USER MOD reduce.3.24.130724 H: found=0, std=0, add=891, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 893 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 115 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 118 CYS SG : rot -22:sc= 0.446 USER MOD Set 1.3: A 119 GLN : amide:sc= -1.68! X(o=-1.2!,f=-1.7) USER MOD Set 2.1: A 39 SER OG : rot 96:sc= 0.964 USER MOD Set 2.2: A 53 CYS SG : rot 140:sc= -0.582 USER MOD Set 2.3: A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot -45:sc= -0.567 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0534) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 HIS :FLIP no HD1:sc= -3.49! C(o=-5.1!,f=-3.5!) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -157:sc= 0.0148 (180deg=-0.602) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 53:sc= 0.474 USER MOD Single : A 50 CYS SG : rot 180:sc= -0.089 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 HIS : no HD1:sc= -0.204 X(o=-0.2,f=-0.0075) USER MOD Single : A 68 THR OG1 : rot -99:sc= 0.00076 USER MOD Single : A 71 CYS SG : rot 156:sc= 0.528 USER MOD Single : A 76 CYS SG : rot 180:sc= -0.873 USER MOD Single : A 77 GLN : amide:sc= 0.137 K(o=0.14,f=-3.1!) USER MOD Single : A 81 LYS NZ :NH3+ -165:sc=-0.00948 (180deg=-0.174) USER MOD Single : A 83 TYR OH : rot 30:sc= 0 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 ASN : amide:sc= -2.62! C(o=-2.6!,f=-5.2!) USER MOD Single : A 93 GLN : amide:sc= 0.137 K(o=0.14,f=-0.47) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ 155:sc= -0.735 (180deg=-1.71!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -33:sc= -1.42 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 160:sc= 0 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 LYS NZ :NH3+ -138:sc= -4.38! (180deg=-9.25!) USER MOD Single : A 117 CYS SG : rot 58:sc= -0.99 USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl 124:sc= -0.205 (180deg=-0.951) USER MOD Single : A 128 SER OG : rot 88:sc= 1.21 USER MOD ----------------------------------------------------------------- ATOM 102 N THR A 10 0.221 4.764 7.065 1.00 0.00 N ATOM 103 CA THR A 10 -0.384 3.810 7.986 1.00 0.00 C ATOM 104 C THR A 10 -0.526 2.436 7.341 1.00 0.00 C ATOM 105 O THR A 10 -1.155 2.294 6.292 1.00 0.00 O ATOM 106 CB THR A 10 -1.770 4.288 8.459 1.00 0.00 C ATOM 107 OG1 THR A 10 -2.542 4.736 7.339 1.00 0.00 O ATOM 108 CG2 THR A 10 -1.637 5.415 9.473 1.00 0.00 C ATOM 0 HA THR A 10 0.281 3.737 8.847 1.00 0.00 H new ATOM 0 HB THR A 10 -2.276 3.449 8.936 1.00 0.00 H new ATOM 0 HG1 THR A 10 -1.984 5.296 6.760 1.00 0.00 H new ATOM 0 HG21 THR A 10 -2.629 5.736 9.792 1.00 0.00 H new ATOM 0 HG22 THR A 10 -1.074 5.062 10.337 1.00 0.00 H new ATOM 0 HG23 THR A 10 -1.113 6.255 9.017 1.00 0.00 H new ATOM 116 N PHE A 11 0.061 1.427 7.974 1.00 0.00 N ATOM 117 CA PHE A 11 0.000 0.063 7.461 1.00 0.00 C ATOM 118 C PHE A 11 -0.607 -0.881 8.495 1.00 0.00 C ATOM 119 O PHE A 11 -0.107 -0.996 9.614 1.00 0.00 O ATOM 120 CB PHE A 11 1.398 -0.421 7.071 1.00 0.00 C ATOM 121 CG PHE A 11 2.142 -1.076 8.199 1.00 0.00 C ATOM 122 CD1 PHE A 11 2.944 -0.327 9.045 1.00 0.00 C ATOM 123 CD2 PHE A 11 2.039 -2.441 8.414 1.00 0.00 C ATOM 124 CE1 PHE A 11 3.631 -0.928 10.083 1.00 0.00 C ATOM 125 CE2 PHE A 11 2.723 -3.048 9.451 1.00 0.00 C ATOM 126 CZ PHE A 11 3.519 -2.290 10.287 1.00 0.00 C ATOM 0 H PHE A 11 0.585 1.527 8.843 1.00 0.00 H new ATOM 0 HA PHE A 11 -0.637 0.063 6.577 1.00 0.00 H new ATOM 0 HB2 PHE A 11 1.312 -1.127 6.245 1.00 0.00 H new ATOM 0 HB3 PHE A 11 1.979 0.427 6.707 1.00 0.00 H new ATOM 0 HD1 PHE A 11 3.033 0.738 8.892 1.00 0.00 H new ATOM 0 HD2 PHE A 11 1.417 -3.038 7.764 1.00 0.00 H new ATOM 0 HE1 PHE A 11 4.255 -0.334 10.734 1.00 0.00 H new ATOM 0 HE2 PHE A 11 2.635 -4.113 9.607 1.00 0.00 H new ATOM 0 HZ PHE A 11 4.053 -2.761 11.099 1.00 0.00 H new ATOM 136 N GLU A 12 -1.688 -1.553 8.112 1.00 0.00 N ATOM 137 CA GLU A 12 -2.364 -2.485 9.006 1.00 0.00 C ATOM 138 C GLU A 12 -2.142 -3.927 8.558 1.00 0.00 C ATOM 139 O GLU A 12 -2.378 -4.271 7.401 1.00 0.00 O ATOM 140 CB GLU A 12 -3.863 -2.181 9.059 1.00 0.00 C ATOM 141 CG GLU A 12 -4.626 -3.051 10.043 1.00 0.00 C ATOM 142 CD GLU A 12 -4.446 -2.602 11.480 1.00 0.00 C ATOM 143 OE1 GLU A 12 -3.365 -2.068 11.804 1.00 0.00 O ATOM 144 OE2 GLU A 12 -5.388 -2.785 12.280 1.00 0.00 O ATOM 0 H GLU A 12 -2.114 -1.469 7.189 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.941 -2.363 10.003 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -4.004 -1.134 9.328 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.288 -2.314 8.064 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -5.686 -3.034 9.791 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.292 -4.084 9.944 1.00 0.00 H new ATOM 151 N GLU A 13 -1.685 -4.765 9.484 1.00 0.00 N ATOM 152 CA GLU A 13 -1.430 -6.169 9.184 1.00 0.00 C ATOM 153 C GLU A 13 -2.672 -7.016 9.446 1.00 0.00 C ATOM 154 O GLU A 13 -3.182 -7.060 10.565 1.00 0.00 O ATOM 155 CB GLU A 13 -0.259 -6.687 10.022 1.00 0.00 C ATOM 156 CG GLU A 13 0.538 -7.786 9.339 1.00 0.00 C ATOM 157 CD GLU A 13 1.217 -8.714 10.327 1.00 0.00 C ATOM 158 OE1 GLU A 13 1.997 -8.220 11.167 1.00 0.00 O ATOM 159 OE2 GLU A 13 0.968 -9.936 10.260 1.00 0.00 O ATOM 0 H GLU A 13 -1.484 -4.496 10.447 1.00 0.00 H new ATOM 0 HA GLU A 13 -1.175 -6.248 8.127 1.00 0.00 H new ATOM 0 HB2 GLU A 13 0.408 -5.856 10.253 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -0.641 -7.063 10.971 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -0.126 -8.366 8.698 1.00 0.00 H new ATOM 0 HG3 GLU A 13 1.291 -7.335 8.693 1.00 0.00 H new ATOM 166 N VAL A 14 -3.153 -7.687 8.405 1.00 0.00 N ATOM 167 CA VAL A 14 -4.335 -8.534 8.521 1.00 0.00 C ATOM 168 C VAL A 14 -4.008 -9.983 8.180 1.00 0.00 C ATOM 169 O VAL A 14 -3.048 -10.261 7.460 1.00 0.00 O ATOM 170 CB VAL A 14 -5.468 -8.044 7.600 1.00 0.00 C ATOM 171 CG1 VAL A 14 -6.686 -8.946 7.727 1.00 0.00 C ATOM 172 CG2 VAL A 14 -5.828 -6.601 7.920 1.00 0.00 C ATOM 0 H VAL A 14 -2.743 -7.661 7.471 1.00 0.00 H new ATOM 0 HA VAL A 14 -4.668 -8.474 9.557 1.00 0.00 H new ATOM 0 HB VAL A 14 -5.119 -8.087 6.568 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.477 -8.585 7.069 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.416 -9.964 7.445 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -7.040 -8.937 8.758 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -6.630 -6.271 7.260 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -6.158 -6.530 8.956 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -4.954 -5.967 7.774 1.00 0.00 H new ATOM 182 N SER A 15 -4.813 -10.904 8.701 1.00 0.00 N ATOM 183 CA SER A 15 -4.607 -12.326 8.454 1.00 0.00 C ATOM 184 C SER A 15 -5.913 -13.000 8.041 1.00 0.00 C ATOM 185 O SER A 15 -6.890 -12.996 8.789 1.00 0.00 O ATOM 186 CB SER A 15 -4.043 -13.006 9.703 1.00 0.00 C ATOM 187 OG SER A 15 -3.877 -14.398 9.496 1.00 0.00 O ATOM 0 H SER A 15 -5.613 -10.691 9.296 1.00 0.00 H new ATOM 0 HA SER A 15 -3.891 -12.428 7.639 1.00 0.00 H new ATOM 0 HB2 SER A 15 -3.084 -12.557 9.963 1.00 0.00 H new ATOM 0 HB3 SER A 15 -4.713 -12.838 10.546 1.00 0.00 H new ATOM 0 HG SER A 15 -3.514 -14.809 10.308 1.00 0.00 H new ATOM 193 N VAL A 16 -5.920 -13.578 6.844 1.00 0.00 N ATOM 194 CA VAL A 16 -7.103 -14.257 6.330 1.00 0.00 C ATOM 195 C VAL A 16 -6.740 -15.603 5.713 1.00 0.00 C ATOM 196 O VAL A 16 -5.604 -15.817 5.287 1.00 0.00 O ATOM 197 CB VAL A 16 -7.829 -13.400 5.276 1.00 0.00 C ATOM 198 CG1 VAL A 16 -8.445 -12.169 5.922 1.00 0.00 C ATOM 199 CG2 VAL A 16 -6.872 -13.006 4.161 1.00 0.00 C ATOM 0 H VAL A 16 -5.119 -13.589 6.212 1.00 0.00 H new ATOM 0 HA VAL A 16 -7.769 -14.417 7.178 1.00 0.00 H new ATOM 0 HB VAL A 16 -8.634 -13.993 4.841 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -8.954 -11.575 5.162 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -9.163 -12.478 6.682 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -7.661 -11.570 6.385 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -7.401 -12.401 3.425 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -6.045 -12.430 4.577 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -6.483 -13.904 3.681 1.00 0.00 H new ATOM 209 N LEU A 17 -7.711 -16.508 5.667 1.00 0.00 N ATOM 210 CA LEU A 17 -7.495 -17.835 5.100 1.00 0.00 C ATOM 211 C LEU A 17 -8.627 -18.213 4.151 1.00 0.00 C ATOM 212 O LEU A 17 -9.779 -18.344 4.563 1.00 0.00 O ATOM 213 CB LEU A 17 -7.380 -18.875 6.216 1.00 0.00 C ATOM 214 CG LEU A 17 -6.599 -20.144 5.873 1.00 0.00 C ATOM 215 CD1 LEU A 17 -6.139 -20.846 7.141 1.00 0.00 C ATOM 216 CD2 LEU A 17 -7.447 -21.078 5.021 1.00 0.00 C ATOM 0 H LEU A 17 -8.656 -16.347 6.016 1.00 0.00 H new ATOM 0 HA LEU A 17 -6.564 -17.814 4.534 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -6.907 -18.403 7.078 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -8.386 -19.163 6.522 1.00 0.00 H new ATOM 0 HG LEU A 17 -5.717 -19.861 5.298 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -5.585 -21.747 6.878 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -5.495 -20.178 7.713 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -7.007 -21.117 7.742 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.875 -21.976 4.786 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -8.347 -21.354 5.570 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -7.726 -20.574 4.096 1.00 0.00 H new ATOM 228 N GLY A 18 -8.290 -18.389 2.877 1.00 0.00 N ATOM 229 CA GLY A 18 -9.289 -18.753 1.889 1.00 0.00 C ATOM 230 C GLY A 18 -9.679 -17.587 1.002 1.00 0.00 C ATOM 231 O GLY A 18 -9.069 -16.519 1.065 1.00 0.00 O ATOM 0 H GLY A 18 -7.343 -18.286 2.511 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.905 -19.564 1.270 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -10.176 -19.132 2.396 1.00 0.00 H new ATOM 235 N PHE A 19 -10.696 -17.792 0.171 1.00 0.00 N ATOM 236 CA PHE A 19 -11.164 -16.749 -0.735 1.00 0.00 C ATOM 237 C PHE A 19 -12.225 -15.882 -0.064 1.00 0.00 C ATOM 238 O PHE A 19 -12.089 -14.661 0.007 1.00 0.00 O ATOM 239 CB PHE A 19 -11.731 -17.372 -2.012 1.00 0.00 C ATOM 240 CG PHE A 19 -11.774 -16.421 -3.175 1.00 0.00 C ATOM 241 CD1 PHE A 19 -12.683 -15.376 -3.198 1.00 0.00 C ATOM 242 CD2 PHE A 19 -10.905 -16.573 -4.243 1.00 0.00 C ATOM 243 CE1 PHE A 19 -12.725 -14.500 -4.267 1.00 0.00 C ATOM 244 CE2 PHE A 19 -10.942 -15.701 -5.314 1.00 0.00 C ATOM 245 CZ PHE A 19 -11.853 -14.662 -5.326 1.00 0.00 C ATOM 0 H PHE A 19 -11.211 -18.670 0.106 1.00 0.00 H new ATOM 0 HA PHE A 19 -10.314 -16.117 -0.993 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -11.127 -18.238 -2.283 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -12.739 -17.736 -1.813 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -13.366 -15.244 -2.372 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -10.190 -17.383 -4.238 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -13.439 -13.690 -4.274 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -10.260 -15.831 -6.141 1.00 0.00 H new ATOM 0 HZ PHE A 19 -11.883 -13.978 -6.161 1.00 0.00 H new ATOM 255 N GLU A 20 -13.282 -16.523 0.426 1.00 0.00 N ATOM 256 CA GLU A 20 -14.366 -15.809 1.090 1.00 0.00 C ATOM 257 C GLU A 20 -13.819 -14.801 2.096 1.00 0.00 C ATOM 258 O GLU A 20 -14.015 -13.595 1.951 1.00 0.00 O ATOM 259 CB GLU A 20 -15.299 -16.796 1.796 1.00 0.00 C ATOM 260 CG GLU A 20 -15.969 -17.782 0.853 1.00 0.00 C ATOM 261 CD GLU A 20 -17.263 -17.246 0.273 1.00 0.00 C ATOM 262 OE1 GLU A 20 -17.255 -16.115 -0.255 1.00 0.00 O ATOM 263 OE2 GLU A 20 -18.286 -17.959 0.348 1.00 0.00 O ATOM 0 H GLU A 20 -13.410 -17.534 0.376 1.00 0.00 H new ATOM 0 HA GLU A 20 -14.929 -15.268 0.330 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -14.730 -17.350 2.543 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -16.068 -16.238 2.330 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -15.284 -18.025 0.041 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -16.172 -18.710 1.387 1.00 0.00 H new ATOM 270 N GLU A 21 -13.132 -15.306 3.117 1.00 0.00 N ATOM 271 CA GLU A 21 -12.558 -14.449 4.148 1.00 0.00 C ATOM 272 C GLU A 21 -11.701 -13.349 3.527 1.00 0.00 C ATOM 273 O GLU A 21 -11.785 -12.185 3.919 1.00 0.00 O ATOM 274 CB GLU A 21 -11.716 -15.278 5.120 1.00 0.00 C ATOM 275 CG GLU A 21 -12.544 -16.076 6.114 1.00 0.00 C ATOM 276 CD GLU A 21 -11.734 -16.540 7.309 1.00 0.00 C ATOM 277 OE1 GLU A 21 -11.339 -15.683 8.127 1.00 0.00 O ATOM 278 OE2 GLU A 21 -11.495 -17.760 7.426 1.00 0.00 O ATOM 0 H GLU A 21 -12.960 -16.302 3.252 1.00 0.00 H new ATOM 0 HA GLU A 21 -13.378 -13.982 4.694 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -11.088 -15.963 4.551 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -11.048 -14.613 5.667 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -13.378 -15.465 6.460 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -12.972 -16.943 5.611 1.00 0.00 H new ATOM 285 N PHE A 22 -10.877 -13.727 2.556 1.00 0.00 N ATOM 286 CA PHE A 22 -10.003 -12.775 1.881 1.00 0.00 C ATOM 287 C PHE A 22 -10.808 -11.618 1.295 1.00 0.00 C ATOM 288 O PHE A 22 -10.682 -10.475 1.733 1.00 0.00 O ATOM 289 CB PHE A 22 -9.212 -13.473 0.772 1.00 0.00 C ATOM 290 CG PHE A 22 -8.629 -12.524 -0.236 1.00 0.00 C ATOM 291 CD1 PHE A 22 -8.022 -11.347 0.171 1.00 0.00 C ATOM 292 CD2 PHE A 22 -8.687 -12.811 -1.590 1.00 0.00 C ATOM 293 CE1 PHE A 22 -7.485 -10.473 -0.755 1.00 0.00 C ATOM 294 CE2 PHE A 22 -8.152 -11.940 -2.521 1.00 0.00 C ATOM 295 CZ PHE A 22 -7.549 -10.770 -2.103 1.00 0.00 C ATOM 0 H PHE A 22 -10.796 -14.686 2.219 1.00 0.00 H new ATOM 0 HA PHE A 22 -9.307 -12.374 2.618 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -8.406 -14.053 1.221 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -9.866 -14.179 0.259 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -7.968 -11.110 1.223 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -9.156 -13.726 -1.922 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -7.015 -9.558 -0.425 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -8.206 -12.174 -3.574 1.00 0.00 H new ATOM 0 HZ PHE A 22 -7.128 -10.089 -2.828 1.00 0.00 H new ATOM 305 N ASP A 23 -11.636 -11.925 0.302 1.00 0.00 N ATOM 306 CA ASP A 23 -12.463 -10.913 -0.344 1.00 0.00 C ATOM 307 C ASP A 23 -13.100 -9.990 0.690 1.00 0.00 C ATOM 308 O ASP A 23 -13.015 -8.766 0.583 1.00 0.00 O ATOM 309 CB ASP A 23 -13.550 -11.576 -1.192 1.00 0.00 C ATOM 310 CG ASP A 23 -13.996 -10.703 -2.348 1.00 0.00 C ATOM 311 OD1 ASP A 23 -13.192 -9.860 -2.800 1.00 0.00 O ATOM 312 OD2 ASP A 23 -15.148 -10.863 -2.802 1.00 0.00 O ATOM 0 H ASP A 23 -11.752 -12.867 -0.073 1.00 0.00 H new ATOM 0 HA ASP A 23 -11.822 -10.316 -0.992 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -13.177 -12.524 -1.579 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -14.409 -11.806 -0.561 1.00 0.00 H new ATOM 317 N LYS A 24 -13.739 -10.584 1.692 1.00 0.00 N ATOM 318 CA LYS A 24 -14.390 -9.817 2.747 1.00 0.00 C ATOM 319 C LYS A 24 -13.450 -8.756 3.309 1.00 0.00 C ATOM 320 O LYS A 24 -13.789 -7.573 3.354 1.00 0.00 O ATOM 321 CB LYS A 24 -14.855 -10.747 3.870 1.00 0.00 C ATOM 322 CG LYS A 24 -15.722 -10.060 4.910 1.00 0.00 C ATOM 323 CD LYS A 24 -17.194 -10.115 4.534 1.00 0.00 C ATOM 324 CE LYS A 24 -17.865 -11.361 5.092 1.00 0.00 C ATOM 325 NZ LYS A 24 -18.106 -11.251 6.558 1.00 0.00 N ATOM 0 H LYS A 24 -13.820 -11.596 1.796 1.00 0.00 H new ATOM 0 HA LYS A 24 -15.257 -9.317 2.315 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.412 -11.577 3.435 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -13.981 -11.173 4.362 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -15.575 -10.536 5.879 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -15.411 -9.021 5.015 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -17.701 -9.227 4.912 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -17.294 -10.101 3.449 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -18.813 -11.524 4.579 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -17.240 -12.231 4.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -18.739 -12.018 6.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -17.201 -11.325 7.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -18.547 -10.333 6.769 1.00 0.00 H new ATOM 339 N ALA A 25 -12.266 -9.185 3.734 1.00 0.00 N ATOM 340 CA ALA A 25 -11.276 -8.271 4.288 1.00 0.00 C ATOM 341 C ALA A 25 -10.953 -7.150 3.307 1.00 0.00 C ATOM 342 O ALA A 25 -10.773 -5.998 3.702 1.00 0.00 O ATOM 343 CB ALA A 25 -10.010 -9.028 4.662 1.00 0.00 C ATOM 0 H ALA A 25 -11.970 -10.161 3.705 1.00 0.00 H new ATOM 0 HA ALA A 25 -11.697 -7.821 5.187 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -9.279 -8.333 5.075 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.247 -9.789 5.406 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -9.596 -9.505 3.774 1.00 0.00 H new ATOM 349 N VAL A 26 -10.881 -7.494 2.025 1.00 0.00 N ATOM 350 CA VAL A 26 -10.580 -6.516 0.986 1.00 0.00 C ATOM 351 C VAL A 26 -11.724 -5.522 0.820 1.00 0.00 C ATOM 352 O VAL A 26 -11.572 -4.331 1.095 1.00 0.00 O ATOM 353 CB VAL A 26 -10.308 -7.199 -0.367 1.00 0.00 C ATOM 354 CG1 VAL A 26 -10.041 -6.161 -1.446 1.00 0.00 C ATOM 355 CG2 VAL A 26 -9.142 -8.169 -0.248 1.00 0.00 C ATOM 0 H VAL A 26 -11.027 -8.443 1.681 1.00 0.00 H new ATOM 0 HA VAL A 26 -9.683 -5.984 1.302 1.00 0.00 H new ATOM 0 HB VAL A 26 -11.194 -7.765 -0.654 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -9.851 -6.663 -2.395 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -10.909 -5.510 -1.547 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -9.171 -5.565 -1.170 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -8.963 -8.643 -1.213 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.248 -7.627 0.061 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.378 -8.933 0.493 1.00 0.00 H new ATOM 365 N LYS A 27 -12.871 -6.018 0.369 1.00 0.00 N ATOM 366 CA LYS A 27 -14.044 -5.175 0.167 1.00 0.00 C ATOM 367 C LYS A 27 -14.287 -4.282 1.379 1.00 0.00 C ATOM 368 O LYS A 27 -14.963 -3.259 1.281 1.00 0.00 O ATOM 369 CB LYS A 27 -15.279 -6.039 -0.099 1.00 0.00 C ATOM 370 CG LYS A 27 -15.255 -6.735 -1.450 1.00 0.00 C ATOM 371 CD LYS A 27 -15.435 -5.746 -2.589 1.00 0.00 C ATOM 372 CE LYS A 27 -15.160 -6.394 -3.938 1.00 0.00 C ATOM 373 NZ LYS A 27 -15.349 -5.436 -5.062 1.00 0.00 N ATOM 0 H LYS A 27 -13.014 -7.001 0.136 1.00 0.00 H new ATOM 0 HA LYS A 27 -13.859 -4.540 -0.699 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -15.362 -6.791 0.686 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -16.170 -5.414 -0.038 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -14.309 -7.263 -1.572 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -16.046 -7.484 -1.489 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -16.451 -5.352 -2.574 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -14.763 -4.899 -2.447 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -14.140 -6.778 -3.955 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -15.824 -7.248 -4.073 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -15.152 -5.916 -5.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -16.329 -5.089 -5.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -14.698 -4.633 -4.947 1.00 0.00 H new ATOM 387 N GLU A 28 -13.730 -4.676 2.520 1.00 0.00 N ATOM 388 CA GLU A 28 -13.887 -3.909 3.750 1.00 0.00 C ATOM 389 C GLU A 28 -12.911 -2.737 3.790 1.00 0.00 C ATOM 390 O GLU A 28 -13.248 -1.649 4.256 1.00 0.00 O ATOM 391 CB GLU A 28 -13.671 -4.809 4.969 1.00 0.00 C ATOM 392 CG GLU A 28 -14.934 -5.508 5.442 1.00 0.00 C ATOM 393 CD GLU A 28 -15.951 -4.545 6.023 1.00 0.00 C ATOM 394 OE1 GLU A 28 -16.746 -3.978 5.243 1.00 0.00 O ATOM 395 OE2 GLU A 28 -15.953 -4.358 7.258 1.00 0.00 O ATOM 0 H GLU A 28 -13.167 -5.521 2.618 1.00 0.00 H new ATOM 0 HA GLU A 28 -14.902 -3.514 3.774 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -12.919 -5.560 4.727 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -13.270 -4.209 5.786 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -15.383 -6.044 4.606 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -14.673 -6.252 6.194 1.00 0.00 H new ATOM 402 N HIS A 29 -11.698 -2.969 3.297 1.00 0.00 N ATOM 403 CA HIS A 29 -10.671 -1.933 3.275 1.00 0.00 C ATOM 404 C HIS A 29 -10.593 -1.274 1.902 1.00 0.00 C ATOM 405 O HIS A 29 -9.656 -0.531 1.612 1.00 0.00 O ATOM 406 CB HIS A 29 -9.311 -2.525 3.648 1.00 0.00 C ATOM 407 CG HIS A 29 -9.329 -3.309 4.924 1.00 0.00 C ATOM 408 ND1 HIS A 29 -8.985 -4.593 5.178 1.00 0.00 N flip ATOM 409 CD2 HIS A 29 -9.738 -2.777 6.128 1.00 0.00 C flip ATOM 410 CE1 HIS A 29 -9.190 -4.812 6.518 1.00 0.00 C flip ATOM 411 NE2 HIS A 29 -9.644 -3.700 7.069 1.00 0.00 N flip ATOM 0 H HIS A 29 -11.403 -3.864 2.908 1.00 0.00 H new ATOM 0 HA HIS A 29 -10.941 -1.173 4.008 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -8.971 -3.171 2.839 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -8.585 -1.717 3.738 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -10.082 -1.764 6.279 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -9.010 -5.742 7.037 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -9.881 -3.575 8.053 1.00 0.00 H new ATOM 420 N GLU A 30 -11.584 -1.552 1.060 1.00 0.00 N ATOM 421 CA GLU A 30 -11.626 -0.986 -0.283 1.00 0.00 C ATOM 422 C GLU A 30 -11.385 0.520 -0.248 1.00 0.00 C ATOM 423 O GLU A 30 -10.651 1.062 -1.073 1.00 0.00 O ATOM 424 CB GLU A 30 -12.974 -1.283 -0.944 1.00 0.00 C ATOM 425 CG GLU A 30 -14.151 -0.615 -0.253 1.00 0.00 C ATOM 426 CD GLU A 30 -15.483 -1.003 -0.864 1.00 0.00 C ATOM 427 OE1 GLU A 30 -15.532 -1.219 -2.093 1.00 0.00 O ATOM 428 OE2 GLU A 30 -16.477 -1.090 -0.113 1.00 0.00 O ATOM 0 H GLU A 30 -12.368 -2.165 1.284 1.00 0.00 H new ATOM 0 HA GLU A 30 -10.832 -1.449 -0.869 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -12.940 -0.955 -1.983 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -13.134 -2.361 -0.955 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -14.148 -0.884 0.803 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -14.032 0.467 -0.307 1.00 0.00 H new ATOM 435 N SER A 31 -12.011 1.191 0.715 1.00 0.00 N ATOM 436 CA SER A 31 -11.869 2.635 0.857 1.00 0.00 C ATOM 437 C SER A 31 -10.413 3.057 0.684 1.00 0.00 C ATOM 438 O SER A 31 -10.125 4.152 0.199 1.00 0.00 O ATOM 439 CB SER A 31 -12.384 3.087 2.224 1.00 0.00 C ATOM 440 OG SER A 31 -13.693 2.599 2.463 1.00 0.00 O ATOM 0 H SER A 31 -12.621 0.757 1.408 1.00 0.00 H new ATOM 0 HA SER A 31 -12.463 3.112 0.077 1.00 0.00 H new ATOM 0 HB2 SER A 31 -11.712 2.732 3.005 1.00 0.00 H new ATOM 0 HB3 SER A 31 -12.384 4.176 2.274 1.00 0.00 H new ATOM 0 HG SER A 31 -13.999 2.900 3.344 1.00 0.00 H new ATOM 446 N LYS A 32 -9.498 2.181 1.085 1.00 0.00 N ATOM 447 CA LYS A 32 -8.071 2.460 0.975 1.00 0.00 C ATOM 448 C LYS A 32 -7.348 1.323 0.260 1.00 0.00 C ATOM 449 O LYS A 32 -7.898 0.235 0.088 1.00 0.00 O ATOM 450 CB LYS A 32 -7.463 2.673 2.363 1.00 0.00 C ATOM 451 CG LYS A 32 -8.356 3.464 3.303 1.00 0.00 C ATOM 452 CD LYS A 32 -8.132 3.065 4.752 1.00 0.00 C ATOM 453 CE LYS A 32 -7.019 3.883 5.390 1.00 0.00 C ATOM 454 NZ LYS A 32 -5.682 3.263 5.175 1.00 0.00 N ATOM 0 H LYS A 32 -9.719 1.271 1.489 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.948 3.371 0.388 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -7.249 1.702 2.810 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -6.510 3.192 2.257 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -8.159 4.529 3.183 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -9.400 3.301 3.037 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.055 3.203 5.315 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -7.882 2.005 4.804 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -7.024 4.890 4.973 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -7.207 3.980 6.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -5.024 3.593 5.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -5.767 2.228 5.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -5.320 3.535 4.239 1.00 0.00 H new ATOM 468 N THR A 33 -6.111 1.581 -0.152 1.00 0.00 N ATOM 469 CA THR A 33 -5.312 0.579 -0.847 1.00 0.00 C ATOM 470 C THR A 33 -5.288 -0.736 -0.077 1.00 0.00 C ATOM 471 O THR A 33 -5.382 -0.749 1.151 1.00 0.00 O ATOM 472 CB THR A 33 -3.866 1.062 -1.061 1.00 0.00 C ATOM 473 OG1 THR A 33 -3.849 2.176 -1.961 1.00 0.00 O ATOM 474 CG2 THR A 33 -2.997 -0.057 -1.615 1.00 0.00 C ATOM 0 H THR A 33 -5.640 2.476 -0.016 1.00 0.00 H new ATOM 0 HA THR A 33 -5.781 0.420 -1.818 1.00 0.00 H new ATOM 0 HB THR A 33 -3.463 1.369 -0.096 1.00 0.00 H new ATOM 0 HG1 THR A 33 -2.926 2.478 -2.090 1.00 0.00 H new ATOM 0 HG21 THR A 33 -1.980 0.309 -1.758 1.00 0.00 H new ATOM 0 HG22 THR A 33 -2.988 -0.891 -0.914 1.00 0.00 H new ATOM 0 HG23 THR A 33 -3.400 -0.391 -2.571 1.00 0.00 H new ATOM 482 N ILE A 34 -5.160 -1.841 -0.804 1.00 0.00 N ATOM 483 CA ILE A 34 -5.121 -3.161 -0.187 1.00 0.00 C ATOM 484 C ILE A 34 -4.002 -4.011 -0.779 1.00 0.00 C ATOM 485 O ILE A 34 -3.784 -4.014 -1.991 1.00 0.00 O ATOM 486 CB ILE A 34 -6.460 -3.902 -0.360 1.00 0.00 C ATOM 487 CG1 ILE A 34 -7.570 -3.181 0.409 1.00 0.00 C ATOM 488 CG2 ILE A 34 -6.332 -5.343 0.111 1.00 0.00 C ATOM 489 CD1 ILE A 34 -8.954 -3.439 -0.145 1.00 0.00 C ATOM 0 H ILE A 34 -5.082 -1.848 -1.821 1.00 0.00 H new ATOM 0 HA ILE A 34 -4.934 -3.008 0.876 1.00 0.00 H new ATOM 0 HB ILE A 34 -6.722 -3.908 -1.418 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.541 -3.495 1.453 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.375 -2.109 0.393 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.286 -5.854 -0.017 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -5.567 -5.851 -0.476 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -6.051 -5.358 1.164 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.690 -2.897 0.448 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -9.001 -3.099 -1.180 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -9.169 -4.507 -0.103 1.00 0.00 H new ATOM 501 N PHE A 35 -3.297 -4.734 0.084 1.00 0.00 N ATOM 502 CA PHE A 35 -2.200 -5.590 -0.352 1.00 0.00 C ATOM 503 C PHE A 35 -2.439 -7.037 0.069 1.00 0.00 C ATOM 504 O PHE A 35 -2.331 -7.377 1.247 1.00 0.00 O ATOM 505 CB PHE A 35 -0.874 -5.091 0.225 1.00 0.00 C ATOM 506 CG PHE A 35 -0.285 -3.938 -0.536 1.00 0.00 C ATOM 507 CD1 PHE A 35 0.388 -4.149 -1.728 1.00 0.00 C ATOM 508 CD2 PHE A 35 -0.405 -2.642 -0.059 1.00 0.00 C ATOM 509 CE1 PHE A 35 0.931 -3.089 -2.430 1.00 0.00 C ATOM 510 CE2 PHE A 35 0.136 -1.579 -0.756 1.00 0.00 C ATOM 511 CZ PHE A 35 0.804 -1.802 -1.944 1.00 0.00 C ATOM 0 H PHE A 35 -3.466 -4.744 1.090 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.152 -5.550 -1.440 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -1.028 -4.791 1.262 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.159 -5.913 0.234 1.00 0.00 H new ATOM 0 HD1 PHE A 35 0.490 -5.153 -2.113 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.928 -2.461 0.869 1.00 0.00 H new ATOM 0 HE1 PHE A 35 1.454 -3.267 -3.358 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.037 -0.574 -0.372 1.00 0.00 H new ATOM 0 HZ PHE A 35 1.226 -0.972 -2.492 1.00 0.00 H new ATOM 521 N ALA A 36 -2.763 -7.884 -0.902 1.00 0.00 N ATOM 522 CA ALA A 36 -3.016 -9.294 -0.633 1.00 0.00 C ATOM 523 C ALA A 36 -1.767 -10.133 -0.882 1.00 0.00 C ATOM 524 O ALA A 36 -1.217 -10.133 -1.983 1.00 0.00 O ATOM 525 CB ALA A 36 -4.170 -9.796 -1.488 1.00 0.00 C ATOM 0 H ALA A 36 -2.857 -7.618 -1.882 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.286 -9.395 0.418 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -4.348 -10.850 -1.277 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.069 -9.223 -1.259 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -3.922 -9.674 -2.542 1.00 0.00 H new ATOM 531 N TYR A 37 -1.324 -10.846 0.148 1.00 0.00 N ATOM 532 CA TYR A 37 -0.138 -11.687 0.041 1.00 0.00 C ATOM 533 C TYR A 37 -0.520 -13.163 -0.021 1.00 0.00 C ATOM 534 O TYR A 37 -0.514 -13.861 0.994 1.00 0.00 O ATOM 535 CB TYR A 37 0.796 -11.440 1.227 1.00 0.00 C ATOM 536 CG TYR A 37 2.081 -12.235 1.162 1.00 0.00 C ATOM 537 CD1 TYR A 37 2.930 -12.132 0.067 1.00 0.00 C ATOM 538 CD2 TYR A 37 2.445 -13.089 2.195 1.00 0.00 C ATOM 539 CE1 TYR A 37 4.104 -12.857 0.003 1.00 0.00 C ATOM 540 CE2 TYR A 37 3.618 -13.817 2.141 1.00 0.00 C ATOM 541 CZ TYR A 37 4.444 -13.698 1.042 1.00 0.00 C ATOM 542 OH TYR A 37 5.612 -14.422 0.983 1.00 0.00 O ATOM 0 H TYR A 37 -1.768 -10.858 1.066 1.00 0.00 H new ATOM 0 HA TYR A 37 0.380 -11.426 -0.882 1.00 0.00 H new ATOM 0 HB2 TYR A 37 1.038 -10.378 1.273 1.00 0.00 H new ATOM 0 HB3 TYR A 37 0.271 -11.688 2.150 1.00 0.00 H new ATOM 0 HD1 TYR A 37 2.668 -11.474 -0.748 1.00 0.00 H new ATOM 0 HD2 TYR A 37 1.800 -13.186 3.056 1.00 0.00 H new ATOM 0 HE1 TYR A 37 4.752 -12.766 -0.856 1.00 0.00 H new ATOM 0 HE2 TYR A 37 3.887 -14.475 2.954 1.00 0.00 H new ATOM 0 HH TYR A 37 5.702 -14.964 1.795 1.00 0.00 H new ATOM 552 N PHE A 38 -0.851 -13.631 -1.219 1.00 0.00 N ATOM 553 CA PHE A 38 -1.237 -15.024 -1.415 1.00 0.00 C ATOM 554 C PHE A 38 -0.035 -15.950 -1.247 1.00 0.00 C ATOM 555 O PHE A 38 0.768 -16.115 -2.165 1.00 0.00 O ATOM 556 CB PHE A 38 -1.851 -15.215 -2.804 1.00 0.00 C ATOM 557 CG PHE A 38 -2.937 -14.227 -3.119 1.00 0.00 C ATOM 558 CD1 PHE A 38 -4.179 -14.325 -2.512 1.00 0.00 C ATOM 559 CD2 PHE A 38 -2.717 -13.200 -4.024 1.00 0.00 C ATOM 560 CE1 PHE A 38 -5.181 -13.418 -2.800 1.00 0.00 C ATOM 561 CE2 PHE A 38 -3.715 -12.290 -4.315 1.00 0.00 C ATOM 562 CZ PHE A 38 -4.949 -12.399 -3.703 1.00 0.00 C ATOM 0 H PHE A 38 -0.860 -13.067 -2.069 1.00 0.00 H new ATOM 0 HA PHE A 38 -1.979 -15.279 -0.659 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -1.065 -15.131 -3.555 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -2.256 -16.224 -2.878 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -4.366 -15.120 -1.805 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -1.755 -13.110 -4.507 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -6.144 -13.506 -2.320 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.531 -11.494 -5.021 1.00 0.00 H new ATOM 0 HZ PHE A 38 -5.730 -11.689 -3.930 1.00 0.00 H new ATOM 572 N SER A 39 0.080 -16.550 -0.067 1.00 0.00 N ATOM 573 CA SER A 39 1.185 -17.456 0.225 1.00 0.00 C ATOM 574 C SER A 39 0.671 -18.774 0.797 1.00 0.00 C ATOM 575 O SER A 39 -0.420 -18.834 1.363 1.00 0.00 O ATOM 576 CB SER A 39 2.160 -16.806 1.209 1.00 0.00 C ATOM 577 OG SER A 39 2.857 -17.785 1.959 1.00 0.00 O ATOM 0 H SER A 39 -0.578 -16.425 0.702 1.00 0.00 H new ATOM 0 HA SER A 39 1.707 -17.664 -0.709 1.00 0.00 H new ATOM 0 HB2 SER A 39 2.872 -16.186 0.664 1.00 0.00 H new ATOM 0 HB3 SER A 39 1.614 -16.147 1.884 1.00 0.00 H new ATOM 0 HG SER A 39 3.721 -17.968 1.535 1.00 0.00 H new ATOM 583 N GLY A 40 1.467 -19.828 0.645 1.00 0.00 N ATOM 584 CA GLY A 40 1.076 -21.131 1.151 1.00 0.00 C ATOM 585 C GLY A 40 0.687 -21.092 2.615 1.00 0.00 C ATOM 586 O GLY A 40 1.094 -20.191 3.349 1.00 0.00 O ATOM 0 H GLY A 40 2.375 -19.803 0.181 1.00 0.00 H new ATOM 0 HA2 GLY A 40 0.237 -21.508 0.565 1.00 0.00 H new ATOM 0 HA3 GLY A 40 1.900 -21.832 1.016 1.00 0.00 H new ATOM 590 N SER A 41 -0.105 -22.070 3.042 1.00 0.00 N ATOM 591 CA SER A 41 -0.555 -22.140 4.428 1.00 0.00 C ATOM 592 C SER A 41 0.633 -22.249 5.379 1.00 0.00 C ATOM 593 O SER A 41 1.711 -22.704 4.996 1.00 0.00 O ATOM 594 CB SER A 41 -1.490 -23.335 4.623 1.00 0.00 C ATOM 595 OG SER A 41 -0.808 -24.558 4.405 1.00 0.00 O ATOM 0 H SER A 41 -0.449 -22.825 2.448 1.00 0.00 H new ATOM 0 HA SER A 41 -1.098 -21.222 4.655 1.00 0.00 H new ATOM 0 HB2 SER A 41 -1.900 -23.319 5.633 1.00 0.00 H new ATOM 0 HB3 SER A 41 -2.332 -23.257 3.936 1.00 0.00 H new ATOM 0 HG SER A 41 -1.427 -25.306 4.537 1.00 0.00 H new ATOM 601 N LYS A 42 0.427 -21.828 6.622 1.00 0.00 N ATOM 602 CA LYS A 42 1.479 -21.878 7.631 1.00 0.00 C ATOM 603 C LYS A 42 1.271 -23.058 8.575 1.00 0.00 C ATOM 604 O LYS A 42 0.145 -23.513 8.778 1.00 0.00 O ATOM 605 CB LYS A 42 1.511 -20.573 8.429 1.00 0.00 C ATOM 606 CG LYS A 42 1.701 -19.337 7.566 1.00 0.00 C ATOM 607 CD LYS A 42 2.218 -18.163 8.380 1.00 0.00 C ATOM 608 CE LYS A 42 1.098 -17.483 9.152 1.00 0.00 C ATOM 609 NZ LYS A 42 1.590 -16.311 9.928 1.00 0.00 N ATOM 0 H LYS A 42 -0.459 -21.448 6.955 1.00 0.00 H new ATOM 0 HA LYS A 42 2.433 -22.008 7.120 1.00 0.00 H new ATOM 0 HB2 LYS A 42 0.580 -20.476 8.988 1.00 0.00 H new ATOM 0 HB3 LYS A 42 2.318 -20.623 9.160 1.00 0.00 H new ATOM 0 HG2 LYS A 42 2.401 -19.559 6.760 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.753 -19.068 7.100 1.00 0.00 H new ATOM 0 HD2 LYS A 42 2.982 -18.510 9.076 1.00 0.00 H new ATOM 0 HD3 LYS A 42 2.695 -17.441 7.717 1.00 0.00 H new ATOM 0 HE2 LYS A 42 0.323 -17.159 8.457 1.00 0.00 H new ATOM 0 HE3 LYS A 42 0.638 -18.201 9.831 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 0.796 -15.876 10.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 2.311 -16.624 10.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 2.007 -15.614 9.278 1.00 0.00 H new ATOM 693 N SER A 48 5.468 -21.778 6.441 1.00 0.00 N ATOM 694 CA SER A 48 4.808 -22.335 5.266 1.00 0.00 C ATOM 695 C SER A 48 5.682 -23.395 4.604 1.00 0.00 C ATOM 696 O SER A 48 6.907 -23.281 4.584 1.00 0.00 O ATOM 697 CB SER A 48 4.483 -21.226 4.264 1.00 0.00 C ATOM 698 OG SER A 48 3.749 -21.733 3.163 1.00 0.00 O ATOM 0 HA SER A 48 3.879 -22.805 5.590 1.00 0.00 H new ATOM 0 HB2 SER A 48 3.909 -20.442 4.758 1.00 0.00 H new ATOM 0 HB3 SER A 48 5.407 -20.769 3.910 1.00 0.00 H new ATOM 0 HG SER A 48 2.962 -22.218 3.490 1.00 0.00 H new ATOM 704 N TRP A 49 5.043 -24.426 4.062 1.00 0.00 N ATOM 705 CA TRP A 49 5.762 -25.508 3.398 1.00 0.00 C ATOM 706 C TRP A 49 6.816 -24.956 2.445 1.00 0.00 C ATOM 707 O TRP A 49 7.949 -25.436 2.413 1.00 0.00 O ATOM 708 CB TRP A 49 4.785 -26.403 2.635 1.00 0.00 C ATOM 709 CG TRP A 49 3.752 -25.636 1.867 1.00 0.00 C ATOM 710 CD1 TRP A 49 2.578 -25.133 2.350 1.00 0.00 C ATOM 711 CD2 TRP A 49 3.799 -25.288 0.479 1.00 0.00 C ATOM 712 NE1 TRP A 49 1.893 -24.492 1.346 1.00 0.00 N ATOM 713 CE2 TRP A 49 2.621 -24.573 0.188 1.00 0.00 C ATOM 714 CE3 TRP A 49 4.723 -25.509 -0.546 1.00 0.00 C ATOM 715 CZ2 TRP A 49 2.345 -24.079 -1.084 1.00 0.00 C ATOM 716 CZ3 TRP A 49 4.447 -25.019 -1.809 1.00 0.00 C ATOM 717 CH2 TRP A 49 3.266 -24.310 -2.069 1.00 0.00 C ATOM 0 H TRP A 49 4.029 -24.536 4.069 1.00 0.00 H new ATOM 0 HA TRP A 49 6.265 -26.100 4.162 1.00 0.00 H new ATOM 0 HB2 TRP A 49 5.345 -27.035 1.946 1.00 0.00 H new ATOM 0 HB3 TRP A 49 4.285 -27.066 3.340 1.00 0.00 H new ATOM 0 HD1 TRP A 49 2.238 -25.225 3.371 1.00 0.00 H new ATOM 0 HE1 TRP A 49 0.989 -24.031 1.446 1.00 0.00 H new ATOM 0 HE3 TRP A 49 5.636 -26.053 -0.355 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 1.436 -23.533 -1.286 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 5.153 -25.185 -2.609 1.00 0.00 H new ATOM 0 HH2 TRP A 49 3.080 -23.939 -3.066 1.00 0.00 H new ATOM 728 N CYS A 50 6.436 -23.945 1.671 1.00 0.00 N ATOM 729 CA CYS A 50 7.350 -23.328 0.715 1.00 0.00 C ATOM 730 C CYS A 50 8.454 -22.563 1.436 1.00 0.00 C ATOM 731 O CYS A 50 8.199 -21.714 2.291 1.00 0.00 O ATOM 732 CB CYS A 50 6.586 -22.388 -0.218 1.00 0.00 C ATOM 733 SG CYS A 50 7.642 -21.455 -1.351 1.00 0.00 S ATOM 0 H CYS A 50 5.502 -23.535 1.686 1.00 0.00 H new ATOM 0 HA CYS A 50 7.809 -24.120 0.124 1.00 0.00 H new ATOM 0 HB2 CYS A 50 5.873 -22.972 -0.800 1.00 0.00 H new ATOM 0 HB3 CYS A 50 6.008 -21.687 0.384 1.00 0.00 H new ATOM 0 HG CYS A 50 6.905 -20.690 -2.100 1.00 0.00 H new ATOM 739 N PRO A 51 9.712 -22.868 1.086 1.00 0.00 N ATOM 740 CA PRO A 51 10.881 -22.221 1.688 1.00 0.00 C ATOM 741 C PRO A 51 11.016 -20.761 1.269 1.00 0.00 C ATOM 742 O PRO A 51 11.577 -19.945 2.000 1.00 0.00 O ATOM 743 CB PRO A 51 12.057 -23.041 1.152 1.00 0.00 C ATOM 744 CG PRO A 51 11.560 -23.624 -0.126 1.00 0.00 C ATOM 745 CD PRO A 51 10.090 -23.869 0.074 1.00 0.00 C ATOM 0 HA PRO A 51 10.819 -22.200 2.776 1.00 0.00 H new ATOM 0 HB2 PRO A 51 12.934 -22.415 0.987 1.00 0.00 H new ATOM 0 HB3 PRO A 51 12.350 -23.820 1.856 1.00 0.00 H new ATOM 0 HG2 PRO A 51 11.732 -22.942 -0.959 1.00 0.00 H new ATOM 0 HG3 PRO A 51 12.082 -24.552 -0.361 1.00 0.00 H new ATOM 0 HD2 PRO A 51 9.531 -23.735 -0.852 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.895 -24.884 0.420 1.00 0.00 H new ATOM 753 N ASP A 52 10.497 -20.439 0.090 1.00 0.00 N ATOM 754 CA ASP A 52 10.557 -19.076 -0.426 1.00 0.00 C ATOM 755 C ASP A 52 9.626 -18.157 0.358 1.00 0.00 C ATOM 756 O ASP A 52 10.016 -17.061 0.764 1.00 0.00 O ATOM 757 CB ASP A 52 10.187 -19.053 -1.910 1.00 0.00 C ATOM 758 CG ASP A 52 10.972 -20.067 -2.718 1.00 0.00 C ATOM 759 OD1 ASP A 52 10.544 -21.239 -2.775 1.00 0.00 O ATOM 760 OD2 ASP A 52 12.014 -19.689 -3.294 1.00 0.00 O ATOM 0 H ASP A 52 10.030 -21.103 -0.527 1.00 0.00 H new ATOM 0 HA ASP A 52 11.578 -18.714 -0.309 1.00 0.00 H new ATOM 0 HB2 ASP A 52 9.121 -19.253 -2.019 1.00 0.00 H new ATOM 0 HB3 ASP A 52 10.367 -18.055 -2.311 1.00 0.00 H new ATOM 765 N CYS A 53 8.394 -18.608 0.566 1.00 0.00 N ATOM 766 CA CYS A 53 7.406 -17.825 1.299 1.00 0.00 C ATOM 767 C CYS A 53 7.952 -17.397 2.658 1.00 0.00 C ATOM 768 O CYS A 53 7.614 -16.328 3.165 1.00 0.00 O ATOM 769 CB CYS A 53 6.120 -18.632 1.484 1.00 0.00 C ATOM 770 SG CYS A 53 4.952 -18.482 0.112 1.00 0.00 S ATOM 0 H CYS A 53 8.055 -19.512 0.237 1.00 0.00 H new ATOM 0 HA CYS A 53 7.184 -16.930 0.718 1.00 0.00 H new ATOM 0 HB2 CYS A 53 6.379 -19.683 1.614 1.00 0.00 H new ATOM 0 HB3 CYS A 53 5.629 -18.309 2.402 1.00 0.00 H new ATOM 0 HG CYS A 53 4.416 -19.641 -0.130 1.00 0.00 H new ATOM 776 N VAL A 54 8.797 -18.240 3.243 1.00 0.00 N ATOM 777 CA VAL A 54 9.389 -17.950 4.543 1.00 0.00 C ATOM 778 C VAL A 54 10.533 -16.951 4.415 1.00 0.00 C ATOM 779 O VAL A 54 10.846 -16.227 5.360 1.00 0.00 O ATOM 780 CB VAL A 54 9.913 -19.230 5.220 1.00 0.00 C ATOM 781 CG1 VAL A 54 10.690 -18.888 6.482 1.00 0.00 C ATOM 782 CG2 VAL A 54 8.763 -20.176 5.532 1.00 0.00 C ATOM 0 H VAL A 54 9.087 -19.130 2.837 1.00 0.00 H new ATOM 0 HA VAL A 54 8.601 -17.519 5.160 1.00 0.00 H new ATOM 0 HB VAL A 54 10.591 -19.733 4.531 1.00 0.00 H new ATOM 0 HG11 VAL A 54 11.052 -19.805 6.946 1.00 0.00 H new ATOM 0 HG12 VAL A 54 11.537 -18.252 6.226 1.00 0.00 H new ATOM 0 HG13 VAL A 54 10.038 -18.362 7.179 1.00 0.00 H new ATOM 0 HG21 VAL A 54 9.151 -21.075 6.010 1.00 0.00 H new ATOM 0 HG22 VAL A 54 8.059 -19.684 6.203 1.00 0.00 H new ATOM 0 HG23 VAL A 54 8.254 -20.448 4.607 1.00 0.00 H new ATOM 792 N GLU A 55 11.154 -16.918 3.240 1.00 0.00 N ATOM 793 CA GLU A 55 12.265 -16.007 2.989 1.00 0.00 C ATOM 794 C GLU A 55 11.759 -14.654 2.498 1.00 0.00 C ATOM 795 O GLU A 55 12.404 -13.626 2.703 1.00 0.00 O ATOM 796 CB GLU A 55 13.224 -16.609 1.960 1.00 0.00 C ATOM 797 CG GLU A 55 14.568 -15.902 1.894 1.00 0.00 C ATOM 798 CD GLU A 55 15.622 -16.718 1.171 1.00 0.00 C ATOM 799 OE1 GLU A 55 15.246 -17.571 0.341 1.00 0.00 O ATOM 800 OE2 GLU A 55 16.823 -16.503 1.437 1.00 0.00 O ATOM 0 H GLU A 55 10.907 -17.511 2.448 1.00 0.00 H new ATOM 0 HA GLU A 55 12.798 -15.857 3.928 1.00 0.00 H new ATOM 0 HB2 GLU A 55 13.387 -17.660 2.199 1.00 0.00 H new ATOM 0 HB3 GLU A 55 12.756 -16.575 0.976 1.00 0.00 H new ATOM 0 HG2 GLU A 55 14.446 -14.944 1.389 1.00 0.00 H new ATOM 0 HG3 GLU A 55 14.911 -15.687 2.906 1.00 0.00 H new ATOM 807 N ALA A 56 10.600 -14.663 1.847 1.00 0.00 N ATOM 808 CA ALA A 56 10.006 -13.438 1.328 1.00 0.00 C ATOM 809 C ALA A 56 9.212 -12.711 2.408 1.00 0.00 C ATOM 810 O ALA A 56 9.149 -11.483 2.425 1.00 0.00 O ATOM 811 CB ALA A 56 9.114 -13.748 0.134 1.00 0.00 C ATOM 0 H ALA A 56 10.054 -15.506 1.667 1.00 0.00 H new ATOM 0 HA ALA A 56 10.814 -12.782 1.004 1.00 0.00 H new ATOM 0 HB1 ALA A 56 8.677 -12.824 -0.243 1.00 0.00 H new ATOM 0 HB2 ALA A 56 9.707 -14.216 -0.652 1.00 0.00 H new ATOM 0 HB3 ALA A 56 8.318 -14.427 0.441 1.00 0.00 H new ATOM 817 N GLU A 57 8.607 -13.479 3.309 1.00 0.00 N ATOM 818 CA GLU A 57 7.816 -12.907 4.392 1.00 0.00 C ATOM 819 C GLU A 57 8.515 -11.691 4.993 1.00 0.00 C ATOM 820 O GLU A 57 7.979 -10.583 5.013 1.00 0.00 O ATOM 821 CB GLU A 57 7.566 -13.955 5.480 1.00 0.00 C ATOM 822 CG GLU A 57 7.476 -13.369 6.879 1.00 0.00 C ATOM 823 CD GLU A 57 6.383 -12.326 7.006 1.00 0.00 C ATOM 824 OE1 GLU A 57 6.040 -11.698 5.982 1.00 0.00 O ATOM 825 OE2 GLU A 57 5.871 -12.138 8.129 1.00 0.00 O ATOM 0 H GLU A 57 8.650 -14.498 3.310 1.00 0.00 H new ATOM 0 HA GLU A 57 6.859 -12.587 3.979 1.00 0.00 H new ATOM 0 HB2 GLU A 57 6.640 -14.485 5.257 1.00 0.00 H new ATOM 0 HB3 GLU A 57 8.369 -14.692 5.455 1.00 0.00 H new ATOM 0 HG2 GLU A 57 7.292 -14.171 7.594 1.00 0.00 H new ATOM 0 HG3 GLU A 57 8.434 -12.920 7.143 1.00 0.00 H new ATOM 832 N PRO A 58 9.741 -11.902 5.495 1.00 0.00 N ATOM 833 CA PRO A 58 10.540 -10.836 6.105 1.00 0.00 C ATOM 834 C PRO A 58 11.028 -9.817 5.080 1.00 0.00 C ATOM 835 O PRO A 58 11.511 -8.743 5.439 1.00 0.00 O ATOM 836 CB PRO A 58 11.725 -11.587 6.718 1.00 0.00 C ATOM 837 CG PRO A 58 11.842 -12.833 5.910 1.00 0.00 C ATOM 838 CD PRO A 58 10.441 -13.197 5.504 1.00 0.00 C ATOM 0 HA PRO A 58 9.964 -10.258 6.828 1.00 0.00 H new ATOM 0 HB2 PRO A 58 12.639 -10.995 6.667 1.00 0.00 H new ATOM 0 HB3 PRO A 58 11.550 -11.812 7.770 1.00 0.00 H new ATOM 0 HG2 PRO A 58 12.473 -12.673 5.035 1.00 0.00 H new ATOM 0 HG3 PRO A 58 12.300 -13.633 6.491 1.00 0.00 H new ATOM 0 HD2 PRO A 58 10.418 -13.673 4.524 1.00 0.00 H new ATOM 0 HD3 PRO A 58 9.987 -13.894 6.208 1.00 0.00 H new ATOM 846 N VAL A 59 10.899 -10.162 3.803 1.00 0.00 N ATOM 847 CA VAL A 59 11.325 -9.277 2.725 1.00 0.00 C ATOM 848 C VAL A 59 10.186 -8.367 2.279 1.00 0.00 C ATOM 849 O VAL A 59 10.418 -7.267 1.775 1.00 0.00 O ATOM 850 CB VAL A 59 11.835 -10.076 1.512 1.00 0.00 C ATOM 851 CG1 VAL A 59 12.458 -9.145 0.483 1.00 0.00 C ATOM 852 CG2 VAL A 59 12.831 -11.138 1.954 1.00 0.00 C ATOM 0 H VAL A 59 10.503 -11.048 3.489 1.00 0.00 H new ATOM 0 HA VAL A 59 12.140 -8.668 3.118 1.00 0.00 H new ATOM 0 HB VAL A 59 10.986 -10.577 1.047 1.00 0.00 H new ATOM 0 HG11 VAL A 59 12.813 -9.728 -0.367 1.00 0.00 H new ATOM 0 HG12 VAL A 59 11.712 -8.426 0.144 1.00 0.00 H new ATOM 0 HG13 VAL A 59 13.296 -8.613 0.934 1.00 0.00 H new ATOM 0 HG21 VAL A 59 13.181 -11.693 1.084 1.00 0.00 H new ATOM 0 HG22 VAL A 59 13.679 -10.660 2.445 1.00 0.00 H new ATOM 0 HG23 VAL A 59 12.348 -11.823 2.651 1.00 0.00 H new ATOM 862 N ILE A 60 8.956 -8.832 2.467 1.00 0.00 N ATOM 863 CA ILE A 60 7.781 -8.059 2.084 1.00 0.00 C ATOM 864 C ILE A 60 7.294 -7.191 3.240 1.00 0.00 C ATOM 865 O ILE A 60 6.940 -6.027 3.049 1.00 0.00 O ATOM 866 CB ILE A 60 6.630 -8.974 1.624 1.00 0.00 C ATOM 867 CG1 ILE A 60 7.074 -9.829 0.435 1.00 0.00 C ATOM 868 CG2 ILE A 60 5.408 -8.145 1.261 1.00 0.00 C ATOM 869 CD1 ILE A 60 5.932 -10.538 -0.258 1.00 0.00 C ATOM 0 H ILE A 60 8.747 -9.740 2.882 1.00 0.00 H new ATOM 0 HA ILE A 60 8.080 -7.420 1.253 1.00 0.00 H new ATOM 0 HB ILE A 60 6.362 -9.639 2.445 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.589 -9.194 -0.287 1.00 0.00 H new ATOM 0 HG13 ILE A 60 7.795 -10.570 0.780 1.00 0.00 H new ATOM 0 HG21 ILE A 60 4.603 -8.805 0.938 1.00 0.00 H new ATOM 0 HG22 ILE A 60 5.083 -7.576 2.132 1.00 0.00 H new ATOM 0 HG23 ILE A 60 5.661 -7.459 0.453 1.00 0.00 H new ATOM 0 HD11 ILE A 60 6.320 -11.125 -1.091 1.00 0.00 H new ATOM 0 HD12 ILE A 60 5.431 -11.199 0.450 1.00 0.00 H new ATOM 0 HD13 ILE A 60 5.221 -9.802 -0.633 1.00 0.00 H new ATOM 881 N ARG A 61 7.280 -7.765 4.439 1.00 0.00 N ATOM 882 CA ARG A 61 6.838 -7.043 5.626 1.00 0.00 C ATOM 883 C ARG A 61 7.743 -5.847 5.904 1.00 0.00 C ATOM 884 O ARG A 61 7.269 -4.767 6.255 1.00 0.00 O ATOM 885 CB ARG A 61 6.820 -7.976 6.838 1.00 0.00 C ATOM 886 CG ARG A 61 5.753 -7.624 7.862 1.00 0.00 C ATOM 887 CD ARG A 61 5.466 -8.793 8.791 1.00 0.00 C ATOM 888 NE ARG A 61 4.993 -8.348 10.100 1.00 0.00 N ATOM 889 CZ ARG A 61 4.853 -9.157 11.144 1.00 0.00 C ATOM 890 NH1 ARG A 61 5.148 -10.445 11.034 1.00 0.00 N ATOM 891 NH2 ARG A 61 4.418 -8.678 12.302 1.00 0.00 N ATOM 0 H ARG A 61 7.570 -8.727 4.614 1.00 0.00 H new ATOM 0 HA ARG A 61 5.828 -6.676 5.443 1.00 0.00 H new ATOM 0 HB2 ARG A 61 6.660 -8.999 6.496 1.00 0.00 H new ATOM 0 HB3 ARG A 61 7.797 -7.950 7.320 1.00 0.00 H new ATOM 0 HG2 ARG A 61 6.078 -6.764 8.447 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.837 -7.332 7.349 1.00 0.00 H new ATOM 0 HD2 ARG A 61 4.718 -9.442 8.336 1.00 0.00 H new ATOM 0 HD3 ARG A 61 6.371 -9.388 8.915 1.00 0.00 H new ATOM 0 HE ARG A 61 4.758 -7.363 10.218 1.00 0.00 H new ATOM 0 HH11 ARG A 61 5.484 -10.817 10.146 1.00 0.00 H new ATOM 0 HH12 ARG A 61 5.039 -11.064 11.838 1.00 0.00 H new ATOM 0 HH21 ARG A 61 4.191 -7.688 12.391 1.00 0.00 H new ATOM 0 HH22 ARG A 61 4.311 -9.300 13.103 1.00 0.00 H new ATOM 905 N GLU A 62 9.047 -6.048 5.745 1.00 0.00 N ATOM 906 CA GLU A 62 10.018 -4.986 5.980 1.00 0.00 C ATOM 907 C GLU A 62 9.774 -3.808 5.041 1.00 0.00 C ATOM 908 O GLU A 62 9.771 -2.653 5.464 1.00 0.00 O ATOM 909 CB GLU A 62 11.441 -5.515 5.794 1.00 0.00 C ATOM 910 CG GLU A 62 11.945 -6.335 6.969 1.00 0.00 C ATOM 911 CD GLU A 62 13.397 -6.742 6.817 1.00 0.00 C ATOM 912 OE1 GLU A 62 14.281 -5.923 7.147 1.00 0.00 O ATOM 913 OE2 GLU A 62 13.651 -7.880 6.369 1.00 0.00 O ATOM 0 H GLU A 62 9.455 -6.936 5.454 1.00 0.00 H new ATOM 0 HA GLU A 62 9.898 -4.640 7.007 1.00 0.00 H new ATOM 0 HB2 GLU A 62 11.477 -6.127 4.893 1.00 0.00 H new ATOM 0 HB3 GLU A 62 12.114 -4.673 5.634 1.00 0.00 H new ATOM 0 HG2 GLU A 62 11.828 -5.758 7.886 1.00 0.00 H new ATOM 0 HG3 GLU A 62 11.330 -7.229 7.073 1.00 0.00 H new ATOM 920 N GLY A 63 9.570 -4.111 3.762 1.00 0.00 N ATOM 921 CA GLY A 63 9.329 -3.068 2.782 1.00 0.00 C ATOM 922 C GLY A 63 8.006 -2.362 3.000 1.00 0.00 C ATOM 923 O GLY A 63 7.891 -1.157 2.772 1.00 0.00 O ATOM 0 H GLY A 63 9.567 -5.060 3.388 1.00 0.00 H new ATOM 0 HA2 GLY A 63 10.138 -2.339 2.826 1.00 0.00 H new ATOM 0 HA3 GLY A 63 9.345 -3.502 1.782 1.00 0.00 H new ATOM 927 N LEU A 64 7.002 -3.113 3.442 1.00 0.00 N ATOM 928 CA LEU A 64 5.679 -2.552 3.690 1.00 0.00 C ATOM 929 C LEU A 64 5.767 -1.326 4.593 1.00 0.00 C ATOM 930 O LEU A 64 4.882 -0.470 4.584 1.00 0.00 O ATOM 931 CB LEU A 64 4.768 -3.604 4.326 1.00 0.00 C ATOM 932 CG LEU A 64 3.985 -4.489 3.356 1.00 0.00 C ATOM 933 CD1 LEU A 64 3.325 -5.641 4.098 1.00 0.00 C ATOM 934 CD2 LEU A 64 2.944 -3.668 2.608 1.00 0.00 C ATOM 0 H LEU A 64 7.080 -4.111 3.636 1.00 0.00 H new ATOM 0 HA LEU A 64 5.257 -2.245 2.733 1.00 0.00 H new ATOM 0 HB2 LEU A 64 5.377 -4.247 4.962 1.00 0.00 H new ATOM 0 HB3 LEU A 64 4.057 -3.094 4.976 1.00 0.00 H new ATOM 0 HG LEU A 64 4.683 -4.905 2.629 1.00 0.00 H new ATOM 0 HD11 LEU A 64 2.772 -6.260 3.391 1.00 0.00 H new ATOM 0 HD12 LEU A 64 4.090 -6.244 4.588 1.00 0.00 H new ATOM 0 HD13 LEU A 64 2.639 -5.246 4.848 1.00 0.00 H new ATOM 0 HD21 LEU A 64 2.396 -4.314 1.922 1.00 0.00 H new ATOM 0 HD22 LEU A 64 2.250 -3.224 3.321 1.00 0.00 H new ATOM 0 HD23 LEU A 64 3.440 -2.878 2.044 1.00 0.00 H new ATOM 946 N LYS A 65 6.841 -1.246 5.370 1.00 0.00 N ATOM 947 CA LYS A 65 7.049 -0.124 6.277 1.00 0.00 C ATOM 948 C LYS A 65 7.473 1.125 5.510 1.00 0.00 C ATOM 949 O LYS A 65 7.181 2.248 5.921 1.00 0.00 O ATOM 950 CB LYS A 65 8.107 -0.476 7.325 1.00 0.00 C ATOM 951 CG LYS A 65 7.596 -1.396 8.420 1.00 0.00 C ATOM 952 CD LYS A 65 8.565 -1.463 9.589 1.00 0.00 C ATOM 953 CE LYS A 65 8.435 -0.245 10.491 1.00 0.00 C ATOM 954 NZ LYS A 65 7.294 -0.376 11.439 1.00 0.00 N ATOM 0 H LYS A 65 7.582 -1.946 5.390 1.00 0.00 H new ATOM 0 HA LYS A 65 6.104 0.083 6.780 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.954 -0.951 6.829 1.00 0.00 H new ATOM 0 HB3 LYS A 65 8.477 0.444 7.778 1.00 0.00 H new ATOM 0 HG2 LYS A 65 6.626 -1.043 8.770 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.444 -2.396 8.015 1.00 0.00 H new ATOM 0 HD2 LYS A 65 8.377 -2.367 10.168 1.00 0.00 H new ATOM 0 HD3 LYS A 65 9.586 -1.532 9.213 1.00 0.00 H new ATOM 0 HE2 LYS A 65 9.359 -0.108 11.052 1.00 0.00 H new ATOM 0 HE3 LYS A 65 8.298 0.647 9.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 7.239 0.474 12.036 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 6.408 -0.481 10.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.436 -1.213 12.040 1.00 0.00 H new ATOM 968 N HIS A 66 8.164 0.921 4.393 1.00 0.00 N ATOM 969 CA HIS A 66 8.627 2.030 3.567 1.00 0.00 C ATOM 970 C HIS A 66 7.464 2.669 2.813 1.00 0.00 C ATOM 971 O HIS A 66 7.537 3.828 2.406 1.00 0.00 O ATOM 972 CB HIS A 66 9.689 1.549 2.577 1.00 0.00 C ATOM 973 CG HIS A 66 10.945 1.068 3.234 1.00 0.00 C ATOM 974 ND1 HIS A 66 12.182 1.629 2.995 1.00 0.00 N ATOM 975 CD2 HIS A 66 11.152 0.073 4.129 1.00 0.00 C ATOM 976 CE1 HIS A 66 13.095 0.999 3.713 1.00 0.00 C ATOM 977 NE2 HIS A 66 12.496 0.050 4.410 1.00 0.00 N ATOM 0 H HIS A 66 8.416 -0.002 4.039 1.00 0.00 H new ATOM 0 HA HIS A 66 9.067 2.780 4.224 1.00 0.00 H new ATOM 0 HB2 HIS A 66 9.273 0.743 1.973 1.00 0.00 H new ATOM 0 HB3 HIS A 66 9.934 2.364 1.895 1.00 0.00 H new ATOM 0 HD2 HIS A 66 10.400 -0.581 4.545 1.00 0.00 H new ATOM 0 HE1 HIS A 66 14.152 1.222 3.728 1.00 0.00 H new ATOM 0 HE2 HIS A 66 12.957 -0.595 5.052 1.00 0.00 H new ATOM 986 N VAL A 67 6.393 1.903 2.630 1.00 0.00 N ATOM 987 CA VAL A 67 5.214 2.394 1.925 1.00 0.00 C ATOM 988 C VAL A 67 4.868 3.815 2.357 1.00 0.00 C ATOM 989 O VAL A 67 4.971 4.161 3.534 1.00 0.00 O ATOM 990 CB VAL A 67 3.995 1.484 2.168 1.00 0.00 C ATOM 991 CG1 VAL A 67 3.342 1.811 3.502 1.00 0.00 C ATOM 992 CG2 VAL A 67 2.996 1.617 1.029 1.00 0.00 C ATOM 0 H VAL A 67 6.317 0.941 2.960 1.00 0.00 H new ATOM 0 HA VAL A 67 5.455 2.389 0.862 1.00 0.00 H new ATOM 0 HB VAL A 67 4.337 0.449 2.202 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.483 1.158 3.656 1.00 0.00 H new ATOM 0 HG12 VAL A 67 4.062 1.660 4.306 1.00 0.00 H new ATOM 0 HG13 VAL A 67 3.013 2.850 3.501 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.141 0.967 1.217 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.658 2.651 0.961 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.472 1.328 0.092 1.00 0.00 H new ATOM 1002 N THR A 68 4.456 4.636 1.395 1.00 0.00 N ATOM 1003 CA THR A 68 4.095 6.020 1.675 1.00 0.00 C ATOM 1004 C THR A 68 2.633 6.286 1.335 1.00 0.00 C ATOM 1005 O THR A 68 2.255 7.414 1.020 1.00 0.00 O ATOM 1006 CB THR A 68 4.980 7.002 0.885 1.00 0.00 C ATOM 1007 OG1 THR A 68 4.600 7.004 -0.495 1.00 0.00 O ATOM 1008 CG2 THR A 68 6.449 6.627 1.011 1.00 0.00 C ATOM 0 H THR A 68 4.364 4.366 0.416 1.00 0.00 H new ATOM 0 HA THR A 68 4.252 6.178 2.742 1.00 0.00 H new ATOM 0 HB THR A 68 4.838 7.999 1.301 1.00 0.00 H new ATOM 0 HG1 THR A 68 5.212 6.432 -1.004 1.00 0.00 H new ATOM 0 HG21 THR A 68 7.055 7.334 0.445 1.00 0.00 H new ATOM 0 HG22 THR A 68 6.743 6.656 2.060 1.00 0.00 H new ATOM 0 HG23 THR A 68 6.603 5.622 0.618 1.00 0.00 H new ATOM 1016 N GLU A 69 1.815 5.240 1.402 1.00 0.00 N ATOM 1017 CA GLU A 69 0.393 5.362 1.101 1.00 0.00 C ATOM 1018 C GLU A 69 -0.440 4.509 2.053 1.00 0.00 C ATOM 1019 O GLU A 69 -0.323 3.283 2.068 1.00 0.00 O ATOM 1020 CB GLU A 69 0.118 4.949 -0.346 1.00 0.00 C ATOM 1021 CG GLU A 69 0.486 3.506 -0.647 1.00 0.00 C ATOM 1022 CD GLU A 69 0.609 3.233 -2.133 1.00 0.00 C ATOM 1023 OE1 GLU A 69 -0.434 3.209 -2.820 1.00 0.00 O ATOM 1024 OE2 GLU A 69 1.748 3.044 -2.610 1.00 0.00 O ATOM 0 H GLU A 69 2.112 4.299 1.662 1.00 0.00 H new ATOM 0 HA GLU A 69 0.108 6.406 1.233 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -0.940 5.098 -0.563 1.00 0.00 H new ATOM 0 HB3 GLU A 69 0.676 5.605 -1.014 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.430 3.266 -0.158 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.270 2.846 -0.222 1.00 0.00 H new ATOM 1031 N ASP A 70 -1.280 5.165 2.846 1.00 0.00 N ATOM 1032 CA ASP A 70 -2.133 4.468 3.801 1.00 0.00 C ATOM 1033 C ASP A 70 -2.801 3.260 3.151 1.00 0.00 C ATOM 1034 O ASP A 70 -3.812 3.393 2.461 1.00 0.00 O ATOM 1035 CB ASP A 70 -3.197 5.417 4.354 1.00 0.00 C ATOM 1036 CG ASP A 70 -2.692 6.841 4.485 1.00 0.00 C ATOM 1037 OD1 ASP A 70 -2.773 7.593 3.491 1.00 0.00 O ATOM 1038 OD2 ASP A 70 -2.215 7.202 5.581 1.00 0.00 O ATOM 0 H ASP A 70 -1.388 6.179 2.846 1.00 0.00 H new ATOM 0 HA ASP A 70 -1.507 4.118 4.622 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -4.068 5.402 3.699 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -3.526 5.060 5.330 1.00 0.00 H new ATOM 1043 N CYS A 71 -2.228 2.082 3.377 1.00 0.00 N ATOM 1044 CA CYS A 71 -2.767 0.850 2.812 1.00 0.00 C ATOM 1045 C CYS A 71 -3.095 -0.154 3.912 1.00 0.00 C ATOM 1046 O CYS A 71 -2.776 0.063 5.081 1.00 0.00 O ATOM 1047 CB CYS A 71 -1.770 0.238 1.826 1.00 0.00 C ATOM 1048 SG CYS A 71 -0.316 -0.499 2.609 1.00 0.00 S ATOM 0 H CYS A 71 -1.392 1.955 3.947 1.00 0.00 H new ATOM 0 HA CYS A 71 -3.688 1.094 2.282 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -2.279 -0.526 1.238 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -1.443 1.011 1.130 1.00 0.00 H new ATOM 0 HG CYS A 71 0.190 -1.402 1.822 1.00 0.00 H new ATOM 1054 N VAL A 72 -3.735 -1.255 3.529 1.00 0.00 N ATOM 1055 CA VAL A 72 -4.107 -2.293 4.483 1.00 0.00 C ATOM 1056 C VAL A 72 -3.636 -3.665 4.014 1.00 0.00 C ATOM 1057 O VAL A 72 -4.276 -4.299 3.174 1.00 0.00 O ATOM 1058 CB VAL A 72 -5.631 -2.333 4.703 1.00 0.00 C ATOM 1059 CG1 VAL A 72 -6.005 -3.461 5.652 1.00 0.00 C ATOM 1060 CG2 VAL A 72 -6.128 -0.995 5.230 1.00 0.00 C ATOM 0 H VAL A 72 -4.006 -1.451 2.565 1.00 0.00 H new ATOM 0 HA VAL A 72 -3.618 -2.047 5.425 1.00 0.00 H new ATOM 0 HB VAL A 72 -6.114 -2.523 3.744 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -7.086 -3.473 5.795 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -5.684 -4.413 5.230 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -5.514 -3.306 6.613 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -7.207 -1.041 5.380 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -5.639 -0.773 6.179 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -5.895 -0.211 4.510 1.00 0.00 H new ATOM 1070 N PHE A 73 -2.514 -4.119 4.562 1.00 0.00 N ATOM 1071 CA PHE A 73 -1.956 -5.417 4.199 1.00 0.00 C ATOM 1072 C PHE A 73 -2.934 -6.540 4.529 1.00 0.00 C ATOM 1073 O PHE A 73 -3.747 -6.421 5.447 1.00 0.00 O ATOM 1074 CB PHE A 73 -0.631 -5.648 4.928 1.00 0.00 C ATOM 1075 CG PHE A 73 0.097 -6.880 4.473 1.00 0.00 C ATOM 1076 CD1 PHE A 73 0.576 -6.977 3.176 1.00 0.00 C ATOM 1077 CD2 PHE A 73 0.302 -7.940 5.340 1.00 0.00 C ATOM 1078 CE1 PHE A 73 1.246 -8.110 2.754 1.00 0.00 C ATOM 1079 CE2 PHE A 73 0.971 -9.076 4.924 1.00 0.00 C ATOM 1080 CZ PHE A 73 1.445 -9.160 3.629 1.00 0.00 C ATOM 0 H PHE A 73 -1.973 -3.608 5.259 1.00 0.00 H new ATOM 0 HA PHE A 73 -1.776 -5.420 3.124 1.00 0.00 H new ATOM 0 HB2 PHE A 73 0.012 -4.780 4.780 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.823 -5.724 5.998 1.00 0.00 H new ATOM 0 HD1 PHE A 73 0.424 -6.159 2.488 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -0.065 -7.879 6.354 1.00 0.00 H new ATOM 0 HE1 PHE A 73 1.614 -8.174 1.741 1.00 0.00 H new ATOM 0 HE2 PHE A 73 1.123 -9.896 5.610 1.00 0.00 H new ATOM 0 HZ PHE A 73 1.970 -10.045 3.301 1.00 0.00 H new ATOM 1090 N ILE A 74 -2.850 -7.631 3.774 1.00 0.00 N ATOM 1091 CA ILE A 74 -3.726 -8.776 3.987 1.00 0.00 C ATOM 1092 C ILE A 74 -2.999 -10.085 3.701 1.00 0.00 C ATOM 1093 O ILE A 74 -2.761 -10.436 2.545 1.00 0.00 O ATOM 1094 CB ILE A 74 -4.983 -8.695 3.099 1.00 0.00 C ATOM 1095 CG1 ILE A 74 -5.720 -7.376 3.340 1.00 0.00 C ATOM 1096 CG2 ILE A 74 -5.900 -9.878 3.372 1.00 0.00 C ATOM 1097 CD1 ILE A 74 -6.907 -7.172 2.425 1.00 0.00 C ATOM 0 H ILE A 74 -2.184 -7.745 3.010 1.00 0.00 H new ATOM 0 HA ILE A 74 -4.028 -8.752 5.034 1.00 0.00 H new ATOM 0 HB ILE A 74 -4.675 -8.732 2.054 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -6.059 -7.343 4.375 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -5.022 -6.549 3.206 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.784 -9.807 2.738 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.371 -10.806 3.155 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -6.203 -9.869 4.419 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.381 -6.217 2.652 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -6.571 -7.173 1.388 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -7.625 -7.978 2.575 1.00 0.00 H new ATOM 1109 N TYR A 75 -2.650 -10.805 4.761 1.00 0.00 N ATOM 1110 CA TYR A 75 -1.949 -12.076 4.625 1.00 0.00 C ATOM 1111 C TYR A 75 -2.930 -13.213 4.355 1.00 0.00 C ATOM 1112 O TYR A 75 -3.417 -13.860 5.283 1.00 0.00 O ATOM 1113 CB TYR A 75 -1.140 -12.374 5.888 1.00 0.00 C ATOM 1114 CG TYR A 75 -0.039 -13.389 5.676 1.00 0.00 C ATOM 1115 CD1 TYR A 75 -0.331 -14.739 5.524 1.00 0.00 C ATOM 1116 CD2 TYR A 75 1.294 -12.998 5.630 1.00 0.00 C ATOM 1117 CE1 TYR A 75 0.671 -15.670 5.331 1.00 0.00 C ATOM 1118 CE2 TYR A 75 2.303 -13.922 5.436 1.00 0.00 C ATOM 1119 CZ TYR A 75 1.986 -15.256 5.287 1.00 0.00 C ATOM 1120 OH TYR A 75 2.989 -16.179 5.095 1.00 0.00 O ATOM 0 H TYR A 75 -2.841 -10.530 5.724 1.00 0.00 H new ATOM 0 HA TYR A 75 -1.269 -11.998 3.777 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -0.702 -11.446 6.256 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -1.814 -12.738 6.664 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -1.360 -15.066 5.557 1.00 0.00 H new ATOM 0 HD2 TYR A 75 1.545 -11.954 5.748 1.00 0.00 H new ATOM 0 HE1 TYR A 75 0.426 -16.716 5.215 1.00 0.00 H new ATOM 0 HE2 TYR A 75 3.334 -13.601 5.401 1.00 0.00 H new ATOM 0 HH TYR A 75 3.856 -15.723 5.088 1.00 0.00 H new ATOM 1130 N CYS A 76 -3.214 -13.450 3.080 1.00 0.00 N ATOM 1131 CA CYS A 76 -4.137 -14.509 2.686 1.00 0.00 C ATOM 1132 C CYS A 76 -3.383 -15.793 2.355 1.00 0.00 C ATOM 1133 O CYS A 76 -2.351 -15.762 1.686 1.00 0.00 O ATOM 1134 CB CYS A 76 -4.969 -14.067 1.481 1.00 0.00 C ATOM 1135 SG CYS A 76 -6.091 -15.338 0.853 1.00 0.00 S ATOM 0 H CYS A 76 -2.819 -12.924 2.301 1.00 0.00 H new ATOM 0 HA CYS A 76 -4.803 -14.707 3.526 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -5.551 -13.188 1.758 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -4.295 -13.764 0.679 1.00 0.00 H new ATOM 0 HG CYS A 76 -6.752 -14.869 -0.163 1.00 0.00 H new ATOM 1141 N GLN A 77 -3.905 -16.919 2.831 1.00 0.00 N ATOM 1142 CA GLN A 77 -3.279 -18.213 2.587 1.00 0.00 C ATOM 1143 C GLN A 77 -4.080 -19.023 1.573 1.00 0.00 C ATOM 1144 O GLN A 77 -5.249 -19.337 1.798 1.00 0.00 O ATOM 1145 CB GLN A 77 -3.150 -18.995 3.895 1.00 0.00 C ATOM 1146 CG GLN A 77 -2.282 -18.304 4.934 1.00 0.00 C ATOM 1147 CD GLN A 77 -2.515 -18.834 6.335 1.00 0.00 C ATOM 1148 OE1 GLN A 77 -1.949 -19.854 6.728 1.00 0.00 O ATOM 1149 NE2 GLN A 77 -3.353 -18.142 7.098 1.00 0.00 N ATOM 0 H GLN A 77 -4.759 -16.961 3.387 1.00 0.00 H new ATOM 0 HA GLN A 77 -2.284 -18.036 2.178 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -4.144 -19.155 4.313 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -2.732 -19.979 3.681 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -1.233 -18.435 4.670 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -2.484 -17.233 4.917 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -3.801 -17.302 6.732 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -3.549 -18.451 8.050 1.00 0.00 H new ATOM 1158 N VAL A 78 -3.444 -19.359 0.455 1.00 0.00 N ATOM 1159 CA VAL A 78 -4.097 -20.133 -0.593 1.00 0.00 C ATOM 1160 C VAL A 78 -4.586 -21.475 -0.061 1.00 0.00 C ATOM 1161 O VAL A 78 -5.745 -21.844 -0.248 1.00 0.00 O ATOM 1162 CB VAL A 78 -3.149 -20.379 -1.782 1.00 0.00 C ATOM 1163 CG1 VAL A 78 -2.837 -19.073 -2.496 1.00 0.00 C ATOM 1164 CG2 VAL A 78 -1.871 -21.058 -1.312 1.00 0.00 C ATOM 0 H VAL A 78 -2.477 -19.107 0.252 1.00 0.00 H new ATOM 0 HA VAL A 78 -4.951 -19.548 -0.934 1.00 0.00 H new ATOM 0 HB VAL A 78 -3.647 -21.042 -2.490 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -2.166 -19.267 -3.333 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -3.762 -18.631 -2.867 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -2.359 -18.383 -1.800 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -1.213 -21.224 -2.165 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -1.368 -20.422 -0.584 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -2.116 -22.015 -0.851 1.00 0.00 H new ATOM 1174 N GLY A 79 -3.695 -22.203 0.604 1.00 0.00 N ATOM 1175 CA GLY A 79 -4.055 -23.497 1.154 1.00 0.00 C ATOM 1176 C GLY A 79 -2.844 -24.365 1.433 1.00 0.00 C ATOM 1177 O GLY A 79 -1.803 -23.870 1.864 1.00 0.00 O ATOM 0 H GLY A 79 -2.730 -21.920 0.772 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.615 -23.353 2.078 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.716 -24.013 0.458 1.00 0.00 H new ATOM 1181 N ASP A 80 -2.981 -25.664 1.189 1.00 0.00 N ATOM 1182 CA ASP A 80 -1.890 -26.604 1.417 1.00 0.00 C ATOM 1183 C ASP A 80 -1.106 -26.850 0.132 1.00 0.00 C ATOM 1184 O ASP A 80 -1.490 -26.382 -0.941 1.00 0.00 O ATOM 1185 CB ASP A 80 -2.433 -27.927 1.959 1.00 0.00 C ATOM 1186 CG ASP A 80 -3.363 -27.731 3.140 1.00 0.00 C ATOM 1187 OD1 ASP A 80 -2.904 -27.206 4.175 1.00 0.00 O ATOM 1188 OD2 ASP A 80 -4.550 -28.104 3.030 1.00 0.00 O ATOM 0 H ASP A 80 -3.837 -26.090 0.833 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.216 -26.168 2.154 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -2.965 -28.451 1.165 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -1.600 -28.563 2.258 1.00 0.00 H new ATOM 1193 N LYS A 81 -0.006 -27.585 0.247 1.00 0.00 N ATOM 1194 CA LYS A 81 0.833 -27.894 -0.905 1.00 0.00 C ATOM 1195 C LYS A 81 0.016 -28.554 -2.012 1.00 0.00 C ATOM 1196 O LYS A 81 0.033 -28.128 -3.167 1.00 0.00 O ATOM 1197 CB LYS A 81 1.985 -28.812 -0.492 1.00 0.00 C ATOM 1198 CG LYS A 81 3.291 -28.507 -1.204 1.00 0.00 C ATOM 1199 CD LYS A 81 4.492 -28.929 -0.374 1.00 0.00 C ATOM 1200 CE LYS A 81 5.767 -28.943 -1.204 1.00 0.00 C ATOM 1201 NZ LYS A 81 5.780 -30.066 -2.181 1.00 0.00 N ATOM 0 H LYS A 81 0.326 -27.979 1.127 1.00 0.00 H new ATOM 0 HA LYS A 81 1.241 -26.958 -1.287 1.00 0.00 H new ATOM 0 HB2 LYS A 81 2.139 -28.726 0.584 1.00 0.00 H new ATOM 0 HB3 LYS A 81 1.704 -29.846 -0.693 1.00 0.00 H new ATOM 0 HG2 LYS A 81 3.312 -29.023 -2.164 1.00 0.00 H new ATOM 0 HG3 LYS A 81 3.351 -27.439 -1.415 1.00 0.00 H new ATOM 0 HD2 LYS A 81 4.612 -28.246 0.467 1.00 0.00 H new ATOM 0 HD3 LYS A 81 4.317 -29.921 0.043 1.00 0.00 H new ATOM 0 HE2 LYS A 81 5.864 -27.997 -1.737 1.00 0.00 H new ATOM 0 HE3 LYS A 81 6.630 -29.027 -0.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 6.746 -30.200 -2.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 5.462 -30.938 -1.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 5.141 -29.846 -2.972 1.00 0.00 H new ATOM 1215 N PRO A 82 -0.719 -29.617 -1.653 1.00 0.00 N ATOM 1216 CA PRO A 82 -1.557 -30.357 -2.601 1.00 0.00 C ATOM 1217 C PRO A 82 -2.769 -29.550 -3.054 1.00 0.00 C ATOM 1218 O PRO A 82 -3.509 -29.970 -3.944 1.00 0.00 O ATOM 1219 CB PRO A 82 -2.001 -31.584 -1.800 1.00 0.00 C ATOM 1220 CG PRO A 82 -1.931 -31.152 -0.376 1.00 0.00 C ATOM 1221 CD PRO A 82 -0.787 -30.180 -0.293 1.00 0.00 C ATOM 0 HA PRO A 82 -1.019 -30.601 -3.517 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -3.011 -31.890 -2.072 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -1.348 -32.437 -1.988 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -2.864 -30.683 -0.064 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -1.767 -32.005 0.283 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -0.970 -29.407 0.453 1.00 0.00 H new ATOM 0 HD3 PRO A 82 0.143 -30.677 -0.017 1.00 0.00 H new ATOM 1229 N TYR A 83 -2.966 -28.390 -2.437 1.00 0.00 N ATOM 1230 CA TYR A 83 -4.090 -27.525 -2.776 1.00 0.00 C ATOM 1231 C TYR A 83 -3.699 -26.523 -3.859 1.00 0.00 C ATOM 1232 O TYR A 83 -4.352 -26.430 -4.898 1.00 0.00 O ATOM 1233 CB TYR A 83 -4.583 -26.783 -1.533 1.00 0.00 C ATOM 1234 CG TYR A 83 -5.726 -25.832 -1.809 1.00 0.00 C ATOM 1235 CD1 TYR A 83 -7.044 -26.272 -1.779 1.00 0.00 C ATOM 1236 CD2 TYR A 83 -5.488 -24.495 -2.100 1.00 0.00 C ATOM 1237 CE1 TYR A 83 -8.091 -25.407 -2.031 1.00 0.00 C ATOM 1238 CE2 TYR A 83 -6.529 -23.622 -2.352 1.00 0.00 C ATOM 1239 CZ TYR A 83 -7.828 -24.083 -2.316 1.00 0.00 C ATOM 1240 OH TYR A 83 -8.868 -23.218 -2.568 1.00 0.00 O ATOM 0 H TYR A 83 -2.362 -28.027 -1.700 1.00 0.00 H new ATOM 0 HA TYR A 83 -4.895 -28.152 -3.160 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -4.900 -27.512 -0.787 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -3.753 -26.224 -1.101 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.253 -27.308 -1.555 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -4.472 -24.131 -2.130 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.110 -25.765 -2.005 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -6.326 -22.585 -2.576 1.00 0.00 H new ATOM 0 HH TYR A 83 -9.662 -23.508 -2.072 1.00 0.00 H new ATOM 1250 N TRP A 84 -2.630 -25.778 -3.606 1.00 0.00 N ATOM 1251 CA TRP A 84 -2.150 -24.782 -4.559 1.00 0.00 C ATOM 1252 C TRP A 84 -2.056 -25.372 -5.961 1.00 0.00 C ATOM 1253 O TRP A 84 -2.463 -24.744 -6.939 1.00 0.00 O ATOM 1254 CB TRP A 84 -0.785 -24.247 -4.124 1.00 0.00 C ATOM 1255 CG TRP A 84 -0.126 -23.389 -5.161 1.00 0.00 C ATOM 1256 CD1 TRP A 84 1.160 -23.488 -5.610 1.00 0.00 C ATOM 1257 CD2 TRP A 84 -0.720 -22.301 -5.877 1.00 0.00 C ATOM 1258 NE1 TRP A 84 1.401 -22.526 -6.562 1.00 0.00 N ATOM 1259 CE2 TRP A 84 0.263 -21.786 -6.744 1.00 0.00 C ATOM 1260 CE3 TRP A 84 -1.988 -21.713 -5.871 1.00 0.00 C ATOM 1261 CZ2 TRP A 84 0.016 -20.711 -7.595 1.00 0.00 C ATOM 1262 CZ3 TRP A 84 -2.231 -20.646 -6.716 1.00 0.00 C ATOM 1263 CH2 TRP A 84 -1.234 -20.155 -7.568 1.00 0.00 C ATOM 0 H TRP A 84 -2.079 -25.844 -2.750 1.00 0.00 H new ATOM 0 HA TRP A 84 -2.865 -23.959 -4.579 1.00 0.00 H new ATOM 0 HB2 TRP A 84 -0.904 -23.670 -3.207 1.00 0.00 H new ATOM 0 HB3 TRP A 84 -0.131 -25.087 -3.889 1.00 0.00 H new ATOM 0 HD1 TRP A 84 1.881 -24.215 -5.268 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.284 -22.386 -7.053 1.00 0.00 H new ATOM 0 HE3 TRP A 84 -2.764 -22.085 -5.218 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 0.784 -20.330 -8.252 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -3.207 -20.183 -6.719 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.456 -19.321 -8.217 1.00 0.00 H new ATOM 1274 N LYS A 85 -1.517 -26.583 -6.054 1.00 0.00 N ATOM 1275 CA LYS A 85 -1.370 -27.260 -7.338 1.00 0.00 C ATOM 1276 C LYS A 85 -2.685 -27.249 -8.112 1.00 0.00 C ATOM 1277 O LYS A 85 -2.701 -27.032 -9.323 1.00 0.00 O ATOM 1278 CB LYS A 85 -0.902 -28.701 -7.127 1.00 0.00 C ATOM 1279 CG LYS A 85 0.506 -28.808 -6.567 1.00 0.00 C ATOM 1280 CD LYS A 85 0.806 -30.215 -6.077 1.00 0.00 C ATOM 1281 CE LYS A 85 2.070 -30.252 -5.232 1.00 0.00 C ATOM 1282 NZ LYS A 85 3.289 -30.439 -6.065 1.00 0.00 N ATOM 0 H LYS A 85 -1.174 -27.116 -5.255 1.00 0.00 H new ATOM 0 HA LYS A 85 -0.621 -26.723 -7.920 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -1.593 -29.203 -6.449 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -0.947 -29.232 -8.078 1.00 0.00 H new ATOM 0 HG2 LYS A 85 1.226 -28.528 -7.336 1.00 0.00 H new ATOM 0 HG3 LYS A 85 0.626 -28.102 -5.745 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -0.036 -30.585 -5.491 1.00 0.00 H new ATOM 0 HD3 LYS A 85 0.918 -30.883 -6.931 1.00 0.00 H new ATOM 0 HE2 LYS A 85 2.156 -29.324 -4.666 1.00 0.00 H new ATOM 0 HE3 LYS A 85 1.998 -31.062 -4.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 4.129 -30.459 -5.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 3.219 -31.337 -6.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 3.372 -29.652 -6.740 1.00 0.00 H new ATOM 1296 N ASP A 86 -3.784 -27.482 -7.404 1.00 0.00 N ATOM 1297 CA ASP A 86 -5.104 -27.497 -8.025 1.00 0.00 C ATOM 1298 C ASP A 86 -5.249 -26.350 -9.021 1.00 0.00 C ATOM 1299 O ASP A 86 -5.425 -25.190 -8.648 1.00 0.00 O ATOM 1300 CB ASP A 86 -6.194 -27.401 -6.956 1.00 0.00 C ATOM 1301 CG ASP A 86 -5.984 -28.387 -5.824 1.00 0.00 C ATOM 1302 OD1 ASP A 86 -5.018 -29.176 -5.897 1.00 0.00 O ATOM 1303 OD2 ASP A 86 -6.784 -28.370 -4.865 1.00 0.00 O ATOM 0 H ASP A 86 -3.788 -27.663 -6.400 1.00 0.00 H new ATOM 0 HA ASP A 86 -5.215 -28.438 -8.563 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -6.215 -26.389 -6.553 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -7.166 -27.581 -7.415 1.00 0.00 H new ATOM 1308 N PRO A 87 -5.171 -26.681 -10.318 1.00 0.00 N ATOM 1309 CA PRO A 87 -5.290 -25.693 -11.395 1.00 0.00 C ATOM 1310 C PRO A 87 -6.706 -25.139 -11.520 1.00 0.00 C ATOM 1311 O PRO A 87 -6.927 -24.115 -12.164 1.00 0.00 O ATOM 1312 CB PRO A 87 -4.915 -26.487 -12.649 1.00 0.00 C ATOM 1313 CG PRO A 87 -5.229 -27.903 -12.308 1.00 0.00 C ATOM 1314 CD PRO A 87 -4.962 -28.044 -10.835 1.00 0.00 C ATOM 0 HA PRO A 87 -4.658 -24.822 -11.220 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -5.486 -26.152 -13.515 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -3.860 -26.363 -12.895 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -6.267 -28.139 -12.541 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -4.609 -28.590 -12.884 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -5.641 -28.759 -10.370 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -3.949 -28.396 -10.642 1.00 0.00 H new ATOM 1322 N ASN A 88 -7.661 -25.823 -10.898 1.00 0.00 N ATOM 1323 CA ASN A 88 -9.055 -25.399 -10.940 1.00 0.00 C ATOM 1324 C ASN A 88 -9.435 -24.651 -9.665 1.00 0.00 C ATOM 1325 O ASN A 88 -10.585 -24.689 -9.231 1.00 0.00 O ATOM 1326 CB ASN A 88 -9.973 -26.609 -11.127 1.00 0.00 C ATOM 1327 CG ASN A 88 -9.480 -27.545 -12.214 1.00 0.00 C ATOM 1328 OD1 ASN A 88 -9.307 -27.142 -13.364 1.00 0.00 O ATOM 1329 ND2 ASN A 88 -9.252 -28.802 -11.853 1.00 0.00 N ATOM 0 H ASN A 88 -7.495 -26.673 -10.359 1.00 0.00 H new ATOM 0 HA ASN A 88 -9.178 -24.724 -11.787 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -10.046 -27.155 -10.187 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -10.977 -26.265 -11.375 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -8.920 -29.478 -12.541 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -9.409 -29.092 -10.888 1.00 0.00 H new ATOM 1336 N ASN A 89 -8.459 -23.972 -9.071 1.00 0.00 N ATOM 1337 CA ASN A 89 -8.691 -23.216 -7.846 1.00 0.00 C ATOM 1338 C ASN A 89 -9.239 -21.827 -8.159 1.00 0.00 C ATOM 1339 O ASN A 89 -9.035 -21.300 -9.253 1.00 0.00 O ATOM 1340 CB ASN A 89 -7.394 -23.095 -7.043 1.00 0.00 C ATOM 1341 CG ASN A 89 -7.201 -24.249 -6.078 1.00 0.00 C ATOM 1342 OD1 ASN A 89 -8.133 -25.004 -5.802 1.00 0.00 O ATOM 1343 ND2 ASN A 89 -5.987 -24.390 -5.560 1.00 0.00 N ATOM 0 H ASN A 89 -7.501 -23.930 -9.418 1.00 0.00 H new ATOM 0 HA ASN A 89 -9.430 -23.754 -7.252 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -6.548 -23.053 -7.729 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -7.400 -22.157 -6.487 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -5.797 -25.148 -4.905 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -5.244 -23.740 -5.817 1.00 0.00 H new ATOM 1350 N ASP A 90 -9.935 -21.240 -7.192 1.00 0.00 N ATOM 1351 CA ASP A 90 -10.512 -19.911 -7.364 1.00 0.00 C ATOM 1352 C ASP A 90 -9.420 -18.848 -7.419 1.00 0.00 C ATOM 1353 O ASP A 90 -9.665 -17.711 -7.823 1.00 0.00 O ATOM 1354 CB ASP A 90 -11.484 -19.603 -6.225 1.00 0.00 C ATOM 1355 CG ASP A 90 -12.672 -20.545 -6.206 1.00 0.00 C ATOM 1356 OD1 ASP A 90 -13.107 -20.972 -7.296 1.00 0.00 O ATOM 1357 OD2 ASP A 90 -13.167 -20.855 -5.102 1.00 0.00 O ATOM 0 H ASP A 90 -10.114 -21.663 -6.281 1.00 0.00 H new ATOM 0 HA ASP A 90 -11.056 -19.897 -8.309 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -10.957 -19.669 -5.273 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -11.839 -18.577 -6.322 1.00 0.00 H new ATOM 1362 N PHE A 91 -8.213 -19.224 -7.009 1.00 0.00 N ATOM 1363 CA PHE A 91 -7.083 -18.302 -7.009 1.00 0.00 C ATOM 1364 C PHE A 91 -6.504 -18.153 -8.413 1.00 0.00 C ATOM 1365 O PHE A 91 -6.083 -17.067 -8.810 1.00 0.00 O ATOM 1366 CB PHE A 91 -5.999 -18.791 -6.046 1.00 0.00 C ATOM 1367 CG PHE A 91 -6.435 -18.804 -4.609 1.00 0.00 C ATOM 1368 CD1 PHE A 91 -6.329 -17.665 -3.829 1.00 0.00 C ATOM 1369 CD2 PHE A 91 -6.952 -19.956 -4.039 1.00 0.00 C ATOM 1370 CE1 PHE A 91 -6.729 -17.675 -2.506 1.00 0.00 C ATOM 1371 CE2 PHE A 91 -7.354 -19.972 -2.717 1.00 0.00 C ATOM 1372 CZ PHE A 91 -7.243 -18.830 -1.949 1.00 0.00 C ATOM 0 H PHE A 91 -7.992 -20.161 -6.672 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.440 -17.327 -6.677 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -5.695 -19.797 -6.334 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -5.121 -18.152 -6.145 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -5.929 -16.759 -4.259 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -7.042 -20.852 -4.635 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -6.640 -16.780 -1.908 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -7.755 -20.877 -2.285 1.00 0.00 H new ATOM 0 HZ PHE A 91 -7.557 -18.840 -0.916 1.00 0.00 H new ATOM 1382 N ARG A 92 -6.485 -19.253 -9.159 1.00 0.00 N ATOM 1383 CA ARG A 92 -5.955 -19.246 -10.517 1.00 0.00 C ATOM 1384 C ARG A 92 -7.068 -19.003 -11.533 1.00 0.00 C ATOM 1385 O ARG A 92 -6.803 -18.733 -12.704 1.00 0.00 O ATOM 1386 CB ARG A 92 -5.254 -20.571 -10.820 1.00 0.00 C ATOM 1387 CG ARG A 92 -4.323 -21.035 -9.713 1.00 0.00 C ATOM 1388 CD ARG A 92 -4.053 -22.529 -9.801 1.00 0.00 C ATOM 1389 NE ARG A 92 -2.786 -22.895 -9.174 1.00 0.00 N ATOM 1390 CZ ARG A 92 -1.608 -22.786 -9.779 1.00 0.00 C ATOM 1391 NH1 ARG A 92 -1.537 -22.324 -11.020 1.00 0.00 N ATOM 1392 NH2 ARG A 92 -0.499 -23.139 -9.143 1.00 0.00 N ATOM 0 H ARG A 92 -6.831 -20.160 -8.846 1.00 0.00 H new ATOM 0 HA ARG A 92 -5.232 -18.434 -10.594 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -6.007 -21.339 -10.995 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -4.684 -20.468 -11.743 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -3.381 -20.490 -9.776 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -4.763 -20.800 -8.744 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -4.866 -23.073 -9.320 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -4.041 -22.834 -10.847 1.00 0.00 H new ATOM 0 HE ARG A 92 -2.806 -23.254 -8.219 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -2.388 -22.051 -11.512 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -0.632 -22.241 -11.482 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -0.550 -23.495 -8.188 1.00 0.00 H new ATOM 0 HH22 ARG A 92 0.405 -23.055 -9.609 1.00 0.00 H new ATOM 1406 N GLN A 93 -8.312 -19.100 -11.075 1.00 0.00 N ATOM 1407 CA GLN A 93 -9.463 -18.891 -11.944 1.00 0.00 C ATOM 1408 C GLN A 93 -10.024 -17.483 -11.777 1.00 0.00 C ATOM 1409 O GLN A 93 -10.230 -16.764 -12.755 1.00 0.00 O ATOM 1410 CB GLN A 93 -10.550 -19.924 -11.643 1.00 0.00 C ATOM 1411 CG GLN A 93 -10.093 -21.362 -11.834 1.00 0.00 C ATOM 1412 CD GLN A 93 -10.122 -21.796 -13.286 1.00 0.00 C ATOM 1413 OE1 GLN A 93 -11.077 -21.514 -14.011 1.00 0.00 O ATOM 1414 NE2 GLN A 93 -9.074 -22.487 -13.719 1.00 0.00 N ATOM 0 H GLN A 93 -8.548 -19.322 -10.108 1.00 0.00 H new ATOM 0 HA GLN A 93 -9.133 -19.011 -12.976 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -10.890 -19.793 -10.616 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -11.408 -19.735 -12.289 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -9.080 -21.472 -11.446 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -10.732 -22.023 -11.248 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -8.305 -22.698 -13.084 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -9.038 -22.806 -14.687 1.00 0.00 H new ATOM 1423 N LYS A 94 -10.269 -17.093 -10.530 1.00 0.00 N ATOM 1424 CA LYS A 94 -10.805 -15.770 -10.233 1.00 0.00 C ATOM 1425 C LYS A 94 -9.683 -14.746 -10.100 1.00 0.00 C ATOM 1426 O LYS A 94 -9.681 -13.720 -10.782 1.00 0.00 O ATOM 1427 CB LYS A 94 -11.630 -15.809 -8.944 1.00 0.00 C ATOM 1428 CG LYS A 94 -12.624 -16.956 -8.893 1.00 0.00 C ATOM 1429 CD LYS A 94 -13.981 -16.542 -9.436 1.00 0.00 C ATOM 1430 CE LYS A 94 -14.101 -16.839 -10.923 1.00 0.00 C ATOM 1431 NZ LYS A 94 -15.167 -16.022 -11.567 1.00 0.00 N ATOM 0 H LYS A 94 -10.105 -17.675 -9.709 1.00 0.00 H new ATOM 0 HA LYS A 94 -11.449 -15.472 -11.060 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -10.954 -15.887 -8.092 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -12.169 -14.867 -8.839 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -12.241 -17.797 -9.471 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -12.732 -17.300 -7.864 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -14.767 -17.068 -8.894 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -14.134 -15.477 -9.263 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -13.147 -16.641 -11.411 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -14.318 -17.898 -11.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -15.218 -16.253 -12.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -16.082 -16.229 -11.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -14.947 -15.012 -11.453 1.00 0.00 H new ATOM 1445 N LEU A 95 -8.730 -15.030 -9.220 1.00 0.00 N ATOM 1446 CA LEU A 95 -7.600 -14.134 -8.998 1.00 0.00 C ATOM 1447 C LEU A 95 -6.535 -14.324 -10.074 1.00 0.00 C ATOM 1448 O LEU A 95 -5.686 -13.458 -10.282 1.00 0.00 O ATOM 1449 CB LEU A 95 -6.993 -14.378 -7.615 1.00 0.00 C ATOM 1450 CG LEU A 95 -7.849 -13.950 -6.422 1.00 0.00 C ATOM 1451 CD1 LEU A 95 -7.226 -14.427 -5.120 1.00 0.00 C ATOM 1452 CD2 LEU A 95 -8.026 -12.438 -6.408 1.00 0.00 C ATOM 0 H LEU A 95 -8.717 -15.874 -8.648 1.00 0.00 H new ATOM 0 HA LEU A 95 -7.966 -13.109 -9.051 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -6.776 -15.442 -7.518 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.040 -13.852 -7.560 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.832 -14.410 -6.521 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -7.849 -14.113 -4.282 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -7.151 -15.514 -5.129 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -6.231 -13.996 -5.014 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.638 -12.151 -5.553 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -7.050 -11.958 -6.334 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -8.517 -12.121 -7.328 1.00 0.00 H new ATOM 1464 N LYS A 96 -6.587 -15.463 -10.756 1.00 0.00 N ATOM 1465 CA LYS A 96 -5.630 -15.768 -11.813 1.00 0.00 C ATOM 1466 C LYS A 96 -4.199 -15.570 -11.324 1.00 0.00 C ATOM 1467 O LYS A 96 -3.407 -14.874 -11.961 1.00 0.00 O ATOM 1468 CB LYS A 96 -5.890 -14.883 -13.035 1.00 0.00 C ATOM 1469 CG LYS A 96 -7.285 -15.043 -13.615 1.00 0.00 C ATOM 1470 CD LYS A 96 -7.365 -16.236 -14.553 1.00 0.00 C ATOM 1471 CE LYS A 96 -6.986 -15.853 -15.975 1.00 0.00 C ATOM 1472 NZ LYS A 96 -5.512 -15.724 -16.141 1.00 0.00 N ATOM 0 H LYS A 96 -7.283 -16.191 -10.595 1.00 0.00 H new ATOM 0 HA LYS A 96 -5.758 -16.813 -12.095 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -5.738 -13.840 -12.757 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -5.156 -15.117 -13.806 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -8.005 -15.166 -12.806 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -7.563 -14.137 -14.153 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -6.701 -17.024 -14.198 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -8.377 -16.642 -14.542 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -7.365 -16.605 -16.667 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -7.465 -14.909 -16.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -5.259 -15.885 -17.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -5.213 -14.769 -15.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -5.033 -16.428 -15.544 1.00 0.00 H new ATOM 1486 N ILE A 97 -3.874 -16.186 -10.193 1.00 0.00 N ATOM 1487 CA ILE A 97 -2.537 -16.079 -9.622 1.00 0.00 C ATOM 1488 C ILE A 97 -1.511 -16.803 -10.487 1.00 0.00 C ATOM 1489 O ILE A 97 -1.783 -17.874 -11.030 1.00 0.00 O ATOM 1490 CB ILE A 97 -2.487 -16.656 -8.195 1.00 0.00 C ATOM 1491 CG1 ILE A 97 -3.463 -15.907 -7.284 1.00 0.00 C ATOM 1492 CG2 ILE A 97 -1.072 -16.578 -7.642 1.00 0.00 C ATOM 1493 CD1 ILE A 97 -3.124 -14.443 -7.110 1.00 0.00 C ATOM 0 H ILE A 97 -4.518 -16.765 -9.654 1.00 0.00 H new ATOM 0 HA ILE A 97 -2.293 -15.017 -9.585 1.00 0.00 H new ATOM 0 HB ILE A 97 -2.785 -17.704 -8.232 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -4.469 -15.992 -7.695 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -3.476 -16.387 -6.306 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -1.053 -16.989 -6.633 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -0.400 -17.151 -8.281 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.748 -15.537 -7.616 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -3.857 -13.975 -6.453 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -2.131 -14.349 -6.671 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -3.139 -13.948 -8.081 1.00 0.00 H new ATOM 1505 N THR A 98 -0.326 -16.211 -10.610 1.00 0.00 N ATOM 1506 CA THR A 98 0.742 -16.799 -11.408 1.00 0.00 C ATOM 1507 C THR A 98 1.523 -17.833 -10.605 1.00 0.00 C ATOM 1508 O THR A 98 1.522 -19.018 -10.934 1.00 0.00 O ATOM 1509 CB THR A 98 1.717 -15.722 -11.922 1.00 0.00 C ATOM 1510 OG1 THR A 98 0.988 -14.657 -12.542 1.00 0.00 O ATOM 1511 CG2 THR A 98 2.703 -16.315 -12.916 1.00 0.00 C ATOM 0 H THR A 98 -0.083 -15.325 -10.167 1.00 0.00 H new ATOM 0 HA THR A 98 0.268 -17.287 -12.260 1.00 0.00 H new ATOM 0 HB THR A 98 2.275 -15.332 -11.071 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.615 -13.976 -12.864 1.00 0.00 H new ATOM 0 HG21 THR A 98 3.381 -15.536 -13.265 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.277 -17.105 -12.432 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.159 -16.729 -13.765 1.00 0.00 H new ATOM 1519 N ALA A 99 2.188 -17.376 -9.549 1.00 0.00 N ATOM 1520 CA ALA A 99 2.971 -18.263 -8.697 1.00 0.00 C ATOM 1521 C ALA A 99 3.139 -17.675 -7.300 1.00 0.00 C ATOM 1522 O ALA A 99 3.604 -16.546 -7.142 1.00 0.00 O ATOM 1523 CB ALA A 99 4.330 -18.533 -9.324 1.00 0.00 C ATOM 0 H ALA A 99 2.200 -16.397 -9.263 1.00 0.00 H new ATOM 0 HA ALA A 99 2.432 -19.206 -8.604 1.00 0.00 H new ATOM 0 HB1 ALA A 99 4.904 -19.197 -8.677 1.00 0.00 H new ATOM 0 HB2 ALA A 99 4.194 -19.004 -10.298 1.00 0.00 H new ATOM 0 HB3 ALA A 99 4.867 -17.593 -9.447 1.00 0.00 H new ATOM 1529 N VAL A 100 2.755 -18.447 -6.288 1.00 0.00 N ATOM 1530 CA VAL A 100 2.864 -18.003 -4.903 1.00 0.00 C ATOM 1531 C VAL A 100 4.294 -18.141 -4.392 1.00 0.00 C ATOM 1532 O VAL A 100 5.041 -19.031 -4.799 1.00 0.00 O ATOM 1533 CB VAL A 100 1.922 -18.800 -3.982 1.00 0.00 C ATOM 1534 CG1 VAL A 100 0.485 -18.699 -4.471 1.00 0.00 C ATOM 1535 CG2 VAL A 100 2.364 -20.253 -3.899 1.00 0.00 C ATOM 0 H VAL A 100 2.366 -19.383 -6.401 1.00 0.00 H new ATOM 0 HA VAL A 100 2.575 -16.952 -4.884 1.00 0.00 H new ATOM 0 HB VAL A 100 1.971 -18.371 -2.981 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -0.166 -19.268 -3.808 1.00 0.00 H new ATOM 0 HG12 VAL A 100 0.175 -17.654 -4.475 1.00 0.00 H new ATOM 0 HG13 VAL A 100 0.415 -19.102 -5.481 1.00 0.00 H new ATOM 0 HG21 VAL A 100 1.688 -20.802 -3.244 1.00 0.00 H new ATOM 0 HG22 VAL A 100 2.345 -20.697 -4.895 1.00 0.00 H new ATOM 0 HG23 VAL A 100 3.377 -20.303 -3.499 1.00 0.00 H new ATOM 1545 N PRO A 101 4.685 -17.240 -3.478 1.00 0.00 N ATOM 1546 CA PRO A 101 3.804 -16.176 -2.988 1.00 0.00 C ATOM 1547 C PRO A 101 3.522 -15.120 -4.051 1.00 0.00 C ATOM 1548 O PRO A 101 4.399 -14.772 -4.843 1.00 0.00 O ATOM 1549 CB PRO A 101 4.595 -15.568 -1.827 1.00 0.00 C ATOM 1550 CG PRO A 101 6.020 -15.867 -2.141 1.00 0.00 C ATOM 1551 CD PRO A 101 6.018 -17.191 -2.854 1.00 0.00 C ATOM 0 HA PRO A 101 2.824 -16.558 -2.701 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.423 -14.494 -1.751 1.00 0.00 H new ATOM 0 HB3 PRO A 101 4.299 -16.007 -0.874 1.00 0.00 H new ATOM 0 HG2 PRO A 101 6.454 -15.087 -2.767 1.00 0.00 H new ATOM 0 HG3 PRO A 101 6.618 -15.915 -1.231 1.00 0.00 H new ATOM 0 HD2 PRO A 101 6.812 -17.248 -3.598 1.00 0.00 H new ATOM 0 HD3 PRO A 101 6.169 -18.020 -2.163 1.00 0.00 H new ATOM 1559 N THR A 102 2.294 -14.613 -4.064 1.00 0.00 N ATOM 1560 CA THR A 102 1.896 -13.597 -5.030 1.00 0.00 C ATOM 1561 C THR A 102 1.438 -12.322 -4.331 1.00 0.00 C ATOM 1562 O THR A 102 0.429 -12.318 -3.624 1.00 0.00 O ATOM 1563 CB THR A 102 0.764 -14.103 -5.944 1.00 0.00 C ATOM 1564 OG1 THR A 102 1.114 -15.376 -6.499 1.00 0.00 O ATOM 1565 CG2 THR A 102 0.491 -13.113 -7.066 1.00 0.00 C ATOM 0 H THR A 102 1.557 -14.890 -3.416 1.00 0.00 H new ATOM 0 HA THR A 102 2.774 -13.379 -5.638 1.00 0.00 H new ATOM 0 HB THR A 102 -0.140 -14.205 -5.343 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.082 -15.414 -6.646 1.00 0.00 H new ATOM 0 HG21 THR A 102 -0.312 -13.492 -7.698 1.00 0.00 H new ATOM 0 HG22 THR A 102 0.196 -12.154 -6.641 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.393 -12.983 -7.664 1.00 0.00 H new ATOM 1573 N LEU A 103 2.184 -11.242 -4.533 1.00 0.00 N ATOM 1574 CA LEU A 103 1.853 -9.959 -3.922 1.00 0.00 C ATOM 1575 C LEU A 103 1.132 -9.053 -4.915 1.00 0.00 C ATOM 1576 O LEU A 103 1.765 -8.353 -5.706 1.00 0.00 O ATOM 1577 CB LEU A 103 3.122 -9.271 -3.415 1.00 0.00 C ATOM 1578 CG LEU A 103 2.918 -7.952 -2.669 1.00 0.00 C ATOM 1579 CD1 LEU A 103 2.236 -8.195 -1.332 1.00 0.00 C ATOM 1580 CD2 LEU A 103 4.249 -7.241 -2.470 1.00 0.00 C ATOM 0 H LEU A 103 3.022 -11.229 -5.115 1.00 0.00 H new ATOM 0 HA LEU A 103 1.187 -10.146 -3.080 1.00 0.00 H new ATOM 0 HB2 LEU A 103 3.646 -9.961 -2.755 1.00 0.00 H new ATOM 0 HB3 LEU A 103 3.776 -9.086 -4.267 1.00 0.00 H new ATOM 0 HG LEU A 103 2.273 -7.312 -3.271 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.099 -7.245 -0.815 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.265 -8.661 -1.498 1.00 0.00 H new ATOM 0 HD13 LEU A 103 2.855 -8.854 -0.722 1.00 0.00 H new ATOM 0 HD21 LEU A 103 4.085 -6.304 -1.937 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.918 -7.876 -1.889 1.00 0.00 H new ATOM 0 HD23 LEU A 103 4.699 -7.033 -3.441 1.00 0.00 H new ATOM 1592 N LEU A 104 -0.196 -9.069 -4.866 1.00 0.00 N ATOM 1593 CA LEU A 104 -1.004 -8.247 -5.759 1.00 0.00 C ATOM 1594 C LEU A 104 -1.454 -6.966 -5.063 1.00 0.00 C ATOM 1595 O LEU A 104 -2.019 -7.006 -3.970 1.00 0.00 O ATOM 1596 CB LEU A 104 -2.224 -9.033 -6.243 1.00 0.00 C ATOM 1597 CG LEU A 104 -3.424 -8.199 -6.695 1.00 0.00 C ATOM 1598 CD1 LEU A 104 -3.152 -7.563 -8.049 1.00 0.00 C ATOM 1599 CD2 LEU A 104 -4.680 -9.057 -6.748 1.00 0.00 C ATOM 0 H LEU A 104 -0.735 -9.642 -4.217 1.00 0.00 H new ATOM 0 HA LEU A 104 -0.390 -7.975 -6.618 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -1.916 -9.669 -7.073 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.548 -9.693 -5.439 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.583 -7.402 -5.968 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.017 -6.974 -8.354 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.278 -6.915 -7.978 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.966 -8.343 -8.787 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.524 -8.447 -7.071 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -4.532 -9.875 -7.453 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.885 -9.464 -5.758 1.00 0.00 H new ATOM 1611 N LYS A 105 -1.201 -5.830 -5.704 1.00 0.00 N ATOM 1612 CA LYS A 105 -1.582 -4.537 -5.150 1.00 0.00 C ATOM 1613 C LYS A 105 -2.977 -4.134 -5.617 1.00 0.00 C ATOM 1614 O LYS A 105 -3.136 -3.526 -6.676 1.00 0.00 O ATOM 1615 CB LYS A 105 -0.567 -3.466 -5.556 1.00 0.00 C ATOM 1616 CG LYS A 105 -0.787 -2.128 -4.871 1.00 0.00 C ATOM 1617 CD LYS A 105 0.376 -1.180 -5.112 1.00 0.00 C ATOM 1618 CE LYS A 105 0.034 0.240 -4.688 1.00 0.00 C ATOM 1619 NZ LYS A 105 0.887 1.246 -5.381 1.00 0.00 N ATOM 0 H LYS A 105 -0.733 -5.779 -6.609 1.00 0.00 H new ATOM 0 HA LYS A 105 -1.594 -4.625 -4.064 1.00 0.00 H new ATOM 0 HB2 LYS A 105 0.437 -3.822 -5.325 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -0.614 -3.324 -6.636 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -1.708 -1.677 -5.240 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -0.915 -2.283 -3.800 1.00 0.00 H new ATOM 0 HD2 LYS A 105 1.249 -1.526 -4.559 1.00 0.00 H new ATOM 0 HD3 LYS A 105 0.643 -1.191 -6.169 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -1.015 0.441 -4.906 1.00 0.00 H new ATOM 0 HE3 LYS A 105 0.160 0.338 -3.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 0.623 2.201 -5.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 1.886 1.070 -5.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 0.748 1.170 -6.409 1.00 0.00 H new ATOM 1633 N TYR A 106 -3.984 -4.474 -4.821 1.00 0.00 N ATOM 1634 CA TYR A 106 -5.365 -4.149 -5.154 1.00 0.00 C ATOM 1635 C TYR A 106 -5.486 -2.704 -5.628 1.00 0.00 C ATOM 1636 O TYR A 106 -5.317 -1.767 -4.849 1.00 0.00 O ATOM 1637 CB TYR A 106 -6.271 -4.377 -3.943 1.00 0.00 C ATOM 1638 CG TYR A 106 -7.683 -4.777 -4.309 1.00 0.00 C ATOM 1639 CD1 TYR A 106 -7.946 -6.006 -4.900 1.00 0.00 C ATOM 1640 CD2 TYR A 106 -8.753 -3.925 -4.063 1.00 0.00 C ATOM 1641 CE1 TYR A 106 -9.234 -6.375 -5.238 1.00 0.00 C ATOM 1642 CE2 TYR A 106 -10.044 -4.287 -4.396 1.00 0.00 C ATOM 1643 CZ TYR A 106 -10.280 -5.512 -4.983 1.00 0.00 C ATOM 1644 OH TYR A 106 -11.564 -5.877 -5.316 1.00 0.00 O ATOM 0 H TYR A 106 -3.870 -4.975 -3.940 1.00 0.00 H new ATOM 0 HA TYR A 106 -5.680 -4.806 -5.965 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.834 -5.153 -3.314 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -6.304 -3.465 -3.347 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -7.130 -6.685 -5.099 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -8.572 -2.964 -3.604 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -9.421 -7.334 -5.699 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -10.865 -3.614 -4.197 1.00 0.00 H new ATOM 0 HH TYR A 106 -12.183 -5.158 -5.069 1.00 0.00 H new ATOM 1654 N GLY A 107 -5.779 -2.532 -6.914 1.00 0.00 N ATOM 1655 CA GLY A 107 -5.917 -1.199 -7.471 1.00 0.00 C ATOM 1656 C GLY A 107 -5.016 -0.975 -8.669 1.00 0.00 C ATOM 1657 O GLY A 107 -5.349 -0.206 -9.571 1.00 0.00 O ATOM 0 H GLY A 107 -5.923 -3.292 -7.579 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.954 -1.037 -7.765 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.685 -0.462 -6.703 1.00 0.00 H new ATOM 1661 N THR A 108 -3.869 -1.647 -8.679 1.00 0.00 N ATOM 1662 CA THR A 108 -2.915 -1.516 -9.773 1.00 0.00 C ATOM 1663 C THR A 108 -2.437 -2.881 -10.252 1.00 0.00 C ATOM 1664 O THR A 108 -2.348 -3.840 -9.484 1.00 0.00 O ATOM 1665 CB THR A 108 -1.695 -0.674 -9.356 1.00 0.00 C ATOM 1666 OG1 THR A 108 -1.002 -1.314 -8.279 1.00 0.00 O ATOM 1667 CG2 THR A 108 -2.121 0.724 -8.932 1.00 0.00 C ATOM 0 H THR A 108 -3.578 -2.288 -7.941 1.00 0.00 H new ATOM 0 HA THR A 108 -3.435 -1.011 -10.587 1.00 0.00 H new ATOM 0 HB THR A 108 -1.030 -0.589 -10.215 1.00 0.00 H new ATOM 0 HG1 THR A 108 -0.085 -0.971 -8.230 1.00 0.00 H new ATOM 0 HG21 THR A 108 -1.242 1.300 -8.642 1.00 0.00 H new ATOM 0 HG22 THR A 108 -2.621 1.220 -9.764 1.00 0.00 H new ATOM 0 HG23 THR A 108 -2.805 0.655 -8.086 1.00 0.00 H new ATOM 1675 N PRO A 109 -2.119 -2.975 -11.552 1.00 0.00 N ATOM 1676 CA PRO A 109 -1.642 -4.220 -12.162 1.00 0.00 C ATOM 1677 C PRO A 109 -0.241 -4.597 -11.692 1.00 0.00 C ATOM 1678 O PRO A 109 0.315 -5.608 -12.119 1.00 0.00 O ATOM 1679 CB PRO A 109 -1.635 -3.901 -13.659 1.00 0.00 C ATOM 1680 CG PRO A 109 -1.486 -2.421 -13.730 1.00 0.00 C ATOM 1681 CD PRO A 109 -2.200 -1.874 -12.525 1.00 0.00 C ATOM 0 HA PRO A 109 -2.270 -5.071 -11.896 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -0.814 -4.406 -14.168 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -2.557 -4.229 -14.138 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -0.434 -2.134 -13.724 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -1.918 -2.029 -14.651 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -1.720 -0.970 -12.150 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -3.234 -1.615 -12.754 1.00 0.00 H new ATOM 1689 N GLN A 110 0.322 -3.778 -10.809 1.00 0.00 N ATOM 1690 CA GLN A 110 1.658 -4.027 -10.281 1.00 0.00 C ATOM 1691 C GLN A 110 1.625 -5.103 -9.202 1.00 0.00 C ATOM 1692 O GLN A 110 0.944 -4.959 -8.186 1.00 0.00 O ATOM 1693 CB GLN A 110 2.254 -2.737 -9.714 1.00 0.00 C ATOM 1694 CG GLN A 110 2.922 -1.863 -10.763 1.00 0.00 C ATOM 1695 CD GLN A 110 3.940 -0.911 -10.167 1.00 0.00 C ATOM 1696 OE1 GLN A 110 5.129 -0.980 -10.480 1.00 0.00 O ATOM 1697 NE2 GLN A 110 3.478 -0.014 -9.303 1.00 0.00 N ATOM 0 H GLN A 110 -0.126 -2.937 -10.445 1.00 0.00 H new ATOM 0 HA GLN A 110 2.285 -4.379 -11.100 1.00 0.00 H new ATOM 0 HB2 GLN A 110 1.464 -2.165 -9.226 1.00 0.00 H new ATOM 0 HB3 GLN A 110 2.985 -2.991 -8.946 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.412 -2.498 -11.501 1.00 0.00 H new ATOM 0 HG3 GLN A 110 2.160 -1.290 -11.292 1.00 0.00 H new ATOM 0 HE21 GLN A 110 2.485 0.007 -9.072 1.00 0.00 H new ATOM 0 HE22 GLN A 110 4.117 0.653 -8.870 1.00 0.00 H new ATOM 1706 N LYS A 111 2.365 -6.184 -9.428 1.00 0.00 N ATOM 1707 CA LYS A 111 2.422 -7.285 -8.474 1.00 0.00 C ATOM 1708 C LYS A 111 3.833 -7.860 -8.391 1.00 0.00 C ATOM 1709 O LYS A 111 4.639 -7.690 -9.307 1.00 0.00 O ATOM 1710 CB LYS A 111 1.435 -8.384 -8.874 1.00 0.00 C ATOM 1711 CG LYS A 111 1.497 -8.751 -10.347 1.00 0.00 C ATOM 1712 CD LYS A 111 2.530 -9.834 -10.609 1.00 0.00 C ATOM 1713 CE LYS A 111 2.089 -11.174 -10.040 1.00 0.00 C ATOM 1714 NZ LYS A 111 2.550 -11.359 -8.636 1.00 0.00 N ATOM 0 H LYS A 111 2.933 -6.321 -10.264 1.00 0.00 H new ATOM 0 HA LYS A 111 2.148 -6.898 -7.493 1.00 0.00 H new ATOM 0 HB2 LYS A 111 1.634 -9.274 -8.278 1.00 0.00 H new ATOM 0 HB3 LYS A 111 0.423 -8.058 -8.632 1.00 0.00 H new ATOM 0 HG2 LYS A 111 0.517 -9.094 -10.679 1.00 0.00 H new ATOM 0 HG3 LYS A 111 1.740 -7.865 -10.934 1.00 0.00 H new ATOM 0 HD2 LYS A 111 2.694 -9.930 -11.682 1.00 0.00 H new ATOM 0 HD3 LYS A 111 3.483 -9.545 -10.165 1.00 0.00 H new ATOM 0 HE2 LYS A 111 1.002 -11.244 -10.078 1.00 0.00 H new ATOM 0 HE3 LYS A 111 2.482 -11.979 -10.661 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 2.894 -12.332 -8.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 3.320 -10.691 -8.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 1.758 -11.184 -7.985 1.00 0.00 H new ATOM 1728 N LEU A 112 4.125 -8.541 -7.289 1.00 0.00 N ATOM 1729 CA LEU A 112 5.439 -9.143 -7.086 1.00 0.00 C ATOM 1730 C LEU A 112 5.322 -10.651 -6.887 1.00 0.00 C ATOM 1731 O LEU A 112 4.651 -11.116 -5.966 1.00 0.00 O ATOM 1732 CB LEU A 112 6.131 -8.509 -5.879 1.00 0.00 C ATOM 1733 CG LEU A 112 6.199 -6.982 -5.869 1.00 0.00 C ATOM 1734 CD1 LEU A 112 6.847 -6.484 -4.586 1.00 0.00 C ATOM 1735 CD2 LEU A 112 6.961 -6.474 -7.085 1.00 0.00 C ATOM 0 H LEU A 112 3.470 -8.691 -6.522 1.00 0.00 H new ATOM 0 HA LEU A 112 6.038 -8.959 -7.978 1.00 0.00 H new ATOM 0 HB2 LEU A 112 5.614 -8.835 -4.977 1.00 0.00 H new ATOM 0 HB3 LEU A 112 7.148 -8.898 -5.823 1.00 0.00 H new ATOM 0 HG LEU A 112 5.182 -6.592 -5.913 1.00 0.00 H new ATOM 0 HD11 LEU A 112 6.886 -5.395 -4.597 1.00 0.00 H new ATOM 0 HD12 LEU A 112 6.261 -6.817 -3.729 1.00 0.00 H new ATOM 0 HD13 LEU A 112 7.859 -6.883 -4.511 1.00 0.00 H new ATOM 0 HD21 LEU A 112 6.999 -5.385 -7.061 1.00 0.00 H new ATOM 0 HD22 LEU A 112 7.975 -6.873 -7.072 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.455 -6.800 -7.994 1.00 0.00 H new ATOM 1747 N VAL A 113 5.982 -11.410 -7.756 1.00 0.00 N ATOM 1748 CA VAL A 113 5.956 -12.866 -7.674 1.00 0.00 C ATOM 1749 C VAL A 113 7.010 -13.380 -6.700 1.00 0.00 C ATOM 1750 O VAL A 113 7.803 -12.607 -6.164 1.00 0.00 O ATOM 1751 CB VAL A 113 6.188 -13.510 -9.053 1.00 0.00 C ATOM 1752 CG1 VAL A 113 5.450 -14.836 -9.154 1.00 0.00 C ATOM 1753 CG2 VAL A 113 5.755 -12.564 -10.162 1.00 0.00 C ATOM 0 H VAL A 113 6.541 -11.041 -8.525 1.00 0.00 H new ATOM 0 HA VAL A 113 4.966 -13.145 -7.314 1.00 0.00 H new ATOM 0 HB VAL A 113 7.254 -13.705 -9.169 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.626 -15.276 -10.135 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.813 -15.514 -8.382 1.00 0.00 H new ATOM 0 HG13 VAL A 113 4.382 -14.669 -9.017 1.00 0.00 H new ATOM 0 HG21 VAL A 113 5.926 -13.035 -11.130 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.695 -12.335 -10.052 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.333 -11.642 -10.100 1.00 0.00 H new ATOM 1763 N GLU A 114 7.012 -14.691 -6.477 1.00 0.00 N ATOM 1764 CA GLU A 114 7.970 -15.309 -5.568 1.00 0.00 C ATOM 1765 C GLU A 114 9.302 -14.563 -5.591 1.00 0.00 C ATOM 1766 O GLU A 114 9.720 -13.986 -4.588 1.00 0.00 O ATOM 1767 CB GLU A 114 8.188 -16.776 -5.941 1.00 0.00 C ATOM 1768 CG GLU A 114 6.903 -17.519 -6.268 1.00 0.00 C ATOM 1769 CD GLU A 114 7.092 -19.022 -6.310 1.00 0.00 C ATOM 1770 OE1 GLU A 114 8.070 -19.515 -5.708 1.00 0.00 O ATOM 1771 OE2 GLU A 114 6.262 -19.707 -6.944 1.00 0.00 O ATOM 0 H GLU A 114 6.362 -15.345 -6.913 1.00 0.00 H new ATOM 0 HA GLU A 114 7.561 -15.255 -4.559 1.00 0.00 H new ATOM 0 HB2 GLU A 114 8.856 -16.828 -6.800 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.690 -17.281 -5.116 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.146 -17.273 -5.523 1.00 0.00 H new ATOM 0 HG3 GLU A 114 6.525 -17.177 -7.232 1.00 0.00 H new ATOM 1778 N SER A 115 9.963 -14.581 -6.744 1.00 0.00 N ATOM 1779 CA SER A 115 11.249 -13.911 -6.898 1.00 0.00 C ATOM 1780 C SER A 115 11.145 -12.440 -6.509 1.00 0.00 C ATOM 1781 O SER A 115 12.010 -11.910 -5.812 1.00 0.00 O ATOM 1782 CB SER A 115 11.742 -14.035 -8.341 1.00 0.00 C ATOM 1783 OG SER A 115 13.158 -14.021 -8.399 1.00 0.00 O ATOM 0 H SER A 115 9.629 -15.052 -7.585 1.00 0.00 H new ATOM 0 HA SER A 115 11.965 -14.395 -6.234 1.00 0.00 H new ATOM 0 HB2 SER A 115 11.366 -14.960 -8.779 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.342 -13.215 -8.937 1.00 0.00 H new ATOM 0 HG SER A 115 13.448 -14.103 -9.331 1.00 0.00 H new ATOM 1789 N GLU A 116 10.080 -11.787 -6.963 1.00 0.00 N ATOM 1790 CA GLU A 116 9.864 -10.377 -6.663 1.00 0.00 C ATOM 1791 C GLU A 116 9.423 -10.191 -5.214 1.00 0.00 C ATOM 1792 O GLU A 116 9.379 -9.069 -4.707 1.00 0.00 O ATOM 1793 CB GLU A 116 8.814 -9.787 -7.607 1.00 0.00 C ATOM 1794 CG GLU A 116 9.044 -10.135 -9.068 1.00 0.00 C ATOM 1795 CD GLU A 116 8.338 -9.183 -10.013 1.00 0.00 C ATOM 1796 OE1 GLU A 116 8.841 -8.056 -10.205 1.00 0.00 O ATOM 1797 OE2 GLU A 116 7.282 -9.564 -10.560 1.00 0.00 O ATOM 0 H GLU A 116 9.354 -12.212 -7.540 1.00 0.00 H new ATOM 0 HA GLU A 116 10.808 -9.852 -6.808 1.00 0.00 H new ATOM 0 HB2 GLU A 116 7.828 -10.143 -7.308 1.00 0.00 H new ATOM 0 HB3 GLU A 116 8.808 -8.703 -7.497 1.00 0.00 H new ATOM 0 HG2 GLU A 116 10.114 -10.121 -9.277 1.00 0.00 H new ATOM 0 HG3 GLU A 116 8.696 -11.151 -9.255 1.00 0.00 H new ATOM 1804 N CYS A 117 9.097 -11.297 -4.555 1.00 0.00 N ATOM 1805 CA CYS A 117 8.657 -11.256 -3.164 1.00 0.00 C ATOM 1806 C CYS A 117 9.845 -11.381 -2.215 1.00 0.00 C ATOM 1807 O CYS A 117 9.747 -11.042 -1.035 1.00 0.00 O ATOM 1808 CB CYS A 117 7.652 -12.376 -2.892 1.00 0.00 C ATOM 1809 SG CYS A 117 5.979 -12.024 -3.479 1.00 0.00 S ATOM 0 H CYS A 117 9.129 -12.232 -4.960 1.00 0.00 H new ATOM 0 HA CYS A 117 8.174 -10.294 -2.989 1.00 0.00 H new ATOM 0 HB2 CYS A 117 8.007 -13.291 -3.366 1.00 0.00 H new ATOM 0 HB3 CYS A 117 7.617 -12.566 -1.819 1.00 0.00 H new ATOM 0 HG CYS A 117 6.009 -11.784 -4.756 1.00 0.00 H new ATOM 1815 N CYS A 118 10.964 -11.870 -2.738 1.00 0.00 N ATOM 1816 CA CYS A 118 12.170 -12.043 -1.936 1.00 0.00 C ATOM 1817 C CYS A 118 13.175 -10.931 -2.220 1.00 0.00 C ATOM 1818 O CYS A 118 14.148 -10.759 -1.486 1.00 0.00 O ATOM 1819 CB CYS A 118 12.806 -13.405 -2.219 1.00 0.00 C ATOM 1820 SG CYS A 118 14.366 -13.687 -1.350 1.00 0.00 S ATOM 0 H CYS A 118 11.061 -12.153 -3.713 1.00 0.00 H new ATOM 0 HA CYS A 118 11.887 -11.994 -0.884 1.00 0.00 H new ATOM 0 HB2 CYS A 118 12.101 -14.188 -1.940 1.00 0.00 H new ATOM 0 HB3 CYS A 118 12.978 -13.498 -3.291 1.00 0.00 H new ATOM 0 HG CYS A 118 14.890 -12.545 -1.017 1.00 0.00 H new ATOM 1826 N GLN A 119 12.932 -10.180 -3.289 1.00 0.00 N ATOM 1827 CA GLN A 119 13.817 -9.085 -3.670 1.00 0.00 C ATOM 1828 C GLN A 119 13.319 -7.760 -3.104 1.00 0.00 C ATOM 1829 O GLN A 119 12.525 -7.063 -3.736 1.00 0.00 O ATOM 1830 CB GLN A 119 13.924 -8.995 -5.194 1.00 0.00 C ATOM 1831 CG GLN A 119 15.003 -9.890 -5.782 1.00 0.00 C ATOM 1832 CD GLN A 119 15.154 -11.196 -5.026 1.00 0.00 C ATOM 1833 OE1 GLN A 119 15.846 -11.262 -4.010 1.00 0.00 O ATOM 1834 NE2 GLN A 119 14.506 -12.244 -5.520 1.00 0.00 N ATOM 0 H GLN A 119 12.130 -10.309 -3.906 1.00 0.00 H new ATOM 0 HA GLN A 119 14.804 -9.288 -3.255 1.00 0.00 H new ATOM 0 HB2 GLN A 119 12.963 -9.262 -5.634 1.00 0.00 H new ATOM 0 HB3 GLN A 119 14.128 -7.962 -5.475 1.00 0.00 H new ATOM 0 HG2 GLN A 119 14.765 -10.103 -6.824 1.00 0.00 H new ATOM 0 HG3 GLN A 119 15.955 -9.358 -5.775 1.00 0.00 H new ATOM 0 HE21 GLN A 119 13.943 -12.144 -6.365 1.00 0.00 H new ATOM 0 HE22 GLN A 119 14.571 -13.149 -5.055 1.00 0.00 H new ATOM 1843 N SER A 120 13.792 -7.417 -1.910 1.00 0.00 N ATOM 1844 CA SER A 120 13.391 -6.177 -1.257 1.00 0.00 C ATOM 1845 C SER A 120 13.383 -5.018 -2.249 1.00 0.00 C ATOM 1846 O SER A 120 12.420 -4.256 -2.323 1.00 0.00 O ATOM 1847 CB SER A 120 14.333 -5.861 -0.093 1.00 0.00 C ATOM 1848 OG SER A 120 13.709 -5.007 0.850 1.00 0.00 O ATOM 0 H SER A 120 14.453 -7.981 -1.376 1.00 0.00 H new ATOM 0 HA SER A 120 12.380 -6.309 -0.871 1.00 0.00 H new ATOM 0 HB2 SER A 120 14.636 -6.787 0.395 1.00 0.00 H new ATOM 0 HB3 SER A 120 15.239 -5.389 -0.472 1.00 0.00 H new ATOM 0 HG SER A 120 14.330 -4.821 1.585 1.00 0.00 H new ATOM 1854 N SER A 121 14.466 -4.892 -3.010 1.00 0.00 N ATOM 1855 CA SER A 121 14.587 -3.824 -3.996 1.00 0.00 C ATOM 1856 C SER A 121 13.249 -3.560 -4.679 1.00 0.00 C ATOM 1857 O SER A 121 12.919 -2.419 -5.004 1.00 0.00 O ATOM 1858 CB SER A 121 15.644 -4.185 -5.042 1.00 0.00 C ATOM 1859 OG SER A 121 15.640 -3.256 -6.112 1.00 0.00 O ATOM 0 H SER A 121 15.272 -5.516 -2.963 1.00 0.00 H new ATOM 0 HA SER A 121 14.895 -2.917 -3.476 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.629 -4.204 -4.576 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.453 -5.187 -5.426 1.00 0.00 H new ATOM 0 HG SER A 121 16.325 -3.508 -6.766 1.00 0.00 H new ATOM 1865 N LEU A 122 12.481 -4.624 -4.892 1.00 0.00 N ATOM 1866 CA LEU A 122 11.177 -4.509 -5.536 1.00 0.00 C ATOM 1867 C LEU A 122 10.081 -4.261 -4.506 1.00 0.00 C ATOM 1868 O LEU A 122 9.123 -3.532 -4.766 1.00 0.00 O ATOM 1869 CB LEU A 122 10.867 -5.777 -6.333 1.00 0.00 C ATOM 1870 CG LEU A 122 11.802 -6.080 -7.504 1.00 0.00 C ATOM 1871 CD1 LEU A 122 11.683 -7.538 -7.919 1.00 0.00 C ATOM 1872 CD2 LEU A 122 11.499 -5.163 -8.680 1.00 0.00 C ATOM 0 H LEU A 122 12.739 -5.575 -4.628 1.00 0.00 H new ATOM 0 HA LEU A 122 11.209 -3.658 -6.217 1.00 0.00 H new ATOM 0 HB2 LEU A 122 10.887 -6.626 -5.649 1.00 0.00 H new ATOM 0 HB3 LEU A 122 9.850 -5.701 -6.717 1.00 0.00 H new ATOM 0 HG LEU A 122 12.827 -5.898 -7.181 1.00 0.00 H new ATOM 0 HD11 LEU A 122 12.356 -7.735 -8.754 1.00 0.00 H new ATOM 0 HD12 LEU A 122 11.950 -8.179 -7.079 1.00 0.00 H new ATOM 0 HD13 LEU A 122 10.657 -7.747 -8.223 1.00 0.00 H new ATOM 0 HD21 LEU A 122 12.174 -5.393 -9.504 1.00 0.00 H new ATOM 0 HD22 LEU A 122 10.469 -5.313 -9.002 1.00 0.00 H new ATOM 0 HD23 LEU A 122 11.637 -4.125 -8.377 1.00 0.00 H new ATOM 1884 N VAL A 123 10.229 -4.870 -3.333 1.00 0.00 N ATOM 1885 CA VAL A 123 9.253 -4.713 -2.262 1.00 0.00 C ATOM 1886 C VAL A 123 9.174 -3.262 -1.799 1.00 0.00 C ATOM 1887 O VAL A 123 8.088 -2.693 -1.695 1.00 0.00 O ATOM 1888 CB VAL A 123 9.596 -5.607 -1.055 1.00 0.00 C ATOM 1889 CG1 VAL A 123 8.634 -5.345 0.094 1.00 0.00 C ATOM 1890 CG2 VAL A 123 9.573 -7.074 -1.456 1.00 0.00 C ATOM 0 H VAL A 123 11.016 -5.476 -3.101 1.00 0.00 H new ATOM 0 HA VAL A 123 8.287 -5.016 -2.667 1.00 0.00 H new ATOM 0 HB VAL A 123 10.603 -5.362 -0.717 1.00 0.00 H new ATOM 0 HG11 VAL A 123 8.892 -5.985 0.938 1.00 0.00 H new ATOM 0 HG12 VAL A 123 8.705 -4.300 0.397 1.00 0.00 H new ATOM 0 HG13 VAL A 123 7.615 -5.561 -0.228 1.00 0.00 H new ATOM 0 HG21 VAL A 123 9.817 -7.691 -0.592 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.580 -7.336 -1.820 1.00 0.00 H new ATOM 0 HG23 VAL A 123 10.306 -7.247 -2.244 1.00 0.00 H new ATOM 1900 N GLU A 124 10.332 -2.671 -1.523 1.00 0.00 N ATOM 1901 CA GLU A 124 10.392 -1.286 -1.071 1.00 0.00 C ATOM 1902 C GLU A 124 9.975 -0.331 -2.186 1.00 0.00 C ATOM 1903 O GLU A 124 9.708 0.846 -1.942 1.00 0.00 O ATOM 1904 CB GLU A 124 11.805 -0.943 -0.594 1.00 0.00 C ATOM 1905 CG GLU A 124 12.845 -0.968 -1.702 1.00 0.00 C ATOM 1906 CD GLU A 124 14.179 -0.397 -1.263 1.00 0.00 C ATOM 1907 OE1 GLU A 124 14.189 0.705 -0.675 1.00 0.00 O ATOM 1908 OE2 GLU A 124 15.214 -1.052 -1.507 1.00 0.00 O ATOM 0 H GLU A 124 11.240 -3.129 -1.604 1.00 0.00 H new ATOM 0 HA GLU A 124 9.697 -1.172 -0.239 1.00 0.00 H new ATOM 0 HB2 GLU A 124 11.795 0.047 -0.139 1.00 0.00 H new ATOM 0 HB3 GLU A 124 12.098 -1.648 0.184 1.00 0.00 H new ATOM 0 HG2 GLU A 124 12.987 -1.995 -2.039 1.00 0.00 H new ATOM 0 HG3 GLU A 124 12.474 -0.401 -2.556 1.00 0.00 H new ATOM 1915 N MET A 125 9.922 -0.846 -3.409 1.00 0.00 N ATOM 1916 CA MET A 125 9.536 -0.040 -4.562 1.00 0.00 C ATOM 1917 C MET A 125 8.019 -0.011 -4.722 1.00 0.00 C ATOM 1918 O MET A 125 7.403 1.054 -4.687 1.00 0.00 O ATOM 1919 CB MET A 125 10.185 -0.588 -5.835 1.00 0.00 C ATOM 1920 CG MET A 125 10.207 0.408 -6.983 1.00 0.00 C ATOM 1921 SD MET A 125 10.228 -0.393 -8.597 1.00 0.00 S ATOM 1922 CE MET A 125 8.626 -1.194 -8.599 1.00 0.00 C ATOM 0 H MET A 125 10.141 -1.818 -3.628 1.00 0.00 H new ATOM 0 HA MET A 125 9.885 0.979 -4.395 1.00 0.00 H new ATOM 0 HB2 MET A 125 11.207 -0.893 -5.610 1.00 0.00 H new ATOM 0 HB3 MET A 125 9.648 -1.482 -6.151 1.00 0.00 H new ATOM 0 HG2 MET A 125 9.333 1.055 -6.914 1.00 0.00 H new ATOM 0 HG3 MET A 125 11.085 1.047 -6.888 1.00 0.00 H new ATOM 0 HE1 MET A 125 8.059 -0.872 -9.473 1.00 0.00 H new ATOM 0 HE2 MET A 125 8.760 -2.275 -8.631 1.00 0.00 H new ATOM 0 HE3 MET A 125 8.082 -0.923 -7.694 1.00 0.00 H new ATOM 1932 N ILE A 126 7.425 -1.187 -4.899 1.00 0.00 N ATOM 1933 CA ILE A 126 5.981 -1.295 -5.064 1.00 0.00 C ATOM 1934 C ILE A 126 5.245 -0.471 -4.012 1.00 0.00 C ATOM 1935 O ILE A 126 4.127 -0.008 -4.242 1.00 0.00 O ATOM 1936 CB ILE A 126 5.512 -2.759 -4.974 1.00 0.00 C ATOM 1937 CG1 ILE A 126 4.045 -2.874 -5.391 1.00 0.00 C ATOM 1938 CG2 ILE A 126 5.711 -3.293 -3.563 1.00 0.00 C ATOM 1939 CD1 ILE A 126 3.666 -4.248 -5.898 1.00 0.00 C ATOM 0 H ILE A 126 7.921 -2.077 -4.932 1.00 0.00 H new ATOM 0 HA ILE A 126 5.746 -0.908 -6.055 1.00 0.00 H new ATOM 0 HB ILE A 126 6.112 -3.360 -5.657 1.00 0.00 H new ATOM 0 HG12 ILE A 126 3.413 -2.623 -4.539 1.00 0.00 H new ATOM 0 HG13 ILE A 126 3.838 -2.139 -6.169 1.00 0.00 H new ATOM 0 HG21 ILE A 126 5.375 -4.329 -3.515 1.00 0.00 H new ATOM 0 HG22 ILE A 126 6.768 -3.242 -3.300 1.00 0.00 H new ATOM 0 HG23 ILE A 126 5.133 -2.691 -2.861 1.00 0.00 H new ATOM 0 HD11 ILE A 126 2.612 -4.256 -6.175 1.00 0.00 H new ATOM 0 HD12 ILE A 126 4.272 -4.494 -6.770 1.00 0.00 H new ATOM 0 HD13 ILE A 126 3.840 -4.986 -5.115 1.00 0.00 H new ATOM 1951 N PHE A 127 5.879 -0.291 -2.859 1.00 0.00 N ATOM 1952 CA PHE A 127 5.285 0.477 -1.771 1.00 0.00 C ATOM 1953 C PHE A 127 5.691 1.945 -1.858 1.00 0.00 C ATOM 1954 O PHE A 127 4.852 2.840 -1.750 1.00 0.00 O ATOM 1955 CB PHE A 127 5.707 -0.102 -0.419 1.00 0.00 C ATOM 1956 CG PHE A 127 5.332 -1.545 -0.242 1.00 0.00 C ATOM 1957 CD1 PHE A 127 4.098 -2.012 -0.666 1.00 0.00 C ATOM 1958 CD2 PHE A 127 6.214 -2.436 0.347 1.00 0.00 C ATOM 1959 CE1 PHE A 127 3.751 -3.339 -0.503 1.00 0.00 C ATOM 1960 CE2 PHE A 127 5.873 -3.766 0.512 1.00 0.00 C ATOM 1961 CZ PHE A 127 4.640 -4.218 0.085 1.00 0.00 C ATOM 0 H PHE A 127 6.805 -0.667 -2.653 1.00 0.00 H new ATOM 0 HA PHE A 127 4.201 0.412 -1.863 1.00 0.00 H new ATOM 0 HB2 PHE A 127 6.787 0.001 -0.310 1.00 0.00 H new ATOM 0 HB3 PHE A 127 5.249 0.485 0.377 1.00 0.00 H new ATOM 0 HD1 PHE A 127 3.400 -1.331 -1.129 1.00 0.00 H new ATOM 0 HD2 PHE A 127 7.180 -2.088 0.682 1.00 0.00 H new ATOM 0 HE1 PHE A 127 2.785 -3.689 -0.835 1.00 0.00 H new ATOM 0 HE2 PHE A 127 6.570 -4.450 0.974 1.00 0.00 H new ATOM 0 HZ PHE A 127 4.371 -5.256 0.210 1.00 0.00 H new ATOM 1971 N SER A 128 6.984 2.185 -2.052 1.00 0.00 N ATOM 1972 CA SER A 128 7.503 3.544 -2.148 1.00 0.00 C ATOM 1973 C SER A 128 6.742 4.343 -3.201 1.00 0.00 C ATOM 1974 O SER A 128 6.192 5.405 -2.912 1.00 0.00 O ATOM 1975 CB SER A 128 8.995 3.520 -2.489 1.00 0.00 C ATOM 1976 OG SER A 128 9.783 3.373 -1.321 1.00 0.00 O ATOM 0 H SER A 128 7.691 1.456 -2.146 1.00 0.00 H new ATOM 0 HA SER A 128 7.366 4.028 -1.181 1.00 0.00 H new ATOM 0 HB2 SER A 128 9.201 2.699 -3.176 1.00 0.00 H new ATOM 0 HB3 SER A 128 9.269 4.442 -3.002 1.00 0.00 H new ATOM 0 HG SER A 128 9.901 2.420 -1.124 1.00 0.00 H new