USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1058 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 138 THR OG1 : rot 49:sc= 0.116 USER MOD Set 2.1: A 77 LYS NZ :NH3+ -173:sc= 0.719 (180deg=0.696) USER MOD Set 2.2: A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 170:sc= -0.0696 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -2.18 K(o=-2.2,f=-4.8!) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -157:sc= -1.93! (180deg=-2.61) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 82:sc= 0.0522 USER MOD Single : A 38 HIS : no HE2:sc= 1.13 K(o=1.1,f=-4.8!) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.221 USER MOD Single : A 51 HIS : no HD1:sc= -1.07 X(o=-1.1,f=-1.4) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= 0.228 K(o=0.23,f=-0.7) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 170:sc= -0.0527 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ -142:sc= -0.206 (180deg=-2.2!) USER MOD Single : A 87 ASN : amide:sc= -0.236 K(o=-0.24,f=-1.9!) USER MOD Single : A 88 SER OG : rot 180:sc= 0.0772 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= -0.0179 K(o=-0.018,f=-1.3) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=-0.0068) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 MET CE :methyl 154:sc= -0.97 (180deg=-1.74!) USER MOD Single : A 119 SER OG : rot 155:sc= 0.551 USER MOD Single : A 120 ASN : amide:sc= -5.79! C(o=-5.8!,f=-13!) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 69:sc= 0.0742 USER MOD Single : A 126 CYS SG : rot 100:sc= -2.62! USER MOD Single : A 127 ASN : amide:sc= -0.194 K(o=-0.19,f=-3!) USER MOD Single : A 136 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 LYS NZ :NH3+ 161:sc=-0.00785 (180deg=-0.159) USER MOD Single : A 144 MET CE :methyl 180:sc= -0.378 (180deg=-0.378) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 150 CYS SG : rot -118:sc= 0.257 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -7.401 -10.110 10.561 1.00 0.00 N ATOM 88 CA ASP A 9 -7.940 -8.761 10.419 1.00 0.00 C ATOM 89 C ASP A 9 -8.834 -8.659 9.188 1.00 0.00 C ATOM 90 O ASP A 9 -8.377 -8.841 8.059 1.00 0.00 O ATOM 91 CB ASP A 9 -6.802 -7.744 10.325 1.00 0.00 C ATOM 92 CG ASP A 9 -7.118 -6.454 11.056 1.00 0.00 C ATOM 93 OD1 ASP A 9 -7.370 -6.511 12.278 1.00 0.00 O ATOM 94 OD2 ASP A 9 -7.116 -5.387 10.407 1.00 0.00 O ATOM 0 HA ASP A 9 -8.542 -8.541 11.300 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -5.893 -8.180 10.740 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -6.600 -7.524 9.277 1.00 0.00 H new ATOM 99 N ILE A 10 -10.111 -8.367 9.413 1.00 0.00 N ATOM 100 CA ILE A 10 -11.070 -8.241 8.322 1.00 0.00 C ATOM 101 C ILE A 10 -12.195 -7.278 8.691 1.00 0.00 C ATOM 102 O ILE A 10 -12.825 -7.415 9.740 1.00 0.00 O ATOM 103 CB ILE A 10 -11.675 -9.608 7.946 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.598 -9.470 6.733 1.00 0.00 C ATOM 105 CG2 ILE A 10 -12.428 -10.201 9.128 1.00 0.00 C ATOM 106 CD1 ILE A 10 -12.482 -10.616 5.752 1.00 0.00 C ATOM 0 H ILE A 10 -10.505 -8.213 10.341 1.00 0.00 H new ATOM 0 HA ILE A 10 -10.527 -7.847 7.463 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.862 -10.285 7.683 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -13.630 -9.400 7.078 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -12.370 -8.537 6.218 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.848 -11.166 8.845 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.743 -10.335 9.965 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.233 -9.527 9.422 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -13.164 -10.452 4.918 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -11.460 -10.673 5.379 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -12.738 -11.550 6.252 1.00 0.00 H new ATOM 118 N VAL A 11 -12.442 -6.303 7.822 1.00 0.00 N ATOM 119 CA VAL A 11 -13.492 -5.319 8.056 1.00 0.00 C ATOM 120 C VAL A 11 -14.277 -5.037 6.780 1.00 0.00 C ATOM 121 O VAL A 11 -13.835 -4.270 5.924 1.00 0.00 O ATOM 122 CB VAL A 11 -12.913 -3.995 8.591 1.00 0.00 C ATOM 123 CG1 VAL A 11 -14.030 -3.055 9.016 1.00 0.00 C ATOM 124 CG2 VAL A 11 -11.959 -4.258 9.746 1.00 0.00 C ATOM 0 H VAL A 11 -11.929 -6.174 6.950 1.00 0.00 H new ATOM 0 HA VAL A 11 -14.161 -5.744 8.805 1.00 0.00 H new ATOM 0 HB VAL A 11 -12.353 -3.515 7.789 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -13.601 -2.126 9.391 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -14.670 -2.840 8.160 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -14.621 -3.525 9.802 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -11.560 -3.312 10.111 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -12.493 -4.761 10.552 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -11.139 -4.890 9.404 1.00 0.00 H new ATOM 134 N GLY A 12 -15.442 -5.663 6.658 1.00 0.00 N ATOM 135 CA GLY A 12 -16.271 -5.466 5.483 1.00 0.00 C ATOM 136 C GLY A 12 -15.771 -6.250 4.284 1.00 0.00 C ATOM 137 O GLY A 12 -16.245 -7.353 4.013 1.00 0.00 O ATOM 0 H GLY A 12 -15.828 -6.304 7.352 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -17.294 -5.766 5.709 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.298 -4.405 5.234 1.00 0.00 H new ATOM 141 N ILE A 13 -14.809 -5.679 3.566 1.00 0.00 N ATOM 142 CA ILE A 13 -14.245 -6.330 2.391 1.00 0.00 C ATOM 143 C ILE A 13 -12.748 -6.060 2.278 1.00 0.00 C ATOM 144 O ILE A 13 -12.198 -6.000 1.179 1.00 0.00 O ATOM 145 CB ILE A 13 -14.938 -5.859 1.098 1.00 0.00 C ATOM 146 CG1 ILE A 13 -14.842 -4.338 0.965 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.391 -6.308 1.083 1.00 0.00 C ATOM 148 CD1 ILE A 13 -15.060 -3.840 -0.447 1.00 0.00 C ATOM 0 H ILE A 13 -14.404 -4.767 3.778 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.411 -7.400 2.514 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.430 -6.310 0.246 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -15.579 -3.877 1.622 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -13.860 -4.013 1.309 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -16.867 -5.968 0.164 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.436 -7.396 1.134 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -16.912 -5.882 1.941 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -14.978 -2.753 -0.466 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -14.307 -4.273 -1.106 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -16.053 -4.135 -0.788 1.00 0.00 H new ATOM 160 N TRP A 14 -12.094 -5.898 3.424 1.00 0.00 N ATOM 161 CA TRP A 14 -10.660 -5.634 3.455 1.00 0.00 C ATOM 162 C TRP A 14 -9.978 -6.456 4.544 1.00 0.00 C ATOM 163 O TRP A 14 -10.425 -6.477 5.691 1.00 0.00 O ATOM 164 CB TRP A 14 -10.399 -4.144 3.684 1.00 0.00 C ATOM 165 CG TRP A 14 -11.108 -3.259 2.706 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.365 -2.741 2.831 1.00 0.00 C ATOM 167 CD2 TRP A 14 -10.602 -2.789 1.451 1.00 0.00 C ATOM 168 NE1 TRP A 14 -12.672 -1.977 1.731 1.00 0.00 N ATOM 169 CE2 TRP A 14 -11.605 -1.991 0.870 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.398 -2.964 0.763 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.442 -1.370 -0.367 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.236 -2.348 -0.463 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.252 -1.559 -1.017 1.00 0.00 C ATOM 0 H TRP A 14 -12.534 -5.945 4.343 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.242 -5.925 2.491 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -10.710 -3.879 4.694 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.327 -3.957 3.621 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -13.022 -2.907 3.672 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -13.550 -1.481 1.580 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -8.608 -3.570 1.182 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.225 -0.763 -0.797 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.310 -2.477 -1.004 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -10.093 -1.090 -1.977 1.00 0.00 H new ATOM 184 N TRP A 15 -8.894 -7.132 4.177 1.00 0.00 N ATOM 185 CA TRP A 15 -8.151 -7.955 5.124 1.00 0.00 C ATOM 186 C TRP A 15 -6.659 -7.641 5.062 1.00 0.00 C ATOM 187 O TRP A 15 -6.079 -7.545 3.980 1.00 0.00 O ATOM 188 CB TRP A 15 -8.384 -9.439 4.835 1.00 0.00 C ATOM 189 CG TRP A 15 -8.218 -9.796 3.390 1.00 0.00 C ATOM 190 CD1 TRP A 15 -9.108 -9.566 2.380 1.00 0.00 C ATOM 191 CD2 TRP A 15 -7.094 -10.452 2.791 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.606 -10.037 1.191 1.00 0.00 N ATOM 193 CE2 TRP A 15 -7.370 -10.585 1.417 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.879 -10.937 3.283 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -6.478 -11.183 0.531 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.993 -11.531 2.403 1.00 0.00 C ATOM 197 CH2 TRP A 15 -5.296 -11.649 1.041 1.00 0.00 C ATOM 0 H TRP A 15 -8.511 -7.126 3.232 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.511 -7.727 6.127 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.689 -10.031 5.430 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.390 -9.711 5.156 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -10.067 -9.084 2.499 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.076 -9.987 0.287 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.636 -10.849 4.332 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.710 -11.276 -0.520 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -4.052 -11.910 2.772 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.583 -12.117 0.379 1.00 0.00 H new ATOM 208 N THR A 16 -6.044 -7.484 6.230 1.00 0.00 N ATOM 209 CA THR A 16 -4.620 -7.181 6.309 1.00 0.00 C ATOM 210 C THR A 16 -3.790 -8.310 5.707 1.00 0.00 C ATOM 211 O THR A 16 -3.896 -9.463 6.125 1.00 0.00 O ATOM 212 CB THR A 16 -4.207 -6.946 7.762 1.00 0.00 C ATOM 213 OG1 THR A 16 -4.971 -5.901 8.339 1.00 0.00 O ATOM 214 CG2 THR A 16 -2.745 -6.586 7.920 1.00 0.00 C ATOM 0 H THR A 16 -6.510 -7.562 7.134 1.00 0.00 H new ATOM 0 HA THR A 16 -4.434 -6.273 5.736 1.00 0.00 H new ATOM 0 HB THR A 16 -4.388 -7.894 8.269 1.00 0.00 H new ATOM 0 HG1 THR A 16 -4.809 -5.873 9.305 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.520 -6.433 8.975 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.127 -7.395 7.531 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.534 -5.670 7.368 1.00 0.00 H new ATOM 222 N VAL A 17 -2.963 -7.970 4.723 1.00 0.00 N ATOM 223 CA VAL A 17 -2.115 -8.955 4.064 1.00 0.00 C ATOM 224 C VAL A 17 -1.076 -9.519 5.027 1.00 0.00 C ATOM 225 O VAL A 17 -1.017 -9.126 6.192 1.00 0.00 O ATOM 226 CB VAL A 17 -1.393 -8.350 2.846 1.00 0.00 C ATOM 227 CG1 VAL A 17 -2.395 -7.964 1.769 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.556 -7.149 3.262 1.00 0.00 C ATOM 0 H VAL A 17 -2.863 -7.020 4.365 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.769 -9.759 3.727 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.723 -9.104 2.433 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.866 -7.538 0.916 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.945 -8.849 1.450 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.092 -7.228 2.168 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.054 -6.735 2.388 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.203 -6.390 3.702 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.188 -7.461 3.995 1.00 0.00 H new ATOM 238 N SER A 18 -0.257 -10.442 4.532 1.00 0.00 N ATOM 239 CA SER A 18 0.781 -11.059 5.349 1.00 0.00 C ATOM 240 C SER A 18 2.144 -10.951 4.673 1.00 0.00 C ATOM 241 O SER A 18 3.140 -10.614 5.312 1.00 0.00 O ATOM 242 CB SER A 18 0.446 -12.529 5.612 1.00 0.00 C ATOM 243 OG SER A 18 -0.310 -12.676 6.800 1.00 0.00 O ATOM 0 H SER A 18 -0.292 -10.779 3.570 1.00 0.00 H new ATOM 0 HA SER A 18 0.824 -10.526 6.299 1.00 0.00 H new ATOM 0 HB2 SER A 18 -0.114 -12.934 4.769 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.367 -13.107 5.690 1.00 0.00 H new ATOM 0 HG SER A 18 -0.512 -13.624 6.944 1.00 0.00 H new ATOM 249 N ASN A 19 2.180 -11.239 3.376 1.00 0.00 N ATOM 250 CA ASN A 19 3.421 -11.173 2.612 1.00 0.00 C ATOM 251 C ASN A 19 3.267 -10.253 1.405 1.00 0.00 C ATOM 252 O ASN A 19 2.209 -9.662 1.191 1.00 0.00 O ATOM 253 CB ASN A 19 3.837 -12.572 2.152 1.00 0.00 C ATOM 254 CG ASN A 19 2.680 -13.364 1.577 1.00 0.00 C ATOM 255 OD1 ASN A 19 1.711 -13.664 2.273 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.775 -13.707 0.298 1.00 0.00 N ATOM 0 H ASN A 19 1.364 -11.520 2.832 1.00 0.00 H new ATOM 0 HA ASN A 19 4.197 -10.766 3.260 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.622 -12.485 1.401 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.262 -13.116 2.995 1.00 0.00 H new ATOM 0 HD21 ASN A 19 2.026 -14.240 -0.144 1.00 0.00 H new ATOM 0 HD22 ASN A 19 3.597 -13.437 -0.243 1.00 0.00 H new ATOM 263 N PHE A 20 4.333 -10.137 0.619 1.00 0.00 N ATOM 264 CA PHE A 20 4.319 -9.287 -0.567 1.00 0.00 C ATOM 265 C PHE A 20 3.465 -9.906 -1.671 1.00 0.00 C ATOM 266 O PHE A 20 2.794 -9.196 -2.420 1.00 0.00 O ATOM 267 CB PHE A 20 5.744 -9.063 -1.075 1.00 0.00 C ATOM 268 CG PHE A 20 5.835 -8.055 -2.184 1.00 0.00 C ATOM 269 CD1 PHE A 20 5.692 -6.701 -1.922 1.00 0.00 C ATOM 270 CD2 PHE A 20 6.063 -8.460 -3.490 1.00 0.00 C ATOM 271 CE1 PHE A 20 5.775 -5.771 -2.941 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.147 -7.535 -4.513 1.00 0.00 C ATOM 273 CZ PHE A 20 6.003 -6.188 -4.238 1.00 0.00 C ATOM 0 H PHE A 20 5.216 -10.620 0.782 1.00 0.00 H new ATOM 0 HA PHE A 20 3.883 -8.327 -0.290 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.369 -8.735 -0.245 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.150 -10.012 -1.424 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.514 -6.369 -0.910 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.176 -9.511 -3.711 1.00 0.00 H new ATOM 0 HE1 PHE A 20 5.662 -4.719 -2.723 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.325 -7.864 -5.526 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.069 -5.463 -5.036 1.00 0.00 H new ATOM 283 N GLY A 21 3.498 -11.231 -1.765 1.00 0.00 N ATOM 284 CA GLY A 21 2.724 -11.922 -2.780 1.00 0.00 C ATOM 285 C GLY A 21 1.240 -11.627 -2.682 1.00 0.00 C ATOM 286 O GLY A 21 0.520 -11.689 -3.679 1.00 0.00 O ATOM 0 H GLY A 21 4.047 -11.839 -1.157 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.084 -11.631 -3.767 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.884 -12.996 -2.686 1.00 0.00 H new ATOM 290 N GLU A 22 0.780 -11.307 -1.477 1.00 0.00 N ATOM 291 CA GLU A 22 -0.628 -11.002 -1.252 1.00 0.00 C ATOM 292 C GLU A 22 -0.981 -9.621 -1.795 1.00 0.00 C ATOM 293 O GLU A 22 -2.114 -9.378 -2.211 1.00 0.00 O ATOM 294 CB GLU A 22 -0.955 -11.076 0.241 1.00 0.00 C ATOM 295 CG GLU A 22 -0.643 -12.425 0.866 1.00 0.00 C ATOM 296 CD GLU A 22 -1.392 -13.563 0.200 1.00 0.00 C ATOM 297 OE1 GLU A 22 -1.111 -13.846 -0.983 1.00 0.00 O ATOM 298 OE2 GLU A 22 -2.259 -14.170 0.862 1.00 0.00 O ATOM 0 H GLU A 22 1.362 -11.252 -0.641 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.224 -11.743 -1.785 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.394 -10.303 0.766 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -2.013 -10.855 0.384 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.429 -12.613 0.800 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.898 -12.398 1.926 1.00 0.00 H new ATOM 305 N ILE A 23 -0.006 -8.719 -1.786 1.00 0.00 N ATOM 306 CA ILE A 23 -0.215 -7.363 -2.279 1.00 0.00 C ATOM 307 C ILE A 23 -0.417 -7.353 -3.791 1.00 0.00 C ATOM 308 O ILE A 23 0.546 -7.370 -4.555 1.00 0.00 O ATOM 309 CB ILE A 23 0.970 -6.444 -1.924 1.00 0.00 C ATOM 310 CG1 ILE A 23 1.304 -6.556 -0.434 1.00 0.00 C ATOM 311 CG2 ILE A 23 0.655 -5.002 -2.295 1.00 0.00 C ATOM 312 CD1 ILE A 23 2.460 -5.681 -0.005 1.00 0.00 C ATOM 0 H ILE A 23 0.937 -8.902 -1.443 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.114 -6.986 -1.792 1.00 0.00 H new ATOM 0 HB ILE A 23 1.840 -6.763 -2.497 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.422 -6.290 0.148 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.539 -7.594 -0.200 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.502 -4.367 -2.038 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.464 -4.935 -3.366 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.227 -4.670 -1.748 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.639 -5.812 1.062 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.355 -5.962 -0.561 1.00 0.00 H new ATOM 0 HD13 ILE A 23 2.220 -4.637 -0.207 1.00 0.00 H new ATOM 324 N SER A 24 -1.678 -7.325 -4.214 1.00 0.00 N ATOM 325 CA SER A 24 -2.006 -7.313 -5.634 1.00 0.00 C ATOM 326 C SER A 24 -3.394 -6.724 -5.867 1.00 0.00 C ATOM 327 O SER A 24 -4.316 -6.956 -5.085 1.00 0.00 O ATOM 328 CB SER A 24 -1.939 -8.730 -6.208 1.00 0.00 C ATOM 329 OG SER A 24 -2.983 -9.537 -5.695 1.00 0.00 O ATOM 0 H SER A 24 -2.487 -7.310 -3.594 1.00 0.00 H new ATOM 0 HA SER A 24 -1.274 -6.687 -6.144 1.00 0.00 H new ATOM 0 HB2 SER A 24 -2.007 -8.689 -7.295 1.00 0.00 H new ATOM 0 HB3 SER A 24 -0.976 -9.179 -5.966 1.00 0.00 H new ATOM 0 HG SER A 24 -2.919 -10.437 -6.078 1.00 0.00 H new ATOM 335 N GLY A 25 -3.534 -5.962 -6.946 1.00 0.00 N ATOM 336 CA GLY A 25 -4.812 -5.352 -7.262 1.00 0.00 C ATOM 337 C GLY A 25 -5.079 -4.106 -6.442 1.00 0.00 C ATOM 338 O GLY A 25 -4.244 -3.203 -6.381 1.00 0.00 O ATOM 0 H GLY A 25 -2.785 -5.756 -7.607 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.838 -5.098 -8.322 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.609 -6.075 -7.088 1.00 0.00 H new ATOM 342 N THR A 26 -6.247 -4.054 -5.809 1.00 0.00 N ATOM 343 CA THR A 26 -6.622 -2.909 -4.988 1.00 0.00 C ATOM 344 C THR A 26 -6.260 -3.147 -3.526 1.00 0.00 C ATOM 345 O THR A 26 -6.484 -4.232 -2.989 1.00 0.00 O ATOM 346 CB THR A 26 -8.121 -2.632 -5.115 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.566 -2.883 -6.437 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.499 -1.210 -4.766 1.00 0.00 C ATOM 0 H THR A 26 -6.950 -4.792 -5.849 1.00 0.00 H new ATOM 0 HA THR A 26 -6.068 -2.041 -5.345 1.00 0.00 H new ATOM 0 HB THR A 26 -8.600 -3.303 -4.402 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.527 -2.702 -6.499 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.576 -1.082 -4.877 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.213 -1.000 -3.735 1.00 0.00 H new ATOM 0 HG23 THR A 26 -7.981 -0.522 -5.434 1.00 0.00 H new ATOM 356 N ILE A 27 -5.700 -2.125 -2.887 1.00 0.00 N ATOM 357 CA ILE A 27 -5.307 -2.223 -1.486 1.00 0.00 C ATOM 358 C ILE A 27 -5.413 -0.871 -0.790 1.00 0.00 C ATOM 359 O ILE A 27 -5.092 0.166 -1.373 1.00 0.00 O ATOM 360 CB ILE A 27 -3.867 -2.750 -1.341 1.00 0.00 C ATOM 361 CG1 ILE A 27 -2.897 -1.875 -2.138 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.783 -4.198 -1.803 1.00 0.00 C ATOM 363 CD1 ILE A 27 -1.445 -2.257 -1.950 1.00 0.00 C ATOM 0 H ILE A 27 -5.508 -1.220 -3.317 1.00 0.00 H new ATOM 0 HA ILE A 27 -5.993 -2.927 -1.014 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.585 -2.707 -0.289 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -3.147 -1.940 -3.197 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -3.032 -0.835 -1.842 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.759 -4.556 -1.694 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.448 -4.813 -1.197 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -4.081 -4.264 -2.849 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -0.815 -1.595 -2.544 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.178 -2.164 -0.897 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.295 -3.287 -2.273 1.00 0.00 H new ATOM 375 N ALA A 28 -5.865 -0.888 0.459 1.00 0.00 N ATOM 376 CA ALA A 28 -6.012 0.337 1.234 1.00 0.00 C ATOM 377 C ALA A 28 -4.957 0.423 2.331 1.00 0.00 C ATOM 378 O ALA A 28 -4.741 -0.534 3.075 1.00 0.00 O ATOM 379 CB ALA A 28 -7.408 0.415 1.835 1.00 0.00 C ATOM 0 H ALA A 28 -6.136 -1.737 0.956 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.869 1.183 0.562 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.505 1.335 2.412 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -8.149 0.408 1.036 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.571 -0.442 2.489 1.00 0.00 H new ATOM 385 N ILE A 29 -4.301 1.575 2.427 1.00 0.00 N ATOM 386 CA ILE A 29 -3.268 1.785 3.433 1.00 0.00 C ATOM 387 C ILE A 29 -3.770 2.687 4.556 1.00 0.00 C ATOM 388 O ILE A 29 -4.282 3.778 4.306 1.00 0.00 O ATOM 389 CB ILE A 29 -2.001 2.409 2.817 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.575 1.629 1.572 1.00 0.00 C ATOM 391 CG2 ILE A 29 -0.875 2.441 3.839 1.00 0.00 C ATOM 392 CD1 ILE A 29 -0.658 2.409 0.655 1.00 0.00 C ATOM 0 H ILE A 29 -4.467 2.377 1.820 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.020 0.805 3.840 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.226 3.434 2.521 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.072 0.713 1.881 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.465 1.333 1.017 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.013 2.885 3.388 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.181 3.036 4.699 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.649 1.425 4.163 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.396 1.795 -0.207 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -1.165 3.312 0.316 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.249 2.683 1.194 1.00 0.00 H new ATOM 404 N GLU A 30 -3.621 2.223 5.792 1.00 0.00 N ATOM 405 CA GLU A 30 -4.060 2.988 6.953 1.00 0.00 C ATOM 406 C GLU A 30 -2.866 3.522 7.736 1.00 0.00 C ATOM 407 O GLU A 30 -1.988 2.762 8.143 1.00 0.00 O ATOM 408 CB GLU A 30 -4.933 2.119 7.862 1.00 0.00 C ATOM 409 CG GLU A 30 -5.822 2.921 8.799 1.00 0.00 C ATOM 410 CD GLU A 30 -6.426 2.070 9.898 1.00 0.00 C ATOM 411 OE1 GLU A 30 -5.672 1.633 10.793 1.00 0.00 O ATOM 412 OE2 GLU A 30 -7.653 1.841 9.867 1.00 0.00 O ATOM 0 H GLU A 30 -3.200 1.321 6.015 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.647 3.835 6.598 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.558 1.475 7.244 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.291 1.467 8.454 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.239 3.726 9.246 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.622 3.388 8.224 1.00 0.00 H new ATOM 419 N MET A 31 -2.841 4.835 7.943 1.00 0.00 N ATOM 420 CA MET A 31 -1.754 5.472 8.678 1.00 0.00 C ATOM 421 C MET A 31 -2.160 5.747 10.122 1.00 0.00 C ATOM 422 O MET A 31 -1.429 5.421 11.056 1.00 0.00 O ATOM 423 CB MET A 31 -1.345 6.777 7.994 1.00 0.00 C ATOM 424 CG MET A 31 -0.713 6.575 6.626 1.00 0.00 C ATOM 425 SD MET A 31 -0.122 8.117 5.901 1.00 0.00 S ATOM 426 CE MET A 31 1.630 7.771 5.755 1.00 0.00 C ATOM 0 H MET A 31 -3.560 5.478 7.612 1.00 0.00 H new ATOM 0 HA MET A 31 -0.904 4.790 8.683 1.00 0.00 H new ATOM 0 HB2 MET A 31 -2.224 7.413 7.889 1.00 0.00 H new ATOM 0 HB3 MET A 31 -0.642 7.309 8.635 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.119 5.877 6.714 1.00 0.00 H new ATOM 0 HG3 MET A 31 -1.442 6.119 5.957 1.00 0.00 H new ATOM 0 HE1 MET A 31 2.184 8.709 5.721 1.00 0.00 H new ATOM 0 HE2 MET A 31 1.958 7.187 6.615 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.815 7.207 4.841 1.00 0.00 H new ATOM 436 N ASP A 32 -3.332 6.349 10.296 1.00 0.00 N ATOM 437 CA ASP A 32 -3.837 6.669 11.627 1.00 0.00 C ATOM 438 C ASP A 32 -4.861 5.633 12.082 1.00 0.00 C ATOM 439 O ASP A 32 -5.162 4.684 11.360 1.00 0.00 O ATOM 440 CB ASP A 32 -4.463 8.066 11.635 1.00 0.00 C ATOM 441 CG ASP A 32 -3.761 9.010 12.591 1.00 0.00 C ATOM 442 OD1 ASP A 32 -2.517 9.102 12.528 1.00 0.00 O ATOM 443 OD2 ASP A 32 -4.455 9.656 13.405 1.00 0.00 O ATOM 0 H ASP A 32 -3.950 6.625 9.533 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.998 6.653 12.323 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -4.429 8.482 10.628 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -5.514 7.988 11.912 1.00 0.00 H new ATOM 448 N LYS A 33 -5.391 5.823 13.286 1.00 0.00 N ATOM 449 CA LYS A 33 -6.381 4.906 13.839 1.00 0.00 C ATOM 450 C LYS A 33 -7.758 5.169 13.238 1.00 0.00 C ATOM 451 O LYS A 33 -8.566 5.903 13.808 1.00 0.00 O ATOM 452 CB LYS A 33 -6.436 5.039 15.363 1.00 0.00 C ATOM 453 CG LYS A 33 -6.406 3.706 16.091 1.00 0.00 C ATOM 454 CD LYS A 33 -5.022 3.080 16.049 1.00 0.00 C ATOM 455 CE LYS A 33 -5.096 1.576 15.827 1.00 0.00 C ATOM 456 NZ LYS A 33 -4.023 1.093 14.914 1.00 0.00 N ATOM 0 H LYS A 33 -5.151 6.604 13.897 1.00 0.00 H new ATOM 0 HA LYS A 33 -6.083 3.889 13.584 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.594 5.645 15.697 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -7.344 5.575 15.640 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -6.710 3.849 17.128 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -7.128 3.026 15.638 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.438 3.538 15.251 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.500 3.286 16.984 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -5.014 1.064 16.786 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -6.070 1.319 15.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -4.110 0.064 14.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.116 1.562 13.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -3.093 1.315 15.323 1.00 0.00 H new ATOM 470 N GLY A 34 -8.019 4.565 12.083 1.00 0.00 N ATOM 471 CA GLY A 34 -9.299 4.746 11.424 1.00 0.00 C ATOM 472 C GLY A 34 -9.196 5.623 10.191 1.00 0.00 C ATOM 473 O GLY A 34 -9.966 5.466 9.244 1.00 0.00 O ATOM 0 H GLY A 34 -7.367 3.954 11.592 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.700 3.773 11.142 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -10.006 5.191 12.125 1.00 0.00 H new ATOM 477 N ALA A 35 -8.243 6.549 10.204 1.00 0.00 N ATOM 478 CA ALA A 35 -8.043 7.455 9.080 1.00 0.00 C ATOM 479 C ALA A 35 -7.307 6.757 7.939 1.00 0.00 C ATOM 480 O ALA A 35 -6.665 5.727 8.140 1.00 0.00 O ATOM 481 CB ALA A 35 -7.277 8.691 9.529 1.00 0.00 C ATOM 0 H ALA A 35 -7.597 6.691 10.981 1.00 0.00 H new ATOM 0 HA ALA A 35 -9.022 7.763 8.712 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -7.135 9.359 8.680 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.842 9.207 10.306 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.305 8.394 9.924 1.00 0.00 H new ATOM 487 N TYR A 36 -7.405 7.327 6.743 1.00 0.00 N ATOM 488 CA TYR A 36 -6.750 6.760 5.570 1.00 0.00 C ATOM 489 C TYR A 36 -6.163 7.859 4.690 1.00 0.00 C ATOM 490 O TYR A 36 -6.626 9.000 4.713 1.00 0.00 O ATOM 491 CB TYR A 36 -7.740 5.920 4.763 1.00 0.00 C ATOM 492 CG TYR A 36 -8.193 4.666 5.474 1.00 0.00 C ATOM 493 CD1 TYR A 36 -7.410 3.518 5.467 1.00 0.00 C ATOM 494 CD2 TYR A 36 -9.405 4.629 6.152 1.00 0.00 C ATOM 495 CE1 TYR A 36 -7.821 2.369 6.116 1.00 0.00 C ATOM 496 CE2 TYR A 36 -9.822 3.484 6.804 1.00 0.00 C ATOM 497 CZ TYR A 36 -9.028 2.357 6.783 1.00 0.00 C ATOM 498 OH TYR A 36 -9.441 1.216 7.430 1.00 0.00 O ATOM 0 H TYR A 36 -7.932 8.181 6.560 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.937 6.121 5.913 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.613 6.529 4.528 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.280 5.643 3.815 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -6.464 3.524 4.946 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -10.031 5.509 6.170 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -7.200 1.485 6.101 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -10.766 3.472 7.328 1.00 0.00 H new ATOM 0 HH TYR A 36 -9.007 1.162 8.307 1.00 0.00 H new ATOM 508 N ILE A 37 -5.141 7.508 3.917 1.00 0.00 N ATOM 509 CA ILE A 37 -4.491 8.465 3.029 1.00 0.00 C ATOM 510 C ILE A 37 -5.467 8.985 1.978 1.00 0.00 C ATOM 511 O ILE A 37 -5.805 8.281 1.027 1.00 0.00 O ATOM 512 CB ILE A 37 -3.274 7.839 2.320 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.344 7.178 3.339 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.525 8.894 1.519 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.769 5.860 2.868 1.00 0.00 C ATOM 0 H ILE A 37 -4.745 6.568 3.887 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.151 9.294 3.650 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.631 7.073 1.631 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.526 7.861 3.568 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.892 7.015 4.267 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.669 8.435 1.025 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.190 9.322 0.769 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.179 9.681 2.189 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.120 5.449 3.641 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -2.580 5.160 2.666 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -1.192 6.019 1.957 1.00 0.00 H new ATOM 527 N HIS A 38 -5.915 10.223 2.157 1.00 0.00 N ATOM 528 CA HIS A 38 -6.852 10.839 1.223 1.00 0.00 C ATOM 529 C HIS A 38 -6.109 11.547 0.094 1.00 0.00 C ATOM 530 O HIS A 38 -4.979 11.999 0.270 1.00 0.00 O ATOM 531 CB HIS A 38 -7.756 11.831 1.955 1.00 0.00 C ATOM 532 CG HIS A 38 -9.042 12.107 1.241 1.00 0.00 C ATOM 533 ND1 HIS A 38 -10.085 11.211 1.164 1.00 0.00 N ATOM 534 CD2 HIS A 38 -9.446 13.211 0.563 1.00 0.00 C ATOM 535 CE1 HIS A 38 -11.069 11.784 0.455 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.730 12.999 0.067 1.00 0.00 N ATOM 0 H HIS A 38 -5.645 10.819 2.939 1.00 0.00 H new ATOM 0 HA HIS A 38 -7.466 10.050 0.790 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -7.978 11.443 2.949 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -7.217 12.769 2.092 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -10.106 10.277 1.574 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.864 14.111 0.429 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -12.015 11.313 0.231 1.00 0.00 H new ATOM 544 N ALA A 39 -6.754 11.639 -1.065 1.00 0.00 N ATOM 545 CA ALA A 39 -6.154 12.292 -2.222 1.00 0.00 C ATOM 546 C ALA A 39 -6.896 13.577 -2.573 1.00 0.00 C ATOM 547 O ALA A 39 -8.113 13.572 -2.762 1.00 0.00 O ATOM 548 CB ALA A 39 -6.142 11.347 -3.413 1.00 0.00 C ATOM 0 H ALA A 39 -7.691 11.270 -1.227 1.00 0.00 H new ATOM 0 HA ALA A 39 -5.127 12.554 -1.968 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.691 11.847 -4.270 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.562 10.458 -3.166 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.164 11.057 -3.658 1.00 0.00 H new ATOM 554 N LEU A 40 -6.155 14.678 -2.659 1.00 0.00 N ATOM 555 CA LEU A 40 -6.743 15.971 -2.988 1.00 0.00 C ATOM 556 C LEU A 40 -6.832 16.159 -4.499 1.00 0.00 C ATOM 557 O LEU A 40 -6.351 15.326 -5.267 1.00 0.00 O ATOM 558 CB LEU A 40 -5.919 17.101 -2.369 1.00 0.00 C ATOM 559 CG LEU A 40 -6.156 17.334 -0.876 1.00 0.00 C ATOM 560 CD1 LEU A 40 -5.327 18.508 -0.379 1.00 0.00 C ATOM 561 CD2 LEU A 40 -7.634 17.570 -0.603 1.00 0.00 C ATOM 0 H LEU A 40 -5.147 14.700 -2.505 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.752 15.999 -2.577 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.862 16.886 -2.524 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.138 18.025 -2.904 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.843 16.441 -0.335 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.510 18.658 0.685 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.269 18.300 -0.540 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.607 19.409 -0.925 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.785 17.734 0.464 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.971 18.447 -1.156 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.206 16.699 -0.921 1.00 0.00 H new ATOM 573 N ASP A 41 -7.450 17.258 -4.918 1.00 0.00 N ATOM 574 CA ASP A 41 -7.602 17.554 -6.338 1.00 0.00 C ATOM 575 C ASP A 41 -6.483 18.468 -6.827 1.00 0.00 C ATOM 576 O ASP A 41 -6.024 18.351 -7.963 1.00 0.00 O ATOM 577 CB ASP A 41 -8.960 18.206 -6.602 1.00 0.00 C ATOM 578 CG ASP A 41 -9.454 17.963 -8.015 1.00 0.00 C ATOM 579 OD1 ASP A 41 -9.909 16.835 -8.299 1.00 0.00 O ATOM 580 OD2 ASP A 41 -9.386 18.900 -8.837 1.00 0.00 O ATOM 0 H ASP A 41 -7.853 17.958 -4.295 1.00 0.00 H new ATOM 0 HA ASP A 41 -7.545 16.614 -6.887 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -9.691 17.817 -5.893 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -8.885 19.279 -6.426 1.00 0.00 H new ATOM 585 N ASN A 42 -6.048 19.377 -5.961 1.00 0.00 N ATOM 586 CA ASN A 42 -4.982 20.312 -6.305 1.00 0.00 C ATOM 587 C ASN A 42 -3.699 19.567 -6.657 1.00 0.00 C ATOM 588 O ASN A 42 -2.907 20.027 -7.480 1.00 0.00 O ATOM 589 CB ASN A 42 -4.725 21.273 -5.144 1.00 0.00 C ATOM 590 CG ASN A 42 -3.749 22.375 -5.511 1.00 0.00 C ATOM 591 OD1 ASN A 42 -3.982 23.139 -6.448 1.00 0.00 O ATOM 592 ND2 ASN A 42 -2.649 22.461 -4.773 1.00 0.00 N ATOM 0 H ASN A 42 -6.417 19.486 -5.016 1.00 0.00 H new ATOM 0 HA ASN A 42 -5.300 20.883 -7.177 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -5.669 21.718 -4.828 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -4.335 20.714 -4.293 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -1.956 23.182 -4.973 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -2.497 21.806 -4.006 1.00 0.00 H new ATOM 599 N GLY A 43 -3.500 18.413 -6.028 1.00 0.00 N ATOM 600 CA GLY A 43 -2.310 17.621 -6.287 1.00 0.00 C ATOM 601 C GLY A 43 -1.535 17.307 -5.023 1.00 0.00 C ATOM 602 O GLY A 43 -0.305 17.345 -5.015 1.00 0.00 O ATOM 0 H GLY A 43 -4.141 18.012 -5.344 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.597 16.689 -6.774 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.664 18.158 -6.981 1.00 0.00 H new ATOM 606 N LEU A 44 -2.256 16.998 -3.950 1.00 0.00 N ATOM 607 CA LEU A 44 -1.629 16.677 -2.674 1.00 0.00 C ATOM 608 C LEU A 44 -2.365 15.538 -1.977 1.00 0.00 C ATOM 609 O LEU A 44 -3.352 15.015 -2.495 1.00 0.00 O ATOM 610 CB LEU A 44 -1.603 17.911 -1.769 1.00 0.00 C ATOM 611 CG LEU A 44 -0.836 19.109 -2.331 1.00 0.00 C ATOM 612 CD1 LEU A 44 -1.410 20.411 -1.792 1.00 0.00 C ATOM 613 CD2 LEU A 44 0.644 18.999 -1.996 1.00 0.00 C ATOM 0 H LEU A 44 -3.275 16.963 -3.939 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.606 16.358 -2.872 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.630 18.218 -1.569 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -1.161 17.632 -0.812 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.944 19.109 -3.416 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.852 21.252 -2.203 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.457 20.494 -2.082 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.333 20.420 -0.705 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.174 19.860 -2.404 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.771 18.974 -0.914 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.048 18.085 -2.430 1.00 0.00 H new ATOM 625 N PHE A 45 -1.879 15.158 -0.800 1.00 0.00 N ATOM 626 CA PHE A 45 -2.490 14.079 -0.033 1.00 0.00 C ATOM 627 C PHE A 45 -2.501 14.409 1.456 1.00 0.00 C ATOM 628 O PHE A 45 -1.451 14.601 2.068 1.00 0.00 O ATOM 629 CB PHE A 45 -1.742 12.767 -0.270 1.00 0.00 C ATOM 630 CG PHE A 45 -2.018 12.154 -1.613 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.506 12.722 -2.768 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.789 11.006 -1.719 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.758 12.159 -4.005 1.00 0.00 C ATOM 634 CE2 PHE A 45 -3.045 10.439 -2.954 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.529 11.016 -4.097 1.00 0.00 C ATOM 0 H PHE A 45 -1.064 15.581 -0.357 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.520 13.967 -0.371 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.671 12.946 -0.174 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -2.017 12.056 0.509 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.903 13.615 -2.701 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.194 10.550 -0.828 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.353 12.612 -4.898 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.648 9.546 -3.024 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.728 10.574 -5.062 1.00 0.00 H new ATOM 645 N THR A 46 -3.696 14.473 2.035 1.00 0.00 N ATOM 646 CA THR A 46 -3.843 14.780 3.453 1.00 0.00 C ATOM 647 C THR A 46 -4.487 13.614 4.197 1.00 0.00 C ATOM 648 O THR A 46 -5.109 12.743 3.588 1.00 0.00 O ATOM 649 CB THR A 46 -4.684 16.043 3.639 1.00 0.00 C ATOM 650 OG1 THR A 46 -5.024 16.226 5.002 1.00 0.00 O ATOM 651 CG2 THR A 46 -5.972 16.028 2.844 1.00 0.00 C ATOM 0 H THR A 46 -4.576 14.316 1.544 1.00 0.00 H new ATOM 0 HA THR A 46 -2.849 14.949 3.867 1.00 0.00 H new ATOM 0 HB THR A 46 -4.060 16.859 3.275 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.560 17.040 5.099 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.520 16.953 3.022 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.743 15.940 1.782 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.582 15.180 3.155 1.00 0.00 H new ATOM 659 N LEU A 47 -4.332 13.602 5.517 1.00 0.00 N ATOM 660 CA LEU A 47 -4.898 12.543 6.344 1.00 0.00 C ATOM 661 C LEU A 47 -6.415 12.493 6.203 1.00 0.00 C ATOM 662 O LEU A 47 -7.119 13.406 6.637 1.00 0.00 O ATOM 663 CB LEU A 47 -4.516 12.751 7.810 1.00 0.00 C ATOM 664 CG LEU A 47 -4.625 11.505 8.691 1.00 0.00 C ATOM 665 CD1 LEU A 47 -3.737 10.393 8.155 1.00 0.00 C ATOM 666 CD2 LEU A 47 -4.257 11.837 10.129 1.00 0.00 C ATOM 0 H LEU A 47 -3.819 14.314 6.037 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.489 11.593 6.001 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.491 13.120 7.854 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -5.153 13.530 8.229 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.658 11.158 8.671 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.828 9.515 8.794 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.046 10.137 7.141 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.700 10.729 8.144 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.340 10.940 10.742 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.233 12.209 10.166 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.934 12.601 10.511 1.00 0.00 H new ATOM 678 N GLY A 48 -6.915 11.422 5.594 1.00 0.00 N ATOM 679 CA GLY A 48 -8.346 11.274 5.408 1.00 0.00 C ATOM 680 C GLY A 48 -9.105 11.285 6.720 1.00 0.00 C ATOM 681 O GLY A 48 -8.612 10.792 7.735 1.00 0.00 O ATOM 0 H GLY A 48 -6.354 10.654 5.226 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.712 12.081 4.773 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.546 10.340 4.884 1.00 0.00 H new ATOM 685 N ALA A 49 -10.308 11.850 6.703 1.00 0.00 N ATOM 686 CA ALA A 49 -11.136 11.924 7.900 1.00 0.00 C ATOM 687 C ALA A 49 -11.504 10.528 8.400 1.00 0.00 C ATOM 688 O ALA A 49 -11.895 9.664 7.614 1.00 0.00 O ATOM 689 CB ALA A 49 -12.391 12.736 7.623 1.00 0.00 C ATOM 0 H ALA A 49 -10.731 12.264 5.872 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.561 12.421 8.681 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -13.000 12.783 8.526 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -12.112 13.745 7.320 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.962 12.262 6.824 1.00 0.00 H new ATOM 695 N PRO A 50 -11.386 10.285 9.719 1.00 0.00 N ATOM 696 CA PRO A 50 -11.711 8.983 10.312 1.00 0.00 C ATOM 697 C PRO A 50 -13.202 8.674 10.246 1.00 0.00 C ATOM 698 O PRO A 50 -14.036 9.580 10.263 1.00 0.00 O ATOM 699 CB PRO A 50 -11.259 9.129 11.767 1.00 0.00 C ATOM 700 CG PRO A 50 -11.293 10.594 12.031 1.00 0.00 C ATOM 701 CD PRO A 50 -10.929 11.255 10.732 1.00 0.00 C ATOM 0 HA PRO A 50 -11.226 8.163 9.783 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.922 8.590 12.443 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -10.258 8.724 11.913 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -12.282 10.908 12.365 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -10.589 10.866 12.818 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -11.425 12.219 10.618 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.857 11.437 10.660 1.00 0.00 H new ATOM 709 N HIS A 51 -13.531 7.389 10.170 1.00 0.00 N ATOM 710 CA HIS A 51 -14.923 6.959 10.102 1.00 0.00 C ATOM 711 C HIS A 51 -15.448 6.592 11.486 1.00 0.00 C ATOM 712 O HIS A 51 -14.798 5.861 12.233 1.00 0.00 O ATOM 713 CB HIS A 51 -15.064 5.766 9.156 1.00 0.00 C ATOM 714 CG HIS A 51 -14.384 5.965 7.836 1.00 0.00 C ATOM 715 ND1 HIS A 51 -15.085 5.928 6.656 1.00 0.00 N ATOM 716 CD2 HIS A 51 -13.076 6.199 7.568 1.00 0.00 C ATOM 717 CE1 HIS A 51 -14.196 6.138 5.700 1.00 0.00 C ATOM 718 NE2 HIS A 51 -12.965 6.308 6.205 1.00 0.00 N ATOM 0 H HIS A 51 -12.853 6.627 10.154 1.00 0.00 H new ATOM 0 HA HIS A 51 -15.515 7.790 9.718 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -14.651 4.880 9.638 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -16.123 5.572 8.984 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -12.276 6.283 8.288 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -14.431 6.169 4.646 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.110 6.484 5.677 1.00 0.00 H new ATOM 726 N ARG A 52 -16.627 7.105 11.821 1.00 0.00 N ATOM 727 CA ARG A 52 -17.241 6.831 13.116 1.00 0.00 C ATOM 728 C ARG A 52 -17.531 5.343 13.278 1.00 0.00 C ATOM 729 O ARG A 52 -17.156 4.732 14.279 1.00 0.00 O ATOM 730 CB ARG A 52 -18.532 7.635 13.272 1.00 0.00 C ATOM 731 CG ARG A 52 -18.875 7.961 14.717 1.00 0.00 C ATOM 732 CD ARG A 52 -20.378 8.046 14.928 1.00 0.00 C ATOM 733 NE ARG A 52 -20.782 7.497 16.219 1.00 0.00 N ATOM 734 CZ ARG A 52 -21.953 7.750 16.800 1.00 0.00 C ATOM 735 NH1 ARG A 52 -22.837 8.544 16.208 1.00 0.00 N ATOM 736 NH2 ARG A 52 -22.242 7.208 17.975 1.00 0.00 N ATOM 0 H ARG A 52 -17.177 7.713 11.214 1.00 0.00 H new ATOM 0 HA ARG A 52 -16.538 7.131 13.893 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -18.441 8.565 12.710 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -19.355 7.074 12.830 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -18.457 7.197 15.372 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.413 8.908 14.997 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -20.695 9.087 14.862 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -20.887 7.506 14.129 1.00 0.00 H new ATOM 0 HE ARG A 52 -20.128 6.883 16.705 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -22.621 8.963 15.304 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -23.733 8.735 16.657 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -21.567 6.597 18.435 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -23.139 7.402 18.419 1.00 0.00 H new ATOM 750 N GLU A 53 -18.203 4.765 12.287 1.00 0.00 N ATOM 751 CA GLU A 53 -18.545 3.347 12.320 1.00 0.00 C ATOM 752 C GLU A 53 -17.309 2.483 12.091 1.00 0.00 C ATOM 753 O GLU A 53 -16.361 2.902 11.427 1.00 0.00 O ATOM 754 CB GLU A 53 -19.605 3.033 11.264 1.00 0.00 C ATOM 755 CG GLU A 53 -21.012 3.433 11.676 1.00 0.00 C ATOM 756 CD GLU A 53 -21.347 4.862 11.295 1.00 0.00 C ATOM 757 OE1 GLU A 53 -21.811 5.078 10.155 1.00 0.00 O ATOM 758 OE2 GLU A 53 -21.147 5.764 12.135 1.00 0.00 O ATOM 0 H GLU A 53 -18.521 5.256 11.452 1.00 0.00 H new ATOM 0 HA GLU A 53 -18.947 3.118 13.307 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -19.347 3.547 10.338 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -19.588 1.964 11.051 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -21.729 2.759 11.208 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -21.119 3.314 12.754 1.00 0.00 H new ATOM 765 N VAL A 54 -17.328 1.275 12.645 1.00 0.00 N ATOM 766 CA VAL A 54 -16.209 0.350 12.500 1.00 0.00 C ATOM 767 C VAL A 54 -16.266 -0.374 11.159 1.00 0.00 C ATOM 768 O VAL A 54 -15.233 -0.737 10.595 1.00 0.00 O ATOM 769 CB VAL A 54 -16.190 -0.692 13.635 1.00 0.00 C ATOM 770 CG1 VAL A 54 -14.934 -1.546 13.557 1.00 0.00 C ATOM 771 CG2 VAL A 54 -16.296 -0.010 14.992 1.00 0.00 C ATOM 0 H VAL A 54 -18.105 0.914 13.198 1.00 0.00 H new ATOM 0 HA VAL A 54 -15.297 0.945 12.550 1.00 0.00 H new ATOM 0 HB VAL A 54 -17.054 -1.346 13.515 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -14.939 -2.276 14.367 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -14.907 -2.067 12.600 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -14.054 -0.909 13.648 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -16.281 -0.763 15.780 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -15.455 0.670 15.124 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -17.229 0.552 15.045 1.00 0.00 H new ATOM 781 N ASP A 55 -17.478 -0.581 10.656 1.00 0.00 N ATOM 782 CA ASP A 55 -17.669 -1.263 9.380 1.00 0.00 C ATOM 783 C ASP A 55 -17.798 -0.257 8.239 1.00 0.00 C ATOM 784 O ASP A 55 -18.665 -0.391 7.375 1.00 0.00 O ATOM 785 CB ASP A 55 -18.913 -2.153 9.437 1.00 0.00 C ATOM 786 CG ASP A 55 -20.163 -1.378 9.801 1.00 0.00 C ATOM 787 OD1 ASP A 55 -20.500 -0.419 9.074 1.00 0.00 O ATOM 788 OD2 ASP A 55 -20.805 -1.729 10.813 1.00 0.00 O ATOM 0 H ASP A 55 -18.342 -0.287 11.111 1.00 0.00 H new ATOM 0 HA ASP A 55 -16.794 -1.885 9.193 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -19.056 -2.634 8.470 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -18.755 -2.946 10.168 1.00 0.00 H new ATOM 793 N GLU A 56 -16.929 0.748 8.243 1.00 0.00 N ATOM 794 CA GLU A 56 -16.945 1.775 7.208 1.00 0.00 C ATOM 795 C GLU A 56 -15.754 1.618 6.268 1.00 0.00 C ATOM 796 O GLU A 56 -14.607 1.837 6.660 1.00 0.00 O ATOM 797 CB GLU A 56 -16.929 3.167 7.844 1.00 0.00 C ATOM 798 CG GLU A 56 -17.822 4.171 7.133 1.00 0.00 C ATOM 799 CD GLU A 56 -19.282 3.762 7.145 1.00 0.00 C ATOM 800 OE1 GLU A 56 -19.723 3.163 8.148 1.00 0.00 O ATOM 801 OE2 GLU A 56 -19.985 4.041 6.151 1.00 0.00 O ATOM 0 H GLU A 56 -16.205 0.873 8.951 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.860 1.658 6.627 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -17.244 3.086 8.884 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -15.906 3.543 7.849 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -17.717 5.146 7.609 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -17.488 4.283 6.101 1.00 0.00 H new ATOM 808 N GLY A 57 -16.034 1.239 5.026 1.00 0.00 N ATOM 809 CA GLY A 57 -14.976 1.059 4.048 1.00 0.00 C ATOM 810 C GLY A 57 -14.494 2.374 3.466 1.00 0.00 C ATOM 811 O GLY A 57 -15.192 3.385 3.548 1.00 0.00 O ATOM 0 H GLY A 57 -16.975 1.053 4.678 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -14.137 0.543 4.515 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -15.335 0.419 3.242 1.00 0.00 H new ATOM 815 N PRO A 58 -13.292 2.394 2.865 1.00 0.00 N ATOM 816 CA PRO A 58 -12.726 3.610 2.269 1.00 0.00 C ATOM 817 C PRO A 58 -13.467 4.035 1.006 1.00 0.00 C ATOM 818 O PRO A 58 -14.288 3.287 0.473 1.00 0.00 O ATOM 819 CB PRO A 58 -11.288 3.207 1.934 1.00 0.00 C ATOM 820 CG PRO A 58 -11.340 1.728 1.764 1.00 0.00 C ATOM 821 CD PRO A 58 -12.390 1.236 2.722 1.00 0.00 C ATOM 0 HA PRO A 58 -12.797 4.464 2.942 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.941 3.698 1.025 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.601 3.490 2.732 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -11.593 1.462 0.738 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -10.372 1.276 1.981 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.914 0.364 2.330 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.956 0.944 3.678 1.00 0.00 H new ATOM 829 N SER A 59 -13.170 5.240 0.532 1.00 0.00 N ATOM 830 CA SER A 59 -13.805 5.770 -0.670 1.00 0.00 C ATOM 831 C SER A 59 -12.886 5.611 -1.881 1.00 0.00 C ATOM 832 O SER A 59 -11.686 5.384 -1.730 1.00 0.00 O ATOM 833 CB SER A 59 -14.163 7.243 -0.468 1.00 0.00 C ATOM 834 OG SER A 59 -15.223 7.388 0.463 1.00 0.00 O ATOM 0 H SER A 59 -12.492 5.869 0.962 1.00 0.00 H new ATOM 0 HA SER A 59 -14.719 5.205 -0.856 1.00 0.00 H new ATOM 0 HB2 SER A 59 -13.288 7.788 -0.115 1.00 0.00 H new ATOM 0 HB3 SER A 59 -14.450 7.685 -1.422 1.00 0.00 H new ATOM 0 HG SER A 59 -15.432 8.339 0.576 1.00 0.00 H new ATOM 840 N PRO A 60 -13.439 5.724 -3.103 1.00 0.00 N ATOM 841 CA PRO A 60 -12.658 5.588 -4.335 1.00 0.00 C ATOM 842 C PRO A 60 -11.381 6.431 -4.325 1.00 0.00 C ATOM 843 O PRO A 60 -10.296 5.918 -4.597 1.00 0.00 O ATOM 844 CB PRO A 60 -13.620 6.068 -5.423 1.00 0.00 C ATOM 845 CG PRO A 60 -14.977 5.806 -4.867 1.00 0.00 C ATOM 846 CD PRO A 60 -14.864 5.992 -3.378 1.00 0.00 C ATOM 0 HA PRO A 60 -12.308 4.566 -4.480 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -13.478 7.127 -5.639 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -13.463 5.528 -6.357 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -15.710 6.492 -5.290 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -15.309 4.796 -5.109 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -15.148 7.000 -3.077 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.513 5.303 -2.837 1.00 0.00 H new ATOM 854 N PRO A 61 -11.483 7.738 -4.009 1.00 0.00 N ATOM 855 CA PRO A 61 -10.314 8.624 -3.969 1.00 0.00 C ATOM 856 C PRO A 61 -9.336 8.239 -2.864 1.00 0.00 C ATOM 857 O PRO A 61 -8.142 8.526 -2.951 1.00 0.00 O ATOM 858 CB PRO A 61 -10.914 10.006 -3.694 1.00 0.00 C ATOM 859 CG PRO A 61 -12.228 9.732 -3.053 1.00 0.00 C ATOM 860 CD PRO A 61 -12.726 8.453 -3.665 1.00 0.00 C ATOM 0 HA PRO A 61 -9.738 8.575 -4.893 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -10.270 10.593 -3.039 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -11.035 10.575 -4.616 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -12.122 9.633 -1.973 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.928 10.549 -3.231 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.338 7.883 -2.966 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -13.340 8.640 -4.546 1.00 0.00 H new ATOM 868 N GLU A 62 -9.849 7.588 -1.825 1.00 0.00 N ATOM 869 CA GLU A 62 -9.021 7.162 -0.703 1.00 0.00 C ATOM 870 C GLU A 62 -8.374 5.809 -0.987 1.00 0.00 C ATOM 871 O GLU A 62 -7.271 5.528 -0.520 1.00 0.00 O ATOM 872 CB GLU A 62 -9.860 7.083 0.574 1.00 0.00 C ATOM 873 CG GLU A 62 -9.165 7.661 1.796 1.00 0.00 C ATOM 874 CD GLU A 62 -10.142 8.100 2.869 1.00 0.00 C ATOM 875 OE1 GLU A 62 -10.554 7.247 3.683 1.00 0.00 O ATOM 876 OE2 GLU A 62 -10.497 9.298 2.894 1.00 0.00 O ATOM 0 H GLU A 62 -10.835 7.344 -1.737 1.00 0.00 H new ATOM 0 HA GLU A 62 -8.230 7.900 -0.565 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.799 7.614 0.415 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -10.112 6.041 0.769 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.487 6.915 2.210 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.556 8.513 1.494 1.00 0.00 H new ATOM 883 N GLN A 63 -9.069 4.978 -1.756 1.00 0.00 N ATOM 884 CA GLN A 63 -8.565 3.655 -2.103 1.00 0.00 C ATOM 885 C GLN A 63 -7.351 3.757 -3.022 1.00 0.00 C ATOM 886 O GLN A 63 -7.172 4.753 -3.722 1.00 0.00 O ATOM 887 CB GLN A 63 -9.662 2.831 -2.780 1.00 0.00 C ATOM 888 CG GLN A 63 -10.771 2.402 -1.834 1.00 0.00 C ATOM 889 CD GLN A 63 -12.023 1.960 -2.565 1.00 0.00 C ATOM 890 OE1 GLN A 63 -11.997 1.710 -3.770 1.00 0.00 O ATOM 891 NE2 GLN A 63 -13.130 1.863 -1.837 1.00 0.00 N ATOM 0 H GLN A 63 -9.983 5.198 -2.151 1.00 0.00 H new ATOM 0 HA GLN A 63 -8.260 3.158 -1.182 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -10.094 3.415 -3.593 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.214 1.944 -3.228 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.413 1.585 -1.208 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -11.016 3.230 -1.169 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.106 2.080 -0.841 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -14.004 1.571 -2.274 1.00 0.00 H new ATOM 900 N PHE A 64 -6.520 2.720 -3.014 1.00 0.00 N ATOM 901 CA PHE A 64 -5.323 2.692 -3.846 1.00 0.00 C ATOM 902 C PHE A 64 -5.180 1.345 -4.545 1.00 0.00 C ATOM 903 O PHE A 64 -5.808 0.360 -4.154 1.00 0.00 O ATOM 904 CB PHE A 64 -4.082 2.977 -3.000 1.00 0.00 C ATOM 905 CG PHE A 64 -4.091 4.334 -2.356 1.00 0.00 C ATOM 906 CD1 PHE A 64 -3.670 5.453 -3.058 1.00 0.00 C ATOM 907 CD2 PHE A 64 -4.522 4.491 -1.048 1.00 0.00 C ATOM 908 CE1 PHE A 64 -3.678 6.702 -2.467 1.00 0.00 C ATOM 909 CE2 PHE A 64 -4.533 5.739 -0.452 1.00 0.00 C ATOM 910 CZ PHE A 64 -4.110 6.845 -1.163 1.00 0.00 C ATOM 0 H PHE A 64 -6.654 1.887 -2.440 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.420 3.467 -4.606 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.999 2.216 -2.224 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.196 2.888 -3.629 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.332 5.347 -4.078 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.853 3.629 -0.488 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.347 7.566 -3.024 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.872 5.849 0.568 1.00 0.00 H new ATOM 0 HZ PHE A 64 -4.117 7.821 -0.700 1.00 0.00 H new ATOM 920 N THR A 65 -4.349 1.306 -5.581 1.00 0.00 N ATOM 921 CA THR A 65 -4.122 0.079 -6.336 1.00 0.00 C ATOM 922 C THR A 65 -2.633 -0.237 -6.428 1.00 0.00 C ATOM 923 O THR A 65 -1.819 0.640 -6.717 1.00 0.00 O ATOM 924 CB THR A 65 -4.716 0.202 -7.739 1.00 0.00 C ATOM 925 OG1 THR A 65 -6.028 0.734 -7.684 1.00 0.00 O ATOM 926 CG2 THR A 65 -4.786 -1.119 -8.477 1.00 0.00 C ATOM 0 H THR A 65 -3.821 2.111 -5.917 1.00 0.00 H new ATOM 0 HA THR A 65 -4.616 -0.738 -5.810 1.00 0.00 H new ATOM 0 HB THR A 65 -4.043 0.867 -8.280 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.390 0.806 -8.592 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.217 -0.961 -9.466 1.00 0.00 H new ATOM 0 HG22 THR A 65 -3.782 -1.532 -8.580 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.409 -1.816 -7.917 1.00 0.00 H new ATOM 934 N ALA A 66 -2.283 -1.496 -6.182 1.00 0.00 N ATOM 935 CA ALA A 66 -0.893 -1.928 -6.237 1.00 0.00 C ATOM 936 C ALA A 66 -0.552 -2.504 -7.608 1.00 0.00 C ATOM 937 O ALA A 66 -1.442 -2.814 -8.400 1.00 0.00 O ATOM 938 CB ALA A 66 -0.614 -2.953 -5.148 1.00 0.00 C ATOM 0 H ALA A 66 -2.945 -2.235 -5.943 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.261 -1.056 -6.069 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.429 -3.266 -5.202 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.810 -2.509 -4.172 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.261 -3.819 -5.289 1.00 0.00 H new ATOM 944 N VAL A 67 0.742 -2.647 -7.879 1.00 0.00 N ATOM 945 CA VAL A 67 1.198 -3.187 -9.154 1.00 0.00 C ATOM 946 C VAL A 67 2.548 -3.881 -9.005 1.00 0.00 C ATOM 947 O VAL A 67 3.590 -3.228 -8.942 1.00 0.00 O ATOM 948 CB VAL A 67 1.318 -2.084 -10.222 1.00 0.00 C ATOM 949 CG1 VAL A 67 1.600 -2.691 -11.587 1.00 0.00 C ATOM 950 CG2 VAL A 67 0.055 -1.237 -10.257 1.00 0.00 C ATOM 0 H VAL A 67 1.491 -2.397 -7.234 1.00 0.00 H new ATOM 0 HA VAL A 67 0.451 -3.913 -9.474 1.00 0.00 H new ATOM 0 HB VAL A 67 2.155 -1.437 -9.959 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.681 -1.896 -12.329 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.535 -3.250 -11.550 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.786 -3.362 -11.862 1.00 0.00 H new ATOM 0 HG21 VAL A 67 0.157 -0.463 -11.017 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -0.800 -1.869 -10.496 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.098 -0.772 -9.283 1.00 0.00 H new ATOM 960 N LYS A 68 2.523 -5.209 -8.951 1.00 0.00 N ATOM 961 CA LYS A 68 3.746 -5.991 -8.810 1.00 0.00 C ATOM 962 C LYS A 68 4.682 -5.750 -9.989 1.00 0.00 C ATOM 963 O LYS A 68 4.330 -6.013 -11.139 1.00 0.00 O ATOM 964 CB LYS A 68 3.414 -7.481 -8.701 1.00 0.00 C ATOM 965 CG LYS A 68 3.337 -7.984 -7.269 1.00 0.00 C ATOM 966 CD LYS A 68 3.694 -9.459 -7.178 1.00 0.00 C ATOM 967 CE LYS A 68 5.189 -9.660 -6.993 1.00 0.00 C ATOM 968 NZ LYS A 68 5.640 -10.982 -7.511 1.00 0.00 N ATOM 0 H LYS A 68 1.670 -5.766 -9.003 1.00 0.00 H new ATOM 0 HA LYS A 68 4.250 -5.672 -7.898 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.461 -7.669 -9.195 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.170 -8.053 -9.238 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.015 -7.405 -6.642 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.331 -7.827 -6.881 1.00 0.00 H new ATOM 0 HD2 LYS A 68 3.159 -9.913 -6.344 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.366 -9.970 -8.083 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.729 -8.865 -7.508 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.438 -9.581 -5.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 6.665 -11.080 -7.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 5.144 -11.742 -7.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 5.426 -11.048 -8.527 1.00 0.00 H new ATOM 982 N LEU A 69 5.878 -5.249 -9.697 1.00 0.00 N ATOM 983 CA LEU A 69 6.865 -4.972 -10.735 1.00 0.00 C ATOM 984 C LEU A 69 8.061 -5.912 -10.614 1.00 0.00 C ATOM 985 O LEU A 69 8.221 -6.832 -11.415 1.00 0.00 O ATOM 986 CB LEU A 69 7.331 -3.517 -10.650 1.00 0.00 C ATOM 987 CG LEU A 69 6.233 -2.473 -10.866 1.00 0.00 C ATOM 988 CD1 LEU A 69 6.768 -1.074 -10.603 1.00 0.00 C ATOM 989 CD2 LEU A 69 5.673 -2.575 -12.277 1.00 0.00 C ATOM 0 H LEU A 69 6.187 -5.027 -8.751 1.00 0.00 H new ATOM 0 HA LEU A 69 6.394 -5.138 -11.704 1.00 0.00 H new ATOM 0 HB2 LEU A 69 7.781 -3.352 -9.671 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.114 -3.358 -11.392 1.00 0.00 H new ATOM 0 HG LEU A 69 5.426 -2.670 -10.160 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.973 -0.345 -10.762 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.122 -1.007 -9.574 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.593 -0.866 -11.285 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.893 -1.826 -12.414 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.472 -2.404 -12.999 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.252 -3.569 -12.430 1.00 0.00 H new ATOM 1001 N SER A 70 8.898 -5.674 -9.609 1.00 0.00 N ATOM 1002 CA SER A 70 10.079 -6.501 -9.385 1.00 0.00 C ATOM 1003 C SER A 70 10.864 -6.013 -8.171 1.00 0.00 C ATOM 1004 O SER A 70 10.757 -4.851 -7.777 1.00 0.00 O ATOM 1005 CB SER A 70 10.978 -6.494 -10.625 1.00 0.00 C ATOM 1006 OG SER A 70 11.330 -7.813 -11.007 1.00 0.00 O ATOM 0 H SER A 70 8.781 -4.916 -8.937 1.00 0.00 H new ATOM 0 HA SER A 70 9.745 -7.521 -9.193 1.00 0.00 H new ATOM 0 HB2 SER A 70 10.463 -5.999 -11.448 1.00 0.00 H new ATOM 0 HB3 SER A 70 11.881 -5.918 -10.421 1.00 0.00 H new ATOM 0 HG SER A 70 11.903 -7.782 -11.802 1.00 0.00 H new ATOM 1012 N ASP A 71 11.653 -6.906 -7.584 1.00 0.00 N ATOM 1013 CA ASP A 71 12.458 -6.567 -6.417 1.00 0.00 C ATOM 1014 C ASP A 71 11.576 -6.094 -5.264 1.00 0.00 C ATOM 1015 O ASP A 71 11.974 -5.234 -4.478 1.00 0.00 O ATOM 1016 CB ASP A 71 13.480 -5.484 -6.774 1.00 0.00 C ATOM 1017 CG ASP A 71 14.896 -5.883 -6.410 1.00 0.00 C ATOM 1018 OD1 ASP A 71 15.088 -6.470 -5.324 1.00 0.00 O ATOM 1019 OD2 ASP A 71 15.815 -5.607 -7.211 1.00 0.00 O ATOM 0 H ASP A 71 11.752 -7.871 -7.898 1.00 0.00 H new ATOM 0 HA ASP A 71 12.987 -7.465 -6.098 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.427 -5.277 -7.843 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.222 -4.560 -6.257 1.00 0.00 H new ATOM 1024 N SER A 72 10.379 -6.663 -5.169 1.00 0.00 N ATOM 1025 CA SER A 72 9.442 -6.300 -4.113 1.00 0.00 C ATOM 1026 C SER A 72 9.077 -4.821 -4.193 1.00 0.00 C ATOM 1027 O SER A 72 8.945 -4.147 -3.172 1.00 0.00 O ATOM 1028 CB SER A 72 10.042 -6.616 -2.741 1.00 0.00 C ATOM 1029 OG SER A 72 10.527 -7.947 -2.690 1.00 0.00 O ATOM 0 H SER A 72 10.035 -7.377 -5.811 1.00 0.00 H new ATOM 0 HA SER A 72 8.534 -6.887 -4.250 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.854 -5.921 -2.527 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.287 -6.471 -1.968 1.00 0.00 H new ATOM 0 HG SER A 72 10.907 -8.123 -1.804 1.00 0.00 H new ATOM 1035 N ARG A 73 8.914 -4.322 -5.415 1.00 0.00 N ATOM 1036 CA ARG A 73 8.563 -2.923 -5.630 1.00 0.00 C ATOM 1037 C ARG A 73 7.234 -2.803 -6.369 1.00 0.00 C ATOM 1038 O ARG A 73 7.119 -3.205 -7.528 1.00 0.00 O ATOM 1039 CB ARG A 73 9.666 -2.215 -6.418 1.00 0.00 C ATOM 1040 CG ARG A 73 11.066 -2.502 -5.899 1.00 0.00 C ATOM 1041 CD ARG A 73 11.196 -2.165 -4.422 1.00 0.00 C ATOM 1042 NE ARG A 73 12.402 -1.389 -4.142 1.00 0.00 N ATOM 1043 CZ ARG A 73 12.533 -0.095 -4.424 1.00 0.00 C ATOM 1044 NH1 ARG A 73 11.536 0.572 -4.992 1.00 0.00 N ATOM 1045 NH2 ARG A 73 13.664 0.534 -4.137 1.00 0.00 N ATOM 0 H ARG A 73 9.020 -4.866 -6.271 1.00 0.00 H new ATOM 0 HA ARG A 73 8.459 -2.445 -4.656 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.606 -2.518 -7.463 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.490 -1.140 -6.387 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.304 -3.554 -6.055 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.792 -1.923 -6.470 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.320 -1.602 -4.100 1.00 0.00 H new ATOM 0 HD3 ARG A 73 11.214 -3.086 -3.840 1.00 0.00 H new ATOM 0 HE ARG A 73 13.190 -1.867 -3.705 1.00 0.00 H new ATOM 0 HH11 ARG A 73 10.663 0.093 -5.215 1.00 0.00 H new ATOM 0 HH12 ARG A 73 11.642 1.564 -5.206 1.00 0.00 H new ATOM 0 HH21 ARG A 73 14.433 0.026 -3.700 1.00 0.00 H new ATOM 0 HH22 ARG A 73 13.765 1.526 -4.353 1.00 0.00 H new ATOM 1059 N ILE A 74 6.233 -2.249 -5.693 1.00 0.00 N ATOM 1060 CA ILE A 74 4.914 -2.076 -6.288 1.00 0.00 C ATOM 1061 C ILE A 74 4.664 -0.618 -6.658 1.00 0.00 C ATOM 1062 O ILE A 74 5.183 0.294 -6.015 1.00 0.00 O ATOM 1063 CB ILE A 74 3.800 -2.549 -5.332 1.00 0.00 C ATOM 1064 CG1 ILE A 74 4.016 -1.966 -3.934 1.00 0.00 C ATOM 1065 CG2 ILE A 74 3.758 -4.068 -5.279 1.00 0.00 C ATOM 1066 CD1 ILE A 74 2.769 -1.975 -3.077 1.00 0.00 C ATOM 0 H ILE A 74 6.311 -1.912 -4.733 1.00 0.00 H new ATOM 0 HA ILE A 74 4.892 -2.686 -7.191 1.00 0.00 H new ATOM 0 HB ILE A 74 2.842 -2.192 -5.709 1.00 0.00 H new ATOM 0 HG12 ILE A 74 4.798 -2.533 -3.429 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.375 -0.941 -4.028 1.00 0.00 H new ATOM 0 HG21 ILE A 74 2.967 -4.387 -4.600 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.561 -4.462 -6.276 1.00 0.00 H new ATOM 0 HG23 ILE A 74 4.716 -4.446 -4.922 1.00 0.00 H new ATOM 0 HD11 ILE A 74 2.996 -1.548 -2.100 1.00 0.00 H new ATOM 0 HD12 ILE A 74 1.991 -1.384 -3.560 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.421 -3.000 -2.952 1.00 0.00 H new ATOM 1078 N ALA A 75 3.866 -0.406 -7.700 1.00 0.00 N ATOM 1079 CA ALA A 75 3.547 0.941 -8.155 1.00 0.00 C ATOM 1080 C ALA A 75 2.154 1.360 -7.697 1.00 0.00 C ATOM 1081 O ALA A 75 1.149 0.968 -8.291 1.00 0.00 O ATOM 1082 CB ALA A 75 3.652 1.023 -9.671 1.00 0.00 C ATOM 0 H ALA A 75 3.429 -1.150 -8.244 1.00 0.00 H new ATOM 0 HA ALA A 75 4.268 1.628 -7.713 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.411 2.034 -9.998 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.667 0.774 -9.979 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.953 0.319 -10.123 1.00 0.00 H new ATOM 1088 N LEU A 76 2.102 2.160 -6.637 1.00 0.00 N ATOM 1089 CA LEU A 76 0.832 2.634 -6.098 1.00 0.00 C ATOM 1090 C LEU A 76 0.073 3.456 -7.134 1.00 0.00 C ATOM 1091 O LEU A 76 0.658 3.952 -8.097 1.00 0.00 O ATOM 1092 CB LEU A 76 1.069 3.471 -4.839 1.00 0.00 C ATOM 1093 CG LEU A 76 1.309 2.665 -3.561 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.821 3.569 -2.451 1.00 0.00 C ATOM 1095 CD2 LEU A 76 0.032 1.959 -3.131 1.00 0.00 C ATOM 0 H LEU A 76 2.924 2.494 -6.134 1.00 0.00 H new ATOM 0 HA LEU A 76 0.229 1.764 -5.839 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.929 4.119 -5.009 1.00 0.00 H new ATOM 0 HB3 LEU A 76 0.207 4.120 -4.685 1.00 0.00 H new ATOM 0 HG LEU A 76 2.067 1.909 -3.765 1.00 0.00 H new ATOM 0 HD11 LEU A 76 1.986 2.980 -1.549 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.759 4.030 -2.761 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.085 4.347 -2.246 1.00 0.00 H new ATOM 0 HD21 LEU A 76 0.220 1.390 -2.220 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -0.747 2.698 -2.943 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -0.293 1.282 -3.921 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.232 3.597 -6.930 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.072 4.360 -7.847 1.00 0.00 C ATOM 1109 C LYS A 77 -3.333 4.854 -7.145 1.00 0.00 C ATOM 1110 O LYS A 77 -4.142 4.059 -6.669 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.450 3.505 -9.058 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.138 4.288 -10.164 1.00 0.00 C ATOM 1113 CD LYS A 77 -3.070 3.552 -11.492 1.00 0.00 C ATOM 1114 CE LYS A 77 -3.435 4.463 -12.654 1.00 0.00 C ATOM 1115 NZ LYS A 77 -2.513 4.287 -13.810 1.00 0.00 N ATOM 0 H LYS A 77 -1.732 3.193 -6.138 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.503 5.226 -8.186 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.550 3.040 -9.459 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.107 2.699 -8.732 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -4.180 4.460 -9.895 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.669 5.267 -10.265 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -2.065 3.158 -11.639 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -3.747 2.698 -11.471 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -4.457 4.256 -12.970 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -3.408 5.501 -12.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.721 5.006 -14.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.530 4.393 -13.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -2.644 3.339 -14.217 1.00 0.00 H new ATOM 1129 N SER A 78 -3.493 6.173 -7.087 1.00 0.00 N ATOM 1130 CA SER A 78 -4.655 6.774 -6.444 1.00 0.00 C ATOM 1131 C SER A 78 -5.926 6.482 -7.236 1.00 0.00 C ATOM 1132 O SER A 78 -5.876 6.242 -8.443 1.00 0.00 O ATOM 1133 CB SER A 78 -4.463 8.285 -6.306 1.00 0.00 C ATOM 1134 OG SER A 78 -4.222 8.886 -7.567 1.00 0.00 O ATOM 0 H SER A 78 -2.832 6.845 -7.478 1.00 0.00 H new ATOM 0 HA SER A 78 -4.757 6.335 -5.451 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.350 8.727 -5.852 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.627 8.489 -5.637 1.00 0.00 H new ATOM 0 HG SER A 78 -4.263 9.861 -7.478 1.00 0.00 H new ATOM 1140 N GLY A 79 -7.063 6.504 -6.549 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.330 6.239 -7.204 1.00 0.00 C ATOM 1142 C GLY A 79 -8.621 7.220 -8.322 1.00 0.00 C ATOM 1143 O GLY A 79 -9.277 6.875 -9.305 1.00 0.00 O ATOM 0 H GLY A 79 -7.130 6.701 -5.550 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.323 5.226 -7.606 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -9.132 6.284 -6.468 1.00 0.00 H new ATOM 1147 N TYR A 80 -8.131 8.447 -8.174 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.342 9.481 -9.180 1.00 0.00 C ATOM 1149 C TYR A 80 -7.757 9.060 -10.525 1.00 0.00 C ATOM 1150 O TYR A 80 -8.258 9.448 -11.580 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.713 10.799 -8.726 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.688 11.732 -8.042 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -9.605 12.471 -8.779 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -8.691 11.873 -6.660 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -10.498 13.324 -8.159 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -9.581 12.723 -6.032 1.00 0.00 C ATOM 1157 CZ TYR A 80 -10.482 13.446 -6.786 1.00 0.00 C ATOM 1158 OH TYR A 80 -11.369 14.294 -6.163 1.00 0.00 O ATOM 0 H TYR A 80 -7.585 8.749 -7.367 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.416 9.622 -9.301 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.890 10.583 -8.044 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.285 11.305 -9.592 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -9.620 12.377 -9.855 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -7.986 11.309 -6.067 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -11.204 13.892 -8.747 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -9.571 12.821 -4.956 1.00 0.00 H new ATOM 0 HH TYR A 80 -11.226 14.262 -5.194 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.692 8.265 -10.479 1.00 0.00 N ATOM 1169 CA GLY A 81 -6.057 7.805 -11.701 1.00 0.00 C ATOM 1170 C GLY A 81 -4.651 8.347 -11.862 1.00 0.00 C ATOM 1171 O GLY A 81 -4.232 8.684 -12.970 1.00 0.00 O ATOM 0 H GLY A 81 -6.258 7.932 -9.618 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.026 6.715 -11.703 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.660 8.108 -12.557 1.00 0.00 H new ATOM 1175 N LYS A 82 -3.920 8.433 -10.756 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.553 8.939 -10.779 1.00 0.00 C ATOM 1177 C LYS A 82 -1.610 7.994 -10.043 1.00 0.00 C ATOM 1178 O LYS A 82 -2.046 7.156 -9.253 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.491 10.332 -10.150 1.00 0.00 C ATOM 1180 CG LYS A 82 -2.936 11.443 -11.087 1.00 0.00 C ATOM 1181 CD LYS A 82 -2.950 12.791 -10.386 1.00 0.00 C ATOM 1182 CE LYS A 82 -3.108 13.933 -11.376 1.00 0.00 C ATOM 1183 NZ LYS A 82 -2.308 15.126 -10.982 1.00 0.00 N ATOM 0 H LYS A 82 -4.252 8.158 -9.831 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.234 9.003 -11.819 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.118 10.347 -9.258 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.470 10.530 -9.825 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.267 11.486 -11.946 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.932 11.220 -11.470 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.766 12.818 -9.664 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.024 12.920 -9.825 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -2.799 13.600 -12.367 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -4.160 14.209 -11.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -2.844 15.990 -11.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -2.108 15.089 -9.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -1.412 15.133 -11.510 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.315 8.134 -10.306 1.00 0.00 N ATOM 1198 CA TYR A 83 0.691 7.292 -9.667 1.00 0.00 C ATOM 1199 C TYR A 83 1.297 7.992 -8.456 1.00 0.00 C ATOM 1200 O TYR A 83 1.819 9.102 -8.566 1.00 0.00 O ATOM 1201 CB TYR A 83 1.791 6.929 -10.667 1.00 0.00 C ATOM 1202 CG TYR A 83 1.451 5.742 -11.539 1.00 0.00 C ATOM 1203 CD1 TYR A 83 1.503 4.449 -11.035 1.00 0.00 C ATOM 1204 CD2 TYR A 83 1.076 5.915 -12.865 1.00 0.00 C ATOM 1205 CE1 TYR A 83 1.193 3.361 -11.829 1.00 0.00 C ATOM 1206 CE2 TYR A 83 0.764 4.832 -13.665 1.00 0.00 C ATOM 1207 CZ TYR A 83 0.824 3.558 -13.143 1.00 0.00 C ATOM 1208 OH TYR A 83 0.515 2.477 -13.937 1.00 0.00 O ATOM 0 H TYR A 83 0.063 8.822 -10.957 1.00 0.00 H new ATOM 0 HA TYR A 83 0.203 6.378 -9.327 1.00 0.00 H new ATOM 0 HB2 TYR A 83 1.990 7.791 -11.304 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.710 6.716 -10.121 1.00 0.00 H new ATOM 0 HD1 TYR A 83 1.790 4.291 -10.006 1.00 0.00 H new ATOM 0 HD2 TYR A 83 1.027 6.912 -13.278 1.00 0.00 H new ATOM 0 HE1 TYR A 83 1.240 2.362 -11.422 1.00 0.00 H new ATOM 0 HE2 TYR A 83 0.475 4.983 -14.694 1.00 0.00 H new ATOM 0 HH TYR A 83 0.275 2.788 -14.835 1.00 0.00 H new ATOM 1218 N LEU A 84 1.228 7.337 -7.303 1.00 0.00 N ATOM 1219 CA LEU A 84 1.771 7.897 -6.071 1.00 0.00 C ATOM 1220 C LEU A 84 3.290 8.016 -6.152 1.00 0.00 C ATOM 1221 O LEU A 84 3.991 7.021 -6.328 1.00 0.00 O ATOM 1222 CB LEU A 84 1.378 7.028 -4.874 1.00 0.00 C ATOM 1223 CG LEU A 84 0.039 7.386 -4.227 1.00 0.00 C ATOM 1224 CD1 LEU A 84 -0.224 6.499 -3.019 1.00 0.00 C ATOM 1225 CD2 LEU A 84 0.017 8.854 -3.827 1.00 0.00 C ATOM 0 H LEU A 84 0.801 6.417 -7.195 1.00 0.00 H new ATOM 0 HA LEU A 84 1.353 8.895 -5.939 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.342 5.987 -5.196 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.160 7.101 -4.119 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.753 7.216 -4.956 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.181 6.768 -2.572 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.251 5.455 -3.333 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.571 6.637 -2.286 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.943 9.092 -3.368 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.818 9.049 -3.114 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.160 9.474 -4.712 1.00 0.00 H new ATOM 1237 N GLY A 85 3.790 9.241 -6.022 1.00 0.00 N ATOM 1238 CA GLY A 85 5.222 9.466 -6.084 1.00 0.00 C ATOM 1239 C GLY A 85 5.709 10.406 -4.999 1.00 0.00 C ATOM 1240 O GLY A 85 4.934 11.196 -4.459 1.00 0.00 O ATOM 0 H GLY A 85 3.230 10.081 -5.875 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.741 8.512 -5.993 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.480 9.878 -7.060 1.00 0.00 H new ATOM 1244 N ILE A 86 6.996 10.320 -4.678 1.00 0.00 N ATOM 1245 CA ILE A 86 7.587 11.169 -3.652 1.00 0.00 C ATOM 1246 C ILE A 86 8.560 12.173 -4.260 1.00 0.00 C ATOM 1247 O ILE A 86 9.296 11.852 -5.193 1.00 0.00 O ATOM 1248 CB ILE A 86 8.327 10.333 -2.590 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.397 9.459 -3.249 1.00 0.00 C ATOM 1250 CG2 ILE A 86 7.341 9.477 -1.808 1.00 0.00 C ATOM 1251 CD1 ILE A 86 10.740 9.521 -2.554 1.00 0.00 C ATOM 0 H ILE A 86 7.649 9.670 -5.115 1.00 0.00 H new ATOM 0 HA ILE A 86 6.767 11.706 -3.176 1.00 0.00 H new ATOM 0 HB ILE A 86 8.820 11.012 -1.894 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.052 8.425 -3.264 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.519 9.769 -4.287 1.00 0.00 H new ATOM 0 HG21 ILE A 86 7.879 8.892 -1.062 1.00 0.00 H new ATOM 0 HG22 ILE A 86 6.615 10.120 -1.311 1.00 0.00 H new ATOM 0 HG23 ILE A 86 6.822 8.804 -2.491 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.449 8.878 -3.075 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.107 10.547 -2.562 1.00 0.00 H new ATOM 0 HD13 ILE A 86 10.632 9.183 -1.523 1.00 0.00 H new ATOM 1263 N ASN A 87 8.558 13.390 -3.725 1.00 0.00 N ATOM 1264 CA ASN A 87 9.441 14.442 -4.217 1.00 0.00 C ATOM 1265 C ASN A 87 10.885 14.174 -3.805 1.00 0.00 C ATOM 1266 O ASN A 87 11.158 13.272 -3.012 1.00 0.00 O ATOM 1267 CB ASN A 87 8.989 15.804 -3.687 1.00 0.00 C ATOM 1268 CG ASN A 87 8.163 16.572 -4.699 1.00 0.00 C ATOM 1269 OD1 ASN A 87 8.295 16.372 -5.907 1.00 0.00 O ATOM 1270 ND2 ASN A 87 7.301 17.457 -4.210 1.00 0.00 N ATOM 0 H ASN A 87 7.956 13.672 -2.952 1.00 0.00 H new ATOM 0 HA ASN A 87 9.389 14.449 -5.306 1.00 0.00 H new ATOM 0 HB2 ASN A 87 8.405 15.661 -2.778 1.00 0.00 H new ATOM 0 HB3 ASN A 87 9.864 16.393 -3.414 1.00 0.00 H new ATOM 0 HD21 ASN A 87 6.716 18.003 -4.843 1.00 0.00 H new ATOM 0 HD22 ASN A 87 7.224 17.591 -3.202 1.00 0.00 H new ATOM 1277 N SER A 88 11.806 14.963 -4.349 1.00 0.00 N ATOM 1278 CA SER A 88 13.223 14.812 -4.038 1.00 0.00 C ATOM 1279 C SER A 88 13.515 15.245 -2.604 1.00 0.00 C ATOM 1280 O SER A 88 14.384 14.681 -1.940 1.00 0.00 O ATOM 1281 CB SER A 88 14.070 15.629 -5.013 1.00 0.00 C ATOM 1282 OG SER A 88 13.351 16.749 -5.501 1.00 0.00 O ATOM 0 H SER A 88 11.596 15.713 -5.007 1.00 0.00 H new ATOM 0 HA SER A 88 13.481 13.758 -4.139 1.00 0.00 H new ATOM 0 HB2 SER A 88 14.979 15.966 -4.515 1.00 0.00 H new ATOM 0 HB3 SER A 88 14.378 14.999 -5.848 1.00 0.00 H new ATOM 0 HG SER A 88 13.916 17.256 -6.121 1.00 0.00 H new ATOM 1288 N ASP A 89 12.784 16.250 -2.135 1.00 0.00 N ATOM 1289 CA ASP A 89 12.965 16.759 -0.781 1.00 0.00 C ATOM 1290 C ASP A 89 12.409 15.779 0.248 1.00 0.00 C ATOM 1291 O ASP A 89 12.936 15.660 1.354 1.00 0.00 O ATOM 1292 CB ASP A 89 12.280 18.120 -0.629 1.00 0.00 C ATOM 1293 CG ASP A 89 13.226 19.275 -0.891 1.00 0.00 C ATOM 1294 OD1 ASP A 89 14.433 19.134 -0.597 1.00 0.00 O ATOM 1295 OD2 ASP A 89 12.762 20.322 -1.391 1.00 0.00 O ATOM 0 H ASP A 89 12.061 16.728 -2.672 1.00 0.00 H new ATOM 0 HA ASP A 89 14.034 16.876 -0.604 1.00 0.00 H new ATOM 0 HB2 ASP A 89 11.438 18.179 -1.319 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.873 18.208 0.378 1.00 0.00 H new ATOM 1300 N GLY A 90 11.342 15.081 -0.124 1.00 0.00 N ATOM 1301 CA GLY A 90 10.731 14.120 0.778 1.00 0.00 C ATOM 1302 C GLY A 90 9.265 14.412 1.031 1.00 0.00 C ATOM 1303 O GLY A 90 8.807 14.378 2.173 1.00 0.00 O ATOM 0 H GLY A 90 10.888 15.163 -1.034 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.832 13.119 0.359 1.00 0.00 H new ATOM 0 HA3 GLY A 90 11.268 14.124 1.727 1.00 0.00 H new ATOM 1307 N LEU A 91 8.528 14.699 -0.037 1.00 0.00 N ATOM 1308 CA LEU A 91 7.105 14.997 0.074 1.00 0.00 C ATOM 1309 C LEU A 91 6.285 14.086 -0.834 1.00 0.00 C ATOM 1310 O LEU A 91 6.469 14.079 -2.051 1.00 0.00 O ATOM 1311 CB LEU A 91 6.840 16.462 -0.280 1.00 0.00 C ATOM 1312 CG LEU A 91 5.557 17.049 0.309 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.811 17.595 1.705 1.00 0.00 C ATOM 1314 CD2 LEU A 91 5.006 18.139 -0.599 1.00 0.00 C ATOM 0 H LEU A 91 8.893 14.731 -0.989 1.00 0.00 H new ATOM 0 HA LEU A 91 6.802 14.819 1.106 1.00 0.00 H new ATOM 0 HB2 LEU A 91 7.685 17.061 0.061 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.800 16.556 -1.365 1.00 0.00 H new ATOM 0 HG LEU A 91 4.816 16.253 0.382 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.886 18.009 2.108 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.161 16.791 2.352 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.568 18.378 1.657 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.093 18.547 -0.165 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.745 18.934 -0.703 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.786 17.718 -1.580 1.00 0.00 H new ATOM 1326 N VAL A 92 5.381 13.320 -0.234 1.00 0.00 N ATOM 1327 CA VAL A 92 4.532 12.405 -0.988 1.00 0.00 C ATOM 1328 C VAL A 92 3.465 13.163 -1.771 1.00 0.00 C ATOM 1329 O VAL A 92 2.529 13.711 -1.190 1.00 0.00 O ATOM 1330 CB VAL A 92 3.846 11.383 -0.063 1.00 0.00 C ATOM 1331 CG1 VAL A 92 3.145 10.308 -0.880 1.00 0.00 C ATOM 1332 CG2 VAL A 92 4.855 10.764 0.892 1.00 0.00 C ATOM 0 H VAL A 92 5.217 13.314 0.773 1.00 0.00 H new ATOM 0 HA VAL A 92 5.181 11.874 -1.685 1.00 0.00 H new ATOM 0 HB VAL A 92 3.094 11.905 0.529 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.666 9.595 -0.209 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.391 10.769 -1.517 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.875 9.788 -1.500 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.351 10.045 1.537 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.633 10.257 0.321 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.305 11.546 1.503 1.00 0.00 H new ATOM 1342 N VAL A 93 3.613 13.188 -3.091 1.00 0.00 N ATOM 1343 CA VAL A 93 2.661 13.880 -3.953 1.00 0.00 C ATOM 1344 C VAL A 93 2.286 13.021 -5.156 1.00 0.00 C ATOM 1345 O VAL A 93 3.134 12.348 -5.740 1.00 0.00 O ATOM 1346 CB VAL A 93 3.227 15.222 -4.452 1.00 0.00 C ATOM 1347 CG1 VAL A 93 3.388 16.198 -3.296 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.551 15.010 -5.168 1.00 0.00 C ATOM 0 H VAL A 93 4.382 12.738 -3.587 1.00 0.00 H new ATOM 0 HA VAL A 93 1.771 14.071 -3.353 1.00 0.00 H new ATOM 0 HB VAL A 93 2.520 15.651 -5.163 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.789 17.140 -3.669 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.418 16.375 -2.831 1.00 0.00 H new ATOM 0 HG13 VAL A 93 4.072 15.779 -2.558 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.936 15.970 -5.513 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.267 14.558 -4.482 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.401 14.350 -6.023 1.00 0.00 H new ATOM 1358 N GLY A 94 1.007 13.050 -5.521 1.00 0.00 N ATOM 1359 CA GLY A 94 0.542 12.271 -6.653 1.00 0.00 C ATOM 1360 C GLY A 94 0.148 13.139 -7.833 1.00 0.00 C ATOM 1361 O GLY A 94 -1.005 13.553 -7.948 1.00 0.00 O ATOM 0 H GLY A 94 0.286 13.599 -5.053 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.326 11.579 -6.961 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.313 11.668 -6.348 1.00 0.00 H new ATOM 1365 N ARG A 95 1.108 13.413 -8.709 1.00 0.00 N ATOM 1366 CA ARG A 95 0.857 14.237 -9.886 1.00 0.00 C ATOM 1367 C ARG A 95 1.903 13.975 -10.966 1.00 0.00 C ATOM 1368 O ARG A 95 2.436 14.908 -11.568 1.00 0.00 O ATOM 1369 CB ARG A 95 0.856 15.720 -9.505 1.00 0.00 C ATOM 1370 CG ARG A 95 2.162 16.188 -8.886 1.00 0.00 C ATOM 1371 CD ARG A 95 2.423 17.657 -9.177 1.00 0.00 C ATOM 1372 NE ARG A 95 3.828 17.912 -9.491 1.00 0.00 N ATOM 1373 CZ ARG A 95 4.786 18.008 -8.573 1.00 0.00 C ATOM 1374 NH1 ARG A 95 4.498 17.870 -7.284 1.00 0.00 N ATOM 1375 NH2 ARG A 95 6.038 18.241 -8.943 1.00 0.00 N ATOM 0 H ARG A 95 2.067 13.077 -8.627 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.122 13.972 -10.284 1.00 0.00 H new ATOM 0 HB2 ARG A 95 0.651 16.315 -10.395 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.043 15.906 -8.803 1.00 0.00 H new ATOM 0 HG2 ARG A 95 2.132 16.030 -7.808 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.985 15.588 -9.274 1.00 0.00 H new ATOM 0 HD2 ARG A 95 1.801 17.977 -10.013 1.00 0.00 H new ATOM 0 HD3 ARG A 95 2.130 18.255 -8.314 1.00 0.00 H new ATOM 0 HE ARG A 95 4.089 18.023 -10.471 1.00 0.00 H new ATOM 0 HH11 ARG A 95 3.537 17.689 -6.993 1.00 0.00 H new ATOM 0 HH12 ARG A 95 5.237 17.945 -6.585 1.00 0.00 H new ATOM 0 HH21 ARG A 95 6.266 18.347 -9.931 1.00 0.00 H new ATOM 0 HH22 ARG A 95 6.773 18.315 -8.239 1.00 0.00 H new ATOM 1389 N SER A 96 2.193 12.701 -11.204 1.00 0.00 N ATOM 1390 CA SER A 96 3.177 12.316 -12.210 1.00 0.00 C ATOM 1391 C SER A 96 2.508 11.607 -13.384 1.00 0.00 C ATOM 1392 O SER A 96 2.899 11.791 -14.537 1.00 0.00 O ATOM 1393 CB SER A 96 4.241 11.408 -11.592 1.00 0.00 C ATOM 1394 OG SER A 96 5.259 11.103 -12.530 1.00 0.00 O ATOM 0 H SER A 96 1.761 11.917 -10.715 1.00 0.00 H new ATOM 0 HA SER A 96 3.653 13.224 -12.580 1.00 0.00 H new ATOM 0 HB2 SER A 96 4.679 11.896 -10.721 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.777 10.486 -11.241 1.00 0.00 H new ATOM 0 HG SER A 96 5.928 10.523 -12.110 1.00 0.00 H new ATOM 1400 N ASP A 97 1.501 10.794 -13.083 1.00 0.00 N ATOM 1401 CA ASP A 97 0.781 10.056 -14.115 1.00 0.00 C ATOM 1402 C ASP A 97 1.718 9.116 -14.864 1.00 0.00 C ATOM 1403 O ASP A 97 1.557 8.887 -16.062 1.00 0.00 O ATOM 1404 CB ASP A 97 0.118 11.024 -15.096 1.00 0.00 C ATOM 1405 CG ASP A 97 -0.823 11.994 -14.408 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -0.346 12.791 -13.573 1.00 0.00 O ATOM 1407 OD2 ASP A 97 -2.036 11.956 -14.703 1.00 0.00 O ATOM 0 H ASP A 97 1.165 10.629 -12.134 1.00 0.00 H new ATOM 0 HA ASP A 97 0.009 9.459 -13.629 1.00 0.00 H new ATOM 0 HB2 ASP A 97 0.889 11.584 -15.626 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -0.434 10.456 -15.845 1.00 0.00 H new ATOM 1412 N ALA A 98 2.700 8.575 -14.148 1.00 0.00 N ATOM 1413 CA ALA A 98 3.665 7.661 -14.745 1.00 0.00 C ATOM 1414 C ALA A 98 4.363 6.825 -13.676 1.00 0.00 C ATOM 1415 O ALA A 98 4.296 7.139 -12.488 1.00 0.00 O ATOM 1416 CB ALA A 98 4.689 8.434 -15.562 1.00 0.00 C ATOM 0 H ALA A 98 2.847 8.754 -13.155 1.00 0.00 H new ATOM 0 HA ALA A 98 3.125 6.983 -15.406 1.00 0.00 H new ATOM 0 HB1 ALA A 98 5.404 7.738 -16.002 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.182 8.983 -16.355 1.00 0.00 H new ATOM 0 HB3 ALA A 98 5.216 9.135 -14.915 1.00 0.00 H new ATOM 1422 N ILE A 99 5.030 5.759 -14.107 1.00 0.00 N ATOM 1423 CA ILE A 99 5.740 4.878 -13.187 1.00 0.00 C ATOM 1424 C ILE A 99 7.216 5.254 -13.099 1.00 0.00 C ATOM 1425 O ILE A 99 8.055 4.676 -13.789 1.00 0.00 O ATOM 1426 CB ILE A 99 5.621 3.402 -13.615 1.00 0.00 C ATOM 1427 CG1 ILE A 99 4.157 3.034 -13.862 1.00 0.00 C ATOM 1428 CG2 ILE A 99 6.230 2.491 -12.559 1.00 0.00 C ATOM 1429 CD1 ILE A 99 3.973 1.947 -14.899 1.00 0.00 C ATOM 0 H ILE A 99 5.094 5.485 -15.087 1.00 0.00 H new ATOM 0 HA ILE A 99 5.276 5.001 -12.208 1.00 0.00 H new ATOM 0 HB ILE A 99 6.172 3.266 -14.546 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.709 2.708 -12.923 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.616 3.925 -14.181 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.137 1.453 -12.877 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.284 2.738 -12.429 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.706 2.629 -11.613 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.910 1.738 -15.022 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.391 2.277 -15.850 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.485 1.042 -14.572 1.00 0.00 H new ATOM 1441 N GLY A 100 7.524 6.226 -12.247 1.00 0.00 N ATOM 1442 CA GLY A 100 8.898 6.662 -12.087 1.00 0.00 C ATOM 1443 C GLY A 100 9.587 5.997 -10.908 1.00 0.00 C ATOM 1444 O GLY A 100 8.929 5.383 -10.069 1.00 0.00 O ATOM 0 H GLY A 100 6.847 6.719 -11.665 1.00 0.00 H new ATOM 0 HA2 GLY A 100 9.454 6.443 -12.999 1.00 0.00 H new ATOM 0 HA3 GLY A 100 8.919 7.744 -11.953 1.00 0.00 H new ATOM 1448 N PRO A 101 10.924 6.106 -10.818 1.00 0.00 N ATOM 1449 CA PRO A 101 11.693 5.504 -9.724 1.00 0.00 C ATOM 1450 C PRO A 101 11.154 5.896 -8.354 1.00 0.00 C ATOM 1451 O PRO A 101 11.152 5.091 -7.422 1.00 0.00 O ATOM 1452 CB PRO A 101 13.102 6.068 -9.925 1.00 0.00 C ATOM 1453 CG PRO A 101 13.175 6.398 -11.376 1.00 0.00 C ATOM 1454 CD PRO A 101 11.789 6.822 -11.775 1.00 0.00 C ATOM 0 HA PRO A 101 11.649 4.415 -9.747 1.00 0.00 H new ATOM 0 HB2 PRO A 101 13.266 6.952 -9.309 1.00 0.00 H new ATOM 0 HB3 PRO A 101 13.863 5.340 -9.646 1.00 0.00 H new ATOM 0 HG2 PRO A 101 13.895 7.196 -11.559 1.00 0.00 H new ATOM 0 HG3 PRO A 101 13.501 5.535 -11.956 1.00 0.00 H new ATOM 0 HD2 PRO A 101 11.662 7.902 -11.701 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.565 6.545 -12.805 1.00 0.00 H new ATOM 1462 N ARG A 102 10.696 7.139 -8.236 1.00 0.00 N ATOM 1463 CA ARG A 102 10.153 7.638 -6.978 1.00 0.00 C ATOM 1464 C ARG A 102 8.767 7.056 -6.716 1.00 0.00 C ATOM 1465 O ARG A 102 8.374 6.859 -5.565 1.00 0.00 O ATOM 1466 CB ARG A 102 10.082 9.165 -6.999 1.00 0.00 C ATOM 1467 CG ARG A 102 11.409 9.840 -6.695 1.00 0.00 C ATOM 1468 CD ARG A 102 11.625 11.068 -7.567 1.00 0.00 C ATOM 1469 NE ARG A 102 13.043 11.339 -7.789 1.00 0.00 N ATOM 1470 CZ ARG A 102 13.505 12.455 -8.349 1.00 0.00 C ATOM 1471 NH1 ARG A 102 12.666 13.405 -8.743 1.00 0.00 N ATOM 1472 NH2 ARG A 102 14.810 12.621 -8.515 1.00 0.00 N ATOM 0 H ARG A 102 10.690 7.819 -8.997 1.00 0.00 H new ATOM 0 HA ARG A 102 10.818 7.324 -6.173 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.734 9.491 -7.979 1.00 0.00 H new ATOM 0 HB3 ARG A 102 9.341 9.496 -6.272 1.00 0.00 H new ATOM 0 HG2 ARG A 102 11.439 10.129 -5.644 1.00 0.00 H new ATOM 0 HG3 ARG A 102 12.223 9.132 -6.854 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.129 10.923 -8.527 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.160 11.934 -7.096 1.00 0.00 H new ATOM 0 HE ARG A 102 13.718 10.632 -7.498 1.00 0.00 H new ATOM 0 HH11 ARG A 102 11.661 13.282 -8.617 1.00 0.00 H new ATOM 0 HH12 ARG A 102 13.026 14.258 -9.171 1.00 0.00 H new ATOM 0 HH21 ARG A 102 15.459 11.894 -8.214 1.00 0.00 H new ATOM 0 HH22 ARG A 102 15.165 13.476 -8.944 1.00 0.00 H new ATOM 1486 N GLU A 103 8.033 6.784 -7.789 1.00 0.00 N ATOM 1487 CA GLU A 103 6.691 6.226 -7.676 1.00 0.00 C ATOM 1488 C GLU A 103 6.731 4.823 -7.077 1.00 0.00 C ATOM 1489 O GLU A 103 5.791 4.398 -6.406 1.00 0.00 O ATOM 1490 CB GLU A 103 6.014 6.188 -9.048 1.00 0.00 C ATOM 1491 CG GLU A 103 5.210 7.438 -9.364 1.00 0.00 C ATOM 1492 CD GLU A 103 6.085 8.661 -9.557 1.00 0.00 C ATOM 1493 OE1 GLU A 103 7.279 8.492 -9.883 1.00 0.00 O ATOM 1494 OE2 GLU A 103 5.576 9.788 -9.383 1.00 0.00 O ATOM 0 H GLU A 103 8.345 6.941 -8.747 1.00 0.00 H new ATOM 0 HA GLU A 103 6.114 6.868 -7.011 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.775 6.052 -9.816 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.355 5.321 -9.095 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.623 7.269 -10.267 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.504 7.625 -8.555 1.00 0.00 H new ATOM 1501 N GLN A 104 7.825 4.110 -7.325 1.00 0.00 N ATOM 1502 CA GLN A 104 7.986 2.754 -6.810 1.00 0.00 C ATOM 1503 C GLN A 104 8.054 2.755 -5.286 1.00 0.00 C ATOM 1504 O GLN A 104 8.660 3.639 -4.682 1.00 0.00 O ATOM 1505 CB GLN A 104 9.249 2.114 -7.388 1.00 0.00 C ATOM 1506 CG GLN A 104 9.222 1.973 -8.901 1.00 0.00 C ATOM 1507 CD GLN A 104 10.334 1.085 -9.423 1.00 0.00 C ATOM 1508 OE1 GLN A 104 10.763 0.147 -8.750 1.00 0.00 O ATOM 1509 NE2 GLN A 104 10.807 1.376 -10.629 1.00 0.00 N ATOM 0 H GLN A 104 8.612 4.448 -7.879 1.00 0.00 H new ATOM 0 HA GLN A 104 7.118 2.170 -7.116 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.113 2.714 -7.103 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.384 1.129 -6.942 1.00 0.00 H new ATOM 0 HG2 GLN A 104 8.260 1.562 -9.207 1.00 0.00 H new ATOM 0 HG3 GLN A 104 9.306 2.960 -9.356 1.00 0.00 H new ATOM 0 HE21 GLN A 104 10.422 2.163 -11.152 1.00 0.00 H new ATOM 0 HE22 GLN A 104 11.555 0.813 -11.033 1.00 0.00 H new ATOM 1518 N TRP A 105 7.429 1.756 -4.671 1.00 0.00 N ATOM 1519 CA TRP A 105 7.419 1.638 -3.217 1.00 0.00 C ATOM 1520 C TRP A 105 7.949 0.277 -2.779 1.00 0.00 C ATOM 1521 O TRP A 105 7.710 -0.735 -3.437 1.00 0.00 O ATOM 1522 CB TRP A 105 6.003 1.845 -2.676 1.00 0.00 C ATOM 1523 CG TRP A 105 5.429 3.187 -3.010 1.00 0.00 C ATOM 1524 CD1 TRP A 105 4.650 3.501 -4.087 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.589 4.399 -2.265 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.316 4.833 -4.057 1.00 0.00 N ATOM 1527 CE2 TRP A 105 4.881 5.406 -2.947 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.263 4.731 -1.085 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 4.827 6.720 -2.488 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.209 6.035 -0.631 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.495 7.016 -1.332 1.00 0.00 C ATOM 0 H TRP A 105 6.923 1.016 -5.157 1.00 0.00 H new ATOM 0 HA TRP A 105 8.071 2.411 -2.810 1.00 0.00 H new ATOM 0 HB2 TRP A 105 5.351 1.069 -3.078 1.00 0.00 H new ATOM 0 HB3 TRP A 105 6.014 1.722 -1.593 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.341 2.803 -4.851 1.00 0.00 H new ATOM 0 HE1 TRP A 105 3.742 5.317 -4.747 1.00 0.00 H new ATOM 0 HE3 TRP A 105 6.816 3.981 -0.538 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.277 7.478 -3.026 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.726 6.302 0.279 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.472 8.027 -0.952 1.00 0.00 H new ATOM 1542 N GLU A 106 8.673 0.259 -1.663 1.00 0.00 N ATOM 1543 CA GLU A 106 9.238 -0.978 -1.138 1.00 0.00 C ATOM 1544 C GLU A 106 8.616 -1.335 0.211 1.00 0.00 C ATOM 1545 O GLU A 106 9.097 -0.901 1.258 1.00 0.00 O ATOM 1546 CB GLU A 106 10.755 -0.847 -0.992 1.00 0.00 C ATOM 1547 CG GLU A 106 11.485 -2.180 -1.011 1.00 0.00 C ATOM 1548 CD GLU A 106 12.592 -2.252 0.023 1.00 0.00 C ATOM 1549 OE1 GLU A 106 13.591 -1.517 -0.123 1.00 0.00 O ATOM 1550 OE2 GLU A 106 12.460 -3.044 0.980 1.00 0.00 O ATOM 0 H GLU A 106 8.881 1.088 -1.106 1.00 0.00 H new ATOM 0 HA GLU A 106 9.013 -1.778 -1.844 1.00 0.00 H new ATOM 0 HB2 GLU A 106 11.137 -0.222 -1.799 1.00 0.00 H new ATOM 0 HB3 GLU A 106 10.979 -0.333 -0.057 1.00 0.00 H new ATOM 0 HG2 GLU A 106 10.771 -2.984 -0.831 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.907 -2.345 -2.002 1.00 0.00 H new ATOM 1557 N PRO A 107 7.535 -2.135 0.205 1.00 0.00 N ATOM 1558 CA PRO A 107 6.854 -2.547 1.436 1.00 0.00 C ATOM 1559 C PRO A 107 7.706 -3.492 2.278 1.00 0.00 C ATOM 1560 O PRO A 107 8.165 -4.527 1.795 1.00 0.00 O ATOM 1561 CB PRO A 107 5.601 -3.266 0.930 1.00 0.00 C ATOM 1562 CG PRO A 107 5.957 -3.734 -0.437 1.00 0.00 C ATOM 1563 CD PRO A 107 6.896 -2.701 -0.998 1.00 0.00 C ATOM 0 HA PRO A 107 6.639 -1.698 2.086 1.00 0.00 H new ATOM 0 HB2 PRO A 107 5.336 -4.102 1.578 1.00 0.00 H new ATOM 0 HB3 PRO A 107 4.742 -2.595 0.907 1.00 0.00 H new ATOM 0 HG2 PRO A 107 6.432 -4.715 -0.402 1.00 0.00 H new ATOM 0 HG3 PRO A 107 5.068 -3.832 -1.060 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.629 -3.146 -1.671 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.363 -1.939 -1.567 1.00 0.00 H new ATOM 1571 N VAL A 108 7.915 -3.127 3.539 1.00 0.00 N ATOM 1572 CA VAL A 108 8.715 -3.940 4.447 1.00 0.00 C ATOM 1573 C VAL A 108 7.829 -4.830 5.314 1.00 0.00 C ATOM 1574 O VAL A 108 6.639 -4.564 5.480 1.00 0.00 O ATOM 1575 CB VAL A 108 9.592 -3.063 5.361 1.00 0.00 C ATOM 1576 CG1 VAL A 108 10.577 -3.919 6.140 1.00 0.00 C ATOM 1577 CG2 VAL A 108 10.320 -2.004 4.548 1.00 0.00 C ATOM 0 H VAL A 108 7.541 -2.274 3.955 1.00 0.00 H new ATOM 0 HA VAL A 108 9.359 -4.565 3.828 1.00 0.00 H new ATOM 0 HB VAL A 108 8.944 -2.556 6.076 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.187 -3.281 6.779 1.00 0.00 H new ATOM 0 HG12 VAL A 108 10.031 -4.634 6.756 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.221 -4.457 5.444 1.00 0.00 H new ATOM 0 HG21 VAL A 108 10.934 -1.395 5.211 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.956 -2.488 3.807 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.592 -1.369 4.042 1.00 0.00 H new ATOM 1587 N PHE A 109 8.419 -5.886 5.864 1.00 0.00 N ATOM 1588 CA PHE A 109 7.686 -6.815 6.716 1.00 0.00 C ATOM 1589 C PHE A 109 8.587 -7.372 7.813 1.00 0.00 C ATOM 1590 O PHE A 109 9.651 -7.926 7.534 1.00 0.00 O ATOM 1591 CB PHE A 109 7.114 -7.963 5.881 1.00 0.00 C ATOM 1592 CG PHE A 109 6.281 -7.503 4.719 1.00 0.00 C ATOM 1593 CD1 PHE A 109 5.011 -6.986 4.919 1.00 0.00 C ATOM 1594 CD2 PHE A 109 6.769 -7.589 3.424 1.00 0.00 C ATOM 1595 CE1 PHE A 109 4.243 -6.563 3.852 1.00 0.00 C ATOM 1596 CE2 PHE A 109 6.005 -7.167 2.352 1.00 0.00 C ATOM 1597 CZ PHE A 109 4.740 -6.654 2.567 1.00 0.00 C ATOM 0 H PHE A 109 9.403 -6.120 5.735 1.00 0.00 H new ATOM 0 HA PHE A 109 6.866 -6.270 7.184 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.936 -8.575 5.509 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.507 -8.601 6.523 1.00 0.00 H new ATOM 0 HD1 PHE A 109 4.617 -6.913 5.922 1.00 0.00 H new ATOM 0 HD2 PHE A 109 7.757 -7.990 3.251 1.00 0.00 H new ATOM 0 HE1 PHE A 109 3.255 -6.162 4.022 1.00 0.00 H new ATOM 0 HE2 PHE A 109 6.396 -7.238 1.348 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.141 -6.325 1.731 1.00 0.00 H new ATOM 1607 N GLN A 110 8.157 -7.220 9.061 1.00 0.00 N ATOM 1608 CA GLN A 110 8.930 -7.708 10.199 1.00 0.00 C ATOM 1609 C GLN A 110 8.013 -8.103 11.353 1.00 0.00 C ATOM 1610 O GLN A 110 7.300 -7.267 11.908 1.00 0.00 O ATOM 1611 CB GLN A 110 9.921 -6.638 10.663 1.00 0.00 C ATOM 1612 CG GLN A 110 11.271 -7.200 11.077 1.00 0.00 C ATOM 1613 CD GLN A 110 11.322 -7.571 12.546 1.00 0.00 C ATOM 1614 OE1 GLN A 110 11.276 -8.748 12.903 1.00 0.00 O ATOM 1615 NE2 GLN A 110 11.418 -6.565 13.409 1.00 0.00 N ATOM 0 H GLN A 110 7.279 -6.764 9.311 1.00 0.00 H new ATOM 0 HA GLN A 110 9.481 -8.592 9.880 1.00 0.00 H new ATOM 0 HB2 GLN A 110 10.068 -5.917 9.859 1.00 0.00 H new ATOM 0 HB3 GLN A 110 9.489 -6.095 11.504 1.00 0.00 H new ATOM 0 HG2 GLN A 110 11.493 -8.081 10.475 1.00 0.00 H new ATOM 0 HG3 GLN A 110 12.047 -6.465 10.865 1.00 0.00 H new ATOM 0 HE21 GLN A 110 11.453 -5.604 13.070 1.00 0.00 H new ATOM 0 HE22 GLN A 110 11.456 -6.754 14.411 1.00 0.00 H new ATOM 1624 N ASP A 111 8.040 -9.384 11.710 1.00 0.00 N ATOM 1625 CA ASP A 111 7.214 -9.892 12.800 1.00 0.00 C ATOM 1626 C ASP A 111 5.736 -9.621 12.539 1.00 0.00 C ATOM 1627 O ASP A 111 4.967 -9.367 13.467 1.00 0.00 O ATOM 1628 CB ASP A 111 7.634 -9.256 14.126 1.00 0.00 C ATOM 1629 CG ASP A 111 8.870 -9.907 14.714 1.00 0.00 C ATOM 1630 OD1 ASP A 111 9.146 -11.075 14.370 1.00 0.00 O ATOM 1631 OD2 ASP A 111 9.561 -9.249 15.520 1.00 0.00 O ATOM 0 H ASP A 111 8.625 -10.089 11.260 1.00 0.00 H new ATOM 0 HA ASP A 111 7.361 -10.970 12.859 1.00 0.00 H new ATOM 0 HB2 ASP A 111 7.825 -8.194 13.972 1.00 0.00 H new ATOM 0 HB3 ASP A 111 6.813 -9.332 14.839 1.00 0.00 H new ATOM 1636 N GLY A 112 5.343 -9.675 11.270 1.00 0.00 N ATOM 1637 CA GLY A 112 3.958 -9.432 10.911 1.00 0.00 C ATOM 1638 C GLY A 112 3.707 -7.993 10.505 1.00 0.00 C ATOM 1639 O GLY A 112 2.945 -7.728 9.576 1.00 0.00 O ATOM 0 H GLY A 112 5.959 -9.883 10.484 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.678 -10.092 10.090 1.00 0.00 H new ATOM 0 HA3 GLY A 112 3.317 -9.685 11.756 1.00 0.00 H new ATOM 1643 N LYS A 113 4.349 -7.063 11.204 1.00 0.00 N ATOM 1644 CA LYS A 113 4.192 -5.642 10.913 1.00 0.00 C ATOM 1645 C LYS A 113 4.589 -5.335 9.472 1.00 0.00 C ATOM 1646 O LYS A 113 5.040 -6.217 8.740 1.00 0.00 O ATOM 1647 CB LYS A 113 5.036 -4.806 11.876 1.00 0.00 C ATOM 1648 CG LYS A 113 4.479 -4.758 13.289 1.00 0.00 C ATOM 1649 CD LYS A 113 3.762 -3.446 13.563 1.00 0.00 C ATOM 1650 CE LYS A 113 2.629 -3.627 14.561 1.00 0.00 C ATOM 1651 NZ LYS A 113 2.527 -2.475 15.498 1.00 0.00 N ATOM 0 H LYS A 113 4.983 -7.267 11.976 1.00 0.00 H new ATOM 0 HA LYS A 113 3.141 -5.384 11.045 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.047 -5.213 11.907 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.113 -3.790 11.490 1.00 0.00 H new ATOM 0 HG2 LYS A 113 3.789 -5.588 13.437 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.291 -4.886 14.005 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.473 -2.715 13.947 1.00 0.00 H new ATOM 0 HD3 LYS A 113 3.366 -3.045 12.630 1.00 0.00 H new ATOM 0 HE2 LYS A 113 1.687 -3.743 14.024 1.00 0.00 H new ATOM 0 HE3 LYS A 113 2.788 -4.544 15.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 1.743 -2.636 16.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 3.416 -2.379 16.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 2.350 -1.604 14.959 1.00 0.00 H new ATOM 1665 N MET A 114 4.419 -4.079 9.071 1.00 0.00 N ATOM 1666 CA MET A 114 4.762 -3.657 7.718 1.00 0.00 C ATOM 1667 C MET A 114 4.940 -2.145 7.648 1.00 0.00 C ATOM 1668 O MET A 114 4.350 -1.402 8.432 1.00 0.00 O ATOM 1669 CB MET A 114 3.677 -4.101 6.734 1.00 0.00 C ATOM 1670 CG MET A 114 2.280 -3.651 7.125 1.00 0.00 C ATOM 1671 SD MET A 114 1.000 -4.794 6.567 1.00 0.00 S ATOM 1672 CE MET A 114 1.482 -6.288 7.429 1.00 0.00 C ATOM 0 H MET A 114 4.046 -3.337 9.663 1.00 0.00 H new ATOM 0 HA MET A 114 5.706 -4.128 7.445 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.913 -3.708 5.745 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.691 -5.188 6.657 1.00 0.00 H new ATOM 0 HG2 MET A 114 2.225 -3.551 8.209 1.00 0.00 H new ATOM 0 HG3 MET A 114 2.089 -2.664 6.704 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.607 -6.921 7.578 1.00 0.00 H new ATOM 0 HE2 MET A 114 2.223 -6.826 6.838 1.00 0.00 H new ATOM 0 HE3 MET A 114 1.910 -6.028 8.397 1.00 0.00 H new ATOM 1682 N ALA A 115 5.759 -1.695 6.702 1.00 0.00 N ATOM 1683 CA ALA A 115 6.016 -0.271 6.527 1.00 0.00 C ATOM 1684 C ALA A 115 6.361 0.049 5.077 1.00 0.00 C ATOM 1685 O ALA A 115 7.240 -0.578 4.484 1.00 0.00 O ATOM 1686 CB ALA A 115 7.138 0.179 7.451 1.00 0.00 C ATOM 0 H ALA A 115 6.256 -2.297 6.045 1.00 0.00 H new ATOM 0 HA ALA A 115 5.107 0.273 6.785 1.00 0.00 H new ATOM 0 HB1 ALA A 115 7.320 1.244 7.310 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.853 -0.007 8.487 1.00 0.00 H new ATOM 0 HB3 ALA A 115 8.046 -0.378 7.219 1.00 0.00 H new ATOM 1692 N LEU A 116 5.662 1.027 4.510 1.00 0.00 N ATOM 1693 CA LEU A 116 5.894 1.430 3.128 1.00 0.00 C ATOM 1694 C LEU A 116 7.146 2.292 3.015 1.00 0.00 C ATOM 1695 O LEU A 116 7.188 3.416 3.517 1.00 0.00 O ATOM 1696 CB LEU A 116 4.684 2.195 2.589 1.00 0.00 C ATOM 1697 CG LEU A 116 4.625 2.321 1.065 1.00 0.00 C ATOM 1698 CD1 LEU A 116 4.537 0.946 0.420 1.00 0.00 C ATOM 1699 CD2 LEU A 116 3.444 3.184 0.649 1.00 0.00 C ATOM 0 H LEU A 116 4.931 1.555 4.986 1.00 0.00 H new ATOM 0 HA LEU A 116 6.041 0.529 2.533 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.777 1.699 2.933 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.683 3.195 3.022 1.00 0.00 H new ATOM 0 HG LEU A 116 5.541 2.803 0.722 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.496 1.054 -0.664 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.414 0.359 0.693 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.638 0.438 0.768 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.416 3.264 -0.438 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.519 2.730 1.003 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.549 4.178 1.083 1.00 0.00 H new ATOM 1711 N LEU A 117 8.167 1.759 2.351 1.00 0.00 N ATOM 1712 CA LEU A 117 9.422 2.480 2.170 1.00 0.00 C ATOM 1713 C LEU A 117 9.476 3.139 0.796 1.00 0.00 C ATOM 1714 O LEU A 117 9.182 2.507 -0.219 1.00 0.00 O ATOM 1715 CB LEU A 117 10.610 1.532 2.341 1.00 0.00 C ATOM 1716 CG LEU A 117 11.985 2.196 2.256 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.468 2.600 3.640 1.00 0.00 C ATOM 1718 CD2 LEU A 117 12.987 1.263 1.591 1.00 0.00 C ATOM 0 H LEU A 117 8.150 0.830 1.929 1.00 0.00 H new ATOM 0 HA LEU A 117 9.477 3.259 2.930 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.523 1.035 3.307 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.550 0.757 1.577 1.00 0.00 H new ATOM 0 HG LEU A 117 11.897 3.096 1.647 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.448 3.071 3.560 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.762 3.304 4.081 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.541 1.715 4.273 1.00 0.00 H new ATOM 0 HD21 LEU A 117 13.960 1.752 1.539 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.072 0.346 2.174 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.647 1.023 0.584 1.00 0.00 H new ATOM 1730 N ALA A 118 9.853 4.413 0.770 1.00 0.00 N ATOM 1731 CA ALA A 118 9.946 5.158 -0.479 1.00 0.00 C ATOM 1732 C ALA A 118 11.209 4.787 -1.247 1.00 0.00 C ATOM 1733 O ALA A 118 12.103 4.131 -0.714 1.00 0.00 O ATOM 1734 CB ALA A 118 9.914 6.654 -0.205 1.00 0.00 C ATOM 0 H ALA A 118 10.099 4.951 1.601 1.00 0.00 H new ATOM 0 HA ALA A 118 9.087 4.894 -1.095 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.984 7.198 -1.147 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.980 6.913 0.295 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.754 6.925 0.434 1.00 0.00 H new ATOM 1740 N SER A 119 11.276 5.215 -2.504 1.00 0.00 N ATOM 1741 CA SER A 119 12.430 4.932 -3.349 1.00 0.00 C ATOM 1742 C SER A 119 13.679 5.651 -2.839 1.00 0.00 C ATOM 1743 O SER A 119 14.795 5.346 -3.259 1.00 0.00 O ATOM 1744 CB SER A 119 12.145 5.347 -4.793 1.00 0.00 C ATOM 1745 OG SER A 119 13.250 5.061 -5.634 1.00 0.00 O ATOM 0 H SER A 119 10.544 5.760 -2.960 1.00 0.00 H new ATOM 0 HA SER A 119 12.615 3.858 -3.313 1.00 0.00 H new ATOM 0 HB2 SER A 119 11.261 4.823 -5.158 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.922 6.413 -4.831 1.00 0.00 H new ATOM 0 HG SER A 119 12.939 4.948 -6.556 1.00 0.00 H new ATOM 1751 N ASN A 120 13.486 6.608 -1.933 1.00 0.00 N ATOM 1752 CA ASN A 120 14.600 7.365 -1.374 1.00 0.00 C ATOM 1753 C ASN A 120 15.082 6.752 -0.060 1.00 0.00 C ATOM 1754 O ASN A 120 15.703 7.429 0.759 1.00 0.00 O ATOM 1755 CB ASN A 120 14.188 8.821 -1.146 1.00 0.00 C ATOM 1756 CG ASN A 120 12.933 8.941 -0.303 1.00 0.00 C ATOM 1757 OD1 ASN A 120 12.410 7.945 0.197 1.00 0.00 O ATOM 1758 ND2 ASN A 120 12.444 10.166 -0.140 1.00 0.00 N ATOM 0 H ASN A 120 12.570 6.876 -1.572 1.00 0.00 H new ATOM 0 HA ASN A 120 15.421 7.329 -2.090 1.00 0.00 H new ATOM 0 HB2 ASN A 120 15.003 9.354 -0.657 1.00 0.00 H new ATOM 0 HB3 ASN A 120 14.023 9.304 -2.109 1.00 0.00 H new ATOM 0 HD21 ASN A 120 11.602 10.309 0.418 1.00 0.00 H new ATOM 0 HD22 ASN A 120 12.910 10.963 -0.573 1.00 0.00 H new ATOM 1765 N SER A 121 14.796 5.467 0.135 1.00 0.00 N ATOM 1766 CA SER A 121 15.204 4.767 1.349 1.00 0.00 C ATOM 1767 C SER A 121 14.697 5.489 2.595 1.00 0.00 C ATOM 1768 O SER A 121 15.357 5.494 3.634 1.00 0.00 O ATOM 1769 CB SER A 121 16.728 4.644 1.404 1.00 0.00 C ATOM 1770 OG SER A 121 17.233 4.035 0.228 1.00 0.00 O ATOM 0 H SER A 121 14.284 4.890 -0.532 1.00 0.00 H new ATOM 0 HA SER A 121 14.764 3.770 1.326 1.00 0.00 H new ATOM 0 HB2 SER A 121 17.172 5.632 1.525 1.00 0.00 H new ATOM 0 HB3 SER A 121 17.017 4.056 2.275 1.00 0.00 H new ATOM 0 HG SER A 121 18.209 3.969 0.287 1.00 0.00 H new ATOM 1776 N CYS A 122 13.521 6.098 2.482 1.00 0.00 N ATOM 1777 CA CYS A 122 12.925 6.823 3.598 1.00 0.00 C ATOM 1778 C CYS A 122 11.471 6.412 3.802 1.00 0.00 C ATOM 1779 O CYS A 122 10.686 6.378 2.854 1.00 0.00 O ATOM 1780 CB CYS A 122 13.013 8.331 3.358 1.00 0.00 C ATOM 1781 SG CYS A 122 14.666 9.022 3.603 1.00 0.00 S ATOM 0 H CYS A 122 12.962 6.104 1.629 1.00 0.00 H new ATOM 0 HA CYS A 122 13.483 6.572 4.500 1.00 0.00 H new ATOM 0 HB2 CYS A 122 12.688 8.546 2.340 1.00 0.00 H new ATOM 0 HB3 CYS A 122 12.317 8.836 4.028 1.00 0.00 H new ATOM 0 HG CYS A 122 15.455 8.605 2.658 1.00 0.00 H new ATOM 1787 N PHE A 123 11.117 6.100 5.045 1.00 0.00 N ATOM 1788 CA PHE A 123 9.757 5.692 5.373 1.00 0.00 C ATOM 1789 C PHE A 123 8.777 6.839 5.152 1.00 0.00 C ATOM 1790 O PHE A 123 9.169 7.934 4.748 1.00 0.00 O ATOM 1791 CB PHE A 123 9.681 5.211 6.824 1.00 0.00 C ATOM 1792 CG PHE A 123 10.173 3.805 7.017 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.611 2.757 6.306 1.00 0.00 C ATOM 1794 CD2 PHE A 123 11.198 3.533 7.908 1.00 0.00 C ATOM 1795 CE1 PHE A 123 10.061 1.463 6.481 1.00 0.00 C ATOM 1796 CE2 PHE A 123 11.653 2.240 8.087 1.00 0.00 C ATOM 1797 CZ PHE A 123 11.083 1.204 7.373 1.00 0.00 C ATOM 0 H PHE A 123 11.754 6.122 5.841 1.00 0.00 H new ATOM 0 HA PHE A 123 9.481 4.871 4.712 1.00 0.00 H new ATOM 0 HB2 PHE A 123 10.268 5.882 7.452 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.648 5.276 7.166 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.812 2.954 5.607 1.00 0.00 H new ATOM 0 HD2 PHE A 123 11.647 4.340 8.469 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.614 0.655 5.921 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.453 2.040 8.784 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.436 0.193 7.512 1.00 0.00 H new ATOM 1807 N ILE A 124 7.501 6.583 5.420 1.00 0.00 N ATOM 1808 CA ILE A 124 6.465 7.595 5.250 1.00 0.00 C ATOM 1809 C ILE A 124 5.645 7.762 6.525 1.00 0.00 C ATOM 1810 O ILE A 124 5.662 6.900 7.403 1.00 0.00 O ATOM 1811 CB ILE A 124 5.520 7.241 4.087 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.988 5.815 4.248 1.00 0.00 C ATOM 1813 CG2 ILE A 124 6.236 7.398 2.755 1.00 0.00 C ATOM 1814 CD1 ILE A 124 3.743 5.539 3.434 1.00 0.00 C ATOM 0 H ILE A 124 7.159 5.683 5.756 1.00 0.00 H new ATOM 0 HA ILE A 124 6.973 8.532 5.023 1.00 0.00 H new ATOM 0 HB ILE A 124 4.674 7.928 4.105 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.767 5.110 3.956 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.772 5.633 5.301 1.00 0.00 H new ATOM 0 HG21 ILE A 124 5.554 7.144 1.943 1.00 0.00 H new ATOM 0 HG22 ILE A 124 6.569 8.430 2.640 1.00 0.00 H new ATOM 0 HG23 ILE A 124 7.099 6.733 2.725 1.00 0.00 H new ATOM 0 HD11 ILE A 124 3.422 4.510 3.597 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.949 6.219 3.741 1.00 0.00 H new ATOM 0 HD13 ILE A 124 3.959 5.688 2.376 1.00 0.00 H new ATOM 1826 N ARG A 125 4.927 8.877 6.617 1.00 0.00 N ATOM 1827 CA ARG A 125 4.099 9.158 7.784 1.00 0.00 C ATOM 1828 C ARG A 125 3.317 10.454 7.597 1.00 0.00 C ATOM 1829 O ARG A 125 3.814 11.411 7.004 1.00 0.00 O ATOM 1830 CB ARG A 125 4.966 9.250 9.041 1.00 0.00 C ATOM 1831 CG ARG A 125 6.042 10.322 8.962 1.00 0.00 C ATOM 1832 CD ARG A 125 6.220 11.032 10.295 1.00 0.00 C ATOM 1833 NE ARG A 125 5.000 11.714 10.720 1.00 0.00 N ATOM 1834 CZ ARG A 125 4.970 12.680 11.634 1.00 0.00 C ATOM 1835 NH1 ARG A 125 6.090 13.084 12.221 1.00 0.00 N ATOM 1836 NH2 ARG A 125 3.816 13.247 11.962 1.00 0.00 N ATOM 0 H ARG A 125 4.902 9.600 5.898 1.00 0.00 H new ATOM 0 HA ARG A 125 3.389 8.339 7.900 1.00 0.00 H new ATOM 0 HB2 ARG A 125 4.326 9.452 9.900 1.00 0.00 H new ATOM 0 HB3 ARG A 125 5.440 8.284 9.217 1.00 0.00 H new ATOM 0 HG2 ARG A 125 6.987 9.869 8.661 1.00 0.00 H new ATOM 0 HG3 ARG A 125 5.777 11.049 8.194 1.00 0.00 H new ATOM 0 HD2 ARG A 125 6.514 10.308 11.055 1.00 0.00 H new ATOM 0 HD3 ARG A 125 7.031 11.756 10.214 1.00 0.00 H new ATOM 0 HE ARG A 125 4.119 11.433 10.290 1.00 0.00 H new ATOM 0 HH11 ARG A 125 6.980 12.653 11.972 1.00 0.00 H new ATOM 0 HH12 ARG A 125 6.060 13.825 12.921 1.00 0.00 H new ATOM 0 HH21 ARG A 125 2.952 12.942 11.513 1.00 0.00 H new ATOM 0 HH22 ARG A 125 3.793 13.988 12.663 1.00 0.00 H new ATOM 1850 N CYS A 126 2.090 10.478 8.107 1.00 0.00 N ATOM 1851 CA CYS A 126 1.238 11.656 7.995 1.00 0.00 C ATOM 1852 C CYS A 126 1.516 12.637 9.130 1.00 0.00 C ATOM 1853 O CYS A 126 1.858 12.235 10.241 1.00 0.00 O ATOM 1854 CB CYS A 126 -0.236 11.249 8.006 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.742 10.347 9.489 1.00 0.00 S ATOM 0 H CYS A 126 1.663 9.695 8.602 1.00 0.00 H new ATOM 0 HA CYS A 126 1.464 12.148 7.049 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.850 12.145 7.912 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.438 10.631 7.131 1.00 0.00 H new ATOM 0 HG CYS A 126 -1.343 11.159 10.307 1.00 0.00 H new ATOM 1861 N ASN A 127 1.365 13.926 8.842 1.00 0.00 N ATOM 1862 CA ASN A 127 1.599 14.964 9.837 1.00 0.00 C ATOM 1863 C ASN A 127 0.299 15.353 10.535 1.00 0.00 C ATOM 1864 O ASN A 127 -0.783 14.921 10.138 1.00 0.00 O ATOM 1865 CB ASN A 127 2.229 16.196 9.183 1.00 0.00 C ATOM 1866 CG ASN A 127 3.742 16.190 9.276 1.00 0.00 C ATOM 1867 OD1 ASN A 127 4.316 15.636 10.214 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.398 16.808 8.301 1.00 0.00 N ATOM 0 H ASN A 127 1.081 14.276 7.927 1.00 0.00 H new ATOM 0 HA ASN A 127 2.286 14.567 10.584 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.932 16.239 8.135 1.00 0.00 H new ATOM 0 HB3 ASN A 127 1.842 17.096 9.661 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.418 16.836 8.311 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.882 17.254 7.542 1.00 0.00 H new ATOM 1875 N GLU A 128 0.414 16.168 11.577 1.00 0.00 N ATOM 1876 CA GLU A 128 -0.753 16.615 12.331 1.00 0.00 C ATOM 1877 C GLU A 128 -1.671 17.464 11.459 1.00 0.00 C ATOM 1878 O GLU A 128 -2.888 17.469 11.644 1.00 0.00 O ATOM 1879 CB GLU A 128 -0.316 17.413 13.562 1.00 0.00 C ATOM 1880 CG GLU A 128 -1.432 17.636 14.569 1.00 0.00 C ATOM 1881 CD GLU A 128 -1.437 16.599 15.673 1.00 0.00 C ATOM 1882 OE1 GLU A 128 -1.530 15.394 15.356 1.00 0.00 O ATOM 1883 OE2 GLU A 128 -1.349 16.991 16.857 1.00 0.00 O ATOM 0 H GLU A 128 1.303 16.533 11.920 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.305 15.733 12.656 1.00 0.00 H new ATOM 0 HB2 GLU A 128 0.505 16.889 14.052 1.00 0.00 H new ATOM 0 HB3 GLU A 128 0.070 18.380 13.240 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -1.327 18.628 15.008 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -2.392 17.616 14.052 1.00 0.00 H new ATOM 1890 N ALA A 129 -1.081 18.183 10.510 1.00 0.00 N ATOM 1891 CA ALA A 129 -1.848 19.037 9.610 1.00 0.00 C ATOM 1892 C ALA A 129 -2.374 18.245 8.419 1.00 0.00 C ATOM 1893 O ALA A 129 -3.469 18.509 7.921 1.00 0.00 O ATOM 1894 CB ALA A 129 -0.993 20.203 9.136 1.00 0.00 C ATOM 0 H ALA A 129 -0.075 18.191 10.344 1.00 0.00 H new ATOM 0 HA ALA A 129 -2.705 19.428 10.159 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -1.577 20.833 8.465 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -0.670 20.790 9.996 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -0.119 19.822 8.608 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.590 17.274 7.965 1.00 0.00 N ATOM 1901 CA GLY A 130 -1.995 16.460 6.834 1.00 0.00 C ATOM 1902 C GLY A 130 -0.876 16.256 5.831 1.00 0.00 C ATOM 1903 O GLY A 130 -0.882 15.284 5.075 1.00 0.00 O ATOM 0 H GLY A 130 -0.680 17.036 8.360 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.337 15.489 7.194 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -2.842 16.932 6.336 1.00 0.00 H new ATOM 1907 N ASP A 131 0.086 17.174 5.823 1.00 0.00 N ATOM 1908 CA ASP A 131 1.215 17.090 4.903 1.00 0.00 C ATOM 1909 C ASP A 131 1.960 15.768 5.071 1.00 0.00 C ATOM 1910 O ASP A 131 2.638 15.550 6.075 1.00 0.00 O ATOM 1911 CB ASP A 131 2.174 18.260 5.133 1.00 0.00 C ATOM 1912 CG ASP A 131 1.492 19.605 4.972 1.00 0.00 C ATOM 1913 OD1 ASP A 131 1.073 19.928 3.841 1.00 0.00 O ATOM 1914 OD2 ASP A 131 1.377 20.335 5.980 1.00 0.00 O ATOM 0 H ASP A 131 0.106 17.984 6.443 1.00 0.00 H new ATOM 0 HA ASP A 131 0.826 17.140 3.886 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.598 18.188 6.135 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.004 18.190 4.430 1.00 0.00 H new ATOM 1919 N ILE A 132 1.828 14.892 4.082 1.00 0.00 N ATOM 1920 CA ILE A 132 2.489 13.592 4.119 1.00 0.00 C ATOM 1921 C ILE A 132 3.889 13.671 3.522 1.00 0.00 C ATOM 1922 O ILE A 132 4.058 14.015 2.353 1.00 0.00 O ATOM 1923 CB ILE A 132 1.677 12.528 3.358 1.00 0.00 C ATOM 1924 CG1 ILE A 132 0.212 12.562 3.795 1.00 0.00 C ATOM 1925 CG2 ILE A 132 2.271 11.145 3.586 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -0.681 11.646 2.988 1.00 0.00 C ATOM 0 H ILE A 132 1.270 15.058 3.245 1.00 0.00 H new ATOM 0 HA ILE A 132 2.560 13.302 5.167 1.00 0.00 H new ATOM 0 HB ILE A 132 1.723 12.752 2.292 1.00 0.00 H new ATOM 0 HG12 ILE A 132 0.149 12.284 4.847 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.160 13.583 3.713 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.686 10.404 3.042 1.00 0.00 H new ATOM 0 HG22 ILE A 132 3.301 11.128 3.229 1.00 0.00 H new ATOM 0 HG23 ILE A 132 2.252 10.912 4.651 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.705 11.722 3.353 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -0.648 11.937 1.938 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -0.335 10.618 3.090 1.00 0.00 H new ATOM 1938 N GLU A 133 4.892 13.349 4.332 1.00 0.00 N ATOM 1939 CA GLU A 133 6.279 13.384 3.884 1.00 0.00 C ATOM 1940 C GLU A 133 6.986 12.070 4.201 1.00 0.00 C ATOM 1941 O GLU A 133 6.417 11.186 4.842 1.00 0.00 O ATOM 1942 CB GLU A 133 7.021 14.547 4.545 1.00 0.00 C ATOM 1943 CG GLU A 133 6.843 14.604 6.053 1.00 0.00 C ATOM 1944 CD GLU A 133 8.010 15.275 6.753 1.00 0.00 C ATOM 1945 OE1 GLU A 133 8.294 16.450 6.439 1.00 0.00 O ATOM 1946 OE2 GLU A 133 8.637 14.624 7.615 1.00 0.00 O ATOM 0 H GLU A 133 4.770 13.061 5.303 1.00 0.00 H new ATOM 0 HA GLU A 133 6.282 13.527 2.803 1.00 0.00 H new ATOM 0 HB2 GLU A 133 8.084 14.466 4.316 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.672 15.484 4.111 1.00 0.00 H new ATOM 0 HG2 GLU A 133 5.925 15.143 6.287 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.725 13.592 6.440 1.00 0.00 H new ATOM 1953 N ALA A 134 8.229 11.948 3.748 1.00 0.00 N ATOM 1954 CA ALA A 134 9.013 10.743 3.982 1.00 0.00 C ATOM 1955 C ALA A 134 10.009 10.948 5.119 1.00 0.00 C ATOM 1956 O ALA A 134 10.923 11.767 5.017 1.00 0.00 O ATOM 1957 CB ALA A 134 9.739 10.330 2.711 1.00 0.00 C ATOM 0 H ALA A 134 8.715 12.670 3.216 1.00 0.00 H new ATOM 0 HA ALA A 134 8.329 9.946 4.272 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.321 9.428 2.901 1.00 0.00 H new ATOM 0 HB2 ALA A 134 9.011 10.133 1.924 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.406 11.132 2.396 1.00 0.00 H new ATOM 1963 N LYS A 135 9.826 10.200 6.202 1.00 0.00 N ATOM 1964 CA LYS A 135 10.710 10.301 7.359 1.00 0.00 C ATOM 1965 C LYS A 135 11.961 9.451 7.161 1.00 0.00 C ATOM 1966 O LYS A 135 12.026 8.628 6.249 1.00 0.00 O ATOM 1967 CB LYS A 135 9.973 9.864 8.628 1.00 0.00 C ATOM 1968 CG LYS A 135 9.997 10.908 9.735 1.00 0.00 C ATOM 1969 CD LYS A 135 10.823 10.444 10.924 1.00 0.00 C ATOM 1970 CE LYS A 135 11.419 11.619 11.681 1.00 0.00 C ATOM 1971 NZ LYS A 135 12.623 11.224 12.463 1.00 0.00 N ATOM 0 H LYS A 135 9.075 9.518 6.303 1.00 0.00 H new ATOM 0 HA LYS A 135 11.015 11.342 7.466 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.937 9.637 8.377 1.00 0.00 H new ATOM 0 HB3 LYS A 135 10.421 8.942 8.999 1.00 0.00 H new ATOM 0 HG2 LYS A 135 10.408 11.840 9.348 1.00 0.00 H new ATOM 0 HG3 LYS A 135 8.978 11.119 10.059 1.00 0.00 H new ATOM 0 HD2 LYS A 135 10.197 9.857 11.596 1.00 0.00 H new ATOM 0 HD3 LYS A 135 11.623 9.789 10.579 1.00 0.00 H new ATOM 0 HE2 LYS A 135 11.686 12.407 10.976 1.00 0.00 H new ATOM 0 HE3 LYS A 135 10.669 12.035 12.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 12.999 12.054 12.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 12.363 10.491 13.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 13.349 10.851 11.818 1.00 0.00 H new ATOM 1985 N ASN A 136 12.954 9.660 8.021 1.00 0.00 N ATOM 1986 CA ASN A 136 14.204 8.914 7.939 1.00 0.00 C ATOM 1987 C ASN A 136 13.953 7.415 8.079 1.00 0.00 C ATOM 1988 O ASN A 136 12.817 6.980 8.266 1.00 0.00 O ATOM 1989 CB ASN A 136 15.174 9.384 9.025 1.00 0.00 C ATOM 1990 CG ASN A 136 16.145 10.432 8.515 1.00 0.00 C ATOM 1991 OD1 ASN A 136 16.043 11.609 8.861 1.00 0.00 O ATOM 1992 ND2 ASN A 136 17.094 10.008 7.690 1.00 0.00 N ATOM 0 H ASN A 136 12.917 10.339 8.781 1.00 0.00 H new ATOM 0 HA ASN A 136 14.646 9.100 6.960 1.00 0.00 H new ATOM 0 HB2 ASN A 136 14.608 9.793 9.862 1.00 0.00 H new ATOM 0 HB3 ASN A 136 15.733 8.529 9.405 1.00 0.00 H new ATOM 0 HD21 ASN A 136 17.777 10.667 7.316 1.00 0.00 H new ATOM 0 HD22 ASN A 136 17.141 9.023 7.430 1.00 0.00 H new ATOM 1999 N LYS A 137 15.022 6.630 7.985 1.00 0.00 N ATOM 2000 CA LYS A 137 14.918 5.180 8.100 1.00 0.00 C ATOM 2001 C LYS A 137 14.323 4.777 9.446 1.00 0.00 C ATOM 2002 O LYS A 137 13.742 3.700 9.580 1.00 0.00 O ATOM 2003 CB LYS A 137 16.294 4.534 7.924 1.00 0.00 C ATOM 2004 CG LYS A 137 16.626 4.197 6.480 1.00 0.00 C ATOM 2005 CD LYS A 137 17.919 3.403 6.378 1.00 0.00 C ATOM 2006 CE LYS A 137 18.649 3.695 5.076 1.00 0.00 C ATOM 2007 NZ LYS A 137 19.243 5.061 5.066 1.00 0.00 N ATOM 0 H LYS A 137 15.970 6.974 7.830 1.00 0.00 H new ATOM 0 HA LYS A 137 14.253 4.827 7.312 1.00 0.00 H new ATOM 0 HB2 LYS A 137 17.056 5.208 8.316 1.00 0.00 H new ATOM 0 HB3 LYS A 137 16.338 3.623 8.521 1.00 0.00 H new ATOM 0 HG2 LYS A 137 15.809 3.623 6.042 1.00 0.00 H new ATOM 0 HG3 LYS A 137 16.715 5.117 5.902 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.565 3.647 7.221 1.00 0.00 H new ATOM 0 HD3 LYS A 137 17.699 2.337 6.442 1.00 0.00 H new ATOM 0 HE2 LYS A 137 19.436 2.956 4.928 1.00 0.00 H new ATOM 0 HE3 LYS A 137 17.956 3.595 4.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 19.982 5.113 4.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 18.502 5.760 4.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 19.661 5.265 5.996 1.00 0.00 H new ATOM 2021 N THR A 138 14.473 5.645 10.443 1.00 0.00 N ATOM 2022 CA THR A 138 13.949 5.376 11.778 1.00 0.00 C ATOM 2023 C THR A 138 12.455 5.067 11.728 1.00 0.00 C ATOM 2024 O THR A 138 11.635 5.959 11.513 1.00 0.00 O ATOM 2025 CB THR A 138 14.204 6.570 12.699 1.00 0.00 C ATOM 2026 OG1 THR A 138 13.877 7.784 12.047 1.00 0.00 O ATOM 2027 CG2 THR A 138 15.641 6.671 13.164 1.00 0.00 C ATOM 0 H THR A 138 14.953 6.540 10.351 1.00 0.00 H new ATOM 0 HA THR A 138 14.468 4.503 12.174 1.00 0.00 H new ATOM 0 HB THR A 138 13.569 6.405 13.569 1.00 0.00 H new ATOM 0 HG1 THR A 138 12.988 7.708 11.641 1.00 0.00 H new ATOM 0 HG21 THR A 138 15.753 7.539 13.814 1.00 0.00 H new ATOM 0 HG22 THR A 138 15.910 5.769 13.714 1.00 0.00 H new ATOM 0 HG23 THR A 138 16.296 6.778 12.300 1.00 0.00 H new ATOM 2035 N ALA A 139 12.112 3.799 11.927 1.00 0.00 N ATOM 2036 CA ALA A 139 10.718 3.373 11.905 1.00 0.00 C ATOM 2037 C ALA A 139 10.075 3.525 13.279 1.00 0.00 C ATOM 2038 O ALA A 139 10.434 2.825 14.225 1.00 0.00 O ATOM 2039 CB ALA A 139 10.617 1.931 11.430 1.00 0.00 C ATOM 0 H ALA A 139 12.780 3.049 12.105 1.00 0.00 H new ATOM 0 HA ALA A 139 10.178 4.014 11.208 1.00 0.00 H new ATOM 0 HB1 ALA A 139 9.571 1.624 11.418 1.00 0.00 H new ATOM 0 HB2 ALA A 139 11.031 1.849 10.425 1.00 0.00 H new ATOM 0 HB3 ALA A 139 11.177 1.285 12.106 1.00 0.00 H new ATOM 2045 N GLY A 140 9.122 4.446 13.381 1.00 0.00 N ATOM 2046 CA GLY A 140 8.442 4.674 14.643 1.00 0.00 C ATOM 2047 C GLY A 140 7.145 3.898 14.753 1.00 0.00 C ATOM 2048 O GLY A 140 6.755 3.193 13.822 1.00 0.00 O ATOM 0 H GLY A 140 8.808 5.039 12.612 1.00 0.00 H new ATOM 0 HA2 GLY A 140 9.101 4.391 15.463 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.235 5.738 14.753 1.00 0.00 H new ATOM 2052 N GLU A 141 6.476 4.027 15.894 1.00 0.00 N ATOM 2053 CA GLU A 141 5.214 3.330 16.122 1.00 0.00 C ATOM 2054 C GLU A 141 4.145 3.807 15.144 1.00 0.00 C ATOM 2055 O GLU A 141 3.331 3.018 14.666 1.00 0.00 O ATOM 2056 CB GLU A 141 4.741 3.548 17.561 1.00 0.00 C ATOM 2057 CG GLU A 141 5.224 2.480 18.528 1.00 0.00 C ATOM 2058 CD GLU A 141 5.470 3.026 19.922 1.00 0.00 C ATOM 2059 OE1 GLU A 141 4.495 3.150 20.693 1.00 0.00 O ATOM 2060 OE2 GLU A 141 6.639 3.330 20.243 1.00 0.00 O ATOM 0 H GLU A 141 6.785 4.606 16.674 1.00 0.00 H new ATOM 0 HA GLU A 141 5.380 2.265 15.959 1.00 0.00 H new ATOM 0 HB2 GLU A 141 5.088 4.522 17.905 1.00 0.00 H new ATOM 0 HB3 GLU A 141 3.651 3.575 17.576 1.00 0.00 H new ATOM 0 HG2 GLU A 141 4.485 1.680 18.580 1.00 0.00 H new ATOM 0 HG3 GLU A 141 6.145 2.039 18.146 1.00 0.00 H new ATOM 2067 N GLU A 142 4.154 5.104 14.851 1.00 0.00 N ATOM 2068 CA GLU A 142 3.185 5.686 13.930 1.00 0.00 C ATOM 2069 C GLU A 142 3.503 5.298 12.489 1.00 0.00 C ATOM 2070 O GLU A 142 2.603 5.163 11.660 1.00 0.00 O ATOM 2071 CB GLU A 142 3.170 7.210 14.069 1.00 0.00 C ATOM 2072 CG GLU A 142 4.527 7.855 13.844 1.00 0.00 C ATOM 2073 CD GLU A 142 4.821 8.957 14.843 1.00 0.00 C ATOM 2074 OE1 GLU A 142 4.050 9.938 14.889 1.00 0.00 O ATOM 2075 OE2 GLU A 142 5.823 8.838 15.580 1.00 0.00 O ATOM 0 H GLU A 142 4.821 5.771 15.238 1.00 0.00 H new ATOM 0 HA GLU A 142 2.200 5.295 14.183 1.00 0.00 H new ATOM 0 HB2 GLU A 142 2.457 7.624 13.356 1.00 0.00 H new ATOM 0 HB3 GLU A 142 2.813 7.472 15.065 1.00 0.00 H new ATOM 0 HG2 GLU A 142 5.303 7.093 13.911 1.00 0.00 H new ATOM 0 HG3 GLU A 142 4.568 8.264 12.835 1.00 0.00 H new ATOM 2082 N GLU A 143 4.787 5.122 12.199 1.00 0.00 N ATOM 2083 CA GLU A 143 5.223 4.750 10.858 1.00 0.00 C ATOM 2084 C GLU A 143 4.616 3.415 10.439 1.00 0.00 C ATOM 2085 O GLU A 143 4.365 3.180 9.257 1.00 0.00 O ATOM 2086 CB GLU A 143 6.751 4.671 10.799 1.00 0.00 C ATOM 2087 CG GLU A 143 7.408 5.960 10.333 1.00 0.00 C ATOM 2088 CD GLU A 143 7.690 6.916 11.476 1.00 0.00 C ATOM 2089 OE1 GLU A 143 6.748 7.234 12.231 1.00 0.00 O ATOM 2090 OE2 GLU A 143 8.854 7.348 11.615 1.00 0.00 O ATOM 0 H GLU A 143 5.544 5.231 12.874 1.00 0.00 H new ATOM 0 HA GLU A 143 4.879 5.518 10.165 1.00 0.00 H new ATOM 0 HB2 GLU A 143 7.132 4.415 11.788 1.00 0.00 H new ATOM 0 HB3 GLU A 143 7.039 3.862 10.127 1.00 0.00 H new ATOM 0 HG2 GLU A 143 8.342 5.724 9.823 1.00 0.00 H new ATOM 0 HG3 GLU A 143 6.762 6.450 9.605 1.00 0.00 H new ATOM 2097 N MET A 144 4.384 2.544 11.415 1.00 0.00 N ATOM 2098 CA MET A 144 3.805 1.232 11.146 1.00 0.00 C ATOM 2099 C MET A 144 2.433 1.365 10.493 1.00 0.00 C ATOM 2100 O MET A 144 1.499 1.898 11.090 1.00 0.00 O ATOM 2101 CB MET A 144 3.689 0.428 12.443 1.00 0.00 C ATOM 2102 CG MET A 144 5.016 0.231 13.157 1.00 0.00 C ATOM 2103 SD MET A 144 6.073 -0.981 12.340 1.00 0.00 S ATOM 2104 CE MET A 144 7.470 0.042 11.882 1.00 0.00 C ATOM 0 H MET A 144 4.588 2.722 12.398 1.00 0.00 H new ATOM 0 HA MET A 144 4.465 0.706 10.457 1.00 0.00 H new ATOM 0 HB2 MET A 144 2.996 0.935 13.115 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.258 -0.548 12.219 1.00 0.00 H new ATOM 0 HG2 MET A 144 5.540 1.185 13.212 1.00 0.00 H new ATOM 0 HG3 MET A 144 4.828 -0.089 14.182 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.213 -0.566 11.366 1.00 0.00 H new ATOM 0 HE2 MET A 144 7.134 0.842 11.222 1.00 0.00 H new ATOM 0 HE3 MET A 144 7.915 0.473 12.779 1.00 0.00 H new ATOM 2114 N ILE A 145 2.319 0.875 9.262 1.00 0.00 N ATOM 2115 CA ILE A 145 1.063 0.939 8.528 1.00 0.00 C ATOM 2116 C ILE A 145 0.443 -0.446 8.376 1.00 0.00 C ATOM 2117 O ILE A 145 1.079 -1.458 8.676 1.00 0.00 O ATOM 2118 CB ILE A 145 1.259 1.556 7.130 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.322 0.780 6.350 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.644 3.023 7.247 1.00 0.00 C ATOM 2121 CD1 ILE A 145 2.056 0.720 4.862 1.00 0.00 C ATOM 0 H ILE A 145 3.083 0.429 8.753 1.00 0.00 H new ATOM 0 HA ILE A 145 0.392 1.574 9.107 1.00 0.00 H new ATOM 0 HB ILE A 145 0.317 1.491 6.585 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.295 1.242 6.519 1.00 0.00 H new ATOM 0 HG13 ILE A 145 2.380 -0.235 6.742 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.779 3.444 6.251 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.855 3.566 7.767 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.575 3.111 7.807 1.00 0.00 H new ATOM 0 HD11 ILE A 145 2.849 0.155 4.373 1.00 0.00 H new ATOM 0 HD12 ILE A 145 1.099 0.231 4.683 1.00 0.00 H new ATOM 0 HD13 ILE A 145 2.028 1.731 4.456 1.00 0.00 H new ATOM 2133 N LYS A 146 -0.800 -0.486 7.909 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.506 -1.748 7.717 1.00 0.00 C ATOM 2135 C LYS A 146 -2.126 -1.818 6.325 1.00 0.00 C ATOM 2136 O LYS A 146 -3.237 -1.338 6.104 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.592 -1.915 8.780 1.00 0.00 C ATOM 2138 CG LYS A 146 -2.104 -2.598 10.047 1.00 0.00 C ATOM 2139 CD LYS A 146 -3.180 -3.483 10.654 1.00 0.00 C ATOM 2140 CE LYS A 146 -2.848 -3.865 12.088 1.00 0.00 C ATOM 2141 NZ LYS A 146 -2.861 -5.342 12.287 1.00 0.00 N ATOM 0 H LYS A 146 -1.340 0.342 7.656 1.00 0.00 H new ATOM 0 HA LYS A 146 -0.784 -2.558 7.815 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -2.991 -0.934 9.037 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.415 -2.493 8.359 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -1.223 -3.198 9.821 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -1.799 -1.844 10.773 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -4.137 -2.963 10.628 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -3.291 -4.385 10.053 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -1.866 -3.472 12.350 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -3.567 -3.401 12.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -2.630 -5.561 13.277 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -3.805 -5.714 12.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -2.157 -5.783 11.662 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.399 -2.421 5.389 1.00 0.00 N ATOM 2156 CA ILE A 147 -1.878 -2.556 4.019 1.00 0.00 C ATOM 2157 C ILE A 147 -2.945 -3.640 3.914 1.00 0.00 C ATOM 2158 O ILE A 147 -2.686 -4.809 4.196 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.726 -2.890 3.051 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.443 -1.925 3.258 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.212 -2.841 1.610 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.758 -2.446 2.722 1.00 0.00 C ATOM 0 H ILE A 147 -0.477 -2.823 5.555 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.311 -1.595 3.739 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.378 -3.901 3.262 1.00 0.00 H new ATOM 0 HG12 ILE A 147 0.212 -0.977 2.772 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.550 -1.719 4.323 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.386 -3.079 0.939 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -2.013 -3.567 1.471 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.585 -1.842 1.386 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.542 -1.710 2.903 1.00 0.00 H new ATOM 0 HD12 ILE A 147 2.012 -3.379 3.226 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.669 -2.625 1.650 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.146 -3.242 3.508 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.254 -4.180 3.366 1.00 0.00 C ATOM 2176 C ARG A 148 -5.580 -4.418 1.895 1.00 0.00 C ATOM 2177 O ARG A 148 -5.310 -3.572 1.044 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.491 -3.653 4.097 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.364 -3.691 5.610 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.310 -2.703 6.275 1.00 0.00 C ATOM 2181 NE ARG A 148 -6.678 -2.006 7.392 1.00 0.00 N ATOM 2182 CZ ARG A 148 -7.352 -1.382 8.355 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -8.679 -1.366 8.342 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -6.697 -0.774 9.335 1.00 0.00 N ATOM 0 H ARG A 148 -4.377 -2.277 3.272 1.00 0.00 H new ATOM 0 HA ARG A 148 -4.954 -5.129 3.811 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.679 -2.627 3.782 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.358 -4.242 3.798 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -6.577 -4.698 5.969 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.337 -3.462 5.896 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -7.649 -1.974 5.539 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -8.194 -3.232 6.631 1.00 0.00 H new ATOM 0 HE ARG A 148 -5.659 -1.997 7.437 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -9.187 -1.834 7.591 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -9.191 -0.886 9.083 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -5.677 -0.785 9.350 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -7.213 -0.296 10.073 1.00 0.00 H new ATOM 2198 N SER A 149 -6.165 -5.576 1.605 1.00 0.00 N ATOM 2199 CA SER A 149 -6.530 -5.926 0.237 1.00 0.00 C ATOM 2200 C SER A 149 -7.959 -6.456 0.173 1.00 0.00 C ATOM 2201 O SER A 149 -8.361 -7.286 0.988 1.00 0.00 O ATOM 2202 CB SER A 149 -5.561 -6.971 -0.320 1.00 0.00 C ATOM 2203 OG SER A 149 -6.083 -7.580 -1.487 1.00 0.00 O ATOM 0 H SER A 149 -6.396 -6.287 2.299 1.00 0.00 H new ATOM 0 HA SER A 149 -6.469 -5.023 -0.371 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.605 -6.500 -0.549 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.368 -7.732 0.436 1.00 0.00 H new ATOM 0 HG SER A 149 -5.444 -8.242 -1.824 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.722 -5.970 -0.801 1.00 0.00 N ATOM 2210 CA CYS A 150 -10.106 -6.394 -0.970 1.00 0.00 C ATOM 2211 C CYS A 150 -10.222 -7.446 -2.070 1.00 0.00 C ATOM 2212 O CYS A 150 -11.195 -7.465 -2.824 1.00 0.00 O ATOM 2213 CB CYS A 150 -10.993 -5.193 -1.302 1.00 0.00 C ATOM 2214 SG CYS A 150 -10.516 -4.318 -2.810 1.00 0.00 S ATOM 0 H CYS A 150 -8.405 -5.283 -1.485 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.441 -6.836 -0.032 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -12.024 -5.533 -1.403 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -10.968 -4.494 -0.466 1.00 0.00 H new ATOM 0 HG CYS A 150 -10.184 -3.096 -2.516 1.00 0.00 H new ATOM 2220 N ALA A 151 -9.223 -8.318 -2.154 1.00 0.00 N ATOM 2221 CA ALA A 151 -9.213 -9.373 -3.161 1.00 0.00 C ATOM 2222 C ALA A 151 -10.057 -10.563 -2.718 1.00 0.00 C ATOM 2223 O ALA A 151 -10.516 -10.621 -1.578 1.00 0.00 O ATOM 2224 CB ALA A 151 -7.785 -9.813 -3.448 1.00 0.00 C ATOM 0 H ALA A 151 -8.410 -8.315 -1.538 1.00 0.00 H new ATOM 0 HA ALA A 151 -9.650 -8.973 -4.076 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -7.791 -10.601 -4.201 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -7.210 -8.964 -3.816 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -7.330 -10.190 -2.532 1.00 0.00 H new