USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 559 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: A2085 GLN : amide:sc= 0.752 K(o=2.7,f=1) USER MOD Set 1.2: A2086 GLN : amide:sc= 0.449 K(o=2.7,f=-0.71) USER MOD Set 1.3: A2089 ASN : amide:sc= 1.55 K(o=2.7,f=-0.71) USER MOD Set 2.1: A2080 SER OG : rot 180:sc= 0.246 USER MOD Set 2.2: A2082 GLN : amide:sc= -0.44 K(o=-0.19,f=-2.1!) USER MOD Single : A2064 SER OG : rot 180:sc= 0 USER MOD Single : A2066 SER OG : rot 180:sc= 0 USER MOD Single : A2069 GLN : amide:sc= -0.121 X(o=-0.12,f=-0.52) USER MOD Single : A2074 THR OG1 : rot 78:sc= 1.04 USER MOD Single : A2076 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2077 SER OG : rot 79:sc= 0.425 USER MOD Single : A2079 SER OG : rot 180:sc= 0 USER MOD Single : A2083 GLN : amide:sc= 0.603 K(o=0.6,f=-2.8!) USER MOD Single : A2084 GLN : amide:sc= 0.403 K(o=0.4,f=-0.27) USER MOD Single : A2092 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2093 SER OG : rot 75:sc= 0.458 USER MOD Single : A2094 ASN : amide:sc= 0.914 K(o=0.91,f=-3!) USER MOD Single : A2096 GLN : amide:sc= -1 X(o=-1,f=-0.84) USER MOD Single : A2098 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A2103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A2104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A2106 THR OG1 : rot 180:sc= 0 USER MOD Single : A2108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 THR OG1 : rot -24:sc= 0.0934 USER MOD Single : B 20 SER OG : rot 180:sc= 0.00591 USER MOD Single : B 24 LYS NZ :NH3+ -174:sc= 1.23 (180deg=1.17) USER MOD Single : B 44 MET CE :methyl -170:sc= -0.153 (180deg=-0.372) USER MOD Single : B 46 SER OG : rot 180:sc= 0 USER MOD Single : B 52 GLN : amide:sc= -0.0636 X(o=-0.064,f=0) USER MOD Single : B 55 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 64 N ILE A2063 4.885 -4.826 -15.735 1.00 0.00 N ATOM 65 CA ILE A2063 5.972 -5.676 -16.257 1.00 0.00 C ATOM 66 C ILE A2063 5.484 -6.404 -17.526 1.00 0.00 C ATOM 67 O ILE A2063 4.274 -6.480 -17.766 1.00 0.00 O ATOM 68 CB ILE A2063 6.481 -6.684 -15.192 1.00 0.00 C ATOM 69 CG1 ILE A2063 5.357 -7.615 -14.676 1.00 0.00 C ATOM 70 CG2 ILE A2063 7.177 -5.954 -14.028 1.00 0.00 C ATOM 71 CD1 ILE A2063 5.850 -8.737 -13.756 1.00 0.00 C ATOM 0 HA ILE A2063 6.819 -5.039 -16.511 1.00 0.00 H new ATOM 0 HB ILE A2063 7.216 -7.321 -15.684 1.00 0.00 H new ATOM 0 HG12 ILE A2063 4.621 -7.016 -14.139 1.00 0.00 H new ATOM 0 HG13 ILE A2063 4.846 -8.058 -15.530 1.00 0.00 H new ATOM 0 HG21 ILE A2063 7.524 -6.684 -13.296 1.00 0.00 H new ATOM 0 HG22 ILE A2063 8.028 -5.390 -14.409 1.00 0.00 H new ATOM 0 HG23 ILE A2063 6.472 -5.271 -13.553 1.00 0.00 H new ATOM 0 HD11 ILE A2063 5.003 -9.345 -13.437 1.00 0.00 H new ATOM 0 HD12 ILE A2063 6.563 -9.362 -14.294 1.00 0.00 H new ATOM 0 HD13 ILE A2063 6.335 -8.304 -12.881 1.00 0.00 H new ATOM 83 N SER A2064 6.401 -6.956 -18.327 1.00 0.00 N ATOM 84 CA SER A2064 6.082 -7.668 -19.581 1.00 0.00 C ATOM 85 C SER A2064 6.743 -9.055 -19.637 1.00 0.00 C ATOM 86 O SER A2064 7.925 -9.172 -19.302 1.00 0.00 O ATOM 87 CB SER A2064 6.537 -6.843 -20.794 1.00 0.00 C ATOM 88 OG SER A2064 5.848 -5.602 -20.853 1.00 0.00 O ATOM 0 H SER A2064 7.400 -6.924 -18.125 1.00 0.00 H new ATOM 0 HA SER A2064 5.001 -7.802 -19.607 1.00 0.00 H new ATOM 0 HB2 SER A2064 7.611 -6.664 -20.735 1.00 0.00 H new ATOM 0 HB3 SER A2064 6.358 -7.407 -21.710 1.00 0.00 H new ATOM 0 HG SER A2064 6.156 -5.094 -21.632 1.00 0.00 H new ATOM 94 N PRO A2065 6.032 -10.119 -20.072 1.00 0.00 N ATOM 95 CA PRO A2065 6.586 -11.474 -20.139 1.00 0.00 C ATOM 96 C PRO A2065 7.677 -11.640 -21.206 1.00 0.00 C ATOM 97 O PRO A2065 8.509 -12.531 -21.073 1.00 0.00 O ATOM 98 CB PRO A2065 5.396 -12.399 -20.403 1.00 0.00 C ATOM 99 CG PRO A2065 4.403 -11.501 -21.138 1.00 0.00 C ATOM 100 CD PRO A2065 4.641 -10.126 -20.510 1.00 0.00 C ATOM 0 HA PRO A2065 7.092 -11.715 -19.204 1.00 0.00 H new ATOM 0 HB2 PRO A2065 5.683 -13.259 -21.008 1.00 0.00 H new ATOM 0 HB3 PRO A2065 4.976 -12.787 -19.475 1.00 0.00 H new ATOM 0 HG2 PRO A2065 4.589 -11.490 -22.212 1.00 0.00 H new ATOM 0 HG3 PRO A2065 3.376 -11.836 -20.995 1.00 0.00 H new ATOM 0 HD2 PRO A2065 4.455 -9.330 -21.231 1.00 0.00 H new ATOM 0 HD3 PRO A2065 3.967 -9.959 -19.670 1.00 0.00 H new ATOM 108 N SER A2066 7.727 -10.783 -22.232 1.00 0.00 N ATOM 109 CA SER A2066 8.767 -10.803 -23.278 1.00 0.00 C ATOM 110 C SER A2066 10.187 -10.682 -22.704 1.00 0.00 C ATOM 111 O SER A2066 11.124 -11.315 -23.199 1.00 0.00 O ATOM 112 CB SER A2066 8.504 -9.683 -24.291 1.00 0.00 C ATOM 113 OG SER A2066 8.302 -8.442 -23.626 1.00 0.00 O ATOM 0 H SER A2066 7.038 -10.043 -22.365 1.00 0.00 H new ATOM 0 HA SER A2066 8.711 -11.772 -23.775 1.00 0.00 H new ATOM 0 HB2 SER A2066 9.347 -9.601 -24.977 1.00 0.00 H new ATOM 0 HB3 SER A2066 7.627 -9.927 -24.891 1.00 0.00 H new ATOM 0 HG SER A2066 8.137 -7.739 -24.288 1.00 0.00 H new ATOM 119 N ALA A2067 10.338 -9.926 -21.612 1.00 0.00 N ATOM 120 CA ALA A2067 11.593 -9.746 -20.885 1.00 0.00 C ATOM 121 C ALA A2067 12.179 -11.070 -20.358 1.00 0.00 C ATOM 122 O ALA A2067 13.398 -11.230 -20.287 1.00 0.00 O ATOM 123 CB ALA A2067 11.306 -8.781 -19.730 1.00 0.00 C ATOM 0 H ALA A2067 9.563 -9.407 -21.199 1.00 0.00 H new ATOM 0 HA ALA A2067 12.347 -9.346 -21.563 1.00 0.00 H new ATOM 0 HB1 ALA A2067 12.219 -8.617 -19.158 1.00 0.00 H new ATOM 0 HB2 ALA A2067 10.952 -7.830 -20.129 1.00 0.00 H new ATOM 0 HB3 ALA A2067 10.542 -9.208 -19.080 1.00 0.00 H new ATOM 129 N LEU A2068 11.325 -12.039 -20.014 1.00 0.00 N ATOM 130 CA LEU A2068 11.738 -13.347 -19.507 1.00 0.00 C ATOM 131 C LEU A2068 12.423 -14.147 -20.633 1.00 0.00 C ATOM 132 O LEU A2068 13.482 -14.737 -20.416 1.00 0.00 O ATOM 133 CB LEU A2068 10.516 -14.074 -18.902 1.00 0.00 C ATOM 134 CG LEU A2068 9.944 -13.521 -17.571 1.00 0.00 C ATOM 135 CD1 LEU A2068 9.768 -12.004 -17.466 1.00 0.00 C ATOM 136 CD2 LEU A2068 8.568 -14.141 -17.325 1.00 0.00 C ATOM 0 H LEU A2068 10.313 -11.933 -20.082 1.00 0.00 H new ATOM 0 HA LEU A2068 12.471 -13.236 -18.708 1.00 0.00 H new ATOM 0 HB2 LEU A2068 9.716 -14.063 -19.643 1.00 0.00 H new ATOM 0 HB3 LEU A2068 10.789 -15.117 -18.744 1.00 0.00 H new ATOM 0 HG LEU A2068 10.701 -13.789 -16.834 1.00 0.00 H new ATOM 0 HD11 LEU A2068 9.361 -11.752 -16.487 1.00 0.00 H new ATOM 0 HD12 LEU A2068 10.734 -11.516 -17.594 1.00 0.00 H new ATOM 0 HD13 LEU A2068 9.083 -11.663 -18.242 1.00 0.00 H new ATOM 0 HD21 LEU A2068 8.158 -13.758 -16.391 1.00 0.00 H new ATOM 0 HD22 LEU A2068 7.900 -13.883 -18.147 1.00 0.00 H new ATOM 0 HD23 LEU A2068 8.663 -15.225 -17.262 1.00 0.00 H new ATOM 148 N GLN A2069 11.882 -14.110 -21.859 1.00 0.00 N ATOM 149 CA GLN A2069 12.525 -14.741 -23.026 1.00 0.00 C ATOM 150 C GLN A2069 13.863 -14.048 -23.357 1.00 0.00 C ATOM 151 O GLN A2069 14.838 -14.715 -23.708 1.00 0.00 O ATOM 152 CB GLN A2069 11.615 -14.733 -24.271 1.00 0.00 C ATOM 153 CG GLN A2069 10.374 -15.639 -24.177 1.00 0.00 C ATOM 154 CD GLN A2069 9.201 -14.949 -23.489 1.00 0.00 C ATOM 155 OE1 GLN A2069 8.424 -14.227 -24.096 1.00 0.00 O ATOM 156 NE2 GLN A2069 9.017 -15.155 -22.205 1.00 0.00 N ATOM 0 H GLN A2069 10.997 -13.649 -22.071 1.00 0.00 H new ATOM 0 HA GLN A2069 12.712 -15.780 -22.755 1.00 0.00 H new ATOM 0 HB2 GLN A2069 11.286 -13.710 -24.455 1.00 0.00 H new ATOM 0 HB3 GLN A2069 12.205 -15.039 -25.135 1.00 0.00 H new ATOM 0 HG2 GLN A2069 10.075 -15.946 -25.179 1.00 0.00 H new ATOM 0 HG3 GLN A2069 10.630 -16.546 -23.630 1.00 0.00 H new ATOM 0 HE21 GLN A2069 9.659 -15.756 -21.688 1.00 0.00 H new ATOM 0 HE22 GLN A2069 8.232 -14.714 -21.725 1.00 0.00 H new ATOM 165 N ASP A2070 13.937 -12.720 -23.214 1.00 0.00 N ATOM 166 CA ASP A2070 15.174 -11.960 -23.442 1.00 0.00 C ATOM 167 C ASP A2070 16.267 -12.311 -22.416 1.00 0.00 C ATOM 168 O ASP A2070 17.442 -12.401 -22.779 1.00 0.00 O ATOM 169 CB ASP A2070 14.892 -10.449 -23.471 1.00 0.00 C ATOM 170 CG ASP A2070 14.044 -10.008 -24.677 1.00 0.00 C ATOM 171 OD1 ASP A2070 14.131 -10.654 -25.751 1.00 0.00 O ATOM 172 OD2 ASP A2070 13.332 -8.983 -24.569 1.00 0.00 O ATOM 0 H ASP A2070 13.144 -12.142 -22.938 1.00 0.00 H new ATOM 0 HA ASP A2070 15.558 -12.250 -24.420 1.00 0.00 H new ATOM 0 HB2 ASP A2070 14.379 -10.165 -22.552 1.00 0.00 H new ATOM 0 HB3 ASP A2070 15.840 -9.910 -23.486 1.00 0.00 H new ATOM 177 N LEU A2071 15.907 -12.574 -21.153 1.00 0.00 N ATOM 178 CA LEU A2071 16.860 -13.024 -20.131 1.00 0.00 C ATOM 179 C LEU A2071 17.474 -14.368 -20.553 1.00 0.00 C ATOM 180 O LEU A2071 18.694 -14.532 -20.496 1.00 0.00 O ATOM 181 CB LEU A2071 16.156 -13.077 -18.760 1.00 0.00 C ATOM 182 CG LEU A2071 17.073 -13.417 -17.563 1.00 0.00 C ATOM 183 CD1 LEU A2071 16.428 -12.915 -16.268 1.00 0.00 C ATOM 184 CD2 LEU A2071 17.321 -14.920 -17.379 1.00 0.00 C ATOM 0 H LEU A2071 14.950 -12.481 -20.812 1.00 0.00 H new ATOM 0 HA LEU A2071 17.686 -12.319 -20.035 1.00 0.00 H new ATOM 0 HB2 LEU A2071 15.685 -12.112 -18.574 1.00 0.00 H new ATOM 0 HB3 LEU A2071 15.358 -13.818 -18.808 1.00 0.00 H new ATOM 0 HG LEU A2071 18.027 -12.934 -17.777 1.00 0.00 H new ATOM 0 HD11 LEU A2071 17.074 -13.154 -15.423 1.00 0.00 H new ATOM 0 HD12 LEU A2071 16.290 -11.835 -16.325 1.00 0.00 H new ATOM 0 HD13 LEU A2071 15.460 -13.398 -16.133 1.00 0.00 H new ATOM 0 HD21 LEU A2071 17.973 -15.079 -16.520 1.00 0.00 H new ATOM 0 HD22 LEU A2071 16.371 -15.428 -17.212 1.00 0.00 H new ATOM 0 HD23 LEU A2071 17.796 -15.323 -18.274 1.00 0.00 H new ATOM 196 N LEU A2072 16.652 -15.312 -21.028 1.00 0.00 N ATOM 197 CA LEU A2072 17.126 -16.614 -21.508 1.00 0.00 C ATOM 198 C LEU A2072 18.046 -16.485 -22.734 1.00 0.00 C ATOM 199 O LEU A2072 19.106 -17.116 -22.750 1.00 0.00 O ATOM 200 CB LEU A2072 15.935 -17.548 -21.793 1.00 0.00 C ATOM 201 CG LEU A2072 15.127 -17.963 -20.548 1.00 0.00 C ATOM 202 CD1 LEU A2072 13.964 -18.854 -20.990 1.00 0.00 C ATOM 203 CD2 LEU A2072 15.971 -18.733 -19.528 1.00 0.00 C ATOM 0 H LEU A2072 15.641 -15.194 -21.090 1.00 0.00 H new ATOM 0 HA LEU A2072 17.729 -17.056 -20.715 1.00 0.00 H new ATOM 0 HB2 LEU A2072 15.264 -17.054 -22.496 1.00 0.00 H new ATOM 0 HB3 LEU A2072 16.306 -18.447 -22.284 1.00 0.00 H new ATOM 0 HG LEU A2072 14.774 -17.051 -20.066 1.00 0.00 H new ATOM 0 HD11 LEU A2072 13.384 -19.155 -20.117 1.00 0.00 H new ATOM 0 HD12 LEU A2072 13.324 -18.302 -21.678 1.00 0.00 H new ATOM 0 HD13 LEU A2072 14.354 -19.741 -21.489 1.00 0.00 H new ATOM 0 HD21 LEU A2072 15.352 -19.000 -18.672 1.00 0.00 H new ATOM 0 HD22 LEU A2072 16.363 -19.639 -19.990 1.00 0.00 H new ATOM 0 HD23 LEU A2072 16.800 -18.108 -19.196 1.00 0.00 H new ATOM 215 N ARG A2073 17.709 -15.657 -23.739 1.00 0.00 N ATOM 216 CA ARG A2073 18.594 -15.454 -24.910 1.00 0.00 C ATOM 217 C ARG A2073 19.936 -14.824 -24.504 1.00 0.00 C ATOM 218 O ARG A2073 20.981 -15.181 -25.048 1.00 0.00 O ATOM 219 CB ARG A2073 17.869 -14.726 -26.067 1.00 0.00 C ATOM 220 CG ARG A2073 18.045 -13.198 -26.134 1.00 0.00 C ATOM 221 CD ARG A2073 17.313 -12.560 -27.324 1.00 0.00 C ATOM 222 NE ARG A2073 15.856 -12.463 -27.110 1.00 0.00 N ATOM 223 CZ ARG A2073 14.893 -13.232 -27.579 1.00 0.00 C ATOM 224 NH1 ARG A2073 15.112 -14.272 -28.335 1.00 0.00 N ATOM 225 NH2 ARG A2073 13.668 -12.929 -27.276 1.00 0.00 N ATOM 0 H ARG A2073 16.842 -15.121 -23.769 1.00 0.00 H new ATOM 0 HA ARG A2073 18.848 -16.434 -25.314 1.00 0.00 H new ATOM 0 HB2 ARG A2073 18.217 -15.151 -27.009 1.00 0.00 H new ATOM 0 HB3 ARG A2073 16.804 -14.944 -25.993 1.00 0.00 H new ATOM 0 HG2 ARG A2073 17.677 -12.755 -25.209 1.00 0.00 H new ATOM 0 HG3 ARG A2073 19.107 -12.963 -26.200 1.00 0.00 H new ATOM 0 HD2 ARG A2073 17.717 -11.564 -27.502 1.00 0.00 H new ATOM 0 HD3 ARG A2073 17.506 -13.147 -28.222 1.00 0.00 H new ATOM 0 HE ARG A2073 15.551 -11.692 -26.515 1.00 0.00 H new ATOM 0 HH11 ARG A2073 16.067 -14.525 -28.591 1.00 0.00 H new ATOM 0 HH12 ARG A2073 14.329 -14.833 -28.670 1.00 0.00 H new ATOM 0 HH21 ARG A2073 13.473 -12.116 -26.691 1.00 0.00 H new ATOM 0 HH22 ARG A2073 12.900 -13.503 -27.623 1.00 0.00 H new ATOM 239 N THR A2074 19.912 -13.936 -23.505 1.00 0.00 N ATOM 240 CA THR A2074 21.109 -13.302 -22.925 1.00 0.00 C ATOM 241 C THR A2074 21.973 -14.344 -22.202 1.00 0.00 C ATOM 242 O THR A2074 23.182 -14.401 -22.423 1.00 0.00 O ATOM 243 CB THR A2074 20.711 -12.166 -21.970 1.00 0.00 C ATOM 244 OG1 THR A2074 19.965 -11.188 -22.664 1.00 0.00 O ATOM 245 CG2 THR A2074 21.914 -11.444 -21.372 1.00 0.00 C ATOM 0 H THR A2074 19.044 -13.629 -23.065 1.00 0.00 H new ATOM 0 HA THR A2074 21.698 -12.873 -23.735 1.00 0.00 H new ATOM 0 HB THR A2074 20.136 -12.638 -21.173 1.00 0.00 H new ATOM 0 HG1 THR A2074 19.046 -11.505 -22.788 1.00 0.00 H new ATOM 0 HG21 THR A2074 21.569 -10.653 -20.706 1.00 0.00 H new ATOM 0 HG22 THR A2074 22.521 -12.153 -20.809 1.00 0.00 H new ATOM 0 HG23 THR A2074 22.513 -11.010 -22.173 1.00 0.00 H new ATOM 253 N LEU A2075 21.367 -15.213 -21.380 1.00 0.00 N ATOM 254 CA LEU A2075 22.055 -16.303 -20.671 1.00 0.00 C ATOM 255 C LEU A2075 22.694 -17.318 -21.641 1.00 0.00 C ATOM 256 O LEU A2075 23.807 -17.787 -21.398 1.00 0.00 O ATOM 257 CB LEU A2075 21.046 -16.980 -19.722 1.00 0.00 C ATOM 258 CG LEU A2075 21.563 -18.240 -18.999 1.00 0.00 C ATOM 259 CD1 LEU A2075 22.806 -17.997 -18.140 1.00 0.00 C ATOM 260 CD2 LEU A2075 20.467 -18.794 -18.093 1.00 0.00 C ATOM 0 H LEU A2075 20.366 -15.178 -21.185 1.00 0.00 H new ATOM 0 HA LEU A2075 22.881 -15.888 -20.093 1.00 0.00 H new ATOM 0 HB2 LEU A2075 20.734 -16.253 -18.972 1.00 0.00 H new ATOM 0 HB3 LEU A2075 20.158 -17.248 -20.294 1.00 0.00 H new ATOM 0 HG LEU A2075 21.839 -18.942 -19.785 1.00 0.00 H new ATOM 0 HD11 LEU A2075 23.108 -18.930 -17.665 1.00 0.00 H new ATOM 0 HD12 LEU A2075 23.617 -17.631 -18.769 1.00 0.00 H new ATOM 0 HD13 LEU A2075 22.579 -17.256 -17.373 1.00 0.00 H new ATOM 0 HD21 LEU A2075 20.833 -19.685 -17.582 1.00 0.00 H new ATOM 0 HD22 LEU A2075 20.189 -18.041 -17.355 1.00 0.00 H new ATOM 0 HD23 LEU A2075 19.595 -19.053 -18.693 1.00 0.00 H new ATOM 272 N LYS A2076 22.008 -17.654 -22.743 1.00 0.00 N ATOM 273 CA LYS A2076 22.512 -18.587 -23.772 1.00 0.00 C ATOM 274 C LYS A2076 23.674 -18.029 -24.612 1.00 0.00 C ATOM 275 O LYS A2076 24.394 -18.805 -25.243 1.00 0.00 O ATOM 276 CB LYS A2076 21.350 -19.071 -24.662 1.00 0.00 C ATOM 277 CG LYS A2076 20.424 -20.086 -23.964 1.00 0.00 C ATOM 278 CD LYS A2076 21.117 -21.432 -23.690 1.00 0.00 C ATOM 279 CE LYS A2076 20.131 -22.451 -23.107 1.00 0.00 C ATOM 280 NZ LYS A2076 20.798 -23.753 -22.837 1.00 0.00 N ATOM 0 H LYS A2076 21.080 -17.285 -22.951 1.00 0.00 H new ATOM 0 HA LYS A2076 22.937 -19.437 -23.238 1.00 0.00 H new ATOM 0 HB2 LYS A2076 20.761 -18.210 -24.977 1.00 0.00 H new ATOM 0 HB3 LYS A2076 21.759 -19.525 -25.565 1.00 0.00 H new ATOM 0 HG2 LYS A2076 20.074 -19.664 -23.022 1.00 0.00 H new ATOM 0 HG3 LYS A2076 19.544 -20.255 -24.584 1.00 0.00 H new ATOM 0 HD2 LYS A2076 21.542 -21.821 -24.615 1.00 0.00 H new ATOM 0 HD3 LYS A2076 21.945 -21.284 -22.996 1.00 0.00 H new ATOM 0 HE2 LYS A2076 19.704 -22.060 -22.184 1.00 0.00 H new ATOM 0 HE3 LYS A2076 19.305 -22.600 -23.802 1.00 0.00 H new ATOM 0 HZ1 LYS A2076 20.106 -24.422 -22.443 1.00 0.00 H new ATOM 0 HZ2 LYS A2076 21.184 -24.136 -23.724 1.00 0.00 H new ATOM 0 HZ3 LYS A2076 21.571 -23.612 -22.155 1.00 0.00 H new ATOM 294 N SER A2077 23.898 -16.715 -24.589 1.00 0.00 N ATOM 295 CA SER A2077 25.034 -16.048 -25.249 1.00 0.00 C ATOM 296 C SER A2077 26.293 -16.119 -24.347 1.00 0.00 C ATOM 297 O SER A2077 26.158 -16.307 -23.132 1.00 0.00 O ATOM 298 CB SER A2077 24.643 -14.599 -25.557 1.00 0.00 C ATOM 299 OG SER A2077 23.568 -14.555 -26.483 1.00 0.00 O ATOM 0 H SER A2077 23.283 -16.064 -24.101 1.00 0.00 H new ATOM 0 HA SER A2077 25.276 -16.553 -26.184 1.00 0.00 H new ATOM 0 HB2 SER A2077 24.357 -14.091 -24.636 1.00 0.00 H new ATOM 0 HB3 SER A2077 25.501 -14.064 -25.963 1.00 0.00 H new ATOM 0 HG SER A2077 22.727 -14.744 -26.017 1.00 0.00 H new ATOM 305 N PRO A2078 27.528 -15.995 -24.881 1.00 0.00 N ATOM 306 CA PRO A2078 28.754 -16.131 -24.081 1.00 0.00 C ATOM 307 C PRO A2078 28.933 -15.022 -23.031 1.00 0.00 C ATOM 308 O PRO A2078 28.556 -13.865 -23.234 1.00 0.00 O ATOM 309 CB PRO A2078 29.907 -16.164 -25.088 1.00 0.00 C ATOM 310 CG PRO A2078 29.348 -15.370 -26.260 1.00 0.00 C ATOM 311 CD PRO A2078 27.872 -15.767 -26.276 1.00 0.00 C ATOM 0 HA PRO A2078 28.713 -17.042 -23.484 1.00 0.00 H new ATOM 0 HB2 PRO A2078 30.811 -15.708 -24.684 1.00 0.00 H new ATOM 0 HB3 PRO A2078 30.165 -17.183 -25.375 1.00 0.00 H new ATOM 0 HG2 PRO A2078 29.475 -14.297 -26.117 1.00 0.00 H new ATOM 0 HG3 PRO A2078 29.845 -15.628 -27.195 1.00 0.00 H new ATOM 0 HD2 PRO A2078 27.256 -14.980 -26.711 1.00 0.00 H new ATOM 0 HD3 PRO A2078 27.711 -16.664 -26.874 1.00 0.00 H new ATOM 319 N SER A2079 29.520 -15.394 -21.895 1.00 0.00 N ATOM 320 CA SER A2079 29.755 -14.530 -20.727 1.00 0.00 C ATOM 321 C SER A2079 30.714 -13.360 -20.998 1.00 0.00 C ATOM 322 O SER A2079 31.803 -13.546 -21.548 1.00 0.00 O ATOM 323 CB SER A2079 30.322 -15.363 -19.571 1.00 0.00 C ATOM 324 OG SER A2079 29.411 -16.388 -19.207 1.00 0.00 O ATOM 0 H SER A2079 29.861 -16.344 -21.752 1.00 0.00 H new ATOM 0 HA SER A2079 28.785 -14.101 -20.476 1.00 0.00 H new ATOM 0 HB2 SER A2079 31.275 -15.802 -19.864 1.00 0.00 H new ATOM 0 HB3 SER A2079 30.518 -14.720 -18.713 1.00 0.00 H new ATOM 0 HG SER A2079 29.787 -16.913 -18.469 1.00 0.00 H new ATOM 330 N SER A2080 30.317 -12.159 -20.569 1.00 0.00 N ATOM 331 CA SER A2080 31.077 -10.903 -20.675 1.00 0.00 C ATOM 332 C SER A2080 30.430 -9.797 -19.821 1.00 0.00 C ATOM 333 O SER A2080 29.243 -9.916 -19.486 1.00 0.00 O ATOM 334 CB SER A2080 31.123 -10.437 -22.142 1.00 0.00 C ATOM 335 OG SER A2080 29.839 -10.041 -22.597 1.00 0.00 O ATOM 0 H SER A2080 29.413 -12.026 -20.116 1.00 0.00 H new ATOM 0 HA SER A2080 32.088 -11.090 -20.312 1.00 0.00 H new ATOM 0 HB2 SER A2080 31.819 -9.604 -22.240 1.00 0.00 H new ATOM 0 HB3 SER A2080 31.501 -11.243 -22.770 1.00 0.00 H new ATOM 0 HG SER A2080 29.899 -9.748 -23.530 1.00 0.00 H new ATOM 341 N PRO A2081 31.143 -8.695 -19.500 1.00 0.00 N ATOM 342 CA PRO A2081 30.549 -7.538 -18.816 1.00 0.00 C ATOM 343 C PRO A2081 29.311 -7.008 -19.563 1.00 0.00 C ATOM 344 O PRO A2081 28.335 -6.579 -18.949 1.00 0.00 O ATOM 345 CB PRO A2081 31.651 -6.474 -18.756 1.00 0.00 C ATOM 346 CG PRO A2081 32.944 -7.272 -18.899 1.00 0.00 C ATOM 347 CD PRO A2081 32.544 -8.438 -19.800 1.00 0.00 C ATOM 0 HA PRO A2081 30.200 -7.812 -17.820 1.00 0.00 H new ATOM 0 HB2 PRO A2081 31.543 -5.742 -19.557 1.00 0.00 H new ATOM 0 HB3 PRO A2081 31.624 -5.924 -17.815 1.00 0.00 H new ATOM 0 HG2 PRO A2081 33.738 -6.673 -19.346 1.00 0.00 H new ATOM 0 HG3 PRO A2081 33.311 -7.619 -17.933 1.00 0.00 H new ATOM 0 HD2 PRO A2081 32.681 -8.187 -20.852 1.00 0.00 H new ATOM 0 HD3 PRO A2081 33.156 -9.317 -19.600 1.00 0.00 H new ATOM 355 N GLN A2082 29.330 -7.088 -20.897 1.00 0.00 N ATOM 356 CA GLN A2082 28.221 -6.698 -21.773 1.00 0.00 C ATOM 357 C GLN A2082 27.018 -7.647 -21.609 1.00 0.00 C ATOM 358 O GLN A2082 25.873 -7.196 -21.599 1.00 0.00 O ATOM 359 CB GLN A2082 28.697 -6.664 -23.237 1.00 0.00 C ATOM 360 CG GLN A2082 29.693 -5.528 -23.548 1.00 0.00 C ATOM 361 CD GLN A2082 31.078 -5.703 -22.920 1.00 0.00 C ATOM 362 OE1 GLN A2082 31.609 -6.798 -22.790 1.00 0.00 O ATOM 363 NE2 GLN A2082 31.715 -4.639 -22.479 1.00 0.00 N ATOM 0 H GLN A2082 30.139 -7.435 -21.411 1.00 0.00 H new ATOM 0 HA GLN A2082 27.890 -5.700 -21.486 1.00 0.00 H new ATOM 0 HB2 GLN A2082 29.164 -7.619 -23.478 1.00 0.00 H new ATOM 0 HB3 GLN A2082 27.829 -6.560 -23.888 1.00 0.00 H new ATOM 0 HG2 GLN A2082 29.807 -5.448 -24.629 1.00 0.00 H new ATOM 0 HG3 GLN A2082 29.268 -4.586 -23.202 1.00 0.00 H new ATOM 0 HE21 GLN A2082 31.293 -3.715 -22.576 1.00 0.00 H new ATOM 0 HE22 GLN A2082 32.631 -4.738 -22.040 1.00 0.00 H new ATOM 372 N GLN A2083 27.254 -8.952 -21.425 1.00 0.00 N ATOM 373 CA GLN A2083 26.197 -9.939 -21.178 1.00 0.00 C ATOM 374 C GLN A2083 25.521 -9.696 -19.818 1.00 0.00 C ATOM 375 O GLN A2083 24.292 -9.700 -19.720 1.00 0.00 O ATOM 376 CB GLN A2083 26.781 -11.362 -21.275 1.00 0.00 C ATOM 377 CG GLN A2083 25.784 -12.328 -21.923 1.00 0.00 C ATOM 378 CD GLN A2083 25.555 -11.978 -23.396 1.00 0.00 C ATOM 379 OE1 GLN A2083 24.532 -11.439 -23.794 1.00 0.00 O ATOM 380 NE2 GLN A2083 26.510 -12.238 -24.262 1.00 0.00 N ATOM 0 H GLN A2083 28.191 -9.355 -21.444 1.00 0.00 H new ATOM 0 HA GLN A2083 25.426 -9.831 -21.941 1.00 0.00 H new ATOM 0 HB2 GLN A2083 27.702 -11.341 -21.858 1.00 0.00 H new ATOM 0 HB3 GLN A2083 27.042 -11.719 -20.279 1.00 0.00 H new ATOM 0 HG2 GLN A2083 26.157 -13.349 -21.842 1.00 0.00 H new ATOM 0 HG3 GLN A2083 24.836 -12.292 -21.386 1.00 0.00 H new ATOM 0 HE21 GLN A2083 27.372 -12.687 -23.952 1.00 0.00 H new ATOM 0 HE22 GLN A2083 26.389 -11.991 -25.244 1.00 0.00 H new ATOM 389 N GLN A2084 26.321 -9.408 -18.785 1.00 0.00 N ATOM 390 CA GLN A2084 25.831 -9.019 -17.453 1.00 0.00 C ATOM 391 C GLN A2084 24.970 -7.746 -17.567 1.00 0.00 C ATOM 392 O GLN A2084 23.857 -7.695 -17.040 1.00 0.00 O ATOM 393 CB GLN A2084 27.018 -8.782 -16.499 1.00 0.00 C ATOM 394 CG GLN A2084 27.782 -10.063 -16.129 1.00 0.00 C ATOM 395 CD GLN A2084 29.170 -9.747 -15.569 1.00 0.00 C ATOM 396 OE1 GLN A2084 30.188 -9.939 -16.220 1.00 0.00 O ATOM 397 NE2 GLN A2084 29.287 -9.266 -14.351 1.00 0.00 N ATOM 0 H GLN A2084 27.339 -9.438 -18.849 1.00 0.00 H new ATOM 0 HA GLN A2084 25.218 -9.824 -17.048 1.00 0.00 H new ATOM 0 HB2 GLN A2084 27.710 -8.079 -16.963 1.00 0.00 H new ATOM 0 HB3 GLN A2084 26.650 -8.313 -15.586 1.00 0.00 H new ATOM 0 HG2 GLN A2084 27.211 -10.628 -15.392 1.00 0.00 H new ATOM 0 HG3 GLN A2084 27.880 -10.697 -17.010 1.00 0.00 H new ATOM 0 HE21 GLN A2084 28.454 -9.097 -13.787 1.00 0.00 H new ATOM 0 HE22 GLN A2084 30.211 -9.062 -13.970 1.00 0.00 H new ATOM 406 N GLN A2085 25.453 -6.734 -18.304 1.00 0.00 N ATOM 407 CA GLN A2085 24.731 -5.492 -18.563 1.00 0.00 C ATOM 408 C GLN A2085 23.396 -5.736 -19.283 1.00 0.00 C ATOM 409 O GLN A2085 22.423 -5.064 -18.957 1.00 0.00 O ATOM 410 CB GLN A2085 25.635 -4.517 -19.338 1.00 0.00 C ATOM 411 CG GLN A2085 25.022 -3.115 -19.494 1.00 0.00 C ATOM 412 CD GLN A2085 24.738 -2.435 -18.155 1.00 0.00 C ATOM 413 OE1 GLN A2085 25.603 -2.279 -17.303 1.00 0.00 O ATOM 414 NE2 GLN A2085 23.518 -2.018 -17.909 1.00 0.00 N ATOM 0 H GLN A2085 26.374 -6.763 -18.742 1.00 0.00 H new ATOM 0 HA GLN A2085 24.474 -5.039 -17.605 1.00 0.00 H new ATOM 0 HB2 GLN A2085 26.592 -4.433 -18.824 1.00 0.00 H new ATOM 0 HB3 GLN A2085 25.839 -4.929 -20.326 1.00 0.00 H new ATOM 0 HG2 GLN A2085 25.700 -2.491 -20.076 1.00 0.00 H new ATOM 0 HG3 GLN A2085 24.094 -3.191 -20.061 1.00 0.00 H new ATOM 0 HE21 GLN A2085 22.786 -2.141 -18.609 1.00 0.00 H new ATOM 0 HE22 GLN A2085 23.302 -1.571 -17.018 1.00 0.00 H new ATOM 423 N GLN A2086 23.297 -6.693 -20.214 1.00 0.00 N ATOM 424 CA GLN A2086 22.022 -6.995 -20.878 1.00 0.00 C ATOM 425 C GLN A2086 20.952 -7.482 -19.891 1.00 0.00 C ATOM 426 O GLN A2086 19.823 -6.997 -19.952 1.00 0.00 O ATOM 427 CB GLN A2086 22.203 -7.985 -22.042 1.00 0.00 C ATOM 428 CG GLN A2086 22.252 -7.280 -23.404 1.00 0.00 C ATOM 429 CD GLN A2086 20.942 -6.557 -23.725 1.00 0.00 C ATOM 430 OE1 GLN A2086 20.821 -5.344 -23.597 1.00 0.00 O ATOM 431 NE2 GLN A2086 19.906 -7.269 -24.113 1.00 0.00 N ATOM 0 H GLN A2086 24.080 -7.269 -20.524 1.00 0.00 H new ATOM 0 HA GLN A2086 21.663 -6.056 -21.299 1.00 0.00 H new ATOM 0 HB2 GLN A2086 23.123 -8.551 -21.895 1.00 0.00 H new ATOM 0 HB3 GLN A2086 21.383 -8.703 -22.036 1.00 0.00 H new ATOM 0 HG2 GLN A2086 23.073 -6.563 -23.411 1.00 0.00 H new ATOM 0 HG3 GLN A2086 22.462 -8.012 -24.184 1.00 0.00 H new ATOM 0 HE21 GLN A2086 19.994 -8.279 -24.223 1.00 0.00 H new ATOM 0 HE22 GLN A2086 19.015 -6.811 -24.304 1.00 0.00 H new ATOM 440 N VAL A2087 21.285 -8.367 -18.941 1.00 0.00 N ATOM 441 CA VAL A2087 20.317 -8.780 -17.905 1.00 0.00 C ATOM 442 C VAL A2087 19.907 -7.572 -17.059 1.00 0.00 C ATOM 443 O VAL A2087 18.718 -7.376 -16.816 1.00 0.00 O ATOM 444 CB VAL A2087 20.845 -9.939 -17.039 1.00 0.00 C ATOM 445 CG1 VAL A2087 19.930 -10.265 -15.853 1.00 0.00 C ATOM 446 CG2 VAL A2087 20.947 -11.206 -17.895 1.00 0.00 C ATOM 0 H VAL A2087 22.202 -8.807 -18.865 1.00 0.00 H new ATOM 0 HA VAL A2087 19.429 -9.164 -18.407 1.00 0.00 H new ATOM 0 HB VAL A2087 21.814 -9.621 -16.654 1.00 0.00 H new ATOM 0 HG11 VAL A2087 20.356 -11.090 -15.281 1.00 0.00 H new ATOM 0 HG12 VAL A2087 19.839 -9.388 -15.212 1.00 0.00 H new ATOM 0 HG13 VAL A2087 18.944 -10.550 -16.221 1.00 0.00 H new ATOM 0 HG21 VAL A2087 21.321 -12.028 -17.285 1.00 0.00 H new ATOM 0 HG22 VAL A2087 19.962 -11.462 -18.285 1.00 0.00 H new ATOM 0 HG23 VAL A2087 21.631 -11.030 -18.725 1.00 0.00 H new ATOM 456 N LEU A2088 20.856 -6.708 -16.676 1.00 0.00 N ATOM 457 CA LEU A2088 20.556 -5.466 -15.952 1.00 0.00 C ATOM 458 C LEU A2088 19.648 -4.534 -16.780 1.00 0.00 C ATOM 459 O LEU A2088 18.724 -3.957 -16.219 1.00 0.00 O ATOM 460 CB LEU A2088 21.864 -4.771 -15.529 1.00 0.00 C ATOM 461 CG LEU A2088 22.698 -5.563 -14.500 1.00 0.00 C ATOM 462 CD1 LEU A2088 24.062 -4.899 -14.317 1.00 0.00 C ATOM 463 CD2 LEU A2088 22.019 -5.635 -13.129 1.00 0.00 C ATOM 0 H LEU A2088 21.850 -6.849 -16.858 1.00 0.00 H new ATOM 0 HA LEU A2088 20.000 -5.717 -15.049 1.00 0.00 H new ATOM 0 HB2 LEU A2088 22.473 -4.597 -16.416 1.00 0.00 H new ATOM 0 HB3 LEU A2088 21.624 -3.794 -15.110 1.00 0.00 H new ATOM 0 HG LEU A2088 22.800 -6.575 -14.891 1.00 0.00 H new ATOM 0 HD11 LEU A2088 24.646 -5.462 -13.590 1.00 0.00 H new ATOM 0 HD12 LEU A2088 24.589 -4.882 -15.271 1.00 0.00 H new ATOM 0 HD13 LEU A2088 23.925 -3.878 -13.960 1.00 0.00 H new ATOM 0 HD21 LEU A2088 22.646 -6.203 -12.442 1.00 0.00 H new ATOM 0 HD22 LEU A2088 21.875 -4.627 -12.741 1.00 0.00 H new ATOM 0 HD23 LEU A2088 21.051 -6.127 -13.228 1.00 0.00 H new ATOM 475 N ASN A2089 19.837 -4.417 -18.100 1.00 0.00 N ATOM 476 CA ASN A2089 18.981 -3.605 -18.982 1.00 0.00 C ATOM 477 C ASN A2089 17.530 -4.127 -18.985 1.00 0.00 C ATOM 478 O ASN A2089 16.576 -3.358 -18.844 1.00 0.00 O ATOM 479 CB ASN A2089 19.532 -3.603 -20.427 1.00 0.00 C ATOM 480 CG ASN A2089 20.886 -2.939 -20.619 1.00 0.00 C ATOM 481 OD1 ASN A2089 21.359 -2.147 -19.815 1.00 0.00 O ATOM 482 ND2 ASN A2089 21.555 -3.233 -21.711 1.00 0.00 N ATOM 0 H ASN A2089 20.596 -4.887 -18.594 1.00 0.00 H new ATOM 0 HA ASN A2089 18.985 -2.586 -18.595 1.00 0.00 H new ATOM 0 HB2 ASN A2089 19.603 -4.635 -20.770 1.00 0.00 H new ATOM 0 HB3 ASN A2089 18.809 -3.102 -21.071 1.00 0.00 H new ATOM 0 HD21 ASN A2089 22.463 -2.802 -21.884 1.00 0.00 H new ATOM 0 HD22 ASN A2089 21.166 -3.892 -22.385 1.00 0.00 H new ATOM 489 N ILE A2090 17.369 -5.448 -19.121 1.00 0.00 N ATOM 490 CA ILE A2090 16.075 -6.151 -19.123 1.00 0.00 C ATOM 491 C ILE A2090 15.368 -5.975 -17.766 1.00 0.00 C ATOM 492 O ILE A2090 14.175 -5.660 -17.713 1.00 0.00 O ATOM 493 CB ILE A2090 16.323 -7.636 -19.492 1.00 0.00 C ATOM 494 CG1 ILE A2090 16.826 -7.759 -20.953 1.00 0.00 C ATOM 495 CG2 ILE A2090 15.056 -8.488 -19.325 1.00 0.00 C ATOM 496 CD1 ILE A2090 17.536 -9.088 -21.246 1.00 0.00 C ATOM 0 H ILE A2090 18.160 -6.081 -19.237 1.00 0.00 H new ATOM 0 HA ILE A2090 15.404 -5.727 -19.869 1.00 0.00 H new ATOM 0 HB ILE A2090 17.083 -8.009 -18.806 1.00 0.00 H new ATOM 0 HG12 ILE A2090 15.979 -7.651 -21.631 1.00 0.00 H new ATOM 0 HG13 ILE A2090 17.510 -6.937 -21.164 1.00 0.00 H new ATOM 0 HG21 ILE A2090 15.274 -9.521 -19.594 1.00 0.00 H new ATOM 0 HG22 ILE A2090 14.723 -8.446 -18.288 1.00 0.00 H new ATOM 0 HG23 ILE A2090 14.270 -8.102 -19.974 1.00 0.00 H new ATOM 0 HD11 ILE A2090 17.861 -9.105 -22.286 1.00 0.00 H new ATOM 0 HD12 ILE A2090 18.403 -9.189 -20.593 1.00 0.00 H new ATOM 0 HD13 ILE A2090 16.849 -9.915 -21.067 1.00 0.00 H new ATOM 508 N LEU A2091 16.109 -6.125 -16.663 1.00 0.00 N ATOM 509 CA LEU A2091 15.618 -5.934 -15.295 1.00 0.00 C ATOM 510 C LEU A2091 15.246 -4.465 -15.015 1.00 0.00 C ATOM 511 O LEU A2091 14.193 -4.207 -14.438 1.00 0.00 O ATOM 512 CB LEU A2091 16.688 -6.424 -14.306 1.00 0.00 C ATOM 513 CG LEU A2091 16.858 -7.952 -14.205 1.00 0.00 C ATOM 514 CD1 LEU A2091 18.089 -8.266 -13.352 1.00 0.00 C ATOM 515 CD2 LEU A2091 15.650 -8.628 -13.555 1.00 0.00 C ATOM 0 H LEU A2091 17.093 -6.390 -16.699 1.00 0.00 H new ATOM 0 HA LEU A2091 14.705 -6.517 -15.170 1.00 0.00 H new ATOM 0 HB2 LEU A2091 17.646 -5.989 -14.591 1.00 0.00 H new ATOM 0 HB3 LEU A2091 16.445 -6.038 -13.316 1.00 0.00 H new ATOM 0 HG LEU A2091 16.964 -8.334 -15.221 1.00 0.00 H new ATOM 0 HD11 LEU A2091 18.214 -9.346 -13.277 1.00 0.00 H new ATOM 0 HD12 LEU A2091 18.974 -7.830 -13.815 1.00 0.00 H new ATOM 0 HD13 LEU A2091 17.957 -7.846 -12.355 1.00 0.00 H new ATOM 0 HD21 LEU A2091 15.818 -9.704 -13.506 1.00 0.00 H new ATOM 0 HD22 LEU A2091 15.513 -8.236 -12.547 1.00 0.00 H new ATOM 0 HD23 LEU A2091 14.758 -8.426 -14.147 1.00 0.00 H new ATOM 527 N LYS A2092 16.050 -3.489 -15.461 1.00 0.00 N ATOM 528 CA LYS A2092 15.764 -2.043 -15.332 1.00 0.00 C ATOM 529 C LYS A2092 14.508 -1.609 -16.101 1.00 0.00 C ATOM 530 O LYS A2092 13.918 -0.582 -15.765 1.00 0.00 O ATOM 531 CB LYS A2092 16.987 -1.214 -15.769 1.00 0.00 C ATOM 532 CG LYS A2092 18.110 -1.157 -14.714 1.00 0.00 C ATOM 533 CD LYS A2092 17.773 -0.382 -13.426 1.00 0.00 C ATOM 534 CE LYS A2092 17.375 1.074 -13.707 1.00 0.00 C ATOM 535 NZ LYS A2092 17.174 1.842 -12.450 1.00 0.00 N ATOM 0 H LYS A2092 16.935 -3.681 -15.931 1.00 0.00 H new ATOM 0 HA LYS A2092 15.560 -1.854 -14.278 1.00 0.00 H new ATOM 0 HB2 LYS A2092 17.389 -1.635 -16.691 1.00 0.00 H new ATOM 0 HB3 LYS A2092 16.663 -0.198 -15.996 1.00 0.00 H new ATOM 0 HG2 LYS A2092 18.381 -2.177 -14.443 1.00 0.00 H new ATOM 0 HG3 LYS A2092 18.990 -0.704 -15.170 1.00 0.00 H new ATOM 0 HD2 LYS A2092 16.958 -0.885 -12.905 1.00 0.00 H new ATOM 0 HD3 LYS A2092 18.635 -0.398 -12.759 1.00 0.00 H new ATOM 0 HE2 LYS A2092 18.149 1.553 -14.306 1.00 0.00 H new ATOM 0 HE3 LYS A2092 16.458 1.093 -14.296 1.00 0.00 H new ATOM 0 HZ1 LYS A2092 16.906 2.820 -12.680 1.00 0.00 H new ATOM 0 HZ2 LYS A2092 16.418 1.399 -11.890 1.00 0.00 H new ATOM 0 HZ3 LYS A2092 18.057 1.845 -11.900 1.00 0.00 H new ATOM 549 N SER A2093 14.070 -2.401 -17.082 1.00 0.00 N ATOM 550 CA SER A2093 12.822 -2.189 -17.839 1.00 0.00 C ATOM 551 C SER A2093 11.602 -2.833 -17.144 1.00 0.00 C ATOM 552 O SER A2093 10.463 -2.614 -17.559 1.00 0.00 O ATOM 553 CB SER A2093 12.963 -2.752 -19.261 1.00 0.00 C ATOM 554 OG SER A2093 14.054 -2.151 -19.943 1.00 0.00 O ATOM 0 H SER A2093 14.582 -3.230 -17.384 1.00 0.00 H new ATOM 0 HA SER A2093 12.650 -1.114 -17.882 1.00 0.00 H new ATOM 0 HB2 SER A2093 13.109 -3.831 -19.215 1.00 0.00 H new ATOM 0 HB3 SER A2093 12.042 -2.578 -19.817 1.00 0.00 H new ATOM 0 HG SER A2093 14.896 -2.511 -19.594 1.00 0.00 H new ATOM 560 N ASN A2094 11.831 -3.613 -16.079 1.00 0.00 N ATOM 561 CA ASN A2094 10.849 -4.330 -15.254 1.00 0.00 C ATOM 562 C ASN A2094 11.283 -4.255 -13.760 1.00 0.00 C ATOM 563 O ASN A2094 11.513 -5.291 -13.129 1.00 0.00 O ATOM 564 CB ASN A2094 10.761 -5.788 -15.761 1.00 0.00 C ATOM 565 CG ASN A2094 10.311 -5.912 -17.206 1.00 0.00 C ATOM 566 OD1 ASN A2094 9.130 -6.020 -17.508 1.00 0.00 O ATOM 567 ND2 ASN A2094 11.236 -5.919 -18.142 1.00 0.00 N ATOM 0 H ASN A2094 12.782 -3.771 -15.746 1.00 0.00 H new ATOM 0 HA ASN A2094 9.860 -3.878 -15.332 1.00 0.00 H new ATOM 0 HB2 ASN A2094 11.738 -6.259 -15.654 1.00 0.00 H new ATOM 0 HB3 ASN A2094 10.069 -6.342 -15.127 1.00 0.00 H new ATOM 0 HD21 ASN A2094 10.969 -6.015 -19.122 1.00 0.00 H new ATOM 0 HD22 ASN A2094 12.220 -5.829 -17.888 1.00 0.00 H new ATOM 574 N PRO A2095 11.460 -3.048 -13.176 1.00 0.00 N ATOM 575 CA PRO A2095 12.040 -2.880 -11.837 1.00 0.00 C ATOM 576 C PRO A2095 11.284 -3.550 -10.683 1.00 0.00 C ATOM 577 O PRO A2095 11.895 -3.837 -9.656 1.00 0.00 O ATOM 578 CB PRO A2095 12.200 -1.368 -11.632 1.00 0.00 C ATOM 579 CG PRO A2095 11.195 -0.755 -12.604 1.00 0.00 C ATOM 580 CD PRO A2095 11.197 -1.744 -13.766 1.00 0.00 C ATOM 0 HA PRO A2095 12.993 -3.408 -11.806 1.00 0.00 H new ATOM 0 HB2 PRO A2095 11.986 -1.080 -10.603 1.00 0.00 H new ATOM 0 HB3 PRO A2095 13.217 -1.041 -11.850 1.00 0.00 H new ATOM 0 HG2 PRO A2095 10.206 -0.660 -12.156 1.00 0.00 H new ATOM 0 HG3 PRO A2095 11.498 0.243 -12.922 1.00 0.00 H new ATOM 0 HD2 PRO A2095 10.240 -1.737 -14.287 1.00 0.00 H new ATOM 0 HD3 PRO A2095 11.961 -1.485 -14.499 1.00 0.00 H new ATOM 588 N GLN A2096 9.989 -3.841 -10.841 1.00 0.00 N ATOM 589 CA GLN A2096 9.161 -4.503 -9.822 1.00 0.00 C ATOM 590 C GLN A2096 9.761 -5.846 -9.372 1.00 0.00 C ATOM 591 O GLN A2096 9.911 -6.105 -8.177 1.00 0.00 O ATOM 592 CB GLN A2096 7.741 -4.738 -10.373 1.00 0.00 C ATOM 593 CG GLN A2096 6.841 -3.494 -10.433 1.00 0.00 C ATOM 594 CD GLN A2096 7.436 -2.323 -11.207 1.00 0.00 C ATOM 595 OE1 GLN A2096 7.790 -1.297 -10.650 1.00 0.00 O ATOM 596 NE2 GLN A2096 7.599 -2.436 -12.509 1.00 0.00 N ATOM 0 H GLN A2096 9.476 -3.620 -11.694 1.00 0.00 H new ATOM 0 HA GLN A2096 9.125 -3.844 -8.954 1.00 0.00 H new ATOM 0 HB2 GLN A2096 7.824 -5.154 -11.377 1.00 0.00 H new ATOM 0 HB3 GLN A2096 7.250 -5.491 -9.756 1.00 0.00 H new ATOM 0 HG2 GLN A2096 5.890 -3.770 -10.889 1.00 0.00 H new ATOM 0 HG3 GLN A2096 6.624 -3.168 -9.416 1.00 0.00 H new ATOM 0 HE21 GLN A2096 7.307 -3.288 -12.987 1.00 0.00 H new ATOM 0 HE22 GLN A2096 8.017 -1.671 -13.039 1.00 0.00 H new ATOM 605 N LEU A2097 10.132 -6.694 -10.334 1.00 0.00 N ATOM 606 CA LEU A2097 10.722 -8.008 -10.065 1.00 0.00 C ATOM 607 C LEU A2097 12.211 -7.935 -9.668 1.00 0.00 C ATOM 608 O LEU A2097 12.685 -8.779 -8.907 1.00 0.00 O ATOM 609 CB LEU A2097 10.379 -8.978 -11.218 1.00 0.00 C ATOM 610 CG LEU A2097 10.612 -8.532 -12.680 1.00 0.00 C ATOM 611 CD1 LEU A2097 12.089 -8.493 -13.069 1.00 0.00 C ATOM 612 CD2 LEU A2097 9.933 -9.523 -13.627 1.00 0.00 C ATOM 0 H LEU A2097 10.031 -6.487 -11.328 1.00 0.00 H new ATOM 0 HA LEU A2097 10.268 -8.430 -9.168 1.00 0.00 H new ATOM 0 HB2 LEU A2097 10.953 -9.891 -11.059 1.00 0.00 H new ATOM 0 HB3 LEU A2097 9.326 -9.243 -11.121 1.00 0.00 H new ATOM 0 HG LEU A2097 10.201 -7.526 -12.759 1.00 0.00 H new ATOM 0 HD11 LEU A2097 12.184 -8.173 -14.107 1.00 0.00 H new ATOM 0 HD12 LEU A2097 12.617 -7.792 -12.423 1.00 0.00 H new ATOM 0 HD13 LEU A2097 12.522 -9.487 -12.955 1.00 0.00 H new ATOM 0 HD21 LEU A2097 10.096 -9.211 -14.658 1.00 0.00 H new ATOM 0 HD22 LEU A2097 10.355 -10.517 -13.478 1.00 0.00 H new ATOM 0 HD23 LEU A2097 8.863 -9.549 -13.420 1.00 0.00 H new ATOM 624 N MET A2098 12.939 -6.904 -10.117 1.00 0.00 N ATOM 625 CA MET A2098 14.353 -6.700 -9.780 1.00 0.00 C ATOM 626 C MET A2098 14.551 -6.199 -8.341 1.00 0.00 C ATOM 627 O MET A2098 15.365 -6.749 -7.595 1.00 0.00 O ATOM 628 CB MET A2098 14.968 -5.686 -10.755 1.00 0.00 C ATOM 629 CG MET A2098 16.496 -5.675 -10.627 1.00 0.00 C ATOM 630 SD MET A2098 17.308 -4.261 -11.414 1.00 0.00 S ATOM 631 CE MET A2098 17.173 -3.109 -10.029 1.00 0.00 C ATOM 0 H MET A2098 12.559 -6.182 -10.730 1.00 0.00 H new ATOM 0 HA MET A2098 14.848 -7.668 -9.862 1.00 0.00 H new ATOM 0 HB2 MET A2098 14.685 -5.938 -11.777 1.00 0.00 H new ATOM 0 HB3 MET A2098 14.573 -4.691 -10.551 1.00 0.00 H new ATOM 0 HG2 MET A2098 16.759 -5.686 -9.569 1.00 0.00 H new ATOM 0 HG3 MET A2098 16.891 -6.593 -11.063 1.00 0.00 H new ATOM 0 HE1 MET A2098 17.621 -2.154 -10.305 1.00 0.00 H new ATOM 0 HE2 MET A2098 16.122 -2.959 -9.782 1.00 0.00 H new ATOM 0 HE3 MET A2098 17.695 -3.518 -9.164 1.00 0.00 H new ATOM 641 N ALA A2099 13.813 -5.159 -7.941 1.00 0.00 N ATOM 642 CA ALA A2099 13.909 -4.564 -6.610 1.00 0.00 C ATOM 643 C ALA A2099 13.554 -5.571 -5.501 1.00 0.00 C ATOM 644 O ALA A2099 14.197 -5.593 -4.449 1.00 0.00 O ATOM 645 CB ALA A2099 13.043 -3.307 -6.571 1.00 0.00 C ATOM 0 H ALA A2099 13.125 -4.704 -8.541 1.00 0.00 H new ATOM 0 HA ALA A2099 14.942 -4.279 -6.412 1.00 0.00 H new ATOM 0 HB1 ALA A2099 13.106 -2.853 -5.582 1.00 0.00 H new ATOM 0 HB2 ALA A2099 13.397 -2.598 -7.319 1.00 0.00 H new ATOM 0 HB3 ALA A2099 12.007 -3.572 -6.784 1.00 0.00 H new ATOM 651 N ALA A2100 12.575 -6.449 -5.756 1.00 0.00 N ATOM 652 CA ALA A2100 12.186 -7.513 -4.834 1.00 0.00 C ATOM 653 C ALA A2100 13.336 -8.518 -4.589 1.00 0.00 C ATOM 654 O ALA A2100 13.529 -8.973 -3.461 1.00 0.00 O ATOM 655 CB ALA A2100 10.938 -8.197 -5.402 1.00 0.00 C ATOM 0 H ALA A2100 12.029 -6.437 -6.617 1.00 0.00 H new ATOM 0 HA ALA A2100 11.960 -7.087 -3.857 1.00 0.00 H new ATOM 0 HB1 ALA A2100 10.625 -8.998 -4.732 1.00 0.00 H new ATOM 0 HB2 ALA A2100 10.134 -7.467 -5.496 1.00 0.00 H new ATOM 0 HB3 ALA A2100 11.166 -8.614 -6.383 1.00 0.00 H new ATOM 661 N PHE A2101 14.126 -8.839 -5.623 1.00 0.00 N ATOM 662 CA PHE A2101 15.279 -9.741 -5.518 1.00 0.00 C ATOM 663 C PHE A2101 16.473 -9.100 -4.793 1.00 0.00 C ATOM 664 O PHE A2101 16.996 -9.682 -3.838 1.00 0.00 O ATOM 665 CB PHE A2101 15.704 -10.204 -6.922 1.00 0.00 C ATOM 666 CG PHE A2101 17.057 -10.893 -6.939 1.00 0.00 C ATOM 667 CD1 PHE A2101 17.187 -12.206 -6.447 1.00 0.00 C ATOM 668 CD2 PHE A2101 18.202 -10.192 -7.371 1.00 0.00 C ATOM 669 CE1 PHE A2101 18.452 -12.819 -6.394 1.00 0.00 C ATOM 670 CE2 PHE A2101 19.466 -10.804 -7.309 1.00 0.00 C ATOM 671 CZ PHE A2101 19.592 -12.118 -6.825 1.00 0.00 C ATOM 0 H PHE A2101 13.980 -8.476 -6.565 1.00 0.00 H new ATOM 0 HA PHE A2101 14.966 -10.596 -4.918 1.00 0.00 H new ATOM 0 HB2 PHE A2101 14.951 -10.886 -7.316 1.00 0.00 H new ATOM 0 HB3 PHE A2101 15.734 -9.342 -7.589 1.00 0.00 H new ATOM 0 HD1 PHE A2101 16.313 -12.744 -6.110 1.00 0.00 H new ATOM 0 HD2 PHE A2101 18.108 -9.185 -7.749 1.00 0.00 H new ATOM 0 HE1 PHE A2101 18.548 -13.828 -6.022 1.00 0.00 H new ATOM 0 HE2 PHE A2101 20.343 -10.263 -7.634 1.00 0.00 H new ATOM 0 HZ PHE A2101 20.563 -12.588 -6.784 1.00 0.00 H new ATOM 681 N ILE A2102 16.924 -7.911 -5.220 1.00 0.00 N ATOM 682 CA ILE A2102 18.108 -7.278 -4.613 1.00 0.00 C ATOM 683 C ILE A2102 17.938 -7.038 -3.109 1.00 0.00 C ATOM 684 O ILE A2102 18.876 -7.250 -2.337 1.00 0.00 O ATOM 685 CB ILE A2102 18.570 -6.034 -5.403 1.00 0.00 C ATOM 686 CG1 ILE A2102 20.039 -5.670 -5.083 1.00 0.00 C ATOM 687 CG2 ILE A2102 17.620 -4.834 -5.286 1.00 0.00 C ATOM 688 CD1 ILE A2102 20.301 -4.753 -3.877 1.00 0.00 C ATOM 0 H ILE A2102 16.495 -7.373 -5.973 1.00 0.00 H new ATOM 0 HA ILE A2102 18.930 -7.989 -4.690 1.00 0.00 H new ATOM 0 HB ILE A2102 18.528 -6.314 -6.456 1.00 0.00 H new ATOM 0 HG12 ILE A2102 20.588 -6.598 -4.924 1.00 0.00 H new ATOM 0 HG13 ILE A2102 20.467 -5.194 -5.965 1.00 0.00 H new ATOM 0 HG21 ILE A2102 18.013 -4.001 -5.868 1.00 0.00 H new ATOM 0 HG22 ILE A2102 16.637 -5.110 -5.666 1.00 0.00 H new ATOM 0 HG23 ILE A2102 17.535 -4.538 -4.240 1.00 0.00 H new ATOM 0 HD11 ILE A2102 21.373 -4.584 -3.774 1.00 0.00 H new ATOM 0 HD12 ILE A2102 19.796 -3.799 -4.029 1.00 0.00 H new ATOM 0 HD13 ILE A2102 19.920 -5.225 -2.971 1.00 0.00 H new ATOM 700 N LYS A2103 16.727 -6.672 -2.672 1.00 0.00 N ATOM 701 CA LYS A2103 16.390 -6.434 -1.262 1.00 0.00 C ATOM 702 C LYS A2103 16.665 -7.636 -0.336 1.00 0.00 C ATOM 703 O LYS A2103 16.910 -7.424 0.851 1.00 0.00 O ATOM 704 CB LYS A2103 14.940 -5.928 -1.198 1.00 0.00 C ATOM 705 CG LYS A2103 14.535 -5.376 0.179 1.00 0.00 C ATOM 706 CD LYS A2103 13.189 -4.635 0.125 1.00 0.00 C ATOM 707 CE LYS A2103 13.316 -3.280 -0.589 1.00 0.00 C ATOM 708 NZ LYS A2103 12.007 -2.591 -0.702 1.00 0.00 N ATOM 0 H LYS A2103 15.937 -6.530 -3.301 1.00 0.00 H new ATOM 0 HA LYS A2103 17.059 -5.670 -0.866 1.00 0.00 H new ATOM 0 HB2 LYS A2103 14.804 -5.147 -1.946 1.00 0.00 H new ATOM 0 HB3 LYS A2103 14.268 -6.744 -1.464 1.00 0.00 H new ATOM 0 HG2 LYS A2103 14.470 -6.196 0.894 1.00 0.00 H new ATOM 0 HG3 LYS A2103 15.308 -4.698 0.541 1.00 0.00 H new ATOM 0 HD2 LYS A2103 12.454 -5.252 -0.392 1.00 0.00 H new ATOM 0 HD3 LYS A2103 12.818 -4.479 1.138 1.00 0.00 H new ATOM 0 HE2 LYS A2103 14.014 -2.646 -0.043 1.00 0.00 H new ATOM 0 HE3 LYS A2103 13.734 -3.432 -1.584 1.00 0.00 H new ATOM 0 HZ1 LYS A2103 12.135 -1.681 -1.189 1.00 0.00 H new ATOM 0 HZ2 LYS A2103 11.348 -3.185 -1.245 1.00 0.00 H new ATOM 0 HZ3 LYS A2103 11.620 -2.423 0.249 1.00 0.00 H new ATOM 722 N GLN A2104 16.703 -8.870 -0.860 1.00 0.00 N ATOM 723 CA GLN A2104 17.109 -10.063 -0.093 1.00 0.00 C ATOM 724 C GLN A2104 18.581 -10.445 -0.357 1.00 0.00 C ATOM 725 O GLN A2104 19.280 -10.868 0.565 1.00 0.00 O ATOM 726 CB GLN A2104 16.138 -11.243 -0.290 1.00 0.00 C ATOM 727 CG GLN A2104 16.011 -11.794 -1.719 1.00 0.00 C ATOM 728 CD GLN A2104 15.350 -13.173 -1.743 1.00 0.00 C ATOM 729 OE1 GLN A2104 14.342 -13.433 -1.100 1.00 0.00 O ATOM 730 NE2 GLN A2104 15.905 -14.121 -2.471 1.00 0.00 N ATOM 0 H GLN A2104 16.453 -9.072 -1.828 1.00 0.00 H new ATOM 0 HA GLN A2104 17.047 -9.799 0.963 1.00 0.00 H new ATOM 0 HB2 GLN A2104 16.453 -12.057 0.363 1.00 0.00 H new ATOM 0 HB3 GLN A2104 15.149 -10.931 0.045 1.00 0.00 H new ATOM 0 HG2 GLN A2104 15.427 -11.101 -2.324 1.00 0.00 H new ATOM 0 HG3 GLN A2104 17.000 -11.858 -2.173 1.00 0.00 H new ATOM 0 HE21 GLN A2104 16.746 -13.921 -3.013 1.00 0.00 H new ATOM 0 HE22 GLN A2104 15.494 -15.054 -2.492 1.00 0.00 H new ATOM 739 N ARG A2105 19.086 -10.253 -1.587 1.00 0.00 N ATOM 740 CA ARG A2105 20.490 -10.516 -1.972 1.00 0.00 C ATOM 741 C ARG A2105 21.485 -9.625 -1.217 1.00 0.00 C ATOM 742 O ARG A2105 22.565 -10.092 -0.864 1.00 0.00 O ATOM 743 CB ARG A2105 20.606 -10.372 -3.501 1.00 0.00 C ATOM 744 CG ARG A2105 22.022 -10.403 -4.097 1.00 0.00 C ATOM 745 CD ARG A2105 22.850 -11.643 -3.741 1.00 0.00 C ATOM 746 NE ARG A2105 24.136 -11.617 -4.469 1.00 0.00 N ATOM 747 CZ ARG A2105 24.501 -12.419 -5.452 1.00 0.00 C ATOM 748 NH1 ARG A2105 23.821 -13.475 -5.785 1.00 0.00 N ATOM 749 NH2 ARG A2105 25.566 -12.183 -6.158 1.00 0.00 N ATOM 0 H ARG A2105 18.521 -9.903 -2.361 1.00 0.00 H new ATOM 0 HA ARG A2105 20.759 -11.533 -1.685 1.00 0.00 H new ATOM 0 HB2 ARG A2105 20.026 -11.172 -3.962 1.00 0.00 H new ATOM 0 HB3 ARG A2105 20.137 -9.431 -3.790 1.00 0.00 H new ATOM 0 HG2 ARG A2105 21.944 -10.336 -5.182 1.00 0.00 H new ATOM 0 HG3 ARG A2105 22.560 -9.517 -3.761 1.00 0.00 H new ATOM 0 HD2 ARG A2105 23.031 -11.673 -2.667 1.00 0.00 H new ATOM 0 HD3 ARG A2105 22.296 -12.546 -3.997 1.00 0.00 H new ATOM 0 HE ARG A2105 24.810 -10.907 -4.183 1.00 0.00 H new ATOM 0 HH11 ARG A2105 22.967 -13.712 -5.279 1.00 0.00 H new ATOM 0 HH12 ARG A2105 24.141 -14.067 -6.552 1.00 0.00 H new ATOM 0 HH21 ARG A2105 26.140 -11.364 -5.957 1.00 0.00 H new ATOM 0 HH22 ARG A2105 25.828 -12.817 -6.913 1.00 0.00 H new ATOM 763 N THR A2106 21.138 -8.371 -0.924 1.00 0.00 N ATOM 764 CA THR A2106 22.008 -7.441 -0.170 1.00 0.00 C ATOM 765 C THR A2106 22.457 -8.007 1.190 1.00 0.00 C ATOM 766 O THR A2106 23.601 -7.808 1.604 1.00 0.00 O ATOM 767 CB THR A2106 21.346 -6.059 -0.027 1.00 0.00 C ATOM 768 OG1 THR A2106 22.283 -5.129 0.467 1.00 0.00 O ATOM 769 CG2 THR A2106 20.133 -6.043 0.905 1.00 0.00 C ATOM 0 H THR A2106 20.245 -7.962 -1.200 1.00 0.00 H new ATOM 0 HA THR A2106 22.919 -7.318 -0.755 1.00 0.00 H new ATOM 0 HB THR A2106 20.998 -5.797 -1.026 1.00 0.00 H new ATOM 0 HG1 THR A2106 21.857 -4.251 0.555 1.00 0.00 H new ATOM 0 HG21 THR A2106 19.724 -5.034 0.952 1.00 0.00 H new ATOM 0 HG22 THR A2106 19.373 -6.725 0.525 1.00 0.00 H new ATOM 0 HG23 THR A2106 20.437 -6.358 1.903 1.00 0.00 H new ATOM 777 N ALA A2107 21.600 -8.794 1.860 1.00 0.00 N ATOM 778 CA ALA A2107 21.899 -9.462 3.134 1.00 0.00 C ATOM 779 C ALA A2107 22.912 -10.628 3.018 1.00 0.00 C ATOM 780 O ALA A2107 23.384 -11.141 4.036 1.00 0.00 O ATOM 781 CB ALA A2107 20.572 -9.935 3.744 1.00 0.00 C ATOM 0 H ALA A2107 20.657 -8.987 1.521 1.00 0.00 H new ATOM 0 HA ALA A2107 22.393 -8.739 3.783 1.00 0.00 H new ATOM 0 HB1 ALA A2107 20.766 -10.436 4.693 1.00 0.00 H new ATOM 0 HB2 ALA A2107 19.922 -9.076 3.913 1.00 0.00 H new ATOM 0 HB3 ALA A2107 20.084 -10.630 3.060 1.00 0.00 H new ATOM 787 N LYS A2108 23.254 -11.046 1.788 1.00 0.00 N ATOM 788 CA LYS A2108 24.199 -12.131 1.457 1.00 0.00 C ATOM 789 C LYS A2108 25.447 -11.634 0.705 1.00 0.00 C ATOM 790 O LYS A2108 26.398 -12.397 0.535 1.00 0.00 O ATOM 791 CB LYS A2108 23.463 -13.206 0.630 1.00 0.00 C ATOM 792 CG LYS A2108 22.283 -13.891 1.345 1.00 0.00 C ATOM 793 CD LYS A2108 22.723 -14.762 2.531 1.00 0.00 C ATOM 794 CE LYS A2108 21.513 -15.503 3.115 1.00 0.00 C ATOM 795 NZ LYS A2108 21.914 -16.440 4.198 1.00 0.00 N ATOM 0 H LYS A2108 22.859 -10.615 0.952 1.00 0.00 H new ATOM 0 HA LYS A2108 24.558 -12.554 2.395 1.00 0.00 H new ATOM 0 HB2 LYS A2108 23.094 -12.746 -0.287 1.00 0.00 H new ATOM 0 HB3 LYS A2108 24.182 -13.971 0.336 1.00 0.00 H new ATOM 0 HG2 LYS A2108 21.588 -13.129 1.699 1.00 0.00 H new ATOM 0 HG3 LYS A2108 21.741 -14.509 0.629 1.00 0.00 H new ATOM 0 HD2 LYS A2108 23.477 -15.479 2.206 1.00 0.00 H new ATOM 0 HD3 LYS A2108 23.184 -14.140 3.298 1.00 0.00 H new ATOM 0 HE2 LYS A2108 20.797 -14.780 3.506 1.00 0.00 H new ATOM 0 HE3 LYS A2108 21.008 -16.056 2.323 1.00 0.00 H new ATOM 0 HZ1 LYS A2108 21.071 -16.923 4.569 1.00 0.00 H new ATOM 0 HZ2 LYS A2108 22.578 -17.145 3.819 1.00 0.00 H new ATOM 0 HZ3 LYS A2108 22.374 -15.908 4.965 1.00 0.00 H new ATOM 1019 N THR B 18 10.399 -22.486 -13.098 1.00 0.00 N ATOM 1020 CA THR B 18 11.710 -21.850 -13.346 1.00 0.00 C ATOM 1021 C THR B 18 11.779 -20.429 -12.757 1.00 0.00 C ATOM 1022 O THR B 18 10.898 -20.034 -11.988 1.00 0.00 O ATOM 1023 CB THR B 18 11.973 -21.810 -14.865 1.00 0.00 C ATOM 1024 OG1 THR B 18 10.952 -21.071 -15.498 1.00 0.00 O ATOM 1025 CG2 THR B 18 12.012 -23.201 -15.490 1.00 0.00 C ATOM 0 HA THR B 18 12.478 -22.443 -12.849 1.00 0.00 H new ATOM 0 HB THR B 18 12.949 -21.345 -15.007 1.00 0.00 H new ATOM 0 HG1 THR B 18 10.144 -21.087 -14.943 1.00 0.00 H new ATOM 0 HG21 THR B 18 12.200 -23.114 -16.560 1.00 0.00 H new ATOM 0 HG22 THR B 18 12.808 -23.785 -15.028 1.00 0.00 H new ATOM 0 HG23 THR B 18 11.056 -23.699 -15.329 1.00 0.00 H new ATOM 1033 N PHE B 19 12.814 -19.645 -13.097 1.00 0.00 N ATOM 1034 CA PHE B 19 13.027 -18.257 -12.647 1.00 0.00 C ATOM 1035 C PHE B 19 11.764 -17.375 -12.702 1.00 0.00 C ATOM 1036 O PHE B 19 11.543 -16.554 -11.813 1.00 0.00 O ATOM 1037 CB PHE B 19 14.169 -17.602 -13.448 1.00 0.00 C ATOM 1038 CG PHE B 19 13.824 -17.206 -14.870 1.00 0.00 C ATOM 1039 CD1 PHE B 19 13.629 -18.199 -15.847 1.00 0.00 C ATOM 1040 CD2 PHE B 19 13.667 -15.850 -15.212 1.00 0.00 C ATOM 1041 CE1 PHE B 19 13.257 -17.841 -17.152 1.00 0.00 C ATOM 1042 CE2 PHE B 19 13.314 -15.489 -16.524 1.00 0.00 C ATOM 1043 CZ PHE B 19 13.106 -16.488 -17.492 1.00 0.00 C ATOM 0 H PHE B 19 13.555 -19.972 -13.717 1.00 0.00 H new ATOM 0 HA PHE B 19 13.300 -18.325 -11.594 1.00 0.00 H new ATOM 0 HB2 PHE B 19 14.502 -16.713 -12.912 1.00 0.00 H new ATOM 0 HB3 PHE B 19 15.012 -18.292 -13.476 1.00 0.00 H new ATOM 0 HD1 PHE B 19 13.766 -19.240 -15.592 1.00 0.00 H new ATOM 0 HD2 PHE B 19 13.818 -15.085 -14.465 1.00 0.00 H new ATOM 0 HE1 PHE B 19 13.087 -18.607 -17.894 1.00 0.00 H new ATOM 0 HE2 PHE B 19 13.203 -14.448 -16.788 1.00 0.00 H new ATOM 0 HZ PHE B 19 12.829 -16.213 -18.499 1.00 0.00 H new ATOM 1053 N SER B 20 10.915 -17.575 -13.715 1.00 0.00 N ATOM 1054 CA SER B 20 9.651 -16.857 -13.909 1.00 0.00 C ATOM 1055 C SER B 20 8.662 -17.021 -12.748 1.00 0.00 C ATOM 1056 O SER B 20 7.864 -16.121 -12.485 1.00 0.00 O ATOM 1057 CB SER B 20 8.992 -17.322 -15.213 1.00 0.00 C ATOM 1058 OG SER B 20 9.937 -17.340 -16.271 1.00 0.00 O ATOM 0 H SER B 20 11.094 -18.263 -14.446 1.00 0.00 H new ATOM 0 HA SER B 20 9.902 -15.797 -13.955 1.00 0.00 H new ATOM 0 HB2 SER B 20 8.570 -18.318 -15.078 1.00 0.00 H new ATOM 0 HB3 SER B 20 8.166 -16.657 -15.467 1.00 0.00 H new ATOM 0 HG SER B 20 9.500 -17.641 -17.095 1.00 0.00 H new ATOM 1064 N ASP B 21 8.731 -18.139 -12.021 1.00 0.00 N ATOM 1065 CA ASP B 21 7.902 -18.409 -10.843 1.00 0.00 C ATOM 1066 C ASP B 21 8.540 -17.877 -9.550 1.00 0.00 C ATOM 1067 O ASP B 21 7.830 -17.596 -8.585 1.00 0.00 O ATOM 1068 CB ASP B 21 7.617 -19.912 -10.757 1.00 0.00 C ATOM 1069 CG ASP B 21 6.448 -20.219 -9.807 1.00 0.00 C ATOM 1070 OD1 ASP B 21 5.301 -19.821 -10.130 1.00 0.00 O ATOM 1071 OD2 ASP B 21 6.666 -20.866 -8.756 1.00 0.00 O ATOM 0 H ASP B 21 9.378 -18.897 -12.239 1.00 0.00 H new ATOM 0 HA ASP B 21 6.959 -17.874 -10.954 1.00 0.00 H new ATOM 0 HB2 ASP B 21 7.388 -20.296 -11.751 1.00 0.00 H new ATOM 0 HB3 ASP B 21 8.511 -20.432 -10.413 1.00 0.00 H new ATOM 1076 N LEU B 22 9.859 -17.650 -9.532 1.00 0.00 N ATOM 1077 CA LEU B 22 10.541 -17.042 -8.381 1.00 0.00 C ATOM 1078 C LEU B 22 10.075 -15.590 -8.191 1.00 0.00 C ATOM 1079 O LEU B 22 9.928 -15.140 -7.054 1.00 0.00 O ATOM 1080 CB LEU B 22 12.074 -17.116 -8.515 1.00 0.00 C ATOM 1081 CG LEU B 22 12.662 -18.525 -8.726 1.00 0.00 C ATOM 1082 CD1 LEU B 22 14.189 -18.431 -8.749 1.00 0.00 C ATOM 1083 CD2 LEU B 22 12.261 -19.518 -7.633 1.00 0.00 C ATOM 0 H LEU B 22 10.480 -17.880 -10.308 1.00 0.00 H new ATOM 0 HA LEU B 22 10.271 -17.616 -7.494 1.00 0.00 H new ATOM 0 HB2 LEU B 22 12.377 -16.487 -9.352 1.00 0.00 H new ATOM 0 HB3 LEU B 22 12.519 -16.688 -7.617 1.00 0.00 H new ATOM 0 HG LEU B 22 12.262 -18.894 -9.670 1.00 0.00 H new ATOM 0 HD11 LEU B 22 14.612 -19.424 -8.898 1.00 0.00 H new ATOM 0 HD12 LEU B 22 14.501 -17.778 -9.564 1.00 0.00 H new ATOM 0 HD13 LEU B 22 14.543 -18.024 -7.802 1.00 0.00 H new ATOM 0 HD21 LEU B 22 12.708 -20.490 -7.842 1.00 0.00 H new ATOM 0 HD22 LEU B 22 12.613 -19.157 -6.667 1.00 0.00 H new ATOM 0 HD23 LEU B 22 11.176 -19.616 -7.610 1.00 0.00 H new ATOM 1095 N TRP B 23 9.764 -14.871 -9.280 1.00 0.00 N ATOM 1096 CA TRP B 23 9.216 -13.507 -9.213 1.00 0.00 C ATOM 1097 C TRP B 23 7.893 -13.452 -8.422 1.00 0.00 C ATOM 1098 O TRP B 23 7.617 -12.457 -7.752 1.00 0.00 O ATOM 1099 CB TRP B 23 9.009 -12.935 -10.619 1.00 0.00 C ATOM 1100 CG TRP B 23 10.165 -13.000 -11.576 1.00 0.00 C ATOM 1101 CD1 TRP B 23 10.057 -13.427 -12.851 1.00 0.00 C ATOM 1102 CD2 TRP B 23 11.570 -12.610 -11.411 1.00 0.00 C ATOM 1103 NE1 TRP B 23 11.279 -13.350 -13.486 1.00 0.00 N ATOM 1104 CE2 TRP B 23 12.250 -12.844 -12.648 1.00 0.00 C ATOM 1105 CE3 TRP B 23 12.339 -12.053 -10.364 1.00 0.00 C ATOM 1106 CZ2 TRP B 23 13.610 -12.554 -12.833 1.00 0.00 C ATOM 1107 CZ3 TRP B 23 13.706 -11.759 -10.536 1.00 0.00 C ATOM 1108 CH2 TRP B 23 14.343 -12.012 -11.764 1.00 0.00 C ATOM 0 H TRP B 23 9.885 -15.218 -10.231 1.00 0.00 H new ATOM 0 HA TRP B 23 9.947 -12.897 -8.682 1.00 0.00 H new ATOM 0 HB2 TRP B 23 8.168 -13.458 -11.073 1.00 0.00 H new ATOM 0 HB3 TRP B 23 8.717 -11.890 -10.516 1.00 0.00 H new ATOM 0 HD1 TRP B 23 9.144 -13.779 -13.309 1.00 0.00 H new ATOM 0 HE1 TRP B 23 11.443 -13.632 -14.452 1.00 0.00 H new ATOM 0 HE3 TRP B 23 11.869 -11.849 -9.413 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 14.087 -12.745 -13.783 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 14.270 -11.336 -9.718 1.00 0.00 H new ATOM 0 HH2 TRP B 23 15.393 -11.790 -11.885 1.00 0.00 H new ATOM 1119 N LYS B 24 7.100 -14.537 -8.469 1.00 0.00 N ATOM 1120 CA LYS B 24 5.822 -14.703 -7.745 1.00 0.00 C ATOM 1121 C LYS B 24 6.000 -15.109 -6.270 1.00 0.00 C ATOM 1122 O LYS B 24 5.045 -15.032 -5.495 1.00 0.00 O ATOM 1123 CB LYS B 24 4.942 -15.739 -8.468 1.00 0.00 C ATOM 1124 CG LYS B 24 4.512 -15.320 -9.887 1.00 0.00 C ATOM 1125 CD LYS B 24 4.043 -16.515 -10.732 1.00 0.00 C ATOM 1126 CE LYS B 24 2.910 -17.326 -10.086 1.00 0.00 C ATOM 1127 NZ LYS B 24 2.817 -18.681 -10.687 1.00 0.00 N ATOM 0 H LYS B 24 7.338 -15.354 -9.032 1.00 0.00 H new ATOM 0 HA LYS B 24 5.338 -13.726 -7.743 1.00 0.00 H new ATOM 0 HB2 LYS B 24 5.485 -16.682 -8.528 1.00 0.00 H new ATOM 0 HB3 LYS B 24 4.050 -15.923 -7.869 1.00 0.00 H new ATOM 0 HG2 LYS B 24 3.707 -14.588 -9.819 1.00 0.00 H new ATOM 0 HG3 LYS B 24 5.347 -14.830 -10.387 1.00 0.00 H new ATOM 0 HD2 LYS B 24 3.708 -16.152 -11.704 1.00 0.00 H new ATOM 0 HD3 LYS B 24 4.891 -17.175 -10.913 1.00 0.00 H new ATOM 0 HE2 LYS B 24 3.084 -17.411 -9.013 1.00 0.00 H new ATOM 0 HE3 LYS B 24 1.963 -16.801 -10.214 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 1.983 -19.173 -10.307 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 2.729 -18.597 -11.720 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 3.674 -19.223 -10.455 1.00 0.00 H new ATOM 1141 N LEU B 25 7.205 -15.538 -5.872 1.00 0.00 N ATOM 1142 CA LEU B 25 7.554 -15.939 -4.497 1.00 0.00 C ATOM 1143 C LEU B 25 8.319 -14.832 -3.744 1.00 0.00 C ATOM 1144 O LEU B 25 8.206 -14.720 -2.520 1.00 0.00 O ATOM 1145 CB LEU B 25 8.374 -17.243 -4.535 1.00 0.00 C ATOM 1146 CG LEU B 25 7.607 -18.475 -5.057 1.00 0.00 C ATOM 1147 CD1 LEU B 25 8.557 -19.671 -5.127 1.00 0.00 C ATOM 1148 CD2 LEU B 25 6.428 -18.857 -4.156 1.00 0.00 C ATOM 0 H LEU B 25 7.991 -15.619 -6.517 1.00 0.00 H new ATOM 0 HA LEU B 25 6.627 -16.107 -3.948 1.00 0.00 H new ATOM 0 HB2 LEU B 25 9.251 -17.086 -5.163 1.00 0.00 H new ATOM 0 HB3 LEU B 25 8.736 -17.457 -3.529 1.00 0.00 H new ATOM 0 HG LEU B 25 7.217 -18.215 -6.041 1.00 0.00 H new ATOM 0 HD11 LEU B 25 8.017 -20.543 -5.496 1.00 0.00 H new ATOM 0 HD12 LEU B 25 9.381 -19.442 -5.803 1.00 0.00 H new ATOM 0 HD13 LEU B 25 8.951 -19.882 -4.133 1.00 0.00 H new ATOM 0 HD21 LEU B 25 5.922 -19.730 -4.569 1.00 0.00 H new ATOM 0 HD22 LEU B 25 6.795 -19.089 -3.156 1.00 0.00 H new ATOM 0 HD23 LEU B 25 5.727 -18.024 -4.101 1.00 0.00 H new ATOM 1408 N LEU B 43 29.873 -3.205 -5.917 1.00 0.00 N ATOM 1409 CA LEU B 43 29.290 -4.547 -5.968 1.00 0.00 C ATOM 1410 C LEU B 43 28.249 -4.620 -7.100 1.00 0.00 C ATOM 1411 O LEU B 43 27.378 -3.755 -7.214 1.00 0.00 O ATOM 1412 CB LEU B 43 28.693 -4.956 -4.603 1.00 0.00 C ATOM 1413 CG LEU B 43 27.781 -3.914 -3.914 1.00 0.00 C ATOM 1414 CD1 LEU B 43 26.595 -4.598 -3.231 1.00 0.00 C ATOM 1415 CD2 LEU B 43 28.539 -3.132 -2.837 1.00 0.00 C ATOM 0 HA LEU B 43 30.080 -5.266 -6.186 1.00 0.00 H new ATOM 0 HB2 LEU B 43 28.121 -5.873 -4.741 1.00 0.00 H new ATOM 0 HB3 LEU B 43 29.515 -5.192 -3.927 1.00 0.00 H new ATOM 0 HG LEU B 43 27.438 -3.237 -4.696 1.00 0.00 H new ATOM 0 HD11 LEU B 43 25.967 -3.846 -2.753 1.00 0.00 H new ATOM 0 HD12 LEU B 43 26.010 -5.140 -3.974 1.00 0.00 H new ATOM 0 HD13 LEU B 43 26.962 -5.296 -2.478 1.00 0.00 H new ATOM 0 HD21 LEU B 43 27.869 -2.409 -2.373 1.00 0.00 H new ATOM 0 HD22 LEU B 43 28.909 -3.822 -2.079 1.00 0.00 H new ATOM 0 HD23 LEU B 43 29.380 -2.608 -3.292 1.00 0.00 H new ATOM 1427 N MET B 44 28.360 -5.649 -7.946 1.00 0.00 N ATOM 1428 CA MET B 44 27.492 -5.902 -9.105 1.00 0.00 C ATOM 1429 C MET B 44 27.464 -7.408 -9.428 1.00 0.00 C ATOM 1430 O MET B 44 28.481 -8.094 -9.286 1.00 0.00 O ATOM 1431 CB MET B 44 28.028 -5.100 -10.308 1.00 0.00 C ATOM 1432 CG MET B 44 27.044 -4.984 -11.484 1.00 0.00 C ATOM 1433 SD MET B 44 26.061 -3.454 -11.563 1.00 0.00 S ATOM 1434 CE MET B 44 25.050 -3.556 -10.060 1.00 0.00 C ATOM 0 H MET B 44 29.085 -6.358 -7.840 1.00 0.00 H new ATOM 0 HA MET B 44 26.473 -5.586 -8.882 1.00 0.00 H new ATOM 0 HB2 MET B 44 28.293 -4.098 -9.972 1.00 0.00 H new ATOM 0 HB3 MET B 44 28.945 -5.570 -10.663 1.00 0.00 H new ATOM 0 HG2 MET B 44 27.607 -5.077 -12.412 1.00 0.00 H new ATOM 0 HG3 MET B 44 26.358 -5.830 -11.441 1.00 0.00 H new ATOM 0 HE1 MET B 44 24.286 -2.779 -10.082 1.00 0.00 H new ATOM 0 HE2 MET B 44 24.571 -4.534 -10.009 1.00 0.00 H new ATOM 0 HE3 MET B 44 25.684 -3.417 -9.185 1.00 0.00 H new ATOM 1444 N LEU B 45 26.300 -7.923 -9.845 1.00 0.00 N ATOM 1445 CA LEU B 45 26.077 -9.343 -10.152 1.00 0.00 C ATOM 1446 C LEU B 45 26.972 -9.883 -11.290 1.00 0.00 C ATOM 1447 O LEU B 45 27.396 -9.149 -12.189 1.00 0.00 O ATOM 1448 CB LEU B 45 24.585 -9.576 -10.468 1.00 0.00 C ATOM 1449 CG LEU B 45 23.589 -9.124 -9.377 1.00 0.00 C ATOM 1450 CD1 LEU B 45 22.161 -9.380 -9.855 1.00 0.00 C ATOM 1451 CD2 LEU B 45 23.775 -9.837 -8.034 1.00 0.00 C ATOM 0 H LEU B 45 25.467 -7.351 -9.982 1.00 0.00 H new ATOM 0 HA LEU B 45 26.363 -9.907 -9.264 1.00 0.00 H new ATOM 0 HB2 LEU B 45 24.343 -9.053 -11.393 1.00 0.00 H new ATOM 0 HB3 LEU B 45 24.434 -10.639 -10.653 1.00 0.00 H new ATOM 0 HG LEU B 45 23.782 -8.064 -9.214 1.00 0.00 H new ATOM 0 HD11 LEU B 45 21.457 -9.061 -9.086 1.00 0.00 H new ATOM 0 HD12 LEU B 45 21.977 -8.817 -10.770 1.00 0.00 H new ATOM 0 HD13 LEU B 45 22.028 -10.444 -10.050 1.00 0.00 H new ATOM 0 HD21 LEU B 45 23.040 -9.466 -7.320 1.00 0.00 H new ATOM 0 HD22 LEU B 45 23.640 -10.910 -8.170 1.00 0.00 H new ATOM 0 HD23 LEU B 45 24.778 -9.643 -7.655 1.00 0.00 H new ATOM 1463 N SER B 46 27.212 -11.194 -11.258 1.00 0.00 N ATOM 1464 CA SER B 46 28.041 -11.975 -12.196 1.00 0.00 C ATOM 1465 C SER B 46 27.200 -12.990 -12.993 1.00 0.00 C ATOM 1466 O SER B 46 26.067 -13.274 -12.598 1.00 0.00 O ATOM 1467 CB SER B 46 29.120 -12.703 -11.375 1.00 0.00 C ATOM 1468 OG SER B 46 30.136 -11.792 -10.986 1.00 0.00 O ATOM 0 H SER B 46 26.809 -11.784 -10.530 1.00 0.00 H new ATOM 0 HA SER B 46 28.495 -11.302 -12.924 1.00 0.00 H new ATOM 0 HB2 SER B 46 28.671 -13.157 -10.492 1.00 0.00 H new ATOM 0 HB3 SER B 46 29.552 -13.512 -11.964 1.00 0.00 H new ATOM 0 HG SER B 46 30.817 -12.265 -10.463 1.00 0.00 H new ATOM 1474 N PRO B 47 27.705 -13.585 -14.098 1.00 0.00 N ATOM 1475 CA PRO B 47 26.942 -14.576 -14.873 1.00 0.00 C ATOM 1476 C PRO B 47 26.516 -15.804 -14.047 1.00 0.00 C ATOM 1477 O PRO B 47 25.484 -16.413 -14.328 1.00 0.00 O ATOM 1478 CB PRO B 47 27.809 -14.931 -16.085 1.00 0.00 C ATOM 1479 CG PRO B 47 29.224 -14.578 -15.633 1.00 0.00 C ATOM 1480 CD PRO B 47 29.010 -13.377 -14.714 1.00 0.00 C ATOM 0 HA PRO B 47 25.989 -14.156 -15.194 1.00 0.00 H new ATOM 0 HB2 PRO B 47 27.723 -15.986 -16.344 1.00 0.00 H new ATOM 0 HB3 PRO B 47 27.517 -14.362 -16.967 1.00 0.00 H new ATOM 0 HG2 PRO B 47 29.697 -15.407 -15.107 1.00 0.00 H new ATOM 0 HG3 PRO B 47 29.866 -14.329 -16.478 1.00 0.00 H new ATOM 0 HD2 PRO B 47 29.795 -13.315 -13.960 1.00 0.00 H new ATOM 0 HD3 PRO B 47 29.034 -12.443 -15.276 1.00 0.00 H new ATOM 1488 N ASP B 48 27.259 -16.113 -12.979 1.00 0.00 N ATOM 1489 CA ASP B 48 26.949 -17.166 -12.001 1.00 0.00 C ATOM 1490 C ASP B 48 25.576 -16.954 -11.323 1.00 0.00 C ATOM 1491 O ASP B 48 24.885 -17.911 -10.976 1.00 0.00 O ATOM 1492 CB ASP B 48 28.066 -17.182 -10.950 1.00 0.00 C ATOM 1493 CG ASP B 48 27.921 -18.355 -9.964 1.00 0.00 C ATOM 1494 OD1 ASP B 48 28.094 -19.524 -10.383 1.00 0.00 O ATOM 1495 OD2 ASP B 48 27.676 -18.108 -8.758 1.00 0.00 O ATOM 0 H ASP B 48 28.125 -15.620 -12.762 1.00 0.00 H new ATOM 0 HA ASP B 48 26.891 -18.122 -12.521 1.00 0.00 H new ATOM 0 HB2 ASP B 48 29.032 -17.248 -11.450 1.00 0.00 H new ATOM 0 HB3 ASP B 48 28.056 -16.242 -10.398 1.00 0.00 H new ATOM 1500 N ASP B 49 25.158 -15.693 -11.177 1.00 0.00 N ATOM 1501 CA ASP B 49 23.864 -15.281 -10.623 1.00 0.00 C ATOM 1502 C ASP B 49 22.715 -15.473 -11.631 1.00 0.00 C ATOM 1503 O ASP B 49 21.567 -15.677 -11.236 1.00 0.00 O ATOM 1504 CB ASP B 49 23.928 -13.824 -10.140 1.00 0.00 C ATOM 1505 CG ASP B 49 25.022 -13.617 -9.084 1.00 0.00 C ATOM 1506 OD1 ASP B 49 25.021 -14.341 -8.062 1.00 0.00 O ATOM 1507 OD2 ASP B 49 25.855 -12.694 -9.220 1.00 0.00 O ATOM 0 H ASP B 49 25.735 -14.899 -11.453 1.00 0.00 H new ATOM 0 HA ASP B 49 23.652 -15.926 -9.770 1.00 0.00 H new ATOM 0 HB2 ASP B 49 24.116 -13.168 -10.990 1.00 0.00 H new ATOM 0 HB3 ASP B 49 22.963 -13.537 -9.723 1.00 0.00 H new ATOM 1512 N ILE B 50 23.009 -15.405 -12.935 1.00 0.00 N ATOM 1513 CA ILE B 50 22.034 -15.592 -14.021 1.00 0.00 C ATOM 1514 C ILE B 50 21.774 -17.090 -14.255 1.00 0.00 C ATOM 1515 O ILE B 50 20.625 -17.506 -14.395 1.00 0.00 O ATOM 1516 CB ILE B 50 22.526 -14.926 -15.334 1.00 0.00 C ATOM 1517 CG1 ILE B 50 23.085 -13.492 -15.157 1.00 0.00 C ATOM 1518 CG2 ILE B 50 21.366 -14.900 -16.350 1.00 0.00 C ATOM 1519 CD1 ILE B 50 23.810 -12.966 -16.406 1.00 0.00 C ATOM 0 H ILE B 50 23.952 -15.214 -13.274 1.00 0.00 H new ATOM 0 HA ILE B 50 21.102 -15.112 -13.722 1.00 0.00 H new ATOM 0 HB ILE B 50 23.360 -15.531 -15.689 1.00 0.00 H new ATOM 0 HG12 ILE B 50 22.265 -12.817 -14.910 1.00 0.00 H new ATOM 0 HG13 ILE B 50 23.774 -13.479 -14.313 1.00 0.00 H new ATOM 0 HG21 ILE B 50 21.703 -14.433 -17.276 1.00 0.00 H new ATOM 0 HG22 ILE B 50 21.039 -15.919 -16.556 1.00 0.00 H new ATOM 0 HG23 ILE B 50 20.534 -14.329 -15.938 1.00 0.00 H new ATOM 0 HD11 ILE B 50 24.177 -11.957 -16.216 1.00 0.00 H new ATOM 0 HD12 ILE B 50 24.650 -13.620 -16.641 1.00 0.00 H new ATOM 0 HD13 ILE B 50 23.118 -12.947 -17.248 1.00 0.00 H new ATOM 1531 N GLU B 51 22.819 -17.925 -14.253 1.00 0.00 N ATOM 1532 CA GLU B 51 22.686 -19.386 -14.405 1.00 0.00 C ATOM 1533 C GLU B 51 22.095 -20.081 -13.154 1.00 0.00 C ATOM 1534 O GLU B 51 21.906 -21.297 -13.131 1.00 0.00 O ATOM 1535 CB GLU B 51 24.029 -20.006 -14.832 1.00 0.00 C ATOM 1536 CG GLU B 51 25.093 -20.016 -13.733 1.00 0.00 C ATOM 1537 CD GLU B 51 26.397 -20.668 -14.232 1.00 0.00 C ATOM 1538 OE1 GLU B 51 27.274 -19.956 -14.778 1.00 0.00 O ATOM 1539 OE2 GLU B 51 26.556 -21.906 -14.084 1.00 0.00 O ATOM 0 H GLU B 51 23.783 -17.611 -14.146 1.00 0.00 H new ATOM 0 HA GLU B 51 21.959 -19.560 -15.198 1.00 0.00 H new ATOM 0 HB2 GLU B 51 23.855 -21.030 -15.163 1.00 0.00 H new ATOM 0 HB3 GLU B 51 24.414 -19.455 -15.690 1.00 0.00 H new ATOM 0 HG2 GLU B 51 25.294 -18.995 -13.407 1.00 0.00 H new ATOM 0 HG3 GLU B 51 24.719 -20.560 -12.865 1.00 0.00 H new ATOM 1546 N GLN B 52 21.803 -19.320 -12.096 1.00 0.00 N ATOM 1547 CA GLN B 52 21.247 -19.814 -10.838 1.00 0.00 C ATOM 1548 C GLN B 52 19.738 -20.098 -10.911 1.00 0.00 C ATOM 1549 O GLN B 52 19.310 -21.209 -10.605 1.00 0.00 O ATOM 1550 CB GLN B 52 21.536 -18.737 -9.775 1.00 0.00 C ATOM 1551 CG GLN B 52 20.891 -18.927 -8.392 1.00 0.00 C ATOM 1552 CD GLN B 52 21.012 -17.665 -7.532 1.00 0.00 C ATOM 1553 OE1 GLN B 52 21.544 -17.679 -6.429 1.00 0.00 O ATOM 1554 NE2 GLN B 52 20.535 -16.523 -7.995 1.00 0.00 N ATOM 0 H GLN B 52 21.953 -18.311 -12.094 1.00 0.00 H new ATOM 0 HA GLN B 52 21.711 -20.770 -10.593 1.00 0.00 H new ATOM 0 HB2 GLN B 52 22.616 -18.677 -9.639 1.00 0.00 H new ATOM 0 HB3 GLN B 52 21.210 -17.775 -10.171 1.00 0.00 H new ATOM 0 HG2 GLN B 52 19.839 -19.185 -8.513 1.00 0.00 H new ATOM 0 HG3 GLN B 52 21.367 -19.763 -7.880 1.00 0.00 H new ATOM 0 HE21 GLN B 52 20.088 -16.491 -8.911 1.00 0.00 H new ATOM 0 HE22 GLN B 52 20.613 -15.673 -7.436 1.00 0.00 H new ATOM 1563 N TRP B 53 18.912 -19.104 -11.266 1.00 0.00 N ATOM 1564 CA TRP B 53 17.448 -19.238 -11.206 1.00 0.00 C ATOM 1565 C TRP B 53 16.776 -20.077 -12.307 1.00 0.00 C ATOM 1566 O TRP B 53 15.646 -20.530 -12.121 1.00 0.00 O ATOM 1567 CB TRP B 53 16.818 -17.846 -11.033 1.00 0.00 C ATOM 1568 CG TRP B 53 17.376 -16.687 -11.809 1.00 0.00 C ATOM 1569 CD1 TRP B 53 17.875 -16.723 -13.065 1.00 0.00 C ATOM 1570 CD2 TRP B 53 17.510 -15.295 -11.374 1.00 0.00 C ATOM 1571 NE1 TRP B 53 18.358 -15.478 -13.408 1.00 0.00 N ATOM 1572 CE2 TRP B 53 18.149 -14.552 -12.412 1.00 0.00 C ATOM 1573 CE3 TRP B 53 17.166 -14.584 -10.202 1.00 0.00 C ATOM 1574 CZ2 TRP B 53 18.445 -13.185 -12.296 1.00 0.00 C ATOM 1575 CZ3 TRP B 53 17.451 -13.209 -10.075 1.00 0.00 C ATOM 1576 CH2 TRP B 53 18.093 -12.511 -11.114 1.00 0.00 C ATOM 0 H TRP B 53 19.233 -18.195 -11.599 1.00 0.00 H new ATOM 0 HA TRP B 53 17.246 -19.853 -10.329 1.00 0.00 H new ATOM 0 HB2 TRP B 53 15.761 -17.931 -11.285 1.00 0.00 H new ATOM 0 HB3 TRP B 53 16.874 -17.590 -9.975 1.00 0.00 H new ATOM 0 HD1 TRP B 53 17.893 -17.594 -13.703 1.00 0.00 H new ATOM 0 HE1 TRP B 53 18.816 -15.268 -14.295 1.00 0.00 H new ATOM 0 HE3 TRP B 53 16.677 -15.102 -9.391 1.00 0.00 H new ATOM 0 HZ2 TRP B 53 18.935 -12.659 -13.102 1.00 0.00 H new ATOM 0 HZ3 TRP B 53 17.174 -12.687 -9.171 1.00 0.00 H new ATOM 0 HH2 TRP B 53 18.315 -11.460 -11.004 1.00 0.00 H new ATOM 1587 N PHE B 54 17.442 -20.328 -13.439 1.00 0.00 N ATOM 1588 CA PHE B 54 16.877 -21.133 -14.543 1.00 0.00 C ATOM 1589 C PHE B 54 17.107 -22.657 -14.397 1.00 0.00 C ATOM 1590 O PHE B 54 16.502 -23.450 -15.121 1.00 0.00 O ATOM 1591 CB PHE B 54 17.420 -20.616 -15.893 1.00 0.00 C ATOM 1592 CG PHE B 54 18.658 -21.328 -16.421 1.00 0.00 C ATOM 1593 CD1 PHE B 54 19.813 -21.432 -15.624 1.00 0.00 C ATOM 1594 CD2 PHE B 54 18.638 -21.938 -17.691 1.00 0.00 C ATOM 1595 CE1 PHE B 54 20.924 -22.167 -16.073 1.00 0.00 C ATOM 1596 CE2 PHE B 54 19.758 -22.654 -18.151 1.00 0.00 C ATOM 1597 CZ PHE B 54 20.900 -22.775 -17.340 1.00 0.00 C ATOM 0 H PHE B 54 18.384 -19.983 -13.622 1.00 0.00 H new ATOM 0 HA PHE B 54 15.795 -21.004 -14.502 1.00 0.00 H new ATOM 0 HB2 PHE B 54 16.629 -20.700 -16.638 1.00 0.00 H new ATOM 0 HB3 PHE B 54 17.649 -19.555 -15.790 1.00 0.00 H new ATOM 0 HD1 PHE B 54 19.846 -20.944 -14.661 1.00 0.00 H new ATOM 0 HD2 PHE B 54 17.759 -21.856 -18.314 1.00 0.00 H new ATOM 0 HE1 PHE B 54 21.797 -22.265 -15.444 1.00 0.00 H new ATOM 0 HE2 PHE B 54 19.741 -23.112 -19.129 1.00 0.00 H new ATOM 0 HZ PHE B 54 21.756 -23.333 -17.689 1.00 0.00 H new ATOM 1607 N THR B 55 17.994 -23.068 -13.481 1.00 0.00 N ATOM 1608 CA THR B 55 18.439 -24.463 -13.272 1.00 0.00 C ATOM 1609 C THR B 55 17.347 -25.478 -12.895 1.00 0.00 C ATOM 1610 O THR B 55 17.525 -26.685 -13.066 1.00 0.00 O ATOM 1611 CB THR B 55 19.573 -24.473 -12.226 1.00 0.00 C ATOM 1612 OG1 THR B 55 20.394 -25.611 -12.386 1.00 0.00 O ATOM 1613 CG2 THR B 55 19.086 -24.437 -10.774 1.00 0.00 C ATOM 0 H THR B 55 18.442 -22.416 -12.837 1.00 0.00 H new ATOM 0 HA THR B 55 18.783 -24.808 -14.247 1.00 0.00 H new ATOM 0 HB THR B 55 20.131 -23.555 -12.411 1.00 0.00 H new ATOM 0 HG1 THR B 55 21.107 -25.597 -11.714 1.00 0.00 H new ATOM 0 HG21 THR B 55 19.944 -24.447 -10.102 1.00 0.00 H new ATOM 0 HG22 THR B 55 18.505 -23.530 -10.608 1.00 0.00 H new ATOM 0 HG23 THR B 55 18.462 -25.309 -10.578 1.00 0.00 H new