USER MOD reduce.3.24.130724 H: found=0, std=0, add=668, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 664 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 67 ASN :FLIP amide:sc= 0.596 F(o=-1.1,f=-0.17) USER MOD Set 1.2: A 71 THR OG1 : rot 171:sc= -0.762 USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= 0.135 K(o=0.13,f=-3.2!) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.0495) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN :FLIP amide:sc= -1.6 F(o=-2.4!,f=-1.6) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 TYR OH : rot 30:sc= 0 USER MOD Single : A 28 THR OG1 : rot 65:sc= 1.04 USER MOD Single : A 29 ASN : amide:sc= -0.33 K(o=-0.33,f=-1!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0.00458 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ -155:sc= -0.107 (180deg=-0.8) USER MOD Single : A 41 SER OG : rot 139:sc= 0.655 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot -45:sc= -6.04! USER MOD Single : A 45 ASN :FLIP amide:sc= -1.58 F(o=-3!,f=-1.6) USER MOD Single : A 47 SER OG : rot -150:sc= -0.129 USER MOD Single : A 50 GLN : amide:sc= -0.109 X(o=-0.11,f=-0.28) USER MOD Single : A 52 THR OG1 : rot -135:sc= -1.66 USER MOD Single : A 56 GLN : amide:sc= -0.208 X(o=-0.21,f=-0.0023) USER MOD Single : A 57 ASN : amide:sc= -0.362 K(o=-0.36,f=-1.7!) USER MOD Single : A 61 LYS NZ :NH3+ 162:sc= -0.0832 (180deg=-0.58) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ -165:sc= -0.0073 (180deg=-0.193) USER MOD Single : A 68 LYS NZ :NH3+ -159:sc= -0.055 (180deg=-0.515) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot -66:sc= 0.268 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.050 0.705 25.066 1.00 0.00 N ATOM 2 CA MET A 1 6.797 2.172 25.109 1.00 0.00 C ATOM 3 C MET A 1 8.124 2.932 25.125 1.00 0.00 C ATOM 4 O MET A 1 8.624 3.289 26.173 1.00 0.00 O ATOM 5 CB MET A 1 6.236 2.413 26.000 1.00 0.00 C ATOM 0 H1 MET A 1 6.143 0.196 25.055 1.00 0.00 H new ATOM 0 H2 MET A 1 7.588 0.471 24.208 1.00 0.00 H new ATOM 0 H3 MET A 1 7.596 0.422 25.905 1.00 0.00 H new ATOM 0 HA MET A 1 6.229 2.462 24.225 1.00 0.00 H new ATOM 7 N SER A 2 8.669 3.161 23.962 1.00 0.00 N ATOM 8 CA SER A 2 9.957 3.893 23.895 1.00 0.00 C ATOM 9 C SER A 2 9.795 5.300 24.447 1.00 0.00 C ATOM 10 O SER A 2 10.159 5.572 25.574 1.00 0.00 O ATOM 11 CB SER A 2 10.385 3.986 22.422 1.00 0.00 C ATOM 12 OG SER A 2 10.847 2.682 22.110 1.00 0.00 O ATOM 0 H SER A 2 8.279 2.874 23.064 1.00 0.00 H new ATOM 0 HA SER A 2 10.705 3.364 24.486 1.00 0.00 H new ATOM 0 HB2 SER A 2 9.551 4.276 21.783 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.169 4.730 22.281 1.00 0.00 H new ATOM 0 HG SER A 2 11.141 2.654 21.176 1.00 0.00 H new ATOM 18 N HIS A 3 9.249 6.169 23.629 1.00 0.00 N ATOM 19 CA HIS A 3 9.039 7.577 24.064 1.00 0.00 C ATOM 20 C HIS A 3 7.557 7.922 24.017 1.00 0.00 C ATOM 21 O HIS A 3 6.765 7.180 23.471 1.00 0.00 O ATOM 22 CB HIS A 3 9.796 8.504 23.096 1.00 0.00 C ATOM 23 CG HIS A 3 9.317 8.251 21.665 1.00 0.00 C ATOM 24 ND1 HIS A 3 9.471 7.181 21.039 1.00 0.00 N ATOM 25 CD2 HIS A 3 8.647 9.092 20.797 1.00 0.00 C ATOM 26 CE1 HIS A 3 8.974 7.249 19.873 1.00 0.00 C ATOM 27 NE2 HIS A 3 8.422 8.437 19.625 1.00 0.00 N ATOM 0 H HIS A 3 8.941 5.959 22.679 1.00 0.00 H new ATOM 0 HA HIS A 3 9.404 7.702 25.083 1.00 0.00 H new ATOM 0 HB2 HIS A 3 9.628 9.546 23.368 1.00 0.00 H new ATOM 0 HB3 HIS A 3 10.869 8.325 23.168 1.00 0.00 H new ATOM 0 HD2 HIS A 3 8.349 10.107 21.014 1.00 0.00 H new ATOM 0 HE1 HIS A 3 8.996 6.436 19.162 1.00 0.00 H new ATOM 0 HE2 HIS A 3 7.955 8.768 18.781 1.00 0.00 H new ATOM 35 N MET A 4 7.202 9.036 24.592 1.00 0.00 N ATOM 36 CA MET A 4 5.772 9.428 24.580 1.00 0.00 C ATOM 37 C MET A 4 5.201 9.323 23.170 1.00 0.00 C ATOM 38 O MET A 4 5.479 10.146 22.321 1.00 0.00 O ATOM 39 CB MET A 4 5.661 10.886 25.055 1.00 0.00 C ATOM 40 CG MET A 4 6.807 11.704 24.453 1.00 0.00 C ATOM 41 SD MET A 4 6.404 13.349 23.814 1.00 0.00 S ATOM 42 CE MET A 4 8.060 14.064 23.963 1.00 0.00 C ATOM 0 H MET A 4 7.834 9.683 25.064 1.00 0.00 H new ATOM 0 HA MET A 4 5.212 8.763 25.237 1.00 0.00 H new ATOM 0 HB2 MET A 4 4.702 11.306 24.754 1.00 0.00 H new ATOM 0 HB3 MET A 4 5.700 10.930 26.143 1.00 0.00 H new ATOM 0 HG2 MET A 4 7.578 11.817 25.215 1.00 0.00 H new ATOM 0 HG3 MET A 4 7.245 11.124 23.641 1.00 0.00 H new ATOM 0 HE1 MET A 4 8.043 15.097 23.617 1.00 0.00 H new ATOM 0 HE2 MET A 4 8.376 14.036 25.006 1.00 0.00 H new ATOM 0 HE3 MET A 4 8.760 13.490 23.356 1.00 0.00 H new ATOM 52 N LEU A 5 4.412 8.307 22.946 1.00 0.00 N ATOM 53 CA LEU A 5 3.812 8.127 21.598 1.00 0.00 C ATOM 54 C LEU A 5 2.591 9.020 21.413 1.00 0.00 C ATOM 55 O LEU A 5 1.892 8.917 20.424 1.00 0.00 O ATOM 56 CB LEU A 5 3.373 6.658 21.456 1.00 0.00 C ATOM 57 CG LEU A 5 2.038 6.454 22.183 1.00 0.00 C ATOM 58 CD1 LEU A 5 1.678 4.970 22.171 1.00 0.00 C ATOM 59 CD2 LEU A 5 2.176 6.926 23.632 1.00 0.00 C ATOM 0 H LEU A 5 4.159 7.599 23.635 1.00 0.00 H new ATOM 0 HA LEU A 5 4.553 8.395 20.845 1.00 0.00 H new ATOM 0 HB2 LEU A 5 3.270 6.398 20.403 1.00 0.00 H new ATOM 0 HB3 LEU A 5 4.133 5.998 21.875 1.00 0.00 H new ATOM 0 HG LEU A 5 1.257 7.026 21.682 1.00 0.00 H new ATOM 0 HD11 LEU A 5 0.729 4.822 22.687 1.00 0.00 H new ATOM 0 HD12 LEU A 5 1.588 4.626 21.141 1.00 0.00 H new ATOM 0 HD13 LEU A 5 2.459 4.402 22.677 1.00 0.00 H new ATOM 0 HD21 LEU A 5 1.229 6.783 24.153 1.00 0.00 H new ATOM 0 HD22 LEU A 5 2.955 6.349 24.130 1.00 0.00 H new ATOM 0 HD23 LEU A 5 2.442 7.983 23.647 1.00 0.00 H new ATOM 71 N GLU A 6 2.350 9.877 22.368 1.00 0.00 N ATOM 72 CA GLU A 6 1.175 10.779 22.256 1.00 0.00 C ATOM 73 C GLU A 6 1.054 11.344 20.845 1.00 0.00 C ATOM 74 O GLU A 6 2.042 11.545 20.166 1.00 0.00 O ATOM 75 CB GLU A 6 1.360 11.941 23.244 1.00 0.00 C ATOM 76 CG GLU A 6 0.106 12.058 24.113 1.00 0.00 C ATOM 77 CD GLU A 6 0.304 13.177 25.135 1.00 0.00 C ATOM 78 OE1 GLU A 6 1.458 13.427 25.447 1.00 0.00 O ATOM 79 OE2 GLU A 6 -0.708 13.717 25.548 1.00 0.00 O ATOM 0 H GLU A 6 2.912 9.989 23.212 1.00 0.00 H new ATOM 0 HA GLU A 6 0.270 10.214 22.481 1.00 0.00 H new ATOM 0 HB2 GLU A 6 2.237 11.769 23.869 1.00 0.00 H new ATOM 0 HB3 GLU A 6 1.532 12.872 22.703 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -0.764 12.268 23.490 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -0.087 11.114 24.623 1.00 0.00 H new ATOM 86 N GLY A 7 -0.159 11.592 20.431 1.00 0.00 N ATOM 87 CA GLY A 7 -0.365 12.146 19.062 1.00 0.00 C ATOM 88 C GLY A 7 -1.690 11.649 18.480 1.00 0.00 C ATOM 89 O GLY A 7 -2.044 11.981 17.366 1.00 0.00 O ATOM 0 H GLY A 7 -1.008 11.437 20.975 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -0.363 13.235 19.099 1.00 0.00 H new ATOM 0 HA3 GLY A 7 0.459 11.847 18.414 1.00 0.00 H new ATOM 93 N ARG A 8 -2.395 10.861 19.245 1.00 0.00 N ATOM 94 CA ARG A 8 -3.692 10.336 18.750 1.00 0.00 C ATOM 95 C ARG A 8 -3.551 9.800 17.330 1.00 0.00 C ATOM 96 O ARG A 8 -4.427 9.976 16.507 1.00 0.00 O ATOM 97 CB ARG A 8 -4.709 11.489 18.746 1.00 0.00 C ATOM 98 CG ARG A 8 -5.144 11.784 20.181 1.00 0.00 C ATOM 99 CD ARG A 8 -5.406 13.285 20.327 1.00 0.00 C ATOM 100 NE ARG A 8 -4.147 14.025 20.034 1.00 0.00 N ATOM 101 CZ ARG A 8 -4.034 15.271 20.405 1.00 0.00 C ATOM 102 NH1 ARG A 8 -5.084 16.044 20.349 1.00 0.00 N ATOM 103 NH2 ARG A 8 -2.876 15.701 20.828 1.00 0.00 N ATOM 0 H ARG A 8 -2.129 10.562 20.183 1.00 0.00 H new ATOM 0 HA ARG A 8 -4.021 9.524 19.398 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -4.266 12.378 18.298 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -5.574 11.224 18.139 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -6.044 11.220 20.424 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -4.371 11.468 20.881 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -6.195 13.598 19.643 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -5.750 13.511 21.336 1.00 0.00 H new ATOM 0 HE ARG A 8 -3.380 13.562 19.547 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -5.974 15.672 20.019 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -5.014 17.021 20.635 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -2.078 15.066 20.864 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -2.769 16.672 21.122 1.00 0.00 H new ATOM 117 N LYS A 9 -2.449 9.152 17.066 1.00 0.00 N ATOM 118 CA LYS A 9 -2.238 8.601 15.703 1.00 0.00 C ATOM 119 C LYS A 9 -3.210 7.462 15.418 1.00 0.00 C ATOM 120 O LYS A 9 -4.280 7.398 15.990 1.00 0.00 O ATOM 121 CB LYS A 9 -0.800 8.062 15.611 1.00 0.00 C ATOM 122 CG LYS A 9 -0.583 7.011 16.700 1.00 0.00 C ATOM 123 CD LYS A 9 0.856 7.111 17.212 1.00 0.00 C ATOM 124 CE LYS A 9 1.813 6.636 16.116 1.00 0.00 C ATOM 125 NZ LYS A 9 2.205 5.217 16.344 1.00 0.00 N ATOM 0 H LYS A 9 -1.694 8.983 17.730 1.00 0.00 H new ATOM 0 HA LYS A 9 -2.407 9.392 14.972 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -0.626 7.625 14.628 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -0.086 8.877 15.729 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -1.285 7.167 17.519 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -0.773 6.014 16.303 1.00 0.00 H new ATOM 0 HD2 LYS A 9 1.085 8.140 17.491 1.00 0.00 H new ATOM 0 HD3 LYS A 9 0.979 6.503 18.108 1.00 0.00 H new ATOM 0 HE2 LYS A 9 1.336 6.735 15.141 1.00 0.00 H new ATOM 0 HE3 LYS A 9 2.702 7.267 16.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 2.854 4.911 15.591 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 2.679 5.132 17.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 1.356 4.616 16.334 1.00 0.00 H new ATOM 139 N LYS A 10 -2.818 6.583 14.537 1.00 0.00 N ATOM 140 CA LYS A 10 -3.706 5.442 14.200 1.00 0.00 C ATOM 141 C LYS A 10 -5.028 5.942 13.624 1.00 0.00 C ATOM 142 O LYS A 10 -6.009 5.226 13.602 1.00 0.00 O ATOM 143 CB LYS A 10 -3.985 4.643 15.485 1.00 0.00 C ATOM 144 CG LYS A 10 -3.582 3.181 15.262 1.00 0.00 C ATOM 145 CD LYS A 10 -3.475 2.472 16.616 1.00 0.00 C ATOM 146 CE LYS A 10 -4.390 1.245 16.617 1.00 0.00 C ATOM 147 NZ LYS A 10 -5.820 1.662 16.626 1.00 0.00 N ATOM 0 H LYS A 10 -1.927 6.607 14.041 1.00 0.00 H new ATOM 0 HA LYS A 10 -3.217 4.814 13.455 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -3.425 5.065 16.319 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -5.041 4.707 15.746 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -4.319 2.681 14.634 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -2.629 3.131 14.736 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -2.444 2.171 16.802 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -3.758 3.152 17.419 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -4.189 0.633 15.738 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -4.179 0.627 17.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -6.416 0.854 16.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -5.952 2.434 17.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -6.092 1.990 15.677 1.00 0.00 H new ATOM 161 N ARG A 11 -5.023 7.167 13.168 1.00 0.00 N ATOM 162 CA ARG A 11 -6.264 7.742 12.587 1.00 0.00 C ATOM 163 C ARG A 11 -6.257 7.598 11.067 1.00 0.00 C ATOM 164 O ARG A 11 -7.280 7.376 10.463 1.00 0.00 O ATOM 165 CB ARG A 11 -6.308 9.237 12.954 1.00 0.00 C ATOM 166 CG ARG A 11 -7.155 9.992 11.928 1.00 0.00 C ATOM 167 CD ARG A 11 -7.371 11.425 12.421 1.00 0.00 C ATOM 168 NE ARG A 11 -6.166 12.239 12.089 1.00 0.00 N ATOM 169 CZ ARG A 11 -5.112 12.168 12.857 1.00 0.00 C ATOM 170 NH1 ARG A 11 -5.198 12.590 14.089 1.00 0.00 N ATOM 171 NH2 ARG A 11 -4.007 11.675 12.368 1.00 0.00 N ATOM 0 H ARG A 11 -4.215 7.789 13.174 1.00 0.00 H new ATOM 0 HA ARG A 11 -7.134 7.217 12.980 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -6.728 9.365 13.952 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -5.298 9.646 12.978 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -6.656 9.998 10.959 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -8.114 9.492 11.790 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -8.257 11.855 11.953 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -7.545 11.431 13.497 1.00 0.00 H new ATOM 0 HE ARG A 11 -6.165 12.846 11.269 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -6.079 12.968 14.438 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -4.385 12.542 14.703 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -3.976 11.353 11.401 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -3.174 11.612 12.953 1.00 0.00 H new ATOM 185 N VAL A 12 -5.084 7.730 10.498 1.00 0.00 N ATOM 186 CA VAL A 12 -4.914 7.613 9.013 1.00 0.00 C ATOM 187 C VAL A 12 -5.790 8.629 8.224 1.00 0.00 C ATOM 188 O VAL A 12 -6.836 9.046 8.680 1.00 0.00 O ATOM 189 CB VAL A 12 -5.239 6.138 8.581 1.00 0.00 C ATOM 190 CG1 VAL A 12 -4.754 5.194 9.683 1.00 0.00 C ATOM 191 CG2 VAL A 12 -6.754 5.897 8.364 1.00 0.00 C ATOM 0 H VAL A 12 -4.221 7.917 11.008 1.00 0.00 H new ATOM 0 HA VAL A 12 -3.880 7.857 8.769 1.00 0.00 H new ATOM 0 HB VAL A 12 -4.735 5.953 7.632 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -4.971 4.164 9.401 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -3.679 5.314 9.818 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.266 5.430 10.616 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -6.919 4.861 8.067 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -7.291 6.098 9.291 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -7.120 6.561 7.581 1.00 0.00 H new ATOM 201 N PRO A 13 -5.304 9.037 7.050 1.00 0.00 N ATOM 202 CA PRO A 13 -6.031 9.993 6.204 1.00 0.00 C ATOM 203 C PRO A 13 -7.345 9.400 5.682 1.00 0.00 C ATOM 204 O PRO A 13 -7.977 8.603 6.346 1.00 0.00 O ATOM 205 CB PRO A 13 -5.082 10.265 5.011 1.00 0.00 C ATOM 206 CG PRO A 13 -3.841 9.339 5.181 1.00 0.00 C ATOM 207 CD PRO A 13 -3.991 8.612 6.526 1.00 0.00 C ATOM 0 HA PRO A 13 -6.293 10.892 6.762 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -5.586 10.062 4.066 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -4.780 11.312 4.992 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -3.782 8.622 4.362 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -2.921 9.923 5.161 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -3.950 7.531 6.396 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -3.187 8.881 7.211 1.00 0.00 H new ATOM 215 N TYR A 14 -7.728 9.814 4.496 1.00 0.00 N ATOM 216 CA TYR A 14 -8.985 9.298 3.905 1.00 0.00 C ATOM 217 C TYR A 14 -10.141 9.453 4.875 1.00 0.00 C ATOM 218 O TYR A 14 -10.739 8.483 5.294 1.00 0.00 O ATOM 219 CB TYR A 14 -8.795 7.805 3.580 1.00 0.00 C ATOM 220 CG TYR A 14 -7.947 7.674 2.312 1.00 0.00 C ATOM 221 CD1 TYR A 14 -8.539 7.707 1.065 1.00 0.00 C ATOM 222 CD2 TYR A 14 -6.578 7.533 2.399 1.00 0.00 C ATOM 223 CE1 TYR A 14 -7.772 7.602 -0.077 1.00 0.00 C ATOM 224 CE2 TYR A 14 -5.811 7.427 1.257 1.00 0.00 C ATOM 225 CZ TYR A 14 -6.402 7.460 0.010 1.00 0.00 C ATOM 226 OH TYR A 14 -5.634 7.355 -1.133 1.00 0.00 O ATOM 0 H TYR A 14 -7.220 10.485 3.920 1.00 0.00 H new ATOM 0 HA TYR A 14 -9.214 9.865 3.002 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -8.308 7.298 4.413 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -9.763 7.325 3.437 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -9.610 7.816 0.983 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -6.103 7.505 3.368 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -8.247 7.631 -1.046 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -4.740 7.317 1.339 1.00 0.00 H new ATOM 0 HH TYR A 14 -4.690 7.262 -0.886 1.00 0.00 H new ATOM 236 N THR A 15 -10.438 10.682 5.213 1.00 0.00 N ATOM 237 CA THR A 15 -11.559 10.930 6.160 1.00 0.00 C ATOM 238 C THR A 15 -12.326 12.192 5.787 1.00 0.00 C ATOM 239 O THR A 15 -12.250 12.660 4.677 1.00 0.00 O ATOM 240 CB THR A 15 -10.969 11.112 7.557 1.00 0.00 C ATOM 241 OG1 THR A 15 -9.589 11.336 7.356 1.00 0.00 O ATOM 242 CG2 THR A 15 -11.034 9.804 8.347 1.00 0.00 C ATOM 0 H THR A 15 -9.956 11.515 4.876 1.00 0.00 H new ATOM 0 HA THR A 15 -12.247 10.085 6.124 1.00 0.00 H new ATOM 0 HB THR A 15 -11.502 11.905 8.082 1.00 0.00 H new ATOM 0 HG1 THR A 15 -9.149 11.463 8.222 1.00 0.00 H new ATOM 0 HG21 THR A 15 -10.608 9.956 9.339 1.00 0.00 H new ATOM 0 HG22 THR A 15 -12.073 9.488 8.442 1.00 0.00 H new ATOM 0 HG23 THR A 15 -10.467 9.034 7.823 1.00 0.00 H new ATOM 250 N LYS A 16 -13.058 12.715 6.732 1.00 0.00 N ATOM 251 CA LYS A 16 -13.836 13.941 6.460 1.00 0.00 C ATOM 252 C LYS A 16 -12.912 15.141 6.366 1.00 0.00 C ATOM 253 O LYS A 16 -13.135 16.036 5.576 1.00 0.00 O ATOM 254 CB LYS A 16 -14.829 14.156 7.614 1.00 0.00 C ATOM 255 CG LYS A 16 -15.921 13.079 7.542 1.00 0.00 C ATOM 256 CD LYS A 16 -15.977 12.320 8.872 1.00 0.00 C ATOM 257 CE LYS A 16 -16.731 13.166 9.901 1.00 0.00 C ATOM 258 NZ LYS A 16 -15.927 13.312 11.147 1.00 0.00 N ATOM 0 H LYS A 16 -13.147 12.342 7.677 1.00 0.00 H new ATOM 0 HA LYS A 16 -14.367 13.832 5.514 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -14.311 14.103 8.571 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -15.274 15.149 7.547 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -16.887 13.538 7.332 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -15.712 12.388 6.725 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -16.476 11.360 8.736 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -14.968 12.108 9.226 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -16.947 14.149 9.484 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -17.689 12.700 10.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -16.453 13.889 11.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -15.742 12.373 11.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -15.024 13.777 10.925 1.00 0.00 H new ATOM 272 N VAL A 17 -11.880 15.143 7.174 1.00 0.00 N ATOM 273 CA VAL A 17 -10.944 16.277 7.129 1.00 0.00 C ATOM 274 C VAL A 17 -10.571 16.504 5.696 1.00 0.00 C ATOM 275 O VAL A 17 -10.080 17.548 5.315 1.00 0.00 O ATOM 276 CB VAL A 17 -9.684 15.910 7.931 1.00 0.00 C ATOM 277 CG1 VAL A 17 -8.559 16.886 7.581 1.00 0.00 C ATOM 278 CG2 VAL A 17 -9.990 16.009 9.428 1.00 0.00 C ATOM 0 H VAL A 17 -11.658 14.412 7.850 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.396 17.174 7.552 1.00 0.00 H new ATOM 0 HB VAL A 17 -9.377 14.893 7.685 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -7.664 16.628 8.148 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -8.343 16.825 6.514 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.867 17.901 7.831 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -9.099 15.749 9.999 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -10.293 17.028 9.671 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.796 15.321 9.681 1.00 0.00 H new ATOM 288 N GLN A 18 -10.825 15.494 4.927 1.00 0.00 N ATOM 289 CA GLN A 18 -10.521 15.553 3.498 1.00 0.00 C ATOM 290 C GLN A 18 -11.573 16.364 2.767 1.00 0.00 C ATOM 291 O GLN A 18 -11.296 17.427 2.242 1.00 0.00 O ATOM 292 CB GLN A 18 -10.563 14.119 2.972 1.00 0.00 C ATOM 293 CG GLN A 18 -9.786 14.047 1.690 1.00 0.00 C ATOM 294 CD GLN A 18 -9.734 12.598 1.204 1.00 0.00 C ATOM 295 OE1 GLN A 18 -8.904 11.767 1.775 1.00 0.00 O flip ATOM 296 NE2 GLN A 18 -10.450 12.208 0.306 1.00 0.00 N flip ATOM 0 H GLN A 18 -11.239 14.617 5.243 1.00 0.00 H new ATOM 0 HA GLN A 18 -9.548 16.018 3.340 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -10.140 13.435 3.708 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -11.595 13.809 2.805 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -10.253 14.678 0.934 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -8.776 14.427 1.843 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -11.100 12.852 -0.144 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -10.402 11.236 0.001 1.00 0.00 H new ATOM 305 N LEU A 19 -12.770 15.849 2.745 1.00 0.00 N ATOM 306 CA LEU A 19 -13.853 16.577 2.053 1.00 0.00 C ATOM 307 C LEU A 19 -14.249 17.802 2.850 1.00 0.00 C ATOM 308 O LEU A 19 -14.961 18.663 2.366 1.00 0.00 O ATOM 309 CB LEU A 19 -15.068 15.646 1.925 1.00 0.00 C ATOM 310 CG LEU A 19 -15.014 14.933 0.570 1.00 0.00 C ATOM 311 CD1 LEU A 19 -15.153 15.966 -0.550 1.00 0.00 C ATOM 312 CD2 LEU A 19 -13.670 14.218 0.431 1.00 0.00 C ATOM 0 H LEU A 19 -13.038 14.963 3.174 1.00 0.00 H new ATOM 0 HA LEU A 19 -13.508 16.890 1.068 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -15.069 14.916 2.734 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -15.991 16.219 2.012 1.00 0.00 H new ATOM 0 HG LEU A 19 -15.825 14.208 0.504 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -15.115 15.463 -1.516 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -16.106 16.486 -0.449 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -14.338 16.686 -0.484 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -13.627 13.709 -0.532 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -12.862 14.947 0.493 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -13.562 13.488 1.233 1.00 0.00 H new ATOM 324 N LYS A 20 -13.771 17.868 4.062 1.00 0.00 N ATOM 325 CA LYS A 20 -14.106 19.025 4.904 1.00 0.00 C ATOM 326 C LYS A 20 -13.211 20.191 4.551 1.00 0.00 C ATOM 327 O LYS A 20 -13.647 21.314 4.508 1.00 0.00 O ATOM 328 CB LYS A 20 -13.879 18.653 6.376 1.00 0.00 C ATOM 329 CG LYS A 20 -14.403 19.785 7.265 1.00 0.00 C ATOM 330 CD LYS A 20 -14.529 19.278 8.706 1.00 0.00 C ATOM 331 CE LYS A 20 -13.769 20.222 9.643 1.00 0.00 C ATOM 332 NZ LYS A 20 -14.509 21.505 9.805 1.00 0.00 N ATOM 0 H LYS A 20 -13.167 17.169 4.494 1.00 0.00 H new ATOM 0 HA LYS A 20 -15.147 19.303 4.740 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -14.393 17.721 6.612 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -12.818 18.488 6.563 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -13.726 20.638 7.225 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -15.371 20.130 6.902 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -15.579 19.227 8.995 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -14.127 18.268 8.785 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -13.634 19.748 10.615 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -12.774 20.417 9.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -13.980 22.133 10.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -14.616 21.964 8.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -15.449 21.315 10.207 1.00 0.00 H new ATOM 346 N GLU A 21 -11.966 19.908 4.292 1.00 0.00 N ATOM 347 CA GLU A 21 -11.056 21.013 3.943 1.00 0.00 C ATOM 348 C GLU A 21 -11.249 21.418 2.490 1.00 0.00 C ATOM 349 O GLU A 21 -10.915 22.511 2.096 1.00 0.00 O ATOM 350 CB GLU A 21 -9.609 20.540 4.150 1.00 0.00 C ATOM 351 CG GLU A 21 -9.366 20.313 5.644 1.00 0.00 C ATOM 352 CD GLU A 21 -9.177 21.663 6.338 1.00 0.00 C ATOM 353 OE1 GLU A 21 -8.054 22.141 6.297 1.00 0.00 O ATOM 354 OE2 GLU A 21 -10.165 22.142 6.871 1.00 0.00 O ATOM 0 H GLU A 21 -11.552 18.976 4.308 1.00 0.00 H new ATOM 0 HA GLU A 21 -11.270 21.873 4.577 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -9.432 19.618 3.596 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.911 21.283 3.764 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -10.209 19.780 6.084 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.484 19.690 5.790 1.00 0.00 H new ATOM 361 N LEU A 22 -11.797 20.533 1.726 1.00 0.00 N ATOM 362 CA LEU A 22 -12.020 20.849 0.301 1.00 0.00 C ATOM 363 C LEU A 22 -13.201 21.808 0.121 1.00 0.00 C ATOM 364 O LEU A 22 -13.055 22.902 -0.400 1.00 0.00 O ATOM 365 CB LEU A 22 -12.351 19.527 -0.428 1.00 0.00 C ATOM 366 CG LEU A 22 -11.360 19.294 -1.575 1.00 0.00 C ATOM 367 CD1 LEU A 22 -11.256 20.563 -2.427 1.00 0.00 C ATOM 368 CD2 LEU A 22 -9.984 18.953 -0.993 1.00 0.00 C ATOM 0 H LEU A 22 -12.100 19.606 2.024 1.00 0.00 H new ATOM 0 HA LEU A 22 -11.126 21.324 -0.102 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -12.308 18.695 0.275 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -13.368 19.563 -0.818 1.00 0.00 H new ATOM 0 HG LEU A 22 -11.708 18.469 -2.197 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -10.552 20.397 -3.242 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -12.236 20.807 -2.838 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -10.907 21.389 -1.808 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -9.276 18.787 -1.805 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -9.636 19.779 -0.373 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -10.059 18.050 -0.387 1.00 0.00 H new ATOM 380 N GLU A 23 -14.340 21.389 0.587 1.00 0.00 N ATOM 381 CA GLU A 23 -15.556 22.243 0.458 1.00 0.00 C ATOM 382 C GLU A 23 -15.504 23.512 1.313 1.00 0.00 C ATOM 383 O GLU A 23 -16.167 24.483 1.005 1.00 0.00 O ATOM 384 CB GLU A 23 -16.769 21.413 0.897 1.00 0.00 C ATOM 385 CG GLU A 23 -17.997 21.861 0.101 1.00 0.00 C ATOM 386 CD GLU A 23 -19.106 20.818 0.249 1.00 0.00 C ATOM 387 OE1 GLU A 23 -19.299 20.388 1.372 1.00 0.00 O ATOM 388 OE2 GLU A 23 -19.697 20.510 -0.773 1.00 0.00 O ATOM 0 H GLU A 23 -14.485 20.493 1.052 1.00 0.00 H new ATOM 0 HA GLU A 23 -15.621 22.561 -0.582 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -16.579 20.353 0.730 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -16.946 21.541 1.965 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -18.343 22.830 0.460 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -17.737 21.985 -0.950 1.00 0.00 H new ATOM 395 N ARG A 24 -14.731 23.502 2.362 1.00 0.00 N ATOM 396 CA ARG A 24 -14.669 24.727 3.207 1.00 0.00 C ATOM 397 C ARG A 24 -13.621 25.689 2.689 1.00 0.00 C ATOM 398 O ARG A 24 -13.900 26.855 2.486 1.00 0.00 O ATOM 399 CB ARG A 24 -14.318 24.317 4.642 1.00 0.00 C ATOM 400 CG ARG A 24 -15.546 23.658 5.307 1.00 0.00 C ATOM 401 CD ARG A 24 -16.337 22.827 4.275 1.00 0.00 C ATOM 402 NE ARG A 24 -17.447 22.126 4.978 1.00 0.00 N ATOM 403 CZ ARG A 24 -18.542 21.850 4.327 1.00 0.00 C ATOM 404 NH1 ARG A 24 -18.549 20.833 3.516 1.00 0.00 N ATOM 405 NH2 ARG A 24 -19.591 22.604 4.509 1.00 0.00 N ATOM 0 H ARG A 24 -14.152 22.719 2.666 1.00 0.00 H new ATOM 0 HA ARG A 24 -15.637 25.227 3.178 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -13.478 23.623 4.637 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -14.007 25.191 5.215 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -15.223 23.018 6.128 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -16.190 24.425 5.736 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -16.734 23.474 3.493 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -15.681 22.105 3.789 1.00 0.00 H new ATOM 0 HE ARG A 24 -17.351 21.864 5.959 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -17.708 20.268 3.399 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -19.396 20.600 2.997 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -19.546 23.394 5.152 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -20.457 22.403 4.008 1.00 0.00 H new ATOM 419 N GLU A 25 -12.434 25.201 2.479 1.00 0.00 N ATOM 420 CA GLU A 25 -11.383 26.102 1.973 1.00 0.00 C ATOM 421 C GLU A 25 -11.819 26.711 0.653 1.00 0.00 C ATOM 422 O GLU A 25 -11.301 27.726 0.232 1.00 0.00 O ATOM 423 CB GLU A 25 -10.099 25.293 1.753 1.00 0.00 C ATOM 424 CG GLU A 25 -9.704 24.609 3.065 1.00 0.00 C ATOM 425 CD GLU A 25 -8.918 25.594 3.936 1.00 0.00 C ATOM 426 OE1 GLU A 25 -9.574 26.384 4.592 1.00 0.00 O ATOM 427 OE2 GLU A 25 -7.701 25.498 3.895 1.00 0.00 O ATOM 0 H GLU A 25 -12.154 24.232 2.634 1.00 0.00 H new ATOM 0 HA GLU A 25 -11.207 26.898 2.696 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -10.254 24.548 0.973 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -9.296 25.948 1.414 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -10.595 24.270 3.594 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -9.099 23.726 2.860 1.00 0.00 H new ATOM 434 N TYR A 26 -12.772 26.076 0.013 1.00 0.00 N ATOM 435 CA TYR A 26 -13.254 26.609 -1.280 1.00 0.00 C ATOM 436 C TYR A 26 -14.389 27.593 -1.049 1.00 0.00 C ATOM 437 O TYR A 26 -14.458 28.628 -1.683 1.00 0.00 O ATOM 438 CB TYR A 26 -13.772 25.440 -2.134 1.00 0.00 C ATOM 439 CG TYR A 26 -13.805 25.860 -3.603 1.00 0.00 C ATOM 440 CD1 TYR A 26 -12.662 26.318 -4.228 1.00 0.00 C ATOM 441 CD2 TYR A 26 -14.981 25.797 -4.322 1.00 0.00 C ATOM 442 CE1 TYR A 26 -12.696 26.710 -5.550 1.00 0.00 C ATOM 443 CE2 TYR A 26 -15.015 26.188 -5.646 1.00 0.00 C ATOM 444 CZ TYR A 26 -13.871 26.648 -6.270 1.00 0.00 C ATOM 445 OH TYR A 26 -13.905 27.040 -7.593 1.00 0.00 O ATOM 0 H TYR A 26 -13.227 25.221 0.334 1.00 0.00 H new ATOM 0 HA TYR A 26 -12.436 27.120 -1.788 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -13.128 24.570 -2.008 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -14.770 25.149 -1.805 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -11.734 26.370 -3.677 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -15.882 25.439 -3.846 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -11.795 27.069 -6.025 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -15.942 26.134 -6.198 1.00 0.00 H new ATOM 0 HH TYR A 26 -13.030 26.879 -8.005 1.00 0.00 H new ATOM 455 N ALA A 27 -15.263 27.254 -0.142 1.00 0.00 N ATOM 456 CA ALA A 27 -16.397 28.155 0.143 1.00 0.00 C ATOM 457 C ALA A 27 -15.965 29.249 1.106 1.00 0.00 C ATOM 458 O ALA A 27 -16.687 30.199 1.341 1.00 0.00 O ATOM 459 CB ALA A 27 -17.523 27.338 0.794 1.00 0.00 C ATOM 0 H ALA A 27 -15.235 26.395 0.408 1.00 0.00 H new ATOM 0 HA ALA A 27 -16.740 28.609 -0.786 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -18.368 27.991 1.010 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -17.840 26.548 0.113 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -17.161 26.894 1.721 1.00 0.00 H new ATOM 465 N THR A 28 -14.787 29.096 1.647 1.00 0.00 N ATOM 466 CA THR A 28 -14.283 30.108 2.594 1.00 0.00 C ATOM 467 C THR A 28 -13.917 31.379 1.858 1.00 0.00 C ATOM 468 O THR A 28 -14.208 32.469 2.311 1.00 0.00 O ATOM 469 CB THR A 28 -13.028 29.551 3.267 1.00 0.00 C ATOM 470 OG1 THR A 28 -13.495 28.584 4.185 1.00 0.00 O ATOM 471 CG2 THR A 28 -12.354 30.619 4.138 1.00 0.00 C ATOM 0 H THR A 28 -14.159 28.312 1.469 1.00 0.00 H new ATOM 0 HA THR A 28 -15.054 30.334 3.330 1.00 0.00 H new ATOM 0 HB THR A 28 -12.335 29.185 2.510 1.00 0.00 H new ATOM 0 HG1 THR A 28 -13.922 27.849 3.697 1.00 0.00 H new ATOM 0 HG21 THR A 28 -11.464 30.198 4.606 1.00 0.00 H new ATOM 0 HG22 THR A 28 -12.070 31.469 3.517 1.00 0.00 H new ATOM 0 HG23 THR A 28 -13.048 30.950 4.911 1.00 0.00 H new ATOM 479 N ASN A 29 -13.283 31.219 0.731 1.00 0.00 N ATOM 480 CA ASN A 29 -12.887 32.410 -0.054 1.00 0.00 C ATOM 481 C ASN A 29 -12.953 32.125 -1.551 1.00 0.00 C ATOM 482 O ASN A 29 -13.730 32.727 -2.266 1.00 0.00 O ATOM 483 CB ASN A 29 -11.442 32.772 0.326 1.00 0.00 C ATOM 484 CG ASN A 29 -10.794 33.561 -0.811 1.00 0.00 C ATOM 485 OD1 ASN A 29 -11.392 34.448 -1.384 1.00 0.00 O ATOM 486 ND2 ASN A 29 -9.573 33.269 -1.165 1.00 0.00 N ATOM 0 H ASN A 29 -13.025 30.320 0.325 1.00 0.00 H new ATOM 0 HA ASN A 29 -13.570 33.230 0.167 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -11.433 33.362 1.242 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -10.870 31.866 0.525 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -9.124 33.786 -1.921 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -9.067 32.524 -0.686 1.00 0.00 H new ATOM 493 N LYS A 30 -12.142 31.206 -1.991 1.00 0.00 N ATOM 494 CA LYS A 30 -12.127 30.855 -3.434 1.00 0.00 C ATOM 495 C LYS A 30 -11.104 29.773 -3.657 1.00 0.00 C ATOM 496 O LYS A 30 -11.393 28.728 -4.206 1.00 0.00 O ATOM 497 CB LYS A 30 -11.717 32.100 -4.244 1.00 0.00 C ATOM 498 CG LYS A 30 -12.583 32.193 -5.501 1.00 0.00 C ATOM 499 CD LYS A 30 -12.034 33.302 -6.403 1.00 0.00 C ATOM 500 CE LYS A 30 -13.173 33.888 -7.240 1.00 0.00 C ATOM 501 NZ LYS A 30 -13.536 32.962 -8.346 1.00 0.00 N ATOM 0 H LYS A 30 -11.487 30.682 -1.410 1.00 0.00 H new ATOM 0 HA LYS A 30 -13.113 30.512 -3.748 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -11.838 32.998 -3.638 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -10.664 32.039 -4.518 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -12.581 31.241 -6.031 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -13.618 32.405 -5.231 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -11.574 34.083 -5.798 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -11.257 32.904 -7.055 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -14.042 34.067 -6.607 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -12.873 34.853 -7.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -14.310 33.375 -8.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -12.709 32.812 -8.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -13.843 32.051 -7.949 1.00 0.00 H new ATOM 515 N PHE A 31 -9.919 30.052 -3.221 1.00 0.00 N ATOM 516 CA PHE A 31 -8.840 29.096 -3.367 1.00 0.00 C ATOM 517 C PHE A 31 -7.862 29.315 -2.243 1.00 0.00 C ATOM 518 O PHE A 31 -7.836 30.379 -1.653 1.00 0.00 O ATOM 519 CB PHE A 31 -8.141 29.281 -4.719 1.00 0.00 C ATOM 520 CG PHE A 31 -7.728 27.896 -5.198 1.00 0.00 C ATOM 521 CD1 PHE A 31 -6.674 27.248 -4.595 1.00 0.00 C ATOM 522 CD2 PHE A 31 -8.460 27.230 -6.162 1.00 0.00 C ATOM 523 CE1 PHE A 31 -6.359 25.958 -4.930 1.00 0.00 C ATOM 524 CE2 PHE A 31 -8.140 25.932 -6.499 1.00 0.00 C ATOM 525 CZ PHE A 31 -7.088 25.299 -5.876 1.00 0.00 C ATOM 0 H PHE A 31 -9.662 30.926 -2.762 1.00 0.00 H new ATOM 0 HA PHE A 31 -9.235 28.081 -3.329 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -8.810 29.754 -5.438 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -7.271 29.930 -4.618 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -6.088 27.763 -3.848 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -9.284 27.727 -6.652 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -5.532 25.462 -4.444 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -8.714 25.412 -7.251 1.00 0.00 H new ATOM 0 HZ PHE A 31 -6.840 24.281 -6.136 1.00 0.00 H new ATOM 535 N ILE A 32 -7.074 28.328 -1.966 1.00 0.00 N ATOM 536 CA ILE A 32 -6.094 28.467 -0.874 1.00 0.00 C ATOM 537 C ILE A 32 -4.683 28.722 -1.395 1.00 0.00 C ATOM 538 O ILE A 32 -4.369 28.460 -2.533 1.00 0.00 O ATOM 539 CB ILE A 32 -6.128 27.181 -0.051 1.00 0.00 C ATOM 540 CG1 ILE A 32 -7.053 26.150 -0.705 1.00 0.00 C ATOM 541 CG2 ILE A 32 -6.703 27.522 1.332 1.00 0.00 C ATOM 542 CD1 ILE A 32 -6.353 25.553 -1.927 1.00 0.00 C ATOM 0 H ILE A 32 -7.067 27.430 -2.450 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.361 29.330 -0.264 1.00 0.00 H new ATOM 0 HB ILE A 32 -5.121 26.769 0.018 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -7.302 25.363 0.007 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -7.991 26.620 -1.001 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -6.739 26.620 1.943 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -6.069 28.264 1.817 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -7.710 27.924 1.218 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -7.006 24.818 -2.397 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -6.126 26.346 -2.640 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -5.427 25.069 -1.616 1.00 0.00 H new ATOM 554 N THR A 33 -3.860 29.232 -0.536 1.00 0.00 N ATOM 555 CA THR A 33 -2.466 29.524 -0.939 1.00 0.00 C ATOM 556 C THR A 33 -1.643 28.256 -1.046 1.00 0.00 C ATOM 557 O THR A 33 -1.958 27.251 -0.442 1.00 0.00 O ATOM 558 CB THR A 33 -1.838 30.425 0.126 1.00 0.00 C ATOM 559 OG1 THR A 33 -2.846 31.353 0.473 1.00 0.00 O ATOM 560 CG2 THR A 33 -0.717 31.281 -0.479 1.00 0.00 C ATOM 0 H THR A 33 -4.092 29.460 0.431 1.00 0.00 H new ATOM 0 HA THR A 33 -2.479 30.008 -1.916 1.00 0.00 H new ATOM 0 HB THR A 33 -1.456 29.818 0.947 1.00 0.00 H new ATOM 0 HG1 THR A 33 -2.506 31.964 1.159 1.00 0.00 H new ATOM 0 HG21 THR A 33 -0.284 31.914 0.296 1.00 0.00 H new ATOM 0 HG22 THR A 33 0.056 30.631 -0.890 1.00 0.00 H new ATOM 0 HG23 THR A 33 -1.125 31.907 -1.273 1.00 0.00 H new ATOM 568 N LYS A 34 -0.597 28.328 -1.815 1.00 0.00 N ATOM 569 CA LYS A 34 0.265 27.141 -1.981 1.00 0.00 C ATOM 570 C LYS A 34 0.542 26.503 -0.632 1.00 0.00 C ATOM 571 O LYS A 34 0.614 25.296 -0.514 1.00 0.00 O ATOM 572 CB LYS A 34 1.588 27.589 -2.616 1.00 0.00 C ATOM 573 CG LYS A 34 1.417 27.667 -4.142 1.00 0.00 C ATOM 574 CD LYS A 34 0.357 28.739 -4.491 1.00 0.00 C ATOM 575 CE LYS A 34 -1.047 28.101 -4.603 1.00 0.00 C ATOM 576 NZ LYS A 34 -1.687 28.478 -5.894 1.00 0.00 N ATOM 0 H LYS A 34 -0.306 29.157 -2.333 1.00 0.00 H new ATOM 0 HA LYS A 34 -0.234 26.410 -2.617 1.00 0.00 H new ATOM 0 HB2 LYS A 34 1.884 28.561 -2.221 1.00 0.00 H new ATOM 0 HB3 LYS A 34 2.383 26.887 -2.363 1.00 0.00 H new ATOM 0 HG2 LYS A 34 2.368 27.915 -4.613 1.00 0.00 H new ATOM 0 HG3 LYS A 34 1.111 26.697 -4.534 1.00 0.00 H new ATOM 0 HD2 LYS A 34 0.350 29.514 -3.725 1.00 0.00 H new ATOM 0 HD3 LYS A 34 0.618 29.223 -5.432 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -0.967 27.016 -4.532 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -1.670 28.430 -3.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -2.629 28.042 -5.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -1.780 29.513 -5.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -1.099 28.143 -6.684 1.00 0.00 H new ATOM 590 N ASP A 35 0.687 27.327 0.366 1.00 0.00 N ATOM 591 CA ASP A 35 0.958 26.789 1.713 1.00 0.00 C ATOM 592 C ASP A 35 -0.256 26.029 2.227 1.00 0.00 C ATOM 593 O ASP A 35 -0.129 25.071 2.962 1.00 0.00 O ATOM 594 CB ASP A 35 1.231 27.968 2.664 1.00 0.00 C ATOM 595 CG ASP A 35 2.451 28.750 2.176 1.00 0.00 C ATOM 596 OD1 ASP A 35 3.040 28.289 1.213 1.00 0.00 O ATOM 597 OD2 ASP A 35 2.725 29.766 2.795 1.00 0.00 O ATOM 0 H ASP A 35 0.629 28.343 0.302 1.00 0.00 H new ATOM 0 HA ASP A 35 1.815 26.117 1.667 1.00 0.00 H new ATOM 0 HB2 ASP A 35 0.360 28.623 2.707 1.00 0.00 H new ATOM 0 HB3 ASP A 35 1.403 27.600 3.675 1.00 0.00 H new ATOM 602 N LYS A 36 -1.418 26.467 1.815 1.00 0.00 N ATOM 603 CA LYS A 36 -2.653 25.787 2.268 1.00 0.00 C ATOM 604 C LYS A 36 -3.011 24.607 1.371 1.00 0.00 C ATOM 605 O LYS A 36 -3.282 23.528 1.859 1.00 0.00 O ATOM 606 CB LYS A 36 -3.797 26.804 2.249 1.00 0.00 C ATOM 607 CG LYS A 36 -3.826 27.548 3.588 1.00 0.00 C ATOM 608 CD LYS A 36 -2.491 28.266 3.798 1.00 0.00 C ATOM 609 CE LYS A 36 -2.502 28.951 5.165 1.00 0.00 C ATOM 610 NZ LYS A 36 -3.764 29.718 5.352 1.00 0.00 N ATOM 0 H LYS A 36 -1.558 27.260 1.189 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.489 25.399 3.273 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -3.660 27.509 1.429 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -4.747 26.298 2.079 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -4.645 28.268 3.599 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -4.007 26.847 4.403 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -1.668 27.554 3.741 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -2.331 29.002 3.010 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.402 28.205 5.953 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.646 29.621 5.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -3.606 30.486 6.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -4.063 30.121 4.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -4.506 29.083 5.710 1.00 0.00 H new ATOM 624 N ARG A 37 -3.010 24.814 0.075 1.00 0.00 N ATOM 625 CA ARG A 37 -3.353 23.683 -0.811 1.00 0.00 C ATOM 626 C ARG A 37 -2.377 22.567 -0.558 1.00 0.00 C ATOM 627 O ARG A 37 -2.648 21.409 -0.832 1.00 0.00 O ATOM 628 CB ARG A 37 -3.276 24.133 -2.283 1.00 0.00 C ATOM 629 CG ARG A 37 -1.821 24.319 -2.698 1.00 0.00 C ATOM 630 CD ARG A 37 -1.310 23.029 -3.345 1.00 0.00 C ATOM 631 NE ARG A 37 -1.615 23.066 -4.805 1.00 0.00 N ATOM 632 CZ ARG A 37 -0.952 23.883 -5.580 1.00 0.00 C ATOM 633 NH1 ARG A 37 0.165 23.476 -6.117 1.00 0.00 N ATOM 634 NH2 ARG A 37 -1.430 25.079 -5.790 1.00 0.00 N ATOM 0 H ARG A 37 -2.791 25.696 -0.388 1.00 0.00 H new ATOM 0 HA ARG A 37 -4.367 23.339 -0.607 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -3.753 23.391 -2.924 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -3.822 25.067 -2.415 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -1.734 25.150 -3.398 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -1.212 24.569 -1.829 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -0.236 22.928 -3.187 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -1.783 22.163 -2.883 1.00 0.00 H new ATOM 0 HE ARG A 37 -2.335 22.458 -5.195 1.00 0.00 H new ATOM 0 HH11 ARG A 37 0.507 22.534 -5.929 1.00 0.00 H new ATOM 0 HH12 ARG A 37 0.696 24.100 -6.725 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -2.307 25.362 -5.352 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -0.927 25.731 -6.392 1.00 0.00 H new ATOM 648 N ARG A 38 -1.250 22.937 -0.011 1.00 0.00 N ATOM 649 CA ARG A 38 -0.229 21.930 0.284 1.00 0.00 C ATOM 650 C ARG A 38 -0.512 21.327 1.643 1.00 0.00 C ATOM 651 O ARG A 38 -0.272 20.156 1.870 1.00 0.00 O ATOM 652 CB ARG A 38 1.155 22.614 0.297 1.00 0.00 C ATOM 653 CG ARG A 38 2.237 21.595 0.690 1.00 0.00 C ATOM 654 CD ARG A 38 2.540 20.684 -0.503 1.00 0.00 C ATOM 655 NE ARG A 38 4.015 20.656 -0.723 1.00 0.00 N ATOM 656 CZ ARG A 38 4.524 21.306 -1.733 1.00 0.00 C ATOM 657 NH1 ARG A 38 4.237 22.569 -1.880 1.00 0.00 N ATOM 658 NH2 ARG A 38 5.305 20.668 -2.562 1.00 0.00 N ATOM 0 H ARG A 38 -1.006 23.895 0.239 1.00 0.00 H new ATOM 0 HA ARG A 38 -0.242 21.145 -0.472 1.00 0.00 H new ATOM 0 HB2 ARG A 38 1.374 23.030 -0.686 1.00 0.00 H new ATOM 0 HB3 ARG A 38 1.153 23.446 1.002 1.00 0.00 H new ATOM 0 HG2 ARG A 38 3.143 22.114 1.004 1.00 0.00 H new ATOM 0 HG3 ARG A 38 1.900 21.000 1.539 1.00 0.00 H new ATOM 0 HD2 ARG A 38 2.167 19.677 -0.314 1.00 0.00 H new ATOM 0 HD3 ARG A 38 2.032 21.049 -1.396 1.00 0.00 H new ATOM 0 HE ARG A 38 4.620 20.133 -0.090 1.00 0.00 H new ATOM 0 HH11 ARG A 38 3.623 23.034 -1.211 1.00 0.00 H new ATOM 0 HH12 ARG A 38 4.626 23.093 -2.664 1.00 0.00 H new ATOM 0 HH21 ARG A 38 5.507 19.679 -2.414 1.00 0.00 H new ATOM 0 HH22 ARG A 38 5.713 21.158 -3.358 1.00 0.00 H new ATOM 672 N ARG A 39 -1.027 22.139 2.539 1.00 0.00 N ATOM 673 CA ARG A 39 -1.329 21.611 3.876 1.00 0.00 C ATOM 674 C ARG A 39 -2.470 20.639 3.725 1.00 0.00 C ATOM 675 O ARG A 39 -2.516 19.614 4.373 1.00 0.00 O ATOM 676 CB ARG A 39 -1.727 22.783 4.818 1.00 0.00 C ATOM 677 CG ARG A 39 -3.245 22.806 5.031 1.00 0.00 C ATOM 678 CD ARG A 39 -3.619 24.064 5.817 1.00 0.00 C ATOM 679 NE ARG A 39 -3.472 23.788 7.275 1.00 0.00 N ATOM 680 CZ ARG A 39 -4.153 24.497 8.135 1.00 0.00 C ATOM 681 NH1 ARG A 39 -5.348 24.909 7.808 1.00 0.00 N ATOM 682 NH2 ARG A 39 -3.616 24.773 9.292 1.00 0.00 N ATOM 0 H ARG A 39 -1.242 23.125 2.391 1.00 0.00 H new ATOM 0 HA ARG A 39 -0.464 21.110 4.310 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -1.220 22.675 5.777 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -1.399 23.730 4.389 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -3.760 22.795 4.070 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -3.563 21.915 5.573 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -2.977 24.895 5.525 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -4.644 24.358 5.591 1.00 0.00 H new ATOM 0 HE ARG A 39 -2.845 23.051 7.598 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -5.735 24.676 6.894 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -5.894 25.464 8.467 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -2.679 24.436 9.513 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -4.133 25.325 9.976 1.00 0.00 H new ATOM 696 N ILE A 40 -3.381 20.987 2.848 1.00 0.00 N ATOM 697 CA ILE A 40 -4.530 20.111 2.617 1.00 0.00 C ATOM 698 C ILE A 40 -3.996 18.773 2.162 1.00 0.00 C ATOM 699 O ILE A 40 -4.062 17.811 2.875 1.00 0.00 O ATOM 700 CB ILE A 40 -5.386 20.721 1.511 1.00 0.00 C ATOM 701 CG1 ILE A 40 -6.023 22.021 2.004 1.00 0.00 C ATOM 702 CG2 ILE A 40 -6.501 19.739 1.155 1.00 0.00 C ATOM 703 CD1 ILE A 40 -6.458 22.872 0.806 1.00 0.00 C ATOM 0 H ILE A 40 -3.363 21.842 2.292 1.00 0.00 H new ATOM 0 HA ILE A 40 -5.130 19.994 3.519 1.00 0.00 H new ATOM 0 HB ILE A 40 -4.761 20.926 0.642 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -6.883 21.799 2.635 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.312 22.575 2.617 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -7.121 20.163 0.365 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -6.064 18.802 0.810 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -7.115 19.550 2.036 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -6.911 23.797 1.162 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -5.589 23.107 0.192 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -7.184 22.318 0.211 1.00 0.00 H new ATOM 715 N SER A 41 -3.469 18.736 0.962 1.00 0.00 N ATOM 716 CA SER A 41 -2.924 17.463 0.463 1.00 0.00 C ATOM 717 C SER A 41 -2.089 16.772 1.554 1.00 0.00 C ATOM 718 O SER A 41 -2.177 15.582 1.743 1.00 0.00 O ATOM 719 CB SER A 41 -2.004 17.778 -0.734 1.00 0.00 C ATOM 720 OG SER A 41 -0.683 17.706 -0.208 1.00 0.00 O ATOM 0 H SER A 41 -3.399 19.528 0.323 1.00 0.00 H new ATOM 0 HA SER A 41 -3.742 16.804 0.173 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.147 17.061 -1.542 1.00 0.00 H new ATOM 0 HB3 SER A 41 -2.213 18.766 -1.144 1.00 0.00 H new ATOM 0 HG SER A 41 -0.097 17.260 -0.855 1.00 0.00 H new ATOM 726 N ALA A 42 -1.286 17.551 2.246 1.00 0.00 N ATOM 727 CA ALA A 42 -0.441 16.962 3.321 1.00 0.00 C ATOM 728 C ALA A 42 -1.323 16.421 4.420 1.00 0.00 C ATOM 729 O ALA A 42 -0.925 15.572 5.194 1.00 0.00 O ATOM 730 CB ALA A 42 0.458 18.066 3.905 1.00 0.00 C ATOM 0 H ALA A 42 -1.184 18.557 2.110 1.00 0.00 H new ATOM 0 HA ALA A 42 0.166 16.156 2.909 1.00 0.00 H new ATOM 0 HB1 ALA A 42 1.082 17.647 4.694 1.00 0.00 H new ATOM 0 HB2 ALA A 42 1.092 18.473 3.118 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -0.163 18.861 4.317 1.00 0.00 H new ATOM 736 N THR A 43 -2.509 16.930 4.465 1.00 0.00 N ATOM 737 CA THR A 43 -3.462 16.480 5.494 1.00 0.00 C ATOM 738 C THR A 43 -4.259 15.350 4.912 1.00 0.00 C ATOM 739 O THR A 43 -4.469 14.330 5.538 1.00 0.00 O ATOM 740 CB THR A 43 -4.402 17.641 5.857 1.00 0.00 C ATOM 741 OG1 THR A 43 -3.924 18.134 7.090 1.00 0.00 O ATOM 742 CG2 THR A 43 -5.813 17.130 6.171 1.00 0.00 C ATOM 0 H THR A 43 -2.862 17.644 3.828 1.00 0.00 H new ATOM 0 HA THR A 43 -2.938 16.155 6.393 1.00 0.00 H new ATOM 0 HB THR A 43 -4.431 18.360 5.038 1.00 0.00 H new ATOM 0 HG1 THR A 43 -4.483 18.885 7.381 1.00 0.00 H new ATOM 0 HG21 THR A 43 -6.457 17.972 6.424 1.00 0.00 H new ATOM 0 HG22 THR A 43 -6.216 16.615 5.299 1.00 0.00 H new ATOM 0 HG23 THR A 43 -5.771 16.439 7.013 1.00 0.00 H new ATOM 750 N THR A 44 -4.693 15.561 3.702 1.00 0.00 N ATOM 751 CA THR A 44 -5.478 14.532 3.021 1.00 0.00 C ATOM 752 C THR A 44 -4.557 13.347 2.744 1.00 0.00 C ATOM 753 O THR A 44 -4.986 12.215 2.647 1.00 0.00 O ATOM 754 CB THR A 44 -5.967 15.121 1.700 1.00 0.00 C ATOM 755 OG1 THR A 44 -4.853 15.102 0.872 1.00 0.00 O ATOM 756 CG2 THR A 44 -6.321 16.617 1.842 1.00 0.00 C ATOM 0 H THR A 44 -4.530 16.412 3.164 1.00 0.00 H new ATOM 0 HA THR A 44 -6.327 14.208 3.623 1.00 0.00 H new ATOM 0 HB THR A 44 -6.837 14.566 1.349 1.00 0.00 H new ATOM 0 HG1 THR A 44 -4.074 15.435 1.364 1.00 0.00 H new ATOM 0 HG21 THR A 44 -6.665 17.002 0.882 1.00 0.00 H new ATOM 0 HG22 THR A 44 -7.110 16.735 2.584 1.00 0.00 H new ATOM 0 HG23 THR A 44 -5.438 17.171 2.160 1.00 0.00 H new ATOM 764 N ASN A 45 -3.289 13.665 2.622 1.00 0.00 N ATOM 765 CA ASN A 45 -2.254 12.630 2.355 1.00 0.00 C ATOM 766 C ASN A 45 -2.343 11.997 0.960 1.00 0.00 C ATOM 767 O ASN A 45 -2.606 10.816 0.837 1.00 0.00 O ATOM 768 CB ASN A 45 -2.402 11.527 3.414 1.00 0.00 C ATOM 769 CG ASN A 45 -1.058 10.817 3.588 1.00 0.00 C ATOM 770 OD1 ASN A 45 -0.329 10.572 2.534 1.00 0.00 O flip ATOM 771 ND2 ASN A 45 -0.659 10.477 4.686 1.00 0.00 N flip ATOM 0 H ASN A 45 -2.928 14.616 2.699 1.00 0.00 H new ATOM 0 HA ASN A 45 -1.284 13.126 2.401 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -2.726 11.957 4.362 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -3.168 10.813 3.109 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -1.223 10.665 5.515 1.00 0.00 H new ATOM 0 HD22 ASN A 45 0.240 10.004 4.778 1.00 0.00 H new ATOM 778 N LEU A 46 -2.122 12.788 -0.076 1.00 0.00 N ATOM 779 CA LEU A 46 -2.194 12.194 -1.465 1.00 0.00 C ATOM 780 C LEU A 46 -1.117 12.776 -2.374 1.00 0.00 C ATOM 781 O LEU A 46 -0.080 12.169 -2.559 1.00 0.00 O ATOM 782 CB LEU A 46 -3.585 12.430 -2.112 1.00 0.00 C ATOM 783 CG LEU A 46 -4.388 13.463 -1.319 1.00 0.00 C ATOM 784 CD1 LEU A 46 -3.919 14.869 -1.718 1.00 0.00 C ATOM 785 CD2 LEU A 46 -5.880 13.314 -1.649 1.00 0.00 C ATOM 0 H LEU A 46 -1.903 13.783 -0.027 1.00 0.00 H new ATOM 0 HA LEU A 46 -2.029 11.122 -1.356 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -3.459 12.772 -3.139 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -4.135 11.490 -2.154 1.00 0.00 H new ATOM 0 HG LEU A 46 -4.236 13.308 -0.251 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.485 15.614 -1.159 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -2.858 14.976 -1.494 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -4.081 15.017 -2.786 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -6.453 14.050 -1.084 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.034 13.475 -2.716 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.213 12.311 -1.381 1.00 0.00 H new ATOM 797 N SER A 47 -1.374 13.932 -2.928 1.00 0.00 N ATOM 798 CA SER A 47 -0.373 14.550 -3.819 1.00 0.00 C ATOM 799 C SER A 47 -0.298 16.041 -3.593 1.00 0.00 C ATOM 800 O SER A 47 -0.092 16.496 -2.490 1.00 0.00 O ATOM 801 CB SER A 47 -0.808 14.302 -5.265 1.00 0.00 C ATOM 802 OG SER A 47 -1.102 12.914 -5.308 1.00 0.00 O ATOM 0 H SER A 47 -2.233 14.466 -2.797 1.00 0.00 H new ATOM 0 HA SER A 47 0.605 14.114 -3.614 1.00 0.00 H new ATOM 0 HB2 SER A 47 -1.680 14.902 -5.527 1.00 0.00 H new ATOM 0 HB3 SER A 47 -0.018 14.564 -5.969 1.00 0.00 H new ATOM 0 HG SER A 47 -0.926 12.570 -6.209 1.00 0.00 H new ATOM 808 N GLU A 48 -0.491 16.763 -4.647 1.00 0.00 N ATOM 809 CA GLU A 48 -0.445 18.226 -4.580 1.00 0.00 C ATOM 810 C GLU A 48 -1.190 18.753 -5.780 1.00 0.00 C ATOM 811 O GLU A 48 -2.196 19.423 -5.655 1.00 0.00 O ATOM 812 CB GLU A 48 1.019 18.665 -4.653 1.00 0.00 C ATOM 813 CG GLU A 48 1.741 18.245 -3.365 1.00 0.00 C ATOM 814 CD GLU A 48 3.069 18.995 -3.258 1.00 0.00 C ATOM 815 OE1 GLU A 48 3.033 20.194 -3.473 1.00 0.00 O ATOM 816 OE2 GLU A 48 4.047 18.324 -2.964 1.00 0.00 O ATOM 0 H GLU A 48 -0.684 16.385 -5.575 1.00 0.00 H new ATOM 0 HA GLU A 48 -0.892 18.601 -3.659 1.00 0.00 H new ATOM 0 HB2 GLU A 48 1.503 18.213 -5.519 1.00 0.00 H new ATOM 0 HB3 GLU A 48 1.080 19.746 -4.782 1.00 0.00 H new ATOM 0 HG2 GLU A 48 1.117 18.463 -2.498 1.00 0.00 H new ATOM 0 HG3 GLU A 48 1.918 17.169 -3.369 1.00 0.00 H new ATOM 823 N ARG A 49 -0.676 18.432 -6.935 1.00 0.00 N ATOM 824 CA ARG A 49 -1.326 18.885 -8.163 1.00 0.00 C ATOM 825 C ARG A 49 -2.729 18.333 -8.176 1.00 0.00 C ATOM 826 O ARG A 49 -3.634 18.916 -8.739 1.00 0.00 O ATOM 827 CB ARG A 49 -0.552 18.324 -9.368 1.00 0.00 C ATOM 828 CG ARG A 49 -1.078 18.971 -10.650 1.00 0.00 C ATOM 829 CD ARG A 49 -0.081 20.032 -11.124 1.00 0.00 C ATOM 830 NE ARG A 49 1.183 19.359 -11.538 1.00 0.00 N ATOM 831 CZ ARG A 49 1.444 19.209 -12.810 1.00 0.00 C ATOM 832 NH1 ARG A 49 0.723 18.375 -13.509 1.00 0.00 N ATOM 833 NH2 ARG A 49 2.417 19.900 -13.340 1.00 0.00 N ATOM 0 H ARG A 49 0.168 17.874 -7.066 1.00 0.00 H new ATOM 0 HA ARG A 49 -1.344 19.974 -8.213 1.00 0.00 H new ATOM 0 HB2 ARG A 49 0.514 18.525 -9.256 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -0.669 17.241 -9.418 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -1.217 18.215 -11.423 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -2.052 19.425 -10.469 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -0.499 20.595 -11.959 1.00 0.00 H new ATOM 0 HD3 ARG A 49 0.117 20.746 -10.325 1.00 0.00 H new ATOM 0 HE ARG A 49 1.839 19.018 -10.835 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -0.030 17.853 -13.061 1.00 0.00 H new ATOM 0 HH12 ARG A 49 0.913 18.246 -14.503 1.00 0.00 H new ATOM 0 HH21 ARG A 49 2.959 20.543 -12.763 1.00 0.00 H new ATOM 0 HH22 ARG A 49 2.635 19.796 -14.331 1.00 0.00 H new ATOM 847 N GLN A 50 -2.885 17.191 -7.542 1.00 0.00 N ATOM 848 CA GLN A 50 -4.211 16.570 -7.493 1.00 0.00 C ATOM 849 C GLN A 50 -5.136 17.429 -6.666 1.00 0.00 C ATOM 850 O GLN A 50 -6.293 17.552 -6.974 1.00 0.00 O ATOM 851 CB GLN A 50 -4.090 15.196 -6.836 1.00 0.00 C ATOM 852 CG GLN A 50 -3.038 14.375 -7.580 1.00 0.00 C ATOM 853 CD GLN A 50 -3.530 14.091 -9.002 1.00 0.00 C ATOM 854 OE1 GLN A 50 -3.255 14.831 -9.926 1.00 0.00 O ATOM 855 NE2 GLN A 50 -4.262 13.031 -9.221 1.00 0.00 N ATOM 0 H GLN A 50 -2.143 16.679 -7.064 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.608 16.470 -8.503 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -3.810 15.304 -5.788 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -5.052 14.683 -6.858 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -2.093 14.917 -7.611 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -2.852 13.439 -7.054 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -4.497 12.405 -8.450 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -4.599 12.829 -10.163 1.00 0.00 H new ATOM 864 N VAL A 51 -4.605 18.016 -5.613 1.00 0.00 N ATOM 865 CA VAL A 51 -5.465 18.872 -4.774 1.00 0.00 C ATOM 866 C VAL A 51 -5.921 19.991 -5.623 1.00 0.00 C ATOM 867 O VAL A 51 -7.097 20.249 -5.766 1.00 0.00 O ATOM 868 CB VAL A 51 -4.659 19.418 -3.618 1.00 0.00 C ATOM 869 CG1 VAL A 51 -5.590 20.164 -2.666 1.00 0.00 C ATOM 870 CG2 VAL A 51 -4.015 18.250 -2.878 1.00 0.00 C ATOM 0 H VAL A 51 -3.633 17.933 -5.315 1.00 0.00 H new ATOM 0 HA VAL A 51 -6.310 18.308 -4.378 1.00 0.00 H new ATOM 0 HB VAL A 51 -3.890 20.098 -3.985 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -5.014 20.560 -1.830 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.071 20.986 -3.197 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -6.351 19.480 -2.291 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -3.429 18.629 -2.040 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -4.792 17.582 -2.505 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -3.363 17.703 -3.559 1.00 0.00 H new ATOM 880 N THR A 52 -4.961 20.641 -6.176 1.00 0.00 N ATOM 881 CA THR A 52 -5.247 21.765 -7.050 1.00 0.00 C ATOM 882 C THR A 52 -6.385 21.371 -7.963 1.00 0.00 C ATOM 883 O THR A 52 -7.291 22.136 -8.226 1.00 0.00 O ATOM 884 CB THR A 52 -4.007 21.980 -7.896 1.00 0.00 C ATOM 885 OG1 THR A 52 -3.015 21.172 -7.301 1.00 0.00 O ATOM 886 CG2 THR A 52 -3.464 23.397 -7.755 1.00 0.00 C ATOM 0 H THR A 52 -3.971 20.431 -6.052 1.00 0.00 H new ATOM 0 HA THR A 52 -5.510 22.661 -6.488 1.00 0.00 H new ATOM 0 HB THR A 52 -4.242 21.770 -8.939 1.00 0.00 H new ATOM 0 HG1 THR A 52 -2.179 21.678 -7.231 1.00 0.00 H new ATOM 0 HG21 THR A 52 -2.576 23.510 -8.377 1.00 0.00 H new ATOM 0 HG22 THR A 52 -4.223 24.111 -8.074 1.00 0.00 H new ATOM 0 HG23 THR A 52 -3.204 23.585 -6.713 1.00 0.00 H new ATOM 894 N ILE A 53 -6.298 20.150 -8.423 1.00 0.00 N ATOM 895 CA ILE A 53 -7.327 19.616 -9.320 1.00 0.00 C ATOM 896 C ILE A 53 -8.544 19.231 -8.499 1.00 0.00 C ATOM 897 O ILE A 53 -9.668 19.330 -8.950 1.00 0.00 O ATOM 898 CB ILE A 53 -6.734 18.378 -10.012 1.00 0.00 C ATOM 899 CG1 ILE A 53 -6.362 18.733 -11.436 1.00 0.00 C ATOM 900 CG2 ILE A 53 -7.776 17.245 -10.042 1.00 0.00 C ATOM 901 CD1 ILE A 53 -7.629 18.749 -12.295 1.00 0.00 C ATOM 0 H ILE A 53 -5.541 19.502 -8.203 1.00 0.00 H new ATOM 0 HA ILE A 53 -7.630 20.352 -10.065 1.00 0.00 H new ATOM 0 HB ILE A 53 -5.852 18.050 -9.462 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -5.875 19.708 -11.466 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -5.649 18.009 -11.830 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -7.349 16.371 -10.534 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -8.060 16.985 -9.022 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -8.657 17.576 -10.591 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -7.369 19.004 -13.322 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -8.096 17.764 -12.273 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -8.325 19.490 -11.902 1.00 0.00 H new ATOM 913 N TRP A 54 -8.287 18.795 -7.297 1.00 0.00 N ATOM 914 CA TRP A 54 -9.384 18.400 -6.417 1.00 0.00 C ATOM 915 C TRP A 54 -10.279 19.574 -6.297 1.00 0.00 C ATOM 916 O TRP A 54 -11.483 19.452 -6.234 1.00 0.00 O ATOM 917 CB TRP A 54 -8.770 18.065 -5.052 1.00 0.00 C ATOM 918 CG TRP A 54 -9.662 17.149 -4.243 1.00 0.00 C ATOM 919 CD1 TRP A 54 -10.906 16.844 -4.550 1.00 0.00 C ATOM 920 CD2 TRP A 54 -9.238 16.455 -3.215 1.00 0.00 C ATOM 921 NE1 TRP A 54 -11.229 15.893 -3.652 1.00 0.00 N ATOM 922 CE2 TRP A 54 -10.213 15.585 -2.766 1.00 0.00 C ATOM 923 CE3 TRP A 54 -7.995 16.491 -2.578 1.00 0.00 C ATOM 924 CZ2 TRP A 54 -9.948 14.746 -1.706 1.00 0.00 C ATOM 925 CZ3 TRP A 54 -7.745 15.650 -1.523 1.00 0.00 C ATOM 926 CH2 TRP A 54 -8.715 14.779 -1.089 1.00 0.00 C ATOM 0 H TRP A 54 -7.353 18.700 -6.898 1.00 0.00 H new ATOM 0 HA TRP A 54 -9.940 17.541 -6.792 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -7.799 17.592 -5.197 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -8.596 18.986 -4.496 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -11.521 17.258 -5.335 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -12.143 15.440 -3.628 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -7.233 17.179 -2.915 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -10.707 14.061 -1.358 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -6.783 15.673 -1.032 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -8.511 14.117 -0.261 1.00 0.00 H new ATOM 937 N PHE A 55 -9.666 20.726 -6.276 1.00 0.00 N ATOM 938 CA PHE A 55 -10.469 21.939 -6.166 1.00 0.00 C ATOM 939 C PHE A 55 -11.199 22.204 -7.475 1.00 0.00 C ATOM 940 O PHE A 55 -12.367 22.535 -7.477 1.00 0.00 O ATOM 941 CB PHE A 55 -9.544 23.099 -5.838 1.00 0.00 C ATOM 942 CG PHE A 55 -9.391 23.140 -4.334 1.00 0.00 C ATOM 943 CD1 PHE A 55 -10.357 23.741 -3.554 1.00 0.00 C ATOM 944 CD2 PHE A 55 -8.331 22.507 -3.722 1.00 0.00 C ATOM 945 CE1 PHE A 55 -10.266 23.701 -2.187 1.00 0.00 C ATOM 946 CE2 PHE A 55 -8.243 22.467 -2.354 1.00 0.00 C ATOM 947 CZ PHE A 55 -9.213 23.067 -1.585 1.00 0.00 C ATOM 0 H PHE A 55 -8.657 20.863 -6.330 1.00 0.00 H new ATOM 0 HA PHE A 55 -11.213 21.823 -5.378 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.575 22.966 -6.319 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -9.958 24.037 -6.208 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -11.189 24.245 -4.023 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -7.565 22.040 -4.323 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -11.028 24.171 -1.583 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -7.412 21.965 -1.881 1.00 0.00 H new ATOM 0 HZ PHE A 55 -9.144 23.038 -0.508 1.00 0.00 H new ATOM 957 N GLN A 56 -10.500 22.052 -8.570 1.00 0.00 N ATOM 958 CA GLN A 56 -11.151 22.289 -9.876 1.00 0.00 C ATOM 959 C GLN A 56 -12.226 21.242 -10.109 1.00 0.00 C ATOM 960 O GLN A 56 -13.160 21.455 -10.857 1.00 0.00 O ATOM 961 CB GLN A 56 -10.103 22.157 -10.974 1.00 0.00 C ATOM 962 CG GLN A 56 -9.103 23.308 -10.863 1.00 0.00 C ATOM 963 CD GLN A 56 -8.240 23.352 -12.127 1.00 0.00 C ATOM 964 OE1 GLN A 56 -7.027 23.335 -12.063 1.00 0.00 O ATOM 965 NE2 GLN A 56 -8.825 23.410 -13.292 1.00 0.00 N ATOM 0 H GLN A 56 -9.519 21.777 -8.609 1.00 0.00 H new ATOM 0 HA GLN A 56 -11.597 23.283 -9.886 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -9.586 21.202 -10.885 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -10.582 22.170 -11.953 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -9.631 24.253 -10.736 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -8.473 23.174 -9.983 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -9.843 23.424 -13.351 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -8.264 23.441 -14.143 1.00 0.00 H new ATOM 974 N ASN A 57 -12.073 20.118 -9.455 1.00 0.00 N ATOM 975 CA ASN A 57 -13.064 19.046 -9.616 1.00 0.00 C ATOM 976 C ASN A 57 -14.226 19.375 -8.742 1.00 0.00 C ATOM 977 O ASN A 57 -15.364 19.101 -9.059 1.00 0.00 O ATOM 978 CB ASN A 57 -12.443 17.714 -9.161 1.00 0.00 C ATOM 979 CG ASN A 57 -12.005 16.914 -10.390 1.00 0.00 C ATOM 980 OD1 ASN A 57 -10.958 17.149 -10.957 1.00 0.00 O ATOM 981 ND2 ASN A 57 -12.779 15.962 -10.834 1.00 0.00 N ATOM 0 H ASN A 57 -11.302 19.910 -8.821 1.00 0.00 H new ATOM 0 HA ASN A 57 -13.378 18.957 -10.656 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -11.588 17.901 -8.511 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -13.166 17.142 -8.579 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -12.503 15.420 -11.653 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -13.660 15.759 -10.362 1.00 0.00 H new ATOM 988 N ARG A 58 -13.910 19.965 -7.638 1.00 0.00 N ATOM 989 CA ARG A 58 -14.954 20.342 -6.706 1.00 0.00 C ATOM 990 C ARG A 58 -15.766 21.455 -7.339 1.00 0.00 C ATOM 991 O ARG A 58 -16.906 21.695 -6.980 1.00 0.00 O ATOM 992 CB ARG A 58 -14.282 20.853 -5.430 1.00 0.00 C ATOM 993 CG ARG A 58 -14.583 19.888 -4.280 1.00 0.00 C ATOM 994 CD ARG A 58 -15.998 20.147 -3.758 1.00 0.00 C ATOM 995 NE ARG A 58 -16.324 19.124 -2.721 1.00 0.00 N ATOM 996 CZ ARG A 58 -17.277 18.259 -2.948 1.00 0.00 C ATOM 997 NH1 ARG A 58 -18.492 18.694 -3.140 1.00 0.00 N ATOM 998 NH2 ARG A 58 -16.981 16.988 -2.974 1.00 0.00 N ATOM 0 H ARG A 58 -12.960 20.199 -7.350 1.00 0.00 H new ATOM 0 HA ARG A 58 -15.604 19.500 -6.470 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -13.205 20.935 -5.580 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -14.647 21.851 -5.188 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -14.493 18.857 -4.622 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -13.857 20.022 -3.478 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -16.066 21.149 -3.334 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -16.717 20.097 -4.576 1.00 0.00 H new ATOM 0 HE ARG A 58 -15.807 19.100 -1.842 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -18.686 19.695 -3.112 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -19.248 18.033 -3.319 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -16.020 16.685 -2.819 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -17.711 16.298 -3.150 1.00 0.00 H new ATOM 1012 N ARG A 59 -15.157 22.103 -8.311 1.00 0.00 N ATOM 1013 CA ARG A 59 -15.859 23.202 -8.998 1.00 0.00 C ATOM 1014 C ARG A 59 -16.671 22.593 -10.096 1.00 0.00 C ATOM 1015 O ARG A 59 -17.694 23.107 -10.503 1.00 0.00 O ATOM 1016 CB ARG A 59 -14.816 24.159 -9.602 1.00 0.00 C ATOM 1017 CG ARG A 59 -15.533 25.374 -10.197 1.00 0.00 C ATOM 1018 CD ARG A 59 -14.557 26.147 -11.086 1.00 0.00 C ATOM 1019 NE ARG A 59 -15.221 27.392 -11.567 1.00 0.00 N ATOM 1020 CZ ARG A 59 -16.131 27.312 -12.499 1.00 0.00 C ATOM 1021 NH1 ARG A 59 -16.534 26.134 -12.887 1.00 0.00 N ATOM 1022 NH2 ARG A 59 -16.607 28.415 -13.012 1.00 0.00 N ATOM 0 H ARG A 59 -14.213 21.909 -8.644 1.00 0.00 H new ATOM 0 HA ARG A 59 -16.496 23.756 -8.309 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -14.110 24.478 -8.835 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -14.240 23.648 -10.373 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -16.397 25.053 -10.778 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -15.906 26.018 -9.400 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -13.654 26.393 -10.528 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -14.251 25.532 -11.933 1.00 0.00 H new ATOM 0 HE ARG A 59 -14.967 28.297 -11.172 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -16.139 25.295 -12.463 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -17.245 26.052 -13.614 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -16.267 29.319 -12.683 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -17.319 28.373 -13.741 1.00 0.00 H new ATOM 1036 N VAL A 60 -16.180 21.485 -10.553 1.00 0.00 N ATOM 1037 CA VAL A 60 -16.855 20.764 -11.622 1.00 0.00 C ATOM 1038 C VAL A 60 -17.954 19.911 -11.004 1.00 0.00 C ATOM 1039 O VAL A 60 -18.909 19.536 -11.656 1.00 0.00 O ATOM 1040 CB VAL A 60 -15.790 19.877 -12.309 1.00 0.00 C ATOM 1041 CG1 VAL A 60 -16.094 18.389 -12.085 1.00 0.00 C ATOM 1042 CG2 VAL A 60 -15.790 20.167 -13.812 1.00 0.00 C ATOM 0 H VAL A 60 -15.321 21.050 -10.216 1.00 0.00 H new ATOM 0 HA VAL A 60 -17.307 21.434 -12.353 1.00 0.00 H new ATOM 0 HB VAL A 60 -14.815 20.104 -11.878 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -15.332 17.784 -12.577 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -16.094 18.174 -11.016 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -17.072 18.151 -12.503 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -15.041 19.545 -14.303 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -16.774 19.945 -14.225 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -15.555 21.218 -13.980 1.00 0.00 H new ATOM 1052 N LYS A 61 -17.782 19.626 -9.734 1.00 0.00 N ATOM 1053 CA LYS A 61 -18.780 18.808 -9.017 1.00 0.00 C ATOM 1054 C LYS A 61 -19.973 19.671 -8.654 1.00 0.00 C ATOM 1055 O LYS A 61 -21.089 19.201 -8.582 1.00 0.00 O ATOM 1056 CB LYS A 61 -18.134 18.273 -7.730 1.00 0.00 C ATOM 1057 CG LYS A 61 -19.107 17.316 -7.036 1.00 0.00 C ATOM 1058 CD LYS A 61 -18.334 16.462 -6.027 1.00 0.00 C ATOM 1059 CE LYS A 61 -19.321 15.603 -5.236 1.00 0.00 C ATOM 1060 NZ LYS A 61 -20.183 14.815 -6.159 1.00 0.00 N ATOM 0 H LYS A 61 -16.987 19.931 -9.172 1.00 0.00 H new ATOM 0 HA LYS A 61 -19.110 17.982 -9.647 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -17.203 17.757 -7.964 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -17.882 19.099 -7.065 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -19.891 17.879 -6.530 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -19.597 16.678 -7.772 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -17.615 15.827 -6.545 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -17.766 17.101 -5.351 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -18.777 14.930 -4.574 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -19.941 16.239 -4.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -20.623 14.030 -5.638 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -20.925 15.430 -6.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -19.604 14.434 -6.934 1.00 0.00 H new ATOM 1074 N GLU A 62 -19.716 20.931 -8.415 1.00 0.00 N ATOM 1075 CA GLU A 62 -20.825 21.828 -8.060 1.00 0.00 C ATOM 1076 C GLU A 62 -21.773 21.903 -9.232 1.00 0.00 C ATOM 1077 O GLU A 62 -22.949 22.158 -9.083 1.00 0.00 O ATOM 1078 CB GLU A 62 -20.255 23.225 -7.796 1.00 0.00 C ATOM 1079 CG GLU A 62 -19.720 23.289 -6.364 1.00 0.00 C ATOM 1080 CD GLU A 62 -20.855 23.681 -5.416 1.00 0.00 C ATOM 1081 OE1 GLU A 62 -21.135 24.867 -5.365 1.00 0.00 O ATOM 1082 OE2 GLU A 62 -21.378 22.770 -4.793 1.00 0.00 O ATOM 0 H GLU A 62 -18.793 21.363 -8.453 1.00 0.00 H new ATOM 0 HA GLU A 62 -21.346 21.461 -7.176 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -19.457 23.445 -8.505 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -21.028 23.980 -7.942 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -19.307 22.323 -6.075 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -18.909 24.015 -6.299 1.00 0.00 H new ATOM 1089 N LYS A 63 -21.220 21.679 -10.391 1.00 0.00 N ATOM 1090 CA LYS A 63 -22.034 21.719 -11.617 1.00 0.00 C ATOM 1091 C LYS A 63 -22.645 20.363 -11.894 1.00 0.00 C ATOM 1092 O LYS A 63 -23.626 20.255 -12.602 1.00 0.00 O ATOM 1093 CB LYS A 63 -21.122 22.104 -12.785 1.00 0.00 C ATOM 1094 CG LYS A 63 -20.474 23.453 -12.480 1.00 0.00 C ATOM 1095 CD LYS A 63 -21.067 24.517 -13.405 1.00 0.00 C ATOM 1096 CE LYS A 63 -22.549 24.707 -13.069 1.00 0.00 C ATOM 1097 NZ LYS A 63 -23.092 25.905 -13.767 1.00 0.00 N ATOM 0 H LYS A 63 -20.232 21.469 -10.533 1.00 0.00 H new ATOM 0 HA LYS A 63 -22.838 22.445 -11.495 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -20.356 21.342 -12.933 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -21.697 22.162 -13.709 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -20.644 23.724 -11.438 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -19.395 23.392 -12.621 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -20.531 25.459 -13.286 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -20.954 24.215 -14.446 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -23.111 23.821 -13.364 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -22.672 24.819 -11.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -24.098 26.020 -13.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -22.566 26.750 -13.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -22.992 25.783 -14.795 1.00 0.00 H new ATOM 1111 N LYS A 64 -22.056 19.343 -11.333 1.00 0.00 N ATOM 1112 CA LYS A 64 -22.605 17.999 -11.564 1.00 0.00 C ATOM 1113 C LYS A 64 -23.974 17.936 -10.939 1.00 0.00 C ATOM 1114 O LYS A 64 -24.675 16.949 -11.040 1.00 0.00 O ATOM 1115 CB LYS A 64 -21.690 16.956 -10.899 1.00 0.00 C ATOM 1116 CG LYS A 64 -20.630 16.504 -11.904 1.00 0.00 C ATOM 1117 CD LYS A 64 -21.162 15.304 -12.689 1.00 0.00 C ATOM 1118 CE LYS A 64 -20.122 14.880 -13.727 1.00 0.00 C ATOM 1119 NZ LYS A 64 -20.037 15.886 -14.822 1.00 0.00 N ATOM 0 H LYS A 64 -21.231 19.390 -10.735 1.00 0.00 H new ATOM 0 HA LYS A 64 -22.668 17.792 -12.632 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -21.213 17.383 -10.017 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -22.277 16.102 -10.562 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -20.385 17.320 -12.584 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -19.710 16.235 -11.385 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -21.375 14.477 -12.012 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -22.100 15.563 -13.181 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -19.148 14.770 -13.250 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -20.387 13.907 -14.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -19.529 15.476 -15.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -20.996 16.160 -15.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -19.526 16.726 -14.483 1.00 0.00 H new ATOM 1133 N VAL A 65 -24.329 19.018 -10.294 1.00 0.00 N ATOM 1134 CA VAL A 65 -25.647 19.080 -9.641 1.00 0.00 C ATOM 1135 C VAL A 65 -26.727 18.738 -10.642 1.00 0.00 C ATOM 1136 O VAL A 65 -27.828 18.375 -10.283 1.00 0.00 O ATOM 1137 CB VAL A 65 -25.862 20.514 -9.142 1.00 0.00 C ATOM 1138 CG1 VAL A 65 -26.389 21.379 -10.292 1.00 0.00 C ATOM 1139 CG2 VAL A 65 -26.881 20.502 -8.013 1.00 0.00 C ATOM 0 H VAL A 65 -23.755 19.855 -10.198 1.00 0.00 H new ATOM 0 HA VAL A 65 -25.690 18.372 -8.813 1.00 0.00 H new ATOM 0 HB VAL A 65 -24.918 20.923 -8.782 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -26.543 22.399 -9.939 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -25.665 21.382 -11.107 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -27.335 20.972 -10.649 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -27.038 21.519 -7.654 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -27.824 20.096 -8.379 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -26.512 19.882 -7.196 1.00 0.00 H new ATOM 1149 N ILE A 66 -26.388 18.873 -11.890 1.00 0.00 N ATOM 1150 CA ILE A 66 -27.364 18.567 -12.949 1.00 0.00 C ATOM 1151 C ILE A 66 -27.961 17.183 -12.730 1.00 0.00 C ATOM 1152 O ILE A 66 -28.977 16.841 -13.304 1.00 0.00 O ATOM 1153 CB ILE A 66 -26.620 18.591 -14.284 1.00 0.00 C ATOM 1154 CG1 ILE A 66 -27.607 18.791 -15.424 1.00 0.00 C ATOM 1155 CG2 ILE A 66 -25.913 17.239 -14.478 1.00 0.00 C ATOM 1156 CD1 ILE A 66 -26.832 18.972 -16.731 1.00 0.00 C ATOM 0 H ILE A 66 -25.473 19.183 -12.216 1.00 0.00 H new ATOM 0 HA ILE A 66 -28.172 19.298 -12.938 1.00 0.00 H new ATOM 0 HB ILE A 66 -25.897 19.407 -14.282 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -28.275 17.933 -15.498 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -28.231 19.664 -15.233 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -25.377 17.241 -15.427 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -25.207 17.077 -13.663 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -26.653 16.439 -14.481 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -27.533 19.116 -17.553 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -26.183 19.844 -16.651 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -26.227 18.085 -16.921 1.00 0.00 H new ATOM 1168 N ASN A 67 -27.315 16.413 -11.892 1.00 0.00 N ATOM 1169 CA ASN A 67 -27.816 15.046 -11.608 1.00 0.00 C ATOM 1170 C ASN A 67 -28.633 15.030 -10.319 1.00 0.00 C ATOM 1171 O ASN A 67 -29.265 14.046 -9.991 1.00 0.00 O ATOM 1172 CB ASN A 67 -26.604 14.117 -11.436 1.00 0.00 C ATOM 1173 CG ASN A 67 -27.010 12.682 -11.779 1.00 0.00 C ATOM 1174 OD1 ASN A 67 -26.158 11.915 -12.405 1.00 0.00 O flip ATOM 1175 ND2 ASN A 67 -28.104 12.246 -11.480 1.00 0.00 N flip ATOM 0 H ASN A 67 -26.464 16.676 -11.396 1.00 0.00 H new ATOM 0 HA ASN A 67 -28.451 14.717 -12.430 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -25.789 14.441 -12.084 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -26.236 14.167 -10.411 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -28.774 12.840 -10.991 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -28.353 11.286 -11.718 1.00 0.00 H new ATOM 1182 N LYS A 68 -28.600 16.126 -9.611 1.00 0.00 N ATOM 1183 CA LYS A 68 -29.365 16.204 -8.341 1.00 0.00 C ATOM 1184 C LYS A 68 -30.842 16.459 -8.612 1.00 0.00 C ATOM 1185 O LYS A 68 -31.695 15.998 -7.879 1.00 0.00 O ATOM 1186 CB LYS A 68 -28.803 17.372 -7.514 1.00 0.00 C ATOM 1187 CG LYS A 68 -29.422 17.343 -6.116 1.00 0.00 C ATOM 1188 CD LYS A 68 -29.133 18.670 -5.413 1.00 0.00 C ATOM 1189 CE LYS A 68 -29.780 18.657 -4.026 1.00 0.00 C ATOM 1190 NZ LYS A 68 -31.260 18.526 -4.141 1.00 0.00 N ATOM 0 H LYS A 68 -28.077 16.966 -9.858 1.00 0.00 H new ATOM 0 HA LYS A 68 -29.269 15.259 -7.806 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -27.718 17.296 -7.446 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -29.026 18.320 -8.004 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -30.498 17.180 -6.184 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -29.010 16.515 -5.540 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -28.057 18.821 -5.324 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -29.524 19.500 -6.002 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -29.380 17.830 -3.440 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -29.531 19.575 -3.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -31.708 18.867 -3.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -31.597 19.092 -4.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -31.510 17.528 -4.291 1.00 0.00 H new ATOM 1204 N LEU A 69 -31.111 17.198 -9.663 1.00 0.00 N ATOM 1205 CA LEU A 69 -32.524 17.507 -10.017 1.00 0.00 C ATOM 1206 C LEU A 69 -32.802 17.139 -11.468 1.00 0.00 C ATOM 1207 O LEU A 69 -32.981 15.981 -11.788 1.00 0.00 O ATOM 1208 CB LEU A 69 -32.746 19.014 -9.835 1.00 0.00 C ATOM 1209 CG LEU A 69 -32.491 19.382 -8.372 1.00 0.00 C ATOM 1210 CD1 LEU A 69 -32.319 20.899 -8.255 1.00 0.00 C ATOM 1211 CD2 LEU A 69 -33.688 18.944 -7.525 1.00 0.00 C ATOM 0 H LEU A 69 -30.410 17.598 -10.287 1.00 0.00 H new ATOM 0 HA LEU A 69 -33.193 16.933 -9.375 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -32.076 19.575 -10.487 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -33.764 19.282 -10.119 1.00 0.00 H new ATOM 0 HG LEU A 69 -31.589 18.882 -8.020 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -32.137 21.165 -7.214 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -31.473 21.217 -8.864 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -33.224 21.396 -8.604 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -33.510 19.204 -6.482 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -34.587 19.449 -7.877 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -33.820 17.866 -7.612 1.00 0.00 H new ATOM 1223 N LYS A 70 -32.836 18.129 -12.321 1.00 0.00 N ATOM 1224 CA LYS A 70 -33.100 17.845 -13.754 1.00 0.00 C ATOM 1225 C LYS A 70 -32.286 16.639 -14.213 1.00 0.00 C ATOM 1226 O LYS A 70 -31.143 16.775 -14.607 1.00 0.00 O ATOM 1227 CB LYS A 70 -32.682 19.074 -14.577 1.00 0.00 C ATOM 1228 CG LYS A 70 -33.666 20.217 -14.311 1.00 0.00 C ATOM 1229 CD LYS A 70 -32.970 21.554 -14.582 1.00 0.00 C ATOM 1230 CE LYS A 70 -32.706 21.689 -16.084 1.00 0.00 C ATOM 1231 NZ LYS A 70 -32.325 23.089 -16.424 1.00 0.00 N ATOM 0 H LYS A 70 -32.693 19.111 -12.087 1.00 0.00 H new ATOM 0 HA LYS A 70 -34.159 17.629 -13.893 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -31.671 19.379 -14.309 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -32.670 18.828 -15.639 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -34.543 20.114 -14.950 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -34.017 20.178 -13.280 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -33.592 22.379 -14.235 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -32.032 21.608 -14.029 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -31.910 21.007 -16.382 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -33.597 21.403 -16.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -32.150 23.162 -17.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -33.097 23.733 -16.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -31.462 23.350 -15.905 1.00 0.00 H new ATOM 1245 N THR A 71 -32.896 15.478 -14.153 1.00 0.00 N ATOM 1246 CA THR A 71 -32.181 14.245 -14.578 1.00 0.00 C ATOM 1247 C THR A 71 -33.096 13.334 -15.391 1.00 0.00 C ATOM 1248 O THR A 71 -34.248 13.147 -15.050 1.00 0.00 O ATOM 1249 CB THR A 71 -31.740 13.497 -13.314 1.00 0.00 C ATOM 1250 OG1 THR A 71 -30.627 14.215 -12.822 1.00 0.00 O ATOM 1251 CG2 THR A 71 -31.181 12.111 -13.663 1.00 0.00 C ATOM 0 H THR A 71 -33.853 15.337 -13.829 1.00 0.00 H new ATOM 0 HA THR A 71 -31.328 14.520 -15.199 1.00 0.00 H new ATOM 0 HB THR A 71 -32.583 13.407 -12.628 1.00 0.00 H new ATOM 0 HG1 THR A 71 -30.383 13.874 -11.936 1.00 0.00 H new ATOM 0 HG21 THR A 71 -30.875 11.601 -12.749 1.00 0.00 H new ATOM 0 HG22 THR A 71 -31.950 11.525 -14.166 1.00 0.00 H new ATOM 0 HG23 THR A 71 -30.320 12.221 -14.322 1.00 0.00 H new ATOM 1259 N THR A 72 -32.557 12.783 -16.453 1.00 0.00 N ATOM 1260 CA THR A 72 -33.368 11.876 -17.315 1.00 0.00 C ATOM 1261 C THR A 72 -32.954 10.420 -17.116 1.00 0.00 C ATOM 1262 O THR A 72 -32.226 9.866 -17.914 1.00 0.00 O ATOM 1263 CB THR A 72 -33.120 12.257 -18.778 1.00 0.00 C ATOM 1264 OG1 THR A 72 -33.169 13.669 -18.809 1.00 0.00 O ATOM 1265 CG2 THR A 72 -34.291 11.811 -19.665 1.00 0.00 C ATOM 0 H THR A 72 -31.593 12.924 -16.756 1.00 0.00 H new ATOM 0 HA THR A 72 -34.420 11.980 -17.050 1.00 0.00 H new ATOM 0 HB THR A 72 -32.188 11.810 -19.123 1.00 0.00 H new ATOM 0 HG1 THR A 72 -33.015 13.982 -19.725 1.00 0.00 H new ATOM 0 HG21 THR A 72 -34.092 12.092 -20.699 1.00 0.00 H new ATOM 0 HG22 THR A 72 -34.406 10.729 -19.599 1.00 0.00 H new ATOM 0 HG23 THR A 72 -35.208 12.294 -19.327 1.00 0.00 H new ATOM 1273 N SER A 73 -33.429 9.826 -16.055 1.00 0.00 N ATOM 1274 CA SER A 73 -33.072 8.410 -15.792 1.00 0.00 C ATOM 1275 C SER A 73 -31.559 8.232 -15.734 1.00 0.00 C ATOM 1276 O SER A 73 -30.953 8.988 -14.995 1.00 0.00 O ATOM 1277 CB SER A 73 -33.628 7.550 -16.937 1.00 0.00 C ATOM 1278 OG SER A 73 -33.591 6.225 -16.426 1.00 0.00 O ATOM 1279 OXT SER A 73 -31.092 7.346 -16.432 1.00 0.00 O ATOM 0 H SER A 73 -34.044 10.259 -15.366 1.00 0.00 H new ATOM 0 HA SER A 73 -33.495 8.109 -14.833 1.00 0.00 H new ATOM 0 HB2 SER A 73 -34.643 7.847 -17.202 1.00 0.00 H new ATOM 0 HB3 SER A 73 -33.022 7.647 -17.838 1.00 0.00 H new ATOM 0 HG SER A 73 -32.659 5.953 -16.289 1.00 0.00 H new TER 1285 SER A 73