USER MOD reduce.3.24.130724 H: found=0, std=0, add=604, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 605 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 132 THR OG1 : rot 170:sc= 0.141 USER MOD Set 1.2: A 158 ASN : amide:sc= 0.146 X(o=0.29,f=0.015) USER MOD Set 2.1: A 113 HIS : no HD1:sc= -0.0109 X(o=-0.011,f=0) USER MOD Set 2.2: A 117 GLN : amide:sc= 0 X(o=-0.011,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -0.97 X(o=-0.97,f=-1.2) USER MOD Single : A 96 ASN : amide:sc= -0.397 K(o=-0.4,f=-1.8!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 SER OG : rot 180:sc= 0.00782 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 TYR OH : rot 30:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 GLN : amide:sc= -0.488 K(o=-0.49,f=-8.1!) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 169:sc= 0.724 (180deg=0.547) USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 119 SER OG : rot -138:sc= 0.72 USER MOD Single : A 125 GLN : amide:sc= -0.0391 K(o=-0.039,f=-1.1) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 GLN : amide:sc= 1.12 K(o=1.1,f=-0.83) USER MOD Single : A 147 TYR OH : rot 30:sc= -0.864 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 SER OG : rot -155:sc= 0.684 USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 MET CE :methyl -148:sc= -2.43 (180deg=-6.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 86 16.111 -12.285 -1.336 1.00 0.00 N ATOM 2 CA ASP A 86 14.728 -12.346 -0.882 1.00 0.00 C ATOM 3 C ASP A 86 13.828 -11.653 -1.891 1.00 0.00 C ATOM 4 O ASP A 86 14.280 -11.292 -2.978 1.00 0.00 O ATOM 5 CB ASP A 86 14.577 -11.702 0.501 1.00 0.00 C ATOM 6 CG ASP A 86 15.244 -12.515 1.597 1.00 0.00 C ATOM 7 OD1 ASP A 86 16.443 -12.293 1.865 1.00 0.00 O ATOM 8 OD2 ASP A 86 14.571 -13.383 2.195 1.00 0.00 O ATOM 0 HA ASP A 86 14.434 -13.392 -0.798 1.00 0.00 H new ATOM 0 HB2 ASP A 86 15.009 -10.701 0.481 1.00 0.00 H new ATOM 0 HB3 ASP A 86 13.518 -11.588 0.731 1.00 0.00 H new ATOM 13 N GLU A 87 12.569 -11.458 -1.527 1.00 0.00 N ATOM 14 CA GLU A 87 11.583 -10.867 -2.427 1.00 0.00 C ATOM 15 C GLU A 87 11.470 -9.351 -2.225 1.00 0.00 C ATOM 16 O GLU A 87 10.891 -8.885 -1.248 1.00 0.00 O ATOM 17 CB GLU A 87 10.224 -11.537 -2.212 1.00 0.00 C ATOM 18 CG GLU A 87 9.847 -11.682 -0.744 1.00 0.00 C ATOM 19 CD GLU A 87 8.497 -12.328 -0.540 1.00 0.00 C ATOM 20 OE1 GLU A 87 8.343 -13.516 -0.887 1.00 0.00 O ATOM 21 OE2 GLU A 87 7.591 -11.657 -0.010 1.00 0.00 O ATOM 0 H GLU A 87 12.202 -11.702 -0.607 1.00 0.00 H new ATOM 0 HA GLU A 87 11.913 -11.035 -3.452 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.456 -10.955 -2.721 1.00 0.00 H new ATOM 0 HB3 GLU A 87 10.236 -12.523 -2.676 1.00 0.00 H new ATOM 0 HG2 GLU A 87 10.608 -12.276 -0.237 1.00 0.00 H new ATOM 0 HG3 GLU A 87 9.846 -10.697 -0.276 1.00 0.00 H new ATOM 28 N PRO A 88 12.048 -8.560 -3.140 1.00 0.00 N ATOM 29 CA PRO A 88 11.966 -7.114 -3.112 1.00 0.00 C ATOM 30 C PRO A 88 10.902 -6.591 -4.075 1.00 0.00 C ATOM 31 O PRO A 88 11.218 -6.069 -5.147 1.00 0.00 O ATOM 32 CB PRO A 88 13.365 -6.709 -3.578 1.00 0.00 C ATOM 33 CG PRO A 88 13.857 -7.855 -4.424 1.00 0.00 C ATOM 34 CD PRO A 88 12.871 -8.993 -4.268 1.00 0.00 C ATOM 0 HA PRO A 88 11.685 -6.715 -2.137 1.00 0.00 H new ATOM 0 HB2 PRO A 88 13.334 -5.783 -4.152 1.00 0.00 H new ATOM 0 HB3 PRO A 88 14.026 -6.536 -2.729 1.00 0.00 H new ATOM 0 HG2 PRO A 88 13.933 -7.555 -5.469 1.00 0.00 H new ATOM 0 HG3 PRO A 88 14.853 -8.165 -4.108 1.00 0.00 H new ATOM 0 HD2 PRO A 88 12.276 -9.139 -5.170 1.00 0.00 H new ATOM 0 HD3 PRO A 88 13.374 -9.938 -4.062 1.00 0.00 H new ATOM 42 N LEU A 89 9.643 -6.741 -3.697 1.00 0.00 N ATOM 43 CA LEU A 89 8.535 -6.349 -4.558 1.00 0.00 C ATOM 44 C LEU A 89 8.450 -4.829 -4.662 1.00 0.00 C ATOM 45 O LEU A 89 8.005 -4.151 -3.737 1.00 0.00 O ATOM 46 CB LEU A 89 7.222 -6.933 -4.030 1.00 0.00 C ATOM 47 CG LEU A 89 5.970 -6.617 -4.854 1.00 0.00 C ATOM 48 CD1 LEU A 89 6.124 -7.112 -6.286 1.00 0.00 C ATOM 49 CD2 LEU A 89 4.743 -7.239 -4.204 1.00 0.00 C ATOM 0 H LEU A 89 9.361 -7.132 -2.798 1.00 0.00 H new ATOM 0 HA LEU A 89 8.711 -6.747 -5.557 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.328 -8.016 -3.967 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.067 -6.568 -3.015 1.00 0.00 H new ATOM 0 HG LEU A 89 5.841 -5.535 -4.883 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.222 -6.876 -6.851 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.981 -6.624 -6.750 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.279 -8.191 -6.283 1.00 0.00 H new ATOM 0 HD21 LEU A 89 3.859 -7.007 -4.799 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.870 -8.320 -4.148 1.00 0.00 H new ATOM 0 HD23 LEU A 89 4.620 -6.836 -3.199 1.00 0.00 H new ATOM 61 N SER A 90 8.919 -4.301 -5.780 1.00 0.00 N ATOM 62 CA SER A 90 8.919 -2.878 -6.009 1.00 0.00 C ATOM 63 C SER A 90 7.686 -2.456 -6.806 1.00 0.00 C ATOM 64 O SER A 90 7.666 -2.539 -8.036 1.00 0.00 O ATOM 65 CB SER A 90 10.195 -2.504 -6.751 1.00 0.00 C ATOM 66 OG SER A 90 11.342 -2.978 -6.055 1.00 0.00 O ATOM 0 H SER A 90 9.307 -4.849 -6.547 1.00 0.00 H new ATOM 0 HA SER A 90 8.884 -2.355 -5.053 1.00 0.00 H new ATOM 0 HB2 SER A 90 10.174 -2.926 -7.756 1.00 0.00 H new ATOM 0 HB3 SER A 90 10.253 -1.421 -6.861 1.00 0.00 H new ATOM 0 HG SER A 90 12.151 -2.729 -6.549 1.00 0.00 H new ATOM 72 N ILE A 91 6.655 -2.025 -6.099 1.00 0.00 N ATOM 73 CA ILE A 91 5.414 -1.604 -6.732 1.00 0.00 C ATOM 74 C ILE A 91 5.322 -0.084 -6.762 1.00 0.00 C ATOM 75 O ILE A 91 5.961 0.600 -5.961 1.00 0.00 O ATOM 76 CB ILE A 91 4.178 -2.173 -6.004 1.00 0.00 C ATOM 77 CG1 ILE A 91 4.209 -1.803 -4.515 1.00 0.00 C ATOM 78 CG2 ILE A 91 4.108 -3.683 -6.187 1.00 0.00 C ATOM 79 CD1 ILE A 91 2.989 -2.264 -3.744 1.00 0.00 C ATOM 0 H ILE A 91 6.652 -1.957 -5.081 1.00 0.00 H new ATOM 0 HA ILE A 91 5.424 -1.994 -7.750 1.00 0.00 H new ATOM 0 HB ILE A 91 3.282 -1.732 -6.441 1.00 0.00 H new ATOM 0 HG12 ILE A 91 5.100 -2.237 -4.061 1.00 0.00 H new ATOM 0 HG13 ILE A 91 4.299 -0.721 -4.421 1.00 0.00 H new ATOM 0 HG21 ILE A 91 3.232 -4.072 -5.669 1.00 0.00 H new ATOM 0 HG22 ILE A 91 4.035 -3.918 -7.249 1.00 0.00 H new ATOM 0 HG23 ILE A 91 5.007 -4.142 -5.775 1.00 0.00 H new ATOM 0 HD11 ILE A 91 3.084 -1.966 -2.700 1.00 0.00 H new ATOM 0 HD12 ILE A 91 2.095 -1.809 -4.171 1.00 0.00 H new ATOM 0 HD13 ILE A 91 2.908 -3.349 -3.805 1.00 0.00 H new ATOM 91 N LEU A 92 4.535 0.444 -7.683 1.00 0.00 N ATOM 92 CA LEU A 92 4.383 1.883 -7.810 1.00 0.00 C ATOM 93 C LEU A 92 3.140 2.358 -7.069 1.00 0.00 C ATOM 94 O LEU A 92 2.010 2.108 -7.496 1.00 0.00 O ATOM 95 CB LEU A 92 4.314 2.284 -9.287 1.00 0.00 C ATOM 96 CG LEU A 92 4.214 3.784 -9.558 1.00 0.00 C ATOM 97 CD1 LEU A 92 5.427 4.511 -9.008 1.00 0.00 C ATOM 98 CD2 LEU A 92 4.076 4.040 -11.048 1.00 0.00 C ATOM 0 H LEU A 92 3.992 -0.101 -8.353 1.00 0.00 H new ATOM 0 HA LEU A 92 5.253 2.363 -7.361 1.00 0.00 H new ATOM 0 HB2 LEU A 92 5.201 1.900 -9.791 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.452 1.793 -9.739 1.00 0.00 H new ATOM 0 HG LEU A 92 3.328 4.167 -9.052 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.335 5.578 -9.212 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.490 4.351 -7.932 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.329 4.127 -9.485 1.00 0.00 H new ATOM 0 HD21 LEU A 92 4.006 5.113 -11.228 1.00 0.00 H new ATOM 0 HD22 LEU A 92 4.947 3.641 -11.568 1.00 0.00 H new ATOM 0 HD23 LEU A 92 3.176 3.550 -11.420 1.00 0.00 H new ATOM 110 N VAL A 93 3.355 3.032 -5.952 1.00 0.00 N ATOM 111 CA VAL A 93 2.261 3.556 -5.158 1.00 0.00 C ATOM 112 C VAL A 93 2.081 5.042 -5.439 1.00 0.00 C ATOM 113 O VAL A 93 2.982 5.849 -5.209 1.00 0.00 O ATOM 114 CB VAL A 93 2.492 3.331 -3.649 1.00 0.00 C ATOM 115 CG1 VAL A 93 1.328 3.878 -2.833 1.00 0.00 C ATOM 116 CG2 VAL A 93 2.702 1.851 -3.352 1.00 0.00 C ATOM 0 H VAL A 93 4.282 3.229 -5.575 1.00 0.00 H new ATOM 0 HA VAL A 93 1.357 3.017 -5.441 1.00 0.00 H new ATOM 0 HB VAL A 93 3.393 3.872 -3.362 1.00 0.00 H new ATOM 0 HG11 VAL A 93 1.515 3.707 -1.773 1.00 0.00 H new ATOM 0 HG12 VAL A 93 1.226 4.948 -3.016 1.00 0.00 H new ATOM 0 HG13 VAL A 93 0.409 3.371 -3.126 1.00 0.00 H new ATOM 0 HG21 VAL A 93 2.863 1.714 -2.283 1.00 0.00 H new ATOM 0 HG22 VAL A 93 1.821 1.289 -3.661 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.573 1.490 -3.899 1.00 0.00 H new ATOM 126 N ARG A 94 0.919 5.391 -5.955 1.00 0.00 N ATOM 127 CA ARG A 94 0.615 6.767 -6.293 1.00 0.00 C ATOM 128 C ARG A 94 -0.329 7.347 -5.254 1.00 0.00 C ATOM 129 O ARG A 94 -1.496 6.960 -5.182 1.00 0.00 O ATOM 130 CB ARG A 94 -0.002 6.837 -7.691 1.00 0.00 C ATOM 131 CG ARG A 94 -0.194 8.251 -8.206 1.00 0.00 C ATOM 132 CD ARG A 94 -0.573 8.254 -9.676 1.00 0.00 C ATOM 133 NE ARG A 94 -0.635 9.605 -10.222 1.00 0.00 N ATOM 134 CZ ARG A 94 0.157 10.058 -11.192 1.00 0.00 C ATOM 135 NH1 ARG A 94 1.084 9.274 -11.731 1.00 0.00 N ATOM 136 NH2 ARG A 94 0.022 11.300 -11.629 1.00 0.00 N ATOM 0 H ARG A 94 0.164 4.734 -6.151 1.00 0.00 H new ATOM 0 HA ARG A 94 1.533 7.355 -6.297 1.00 0.00 H new ATOM 0 HB2 ARG A 94 0.635 6.290 -8.387 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -0.967 6.331 -7.678 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -0.971 8.749 -7.627 1.00 0.00 H new ATOM 0 HG3 ARG A 94 0.724 8.820 -8.064 1.00 0.00 H new ATOM 0 HD2 ARG A 94 0.154 7.669 -10.239 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -1.540 7.767 -9.802 1.00 0.00 H new ATOM 0 HE ARG A 94 -1.330 10.244 -9.836 1.00 0.00 H new ATOM 0 HH11 ARG A 94 1.195 8.315 -11.402 1.00 0.00 H new ATOM 0 HH12 ARG A 94 1.685 9.631 -12.473 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -0.688 11.909 -11.223 1.00 0.00 H new ATOM 0 HH22 ARG A 94 0.628 11.648 -12.372 1.00 0.00 H new ATOM 150 N ASN A 95 0.183 8.245 -4.429 1.00 0.00 N ATOM 151 CA ASN A 95 -0.607 8.813 -3.351 1.00 0.00 C ATOM 152 C ASN A 95 -1.337 10.079 -3.793 1.00 0.00 C ATOM 153 O ASN A 95 -0.732 11.117 -4.076 1.00 0.00 O ATOM 154 CB ASN A 95 0.243 9.051 -2.088 1.00 0.00 C ATOM 155 CG ASN A 95 1.511 9.854 -2.324 1.00 0.00 C ATOM 156 OD1 ASN A 95 2.547 9.303 -2.697 1.00 0.00 O ATOM 157 ND2 ASN A 95 1.459 11.148 -2.055 1.00 0.00 N ATOM 0 H ASN A 95 1.139 8.595 -4.485 1.00 0.00 H new ATOM 0 HA ASN A 95 -1.370 8.081 -3.089 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -0.367 9.568 -1.347 1.00 0.00 H new ATOM 0 HB3 ASN A 95 0.514 8.086 -1.660 1.00 0.00 H new ATOM 0 HD21 ASN A 95 2.295 11.724 -2.154 1.00 0.00 H new ATOM 0 HD22 ASN A 95 0.583 11.570 -1.748 1.00 0.00 H new ATOM 164 N ASN A 96 -2.656 9.940 -3.866 1.00 0.00 N ATOM 165 CA ASN A 96 -3.591 11.010 -4.211 1.00 0.00 C ATOM 166 C ASN A 96 -3.488 11.433 -5.674 1.00 0.00 C ATOM 167 O ASN A 96 -4.226 10.924 -6.517 1.00 0.00 O ATOM 168 CB ASN A 96 -3.437 12.227 -3.299 1.00 0.00 C ATOM 169 CG ASN A 96 -4.691 13.086 -3.292 1.00 0.00 C ATOM 170 OD1 ASN A 96 -5.803 12.578 -3.441 1.00 0.00 O ATOM 171 ND2 ASN A 96 -4.531 14.385 -3.118 1.00 0.00 N ATOM 0 H ASN A 96 -3.121 9.051 -3.681 1.00 0.00 H new ATOM 0 HA ASN A 96 -4.585 10.590 -4.056 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -3.217 11.896 -2.284 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -2.588 12.825 -3.630 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -5.343 15.002 -3.104 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -3.595 14.772 -2.998 1.00 0.00 H new ATOM 178 N LYS A 97 -2.586 12.361 -5.983 1.00 0.00 N ATOM 179 CA LYS A 97 -2.543 12.939 -7.321 1.00 0.00 C ATOM 180 C LYS A 97 -1.150 12.919 -7.938 1.00 0.00 C ATOM 181 O LYS A 97 -0.885 12.142 -8.855 1.00 0.00 O ATOM 182 CB LYS A 97 -3.065 14.377 -7.300 1.00 0.00 C ATOM 183 CG LYS A 97 -4.544 14.487 -6.980 1.00 0.00 C ATOM 184 CD LYS A 97 -5.384 13.725 -7.989 1.00 0.00 C ATOM 185 CE LYS A 97 -6.861 13.841 -7.678 1.00 0.00 C ATOM 186 NZ LYS A 97 -7.685 12.988 -8.575 1.00 0.00 N ATOM 0 H LYS A 97 -1.886 12.724 -5.336 1.00 0.00 H new ATOM 0 HA LYS A 97 -3.184 12.313 -7.942 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -2.500 14.948 -6.563 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -2.878 14.836 -8.271 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -4.732 14.098 -5.979 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -4.840 15.536 -6.975 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -5.190 14.110 -8.990 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -5.092 12.675 -7.989 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -7.037 13.554 -6.641 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -7.173 14.881 -7.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -8.690 13.096 -8.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -7.537 13.278 -9.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -7.406 11.993 -8.461 1.00 0.00 H new ATOM 200 N GLY A 98 -0.265 13.768 -7.436 1.00 0.00 N ATOM 201 CA GLY A 98 0.982 14.026 -8.139 1.00 0.00 C ATOM 202 C GLY A 98 2.193 13.391 -7.491 1.00 0.00 C ATOM 203 O GLY A 98 3.313 13.872 -7.663 1.00 0.00 O ATOM 0 H GLY A 98 -0.383 14.281 -6.562 1.00 0.00 H new ATOM 0 HA2 GLY A 98 0.894 13.658 -9.161 1.00 0.00 H new ATOM 0 HA3 GLY A 98 1.137 15.103 -8.200 1.00 0.00 H new ATOM 207 N ARG A 99 1.986 12.316 -6.753 1.00 0.00 N ATOM 208 CA ARG A 99 3.094 11.619 -6.126 1.00 0.00 C ATOM 209 C ARG A 99 3.007 10.119 -6.348 1.00 0.00 C ATOM 210 O ARG A 99 2.294 9.411 -5.644 1.00 0.00 O ATOM 211 CB ARG A 99 3.160 11.935 -4.631 1.00 0.00 C ATOM 212 CG ARG A 99 3.871 13.241 -4.308 1.00 0.00 C ATOM 213 CD ARG A 99 5.325 13.201 -4.762 1.00 0.00 C ATOM 214 NE ARG A 99 6.026 12.039 -4.218 1.00 0.00 N ATOM 215 CZ ARG A 99 7.166 11.553 -4.705 1.00 0.00 C ATOM 216 NH1 ARG A 99 7.774 12.149 -5.726 1.00 0.00 N ATOM 217 NH2 ARG A 99 7.704 10.475 -4.151 1.00 0.00 N ATOM 0 H ARG A 99 1.068 11.909 -6.574 1.00 0.00 H new ATOM 0 HA ARG A 99 4.011 11.974 -6.597 1.00 0.00 H new ATOM 0 HB2 ARG A 99 2.146 11.977 -4.233 1.00 0.00 H new ATOM 0 HB3 ARG A 99 3.670 11.119 -4.119 1.00 0.00 H new ATOM 0 HG2 ARG A 99 3.357 14.069 -4.796 1.00 0.00 H new ATOM 0 HG3 ARG A 99 3.827 13.427 -3.235 1.00 0.00 H new ATOM 0 HD2 ARG A 99 5.366 13.175 -5.851 1.00 0.00 H new ATOM 0 HD3 ARG A 99 5.831 14.113 -4.446 1.00 0.00 H new ATOM 0 HE ARG A 99 5.614 11.569 -3.412 1.00 0.00 H new ATOM 0 HH11 ARG A 99 7.368 12.986 -6.143 1.00 0.00 H new ATOM 0 HH12 ARG A 99 8.647 11.769 -6.092 1.00 0.00 H new ATOM 0 HH21 ARG A 99 7.245 10.026 -3.359 1.00 0.00 H new ATOM 0 HH22 ARG A 99 8.577 10.095 -4.517 1.00 0.00 H new ATOM 231 N SER A 100 3.707 9.650 -7.364 1.00 0.00 N ATOM 232 CA SER A 100 3.845 8.226 -7.609 1.00 0.00 C ATOM 233 C SER A 100 5.257 7.777 -7.259 1.00 0.00 C ATOM 234 O SER A 100 6.219 8.100 -7.958 1.00 0.00 O ATOM 235 CB SER A 100 3.506 7.907 -9.068 1.00 0.00 C ATOM 236 OG SER A 100 3.987 8.923 -9.941 1.00 0.00 O ATOM 0 H SER A 100 4.193 10.241 -8.039 1.00 0.00 H new ATOM 0 HA SER A 100 3.146 7.680 -6.975 1.00 0.00 H new ATOM 0 HB2 SER A 100 3.944 6.948 -9.345 1.00 0.00 H new ATOM 0 HB3 SER A 100 2.426 7.808 -9.180 1.00 0.00 H new ATOM 0 HG SER A 100 3.759 8.694 -10.866 1.00 0.00 H new ATOM 242 N SER A 101 5.386 7.051 -6.162 1.00 0.00 N ATOM 243 CA SER A 101 6.688 6.614 -5.696 1.00 0.00 C ATOM 244 C SER A 101 6.777 5.095 -5.722 1.00 0.00 C ATOM 245 O SER A 101 5.819 4.400 -5.374 1.00 0.00 O ATOM 246 CB SER A 101 6.948 7.146 -4.283 1.00 0.00 C ATOM 247 OG SER A 101 8.252 6.814 -3.829 1.00 0.00 O ATOM 0 H SER A 101 4.605 6.752 -5.578 1.00 0.00 H new ATOM 0 HA SER A 101 7.452 7.013 -6.363 1.00 0.00 H new ATOM 0 HB2 SER A 101 6.824 8.229 -4.273 1.00 0.00 H new ATOM 0 HB3 SER A 101 6.208 6.734 -3.597 1.00 0.00 H new ATOM 0 HG SER A 101 8.384 7.170 -2.926 1.00 0.00 H new ATOM 253 N THR A 102 7.911 4.586 -6.164 1.00 0.00 N ATOM 254 CA THR A 102 8.150 3.158 -6.158 1.00 0.00 C ATOM 255 C THR A 102 8.473 2.695 -4.734 1.00 0.00 C ATOM 256 O THR A 102 9.467 3.127 -4.145 1.00 0.00 O ATOM 257 CB THR A 102 9.312 2.792 -7.101 1.00 0.00 C ATOM 258 OG1 THR A 102 9.126 3.425 -8.378 1.00 0.00 O ATOM 259 CG2 THR A 102 9.401 1.283 -7.290 1.00 0.00 C ATOM 0 H THR A 102 8.682 5.143 -6.532 1.00 0.00 H new ATOM 0 HA THR A 102 7.249 2.655 -6.511 1.00 0.00 H new ATOM 0 HB THR A 102 10.240 3.144 -6.651 1.00 0.00 H new ATOM 0 HG1 THR A 102 9.869 3.189 -8.971 1.00 0.00 H new ATOM 0 HG21 THR A 102 10.229 1.048 -7.960 1.00 0.00 H new ATOM 0 HG22 THR A 102 9.568 0.805 -6.325 1.00 0.00 H new ATOM 0 HG23 THR A 102 8.470 0.915 -7.721 1.00 0.00 H new ATOM 267 N TYR A 103 7.624 1.843 -4.177 1.00 0.00 N ATOM 268 CA TYR A 103 7.807 1.369 -2.812 1.00 0.00 C ATOM 269 C TYR A 103 8.335 -0.058 -2.792 1.00 0.00 C ATOM 270 O TYR A 103 8.038 -0.856 -3.681 1.00 0.00 O ATOM 271 CB TYR A 103 6.494 1.450 -2.025 1.00 0.00 C ATOM 272 CG TYR A 103 6.159 2.844 -1.536 1.00 0.00 C ATOM 273 CD1 TYR A 103 5.593 3.780 -2.390 1.00 0.00 C ATOM 274 CD2 TYR A 103 6.411 3.219 -0.223 1.00 0.00 C ATOM 275 CE1 TYR A 103 5.289 5.053 -1.952 1.00 0.00 C ATOM 276 CE2 TYR A 103 6.108 4.491 0.224 1.00 0.00 C ATOM 277 CZ TYR A 103 5.547 5.405 -0.644 1.00 0.00 C ATOM 278 OH TYR A 103 5.247 6.673 -0.208 1.00 0.00 O ATOM 0 H TYR A 103 6.802 1.466 -4.649 1.00 0.00 H new ATOM 0 HA TYR A 103 8.543 2.017 -2.336 1.00 0.00 H new ATOM 0 HB2 TYR A 103 5.681 1.091 -2.656 1.00 0.00 H new ATOM 0 HB3 TYR A 103 6.553 0.779 -1.168 1.00 0.00 H new ATOM 0 HD1 TYR A 103 5.387 3.508 -3.415 1.00 0.00 H new ATOM 0 HD2 TYR A 103 6.850 2.506 0.459 1.00 0.00 H new ATOM 0 HE1 TYR A 103 4.851 5.770 -2.631 1.00 0.00 H new ATOM 0 HE2 TYR A 103 6.309 4.768 1.248 1.00 0.00 H new ATOM 0 HH TYR A 103 4.482 7.020 -0.712 1.00 0.00 H new ATOM 288 N GLU A 104 9.119 -0.363 -1.771 1.00 0.00 N ATOM 289 CA GLU A 104 9.699 -1.683 -1.607 1.00 0.00 C ATOM 290 C GLU A 104 8.927 -2.464 -0.553 1.00 0.00 C ATOM 291 O GLU A 104 8.968 -2.131 0.636 1.00 0.00 O ATOM 292 CB GLU A 104 11.168 -1.550 -1.209 1.00 0.00 C ATOM 293 CG GLU A 104 11.853 -2.869 -0.897 1.00 0.00 C ATOM 294 CD GLU A 104 13.290 -2.675 -0.460 1.00 0.00 C ATOM 295 OE1 GLU A 104 13.516 -2.222 0.685 1.00 0.00 O ATOM 296 OE2 GLU A 104 14.203 -2.966 -1.262 1.00 0.00 O ATOM 0 H GLU A 104 9.370 0.297 -1.035 1.00 0.00 H new ATOM 0 HA GLU A 104 9.638 -2.226 -2.550 1.00 0.00 H new ATOM 0 HB2 GLU A 104 11.708 -1.056 -2.017 1.00 0.00 H new ATOM 0 HB3 GLU A 104 11.238 -0.902 -0.335 1.00 0.00 H new ATOM 0 HG2 GLU A 104 11.302 -3.386 -0.111 1.00 0.00 H new ATOM 0 HG3 GLU A 104 11.826 -3.509 -1.779 1.00 0.00 H new ATOM 303 N VAL A 105 8.205 -3.481 -0.995 1.00 0.00 N ATOM 304 CA VAL A 105 7.411 -4.301 -0.097 1.00 0.00 C ATOM 305 C VAL A 105 7.678 -5.783 -0.331 1.00 0.00 C ATOM 306 O VAL A 105 8.484 -6.153 -1.182 1.00 0.00 O ATOM 307 CB VAL A 105 5.897 -4.030 -0.254 1.00 0.00 C ATOM 308 CG1 VAL A 105 5.563 -2.595 0.112 1.00 0.00 C ATOM 309 CG2 VAL A 105 5.428 -4.341 -1.669 1.00 0.00 C ATOM 0 H VAL A 105 8.153 -3.759 -1.975 1.00 0.00 H new ATOM 0 HA VAL A 105 7.709 -4.031 0.916 1.00 0.00 H new ATOM 0 HB VAL A 105 5.369 -4.692 0.432 1.00 0.00 H new ATOM 0 HG11 VAL A 105 4.492 -2.429 -0.007 1.00 0.00 H new ATOM 0 HG12 VAL A 105 5.847 -2.408 1.148 1.00 0.00 H new ATOM 0 HG13 VAL A 105 6.110 -1.916 -0.542 1.00 0.00 H new ATOM 0 HG21 VAL A 105 4.360 -4.141 -1.750 1.00 0.00 H new ATOM 0 HG22 VAL A 105 5.969 -3.714 -2.378 1.00 0.00 H new ATOM 0 HG23 VAL A 105 5.619 -5.390 -1.893 1.00 0.00 H new ATOM 319 N ARG A 106 7.002 -6.620 0.436 1.00 0.00 N ATOM 320 CA ARG A 106 7.112 -8.062 0.302 1.00 0.00 C ATOM 321 C ARG A 106 5.724 -8.674 0.179 1.00 0.00 C ATOM 322 O ARG A 106 4.730 -8.058 0.572 1.00 0.00 O ATOM 323 CB ARG A 106 7.858 -8.650 1.504 1.00 0.00 C ATOM 324 CG ARG A 106 9.357 -8.393 1.476 1.00 0.00 C ATOM 325 CD ARG A 106 10.001 -8.637 2.831 1.00 0.00 C ATOM 326 NE ARG A 106 9.679 -7.573 3.783 1.00 0.00 N ATOM 327 CZ ARG A 106 10.038 -7.572 5.067 1.00 0.00 C ATOM 328 NH1 ARG A 106 10.634 -8.633 5.602 1.00 0.00 N ATOM 329 NH2 ARG A 106 9.776 -6.507 5.815 1.00 0.00 N ATOM 0 H ARG A 106 6.361 -6.319 1.170 1.00 0.00 H new ATOM 0 HA ARG A 106 7.679 -8.296 -0.599 1.00 0.00 H new ATOM 0 HB2 ARG A 106 7.443 -8.229 2.420 1.00 0.00 H new ATOM 0 HB3 ARG A 106 7.683 -9.725 1.539 1.00 0.00 H new ATOM 0 HG2 ARG A 106 9.822 -9.039 0.732 1.00 0.00 H new ATOM 0 HG3 ARG A 106 9.543 -7.365 1.166 1.00 0.00 H new ATOM 0 HD2 ARG A 106 9.663 -9.594 3.227 1.00 0.00 H new ATOM 0 HD3 ARG A 106 11.082 -8.705 2.713 1.00 0.00 H new ATOM 0 HE ARG A 106 9.142 -6.776 3.440 1.00 0.00 H new ATOM 0 HH11 ARG A 106 10.820 -9.456 5.029 1.00 0.00 H new ATOM 0 HH12 ARG A 106 10.905 -8.624 6.585 1.00 0.00 H new ATOM 0 HH21 ARG A 106 9.304 -5.700 5.406 1.00 0.00 H new ATOM 0 HH22 ARG A 106 10.046 -6.496 6.798 1.00 0.00 H new ATOM 343 N LEU A 107 5.654 -9.886 -0.351 1.00 0.00 N ATOM 344 CA LEU A 107 4.378 -10.543 -0.588 1.00 0.00 C ATOM 345 C LEU A 107 3.868 -11.174 0.697 1.00 0.00 C ATOM 346 O LEU A 107 2.663 -11.317 0.899 1.00 0.00 O ATOM 347 CB LEU A 107 4.497 -11.610 -1.686 1.00 0.00 C ATOM 348 CG LEU A 107 4.772 -11.087 -3.103 1.00 0.00 C ATOM 349 CD1 LEU A 107 6.216 -10.634 -3.256 1.00 0.00 C ATOM 350 CD2 LEU A 107 4.438 -12.156 -4.132 1.00 0.00 C ATOM 0 H LEU A 107 6.468 -10.435 -0.626 1.00 0.00 H new ATOM 0 HA LEU A 107 3.668 -9.788 -0.925 1.00 0.00 H new ATOM 0 HB2 LEU A 107 5.297 -12.298 -1.412 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.573 -12.188 -1.706 1.00 0.00 H new ATOM 0 HG LEU A 107 4.132 -10.221 -3.272 1.00 0.00 H new ATOM 0 HD11 LEU A 107 6.377 -10.270 -4.270 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.424 -9.834 -2.546 1.00 0.00 H new ATOM 0 HD13 LEU A 107 6.883 -11.474 -3.062 1.00 0.00 H new ATOM 0 HD21 LEU A 107 4.637 -11.773 -5.133 1.00 0.00 H new ATOM 0 HD22 LEU A 107 5.052 -13.038 -3.952 1.00 0.00 H new ATOM 0 HD23 LEU A 107 3.385 -12.424 -4.049 1.00 0.00 H new ATOM 362 N THR A 108 4.800 -11.532 1.573 1.00 0.00 N ATOM 363 CA THR A 108 4.462 -12.138 2.852 1.00 0.00 C ATOM 364 C THR A 108 4.145 -11.061 3.901 1.00 0.00 C ATOM 365 O THR A 108 4.017 -11.341 5.093 1.00 0.00 O ATOM 366 CB THR A 108 5.613 -13.047 3.329 1.00 0.00 C ATOM 367 OG1 THR A 108 6.067 -13.838 2.225 1.00 0.00 O ATOM 368 CG2 THR A 108 5.159 -13.980 4.444 1.00 0.00 C ATOM 0 H THR A 108 5.801 -11.411 1.418 1.00 0.00 H new ATOM 0 HA THR A 108 3.569 -12.749 2.721 1.00 0.00 H new ATOM 0 HB THR A 108 6.413 -12.414 3.712 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.800 -14.418 2.518 1.00 0.00 H new ATOM 0 HG21 THR A 108 5.994 -14.607 4.757 1.00 0.00 H new ATOM 0 HG22 THR A 108 4.810 -13.391 5.292 1.00 0.00 H new ATOM 0 HG23 THR A 108 4.347 -14.611 4.082 1.00 0.00 H new ATOM 376 N GLN A 109 4.022 -9.823 3.442 1.00 0.00 N ATOM 377 CA GLN A 109 3.572 -8.739 4.296 1.00 0.00 C ATOM 378 C GLN A 109 2.075 -8.548 4.132 1.00 0.00 C ATOM 379 O GLN A 109 1.547 -8.689 3.030 1.00 0.00 O ATOM 380 CB GLN A 109 4.262 -7.422 3.944 1.00 0.00 C ATOM 381 CG GLN A 109 5.760 -7.395 4.185 1.00 0.00 C ATOM 382 CD GLN A 109 6.377 -6.057 3.810 1.00 0.00 C ATOM 383 OE1 GLN A 109 7.529 -5.986 3.396 1.00 0.00 O ATOM 384 NE2 GLN A 109 5.614 -4.982 3.950 1.00 0.00 N ATOM 0 H GLN A 109 4.228 -9.547 2.482 1.00 0.00 H new ATOM 0 HA GLN A 109 3.821 -9.006 5.323 1.00 0.00 H new ATOM 0 HB2 GLN A 109 4.075 -7.201 2.893 1.00 0.00 H new ATOM 0 HB3 GLN A 109 3.802 -6.622 4.524 1.00 0.00 H new ATOM 0 HG2 GLN A 109 5.961 -7.604 5.236 1.00 0.00 H new ATOM 0 HG3 GLN A 109 6.234 -8.187 3.605 1.00 0.00 H new ATOM 0 HE21 GLN A 109 4.659 -5.076 4.297 1.00 0.00 H new ATOM 0 HE22 GLN A 109 5.981 -4.061 3.710 1.00 0.00 H new ATOM 393 N THR A 110 1.395 -8.227 5.214 1.00 0.00 N ATOM 394 CA THR A 110 0.004 -7.832 5.122 1.00 0.00 C ATOM 395 C THR A 110 -0.072 -6.379 4.681 1.00 0.00 C ATOM 396 O THR A 110 0.892 -5.623 4.859 1.00 0.00 O ATOM 397 CB THR A 110 -0.729 -8.006 6.465 1.00 0.00 C ATOM 398 OG1 THR A 110 0.023 -7.386 7.518 1.00 0.00 O ATOM 399 CG2 THR A 110 -0.943 -9.479 6.777 1.00 0.00 C ATOM 0 H THR A 110 1.778 -8.231 6.159 1.00 0.00 H new ATOM 0 HA THR A 110 -0.487 -8.476 4.392 1.00 0.00 H new ATOM 0 HB THR A 110 -1.704 -7.525 6.389 1.00 0.00 H new ATOM 0 HG1 THR A 110 -0.450 -7.499 8.369 1.00 0.00 H new ATOM 0 HG21 THR A 110 -1.462 -9.577 7.730 1.00 0.00 H new ATOM 0 HG22 THR A 110 -1.542 -9.935 5.989 1.00 0.00 H new ATOM 0 HG23 THR A 110 0.022 -9.982 6.836 1.00 0.00 H new ATOM 407 N VAL A 111 -1.195 -5.985 4.094 1.00 0.00 N ATOM 408 CA VAL A 111 -1.375 -4.610 3.647 1.00 0.00 C ATOM 409 C VAL A 111 -1.244 -3.645 4.826 1.00 0.00 C ATOM 410 O VAL A 111 -0.832 -2.496 4.659 1.00 0.00 O ATOM 411 CB VAL A 111 -2.734 -4.415 2.937 1.00 0.00 C ATOM 412 CG1 VAL A 111 -2.930 -2.967 2.505 1.00 0.00 C ATOM 413 CG2 VAL A 111 -2.844 -5.345 1.738 1.00 0.00 C ATOM 0 H VAL A 111 -1.992 -6.596 3.917 1.00 0.00 H new ATOM 0 HA VAL A 111 -0.590 -4.392 2.923 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.522 -4.662 3.648 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -3.895 -2.863 2.009 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -2.900 -2.319 3.381 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.135 -2.682 1.816 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -3.807 -5.196 1.249 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -2.041 -5.127 1.034 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -2.763 -6.380 2.071 1.00 0.00 H new ATOM 423 N ALA A 112 -1.550 -4.140 6.025 1.00 0.00 N ATOM 424 CA ALA A 112 -1.434 -3.348 7.245 1.00 0.00 C ATOM 425 C ALA A 112 -0.013 -2.833 7.448 1.00 0.00 C ATOM 426 O ALA A 112 0.188 -1.734 7.961 1.00 0.00 O ATOM 427 CB ALA A 112 -1.863 -4.175 8.446 1.00 0.00 C ATOM 0 H ALA A 112 -1.882 -5.093 6.176 1.00 0.00 H new ATOM 0 HA ALA A 112 -2.091 -2.484 7.145 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -1.773 -3.575 9.352 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -2.899 -4.489 8.320 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -1.225 -5.055 8.529 1.00 0.00 H new ATOM 433 N HIS A 113 0.973 -3.618 7.027 1.00 0.00 N ATOM 434 CA HIS A 113 2.365 -3.251 7.239 1.00 0.00 C ATOM 435 C HIS A 113 2.748 -2.073 6.348 1.00 0.00 C ATOM 436 O HIS A 113 3.410 -1.143 6.794 1.00 0.00 O ATOM 437 CB HIS A 113 3.288 -4.442 6.974 1.00 0.00 C ATOM 438 CG HIS A 113 4.511 -4.452 7.842 1.00 0.00 C ATOM 439 ND1 HIS A 113 5.111 -5.610 8.282 1.00 0.00 N ATOM 440 CD2 HIS A 113 5.243 -3.436 8.360 1.00 0.00 C ATOM 441 CE1 HIS A 113 6.154 -5.308 9.032 1.00 0.00 C ATOM 442 NE2 HIS A 113 6.257 -3.993 9.095 1.00 0.00 N ATOM 0 H HIS A 113 0.835 -4.504 6.541 1.00 0.00 H new ATOM 0 HA HIS A 113 2.483 -2.953 8.281 1.00 0.00 H new ATOM 0 HB2 HIS A 113 2.732 -5.366 7.132 1.00 0.00 H new ATOM 0 HB3 HIS A 113 3.594 -4.429 5.928 1.00 0.00 H new ATOM 0 HD2 HIS A 113 5.061 -2.381 8.219 1.00 0.00 H new ATOM 0 HE1 HIS A 113 6.812 -6.017 9.513 1.00 0.00 H new ATOM 0 HE2 HIS A 113 6.973 -3.477 9.606 1.00 0.00 H new ATOM 451 N LEU A 114 2.318 -2.111 5.088 1.00 0.00 N ATOM 452 CA LEU A 114 2.567 -0.998 4.175 1.00 0.00 C ATOM 453 C LEU A 114 1.736 0.200 4.595 1.00 0.00 C ATOM 454 O LEU A 114 2.183 1.342 4.510 1.00 0.00 O ATOM 455 CB LEU A 114 2.236 -1.384 2.732 1.00 0.00 C ATOM 456 CG LEU A 114 2.421 -0.264 1.700 1.00 0.00 C ATOM 457 CD1 LEU A 114 3.867 0.209 1.663 1.00 0.00 C ATOM 458 CD2 LEU A 114 1.977 -0.731 0.322 1.00 0.00 C ATOM 0 H LEU A 114 1.802 -2.890 4.680 1.00 0.00 H new ATOM 0 HA LEU A 114 3.626 -0.744 4.222 1.00 0.00 H new ATOM 0 HB2 LEU A 114 2.863 -2.228 2.445 1.00 0.00 H new ATOM 0 HB3 LEU A 114 1.202 -1.727 2.692 1.00 0.00 H new ATOM 0 HG LEU A 114 1.797 0.578 1.999 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.971 1.003 0.924 1.00 0.00 H new ATOM 0 HD12 LEU A 114 4.151 0.588 2.645 1.00 0.00 H new ATOM 0 HD13 LEU A 114 4.516 -0.625 1.394 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.115 0.076 -0.398 1.00 0.00 H new ATOM 0 HD22 LEU A 114 2.573 -1.592 0.020 1.00 0.00 H new ATOM 0 HD23 LEU A 114 0.924 -1.012 0.355 1.00 0.00 H new ATOM 470 N LYS A 115 0.525 -0.086 5.053 1.00 0.00 N ATOM 471 CA LYS A 115 -0.384 0.923 5.577 1.00 0.00 C ATOM 472 C LYS A 115 0.319 1.805 6.605 1.00 0.00 C ATOM 473 O LYS A 115 0.309 3.022 6.481 1.00 0.00 O ATOM 474 CB LYS A 115 -1.599 0.221 6.197 1.00 0.00 C ATOM 475 CG LYS A 115 -2.583 1.133 6.908 1.00 0.00 C ATOM 476 CD LYS A 115 -3.192 2.170 5.980 1.00 0.00 C ATOM 477 CE LYS A 115 -4.524 2.661 6.517 1.00 0.00 C ATOM 478 NZ LYS A 115 -4.480 2.895 7.983 1.00 0.00 N ATOM 0 H LYS A 115 0.143 -1.032 5.071 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.715 1.571 4.765 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.129 -0.315 5.410 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.243 -0.526 6.907 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -3.379 0.531 7.347 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.076 1.639 7.730 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -2.508 3.011 5.869 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -3.331 1.739 4.988 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -4.801 3.586 6.010 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -5.299 1.929 6.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -5.339 3.401 8.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -4.427 1.982 8.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -3.643 3.466 8.218 1.00 0.00 H new ATOM 492 N GLN A 116 0.961 1.181 7.587 1.00 0.00 N ATOM 493 CA GLN A 116 1.646 1.918 8.647 1.00 0.00 C ATOM 494 C GLN A 116 2.828 2.725 8.101 1.00 0.00 C ATOM 495 O GLN A 116 3.119 3.811 8.602 1.00 0.00 O ATOM 496 CB GLN A 116 2.114 0.957 9.741 1.00 0.00 C ATOM 497 CG GLN A 116 0.973 0.212 10.413 1.00 0.00 C ATOM 498 CD GLN A 116 1.451 -0.784 11.449 1.00 0.00 C ATOM 499 OE1 GLN A 116 1.719 -1.944 11.136 1.00 0.00 O ATOM 500 NE2 GLN A 116 1.547 -0.345 12.694 1.00 0.00 N ATOM 0 H GLN A 116 1.022 0.166 7.672 1.00 0.00 H new ATOM 0 HA GLN A 116 0.935 2.625 9.075 1.00 0.00 H new ATOM 0 HB2 GLN A 116 2.806 0.234 9.309 1.00 0.00 H new ATOM 0 HB3 GLN A 116 2.667 1.517 10.495 1.00 0.00 H new ATOM 0 HG2 GLN A 116 0.306 0.931 10.888 1.00 0.00 H new ATOM 0 HG3 GLN A 116 0.390 -0.311 9.655 1.00 0.00 H new ATOM 0 HE21 GLN A 116 1.316 0.624 12.912 1.00 0.00 H new ATOM 0 HE22 GLN A 116 1.852 -0.976 13.435 1.00 0.00 H new ATOM 509 N GLN A 117 3.505 2.211 7.074 1.00 0.00 N ATOM 510 CA GLN A 117 4.575 2.975 6.426 1.00 0.00 C ATOM 511 C GLN A 117 3.997 4.196 5.723 1.00 0.00 C ATOM 512 O GLN A 117 4.543 5.302 5.813 1.00 0.00 O ATOM 513 CB GLN A 117 5.367 2.129 5.425 1.00 0.00 C ATOM 514 CG GLN A 117 6.594 1.460 6.024 1.00 0.00 C ATOM 515 CD GLN A 117 6.287 0.151 6.717 1.00 0.00 C ATOM 516 OE1 GLN A 117 5.974 0.115 7.906 1.00 0.00 O ATOM 517 NE2 GLN A 117 6.389 -0.935 5.972 1.00 0.00 N ATOM 0 H GLN A 117 3.337 1.286 6.677 1.00 0.00 H new ATOM 0 HA GLN A 117 5.264 3.291 7.209 1.00 0.00 H new ATOM 0 HB2 GLN A 117 4.711 1.362 5.012 1.00 0.00 H new ATOM 0 HB3 GLN A 117 5.679 2.762 4.594 1.00 0.00 H new ATOM 0 HG2 GLN A 117 7.323 1.282 5.234 1.00 0.00 H new ATOM 0 HG3 GLN A 117 7.057 2.141 6.738 1.00 0.00 H new ATOM 0 HE21 GLN A 117 6.652 -0.857 4.990 1.00 0.00 H new ATOM 0 HE22 GLN A 117 6.205 -1.852 6.379 1.00 0.00 H new ATOM 526 N VAL A 118 2.882 3.996 5.031 1.00 0.00 N ATOM 527 CA VAL A 118 2.169 5.097 4.407 1.00 0.00 C ATOM 528 C VAL A 118 1.712 6.074 5.481 1.00 0.00 C ATOM 529 O VAL A 118 1.854 7.283 5.328 1.00 0.00 O ATOM 530 CB VAL A 118 0.949 4.613 3.587 1.00 0.00 C ATOM 531 CG1 VAL A 118 0.202 5.792 2.976 1.00 0.00 C ATOM 532 CG2 VAL A 118 1.383 3.642 2.500 1.00 0.00 C ATOM 0 H VAL A 118 2.454 3.081 4.889 1.00 0.00 H new ATOM 0 HA VAL A 118 2.853 5.588 3.714 1.00 0.00 H new ATOM 0 HB VAL A 118 0.273 4.094 4.266 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.651 5.426 2.405 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -0.149 6.451 3.770 1.00 0.00 H new ATOM 0 HG13 VAL A 118 0.871 6.344 2.316 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.510 3.314 1.935 1.00 0.00 H new ATOM 0 HG22 VAL A 118 2.084 4.137 1.829 1.00 0.00 H new ATOM 0 HG23 VAL A 118 1.866 2.778 2.956 1.00 0.00 H new ATOM 542 N SER A 119 1.208 5.526 6.583 1.00 0.00 N ATOM 543 CA SER A 119 0.784 6.312 7.734 1.00 0.00 C ATOM 544 C SER A 119 1.950 7.114 8.324 1.00 0.00 C ATOM 545 O SER A 119 1.744 8.108 9.022 1.00 0.00 O ATOM 546 CB SER A 119 0.176 5.385 8.796 1.00 0.00 C ATOM 547 OG SER A 119 -0.952 4.693 8.284 1.00 0.00 O ATOM 0 H SER A 119 1.082 4.521 6.702 1.00 0.00 H new ATOM 0 HA SER A 119 0.029 7.026 7.404 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.926 4.668 9.130 1.00 0.00 H new ATOM 0 HB3 SER A 119 -0.117 5.969 9.668 1.00 0.00 H new ATOM 0 HG SER A 119 -1.662 4.680 8.959 1.00 0.00 H new ATOM 553 N GLY A 120 3.170 6.682 8.036 1.00 0.00 N ATOM 554 CA GLY A 120 4.340 7.402 8.493 1.00 0.00 C ATOM 555 C GLY A 120 4.740 8.528 7.552 1.00 0.00 C ATOM 556 O GLY A 120 5.350 9.512 7.976 1.00 0.00 O ATOM 0 H GLY A 120 3.370 5.843 7.492 1.00 0.00 H new ATOM 0 HA2 GLY A 120 4.145 7.814 9.483 1.00 0.00 H new ATOM 0 HA3 GLY A 120 5.173 6.706 8.595 1.00 0.00 H new ATOM 560 N LEU A 121 4.408 8.387 6.273 1.00 0.00 N ATOM 561 CA LEU A 121 4.753 9.404 5.278 1.00 0.00 C ATOM 562 C LEU A 121 3.567 10.319 4.955 1.00 0.00 C ATOM 563 O LEU A 121 3.583 11.512 5.257 1.00 0.00 O ATOM 564 CB LEU A 121 5.259 8.734 3.998 1.00 0.00 C ATOM 565 CG LEU A 121 6.568 7.957 4.145 1.00 0.00 C ATOM 566 CD1 LEU A 121 6.920 7.257 2.843 1.00 0.00 C ATOM 567 CD2 LEU A 121 7.693 8.891 4.566 1.00 0.00 C ATOM 0 H LEU A 121 3.903 7.584 5.899 1.00 0.00 H new ATOM 0 HA LEU A 121 5.541 10.025 5.704 1.00 0.00 H new ATOM 0 HB2 LEU A 121 4.489 8.053 3.634 1.00 0.00 H new ATOM 0 HB3 LEU A 121 5.393 9.500 3.234 1.00 0.00 H new ATOM 0 HG LEU A 121 6.436 7.201 4.919 1.00 0.00 H new ATOM 0 HD11 LEU A 121 7.854 6.709 2.966 1.00 0.00 H new ATOM 0 HD12 LEU A 121 6.124 6.562 2.577 1.00 0.00 H new ATOM 0 HD13 LEU A 121 7.035 7.997 2.051 1.00 0.00 H new ATOM 0 HD21 LEU A 121 8.618 8.324 4.667 1.00 0.00 H new ATOM 0 HD22 LEU A 121 7.823 9.667 3.812 1.00 0.00 H new ATOM 0 HD23 LEU A 121 7.444 9.352 5.522 1.00 0.00 H new ATOM 579 N GLU A 122 2.545 9.745 4.342 1.00 0.00 N ATOM 580 CA GLU A 122 1.359 10.487 3.908 1.00 0.00 C ATOM 581 C GLU A 122 0.228 10.280 4.912 1.00 0.00 C ATOM 582 O GLU A 122 -0.915 10.655 4.670 1.00 0.00 O ATOM 583 CB GLU A 122 0.929 10.028 2.510 1.00 0.00 C ATOM 584 CG GLU A 122 -0.039 10.975 1.810 1.00 0.00 C ATOM 585 CD GLU A 122 0.606 12.285 1.389 1.00 0.00 C ATOM 586 OE1 GLU A 122 1.098 13.025 2.266 1.00 0.00 O ATOM 587 OE2 GLU A 122 0.624 12.582 0.177 1.00 0.00 O ATOM 0 H GLU A 122 2.508 8.748 4.128 1.00 0.00 H new ATOM 0 HA GLU A 122 1.598 11.549 3.861 1.00 0.00 H new ATOM 0 HB2 GLU A 122 1.817 9.911 1.889 1.00 0.00 H new ATOM 0 HB3 GLU A 122 0.464 9.045 2.590 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -0.449 10.480 0.930 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -0.876 11.187 2.476 1.00 0.00 H new ATOM 594 N GLY A 123 0.589 9.637 6.021 1.00 0.00 N ATOM 595 CA GLY A 123 -0.341 9.186 7.055 1.00 0.00 C ATOM 596 C GLY A 123 -1.273 10.230 7.656 1.00 0.00 C ATOM 597 O GLY A 123 -1.908 9.939 8.665 1.00 0.00 O ATOM 0 H GLY A 123 1.561 9.409 6.231 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -0.954 8.389 6.634 1.00 0.00 H new ATOM 0 HA3 GLY A 123 0.241 8.747 7.865 1.00 0.00 H new ATOM 601 N VAL A 124 -1.288 11.437 7.094 1.00 0.00 N ATOM 602 CA VAL A 124 -2.222 12.506 7.475 1.00 0.00 C ATOM 603 C VAL A 124 -3.567 11.958 7.954 1.00 0.00 C ATOM 604 O VAL A 124 -4.448 11.679 7.140 1.00 0.00 O ATOM 605 CB VAL A 124 -2.496 13.429 6.275 1.00 0.00 C ATOM 606 CG1 VAL A 124 -3.542 14.476 6.632 1.00 0.00 C ATOM 607 CG2 VAL A 124 -1.209 14.071 5.779 1.00 0.00 C ATOM 0 H VAL A 124 -0.645 11.708 6.350 1.00 0.00 H new ATOM 0 HA VAL A 124 -1.748 13.052 8.291 1.00 0.00 H new ATOM 0 HB VAL A 124 -2.895 12.825 5.460 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -3.722 15.119 5.770 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -4.471 13.981 6.915 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -3.183 15.079 7.466 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -1.429 14.719 4.930 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -0.764 14.661 6.580 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -0.510 13.294 5.470 1.00 0.00 H new ATOM 617 N GLN A 125 -3.705 11.828 9.276 1.00 0.00 N ATOM 618 CA GLN A 125 -4.874 11.206 9.895 1.00 0.00 C ATOM 619 C GLN A 125 -5.146 9.832 9.285 1.00 0.00 C ATOM 620 O GLN A 125 -5.697 9.713 8.191 1.00 0.00 O ATOM 621 CB GLN A 125 -6.104 12.108 9.791 1.00 0.00 C ATOM 622 CG GLN A 125 -5.950 13.417 10.547 1.00 0.00 C ATOM 623 CD GLN A 125 -7.239 14.201 10.628 1.00 0.00 C ATOM 624 OE1 GLN A 125 -8.330 13.630 10.656 1.00 0.00 O ATOM 625 NE2 GLN A 125 -7.125 15.518 10.657 1.00 0.00 N ATOM 0 H GLN A 125 -3.008 12.152 9.946 1.00 0.00 H new ATOM 0 HA GLN A 125 -4.657 11.068 10.954 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -6.301 12.323 8.741 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -6.973 11.573 10.176 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -5.593 13.209 11.555 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -5.190 14.026 10.059 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -6.202 15.951 10.632 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -7.960 16.101 10.704 1.00 0.00 H new ATOM 634 N ASP A 126 -4.784 8.797 10.033 1.00 0.00 N ATOM 635 CA ASP A 126 -4.778 7.418 9.538 1.00 0.00 C ATOM 636 C ASP A 126 -6.148 6.972 9.007 1.00 0.00 C ATOM 637 O ASP A 126 -6.261 5.948 8.330 1.00 0.00 O ATOM 638 CB ASP A 126 -4.310 6.484 10.658 1.00 0.00 C ATOM 639 CG ASP A 126 -4.249 5.034 10.233 1.00 0.00 C ATOM 640 OD1 ASP A 126 -3.313 4.665 9.498 1.00 0.00 O ATOM 641 OD2 ASP A 126 -5.145 4.255 10.634 1.00 0.00 O ATOM 0 H ASP A 126 -4.485 8.886 11.004 1.00 0.00 H new ATOM 0 HA ASP A 126 -4.089 7.370 8.695 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -3.323 6.799 10.997 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -4.985 6.579 11.509 1.00 0.00 H new ATOM 646 N ASP A 127 -7.186 7.741 9.295 1.00 0.00 N ATOM 647 CA ASP A 127 -8.530 7.383 8.869 1.00 0.00 C ATOM 648 C ASP A 127 -8.964 8.145 7.610 1.00 0.00 C ATOM 649 O ASP A 127 -9.916 7.738 6.942 1.00 0.00 O ATOM 650 CB ASP A 127 -9.525 7.633 10.006 1.00 0.00 C ATOM 651 CG ASP A 127 -10.912 7.116 9.686 1.00 0.00 C ATOM 652 OD1 ASP A 127 -11.111 5.878 9.708 1.00 0.00 O ATOM 653 OD2 ASP A 127 -11.815 7.939 9.438 1.00 0.00 O ATOM 0 H ASP A 127 -7.125 8.614 9.820 1.00 0.00 H new ATOM 0 HA ASP A 127 -8.520 6.322 8.618 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -9.162 7.152 10.914 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -9.577 8.702 10.210 1.00 0.00 H new ATOM 658 N LEU A 128 -8.265 9.231 7.259 1.00 0.00 N ATOM 659 CA LEU A 128 -8.682 10.055 6.124 1.00 0.00 C ATOM 660 C LEU A 128 -8.241 9.460 4.794 1.00 0.00 C ATOM 661 O LEU A 128 -8.696 9.889 3.732 1.00 0.00 O ATOM 662 CB LEU A 128 -8.127 11.469 6.242 1.00 0.00 C ATOM 663 CG LEU A 128 -8.715 12.314 7.364 1.00 0.00 C ATOM 664 CD1 LEU A 128 -8.110 13.701 7.326 1.00 0.00 C ATOM 665 CD2 LEU A 128 -10.230 12.390 7.251 1.00 0.00 C ATOM 0 H LEU A 128 -7.423 9.554 7.736 1.00 0.00 H new ATOM 0 HA LEU A 128 -9.771 10.085 6.148 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -7.048 11.406 6.386 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -8.293 11.986 5.297 1.00 0.00 H new ATOM 0 HG LEU A 128 -8.475 11.845 8.318 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -8.532 14.304 8.130 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -7.030 13.630 7.454 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -8.332 14.169 6.367 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -10.625 12.999 8.064 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -10.502 12.839 6.296 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -10.650 11.386 7.312 1.00 0.00 H new ATOM 677 N PHE A 129 -7.342 8.495 4.843 1.00 0.00 N ATOM 678 CA PHE A 129 -6.853 7.872 3.625 1.00 0.00 C ATOM 679 C PHE A 129 -7.060 6.364 3.635 1.00 0.00 C ATOM 680 O PHE A 129 -7.087 5.728 4.691 1.00 0.00 O ATOM 681 CB PHE A 129 -5.372 8.199 3.409 1.00 0.00 C ATOM 682 CG PHE A 129 -4.435 7.553 4.388 1.00 0.00 C ATOM 683 CD1 PHE A 129 -4.105 8.188 5.573 1.00 0.00 C ATOM 684 CD2 PHE A 129 -3.870 6.316 4.117 1.00 0.00 C ATOM 685 CE1 PHE A 129 -3.236 7.601 6.468 1.00 0.00 C ATOM 686 CE2 PHE A 129 -3.001 5.723 5.008 1.00 0.00 C ATOM 687 CZ PHE A 129 -2.682 6.367 6.184 1.00 0.00 C ATOM 0 H PHE A 129 -6.938 8.127 5.704 1.00 0.00 H new ATOM 0 HA PHE A 129 -7.433 8.281 2.798 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -5.090 7.893 2.402 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -5.242 9.280 3.462 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -4.533 9.154 5.799 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -4.114 5.810 3.195 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -2.988 8.105 7.390 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -2.572 4.757 4.785 1.00 0.00 H new ATOM 0 HZ PHE A 129 -1.999 5.908 6.883 1.00 0.00 H new ATOM 697 N TRP A 130 -7.217 5.808 2.446 1.00 0.00 N ATOM 698 CA TRP A 130 -7.266 4.367 2.258 1.00 0.00 C ATOM 699 C TRP A 130 -6.699 4.048 0.880 1.00 0.00 C ATOM 700 O TRP A 130 -6.658 4.915 0.013 1.00 0.00 O ATOM 701 CB TRP A 130 -8.698 3.830 2.414 1.00 0.00 C ATOM 702 CG TRP A 130 -9.568 3.979 1.197 1.00 0.00 C ATOM 703 CD1 TRP A 130 -9.946 2.981 0.352 1.00 0.00 C ATOM 704 CD2 TRP A 130 -10.167 5.179 0.688 1.00 0.00 C ATOM 705 NE1 TRP A 130 -10.747 3.478 -0.644 1.00 0.00 N ATOM 706 CE2 TRP A 130 -10.894 4.825 -0.464 1.00 0.00 C ATOM 707 CE3 TRP A 130 -10.161 6.516 1.093 1.00 0.00 C ATOM 708 CZ2 TRP A 130 -11.604 5.755 -1.214 1.00 0.00 C ATOM 709 CZ3 TRP A 130 -10.865 7.439 0.344 1.00 0.00 C ATOM 710 CH2 TRP A 130 -11.579 7.053 -0.797 1.00 0.00 C ATOM 0 H TRP A 130 -7.314 6.343 1.583 1.00 0.00 H new ATOM 0 HA TRP A 130 -6.668 3.875 3.025 1.00 0.00 H new ATOM 0 HB2 TRP A 130 -8.647 2.774 2.679 1.00 0.00 H new ATOM 0 HB3 TRP A 130 -9.174 4.345 3.248 1.00 0.00 H new ATOM 0 HD1 TRP A 130 -9.656 1.945 0.452 1.00 0.00 H new ATOM 0 HE1 TRP A 130 -11.165 2.931 -1.397 1.00 0.00 H new ATOM 0 HE3 TRP A 130 -9.617 6.822 1.974 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 -12.155 5.460 -2.095 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 -10.865 8.477 0.644 1.00 0.00 H new ATOM 0 HH2 TRP A 130 -12.121 7.799 -1.359 1.00 0.00 H new ATOM 721 N LEU A 131 -6.243 2.827 0.670 1.00 0.00 N ATOM 722 CA LEU A 131 -5.568 2.500 -0.578 1.00 0.00 C ATOM 723 C LEU A 131 -6.463 1.664 -1.485 1.00 0.00 C ATOM 724 O LEU A 131 -7.116 0.724 -1.032 1.00 0.00 O ATOM 725 CB LEU A 131 -4.249 1.753 -0.319 1.00 0.00 C ATOM 726 CG LEU A 131 -3.163 2.532 0.439 1.00 0.00 C ATOM 727 CD1 LEU A 131 -3.489 2.642 1.923 1.00 0.00 C ATOM 728 CD2 LEU A 131 -1.808 1.870 0.245 1.00 0.00 C ATOM 0 H LEU A 131 -6.324 2.056 1.333 1.00 0.00 H new ATOM 0 HA LEU A 131 -5.343 3.442 -1.079 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -4.474 0.846 0.242 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -3.839 1.440 -1.279 1.00 0.00 H new ATOM 0 HG LEU A 131 -3.129 3.541 0.029 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -2.700 3.199 2.429 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -4.438 3.162 2.049 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -3.562 1.644 2.354 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -1.048 2.432 0.787 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -1.844 0.849 0.625 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -1.559 1.854 -0.816 1.00 0.00 H new ATOM 740 N THR A 132 -6.489 2.019 -2.763 1.00 0.00 N ATOM 741 CA THR A 132 -7.271 1.289 -3.748 1.00 0.00 C ATOM 742 C THR A 132 -6.393 0.804 -4.897 1.00 0.00 C ATOM 743 O THR A 132 -5.706 1.598 -5.535 1.00 0.00 O ATOM 744 CB THR A 132 -8.395 2.173 -4.325 1.00 0.00 C ATOM 745 OG1 THR A 132 -7.863 3.443 -4.720 1.00 0.00 O ATOM 746 CG2 THR A 132 -9.507 2.376 -3.311 1.00 0.00 C ATOM 0 H THR A 132 -5.973 2.813 -3.142 1.00 0.00 H new ATOM 0 HA THR A 132 -7.707 0.430 -3.238 1.00 0.00 H new ATOM 0 HB THR A 132 -8.813 1.666 -5.195 1.00 0.00 H new ATOM 0 HG1 THR A 132 -8.539 3.937 -5.229 1.00 0.00 H new ATOM 0 HG21 THR A 132 -10.286 3.003 -3.745 1.00 0.00 H new ATOM 0 HG22 THR A 132 -9.930 1.410 -3.037 1.00 0.00 H new ATOM 0 HG23 THR A 132 -9.104 2.861 -2.422 1.00 0.00 H new ATOM 754 N PHE A 133 -6.401 -0.498 -5.146 1.00 0.00 N ATOM 755 CA PHE A 133 -5.725 -1.040 -6.317 1.00 0.00 C ATOM 756 C PHE A 133 -6.721 -1.248 -7.454 1.00 0.00 C ATOM 757 O PHE A 133 -6.693 -0.536 -8.457 1.00 0.00 O ATOM 758 CB PHE A 133 -4.998 -2.355 -5.988 1.00 0.00 C ATOM 759 CG PHE A 133 -4.659 -3.159 -7.216 1.00 0.00 C ATOM 760 CD1 PHE A 133 -3.833 -2.639 -8.201 1.00 0.00 C ATOM 761 CD2 PHE A 133 -5.198 -4.422 -7.396 1.00 0.00 C ATOM 762 CE1 PHE A 133 -3.560 -3.361 -9.344 1.00 0.00 C ATOM 763 CE2 PHE A 133 -4.920 -5.151 -8.534 1.00 0.00 C ATOM 764 CZ PHE A 133 -4.104 -4.619 -9.511 1.00 0.00 C ATOM 0 H PHE A 133 -6.863 -1.193 -4.560 1.00 0.00 H new ATOM 0 HA PHE A 133 -4.973 -0.318 -6.635 1.00 0.00 H new ATOM 0 HB2 PHE A 133 -4.082 -2.131 -5.442 1.00 0.00 H new ATOM 0 HB3 PHE A 133 -5.624 -2.955 -5.328 1.00 0.00 H new ATOM 0 HD1 PHE A 133 -3.399 -1.659 -8.072 1.00 0.00 H new ATOM 0 HD2 PHE A 133 -5.843 -4.841 -6.638 1.00 0.00 H new ATOM 0 HE1 PHE A 133 -2.921 -2.943 -10.108 1.00 0.00 H new ATOM 0 HE2 PHE A 133 -5.341 -6.138 -8.660 1.00 0.00 H new ATOM 0 HZ PHE A 133 -3.891 -5.186 -10.405 1.00 0.00 H new ATOM 774 N GLU A 134 -7.604 -2.220 -7.281 1.00 0.00 N ATOM 775 CA GLU A 134 -8.623 -2.518 -8.281 1.00 0.00 C ATOM 776 C GLU A 134 -9.655 -1.399 -8.334 1.00 0.00 C ATOM 777 O GLU A 134 -10.229 -1.097 -9.380 1.00 0.00 O ATOM 778 CB GLU A 134 -9.350 -3.816 -7.937 1.00 0.00 C ATOM 779 CG GLU A 134 -8.485 -5.056 -7.970 1.00 0.00 C ATOM 780 CD GLU A 134 -9.297 -6.301 -7.705 1.00 0.00 C ATOM 781 OE1 GLU A 134 -10.047 -6.721 -8.612 1.00 0.00 O ATOM 782 OE2 GLU A 134 -9.202 -6.853 -6.593 1.00 0.00 O ATOM 0 H GLU A 134 -7.637 -2.818 -6.456 1.00 0.00 H new ATOM 0 HA GLU A 134 -8.123 -2.616 -9.244 1.00 0.00 H new ATOM 0 HB2 GLU A 134 -9.785 -3.720 -6.942 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -10.177 -3.948 -8.635 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -7.999 -5.137 -8.942 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -7.694 -4.970 -7.225 1.00 0.00 H new ATOM 789 N GLY A 135 -9.862 -0.792 -7.177 1.00 0.00 N ATOM 790 CA GLY A 135 -10.946 0.141 -6.985 1.00 0.00 C ATOM 791 C GLY A 135 -11.562 -0.086 -5.626 1.00 0.00 C ATOM 792 O GLY A 135 -12.168 0.806 -5.034 1.00 0.00 O ATOM 0 H GLY A 135 -9.282 -0.935 -6.350 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -10.579 1.164 -7.065 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -11.697 0.010 -7.764 1.00 0.00 H new ATOM 796 N LYS A 136 -11.389 -1.310 -5.141 1.00 0.00 N ATOM 797 CA LYS A 136 -11.765 -1.678 -3.787 1.00 0.00 C ATOM 798 C LYS A 136 -10.638 -1.326 -2.821 1.00 0.00 C ATOM 799 O LYS A 136 -9.467 -1.296 -3.215 1.00 0.00 O ATOM 800 CB LYS A 136 -12.057 -3.179 -3.707 1.00 0.00 C ATOM 801 CG LYS A 136 -13.340 -3.601 -4.404 1.00 0.00 C ATOM 802 CD LYS A 136 -13.460 -5.117 -4.465 1.00 0.00 C ATOM 803 CE LYS A 136 -13.323 -5.753 -3.087 1.00 0.00 C ATOM 804 NZ LYS A 136 -13.327 -7.238 -3.162 1.00 0.00 N ATOM 0 H LYS A 136 -10.983 -2.075 -5.679 1.00 0.00 H new ATOM 0 HA LYS A 136 -12.664 -1.125 -3.512 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -11.222 -3.724 -4.146 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -12.113 -3.472 -2.659 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -14.198 -3.187 -3.874 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -13.360 -3.191 -5.414 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -14.424 -5.388 -4.896 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -12.691 -5.516 -5.127 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -12.397 -5.415 -2.621 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -14.141 -5.419 -2.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -13.232 -7.634 -2.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -14.221 -7.562 -3.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -12.531 -7.558 -3.750 1.00 0.00 H new ATOM 818 N PRO A 137 -10.980 -1.042 -1.556 1.00 0.00 N ATOM 819 CA PRO A 137 -9.992 -0.768 -0.508 1.00 0.00 C ATOM 820 C PRO A 137 -9.159 -2.002 -0.174 1.00 0.00 C ATOM 821 O PRO A 137 -9.698 -3.096 -0.002 1.00 0.00 O ATOM 822 CB PRO A 137 -10.845 -0.367 0.705 1.00 0.00 C ATOM 823 CG PRO A 137 -12.200 -0.070 0.158 1.00 0.00 C ATOM 824 CD PRO A 137 -12.355 -0.953 -1.045 1.00 0.00 C ATOM 0 HA PRO A 137 -9.280 -0.002 -0.814 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -10.886 -1.172 1.439 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -10.426 0.504 1.209 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -12.974 -0.276 0.897 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -12.291 0.982 -0.114 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -12.753 -1.932 -0.780 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -13.034 -0.521 -1.780 1.00 0.00 H new ATOM 832 N LEU A 138 -7.847 -1.821 -0.092 1.00 0.00 N ATOM 833 CA LEU A 138 -6.954 -2.912 0.268 1.00 0.00 C ATOM 834 C LEU A 138 -7.189 -3.323 1.714 1.00 0.00 C ATOM 835 O LEU A 138 -7.058 -2.507 2.628 1.00 0.00 O ATOM 836 CB LEU A 138 -5.487 -2.509 0.090 1.00 0.00 C ATOM 837 CG LEU A 138 -5.082 -2.041 -1.310 1.00 0.00 C ATOM 838 CD1 LEU A 138 -3.570 -1.888 -1.392 1.00 0.00 C ATOM 839 CD2 LEU A 138 -5.576 -3.010 -2.372 1.00 0.00 C ATOM 0 H LEU A 138 -7.380 -0.932 -0.269 1.00 0.00 H new ATOM 0 HA LEU A 138 -7.168 -3.751 -0.395 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -5.262 -1.710 0.797 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.862 -3.360 0.361 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.546 -1.073 -1.496 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.292 -1.555 -2.392 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.238 -1.153 -0.659 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -3.095 -2.847 -1.184 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -5.275 -2.654 -3.357 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -5.145 -3.995 -2.195 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -6.663 -3.076 -2.327 1.00 0.00 H new ATOM 851 N GLU A 139 -7.549 -4.580 1.914 1.00 0.00 N ATOM 852 CA GLU A 139 -7.771 -5.097 3.253 1.00 0.00 C ATOM 853 C GLU A 139 -6.443 -5.298 3.971 1.00 0.00 C ATOM 854 O GLU A 139 -5.589 -6.055 3.513 1.00 0.00 O ATOM 855 CB GLU A 139 -8.543 -6.414 3.196 1.00 0.00 C ATOM 856 CG GLU A 139 -9.969 -6.255 2.695 1.00 0.00 C ATOM 857 CD GLU A 139 -10.684 -7.577 2.523 1.00 0.00 C ATOM 858 OE1 GLU A 139 -10.743 -8.361 3.493 1.00 0.00 O ATOM 859 OE2 GLU A 139 -11.192 -7.843 1.412 1.00 0.00 O ATOM 0 H GLU A 139 -7.693 -5.260 1.167 1.00 0.00 H new ATOM 0 HA GLU A 139 -8.363 -4.370 3.809 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -8.013 -7.110 2.546 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -8.562 -6.859 4.191 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -10.528 -5.634 3.395 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -9.957 -5.728 1.741 1.00 0.00 H new ATOM 866 N ASP A 140 -6.281 -4.623 5.104 1.00 0.00 N ATOM 867 CA ASP A 140 -5.045 -4.709 5.881 1.00 0.00 C ATOM 868 C ASP A 140 -4.893 -6.100 6.487 1.00 0.00 C ATOM 869 O ASP A 140 -3.807 -6.499 6.907 1.00 0.00 O ATOM 870 CB ASP A 140 -5.021 -3.645 6.982 1.00 0.00 C ATOM 871 CG ASP A 140 -5.891 -3.992 8.171 1.00 0.00 C ATOM 872 OD1 ASP A 140 -7.123 -4.095 8.005 1.00 0.00 O ATOM 873 OD2 ASP A 140 -5.347 -4.159 9.282 1.00 0.00 O ATOM 0 H ASP A 140 -6.989 -4.009 5.507 1.00 0.00 H new ATOM 0 HA ASP A 140 -4.207 -4.527 5.209 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -3.994 -3.506 7.321 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -5.351 -2.693 6.565 1.00 0.00 H new ATOM 878 N GLN A 141 -5.996 -6.833 6.501 1.00 0.00 N ATOM 879 CA GLN A 141 -6.022 -8.201 7.000 1.00 0.00 C ATOM 880 C GLN A 141 -5.586 -9.196 5.926 1.00 0.00 C ATOM 881 O GLN A 141 -5.472 -10.394 6.188 1.00 0.00 O ATOM 882 CB GLN A 141 -7.427 -8.542 7.502 1.00 0.00 C ATOM 883 CG GLN A 141 -8.539 -8.140 6.544 1.00 0.00 C ATOM 884 CD GLN A 141 -9.918 -8.475 7.077 1.00 0.00 C ATOM 885 OE1 GLN A 141 -10.133 -8.526 8.287 1.00 0.00 O ATOM 886 NE2 GLN A 141 -10.865 -8.680 6.179 1.00 0.00 N ATOM 0 H GLN A 141 -6.899 -6.497 6.167 1.00 0.00 H new ATOM 0 HA GLN A 141 -5.315 -8.276 7.826 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -7.487 -9.615 7.683 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -7.590 -8.048 8.460 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -8.478 -7.069 6.352 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -8.390 -8.644 5.589 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -10.645 -8.628 5.184 1.00 0.00 H new ATOM 0 HE22 GLN A 141 -11.817 -8.890 6.480 1.00 0.00 H new ATOM 895 N LEU A 142 -5.342 -8.696 4.722 1.00 0.00 N ATOM 896 CA LEU A 142 -4.888 -9.536 3.623 1.00 0.00 C ATOM 897 C LEU A 142 -3.452 -9.177 3.243 1.00 0.00 C ATOM 898 O LEU A 142 -2.978 -8.082 3.554 1.00 0.00 O ATOM 899 CB LEU A 142 -5.813 -9.382 2.410 1.00 0.00 C ATOM 900 CG LEU A 142 -7.250 -9.872 2.617 1.00 0.00 C ATOM 901 CD1 LEU A 142 -8.047 -9.742 1.332 1.00 0.00 C ATOM 902 CD2 LEU A 142 -7.265 -11.313 3.104 1.00 0.00 C ATOM 0 H LEU A 142 -5.451 -7.711 4.482 1.00 0.00 H new ATOM 0 HA LEU A 142 -4.916 -10.576 3.948 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.842 -8.330 2.127 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.378 -9.925 1.571 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.714 -9.247 3.380 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -9.065 -10.095 1.498 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -8.071 -8.697 1.023 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -7.578 -10.341 0.551 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -8.296 -11.639 3.244 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -6.779 -11.952 2.366 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -6.731 -11.382 4.052 1.00 0.00 H new ATOM 914 N PRO A 143 -2.732 -10.102 2.589 1.00 0.00 N ATOM 915 CA PRO A 143 -1.344 -9.877 2.179 1.00 0.00 C ATOM 916 C PRO A 143 -1.221 -8.900 1.010 1.00 0.00 C ATOM 917 O PRO A 143 -2.092 -8.836 0.139 1.00 0.00 O ATOM 918 CB PRO A 143 -0.866 -11.270 1.762 1.00 0.00 C ATOM 919 CG PRO A 143 -2.102 -11.988 1.348 1.00 0.00 C ATOM 920 CD PRO A 143 -3.205 -11.451 2.219 1.00 0.00 C ATOM 0 HA PRO A 143 -0.757 -9.428 2.980 1.00 0.00 H new ATOM 0 HB2 PRO A 143 -0.148 -11.213 0.943 1.00 0.00 H new ATOM 0 HB3 PRO A 143 -0.369 -11.781 2.587 1.00 0.00 H new ATOM 0 HG2 PRO A 143 -2.319 -11.816 0.294 1.00 0.00 H new ATOM 0 HG3 PRO A 143 -1.990 -13.064 1.479 1.00 0.00 H new ATOM 0 HD2 PRO A 143 -4.154 -11.410 1.684 1.00 0.00 H new ATOM 0 HD3 PRO A 143 -3.361 -12.076 3.098 1.00 0.00 H new ATOM 928 N LEU A 144 -0.122 -8.156 0.996 1.00 0.00 N ATOM 929 CA LEU A 144 0.154 -7.196 -0.067 1.00 0.00 C ATOM 930 C LEU A 144 0.379 -7.897 -1.395 1.00 0.00 C ATOM 931 O LEU A 144 -0.043 -7.409 -2.439 1.00 0.00 O ATOM 932 CB LEU A 144 1.382 -6.355 0.282 1.00 0.00 C ATOM 933 CG LEU A 144 1.122 -5.181 1.219 1.00 0.00 C ATOM 934 CD1 LEU A 144 2.430 -4.675 1.804 1.00 0.00 C ATOM 935 CD2 LEU A 144 0.410 -4.064 0.472 1.00 0.00 C ATOM 0 H LEU A 144 0.599 -8.200 1.716 1.00 0.00 H new ATOM 0 HA LEU A 144 -0.716 -6.546 -0.161 1.00 0.00 H new ATOM 0 HB2 LEU A 144 2.129 -7.004 0.738 1.00 0.00 H new ATOM 0 HB3 LEU A 144 1.814 -5.972 -0.642 1.00 0.00 H new ATOM 0 HG LEU A 144 0.484 -5.518 2.036 1.00 0.00 H new ATOM 0 HD11 LEU A 144 2.230 -3.837 2.471 1.00 0.00 H new ATOM 0 HD12 LEU A 144 2.913 -5.477 2.363 1.00 0.00 H new ATOM 0 HD13 LEU A 144 3.087 -4.348 0.998 1.00 0.00 H new ATOM 0 HD21 LEU A 144 0.229 -3.230 1.150 1.00 0.00 H new ATOM 0 HD22 LEU A 144 1.031 -3.728 -0.358 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -0.541 -4.432 0.088 1.00 0.00 H new ATOM 947 N GLY A 145 1.033 -9.054 -1.344 1.00 0.00 N ATOM 948 CA GLY A 145 1.335 -9.797 -2.554 1.00 0.00 C ATOM 949 C GLY A 145 0.093 -10.186 -3.329 1.00 0.00 C ATOM 950 O GLY A 145 0.151 -10.391 -4.536 1.00 0.00 O ATOM 0 H GLY A 145 1.360 -9.491 -0.482 1.00 0.00 H new ATOM 0 HA2 GLY A 145 1.982 -9.196 -3.192 1.00 0.00 H new ATOM 0 HA3 GLY A 145 1.892 -10.697 -2.293 1.00 0.00 H new ATOM 954 N GLU A 146 -1.036 -10.266 -2.643 1.00 0.00 N ATOM 955 CA GLU A 146 -2.281 -10.668 -3.275 1.00 0.00 C ATOM 956 C GLU A 146 -2.771 -9.580 -4.232 1.00 0.00 C ATOM 957 O GLU A 146 -3.429 -9.867 -5.230 1.00 0.00 O ATOM 958 CB GLU A 146 -3.334 -10.974 -2.209 1.00 0.00 C ATOM 959 CG GLU A 146 -4.528 -11.753 -2.734 1.00 0.00 C ATOM 960 CD GLU A 146 -4.941 -12.865 -1.796 1.00 0.00 C ATOM 961 OE1 GLU A 146 -4.277 -13.924 -1.801 1.00 0.00 O ATOM 962 OE2 GLU A 146 -5.926 -12.691 -1.051 1.00 0.00 O ATOM 0 H GLU A 146 -1.115 -10.058 -1.648 1.00 0.00 H new ATOM 0 HA GLU A 146 -2.106 -11.573 -3.857 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -2.868 -11.541 -1.403 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -3.685 -10.036 -1.778 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -5.367 -11.073 -2.881 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -4.285 -12.174 -3.709 1.00 0.00 H new ATOM 969 N TYR A 147 -2.438 -8.330 -3.922 1.00 0.00 N ATOM 970 CA TYR A 147 -2.788 -7.202 -4.783 1.00 0.00 C ATOM 971 C TYR A 147 -1.586 -6.764 -5.621 1.00 0.00 C ATOM 972 O TYR A 147 -1.717 -6.419 -6.796 1.00 0.00 O ATOM 973 CB TYR A 147 -3.256 -6.011 -3.947 1.00 0.00 C ATOM 974 CG TYR A 147 -4.400 -6.305 -3.002 1.00 0.00 C ATOM 975 CD1 TYR A 147 -5.704 -6.422 -3.468 1.00 0.00 C ATOM 976 CD2 TYR A 147 -4.177 -6.438 -1.637 1.00 0.00 C ATOM 977 CE1 TYR A 147 -6.753 -6.659 -2.600 1.00 0.00 C ATOM 978 CE2 TYR A 147 -5.218 -6.682 -0.763 1.00 0.00 C ATOM 979 CZ TYR A 147 -6.505 -6.791 -1.250 1.00 0.00 C ATOM 980 OH TYR A 147 -7.547 -7.012 -0.379 1.00 0.00 O ATOM 0 H TYR A 147 -1.925 -8.071 -3.079 1.00 0.00 H new ATOM 0 HA TYR A 147 -3.593 -7.531 -5.441 1.00 0.00 H new ATOM 0 HB2 TYR A 147 -2.411 -5.639 -3.367 1.00 0.00 H new ATOM 0 HB3 TYR A 147 -3.558 -5.209 -4.621 1.00 0.00 H new ATOM 0 HD1 TYR A 147 -5.901 -6.326 -4.526 1.00 0.00 H new ATOM 0 HD2 TYR A 147 -3.172 -6.349 -1.253 1.00 0.00 H new ATOM 0 HE1 TYR A 147 -7.762 -6.740 -2.977 1.00 0.00 H new ATOM 0 HE2 TYR A 147 -5.026 -6.787 0.295 1.00 0.00 H new ATOM 0 HH TYR A 147 -8.258 -7.505 -0.838 1.00 0.00 H new ATOM 990 N GLY A 148 -0.415 -6.789 -4.997 1.00 0.00 N ATOM 991 CA GLY A 148 0.781 -6.204 -5.580 1.00 0.00 C ATOM 992 C GLY A 148 1.683 -7.210 -6.268 1.00 0.00 C ATOM 993 O GLY A 148 2.802 -6.864 -6.632 1.00 0.00 O ATOM 0 H GLY A 148 -0.270 -7.212 -4.080 1.00 0.00 H new ATOM 0 HA2 GLY A 148 0.486 -5.442 -6.301 1.00 0.00 H new ATOM 0 HA3 GLY A 148 1.346 -5.700 -4.796 1.00 0.00 H new ATOM 997 N LEU A 149 1.214 -8.456 -6.391 1.00 0.00 N ATOM 998 CA LEU A 149 1.997 -9.559 -6.976 1.00 0.00 C ATOM 999 C LEU A 149 2.841 -9.127 -8.182 1.00 0.00 C ATOM 1000 O LEU A 149 3.951 -9.623 -8.381 1.00 0.00 O ATOM 1001 CB LEU A 149 1.083 -10.726 -7.387 1.00 0.00 C ATOM 1002 CG LEU A 149 0.126 -10.467 -8.561 1.00 0.00 C ATOM 1003 CD1 LEU A 149 -0.409 -11.784 -9.102 1.00 0.00 C ATOM 1004 CD2 LEU A 149 -1.034 -9.575 -8.136 1.00 0.00 C ATOM 0 H LEU A 149 0.280 -8.733 -6.089 1.00 0.00 H new ATOM 0 HA LEU A 149 2.683 -9.883 -6.193 1.00 0.00 H new ATOM 0 HB2 LEU A 149 1.712 -11.579 -7.642 1.00 0.00 H new ATOM 0 HB3 LEU A 149 0.489 -11.016 -6.520 1.00 0.00 H new ATOM 0 HG LEU A 149 0.685 -9.955 -9.344 1.00 0.00 H new ATOM 0 HD11 LEU A 149 -1.086 -11.588 -9.933 1.00 0.00 H new ATOM 0 HD12 LEU A 149 0.421 -12.400 -9.448 1.00 0.00 H new ATOM 0 HD13 LEU A 149 -0.946 -12.310 -8.313 1.00 0.00 H new ATOM 0 HD21 LEU A 149 -1.695 -9.408 -8.986 1.00 0.00 H new ATOM 0 HD22 LEU A 149 -1.590 -10.059 -7.333 1.00 0.00 H new ATOM 0 HD23 LEU A 149 -0.647 -8.619 -7.784 1.00 0.00 H new ATOM 1016 N LYS A 150 2.312 -8.218 -8.984 1.00 0.00 N ATOM 1017 CA LYS A 150 3.061 -7.671 -10.102 1.00 0.00 C ATOM 1018 C LYS A 150 3.555 -6.268 -9.758 1.00 0.00 C ATOM 1019 O LYS A 150 2.798 -5.445 -9.243 1.00 0.00 O ATOM 1020 CB LYS A 150 2.201 -7.649 -11.372 1.00 0.00 C ATOM 1021 CG LYS A 150 0.893 -6.893 -11.219 1.00 0.00 C ATOM 1022 CD LYS A 150 0.039 -7.002 -12.466 1.00 0.00 C ATOM 1023 CE LYS A 150 -1.314 -6.337 -12.278 1.00 0.00 C ATOM 1024 NZ LYS A 150 -2.209 -6.580 -13.436 1.00 0.00 N ATOM 0 H LYS A 150 1.369 -7.844 -8.882 1.00 0.00 H new ATOM 0 HA LYS A 150 3.924 -8.309 -10.293 1.00 0.00 H new ATOM 0 HB2 LYS A 150 2.777 -7.199 -12.181 1.00 0.00 H new ATOM 0 HB3 LYS A 150 1.983 -8.675 -11.669 1.00 0.00 H new ATOM 0 HG2 LYS A 150 0.342 -7.286 -10.364 1.00 0.00 H new ATOM 0 HG3 LYS A 150 1.100 -5.844 -11.009 1.00 0.00 H new ATOM 0 HD2 LYS A 150 0.559 -6.539 -13.305 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -0.103 -8.053 -12.719 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -1.783 -6.716 -11.370 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -1.177 -5.264 -12.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -3.123 -6.111 -13.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -1.773 -6.196 -14.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -2.360 -7.603 -13.550 1.00 0.00 H new ATOM 1038 N PRO A 151 4.835 -5.976 -10.038 1.00 0.00 N ATOM 1039 CA PRO A 151 5.441 -4.666 -9.739 1.00 0.00 C ATOM 1040 C PRO A 151 4.757 -3.522 -10.489 1.00 0.00 C ATOM 1041 O PRO A 151 5.041 -2.346 -10.255 1.00 0.00 O ATOM 1042 CB PRO A 151 6.891 -4.824 -10.213 1.00 0.00 C ATOM 1043 CG PRO A 151 7.125 -6.292 -10.273 1.00 0.00 C ATOM 1044 CD PRO A 151 5.805 -6.902 -10.643 1.00 0.00 C ATOM 0 HA PRO A 151 5.349 -4.409 -8.684 1.00 0.00 H new ATOM 0 HB2 PRO A 151 7.039 -4.362 -11.189 1.00 0.00 H new ATOM 0 HB3 PRO A 151 7.585 -4.343 -9.524 1.00 0.00 H new ATOM 0 HG2 PRO A 151 7.889 -6.536 -11.011 1.00 0.00 H new ATOM 0 HG3 PRO A 151 7.476 -6.672 -9.313 1.00 0.00 H new ATOM 0 HD2 PRO A 151 5.680 -6.969 -11.724 1.00 0.00 H new ATOM 0 HD3 PRO A 151 5.701 -7.912 -10.246 1.00 0.00 H new ATOM 1052 N LEU A 152 3.853 -3.879 -11.388 1.00 0.00 N ATOM 1053 CA LEU A 152 3.124 -2.904 -12.179 1.00 0.00 C ATOM 1054 C LEU A 152 1.783 -2.569 -11.533 1.00 0.00 C ATOM 1055 O LEU A 152 1.020 -1.756 -12.063 1.00 0.00 O ATOM 1056 CB LEU A 152 2.910 -3.421 -13.605 1.00 0.00 C ATOM 1057 CG LEU A 152 4.186 -3.603 -14.428 1.00 0.00 C ATOM 1058 CD1 LEU A 152 3.858 -4.165 -15.803 1.00 0.00 C ATOM 1059 CD2 LEU A 152 4.928 -2.282 -14.553 1.00 0.00 C ATOM 0 H LEU A 152 3.606 -4.848 -11.588 1.00 0.00 H new ATOM 0 HA LEU A 152 3.720 -1.993 -12.222 1.00 0.00 H new ATOM 0 HB2 LEU A 152 2.390 -4.378 -13.554 1.00 0.00 H new ATOM 0 HB3 LEU A 152 2.253 -2.729 -14.131 1.00 0.00 H new ATOM 0 HG LEU A 152 4.832 -4.314 -13.913 1.00 0.00 H new ATOM 0 HD11 LEU A 152 4.778 -4.288 -16.375 1.00 0.00 H new ATOM 0 HD12 LEU A 152 3.367 -5.132 -15.693 1.00 0.00 H new ATOM 0 HD13 LEU A 152 3.194 -3.478 -16.328 1.00 0.00 H new ATOM 0 HD21 LEU A 152 5.834 -2.428 -15.141 1.00 0.00 H new ATOM 0 HD22 LEU A 152 4.288 -1.551 -15.047 1.00 0.00 H new ATOM 0 HD23 LEU A 152 5.195 -1.919 -13.560 1.00 0.00 H new ATOM 1071 N SER A 153 1.488 -3.201 -10.400 1.00 0.00 N ATOM 1072 CA SER A 153 0.290 -2.872 -9.644 1.00 0.00 C ATOM 1073 C SER A 153 0.382 -1.446 -9.111 1.00 0.00 C ATOM 1074 O SER A 153 1.128 -1.166 -8.172 1.00 0.00 O ATOM 1075 CB SER A 153 0.085 -3.853 -8.487 1.00 0.00 C ATOM 1076 OG SER A 153 -0.231 -5.151 -8.958 1.00 0.00 O ATOM 0 H SER A 153 2.060 -3.939 -9.990 1.00 0.00 H new ATOM 0 HA SER A 153 -0.567 -2.950 -10.313 1.00 0.00 H new ATOM 0 HB2 SER A 153 0.989 -3.895 -7.880 1.00 0.00 H new ATOM 0 HB3 SER A 153 -0.716 -3.494 -7.841 1.00 0.00 H new ATOM 0 HG SER A 153 -0.735 -5.635 -8.270 1.00 0.00 H new ATOM 1082 N THR A 154 -0.360 -0.543 -9.736 1.00 0.00 N ATOM 1083 CA THR A 154 -0.370 0.842 -9.320 1.00 0.00 C ATOM 1084 C THR A 154 -1.321 1.030 -8.149 1.00 0.00 C ATOM 1085 O THR A 154 -2.540 1.065 -8.318 1.00 0.00 O ATOM 1086 CB THR A 154 -0.781 1.767 -10.480 1.00 0.00 C ATOM 1087 OG1 THR A 154 -0.026 1.431 -11.653 1.00 0.00 O ATOM 1088 CG2 THR A 154 -0.543 3.228 -10.123 1.00 0.00 C ATOM 0 H THR A 154 -0.962 -0.750 -10.533 1.00 0.00 H new ATOM 0 HA THR A 154 0.641 1.108 -9.011 1.00 0.00 H new ATOM 0 HB THR A 154 -1.845 1.627 -10.671 1.00 0.00 H new ATOM 0 HG1 THR A 154 -0.290 2.019 -12.391 1.00 0.00 H new ATOM 0 HG21 THR A 154 -0.841 3.860 -10.959 1.00 0.00 H new ATOM 0 HG22 THR A 154 -1.132 3.488 -9.243 1.00 0.00 H new ATOM 0 HG23 THR A 154 0.515 3.383 -9.911 1.00 0.00 H new ATOM 1096 N VAL A 155 -0.761 1.112 -6.957 1.00 0.00 N ATOM 1097 CA VAL A 155 -1.560 1.282 -5.763 1.00 0.00 C ATOM 1098 C VAL A 155 -1.925 2.749 -5.583 1.00 0.00 C ATOM 1099 O VAL A 155 -1.079 3.575 -5.236 1.00 0.00 O ATOM 1100 CB VAL A 155 -0.820 0.767 -4.509 1.00 0.00 C ATOM 1101 CG1 VAL A 155 -1.700 0.898 -3.276 1.00 0.00 C ATOM 1102 CG2 VAL A 155 -0.378 -0.678 -4.701 1.00 0.00 C ATOM 0 H VAL A 155 0.244 1.063 -6.792 1.00 0.00 H new ATOM 0 HA VAL A 155 -2.469 0.693 -5.883 1.00 0.00 H new ATOM 0 HB VAL A 155 0.069 1.380 -4.362 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -1.161 0.530 -2.403 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -1.962 1.945 -3.126 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -2.609 0.313 -3.414 1.00 0.00 H new ATOM 0 HG21 VAL A 155 0.141 -1.022 -3.806 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -1.252 -1.305 -4.877 1.00 0.00 H new ATOM 0 HG23 VAL A 155 0.293 -0.742 -5.557 1.00 0.00 H new ATOM 1112 N PHE A 156 -3.178 3.075 -5.848 1.00 0.00 N ATOM 1113 CA PHE A 156 -3.652 4.434 -5.685 1.00 0.00 C ATOM 1114 C PHE A 156 -4.025 4.686 -4.234 1.00 0.00 C ATOM 1115 O PHE A 156 -5.064 4.229 -3.754 1.00 0.00 O ATOM 1116 CB PHE A 156 -4.848 4.709 -6.600 1.00 0.00 C ATOM 1117 CG PHE A 156 -4.498 4.730 -8.059 1.00 0.00 C ATOM 1118 CD1 PHE A 156 -3.953 5.868 -8.636 1.00 0.00 C ATOM 1119 CD2 PHE A 156 -4.716 3.619 -8.858 1.00 0.00 C ATOM 1120 CE1 PHE A 156 -3.632 5.896 -9.978 1.00 0.00 C ATOM 1121 CE2 PHE A 156 -4.397 3.642 -10.203 1.00 0.00 C ATOM 1122 CZ PHE A 156 -3.854 4.782 -10.764 1.00 0.00 C ATOM 0 H PHE A 156 -3.884 2.416 -6.177 1.00 0.00 H new ATOM 0 HA PHE A 156 -2.848 5.115 -5.966 1.00 0.00 H new ATOM 0 HB2 PHE A 156 -5.608 3.947 -6.429 1.00 0.00 H new ATOM 0 HB3 PHE A 156 -5.290 5.667 -6.327 1.00 0.00 H new ATOM 0 HD1 PHE A 156 -3.778 6.743 -8.027 1.00 0.00 H new ATOM 0 HD2 PHE A 156 -5.140 2.725 -8.425 1.00 0.00 H new ATOM 0 HE1 PHE A 156 -3.207 6.788 -10.413 1.00 0.00 H new ATOM 0 HE2 PHE A 156 -4.572 2.769 -10.815 1.00 0.00 H new ATOM 0 HZ PHE A 156 -3.604 4.802 -11.814 1.00 0.00 H new ATOM 1132 N MET A 157 -3.152 5.385 -3.532 1.00 0.00 N ATOM 1133 CA MET A 157 -3.405 5.752 -2.150 1.00 0.00 C ATOM 1134 C MET A 157 -4.352 6.944 -2.135 1.00 0.00 C ATOM 1135 O MET A 157 -3.992 8.036 -2.566 1.00 0.00 O ATOM 1136 CB MET A 157 -2.089 6.079 -1.437 1.00 0.00 C ATOM 1137 CG MET A 157 -2.153 5.964 0.079 1.00 0.00 C ATOM 1138 SD MET A 157 -3.227 7.189 0.844 1.00 0.00 S ATOM 1139 CE MET A 157 -2.359 8.697 0.432 1.00 0.00 C ATOM 0 H MET A 157 -2.258 5.711 -3.898 1.00 0.00 H new ATOM 0 HA MET A 157 -3.865 4.920 -1.617 1.00 0.00 H new ATOM 0 HB2 MET A 157 -1.312 5.410 -1.808 1.00 0.00 H new ATOM 0 HB3 MET A 157 -1.789 7.093 -1.700 1.00 0.00 H new ATOM 0 HG2 MET A 157 -2.504 4.967 0.346 1.00 0.00 H new ATOM 0 HG3 MET A 157 -1.147 6.068 0.487 1.00 0.00 H new ATOM 0 HE1 MET A 157 -2.506 9.430 1.225 1.00 0.00 H new ATOM 0 HE2 MET A 157 -1.295 8.487 0.325 1.00 0.00 H new ATOM 0 HE3 MET A 157 -2.746 9.095 -0.506 1.00 0.00 H new ATOM 1149 N ASN A 158 -5.562 6.724 -1.655 1.00 0.00 N ATOM 1150 CA ASN A 158 -6.636 7.694 -1.798 1.00 0.00 C ATOM 1151 C ASN A 158 -6.766 8.599 -0.577 1.00 0.00 C ATOM 1152 O ASN A 158 -7.117 8.143 0.510 1.00 0.00 O ATOM 1153 CB ASN A 158 -7.953 6.958 -2.045 1.00 0.00 C ATOM 1154 CG ASN A 158 -8.520 7.222 -3.425 1.00 0.00 C ATOM 1155 OD1 ASN A 158 -9.238 8.197 -3.640 1.00 0.00 O ATOM 1156 ND2 ASN A 158 -8.219 6.340 -4.365 1.00 0.00 N ATOM 0 H ASN A 158 -5.829 5.874 -1.158 1.00 0.00 H new ATOM 0 HA ASN A 158 -6.396 8.334 -2.647 1.00 0.00 H new ATOM 0 HB2 ASN A 158 -7.795 5.887 -1.920 1.00 0.00 H new ATOM 0 HB3 ASN A 158 -8.681 7.262 -1.293 1.00 0.00 H new ATOM 0 HD21 ASN A 158 -8.586 6.456 -5.309 1.00 0.00 H new ATOM 0 HD22 ASN A 158 -7.620 5.545 -4.145 1.00 0.00 H new ATOM 1163 N LEU A 159 -6.473 9.882 -0.768 1.00 0.00 N ATOM 1164 CA LEU A 159 -6.661 10.886 0.278 1.00 0.00 C ATOM 1165 C LEU A 159 -8.032 11.533 0.149 1.00 0.00 C ATOM 1166 O LEU A 159 -8.161 12.611 -0.436 1.00 0.00 O ATOM 1167 CB LEU A 159 -5.582 11.974 0.196 1.00 0.00 C ATOM 1168 CG LEU A 159 -4.200 11.577 0.710 1.00 0.00 C ATOM 1169 CD1 LEU A 159 -3.169 12.632 0.345 1.00 0.00 C ATOM 1170 CD2 LEU A 159 -4.232 11.386 2.218 1.00 0.00 C ATOM 0 H LEU A 159 -6.102 10.254 -1.642 1.00 0.00 H new ATOM 0 HA LEU A 159 -6.583 10.381 1.241 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -5.486 12.287 -0.844 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -5.924 12.842 0.760 1.00 0.00 H new ATOM 0 HG LEU A 159 -3.919 10.635 0.238 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -2.191 12.330 0.720 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -3.125 12.738 -0.739 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -3.450 13.586 0.792 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -3.240 11.103 2.570 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -4.535 12.317 2.696 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -4.944 10.600 2.470 1.00 0.00 H new ATOM 1182 N ARG A 160 -9.058 10.866 0.662 1.00 0.00 N ATOM 1183 CA ARG A 160 -10.427 11.365 0.564 1.00 0.00 C ATOM 1184 C ARG A 160 -11.249 10.935 1.770 1.00 0.00 C ATOM 1185 O ARG A 160 -11.176 9.791 2.209 1.00 0.00 O ATOM 1186 CB ARG A 160 -11.111 10.864 -0.714 1.00 0.00 C ATOM 1187 CG ARG A 160 -10.470 11.366 -1.994 1.00 0.00 C ATOM 1188 CD ARG A 160 -11.179 10.841 -3.226 1.00 0.00 C ATOM 1189 NE ARG A 160 -10.484 11.234 -4.449 1.00 0.00 N ATOM 1190 CZ ARG A 160 -10.809 10.817 -5.670 1.00 0.00 C ATOM 1191 NH1 ARG A 160 -11.855 10.019 -5.855 1.00 0.00 N ATOM 1192 NH2 ARG A 160 -10.084 11.206 -6.710 1.00 0.00 N ATOM 0 H ARG A 160 -8.969 9.976 1.152 1.00 0.00 H new ATOM 0 HA ARG A 160 -10.371 12.453 0.534 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -11.099 9.774 -0.717 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -12.157 11.171 -0.699 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -10.485 12.456 -2.004 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -9.424 11.061 -2.020 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -11.243 9.754 -3.175 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -12.201 11.220 -3.249 1.00 0.00 H new ATOM 0 HE ARG A 160 -9.694 11.873 -4.361 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -12.416 9.721 -5.057 1.00 0.00 H new ATOM 0 HH12 ARG A 160 -12.097 9.704 -6.795 1.00 0.00 H new ATOM 0 HH21 ARG A 160 -9.282 11.821 -6.571 1.00 0.00 H new ATOM 0 HH22 ARG A 160 -10.328 10.890 -7.649 1.00 0.00 H new TER 1206 ARG A 160