USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1040 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 Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 LYS NZ :NH3+ 149:sc= 0.942 (180deg=0.0953) USER MOD Single : A 15 SER OG : rot 137:sc= -0.617 USER MOD Single : A 17 GLN : amide:sc= -0.703 X(o=-0.7,f=-0.53) USER MOD Single : A 19 GLN : amide:sc= -0.265 K(o=-0.27,f=-1.8) USER MOD Single : A 23 MET CE :methyl -162:sc= -0.092 (180deg=-0.714) USER MOD Single : A 25 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl -156:sc= -0.0121 (180deg=-0.131) USER MOD Single : A 32 ASN : amide:sc= -0.0159 X(o=-0.016,f=-0.059) USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 ASN :FLIP amide:sc= -0.357 F(o=-1.2,f=-0.36) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= -0.188 USER MOD Single : A 61 LYS NZ :NH3+ 170:sc= -0.248 (180deg=-0.27) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.443 X(o=-0.44,f=-0.11) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= 0.158 K(o=0.16,f=-1.5) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 MET CE :methyl 166:sc= -7! (180deg=-7.52!) USER MOD Single : A 85 HIS :FLIP no HD1:sc= -0.18 F(o=-1,f=-0.18) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot -31:sc= 1.11 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= -0.101 K(o=-0.1,f=-1.5!) USER MOD Single : A 98 SER OG : rot 107:sc= 1.15 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 104 HIS : no HD1:sc= -0.0278 X(o=-0.028,f=-0.5) USER MOD Single : A 105 GLN : amide:sc= -1.34 K(o=-1.3,f=-4.8!) USER MOD Single : A 106 GLN :FLIP amide:sc= -0.322 F(o=-1.9,f=-0.32) USER MOD Single : A 110 ASN : amide:sc= 0.996 K(o=1,f=-2.6!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 THR OG1 : rot -67:sc= 1.03 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 126 CYS SG : rot 180:sc= -0.0177 USER MOD Single : A 128 CYS SG : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= -0.0817 X(o=-0.082,f=0.22) USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 ASN : amide:sc= 0.444 K(o=0.44,f=-0.48) USER MOD Single : A 138 SER OG : rot 110:sc= -0.433 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 104 N SER A 11 -3.934 22.650 -2.065 1.00 0.00 N ATOM 105 CA SER A 11 -2.604 22.677 -2.662 1.00 0.00 C ATOM 106 C SER A 11 -1.883 21.351 -2.441 1.00 0.00 C ATOM 107 O SER A 11 -1.928 20.780 -1.351 1.00 0.00 O ATOM 108 CB SER A 11 -1.780 23.823 -2.072 1.00 0.00 C ATOM 109 OG SER A 11 -0.630 24.082 -2.860 1.00 0.00 O ATOM 0 HA SER A 11 -2.717 22.835 -3.735 1.00 0.00 H new ATOM 0 HB2 SER A 11 -2.393 24.722 -2.011 1.00 0.00 H new ATOM 0 HB3 SER A 11 -1.479 23.573 -1.055 1.00 0.00 H new ATOM 0 HG SER A 11 -0.121 24.819 -2.463 1.00 0.00 H new ATOM 115 N VAL A 12 -1.217 20.865 -3.484 1.00 0.00 N ATOM 116 CA VAL A 12 -0.485 19.607 -3.406 1.00 0.00 C ATOM 117 C VAL A 12 0.352 19.537 -2.133 1.00 0.00 C ATOM 118 O VAL A 12 0.654 18.452 -1.634 1.00 0.00 O ATOM 119 CB VAL A 12 0.438 19.418 -4.624 1.00 0.00 C ATOM 120 CG1 VAL A 12 1.131 18.065 -4.564 1.00 0.00 C ATOM 121 CG2 VAL A 12 -0.350 19.566 -5.917 1.00 0.00 C ATOM 0 H VAL A 12 -1.170 21.324 -4.394 1.00 0.00 H new ATOM 0 HA VAL A 12 -1.227 18.809 -3.395 1.00 0.00 H new ATOM 0 HB VAL A 12 1.204 20.193 -4.601 1.00 0.00 H new ATOM 0 HG11 VAL A 12 1.779 17.949 -5.433 1.00 0.00 H new ATOM 0 HG12 VAL A 12 1.729 18.002 -3.655 1.00 0.00 H new ATOM 0 HG13 VAL A 12 0.383 17.273 -4.562 1.00 0.00 H new ATOM 0 HG21 VAL A 12 0.318 19.429 -6.768 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -1.139 18.814 -5.950 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -0.794 20.560 -5.960 1.00 0.00 H new ATOM 131 N LYS A 13 0.723 20.701 -1.610 1.00 0.00 N ATOM 132 CA LYS A 13 1.523 20.773 -0.394 1.00 0.00 C ATOM 133 C LYS A 13 1.005 19.797 0.658 1.00 0.00 C ATOM 134 O LYS A 13 1.699 18.856 1.039 1.00 0.00 O ATOM 135 CB LYS A 13 1.510 22.197 0.166 1.00 0.00 C ATOM 136 CG LYS A 13 2.528 23.117 -0.486 1.00 0.00 C ATOM 137 CD LYS A 13 2.764 24.366 0.346 1.00 0.00 C ATOM 138 CE LYS A 13 3.345 24.027 1.710 1.00 0.00 C ATOM 139 NZ LYS A 13 4.035 25.194 2.325 1.00 0.00 N ATOM 0 H LYS A 13 0.482 21.608 -2.010 1.00 0.00 H new ATOM 0 HA LYS A 13 2.547 20.497 -0.646 1.00 0.00 H new ATOM 0 HB2 LYS A 13 0.514 22.621 0.036 1.00 0.00 H new ATOM 0 HB3 LYS A 13 1.702 22.158 1.238 1.00 0.00 H new ATOM 0 HG2 LYS A 13 3.469 22.584 -0.618 1.00 0.00 H new ATOM 0 HG3 LYS A 13 2.180 23.401 -1.479 1.00 0.00 H new ATOM 0 HD2 LYS A 13 3.443 25.034 -0.184 1.00 0.00 H new ATOM 0 HD3 LYS A 13 1.824 24.902 0.473 1.00 0.00 H new ATOM 0 HE2 LYS A 13 2.547 23.688 2.370 1.00 0.00 H new ATOM 0 HE3 LYS A 13 4.049 23.201 1.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 3.953 25.140 3.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 5.040 25.184 2.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 3.595 26.074 1.988 1.00 0.00 H new ATOM 153 N GLU A 14 -0.220 20.029 1.121 1.00 0.00 N ATOM 154 CA GLU A 14 -0.830 19.169 2.128 1.00 0.00 C ATOM 155 C GLU A 14 -0.850 17.716 1.662 1.00 0.00 C ATOM 156 O GLU A 14 -0.260 16.841 2.298 1.00 0.00 O ATOM 157 CB GLU A 14 -2.254 19.637 2.434 1.00 0.00 C ATOM 158 CG GLU A 14 -2.313 20.867 3.323 1.00 0.00 C ATOM 159 CD GLU A 14 -3.730 21.352 3.556 1.00 0.00 C ATOM 160 OE1 GLU A 14 -4.558 20.555 4.045 1.00 0.00 O ATOM 161 OE2 GLU A 14 -4.012 22.530 3.250 1.00 0.00 O ATOM 0 H GLU A 14 -0.808 20.804 0.815 1.00 0.00 H new ATOM 0 HA GLU A 14 -0.231 19.233 3.036 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -2.766 19.852 1.496 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -2.799 18.825 2.915 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -1.849 20.639 4.283 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -1.729 21.667 2.868 1.00 0.00 H new ATOM 168 N SER A 15 -1.532 17.465 0.550 1.00 0.00 N ATOM 169 CA SER A 15 -1.633 16.118 0.001 1.00 0.00 C ATOM 170 C SER A 15 -0.313 15.370 0.153 1.00 0.00 C ATOM 171 O SER A 15 -0.229 14.375 0.875 1.00 0.00 O ATOM 172 CB SER A 15 -2.034 16.174 -1.474 1.00 0.00 C ATOM 173 OG SER A 15 -1.001 16.741 -2.262 1.00 0.00 O ATOM 0 H SER A 15 -2.024 18.178 0.011 1.00 0.00 H new ATOM 0 HA SER A 15 -2.401 15.582 0.558 1.00 0.00 H new ATOM 0 HB2 SER A 15 -2.259 15.169 -1.832 1.00 0.00 H new ATOM 0 HB3 SER A 15 -2.945 16.763 -1.584 1.00 0.00 H new ATOM 0 HG SER A 15 -0.897 16.223 -3.087 1.00 0.00 H new ATOM 179 N LEU A 16 0.717 15.854 -0.532 1.00 0.00 N ATOM 180 CA LEU A 16 2.036 15.232 -0.474 1.00 0.00 C ATOM 181 C LEU A 16 2.460 14.988 0.971 1.00 0.00 C ATOM 182 O LEU A 16 2.771 13.861 1.354 1.00 0.00 O ATOM 183 CB LEU A 16 3.068 16.114 -1.179 1.00 0.00 C ATOM 184 CG LEU A 16 3.159 15.958 -2.697 1.00 0.00 C ATOM 185 CD1 LEU A 16 3.934 17.116 -3.307 1.00 0.00 C ATOM 186 CD2 LEU A 16 3.808 14.630 -3.059 1.00 0.00 C ATOM 0 H LEU A 16 0.665 16.675 -1.134 1.00 0.00 H new ATOM 0 HA LEU A 16 1.980 14.270 -0.984 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.840 17.156 -0.954 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.049 15.903 -0.753 1.00 0.00 H new ATOM 0 HG LEU A 16 2.148 15.969 -3.105 1.00 0.00 H new ATOM 0 HD11 LEU A 16 3.989 16.988 -4.388 1.00 0.00 H new ATOM 0 HD12 LEU A 16 3.428 18.054 -3.078 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.942 17.137 -2.893 1.00 0.00 H new ATOM 0 HD21 LEU A 16 3.864 14.536 -4.143 1.00 0.00 H new ATOM 0 HD22 LEU A 16 4.813 14.590 -2.639 1.00 0.00 H new ATOM 0 HD23 LEU A 16 3.212 13.812 -2.655 1.00 0.00 H new ATOM 198 N GLN A 17 2.467 16.052 1.768 1.00 0.00 N ATOM 199 CA GLN A 17 2.852 15.952 3.170 1.00 0.00 C ATOM 200 C GLN A 17 2.159 14.771 3.842 1.00 0.00 C ATOM 201 O GLN A 17 2.804 13.942 4.484 1.00 0.00 O ATOM 202 CB GLN A 17 2.509 17.247 3.909 1.00 0.00 C ATOM 203 CG GLN A 17 3.380 17.502 5.128 1.00 0.00 C ATOM 204 CD GLN A 17 3.081 16.548 6.268 1.00 0.00 C ATOM 205 OE1 GLN A 17 3.976 15.877 6.782 1.00 0.00 O ATOM 206 NE2 GLN A 17 1.817 16.482 6.670 1.00 0.00 N ATOM 0 H GLN A 17 2.211 16.992 1.467 1.00 0.00 H new ATOM 0 HA GLN A 17 3.929 15.791 3.214 1.00 0.00 H new ATOM 0 HB2 GLN A 17 2.609 18.086 3.220 1.00 0.00 H new ATOM 0 HB3 GLN A 17 1.465 17.212 4.220 1.00 0.00 H new ATOM 0 HG2 GLN A 17 4.429 17.409 4.847 1.00 0.00 H new ATOM 0 HG3 GLN A 17 3.231 18.527 5.468 1.00 0.00 H new ATOM 0 HE21 GLN A 17 1.107 17.056 6.216 1.00 0.00 H new ATOM 0 HE22 GLN A 17 1.556 15.857 7.433 1.00 0.00 H new ATOM 215 N LEU A 18 0.841 14.701 3.691 1.00 0.00 N ATOM 216 CA LEU A 18 0.059 13.621 4.283 1.00 0.00 C ATOM 217 C LEU A 18 0.638 12.261 3.909 1.00 0.00 C ATOM 218 O LEU A 18 0.623 11.328 4.711 1.00 0.00 O ATOM 219 CB LEU A 18 -1.398 13.711 3.827 1.00 0.00 C ATOM 220 CG LEU A 18 -2.196 14.903 4.356 1.00 0.00 C ATOM 221 CD1 LEU A 18 -3.477 15.086 3.558 1.00 0.00 C ATOM 222 CD2 LEU A 18 -2.508 14.721 5.835 1.00 0.00 C ATOM 0 H LEU A 18 0.291 15.379 3.164 1.00 0.00 H new ATOM 0 HA LEU A 18 0.101 13.727 5.367 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -1.415 13.743 2.738 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -1.909 12.796 4.127 1.00 0.00 H new ATOM 0 HG LEU A 18 -1.590 15.801 4.240 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -4.031 15.939 3.950 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.231 15.263 2.511 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -4.089 14.188 3.640 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.076 15.579 6.195 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.094 13.813 5.974 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -1.577 14.641 6.396 1.00 0.00 H new ATOM 234 N GLN A 19 1.150 12.157 2.687 1.00 0.00 N ATOM 235 CA GLN A 19 1.736 10.911 2.207 1.00 0.00 C ATOM 236 C GLN A 19 2.945 10.519 3.050 1.00 0.00 C ATOM 237 O GLN A 19 3.121 9.350 3.396 1.00 0.00 O ATOM 238 CB GLN A 19 2.145 11.046 0.739 1.00 0.00 C ATOM 239 CG GLN A 19 1.005 11.472 -0.172 1.00 0.00 C ATOM 240 CD GLN A 19 1.456 11.699 -1.602 1.00 0.00 C ATOM 241 OE1 GLN A 19 2.583 11.366 -1.970 1.00 0.00 O ATOM 242 NE2 GLN A 19 0.575 12.267 -2.417 1.00 0.00 N ATOM 0 H GLN A 19 1.171 12.921 2.011 1.00 0.00 H new ATOM 0 HA GLN A 19 0.984 10.127 2.296 1.00 0.00 H new ATOM 0 HB2 GLN A 19 2.953 11.773 0.661 1.00 0.00 H new ATOM 0 HB3 GLN A 19 2.540 10.092 0.391 1.00 0.00 H new ATOM 0 HG2 GLN A 19 0.228 10.708 -0.157 1.00 0.00 H new ATOM 0 HG3 GLN A 19 0.559 12.388 0.214 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -0.348 12.527 -2.069 1.00 0.00 H new ATOM 0 HE22 GLN A 19 0.821 12.444 -3.391 1.00 0.00 H new ATOM 251 N LEU A 20 3.777 11.502 3.377 1.00 0.00 N ATOM 252 CA LEU A 20 4.971 11.260 4.179 1.00 0.00 C ATOM 253 C LEU A 20 4.599 10.743 5.565 1.00 0.00 C ATOM 254 O LEU A 20 5.350 9.982 6.177 1.00 0.00 O ATOM 255 CB LEU A 20 5.794 12.543 4.305 1.00 0.00 C ATOM 256 CG LEU A 20 6.486 13.024 3.029 1.00 0.00 C ATOM 257 CD1 LEU A 20 7.042 14.427 3.219 1.00 0.00 C ATOM 258 CD2 LEU A 20 7.593 12.060 2.627 1.00 0.00 C ATOM 0 H LEU A 20 3.646 12.475 3.099 1.00 0.00 H new ATOM 0 HA LEU A 20 5.569 10.500 3.676 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.139 13.338 4.661 1.00 0.00 H new ATOM 0 HB3 LEU A 20 6.554 12.390 5.071 1.00 0.00 H new ATOM 0 HG LEU A 20 5.748 13.053 2.228 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.531 14.752 2.301 1.00 0.00 H new ATOM 0 HD12 LEU A 20 6.228 15.111 3.459 1.00 0.00 H new ATOM 0 HD13 LEU A 20 7.766 14.424 4.034 1.00 0.00 H new ATOM 0 HD21 LEU A 20 8.075 12.418 1.717 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.330 11.998 3.428 1.00 0.00 H new ATOM 0 HD23 LEU A 20 7.168 11.072 2.448 1.00 0.00 H new ATOM 270 N LEU A 21 3.436 11.158 6.054 1.00 0.00 N ATOM 271 CA LEU A 21 2.963 10.735 7.367 1.00 0.00 C ATOM 272 C LEU A 21 2.782 9.221 7.419 1.00 0.00 C ATOM 273 O LEU A 21 3.354 8.548 8.276 1.00 0.00 O ATOM 274 CB LEU A 21 1.643 11.430 7.704 1.00 0.00 C ATOM 275 CG LEU A 21 1.727 12.585 8.702 1.00 0.00 C ATOM 276 CD1 LEU A 21 0.342 13.138 8.997 1.00 0.00 C ATOM 277 CD2 LEU A 21 2.407 12.131 9.986 1.00 0.00 C ATOM 0 H LEU A 21 2.803 11.787 5.561 1.00 0.00 H new ATOM 0 HA LEU A 21 3.714 11.018 8.105 1.00 0.00 H new ATOM 0 HB2 LEU A 21 1.208 11.807 6.779 1.00 0.00 H new ATOM 0 HB3 LEU A 21 0.954 10.684 8.100 1.00 0.00 H new ATOM 0 HG LEU A 21 2.326 13.381 8.258 1.00 0.00 H new ATOM 0 HD11 LEU A 21 0.422 13.959 9.709 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -0.109 13.501 8.074 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -0.282 12.350 9.420 1.00 0.00 H new ATOM 0 HD21 LEU A 21 2.458 12.966 10.685 1.00 0.00 H new ATOM 0 HD22 LEU A 21 1.835 11.318 10.433 1.00 0.00 H new ATOM 0 HD23 LEU A 21 3.415 11.784 9.761 1.00 0.00 H new ATOM 289 N GLU A 22 1.985 8.694 6.496 1.00 0.00 N ATOM 290 CA GLU A 22 1.731 7.259 6.436 1.00 0.00 C ATOM 291 C GLU A 22 3.036 6.480 6.300 1.00 0.00 C ATOM 292 O GLU A 22 3.164 5.368 6.812 1.00 0.00 O ATOM 293 CB GLU A 22 0.804 6.931 5.264 1.00 0.00 C ATOM 294 CG GLU A 22 1.397 7.268 3.906 1.00 0.00 C ATOM 295 CD GLU A 22 0.897 6.350 2.807 1.00 0.00 C ATOM 296 OE1 GLU A 22 1.357 5.191 2.747 1.00 0.00 O ATOM 297 OE2 GLU A 22 0.046 6.792 2.007 1.00 0.00 O ATOM 0 H GLU A 22 1.504 9.238 5.780 1.00 0.00 H new ATOM 0 HA GLU A 22 1.247 6.963 7.367 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.560 5.869 5.291 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -0.132 7.476 5.388 1.00 0.00 H new ATOM 0 HG2 GLU A 22 1.152 8.299 3.652 1.00 0.00 H new ATOM 0 HG3 GLU A 22 2.484 7.203 3.962 1.00 0.00 H new ATOM 304 N MET A 23 4.002 7.073 5.606 1.00 0.00 N ATOM 305 CA MET A 23 5.298 6.435 5.402 1.00 0.00 C ATOM 306 C MET A 23 5.956 6.103 6.738 1.00 0.00 C ATOM 307 O MET A 23 6.290 4.949 7.004 1.00 0.00 O ATOM 308 CB MET A 23 6.215 7.344 4.582 1.00 0.00 C ATOM 309 CG MET A 23 5.787 7.488 3.130 1.00 0.00 C ATOM 310 SD MET A 23 5.529 5.897 2.322 1.00 0.00 S ATOM 311 CE MET A 23 7.106 5.103 2.625 1.00 0.00 C ATOM 0 H MET A 23 3.912 7.993 5.176 1.00 0.00 H new ATOM 0 HA MET A 23 5.136 5.506 4.855 1.00 0.00 H new ATOM 0 HB2 MET A 23 6.242 8.331 5.044 1.00 0.00 H new ATOM 0 HB3 MET A 23 7.230 6.948 4.616 1.00 0.00 H new ATOM 0 HG2 MET A 23 4.866 8.069 3.083 1.00 0.00 H new ATOM 0 HG3 MET A 23 6.546 8.049 2.585 1.00 0.00 H new ATOM 0 HE1 MET A 23 7.231 4.267 1.937 1.00 0.00 H new ATOM 0 HE2 MET A 23 7.911 5.822 2.472 1.00 0.00 H new ATOM 0 HE3 MET A 23 7.138 4.736 3.651 1.00 0.00 H new ATOM 321 N GLU A 24 6.138 7.121 7.573 1.00 0.00 N ATOM 322 CA GLU A 24 6.757 6.935 8.880 1.00 0.00 C ATOM 323 C GLU A 24 5.932 5.984 9.742 1.00 0.00 C ATOM 324 O GLU A 24 6.441 5.396 10.696 1.00 0.00 O ATOM 325 CB GLU A 24 6.913 8.281 9.591 1.00 0.00 C ATOM 326 CG GLU A 24 5.591 8.912 9.995 1.00 0.00 C ATOM 327 CD GLU A 24 5.740 9.899 11.137 1.00 0.00 C ATOM 328 OE1 GLU A 24 6.239 11.018 10.894 1.00 0.00 O ATOM 329 OE2 GLU A 24 5.358 9.551 12.274 1.00 0.00 O ATOM 0 H GLU A 24 5.866 8.082 7.368 1.00 0.00 H new ATOM 0 HA GLU A 24 7.743 6.496 8.728 1.00 0.00 H new ATOM 0 HB2 GLU A 24 7.527 8.143 10.481 1.00 0.00 H new ATOM 0 HB3 GLU A 24 7.449 8.968 8.937 1.00 0.00 H new ATOM 0 HG2 GLU A 24 5.158 9.421 9.134 1.00 0.00 H new ATOM 0 HG3 GLU A 24 4.892 8.128 10.286 1.00 0.00 H new ATOM 336 N MET A 25 4.657 5.839 9.398 1.00 0.00 N ATOM 337 CA MET A 25 3.761 4.959 10.140 1.00 0.00 C ATOM 338 C MET A 25 3.818 3.537 9.590 1.00 0.00 C ATOM 339 O MET A 25 3.595 2.569 10.319 1.00 0.00 O ATOM 340 CB MET A 25 2.326 5.486 10.078 1.00 0.00 C ATOM 341 CG MET A 25 2.123 6.787 10.837 1.00 0.00 C ATOM 342 SD MET A 25 0.425 7.004 11.402 1.00 0.00 S ATOM 343 CE MET A 25 -0.011 8.536 10.582 1.00 0.00 C ATOM 0 H MET A 25 4.221 6.319 8.611 1.00 0.00 H new ATOM 0 HA MET A 25 4.088 4.941 11.180 1.00 0.00 H new ATOM 0 HB2 MET A 25 2.048 5.636 9.035 1.00 0.00 H new ATOM 0 HB3 MET A 25 1.652 4.730 10.482 1.00 0.00 H new ATOM 0 HG2 MET A 25 2.793 6.810 11.696 1.00 0.00 H new ATOM 0 HG3 MET A 25 2.398 7.624 10.195 1.00 0.00 H new ATOM 0 HE1 MET A 25 -1.037 8.804 10.834 1.00 0.00 H new ATOM 0 HE2 MET A 25 0.662 9.328 10.910 1.00 0.00 H new ATOM 0 HE3 MET A 25 0.076 8.409 9.503 1.00 0.00 H new ATOM 353 N LEU A 26 4.116 3.417 8.301 1.00 0.00 N ATOM 354 CA LEU A 26 4.201 2.113 7.654 1.00 0.00 C ATOM 355 C LEU A 26 5.501 1.406 8.022 1.00 0.00 C ATOM 356 O LEU A 26 5.516 0.200 8.267 1.00 0.00 O ATOM 357 CB LEU A 26 4.104 2.269 6.135 1.00 0.00 C ATOM 358 CG LEU A 26 2.700 2.488 5.571 1.00 0.00 C ATOM 359 CD1 LEU A 26 2.763 3.277 4.273 1.00 0.00 C ATOM 360 CD2 LEU A 26 1.998 1.156 5.354 1.00 0.00 C ATOM 0 H LEU A 26 4.303 4.207 7.683 1.00 0.00 H new ATOM 0 HA LEU A 26 3.367 1.505 8.005 1.00 0.00 H new ATOM 0 HB2 LEU A 26 4.729 3.110 5.836 1.00 0.00 H new ATOM 0 HB3 LEU A 26 4.525 1.377 5.671 1.00 0.00 H new ATOM 0 HG LEU A 26 2.125 3.065 6.295 1.00 0.00 H new ATOM 0 HD11 LEU A 26 1.754 3.423 3.887 1.00 0.00 H new ATOM 0 HD12 LEU A 26 3.224 4.247 4.459 1.00 0.00 H new ATOM 0 HD13 LEU A 26 3.356 2.728 3.542 1.00 0.00 H new ATOM 0 HD21 LEU A 26 1.000 1.332 4.952 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.571 0.553 4.650 1.00 0.00 H new ATOM 0 HD23 LEU A 26 1.919 0.627 6.304 1.00 0.00 H new ATOM 372 N PHE A 27 6.591 2.166 8.061 1.00 0.00 N ATOM 373 CA PHE A 27 7.897 1.612 8.401 1.00 0.00 C ATOM 374 C PHE A 27 7.853 0.905 9.752 1.00 0.00 C ATOM 375 O PHE A 27 8.241 -0.257 9.869 1.00 0.00 O ATOM 376 CB PHE A 27 8.952 2.719 8.426 1.00 0.00 C ATOM 377 CG PHE A 27 9.337 3.212 7.061 1.00 0.00 C ATOM 378 CD1 PHE A 27 9.599 2.318 6.035 1.00 0.00 C ATOM 379 CD2 PHE A 27 9.438 4.570 6.803 1.00 0.00 C ATOM 380 CE1 PHE A 27 9.952 2.769 4.777 1.00 0.00 C ATOM 381 CE2 PHE A 27 9.791 5.026 5.547 1.00 0.00 C ATOM 382 CZ PHE A 27 10.049 4.124 4.533 1.00 0.00 C ATOM 0 H PHE A 27 6.596 3.166 7.862 1.00 0.00 H new ATOM 0 HA PHE A 27 8.164 0.881 7.638 1.00 0.00 H new ATOM 0 HB2 PHE A 27 8.574 3.556 9.013 1.00 0.00 H new ATOM 0 HB3 PHE A 27 9.843 2.350 8.934 1.00 0.00 H new ATOM 0 HD1 PHE A 27 9.527 1.257 6.221 1.00 0.00 H new ATOM 0 HD2 PHE A 27 9.239 5.280 7.592 1.00 0.00 H new ATOM 0 HE1 PHE A 27 10.152 2.062 3.986 1.00 0.00 H new ATOM 0 HE2 PHE A 27 9.865 6.087 5.358 1.00 0.00 H new ATOM 0 HZ PHE A 27 10.326 4.478 3.551 1.00 0.00 H new ATOM 392 N SER A 28 7.377 1.615 10.770 1.00 0.00 N ATOM 393 CA SER A 28 7.286 1.058 12.114 1.00 0.00 C ATOM 394 C SER A 28 6.388 -0.175 12.132 1.00 0.00 C ATOM 395 O SER A 28 6.633 -1.124 12.876 1.00 0.00 O ATOM 396 CB SER A 28 6.749 2.108 13.089 1.00 0.00 C ATOM 397 OG SER A 28 6.957 1.710 14.433 1.00 0.00 O ATOM 0 H SER A 28 7.048 2.577 10.689 1.00 0.00 H new ATOM 0 HA SER A 28 8.287 0.761 12.426 1.00 0.00 H new ATOM 0 HB2 SER A 28 7.243 3.063 12.909 1.00 0.00 H new ATOM 0 HB3 SER A 28 5.684 2.262 12.913 1.00 0.00 H new ATOM 0 HG SER A 28 6.607 2.398 15.036 1.00 0.00 H new ATOM 403 N MET A 29 5.348 -0.153 11.306 1.00 0.00 N ATOM 404 CA MET A 29 4.413 -1.269 11.225 1.00 0.00 C ATOM 405 C MET A 29 5.081 -2.494 10.609 1.00 0.00 C ATOM 406 O MET A 29 4.755 -3.631 10.953 1.00 0.00 O ATOM 407 CB MET A 29 3.185 -0.876 10.401 1.00 0.00 C ATOM 408 CG MET A 29 2.096 -0.200 11.218 1.00 0.00 C ATOM 409 SD MET A 29 0.453 -0.437 10.515 1.00 0.00 S ATOM 410 CE MET A 29 0.650 0.351 8.919 1.00 0.00 C ATOM 0 H MET A 29 5.131 0.625 10.683 1.00 0.00 H new ATOM 0 HA MET A 29 4.097 -1.519 12.238 1.00 0.00 H new ATOM 0 HB2 MET A 29 3.495 -0.206 9.599 1.00 0.00 H new ATOM 0 HB3 MET A 29 2.773 -1.768 9.930 1.00 0.00 H new ATOM 0 HG2 MET A 29 2.112 -0.594 12.234 1.00 0.00 H new ATOM 0 HG3 MET A 29 2.308 0.867 11.286 1.00 0.00 H new ATOM 0 HE1 MET A 29 -0.324 0.670 8.548 1.00 0.00 H new ATOM 0 HE2 MET A 29 1.302 1.219 9.020 1.00 0.00 H new ATOM 0 HE3 MET A 29 1.092 -0.355 8.217 1.00 0.00 H new ATOM 420 N PHE A 30 6.019 -2.256 9.698 1.00 0.00 N ATOM 421 CA PHE A 30 6.732 -3.341 9.033 1.00 0.00 C ATOM 422 C PHE A 30 8.226 -3.276 9.338 1.00 0.00 C ATOM 423 O PHE A 30 9.027 -2.782 8.544 1.00 0.00 O ATOM 424 CB PHE A 30 6.506 -3.278 7.521 1.00 0.00 C ATOM 425 CG PHE A 30 5.062 -3.405 7.126 1.00 0.00 C ATOM 426 CD1 PHE A 30 4.445 -4.645 7.097 1.00 0.00 C ATOM 427 CD2 PHE A 30 4.323 -2.284 6.782 1.00 0.00 C ATOM 428 CE1 PHE A 30 3.117 -4.765 6.734 1.00 0.00 C ATOM 429 CE2 PHE A 30 2.995 -2.399 6.418 1.00 0.00 C ATOM 430 CZ PHE A 30 2.391 -3.641 6.393 1.00 0.00 C ATOM 0 H PHE A 30 6.303 -1.322 9.403 1.00 0.00 H new ATOM 0 HA PHE A 30 6.341 -4.285 9.412 1.00 0.00 H new ATOM 0 HB2 PHE A 30 6.897 -2.334 7.142 1.00 0.00 H new ATOM 0 HB3 PHE A 30 7.077 -4.074 7.043 1.00 0.00 H new ATOM 0 HD1 PHE A 30 5.008 -5.528 7.361 1.00 0.00 H new ATOM 0 HD2 PHE A 30 4.790 -1.310 6.799 1.00 0.00 H new ATOM 0 HE1 PHE A 30 2.647 -5.737 6.717 1.00 0.00 H new ATOM 0 HE2 PHE A 30 2.429 -1.518 6.153 1.00 0.00 H new ATOM 0 HZ PHE A 30 1.353 -3.733 6.107 1.00 0.00 H new ATOM 440 N PRO A 31 8.611 -3.786 10.517 1.00 0.00 N ATOM 441 CA PRO A 31 10.010 -3.799 10.955 1.00 0.00 C ATOM 442 C PRO A 31 10.863 -4.770 10.146 1.00 0.00 C ATOM 443 O PRO A 31 11.987 -4.452 9.763 1.00 0.00 O ATOM 444 CB PRO A 31 9.921 -4.254 12.414 1.00 0.00 C ATOM 445 CG PRO A 31 8.655 -5.035 12.491 1.00 0.00 C ATOM 446 CD PRO A 31 7.711 -4.391 11.513 1.00 0.00 C ATOM 0 HA PRO A 31 10.486 -2.827 10.825 1.00 0.00 H new ATOM 0 HB2 PRO A 31 10.780 -4.865 12.691 1.00 0.00 H new ATOM 0 HB3 PRO A 31 9.903 -3.402 13.094 1.00 0.00 H new ATOM 0 HG2 PRO A 31 8.826 -6.081 12.237 1.00 0.00 H new ATOM 0 HG3 PRO A 31 8.245 -5.015 13.501 1.00 0.00 H new ATOM 0 HD2 PRO A 31 7.043 -5.122 11.059 1.00 0.00 H new ATOM 0 HD3 PRO A 31 7.083 -3.642 11.995 1.00 0.00 H new ATOM 454 N ASN A 32 10.318 -5.955 9.888 1.00 0.00 N ATOM 455 CA ASN A 32 11.030 -6.973 9.124 1.00 0.00 C ATOM 456 C ASN A 32 11.514 -6.412 7.790 1.00 0.00 C ATOM 457 O ASN A 32 10.781 -6.415 6.802 1.00 0.00 O ATOM 458 CB ASN A 32 10.127 -8.183 8.883 1.00 0.00 C ATOM 459 CG ASN A 32 9.642 -8.810 10.176 1.00 0.00 C ATOM 460 OD1 ASN A 32 10.432 -9.092 11.076 1.00 0.00 O ATOM 461 ND2 ASN A 32 8.336 -9.031 10.273 1.00 0.00 N ATOM 0 H ASN A 32 9.387 -6.233 10.197 1.00 0.00 H new ATOM 0 HA ASN A 32 11.899 -7.286 9.703 1.00 0.00 H new ATOM 0 HB2 ASN A 32 9.268 -7.878 8.286 1.00 0.00 H new ATOM 0 HB3 ASN A 32 10.670 -8.928 8.303 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.951 -9.451 11.119 1.00 0.00 H new ATOM 0 HD22 ASN A 32 7.718 -8.781 9.501 1.00 0.00 H new ATOM 468 N GLN A 33 12.753 -5.931 7.772 1.00 0.00 N ATOM 469 CA GLN A 33 13.335 -5.367 6.559 1.00 0.00 C ATOM 470 C GLN A 33 12.922 -6.171 5.332 1.00 0.00 C ATOM 471 O GLN A 33 13.084 -7.390 5.292 1.00 0.00 O ATOM 472 CB GLN A 33 14.860 -5.330 6.670 1.00 0.00 C ATOM 473 CG GLN A 33 15.392 -4.067 7.329 1.00 0.00 C ATOM 474 CD GLN A 33 16.907 -4.028 7.379 1.00 0.00 C ATOM 475 OE1 GLN A 33 17.579 -4.292 6.381 1.00 0.00 O ATOM 476 NE2 GLN A 33 17.453 -3.697 8.543 1.00 0.00 N ATOM 0 H GLN A 33 13.373 -5.920 8.582 1.00 0.00 H new ATOM 0 HA GLN A 33 12.961 -4.349 6.446 1.00 0.00 H new ATOM 0 HB2 GLN A 33 15.196 -6.196 7.240 1.00 0.00 H new ATOM 0 HB3 GLN A 33 15.291 -5.419 5.673 1.00 0.00 H new ATOM 0 HG2 GLN A 33 15.028 -3.196 6.784 1.00 0.00 H new ATOM 0 HG3 GLN A 33 14.997 -3.997 8.342 1.00 0.00 H new ATOM 0 HE21 GLN A 33 16.858 -3.486 9.344 1.00 0.00 H new ATOM 0 HE22 GLN A 33 18.468 -3.654 8.636 1.00 0.00 H new ATOM 485 N GLY A 34 12.386 -5.481 4.330 1.00 0.00 N ATOM 486 CA GLY A 34 11.957 -6.148 3.114 1.00 0.00 C ATOM 487 C GLY A 34 10.513 -5.846 2.766 1.00 0.00 C ATOM 488 O GLY A 34 10.190 -5.583 1.609 1.00 0.00 O ATOM 0 H GLY A 34 12.241 -4.471 4.338 1.00 0.00 H new ATOM 0 HA2 GLY A 34 12.599 -5.840 2.288 1.00 0.00 H new ATOM 0 HA3 GLY A 34 12.082 -7.225 3.230 1.00 0.00 H new ATOM 492 N GLU A 35 9.643 -5.887 3.770 1.00 0.00 N ATOM 493 CA GLU A 35 8.225 -5.618 3.563 1.00 0.00 C ATOM 494 C GLU A 35 8.027 -4.475 2.571 1.00 0.00 C ATOM 495 O GLU A 35 7.504 -4.672 1.474 1.00 0.00 O ATOM 496 CB GLU A 35 7.547 -5.278 4.892 1.00 0.00 C ATOM 497 CG GLU A 35 7.500 -6.442 5.866 1.00 0.00 C ATOM 498 CD GLU A 35 6.433 -7.459 5.509 1.00 0.00 C ATOM 499 OE1 GLU A 35 6.526 -8.060 4.419 1.00 0.00 O ATOM 500 OE2 GLU A 35 5.504 -7.653 6.322 1.00 0.00 O ATOM 0 H GLU A 35 9.895 -6.104 4.734 1.00 0.00 H new ATOM 0 HA GLU A 35 7.768 -6.518 3.151 1.00 0.00 H new ATOM 0 HB2 GLU A 35 8.076 -4.447 5.358 1.00 0.00 H new ATOM 0 HB3 GLU A 35 6.530 -4.939 4.695 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.473 -6.933 5.886 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.314 -6.063 6.871 1.00 0.00 H new ATOM 507 N VAL A 36 8.449 -3.277 2.966 1.00 0.00 N ATOM 508 CA VAL A 36 8.319 -2.102 2.113 1.00 0.00 C ATOM 509 C VAL A 36 9.553 -1.920 1.236 1.00 0.00 C ATOM 510 O VAL A 36 10.683 -1.926 1.726 1.00 0.00 O ATOM 511 CB VAL A 36 8.103 -0.825 2.947 1.00 0.00 C ATOM 512 CG1 VAL A 36 8.020 0.396 2.043 1.00 0.00 C ATOM 513 CG2 VAL A 36 6.850 -0.952 3.800 1.00 0.00 C ATOM 0 H VAL A 36 8.883 -3.096 3.871 1.00 0.00 H new ATOM 0 HA VAL A 36 7.447 -2.266 1.479 1.00 0.00 H new ATOM 0 HB VAL A 36 8.957 -0.698 3.612 1.00 0.00 H new ATOM 0 HG11 VAL A 36 7.867 1.288 2.650 1.00 0.00 H new ATOM 0 HG12 VAL A 36 8.948 0.495 1.479 1.00 0.00 H new ATOM 0 HG13 VAL A 36 7.186 0.281 1.351 1.00 0.00 H new ATOM 0 HG21 VAL A 36 6.713 -0.041 4.383 1.00 0.00 H new ATOM 0 HG22 VAL A 36 5.985 -1.104 3.155 1.00 0.00 H new ATOM 0 HG23 VAL A 36 6.954 -1.802 4.474 1.00 0.00 H new ATOM 523 N LYS A 37 9.330 -1.759 -0.063 1.00 0.00 N ATOM 524 CA LYS A 37 10.423 -1.574 -1.011 1.00 0.00 C ATOM 525 C LYS A 37 10.321 -0.217 -1.700 1.00 0.00 C ATOM 526 O LYS A 37 9.410 0.021 -2.494 1.00 0.00 O ATOM 527 CB LYS A 37 10.414 -2.691 -2.056 1.00 0.00 C ATOM 528 CG LYS A 37 11.456 -2.511 -3.147 1.00 0.00 C ATOM 529 CD LYS A 37 11.058 -3.235 -4.423 1.00 0.00 C ATOM 530 CE LYS A 37 10.961 -4.737 -4.203 1.00 0.00 C ATOM 531 NZ LYS A 37 12.305 -5.373 -4.113 1.00 0.00 N ATOM 0 H LYS A 37 8.401 -1.753 -0.485 1.00 0.00 H new ATOM 0 HA LYS A 37 11.361 -1.611 -0.458 1.00 0.00 H new ATOM 0 HB2 LYS A 37 10.583 -3.645 -1.557 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.426 -2.741 -2.513 1.00 0.00 H new ATOM 0 HG2 LYS A 37 11.586 -1.449 -3.356 1.00 0.00 H new ATOM 0 HG3 LYS A 37 12.418 -2.888 -2.799 1.00 0.00 H new ATOM 0 HD2 LYS A 37 10.099 -2.855 -4.775 1.00 0.00 H new ATOM 0 HD3 LYS A 37 11.789 -3.027 -5.204 1.00 0.00 H new ATOM 0 HE2 LYS A 37 10.404 -4.935 -3.287 1.00 0.00 H new ATOM 0 HE3 LYS A 37 10.400 -5.188 -5.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 12.195 -6.396 -3.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 12.828 -5.207 -4.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 12.831 -4.961 -3.316 1.00 0.00 H new ATOM 545 N LEU A 38 11.262 0.670 -1.393 1.00 0.00 N ATOM 546 CA LEU A 38 11.279 2.003 -1.984 1.00 0.00 C ATOM 547 C LEU A 38 12.351 2.106 -3.064 1.00 0.00 C ATOM 548 O LEU A 38 13.540 2.201 -2.764 1.00 0.00 O ATOM 549 CB LEU A 38 11.524 3.059 -0.905 1.00 0.00 C ATOM 550 CG LEU A 38 10.277 3.618 -0.218 1.00 0.00 C ATOM 551 CD1 LEU A 38 10.655 4.351 1.060 1.00 0.00 C ATOM 552 CD2 LEU A 38 9.519 4.542 -1.160 1.00 0.00 C ATOM 0 H LEU A 38 12.023 0.490 -0.738 1.00 0.00 H new ATOM 0 HA LEU A 38 10.307 2.181 -2.444 1.00 0.00 H new ATOM 0 HB2 LEU A 38 12.172 2.627 -0.142 1.00 0.00 H new ATOM 0 HB3 LEU A 38 12.070 3.889 -1.354 1.00 0.00 H new ATOM 0 HG LEU A 38 9.625 2.785 0.045 1.00 0.00 H new ATOM 0 HD11 LEU A 38 9.755 4.742 1.535 1.00 0.00 H new ATOM 0 HD12 LEU A 38 11.154 3.662 1.741 1.00 0.00 H new ATOM 0 HD13 LEU A 38 11.327 5.176 0.821 1.00 0.00 H new ATOM 0 HD21 LEU A 38 8.635 4.931 -0.655 1.00 0.00 H new ATOM 0 HD22 LEU A 38 10.163 5.371 -1.453 1.00 0.00 H new ATOM 0 HD23 LEU A 38 9.215 3.987 -2.048 1.00 0.00 H new ATOM 564 N GLU A 39 11.920 2.089 -4.322 1.00 0.00 N ATOM 565 CA GLU A 39 12.845 2.181 -5.446 1.00 0.00 C ATOM 566 C GLU A 39 13.909 3.244 -5.189 1.00 0.00 C ATOM 567 O GLU A 39 15.066 3.086 -5.581 1.00 0.00 O ATOM 568 CB GLU A 39 12.085 2.506 -6.734 1.00 0.00 C ATOM 569 CG GLU A 39 11.098 1.428 -7.147 1.00 0.00 C ATOM 570 CD GLU A 39 11.753 0.070 -7.314 1.00 0.00 C ATOM 571 OE1 GLU A 39 12.487 -0.115 -8.307 1.00 0.00 O ATOM 572 OE2 GLU A 39 11.532 -0.806 -6.452 1.00 0.00 O ATOM 0 H GLU A 39 10.938 2.013 -4.588 1.00 0.00 H new ATOM 0 HA GLU A 39 13.339 1.216 -5.557 1.00 0.00 H new ATOM 0 HB2 GLU A 39 11.549 3.446 -6.602 1.00 0.00 H new ATOM 0 HB3 GLU A 39 12.802 2.658 -7.540 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.309 1.357 -6.398 1.00 0.00 H new ATOM 0 HG3 GLU A 39 10.623 1.716 -8.085 1.00 0.00 H new ATOM 579 N ASP A 40 13.510 4.326 -4.530 1.00 0.00 N ATOM 580 CA ASP A 40 14.429 5.415 -4.219 1.00 0.00 C ATOM 581 C ASP A 40 13.971 6.175 -2.979 1.00 0.00 C ATOM 582 O ASP A 40 12.972 6.894 -3.012 1.00 0.00 O ATOM 583 CB ASP A 40 14.540 6.371 -5.408 1.00 0.00 C ATOM 584 CG ASP A 40 15.589 5.931 -6.409 1.00 0.00 C ATOM 585 OD1 ASP A 40 16.790 6.150 -6.145 1.00 0.00 O ATOM 586 OD2 ASP A 40 15.210 5.368 -7.457 1.00 0.00 O ATOM 0 H ASP A 40 12.556 4.473 -4.201 1.00 0.00 H new ATOM 0 HA ASP A 40 15.410 4.984 -4.016 1.00 0.00 H new ATOM 0 HB2 ASP A 40 13.573 6.440 -5.906 1.00 0.00 H new ATOM 0 HB3 ASP A 40 14.784 7.370 -5.046 1.00 0.00 H new ATOM 591 N VAL A 41 14.708 6.012 -1.885 1.00 0.00 N ATOM 592 CA VAL A 41 14.377 6.683 -0.633 1.00 0.00 C ATOM 593 C VAL A 41 14.346 8.196 -0.813 1.00 0.00 C ATOM 594 O VAL A 41 13.789 8.918 0.013 1.00 0.00 O ATOM 595 CB VAL A 41 15.386 6.329 0.476 1.00 0.00 C ATOM 596 CG1 VAL A 41 15.442 4.824 0.687 1.00 0.00 C ATOM 597 CG2 VAL A 41 16.763 6.880 0.139 1.00 0.00 C ATOM 0 H VAL A 41 15.538 5.421 -1.840 1.00 0.00 H new ATOM 0 HA VAL A 41 13.387 6.335 -0.338 1.00 0.00 H new ATOM 0 HB VAL A 41 15.053 6.790 1.406 1.00 0.00 H new ATOM 0 HG11 VAL A 41 16.160 4.593 1.474 1.00 0.00 H new ATOM 0 HG12 VAL A 41 14.456 4.460 0.977 1.00 0.00 H new ATOM 0 HG13 VAL A 41 15.750 4.338 -0.239 1.00 0.00 H new ATOM 0 HG21 VAL A 41 17.463 6.621 0.933 1.00 0.00 H new ATOM 0 HG22 VAL A 41 17.106 6.450 -0.802 1.00 0.00 H new ATOM 0 HG23 VAL A 41 16.708 7.964 0.044 1.00 0.00 H new ATOM 607 N ASN A 42 14.948 8.670 -1.899 1.00 0.00 N ATOM 608 CA ASN A 42 14.989 10.099 -2.187 1.00 0.00 C ATOM 609 C ASN A 42 13.600 10.623 -2.539 1.00 0.00 C ATOM 610 O ASN A 42 13.370 11.832 -2.564 1.00 0.00 O ATOM 611 CB ASN A 42 15.959 10.381 -3.337 1.00 0.00 C ATOM 612 CG ASN A 42 17.394 10.045 -2.978 1.00 0.00 C ATOM 613 OD1 ASN A 42 18.107 10.861 -2.395 1.00 0.00 O ATOM 614 ND2 ASN A 42 17.823 8.837 -3.327 1.00 0.00 N ATOM 0 H ASN A 42 15.414 8.086 -2.594 1.00 0.00 H new ATOM 0 HA ASN A 42 15.337 10.615 -1.292 1.00 0.00 H new ATOM 0 HB2 ASN A 42 15.661 9.802 -4.211 1.00 0.00 H new ATOM 0 HB3 ASN A 42 15.893 11.433 -3.614 1.00 0.00 H new ATOM 0 HD21 ASN A 42 18.779 8.554 -3.113 1.00 0.00 H new ATOM 0 HD22 ASN A 42 17.196 8.193 -3.809 1.00 0.00 H new ATOM 621 N ALA A 43 12.678 9.705 -2.810 1.00 0.00 N ATOM 622 CA ALA A 43 11.312 10.074 -3.158 1.00 0.00 C ATOM 623 C ALA A 43 10.682 10.936 -2.069 1.00 0.00 C ATOM 624 O ALA A 43 10.056 11.957 -2.356 1.00 0.00 O ATOM 625 CB ALA A 43 10.473 8.827 -3.398 1.00 0.00 C ATOM 0 H ALA A 43 12.853 8.700 -2.795 1.00 0.00 H new ATOM 0 HA ALA A 43 11.343 10.660 -4.077 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.455 9.118 -3.657 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.905 8.250 -4.216 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.458 8.219 -2.493 1.00 0.00 H new ATOM 631 N LEU A 44 10.850 10.518 -0.819 1.00 0.00 N ATOM 632 CA LEU A 44 10.297 11.252 0.314 1.00 0.00 C ATOM 633 C LEU A 44 10.974 12.610 0.466 1.00 0.00 C ATOM 634 O LEU A 44 10.323 13.611 0.767 1.00 0.00 O ATOM 635 CB LEU A 44 10.461 10.441 1.601 1.00 0.00 C ATOM 636 CG LEU A 44 10.246 8.932 1.475 1.00 0.00 C ATOM 637 CD1 LEU A 44 10.049 8.305 2.847 1.00 0.00 C ATOM 638 CD2 LEU A 44 9.056 8.636 0.575 1.00 0.00 C ATOM 0 H LEU A 44 11.365 9.675 -0.565 1.00 0.00 H new ATOM 0 HA LEU A 44 9.236 11.415 0.127 1.00 0.00 H new ATOM 0 HB2 LEU A 44 11.464 10.614 1.990 1.00 0.00 H new ATOM 0 HB3 LEU A 44 9.761 10.827 2.342 1.00 0.00 H new ATOM 0 HG LEU A 44 11.135 8.494 1.022 1.00 0.00 H new ATOM 0 HD11 LEU A 44 9.897 7.231 2.738 1.00 0.00 H new ATOM 0 HD12 LEU A 44 10.932 8.486 3.460 1.00 0.00 H new ATOM 0 HD13 LEU A 44 9.176 8.748 3.327 1.00 0.00 H new ATOM 0 HD21 LEU A 44 8.918 7.558 0.497 1.00 0.00 H new ATOM 0 HD22 LEU A 44 8.159 9.087 0.998 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.237 9.051 -0.416 1.00 0.00 H new ATOM 650 N THR A 45 12.286 12.639 0.253 1.00 0.00 N ATOM 651 CA THR A 45 13.051 13.874 0.365 1.00 0.00 C ATOM 652 C THR A 45 12.610 14.891 -0.682 1.00 0.00 C ATOM 653 O THR A 45 12.215 16.007 -0.348 1.00 0.00 O ATOM 654 CB THR A 45 14.562 13.615 0.208 1.00 0.00 C ATOM 655 OG1 THR A 45 15.045 12.847 1.316 1.00 0.00 O ATOM 656 CG2 THR A 45 15.329 14.926 0.120 1.00 0.00 C ATOM 0 H THR A 45 12.841 11.821 0.002 1.00 0.00 H new ATOM 0 HA THR A 45 12.860 14.275 1.360 1.00 0.00 H new ATOM 0 HB THR A 45 14.719 13.058 -0.716 1.00 0.00 H new ATOM 0 HG1 THR A 45 16.005 12.685 1.208 1.00 0.00 H new ATOM 0 HG21 THR A 45 16.393 14.718 0.010 1.00 0.00 H new ATOM 0 HG22 THR A 45 14.979 15.495 -0.741 1.00 0.00 H new ATOM 0 HG23 THR A 45 15.165 15.505 1.029 1.00 0.00 H new ATOM 664 N ASN A 46 12.680 14.497 -1.949 1.00 0.00 N ATOM 665 CA ASN A 46 12.287 15.376 -3.045 1.00 0.00 C ATOM 666 C ASN A 46 10.980 16.094 -2.725 1.00 0.00 C ATOM 667 O ASN A 46 10.754 17.220 -3.170 1.00 0.00 O ATOM 668 CB ASN A 46 12.138 14.574 -4.340 1.00 0.00 C ATOM 669 CG ASN A 46 13.459 14.012 -4.828 1.00 0.00 C ATOM 670 OD1 ASN A 46 13.506 12.700 -5.026 1.00 0.00 O flip ATOM 671 ND2 ASN A 46 14.425 14.749 -5.024 1.00 0.00 N flip ATOM 0 H ASN A 46 13.005 13.576 -2.242 1.00 0.00 H new ATOM 0 HA ASN A 46 13.069 16.124 -3.176 1.00 0.00 H new ATOM 0 HB2 ASN A 46 11.436 13.756 -4.179 1.00 0.00 H new ATOM 0 HB3 ASN A 46 11.711 15.213 -5.113 1.00 0.00 H new ATOM 0 HD21 ASN A 46 14.343 15.752 -4.858 1.00 0.00 H new ATOM 0 HD22 ASN A 46 15.308 14.357 -5.352 1.00 0.00 H new ATOM 678 N ILE A 47 10.125 15.437 -1.950 1.00 0.00 N ATOM 679 CA ILE A 47 8.841 16.013 -1.568 1.00 0.00 C ATOM 680 C ILE A 47 9.024 17.144 -0.562 1.00 0.00 C ATOM 681 O ILE A 47 8.689 18.296 -0.837 1.00 0.00 O ATOM 682 CB ILE A 47 7.904 14.951 -0.965 1.00 0.00 C ATOM 683 CG1 ILE A 47 7.407 14.000 -2.056 1.00 0.00 C ATOM 684 CG2 ILE A 47 6.731 15.617 -0.261 1.00 0.00 C ATOM 685 CD1 ILE A 47 6.623 12.822 -1.519 1.00 0.00 C ATOM 0 H ILE A 47 10.298 14.505 -1.574 1.00 0.00 H new ATOM 0 HA ILE A 47 8.389 16.408 -2.478 1.00 0.00 H new ATOM 0 HB ILE A 47 8.462 14.371 -0.230 1.00 0.00 H new ATOM 0 HG12 ILE A 47 6.780 14.556 -2.753 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.262 13.630 -2.621 1.00 0.00 H new ATOM 0 HG21 ILE A 47 6.078 14.853 0.160 1.00 0.00 H new ATOM 0 HG22 ILE A 47 7.103 16.257 0.539 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.171 16.219 -0.977 1.00 0.00 H new ATOM 0 HD11 ILE A 47 6.302 12.190 -2.347 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.253 12.243 -0.844 1.00 0.00 H new ATOM 0 HD13 ILE A 47 5.748 13.183 -0.978 1.00 0.00 H new ATOM 697 N LYS A 48 9.560 16.808 0.607 1.00 0.00 N ATOM 698 CA LYS A 48 9.792 17.794 1.655 1.00 0.00 C ATOM 699 C LYS A 48 10.275 19.114 1.063 1.00 0.00 C ATOM 700 O LYS A 48 10.012 20.185 1.611 1.00 0.00 O ATOM 701 CB LYS A 48 10.819 17.269 2.661 1.00 0.00 C ATOM 702 CG LYS A 48 10.391 15.985 3.351 1.00 0.00 C ATOM 703 CD LYS A 48 11.243 15.701 4.577 1.00 0.00 C ATOM 704 CE LYS A 48 10.591 14.665 5.481 1.00 0.00 C ATOM 705 NZ LYS A 48 9.695 15.295 6.489 1.00 0.00 N ATOM 0 H LYS A 48 9.842 15.859 0.852 1.00 0.00 H new ATOM 0 HA LYS A 48 8.847 17.970 2.168 1.00 0.00 H new ATOM 0 HB2 LYS A 48 11.765 17.098 2.147 1.00 0.00 H new ATOM 0 HB3 LYS A 48 11.001 18.034 3.416 1.00 0.00 H new ATOM 0 HG2 LYS A 48 9.344 16.060 3.644 1.00 0.00 H new ATOM 0 HG3 LYS A 48 10.468 15.152 2.652 1.00 0.00 H new ATOM 0 HD2 LYS A 48 12.225 15.346 4.265 1.00 0.00 H new ATOM 0 HD3 LYS A 48 11.400 16.625 5.134 1.00 0.00 H new ATOM 0 HE2 LYS A 48 10.019 13.963 4.875 1.00 0.00 H new ATOM 0 HE3 LYS A 48 11.364 14.090 5.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 9.270 14.557 7.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 10.246 15.946 7.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 8.942 15.823 6.003 1.00 0.00 H new ATOM 719 N ARG A 49 10.980 19.031 -0.060 1.00 0.00 N ATOM 720 CA ARG A 49 11.499 20.219 -0.727 1.00 0.00 C ATOM 721 C ARG A 49 10.365 21.048 -1.322 1.00 0.00 C ATOM 722 O ARG A 49 10.249 22.244 -1.055 1.00 0.00 O ATOM 723 CB ARG A 49 12.487 19.824 -1.826 1.00 0.00 C ATOM 724 CG ARG A 49 13.638 18.965 -1.329 1.00 0.00 C ATOM 725 CD ARG A 49 14.560 18.557 -2.468 1.00 0.00 C ATOM 726 NE ARG A 49 15.599 17.630 -2.026 1.00 0.00 N ATOM 727 CZ ARG A 49 16.737 18.017 -1.462 1.00 0.00 C ATOM 728 NH1 ARG A 49 16.982 19.306 -1.272 1.00 0.00 N ATOM 729 NH2 ARG A 49 17.634 17.114 -1.086 1.00 0.00 N ATOM 0 H ARG A 49 11.205 18.153 -0.528 1.00 0.00 H new ATOM 0 HA ARG A 49 12.017 20.824 0.017 1.00 0.00 H new ATOM 0 HB2 ARG A 49 11.952 19.284 -2.607 1.00 0.00 H new ATOM 0 HB3 ARG A 49 12.890 20.728 -2.283 1.00 0.00 H new ATOM 0 HG2 ARG A 49 14.206 19.515 -0.578 1.00 0.00 H new ATOM 0 HG3 ARG A 49 13.244 18.074 -0.841 1.00 0.00 H new ATOM 0 HD2 ARG A 49 13.973 18.093 -3.261 1.00 0.00 H new ATOM 0 HD3 ARG A 49 15.025 19.446 -2.894 1.00 0.00 H new ATOM 0 HE ARG A 49 15.442 16.631 -2.158 1.00 0.00 H new ATOM 0 HH11 ARG A 49 16.295 20.003 -1.559 1.00 0.00 H new ATOM 0 HH12 ARG A 49 17.857 19.600 -0.838 1.00 0.00 H new ATOM 0 HH21 ARG A 49 17.450 16.121 -1.230 1.00 0.00 H new ATOM 0 HH22 ARG A 49 18.508 17.413 -0.653 1.00 0.00 H new ATOM 743 N TYR A 50 9.530 20.404 -2.130 1.00 0.00 N ATOM 744 CA TYR A 50 8.406 21.082 -2.766 1.00 0.00 C ATOM 745 C TYR A 50 7.585 21.856 -1.739 1.00 0.00 C ATOM 746 O TYR A 50 7.225 23.013 -1.959 1.00 0.00 O ATOM 747 CB TYR A 50 7.515 20.070 -3.488 1.00 0.00 C ATOM 748 CG TYR A 50 6.179 20.634 -3.913 1.00 0.00 C ATOM 749 CD1 TYR A 50 5.188 20.907 -2.978 1.00 0.00 C ATOM 750 CD2 TYR A 50 5.906 20.894 -5.250 1.00 0.00 C ATOM 751 CE1 TYR A 50 3.965 21.423 -3.362 1.00 0.00 C ATOM 752 CE2 TYR A 50 4.686 21.410 -5.643 1.00 0.00 C ATOM 753 CZ TYR A 50 3.719 21.673 -4.695 1.00 0.00 C ATOM 754 OH TYR A 50 2.503 22.186 -5.083 1.00 0.00 O ATOM 0 H TYR A 50 9.610 19.414 -2.360 1.00 0.00 H new ATOM 0 HA TYR A 50 8.806 21.789 -3.493 1.00 0.00 H new ATOM 0 HB2 TYR A 50 8.040 19.700 -4.368 1.00 0.00 H new ATOM 0 HB3 TYR A 50 7.347 19.215 -2.834 1.00 0.00 H new ATOM 0 HD1 TYR A 50 5.377 20.712 -1.933 1.00 0.00 H new ATOM 0 HD2 TYR A 50 6.660 20.689 -5.995 1.00 0.00 H new ATOM 0 HE1 TYR A 50 3.206 21.629 -2.622 1.00 0.00 H new ATOM 0 HE2 TYR A 50 4.490 21.606 -6.687 1.00 0.00 H new ATOM 0 HH TYR A 50 2.493 22.304 -6.056 1.00 0.00 H new ATOM 764 N LEU A 51 7.295 21.211 -0.615 1.00 0.00 N ATOM 765 CA LEU A 51 6.517 21.837 0.448 1.00 0.00 C ATOM 766 C LEU A 51 6.994 23.263 0.704 1.00 0.00 C ATOM 767 O LEU A 51 6.205 24.137 1.060 1.00 0.00 O ATOM 768 CB LEU A 51 6.619 21.015 1.734 1.00 0.00 C ATOM 769 CG LEU A 51 5.640 19.848 1.864 1.00 0.00 C ATOM 770 CD1 LEU A 51 6.112 18.871 2.930 1.00 0.00 C ATOM 771 CD2 LEU A 51 4.243 20.356 2.185 1.00 0.00 C ATOM 0 H LEU A 51 7.587 20.254 -0.416 1.00 0.00 H new ATOM 0 HA LEU A 51 5.475 21.873 0.129 1.00 0.00 H new ATOM 0 HB2 LEU A 51 7.633 20.623 1.811 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.471 21.684 2.582 1.00 0.00 H new ATOM 0 HG LEU A 51 5.603 19.323 0.910 1.00 0.00 H new ATOM 0 HD11 LEU A 51 5.403 18.047 3.008 1.00 0.00 H new ATOM 0 HD12 LEU A 51 7.093 18.481 2.657 1.00 0.00 H new ATOM 0 HD13 LEU A 51 6.180 19.384 3.889 1.00 0.00 H new ATOM 0 HD21 LEU A 51 3.560 19.511 2.274 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.263 20.907 3.126 1.00 0.00 H new ATOM 0 HD23 LEU A 51 3.903 21.015 1.386 1.00 0.00 H new ATOM 783 N GLU A 52 8.291 23.490 0.517 1.00 0.00 N ATOM 784 CA GLU A 52 8.872 24.811 0.726 1.00 0.00 C ATOM 785 C GLU A 52 8.778 25.654 -0.542 1.00 0.00 C ATOM 786 O GLU A 52 8.678 26.879 -0.480 1.00 0.00 O ATOM 787 CB GLU A 52 10.334 24.686 1.161 1.00 0.00 C ATOM 788 CG GLU A 52 11.212 25.830 0.680 1.00 0.00 C ATOM 789 CD GLU A 52 12.339 26.145 1.644 1.00 0.00 C ATOM 790 OE1 GLU A 52 12.125 26.025 2.868 1.00 0.00 O ATOM 791 OE2 GLU A 52 13.437 26.511 1.173 1.00 0.00 O ATOM 0 H GLU A 52 8.958 22.777 0.222 1.00 0.00 H new ATOM 0 HA GLU A 52 8.306 25.308 1.514 1.00 0.00 H new ATOM 0 HB2 GLU A 52 10.378 24.638 2.249 1.00 0.00 H new ATOM 0 HB3 GLU A 52 10.737 23.746 0.784 1.00 0.00 H new ATOM 0 HG2 GLU A 52 11.632 25.576 -0.293 1.00 0.00 H new ATOM 0 HG3 GLU A 52 10.599 26.720 0.541 1.00 0.00 H new ATOM 798 N GLY A 53 8.811 24.989 -1.693 1.00 0.00 N ATOM 799 CA GLY A 53 8.728 25.692 -2.959 1.00 0.00 C ATOM 800 C GLY A 53 10.082 25.850 -3.623 1.00 0.00 C ATOM 801 O GLY A 53 10.297 26.783 -4.398 1.00 0.00 O ATOM 0 H GLY A 53 8.894 23.975 -1.771 1.00 0.00 H new ATOM 0 HA2 GLY A 53 8.059 25.151 -3.628 1.00 0.00 H new ATOM 0 HA3 GLY A 53 8.289 26.676 -2.797 1.00 0.00 H new ATOM 868 N LEU A 58 7.818 19.018 -10.516 1.00 0.00 N ATOM 869 CA LEU A 58 7.070 18.130 -9.633 1.00 0.00 C ATOM 870 C LEU A 58 7.909 16.916 -9.244 1.00 0.00 C ATOM 871 O LEU A 58 8.456 16.212 -10.092 1.00 0.00 O ATOM 872 CB LEU A 58 5.777 17.674 -10.311 1.00 0.00 C ATOM 873 CG LEU A 58 4.574 17.467 -9.390 1.00 0.00 C ATOM 874 CD1 LEU A 58 4.828 16.315 -8.430 1.00 0.00 C ATOM 875 CD2 LEU A 58 4.262 18.744 -8.624 1.00 0.00 C ATOM 0 HA LEU A 58 6.822 18.683 -8.727 1.00 0.00 H new ATOM 0 HB2 LEU A 58 5.508 18.411 -11.068 1.00 0.00 H new ATOM 0 HB3 LEU A 58 5.975 16.738 -10.834 1.00 0.00 H new ATOM 0 HG LEU A 58 3.710 17.216 -10.005 1.00 0.00 H new ATOM 0 HD11 LEU A 58 3.961 16.183 -7.783 1.00 0.00 H new ATOM 0 HD12 LEU A 58 5.000 15.400 -8.997 1.00 0.00 H new ATOM 0 HD13 LEU A 58 5.705 16.535 -7.821 1.00 0.00 H new ATOM 0 HD21 LEU A 58 3.403 18.578 -7.974 1.00 0.00 H new ATOM 0 HD22 LEU A 58 5.125 19.026 -8.021 1.00 0.00 H new ATOM 0 HD23 LEU A 58 4.034 19.544 -9.328 1.00 0.00 H new ATOM 887 N PRO A 59 8.012 16.664 -7.931 1.00 0.00 N ATOM 888 CA PRO A 59 8.780 15.534 -7.399 1.00 0.00 C ATOM 889 C PRO A 59 8.124 14.192 -7.705 1.00 0.00 C ATOM 890 O PRO A 59 6.925 14.108 -7.976 1.00 0.00 O ATOM 891 CB PRO A 59 8.793 15.792 -5.891 1.00 0.00 C ATOM 892 CG PRO A 59 7.576 16.614 -5.636 1.00 0.00 C ATOM 893 CD PRO A 59 7.386 17.463 -6.863 1.00 0.00 C ATOM 0 HA PRO A 59 9.774 15.472 -7.843 1.00 0.00 H new ATOM 0 HB2 PRO A 59 8.765 14.858 -5.329 1.00 0.00 H new ATOM 0 HB3 PRO A 59 9.697 16.319 -5.587 1.00 0.00 H new ATOM 0 HG2 PRO A 59 6.706 15.980 -5.461 1.00 0.00 H new ATOM 0 HG3 PRO A 59 7.702 17.234 -4.748 1.00 0.00 H new ATOM 0 HD2 PRO A 59 6.331 17.647 -7.065 1.00 0.00 H new ATOM 0 HD3 PRO A 59 7.865 18.436 -6.756 1.00 0.00 H new ATOM 901 N PRO A 60 8.924 13.117 -7.662 1.00 0.00 N ATOM 902 CA PRO A 60 8.442 11.759 -7.931 1.00 0.00 C ATOM 903 C PRO A 60 7.524 11.242 -6.829 1.00 0.00 C ATOM 904 O PRO A 60 7.945 11.068 -5.685 1.00 0.00 O ATOM 905 CB PRO A 60 9.728 10.931 -7.988 1.00 0.00 C ATOM 906 CG PRO A 60 10.706 11.692 -7.162 1.00 0.00 C ATOM 907 CD PRO A 60 10.363 13.145 -7.346 1.00 0.00 C ATOM 0 HA PRO A 60 7.847 11.710 -8.843 1.00 0.00 H new ATOM 0 HB2 PRO A 60 9.571 9.928 -7.591 1.00 0.00 H new ATOM 0 HB3 PRO A 60 10.080 10.817 -9.013 1.00 0.00 H new ATOM 0 HG2 PRO A 60 10.637 11.405 -6.113 1.00 0.00 H new ATOM 0 HG3 PRO A 60 11.728 11.489 -7.482 1.00 0.00 H new ATOM 0 HD2 PRO A 60 10.566 13.723 -6.445 1.00 0.00 H new ATOM 0 HD3 PRO A 60 10.943 13.596 -8.151 1.00 0.00 H new ATOM 915 N LYS A 61 6.266 10.996 -7.180 1.00 0.00 N ATOM 916 CA LYS A 61 5.287 10.496 -6.222 1.00 0.00 C ATOM 917 C LYS A 61 5.871 9.357 -5.391 1.00 0.00 C ATOM 918 O LYS A 61 6.971 8.876 -5.668 1.00 0.00 O ATOM 919 CB LYS A 61 4.029 10.017 -6.950 1.00 0.00 C ATOM 920 CG LYS A 61 4.296 8.928 -7.974 1.00 0.00 C ATOM 921 CD LYS A 61 3.003 8.328 -8.500 1.00 0.00 C ATOM 922 CE LYS A 61 3.158 7.838 -9.932 1.00 0.00 C ATOM 923 NZ LYS A 61 3.925 6.564 -10.002 1.00 0.00 N ATOM 0 H LYS A 61 5.900 11.135 -8.122 1.00 0.00 H new ATOM 0 HA LYS A 61 5.022 11.313 -5.551 1.00 0.00 H new ATOM 0 HB2 LYS A 61 3.314 9.646 -6.216 1.00 0.00 H new ATOM 0 HB3 LYS A 61 3.562 10.866 -7.449 1.00 0.00 H new ATOM 0 HG2 LYS A 61 4.871 9.340 -8.803 1.00 0.00 H new ATOM 0 HG3 LYS A 61 4.905 8.144 -7.523 1.00 0.00 H new ATOM 0 HD2 LYS A 61 2.699 7.499 -7.861 1.00 0.00 H new ATOM 0 HD3 LYS A 61 2.209 9.074 -8.453 1.00 0.00 H new ATOM 0 HE2 LYS A 61 2.173 7.694 -10.375 1.00 0.00 H new ATOM 0 HE3 LYS A 61 3.665 8.600 -10.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 3.865 6.175 -10.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 4.921 6.745 -9.763 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 3.525 5.881 -9.327 1.00 0.00 H new ATOM 937 N ILE A 62 5.129 8.931 -4.376 1.00 0.00 N ATOM 938 CA ILE A 62 5.572 7.847 -3.507 1.00 0.00 C ATOM 939 C ILE A 62 4.988 6.512 -3.953 1.00 0.00 C ATOM 940 O ILE A 62 3.833 6.200 -3.661 1.00 0.00 O ATOM 941 CB ILE A 62 5.179 8.104 -2.041 1.00 0.00 C ATOM 942 CG1 ILE A 62 5.879 9.358 -1.514 1.00 0.00 C ATOM 943 CG2 ILE A 62 5.523 6.897 -1.181 1.00 0.00 C ATOM 944 CD1 ILE A 62 5.449 9.748 -0.117 1.00 0.00 C ATOM 0 H ILE A 62 4.217 9.320 -4.134 1.00 0.00 H new ATOM 0 HA ILE A 62 6.659 7.807 -3.581 1.00 0.00 H new ATOM 0 HB ILE A 62 4.102 8.265 -1.992 1.00 0.00 H new ATOM 0 HG12 ILE A 62 6.956 9.193 -1.521 1.00 0.00 H new ATOM 0 HG13 ILE A 62 5.679 10.188 -2.192 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.239 7.094 -0.147 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.982 6.024 -1.546 1.00 0.00 H new ATOM 0 HG23 ILE A 62 6.595 6.707 -1.233 1.00 0.00 H new ATOM 0 HD11 ILE A 62 5.986 10.645 0.192 1.00 0.00 H new ATOM 0 HD12 ILE A 62 4.377 9.945 -0.108 1.00 0.00 H new ATOM 0 HD13 ILE A 62 5.674 8.935 0.573 1.00 0.00 H new ATOM 956 N GLU A 63 5.793 5.725 -4.660 1.00 0.00 N ATOM 957 CA GLU A 63 5.355 4.422 -5.145 1.00 0.00 C ATOM 958 C GLU A 63 6.281 3.316 -4.646 1.00 0.00 C ATOM 959 O GLU A 63 7.492 3.360 -4.864 1.00 0.00 O ATOM 960 CB GLU A 63 5.308 4.411 -6.674 1.00 0.00 C ATOM 961 CG GLU A 63 4.486 3.270 -7.250 1.00 0.00 C ATOM 962 CD GLU A 63 4.795 3.008 -8.711 1.00 0.00 C ATOM 963 OE1 GLU A 63 4.575 3.919 -9.537 1.00 0.00 O ATOM 964 OE2 GLU A 63 5.257 1.892 -9.029 1.00 0.00 O ATOM 0 H GLU A 63 6.752 5.967 -4.909 1.00 0.00 H new ATOM 0 HA GLU A 63 4.354 4.237 -4.757 1.00 0.00 H new ATOM 0 HB2 GLU A 63 4.895 5.357 -7.023 1.00 0.00 H new ATOM 0 HB3 GLU A 63 6.325 4.346 -7.060 1.00 0.00 H new ATOM 0 HG2 GLU A 63 4.675 2.364 -6.674 1.00 0.00 H new ATOM 0 HG3 GLU A 63 3.426 3.500 -7.142 1.00 0.00 H new ATOM 971 N PHE A 64 5.703 2.326 -3.974 1.00 0.00 N ATOM 972 CA PHE A 64 6.475 1.209 -3.442 1.00 0.00 C ATOM 973 C PHE A 64 5.636 -0.065 -3.407 1.00 0.00 C ATOM 974 O PHE A 64 4.474 -0.067 -3.812 1.00 0.00 O ATOM 975 CB PHE A 64 6.985 1.537 -2.037 1.00 0.00 C ATOM 976 CG PHE A 64 5.906 2.002 -1.102 1.00 0.00 C ATOM 977 CD1 PHE A 64 5.243 3.198 -1.327 1.00 0.00 C ATOM 978 CD2 PHE A 64 5.553 1.243 0.002 1.00 0.00 C ATOM 979 CE1 PHE A 64 4.251 3.629 -0.467 1.00 0.00 C ATOM 980 CE2 PHE A 64 4.561 1.668 0.865 1.00 0.00 C ATOM 981 CZ PHE A 64 3.908 2.862 0.629 1.00 0.00 C ATOM 0 H PHE A 64 4.702 2.274 -3.785 1.00 0.00 H new ATOM 0 HA PHE A 64 7.328 1.043 -4.101 1.00 0.00 H new ATOM 0 HB2 PHE A 64 7.463 0.652 -1.617 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.751 2.309 -2.108 1.00 0.00 H new ATOM 0 HD1 PHE A 64 5.505 3.800 -2.184 1.00 0.00 H new ATOM 0 HD2 PHE A 64 6.059 0.308 0.190 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.744 4.565 -0.652 1.00 0.00 H new ATOM 0 HE2 PHE A 64 4.297 1.067 1.723 1.00 0.00 H new ATOM 0 HZ PHE A 64 3.130 3.195 1.300 1.00 0.00 H new ATOM 991 N VAL A 65 6.235 -1.147 -2.920 1.00 0.00 N ATOM 992 CA VAL A 65 5.544 -2.428 -2.831 1.00 0.00 C ATOM 993 C VAL A 65 5.561 -2.963 -1.403 1.00 0.00 C ATOM 994 O VAL A 65 6.623 -3.109 -0.797 1.00 0.00 O ATOM 995 CB VAL A 65 6.177 -3.474 -3.767 1.00 0.00 C ATOM 996 CG1 VAL A 65 5.290 -4.705 -3.871 1.00 0.00 C ATOM 997 CG2 VAL A 65 6.433 -2.873 -5.141 1.00 0.00 C ATOM 0 H VAL A 65 7.197 -1.162 -2.581 1.00 0.00 H new ATOM 0 HA VAL A 65 4.513 -2.254 -3.139 1.00 0.00 H new ATOM 0 HB VAL A 65 7.134 -3.781 -3.346 1.00 0.00 H new ATOM 0 HG11 VAL A 65 5.754 -5.433 -4.537 1.00 0.00 H new ATOM 0 HG12 VAL A 65 5.163 -5.147 -2.883 1.00 0.00 H new ATOM 0 HG13 VAL A 65 4.316 -4.419 -4.268 1.00 0.00 H new ATOM 0 HG21 VAL A 65 6.881 -3.626 -5.790 1.00 0.00 H new ATOM 0 HG22 VAL A 65 5.490 -2.536 -5.572 1.00 0.00 H new ATOM 0 HG23 VAL A 65 7.112 -2.025 -5.047 1.00 0.00 H new ATOM 1007 N ILE A 66 4.378 -3.254 -0.873 1.00 0.00 N ATOM 1008 CA ILE A 66 4.257 -3.775 0.483 1.00 0.00 C ATOM 1009 C ILE A 66 3.888 -5.254 0.473 1.00 0.00 C ATOM 1010 O ILE A 66 2.896 -5.654 -0.138 1.00 0.00 O ATOM 1011 CB ILE A 66 3.201 -2.999 1.292 1.00 0.00 C ATOM 1012 CG1 ILE A 66 3.563 -1.514 1.353 1.00 0.00 C ATOM 1013 CG2 ILE A 66 3.078 -3.577 2.694 1.00 0.00 C ATOM 1014 CD1 ILE A 66 2.676 -0.713 2.280 1.00 0.00 C ATOM 0 H ILE A 66 3.490 -3.138 -1.362 1.00 0.00 H new ATOM 0 HA ILE A 66 5.230 -3.649 0.957 1.00 0.00 H new ATOM 0 HB ILE A 66 2.237 -3.099 0.793 1.00 0.00 H new ATOM 0 HG12 ILE A 66 4.599 -1.414 1.678 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.501 -1.092 0.350 1.00 0.00 H new ATOM 0 HG21 ILE A 66 2.328 -3.018 3.253 1.00 0.00 H new ATOM 0 HG22 ILE A 66 2.779 -4.623 2.631 1.00 0.00 H new ATOM 0 HG23 ILE A 66 4.039 -3.504 3.203 1.00 0.00 H new ATOM 0 HD11 ILE A 66 2.991 0.331 2.273 1.00 0.00 H new ATOM 0 HD12 ILE A 66 1.642 -0.782 1.944 1.00 0.00 H new ATOM 0 HD13 ILE A 66 2.756 -1.109 3.292 1.00 0.00 H new ATOM 1026 N THR A 67 4.691 -6.064 1.156 1.00 0.00 N ATOM 1027 CA THR A 67 4.448 -7.500 1.227 1.00 0.00 C ATOM 1028 C THR A 67 3.556 -7.849 2.413 1.00 0.00 C ATOM 1029 O THR A 67 3.992 -7.808 3.564 1.00 0.00 O ATOM 1030 CB THR A 67 5.767 -8.287 1.342 1.00 0.00 C ATOM 1031 OG1 THR A 67 6.580 -8.053 0.186 1.00 0.00 O ATOM 1032 CG2 THR A 67 5.497 -9.777 1.485 1.00 0.00 C ATOM 0 H THR A 67 5.515 -5.750 1.668 1.00 0.00 H new ATOM 0 HA THR A 67 3.944 -7.782 0.302 1.00 0.00 H new ATOM 0 HB THR A 67 6.294 -7.942 2.232 1.00 0.00 H new ATOM 0 HG1 THR A 67 7.417 -8.556 0.268 1.00 0.00 H new ATOM 0 HG21 THR A 67 6.443 -10.312 1.565 1.00 0.00 H new ATOM 0 HG22 THR A 67 4.903 -9.955 2.382 1.00 0.00 H new ATOM 0 HG23 THR A 67 4.951 -10.133 0.612 1.00 0.00 H new ATOM 1040 N LEU A 68 2.306 -8.193 2.125 1.00 0.00 N ATOM 1041 CA LEU A 68 1.351 -8.551 3.169 1.00 0.00 C ATOM 1042 C LEU A 68 1.699 -9.903 3.784 1.00 0.00 C ATOM 1043 O LEU A 68 1.356 -10.950 3.236 1.00 0.00 O ATOM 1044 CB LEU A 68 -0.068 -8.586 2.599 1.00 0.00 C ATOM 1045 CG LEU A 68 -0.767 -7.234 2.456 1.00 0.00 C ATOM 1046 CD1 LEU A 68 -0.972 -6.592 3.819 1.00 0.00 C ATOM 1047 CD2 LEU A 68 0.032 -6.314 1.545 1.00 0.00 C ATOM 0 H LEU A 68 1.930 -8.232 1.178 1.00 0.00 H new ATOM 0 HA LEU A 68 1.403 -7.793 3.951 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.032 -9.060 1.618 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -0.679 -9.223 3.238 1.00 0.00 H new ATOM 0 HG LEU A 68 -1.745 -7.399 2.004 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.471 -5.631 3.697 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -1.587 -7.244 4.439 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.005 -6.441 4.299 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.481 -5.356 1.455 1.00 0.00 H new ATOM 0 HD22 LEU A 68 1.024 -6.156 1.967 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.126 -6.770 0.559 1.00 0.00 H new ATOM 1059 N GLN A 69 2.378 -9.871 4.926 1.00 0.00 N ATOM 1060 CA GLN A 69 2.770 -11.094 5.616 1.00 0.00 C ATOM 1061 C GLN A 69 1.562 -11.765 6.262 1.00 0.00 C ATOM 1062 O GLN A 69 1.321 -11.610 7.460 1.00 0.00 O ATOM 1063 CB GLN A 69 3.828 -10.789 6.678 1.00 0.00 C ATOM 1064 CG GLN A 69 4.279 -12.015 7.456 1.00 0.00 C ATOM 1065 CD GLN A 69 4.654 -13.174 6.553 1.00 0.00 C ATOM 1066 OE1 GLN A 69 5.787 -13.267 6.081 1.00 0.00 O ATOM 1067 NE2 GLN A 69 3.701 -14.066 6.310 1.00 0.00 N ATOM 0 H GLN A 69 2.668 -9.012 5.393 1.00 0.00 H new ATOM 0 HA GLN A 69 3.192 -11.778 4.880 1.00 0.00 H new ATOM 0 HB2 GLN A 69 4.694 -10.335 6.196 1.00 0.00 H new ATOM 0 HB3 GLN A 69 3.429 -10.053 7.376 1.00 0.00 H new ATOM 0 HG2 GLN A 69 5.135 -11.752 8.077 1.00 0.00 H new ATOM 0 HG3 GLN A 69 3.481 -12.327 8.129 1.00 0.00 H new ATOM 0 HE21 GLN A 69 2.776 -13.949 6.723 1.00 0.00 H new ATOM 0 HE22 GLN A 69 3.894 -14.868 5.711 1.00 0.00 H new ATOM 1076 N ILE A 70 0.807 -12.510 5.462 1.00 0.00 N ATOM 1077 CA ILE A 70 -0.375 -13.205 5.957 1.00 0.00 C ATOM 1078 C ILE A 70 0.006 -14.309 6.937 1.00 0.00 C ATOM 1079 O ILE A 70 0.570 -15.330 6.547 1.00 0.00 O ATOM 1080 CB ILE A 70 -1.192 -13.817 4.804 1.00 0.00 C ATOM 1081 CG1 ILE A 70 -1.521 -12.749 3.759 1.00 0.00 C ATOM 1082 CG2 ILE A 70 -2.466 -14.454 5.338 1.00 0.00 C ATOM 1083 CD1 ILE A 70 -2.549 -11.742 4.227 1.00 0.00 C ATOM 0 H ILE A 70 0.993 -12.648 4.469 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.986 -12.462 6.470 1.00 0.00 H new ATOM 0 HB ILE A 70 -0.594 -14.593 4.326 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -0.606 -12.223 3.489 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -1.887 -13.237 2.856 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -3.033 -14.882 4.511 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.210 -15.240 6.048 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -3.070 -13.696 5.838 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -2.733 -11.015 3.436 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.478 -12.257 4.470 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.177 -11.227 5.113 1.00 0.00 H new ATOM 1095 N GLU A 71 -0.307 -14.095 8.212 1.00 0.00 N ATOM 1096 CA GLU A 71 0.002 -15.074 9.248 1.00 0.00 C ATOM 1097 C GLU A 71 -0.418 -16.475 8.815 1.00 0.00 C ATOM 1098 O GLU A 71 0.345 -17.432 8.948 1.00 0.00 O ATOM 1099 CB GLU A 71 -0.696 -14.701 10.557 1.00 0.00 C ATOM 1100 CG GLU A 71 -0.014 -13.571 11.310 1.00 0.00 C ATOM 1101 CD GLU A 71 1.075 -14.065 12.243 1.00 0.00 C ATOM 1102 OE1 GLU A 71 0.751 -14.818 13.186 1.00 0.00 O ATOM 1103 OE2 GLU A 71 2.249 -13.699 12.031 1.00 0.00 O ATOM 0 H GLU A 71 -0.774 -13.254 8.551 1.00 0.00 H new ATOM 0 HA GLU A 71 1.080 -15.070 9.406 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.725 -14.413 10.341 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -0.739 -15.580 11.199 1.00 0.00 H new ATOM 0 HG2 GLU A 71 0.416 -12.870 10.594 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -0.759 -13.022 11.886 1.00 0.00 H new ATOM 1110 N GLU A 72 -1.638 -16.588 8.299 1.00 0.00 N ATOM 1111 CA GLU A 72 -2.161 -17.873 7.849 1.00 0.00 C ATOM 1112 C GLU A 72 -3.298 -17.678 6.851 1.00 0.00 C ATOM 1113 O GLU A 72 -4.224 -16.897 7.071 1.00 0.00 O ATOM 1114 CB GLU A 72 -2.650 -18.696 9.042 1.00 0.00 C ATOM 1115 CG GLU A 72 -4.105 -18.443 9.401 1.00 0.00 C ATOM 1116 CD GLU A 72 -4.411 -18.754 10.853 1.00 0.00 C ATOM 1117 OE1 GLU A 72 -3.604 -18.368 11.725 1.00 0.00 O ATOM 1118 OE2 GLU A 72 -5.456 -19.384 11.118 1.00 0.00 O ATOM 0 H GLU A 72 -2.282 -15.806 8.182 1.00 0.00 H new ATOM 0 HA GLU A 72 -1.353 -18.411 7.353 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -2.518 -19.755 8.820 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -2.027 -18.471 9.908 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -4.349 -17.400 9.198 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -4.744 -19.051 8.761 1.00 0.00 H new ATOM 1125 N PRO A 73 -3.228 -18.405 5.725 1.00 0.00 N ATOM 1126 CA PRO A 73 -2.131 -19.337 5.452 1.00 0.00 C ATOM 1127 C PRO A 73 -0.812 -18.619 5.187 1.00 0.00 C ATOM 1128 O PRO A 73 -0.742 -17.716 4.353 1.00 0.00 O ATOM 1129 CB PRO A 73 -2.599 -20.078 4.197 1.00 0.00 C ATOM 1130 CG PRO A 73 -3.537 -19.133 3.528 1.00 0.00 C ATOM 1131 CD PRO A 73 -4.215 -18.371 4.633 1.00 0.00 C ATOM 0 HA PRO A 73 -1.932 -19.992 6.300 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -1.759 -20.328 3.549 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -3.095 -21.015 4.452 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -3.001 -18.458 2.860 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.265 -19.670 2.921 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -4.447 -17.349 4.333 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -5.155 -18.839 4.926 1.00 0.00 H new ATOM 1139 N LYS A 74 0.232 -19.025 5.901 1.00 0.00 N ATOM 1140 CA LYS A 74 1.550 -18.422 5.742 1.00 0.00 C ATOM 1141 C LYS A 74 1.930 -18.326 4.268 1.00 0.00 C ATOM 1142 O LYS A 74 2.450 -19.278 3.687 1.00 0.00 O ATOM 1143 CB LYS A 74 2.601 -19.238 6.498 1.00 0.00 C ATOM 1144 CG LYS A 74 3.764 -18.405 7.010 1.00 0.00 C ATOM 1145 CD LYS A 74 3.498 -17.878 8.410 1.00 0.00 C ATOM 1146 CE LYS A 74 4.793 -17.540 9.133 1.00 0.00 C ATOM 1147 NZ LYS A 74 4.643 -17.635 10.612 1.00 0.00 N ATOM 0 H LYS A 74 0.191 -19.770 6.596 1.00 0.00 H new ATOM 0 HA LYS A 74 1.514 -17.414 6.156 1.00 0.00 H new ATOM 0 HB2 LYS A 74 2.124 -19.738 7.341 1.00 0.00 H new ATOM 0 HB3 LYS A 74 2.985 -20.018 5.841 1.00 0.00 H new ATOM 0 HG2 LYS A 74 4.671 -19.009 7.014 1.00 0.00 H new ATOM 0 HG3 LYS A 74 3.940 -17.569 6.333 1.00 0.00 H new ATOM 0 HD2 LYS A 74 2.870 -16.989 8.352 1.00 0.00 H new ATOM 0 HD3 LYS A 74 2.945 -18.623 8.982 1.00 0.00 H new ATOM 0 HE2 LYS A 74 5.581 -18.218 8.803 1.00 0.00 H new ATOM 0 HE3 LYS A 74 5.107 -16.532 8.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 5.547 -17.397 11.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 3.909 -16.970 10.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 4.368 -18.604 10.872 1.00 0.00 H new ATOM 1161 N VAL A 75 1.667 -17.169 3.668 1.00 0.00 N ATOM 1162 CA VAL A 75 1.984 -16.947 2.262 1.00 0.00 C ATOM 1163 C VAL A 75 2.518 -15.537 2.035 1.00 0.00 C ATOM 1164 O VAL A 75 2.576 -14.726 2.960 1.00 0.00 O ATOM 1165 CB VAL A 75 0.750 -17.167 1.367 1.00 0.00 C ATOM 1166 CG1 VAL A 75 0.228 -18.588 1.517 1.00 0.00 C ATOM 1167 CG2 VAL A 75 -0.335 -16.154 1.698 1.00 0.00 C ATOM 0 H VAL A 75 1.235 -16.371 4.134 1.00 0.00 H new ATOM 0 HA VAL A 75 2.753 -17.671 1.993 1.00 0.00 H new ATOM 0 HB VAL A 75 1.046 -17.022 0.328 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -0.644 -18.725 0.877 1.00 0.00 H new ATOM 0 HG12 VAL A 75 1.006 -19.294 1.226 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -0.053 -18.765 2.555 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -1.199 -16.324 1.056 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -0.630 -16.265 2.741 1.00 0.00 H new ATOM 0 HG23 VAL A 75 0.046 -15.146 1.534 1.00 0.00 H new ATOM 1177 N LYS A 76 2.907 -15.250 0.797 1.00 0.00 N ATOM 1178 CA LYS A 76 3.435 -13.937 0.446 1.00 0.00 C ATOM 1179 C LYS A 76 2.570 -13.271 -0.619 1.00 0.00 C ATOM 1180 O LYS A 76 2.209 -13.894 -1.618 1.00 0.00 O ATOM 1181 CB LYS A 76 4.875 -14.062 -0.056 1.00 0.00 C ATOM 1182 CG LYS A 76 5.626 -12.742 -0.084 1.00 0.00 C ATOM 1183 CD LYS A 76 7.095 -12.942 -0.415 1.00 0.00 C ATOM 1184 CE LYS A 76 7.304 -13.174 -1.904 1.00 0.00 C ATOM 1185 NZ LYS A 76 8.723 -12.961 -2.304 1.00 0.00 N ATOM 0 H LYS A 76 2.866 -15.909 0.020 1.00 0.00 H new ATOM 0 HA LYS A 76 3.422 -13.315 1.341 1.00 0.00 H new ATOM 0 HB2 LYS A 76 5.414 -14.763 0.581 1.00 0.00 H new ATOM 0 HB3 LYS A 76 4.865 -14.486 -1.060 1.00 0.00 H new ATOM 0 HG2 LYS A 76 5.173 -12.080 -0.822 1.00 0.00 H new ATOM 0 HG3 LYS A 76 5.534 -12.250 0.884 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.663 -12.067 -0.099 1.00 0.00 H new ATOM 0 HD3 LYS A 76 7.483 -13.793 0.145 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.003 -14.190 -2.159 1.00 0.00 H new ATOM 0 HE3 LYS A 76 6.662 -12.500 -2.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 8.825 -13.129 -3.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 9.003 -11.984 -2.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 9.334 -13.622 -1.782 1.00 0.00 H new ATOM 1199 N ILE A 77 2.243 -12.002 -0.400 1.00 0.00 N ATOM 1200 CA ILE A 77 1.423 -11.251 -1.343 1.00 0.00 C ATOM 1201 C ILE A 77 2.043 -9.891 -1.649 1.00 0.00 C ATOM 1202 O ILE A 77 2.075 -9.006 -0.794 1.00 0.00 O ATOM 1203 CB ILE A 77 -0.005 -11.043 -0.806 1.00 0.00 C ATOM 1204 CG1 ILE A 77 -0.716 -12.389 -0.651 1.00 0.00 C ATOM 1205 CG2 ILE A 77 -0.791 -10.126 -1.732 1.00 0.00 C ATOM 1206 CD1 ILE A 77 -2.122 -12.270 -0.105 1.00 0.00 C ATOM 0 H ILE A 77 2.533 -11.472 0.422 1.00 0.00 H new ATOM 0 HA ILE A 77 1.375 -11.840 -2.259 1.00 0.00 H new ATOM 0 HB ILE A 77 0.057 -10.571 0.174 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -0.752 -12.885 -1.621 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -0.130 -13.026 0.012 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -1.798 -9.989 -1.339 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.292 -9.159 -1.796 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.847 -10.572 -2.725 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.565 -13.262 -0.022 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -2.092 -11.802 0.879 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -2.723 -11.660 -0.779 1.00 0.00 H new ATOM 1218 N ASP A 78 2.531 -9.732 -2.874 1.00 0.00 N ATOM 1219 CA ASP A 78 3.147 -8.479 -3.294 1.00 0.00 C ATOM 1220 C ASP A 78 2.085 -7.447 -3.660 1.00 0.00 C ATOM 1221 O ASP A 78 1.414 -7.567 -4.686 1.00 0.00 O ATOM 1222 CB ASP A 78 4.076 -8.717 -4.486 1.00 0.00 C ATOM 1223 CG ASP A 78 5.239 -9.626 -4.141 1.00 0.00 C ATOM 1224 OD1 ASP A 78 6.204 -9.142 -3.512 1.00 0.00 O ATOM 1225 OD2 ASP A 78 5.186 -10.821 -4.500 1.00 0.00 O ATOM 0 H ASP A 78 2.512 -10.455 -3.593 1.00 0.00 H new ATOM 0 HA ASP A 78 3.731 -8.092 -2.459 1.00 0.00 H new ATOM 0 HB2 ASP A 78 3.506 -9.156 -5.305 1.00 0.00 H new ATOM 0 HB3 ASP A 78 4.459 -7.760 -4.841 1.00 0.00 H new ATOM 1230 N LEU A 79 1.936 -6.434 -2.814 1.00 0.00 N ATOM 1231 CA LEU A 79 0.954 -5.380 -3.046 1.00 0.00 C ATOM 1232 C LEU A 79 1.624 -4.121 -3.587 1.00 0.00 C ATOM 1233 O LEU A 79 2.440 -3.500 -2.907 1.00 0.00 O ATOM 1234 CB LEU A 79 0.207 -5.058 -1.752 1.00 0.00 C ATOM 1235 CG LEU A 79 -0.727 -3.847 -1.799 1.00 0.00 C ATOM 1236 CD1 LEU A 79 -2.121 -4.265 -2.239 1.00 0.00 C ATOM 1237 CD2 LEU A 79 -0.777 -3.159 -0.443 1.00 0.00 C ATOM 0 H LEU A 79 2.483 -6.320 -1.961 1.00 0.00 H new ATOM 0 HA LEU A 79 0.242 -5.738 -3.789 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -0.378 -5.932 -1.467 1.00 0.00 H new ATOM 0 HB3 LEU A 79 0.941 -4.895 -0.963 1.00 0.00 H new ATOM 0 HG LEU A 79 -0.336 -3.138 -2.529 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -2.771 -3.391 -2.267 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -2.071 -4.711 -3.232 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.522 -4.993 -1.534 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.446 -2.300 -0.495 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.144 -3.860 0.307 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.223 -2.824 -0.168 1.00 0.00 H new ATOM 1249 N GLN A 80 1.272 -3.750 -4.814 1.00 0.00 N ATOM 1250 CA GLN A 80 1.839 -2.564 -5.445 1.00 0.00 C ATOM 1251 C GLN A 80 0.998 -1.330 -5.138 1.00 0.00 C ATOM 1252 O GLN A 80 -0.089 -1.153 -5.689 1.00 0.00 O ATOM 1253 CB GLN A 80 1.938 -2.764 -6.959 1.00 0.00 C ATOM 1254 CG GLN A 80 2.622 -4.062 -7.357 1.00 0.00 C ATOM 1255 CD GLN A 80 2.844 -4.169 -8.853 1.00 0.00 C ATOM 1256 OE1 GLN A 80 2.163 -4.930 -9.541 1.00 0.00 O ATOM 1257 NE2 GLN A 80 3.802 -3.405 -9.365 1.00 0.00 N ATOM 0 H GLN A 80 0.597 -4.253 -5.390 1.00 0.00 H new ATOM 0 HA GLN A 80 2.839 -2.410 -5.039 1.00 0.00 H new ATOM 0 HB2 GLN A 80 0.935 -2.745 -7.386 1.00 0.00 H new ATOM 0 HB3 GLN A 80 2.485 -1.927 -7.393 1.00 0.00 H new ATOM 0 HG2 GLN A 80 3.581 -4.135 -6.845 1.00 0.00 H new ATOM 0 HG3 GLN A 80 2.017 -4.905 -7.022 1.00 0.00 H new ATOM 0 HE21 GLN A 80 4.342 -2.789 -8.758 1.00 0.00 H new ATOM 0 HE22 GLN A 80 3.998 -3.434 -10.366 1.00 0.00 H new ATOM 1266 N VAL A 81 1.507 -0.478 -4.254 1.00 0.00 N ATOM 1267 CA VAL A 81 0.803 0.741 -3.873 1.00 0.00 C ATOM 1268 C VAL A 81 1.300 1.937 -4.678 1.00 0.00 C ATOM 1269 O VAL A 81 2.502 2.199 -4.744 1.00 0.00 O ATOM 1270 CB VAL A 81 0.972 1.041 -2.372 1.00 0.00 C ATOM 1271 CG1 VAL A 81 2.306 1.724 -2.110 1.00 0.00 C ATOM 1272 CG2 VAL A 81 -0.182 1.894 -1.867 1.00 0.00 C ATOM 0 H VAL A 81 2.405 -0.609 -3.788 1.00 0.00 H new ATOM 0 HA VAL A 81 -0.253 0.576 -4.086 1.00 0.00 H new ATOM 0 HB VAL A 81 0.962 0.097 -1.827 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.407 1.928 -1.044 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.118 1.073 -2.434 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.350 2.661 -2.665 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -0.047 2.097 -0.805 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -0.206 2.835 -2.416 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -1.121 1.362 -2.018 1.00 0.00 H new ATOM 1282 N THR A 82 0.368 2.661 -5.289 1.00 0.00 N ATOM 1283 CA THR A 82 0.710 3.829 -6.091 1.00 0.00 C ATOM 1284 C THR A 82 -0.055 5.061 -5.622 1.00 0.00 C ATOM 1285 O THR A 82 -1.238 5.219 -5.921 1.00 0.00 O ATOM 1286 CB THR A 82 0.414 3.592 -7.584 1.00 0.00 C ATOM 1287 OG1 THR A 82 0.898 2.304 -7.981 1.00 0.00 O ATOM 1288 CG2 THR A 82 1.062 4.669 -8.441 1.00 0.00 C ATOM 0 H THR A 82 -0.631 2.459 -5.244 1.00 0.00 H new ATOM 0 HA THR A 82 1.779 3.998 -5.963 1.00 0.00 H new ATOM 0 HB THR A 82 -0.665 3.634 -7.729 1.00 0.00 H new ATOM 0 HG1 THR A 82 0.704 2.160 -8.931 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.839 4.481 -9.491 1.00 0.00 H new ATOM 0 HG22 THR A 82 0.670 5.645 -8.156 1.00 0.00 H new ATOM 0 HG23 THR A 82 2.141 4.653 -8.290 1.00 0.00 H new ATOM 1296 N MET A 83 0.628 5.931 -4.886 1.00 0.00 N ATOM 1297 CA MET A 83 0.011 7.151 -4.378 1.00 0.00 C ATOM 1298 C MET A 83 0.324 8.337 -5.284 1.00 0.00 C ATOM 1299 O MET A 83 1.473 8.757 -5.424 1.00 0.00 O ATOM 1300 CB MET A 83 0.497 7.439 -2.956 1.00 0.00 C ATOM 1301 CG MET A 83 -0.117 6.526 -1.907 1.00 0.00 C ATOM 1302 SD MET A 83 0.866 5.044 -1.615 1.00 0.00 S ATOM 1303 CE MET A 83 1.012 5.080 0.170 1.00 0.00 C ATOM 0 H MET A 83 1.608 5.814 -4.628 1.00 0.00 H new ATOM 0 HA MET A 83 -1.069 7.003 -4.363 1.00 0.00 H new ATOM 0 HB2 MET A 83 1.582 7.337 -2.924 1.00 0.00 H new ATOM 0 HB3 MET A 83 0.266 8.474 -2.705 1.00 0.00 H new ATOM 0 HG2 MET A 83 -0.226 7.075 -0.972 1.00 0.00 H new ATOM 0 HG3 MET A 83 -1.119 6.236 -2.225 1.00 0.00 H new ATOM 0 HE1 MET A 83 1.372 4.114 0.525 1.00 0.00 H new ATOM 0 HE2 MET A 83 1.716 5.859 0.462 1.00 0.00 H new ATOM 0 HE3 MET A 83 0.037 5.289 0.611 1.00 0.00 H new ATOM 1313 N PRO A 84 -0.721 8.891 -5.917 1.00 0.00 N ATOM 1314 CA PRO A 84 -0.583 10.037 -6.821 1.00 0.00 C ATOM 1315 C PRO A 84 -0.225 11.320 -6.080 1.00 0.00 C ATOM 1316 O PRO A 84 0.080 11.296 -4.887 1.00 0.00 O ATOM 1317 CB PRO A 84 -1.969 10.155 -7.458 1.00 0.00 C ATOM 1318 CG PRO A 84 -2.896 9.543 -6.466 1.00 0.00 C ATOM 1319 CD PRO A 84 -2.119 8.443 -5.798 1.00 0.00 C ATOM 0 HA PRO A 84 0.221 9.893 -7.542 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -2.228 11.196 -7.652 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -2.011 9.633 -8.414 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -3.232 10.282 -5.738 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -3.787 9.150 -6.955 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -2.414 8.319 -4.756 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -2.277 7.483 -6.291 1.00 0.00 H new ATOM 1327 N HIS A 85 -0.265 12.441 -6.794 1.00 0.00 N ATOM 1328 CA HIS A 85 0.054 13.736 -6.202 1.00 0.00 C ATOM 1329 C HIS A 85 -1.150 14.303 -5.456 1.00 0.00 C ATOM 1330 O HIS A 85 -0.997 15.039 -4.481 1.00 0.00 O ATOM 1331 CB HIS A 85 0.506 14.717 -7.284 1.00 0.00 C ATOM 1332 CG HIS A 85 1.576 14.170 -8.179 1.00 0.00 C ATOM 1333 ND1 HIS A 85 2.466 13.169 -7.986 1.00 0.00 N flip ATOM 1334 CD2 HIS A 85 1.823 14.661 -9.444 1.00 0.00 C flip ATOM 1335 CE1 HIS A 85 3.226 13.074 -9.125 1.00 0.00 C flip ATOM 1336 NE2 HIS A 85 2.817 13.985 -9.990 1.00 0.00 N flip ATOM 0 H HIS A 85 -0.515 12.479 -7.782 1.00 0.00 H new ATOM 0 HA HIS A 85 0.866 13.592 -5.490 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -0.355 14.998 -7.890 1.00 0.00 H new ATOM 0 HB3 HIS A 85 0.872 15.627 -6.808 1.00 0.00 H new ATOM 0 HD2 HIS A 85 1.287 15.472 -9.915 1.00 0.00 H new ATOM 0 HE1 HIS A 85 4.028 12.369 -9.288 1.00 0.00 H new ATOM 0 HE2 HIS A 85 3.203 14.140 -10.921 1.00 0.00 H new ATOM 1345 N SER A 86 -2.346 13.957 -5.921 1.00 0.00 N ATOM 1346 CA SER A 86 -3.575 14.436 -5.300 1.00 0.00 C ATOM 1347 C SER A 86 -3.868 13.671 -4.013 1.00 0.00 C ATOM 1348 O SER A 86 -4.208 14.263 -2.989 1.00 0.00 O ATOM 1349 CB SER A 86 -4.750 14.293 -6.270 1.00 0.00 C ATOM 1350 OG SER A 86 -4.919 15.468 -7.043 1.00 0.00 O ATOM 0 H SER A 86 -2.490 13.347 -6.726 1.00 0.00 H new ATOM 0 HA SER A 86 -3.442 15.489 -5.053 1.00 0.00 H new ATOM 0 HB2 SER A 86 -4.580 13.442 -6.929 1.00 0.00 H new ATOM 0 HB3 SER A 86 -5.663 14.087 -5.712 1.00 0.00 H new ATOM 0 HG SER A 86 -5.675 15.351 -7.656 1.00 0.00 H new ATOM 1356 N TYR A 87 -3.732 12.351 -4.073 1.00 0.00 N ATOM 1357 CA TYR A 87 -3.984 11.503 -2.914 1.00 0.00 C ATOM 1358 C TYR A 87 -3.559 12.201 -1.626 1.00 0.00 C ATOM 1359 O TYR A 87 -2.595 12.966 -1.593 1.00 0.00 O ATOM 1360 CB TYR A 87 -3.239 10.174 -3.057 1.00 0.00 C ATOM 1361 CG TYR A 87 -2.990 9.475 -1.740 1.00 0.00 C ATOM 1362 CD1 TYR A 87 -2.066 9.975 -0.830 1.00 0.00 C ATOM 1363 CD2 TYR A 87 -3.677 8.315 -1.404 1.00 0.00 C ATOM 1364 CE1 TYR A 87 -1.833 9.340 0.375 1.00 0.00 C ATOM 1365 CE2 TYR A 87 -3.452 7.674 -0.202 1.00 0.00 C ATOM 1366 CZ TYR A 87 -2.530 8.190 0.684 1.00 0.00 C ATOM 1367 OH TYR A 87 -2.302 7.554 1.883 1.00 0.00 O ATOM 0 H TYR A 87 -3.449 11.845 -4.912 1.00 0.00 H new ATOM 0 HA TYR A 87 -5.055 11.308 -2.864 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -3.813 9.513 -3.707 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -2.283 10.354 -3.550 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -1.520 10.876 -1.069 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -4.400 7.908 -2.095 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -1.110 9.741 1.070 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -3.995 6.773 0.043 1.00 0.00 H new ATOM 0 HH TYR A 87 -1.371 7.692 2.155 1.00 0.00 H new ATOM 1377 N PRO A 88 -4.295 11.931 -0.538 1.00 0.00 N ATOM 1378 CA PRO A 88 -5.444 11.022 -0.565 1.00 0.00 C ATOM 1379 C PRO A 88 -6.624 11.602 -1.338 1.00 0.00 C ATOM 1380 O PRO A 88 -7.432 10.864 -1.902 1.00 0.00 O ATOM 1381 CB PRO A 88 -5.803 10.859 0.914 1.00 0.00 C ATOM 1382 CG PRO A 88 -5.296 12.100 1.565 1.00 0.00 C ATOM 1383 CD PRO A 88 -4.061 12.492 0.803 1.00 0.00 C ATOM 0 HA PRO A 88 -5.209 10.083 -1.067 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -6.879 10.751 1.051 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -5.337 9.970 1.339 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -6.044 12.892 1.530 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -5.067 11.924 2.616 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -3.936 13.574 0.770 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -3.160 12.081 1.259 1.00 0.00 H new ATOM 1391 N TYR A 89 -6.716 12.927 -1.362 1.00 0.00 N ATOM 1392 CA TYR A 89 -7.798 13.605 -2.065 1.00 0.00 C ATOM 1393 C TYR A 89 -8.203 12.833 -3.317 1.00 0.00 C ATOM 1394 O TYR A 89 -9.388 12.709 -3.628 1.00 0.00 O ATOM 1395 CB TYR A 89 -7.376 15.026 -2.443 1.00 0.00 C ATOM 1396 CG TYR A 89 -7.597 16.037 -1.340 1.00 0.00 C ATOM 1397 CD1 TYR A 89 -8.842 16.622 -1.146 1.00 0.00 C ATOM 1398 CD2 TYR A 89 -6.560 16.406 -0.492 1.00 0.00 C ATOM 1399 CE1 TYR A 89 -9.048 17.546 -0.140 1.00 0.00 C ATOM 1400 CE2 TYR A 89 -6.757 17.329 0.517 1.00 0.00 C ATOM 1401 CZ TYR A 89 -8.003 17.896 0.689 1.00 0.00 C ATOM 1402 OH TYR A 89 -8.204 18.816 1.692 1.00 0.00 O ATOM 0 H TYR A 89 -6.054 13.553 -0.903 1.00 0.00 H new ATOM 0 HA TYR A 89 -8.658 13.653 -1.396 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -6.320 15.022 -2.715 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -7.932 15.338 -3.327 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -9.663 16.350 -1.793 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -5.584 15.964 -0.624 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -10.022 17.992 -0.003 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -5.940 17.605 1.167 1.00 0.00 H new ATOM 0 HH TYR A 89 -7.368 18.950 2.185 1.00 0.00 H new ATOM 1412 N LEU A 90 -7.210 12.315 -4.031 1.00 0.00 N ATOM 1413 CA LEU A 90 -7.461 11.553 -5.250 1.00 0.00 C ATOM 1414 C LEU A 90 -7.405 10.053 -4.975 1.00 0.00 C ATOM 1415 O LEU A 90 -6.779 9.611 -4.013 1.00 0.00 O ATOM 1416 CB LEU A 90 -6.439 11.924 -6.326 1.00 0.00 C ATOM 1417 CG LEU A 90 -6.248 10.906 -7.450 1.00 0.00 C ATOM 1418 CD1 LEU A 90 -7.348 11.046 -8.491 1.00 0.00 C ATOM 1419 CD2 LEU A 90 -4.879 11.072 -8.093 1.00 0.00 C ATOM 0 H LEU A 90 -6.224 12.408 -3.787 1.00 0.00 H new ATOM 0 HA LEU A 90 -8.461 11.802 -5.606 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -6.737 12.874 -6.770 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -5.476 12.087 -5.843 1.00 0.00 H new ATOM 0 HG LEU A 90 -6.307 9.906 -7.021 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -7.195 10.313 -9.283 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -8.317 10.876 -8.022 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -7.322 12.050 -8.915 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -4.761 10.339 -8.891 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -4.791 12.076 -8.507 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -4.104 10.920 -7.342 1.00 0.00 H new ATOM 1431 N ALA A 91 -8.062 9.276 -5.830 1.00 0.00 N ATOM 1432 CA ALA A 91 -8.083 7.826 -5.682 1.00 0.00 C ATOM 1433 C ALA A 91 -6.777 7.206 -6.166 1.00 0.00 C ATOM 1434 O ALA A 91 -6.395 7.362 -7.326 1.00 0.00 O ATOM 1435 CB ALA A 91 -9.263 7.236 -6.441 1.00 0.00 C ATOM 0 H ALA A 91 -8.586 9.626 -6.632 1.00 0.00 H new ATOM 0 HA ALA A 91 -8.194 7.595 -4.623 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -9.267 6.152 -6.322 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -10.192 7.648 -6.046 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -9.176 7.485 -7.499 1.00 0.00 H new ATOM 1441 N LEU A 92 -6.095 6.501 -5.269 1.00 0.00 N ATOM 1442 CA LEU A 92 -4.829 5.857 -5.605 1.00 0.00 C ATOM 1443 C LEU A 92 -5.063 4.584 -6.412 1.00 0.00 C ATOM 1444 O LEU A 92 -6.196 4.270 -6.777 1.00 0.00 O ATOM 1445 CB LEU A 92 -4.047 5.531 -4.331 1.00 0.00 C ATOM 1446 CG LEU A 92 -4.689 4.508 -3.393 1.00 0.00 C ATOM 1447 CD1 LEU A 92 -4.289 3.095 -3.789 1.00 0.00 C ATOM 1448 CD2 LEU A 92 -4.300 4.790 -1.949 1.00 0.00 C ATOM 0 H LEU A 92 -6.397 6.361 -4.305 1.00 0.00 H new ATOM 0 HA LEU A 92 -4.247 6.549 -6.214 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.062 5.163 -4.617 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -3.893 6.457 -3.776 1.00 0.00 H new ATOM 0 HG LEU A 92 -5.772 4.594 -3.480 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -4.755 2.381 -3.110 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -4.619 2.896 -4.808 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.205 2.994 -3.733 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -4.766 4.052 -1.296 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -3.216 4.733 -1.846 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.639 5.788 -1.669 1.00 0.00 H new ATOM 1460 N GLN A 93 -3.986 3.856 -6.684 1.00 0.00 N ATOM 1461 CA GLN A 93 -4.075 2.616 -7.447 1.00 0.00 C ATOM 1462 C GLN A 93 -3.320 1.491 -6.747 1.00 0.00 C ATOM 1463 O GLN A 93 -2.108 1.574 -6.544 1.00 0.00 O ATOM 1464 CB GLN A 93 -3.518 2.819 -8.857 1.00 0.00 C ATOM 1465 CG GLN A 93 -4.108 1.869 -9.887 1.00 0.00 C ATOM 1466 CD GLN A 93 -3.999 2.401 -11.302 1.00 0.00 C ATOM 1467 OE1 GLN A 93 -3.991 3.612 -11.524 1.00 0.00 O ATOM 1468 NE2 GLN A 93 -3.913 1.495 -12.270 1.00 0.00 N ATOM 0 H GLN A 93 -3.042 4.102 -6.388 1.00 0.00 H new ATOM 0 HA GLN A 93 -5.126 2.336 -7.516 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -3.709 3.845 -9.170 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -2.436 2.690 -8.833 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -3.597 0.908 -9.824 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -5.157 1.689 -9.651 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -3.923 0.501 -12.041 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -3.837 1.793 -13.242 1.00 0.00 H new ATOM 1477 N LEU A 94 -4.044 0.440 -6.379 1.00 0.00 N ATOM 1478 CA LEU A 94 -3.442 -0.703 -5.700 1.00 0.00 C ATOM 1479 C LEU A 94 -3.592 -1.972 -6.534 1.00 0.00 C ATOM 1480 O LEU A 94 -4.581 -2.146 -7.247 1.00 0.00 O ATOM 1481 CB LEU A 94 -4.086 -0.903 -4.327 1.00 0.00 C ATOM 1482 CG LEU A 94 -3.416 -0.177 -3.160 1.00 0.00 C ATOM 1483 CD1 LEU A 94 -4.401 0.018 -2.017 1.00 0.00 C ATOM 1484 CD2 LEU A 94 -2.191 -0.946 -2.686 1.00 0.00 C ATOM 0 H LEU A 94 -5.048 0.355 -6.539 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.379 -0.499 -5.570 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -5.124 -0.577 -4.384 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -4.099 -1.970 -4.106 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.092 0.805 -3.505 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -3.907 0.536 -1.195 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -5.247 0.611 -2.363 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -4.755 -0.953 -1.672 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -1.727 -0.415 -1.855 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -2.491 -1.941 -2.358 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -1.477 -1.033 -3.505 1.00 0.00 H new ATOM 1496 N PHE A 95 -2.606 -2.857 -6.438 1.00 0.00 N ATOM 1497 CA PHE A 95 -2.628 -4.111 -7.182 1.00 0.00 C ATOM 1498 C PHE A 95 -2.001 -5.238 -6.367 1.00 0.00 C ATOM 1499 O PHE A 95 -0.807 -5.215 -6.071 1.00 0.00 O ATOM 1500 CB PHE A 95 -1.887 -3.953 -8.511 1.00 0.00 C ATOM 1501 CG PHE A 95 -2.354 -4.905 -9.575 1.00 0.00 C ATOM 1502 CD1 PHE A 95 -2.128 -6.267 -9.452 1.00 0.00 C ATOM 1503 CD2 PHE A 95 -3.018 -4.438 -10.697 1.00 0.00 C ATOM 1504 CE1 PHE A 95 -2.557 -7.145 -10.429 1.00 0.00 C ATOM 1505 CE2 PHE A 95 -3.450 -5.312 -11.677 1.00 0.00 C ATOM 1506 CZ PHE A 95 -3.218 -6.667 -11.544 1.00 0.00 C ATOM 0 H PHE A 95 -1.781 -2.729 -5.852 1.00 0.00 H new ATOM 0 HA PHE A 95 -3.668 -4.367 -7.383 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -2.013 -2.931 -8.869 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -0.820 -4.103 -8.343 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -1.611 -6.646 -8.583 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -3.200 -3.379 -10.808 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -2.376 -8.204 -10.321 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -3.969 -4.935 -12.546 1.00 0.00 H new ATOM 0 HZ PHE A 95 -3.552 -7.351 -12.310 1.00 0.00 H new ATOM 1516 N GLY A 96 -2.816 -6.225 -6.006 1.00 0.00 N ATOM 1517 CA GLY A 96 -2.325 -7.347 -5.229 1.00 0.00 C ATOM 1518 C GLY A 96 -2.446 -8.664 -5.970 1.00 0.00 C ATOM 1519 O GLY A 96 -3.542 -9.064 -6.362 1.00 0.00 O ATOM 0 H GLY A 96 -3.808 -6.267 -6.238 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -1.281 -7.175 -4.969 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -2.881 -7.408 -4.293 1.00 0.00 H new ATOM 1523 N ARG A 97 -1.317 -9.338 -6.164 1.00 0.00 N ATOM 1524 CA ARG A 97 -1.302 -10.616 -6.866 1.00 0.00 C ATOM 1525 C ARG A 97 -0.245 -11.546 -6.278 1.00 0.00 C ATOM 1526 O ARG A 97 0.865 -11.119 -5.960 1.00 0.00 O ATOM 1527 CB ARG A 97 -1.034 -10.400 -8.357 1.00 0.00 C ATOM 1528 CG ARG A 97 0.302 -9.735 -8.645 1.00 0.00 C ATOM 1529 CD ARG A 97 0.845 -10.145 -10.005 1.00 0.00 C ATOM 1530 NE ARG A 97 2.158 -9.563 -10.268 1.00 0.00 N ATOM 1531 CZ ARG A 97 2.347 -8.283 -10.571 1.00 0.00 C ATOM 1532 NH1 ARG A 97 1.313 -7.457 -10.648 1.00 0.00 N ATOM 1533 NH2 ARG A 97 3.573 -7.827 -10.797 1.00 0.00 N ATOM 0 H ARG A 97 -0.402 -9.021 -5.845 1.00 0.00 H new ATOM 0 HA ARG A 97 -2.280 -11.081 -6.743 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -1.069 -11.363 -8.867 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -1.833 -9.788 -8.776 1.00 0.00 H new ATOM 0 HG2 ARG A 97 0.186 -8.652 -8.610 1.00 0.00 H new ATOM 0 HG3 ARG A 97 1.019 -10.004 -7.869 1.00 0.00 H new ATOM 0 HD2 ARG A 97 0.913 -11.232 -10.055 1.00 0.00 H new ATOM 0 HD3 ARG A 97 0.148 -9.833 -10.783 1.00 0.00 H new ATOM 0 HE ARG A 97 2.975 -10.172 -10.216 1.00 0.00 H new ATOM 0 HH11 ARG A 97 0.369 -7.803 -10.474 1.00 0.00 H new ATOM 0 HH12 ARG A 97 1.461 -6.475 -10.881 1.00 0.00 H new ATOM 0 HH21 ARG A 97 4.371 -8.459 -10.738 1.00 0.00 H new ATOM 0 HH22 ARG A 97 3.717 -6.844 -11.030 1.00 0.00 H new ATOM 1547 N SER A 98 -0.598 -12.820 -6.136 1.00 0.00 N ATOM 1548 CA SER A 98 0.318 -13.810 -5.582 1.00 0.00 C ATOM 1549 C SER A 98 0.418 -15.028 -6.496 1.00 0.00 C ATOM 1550 O SER A 98 -0.429 -15.238 -7.364 1.00 0.00 O ATOM 1551 CB SER A 98 -0.144 -14.239 -4.189 1.00 0.00 C ATOM 1552 OG SER A 98 0.780 -15.139 -3.600 1.00 0.00 O ATOM 0 H SER A 98 -1.512 -13.191 -6.397 1.00 0.00 H new ATOM 0 HA SER A 98 1.305 -13.354 -5.505 1.00 0.00 H new ATOM 0 HB2 SER A 98 -0.257 -13.361 -3.553 1.00 0.00 H new ATOM 0 HB3 SER A 98 -1.124 -14.711 -4.257 1.00 0.00 H new ATOM 0 HG SER A 98 1.271 -14.682 -2.885 1.00 0.00 H new ATOM 1558 N SER A 99 1.460 -15.828 -6.292 1.00 0.00 N ATOM 1559 CA SER A 99 1.674 -17.024 -7.099 1.00 0.00 C ATOM 1560 C SER A 99 0.539 -18.024 -6.900 1.00 0.00 C ATOM 1561 O SER A 99 -0.029 -18.533 -7.866 1.00 0.00 O ATOM 1562 CB SER A 99 3.011 -17.674 -6.739 1.00 0.00 C ATOM 1563 OG SER A 99 3.326 -18.723 -7.639 1.00 0.00 O ATOM 0 H SER A 99 2.169 -15.670 -5.576 1.00 0.00 H new ATOM 0 HA SER A 99 1.693 -16.727 -8.148 1.00 0.00 H new ATOM 0 HB2 SER A 99 3.801 -16.923 -6.759 1.00 0.00 H new ATOM 0 HB3 SER A 99 2.968 -18.064 -5.722 1.00 0.00 H new ATOM 0 HG SER A 99 4.186 -19.122 -7.389 1.00 0.00 H new ATOM 1569 N GLU A 100 0.215 -18.299 -5.641 1.00 0.00 N ATOM 1570 CA GLU A 100 -0.852 -19.238 -5.315 1.00 0.00 C ATOM 1571 C GLU A 100 -2.188 -18.759 -5.874 1.00 0.00 C ATOM 1572 O GLU A 100 -2.850 -19.473 -6.630 1.00 0.00 O ATOM 1573 CB GLU A 100 -0.956 -19.420 -3.799 1.00 0.00 C ATOM 1574 CG GLU A 100 0.327 -19.919 -3.156 1.00 0.00 C ATOM 1575 CD GLU A 100 0.076 -20.684 -1.871 1.00 0.00 C ATOM 1576 OE1 GLU A 100 -0.826 -21.547 -1.860 1.00 0.00 O ATOM 1577 OE2 GLU A 100 0.783 -20.418 -0.876 1.00 0.00 O ATOM 0 H GLU A 100 0.676 -17.885 -4.830 1.00 0.00 H new ATOM 0 HA GLU A 100 -0.610 -20.197 -5.773 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -1.233 -18.468 -3.346 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -1.759 -20.123 -3.580 1.00 0.00 H new ATOM 0 HG2 GLU A 100 0.856 -20.562 -3.860 1.00 0.00 H new ATOM 0 HG3 GLU A 100 0.979 -19.070 -2.948 1.00 0.00 H new ATOM 1584 N LEU A 101 -2.580 -17.547 -5.497 1.00 0.00 N ATOM 1585 CA LEU A 101 -3.839 -16.972 -5.959 1.00 0.00 C ATOM 1586 C LEU A 101 -4.063 -17.270 -7.438 1.00 0.00 C ATOM 1587 O LEU A 101 -3.151 -17.134 -8.254 1.00 0.00 O ATOM 1588 CB LEU A 101 -3.847 -15.460 -5.725 1.00 0.00 C ATOM 1589 CG LEU A 101 -4.052 -15.006 -4.280 1.00 0.00 C ATOM 1590 CD1 LEU A 101 -3.623 -13.557 -4.109 1.00 0.00 C ATOM 1591 CD2 LEU A 101 -5.506 -15.186 -3.865 1.00 0.00 C ATOM 0 H LEU A 101 -2.045 -16.943 -4.873 1.00 0.00 H new ATOM 0 HA LEU A 101 -4.649 -17.427 -5.389 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -2.901 -15.052 -6.082 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -4.635 -15.022 -6.338 1.00 0.00 H new ATOM 0 HG LEU A 101 -3.431 -15.626 -3.634 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -3.776 -13.252 -3.074 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -2.568 -13.457 -4.364 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -4.217 -12.922 -4.766 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -5.633 -14.858 -2.833 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.147 -14.592 -4.517 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.780 -16.238 -3.947 1.00 0.00 H new ATOM 1603 N ASP A 102 -5.282 -17.675 -7.777 1.00 0.00 N ATOM 1604 CA ASP A 102 -5.627 -17.989 -9.158 1.00 0.00 C ATOM 1605 C ASP A 102 -6.259 -16.784 -9.848 1.00 0.00 C ATOM 1606 O ASP A 102 -6.565 -15.779 -9.206 1.00 0.00 O ATOM 1607 CB ASP A 102 -6.584 -19.181 -9.209 1.00 0.00 C ATOM 1608 CG ASP A 102 -6.692 -19.778 -10.598 1.00 0.00 C ATOM 1609 OD1 ASP A 102 -5.836 -20.616 -10.953 1.00 0.00 O ATOM 1610 OD2 ASP A 102 -7.634 -19.408 -11.331 1.00 0.00 O ATOM 0 H ASP A 102 -6.048 -17.794 -7.114 1.00 0.00 H new ATOM 0 HA ASP A 102 -4.709 -18.247 -9.686 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -6.243 -19.947 -8.513 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.572 -18.864 -8.875 1.00 0.00 H new ATOM 1615 N ARG A 103 -6.451 -16.892 -11.159 1.00 0.00 N ATOM 1616 CA ARG A 103 -7.045 -15.811 -11.936 1.00 0.00 C ATOM 1617 C ARG A 103 -8.308 -15.286 -11.260 1.00 0.00 C ATOM 1618 O ARG A 103 -8.354 -14.140 -10.809 1.00 0.00 O ATOM 1619 CB ARG A 103 -7.372 -16.291 -13.351 1.00 0.00 C ATOM 1620 CG ARG A 103 -7.928 -15.199 -14.251 1.00 0.00 C ATOM 1621 CD ARG A 103 -6.848 -14.209 -14.657 1.00 0.00 C ATOM 1622 NE ARG A 103 -5.924 -14.778 -15.635 1.00 0.00 N ATOM 1623 CZ ARG A 103 -4.968 -14.078 -16.237 1.00 0.00 C ATOM 1624 NH1 ARG A 103 -4.812 -12.790 -15.962 1.00 0.00 N ATOM 1625 NH2 ARG A 103 -4.167 -14.666 -17.116 1.00 0.00 N ATOM 0 H ARG A 103 -6.204 -17.717 -11.705 1.00 0.00 H new ATOM 0 HA ARG A 103 -6.321 -14.999 -11.994 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -6.469 -16.700 -13.805 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -8.095 -17.105 -13.292 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -8.365 -15.648 -15.143 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -8.730 -14.673 -13.733 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -7.313 -13.316 -15.074 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -6.293 -13.896 -13.773 1.00 0.00 H new ATOM 0 HE ARG A 103 -6.018 -15.766 -15.869 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -5.426 -12.335 -15.287 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -4.078 -12.255 -16.425 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -4.285 -15.656 -17.330 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -3.434 -14.128 -17.577 1.00 0.00 H new ATOM 1639 N HIS A 104 -9.333 -16.130 -11.194 1.00 0.00 N ATOM 1640 CA HIS A 104 -10.597 -15.752 -10.573 1.00 0.00 C ATOM 1641 C HIS A 104 -10.358 -15.022 -9.255 1.00 0.00 C ATOM 1642 O HIS A 104 -10.934 -13.963 -9.008 1.00 0.00 O ATOM 1643 CB HIS A 104 -11.463 -16.989 -10.335 1.00 0.00 C ATOM 1644 CG HIS A 104 -12.873 -16.667 -9.944 1.00 0.00 C ATOM 1645 ND1 HIS A 104 -13.636 -15.719 -10.593 1.00 0.00 N ATOM 1646 CD2 HIS A 104 -13.658 -17.175 -8.966 1.00 0.00 C ATOM 1647 CE1 HIS A 104 -14.829 -15.657 -10.030 1.00 0.00 C ATOM 1648 NE2 HIS A 104 -14.869 -16.530 -9.040 1.00 0.00 N ATOM 0 H HIS A 104 -9.313 -17.081 -11.563 1.00 0.00 H new ATOM 0 HA HIS A 104 -11.119 -15.078 -11.252 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -11.475 -17.594 -11.242 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -11.007 -17.596 -9.553 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -13.384 -17.944 -8.259 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -15.635 -15.003 -10.329 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -15.669 -16.698 -8.430 1.00 0.00 H new ATOM 1657 N GLN A 105 -9.506 -15.596 -8.412 1.00 0.00 N ATOM 1658 CA GLN A 105 -9.193 -15.000 -7.118 1.00 0.00 C ATOM 1659 C GLN A 105 -8.686 -13.572 -7.286 1.00 0.00 C ATOM 1660 O GLN A 105 -9.331 -12.620 -6.847 1.00 0.00 O ATOM 1661 CB GLN A 105 -8.147 -15.842 -6.385 1.00 0.00 C ATOM 1662 CG GLN A 105 -8.745 -16.967 -5.555 1.00 0.00 C ATOM 1663 CD GLN A 105 -10.033 -17.506 -6.144 1.00 0.00 C ATOM 1664 OE1 GLN A 105 -10.086 -17.874 -7.319 1.00 0.00 O ATOM 1665 NE2 GLN A 105 -11.081 -17.557 -5.331 1.00 0.00 N ATOM 0 H GLN A 105 -9.020 -16.473 -8.601 1.00 0.00 H new ATOM 0 HA GLN A 105 -10.108 -14.974 -6.526 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -7.458 -16.267 -7.115 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -7.561 -15.193 -5.734 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -8.021 -17.777 -5.473 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -8.935 -16.606 -4.544 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -10.993 -17.242 -4.365 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -11.974 -17.911 -5.672 1.00 0.00 H new ATOM 1674 N GLN A 106 -7.528 -13.430 -7.922 1.00 0.00 N ATOM 1675 CA GLN A 106 -6.935 -12.117 -8.146 1.00 0.00 C ATOM 1676 C GLN A 106 -8.011 -11.077 -8.442 1.00 0.00 C ATOM 1677 O GLN A 106 -8.082 -10.037 -7.785 1.00 0.00 O ATOM 1678 CB GLN A 106 -5.935 -12.176 -9.302 1.00 0.00 C ATOM 1679 CG GLN A 106 -4.530 -12.565 -8.871 1.00 0.00 C ATOM 1680 CD GLN A 106 -3.608 -12.820 -10.048 1.00 0.00 C ATOM 1681 OE1 GLN A 106 -2.823 -11.813 -10.414 1.00 0.00 O flip ATOM 1682 NE2 GLN A 106 -3.602 -13.909 -10.622 1.00 0.00 N flip ATOM 0 H GLN A 106 -6.982 -14.208 -8.291 1.00 0.00 H new ATOM 0 HA GLN A 106 -6.411 -11.823 -7.236 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -6.290 -12.892 -10.043 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -5.900 -11.203 -9.791 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -4.111 -11.772 -8.252 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -4.579 -13.461 -8.252 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -4.222 -14.655 -10.307 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -2.977 -14.065 -11.413 1.00 0.00 H new ATOM 1691 N LEU A 107 -8.847 -11.364 -9.433 1.00 0.00 N ATOM 1692 CA LEU A 107 -9.920 -10.453 -9.817 1.00 0.00 C ATOM 1693 C LEU A 107 -10.779 -10.085 -8.611 1.00 0.00 C ATOM 1694 O LEU A 107 -11.025 -8.907 -8.347 1.00 0.00 O ATOM 1695 CB LEU A 107 -10.791 -11.088 -10.903 1.00 0.00 C ATOM 1696 CG LEU A 107 -10.199 -11.107 -12.312 1.00 0.00 C ATOM 1697 CD1 LEU A 107 -11.073 -11.927 -13.248 1.00 0.00 C ATOM 1698 CD2 LEU A 107 -10.033 -9.689 -12.840 1.00 0.00 C ATOM 0 H LEU A 107 -8.803 -12.220 -9.986 1.00 0.00 H new ATOM 0 HA LEU A 107 -9.467 -9.542 -10.209 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -11.012 -12.114 -10.610 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -11.741 -10.555 -10.937 1.00 0.00 H new ATOM 0 HG LEU A 107 -9.215 -11.574 -12.265 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -10.635 -11.929 -14.246 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -11.140 -12.951 -12.879 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -12.071 -11.490 -13.290 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -9.610 -9.722 -13.844 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -11.005 -9.196 -12.871 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -9.365 -9.132 -12.183 1.00 0.00 H new ATOM 1710 N LEU A 108 -11.231 -11.099 -7.881 1.00 0.00 N ATOM 1711 CA LEU A 108 -12.060 -10.883 -6.701 1.00 0.00 C ATOM 1712 C LEU A 108 -11.332 -10.021 -5.674 1.00 0.00 C ATOM 1713 O LEU A 108 -11.841 -8.985 -5.245 1.00 0.00 O ATOM 1714 CB LEU A 108 -12.450 -12.223 -6.075 1.00 0.00 C ATOM 1715 CG LEU A 108 -13.346 -13.125 -6.924 1.00 0.00 C ATOM 1716 CD1 LEU A 108 -13.486 -14.496 -6.281 1.00 0.00 C ATOM 1717 CD2 LEU A 108 -14.712 -12.485 -7.123 1.00 0.00 C ATOM 0 H LEU A 108 -11.037 -12.079 -8.086 1.00 0.00 H new ATOM 0 HA LEU A 108 -12.963 -10.358 -7.013 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -11.537 -12.770 -5.839 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -12.957 -12.026 -5.131 1.00 0.00 H new ATOM 0 HG LEU A 108 -12.880 -13.251 -7.901 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -14.127 -15.124 -6.899 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -12.503 -14.958 -6.191 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -13.929 -14.390 -5.291 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -15.336 -13.141 -7.730 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -15.185 -12.328 -6.154 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -14.595 -11.527 -7.629 1.00 0.00 H new ATOM 1729 N LEU A 109 -10.138 -10.455 -5.286 1.00 0.00 N ATOM 1730 CA LEU A 109 -9.338 -9.723 -4.311 1.00 0.00 C ATOM 1731 C LEU A 109 -9.178 -8.263 -4.723 1.00 0.00 C ATOM 1732 O LEU A 109 -9.537 -7.354 -3.977 1.00 0.00 O ATOM 1733 CB LEU A 109 -7.963 -10.375 -4.157 1.00 0.00 C ATOM 1734 CG LEU A 109 -7.155 -9.957 -2.928 1.00 0.00 C ATOM 1735 CD1 LEU A 109 -7.461 -10.872 -1.752 1.00 0.00 C ATOM 1736 CD2 LEU A 109 -5.665 -9.966 -3.240 1.00 0.00 C ATOM 0 H LEU A 109 -9.703 -11.310 -5.632 1.00 0.00 H new ATOM 0 HA LEU A 109 -9.858 -9.756 -3.354 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -8.097 -11.456 -4.128 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -7.375 -10.150 -5.047 1.00 0.00 H new ATOM 0 HG LEU A 109 -7.442 -8.941 -2.656 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -6.877 -10.560 -0.886 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -8.523 -10.815 -1.513 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -7.203 -11.898 -2.013 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -5.106 -9.666 -2.354 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -5.362 -10.970 -3.538 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -5.459 -9.269 -4.052 1.00 0.00 H new ATOM 1748 N ASN A 110 -8.638 -8.048 -5.919 1.00 0.00 N ATOM 1749 CA ASN A 110 -8.433 -6.698 -6.432 1.00 0.00 C ATOM 1750 C ASN A 110 -9.747 -5.925 -6.471 1.00 0.00 C ATOM 1751 O ASN A 110 -9.908 -4.916 -5.783 1.00 0.00 O ATOM 1752 CB ASN A 110 -7.817 -6.751 -7.832 1.00 0.00 C ATOM 1753 CG ASN A 110 -6.326 -7.023 -7.798 1.00 0.00 C ATOM 1754 OD1 ASN A 110 -5.529 -6.141 -7.476 1.00 0.00 O ATOM 1755 ND2 ASN A 110 -5.941 -8.250 -8.131 1.00 0.00 N ATOM 0 H ASN A 110 -8.335 -8.790 -6.550 1.00 0.00 H new ATOM 0 HA ASN A 110 -7.748 -6.181 -5.760 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -8.312 -7.528 -8.414 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -7.999 -5.805 -8.342 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -4.950 -8.493 -8.126 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -6.636 -8.950 -8.391 1.00 0.00 H new ATOM 1762 N LYS A 111 -10.685 -6.404 -7.281 1.00 0.00 N ATOM 1763 CA LYS A 111 -11.987 -5.760 -7.410 1.00 0.00 C ATOM 1764 C LYS A 111 -12.519 -5.331 -6.046 1.00 0.00 C ATOM 1765 O LYS A 111 -12.915 -4.182 -5.857 1.00 0.00 O ATOM 1766 CB LYS A 111 -12.983 -6.708 -8.082 1.00 0.00 C ATOM 1767 CG LYS A 111 -12.887 -6.715 -9.598 1.00 0.00 C ATOM 1768 CD LYS A 111 -14.033 -7.491 -10.226 1.00 0.00 C ATOM 1769 CE LYS A 111 -13.865 -7.612 -11.733 1.00 0.00 C ATOM 1770 NZ LYS A 111 -14.851 -8.556 -12.327 1.00 0.00 N ATOM 0 H LYS A 111 -10.568 -7.237 -7.858 1.00 0.00 H new ATOM 0 HA LYS A 111 -11.865 -4.871 -8.029 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -12.816 -7.719 -7.711 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -13.995 -6.424 -7.792 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -12.894 -5.690 -9.969 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -11.938 -7.157 -9.901 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -14.086 -8.486 -9.784 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -14.976 -6.993 -10.003 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -13.981 -6.630 -12.191 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -12.855 -7.952 -11.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -14.704 -8.611 -13.355 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -14.724 -9.500 -11.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -15.815 -8.218 -12.133 1.00 0.00 H new ATOM 1784 N GLY A 112 -12.525 -6.263 -5.098 1.00 0.00 N ATOM 1785 CA GLY A 112 -13.009 -5.961 -3.764 1.00 0.00 C ATOM 1786 C GLY A 112 -12.240 -4.830 -3.110 1.00 0.00 C ATOM 1787 O GLY A 112 -12.834 -3.906 -2.552 1.00 0.00 O ATOM 0 H GLY A 112 -12.203 -7.222 -5.230 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -14.065 -5.696 -3.815 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -12.934 -6.854 -3.143 1.00 0.00 H new ATOM 1791 N LEU A 113 -10.915 -4.902 -3.177 1.00 0.00 N ATOM 1792 CA LEU A 113 -10.063 -3.877 -2.585 1.00 0.00 C ATOM 1793 C LEU A 113 -10.282 -2.528 -3.263 1.00 0.00 C ATOM 1794 O LEU A 113 -10.818 -1.598 -2.661 1.00 0.00 O ATOM 1795 CB LEU A 113 -8.592 -4.283 -2.695 1.00 0.00 C ATOM 1796 CG LEU A 113 -7.569 -3.193 -2.375 1.00 0.00 C ATOM 1797 CD1 LEU A 113 -7.473 -2.974 -0.873 1.00 0.00 C ATOM 1798 CD2 LEU A 113 -6.207 -3.553 -2.951 1.00 0.00 C ATOM 0 H LEU A 113 -10.408 -5.659 -3.635 1.00 0.00 H new ATOM 0 HA LEU A 113 -10.330 -3.781 -1.532 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -8.417 -5.125 -2.025 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -8.409 -4.639 -3.709 1.00 0.00 H new ATOM 0 HG LEU A 113 -7.902 -2.263 -2.836 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -6.740 -2.195 -0.665 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -8.446 -2.670 -0.487 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -7.164 -3.901 -0.389 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -5.492 -2.766 -2.713 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -5.867 -4.494 -2.520 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -6.286 -3.657 -4.033 1.00 0.00 H new ATOM 1810 N THR A 114 -9.865 -2.430 -4.522 1.00 0.00 N ATOM 1811 CA THR A 114 -10.016 -1.196 -5.283 1.00 0.00 C ATOM 1812 C THR A 114 -11.312 -0.480 -4.917 1.00 0.00 C ATOM 1813 O THR A 114 -11.294 0.672 -4.485 1.00 0.00 O ATOM 1814 CB THR A 114 -10.003 -1.467 -6.799 1.00 0.00 C ATOM 1815 OG1 THR A 114 -10.783 -2.630 -7.097 1.00 0.00 O ATOM 1816 CG2 THR A 114 -8.580 -1.661 -7.301 1.00 0.00 C ATOM 0 H THR A 114 -9.420 -3.191 -5.036 1.00 0.00 H new ATOM 0 HA THR A 114 -9.168 -0.560 -5.028 1.00 0.00 H new ATOM 0 HB THR A 114 -10.435 -0.603 -7.304 1.00 0.00 H new ATOM 0 HG1 THR A 114 -10.344 -3.423 -6.724 1.00 0.00 H new ATOM 0 HG21 THR A 114 -8.596 -1.851 -8.374 1.00 0.00 H new ATOM 0 HG22 THR A 114 -7.998 -0.762 -7.100 1.00 0.00 H new ATOM 0 HG23 THR A 114 -8.126 -2.509 -6.789 1.00 0.00 H new ATOM 1824 N SER A 115 -12.434 -1.170 -5.093 1.00 0.00 N ATOM 1825 CA SER A 115 -13.739 -0.598 -4.784 1.00 0.00 C ATOM 1826 C SER A 115 -13.834 -0.228 -3.308 1.00 0.00 C ATOM 1827 O SER A 115 -14.387 0.813 -2.952 1.00 0.00 O ATOM 1828 CB SER A 115 -14.851 -1.585 -5.147 1.00 0.00 C ATOM 1829 OG SER A 115 -16.130 -1.012 -4.938 1.00 0.00 O ATOM 0 H SER A 115 -12.466 -2.126 -5.448 1.00 0.00 H new ATOM 0 HA SER A 115 -13.860 0.309 -5.376 1.00 0.00 H new ATOM 0 HB2 SER A 115 -14.749 -1.885 -6.190 1.00 0.00 H new ATOM 0 HB3 SER A 115 -14.751 -2.488 -4.545 1.00 0.00 H new ATOM 0 HG SER A 115 -16.823 -1.662 -5.179 1.00 0.00 H new ATOM 1835 N TYR A 116 -13.291 -1.087 -2.453 1.00 0.00 N ATOM 1836 CA TYR A 116 -13.316 -0.853 -1.014 1.00 0.00 C ATOM 1837 C TYR A 116 -12.529 0.403 -0.653 1.00 0.00 C ATOM 1838 O TYR A 116 -12.734 0.994 0.408 1.00 0.00 O ATOM 1839 CB TYR A 116 -12.742 -2.059 -0.269 1.00 0.00 C ATOM 1840 CG TYR A 116 -12.397 -1.772 1.175 1.00 0.00 C ATOM 1841 CD1 TYR A 116 -13.391 -1.678 2.141 1.00 0.00 C ATOM 1842 CD2 TYR A 116 -11.078 -1.593 1.572 1.00 0.00 C ATOM 1843 CE1 TYR A 116 -13.081 -1.415 3.462 1.00 0.00 C ATOM 1844 CE2 TYR A 116 -10.758 -1.331 2.890 1.00 0.00 C ATOM 1845 CZ TYR A 116 -11.763 -1.243 3.831 1.00 0.00 C ATOM 1846 OH TYR A 116 -11.449 -0.981 5.145 1.00 0.00 O ATOM 0 H TYR A 116 -12.828 -1.952 -2.731 1.00 0.00 H new ATOM 0 HA TYR A 116 -14.354 -0.709 -0.713 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -13.464 -2.875 -0.306 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -11.846 -2.402 -0.786 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -14.424 -1.813 1.855 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -10.289 -1.660 0.838 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -13.866 -1.345 4.201 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -9.727 -1.196 3.182 1.00 0.00 H new ATOM 0 HH TYR A 116 -10.478 -0.888 5.237 1.00 0.00 H new ATOM 1856 N ILE A 117 -11.628 0.805 -1.543 1.00 0.00 N ATOM 1857 CA ILE A 117 -10.811 1.991 -1.320 1.00 0.00 C ATOM 1858 C ILE A 117 -11.465 3.231 -1.921 1.00 0.00 C ATOM 1859 O ILE A 117 -11.074 4.358 -1.623 1.00 0.00 O ATOM 1860 CB ILE A 117 -9.402 1.826 -1.921 1.00 0.00 C ATOM 1861 CG1 ILE A 117 -8.703 0.610 -1.310 1.00 0.00 C ATOM 1862 CG2 ILE A 117 -8.579 3.085 -1.696 1.00 0.00 C ATOM 1863 CD1 ILE A 117 -8.423 0.754 0.170 1.00 0.00 C ATOM 0 H ILE A 117 -11.445 0.327 -2.425 1.00 0.00 H new ATOM 0 HA ILE A 117 -10.725 2.115 -0.241 1.00 0.00 H new ATOM 0 HB ILE A 117 -9.498 1.666 -2.995 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -9.322 -0.273 -1.470 1.00 0.00 H new ATOM 0 HG13 ILE A 117 -7.763 0.440 -1.835 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -7.586 2.953 -2.126 1.00 0.00 H new ATOM 0 HG22 ILE A 117 -9.072 3.932 -2.174 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -8.488 3.274 -0.626 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -7.926 -0.145 0.536 1.00 0.00 H new ATOM 0 HD12 ILE A 117 -7.779 1.617 0.336 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -9.362 0.893 0.706 1.00 0.00 H new ATOM 1875 N GLY A 118 -12.466 3.013 -2.768 1.00 0.00 N ATOM 1876 CA GLY A 118 -13.160 4.121 -3.397 1.00 0.00 C ATOM 1877 C GLY A 118 -14.330 4.617 -2.569 1.00 0.00 C ATOM 1878 O GLY A 118 -15.209 5.314 -3.077 1.00 0.00 O ATOM 0 H GLY A 118 -12.809 2.089 -3.030 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -12.459 4.940 -3.558 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -13.519 3.811 -4.378 1.00 0.00 H new ATOM 1882 N THR A 119 -14.343 4.256 -1.290 1.00 0.00 N ATOM 1883 CA THR A 119 -15.414 4.666 -0.391 1.00 0.00 C ATOM 1884 C THR A 119 -14.875 5.515 0.755 1.00 0.00 C ATOM 1885 O THR A 119 -15.562 5.737 1.752 1.00 0.00 O ATOM 1886 CB THR A 119 -16.155 3.448 0.192 1.00 0.00 C ATOM 1887 OG1 THR A 119 -15.389 2.871 1.256 1.00 0.00 O ATOM 1888 CG2 THR A 119 -16.407 2.402 -0.883 1.00 0.00 C ATOM 0 H THR A 119 -13.623 3.680 -0.853 1.00 0.00 H new ATOM 0 HA THR A 119 -16.113 5.259 -0.981 1.00 0.00 H new ATOM 0 HB THR A 119 -17.116 3.787 0.579 1.00 0.00 H new ATOM 0 HG1 THR A 119 -15.868 2.098 1.622 1.00 0.00 H new ATOM 0 HG21 THR A 119 -16.931 1.552 -0.447 1.00 0.00 H new ATOM 0 HG22 THR A 119 -17.015 2.835 -1.677 1.00 0.00 H new ATOM 0 HG23 THR A 119 -15.455 2.068 -1.296 1.00 0.00 H new ATOM 1896 N PHE A 120 -13.643 5.989 0.605 1.00 0.00 N ATOM 1897 CA PHE A 120 -13.012 6.814 1.629 1.00 0.00 C ATOM 1898 C PHE A 120 -13.096 8.293 1.262 1.00 0.00 C ATOM 1899 O PHE A 120 -13.163 8.650 0.086 1.00 0.00 O ATOM 1900 CB PHE A 120 -11.549 6.405 1.813 1.00 0.00 C ATOM 1901 CG PHE A 120 -11.354 5.318 2.831 1.00 0.00 C ATOM 1902 CD1 PHE A 120 -11.979 4.091 2.682 1.00 0.00 C ATOM 1903 CD2 PHE A 120 -10.546 5.524 3.937 1.00 0.00 C ATOM 1904 CE1 PHE A 120 -11.802 3.088 3.616 1.00 0.00 C ATOM 1905 CE2 PHE A 120 -10.364 4.525 4.875 1.00 0.00 C ATOM 1906 CZ PHE A 120 -10.994 3.306 4.715 1.00 0.00 C ATOM 0 H PHE A 120 -13.062 5.816 -0.215 1.00 0.00 H new ATOM 0 HA PHE A 120 -13.546 6.659 2.566 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -11.150 6.071 0.855 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -10.970 7.279 2.111 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -12.613 3.916 1.825 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -10.053 6.476 4.068 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -12.294 2.136 3.487 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -9.730 4.697 5.732 1.00 0.00 H new ATOM 0 HZ PHE A 120 -10.855 2.525 5.448 1.00 0.00 H new ATOM 1916 N ASP A 121 -13.092 9.149 2.279 1.00 0.00 N ATOM 1917 CA ASP A 121 -13.168 10.589 2.065 1.00 0.00 C ATOM 1918 C ASP A 121 -11.803 11.154 1.681 1.00 0.00 C ATOM 1919 O ASP A 121 -10.759 10.670 2.117 1.00 0.00 O ATOM 1920 CB ASP A 121 -13.686 11.286 3.324 1.00 0.00 C ATOM 1921 CG ASP A 121 -13.157 12.701 3.462 1.00 0.00 C ATOM 1922 OD1 ASP A 121 -11.979 12.858 3.845 1.00 0.00 O ATOM 1923 OD2 ASP A 121 -13.922 13.650 3.188 1.00 0.00 O ATOM 0 H ASP A 121 -13.037 8.870 3.259 1.00 0.00 H new ATOM 0 HA ASP A 121 -13.862 10.774 1.245 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -14.776 11.309 3.301 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -13.398 10.706 4.201 1.00 0.00 H new ATOM 1928 N PRO A 122 -11.811 12.202 0.844 1.00 0.00 N ATOM 1929 CA PRO A 122 -10.582 12.855 0.382 1.00 0.00 C ATOM 1930 C PRO A 122 -9.881 13.624 1.496 1.00 0.00 C ATOM 1931 O PRO A 122 -10.500 14.424 2.197 1.00 0.00 O ATOM 1932 CB PRO A 122 -11.077 13.816 -0.702 1.00 0.00 C ATOM 1933 CG PRO A 122 -12.496 14.094 -0.343 1.00 0.00 C ATOM 1934 CD PRO A 122 -13.019 12.831 0.285 1.00 0.00 C ATOM 0 HA PRO A 122 -9.845 12.134 0.027 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -10.486 14.732 -0.719 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -11.000 13.369 -1.693 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -12.566 14.933 0.350 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -13.077 14.361 -1.226 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -13.757 13.043 1.059 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -13.504 12.188 -0.450 1.00 0.00 H new ATOM 1942 N GLY A 123 -8.584 13.377 1.655 1.00 0.00 N ATOM 1943 CA GLY A 123 -7.820 14.055 2.685 1.00 0.00 C ATOM 1944 C GLY A 123 -7.256 13.096 3.715 1.00 0.00 C ATOM 1945 O GLY A 123 -6.205 13.353 4.301 1.00 0.00 O ATOM 0 H GLY A 123 -8.049 12.719 1.088 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -7.003 14.608 2.222 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -8.457 14.786 3.184 1.00 0.00 H new ATOM 1949 N GLU A 124 -7.956 11.988 3.935 1.00 0.00 N ATOM 1950 CA GLU A 124 -7.519 10.989 4.903 1.00 0.00 C ATOM 1951 C GLU A 124 -6.794 9.839 4.209 1.00 0.00 C ATOM 1952 O GLU A 124 -6.961 9.620 3.008 1.00 0.00 O ATOM 1953 CB GLU A 124 -8.717 10.450 5.690 1.00 0.00 C ATOM 1954 CG GLU A 124 -9.850 9.954 4.808 1.00 0.00 C ATOM 1955 CD GLU A 124 -10.845 9.096 5.566 1.00 0.00 C ATOM 1956 OE1 GLU A 124 -11.111 9.401 6.748 1.00 0.00 O ATOM 1957 OE2 GLU A 124 -11.359 8.122 4.977 1.00 0.00 O ATOM 0 H GLU A 124 -8.827 11.759 3.457 1.00 0.00 H new ATOM 0 HA GLU A 124 -6.826 11.469 5.594 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -8.383 9.634 6.331 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -9.094 11.236 6.345 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -10.369 10.809 4.374 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -9.436 9.379 3.980 1.00 0.00 H new ATOM 1964 N LEU A 125 -5.990 9.108 4.972 1.00 0.00 N ATOM 1965 CA LEU A 125 -5.238 7.981 4.432 1.00 0.00 C ATOM 1966 C LEU A 125 -6.170 6.832 4.063 1.00 0.00 C ATOM 1967 O LEU A 125 -7.247 6.683 4.641 1.00 0.00 O ATOM 1968 CB LEU A 125 -4.197 7.503 5.446 1.00 0.00 C ATOM 1969 CG LEU A 125 -3.283 8.582 6.029 1.00 0.00 C ATOM 1970 CD1 LEU A 125 -2.111 7.949 6.762 1.00 0.00 C ATOM 1971 CD2 LEU A 125 -2.788 9.511 4.930 1.00 0.00 C ATOM 0 H LEU A 125 -5.842 9.275 5.967 1.00 0.00 H new ATOM 0 HA LEU A 125 -4.728 8.316 3.529 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -4.718 7.013 6.269 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -3.574 6.747 4.968 1.00 0.00 H new ATOM 0 HG LEU A 125 -3.857 9.171 6.744 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -1.471 8.732 7.170 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -2.484 7.325 7.574 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -1.536 7.336 6.068 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -2.139 10.273 5.362 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -2.230 8.936 4.191 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -3.640 9.991 4.448 1.00 0.00 H new ATOM 1983 N CYS A 126 -5.748 6.021 3.099 1.00 0.00 N ATOM 1984 CA CYS A 126 -6.545 4.883 2.654 1.00 0.00 C ATOM 1985 C CYS A 126 -5.718 3.602 2.667 1.00 0.00 C ATOM 1986 O CYS A 126 -6.185 2.553 3.112 1.00 0.00 O ATOM 1987 CB CYS A 126 -7.093 5.136 1.249 1.00 0.00 C ATOM 1988 SG CYS A 126 -7.746 6.804 1.001 1.00 0.00 S ATOM 0 H CYS A 126 -4.859 6.130 2.611 1.00 0.00 H new ATOM 0 HA CYS A 126 -7.379 4.763 3.345 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -6.300 4.956 0.523 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -7.883 4.414 1.043 1.00 0.00 H new ATOM 0 HG CYS A 126 -8.184 6.922 -0.217 1.00 0.00 H new ATOM 1994 N VAL A 127 -4.487 3.693 2.173 1.00 0.00 N ATOM 1995 CA VAL A 127 -3.594 2.541 2.128 1.00 0.00 C ATOM 1996 C VAL A 127 -3.539 1.834 3.477 1.00 0.00 C ATOM 1997 O VAL A 127 -3.592 0.606 3.549 1.00 0.00 O ATOM 1998 CB VAL A 127 -2.168 2.953 1.718 1.00 0.00 C ATOM 1999 CG1 VAL A 127 -1.524 3.803 2.803 1.00 0.00 C ATOM 2000 CG2 VAL A 127 -1.323 1.723 1.422 1.00 0.00 C ATOM 0 H VAL A 127 -4.086 4.553 1.798 1.00 0.00 H new ATOM 0 HA VAL A 127 -3.997 1.858 1.380 1.00 0.00 H new ATOM 0 HB VAL A 127 -2.229 3.552 0.809 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -0.517 4.084 2.495 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -2.119 4.702 2.962 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -1.474 3.232 3.730 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -0.318 2.032 1.134 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -1.268 1.096 2.312 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -1.776 1.158 0.608 1.00 0.00 H new ATOM 2010 N CYS A 128 -3.434 2.617 4.545 1.00 0.00 N ATOM 2011 CA CYS A 128 -3.372 2.067 5.894 1.00 0.00 C ATOM 2012 C CYS A 128 -4.548 1.130 6.154 1.00 0.00 C ATOM 2013 O CYS A 128 -4.451 0.205 6.959 1.00 0.00 O ATOM 2014 CB CYS A 128 -3.364 3.194 6.928 1.00 0.00 C ATOM 2015 SG CYS A 128 -1.739 3.943 7.190 1.00 0.00 S ATOM 0 H CYS A 128 -3.390 3.635 4.503 1.00 0.00 H new ATOM 0 HA CYS A 128 -2.448 1.495 5.984 1.00 0.00 H new ATOM 0 HB2 CYS A 128 -4.062 3.968 6.611 1.00 0.00 H new ATOM 0 HB3 CYS A 128 -3.730 2.804 7.878 1.00 0.00 H new ATOM 0 HG CYS A 128 -1.834 4.887 8.079 1.00 0.00 H new ATOM 2021 N ALA A 129 -5.659 1.380 5.468 1.00 0.00 N ATOM 2022 CA ALA A 129 -6.853 0.559 5.624 1.00 0.00 C ATOM 2023 C ALA A 129 -6.793 -0.674 4.729 1.00 0.00 C ATOM 2024 O ALA A 129 -7.202 -1.764 5.130 1.00 0.00 O ATOM 2025 CB ALA A 129 -8.099 1.377 5.316 1.00 0.00 C ATOM 0 H ALA A 129 -5.757 2.144 4.799 1.00 0.00 H new ATOM 0 HA ALA A 129 -6.899 0.222 6.659 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -8.984 0.752 5.436 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -8.157 2.223 6.000 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -8.050 1.743 4.290 1.00 0.00 H new ATOM 2031 N ALA A 130 -6.280 -0.495 3.516 1.00 0.00 N ATOM 2032 CA ALA A 130 -6.166 -1.594 2.566 1.00 0.00 C ATOM 2033 C ALA A 130 -5.388 -2.761 3.166 1.00 0.00 C ATOM 2034 O ALA A 130 -5.794 -3.917 3.044 1.00 0.00 O ATOM 2035 CB ALA A 130 -5.498 -1.116 1.285 1.00 0.00 C ATOM 0 H ALA A 130 -5.937 0.401 3.169 1.00 0.00 H new ATOM 0 HA ALA A 130 -7.171 -1.944 2.331 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -5.419 -1.947 0.584 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -6.094 -0.320 0.839 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -4.501 -0.738 1.513 1.00 0.00 H new ATOM 2041 N ILE A 131 -4.270 -2.450 3.814 1.00 0.00 N ATOM 2042 CA ILE A 131 -3.437 -3.473 4.433 1.00 0.00 C ATOM 2043 C ILE A 131 -4.265 -4.387 5.330 1.00 0.00 C ATOM 2044 O ILE A 131 -4.323 -5.597 5.114 1.00 0.00 O ATOM 2045 CB ILE A 131 -2.302 -2.847 5.265 1.00 0.00 C ATOM 2046 CG1 ILE A 131 -1.368 -2.036 4.365 1.00 0.00 C ATOM 2047 CG2 ILE A 131 -1.528 -3.929 6.003 1.00 0.00 C ATOM 2048 CD1 ILE A 131 -0.382 -1.182 5.131 1.00 0.00 C ATOM 0 H ILE A 131 -3.921 -1.498 3.924 1.00 0.00 H new ATOM 0 HA ILE A 131 -3.002 -4.059 3.623 1.00 0.00 H new ATOM 0 HB ILE A 131 -2.740 -2.174 6.002 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -0.818 -2.718 3.717 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -1.966 -1.394 3.718 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -0.729 -3.471 6.587 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -2.201 -4.468 6.670 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -1.098 -4.625 5.282 1.00 0.00 H new ATOM 0 HD11 ILE A 131 0.248 -0.635 4.429 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -0.924 -0.475 5.759 1.00 0.00 H new ATOM 0 HD13 ILE A 131 0.242 -1.820 5.757 1.00 0.00 H new ATOM 2060 N GLN A 132 -4.906 -3.799 6.335 1.00 0.00 N ATOM 2061 CA GLN A 132 -5.732 -4.562 7.264 1.00 0.00 C ATOM 2062 C GLN A 132 -6.868 -5.267 6.529 1.00 0.00 C ATOM 2063 O GLN A 132 -7.148 -6.439 6.780 1.00 0.00 O ATOM 2064 CB GLN A 132 -6.302 -3.642 8.345 1.00 0.00 C ATOM 2065 CG GLN A 132 -7.124 -4.373 9.394 1.00 0.00 C ATOM 2066 CD GLN A 132 -6.346 -5.478 10.081 1.00 0.00 C ATOM 2067 OE1 GLN A 132 -6.280 -6.605 9.589 1.00 0.00 O ATOM 2068 NE2 GLN A 132 -5.749 -5.160 11.224 1.00 0.00 N ATOM 0 H GLN A 132 -4.869 -2.798 6.527 1.00 0.00 H new ATOM 0 HA GLN A 132 -5.103 -5.318 7.734 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -5.481 -3.121 8.837 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -6.924 -2.882 7.873 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -7.470 -3.659 10.141 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -8.011 -4.797 8.924 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -5.830 -4.214 11.596 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -5.210 -5.862 11.730 1.00 0.00 H new ATOM 2077 N TRP A 133 -7.518 -4.545 5.624 1.00 0.00 N ATOM 2078 CA TRP A 133 -8.624 -5.102 4.853 1.00 0.00 C ATOM 2079 C TRP A 133 -8.203 -6.387 4.147 1.00 0.00 C ATOM 2080 O TRP A 133 -8.990 -7.326 4.025 1.00 0.00 O ATOM 2081 CB TRP A 133 -9.123 -4.083 3.828 1.00 0.00 C ATOM 2082 CG TRP A 133 -10.256 -4.590 2.988 1.00 0.00 C ATOM 2083 CD1 TRP A 133 -11.590 -4.426 3.226 1.00 0.00 C ATOM 2084 CD2 TRP A 133 -10.152 -5.347 1.777 1.00 0.00 C ATOM 2085 NE1 TRP A 133 -12.323 -5.034 2.236 1.00 0.00 N ATOM 2086 CE2 TRP A 133 -11.464 -5.606 1.334 1.00 0.00 C ATOM 2087 CE3 TRP A 133 -9.079 -5.829 1.023 1.00 0.00 C ATOM 2088 CZ2 TRP A 133 -11.729 -6.326 0.173 1.00 0.00 C ATOM 2089 CZ3 TRP A 133 -9.343 -6.544 -0.130 1.00 0.00 C ATOM 2090 CH2 TRP A 133 -10.659 -6.786 -0.546 1.00 0.00 C ATOM 0 H TRP A 133 -7.299 -3.573 5.406 1.00 0.00 H new ATOM 0 HA TRP A 133 -9.433 -5.337 5.544 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -9.442 -3.181 4.349 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -8.296 -3.799 3.177 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -12.008 -3.896 4.069 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -13.341 -5.056 2.181 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -8.062 -5.646 1.336 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -12.742 -6.515 -0.149 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -8.521 -6.922 -0.720 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -10.833 -7.347 -1.452 1.00 0.00 H new ATOM 2101 N LEU A 134 -6.958 -6.421 3.684 1.00 0.00 N ATOM 2102 CA LEU A 134 -6.433 -7.592 2.990 1.00 0.00 C ATOM 2103 C LEU A 134 -6.195 -8.741 3.964 1.00 0.00 C ATOM 2104 O LEU A 134 -6.793 -9.809 3.837 1.00 0.00 O ATOM 2105 CB LEU A 134 -5.130 -7.240 2.270 1.00 0.00 C ATOM 2106 CG LEU A 134 -5.274 -6.702 0.846 1.00 0.00 C ATOM 2107 CD1 LEU A 134 -4.113 -5.782 0.503 1.00 0.00 C ATOM 2108 CD2 LEU A 134 -5.362 -7.848 -0.151 1.00 0.00 C ATOM 0 H LEU A 134 -6.294 -5.652 3.776 1.00 0.00 H new ATOM 0 HA LEU A 134 -7.172 -7.911 2.255 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -4.598 -6.498 2.865 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -4.503 -8.131 2.239 1.00 0.00 H new ATOM 0 HG LEU A 134 -6.197 -6.125 0.788 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -4.233 -5.409 -0.514 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -4.096 -4.942 1.198 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -3.176 -6.334 0.579 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -5.464 -7.446 -1.159 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -4.457 -8.453 -0.091 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -6.228 -8.467 0.082 1.00 0.00 H new ATOM 2120 N GLN A 135 -5.318 -8.513 4.937 1.00 0.00 N ATOM 2121 CA GLN A 135 -5.002 -9.530 5.933 1.00 0.00 C ATOM 2122 C GLN A 135 -6.261 -10.272 6.371 1.00 0.00 C ATOM 2123 O GLN A 135 -6.332 -11.498 6.286 1.00 0.00 O ATOM 2124 CB GLN A 135 -4.324 -8.892 7.146 1.00 0.00 C ATOM 2125 CG GLN A 135 -3.027 -8.172 6.810 1.00 0.00 C ATOM 2126 CD GLN A 135 -2.112 -8.027 8.010 1.00 0.00 C ATOM 2127 OE1 GLN A 135 -2.287 -7.129 8.834 1.00 0.00 O ATOM 2128 NE2 GLN A 135 -1.128 -8.913 8.115 1.00 0.00 N ATOM 0 H GLN A 135 -4.814 -7.634 5.056 1.00 0.00 H new ATOM 0 HA GLN A 135 -4.318 -10.248 5.479 1.00 0.00 H new ATOM 0 HB2 GLN A 135 -5.014 -8.185 7.607 1.00 0.00 H new ATOM 0 HB3 GLN A 135 -4.119 -9.666 7.886 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -2.506 -8.719 6.024 1.00 0.00 H new ATOM 0 HG3 GLN A 135 -3.257 -7.184 6.412 1.00 0.00 H new ATOM 0 HE21 GLN A 135 -1.020 -9.641 7.409 1.00 0.00 H new ATOM 0 HE22 GLN A 135 -0.481 -8.865 8.902 1.00 0.00 H new ATOM 2137 N ASP A 136 -7.251 -9.521 6.841 1.00 0.00 N ATOM 2138 CA ASP A 136 -8.507 -10.107 7.292 1.00 0.00 C ATOM 2139 C ASP A 136 -9.221 -10.813 6.143 1.00 0.00 C ATOM 2140 O ASP A 136 -9.676 -11.947 6.285 1.00 0.00 O ATOM 2141 CB ASP A 136 -9.414 -9.029 7.887 1.00 0.00 C ATOM 2142 CG ASP A 136 -10.627 -9.612 8.585 1.00 0.00 C ATOM 2143 OD1 ASP A 136 -10.442 -10.375 9.556 1.00 0.00 O ATOM 2144 OD2 ASP A 136 -11.760 -9.304 8.161 1.00 0.00 O ATOM 0 H ASP A 136 -7.208 -8.505 6.919 1.00 0.00 H new ATOM 0 HA ASP A 136 -8.279 -10.844 8.062 1.00 0.00 H new ATOM 0 HB2 ASP A 136 -8.844 -8.430 8.597 1.00 0.00 H new ATOM 0 HB3 ASP A 136 -9.743 -8.357 7.094 1.00 0.00 H new ATOM 2149 N ASN A 137 -9.316 -10.132 5.006 1.00 0.00 N ATOM 2150 CA ASN A 137 -9.977 -10.693 3.832 1.00 0.00 C ATOM 2151 C ASN A 137 -8.954 -11.245 2.844 1.00 0.00 C ATOM 2152 O ASN A 137 -9.057 -11.022 1.638 1.00 0.00 O ATOM 2153 CB ASN A 137 -10.839 -9.630 3.150 1.00 0.00 C ATOM 2154 CG ASN A 137 -11.753 -8.913 4.125 1.00 0.00 C ATOM 2155 OD1 ASN A 137 -12.637 -9.522 4.728 1.00 0.00 O ATOM 2156 ND2 ASN A 137 -11.544 -7.611 4.284 1.00 0.00 N ATOM 0 H ASN A 137 -8.944 -9.192 4.872 1.00 0.00 H new ATOM 0 HA ASN A 137 -10.616 -11.512 4.162 1.00 0.00 H new ATOM 0 HB2 ASN A 137 -10.193 -8.902 2.660 1.00 0.00 H new ATOM 0 HB3 ASN A 137 -11.440 -10.099 2.371 1.00 0.00 H new ATOM 0 HD21 ASN A 137 -12.128 -7.075 4.926 1.00 0.00 H new ATOM 0 HD22 ASN A 137 -10.800 -7.147 3.764 1.00 0.00 H new ATOM 2163 N SER A 138 -7.967 -11.968 3.365 1.00 0.00 N ATOM 2164 CA SER A 138 -6.923 -12.550 2.529 1.00 0.00 C ATOM 2165 C SER A 138 -7.113 -14.057 2.393 1.00 0.00 C ATOM 2166 O SER A 138 -7.134 -14.594 1.286 1.00 0.00 O ATOM 2167 CB SER A 138 -5.543 -12.249 3.117 1.00 0.00 C ATOM 2168 OG SER A 138 -4.541 -13.033 2.493 1.00 0.00 O ATOM 0 H SER A 138 -7.869 -12.164 4.361 1.00 0.00 H new ATOM 0 HA SER A 138 -6.993 -12.102 1.538 1.00 0.00 H new ATOM 0 HB2 SER A 138 -5.313 -11.191 2.990 1.00 0.00 H new ATOM 0 HB3 SER A 138 -5.550 -12.447 4.189 1.00 0.00 H new ATOM 0 HG SER A 138 -3.974 -12.458 1.938 1.00 0.00 H new ATOM 2174 N ALA A 139 -7.252 -14.734 3.528 1.00 0.00 N ATOM 2175 CA ALA A 139 -7.442 -16.180 3.538 1.00 0.00 C ATOM 2176 C ALA A 139 -8.794 -16.559 2.942 1.00 0.00 C ATOM 2177 O ALA A 139 -8.894 -17.497 2.151 1.00 0.00 O ATOM 2178 CB ALA A 139 -7.317 -16.720 4.954 1.00 0.00 C ATOM 0 H ALA A 139 -7.237 -14.304 4.453 1.00 0.00 H new ATOM 0 HA ALA A 139 -6.663 -16.628 2.921 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -7.461 -17.800 4.945 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -6.326 -16.489 5.345 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -8.074 -16.258 5.588 1.00 0.00 H new ATOM 2184 N SER A 140 -9.833 -15.824 3.329 1.00 0.00 N ATOM 2185 CA SER A 140 -11.180 -16.087 2.836 1.00 0.00 C ATOM 2186 C SER A 140 -11.161 -16.403 1.344 1.00 0.00 C ATOM 2187 O SER A 140 -12.055 -17.075 0.829 1.00 0.00 O ATOM 2188 CB SER A 140 -12.087 -14.884 3.103 1.00 0.00 C ATOM 2189 OG SER A 140 -12.451 -14.814 4.471 1.00 0.00 O ATOM 0 H SER A 140 -9.767 -15.043 3.982 1.00 0.00 H new ATOM 0 HA SER A 140 -11.572 -16.954 3.368 1.00 0.00 H new ATOM 0 HB2 SER A 140 -11.575 -13.967 2.812 1.00 0.00 H new ATOM 0 HB3 SER A 140 -12.984 -14.957 2.488 1.00 0.00 H new ATOM 0 HG SER A 140 -13.029 -14.036 4.616 1.00 0.00 H new ATOM 2195 N TYR A 141 -10.136 -15.913 0.655 1.00 0.00 N ATOM 2196 CA TYR A 141 -10.001 -16.140 -0.779 1.00 0.00 C ATOM 2197 C TYR A 141 -9.300 -17.466 -1.057 1.00 0.00 C ATOM 2198 O TYR A 141 -9.795 -18.296 -1.819 1.00 0.00 O ATOM 2199 CB TYR A 141 -9.223 -14.993 -1.427 1.00 0.00 C ATOM 2200 CG TYR A 141 -9.993 -13.692 -1.478 1.00 0.00 C ATOM 2201 CD1 TYR A 141 -10.207 -12.943 -0.328 1.00 0.00 C ATOM 2202 CD2 TYR A 141 -10.506 -13.213 -2.677 1.00 0.00 C ATOM 2203 CE1 TYR A 141 -10.910 -11.755 -0.370 1.00 0.00 C ATOM 2204 CE2 TYR A 141 -11.209 -12.025 -2.728 1.00 0.00 C ATOM 2205 CZ TYR A 141 -11.408 -11.300 -1.572 1.00 0.00 C ATOM 2206 OH TYR A 141 -12.109 -10.116 -1.619 1.00 0.00 O ATOM 0 H TYR A 141 -9.387 -15.356 1.066 1.00 0.00 H new ATOM 0 HA TYR A 141 -11.001 -16.181 -1.210 1.00 0.00 H new ATOM 0 HB2 TYR A 141 -8.297 -14.836 -0.875 1.00 0.00 H new ATOM 0 HB3 TYR A 141 -8.945 -15.281 -2.441 1.00 0.00 H new ATOM 0 HD1 TYR A 141 -9.817 -13.296 0.615 1.00 0.00 H new ATOM 0 HD2 TYR A 141 -10.353 -13.779 -3.584 1.00 0.00 H new ATOM 0 HE1 TYR A 141 -11.069 -11.186 0.534 1.00 0.00 H new ATOM 0 HE2 TYR A 141 -11.601 -11.666 -3.668 1.00 0.00 H new ATOM 0 HH TYR A 141 -12.390 -9.938 -2.541 1.00 0.00 H new ATOM 2216 N PHE A 142 -8.143 -17.658 -0.432 1.00 0.00 N ATOM 2217 CA PHE A 142 -7.371 -18.883 -0.611 1.00 0.00 C ATOM 2218 C PHE A 142 -8.258 -20.113 -0.445 1.00 0.00 C ATOM 2219 O PHE A 142 -8.227 -21.030 -1.266 1.00 0.00 O ATOM 2220 CB PHE A 142 -6.216 -18.934 0.391 1.00 0.00 C ATOM 2221 CG PHE A 142 -5.006 -18.161 -0.050 1.00 0.00 C ATOM 2222 CD1 PHE A 142 -4.981 -16.778 0.035 1.00 0.00 C ATOM 2223 CD2 PHE A 142 -3.893 -18.817 -0.550 1.00 0.00 C ATOM 2224 CE1 PHE A 142 -3.869 -16.065 -0.370 1.00 0.00 C ATOM 2225 CE2 PHE A 142 -2.777 -18.110 -0.957 1.00 0.00 C ATOM 2226 CZ PHE A 142 -2.765 -16.732 -0.866 1.00 0.00 C ATOM 0 H PHE A 142 -7.719 -16.981 0.203 1.00 0.00 H new ATOM 0 HA PHE A 142 -6.965 -18.883 -1.623 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -6.559 -18.542 1.349 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -5.933 -19.974 0.555 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -5.841 -16.251 0.422 1.00 0.00 H new ATOM 0 HD2 PHE A 142 -3.897 -19.895 -0.623 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -3.863 -14.987 -0.299 1.00 0.00 H new ATOM 0 HE2 PHE A 142 -1.916 -18.634 -1.345 1.00 0.00 H new ATOM 0 HZ PHE A 142 -1.894 -16.177 -1.182 1.00 0.00 H new