O ATOM 1488 CB GLN A 144 21.347 13.035 4.250 1.00 0.00 C ATOM 1489 CG GLN A 144 21.935 13.065 2.830 1.00 0.00 C ATOM 1490 CD GLN A 144 20.885 12.665 1.799 1.00 0.00 C ATOM 1491 OE1 GLN A 144 20.300 13.495 1.114 1.00 0.00 O ATOM 1492 NE2 GLN A 144 20.582 11.393 1.663 1.00 0.00 N ATOM 0 H GLN A 144 20.790 12.843 6.579 1.00 0.00 H new ATOM 0 HA GLN A 144 23.258 12.876 5.274 1.00 0.00 H new ATOM 0 HB2 GLN A 144 21.001 12.025 4.471 1.00 0.00 H new ATOM 0 HB3 GLN A 144 20.474 13.687 4.288 1.00 0.00 H new ATOM 0 HG2 GLN A 144 22.307 14.065 2.607 1.00 0.00 H new ATOM 0 HG3 GLN A 144 22.786 12.387 2.770 1.00 0.00 H new ATOM 0 HE21 GLN A 144 21.061 10.691 2.227 1.00 0.00 H new ATOM 0 HE22 GLN A 144 19.867 11.108 0.993 1.00 0.00 H new ATOM 1501 N ALA A 145 22.027 15.892 5.632 1.00 0.00 N ATOM 1502 CA ALA A 145 22.322 17.328 5.589 1.00 0.00 C ATOM 1503 C ALA A 145 23.509 17.768 6.478 1.00 0.00 C ATOM 1504 O ALA A 145 23.985 18.901 6.356 1.00 0.00 O ATOM 1505 CB ALA A 145 21.049 18.057 6.031 1.00 0.00 C ATOM 0 H ALA A 145 21.146 15.686 6.102 1.00 0.00 H new ATOM 0 HA ALA A 145 22.624 17.577 4.572 1.00 0.00 H new ATOM 0 HB1 ALA A 145 21.222 19.133 6.015 1.00 0.00 H new ATOM 0 HB2 ALA A 145 20.234 17.810 5.351 1.00 0.00 H new ATOM 0 HB3 ALA A 145 20.785 17.747 7.042 1.00 0.00 H new ATOM 1511 N ARG A 146 23.969 16.899 7.389 1.00 0.00 N ATOM 1512 CA ARG A 146 24.859 17.211 8.521 1.00 0.00 C ATOM 1513 C ARG A 146 26.129 16.343 8.598 1.00 0.00 C ATOM 1514 O ARG A 146 26.997 16.624 9.429 1.00 0.00 O ATOM 1515 CB ARG A 146 24.027 17.126 9.817 1.00 0.00 C ATOM 1516 CG ARG A 146 23.002 18.269 9.938 1.00 0.00 C ATOM 1517 CD ARG A 146 22.201 18.192 11.243 1.00 0.00 C ATOM 1518 NE ARG A 146 23.042 18.462 12.429 1.00 0.00 N ATOM 1519 CZ ARG A 146 22.688 18.359 13.697 1.00 0.00 C ATOM 1520 NH1 ARG A 146 21.492 17.978 14.051 1.00 0.00 N ATOM 1521 NH2 ARG A 146 23.535 18.641 14.646 1.00 0.00 N ATOM 1522 OXT ARG A 146 26.277 15.384 7.844 1.00 0.00 O ATOM 0 H ARG A 146 23.719 15.911 7.357 1.00 0.00 H new ATOM 0 HA ARG A 146 25.246 18.219 8.373 1.00 0.00 H new ATOM 0 HB2 ARG A 146 23.505 16.170 9.847 1.00 0.00 H new ATOM 0 HB3 ARG A 146 24.697 17.151 10.677 1.00 0.00 H new ATOM 0 HG2 ARG A 146 23.520 19.227 9.888 1.00 0.00 H new ATOM 0 HG3 ARG A 146 22.317 18.232 9.091 1.00 0.00 H new ATOM 0 HD2 ARG A 146 21.382 18.911 11.208 1.00 0.00 H new ATOM 0 HD3 ARG A 146 21.753 17.203 11.335 1.00 0.00 H new ATOM 0 HE ARG A 146 24.000 18.760 12.248 1.00 0.00 H new ATOM 0 HH11 ARG A 146 20.798 17.749 13.339 1.00 0.00 H new ATOM 0 HH12 ARG A 146 21.251 17.909 15.040 1.00 0.00 H new ATOM 0 HH21 ARG A 146 24.480 18.944 14.412 1.00 0.00 H new ATOM 0 HH22 ARG A 146 23.253 18.559 15.623 1.00 0.00 H new TER 1536 ARG A 146 ATOM 1537 O5' C B 147 -1.597 -11.339 6.030 1.00 0.00 O ATOM 1538 C5' C B 147 -0.226 -11.217 6.384 1.00 0.00 C ATOM 1539 C4' C B 147 0.115 -9.804 6.889 1.00 0.00 C ATOM 1540 O4' C B 147 1.509 -9.735 7.166 1.00 0.00 O ATOM 1541 C3' C B 147 -0.159 -8.695 5.860 1.00 0.00 C ATOM 1542 O3' C B 147 -0.254 -7.426 6.488 1.00 0.00 O ATOM 1543 C2' C B 147 1.114 -8.766 5.025 1.00 0.00 C ATOM 1544 O2' C B 147 1.361 -7.582 4.289 1.00 0.00 O ATOM 1545 C1' C B 147 2.176 -9.070 6.096 1.00 0.00 C ATOM 1546 N1 C B 147 3.350 -9.888 5.672 1.00 0.00 N ATOM 1547 C2 C B 147 4.540 -9.777 6.416 1.00 0.00 C ATOM 1548 O2 C B 147 4.618 -9.079 7.432 1.00 0.00 O ATOM 1549 N3 C B 147 5.650 -10.472 6.054 1.00 0.00 N ATOM 1550 C4 C B 147 5.585 -11.259 5.001 1.00 0.00 C ATOM 1551 N4 C B 147 6.674 -11.916 4.712 1.00 0.00 N ATOM 1552 C5 C B 147 4.407 -11.444 4.228 1.00 0.00 C ATOM 1553 C6 C B 147 3.303 -10.746 4.596 1.00 0.00 C ATOM 0 H5' C B 147 0.394 -11.452 5.519 1.00 0.00 H new ATOM 0 H5'' C B 147 0.015 -11.946 7.157 1.00 0.00 H new ATOM 0 H4' C B 147 -0.516 -9.642 7.763 1.00 0.00 H new ATOM 0 H3' C B 147 -1.089 -8.819 5.306 1.00 0.00 H new ATOM 0 H2' C B 147 1.082 -9.515 4.234 1.00 0.00 H new ATOM 0 HO2' C B 147 0.910 -6.828 4.722 1.00 0.00 H new ATOM 0 HO5' C B 147 -1.850 -12.286 6.022 1.00 0.00 H new ATOM 0 H1' C B 147 2.613 -8.109 6.366 1.00 0.00 H new ATOM 0 H41 C B 147 6.693 -12.544 3.908 1.00 0.00 H new ATOM 0 H42 C B 147 7.507 -11.802 5.290 1.00 0.00 H new ATOM 0 H5 C B 147 4.391 -12.114 3.381 1.00 0.00 H new ATOM 0 H6 C B 147 2.383 -10.864 4.042 1.00 0.00 H new ATOM 1566 P U B 148 -1.500 -7.033 7.409 1.00 0.00 P ATOM 1567 OP1 U B 148 -1.012 -6.817 8.790 1.00 0.00 O ATOM 1568 OP2 U B 148 -2.611 -7.982 7.177 1.00 0.00 O ATOM 1569 O5' U B 148 -1.943 -5.627 6.796 1.00 0.00 O ATOM 1570 C5' U B 148 -0.982 -4.639 6.474 1.00 0.00 C ATOM 1571 C4' U B 148 -1.535 -3.234 6.704 1.00 0.00 C ATOM 1572 O4' U B 148 -2.740 -3.057 5.967 1.00 0.00 O ATOM 1573 C3' U B 148 -1.806 -2.989 8.192 1.00 0.00 C ATOM 1574 O3' U B 148 -1.459 -1.649 8.529 1.00 0.00 O ATOM 1575 C2' U B 148 -3.317 -3.184 8.278 1.00 0.00 C ATOM 1576 O2' U B 148 -3.928 -2.443 9.330 1.00 0.00 O ATOM 1577 C1' U B 148 -3.765 -2.723 6.888 1.00 0.00 C ATOM 1578 N1 U B 148 -5.064 -3.345 6.519 1.00 0.00 N ATOM 1579 C2 U B 148 -6.139 -2.500 6.213 1.00 0.00 C ATOM 1580 O2 U B 148 -6.044 -1.274 6.142 1.00 0.00 O ATOM 1581 N3 U B 148 -7.349 -3.103 5.940 1.00 0.00 N ATOM 1582 C4 U B 148 -7.587 -4.457 5.919 1.00 0.00 C ATOM 1583 O4 U B 148 -8.709 -4.878 5.651 1.00 0.00 O ATOM 1584 C5 U B 148 -6.427 -5.272 6.209 1.00 0.00 C ATOM 1585 C6 U B 148 -5.217 -4.719 6.494 1.00 0.00 C ATOM 0 H5' U B 148 -0.680 -4.748 5.432 1.00 0.00 H new ATOM 0 H5'' U B 148 -0.089 -4.785 7.082 1.00 0.00 H new ATOM 0 H4' U B 148 -0.789 -2.517 6.362 1.00 0.00 H new ATOM 0 H3' U B 148 -1.242 -3.636 8.864 1.00 0.00 H new ATOM 0 H2' U B 148 -3.607 -4.206 8.521 1.00 0.00 H new ATOM 0 HO2' U B 148 -3.340 -1.705 9.594 1.00 0.00 H new ATOM 0 H1' U B 148 -3.925 -1.645 6.877 1.00 0.00 H new ATOM 0 H3 U B 148 -8.138 -2.490 5.735 1.00 0.00 H new ATOM 0 H5 U B 148 -6.524 -6.348 6.199 1.00 0.00 H new ATOM 0 H6 U B 148 -4.371 -5.357 6.702 1.00 0.00 H new ATOM 1596 P C B 149 -0.332 -1.303 9.616 1.00 0.00 P ATOM 1597 OP1 C B 149 0.006 -2.521 10.389 1.00 0.00 O ATOM 1598 OP2 C B 149 -0.854 -0.134 10.355 1.00 0.00 O ATOM 1599 O5' C B 149 0.992 -0.886 8.777 1.00 0.00 O ATOM 1600 C5' C B 149 0.961 -0.156 7.552 1.00 0.00 C ATOM 1601 C4' C B 149 1.340 1.338 7.601 1.00 0.00 C ATOM 1602 O4' C B 149 1.001 1.917 6.345 1.00 0.00 O ATOM 1603 C3' C B 149 0.699 2.200 8.702 1.00 0.00 C ATOM 1604 O3' C B 149 1.534 2.716 9.752 1.00 0.00 O ATOM 1605 C2' C B 149 -0.168 3.240 7.974 1.00 0.00 C ATOM 1606 O2' C B 149 0.143 4.593 8.264 1.00 0.00 O ATOM 1607 C1' C B 149 0.019 2.935 6.484 1.00 0.00 C ATOM 1608 N1 C B 149 -1.265 2.557 5.806 1.00 0.00 N ATOM 1609 C2 C B 149 -1.781 3.401 4.816 1.00 0.00 C ATOM 1610 O2 C B 149 -1.316 4.510 4.592 1.00 0.00 O ATOM 1611 N3 C B 149 -2.850 3.037 4.075 1.00 0.00 N ATOM 1612 C4 C B 149 -3.416 1.875 4.298 1.00 0.00 C ATOM 1613 N4 C B 149 -4.494 1.599 3.611 1.00 0.00 N ATOM 1614 C5 C B 149 -2.977 0.999 5.314 1.00 0.00 C ATOM 1615 C6 C B 149 -1.932 1.388 6.083 1.00 0.00 C ATOM 0 H5' C B 149 -0.045 -0.234 7.140 1.00 0.00 H new ATOM 0 H5'' C B 149 1.632 -0.650 6.850 1.00 0.00 H new ATOM 0 H4' C B 149 2.405 1.340 7.835 1.00 0.00 H new ATOM 0 H3' C B 149 0.101 1.545 9.335 1.00 0.00 H new ATOM 0 H2' C B 149 -1.201 3.150 8.310 1.00 0.00 H new ATOM 0 HO2' C B 149 1.111 4.689 8.379 1.00 0.00 H new ATOM 0 H1' C B 149 0.358 3.843 5.985 1.00 0.00 H new ATOM 0 H41 C B 149 -4.972 0.708 3.748 1.00 0.00 H new ATOM 0 H42 C B 149 -4.857 2.275 2.939 1.00 0.00 H new ATOM 0 H5 C B 149 -3.460 0.046 5.474 1.00 0.00 H new ATOM 0 H6 C B 149 -1.622 0.777 6.918 1.00 0.00 H new ATOM 1627 P U B 150 3.014 3.356 9.599 1.00 0.00 P ATOM 1628 OP1 U B 150 3.950 2.322 9.093 1.00 0.00 O ATOM 1629 OP2 U B 150 3.299 3.994 10.907 1.00 0.00 O ATOM 1630 O5' U B 150 2.870 4.557 8.526 1.00 0.00 O ATOM 1631 C5' U B 150 3.269 4.446 7.167 1.00 0.00 C ATOM 1632 C4' U B 150 4.789 4.523 6.925 1.00 0.00 C ATOM 1633 O4' U B 150 4.970 4.956 5.584 1.00 0.00 O ATOM 1634 C3' U B 150 5.548 5.494 7.841 1.00 0.00 C ATOM 1635 O3' U B 150 6.202 4.794 8.899 1.00 0.00 O ATOM 1636 C2' U B 150 6.527 6.209 6.887 1.00 0.00 C ATOM 1637 O2' U B 150 7.869 5.727 6.951 1.00 0.00 O ATOM 1638 C1' U B 150 6.006 5.926 5.481 1.00 0.00 C ATOM 1639 N1 U B 150 5.570 7.190 4.806 1.00 0.00 N ATOM 1640 C2 U B 150 6.543 8.029 4.242 1.00 0.00 C ATOM 1641 O2 U B 150 7.749 7.774 4.236 1.00 0.00 O ATOM 1642 N3 U B 150 6.101 9.194 3.644 1.00 0.00 N ATOM 1643 C4 U B 150 4.791 9.586 3.518 1.00 0.00 C ATOM 1644 O4 U B 150 4.512 10.638 2.947 1.00 0.00 O ATOM 1645 C5 U B 150 3.838 8.652 4.069 1.00 0.00 C ATOM 1646 C6 U B 150 4.238 7.510 4.690 1.00 0.00 C ATOM 0 H5' U B 150 2.785 5.239 6.596 1.00 0.00 H new ATOM 0 H5'' U B 150 2.901 3.499 6.772 1.00 0.00 H new ATOM 0 H4' U B 150 5.195 3.534 7.137 1.00 0.00 H new ATOM 0 H3' U B 150 4.901 6.206 8.353 1.00 0.00 H new ATOM 0 H2' U B 150 6.565 7.263 7.163 1.00 0.00 H new ATOM 0 HO2' U B 150 8.214 5.841 7.861 1.00 0.00 H new ATOM 0 H1' U B 150 6.796 5.521 4.848 1.00 0.00 H new ATOM 0 H3 U B 150 6.811 9.818 3.262 1.00 0.00 H new ATOM 0 H5 U B 150 2.782 8.865 3.986 1.00 0.00 H new ATOM 0 H6 U B 150 3.495 6.842 5.100 1.00 0.00 H new ATOM 1657 P C B 151 6.961 5.556 10.087 1.00 0.00 P ATOM 1658 OP1 C B 151 6.111 6.674 10.564 1.00 0.00 O ATOM 1659 OP2 C B 151 8.337 5.852 9.620 1.00 0.00 O ATOM 1660 O5' C B 151 7.035 4.442 11.247 1.00 0.00 O ATOM 1661 C5' C B 151 7.973 3.376 11.206 1.00 0.00 C ATOM 1662 C4' C B 151 7.796 2.358 12.355 1.00 0.00 C ATOM 1663 O4' C B 151 7.933 2.992 13.625 1.00 0.00 O ATOM 1664 C3' C B 151 6.437 1.635 12.343 1.00 0.00 C ATOM 1665 O3' C B 151 6.499 0.335 12.931 1.00 0.00 O ATOM 1666 C2' C B 151 5.609 2.568 13.239 1.00 0.00 C ATOM 1667 O2' C B 151 4.515 1.909 13.867 1.00 0.00 O ATOM 1668 C1' C B 151 6.655 3.054 14.256 1.00 0.00 C ATOM 1669 N1 C B 151 6.426 4.405 14.850 1.00 0.00 N ATOM 1670 C2 C B 151 6.809 4.609 16.188 1.00 0.00 C ATOM 1671 O2 C B 151 7.355 3.725 16.854 1.00 0.00 O ATOM 1672 N3 C B 151 6.588 5.803 16.798 1.00 0.00 N ATOM 1673 C4 C B 151 6.022 6.770 16.107 1.00 0.00 C ATOM 1674 N4 C B 151 5.838 7.891 16.746 1.00 0.00 N ATOM 1675 C5 C B 151 5.630 6.640 14.748 1.00 0.00 C ATOM 1676 C6 C B 151 5.851 5.443 14.148 1.00 0.00 C ATOM 0 H5' C B 151 8.981 3.788 11.247 1.00 0.00 H new ATOM 0 H5'' C B 151 7.880 2.856 10.252 1.00 0.00 H new ATOM 0 H4' C B 151 8.580 1.619 12.193 1.00 0.00 H new ATOM 0 H3' C B 151 6.049 1.468 11.338 1.00 0.00 H new ATOM 0 H2' C B 151 5.128 3.374 12.685 1.00 0.00 H new ATOM 0 HO2' C B 151 4.643 0.939 13.814 1.00 0.00 H new ATOM 0 H1' C B 151 6.579 2.389 15.117 1.00 0.00 H new ATOM 0 H41 C B 151 5.404 8.683 16.272 1.00 0.00 H new ATOM 0 H42 C B 151 6.128 7.976 17.720 1.00 0.00 H new ATOM 0 H5 C B 151 5.174 7.461 14.214 1.00 0.00 H new ATOM 0 H6 C B 151 5.575 5.303 13.113 1.00 0.00 H new ATOM 1688 P U B 152 7.212 -0.899 12.199 1.00 0.00 P ATOM 1689 OP1 U B 152 7.883 -0.424 10.965 1.00 0.00 O ATOM 1690 OP2 U B 152 6.231 -2.002 12.094 1.00 0.00 O ATOM 1691 O5' U B 152 8.347 -1.293 13.274 1.00 0.00 O ATOM 1692 C5' U B 152 8.057 -2.129 14.393 1.00 0.00 C ATOM 1693 C4' U B 152 8.401 -1.503 15.752 1.00 0.00 C ATOM 1694 O4' U B 152 9.807 -1.463 15.972 1.00 0.00 O ATOM 1695 C3' U B 152 7.894 -0.070 15.948 1.00 0.00 C ATOM 1696 O3' U B 152 6.511 0.031 16.273 1.00 0.00 O ATOM 1697 C2' U B 152 8.781 0.371 17.121 1.00 0.00 C ATOM 1698 O2' U B 152 8.268 -0.075 18.377 1.00 0.00 O ATOM 1699 C1' U B 152 10.100 -0.371 16.842 1.00 0.00 C ATOM 1700 N1 U B 152 11.127 0.530 16.248 1.00 0.00 N ATOM 1701 C2 U B 152 12.120 1.044 17.091 1.00 0.00 C ATOM 1702 O2 U B 152 12.200 0.781 18.292 1.00 0.00 O ATOM 1703 N3 U B 152 13.048 1.895 16.524 1.00 0.00 N ATOM 1704 C4 U B 152 13.078 2.280 15.202 1.00 0.00 C ATOM 1705 O4 U B 152 13.948 3.048 14.805 1.00 0.00 O ATOM 1706 C5 U B 152 12.025 1.712 14.389 1.00 0.00 C ATOM 1707 C6 U B 152 11.094 0.870 14.911 1.00 0.00 C ATOM 0 H5' U B 152 8.608 -3.064 14.286 1.00 0.00 H new ATOM 0 H5'' U B 152 6.996 -2.380 14.379 1.00 0.00 H new ATOM 0 H4' U B 152 7.892 -2.156 16.461 1.00 0.00 H new ATOM 0 H3' U B 152 7.959 0.534 15.043 1.00 0.00 H new ATOM 0 H2' U B 152 8.861 1.456 17.187 1.00 0.00 H new ATOM 0 HO2' U B 152 7.327 -0.329 18.274 1.00 0.00 H new ATOM 0 HO3' U B 152 6.335 0.901 16.688 1.00 0.00 H new ATOM 0 H1' U B 152 10.522 -0.735 17.779 1.00 0.00 H new ATOM 0 H3 U B 152 13.773 2.270 17.136 1.00 0.00 H new ATOM 0 H5 U B 152 11.977 1.963 13.340 1.00 0.00 H new ATOM 0 H6 U B 152 10.322 0.464 14.274 1.00 0.00 H new TER 1719 U B 152