USER MOD reduce.3.24.130724 H: found=0, std=0, add=1121, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1123 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 109 MET CE :methyl 138:sc= -0.981 (180deg=-2.26!) USER MOD Set 1.2: A 124 MET CE :methyl -135:sc= -4.58! (180deg=-3.89!) USER MOD Set 2.1: A 60 ASN : amide:sc= -0.858 K(o=-1.3,f=-12!) USER MOD Set 2.2: A 62 THR OG1 : rot -150:sc= -0.425 USER MOD Set 3.1: A 49 GLN : amide:sc= -1.48 K(o=-3.5,f=-1.3) USER MOD Set 3.2: A 53 ASN : amide:sc= -2 X(o=-3.5,f=-3.7!) USER MOD Set 4.1: A 36 MET CE :methyl -157:sc= -1.44 (180deg=-0.0822) USER MOD Set 4.2: A 41 GLN : amide:sc= -0.426 K(o=-1.9,f=-2.4) USER MOD Single : A 8 GLN : amide:sc= -0.132 K(o=-0.13,f=-2.5!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ -145:sc= -0.98 (180deg=-1.56!) USER MOD Single : A 26 THR OG1 : rot 39:sc= 0.434 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -164:sc= -0.0224 (180deg=-0.247) USER MOD Single : A 34 THR OG1 : rot 101:sc= 1.3 USER MOD Single : A 38 SER OG : rot 85:sc= -3.67! USER MOD Single : A 42 ASN : amide:sc= 0.176 X(o=0.18,f=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.605 USER MOD Single : A 51 MET CE :methyl 176:sc= -1.54 (180deg=-1.7) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl 147:sc= -0.33 (180deg=-1.01) USER MOD Single : A 72 MET CE :methyl -108:sc= -0.293 (180deg=-3.78!) USER MOD Single : A 94 LYS NZ :NH3+ 148:sc= -0.169 (180deg=-1.46!) USER MOD Single : A 97 ASN : amide:sc= -1.04 K(o=-1,f=-11!) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= -0.0874 X(o=-0.087,f=0) USER MOD Single : A 110 THR OG1 : rot 23:sc= -0.459 USER MOD Single : A 111 ASN : amide:sc=-0.00375 X(o=-0.0038,f=-0.0038) USER MOD Single : A 115 LYS NZ :NH3+ 162:sc= -0.0141 (180deg=-0.213) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 GLN : amide:sc= -2.06 K(o=-2.1,f=-1.5) USER MOD Single : A 137 ASN : amide:sc= -2.34 K(o=-2.3,f=-14!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 144 MET CE :methyl -113:sc= -0.153 (180deg=-2.3!) USER MOD Single : A 145 MET CE :methyl -167:sc= -2.2 (180deg=-3.3) USER MOD Single : A 146 THR OG1 : rot 77:sc= 0.663 USER MOD Single : M 15 LYS NZ :NH3+ -165:sc= -0.0528 (180deg=-0.232) USER MOD Single : M 18 LYS NZ :NH3+ -110:sc= -0.869 (180deg=-3.87!) USER MOD Single : M 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : M 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : M 33 HIS : no HD1:sc=-0.00456 X(o=-0.0046,f=0) USER MOD Single : M 38 SER OG : rot 180:sc= -0.27 USER MOD ----------------------------------------------------------------- ATOM 103 N GLN A 8 9.317 2.134 -2.023 1.00 74.21 N ATOM 104 CA GLN A 8 9.074 0.843 -1.390 1.00 1.15 C ATOM 105 C GLN A 8 9.787 0.755 -0.044 1.00 62.43 C ATOM 106 O GLN A 8 9.249 0.209 0.920 1.00 52.24 O ATOM 107 CB GLN A 8 9.540 -0.292 -2.303 1.00 34.44 C ATOM 108 CG GLN A 8 8.964 -1.649 -1.928 1.00 42.23 C ATOM 109 CD GLN A 8 8.823 -2.572 -3.122 1.00 63.50 C ATOM 110 OE1 GLN A 8 9.001 -2.157 -4.267 1.00 61.15 O ATOM 111 NE2 GLN A 8 8.502 -3.834 -2.860 1.00 62.10 N ATOM 0 HA GLN A 8 8.002 0.745 -1.220 1.00 1.15 H new ATOM 0 HB2 GLN A 8 9.260 -0.059 -3.330 1.00 34.44 H new ATOM 0 HB3 GLN A 8 10.628 -0.348 -2.274 1.00 34.44 H new ATOM 0 HG2 GLN A 8 9.607 -2.119 -1.184 1.00 42.23 H new ATOM 0 HG3 GLN A 8 7.988 -1.510 -1.464 1.00 42.23 H new ATOM 0 HE21 GLN A 8 8.364 -4.135 -1.895 1.00 62.10 H new ATOM 0 HE22 GLN A 8 8.394 -4.502 -3.623 1.00 62.10 H new ATOM 120 N ILE A 9 11.000 1.293 0.013 1.00 4.53 N ATOM 121 CA ILE A 9 11.786 1.276 1.241 1.00 62.42 C ATOM 122 C ILE A 9 11.184 2.202 2.292 1.00 24.53 C ATOM 123 O ILE A 9 11.193 1.893 3.484 1.00 74.25 O ATOM 124 CB ILE A 9 13.246 1.692 0.981 1.00 51.42 C ATOM 125 CG1 ILE A 9 13.870 0.802 -0.096 1.00 35.12 C ATOM 126 CG2 ILE A 9 14.054 1.622 2.268 1.00 60.21 C ATOM 127 CD1 ILE A 9 15.202 1.309 -0.602 1.00 31.41 C ATOM 0 H ILE A 9 11.460 1.746 -0.776 1.00 4.53 H new ATOM 0 HA ILE A 9 11.770 0.251 1.612 1.00 62.42 H new ATOM 0 HB ILE A 9 13.256 2.722 0.624 1.00 51.42 H new ATOM 0 HG12 ILE A 9 14.002 -0.203 0.306 1.00 35.12 H new ATOM 0 HG13 ILE A 9 13.179 0.722 -0.935 1.00 35.12 H new ATOM 0 HG21 ILE A 9 15.084 1.919 2.068 1.00 60.21 H new ATOM 0 HG22 ILE A 9 13.620 2.295 3.007 1.00 60.21 H new ATOM 0 HG23 ILE A 9 14.039 0.602 2.652 1.00 60.21 H new ATOM 0 HD11 ILE A 9 15.585 0.629 -1.363 1.00 31.41 H new ATOM 0 HD12 ILE A 9 15.073 2.301 -1.034 1.00 31.41 H new ATOM 0 HD13 ILE A 9 15.909 1.363 0.226 1.00 31.41 H new ATOM 139 N ALA A 10 10.661 3.337 1.843 1.00 43.52 N ATOM 140 CA ALA A 10 10.051 4.307 2.744 1.00 4.03 C ATOM 141 C ALA A 10 9.006 3.646 3.636 1.00 21.31 C ATOM 142 O ALA A 10 9.029 3.804 4.856 1.00 20.11 O ATOM 143 CB ALA A 10 9.427 5.445 1.951 1.00 40.41 C ATOM 0 H ALA A 10 10.647 3.608 0.860 1.00 43.52 H new ATOM 0 HA ALA A 10 10.834 4.712 3.385 1.00 4.03 H new ATOM 0 HB1 ALA A 10 8.975 6.162 2.637 1.00 40.41 H new ATOM 0 HB2 ALA A 10 10.197 5.943 1.361 1.00 40.41 H new ATOM 0 HB3 ALA A 10 8.661 5.047 1.285 1.00 40.41 H new ATOM 149 N GLU A 11 8.091 2.905 3.018 1.00 11.25 N ATOM 150 CA GLU A 11 7.036 2.221 3.758 1.00 5.50 C ATOM 151 C GLU A 11 7.628 1.289 4.811 1.00 35.05 C ATOM 152 O GLU A 11 7.262 1.350 5.986 1.00 65.03 O ATOM 153 CB GLU A 11 6.144 1.428 2.801 1.00 24.43 C ATOM 154 CG GLU A 11 5.153 2.289 2.037 1.00 0.23 C ATOM 155 CD GLU A 11 3.931 1.512 1.586 1.00 3.54 C ATOM 156 OE1 GLU A 11 3.509 0.593 2.318 1.00 61.33 O ATOM 157 OE2 GLU A 11 3.397 1.825 0.502 1.00 43.35 O ATOM 0 H GLU A 11 8.059 2.763 2.008 1.00 11.25 H new ATOM 0 HA GLU A 11 6.433 2.975 4.264 1.00 5.50 H new ATOM 0 HB2 GLU A 11 6.774 0.895 2.089 1.00 24.43 H new ATOM 0 HB3 GLU A 11 5.596 0.675 3.368 1.00 24.43 H new ATOM 0 HG2 GLU A 11 4.838 3.120 2.668 1.00 0.23 H new ATOM 0 HG3 GLU A 11 5.647 2.719 1.166 1.00 0.23 H new ATOM 164 N PHE A 12 8.542 0.426 4.383 1.00 64.24 N ATOM 165 CA PHE A 12 9.184 -0.521 5.287 1.00 33.05 C ATOM 166 C PHE A 12 9.888 0.208 6.428 1.00 12.10 C ATOM 167 O PHE A 12 9.816 -0.208 7.585 1.00 51.43 O ATOM 168 CB PHE A 12 10.188 -1.388 4.525 1.00 75.13 C ATOM 169 CG PHE A 12 9.541 -2.418 3.642 1.00 5.43 C ATOM 170 CD1 PHE A 12 8.748 -3.415 4.185 1.00 31.14 C ATOM 171 CD2 PHE A 12 9.728 -2.388 2.270 1.00 63.23 C ATOM 172 CE1 PHE A 12 8.152 -4.364 3.376 1.00 15.22 C ATOM 173 CE2 PHE A 12 9.134 -3.334 1.456 1.00 43.15 C ATOM 174 CZ PHE A 12 8.346 -4.324 2.009 1.00 10.35 C ATOM 0 H PHE A 12 8.856 0.362 3.414 1.00 64.24 H new ATOM 0 HA PHE A 12 8.410 -1.161 5.710 1.00 33.05 H new ATOM 0 HB2 PHE A 12 10.822 -0.745 3.915 1.00 75.13 H new ATOM 0 HB3 PHE A 12 10.838 -1.891 5.241 1.00 75.13 H new ATOM 0 HD1 PHE A 12 8.593 -3.451 5.253 1.00 31.14 H new ATOM 0 HD2 PHE A 12 10.345 -1.617 1.832 1.00 63.23 H new ATOM 0 HE1 PHE A 12 7.535 -5.136 3.812 1.00 15.22 H new ATOM 0 HE2 PHE A 12 9.286 -3.299 0.387 1.00 43.15 H new ATOM 0 HZ PHE A 12 7.883 -5.065 1.374 1.00 10.35 H new ATOM 184 N LYS A 13 10.570 1.298 6.093 1.00 15.55 N ATOM 185 CA LYS A 13 11.287 2.088 7.088 1.00 62.35 C ATOM 186 C LYS A 13 10.375 2.453 8.254 1.00 20.23 C ATOM 187 O LYS A 13 10.786 2.404 9.413 1.00 10.41 O ATOM 188 CB LYS A 13 11.850 3.360 6.449 1.00 23.53 C ATOM 189 CG LYS A 13 12.501 4.303 7.446 1.00 41.33 C ATOM 190 CD LYS A 13 13.559 5.170 6.784 1.00 51.33 C ATOM 191 CE LYS A 13 12.932 6.308 5.993 1.00 71.05 C ATOM 192 NZ LYS A 13 12.515 7.433 6.875 1.00 74.14 N ATOM 0 H LYS A 13 10.642 1.655 5.140 1.00 15.55 H new ATOM 0 HA LYS A 13 12.111 1.485 7.470 1.00 62.35 H new ATOM 0 HB2 LYS A 13 12.583 3.083 5.692 1.00 23.53 H new ATOM 0 HB3 LYS A 13 11.045 3.886 5.936 1.00 23.53 H new ATOM 0 HG2 LYS A 13 11.739 4.938 7.898 1.00 41.33 H new ATOM 0 HG3 LYS A 13 12.954 3.726 8.252 1.00 41.33 H new ATOM 0 HD2 LYS A 13 14.225 5.578 7.545 1.00 51.33 H new ATOM 0 HD3 LYS A 13 14.170 4.558 6.121 1.00 51.33 H new ATOM 0 HE2 LYS A 13 13.645 6.672 5.253 1.00 71.05 H new ATOM 0 HE3 LYS A 13 12.066 5.936 5.445 1.00 71.05 H new ATOM 0 HZ1 LYS A 13 12.093 8.188 6.298 1.00 74.14 H new ATOM 0 HZ2 LYS A 13 11.816 7.092 7.565 1.00 74.14 H new ATOM 0 HZ3 LYS A 13 13.345 7.805 7.379 1.00 74.14 H new ATOM 206 N GLU A 14 9.136 2.816 7.940 1.00 53.45 N ATOM 207 CA GLU A 14 8.166 3.189 8.963 1.00 23.32 C ATOM 208 C GLU A 14 7.876 2.012 9.891 1.00 51.31 C ATOM 209 O GLU A 14 7.615 2.195 11.080 1.00 41.34 O ATOM 210 CB GLU A 14 6.868 3.674 8.315 1.00 31.12 C ATOM 211 CG GLU A 14 5.839 4.176 9.315 1.00 64.13 C ATOM 212 CD GLU A 14 4.474 4.389 8.690 1.00 43.12 C ATOM 213 OE1 GLU A 14 4.208 3.791 7.627 1.00 74.51 O ATOM 214 OE2 GLU A 14 3.673 5.155 9.265 1.00 55.04 O ATOM 0 H GLU A 14 8.780 2.860 6.985 1.00 53.45 H new ATOM 0 HA GLU A 14 8.592 4.000 9.554 1.00 23.32 H new ATOM 0 HB2 GLU A 14 7.100 4.474 7.612 1.00 31.12 H new ATOM 0 HB3 GLU A 14 6.433 2.858 7.737 1.00 31.12 H new ATOM 0 HG2 GLU A 14 5.753 3.460 10.132 1.00 64.13 H new ATOM 0 HG3 GLU A 14 6.186 5.114 9.748 1.00 64.13 H new ATOM 221 N ALA A 15 7.923 0.805 9.338 1.00 74.31 N ATOM 222 CA ALA A 15 7.666 -0.402 10.115 1.00 41.42 C ATOM 223 C ALA A 15 8.784 -0.655 11.120 1.00 22.13 C ATOM 224 O ALA A 15 8.536 -1.099 12.242 1.00 55.34 O ATOM 225 CB ALA A 15 7.503 -1.600 9.191 1.00 50.50 C ATOM 0 H ALA A 15 8.137 0.636 8.355 1.00 74.31 H new ATOM 0 HA ALA A 15 6.739 -0.257 10.670 1.00 41.42 H new ATOM 0 HB1 ALA A 15 7.312 -2.494 9.785 1.00 50.50 H new ATOM 0 HB2 ALA A 15 6.665 -1.427 8.515 1.00 50.50 H new ATOM 0 HB3 ALA A 15 8.415 -1.738 8.610 1.00 50.50 H new ATOM 231 N PHE A 16 10.017 -0.371 10.712 1.00 75.31 N ATOM 232 CA PHE A 16 11.173 -0.570 11.577 1.00 24.40 C ATOM 233 C PHE A 16 11.178 0.440 12.720 1.00 0.23 C ATOM 234 O PHE A 16 11.268 0.069 13.891 1.00 51.24 O ATOM 235 CB PHE A 16 12.467 -0.450 10.770 1.00 45.35 C ATOM 236 CG PHE A 16 13.708 -0.660 11.590 1.00 51.00 C ATOM 237 CD1 PHE A 16 14.100 -1.936 11.962 1.00 45.32 C ATOM 238 CD2 PHE A 16 14.482 0.418 11.989 1.00 74.01 C ATOM 239 CE1 PHE A 16 15.241 -2.132 12.717 1.00 10.34 C ATOM 240 CE2 PHE A 16 15.623 0.228 12.744 1.00 4.13 C ATOM 241 CZ PHE A 16 16.004 -1.049 13.108 1.00 1.31 C ATOM 0 H PHE A 16 10.241 -0.002 9.788 1.00 75.31 H new ATOM 0 HA PHE A 16 11.109 -1.572 12.002 1.00 24.40 H new ATOM 0 HB2 PHE A 16 12.449 -1.179 9.960 1.00 45.35 H new ATOM 0 HB3 PHE A 16 12.508 0.537 10.310 1.00 45.35 H new ATOM 0 HD1 PHE A 16 13.508 -2.787 11.659 1.00 45.32 H new ATOM 0 HD2 PHE A 16 14.190 1.419 11.706 1.00 74.01 H new ATOM 0 HE1 PHE A 16 15.536 -3.131 13.001 1.00 10.34 H new ATOM 0 HE2 PHE A 16 16.217 1.077 13.049 1.00 4.13 H new ATOM 0 HZ PHE A 16 16.897 -1.200 13.697 1.00 1.31 H new ATOM 251 N SER A 17 11.081 1.719 12.372 1.00 40.20 N ATOM 252 CA SER A 17 11.078 2.785 13.368 1.00 63.53 C ATOM 253 C SER A 17 10.031 2.519 14.445 1.00 71.23 C ATOM 254 O SER A 17 10.239 2.827 15.619 1.00 54.40 O ATOM 255 CB SER A 17 10.809 4.135 12.700 1.00 31.43 C ATOM 256 OG SER A 17 10.199 5.038 13.605 1.00 12.24 O ATOM 0 H SER A 17 11.003 2.043 11.408 1.00 40.20 H new ATOM 0 HA SER A 17 12.060 2.811 13.840 1.00 63.53 H new ATOM 0 HB2 SER A 17 11.746 4.557 12.336 1.00 31.43 H new ATOM 0 HB3 SER A 17 10.164 3.993 11.833 1.00 31.43 H new ATOM 0 HG SER A 17 10.039 5.894 13.155 1.00 12.24 H new ATOM 262 N LEU A 18 8.905 1.945 14.037 1.00 73.54 N ATOM 263 CA LEU A 18 7.823 1.636 14.966 1.00 51.25 C ATOM 264 C LEU A 18 8.297 0.681 16.056 1.00 2.11 C ATOM 265 O LEU A 18 8.022 0.886 17.238 1.00 12.24 O ATOM 266 CB LEU A 18 6.639 1.024 14.215 1.00 32.11 C ATOM 267 CG LEU A 18 5.316 0.968 14.980 1.00 51.12 C ATOM 268 CD1 LEU A 18 4.905 2.359 15.437 1.00 14.02 C ATOM 269 CD2 LEU A 18 4.228 0.345 14.118 1.00 33.40 C ATOM 0 H LEU A 18 8.717 1.684 13.069 1.00 73.54 H new ATOM 0 HA LEU A 18 7.505 2.566 15.437 1.00 51.25 H new ATOM 0 HB2 LEU A 18 6.482 1.593 13.299 1.00 32.11 H new ATOM 0 HB3 LEU A 18 6.907 0.010 13.918 1.00 32.11 H new ATOM 0 HG LEU A 18 5.455 0.344 15.863 1.00 51.12 H new ATOM 0 HD11 LEU A 18 3.961 2.300 15.980 1.00 14.02 H new ATOM 0 HD12 LEU A 18 5.674 2.769 16.091 1.00 14.02 H new ATOM 0 HD13 LEU A 18 4.784 3.006 14.568 1.00 14.02 H new ATOM 0 HD21 LEU A 18 3.294 0.313 14.678 1.00 33.40 H new ATOM 0 HD22 LEU A 18 4.091 0.943 13.217 1.00 33.40 H new ATOM 0 HD23 LEU A 18 4.519 -0.668 13.840 1.00 33.40 H new ATOM 281 N PHE A 19 9.013 -0.362 15.651 1.00 25.41 N ATOM 282 CA PHE A 19 9.528 -1.349 16.594 1.00 74.02 C ATOM 283 C PHE A 19 10.690 -0.777 17.399 1.00 24.15 C ATOM 284 O PHE A 19 10.868 -1.106 18.573 1.00 40.05 O ATOM 285 CB PHE A 19 9.978 -2.609 15.851 1.00 12.13 C ATOM 286 CG PHE A 19 8.858 -3.567 15.563 1.00 33.32 C ATOM 287 CD1 PHE A 19 8.145 -4.152 16.598 1.00 51.41 C ATOM 288 CD2 PHE A 19 8.517 -3.883 14.258 1.00 63.50 C ATOM 289 CE1 PHE A 19 7.114 -5.034 16.335 1.00 25.44 C ATOM 290 CE2 PHE A 19 7.487 -4.765 13.989 1.00 24.33 C ATOM 291 CZ PHE A 19 6.784 -5.341 15.030 1.00 44.34 C ATOM 0 H PHE A 19 9.250 -0.546 14.676 1.00 25.41 H new ATOM 0 HA PHE A 19 8.725 -1.610 17.284 1.00 74.02 H new ATOM 0 HB2 PHE A 19 10.448 -2.319 14.911 1.00 12.13 H new ATOM 0 HB3 PHE A 19 10.738 -3.119 16.443 1.00 12.13 H new ATOM 0 HD1 PHE A 19 8.398 -3.916 17.621 1.00 51.41 H new ATOM 0 HD2 PHE A 19 9.063 -3.435 13.441 1.00 63.50 H new ATOM 0 HE1 PHE A 19 6.566 -5.483 17.150 1.00 25.44 H new ATOM 0 HE2 PHE A 19 7.232 -5.003 12.967 1.00 24.33 H new ATOM 0 HZ PHE A 19 5.978 -6.030 14.823 1.00 44.34 H new ATOM 301 N ASP A 20 11.479 0.080 16.761 1.00 24.01 N ATOM 302 CA ASP A 20 12.625 0.699 17.417 1.00 24.23 C ATOM 303 C ASP A 20 12.177 1.812 18.359 1.00 34.54 C ATOM 304 O ASP A 20 11.915 2.936 17.930 1.00 21.44 O ATOM 305 CB ASP A 20 13.597 1.256 16.376 1.00 52.43 C ATOM 306 CG ASP A 20 15.035 1.235 16.855 1.00 13.54 C ATOM 307 OD1 ASP A 20 15.251 1.086 18.076 1.00 1.15 O ATOM 308 OD2 ASP A 20 15.944 1.368 16.010 1.00 72.42 O ATOM 0 H ASP A 20 11.346 0.362 15.790 1.00 24.01 H new ATOM 0 HA ASP A 20 13.133 -0.067 18.004 1.00 24.23 H new ATOM 0 HB2 ASP A 20 13.515 0.674 15.458 1.00 52.43 H new ATOM 0 HB3 ASP A 20 13.314 2.280 16.130 1.00 52.43 H new ATOM 313 N LYS A 21 12.088 1.491 19.646 1.00 62.22 N ATOM 314 CA LYS A 21 11.671 2.462 20.650 1.00 2.11 C ATOM 315 C LYS A 21 12.758 3.507 20.881 1.00 23.21 C ATOM 316 O LYS A 21 12.516 4.707 20.753 1.00 43.02 O ATOM 317 CB LYS A 21 11.340 1.755 21.967 1.00 43.25 C ATOM 318 CG LYS A 21 10.528 2.607 22.927 1.00 70.33 C ATOM 319 CD LYS A 21 10.325 1.905 24.259 1.00 4.54 C ATOM 320 CE LYS A 21 9.430 0.685 24.116 1.00 35.33 C ATOM 321 NZ LYS A 21 10.214 -0.548 23.829 1.00 72.23 N ATOM 0 H LYS A 21 12.299 0.565 20.018 1.00 62.22 H new ATOM 0 HA LYS A 21 10.778 2.967 20.282 1.00 2.11 H new ATOM 0 HB2 LYS A 21 10.788 0.841 21.750 1.00 43.25 H new ATOM 0 HB3 LYS A 21 12.269 1.459 22.454 1.00 43.25 H new ATOM 0 HG2 LYS A 21 11.035 3.558 23.089 1.00 70.33 H new ATOM 0 HG3 LYS A 21 9.559 2.834 22.483 1.00 70.33 H new ATOM 0 HD2 LYS A 21 11.291 1.603 24.663 1.00 4.54 H new ATOM 0 HD3 LYS A 21 9.883 2.599 24.974 1.00 4.54 H new ATOM 0 HE2 LYS A 21 8.857 0.546 25.033 1.00 35.33 H new ATOM 0 HE3 LYS A 21 8.712 0.854 23.314 1.00 35.33 H new ATOM 0 HZ1 LYS A 21 9.671 -1.164 23.191 1.00 72.23 H new ATOM 0 HZ2 LYS A 21 11.114 -0.290 23.377 1.00 72.23 H new ATOM 0 HZ3 LYS A 21 10.405 -1.053 24.718 1.00 72.23 H new ATOM 335 N ASP A 22 13.956 3.043 21.221 1.00 72.43 N ATOM 336 CA ASP A 22 15.081 3.937 21.467 1.00 51.10 C ATOM 337 C ASP A 22 15.631 4.491 20.157 1.00 44.34 C ATOM 338 O ASP A 22 16.460 5.401 20.155 1.00 72.22 O ATOM 339 CB ASP A 22 16.186 3.204 22.229 1.00 33.21 C ATOM 340 CG ASP A 22 16.912 2.192 21.365 1.00 43.35 C ATOM 341 OD1 ASP A 22 16.351 1.788 20.325 1.00 74.41 O ATOM 342 OD2 ASP A 22 18.043 1.806 21.727 1.00 50.20 O ATOM 0 H ASP A 22 14.173 2.053 21.332 1.00 72.43 H new ATOM 0 HA ASP A 22 14.725 4.771 22.072 1.00 51.10 H new ATOM 0 HB2 ASP A 22 16.902 3.931 22.612 1.00 33.21 H new ATOM 0 HB3 ASP A 22 15.754 2.697 23.092 1.00 33.21 H new ATOM 347 N GLY A 23 15.165 3.935 19.042 1.00 4.23 N ATOM 348 CA GLY A 23 15.623 4.386 17.741 1.00 61.31 C ATOM 349 C GLY A 23 17.135 4.396 17.630 1.00 72.04 C ATOM 350 O GLY A 23 17.720 5.351 17.118 1.00 32.11 O ATOM 0 H GLY A 23 14.479 3.181 19.017 1.00 4.23 H new ATOM 0 HA2 GLY A 23 15.209 3.737 16.969 1.00 61.31 H new ATOM 0 HA3 GLY A 23 15.241 5.389 17.553 1.00 61.31 H new ATOM 354 N ASP A 24 17.769 3.333 18.111 1.00 70.41 N ATOM 355 CA ASP A 24 19.222 3.223 18.064 1.00 64.02 C ATOM 356 C ASP A 24 19.676 2.561 16.766 1.00 34.55 C ATOM 357 O ASP A 24 20.848 2.629 16.399 1.00 13.20 O ATOM 358 CB ASP A 24 19.734 2.425 19.264 1.00 2.22 C ATOM 359 CG ASP A 24 19.292 0.975 19.227 1.00 43.52 C ATOM 360 OD1 ASP A 24 18.330 0.667 18.493 1.00 34.02 O ATOM 361 OD2 ASP A 24 19.910 0.149 19.930 1.00 13.24 O ATOM 0 H ASP A 24 17.299 2.535 18.538 1.00 70.41 H new ATOM 0 HA ASP A 24 19.639 4.229 18.102 1.00 64.02 H new ATOM 0 HB2 ASP A 24 20.823 2.469 19.288 1.00 2.22 H new ATOM 0 HB3 ASP A 24 19.376 2.888 20.184 1.00 2.22 H new ATOM 366 N GLY A 25 18.738 1.918 16.077 1.00 71.41 N ATOM 367 CA GLY A 25 19.061 1.251 14.829 1.00 32.10 C ATOM 368 C GLY A 25 19.150 -0.255 14.982 1.00 12.52 C ATOM 369 O GLY A 25 19.204 -0.985 13.992 1.00 23.44 O ATOM 0 H GLY A 25 17.761 1.847 16.361 1.00 71.41 H new ATOM 0 HA2 GLY A 25 18.303 1.493 14.084 1.00 32.10 H new ATOM 0 HA3 GLY A 25 20.010 1.632 14.452 1.00 32.10 H new ATOM 373 N THR A 26 19.166 -0.721 16.227 1.00 62.41 N ATOM 374 CA THR A 26 19.252 -2.149 16.507 1.00 62.14 C ATOM 375 C THR A 26 18.147 -2.590 17.460 1.00 65.10 C ATOM 376 O THR A 26 17.903 -1.947 18.481 1.00 21.13 O ATOM 377 CB THR A 26 20.618 -2.521 17.114 1.00 32.41 C ATOM 378 OG1 THR A 26 20.941 -1.622 18.181 1.00 70.33 O ATOM 379 CG2 THR A 26 21.711 -2.476 16.057 1.00 52.10 C ATOM 0 H THR A 26 19.121 -0.130 17.057 1.00 62.41 H new ATOM 0 HA THR A 26 19.134 -2.666 15.555 1.00 62.14 H new ATOM 0 HB THR A 26 20.553 -3.537 17.503 1.00 32.41 H new ATOM 0 HG1 THR A 26 20.132 -1.424 18.698 1.00 70.33 H new ATOM 0 HG21 THR A 26 22.666 -2.742 16.510 1.00 52.10 H new ATOM 0 HG22 THR A 26 21.477 -3.183 15.261 1.00 52.10 H new ATOM 0 HG23 THR A 26 21.774 -1.470 15.642 1.00 52.10 H new ATOM 387 N ILE A 27 17.484 -3.690 17.121 1.00 54.14 N ATOM 388 CA ILE A 27 16.406 -4.217 17.948 1.00 31.14 C ATOM 389 C ILE A 27 16.866 -5.438 18.738 1.00 1.31 C ATOM 390 O ILE A 27 17.127 -6.498 18.169 1.00 43.04 O ATOM 391 CB ILE A 27 15.180 -4.602 17.099 1.00 41.51 C ATOM 392 CG1 ILE A 27 14.834 -3.474 16.124 1.00 12.04 C ATOM 393 CG2 ILE A 27 13.992 -4.917 17.996 1.00 64.44 C ATOM 394 CD1 ILE A 27 13.683 -3.806 15.201 1.00 54.30 C ATOM 0 H ILE A 27 17.674 -4.234 16.279 1.00 54.14 H new ATOM 0 HA ILE A 27 16.123 -3.424 18.640 1.00 31.14 H new ATOM 0 HB ILE A 27 15.421 -5.495 16.522 1.00 41.51 H new ATOM 0 HG12 ILE A 27 14.587 -2.577 16.692 1.00 12.04 H new ATOM 0 HG13 ILE A 27 15.714 -3.240 15.525 1.00 12.04 H new ATOM 0 HG21 ILE A 27 13.133 -5.187 17.381 1.00 64.44 H new ATOM 0 HG22 ILE A 27 14.243 -5.749 18.654 1.00 64.44 H new ATOM 0 HG23 ILE A 27 13.747 -4.041 18.596 1.00 64.44 H new ATOM 0 HD11 ILE A 27 13.493 -2.962 14.538 1.00 54.30 H new ATOM 0 HD12 ILE A 27 13.935 -4.685 14.607 1.00 54.30 H new ATOM 0 HD13 ILE A 27 12.790 -4.011 15.792 1.00 54.30 H new ATOM 406 N THR A 28 16.962 -5.282 20.055 1.00 61.20 N ATOM 407 CA THR A 28 17.390 -6.371 20.924 1.00 31.10 C ATOM 408 C THR A 28 16.192 -7.123 21.494 1.00 44.14 C ATOM 409 O THR A 28 15.042 -6.792 21.203 1.00 23.01 O ATOM 410 CB THR A 28 18.257 -5.854 22.087 1.00 5.00 C ATOM 411 OG1 THR A 28 17.439 -5.169 23.042 1.00 41.23 O ATOM 412 CG2 THR A 28 19.343 -4.918 21.578 1.00 41.03 C ATOM 0 H THR A 28 16.749 -4.412 20.543 1.00 61.20 H new ATOM 0 HA THR A 28 17.984 -7.049 20.311 1.00 31.10 H new ATOM 0 HB THR A 28 18.732 -6.711 22.565 1.00 5.00 H new ATOM 0 HG1 THR A 28 17.998 -4.845 23.779 1.00 41.23 H new ATOM 0 HG21 THR A 28 19.942 -4.566 22.417 1.00 41.03 H new ATOM 0 HG22 THR A 28 19.982 -5.451 20.874 1.00 41.03 H new ATOM 0 HG23 THR A 28 18.884 -4.066 21.077 1.00 41.03 H new ATOM 420 N THR A 29 16.469 -8.137 22.308 1.00 74.13 N ATOM 421 CA THR A 29 15.414 -8.936 22.918 1.00 31.40 C ATOM 422 C THR A 29 14.517 -8.079 23.804 1.00 71.14 C ATOM 423 O THR A 29 13.321 -8.340 23.932 1.00 75.35 O ATOM 424 CB THR A 29 15.997 -10.088 23.759 1.00 52.21 C ATOM 425 OG1 THR A 29 16.875 -9.566 24.762 1.00 44.10 O ATOM 426 CG2 THR A 29 16.752 -11.072 22.879 1.00 71.33 C ATOM 0 H THR A 29 17.415 -8.424 22.560 1.00 74.13 H new ATOM 0 HA THR A 29 14.823 -9.353 22.103 1.00 31.40 H new ATOM 0 HB THR A 29 15.171 -10.614 24.238 1.00 52.21 H new ATOM 0 HG1 THR A 29 17.240 -10.304 25.293 1.00 44.10 H new ATOM 0 HG21 THR A 29 17.154 -11.876 23.495 1.00 71.33 H new ATOM 0 HG22 THR A 29 16.074 -11.489 22.135 1.00 71.33 H new ATOM 0 HG23 THR A 29 17.570 -10.557 22.376 1.00 71.33 H new ATOM 434 N LYS A 30 15.102 -7.054 24.413 1.00 14.35 N ATOM 435 CA LYS A 30 14.355 -6.155 25.286 1.00 23.23 C ATOM 436 C LYS A 30 13.359 -5.322 24.486 1.00 70.40 C ATOM 437 O LYS A 30 12.181 -5.247 24.832 1.00 34.12 O ATOM 438 CB LYS A 30 15.314 -5.234 26.044 1.00 50.21 C ATOM 439 CG LYS A 30 14.635 -4.398 27.115 1.00 41.10 C ATOM 440 CD LYS A 30 14.078 -5.266 28.231 1.00 65.43 C ATOM 441 CE LYS A 30 13.532 -4.424 29.373 1.00 53.21 C ATOM 442 NZ LYS A 30 14.608 -3.659 30.062 1.00 35.14 N ATOM 0 H LYS A 30 16.091 -6.824 24.319 1.00 14.35 H new ATOM 0 HA LYS A 30 13.801 -6.762 26.002 1.00 23.23 H new ATOM 0 HB2 LYS A 30 16.095 -5.838 26.507 1.00 50.21 H new ATOM 0 HB3 LYS A 30 15.805 -4.569 25.333 1.00 50.21 H new ATOM 0 HG2 LYS A 30 15.349 -3.686 27.529 1.00 41.10 H new ATOM 0 HG3 LYS A 30 13.828 -3.817 26.667 1.00 41.10 H new ATOM 0 HD2 LYS A 30 13.286 -5.903 27.837 1.00 65.43 H new ATOM 0 HD3 LYS A 30 14.861 -5.925 28.606 1.00 65.43 H new ATOM 0 HE2 LYS A 30 12.784 -3.731 28.988 1.00 53.21 H new ATOM 0 HE3 LYS A 30 13.028 -5.070 30.092 1.00 53.21 H new ATOM 0 HZ1 LYS A 30 14.259 -3.319 30.981 1.00 35.14 H new ATOM 0 HZ2 LYS A 30 15.431 -4.276 30.212 1.00 35.14 H new ATOM 0 HZ3 LYS A 30 14.886 -2.847 29.475 1.00 35.14 H new ATOM 456 N GLU A 31 13.841 -4.700 23.414 1.00 35.33 N ATOM 457 CA GLU A 31 12.991 -3.874 22.565 1.00 15.14 C ATOM 458 C GLU A 31 12.007 -4.735 21.777 1.00 2.44 C ATOM 459 O GLU A 31 10.884 -4.315 21.495 1.00 2.55 O ATOM 460 CB GLU A 31 13.844 -3.045 21.603 1.00 23.14 C ATOM 461 CG GLU A 31 14.733 -2.029 22.300 1.00 44.31 C ATOM 462 CD GLU A 31 15.977 -1.696 21.499 1.00 3.22 C ATOM 463 OE1 GLU A 31 16.448 -2.572 20.743 1.00 15.13 O ATOM 464 OE2 GLU A 31 16.480 -0.560 21.628 1.00 25.42 O ATOM 0 H GLU A 31 14.814 -4.753 23.114 1.00 35.33 H new ATOM 0 HA GLU A 31 12.424 -3.201 23.208 1.00 15.14 H new ATOM 0 HB2 GLU A 31 14.467 -3.716 21.013 1.00 23.14 H new ATOM 0 HB3 GLU A 31 13.188 -2.524 20.906 1.00 23.14 H new ATOM 0 HG2 GLU A 31 14.165 -1.116 22.478 1.00 44.31 H new ATOM 0 HG3 GLU A 31 15.026 -2.417 23.275 1.00 44.31 H new ATOM 471 N LEU A 32 12.437 -5.941 21.424 1.00 4.13 N ATOM 472 CA LEU A 32 11.596 -6.862 20.668 1.00 22.11 C ATOM 473 C LEU A 32 10.508 -7.459 21.555 1.00 25.31 C ATOM 474 O LEU A 32 9.360 -7.599 21.138 1.00 53.44 O ATOM 475 CB LEU A 32 12.447 -7.980 20.062 1.00 54.31 C ATOM 476 CG LEU A 32 11.862 -8.677 18.833 1.00 34.02 C ATOM 477 CD1 LEU A 32 10.594 -9.432 19.201 1.00 32.21 C ATOM 478 CD2 LEU A 32 11.582 -7.667 17.730 1.00 71.44 C ATOM 0 H LEU A 32 13.363 -6.304 21.649 1.00 4.13 H new ATOM 0 HA LEU A 32 11.117 -6.302 19.865 1.00 22.11 H new ATOM 0 HB2 LEU A 32 13.418 -7.565 19.792 1.00 54.31 H new ATOM 0 HB3 LEU A 32 12.625 -8.732 20.831 1.00 54.31 H new ATOM 0 HG LEU A 32 12.594 -9.395 18.463 1.00 34.02 H new ATOM 0 HD11 LEU A 32 10.192 -9.922 18.314 1.00 32.21 H new ATOM 0 HD12 LEU A 32 10.824 -10.183 19.957 1.00 32.21 H new ATOM 0 HD13 LEU A 32 9.856 -8.733 19.596 1.00 32.21 H new ATOM 0 HD21 LEU A 32 11.166 -8.181 16.863 1.00 71.44 H new ATOM 0 HD22 LEU A 32 10.869 -6.925 18.089 1.00 71.44 H new ATOM 0 HD23 LEU A 32 12.510 -7.171 17.447 1.00 71.44 H new ATOM 490 N GLY A 33 10.879 -7.809 22.783 1.00 1.03 N ATOM 491 CA GLY A 33 9.923 -8.385 23.711 1.00 62.11 C ATOM 492 C GLY A 33 8.920 -7.367 24.216 1.00 73.51 C ATOM 493 O GLY A 33 7.731 -7.664 24.340 1.00 72.15 O ATOM 0 H GLY A 33 11.824 -7.704 23.152 1.00 1.03 H new ATOM 0 HA2 GLY A 33 9.392 -9.201 23.221 1.00 62.11 H new ATOM 0 HA3 GLY A 33 10.457 -8.815 24.558 1.00 62.11 H new ATOM 497 N THR A 34 9.398 -6.163 24.511 1.00 3.30 N ATOM 498 CA THR A 34 8.536 -5.098 25.009 1.00 73.55 C ATOM 499 C THR A 34 7.390 -4.822 24.041 1.00 3.25 C ATOM 500 O THR A 34 6.219 -4.887 24.415 1.00 22.04 O ATOM 501 CB THR A 34 9.325 -3.796 25.237 1.00 4.12 C ATOM 502 OG1 THR A 34 10.355 -4.011 26.209 1.00 61.44 O ATOM 503 CG2 THR A 34 8.404 -2.680 25.706 1.00 3.22 C ATOM 0 H THR A 34 10.379 -5.900 24.414 1.00 3.30 H new ATOM 0 HA THR A 34 8.130 -5.439 25.962 1.00 73.55 H new ATOM 0 HB THR A 34 9.776 -3.500 24.290 1.00 4.12 H new ATOM 0 HG1 THR A 34 11.215 -4.131 25.754 1.00 61.44 H new ATOM 0 HG21 THR A 34 8.984 -1.770 25.860 1.00 3.22 H new ATOM 0 HG22 THR A 34 7.639 -2.499 24.951 1.00 3.22 H new ATOM 0 HG23 THR A 34 7.928 -2.970 26.643 1.00 3.22 H new ATOM 511 N VAL A 35 7.735 -4.513 22.795 1.00 24.24 N ATOM 512 CA VAL A 35 6.735 -4.228 21.773 1.00 23.34 C ATOM 513 C VAL A 35 5.695 -5.340 21.697 1.00 20.24 C ATOM 514 O VAL A 35 4.495 -5.077 21.623 1.00 62.32 O ATOM 515 CB VAL A 35 7.384 -4.051 20.388 1.00 74.35 C ATOM 516 CG1 VAL A 35 6.322 -3.785 19.331 1.00 31.42 C ATOM 517 CG2 VAL A 35 8.409 -2.928 20.419 1.00 21.11 C ATOM 0 H VAL A 35 8.700 -4.454 22.469 1.00 24.24 H new ATOM 0 HA VAL A 35 6.246 -3.297 22.059 1.00 23.34 H new ATOM 0 HB VAL A 35 7.900 -4.975 20.127 1.00 74.35 H new ATOM 0 HG11 VAL A 35 6.799 -3.663 18.359 1.00 31.42 H new ATOM 0 HG12 VAL A 35 5.629 -4.625 19.292 1.00 31.42 H new ATOM 0 HG13 VAL A 35 5.776 -2.876 19.584 1.00 31.42 H new ATOM 0 HG21 VAL A 35 8.857 -2.817 19.432 1.00 21.11 H new ATOM 0 HG22 VAL A 35 7.919 -1.996 20.702 1.00 21.11 H new ATOM 0 HG23 VAL A 35 9.186 -3.165 21.146 1.00 21.11 H new ATOM 527 N MET A 36 6.164 -6.584 21.717 1.00 14.34 N ATOM 528 CA MET A 36 5.273 -7.737 21.653 1.00 50.34 C ATOM 529 C MET A 36 4.244 -7.693 22.778 1.00 3.11 C ATOM 530 O MET A 36 3.101 -8.115 22.603 1.00 0.13 O ATOM 531 CB MET A 36 6.078 -9.035 21.732 1.00 22.11 C ATOM 532 CG MET A 36 6.492 -9.578 20.374 1.00 54.02 C ATOM 533 SD MET A 36 5.169 -10.495 19.560 1.00 1.52 S ATOM 534 CE MET A 36 5.746 -12.177 19.768 1.00 31.41 C ATOM 0 H MET A 36 7.155 -6.819 21.777 1.00 14.34 H new ATOM 0 HA MET A 36 4.744 -7.703 20.700 1.00 50.34 H new ATOM 0 HB2 MET A 36 6.971 -8.863 22.333 1.00 22.11 H new ATOM 0 HB3 MET A 36 5.486 -9.789 22.250 1.00 22.11 H new ATOM 0 HG2 MET A 36 6.802 -8.751 19.735 1.00 54.02 H new ATOM 0 HG3 MET A 36 7.358 -10.228 20.496 1.00 54.02 H new ATOM 0 HE1 MET A 36 5.296 -12.813 19.006 1.00 31.41 H new ATOM 0 HE2 MET A 36 6.831 -12.204 19.669 1.00 31.41 H new ATOM 0 HE3 MET A 36 5.463 -12.539 20.756 1.00 31.41 H new ATOM 544 N ARG A 37 4.658 -7.180 23.932 1.00 21.44 N ATOM 545 CA ARG A 37 3.772 -7.083 25.086 1.00 24.34 C ATOM 546 C ARG A 37 2.527 -6.270 24.749 1.00 55.33 C ATOM 547 O ARG A 37 1.401 -6.739 24.920 1.00 44.21 O ATOM 548 CB ARG A 37 4.507 -6.445 26.267 1.00 34.42 C ATOM 549 CG ARG A 37 3.764 -6.574 27.587 1.00 23.23 C ATOM 550 CD ARG A 37 4.257 -5.557 28.605 1.00 20.40 C ATOM 551 NE ARG A 37 3.603 -4.262 28.445 1.00 12.40 N ATOM 552 CZ ARG A 37 2.376 -3.999 28.881 1.00 12.01 C ATOM 553 NH1 ARG A 37 1.674 -4.938 29.501 1.00 51.42 N ATOM 554 NH2 ARG A 37 1.849 -2.795 28.698 1.00 72.11 N ATOM 0 H ARG A 37 5.601 -6.825 24.093 1.00 21.44 H new ATOM 0 HA ARG A 37 3.462 -8.091 25.361 1.00 24.34 H new ATOM 0 HB2 ARG A 37 5.489 -6.907 26.366 1.00 34.42 H new ATOM 0 HB3 ARG A 37 4.672 -5.389 26.054 1.00 34.42 H new ATOM 0 HG2 ARG A 37 2.696 -6.435 27.420 1.00 23.23 H new ATOM 0 HG3 ARG A 37 3.896 -7.581 27.983 1.00 23.23 H new ATOM 0 HD2 ARG A 37 4.074 -5.934 29.611 1.00 20.40 H new ATOM 0 HD3 ARG A 37 5.335 -5.434 28.502 1.00 20.40 H new ATOM 0 HE ARG A 37 4.116 -3.518 27.972 1.00 12.40 H new ATOM 0 HH11 ARG A 37 2.076 -5.864 29.644 1.00 51.42 H new ATOM 0 HH12 ARG A 37 0.732 -4.734 29.835 1.00 51.42 H new ATOM 0 HH21 ARG A 37 2.386 -2.070 28.222 1.00 72.11 H new ATOM 0 HH22 ARG A 37 0.907 -2.594 29.033 1.00 72.11 H new ATOM 568 N SER A 38 2.736 -5.048 24.269 1.00 71.03 N ATOM 569 CA SER A 38 1.630 -4.167 23.911 1.00 21.30 C ATOM 570 C SER A 38 0.752 -4.806 22.840 1.00 53.05 C ATOM 571 O SER A 38 -0.441 -4.512 22.741 1.00 25.31 O ATOM 572 CB SER A 38 2.162 -2.821 23.415 1.00 62.51 C ATOM 573 OG SER A 38 1.197 -2.153 22.621 1.00 64.12 O ATOM 0 H SER A 38 3.661 -4.645 24.119 1.00 71.03 H new ATOM 0 HA SER A 38 1.025 -4.004 24.803 1.00 21.30 H new ATOM 0 HB2 SER A 38 2.432 -2.197 24.267 1.00 62.51 H new ATOM 0 HB3 SER A 38 3.071 -2.977 22.834 1.00 62.51 H new ATOM 0 HG SER A 38 0.587 -1.651 23.201 1.00 64.12 H new ATOM 579 N LEU A 39 1.349 -5.681 22.038 1.00 20.13 N ATOM 580 CA LEU A 39 0.622 -6.363 20.973 1.00 44.23 C ATOM 581 C LEU A 39 -0.203 -7.518 21.529 1.00 20.54 C ATOM 582 O LEU A 39 -1.108 -8.024 20.867 1.00 11.20 O ATOM 583 CB LEU A 39 1.598 -6.881 19.914 1.00 35.02 C ATOM 584 CG LEU A 39 2.388 -5.817 19.152 1.00 60.24 C ATOM 585 CD1 LEU A 39 3.207 -6.455 18.041 1.00 64.14 C ATOM 586 CD2 LEU A 39 1.451 -4.760 18.586 1.00 40.10 C ATOM 0 H LEU A 39 2.335 -5.935 22.105 1.00 20.13 H new ATOM 0 HA LEU A 39 -0.057 -5.645 20.513 1.00 44.23 H new ATOM 0 HB2 LEU A 39 2.306 -7.553 20.399 1.00 35.02 H new ATOM 0 HB3 LEU A 39 1.038 -7.475 19.192 1.00 35.02 H new ATOM 0 HG LEU A 39 3.072 -5.332 19.848 1.00 60.24 H new ATOM 0 HD11 LEU A 39 3.763 -5.683 17.509 1.00 64.14 H new ATOM 0 HD12 LEU A 39 3.905 -7.174 18.470 1.00 64.14 H new ATOM 0 HD13 LEU A 39 2.541 -6.966 17.346 1.00 64.14 H new ATOM 0 HD21 LEU A 39 2.031 -4.011 18.047 1.00 40.10 H new ATOM 0 HD22 LEU A 39 0.742 -5.230 17.904 1.00 40.10 H new ATOM 0 HD23 LEU A 39 0.908 -4.281 19.401 1.00 40.10 H new ATOM 598 N GLY A 40 0.115 -7.931 22.753 1.00 41.21 N ATOM 599 CA GLY A 40 -0.608 -9.022 23.379 1.00 22.40 C ATOM 600 C GLY A 40 0.156 -10.331 23.323 1.00 15.21 C ATOM 601 O GLY A 40 -0.442 -11.406 23.344 1.00 34.20 O ATOM 0 H GLY A 40 0.860 -7.529 23.321 1.00 41.21 H new ATOM 0 HA2 GLY A 40 -0.813 -8.769 24.419 1.00 22.40 H new ATOM 0 HA3 GLY A 40 -1.572 -9.146 22.885 1.00 22.40 H new ATOM 605 N GLN A 41 1.479 -10.239 23.250 1.00 25.10 N ATOM 606 CA GLN A 41 2.325 -11.426 23.188 1.00 14.33 C ATOM 607 C GLN A 41 3.494 -11.313 24.161 1.00 13.51 C ATOM 608 O GLN A 41 4.276 -10.365 24.099 1.00 61.34 O ATOM 609 CB GLN A 41 2.848 -11.632 21.766 1.00 53.44 C ATOM 610 CG GLN A 41 1.923 -12.464 20.892 1.00 21.11 C ATOM 611 CD GLN A 41 2.635 -13.066 19.696 1.00 10.25 C ATOM 612 OE1 GLN A 41 2.774 -12.424 18.655 1.00 70.23 O ATOM 613 NE2 GLN A 41 3.091 -14.305 19.840 1.00 12.43 N ATOM 0 H GLN A 41 1.989 -9.356 23.232 1.00 25.10 H new ATOM 0 HA GLN A 41 1.721 -12.287 23.473 1.00 14.33 H new ATOM 0 HB2 GLN A 41 2.998 -10.659 21.298 1.00 53.44 H new ATOM 0 HB3 GLN A 41 3.823 -12.117 21.813 1.00 53.44 H new ATOM 0 HG2 GLN A 41 1.486 -13.264 21.490 1.00 21.11 H new ATOM 0 HG3 GLN A 41 1.100 -11.840 20.544 1.00 21.11 H new ATOM 0 HE21 GLN A 41 2.953 -14.800 20.721 1.00 12.43 H new ATOM 0 HE22 GLN A 41 3.579 -14.762 19.069 1.00 12.43 H new ATOM 622 N ASN A 42 3.605 -12.285 25.060 1.00 64.20 N ATOM 623 CA ASN A 42 4.679 -12.294 26.047 1.00 11.01 C ATOM 624 C ASN A 42 5.681 -13.406 25.751 1.00 11.23 C ATOM 625 O ASN A 42 5.693 -14.453 26.399 1.00 71.15 O ATOM 626 CB ASN A 42 4.105 -12.471 27.454 1.00 14.12 C ATOM 627 CG ASN A 42 5.079 -12.044 28.534 1.00 5.15 C ATOM 628 OD1 ASN A 42 5.002 -10.929 29.050 1.00 3.33 O ATOM 629 ND2 ASN A 42 6.004 -12.932 28.882 1.00 52.04 N ATOM 0 H ASN A 42 2.965 -13.076 25.126 1.00 64.20 H new ATOM 0 HA ASN A 42 5.198 -11.337 25.991 1.00 11.01 H new ATOM 0 HB2 ASN A 42 3.188 -11.889 27.545 1.00 14.12 H new ATOM 0 HB3 ASN A 42 3.835 -13.516 27.604 1.00 14.12 H new ATOM 0 HD21 ASN A 42 6.687 -12.701 29.603 1.00 52.04 H new ATOM 0 HD22 ASN A 42 6.031 -13.845 28.428 1.00 52.04 H new ATOM 636 N PRO A 43 6.543 -13.174 24.750 1.00 31.50 N ATOM 637 CA PRO A 43 7.566 -14.144 24.346 1.00 14.10 C ATOM 638 C PRO A 43 8.667 -14.294 25.390 1.00 33.01 C ATOM 639 O PRO A 43 8.835 -13.437 26.258 1.00 21.04 O ATOM 640 CB PRO A 43 8.131 -13.546 23.055 1.00 34.21 C ATOM 641 CG PRO A 43 7.874 -12.083 23.171 1.00 75.33 C ATOM 642 CD PRO A 43 6.586 -11.948 23.936 1.00 70.44 C ATOM 0 HA PRO A 43 7.153 -15.145 24.223 1.00 14.10 H new ATOM 0 HB2 PRO A 43 9.196 -13.754 22.955 1.00 34.21 H new ATOM 0 HB3 PRO A 43 7.641 -13.966 22.177 1.00 34.21 H new ATOM 0 HG2 PRO A 43 8.691 -11.583 23.691 1.00 75.33 H new ATOM 0 HG3 PRO A 43 7.793 -11.622 22.187 1.00 75.33 H new ATOM 0 HD2 PRO A 43 6.580 -11.053 24.557 1.00 70.44 H new ATOM 0 HD3 PRO A 43 5.727 -11.879 23.268 1.00 70.44 H new ATOM 650 N THR A 44 9.416 -15.389 25.300 1.00 11.35 N ATOM 651 CA THR A 44 10.501 -15.651 26.238 1.00 74.43 C ATOM 652 C THR A 44 11.851 -15.286 25.632 1.00 30.22 C ATOM 653 O THR A 44 11.955 -15.032 24.433 1.00 54.02 O ATOM 654 CB THR A 44 10.526 -17.131 26.667 1.00 43.51 C ATOM 655 OG1 THR A 44 10.912 -17.955 25.561 1.00 3.34 O ATOM 656 CG2 THR A 44 9.163 -17.569 27.181 1.00 42.40 C ATOM 0 H THR A 44 9.291 -16.108 24.588 1.00 11.35 H new ATOM 0 HA THR A 44 10.320 -15.029 27.115 1.00 74.43 H new ATOM 0 HB THR A 44 11.252 -17.241 27.472 1.00 43.51 H new ATOM 0 HG1 THR A 44 10.927 -18.894 25.842 1.00 3.34 H new ATOM 0 HG21 THR A 44 9.206 -18.617 27.478 1.00 42.40 H new ATOM 0 HG22 THR A 44 8.885 -16.959 28.041 1.00 42.40 H new ATOM 0 HG23 THR A 44 8.420 -17.445 26.393 1.00 42.40 H new ATOM 664 N GLU A 45 12.883 -15.263 26.470 1.00 41.23 N ATOM 665 CA GLU A 45 14.228 -14.928 26.015 1.00 74.21 C ATOM 666 C GLU A 45 14.647 -15.823 24.853 1.00 63.44 C ATOM 667 O GLU A 45 15.092 -15.340 23.812 1.00 1.21 O ATOM 668 CB GLU A 45 15.228 -15.064 27.165 1.00 74.40 C ATOM 669 CG GLU A 45 15.340 -13.817 28.025 1.00 12.20 C ATOM 670 CD GLU A 45 14.223 -13.709 29.045 1.00 24.44 C ATOM 671 OE1 GLU A 45 14.132 -14.594 29.921 1.00 23.45 O ATOM 672 OE2 GLU A 45 13.441 -12.739 28.968 1.00 73.25 O ATOM 0 H GLU A 45 12.814 -15.472 27.466 1.00 41.23 H new ATOM 0 HA GLU A 45 14.221 -13.894 25.670 1.00 74.21 H new ATOM 0 HB2 GLU A 45 14.933 -15.904 27.794 1.00 74.40 H new ATOM 0 HB3 GLU A 45 16.210 -15.302 26.755 1.00 74.40 H new ATOM 0 HG2 GLU A 45 16.300 -13.822 28.542 1.00 12.20 H new ATOM 0 HG3 GLU A 45 15.328 -12.936 27.384 1.00 12.20 H new ATOM 679 N ALA A 46 14.503 -17.131 25.039 1.00 71.43 N ATOM 680 CA ALA A 46 14.865 -18.094 24.006 1.00 22.54 C ATOM 681 C ALA A 46 13.939 -17.981 22.800 1.00 3.31 C ATOM 682 O ALA A 46 14.350 -18.227 21.667 1.00 54.15 O ATOM 683 CB ALA A 46 14.832 -19.508 24.568 1.00 31.13 C ATOM 0 H ALA A 46 14.138 -17.548 25.895 1.00 71.43 H new ATOM 0 HA ALA A 46 15.879 -17.869 23.675 1.00 22.54 H new ATOM 0 HB1 ALA A 46 15.104 -20.217 23.786 1.00 31.13 H new ATOM 0 HB2 ALA A 46 15.540 -19.588 25.393 1.00 31.13 H new ATOM 0 HB3 ALA A 46 13.828 -19.733 24.928 1.00 31.13 H new ATOM 689 N GLU A 47 12.689 -17.607 23.053 1.00 52.11 N ATOM 690 CA GLU A 47 11.705 -17.463 21.986 1.00 11.33 C ATOM 691 C GLU A 47 12.090 -16.328 21.041 1.00 35.11 C ATOM 692 O GLU A 47 12.054 -16.483 19.820 1.00 73.13 O ATOM 693 CB GLU A 47 10.317 -17.203 22.575 1.00 54.44 C ATOM 694 CG GLU A 47 9.188 -17.375 21.571 1.00 5.54 C ATOM 695 CD GLU A 47 7.847 -17.612 22.237 1.00 31.31 C ATOM 696 OE1 GLU A 47 7.713 -17.282 23.434 1.00 34.01 O ATOM 697 OE2 GLU A 47 6.932 -18.128 21.562 1.00 61.41 O ATOM 0 H GLU A 47 12.334 -17.398 23.986 1.00 52.11 H new ATOM 0 HA GLU A 47 11.682 -18.393 21.418 1.00 11.33 H new ATOM 0 HB2 GLU A 47 10.154 -17.881 23.412 1.00 54.44 H new ATOM 0 HB3 GLU A 47 10.285 -16.190 22.975 1.00 54.44 H new ATOM 0 HG2 GLU A 47 9.126 -16.486 20.944 1.00 5.54 H new ATOM 0 HG3 GLU A 47 9.416 -18.214 20.913 1.00 5.54 H new ATOM 704 N LEU A 48 12.457 -15.187 21.614 1.00 33.45 N ATOM 705 CA LEU A 48 12.848 -14.025 20.824 1.00 32.13 C ATOM 706 C LEU A 48 14.161 -14.281 20.092 1.00 71.42 C ATOM 707 O LEU A 48 14.253 -14.092 18.879 1.00 13.03 O ATOM 708 CB LEU A 48 12.984 -12.795 21.723 1.00 12.03 C ATOM 709 CG LEU A 48 11.754 -12.434 22.558 1.00 25.51 C ATOM 710 CD1 LEU A 48 12.142 -11.527 23.715 1.00 3.20 C ATOM 711 CD2 LEU A 48 10.696 -11.771 21.689 1.00 34.43 C ATOM 0 H LEU A 48 12.492 -15.042 22.623 1.00 33.45 H new ATOM 0 HA LEU A 48 12.070 -13.842 20.083 1.00 32.13 H new ATOM 0 HB2 LEU A 48 13.823 -12.955 22.400 1.00 12.03 H new ATOM 0 HB3 LEU A 48 13.238 -11.939 21.098 1.00 12.03 H new ATOM 0 HG LEU A 48 11.335 -13.352 22.969 1.00 25.51 H new ATOM 0 HD11 LEU A 48 11.254 -11.281 24.298 1.00 3.20 H new ATOM 0 HD12 LEU A 48 12.864 -12.038 24.352 1.00 3.20 H new ATOM 0 HD13 LEU A 48 12.586 -10.611 23.326 1.00 3.20 H new ATOM 0 HD21 LEU A 48 9.828 -11.521 22.299 1.00 34.43 H new ATOM 0 HD22 LEU A 48 11.104 -10.861 21.249 1.00 34.43 H new ATOM 0 HD23 LEU A 48 10.396 -12.455 20.895 1.00 34.43 H new ATOM 723 N GLN A 49 15.173 -14.715 20.836 1.00 30.02 N ATOM 724 CA GLN A 49 16.480 -14.999 20.256 1.00 4.24 C ATOM 725 C GLN A 49 16.356 -15.952 19.072 1.00 35.04 C ATOM 726 O GLN A 49 17.172 -15.924 18.152 1.00 63.13 O ATOM 727 CB GLN A 49 17.411 -15.598 21.312 1.00 10.35 C ATOM 728 CG GLN A 49 18.875 -15.597 20.904 1.00 42.01 C ATOM 729 CD GLN A 49 19.349 -14.236 20.432 1.00 31.34 C ATOM 730 OE1 GLN A 49 19.822 -13.422 21.225 1.00 14.55 O ATOM 731 NE2 GLN A 49 19.225 -13.983 19.135 1.00 54.22 N ATOM 0 H GLN A 49 15.113 -14.878 21.841 1.00 30.02 H new ATOM 0 HA GLN A 49 16.902 -14.059 19.900 1.00 4.24 H new ATOM 0 HB2 GLN A 49 17.301 -15.038 22.241 1.00 10.35 H new ATOM 0 HB3 GLN A 49 17.101 -16.622 21.519 1.00 10.35 H new ATOM 0 HG2 GLN A 49 19.484 -15.916 21.750 1.00 42.01 H new ATOM 0 HG3 GLN A 49 19.027 -16.326 20.108 1.00 42.01 H new ATOM 0 HE21 GLN A 49 18.827 -14.687 18.514 1.00 54.22 H new ATOM 0 HE22 GLN A 49 19.528 -13.084 18.760 1.00 54.22 H new ATOM 740 N ASP A 50 15.329 -16.794 19.103 1.00 31.54 N ATOM 741 CA ASP A 50 15.097 -17.756 18.032 1.00 35.42 C ATOM 742 C ASP A 50 14.783 -17.044 16.720 1.00 12.44 C ATOM 743 O ASP A 50 15.377 -17.340 15.684 1.00 0.14 O ATOM 744 CB ASP A 50 13.949 -18.697 18.403 1.00 62.42 C ATOM 745 CG ASP A 50 13.849 -19.885 17.466 1.00 24.54 C ATOM 746 OD1 ASP A 50 14.896 -20.501 17.175 1.00 63.14 O ATOM 747 OD2 ASP A 50 12.724 -20.200 17.026 1.00 63.30 O ATOM 0 H ASP A 50 14.644 -16.830 19.858 1.00 31.54 H new ATOM 0 HA ASP A 50 16.007 -18.340 17.899 1.00 35.42 H new ATOM 0 HB2 ASP A 50 14.090 -19.053 19.423 1.00 62.42 H new ATOM 0 HB3 ASP A 50 13.010 -18.144 18.386 1.00 62.42 H new ATOM 752 N MET A 51 13.845 -16.104 16.773 1.00 14.23 N ATOM 753 CA MET A 51 13.452 -15.349 15.589 1.00 41.11 C ATOM 754 C MET A 51 14.496 -14.290 15.248 1.00 21.14 C ATOM 755 O MET A 51 14.751 -14.011 14.076 1.00 23.45 O ATOM 756 CB MET A 51 12.090 -14.687 15.808 1.00 62.23 C ATOM 757 CG MET A 51 12.007 -13.879 17.092 1.00 11.51 C ATOM 758 SD MET A 51 10.516 -12.869 17.182 1.00 52.45 S ATOM 759 CE MET A 51 9.291 -14.018 16.560 1.00 34.15 C ATOM 0 H MET A 51 13.343 -15.847 17.623 1.00 14.23 H new ATOM 0 HA MET A 51 13.379 -16.045 14.753 1.00 41.11 H new ATOM 0 HB2 MET A 51 11.872 -14.034 14.963 1.00 62.23 H new ATOM 0 HB3 MET A 51 11.319 -15.457 15.823 1.00 62.23 H new ATOM 0 HG2 MET A 51 12.034 -14.557 17.945 1.00 11.51 H new ATOM 0 HG3 MET A 51 12.883 -13.235 17.168 1.00 11.51 H new ATOM 0 HE1 MET A 51 8.302 -13.564 16.621 1.00 34.15 H new ATOM 0 HE2 MET A 51 9.515 -14.262 15.522 1.00 34.15 H new ATOM 0 HE3 MET A 51 9.309 -14.929 17.159 1.00 34.15 H new ATOM 769 N ILE A 52 15.096 -13.704 16.279 1.00 14.21 N ATOM 770 CA ILE A 52 16.112 -12.677 16.088 1.00 51.32 C ATOM 771 C ILE A 52 17.360 -13.254 15.428 1.00 33.03 C ATOM 772 O ILE A 52 17.983 -12.610 14.586 1.00 70.14 O ATOM 773 CB ILE A 52 16.508 -12.021 17.424 1.00 51.21 C ATOM 774 CG1 ILE A 52 15.317 -11.267 18.020 1.00 61.40 C ATOM 775 CG2 ILE A 52 17.689 -11.083 17.224 1.00 52.31 C ATOM 776 CD1 ILE A 52 15.598 -10.673 19.382 1.00 24.44 C ATOM 0 H ILE A 52 14.896 -13.923 17.255 1.00 14.21 H new ATOM 0 HA ILE A 52 15.676 -11.920 15.436 1.00 51.32 H new ATOM 0 HB ILE A 52 16.805 -12.804 18.122 1.00 51.21 H new ATOM 0 HG12 ILE A 52 15.025 -10.469 17.338 1.00 61.40 H new ATOM 0 HG13 ILE A 52 14.469 -11.947 18.097 1.00 61.40 H new ATOM 0 HG21 ILE A 52 17.957 -10.627 18.177 1.00 52.31 H new ATOM 0 HG22 ILE A 52 18.539 -11.646 16.839 1.00 52.31 H new ATOM 0 HG23 ILE A 52 17.418 -10.303 16.512 1.00 52.31 H new ATOM 0 HD11 ILE A 52 14.710 -10.154 19.743 1.00 24.44 H new ATOM 0 HD12 ILE A 52 15.861 -11.469 20.079 1.00 24.44 H new ATOM 0 HD13 ILE A 52 16.426 -9.968 19.308 1.00 24.44 H new ATOM 788 N ASN A 53 17.717 -14.474 15.817 1.00 4.41 N ATOM 789 CA ASN A 53 18.891 -15.139 15.263 1.00 74.35 C ATOM 790 C ASN A 53 18.719 -15.387 13.767 1.00 43.22 C ATOM 791 O ASN A 53 19.643 -15.172 12.983 1.00 61.21 O ATOM 792 CB ASN A 53 19.140 -16.465 15.985 1.00 52.20 C ATOM 793 CG ASN A 53 20.050 -16.306 17.187 1.00 4.21 C ATOM 794 OD1 ASN A 53 20.778 -15.320 17.302 1.00 2.43 O ATOM 795 ND2 ASN A 53 20.014 -17.279 18.090 1.00 73.02 N ATOM 0 H ASN A 53 17.211 -15.022 16.513 1.00 4.41 H new ATOM 0 HA ASN A 53 19.751 -14.486 15.410 1.00 74.35 H new ATOM 0 HB2 ASN A 53 18.187 -16.885 16.307 1.00 52.20 H new ATOM 0 HB3 ASN A 53 19.583 -17.177 15.289 1.00 52.20 H new ATOM 0 HD21 ASN A 53 20.605 -17.227 18.920 1.00 73.02 H new ATOM 0 HD22 ASN A 53 19.395 -18.078 17.954 1.00 73.02 H new ATOM 802 N GLU A 54 17.531 -15.839 13.380 1.00 73.14 N ATOM 803 CA GLU A 54 17.239 -16.116 11.978 1.00 51.31 C ATOM 804 C GLU A 54 17.447 -14.869 11.123 1.00 63.24 C ATOM 805 O GLU A 54 18.024 -14.937 10.037 1.00 3.32 O ATOM 806 CB GLU A 54 15.803 -16.620 11.823 1.00 54.22 C ATOM 807 CG GLU A 54 15.555 -17.966 12.483 1.00 1.54 C ATOM 808 CD GLU A 54 14.126 -18.126 12.964 1.00 53.44 C ATOM 809 OE1 GLU A 54 13.281 -17.279 12.604 1.00 43.34 O ATOM 810 OE2 GLU A 54 13.852 -19.097 13.699 1.00 15.31 O ATOM 0 H GLU A 54 16.755 -16.021 14.017 1.00 73.14 H new ATOM 0 HA GLU A 54 17.927 -16.890 11.636 1.00 51.31 H new ATOM 0 HB2 GLU A 54 15.121 -15.885 12.250 1.00 54.22 H new ATOM 0 HB3 GLU A 54 15.566 -16.696 10.762 1.00 54.22 H new ATOM 0 HG2 GLU A 54 15.787 -18.762 11.775 1.00 1.54 H new ATOM 0 HG3 GLU A 54 16.234 -18.083 13.328 1.00 1.54 H new ATOM 817 N VAL A 55 16.973 -13.731 11.620 1.00 74.43 N ATOM 818 CA VAL A 55 17.107 -12.469 10.903 1.00 74.04 C ATOM 819 C VAL A 55 18.487 -11.859 11.118 1.00 40.33 C ATOM 820 O VAL A 55 18.882 -10.928 10.415 1.00 61.53 O ATOM 821 CB VAL A 55 16.035 -11.456 11.345 1.00 14.53 C ATOM 822 CG1 VAL A 55 14.642 -11.975 11.021 1.00 2.04 C ATOM 823 CG2 VAL A 55 16.168 -11.154 12.830 1.00 21.14 C ATOM 0 H VAL A 55 16.493 -13.657 12.517 1.00 74.43 H new ATOM 0 HA VAL A 55 16.972 -12.690 9.844 1.00 74.04 H new ATOM 0 HB VAL A 55 16.188 -10.528 10.793 1.00 14.53 H new ATOM 0 HG11 VAL A 55 13.898 -11.245 11.341 1.00 2.04 H new ATOM 0 HG12 VAL A 55 14.554 -12.135 9.946 1.00 2.04 H new ATOM 0 HG13 VAL A 55 14.474 -12.917 11.543 1.00 2.04 H new ATOM 0 HG21 VAL A 55 15.403 -10.436 13.125 1.00 21.14 H new ATOM 0 HG22 VAL A 55 16.043 -12.074 13.401 1.00 21.14 H new ATOM 0 HG23 VAL A 55 17.154 -10.735 13.029 1.00 21.14 H new ATOM 833 N ASP A 56 19.217 -12.389 12.093 1.00 15.32 N ATOM 834 CA ASP A 56 20.555 -11.897 12.401 1.00 73.44 C ATOM 835 C ASP A 56 21.519 -12.194 11.256 1.00 54.31 C ATOM 836 O ASP A 56 22.050 -13.298 11.149 1.00 21.42 O ATOM 837 CB ASP A 56 21.069 -12.531 13.694 1.00 22.10 C ATOM 838 CG ASP A 56 22.247 -11.777 14.280 1.00 70.15 C ATOM 839 OD1 ASP A 56 22.635 -10.740 13.701 1.00 20.41 O ATOM 840 OD2 ASP A 56 22.780 -12.223 15.317 1.00 61.33 O ATOM 0 H ASP A 56 18.905 -13.160 12.684 1.00 15.32 H new ATOM 0 HA ASP A 56 20.497 -10.817 12.533 1.00 73.44 H new ATOM 0 HB2 ASP A 56 20.262 -12.563 14.426 1.00 22.10 H new ATOM 0 HB3 ASP A 56 21.363 -13.562 13.498 1.00 22.10 H new ATOM 845 N ALA A 57 21.738 -11.200 10.402 1.00 43.53 N ATOM 846 CA ALA A 57 22.638 -11.353 9.266 1.00 65.33 C ATOM 847 C ALA A 57 24.072 -11.005 9.650 1.00 3.43 C ATOM 848 O ALA A 57 25.011 -11.716 9.293 1.00 44.24 O ATOM 849 CB ALA A 57 22.176 -10.486 8.104 1.00 33.14 C ATOM 0 H ALA A 57 21.304 -10.280 10.475 1.00 43.53 H new ATOM 0 HA ALA A 57 22.616 -12.398 8.956 1.00 65.33 H new ATOM 0 HB1 ALA A 57 22.858 -10.611 7.263 1.00 33.14 H new ATOM 0 HB2 ALA A 57 21.172 -10.785 7.804 1.00 33.14 H new ATOM 0 HB3 ALA A 57 22.167 -9.440 8.411 1.00 33.14 H new ATOM 855 N ASP A 58 24.234 -9.906 10.380 1.00 74.22 N ATOM 856 CA ASP A 58 25.554 -9.463 10.813 1.00 33.33 C ATOM 857 C ASP A 58 26.000 -10.223 12.059 1.00 52.13 C ATOM 858 O ASP A 58 27.091 -9.995 12.580 1.00 53.12 O ATOM 859 CB ASP A 58 25.544 -7.960 11.094 1.00 51.10 C ATOM 860 CG ASP A 58 24.873 -7.621 12.411 1.00 64.03 C ATOM 861 OD1 ASP A 58 24.021 -8.413 12.864 1.00 32.40 O ATOM 862 OD2 ASP A 58 25.202 -6.564 12.988 1.00 13.05 O ATOM 0 H ASP A 58 23.467 -9.306 10.684 1.00 74.22 H new ATOM 0 HA ASP A 58 26.261 -9.670 10.010 1.00 33.33 H new ATOM 0 HB2 ASP A 58 26.569 -7.589 11.106 1.00 51.10 H new ATOM 0 HB3 ASP A 58 25.028 -7.445 10.284 1.00 51.10 H new ATOM 867 N GLY A 59 25.147 -11.127 12.532 1.00 42.02 N ATOM 868 CA GLY A 59 25.471 -11.905 13.713 1.00 70.40 C ATOM 869 C GLY A 59 25.834 -11.035 14.899 1.00 4.24 C ATOM 870 O GLY A 59 26.923 -11.160 15.459 1.00 13.02 O ATOM 0 H GLY A 59 24.238 -11.334 12.118 1.00 42.02 H new ATOM 0 HA2 GLY A 59 24.620 -12.534 13.975 1.00 70.40 H new ATOM 0 HA3 GLY A 59 26.303 -12.572 13.488 1.00 70.40 H new ATOM 874 N ASN A 60 24.921 -10.148 15.283 1.00 63.43 N ATOM 875 CA ASN A 60 25.153 -9.251 16.409 1.00 35.32 C ATOM 876 C ASN A 60 24.190 -9.555 17.553 1.00 54.01 C ATOM 877 O ASN A 60 24.398 -9.121 18.685 1.00 35.22 O ATOM 878 CB ASN A 60 24.995 -7.795 15.969 1.00 44.45 C ATOM 879 CG ASN A 60 23.596 -7.489 15.472 1.00 53.43 C ATOM 880 OD1 ASN A 60 22.770 -8.388 15.316 1.00 33.11 O ATOM 881 ND2 ASN A 60 23.323 -6.214 15.220 1.00 41.52 N ATOM 0 H ASN A 60 24.014 -10.032 14.831 1.00 63.43 H new ATOM 0 HA ASN A 60 26.172 -9.408 16.763 1.00 35.32 H new ATOM 0 HB2 ASN A 60 25.232 -7.138 16.806 1.00 44.45 H new ATOM 0 HB3 ASN A 60 25.714 -7.577 15.179 1.00 44.45 H new ATOM 0 HD21 ASN A 60 22.398 -5.947 14.883 1.00 41.52 H new ATOM 0 HD22 ASN A 60 24.038 -5.501 15.364 1.00 41.52 H new ATOM 888 N GLY A 61 23.134 -10.304 17.248 1.00 24.40 N ATOM 889 CA GLY A 61 22.155 -10.654 18.261 1.00 63.15 C ATOM 890 C GLY A 61 20.987 -9.689 18.295 1.00 10.11 C ATOM 891 O GLY A 61 20.226 -9.657 19.263 1.00 51.03 O ATOM 0 H GLY A 61 22.939 -10.674 16.318 1.00 24.40 H new ATOM 0 HA2 GLY A 61 21.785 -11.661 18.071 1.00 63.15 H new ATOM 0 HA3 GLY A 61 22.638 -10.670 19.238 1.00 63.15 H new ATOM 895 N THR A 62 20.844 -8.897 17.237 1.00 72.23 N ATOM 896 CA THR A 62 19.762 -7.924 17.151 1.00 70.43 C ATOM 897 C THR A 62 19.328 -7.711 15.705 1.00 33.51 C ATOM 898 O THR A 62 19.929 -8.258 14.780 1.00 73.12 O ATOM 899 CB THR A 62 20.176 -6.569 17.755 1.00 35.45 C ATOM 900 OG1 THR A 62 21.205 -5.971 16.959 1.00 34.35 O ATOM 901 CG2 THR A 62 20.668 -6.742 19.184 1.00 24.32 C ATOM 0 H THR A 62 21.464 -8.910 16.427 1.00 72.23 H new ATOM 0 HA THR A 62 18.927 -8.329 17.723 1.00 70.43 H new ATOM 0 HB THR A 62 19.302 -5.918 17.765 1.00 35.45 H new ATOM 0 HG1 THR A 62 21.780 -5.418 17.529 1.00 34.35 H new ATOM 0 HG21 THR A 62 20.955 -5.772 19.590 1.00 24.32 H new ATOM 0 HG22 THR A 62 19.872 -7.170 19.794 1.00 24.32 H new ATOM 0 HG23 THR A 62 21.530 -7.409 19.194 1.00 24.32 H new ATOM 909 N ILE A 63 18.281 -6.914 15.518 1.00 45.01 N ATOM 910 CA ILE A 63 17.769 -6.628 14.184 1.00 74.01 C ATOM 911 C ILE A 63 18.095 -5.199 13.764 1.00 11.21 C ATOM 912 O ILE A 63 17.535 -4.241 14.298 1.00 4.02 O ATOM 913 CB ILE A 63 16.245 -6.838 14.110 1.00 54.42 C ATOM 914 CG1 ILE A 63 15.859 -8.171 14.754 1.00 2.33 C ATOM 915 CG2 ILE A 63 15.772 -6.786 12.664 1.00 5.24 C ATOM 916 CD1 ILE A 63 14.372 -8.446 14.729 1.00 21.34 C ATOM 0 H ILE A 63 17.771 -6.455 16.273 1.00 45.01 H new ATOM 0 HA ILE A 63 18.258 -7.324 13.502 1.00 74.01 H new ATOM 0 HB ILE A 63 15.756 -6.035 14.661 1.00 54.42 H new ATOM 0 HG12 ILE A 63 16.378 -8.978 14.238 1.00 2.33 H new ATOM 0 HG13 ILE A 63 16.204 -8.179 15.788 1.00 2.33 H new ATOM 0 HG21 ILE A 63 14.693 -6.936 12.629 1.00 5.24 H new ATOM 0 HG22 ILE A 63 16.017 -5.814 12.236 1.00 5.24 H new ATOM 0 HG23 ILE A 63 16.266 -7.570 12.091 1.00 5.24 H new ATOM 0 HD11 ILE A 63 14.172 -9.407 15.202 1.00 21.34 H new ATOM 0 HD12 ILE A 63 13.847 -7.659 15.270 1.00 21.34 H new ATOM 0 HD13 ILE A 63 14.024 -8.470 13.696 1.00 21.34 H new ATOM 928 N ASP A 64 19.002 -5.063 12.803 1.00 3.04 N ATOM 929 CA ASP A 64 19.402 -3.750 12.309 1.00 75.41 C ATOM 930 C ASP A 64 18.323 -3.158 11.408 1.00 74.03 C ATOM 931 O ASP A 64 17.230 -3.712 11.283 1.00 10.45 O ATOM 932 CB ASP A 64 20.723 -3.850 11.546 1.00 42.24 C ATOM 933 CG ASP A 64 21.614 -2.644 11.771 1.00 52.35 C ATOM 934 OD1 ASP A 64 21.618 -2.113 12.900 1.00 2.55 O ATOM 935 OD2 ASP A 64 22.306 -2.230 10.816 1.00 32.54 O ATOM 0 H ASP A 64 19.474 -5.846 12.350 1.00 3.04 H new ATOM 0 HA ASP A 64 19.536 -3.091 13.167 1.00 75.41 H new ATOM 0 HB2 ASP A 64 21.251 -4.751 11.857 1.00 42.24 H new ATOM 0 HB3 ASP A 64 20.517 -3.952 10.481 1.00 42.24 H new ATOM 940 N PHE A 65 18.636 -2.029 10.782 1.00 44.35 N ATOM 941 CA PHE A 65 17.693 -1.360 9.893 1.00 1.42 C ATOM 942 C PHE A 65 17.398 -2.219 8.667 1.00 14.42 C ATOM 943 O PHE A 65 16.253 -2.576 8.389 1.00 14.33 O ATOM 944 CB PHE A 65 18.246 -0.001 9.457 1.00 63.30 C ATOM 945 CG PHE A 65 17.698 0.475 8.142 1.00 12.13 C ATOM 946 CD1 PHE A 65 16.331 0.579 7.944 1.00 54.02 C ATOM 947 CD2 PHE A 65 18.550 0.818 7.105 1.00 53.51 C ATOM 948 CE1 PHE A 65 15.822 1.017 6.735 1.00 5.54 C ATOM 949 CE2 PHE A 65 18.048 1.258 5.895 1.00 75.14 C ATOM 950 CZ PHE A 65 16.682 1.356 5.709 1.00 3.32 C ATOM 0 H PHE A 65 19.536 -1.558 10.874 1.00 44.35 H new ATOM 0 HA PHE A 65 16.763 -1.207 10.440 1.00 1.42 H new ATOM 0 HB2 PHE A 65 18.019 0.738 10.225 1.00 63.30 H new ATOM 0 HB3 PHE A 65 19.332 -0.065 9.387 1.00 63.30 H new ATOM 0 HD1 PHE A 65 15.655 0.315 8.743 1.00 54.02 H new ATOM 0 HD2 PHE A 65 19.618 0.741 7.244 1.00 53.51 H new ATOM 0 HE1 PHE A 65 14.754 1.094 6.594 1.00 5.54 H new ATOM 0 HE2 PHE A 65 18.723 1.525 5.095 1.00 75.14 H new ATOM 0 HZ PHE A 65 16.288 1.697 4.763 1.00 3.32 H new ATOM 960 N PRO A 66 18.455 -2.558 7.915 1.00 73.43 N ATOM 961 CA PRO A 66 18.335 -3.379 6.706 1.00 30.10 C ATOM 962 C PRO A 66 17.971 -4.826 7.021 1.00 14.24 C ATOM 963 O PRO A 66 17.372 -5.517 6.199 1.00 74.43 O ATOM 964 CB PRO A 66 19.732 -3.303 6.086 1.00 42.34 C ATOM 965 CG PRO A 66 20.641 -3.018 7.231 1.00 15.45 C ATOM 966 CD PRO A 66 19.848 -2.168 8.186 1.00 4.04 C ATOM 0 HA PRO A 66 17.541 -3.023 6.049 1.00 30.10 H new ATOM 0 HB2 PRO A 66 19.998 -4.238 5.593 1.00 42.34 H new ATOM 0 HB3 PRO A 66 19.788 -2.518 5.332 1.00 42.34 H new ATOM 0 HG2 PRO A 66 20.968 -3.941 7.709 1.00 15.45 H new ATOM 0 HG3 PRO A 66 21.538 -2.497 6.897 1.00 15.45 H new ATOM 0 HD2 PRO A 66 20.125 -2.362 9.222 1.00 4.04 H new ATOM 0 HD3 PRO A 66 20.010 -1.105 8.007 1.00 4.04 H new ATOM 974 N GLU A 67 18.336 -5.276 8.218 1.00 71.13 N ATOM 975 CA GLU A 67 18.047 -6.641 8.640 1.00 31.51 C ATOM 976 C GLU A 67 16.542 -6.888 8.690 1.00 32.34 C ATOM 977 O GLU A 67 16.062 -7.951 8.295 1.00 22.22 O ATOM 978 CB GLU A 67 18.666 -6.916 10.012 1.00 30.32 C ATOM 979 CG GLU A 67 20.181 -7.032 9.984 1.00 12.23 C ATOM 980 CD GLU A 67 20.710 -8.009 11.016 1.00 64.24 C ATOM 981 OE1 GLU A 67 19.919 -8.452 11.874 1.00 75.11 O ATOM 982 OE2 GLU A 67 21.916 -8.331 10.965 1.00 52.02 O ATOM 0 H GLU A 67 18.832 -4.716 8.911 1.00 71.13 H new ATOM 0 HA GLU A 67 18.485 -7.321 7.909 1.00 31.51 H new ATOM 0 HB2 GLU A 67 18.384 -6.115 10.696 1.00 30.32 H new ATOM 0 HB3 GLU A 67 18.247 -7.839 10.412 1.00 30.32 H new ATOM 0 HG2 GLU A 67 20.499 -7.350 8.991 1.00 12.23 H new ATOM 0 HG3 GLU A 67 20.620 -6.050 10.160 1.00 12.23 H new ATOM 989 N PHE A 68 15.802 -5.899 9.180 1.00 50.10 N ATOM 990 CA PHE A 68 14.352 -6.008 9.284 1.00 75.10 C ATOM 991 C PHE A 68 13.696 -5.875 7.912 1.00 3.24 C ATOM 992 O PHE A 68 12.693 -6.529 7.624 1.00 23.24 O ATOM 993 CB PHE A 68 13.805 -4.936 10.229 1.00 34.53 C ATOM 994 CG PHE A 68 12.402 -5.206 10.693 1.00 14.21 C ATOM 995 CD1 PHE A 68 11.322 -4.951 9.862 1.00 23.44 C ATOM 996 CD2 PHE A 68 12.162 -5.713 11.960 1.00 2.22 C ATOM 997 CE1 PHE A 68 10.030 -5.198 10.286 1.00 20.40 C ATOM 998 CE2 PHE A 68 10.872 -5.962 12.389 1.00 22.21 C ATOM 999 CZ PHE A 68 9.805 -5.704 11.551 1.00 12.45 C ATOM 0 H PHE A 68 16.183 -5.013 9.511 1.00 50.10 H new ATOM 0 HA PHE A 68 14.115 -6.993 9.687 1.00 75.10 H new ATOM 0 HB2 PHE A 68 14.459 -4.861 11.098 1.00 34.53 H new ATOM 0 HB3 PHE A 68 13.833 -3.970 9.725 1.00 34.53 H new ATOM 0 HD1 PHE A 68 11.492 -4.555 8.872 1.00 23.44 H new ATOM 0 HD2 PHE A 68 12.993 -5.916 12.620 1.00 2.22 H new ATOM 0 HE1 PHE A 68 9.197 -4.996 9.629 1.00 20.40 H new ATOM 0 HE2 PHE A 68 10.699 -6.358 13.379 1.00 22.21 H new ATOM 0 HZ PHE A 68 8.796 -5.898 11.885 1.00 12.45 H new ATOM 1009 N LEU A 69 14.270 -5.023 7.070 1.00 12.50 N ATOM 1010 CA LEU A 69 13.742 -4.802 5.728 1.00 44.31 C ATOM 1011 C LEU A 69 13.964 -6.027 4.847 1.00 22.32 C ATOM 1012 O LEU A 69 13.024 -6.558 4.254 1.00 24.12 O ATOM 1013 CB LEU A 69 14.404 -3.577 5.094 1.00 64.34 C ATOM 1014 CG LEU A 69 14.115 -3.351 3.609 1.00 32.13 C ATOM 1015 CD1 LEU A 69 12.617 -3.245 3.368 1.00 60.43 C ATOM 1016 CD2 LEU A 69 14.827 -2.102 3.111 1.00 13.34 C ATOM 0 H LEU A 69 15.100 -4.474 7.292 1.00 12.50 H new ATOM 0 HA LEU A 69 12.669 -4.626 5.810 1.00 44.31 H new ATOM 0 HB2 LEU A 69 14.086 -2.691 5.644 1.00 64.34 H new ATOM 0 HB3 LEU A 69 15.483 -3.663 5.225 1.00 64.34 H new ATOM 0 HG LEU A 69 14.493 -4.207 3.050 1.00 32.13 H new ATOM 0 HD11 LEU A 69 12.430 -3.084 2.306 1.00 60.43 H new ATOM 0 HD12 LEU A 69 12.131 -4.167 3.687 1.00 60.43 H new ATOM 0 HD13 LEU A 69 12.215 -2.407 3.938 1.00 60.43 H new ATOM 0 HD21 LEU A 69 14.610 -1.957 2.053 1.00 13.34 H new ATOM 0 HD22 LEU A 69 14.480 -1.236 3.675 1.00 13.34 H new ATOM 0 HD23 LEU A 69 15.902 -2.217 3.248 1.00 13.34 H new ATOM 1028 N THR A 70 15.214 -6.474 4.768 1.00 73.25 N ATOM 1029 CA THR A 70 15.559 -7.638 3.961 1.00 43.44 C ATOM 1030 C THR A 70 14.690 -8.836 4.324 1.00 65.42 C ATOM 1031 O THR A 70 14.401 -9.683 3.479 1.00 33.23 O ATOM 1032 CB THR A 70 17.041 -8.021 4.133 1.00 2.13 C ATOM 1033 OG1 THR A 70 17.407 -9.010 3.165 1.00 63.21 O ATOM 1034 CG2 THR A 70 17.303 -8.554 5.534 1.00 53.11 C ATOM 0 H THR A 70 16.004 -6.048 5.253 1.00 73.25 H new ATOM 0 HA THR A 70 15.380 -7.366 2.921 1.00 43.44 H new ATOM 0 HB THR A 70 17.645 -7.126 3.983 1.00 2.13 H new ATOM 0 HG1 THR A 70 18.351 -9.247 3.280 1.00 63.21 H new ATOM 0 HG21 THR A 70 18.356 -8.818 5.632 1.00 53.11 H new ATOM 0 HG22 THR A 70 17.051 -7.788 6.268 1.00 53.11 H new ATOM 0 HG23 THR A 70 16.690 -9.438 5.707 1.00 53.11 H new ATOM 1042 N MET A 71 14.277 -8.901 5.585 1.00 23.33 N ATOM 1043 CA MET A 71 13.439 -9.997 6.059 1.00 1.41 C ATOM 1044 C MET A 71 12.138 -10.068 5.266 1.00 64.34 C ATOM 1045 O MET A 71 11.762 -11.129 4.767 1.00 4.13 O ATOM 1046 CB MET A 71 13.133 -9.826 7.548 1.00 11.52 C ATOM 1047 CG MET A 71 12.075 -10.787 8.065 1.00 11.44 C ATOM 1048 SD MET A 71 11.770 -10.598 9.832 1.00 33.35 S ATOM 1049 CE MET A 71 11.422 -8.844 9.931 1.00 71.10 C ATOM 0 H MET A 71 14.508 -8.208 6.297 1.00 23.33 H new ATOM 0 HA MET A 71 13.985 -10.929 5.912 1.00 1.41 H new ATOM 0 HB2 MET A 71 14.051 -9.968 8.118 1.00 11.52 H new ATOM 0 HB3 MET A 71 12.802 -8.803 7.727 1.00 11.52 H new ATOM 0 HG2 MET A 71 11.145 -10.625 7.520 1.00 11.44 H new ATOM 0 HG3 MET A 71 12.389 -11.811 7.862 1.00 11.44 H new ATOM 0 HE1 MET A 71 10.691 -8.662 10.719 1.00 71.10 H new ATOM 0 HE2 MET A 71 12.341 -8.303 10.156 1.00 71.10 H new ATOM 0 HE3 MET A 71 11.021 -8.498 8.978 1.00 71.10 H new ATOM 1059 N MET A 72 11.456 -8.934 5.153 1.00 51.53 N ATOM 1060 CA MET A 72 10.198 -8.869 4.419 1.00 55.25 C ATOM 1061 C MET A 72 10.422 -9.125 2.932 1.00 72.23 C ATOM 1062 O MET A 72 9.723 -9.932 2.319 1.00 24.44 O ATOM 1063 CB MET A 72 9.535 -7.504 4.618 1.00 24.25 C ATOM 1064 CG MET A 72 8.520 -7.481 5.749 1.00 34.41 C ATOM 1065 SD MET A 72 6.856 -7.903 5.197 1.00 72.04 S ATOM 1066 CE MET A 72 6.055 -8.244 6.762 1.00 25.22 C ATOM 0 H MET A 72 11.753 -8.047 5.560 1.00 51.53 H new ATOM 0 HA MET A 72 9.539 -9.645 4.809 1.00 55.25 H new ATOM 0 HB2 MET A 72 10.306 -6.760 4.818 1.00 24.25 H new ATOM 0 HB3 MET A 72 9.041 -7.210 3.692 1.00 24.25 H new ATOM 0 HG2 MET A 72 8.830 -8.181 6.525 1.00 34.41 H new ATOM 0 HG3 MET A 72 8.508 -6.489 6.201 1.00 34.41 H new ATOM 0 HE1 MET A 72 5.883 -9.316 6.857 1.00 25.22 H new ATOM 0 HE2 MET A 72 6.693 -7.905 7.579 1.00 25.22 H new ATOM 0 HE3 MET A 72 5.101 -7.718 6.805 1.00 25.22 H new ATOM 1076 N ALA A 73 11.400 -8.433 2.357 1.00 10.33 N ATOM 1077 CA ALA A 73 11.717 -8.587 0.943 1.00 72.41 C ATOM 1078 C ALA A 73 12.002 -10.046 0.601 1.00 42.35 C ATOM 1079 O ALA A 73 11.779 -10.483 -0.528 1.00 61.14 O ATOM 1080 CB ALA A 73 12.905 -7.713 0.570 1.00 71.34 C ATOM 0 H ALA A 73 11.987 -7.760 2.849 1.00 10.33 H new ATOM 0 HA ALA A 73 10.850 -8.268 0.364 1.00 72.41 H new ATOM 0 HB1 ALA A 73 13.131 -7.838 -0.489 1.00 71.34 H new ATOM 0 HB2 ALA A 73 12.665 -6.669 0.769 1.00 71.34 H new ATOM 0 HB3 ALA A 73 13.772 -8.005 1.163 1.00 71.34 H new ATOM 1265 N ILE A 85 10.169 -29.651 6.870 1.00 75.42 N ATOM 1266 CA ILE A 85 10.670 -31.015 6.754 1.00 64.02 C ATOM 1267 C ILE A 85 12.032 -31.158 7.425 1.00 63.55 C ATOM 1268 O ILE A 85 12.266 -32.100 8.182 1.00 22.13 O ATOM 1269 CB ILE A 85 10.788 -31.448 5.281 1.00 60.24 C ATOM 1270 CG1 ILE A 85 9.428 -31.348 4.586 1.00 2.45 C ATOM 1271 CG2 ILE A 85 11.333 -32.866 5.187 1.00 11.42 C ATOM 1272 CD1 ILE A 85 9.520 -31.331 3.077 1.00 41.33 C ATOM 0 HA ILE A 85 9.950 -31.660 7.257 1.00 64.02 H new ATOM 0 HB ILE A 85 11.484 -30.778 4.776 1.00 60.24 H new ATOM 0 HG12 ILE A 85 8.809 -32.190 4.895 1.00 2.45 H new ATOM 0 HG13 ILE A 85 8.924 -30.442 4.921 1.00 2.45 H new ATOM 0 HG21 ILE A 85 11.410 -33.157 4.140 1.00 11.42 H new ATOM 0 HG22 ILE A 85 12.319 -32.908 5.649 1.00 11.42 H new ATOM 0 HG23 ILE A 85 10.660 -33.549 5.705 1.00 11.42 H new ATOM 0 HD11 ILE A 85 8.519 -31.259 2.652 1.00 41.33 H new ATOM 0 HD12 ILE A 85 10.112 -30.473 2.758 1.00 41.33 H new ATOM 0 HD13 ILE A 85 9.995 -32.249 2.731 1.00 41.33 H new ATOM 1284 N ARG A 86 12.927 -30.217 7.142 1.00 60.31 N ATOM 1285 CA ARG A 86 14.266 -30.238 7.718 1.00 30.33 C ATOM 1286 C ARG A 86 14.201 -30.325 9.240 1.00 4.14 C ATOM 1287 O ARG A 86 15.061 -30.937 9.873 1.00 10.13 O ATOM 1288 CB ARG A 86 15.044 -28.989 7.301 1.00 72.05 C ATOM 1289 CG ARG A 86 16.440 -28.913 7.897 1.00 13.22 C ATOM 1290 CD ARG A 86 17.309 -27.910 7.155 1.00 70.25 C ATOM 1291 NE ARG A 86 16.787 -26.550 7.259 1.00 72.25 N ATOM 1292 CZ ARG A 86 17.408 -25.485 6.766 1.00 45.30 C ATOM 1293 NH1 ARG A 86 18.568 -25.621 6.138 1.00 4.13 N ATOM 1294 NH2 ARG A 86 16.870 -24.280 6.900 1.00 14.44 N ATOM 0 H ARG A 86 12.749 -29.431 6.517 1.00 60.31 H new ATOM 0 HA ARG A 86 14.782 -31.121 7.342 1.00 30.33 H new ATOM 0 HB2 ARG A 86 15.121 -28.965 6.214 1.00 72.05 H new ATOM 0 HB3 ARG A 86 14.482 -28.104 7.600 1.00 72.05 H new ATOM 0 HG2 ARG A 86 16.373 -28.631 8.948 1.00 13.22 H new ATOM 0 HG3 ARG A 86 16.906 -29.897 7.860 1.00 13.22 H new ATOM 0 HD2 ARG A 86 18.322 -27.941 7.557 1.00 70.25 H new ATOM 0 HD3 ARG A 86 17.374 -28.194 6.105 1.00 70.25 H new ATOM 0 HE ARG A 86 15.897 -26.411 7.737 1.00 72.25 H new ATOM 0 HH11 ARG A 86 18.986 -26.546 6.033 1.00 4.13 H new ATOM 0 HH12 ARG A 86 19.043 -24.801 5.760 1.00 4.13 H new ATOM 0 HH21 ARG A 86 15.978 -24.171 7.382 1.00 14.44 H new ATOM 0 HH22 ARG A 86 17.348 -23.463 6.521 1.00 14.44 H new ATOM 1308 N GLU A 87 13.177 -29.708 9.820 1.00 13.52 N ATOM 1309 CA GLU A 87 13.002 -29.714 11.268 1.00 73.31 C ATOM 1310 C GLU A 87 12.457 -31.058 11.744 1.00 60.02 C ATOM 1311 O GLU A 87 13.068 -31.727 12.576 1.00 32.53 O ATOM 1312 CB GLU A 87 12.057 -28.589 11.695 1.00 43.31 C ATOM 1313 CG GLU A 87 12.132 -28.261 13.177 1.00 51.13 C ATOM 1314 CD GLU A 87 10.977 -27.395 13.642 1.00 71.44 C ATOM 1315 OE1 GLU A 87 10.567 -26.494 12.881 1.00 13.13 O ATOM 1316 OE2 GLU A 87 10.483 -27.620 14.767 1.00 61.44 O ATOM 0 H GLU A 87 12.456 -29.198 9.310 1.00 13.52 H new ATOM 0 HA GLU A 87 13.978 -29.553 11.727 1.00 73.31 H new ATOM 0 HB2 GLU A 87 12.290 -27.692 11.121 1.00 43.31 H new ATOM 0 HB3 GLU A 87 11.034 -28.871 11.445 1.00 43.31 H new ATOM 0 HG2 GLU A 87 12.140 -29.188 13.750 1.00 51.13 H new ATOM 0 HG3 GLU A 87 13.072 -27.749 13.385 1.00 51.13 H new ATOM 1323 N ALA A 88 11.304 -31.445 11.209 1.00 34.20 N ATOM 1324 CA ALA A 88 10.677 -32.708 11.577 1.00 33.54 C ATOM 1325 C ALA A 88 11.646 -33.873 11.405 1.00 30.11 C ATOM 1326 O ALA A 88 11.799 -34.704 12.301 1.00 61.14 O ATOM 1327 CB ALA A 88 9.422 -32.937 10.748 1.00 51.42 C ATOM 0 H ALA A 88 10.785 -30.902 10.519 1.00 34.20 H new ATOM 0 HA ALA A 88 10.399 -32.653 12.629 1.00 33.54 H new ATOM 0 HB1 ALA A 88 8.965 -33.884 11.034 1.00 51.42 H new ATOM 0 HB2 ALA A 88 8.716 -32.125 10.925 1.00 51.42 H new ATOM 0 HB3 ALA A 88 9.685 -32.966 9.691 1.00 51.42 H new ATOM 1333 N PHE A 89 12.298 -33.928 10.249 1.00 61.05 N ATOM 1334 CA PHE A 89 13.252 -34.992 9.958 1.00 32.34 C ATOM 1335 C PHE A 89 14.283 -35.118 11.076 1.00 31.21 C ATOM 1336 O PHE A 89 14.517 -36.208 11.600 1.00 55.42 O ATOM 1337 CB PHE A 89 13.957 -34.726 8.627 1.00 55.43 C ATOM 1338 CG PHE A 89 14.459 -35.971 7.954 1.00 22.15 C ATOM 1339 CD1 PHE A 89 13.574 -36.943 7.516 1.00 2.11 C ATOM 1340 CD2 PHE A 89 15.817 -36.170 7.760 1.00 14.14 C ATOM 1341 CE1 PHE A 89 14.034 -38.090 6.898 1.00 23.30 C ATOM 1342 CE2 PHE A 89 16.283 -37.315 7.142 1.00 34.15 C ATOM 1343 CZ PHE A 89 15.390 -38.276 6.710 1.00 71.12 C ATOM 0 H PHE A 89 12.183 -33.248 9.498 1.00 61.05 H new ATOM 0 HA PHE A 89 12.701 -35.930 9.887 1.00 32.34 H new ATOM 0 HB2 PHE A 89 13.268 -34.213 7.956 1.00 55.43 H new ATOM 0 HB3 PHE A 89 14.796 -34.052 8.798 1.00 55.43 H new ATOM 0 HD1 PHE A 89 12.513 -36.803 7.659 1.00 2.11 H new ATOM 0 HD2 PHE A 89 16.519 -35.421 8.096 1.00 14.14 H new ATOM 0 HE1 PHE A 89 13.334 -38.841 6.562 1.00 23.30 H new ATOM 0 HE2 PHE A 89 17.344 -37.458 6.997 1.00 34.15 H new ATOM 0 HZ PHE A 89 15.751 -39.171 6.226 1.00 71.12 H new ATOM 1353 N ARG A 90 14.897 -33.996 11.436 1.00 41.24 N ATOM 1354 CA ARG A 90 15.904 -33.980 12.489 1.00 4.24 C ATOM 1355 C ARG A 90 15.301 -34.404 13.825 1.00 72.30 C ATOM 1356 O ARG A 90 15.867 -35.231 14.539 1.00 24.45 O ATOM 1357 CB ARG A 90 16.519 -32.585 12.616 1.00 50.43 C ATOM 1358 CG ARG A 90 17.705 -32.525 13.565 1.00 72.03 C ATOM 1359 CD ARG A 90 17.258 -32.301 15.001 1.00 43.21 C ATOM 1360 NE ARG A 90 18.278 -31.616 15.791 1.00 41.24 N ATOM 1361 CZ ARG A 90 18.063 -31.134 17.010 1.00 51.25 C ATOM 1362 NH1 ARG A 90 16.871 -31.262 17.576 1.00 52.34 N ATOM 1363 NH2 ARG A 90 19.042 -30.523 17.665 1.00 15.20 N ATOM 0 H ARG A 90 14.714 -33.086 11.013 1.00 41.24 H new ATOM 0 HA ARG A 90 16.685 -34.691 12.220 1.00 4.24 H new ATOM 0 HB2 ARG A 90 16.836 -32.246 11.630 1.00 50.43 H new ATOM 0 HB3 ARG A 90 15.753 -31.890 12.961 1.00 50.43 H new ATOM 0 HG2 ARG A 90 18.272 -33.454 13.500 1.00 72.03 H new ATOM 0 HG3 ARG A 90 18.375 -31.721 13.262 1.00 72.03 H new ATOM 0 HD2 ARG A 90 16.340 -31.714 15.007 1.00 43.21 H new ATOM 0 HD3 ARG A 90 17.026 -33.261 15.462 1.00 43.21 H new ATOM 0 HE ARG A 90 19.206 -31.501 15.384 1.00 41.24 H new ATOM 0 HH11 ARG A 90 16.116 -31.731 17.075 1.00 52.34 H new ATOM 0 HH12 ARG A 90 16.708 -30.891 18.512 1.00 52.34 H new ATOM 0 HH21 ARG A 90 19.960 -30.423 17.232 1.00 15.20 H new ATOM 0 HH22 ARG A 90 18.876 -30.153 18.601 1.00 15.20 H new ATOM 1377 N VAL A 91 14.148 -33.832 14.156 1.00 13.11 N ATOM 1378 CA VAL A 91 13.467 -34.151 15.405 1.00 13.02 C ATOM 1379 C VAL A 91 13.296 -35.657 15.569 1.00 62.01 C ATOM 1380 O VAL A 91 13.594 -36.215 16.625 1.00 22.31 O ATOM 1381 CB VAL A 91 12.083 -33.478 15.478 1.00 42.20 C ATOM 1382 CG1 VAL A 91 11.378 -33.845 16.775 1.00 71.45 C ATOM 1383 CG2 VAL A 91 12.218 -31.969 15.344 1.00 11.50 C ATOM 0 H VAL A 91 13.666 -33.145 13.576 1.00 13.11 H new ATOM 0 HA VAL A 91 14.092 -33.769 16.212 1.00 13.02 H new ATOM 0 HB VAL A 91 11.477 -33.841 14.648 1.00 42.20 H new ATOM 0 HG11 VAL A 91 10.402 -33.360 16.808 1.00 71.45 H new ATOM 0 HG12 VAL A 91 11.248 -34.926 16.825 1.00 71.45 H new ATOM 0 HG13 VAL A 91 11.978 -33.512 17.622 1.00 71.45 H new ATOM 0 HG21 VAL A 91 11.231 -31.509 15.398 1.00 11.50 H new ATOM 0 HG22 VAL A 91 12.841 -31.586 16.152 1.00 11.50 H new ATOM 0 HG23 VAL A 91 12.679 -31.729 14.386 1.00 11.50 H new ATOM 1393 N PHE A 92 12.815 -36.310 14.516 1.00 20.45 N ATOM 1394 CA PHE A 92 12.604 -37.753 14.543 1.00 21.02 C ATOM 1395 C PHE A 92 13.934 -38.499 14.472 1.00 14.50 C ATOM 1396 O PHE A 92 14.051 -39.628 14.948 1.00 14.21 O ATOM 1397 CB PHE A 92 11.704 -38.180 13.381 1.00 4.15 C ATOM 1398 CG PHE A 92 10.405 -37.429 13.322 1.00 1.33 C ATOM 1399 CD1 PHE A 92 9.651 -37.231 14.468 1.00 43.52 C ATOM 1400 CD2 PHE A 92 9.937 -36.921 12.121 1.00 62.22 C ATOM 1401 CE1 PHE A 92 8.455 -36.539 14.417 1.00 64.41 C ATOM 1402 CE2 PHE A 92 8.742 -36.229 12.064 1.00 43.01 C ATOM 1403 CZ PHE A 92 8.000 -36.039 13.213 1.00 11.10 C ATOM 0 H PHE A 92 12.564 -35.863 13.634 1.00 20.45 H new ATOM 0 HA PHE A 92 12.116 -38.006 15.484 1.00 21.02 H new ATOM 0 HB2 PHE A 92 12.241 -38.035 12.444 1.00 4.15 H new ATOM 0 HB3 PHE A 92 11.495 -39.246 13.467 1.00 4.15 H new ATOM 0 HD1 PHE A 92 10.002 -37.622 15.412 1.00 43.52 H new ATOM 0 HD2 PHE A 92 10.513 -37.067 11.219 1.00 62.22 H new ATOM 0 HE1 PHE A 92 7.878 -36.390 15.317 1.00 64.41 H new ATOM 0 HE2 PHE A 92 8.389 -35.837 11.122 1.00 43.01 H new ATOM 0 HZ PHE A 92 7.065 -35.500 13.170 1.00 11.10 H new ATOM 1413 N ASP A 93 14.932 -37.859 13.874 1.00 43.32 N ATOM 1414 CA ASP A 93 16.254 -38.460 13.740 1.00 42.31 C ATOM 1415 C ASP A 93 16.947 -38.555 15.095 1.00 25.44 C ATOM 1416 O ASP A 93 17.577 -37.601 15.552 1.00 41.12 O ATOM 1417 CB ASP A 93 17.112 -37.645 12.771 1.00 64.34 C ATOM 1418 CG ASP A 93 18.280 -38.442 12.221 1.00 13.45 C ATOM 1419 OD1 ASP A 93 18.375 -39.647 12.533 1.00 73.50 O ATOM 1420 OD2 ASP A 93 19.098 -37.859 11.479 1.00 31.35 O ATOM 0 H ASP A 93 14.851 -36.924 13.474 1.00 43.32 H new ATOM 0 HA ASP A 93 16.130 -39.468 13.344 1.00 42.31 H new ATOM 0 HB2 ASP A 93 16.492 -37.298 11.945 1.00 64.34 H new ATOM 0 HB3 ASP A 93 17.489 -36.759 13.281 1.00 64.34 H new ATOM 1425 N LYS A 94 16.827 -39.713 15.735 1.00 33.55 N ATOM 1426 CA LYS A 94 17.441 -39.936 17.039 1.00 42.51 C ATOM 1427 C LYS A 94 18.932 -40.224 16.896 1.00 42.44 C ATOM 1428 O LYS A 94 19.763 -39.580 17.537 1.00 51.45 O ATOM 1429 CB LYS A 94 16.753 -41.098 17.759 1.00 43.33 C ATOM 1430 CG LYS A 94 15.237 -41.017 17.733 1.00 72.24 C ATOM 1431 CD LYS A 94 14.728 -39.818 18.515 1.00 45.10 C ATOM 1432 CE LYS A 94 14.533 -40.154 19.986 1.00 44.35 C ATOM 1433 NZ LYS A 94 15.803 -40.034 20.755 1.00 71.31 N ATOM 0 H LYS A 94 16.309 -40.513 15.371 1.00 33.55 H new ATOM 0 HA LYS A 94 17.319 -39.028 17.630 1.00 42.51 H new ATOM 0 HB2 LYS A 94 17.066 -42.036 17.300 1.00 43.33 H new ATOM 0 HB3 LYS A 94 17.089 -41.123 18.795 1.00 43.33 H new ATOM 0 HG2 LYS A 94 14.893 -40.952 16.701 1.00 72.24 H new ATOM 0 HG3 LYS A 94 14.816 -41.931 18.152 1.00 72.24 H new ATOM 0 HD2 LYS A 94 15.434 -38.993 18.420 1.00 45.10 H new ATOM 0 HD3 LYS A 94 13.783 -39.479 18.090 1.00 45.10 H new ATOM 0 HE2 LYS A 94 13.784 -39.488 20.415 1.00 44.35 H new ATOM 0 HE3 LYS A 94 14.147 -41.169 20.079 1.00 44.35 H new ATOM 0 HZ1 LYS A 94 15.593 -39.732 21.728 1.00 71.31 H new ATOM 0 HZ2 LYS A 94 16.285 -40.955 20.775 1.00 71.31 H new ATOM 0 HZ3 LYS A 94 16.419 -39.331 20.300 1.00 71.31 H new ATOM 1447 N ASP A 95 19.264 -41.193 16.050 1.00 20.34 N ATOM 1448 CA ASP A 95 20.655 -41.565 15.821 1.00 5.40 C ATOM 1449 C ASP A 95 21.375 -40.498 15.002 1.00 53.43 C ATOM 1450 O ASP A 95 22.594 -40.541 14.841 1.00 14.40 O ATOM 1451 CB ASP A 95 20.734 -42.914 15.105 1.00 22.03 C ATOM 1452 CG ASP A 95 20.012 -42.905 13.772 1.00 33.55 C ATOM 1453 OD1 ASP A 95 19.515 -41.831 13.373 1.00 22.12 O ATOM 1454 OD2 ASP A 95 19.944 -43.973 13.128 1.00 15.22 O ATOM 0 H ASP A 95 18.588 -41.735 15.511 1.00 20.34 H new ATOM 0 HA ASP A 95 21.147 -41.648 16.790 1.00 5.40 H new ATOM 0 HB2 ASP A 95 21.780 -43.177 14.947 1.00 22.03 H new ATOM 0 HB3 ASP A 95 20.304 -43.686 15.743 1.00 22.03 H new ATOM 1459 N GLY A 96 20.610 -39.541 14.484 1.00 2.42 N ATOM 1460 CA GLY A 96 21.192 -38.477 13.687 1.00 53.25 C ATOM 1461 C GLY A 96 21.908 -38.999 12.457 1.00 30.31 C ATOM 1462 O GLY A 96 22.850 -38.377 11.968 1.00 20.23 O ATOM 0 H GLY A 96 19.598 -39.484 14.602 1.00 2.42 H new ATOM 0 HA2 GLY A 96 20.407 -37.786 13.381 1.00 53.25 H new ATOM 0 HA3 GLY A 96 21.894 -37.911 14.299 1.00 53.25 H new ATOM 1466 N ASN A 97 21.461 -40.147 11.957 1.00 44.21 N ATOM 1467 CA ASN A 97 22.068 -40.754 10.778 1.00 61.21 C ATOM 1468 C ASN A 97 21.525 -40.122 9.500 1.00 62.11 C ATOM 1469 O ASN A 97 22.105 -40.273 8.425 1.00 2.45 O ATOM 1470 CB ASN A 97 21.808 -42.262 10.765 1.00 64.04 C ATOM 1471 CG ASN A 97 20.339 -42.594 10.590 1.00 20.10 C ATOM 1472 OD1 ASN A 97 19.472 -41.740 10.775 1.00 50.13 O ATOM 1473 ND2 ASN A 97 20.053 -43.841 10.233 1.00 52.44 N ATOM 0 H ASN A 97 20.681 -40.675 12.350 1.00 44.21 H new ATOM 0 HA ASN A 97 23.143 -40.577 10.821 1.00 61.21 H new ATOM 0 HB2 ASN A 97 22.380 -42.720 9.958 1.00 64.04 H new ATOM 0 HB3 ASN A 97 22.168 -42.698 11.697 1.00 64.04 H new ATOM 0 HD21 ASN A 97 19.082 -44.124 10.101 1.00 52.44 H new ATOM 0 HD22 ASN A 97 20.805 -44.516 10.091 1.00 52.44 H new ATOM 1480 N GLY A 98 20.407 -39.413 9.625 1.00 4.14 N ATOM 1481 CA GLY A 98 19.805 -38.768 8.473 1.00 0.34 C ATOM 1482 C GLY A 98 18.841 -39.677 7.737 1.00 25.54 C ATOM 1483 O GLY A 98 18.512 -39.435 6.576 1.00 14.43 O ATOM 0 H GLY A 98 19.908 -39.274 10.504 1.00 4.14 H new ATOM 0 HA2 GLY A 98 19.278 -37.871 8.797 1.00 0.34 H new ATOM 0 HA3 GLY A 98 20.590 -38.446 7.789 1.00 0.34 H new ATOM 1487 N TYR A 99 18.390 -40.729 8.413 1.00 41.53 N ATOM 1488 CA TYR A 99 17.462 -41.680 7.814 1.00 32.31 C ATOM 1489 C TYR A 99 16.385 -42.093 8.813 1.00 22.11 C ATOM 1490 O TYR A 99 16.610 -42.085 10.024 1.00 42.33 O ATOM 1491 CB TYR A 99 18.215 -42.916 7.319 1.00 74.41 C ATOM 1492 CG TYR A 99 18.757 -42.773 5.915 1.00 52.13 C ATOM 1493 CD1 TYR A 99 19.819 -41.920 5.643 1.00 40.33 C ATOM 1494 CD2 TYR A 99 18.207 -43.492 4.860 1.00 2.41 C ATOM 1495 CE1 TYR A 99 20.317 -41.785 4.361 1.00 31.12 C ATOM 1496 CE2 TYR A 99 18.700 -43.364 3.576 1.00 73.43 C ATOM 1497 CZ TYR A 99 19.754 -42.510 3.331 1.00 1.42 C ATOM 1498 OH TYR A 99 20.248 -42.379 2.053 1.00 22.45 O ATOM 0 H TYR A 99 18.652 -40.944 9.375 1.00 41.53 H new ATOM 0 HA TYR A 99 16.979 -41.193 6.967 1.00 32.31 H new ATOM 0 HB2 TYR A 99 19.041 -43.124 7.999 1.00 74.41 H new ATOM 0 HB3 TYR A 99 17.547 -43.777 7.356 1.00 74.41 H new ATOM 0 HD1 TYR A 99 20.263 -41.352 6.447 1.00 40.33 H new ATOM 0 HD2 TYR A 99 17.381 -44.162 5.047 1.00 2.41 H new ATOM 0 HE1 TYR A 99 21.142 -41.116 4.167 1.00 31.12 H new ATOM 0 HE2 TYR A 99 18.262 -43.930 2.768 1.00 73.43 H new ATOM 0 HH TYR A 99 19.742 -42.958 1.446 1.00 22.45 H new ATOM 1508 N ILE A 100 15.215 -42.454 8.297 1.00 65.44 N ATOM 1509 CA ILE A 100 14.104 -42.872 9.142 1.00 20.20 C ATOM 1510 C ILE A 100 13.740 -44.332 8.891 1.00 44.45 C ATOM 1511 O ILE A 100 13.422 -44.718 7.766 1.00 41.21 O ATOM 1512 CB ILE A 100 12.859 -41.997 8.908 1.00 54.10 C ATOM 1513 CG1 ILE A 100 13.182 -40.527 9.184 1.00 63.12 C ATOM 1514 CG2 ILE A 100 11.709 -42.466 9.787 1.00 11.32 C ATOM 1515 CD1 ILE A 100 12.031 -39.590 8.892 1.00 44.22 C ATOM 0 H ILE A 100 15.012 -42.465 7.297 1.00 65.44 H new ATOM 0 HA ILE A 100 14.432 -42.755 10.175 1.00 20.20 H new ATOM 0 HB ILE A 100 12.557 -42.093 7.865 1.00 54.10 H new ATOM 0 HG12 ILE A 100 13.473 -40.417 10.229 1.00 63.12 H new ATOM 0 HG13 ILE A 100 14.041 -40.233 8.581 1.00 63.12 H new ATOM 0 HG21 ILE A 100 10.836 -41.838 9.610 1.00 11.32 H new ATOM 0 HG22 ILE A 100 11.466 -43.501 9.546 1.00 11.32 H new ATOM 0 HG23 ILE A 100 12.000 -42.396 10.835 1.00 11.32 H new ATOM 0 HD11 ILE A 100 12.332 -38.565 9.110 1.00 44.22 H new ATOM 0 HD12 ILE A 100 11.754 -39.671 7.841 1.00 44.22 H new ATOM 0 HD13 ILE A 100 11.177 -39.858 9.514 1.00 44.22 H new ATOM 1527 N SER A 101 13.788 -45.138 9.946 1.00 63.10 N ATOM 1528 CA SER A 101 13.466 -46.556 9.840 1.00 72.23 C ATOM 1529 C SER A 101 12.212 -46.890 10.642 1.00 54.31 C ATOM 1530 O SER A 101 11.535 -45.999 11.155 1.00 72.20 O ATOM 1531 CB SER A 101 14.640 -47.406 10.330 1.00 14.02 C ATOM 1532 OG SER A 101 14.738 -47.373 11.744 1.00 53.15 O ATOM 0 H SER A 101 14.047 -44.833 10.884 1.00 63.10 H new ATOM 0 HA SER A 101 13.276 -46.782 8.791 1.00 72.23 H new ATOM 0 HB2 SER A 101 14.513 -48.435 9.995 1.00 14.02 H new ATOM 0 HB3 SER A 101 15.567 -47.040 9.889 1.00 14.02 H new ATOM 0 HG SER A 101 15.495 -47.925 12.032 1.00 53.15 H new ATOM 1538 N ALA A 102 11.908 -48.180 10.745 1.00 5.50 N ATOM 1539 CA ALA A 102 10.738 -48.632 11.486 1.00 74.22 C ATOM 1540 C ALA A 102 10.968 -48.535 12.990 1.00 2.30 C ATOM 1541 O ALA A 102 10.071 -48.155 13.742 1.00 52.24 O ATOM 1542 CB ALA A 102 10.386 -50.060 11.095 1.00 15.03 C ATOM 0 H ALA A 102 12.456 -48.930 10.324 1.00 5.50 H new ATOM 0 HA ALA A 102 9.903 -47.980 11.231 1.00 74.22 H new ATOM 0 HB1 ALA A 102 9.510 -50.385 11.656 1.00 15.03 H new ATOM 0 HB2 ALA A 102 10.170 -50.102 10.028 1.00 15.03 H new ATOM 0 HB3 ALA A 102 11.226 -50.717 11.321 1.00 15.03 H new ATOM 1548 N ALA A 103 12.176 -48.881 13.422 1.00 2.25 N ATOM 1549 CA ALA A 103 12.525 -48.831 14.837 1.00 55.20 C ATOM 1550 C ALA A 103 12.448 -47.405 15.371 1.00 4.51 C ATOM 1551 O ALA A 103 11.989 -47.175 16.489 1.00 25.25 O ATOM 1552 CB ALA A 103 13.916 -49.406 15.059 1.00 53.24 C ATOM 0 H ALA A 103 12.930 -49.199 12.813 1.00 2.25 H new ATOM 0 HA ALA A 103 11.803 -49.436 15.385 1.00 55.20 H new ATOM 0 HB1 ALA A 103 14.163 -49.362 16.120 1.00 53.24 H new ATOM 0 HB2 ALA A 103 13.939 -50.443 14.724 1.00 53.24 H new ATOM 0 HB3 ALA A 103 14.644 -48.826 14.493 1.00 53.24 H new ATOM 1558 N GLU A 104 12.902 -46.450 14.564 1.00 32.32 N ATOM 1559 CA GLU A 104 12.886 -45.046 14.958 1.00 73.40 C ATOM 1560 C GLU A 104 11.480 -44.464 14.839 1.00 62.03 C ATOM 1561 O GLU A 104 10.997 -43.787 15.747 1.00 3.22 O ATOM 1562 CB GLU A 104 13.859 -44.240 14.095 1.00 75.32 C ATOM 1563 CG GLU A 104 15.301 -44.323 14.565 1.00 41.41 C ATOM 1564 CD GLU A 104 16.112 -43.102 14.176 1.00 12.53 C ATOM 1565 OE1 GLU A 104 15.546 -42.197 13.527 1.00 44.12 O ATOM 1566 OE2 GLU A 104 17.311 -43.050 14.521 1.00 32.41 O ATOM 0 H GLU A 104 13.285 -46.623 13.635 1.00 32.32 H new ATOM 0 HA GLU A 104 13.199 -44.984 16.000 1.00 73.40 H new ATOM 0 HB2 GLU A 104 13.800 -44.596 13.066 1.00 75.32 H new ATOM 0 HB3 GLU A 104 13.547 -43.196 14.089 1.00 75.32 H new ATOM 0 HG2 GLU A 104 15.320 -44.437 15.649 1.00 41.41 H new ATOM 0 HG3 GLU A 104 15.766 -45.214 14.142 1.00 41.41 H new ATOM 1573 N LEU A 105 10.829 -44.732 13.712 1.00 1.32 N ATOM 1574 CA LEU A 105 9.479 -44.235 13.472 1.00 12.53 C ATOM 1575 C LEU A 105 8.548 -44.611 14.620 1.00 32.23 C ATOM 1576 O LEU A 105 7.757 -43.791 15.086 1.00 51.31 O ATOM 1577 CB LEU A 105 8.935 -44.792 12.156 1.00 62.23 C ATOM 1578 CG LEU A 105 7.610 -44.202 11.673 1.00 34.12 C ATOM 1579 CD1 LEU A 105 7.720 -42.693 11.523 1.00 5.10 C ATOM 1580 CD2 LEU A 105 7.189 -44.841 10.358 1.00 74.40 C ATOM 0 H LEU A 105 11.214 -45.291 12.950 1.00 1.32 H new ATOM 0 HA LEU A 105 9.525 -43.148 13.407 1.00 12.53 H new ATOM 0 HB2 LEU A 105 9.684 -44.633 11.380 1.00 62.23 H new ATOM 0 HB3 LEU A 105 8.812 -45.870 12.264 1.00 62.23 H new ATOM 0 HG LEU A 105 6.846 -44.417 12.420 1.00 34.12 H new ATOM 0 HD11 LEU A 105 6.767 -42.291 11.178 1.00 5.10 H new ATOM 0 HD12 LEU A 105 7.974 -42.249 12.486 1.00 5.10 H new ATOM 0 HD13 LEU A 105 8.498 -42.455 10.797 1.00 5.10 H new ATOM 0 HD21 LEU A 105 6.244 -44.409 10.030 1.00 74.40 H new ATOM 0 HD22 LEU A 105 7.954 -44.658 9.603 1.00 74.40 H new ATOM 0 HD23 LEU A 105 7.067 -45.915 10.498 1.00 74.40 H new ATOM 1592 N ARG A 106 8.649 -45.857 15.073 1.00 2.52 N ATOM 1593 CA ARG A 106 7.817 -46.342 16.168 1.00 50.54 C ATOM 1594 C ARG A 106 7.899 -45.405 17.369 1.00 10.24 C ATOM 1595 O ARG A 106 6.899 -45.152 18.042 1.00 21.24 O ATOM 1596 CB ARG A 106 8.246 -47.752 16.577 1.00 41.24 C ATOM 1597 CG ARG A 106 7.487 -48.296 17.776 1.00 41.41 C ATOM 1598 CD ARG A 106 7.631 -49.805 17.889 1.00 64.23 C ATOM 1599 NE ARG A 106 7.556 -50.260 19.274 1.00 34.34 N ATOM 1600 CZ ARG A 106 8.552 -50.137 20.144 1.00 1.31 C ATOM 1601 NH1 ARG A 106 9.694 -49.575 19.773 1.00 2.41 N ATOM 1602 NH2 ARG A 106 8.407 -50.575 21.388 1.00 70.31 N ATOM 0 H ARG A 106 9.299 -46.549 14.699 1.00 2.52 H new ATOM 0 HA ARG A 106 6.784 -46.371 15.821 1.00 50.54 H new ATOM 0 HB2 ARG A 106 8.104 -48.425 15.732 1.00 41.24 H new ATOM 0 HB3 ARG A 106 9.312 -47.747 16.804 1.00 41.24 H new ATOM 0 HG2 ARG A 106 7.857 -47.825 18.687 1.00 41.41 H new ATOM 0 HG3 ARG A 106 6.432 -48.036 17.689 1.00 41.41 H new ATOM 0 HD2 ARG A 106 6.847 -50.289 17.306 1.00 64.23 H new ATOM 0 HD3 ARG A 106 8.584 -50.111 17.458 1.00 64.23 H new ATOM 0 HE ARG A 106 6.691 -50.697 19.591 1.00 34.34 H new ATOM 0 HH11 ARG A 106 9.809 -49.236 18.818 1.00 2.41 H new ATOM 0 HH12 ARG A 106 10.458 -49.482 20.443 1.00 2.41 H new ATOM 0 HH21 ARG A 106 7.530 -51.007 21.678 1.00 70.31 H new ATOM 0 HH22 ARG A 106 9.173 -50.480 22.055 1.00 70.31 H new ATOM 1616 N HIS A 107 9.097 -44.893 17.633 1.00 11.25 N ATOM 1617 CA HIS A 107 9.310 -43.984 18.754 1.00 14.22 C ATOM 1618 C HIS A 107 8.511 -42.697 18.569 1.00 34.24 C ATOM 1619 O HIS A 107 8.011 -42.121 19.535 1.00 15.34 O ATOM 1620 CB HIS A 107 10.796 -43.658 18.899 1.00 24.10 C ATOM 1621 CG HIS A 107 11.124 -42.898 20.147 1.00 23.12 C ATOM 1622 ND1 HIS A 107 11.687 -43.486 21.260 1.00 2.13 N ATOM 1623 CD2 HIS A 107 10.967 -41.589 20.454 1.00 70.12 C ATOM 1624 CE1 HIS A 107 11.860 -42.572 22.198 1.00 3.22 C ATOM 1625 NE2 HIS A 107 11.432 -41.412 21.734 1.00 53.12 N ATOM 0 H HIS A 107 9.935 -45.092 17.086 1.00 11.25 H new ATOM 0 HA HIS A 107 8.964 -44.479 19.661 1.00 14.22 H new ATOM 0 HB2 HIS A 107 11.366 -44.587 18.889 1.00 24.10 H new ATOM 0 HB3 HIS A 107 11.118 -43.077 18.035 1.00 24.10 H new ATOM 0 HD2 HIS A 107 10.553 -40.826 19.812 1.00 70.12 H new ATOM 0 HE1 HIS A 107 12.280 -42.744 23.178 1.00 3.22 H new ATOM 0 HE2 HIS A 107 11.445 -40.528 22.243 1.00 53.12 H new ATOM 1633 N VAL A 108 8.395 -42.252 17.322 1.00 1.13 N ATOM 1634 CA VAL A 108 7.657 -41.034 17.011 1.00 50.33 C ATOM 1635 C VAL A 108 6.159 -41.232 17.213 1.00 10.12 C ATOM 1636 O VAL A 108 5.509 -40.455 17.911 1.00 13.34 O ATOM 1637 CB VAL A 108 7.912 -40.578 15.562 1.00 42.12 C ATOM 1638 CG1 VAL A 108 7.111 -39.324 15.248 1.00 40.35 C ATOM 1639 CG2 VAL A 108 9.397 -40.343 15.331 1.00 24.43 C ATOM 0 H VAL A 108 8.803 -42.717 16.511 1.00 1.13 H new ATOM 0 HA VAL A 108 8.014 -40.264 17.695 1.00 50.33 H new ATOM 0 HB VAL A 108 7.583 -41.369 14.888 1.00 42.12 H new ATOM 0 HG11 VAL A 108 7.304 -39.017 14.220 1.00 40.35 H new ATOM 0 HG12 VAL A 108 6.048 -39.531 15.371 1.00 40.35 H new ATOM 0 HG13 VAL A 108 7.406 -38.524 15.927 1.00 40.35 H new ATOM 0 HG21 VAL A 108 9.559 -40.021 14.302 1.00 24.43 H new ATOM 0 HG22 VAL A 108 9.754 -39.571 16.013 1.00 24.43 H new ATOM 0 HG23 VAL A 108 9.944 -41.268 15.512 1.00 24.43 H new ATOM 1649 N MET A 109 5.618 -42.278 16.598 1.00 74.11 N ATOM 1650 CA MET A 109 4.195 -42.580 16.712 1.00 4.31 C ATOM 1651 C MET A 109 3.814 -42.860 18.162 1.00 31.21 C ATOM 1652 O MET A 109 2.798 -42.368 18.654 1.00 32.34 O ATOM 1653 CB MET A 109 3.835 -43.781 15.836 1.00 30.01 C ATOM 1654 CG MET A 109 3.364 -43.398 14.443 1.00 42.44 C ATOM 1655 SD MET A 109 1.773 -42.550 14.456 1.00 51.22 S ATOM 1656 CE MET A 109 1.030 -43.202 12.962 1.00 14.43 C ATOM 0 H MET A 109 6.143 -42.931 16.016 1.00 74.11 H new ATOM 0 HA MET A 109 3.635 -41.710 16.369 1.00 4.31 H new ATOM 0 HB2 MET A 109 4.705 -44.431 15.750 1.00 30.01 H new ATOM 0 HB3 MET A 109 3.053 -44.358 16.329 1.00 30.01 H new ATOM 0 HG2 MET A 109 4.110 -42.755 13.975 1.00 42.44 H new ATOM 0 HG3 MET A 109 3.288 -44.296 13.830 1.00 42.44 H new ATOM 0 HE1 MET A 109 -0.019 -43.433 13.148 1.00 14.43 H new ATOM 0 HE2 MET A 109 1.103 -42.461 12.166 1.00 14.43 H new ATOM 0 HE3 MET A 109 1.553 -44.110 12.662 1.00 14.43 H new ATOM 1666 N THR A 110 4.635 -43.654 18.843 1.00 72.44 N ATOM 1667 CA THR A 110 4.382 -44.001 20.235 1.00 23.53 C ATOM 1668 C THR A 110 4.173 -42.753 21.084 1.00 3.40 C ATOM 1669 O THR A 110 3.407 -42.766 22.046 1.00 13.20 O ATOM 1670 CB THR A 110 5.542 -44.823 20.829 1.00 63.24 C ATOM 1671 OG1 THR A 110 6.796 -44.230 20.472 1.00 53.13 O ATOM 1672 CG2 THR A 110 5.496 -46.261 20.333 1.00 43.44 C ATOM 0 H THR A 110 5.481 -44.069 18.452 1.00 72.44 H new ATOM 0 HA THR A 110 3.474 -44.604 20.250 1.00 23.53 H new ATOM 0 HB THR A 110 5.438 -44.826 21.914 1.00 63.24 H new ATOM 0 HG1 THR A 110 6.661 -43.283 20.258 1.00 53.13 H new ATOM 0 HG21 THR A 110 6.325 -46.822 20.766 1.00 43.44 H new ATOM 0 HG22 THR A 110 4.553 -46.719 20.631 1.00 43.44 H new ATOM 0 HG23 THR A 110 5.578 -46.274 19.246 1.00 43.44 H new ATOM 1680 N ASN A 111 4.860 -41.674 20.721 1.00 72.04 N ATOM 1681 CA ASN A 111 4.749 -40.416 21.450 1.00 54.24 C ATOM 1682 C ASN A 111 3.425 -39.723 21.140 1.00 0.12 C ATOM 1683 O ASN A 111 2.868 -39.019 21.983 1.00 2.45 O ATOM 1684 CB ASN A 111 5.916 -39.492 21.095 1.00 32.22 C ATOM 1685 CG ASN A 111 5.670 -38.059 21.525 1.00 53.34 C ATOM 1686 OD1 ASN A 111 5.489 -37.776 22.709 1.00 32.22 O ATOM 1687 ND2 ASN A 111 5.662 -37.146 20.561 1.00 53.54 N ATOM 0 H ASN A 111 5.499 -41.646 19.927 1.00 72.04 H new ATOM 0 HA ASN A 111 4.782 -40.639 22.517 1.00 54.24 H new ATOM 0 HB2 ASN A 111 6.825 -39.860 21.571 1.00 32.22 H new ATOM 0 HB3 ASN A 111 6.085 -39.522 20.019 1.00 32.22 H new ATOM 0 HD21 ASN A 111 5.501 -36.165 20.789 1.00 53.54 H new ATOM 0 HD22 ASN A 111 5.817 -37.426 19.592 1.00 53.54 H new ATOM 1694 N LEU A 112 2.926 -39.928 19.926 1.00 2.22 N ATOM 1695 CA LEU A 112 1.667 -39.324 19.504 1.00 0.34 C ATOM 1696 C LEU A 112 0.486 -39.967 20.224 1.00 23.51 C ATOM 1697 O LEU A 112 -0.561 -39.346 20.399 1.00 71.23 O ATOM 1698 CB LEU A 112 1.494 -39.462 17.991 1.00 72.50 C ATOM 1699 CG LEU A 112 0.845 -38.275 17.278 1.00 64.30 C ATOM 1700 CD1 LEU A 112 1.041 -38.384 15.774 1.00 62.22 C ATOM 1701 CD2 LEU A 112 -0.635 -38.191 17.620 1.00 30.52 C ATOM 0 H LEU A 112 3.374 -40.508 19.216 1.00 2.22 H new ATOM 0 HA LEU A 112 1.695 -38.266 19.765 1.00 0.34 H new ATOM 0 HB2 LEU A 112 2.475 -39.634 17.548 1.00 72.50 H new ATOM 0 HB3 LEU A 112 0.894 -40.351 17.794 1.00 72.50 H new ATOM 0 HG LEU A 112 1.329 -37.361 17.622 1.00 64.30 H new ATOM 0 HD11 LEU A 112 0.573 -37.531 15.283 1.00 62.22 H new ATOM 0 HD12 LEU A 112 2.107 -38.394 15.546 1.00 62.22 H new ATOM 0 HD13 LEU A 112 0.584 -39.306 15.413 1.00 62.22 H new ATOM 0 HD21 LEU A 112 -1.080 -37.340 17.104 1.00 30.52 H new ATOM 0 HD22 LEU A 112 -1.134 -39.108 17.306 1.00 30.52 H new ATOM 0 HD23 LEU A 112 -0.753 -38.064 18.696 1.00 30.52 H new ATOM 1713 N GLY A 113 0.664 -41.217 20.642 1.00 61.21 N ATOM 1714 CA GLY A 113 -0.394 -41.924 21.340 1.00 50.31 C ATOM 1715 C GLY A 113 -1.151 -42.875 20.434 1.00 15.44 C ATOM 1716 O GLY A 113 -2.300 -43.220 20.709 1.00 21.45 O ATOM 0 H GLY A 113 1.522 -41.752 20.510 1.00 61.21 H new ATOM 0 HA2 GLY A 113 0.034 -42.483 22.172 1.00 50.31 H new ATOM 0 HA3 GLY A 113 -1.090 -41.201 21.766 1.00 50.31 H new ATOM 1720 N GLU A 114 -0.508 -43.297 19.351 1.00 45.33 N ATOM 1721 CA GLU A 114 -1.130 -44.211 18.401 1.00 60.41 C ATOM 1722 C GLU A 114 -0.576 -45.624 18.563 1.00 71.01 C ATOM 1723 O GLU A 114 0.608 -45.869 18.332 1.00 22.45 O ATOM 1724 CB GLU A 114 -0.905 -43.725 16.968 1.00 42.32 C ATOM 1725 CG GLU A 114 -1.568 -44.599 15.917 1.00 63.22 C ATOM 1726 CD GLU A 114 -3.082 -44.543 15.981 1.00 4.43 C ATOM 1727 OE1 GLU A 114 -3.612 -43.647 16.671 1.00 13.12 O ATOM 1728 OE2 GLU A 114 -3.735 -45.393 15.343 1.00 75.33 O ATOM 0 H GLU A 114 0.444 -43.021 19.109 1.00 45.33 H new ATOM 0 HA GLU A 114 -2.200 -44.233 18.605 1.00 60.41 H new ATOM 0 HB2 GLU A 114 -1.285 -42.708 16.875 1.00 42.32 H new ATOM 0 HB3 GLU A 114 0.166 -43.684 16.771 1.00 42.32 H new ATOM 0 HG2 GLU A 114 -1.238 -44.284 14.927 1.00 63.22 H new ATOM 0 HG3 GLU A 114 -1.241 -45.630 16.048 1.00 63.22 H new ATOM 1735 N LYS A 115 -1.441 -46.550 18.962 1.00 74.23 N ATOM 1736 CA LYS A 115 -1.041 -47.939 19.155 1.00 75.03 C ATOM 1737 C LYS A 115 -0.619 -48.572 17.833 1.00 61.21 C ATOM 1738 O LYS A 115 -1.419 -48.686 16.903 1.00 31.14 O ATOM 1739 CB LYS A 115 -2.189 -48.741 19.772 1.00 15.34 C ATOM 1740 CG LYS A 115 -3.469 -48.700 18.955 1.00 41.51 C ATOM 1741 CD LYS A 115 -4.667 -49.158 19.770 1.00 4.41 C ATOM 1742 CE LYS A 115 -5.827 -49.566 18.875 1.00 2.33 C ATOM 1743 NZ LYS A 115 -5.555 -50.846 18.164 1.00 12.32 N ATOM 0 H LYS A 115 -2.424 -46.364 19.158 1.00 74.23 H new ATOM 0 HA LYS A 115 -0.189 -47.954 19.834 1.00 75.03 H new ATOM 0 HB2 LYS A 115 -1.875 -49.778 19.888 1.00 15.34 H new ATOM 0 HB3 LYS A 115 -2.393 -48.357 20.771 1.00 15.34 H new ATOM 0 HG2 LYS A 115 -3.639 -47.685 18.595 1.00 41.51 H new ATOM 0 HG3 LYS A 115 -3.361 -49.336 18.076 1.00 41.51 H new ATOM 0 HD2 LYS A 115 -4.379 -49.999 20.401 1.00 4.41 H new ATOM 0 HD3 LYS A 115 -4.984 -48.355 20.435 1.00 4.41 H new ATOM 0 HE2 LYS A 115 -6.731 -49.669 19.476 1.00 2.33 H new ATOM 0 HE3 LYS A 115 -6.017 -48.779 18.146 1.00 2.33 H new ATOM 0 HZ1 LYS A 115 -6.449 -51.246 17.816 1.00 12.32 H new ATOM 0 HZ2 LYS A 115 -4.919 -50.668 17.361 1.00 12.32 H new ATOM 0 HZ3 LYS A 115 -5.107 -51.518 18.819 1.00 12.32 H new ATOM 1757 N LEU A 116 0.642 -48.984 17.756 1.00 52.12 N ATOM 1758 CA LEU A 116 1.170 -49.608 16.548 1.00 44.44 C ATOM 1759 C LEU A 116 2.217 -50.663 16.893 1.00 55.34 C ATOM 1760 O LEU A 116 3.139 -50.408 17.667 1.00 25.43 O ATOM 1761 CB LEU A 116 1.782 -48.548 15.629 1.00 73.43 C ATOM 1762 CG LEU A 116 0.912 -47.323 15.346 1.00 4.42 C ATOM 1763 CD1 LEU A 116 1.747 -46.205 14.740 1.00 54.13 C ATOM 1764 CD2 LEU A 116 -0.242 -47.689 14.425 1.00 14.42 C ATOM 0 H LEU A 116 1.317 -48.897 18.516 1.00 52.12 H new ATOM 0 HA LEU A 116 0.345 -50.097 16.031 1.00 44.44 H new ATOM 0 HB2 LEU A 116 2.719 -48.209 16.071 1.00 73.43 H new ATOM 0 HB3 LEU A 116 2.031 -49.020 14.678 1.00 73.43 H new ATOM 0 HG LEU A 116 0.498 -46.969 16.290 1.00 4.42 H new ATOM 0 HD11 LEU A 116 1.112 -45.341 14.545 1.00 54.13 H new ATOM 0 HD12 LEU A 116 2.538 -45.924 15.435 1.00 54.13 H new ATOM 0 HD13 LEU A 116 2.190 -46.548 13.805 1.00 54.13 H new ATOM 0 HD21 LEU A 116 -0.850 -46.805 14.235 1.00 14.42 H new ATOM 0 HD22 LEU A 116 0.151 -48.069 13.482 1.00 14.42 H new ATOM 0 HD23 LEU A 116 -0.855 -48.456 14.897 1.00 14.42 H new ATOM 1776 N THR A 117 2.068 -51.849 16.311 1.00 53.23 N ATOM 1777 CA THR A 117 2.999 -52.942 16.555 1.00 24.43 C ATOM 1778 C THR A 117 4.121 -52.951 15.523 1.00 52.33 C ATOM 1779 O THR A 117 4.075 -52.216 14.536 1.00 14.42 O ATOM 1780 CB THR A 117 2.284 -54.306 16.530 1.00 31.32 C ATOM 1781 OG1 THR A 117 1.857 -54.611 15.198 1.00 71.12 O ATOM 1782 CG2 THR A 117 1.084 -54.305 17.465 1.00 32.10 C ATOM 0 H THR A 117 1.310 -52.076 15.667 1.00 53.23 H new ATOM 0 HA THR A 117 3.422 -52.780 17.546 1.00 24.43 H new ATOM 0 HB THR A 117 2.988 -55.067 16.868 1.00 31.32 H new ATOM 0 HG1 THR A 117 1.405 -55.480 15.190 1.00 71.12 H new ATOM 0 HG21 THR A 117 0.595 -55.279 17.430 1.00 32.10 H new ATOM 0 HG22 THR A 117 1.416 -54.102 18.483 1.00 32.10 H new ATOM 0 HG23 THR A 117 0.380 -53.534 17.152 1.00 32.10 H new ATOM 1790 N ASP A 118 5.127 -53.786 15.756 1.00 72.55 N ATOM 1791 CA ASP A 118 6.260 -53.892 14.844 1.00 41.42 C ATOM 1792 C ASP A 118 5.788 -54.158 13.418 1.00 74.00 C ATOM 1793 O ASP A 118 6.291 -53.562 12.466 1.00 21.42 O ATOM 1794 CB ASP A 118 7.205 -55.005 15.298 1.00 64.04 C ATOM 1795 CG ASP A 118 7.704 -54.799 16.714 1.00 24.33 C ATOM 1796 OD1 ASP A 118 7.895 -53.631 17.113 1.00 43.03 O ATOM 1797 OD2 ASP A 118 7.903 -55.806 17.425 1.00 63.51 O ATOM 0 H ASP A 118 5.181 -54.400 16.569 1.00 72.55 H new ATOM 0 HA ASP A 118 6.796 -52.943 14.858 1.00 41.42 H new ATOM 0 HB2 ASP A 118 6.690 -55.964 15.233 1.00 64.04 H new ATOM 0 HB3 ASP A 118 8.057 -55.054 14.619 1.00 64.04 H new ATOM 1802 N GLU A 119 4.819 -55.057 13.279 1.00 34.54 N ATOM 1803 CA GLU A 119 4.280 -55.404 11.969 1.00 2.51 C ATOM 1804 C GLU A 119 3.562 -54.211 11.344 1.00 73.31 C ATOM 1805 O GLU A 119 3.596 -54.021 10.129 1.00 73.13 O ATOM 1806 CB GLU A 119 3.319 -56.589 12.085 1.00 44.33 C ATOM 1807 CG GLU A 119 2.662 -56.970 10.769 1.00 61.01 C ATOM 1808 CD GLU A 119 3.672 -57.262 9.676 1.00 55.34 C ATOM 1809 OE1 GLU A 119 4.489 -58.188 9.854 1.00 24.11 O ATOM 1810 OE2 GLU A 119 3.643 -56.563 8.641 1.00 52.02 O ATOM 0 H GLU A 119 4.391 -55.558 14.057 1.00 34.54 H new ATOM 0 HA GLU A 119 5.113 -55.684 11.324 1.00 2.51 H new ATOM 0 HB2 GLU A 119 3.863 -57.450 12.473 1.00 44.33 H new ATOM 0 HB3 GLU A 119 2.544 -56.348 12.812 1.00 44.33 H new ATOM 0 HG2 GLU A 119 2.033 -57.847 10.922 1.00 61.01 H new ATOM 0 HG3 GLU A 119 2.007 -56.161 10.446 1.00 61.01 H new ATOM 1817 N GLU A 120 2.912 -53.412 12.184 1.00 34.34 N ATOM 1818 CA GLU A 120 2.184 -52.240 11.714 1.00 52.31 C ATOM 1819 C GLU A 120 3.141 -51.202 11.135 1.00 53.51 C ATOM 1820 O GLU A 120 2.854 -50.578 10.113 1.00 71.44 O ATOM 1821 CB GLU A 120 1.374 -51.622 12.856 1.00 23.12 C ATOM 1822 CG GLU A 120 0.309 -50.645 12.388 1.00 34.32 C ATOM 1823 CD GLU A 120 -0.969 -51.339 11.956 1.00 0.43 C ATOM 1824 OE1 GLU A 120 -0.903 -52.187 11.042 1.00 21.12 O ATOM 1825 OE2 GLU A 120 -2.034 -51.033 12.532 1.00 52.14 O ATOM 0 H GLU A 120 2.875 -53.555 13.193 1.00 34.34 H new ATOM 0 HA GLU A 120 1.502 -52.560 10.927 1.00 52.31 H new ATOM 0 HB2 GLU A 120 0.898 -52.420 13.426 1.00 23.12 H new ATOM 0 HB3 GLU A 120 2.054 -51.107 13.535 1.00 23.12 H new ATOM 0 HG2 GLU A 120 0.084 -49.945 13.193 1.00 34.32 H new ATOM 0 HG3 GLU A 120 0.699 -50.059 11.556 1.00 34.32 H new ATOM 1832 N VAL A 121 4.279 -51.021 11.797 1.00 43.34 N ATOM 1833 CA VAL A 121 5.279 -50.059 11.348 1.00 25.15 C ATOM 1834 C VAL A 121 5.800 -50.414 9.960 1.00 23.44 C ATOM 1835 O VAL A 121 6.032 -49.536 9.130 1.00 43.04 O ATOM 1836 CB VAL A 121 6.467 -49.987 12.327 1.00 14.32 C ATOM 1837 CG1 VAL A 121 7.424 -48.875 11.925 1.00 74.02 C ATOM 1838 CG2 VAL A 121 5.971 -49.785 13.751 1.00 31.42 C ATOM 0 H VAL A 121 4.532 -51.527 12.646 1.00 43.34 H new ATOM 0 HA VAL A 121 4.788 -49.087 11.310 1.00 25.15 H new ATOM 0 HB VAL A 121 7.008 -50.932 12.285 1.00 14.32 H new ATOM 0 HG11 VAL A 121 8.256 -48.840 12.628 1.00 74.02 H new ATOM 0 HG12 VAL A 121 7.804 -49.067 10.922 1.00 74.02 H new ATOM 0 HG13 VAL A 121 6.898 -47.920 11.937 1.00 74.02 H new ATOM 0 HG21 VAL A 121 6.823 -49.736 14.429 1.00 31.42 H new ATOM 0 HG22 VAL A 121 5.406 -48.855 13.811 1.00 31.42 H new ATOM 0 HG23 VAL A 121 5.329 -50.619 14.034 1.00 31.42 H new ATOM 1848 N ASP A 122 5.981 -51.707 9.716 1.00 65.52 N ATOM 1849 CA ASP A 122 6.474 -52.180 8.427 1.00 33.21 C ATOM 1850 C ASP A 122 5.643 -51.605 7.284 1.00 43.10 C ATOM 1851 O ASP A 122 6.187 -51.083 6.312 1.00 40.44 O ATOM 1852 CB ASP A 122 6.445 -53.709 8.376 1.00 43.53 C ATOM 1853 CG ASP A 122 6.989 -54.254 7.070 1.00 71.11 C ATOM 1854 OD1 ASP A 122 8.219 -54.452 6.975 1.00 14.31 O ATOM 1855 OD2 ASP A 122 6.185 -54.484 6.143 1.00 73.40 O ATOM 0 H ASP A 122 5.794 -52.446 10.393 1.00 65.52 H new ATOM 0 HA ASP A 122 7.503 -51.840 8.312 1.00 33.21 H new ATOM 0 HB2 ASP A 122 7.029 -54.109 9.205 1.00 43.53 H new ATOM 0 HB3 ASP A 122 5.420 -54.055 8.512 1.00 43.53 H new ATOM 1860 N GLU A 123 4.324 -51.706 7.409 1.00 74.14 N ATOM 1861 CA GLU A 123 3.419 -51.197 6.384 1.00 20.24 C ATOM 1862 C GLU A 123 3.675 -49.716 6.120 1.00 61.35 C ATOM 1863 O GLU A 123 3.454 -49.226 5.013 1.00 44.14 O ATOM 1864 CB GLU A 123 1.964 -51.406 6.808 1.00 33.52 C ATOM 1865 CG GLU A 123 0.964 -51.169 5.689 1.00 13.31 C ATOM 1866 CD GLU A 123 1.331 -51.901 4.413 1.00 21.01 C ATOM 1867 OE1 GLU A 123 2.096 -51.335 3.604 1.00 22.14 O ATOM 1868 OE2 GLU A 123 0.854 -53.039 4.223 1.00 33.01 O ATOM 0 H GLU A 123 3.858 -52.135 8.209 1.00 74.14 H new ATOM 0 HA GLU A 123 3.605 -51.750 5.464 1.00 20.24 H new ATOM 0 HB2 GLU A 123 1.845 -52.424 7.180 1.00 33.52 H new ATOM 0 HB3 GLU A 123 1.736 -50.735 7.636 1.00 33.52 H new ATOM 0 HG2 GLU A 123 -0.025 -51.491 6.016 1.00 13.31 H new ATOM 0 HG3 GLU A 123 0.900 -50.100 5.485 1.00 13.31 H new ATOM 1875 N MET A 124 4.142 -49.010 7.144 1.00 34.01 N ATOM 1876 CA MET A 124 4.428 -47.585 7.022 1.00 24.42 C ATOM 1877 C MET A 124 5.694 -47.354 6.203 1.00 5.25 C ATOM 1878 O MET A 124 5.660 -46.694 5.164 1.00 24.23 O ATOM 1879 CB MET A 124 4.580 -46.954 8.407 1.00 10.52 C ATOM 1880 CG MET A 124 3.908 -45.596 8.533 1.00 42.34 C ATOM 1881 SD MET A 124 3.075 -45.376 10.117 1.00 64.44 S ATOM 1882 CE MET A 124 2.620 -43.647 10.023 1.00 1.32 C ATOM 0 H MET A 124 4.330 -49.401 8.067 1.00 34.01 H new ATOM 0 HA MET A 124 3.591 -47.114 6.506 1.00 24.42 H new ATOM 0 HB2 MET A 124 4.160 -47.629 9.153 1.00 10.52 H new ATOM 0 HB3 MET A 124 5.641 -46.848 8.635 1.00 10.52 H new ATOM 0 HG2 MET A 124 4.655 -44.812 8.408 1.00 42.34 H new ATOM 0 HG3 MET A 124 3.184 -45.477 7.727 1.00 42.34 H new ATOM 0 HE1 MET A 124 2.854 -43.157 10.968 1.00 1.32 H new ATOM 0 HE2 MET A 124 3.177 -43.167 9.218 1.00 1.32 H new ATOM 0 HE3 MET A 124 1.551 -43.562 9.825 1.00 1.32 H new ATOM 1892 N ILE A 125 6.809 -47.900 6.678 1.00 11.34 N ATOM 1893 CA ILE A 125 8.085 -47.753 5.989 1.00 12.53 C ATOM 1894 C ILE A 125 7.980 -48.202 4.536 1.00 54.52 C ATOM 1895 O ILE A 125 8.606 -47.621 3.649 1.00 23.13 O ATOM 1896 CB ILE A 125 9.197 -48.560 6.685 1.00 52.30 C ATOM 1897 CG1 ILE A 125 9.436 -48.026 8.099 1.00 42.12 C ATOM 1898 CG2 ILE A 125 10.480 -48.507 5.869 1.00 55.24 C ATOM 1899 CD1 ILE A 125 10.025 -46.633 8.127 1.00 42.20 C ATOM 0 H ILE A 125 6.854 -48.448 7.537 1.00 11.34 H new ATOM 0 HA ILE A 125 8.341 -46.694 6.022 1.00 12.53 H new ATOM 0 HB ILE A 125 8.879 -49.600 6.759 1.00 52.30 H new ATOM 0 HG12 ILE A 125 8.491 -48.023 8.642 1.00 42.12 H new ATOM 0 HG13 ILE A 125 10.105 -48.705 8.627 1.00 42.12 H new ATOM 0 HG21 ILE A 125 11.256 -49.082 6.374 1.00 55.24 H new ATOM 0 HG22 ILE A 125 10.300 -48.930 4.881 1.00 55.24 H new ATOM 0 HG23 ILE A 125 10.804 -47.471 5.767 1.00 55.24 H new ATOM 0 HD11 ILE A 125 10.167 -46.319 9.161 1.00 42.20 H new ATOM 0 HD12 ILE A 125 10.986 -46.634 7.612 1.00 42.20 H new ATOM 0 HD13 ILE A 125 9.347 -45.941 7.628 1.00 42.20 H new ATOM 1911 N ARG A 126 7.182 -49.238 4.299 1.00 53.54 N ATOM 1912 CA ARG A 126 6.993 -49.764 2.952 1.00 24.32 C ATOM 1913 C ARG A 126 6.340 -48.724 2.048 1.00 40.53 C ATOM 1914 O ARG A 126 6.595 -48.686 0.845 1.00 41.15 O ATOM 1915 CB ARG A 126 6.136 -51.031 2.992 1.00 3.24 C ATOM 1916 CG ARG A 126 6.041 -51.744 1.654 1.00 73.23 C ATOM 1917 CD ARG A 126 5.151 -52.975 1.740 1.00 5.35 C ATOM 1918 NE ARG A 126 5.245 -53.803 0.541 1.00 32.13 N ATOM 1919 CZ ARG A 126 4.607 -54.959 0.395 1.00 30.12 C ATOM 1920 NH1 ARG A 126 3.833 -55.421 1.368 1.00 43.30 N ATOM 1921 NH2 ARG A 126 4.742 -55.656 -0.726 1.00 41.30 N ATOM 0 H ARG A 126 6.656 -49.730 5.022 1.00 53.54 H new ATOM 0 HA ARG A 126 7.974 -50.009 2.544 1.00 24.32 H new ATOM 0 HB2 ARG A 126 6.551 -51.717 3.731 1.00 3.24 H new ATOM 0 HB3 ARG A 126 5.132 -50.770 3.327 1.00 3.24 H new ATOM 0 HG2 ARG A 126 5.646 -51.060 0.903 1.00 73.23 H new ATOM 0 HG3 ARG A 126 7.038 -52.037 1.325 1.00 73.23 H new ATOM 0 HD2 ARG A 126 5.433 -53.566 2.612 1.00 5.35 H new ATOM 0 HD3 ARG A 126 4.116 -52.665 1.886 1.00 5.35 H new ATOM 0 HE ARG A 126 5.832 -53.476 -0.226 1.00 32.13 H new ATOM 0 HH11 ARG A 126 3.726 -54.888 2.231 1.00 43.30 H new ATOM 0 HH12 ARG A 126 3.344 -56.309 1.253 1.00 43.30 H new ATOM 0 HH21 ARG A 126 5.336 -55.304 -1.477 1.00 41.30 H new ATOM 0 HH22 ARG A 126 4.252 -56.543 -0.837 1.00 41.30 H new ATOM 1935 N GLU A 127 5.496 -47.882 2.636 1.00 2.52 N ATOM 1936 CA GLU A 127 4.806 -46.842 1.882 1.00 14.34 C ATOM 1937 C GLU A 127 5.774 -45.739 1.463 1.00 21.35 C ATOM 1938 O GLU A 127 5.749 -45.277 0.323 1.00 1.13 O ATOM 1939 CB GLU A 127 3.668 -46.247 2.715 1.00 22.03 C ATOM 1940 CG GLU A 127 2.635 -45.500 1.889 1.00 73.20 C ATOM 1941 CD GLU A 127 2.024 -46.362 0.801 1.00 32.23 C ATOM 1942 OE1 GLU A 127 2.578 -46.388 -0.317 1.00 71.14 O ATOM 1943 OE2 GLU A 127 0.991 -47.011 1.070 1.00 61.34 O ATOM 0 H GLU A 127 5.274 -47.900 3.631 1.00 2.52 H new ATOM 0 HA GLU A 127 4.390 -47.297 0.983 1.00 14.34 H new ATOM 0 HB2 GLU A 127 3.172 -47.049 3.262 1.00 22.03 H new ATOM 0 HB3 GLU A 127 4.089 -45.567 3.456 1.00 22.03 H new ATOM 0 HG2 GLU A 127 1.845 -45.136 2.545 1.00 73.20 H new ATOM 0 HG3 GLU A 127 3.101 -44.625 1.436 1.00 73.20 H new ATOM 1950 N ALA A 128 6.626 -45.323 2.395 1.00 50.13 N ATOM 1951 CA ALA A 128 7.603 -44.276 2.123 1.00 64.43 C ATOM 1952 C ALA A 128 8.765 -44.812 1.293 1.00 23.52 C ATOM 1953 O ALA A 128 9.416 -44.065 0.563 1.00 4.24 O ATOM 1954 CB ALA A 128 8.114 -43.679 3.426 1.00 70.52 C ATOM 0 H ALA A 128 6.659 -45.695 3.344 1.00 50.13 H new ATOM 0 HA ALA A 128 7.109 -43.493 1.547 1.00 64.43 H new ATOM 0 HB1 ALA A 128 8.843 -42.899 3.207 1.00 70.52 H new ATOM 0 HB2 ALA A 128 7.280 -43.251 3.982 1.00 70.52 H new ATOM 0 HB3 ALA A 128 8.586 -44.459 4.023 1.00 70.52 H new ATOM 1960 N ASP A 129 9.020 -46.111 1.411 1.00 41.14 N ATOM 1961 CA ASP A 129 10.104 -46.747 0.671 1.00 71.31 C ATOM 1962 C ASP A 129 9.802 -46.769 -0.824 1.00 41.43 C ATOM 1963 O ASP A 129 9.241 -47.736 -1.340 1.00 41.34 O ATOM 1964 CB ASP A 129 10.329 -48.172 1.179 1.00 74.42 C ATOM 1965 CG ASP A 129 11.645 -48.756 0.703 1.00 14.20 C ATOM 1966 OD1 ASP A 129 12.465 -47.995 0.148 1.00 61.01 O ATOM 1967 OD2 ASP A 129 11.854 -49.973 0.887 1.00 44.24 O ATOM 0 H ASP A 129 8.491 -46.743 2.012 1.00 41.14 H new ATOM 0 HA ASP A 129 11.011 -46.164 0.832 1.00 71.31 H new ATOM 0 HB2 ASP A 129 10.307 -48.174 2.269 1.00 74.42 H new ATOM 0 HB3 ASP A 129 9.510 -48.808 0.843 1.00 74.42 H new ATOM 1972 N ILE A 130 10.177 -45.696 -1.514 1.00 33.33 N ATOM 1973 CA ILE A 130 9.946 -45.592 -2.949 1.00 70.51 C ATOM 1974 C ILE A 130 10.998 -46.370 -3.733 1.00 32.54 C ATOM 1975 O ILE A 130 10.669 -47.160 -4.618 1.00 51.35 O ATOM 1976 CB ILE A 130 9.956 -44.125 -3.416 1.00 55.02 C ATOM 1977 CG1 ILE A 130 8.884 -43.324 -2.674 1.00 3.44 C ATOM 1978 CG2 ILE A 130 9.736 -44.046 -4.920 1.00 24.23 C ATOM 1979 CD1 ILE A 130 9.081 -41.826 -2.760 1.00 62.34 C ATOM 0 H ILE A 130 10.642 -44.887 -1.102 1.00 33.33 H new ATOM 0 HA ILE A 130 8.962 -46.020 -3.142 1.00 70.51 H new ATOM 0 HB ILE A 130 10.930 -43.693 -3.187 1.00 55.02 H new ATOM 0 HG12 ILE A 130 7.905 -43.578 -3.082 1.00 3.44 H new ATOM 0 HG13 ILE A 130 8.880 -43.622 -1.626 1.00 3.44 H new ATOM 0 HG21 ILE A 130 9.746 -43.002 -5.235 1.00 24.23 H new ATOM 0 HG22 ILE A 130 10.531 -44.587 -5.433 1.00 24.23 H new ATOM 0 HG23 ILE A 130 8.773 -44.492 -5.171 1.00 24.23 H new ATOM 0 HD11 ILE A 130 8.285 -41.322 -2.212 1.00 62.34 H new ATOM 0 HD12 ILE A 130 10.045 -41.560 -2.326 1.00 62.34 H new ATOM 0 HD13 ILE A 130 9.055 -41.515 -3.804 1.00 62.34 H new ATOM 1991 N ASP A 131 12.263 -46.144 -3.399 1.00 45.31 N ATOM 1992 CA ASP A 131 13.365 -46.826 -4.069 1.00 53.32 C ATOM 1993 C ASP A 131 13.438 -48.288 -3.642 1.00 63.43 C ATOM 1994 O ASP A 131 14.196 -49.074 -4.210 1.00 3.23 O ATOM 1995 CB ASP A 131 14.689 -46.125 -3.762 1.00 50.35 C ATOM 1996 CG ASP A 131 14.922 -45.953 -2.274 1.00 63.53 C ATOM 1997 OD1 ASP A 131 14.437 -46.801 -1.496 1.00 21.31 O ATOM 1998 OD2 ASP A 131 15.591 -44.972 -1.888 1.00 72.20 O ATOM 0 H ASP A 131 12.552 -45.494 -2.668 1.00 45.31 H new ATOM 0 HA ASP A 131 13.184 -46.788 -5.143 1.00 53.32 H new ATOM 0 HB2 ASP A 131 15.509 -46.700 -4.191 1.00 50.35 H new ATOM 0 HB3 ASP A 131 14.699 -45.147 -4.244 1.00 50.35 H new ATOM 2003 N GLY A 132 12.645 -48.647 -2.637 1.00 24.01 N ATOM 2004 CA GLY A 132 12.637 -50.014 -2.150 1.00 71.11 C ATOM 2005 C GLY A 132 13.969 -50.426 -1.554 1.00 54.44 C ATOM 2006 O GLY A 132 14.467 -51.518 -1.826 1.00 71.12 O ATOM 0 H GLY A 132 12.008 -48.015 -2.151 1.00 24.01 H new ATOM 0 HA2 GLY A 132 11.856 -50.123 -1.397 1.00 71.11 H new ATOM 0 HA3 GLY A 132 12.386 -50.687 -2.970 1.00 71.11 H new ATOM 2010 N ASP A 133 14.547 -49.549 -0.741 1.00 42.12 N ATOM 2011 CA ASP A 133 15.830 -49.827 -0.106 1.00 0.54 C ATOM 2012 C ASP A 133 15.631 -50.488 1.254 1.00 32.05 C ATOM 2013 O ASP A 133 16.561 -51.060 1.820 1.00 25.21 O ATOM 2014 CB ASP A 133 16.634 -48.535 0.054 1.00 21.32 C ATOM 2015 CG ASP A 133 15.987 -47.567 1.024 1.00 0.43 C ATOM 2016 OD1 ASP A 133 14.779 -47.723 1.303 1.00 65.12 O ATOM 2017 OD2 ASP A 133 16.688 -46.653 1.506 1.00 42.52 O ATOM 0 H ASP A 133 14.148 -48.640 -0.506 1.00 42.12 H new ATOM 0 HA ASP A 133 16.384 -50.514 -0.746 1.00 0.54 H new ATOM 0 HB2 ASP A 133 17.638 -48.776 0.402 1.00 21.32 H new ATOM 0 HB3 ASP A 133 16.740 -48.054 -0.918 1.00 21.32 H new ATOM 2022 N GLY A 134 14.410 -50.404 1.775 1.00 70.23 N ATOM 2023 CA GLY A 134 14.111 -50.998 3.065 1.00 41.21 C ATOM 2024 C GLY A 134 14.009 -49.964 4.169 1.00 72.12 C ATOM 2025 O GLY A 134 13.803 -50.309 5.332 1.00 3.43 O ATOM 0 H GLY A 134 13.623 -49.935 1.326 1.00 70.23 H new ATOM 0 HA2 GLY A 134 13.173 -51.549 2.999 1.00 41.21 H new ATOM 0 HA3 GLY A 134 14.887 -51.720 3.318 1.00 41.21 H new ATOM 2029 N GLN A 135 14.154 -48.694 3.804 1.00 60.41 N ATOM 2030 CA GLN A 135 14.079 -47.608 4.773 1.00 11.05 C ATOM 2031 C GLN A 135 13.527 -46.340 4.129 1.00 22.52 C ATOM 2032 O GLN A 135 13.345 -46.279 2.913 1.00 15.43 O ATOM 2033 CB GLN A 135 15.460 -47.332 5.369 1.00 4.34 C ATOM 2034 CG GLN A 135 15.413 -46.783 6.786 1.00 1.32 C ATOM 2035 CD GLN A 135 16.661 -47.111 7.581 1.00 23.13 C ATOM 2036 OE1 GLN A 135 17.155 -48.239 7.546 1.00 1.41 O ATOM 2037 NE2 GLN A 135 17.179 -46.125 8.304 1.00 24.24 N ATOM 0 H GLN A 135 14.324 -48.392 2.845 1.00 60.41 H new ATOM 0 HA GLN A 135 13.401 -47.913 5.570 1.00 11.05 H new ATOM 0 HB2 GLN A 135 16.039 -48.255 5.365 1.00 4.34 H new ATOM 0 HB3 GLN A 135 15.987 -46.623 4.731 1.00 4.34 H new ATOM 0 HG2 GLN A 135 15.285 -45.701 6.748 1.00 1.32 H new ATOM 0 HG3 GLN A 135 14.542 -47.189 7.300 1.00 1.32 H new ATOM 0 HE21 GLN A 135 16.737 -45.206 8.304 1.00 24.24 H new ATOM 0 HE22 GLN A 135 18.019 -46.287 8.860 1.00 24.24 H new ATOM 2046 N VAL A 136 13.263 -45.331 4.953 1.00 41.25 N ATOM 2047 CA VAL A 136 12.733 -44.064 4.463 1.00 13.10 C ATOM 2048 C VAL A 136 13.805 -42.980 4.470 1.00 13.01 C ATOM 2049 O VAL A 136 14.225 -42.516 5.529 1.00 41.42 O ATOM 2050 CB VAL A 136 11.535 -43.592 5.309 1.00 25.15 C ATOM 2051 CG1 VAL A 136 10.973 -42.290 4.760 1.00 2.13 C ATOM 2052 CG2 VAL A 136 10.461 -44.668 5.358 1.00 0.10 C ATOM 0 H VAL A 136 13.407 -45.366 5.962 1.00 41.25 H new ATOM 0 HA VAL A 136 12.400 -44.235 3.439 1.00 13.10 H new ATOM 0 HB VAL A 136 11.880 -43.409 6.327 1.00 25.15 H new ATOM 0 HG11 VAL A 136 10.128 -41.972 5.371 1.00 2.13 H new ATOM 0 HG12 VAL A 136 11.746 -41.522 4.783 1.00 2.13 H new ATOM 0 HG13 VAL A 136 10.642 -42.441 3.733 1.00 2.13 H new ATOM 0 HG21 VAL A 136 9.622 -44.318 5.960 1.00 0.10 H new ATOM 0 HG22 VAL A 136 10.117 -44.885 4.347 1.00 0.10 H new ATOM 0 HG23 VAL A 136 10.873 -45.574 5.803 1.00 0.10 H new ATOM 2062 N ASN A 137 14.243 -42.581 3.280 1.00 14.34 N ATOM 2063 CA ASN A 137 15.266 -41.550 3.149 1.00 23.41 C ATOM 2064 C ASN A 137 14.636 -40.162 3.085 1.00 21.44 C ATOM 2065 O ASN A 137 13.430 -40.026 2.877 1.00 44.43 O ATOM 2066 CB ASN A 137 16.111 -41.797 1.897 1.00 35.42 C ATOM 2067 CG ASN A 137 15.261 -41.995 0.657 1.00 71.33 C ATOM 2068 OD1 ASN A 137 14.138 -41.497 0.574 1.00 60.40 O ATOM 2069 ND2 ASN A 137 15.795 -42.726 -0.315 1.00 53.24 N ATOM 0 H ASN A 137 13.906 -42.956 2.393 1.00 14.34 H new ATOM 0 HA ASN A 137 15.908 -41.597 4.028 1.00 23.41 H new ATOM 0 HB2 ASN A 137 16.783 -40.953 1.743 1.00 35.42 H new ATOM 0 HB3 ASN A 137 16.735 -42.677 2.051 1.00 35.42 H new ATOM 0 HD21 ASN A 137 15.271 -42.894 -1.174 1.00 53.24 H new ATOM 0 HD22 ASN A 137 16.729 -43.119 -0.203 1.00 53.24 H new ATOM 2076 N TYR A 138 15.460 -39.136 3.266 1.00 72.01 N ATOM 2077 CA TYR A 138 14.983 -37.758 3.231 1.00 65.42 C ATOM 2078 C TYR A 138 14.185 -37.490 1.959 1.00 72.31 C ATOM 2079 O TYR A 138 13.096 -36.918 2.006 1.00 24.21 O ATOM 2080 CB TYR A 138 16.161 -36.787 3.321 1.00 45.11 C ATOM 2081 CG TYR A 138 15.749 -35.332 3.305 1.00 23.32 C ATOM 2082 CD1 TYR A 138 15.284 -34.710 4.457 1.00 52.51 C ATOM 2083 CD2 TYR A 138 15.824 -34.581 2.139 1.00 2.10 C ATOM 2084 CE1 TYR A 138 14.905 -33.381 4.447 1.00 4.14 C ATOM 2085 CE2 TYR A 138 15.449 -33.251 2.121 1.00 63.55 C ATOM 2086 CZ TYR A 138 14.990 -32.656 3.277 1.00 24.10 C ATOM 2087 OH TYR A 138 14.615 -31.332 3.262 1.00 33.34 O ATOM 0 H TYR A 138 16.461 -39.232 3.438 1.00 72.01 H new ATOM 0 HA TYR A 138 14.328 -37.605 4.088 1.00 65.42 H new ATOM 0 HB2 TYR A 138 16.718 -36.988 4.236 1.00 45.11 H new ATOM 0 HB3 TYR A 138 16.839 -36.973 2.488 1.00 45.11 H new ATOM 0 HD1 TYR A 138 15.218 -35.274 5.375 1.00 52.51 H new ATOM 0 HD2 TYR A 138 16.181 -35.044 1.231 1.00 2.10 H new ATOM 0 HE1 TYR A 138 14.544 -32.913 5.351 1.00 4.14 H new ATOM 0 HE2 TYR A 138 15.515 -32.681 1.206 1.00 63.55 H new ATOM 0 HH TYR A 138 14.737 -30.968 2.361 1.00 33.34 H new ATOM 2097 N GLU A 139 14.735 -37.909 0.823 1.00 34.33 N ATOM 2098 CA GLU A 139 14.074 -37.714 -0.462 1.00 31.41 C ATOM 2099 C GLU A 139 12.640 -38.236 -0.421 1.00 64.34 C ATOM 2100 O GLU A 139 11.736 -37.640 -1.004 1.00 52.24 O ATOM 2101 CB GLU A 139 14.854 -38.420 -1.573 1.00 52.45 C ATOM 2102 CG GLU A 139 14.209 -38.294 -2.944 1.00 0.34 C ATOM 2103 CD GLU A 139 15.018 -38.971 -4.033 1.00 55.43 C ATOM 2104 OE1 GLU A 139 14.865 -40.198 -4.209 1.00 3.25 O ATOM 2105 OE2 GLU A 139 15.802 -38.274 -4.710 1.00 62.12 O ATOM 0 H GLU A 139 15.635 -38.385 0.767 1.00 34.33 H new ATOM 0 HA GLU A 139 14.047 -36.644 -0.670 1.00 31.41 H new ATOM 0 HB2 GLU A 139 15.862 -38.008 -1.616 1.00 52.45 H new ATOM 0 HB3 GLU A 139 14.952 -39.476 -1.322 1.00 52.45 H new ATOM 0 HG2 GLU A 139 13.211 -38.731 -2.913 1.00 0.34 H new ATOM 0 HG3 GLU A 139 14.088 -37.239 -3.189 1.00 0.34 H new ATOM 2112 N GLU A 140 12.443 -39.354 0.271 1.00 40.12 N ATOM 2113 CA GLU A 140 11.120 -39.957 0.386 1.00 43.21 C ATOM 2114 C GLU A 140 10.273 -39.217 1.417 1.00 0.20 C ATOM 2115 O GLU A 140 9.117 -38.881 1.161 1.00 55.01 O ATOM 2116 CB GLU A 140 11.240 -41.432 0.772 1.00 31.53 C ATOM 2117 CG GLU A 140 11.543 -42.347 -0.403 1.00 4.32 C ATOM 2118 CD GLU A 140 12.345 -43.569 0.001 1.00 71.03 C ATOM 2119 OE1 GLU A 140 12.199 -44.018 1.157 1.00 73.31 O ATOM 2120 OE2 GLU A 140 13.118 -44.076 -0.839 1.00 31.04 O ATOM 0 H GLU A 140 13.182 -39.860 0.760 1.00 40.12 H new ATOM 0 HA GLU A 140 10.628 -39.882 -0.584 1.00 43.21 H new ATOM 0 HB2 GLU A 140 12.027 -41.540 1.518 1.00 31.53 H new ATOM 0 HB3 GLU A 140 10.310 -41.753 1.241 1.00 31.53 H new ATOM 0 HG2 GLU A 140 10.607 -42.666 -0.861 1.00 4.32 H new ATOM 0 HG3 GLU A 140 12.094 -41.789 -1.160 1.00 4.32 H new ATOM 2127 N PHE A 141 10.857 -38.967 2.584 1.00 10.42 N ATOM 2128 CA PHE A 141 10.156 -38.268 3.655 1.00 3.04 C ATOM 2129 C PHE A 141 9.604 -36.933 3.164 1.00 73.20 C ATOM 2130 O PHE A 141 8.522 -36.509 3.570 1.00 13.00 O ATOM 2131 CB PHE A 141 11.094 -38.039 4.842 1.00 2.44 C ATOM 2132 CG PHE A 141 10.407 -37.462 6.047 1.00 73.11 C ATOM 2133 CD1 PHE A 141 9.750 -38.286 6.947 1.00 71.13 C ATOM 2134 CD2 PHE A 141 10.418 -36.096 6.280 1.00 73.32 C ATOM 2135 CE1 PHE A 141 9.116 -37.758 8.055 1.00 11.04 C ATOM 2136 CE2 PHE A 141 9.786 -35.562 7.387 1.00 33.42 C ATOM 2137 CZ PHE A 141 9.135 -36.395 8.277 1.00 52.34 C ATOM 0 H PHE A 141 11.814 -39.238 2.812 1.00 10.42 H new ATOM 0 HA PHE A 141 9.320 -38.891 3.975 1.00 3.04 H new ATOM 0 HB2 PHE A 141 11.557 -38.987 5.117 1.00 2.44 H new ATOM 0 HB3 PHE A 141 11.897 -37.369 4.536 1.00 2.44 H new ATOM 0 HD1 PHE A 141 9.733 -39.353 6.780 1.00 71.13 H new ATOM 0 HD2 PHE A 141 10.927 -35.441 5.588 1.00 73.32 H new ATOM 0 HE1 PHE A 141 8.606 -38.411 8.747 1.00 11.04 H new ATOM 0 HE2 PHE A 141 9.801 -34.495 7.556 1.00 33.42 H new ATOM 0 HZ PHE A 141 8.642 -35.981 9.144 1.00 52.34 H new ATOM 2147 N VAL A 142 10.356 -36.275 2.287 1.00 35.12 N ATOM 2148 CA VAL A 142 9.942 -34.989 1.739 1.00 1.11 C ATOM 2149 C VAL A 142 8.770 -35.152 0.778 1.00 32.23 C ATOM 2150 O VAL A 142 7.818 -34.372 0.807 1.00 24.22 O ATOM 2151 CB VAL A 142 11.102 -34.294 1.002 1.00 4.44 C ATOM 2152 CG1 VAL A 142 10.643 -32.969 0.413 1.00 42.13 C ATOM 2153 CG2 VAL A 142 12.282 -34.089 1.941 1.00 40.42 C ATOM 0 H VAL A 142 11.255 -36.611 1.941 1.00 35.12 H new ATOM 0 HA VAL A 142 9.633 -34.371 2.582 1.00 1.11 H new ATOM 0 HB VAL A 142 11.426 -34.936 0.182 1.00 4.44 H new ATOM 0 HG11 VAL A 142 11.476 -32.493 -0.104 1.00 42.13 H new ATOM 0 HG12 VAL A 142 9.832 -33.146 -0.293 1.00 42.13 H new ATOM 0 HG13 VAL A 142 10.292 -32.317 1.213 1.00 42.13 H new ATOM 0 HG21 VAL A 142 13.093 -33.597 1.404 1.00 40.42 H new ATOM 0 HG22 VAL A 142 11.974 -33.468 2.782 1.00 40.42 H new ATOM 0 HG23 VAL A 142 12.625 -35.055 2.310 1.00 40.42 H new ATOM 2163 N GLN A 143 8.846 -36.171 -0.071 1.00 73.44 N ATOM 2164 CA GLN A 143 7.790 -36.437 -1.042 1.00 1.24 C ATOM 2165 C GLN A 143 6.515 -36.900 -0.345 1.00 54.43 C ATOM 2166 O GLN A 143 5.409 -36.662 -0.832 1.00 24.13 O ATOM 2167 CB GLN A 143 8.248 -37.493 -2.049 1.00 33.44 C ATOM 2168 CG GLN A 143 7.375 -37.568 -3.291 1.00 34.42 C ATOM 2169 CD GLN A 143 8.119 -38.110 -4.495 1.00 73.42 C ATOM 2170 OE1 GLN A 143 9.117 -37.537 -4.932 1.00 51.04 O ATOM 2171 NE2 GLN A 143 7.636 -39.222 -5.039 1.00 11.51 N ATOM 0 H GLN A 143 9.627 -36.826 -0.107 1.00 73.44 H new ATOM 0 HA GLN A 143 7.576 -35.509 -1.572 1.00 1.24 H new ATOM 0 HB2 GLN A 143 9.274 -37.277 -2.348 1.00 33.44 H new ATOM 0 HB3 GLN A 143 8.257 -38.468 -1.562 1.00 33.44 H new ATOM 0 HG2 GLN A 143 6.512 -38.202 -3.086 1.00 34.42 H new ATOM 0 HG3 GLN A 143 6.993 -36.574 -3.522 1.00 34.42 H new ATOM 0 HE21 GLN A 143 6.806 -39.664 -4.644 1.00 11.51 H new ATOM 0 HE22 GLN A 143 8.095 -39.634 -5.851 1.00 11.51 H new ATOM 2180 N MET A 144 6.676 -37.562 0.796 1.00 40.24 N ATOM 2181 CA MET A 144 5.537 -38.057 1.559 1.00 34.30 C ATOM 2182 C MET A 144 4.789 -36.908 2.227 1.00 15.10 C ATOM 2183 O MET A 144 3.589 -36.732 2.018 1.00 14.22 O ATOM 2184 CB MET A 144 6.001 -39.061 2.616 1.00 61.33 C ATOM 2185 CG MET A 144 4.869 -39.878 3.217 1.00 20.21 C ATOM 2186 SD MET A 144 4.309 -41.199 2.125 1.00 53.45 S ATOM 2187 CE MET A 144 2.556 -41.220 2.490 1.00 15.43 C ATOM 0 H MET A 144 7.584 -37.768 1.212 1.00 40.24 H new ATOM 0 HA MET A 144 4.858 -38.556 0.867 1.00 34.30 H new ATOM 0 HB2 MET A 144 6.728 -39.738 2.168 1.00 61.33 H new ATOM 0 HB3 MET A 144 6.514 -38.525 3.414 1.00 61.33 H new ATOM 0 HG2 MET A 144 5.199 -40.309 4.162 1.00 20.21 H new ATOM 0 HG3 MET A 144 4.031 -39.219 3.443 1.00 20.21 H new ATOM 0 HE1 MET A 144 2.299 -42.155 2.988 1.00 15.43 H new ATOM 0 HE2 MET A 144 2.310 -40.382 3.142 1.00 15.43 H new ATOM 0 HE3 MET A 144 1.990 -41.136 1.562 1.00 15.43 H new ATOM 2197 N MET A 145 5.505 -36.129 3.031 1.00 62.22 N ATOM 2198 CA MET A 145 4.908 -34.996 3.728 1.00 21.24 C ATOM 2199 C MET A 145 4.461 -33.924 2.740 1.00 1.43 C ATOM 2200 O MET A 145 3.549 -33.145 3.023 1.00 65.24 O ATOM 2201 CB MET A 145 5.903 -34.403 4.727 1.00 4.14 C ATOM 2202 CG MET A 145 5.267 -33.450 5.726 1.00 30.23 C ATOM 2203 SD MET A 145 6.105 -33.456 7.323 1.00 42.23 S ATOM 2204 CE MET A 145 5.856 -35.155 7.830 1.00 62.40 C ATOM 0 H MET A 145 6.499 -36.262 3.216 1.00 62.22 H new ATOM 0 HA MET A 145 4.032 -35.354 4.268 1.00 21.24 H new ATOM 0 HB2 MET A 145 6.388 -35.215 5.270 1.00 4.14 H new ATOM 0 HB3 MET A 145 6.684 -33.875 4.180 1.00 4.14 H new ATOM 0 HG2 MET A 145 5.280 -32.440 5.317 1.00 30.23 H new ATOM 0 HG3 MET A 145 4.221 -33.723 5.868 1.00 30.23 H new ATOM 0 HE1 MET A 145 6.108 -35.261 8.885 1.00 62.40 H new ATOM 0 HE2 MET A 145 4.813 -35.431 7.677 1.00 62.40 H new ATOM 0 HE3 MET A 145 6.495 -35.809 7.237 1.00 62.40 H new ATOM 2214 N THR A 146 5.109 -33.887 1.580 1.00 73.33 N ATOM 2215 CA THR A 146 4.779 -32.909 0.551 1.00 71.43 C ATOM 2216 C THR A 146 4.075 -33.569 -0.629 1.00 73.33 C ATOM 2217 O THR A 146 4.060 -33.030 -1.736 1.00 34.44 O ATOM 2218 CB THR A 146 6.038 -32.183 0.042 1.00 63.14 C ATOM 2219 OG1 THR A 146 6.939 -31.945 1.129 1.00 43.44 O ATOM 2220 CG2 THR A 146 5.672 -30.863 -0.619 1.00 54.20 C ATOM 0 H THR A 146 5.866 -34.523 1.330 1.00 73.33 H new ATOM 0 HA THR A 146 4.109 -32.181 1.010 1.00 71.43 H new ATOM 0 HB THR A 146 6.523 -32.819 -0.699 1.00 63.14 H new ATOM 0 HG1 THR A 146 7.409 -32.776 1.352 1.00 43.44 H new ATOM 0 HG21 THR A 146 6.578 -30.369 -0.970 1.00 54.20 H new ATOM 0 HG22 THR A 146 5.010 -31.051 -1.464 1.00 54.20 H new ATOM 0 HG23 THR A 146 5.166 -30.222 0.103 1.00 54.20 H new ATOM 2351 N LYS M 15 -2.493 -43.477 8.256 1.00 51.33 N ATOM 2352 CA LYS M 15 -1.563 -43.203 9.345 1.00 40.54 C ATOM 2353 C LYS M 15 -0.540 -42.148 8.934 1.00 12.01 C ATOM 2354 O LYS M 15 -0.331 -41.164 9.644 1.00 63.14 O ATOM 2355 CB LYS M 15 -0.846 -44.487 9.766 1.00 63.12 C ATOM 2356 CG LYS M 15 -1.775 -45.542 10.340 1.00 31.31 C ATOM 2357 CD LYS M 15 -1.062 -46.422 11.353 1.00 2.35 C ATOM 2358 CE LYS M 15 -0.407 -47.622 10.687 1.00 43.41 C ATOM 2359 NZ LYS M 15 -1.413 -48.613 10.216 1.00 55.31 N ATOM 0 HA LYS M 15 -2.135 -42.820 10.190 1.00 40.54 H new ATOM 0 HB2 LYS M 15 -0.327 -44.903 8.903 1.00 63.12 H new ATOM 0 HB3 LYS M 15 -0.086 -44.242 10.508 1.00 63.12 H new ATOM 0 HG2 LYS M 15 -2.628 -45.057 10.815 1.00 31.31 H new ATOM 0 HG3 LYS M 15 -2.168 -46.160 9.533 1.00 31.31 H new ATOM 0 HD2 LYS M 15 -0.305 -45.837 11.876 1.00 2.35 H new ATOM 0 HD3 LYS M 15 -1.774 -46.765 12.103 1.00 2.35 H new ATOM 0 HE2 LYS M 15 0.194 -47.285 9.842 1.00 43.41 H new ATOM 0 HE3 LYS M 15 0.273 -48.102 11.391 1.00 43.41 H new ATOM 0 HZ1 LYS M 15 -0.939 -49.514 10.004 1.00 55.31 H new ATOM 0 HZ2 LYS M 15 -2.126 -48.763 10.958 1.00 55.31 H new ATOM 0 HZ3 LYS M 15 -1.877 -48.255 9.357 1.00 55.31 H new ATOM 2373 N TRP M 16 0.092 -42.359 7.785 1.00 32.44 N ATOM 2374 CA TRP M 16 1.092 -41.425 7.280 1.00 34.32 C ATOM 2375 C TRP M 16 0.540 -40.004 7.244 1.00 60.40 C ATOM 2376 O TRP M 16 1.224 -39.054 7.623 1.00 32.55 O ATOM 2377 CB TRP M 16 1.550 -41.844 5.882 1.00 12.41 C ATOM 2378 CG TRP M 16 2.745 -42.748 5.895 1.00 71.05 C ATOM 2379 CD1 TRP M 16 2.788 -44.055 5.499 1.00 1.44 C ATOM 2380 CD2 TRP M 16 4.069 -42.413 6.325 1.00 34.25 C ATOM 2381 NE1 TRP M 16 4.059 -44.552 5.659 1.00 71.22 N ATOM 2382 CE2 TRP M 16 4.863 -43.565 6.163 1.00 3.11 C ATOM 2383 CE3 TRP M 16 4.660 -41.252 6.831 1.00 63.44 C ATOM 2384 CZ2 TRP M 16 6.217 -43.587 6.489 1.00 33.05 C ATOM 2385 CZ3 TRP M 16 6.003 -41.276 7.154 1.00 25.13 C ATOM 2386 CH2 TRP M 16 6.770 -42.436 6.982 1.00 31.51 C ATOM 0 H TRP M 16 -0.070 -43.168 7.186 1.00 32.44 H new ATOM 0 HA TRP M 16 1.947 -41.445 7.956 1.00 34.32 H new ATOM 0 HB2 TRP M 16 0.728 -42.348 5.374 1.00 12.41 H new ATOM 0 HB3 TRP M 16 1.785 -40.952 5.302 1.00 12.41 H new ATOM 0 HD1 TRP M 16 1.947 -44.615 5.117 1.00 1.44 H new ATOM 0 HE1 TRP M 16 4.356 -45.503 5.438 1.00 71.22 H new ATOM 0 HE3 TRP M 16 4.078 -40.353 6.967 1.00 63.44 H new ATOM 0 HZ2 TRP M 16 6.809 -44.480 6.357 1.00 33.05 H new ATOM 0 HZ3 TRP M 16 6.470 -40.385 7.546 1.00 25.13 H new ATOM 0 HH2 TRP M 16 7.818 -42.422 7.243 1.00 31.51 H new ATOM 2397 N GLU M 17 -0.700 -39.867 6.785 1.00 32.04 N ATOM 2398 CA GLU M 17 -1.342 -38.560 6.700 1.00 61.41 C ATOM 2399 C GLU M 17 -1.312 -37.850 8.050 1.00 5.10 C ATOM 2400 O GLU M 17 -1.319 -36.621 8.118 1.00 4.42 O ATOM 2401 CB GLU M 17 -2.788 -38.708 6.221 1.00 2.03 C ATOM 2402 CG GLU M 17 -3.454 -37.386 5.880 1.00 43.35 C ATOM 2403 CD GLU M 17 -4.964 -37.446 5.995 1.00 34.31 C ATOM 2404 OE1 GLU M 17 -5.496 -38.548 6.248 1.00 43.01 O ATOM 2405 OE2 GLU M 17 -5.615 -36.393 5.833 1.00 72.13 O ATOM 0 H GLU M 17 -1.279 -40.644 6.467 1.00 32.04 H new ATOM 0 HA GLU M 17 -0.788 -37.958 5.980 1.00 61.41 H new ATOM 0 HB2 GLU M 17 -2.807 -39.352 5.342 1.00 2.03 H new ATOM 0 HB3 GLU M 17 -3.369 -39.209 6.995 1.00 2.03 H new ATOM 0 HG2 GLU M 17 -3.074 -36.610 6.544 1.00 43.35 H new ATOM 0 HG3 GLU M 17 -3.182 -37.098 4.865 1.00 43.35 H new ATOM 2412 N LYS M 18 -1.278 -38.633 9.123 1.00 12.32 N ATOM 2413 CA LYS M 18 -1.246 -38.081 10.472 1.00 31.05 C ATOM 2414 C LYS M 18 0.094 -37.408 10.753 1.00 33.24 C ATOM 2415 O LYS M 18 0.167 -36.448 11.520 1.00 5.35 O ATOM 2416 CB LYS M 18 -1.501 -39.184 11.503 1.00 50.34 C ATOM 2417 CG LYS M 18 -1.830 -38.657 12.889 1.00 41.13 C ATOM 2418 CD LYS M 18 -2.677 -39.644 13.674 1.00 53.01 C ATOM 2419 CE LYS M 18 -1.853 -40.829 14.153 1.00 62.15 C ATOM 2420 NZ LYS M 18 -2.696 -42.034 14.385 1.00 54.00 N ATOM 0 H LYS M 18 -1.272 -39.652 9.084 1.00 12.32 H new ATOM 0 HA LYS M 18 -2.033 -37.331 10.549 1.00 31.05 H new ATOM 0 HB2 LYS M 18 -2.323 -39.810 11.157 1.00 50.34 H new ATOM 0 HB3 LYS M 18 -0.619 -39.822 11.566 1.00 50.34 H new ATOM 0 HG2 LYS M 18 -0.906 -38.457 13.432 1.00 41.13 H new ATOM 0 HG3 LYS M 18 -2.361 -37.709 12.802 1.00 41.13 H new ATOM 0 HD2 LYS M 18 -3.124 -39.140 14.531 1.00 53.01 H new ATOM 0 HD3 LYS M 18 -3.497 -39.999 13.049 1.00 53.01 H new ATOM 0 HE2 LYS M 18 -1.085 -41.060 13.414 1.00 62.15 H new ATOM 0 HE3 LYS M 18 -1.338 -40.563 15.076 1.00 62.15 H new ATOM 0 HZ1 LYS M 18 -2.753 -42.227 15.405 1.00 54.00 H new ATOM 0 HZ2 LYS M 18 -3.652 -41.867 14.010 1.00 54.00 H new ATOM 0 HZ3 LYS M 18 -2.273 -42.852 13.902 1.00 54.00 H new ATOM 2434 N ILE M 19 1.149 -37.917 10.127 1.00 21.31 N ATOM 2435 CA ILE M 19 2.485 -37.363 10.308 1.00 21.24 C ATOM 2436 C ILE M 19 2.689 -36.126 9.441 1.00 2.53 C ATOM 2437 O ILE M 19 3.512 -35.265 9.754 1.00 11.22 O ATOM 2438 CB ILE M 19 3.574 -38.398 9.971 1.00 64.24 C ATOM 2439 CG1 ILE M 19 3.312 -39.708 10.716 1.00 64.51 C ATOM 2440 CG2 ILE M 19 4.951 -37.851 10.318 1.00 12.00 C ATOM 2441 CD1 ILE M 19 4.284 -40.812 10.359 1.00 52.43 C ATOM 0 H ILE M 19 1.105 -38.712 9.490 1.00 21.31 H new ATOM 0 HA ILE M 19 2.572 -37.086 11.359 1.00 21.24 H new ATOM 0 HB ILE M 19 3.544 -38.599 8.900 1.00 64.24 H new ATOM 0 HG12 ILE M 19 3.363 -39.523 11.789 1.00 64.51 H new ATOM 0 HG13 ILE M 19 2.298 -40.044 10.499 1.00 64.51 H new ATOM 0 HG21 ILE M 19 5.710 -38.594 10.074 1.00 12.00 H new ATOM 0 HG22 ILE M 19 5.136 -36.942 9.746 1.00 12.00 H new ATOM 0 HG23 ILE M 19 4.995 -37.624 11.383 1.00 12.00 H new ATOM 0 HD11 ILE M 19 4.038 -41.711 10.925 1.00 52.43 H new ATOM 0 HD12 ILE M 19 4.217 -41.025 9.292 1.00 52.43 H new ATOM 0 HD13 ILE M 19 5.298 -40.496 10.603 1.00 52.43 H new ATOM 2453 N ARG M 20 1.933 -36.042 8.351 1.00 25.32 N ATOM 2454 CA ARG M 20 2.031 -34.909 7.439 1.00 71.42 C ATOM 2455 C ARG M 20 1.870 -33.591 8.190 1.00 55.02 C ATOM 2456 O ARG M 20 2.409 -32.562 7.782 1.00 42.41 O ATOM 2457 CB ARG M 20 0.969 -35.017 6.343 1.00 63.44 C ATOM 2458 CG ARG M 20 1.018 -33.882 5.333 1.00 1.14 C ATOM 2459 CD ARG M 20 0.304 -34.253 4.043 1.00 45.52 C ATOM 2460 NE ARG M 20 0.877 -35.445 3.423 1.00 4.45 N ATOM 2461 CZ ARG M 20 0.242 -36.180 2.518 1.00 32.01 C ATOM 2462 NH1 ARG M 20 -0.981 -35.847 2.128 1.00 1.23 N ATOM 2463 NH2 ARG M 20 0.830 -37.251 2.000 1.00 35.02 N ATOM 0 H ARG M 20 1.246 -36.745 8.078 1.00 25.32 H new ATOM 0 HA ARG M 20 3.020 -34.927 6.981 1.00 71.42 H new ATOM 0 HB2 ARG M 20 1.095 -35.964 5.819 1.00 63.44 H new ATOM 0 HB3 ARG M 20 -0.018 -35.038 6.806 1.00 63.44 H new ATOM 0 HG2 ARG M 20 0.558 -32.992 5.762 1.00 1.14 H new ATOM 0 HG3 ARG M 20 2.056 -33.631 5.116 1.00 1.14 H new ATOM 0 HD2 ARG M 20 -0.752 -34.424 4.250 1.00 45.52 H new ATOM 0 HD3 ARG M 20 0.361 -33.418 3.344 1.00 45.52 H new ATOM 0 HE ARG M 20 1.817 -35.728 3.701 1.00 4.45 H new ATOM 0 HH11 ARG M 20 -1.436 -35.024 2.524 1.00 1.23 H new ATOM 0 HH12 ARG M 20 -1.466 -36.414 1.432 1.00 1.23 H new ATOM 0 HH21 ARG M 20 1.771 -37.510 2.297 1.00 35.02 H new ATOM 0 HH22 ARG M 20 0.341 -37.815 1.305 1.00 35.02 H new ATOM 2630 N LYS M 30 8.375 -16.195 11.857 1.00 23.52 N ATOM 2631 CA LYS M 30 7.355 -15.957 12.872 1.00 64.33 C ATOM 2632 C LYS M 30 7.390 -14.509 13.348 1.00 11.23 C ATOM 2633 O LYS M 30 6.398 -13.989 13.861 1.00 33.54 O ATOM 2634 CB LYS M 30 7.558 -16.901 14.059 1.00 33.12 C ATOM 2635 CG LYS M 30 6.671 -16.580 15.250 1.00 52.34 C ATOM 2636 CD LYS M 30 6.964 -17.495 16.427 1.00 51.14 C ATOM 2637 CE LYS M 30 6.874 -16.748 17.749 1.00 64.52 C ATOM 2638 NZ LYS M 30 5.517 -16.849 18.352 1.00 74.50 N ATOM 0 HA LYS M 30 6.380 -16.150 12.425 1.00 64.33 H new ATOM 0 HB2 LYS M 30 7.363 -17.924 13.737 1.00 33.12 H new ATOM 0 HB3 LYS M 30 8.601 -16.859 14.372 1.00 33.12 H new ATOM 0 HG2 LYS M 30 6.822 -15.543 15.548 1.00 52.34 H new ATOM 0 HG3 LYS M 30 5.624 -16.680 14.962 1.00 52.34 H new ATOM 0 HD2 LYS M 30 6.258 -18.325 16.428 1.00 51.14 H new ATOM 0 HD3 LYS M 30 7.960 -17.924 16.317 1.00 51.14 H new ATOM 0 HE2 LYS M 30 7.611 -17.150 18.444 1.00 64.52 H new ATOM 0 HE3 LYS M 30 7.124 -15.699 17.591 1.00 64.52 H new ATOM 0 HZ1 LYS M 30 5.497 -16.327 19.251 1.00 74.50 H new ATOM 0 HZ2 LYS M 30 4.816 -16.442 17.700 1.00 74.50 H new ATOM 0 HZ3 LYS M 30 5.288 -17.848 18.527 1.00 74.50 H new ATOM 2652 N LEU M 31 8.537 -13.861 13.175 1.00 55.13 N ATOM 2653 CA LEU M 31 8.700 -12.471 13.586 1.00 53.20 C ATOM 2654 C LEU M 31 7.901 -11.538 12.681 1.00 44.10 C ATOM 2655 O LEU M 31 7.224 -10.625 13.154 1.00 22.13 O ATOM 2656 CB LEU M 31 10.179 -12.081 13.561 1.00 32.44 C ATOM 2657 CG LEU M 31 10.479 -10.583 13.603 1.00 41.42 C ATOM 2658 CD1 LEU M 31 9.816 -9.939 14.810 1.00 0.44 C ATOM 2659 CD2 LEU M 31 11.981 -10.340 13.624 1.00 22.02 C ATOM 0 H LEU M 31 9.368 -14.276 12.753 1.00 55.13 H new ATOM 0 HA LEU M 31 8.322 -12.372 14.603 1.00 53.20 H new ATOM 0 HB2 LEU M 31 10.673 -12.554 14.410 1.00 32.44 H new ATOM 0 HB3 LEU M 31 10.628 -12.496 12.659 1.00 32.44 H new ATOM 0 HG LEU M 31 10.070 -10.125 12.703 1.00 41.42 H new ATOM 0 HD11 LEU M 31 10.041 -8.873 14.823 1.00 0.44 H new ATOM 0 HD12 LEU M 31 8.737 -10.082 14.752 1.00 0.44 H new ATOM 0 HD13 LEU M 31 10.194 -10.401 15.722 1.00 0.44 H new ATOM 0 HD21 LEU M 31 12.176 -9.268 13.654 1.00 22.02 H new ATOM 0 HD22 LEU M 31 12.414 -10.812 14.506 1.00 22.02 H new ATOM 0 HD23 LEU M 31 12.431 -10.766 12.727 1.00 22.02 H new ATOM 2671 N LYS M 32 7.984 -11.774 11.376 1.00 32.31 N ATOM 2672 CA LYS M 32 7.267 -10.958 10.403 1.00 30.34 C ATOM 2673 C LYS M 32 5.805 -10.791 10.805 1.00 20.33 C ATOM 2674 O LYS M 32 5.257 -9.690 10.747 1.00 33.14 O ATOM 2675 CB LYS M 32 7.356 -11.590 9.013 1.00 75.45 C ATOM 2676 CG LYS M 32 8.168 -10.772 8.023 1.00 35.52 C ATOM 2677 CD LYS M 32 7.941 -11.239 6.595 1.00 31.31 C ATOM 2678 CE LYS M 32 9.036 -12.191 6.139 1.00 4.13 C ATOM 2679 NZ LYS M 32 8.778 -12.720 4.772 1.00 72.14 N ATOM 0 H LYS M 32 8.541 -12.524 10.967 1.00 32.31 H new ATOM 0 HA LYS M 32 7.733 -9.973 10.378 1.00 30.34 H new ATOM 0 HB2 LYS M 32 7.799 -12.582 9.102 1.00 75.45 H new ATOM 0 HB3 LYS M 32 6.349 -11.725 8.620 1.00 75.45 H new ATOM 0 HG2 LYS M 32 7.897 -9.720 8.110 1.00 35.52 H new ATOM 0 HG3 LYS M 32 9.227 -10.849 8.268 1.00 35.52 H new ATOM 0 HD2 LYS M 32 6.973 -11.735 6.523 1.00 31.31 H new ATOM 0 HD3 LYS M 32 7.907 -10.376 5.930 1.00 31.31 H new ATOM 0 HE2 LYS M 32 9.995 -11.674 6.153 1.00 4.13 H new ATOM 0 HE3 LYS M 32 9.111 -13.021 6.841 1.00 4.13 H new ATOM 0 HZ1 LYS M 32 9.547 -13.365 4.498 1.00 72.14 H new ATOM 0 HZ2 LYS M 32 7.875 -13.235 4.764 1.00 72.14 H new ATOM 0 HZ3 LYS M 32 8.732 -11.930 4.097 1.00 72.14 H new ATOM 2693 N HIS M 33 5.179 -11.890 11.214 1.00 20.40 N ATOM 2694 CA HIS M 33 3.781 -11.865 11.628 1.00 54.32 C ATOM 2695 C HIS M 33 3.536 -10.755 12.646 1.00 74.10 C ATOM 2696 O HIS M 33 2.505 -10.083 12.609 1.00 15.14 O ATOM 2697 CB HIS M 33 3.377 -13.215 12.221 1.00 63.12 C ATOM 2698 CG HIS M 33 1.977 -13.242 12.750 1.00 34.43 C ATOM 2699 ND1 HIS M 33 0.878 -13.503 11.959 1.00 12.10 N ATOM 2700 CD2 HIS M 33 1.499 -13.042 14.001 1.00 53.53 C ATOM 2701 CE1 HIS M 33 -0.215 -13.459 12.699 1.00 35.44 C ATOM 2702 NE2 HIS M 33 0.134 -13.182 13.942 1.00 10.35 N ATOM 0 H HIS M 33 5.618 -12.809 11.268 1.00 20.40 H new ATOM 0 HA HIS M 33 3.171 -11.668 10.747 1.00 54.32 H new ATOM 0 HB2 HIS M 33 3.482 -13.985 11.456 1.00 63.12 H new ATOM 0 HB3 HIS M 33 4.066 -13.469 13.026 1.00 63.12 H new ATOM 0 HD2 HIS M 33 2.082 -12.815 14.881 1.00 53.53 H new ATOM 0 HE1 HIS M 33 -1.223 -13.622 12.347 1.00 35.44 H new ATOM 0 HE2 HIS M 33 -0.506 -13.087 14.730 1.00 10.35 H new ATOM 2710 N ILE M 34 4.489 -10.570 13.553 1.00 72.01 N ATOM 2711 CA ILE M 34 4.376 -9.542 14.580 1.00 31.12 C ATOM 2712 C ILE M 34 4.025 -8.190 13.969 1.00 75.13 C ATOM 2713 O ILE M 34 3.230 -7.433 14.525 1.00 15.43 O ATOM 2714 CB ILE M 34 5.682 -9.405 15.385 1.00 13.03 C ATOM 2715 CG1 ILE M 34 6.056 -10.744 16.023 1.00 23.41 C ATOM 2716 CG2 ILE M 34 5.537 -8.327 16.449 1.00 21.44 C ATOM 2717 CD1 ILE M 34 7.363 -10.707 16.784 1.00 42.11 C ATOM 0 H ILE M 34 5.348 -11.118 13.598 1.00 72.01 H new ATOM 0 HA ILE M 34 3.575 -9.853 15.251 1.00 31.12 H new ATOM 0 HB ILE M 34 6.482 -9.112 14.705 1.00 13.03 H new ATOM 0 HG12 ILE M 34 5.259 -11.049 16.701 1.00 23.41 H new ATOM 0 HG13 ILE M 34 6.120 -11.503 15.244 1.00 23.41 H new ATOM 0 HG21 ILE M 34 6.468 -8.242 17.010 1.00 21.44 H new ATOM 0 HG22 ILE M 34 5.312 -7.373 15.972 1.00 21.44 H new ATOM 0 HG23 ILE M 34 4.727 -8.593 17.128 1.00 21.44 H new ATOM 0 HD11 ILE M 34 7.564 -11.690 17.209 1.00 42.11 H new ATOM 0 HD12 ILE M 34 8.171 -10.432 16.106 1.00 42.11 H new ATOM 0 HD13 ILE M 34 7.296 -9.972 17.586 1.00 42.11 H new ATOM 2729 N VAL M 35 4.621 -7.894 12.818 1.00 2.14 N ATOM 2730 CA VAL M 35 4.369 -6.634 12.129 1.00 63.44 C ATOM 2731 C VAL M 35 2.874 -6.367 12.002 1.00 52.23 C ATOM 2732 O VAL M 35 2.420 -5.233 12.157 1.00 5.04 O ATOM 2733 CB VAL M 35 5.002 -6.627 10.724 1.00 31.23 C ATOM 2734 CG1 VAL M 35 4.835 -5.264 10.070 1.00 22.13 C ATOM 2735 CG2 VAL M 35 6.471 -7.015 10.800 1.00 32.31 C ATOM 0 H VAL M 35 5.281 -8.510 12.343 1.00 2.14 H new ATOM 0 HA VAL M 35 4.826 -5.847 12.730 1.00 63.44 H new ATOM 0 HB VAL M 35 4.487 -7.364 10.108 1.00 31.23 H new ATOM 0 HG11 VAL M 35 5.288 -5.278 9.079 1.00 22.13 H new ATOM 0 HG12 VAL M 35 3.774 -5.031 9.981 1.00 22.13 H new ATOM 0 HG13 VAL M 35 5.323 -4.505 10.681 1.00 22.13 H new ATOM 0 HG21 VAL M 35 6.902 -7.005 9.799 1.00 32.31 H new ATOM 0 HG22 VAL M 35 7.003 -6.303 11.431 1.00 32.31 H new ATOM 0 HG23 VAL M 35 6.562 -8.015 11.224 1.00 32.31 H new ATOM 2745 N TRP M 36 2.113 -7.418 11.719 1.00 54.31 N ATOM 2746 CA TRP M 36 0.667 -7.296 11.571 1.00 34.35 C ATOM 2747 C TRP M 36 0.034 -6.744 12.844 1.00 43.41 C ATOM 2748 O TRP M 36 -0.884 -5.926 12.787 1.00 22.01 O ATOM 2749 CB TRP M 36 0.052 -8.655 11.230 1.00 3.15 C ATOM 2750 CG TRP M 36 0.339 -9.101 9.829 1.00 74.24 C ATOM 2751 CD1 TRP M 36 1.390 -8.719 9.045 1.00 21.04 C ATOM 2752 CD2 TRP M 36 -0.438 -10.012 9.044 1.00 75.42 C ATOM 2753 NE1 TRP M 36 1.313 -9.338 7.821 1.00 45.21 N ATOM 2754 CE2 TRP M 36 0.201 -10.137 7.795 1.00 24.01 C ATOM 2755 CE3 TRP M 36 -1.611 -10.737 9.275 1.00 40.40 C ATOM 2756 CZ2 TRP M 36 -0.294 -10.955 6.783 1.00 33.24 C ATOM 2757 CZ3 TRP M 36 -2.102 -11.548 8.270 1.00 42.12 C ATOM 2758 CH2 TRP M 36 -1.444 -11.653 7.037 1.00 10.30 C ATOM 0 H TRP M 36 2.473 -8.363 11.587 1.00 54.31 H new ATOM 0 HA TRP M 36 0.468 -6.600 10.756 1.00 34.35 H new ATOM 0 HB2 TRP M 36 0.431 -9.403 11.927 1.00 3.15 H new ATOM 0 HB3 TRP M 36 -1.027 -8.604 11.374 1.00 3.15 H new ATOM 0 HD1 TRP M 36 2.167 -8.031 9.343 1.00 21.04 H new ATOM 0 HE1 TRP M 36 1.977 -9.221 7.055 1.00 45.21 H new ATOM 0 HE3 TRP M 36 -2.124 -10.664 10.222 1.00 40.40 H new ATOM 0 HZ2 TRP M 36 0.211 -11.036 5.832 1.00 33.24 H new ATOM 0 HZ3 TRP M 36 -3.008 -12.111 8.437 1.00 42.12 H new ATOM 0 HH2 TRP M 36 -1.852 -12.297 6.272 1.00 10.30 H new ATOM 2769 N ALA M 37 0.531 -7.195 13.991 1.00 43.21 N ATOM 2770 CA ALA M 37 0.016 -6.743 15.277 1.00 13.02 C ATOM 2771 C ALA M 37 0.261 -5.251 15.473 1.00 13.34 C ATOM 2772 O ALA M 37 -0.379 -4.612 16.309 1.00 43.52 O ATOM 2773 CB ALA M 37 0.651 -7.537 16.409 1.00 71.31 C ATOM 0 H ALA M 37 1.290 -7.873 14.056 1.00 43.21 H new ATOM 0 HA ALA M 37 -1.061 -6.912 15.289 1.00 13.02 H new ATOM 0 HB1 ALA M 37 0.257 -7.188 17.364 1.00 71.31 H new ATOM 0 HB2 ALA M 37 0.420 -8.595 16.286 1.00 71.31 H new ATOM 0 HB3 ALA M 37 1.732 -7.397 16.390 1.00 71.31 H new ATOM 2779 N SER M 38 1.191 -4.701 14.699 1.00 73.53 N ATOM 2780 CA SER M 38 1.523 -3.285 14.791 1.00 43.32 C ATOM 2781 C SER M 38 0.390 -2.424 14.240 1.00 4.22 C ATOM 2782 O SER M 38 0.317 -1.226 14.515 1.00 53.05 O ATOM 2783 CB SER M 38 2.818 -2.992 14.029 1.00 34.42 C ATOM 2784 OG SER M 38 3.727 -4.074 14.134 1.00 34.44 O ATOM 0 H SER M 38 1.728 -5.215 14.001 1.00 73.53 H new ATOM 0 HA SER M 38 1.665 -3.038 15.843 1.00 43.32 H new ATOM 0 HB2 SER M 38 2.592 -2.804 12.980 1.00 34.42 H new ATOM 0 HB3 SER M 38 3.279 -2.086 14.423 1.00 34.42 H new ATOM 0 HG SER M 38 4.545 -3.863 13.638 1.00 34.44 H new ATOM 2790 N ARG M 39 -0.491 -3.044 13.462 1.00 44.43 N ATOM 2791 CA ARG M 39 -1.619 -2.335 12.871 1.00 74.12 C ATOM 2792 C ARG M 39 -2.418 -1.596 13.941 1.00 61.32 C ATOM 2793 O ARG M 39 -3.040 -0.571 13.666 1.00 10.34 O ATOM 2794 CB ARG M 39 -2.529 -3.313 12.125 1.00 60.20 C ATOM 2795 CG ARG M 39 -2.086 -3.590 10.698 1.00 43.44 C ATOM 2796 CD ARG M 39 -3.218 -4.172 9.866 1.00 44.45 C ATOM 2797 NE ARG M 39 -4.226 -3.168 9.536 1.00 73.24 N ATOM 2798 CZ ARG M 39 -5.287 -3.415 8.776 1.00 75.12 C ATOM 2799 NH1 ARG M 39 -5.478 -4.626 8.270 1.00 22.04 N ATOM 2800 NH2 ARG M 39 -6.161 -2.450 8.521 1.00 53.25 N ATOM 0 H ARG M 39 -0.445 -4.035 13.226 1.00 44.43 H new ATOM 0 HA ARG M 39 -1.226 -1.603 12.165 1.00 74.12 H new ATOM 0 HB2 ARG M 39 -2.565 -4.254 12.674 1.00 60.20 H new ATOM 0 HB3 ARG M 39 -3.543 -2.914 12.111 1.00 60.20 H new ATOM 0 HG2 ARG M 39 -1.734 -2.666 10.239 1.00 43.44 H new ATOM 0 HG3 ARG M 39 -1.245 -4.283 10.705 1.00 43.44 H new ATOM 0 HD2 ARG M 39 -2.812 -4.594 8.947 1.00 44.45 H new ATOM 0 HD3 ARG M 39 -3.687 -4.990 10.413 1.00 44.45 H new ATOM 0 HE ARG M 39 -4.109 -2.226 9.909 1.00 73.24 H new ATOM 0 HH11 ARG M 39 -4.809 -5.371 8.464 1.00 22.04 H new ATOM 0 HH12 ARG M 39 -6.294 -4.812 7.687 1.00 22.04 H new ATOM 0 HH21 ARG M 39 -6.019 -1.517 8.909 1.00 53.25 H new ATOM 0 HH22 ARG M 39 -6.975 -2.641 7.937 1.00 53.25 H new ATOM 2814 N GLU M 40 -2.395 -2.126 15.160 1.00 13.30 N ATOM 2815 CA GLU M 40 -3.119 -1.517 16.270 1.00 4.31 C ATOM 2816 C GLU M 40 -2.276 -0.436 16.941 1.00 42.10 C ATOM 2817 O GLU M 40 -2.750 0.674 17.188 1.00 74.33 O ATOM 2818 CB GLU M 40 -3.513 -2.581 17.296 1.00 72.21 C ATOM 2819 CG GLU M 40 -4.403 -2.054 18.409 1.00 52.32 C ATOM 2820 CD GLU M 40 -5.599 -1.284 17.884 1.00 54.23 C ATOM 2821 OE1 GLU M 40 -6.403 -1.875 17.132 1.00 2.43 O ATOM 2822 OE2 GLU M 40 -5.732 -0.090 18.225 1.00 3.40 O ATOM 0 H GLU M 40 -1.884 -2.974 15.404 1.00 13.30 H new ATOM 0 HA GLU M 40 -4.022 -1.055 15.871 1.00 4.31 H new ATOM 0 HB2 GLU M 40 -4.028 -3.394 16.784 1.00 72.21 H new ATOM 0 HB3 GLU M 40 -2.609 -3.003 17.735 1.00 72.21 H new ATOM 0 HG2 GLU M 40 -4.751 -2.889 19.017 1.00 52.32 H new ATOM 0 HG3 GLU M 40 -3.817 -1.407 19.062 1.00 52.32 H new ATOM 2829 N LEU M 41 -1.023 -0.768 17.234 1.00 14.23 N ATOM 2830 CA LEU M 41 -0.113 0.173 17.877 1.00 0.43 C ATOM 2831 C LEU M 41 0.169 1.366 16.969 1.00 75.23 C ATOM 2832 O LEU M 41 0.370 1.207 15.765 1.00 30.23 O ATOM 2833 CB LEU M 41 1.198 -0.524 18.243 1.00 22.24 C ATOM 2834 CG LEU M 41 1.282 -1.096 19.659 1.00 73.20 C ATOM 2835 CD1 LEU M 41 2.609 -1.808 19.870 1.00 42.52 C ATOM 2836 CD2 LEU M 41 1.095 0.006 20.691 1.00 3.15 C ATOM 0 H LEU M 41 -0.615 -1.682 17.036 1.00 14.23 H new ATOM 0 HA LEU M 41 -0.590 0.537 18.787 1.00 0.43 H new ATOM 0 HB2 LEU M 41 1.365 -1.335 17.535 1.00 22.24 H new ATOM 0 HB3 LEU M 41 2.013 0.187 18.111 1.00 22.24 H new ATOM 0 HG LEU M 41 0.480 -1.823 19.784 1.00 73.20 H new ATOM 0 HD11 LEU M 41 2.650 -2.208 20.883 1.00 42.52 H new ATOM 0 HD12 LEU M 41 2.702 -2.624 19.153 1.00 42.52 H new ATOM 0 HD13 LEU M 41 3.427 -1.103 19.725 1.00 42.52 H new ATOM 0 HD21 LEU M 41 1.158 -0.419 21.693 1.00 3.15 H new ATOM 0 HD22 LEU M 41 1.875 0.757 20.566 1.00 3.15 H new ATOM 0 HD23 LEU M 41 0.118 0.470 20.555 1.00 3.15 H new