USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=27 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+ -162:sc= -0.182 (180deg=-0.837) USER MOD Set 1.2: A 136 ASN : amide:sc=-5.22e-05 X(o=-0.18,f=-0.21) USER MOD Set 2.1: A 65 THR OG1 : rot -160:sc= 0 USER MOD Set 2.2: A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot -170:sc= -0.302 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -1.13 K(o=-1.1,f=0) USER MOD Single : A 24 SER OG : rot 180:sc= -0.0592 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -134:sc= -6.43! (180deg=-12.6!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 130:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= -0.0964 K(o=-0.096,f=-0.64) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=-0.0073) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.192 USER MOD Single : A 51 HIS : no HD1:sc= -0.0286 K(o=-0.029,f=-0.99) USER MOD Single : A 59 SER OG : rot 180:sc= -1.36 USER MOD Single : A 63 GLN : amide:sc= -1.06 K(o=-1.1,f=-3!) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= -0.0767 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 180:sc= 0.076 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 150:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.0805 K(o=-0.081,f=-1.4!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 23:sc= 0.0414 USER MOD Single : A 104 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 LYS NZ :NH3+ -163:sc= -0.147 (180deg=-0.538) USER MOD Single : A 114 MET CE :methyl -149:sc= -0.0592 (180deg=-2.18) USER MOD Single : A 119 SER OG : rot 146:sc= 1.16 USER MOD Single : A 120 ASN : amide:sc= -4.8! C(o=-4.8!,f=-12!) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 180:sc= 0 USER MOD Single : A 126 CYS SG : rot 140:sc= -0.034 USER MOD Single : A 127 ASN : amide:sc= -1 K(o=-1,f=-2.8!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0577 USER MOD Single : A 144 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 146 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.425) USER MOD Single : A 149 SER OG : rot -149:sc= 1.55 USER MOD Single : A 150 CYS SG : rot -123:sc= -0.293 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -6.445 -10.255 9.603 1.00 0.00 N ATOM 88 CA ASP A 9 -7.413 -9.211 9.917 1.00 0.00 C ATOM 89 C ASP A 9 -8.305 -8.918 8.714 1.00 0.00 C ATOM 90 O ASP A 9 -7.835 -8.438 7.683 1.00 0.00 O ATOM 91 CB ASP A 9 -6.693 -7.934 10.357 1.00 0.00 C ATOM 92 CG ASP A 9 -7.348 -7.289 11.563 1.00 0.00 C ATOM 93 OD1 ASP A 9 -8.409 -6.651 11.392 1.00 0.00 O ATOM 94 OD2 ASP A 9 -6.802 -7.423 12.678 1.00 0.00 O ATOM 0 HA ASP A 9 -8.041 -9.565 10.735 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -5.655 -8.168 10.592 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -6.680 -7.224 9.530 1.00 0.00 H new ATOM 99 N ILE A 10 -9.594 -9.210 8.855 1.00 0.00 N ATOM 100 CA ILE A 10 -10.551 -8.979 7.781 1.00 0.00 C ATOM 101 C ILE A 10 -11.698 -8.088 8.249 1.00 0.00 C ATOM 102 O ILE A 10 -12.463 -8.460 9.139 1.00 0.00 O ATOM 103 CB ILE A 10 -11.126 -10.306 7.245 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.047 -10.048 6.050 1.00 0.00 C ATOM 105 CG2 ILE A 10 -11.871 -11.048 8.345 1.00 0.00 C ATOM 106 CD1 ILE A 10 -11.876 -11.049 4.927 1.00 0.00 C ATOM 0 H ILE A 10 -9.999 -9.607 9.703 1.00 0.00 H new ATOM 0 HA ILE A 10 -10.012 -8.477 6.978 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.297 -10.930 6.911 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -13.083 -10.068 6.389 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -11.857 -9.046 5.665 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.270 -11.982 7.948 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.187 -11.265 9.165 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.691 -10.430 8.710 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -12.560 -10.804 4.114 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -10.850 -11.013 4.561 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -12.095 -12.051 5.296 1.00 0.00 H new ATOM 118 N VAL A 11 -11.811 -6.910 7.643 1.00 0.00 N ATOM 119 CA VAL A 11 -12.864 -5.967 7.997 1.00 0.00 C ATOM 120 C VAL A 11 -13.821 -5.750 6.831 1.00 0.00 C ATOM 121 O VAL A 11 -13.480 -5.092 5.847 1.00 0.00 O ATOM 122 CB VAL A 11 -12.280 -4.607 8.426 1.00 0.00 C ATOM 123 CG1 VAL A 11 -13.373 -3.707 8.980 1.00 0.00 C ATOM 124 CG2 VAL A 11 -11.170 -4.802 9.448 1.00 0.00 C ATOM 0 H VAL A 11 -11.186 -6.587 6.905 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.408 -6.401 8.836 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.853 -4.122 7.548 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -12.941 -2.751 9.278 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -14.130 -3.540 8.214 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -13.832 -4.183 9.846 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -10.769 -3.831 9.740 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -11.569 -5.309 10.327 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.375 -5.406 9.011 1.00 0.00 H new ATOM 134 N GLY A 12 -15.023 -6.308 6.945 1.00 0.00 N ATOM 135 CA GLY A 12 -16.010 -6.164 5.893 1.00 0.00 C ATOM 136 C GLY A 12 -15.567 -6.801 4.590 1.00 0.00 C ATOM 137 O GLY A 12 -15.895 -7.954 4.313 1.00 0.00 O ATOM 0 H GLY A 12 -15.330 -6.857 7.748 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -16.948 -6.617 6.215 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.208 -5.105 5.727 1.00 0.00 H new ATOM 141 N ILE A 13 -14.820 -6.048 3.790 1.00 0.00 N ATOM 142 CA ILE A 13 -14.330 -6.546 2.510 1.00 0.00 C ATOM 143 C ILE A 13 -12.862 -6.189 2.306 1.00 0.00 C ATOM 144 O ILE A 13 -12.411 -5.991 1.177 1.00 0.00 O ATOM 145 CB ILE A 13 -15.152 -5.982 1.335 1.00 0.00 C ATOM 146 CG1 ILE A 13 -15.319 -4.468 1.478 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.508 -6.666 1.261 1.00 0.00 C ATOM 148 CD1 ILE A 13 -15.136 -3.714 0.178 1.00 0.00 C ATOM 0 H ILE A 13 -14.541 -5.091 4.005 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.438 -7.630 2.531 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.615 -6.182 0.408 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -16.312 -4.256 1.875 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.598 -4.098 2.208 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -17.077 -6.257 0.426 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.368 -7.737 1.114 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -17.053 -6.495 2.190 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -15.268 -2.647 0.355 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -14.134 -3.896 -0.210 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -15.874 -4.056 -0.548 1.00 0.00 H new ATOM 160 N TRP A 14 -12.118 -6.108 3.405 1.00 0.00 N ATOM 161 CA TRP A 14 -10.700 -5.776 3.346 1.00 0.00 C ATOM 162 C TRP A 14 -9.885 -6.706 4.238 1.00 0.00 C ATOM 163 O TRP A 14 -10.102 -6.770 5.449 1.00 0.00 O ATOM 164 CB TRP A 14 -10.476 -4.322 3.769 1.00 0.00 C ATOM 165 CG TRP A 14 -11.230 -3.337 2.930 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.541 -2.981 3.062 1.00 0.00 C ATOM 167 CD2 TRP A 14 -10.717 -2.579 1.828 1.00 0.00 C ATOM 168 NE1 TRP A 14 -12.876 -2.049 2.109 1.00 0.00 N ATOM 169 CE2 TRP A 14 -11.773 -1.785 1.340 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.467 -2.493 1.208 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.617 -0.919 0.261 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.314 -1.633 0.136 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.382 -0.856 -0.327 1.00 0.00 C ATOM 0 H TRP A 14 -12.475 -6.268 4.347 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.367 -5.904 2.316 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -10.774 -4.204 4.811 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.411 -4.095 3.714 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -13.217 -3.374 3.807 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -13.796 -1.623 1.993 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -8.636 -3.087 1.560 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.440 -0.319 -0.099 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.354 -1.560 -0.352 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -10.229 -0.193 -1.166 1.00 0.00 H new ATOM 184 N TRP A 15 -8.946 -7.427 3.633 1.00 0.00 N ATOM 185 CA TRP A 15 -8.098 -8.354 4.372 1.00 0.00 C ATOM 186 C TRP A 15 -6.651 -7.871 4.390 1.00 0.00 C ATOM 187 O TRP A 15 -6.040 -7.671 3.341 1.00 0.00 O ATOM 188 CB TRP A 15 -8.174 -9.751 3.754 1.00 0.00 C ATOM 189 CG TRP A 15 -7.954 -9.758 2.272 1.00 0.00 C ATOM 190 CD1 TRP A 15 -8.905 -9.610 1.303 1.00 0.00 C ATOM 191 CD2 TRP A 15 -6.706 -9.922 1.590 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.323 -9.671 0.060 1.00 0.00 N ATOM 193 CE2 TRP A 15 -6.974 -9.861 0.210 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.387 -10.112 2.012 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -5.973 -9.986 -0.750 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.394 -10.235 1.059 1.00 0.00 C ATOM 197 CH2 TRP A 15 -4.691 -10.171 -0.308 1.00 0.00 C ATOM 0 H TRP A 15 -8.754 -7.387 2.632 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.460 -8.399 5.399 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.429 -10.391 4.228 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.151 -10.184 3.971 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.959 -9.466 1.487 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.815 -9.588 -0.830 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.148 -10.162 3.064 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.200 -9.939 -1.805 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.372 -10.383 1.374 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -3.892 -10.270 -1.028 1.00 0.00 H new ATOM 208 N THR A 16 -6.108 -7.689 5.589 1.00 0.00 N ATOM 209 CA THR A 16 -4.733 -7.230 5.743 1.00 0.00 C ATOM 210 C THR A 16 -3.758 -8.209 5.094 1.00 0.00 C ATOM 211 O THR A 16 -3.909 -9.424 5.218 1.00 0.00 O ATOM 212 CB THR A 16 -4.391 -7.058 7.224 1.00 0.00 C ATOM 213 OG1 THR A 16 -5.323 -6.199 7.857 1.00 0.00 O ATOM 214 CG2 THR A 16 -3.009 -6.489 7.458 1.00 0.00 C ATOM 0 H THR A 16 -6.599 -7.852 6.468 1.00 0.00 H new ATOM 0 HA THR A 16 -4.640 -6.266 5.243 1.00 0.00 H new ATOM 0 HB THR A 16 -4.428 -8.062 7.647 1.00 0.00 H new ATOM 0 HG1 THR A 16 -5.003 -5.975 8.756 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.832 -6.393 8.529 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.263 -7.155 7.025 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.935 -5.508 6.989 1.00 0.00 H new ATOM 222 N VAL A 17 -2.760 -7.670 4.401 1.00 0.00 N ATOM 223 CA VAL A 17 -1.762 -8.495 3.732 1.00 0.00 C ATOM 224 C VAL A 17 -0.750 -9.053 4.728 1.00 0.00 C ATOM 225 O VAL A 17 -0.332 -8.361 5.657 1.00 0.00 O ATOM 226 CB VAL A 17 -1.012 -7.699 2.647 1.00 0.00 C ATOM 227 CG1 VAL A 17 -1.946 -7.348 1.500 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.388 -6.445 3.241 1.00 0.00 C ATOM 0 H VAL A 17 -2.621 -6.666 4.288 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.298 -9.320 3.263 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.210 -8.323 2.252 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.398 -6.786 0.744 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.339 -8.263 1.058 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.771 -6.743 1.875 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.138 -5.895 2.460 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.170 -5.815 3.665 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.316 -6.725 4.024 1.00 0.00 H new ATOM 238 N SER A 18 -0.359 -10.306 4.525 1.00 0.00 N ATOM 239 CA SER A 18 0.606 -10.957 5.405 1.00 0.00 C ATOM 240 C SER A 18 2.014 -10.863 4.828 1.00 0.00 C ATOM 241 O SER A 18 2.987 -10.689 5.563 1.00 0.00 O ATOM 242 CB SER A 18 0.225 -12.423 5.618 1.00 0.00 C ATOM 243 OG SER A 18 -0.554 -12.582 6.791 1.00 0.00 O ATOM 0 H SER A 18 -0.695 -10.891 3.760 1.00 0.00 H new ATOM 0 HA SER A 18 0.591 -10.443 6.366 1.00 0.00 H new ATOM 0 HB2 SER A 18 -0.333 -12.786 4.755 1.00 0.00 H new ATOM 0 HB3 SER A 18 1.128 -13.030 5.692 1.00 0.00 H new ATOM 0 HG SER A 18 -0.786 -13.527 6.904 1.00 0.00 H new ATOM 249 N ASN A 19 2.118 -10.982 3.508 1.00 0.00 N ATOM 250 CA ASN A 19 3.409 -10.912 2.833 1.00 0.00 C ATOM 251 C ASN A 19 3.311 -10.086 1.554 1.00 0.00 C ATOM 252 O ASN A 19 2.218 -9.712 1.127 1.00 0.00 O ATOM 253 CB ASN A 19 3.920 -12.318 2.509 1.00 0.00 C ATOM 254 CG ASN A 19 2.832 -13.219 1.955 1.00 0.00 C ATOM 255 OD1 ASN A 19 2.196 -13.971 2.694 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.615 -13.148 0.647 1.00 0.00 N ATOM 0 H ASN A 19 1.324 -11.127 2.885 1.00 0.00 H new ATOM 0 HA ASN A 19 4.115 -10.425 3.506 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.732 -12.248 1.786 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.335 -12.767 3.411 1.00 0.00 H new ATOM 0 HD21 ASN A 19 1.897 -13.731 0.217 1.00 0.00 H new ATOM 0 HD22 ASN A 19 3.166 -12.510 0.072 1.00 0.00 H new ATOM 263 N PHE A 20 4.460 -9.806 0.947 1.00 0.00 N ATOM 264 CA PHE A 20 4.505 -9.024 -0.283 1.00 0.00 C ATOM 265 C PHE A 20 3.701 -9.701 -1.389 1.00 0.00 C ATOM 266 O PHE A 20 2.944 -9.048 -2.107 1.00 0.00 O ATOM 267 CB PHE A 20 5.954 -8.829 -0.734 1.00 0.00 C ATOM 268 CG PHE A 20 6.089 -8.006 -1.983 1.00 0.00 C ATOM 269 CD1 PHE A 20 5.966 -6.627 -1.937 1.00 0.00 C ATOM 270 CD2 PHE A 20 6.342 -8.613 -3.203 1.00 0.00 C ATOM 271 CE1 PHE A 20 6.091 -5.867 -3.085 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.468 -7.858 -4.354 1.00 0.00 C ATOM 273 CZ PHE A 20 6.343 -6.484 -4.295 1.00 0.00 C ATOM 0 H PHE A 20 5.373 -10.109 1.287 1.00 0.00 H new ATOM 0 HA PHE A 20 4.060 -8.050 -0.082 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.514 -8.350 0.069 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.408 -9.806 -0.901 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.770 -6.140 -0.993 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.442 -9.687 -3.255 1.00 0.00 H new ATOM 0 HE1 PHE A 20 5.992 -4.793 -3.036 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.664 -8.343 -5.299 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.442 -5.893 -5.193 1.00 0.00 H new ATOM 283 N GLY A 21 3.870 -11.013 -1.520 1.00 0.00 N ATOM 284 CA GLY A 21 3.153 -11.757 -2.540 1.00 0.00 C ATOM 285 C GLY A 21 1.651 -11.566 -2.449 1.00 0.00 C ATOM 286 O GLY A 21 0.942 -11.684 -3.448 1.00 0.00 O ATOM 0 H GLY A 21 4.491 -11.575 -0.938 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.497 -11.442 -3.525 1.00 0.00 H new ATOM 0 HA3 GLY A 21 3.388 -12.817 -2.445 1.00 0.00 H new ATOM 290 N GLU A 22 1.166 -11.271 -1.247 1.00 0.00 N ATOM 291 CA GLU A 22 -0.261 -11.063 -1.028 1.00 0.00 C ATOM 292 C GLU A 22 -0.678 -9.661 -1.460 1.00 0.00 C ATOM 293 O GLU A 22 -1.815 -9.442 -1.879 1.00 0.00 O ATOM 294 CB GLU A 22 -0.608 -11.279 0.447 1.00 0.00 C ATOM 295 CG GLU A 22 -0.799 -12.739 0.820 1.00 0.00 C ATOM 296 CD GLU A 22 -2.155 -13.275 0.406 1.00 0.00 C ATOM 297 OE1 GLU A 22 -2.432 -13.311 -0.811 1.00 0.00 O ATOM 298 OE2 GLU A 22 -2.939 -13.659 1.298 1.00 0.00 O ATOM 0 H GLU A 22 1.740 -11.171 -0.410 1.00 0.00 H new ATOM 0 HA GLU A 22 -0.806 -11.788 -1.633 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.185 -10.856 1.064 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.521 -10.731 0.681 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.018 -13.335 0.349 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.681 -12.853 1.898 1.00 0.00 H new ATOM 305 N ILE A 23 0.249 -8.714 -1.356 1.00 0.00 N ATOM 306 CA ILE A 23 -0.022 -7.333 -1.737 1.00 0.00 C ATOM 307 C ILE A 23 -0.152 -7.197 -3.250 1.00 0.00 C ATOM 308 O ILE A 23 0.846 -7.089 -3.961 1.00 0.00 O ATOM 309 CB ILE A 23 1.085 -6.384 -1.239 1.00 0.00 C ATOM 310 CG1 ILE A 23 1.357 -6.615 0.248 1.00 0.00 C ATOM 311 CG2 ILE A 23 0.694 -4.935 -1.493 1.00 0.00 C ATOM 312 CD1 ILE A 23 2.505 -5.788 0.787 1.00 0.00 C ATOM 0 H ILE A 23 1.195 -8.878 -1.011 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.965 -7.054 -1.267 1.00 0.00 H new ATOM 0 HB ILE A 23 2.000 -6.596 -1.792 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.455 -6.383 0.815 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.573 -7.671 0.410 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.486 -4.277 -1.136 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.547 -4.780 -2.562 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.232 -4.710 -0.963 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.642 -6.002 1.847 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.418 -6.037 0.246 1.00 0.00 H new ATOM 0 HD13 ILE A 23 2.283 -4.729 0.657 1.00 0.00 H new ATOM 324 N SER A 24 -1.389 -7.201 -3.735 1.00 0.00 N ATOM 325 CA SER A 24 -1.651 -7.078 -5.164 1.00 0.00 C ATOM 326 C SER A 24 -3.018 -6.450 -5.414 1.00 0.00 C ATOM 327 O SER A 24 -3.877 -6.436 -4.532 1.00 0.00 O ATOM 328 CB SER A 24 -1.575 -8.449 -5.839 1.00 0.00 C ATOM 329 OG SER A 24 -0.306 -9.045 -5.641 1.00 0.00 O ATOM 0 H SER A 24 -2.226 -7.288 -3.159 1.00 0.00 H new ATOM 0 HA SER A 24 -0.888 -6.428 -5.593 1.00 0.00 H new ATOM 0 HB2 SER A 24 -2.352 -9.099 -5.437 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.768 -8.343 -6.907 1.00 0.00 H new ATOM 0 HG SER A 24 -0.284 -9.921 -6.081 1.00 0.00 H new ATOM 335 N GLY A 25 -3.214 -5.931 -6.622 1.00 0.00 N ATOM 336 CA GLY A 25 -4.479 -5.308 -6.965 1.00 0.00 C ATOM 337 C GLY A 25 -4.785 -4.102 -6.101 1.00 0.00 C ATOM 338 O GLY A 25 -3.875 -3.409 -5.646 1.00 0.00 O ATOM 0 H GLY A 25 -2.520 -5.931 -7.369 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.459 -5.005 -8.012 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.281 -6.039 -6.860 1.00 0.00 H new ATOM 342 N THR A 26 -6.070 -3.850 -5.871 1.00 0.00 N ATOM 343 CA THR A 26 -6.493 -2.719 -5.055 1.00 0.00 C ATOM 344 C THR A 26 -6.162 -2.955 -3.585 1.00 0.00 C ATOM 345 O THR A 26 -6.465 -4.012 -3.032 1.00 0.00 O ATOM 346 CB THR A 26 -7.995 -2.479 -5.217 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.343 -2.394 -6.588 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.474 -1.211 -4.544 1.00 0.00 C ATOM 0 H THR A 26 -6.836 -4.414 -6.239 1.00 0.00 H new ATOM 0 HA THR A 26 -5.952 -1.836 -5.395 1.00 0.00 H new ATOM 0 HB THR A 26 -8.478 -3.331 -4.738 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.308 -2.242 -6.672 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.548 -1.101 -4.697 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.263 -1.264 -3.476 1.00 0.00 H new ATOM 0 HG23 THR A 26 -7.956 -0.353 -4.974 1.00 0.00 H new ATOM 356 N ILE A 27 -5.537 -1.964 -2.958 1.00 0.00 N ATOM 357 CA ILE A 27 -5.164 -2.064 -1.552 1.00 0.00 C ATOM 358 C ILE A 27 -5.197 -0.698 -0.876 1.00 0.00 C ATOM 359 O ILE A 27 -4.915 0.323 -1.504 1.00 0.00 O ATOM 360 CB ILE A 27 -3.758 -2.673 -1.386 1.00 0.00 C ATOM 361 CG1 ILE A 27 -2.722 -1.834 -2.136 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.742 -4.111 -1.878 1.00 0.00 C ATOM 363 CD1 ILE A 27 -1.295 -2.255 -1.868 1.00 0.00 C ATOM 0 H ILE A 27 -5.278 -1.083 -3.401 1.00 0.00 H new ATOM 0 HA ILE A 27 -5.894 -2.719 -1.077 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.500 -2.670 -0.327 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -2.917 -1.902 -3.206 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -2.842 -0.788 -1.856 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.742 -4.527 -1.754 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.454 -4.701 -1.301 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -4.018 -4.138 -2.932 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -0.615 -1.617 -2.433 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.082 -2.160 -0.803 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.158 -3.292 -2.175 1.00 0.00 H new ATOM 375 N ALA A 28 -5.546 -0.687 0.406 1.00 0.00 N ATOM 376 CA ALA A 28 -5.616 0.554 1.167 1.00 0.00 C ATOM 377 C ALA A 28 -4.453 0.667 2.145 1.00 0.00 C ATOM 378 O ALA A 28 -3.924 -0.341 2.615 1.00 0.00 O ATOM 379 CB ALA A 28 -6.942 0.642 1.909 1.00 0.00 C ATOM 0 H ALA A 28 -5.785 -1.523 0.939 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.547 1.385 0.465 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -6.982 1.574 2.474 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.763 0.617 1.192 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.033 -0.201 2.594 1.00 0.00 H new ATOM 385 N ILE A 29 -4.058 1.899 2.448 1.00 0.00 N ATOM 386 CA ILE A 29 -2.956 2.143 3.371 1.00 0.00 C ATOM 387 C ILE A 29 -3.381 3.075 4.500 1.00 0.00 C ATOM 388 O ILE A 29 -3.772 4.218 4.261 1.00 0.00 O ATOM 389 CB ILE A 29 -1.741 2.755 2.647 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.411 1.951 1.389 1.00 0.00 C ATOM 391 CG2 ILE A 29 -0.540 2.808 3.579 1.00 0.00 C ATOM 392 CD1 ILE A 29 -0.509 2.686 0.421 1.00 0.00 C ATOM 0 H ILE A 29 -4.485 2.744 2.068 1.00 0.00 H new ATOM 0 HA ILE A 29 -2.673 1.176 3.787 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.990 3.774 2.349 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.933 1.016 1.680 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.339 1.689 0.881 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.310 3.243 3.053 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -0.781 3.420 4.448 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.288 1.799 3.905 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.317 2.056 -0.447 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -0.994 3.608 0.100 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.435 2.924 0.912 1.00 0.00 H new ATOM 404 N GLU A 30 -3.302 2.580 5.731 1.00 0.00 N ATOM 405 CA GLU A 30 -3.679 3.369 6.898 1.00 0.00 C ATOM 406 C GLU A 30 -2.445 3.794 7.688 1.00 0.00 C ATOM 407 O GLU A 30 -1.610 2.965 8.048 1.00 0.00 O ATOM 408 CB GLU A 30 -4.623 2.570 7.798 1.00 0.00 C ATOM 409 CG GLU A 30 -5.301 3.410 8.866 1.00 0.00 C ATOM 410 CD GLU A 30 -5.811 2.578 10.026 1.00 0.00 C ATOM 411 OE1 GLU A 30 -4.986 1.913 10.688 1.00 0.00 O ATOM 412 OE2 GLU A 30 -7.035 2.591 10.273 1.00 0.00 O ATOM 0 H GLU A 30 -2.980 1.636 5.946 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.193 4.265 6.549 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.387 2.097 7.180 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.062 1.769 8.279 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -4.597 4.154 9.239 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.134 3.954 8.421 1.00 0.00 H new ATOM 419 N MET A 31 -2.338 5.092 7.953 1.00 0.00 N ATOM 420 CA MET A 31 -1.206 5.628 8.701 1.00 0.00 C ATOM 421 C MET A 31 -1.518 5.684 10.193 1.00 0.00 C ATOM 422 O MET A 31 -0.783 5.131 11.012 1.00 0.00 O ATOM 423 CB MET A 31 -0.845 7.024 8.190 1.00 0.00 C ATOM 424 CG MET A 31 -0.583 7.074 6.694 1.00 0.00 C ATOM 425 SD MET A 31 0.514 8.427 6.226 1.00 0.00 S ATOM 426 CE MET A 31 1.308 7.734 4.778 1.00 0.00 C ATOM 0 H MET A 31 -3.021 5.792 7.661 1.00 0.00 H new ATOM 0 HA MET A 31 -0.355 4.963 8.551 1.00 0.00 H new ATOM 0 HB2 MET A 31 -1.656 7.711 8.432 1.00 0.00 H new ATOM 0 HB3 MET A 31 0.041 7.377 8.718 1.00 0.00 H new ATOM 0 HG2 MET A 31 -0.145 6.129 6.374 1.00 0.00 H new ATOM 0 HG3 MET A 31 -1.531 7.181 6.166 1.00 0.00 H new ATOM 0 HE1 MET A 31 2.383 7.908 4.834 1.00 0.00 H new ATOM 0 HE2 MET A 31 1.116 6.662 4.736 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.910 8.210 3.882 1.00 0.00 H new ATOM 436 N ASP A 32 -2.611 6.356 10.539 1.00 0.00 N ATOM 437 CA ASP A 32 -3.021 6.484 11.933 1.00 0.00 C ATOM 438 C ASP A 32 -4.081 5.446 12.285 1.00 0.00 C ATOM 439 O ASP A 32 -4.572 4.727 11.416 1.00 0.00 O ATOM 440 CB ASP A 32 -3.556 7.892 12.201 1.00 0.00 C ATOM 441 CG ASP A 32 -2.494 8.818 12.759 1.00 0.00 C ATOM 442 OD1 ASP A 32 -1.362 8.808 12.233 1.00 0.00 O ATOM 443 OD2 ASP A 32 -2.795 9.555 13.722 1.00 0.00 O ATOM 0 H ASP A 32 -3.229 6.820 9.873 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.148 6.310 12.562 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -3.949 8.311 11.274 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -4.388 7.834 12.902 1.00 0.00 H new ATOM 448 N LYS A 33 -4.431 5.375 13.565 1.00 0.00 N ATOM 449 CA LYS A 33 -5.434 4.425 14.032 1.00 0.00 C ATOM 450 C LYS A 33 -6.841 4.982 13.843 1.00 0.00 C ATOM 451 O LYS A 33 -7.454 5.483 14.785 1.00 0.00 O ATOM 452 CB LYS A 33 -5.201 4.089 15.507 1.00 0.00 C ATOM 453 CG LYS A 33 -3.924 3.303 15.757 1.00 0.00 C ATOM 454 CD LYS A 33 -2.780 4.214 16.172 1.00 0.00 C ATOM 455 CE LYS A 33 -1.446 3.705 15.652 1.00 0.00 C ATOM 456 NZ LYS A 33 -0.300 4.277 16.413 1.00 0.00 N ATOM 0 H LYS A 33 -4.035 5.964 14.297 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.340 3.515 13.439 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.166 5.015 16.081 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.050 3.515 15.879 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.099 2.560 16.535 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -3.648 2.759 14.854 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.959 5.220 15.793 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -2.745 4.284 17.259 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -1.421 2.617 15.720 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.346 3.961 14.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 0.592 3.906 16.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -0.309 5.313 16.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -0.382 4.012 17.415 1.00 0.00 H new ATOM 470 N GLY A 34 -7.348 4.891 12.617 1.00 0.00 N ATOM 471 CA GLY A 34 -8.678 5.389 12.326 1.00 0.00 C ATOM 472 C GLY A 34 -8.713 6.265 11.089 1.00 0.00 C ATOM 473 O GLY A 34 -9.732 6.343 10.402 1.00 0.00 O ATOM 0 H GLY A 34 -6.860 4.481 11.821 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -9.356 4.546 12.190 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.044 5.958 13.181 1.00 0.00 H new ATOM 477 N ALA A 35 -7.596 6.927 10.804 1.00 0.00 N ATOM 478 CA ALA A 35 -7.501 7.802 9.641 1.00 0.00 C ATOM 479 C ALA A 35 -6.797 7.103 8.484 1.00 0.00 C ATOM 480 O ALA A 35 -5.971 6.213 8.693 1.00 0.00 O ATOM 481 CB ALA A 35 -6.774 9.087 10.006 1.00 0.00 C ATOM 0 H ALA A 35 -6.744 6.874 11.363 1.00 0.00 H new ATOM 0 HA ALA A 35 -8.513 8.049 9.319 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -6.710 9.731 9.129 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.321 9.603 10.796 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -5.769 8.850 10.356 1.00 0.00 H new ATOM 487 N TYR A 36 -7.130 7.510 7.264 1.00 0.00 N ATOM 488 CA TYR A 36 -6.529 6.923 6.071 1.00 0.00 C ATOM 489 C TYR A 36 -5.916 8.001 5.183 1.00 0.00 C ATOM 490 O TYR A 36 -6.154 9.193 5.383 1.00 0.00 O ATOM 491 CB TYR A 36 -7.576 6.132 5.284 1.00 0.00 C ATOM 492 CG TYR A 36 -7.992 4.842 5.954 1.00 0.00 C ATOM 493 CD1 TYR A 36 -9.054 4.814 6.849 1.00 0.00 C ATOM 494 CD2 TYR A 36 -7.322 3.653 5.692 1.00 0.00 C ATOM 495 CE1 TYR A 36 -9.438 3.636 7.464 1.00 0.00 C ATOM 496 CE2 TYR A 36 -7.700 2.473 6.302 1.00 0.00 C ATOM 497 CZ TYR A 36 -8.758 2.469 7.187 1.00 0.00 C ATOM 498 OH TYR A 36 -9.137 1.295 7.797 1.00 0.00 O ATOM 0 H TYR A 36 -7.813 8.244 7.075 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.736 6.247 6.390 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.457 6.757 5.139 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.179 5.906 4.294 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -9.588 5.727 7.068 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -6.493 3.652 5.000 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -10.266 3.630 8.157 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -7.169 1.557 6.087 1.00 0.00 H new ATOM 0 HH TYR A 36 -9.243 0.594 7.120 1.00 0.00 H new ATOM 508 N ILE A 37 -5.127 7.576 4.203 1.00 0.00 N ATOM 509 CA ILE A 37 -4.480 8.504 3.284 1.00 0.00 C ATOM 510 C ILE A 37 -5.469 9.041 2.257 1.00 0.00 C ATOM 511 O ILE A 37 -5.969 8.296 1.413 1.00 0.00 O ATOM 512 CB ILE A 37 -3.303 7.838 2.547 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.391 7.117 3.540 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.519 8.874 1.754 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.287 6.320 2.879 1.00 0.00 C ATOM 0 H ILE A 37 -4.920 6.593 4.024 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.101 9.330 3.886 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.702 7.101 1.850 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.946 7.851 4.211 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.993 6.448 4.154 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.691 8.387 1.239 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.175 9.345 1.022 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.129 9.633 2.432 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.680 5.836 3.644 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.724 5.562 2.229 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.661 6.987 2.287 1.00 0.00 H new ATOM 527 N HIS A 38 -5.751 10.337 2.334 1.00 0.00 N ATOM 528 CA HIS A 38 -6.682 10.973 1.409 1.00 0.00 C ATOM 529 C HIS A 38 -5.938 11.620 0.245 1.00 0.00 C ATOM 530 O HIS A 38 -4.748 11.917 0.346 1.00 0.00 O ATOM 531 CB HIS A 38 -7.521 12.024 2.139 1.00 0.00 C ATOM 532 CG HIS A 38 -8.750 12.435 1.388 1.00 0.00 C ATOM 533 ND1 HIS A 38 -9.863 11.636 1.241 1.00 0.00 N ATOM 534 CD2 HIS A 38 -9.030 13.591 0.735 1.00 0.00 C ATOM 535 CE1 HIS A 38 -10.763 12.316 0.517 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.306 13.508 0.186 1.00 0.00 N ATOM 0 H HIS A 38 -5.348 10.968 3.027 1.00 0.00 H new ATOM 0 HA HIS A 38 -7.342 10.202 1.011 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -7.814 11.631 3.113 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -6.906 12.905 2.323 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.368 14.440 0.654 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -11.736 11.937 0.241 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -10.788 14.222 -0.360 1.00 0.00 H new ATOM 544 N ALA A 39 -6.648 11.834 -0.857 1.00 0.00 N ATOM 545 CA ALA A 39 -6.055 12.444 -2.041 1.00 0.00 C ATOM 546 C ALA A 39 -6.722 13.777 -2.364 1.00 0.00 C ATOM 547 O ALA A 39 -7.924 13.834 -2.625 1.00 0.00 O ATOM 548 CB ALA A 39 -6.158 11.500 -3.230 1.00 0.00 C ATOM 0 H ALA A 39 -7.635 11.594 -0.955 1.00 0.00 H new ATOM 0 HA ALA A 39 -5.002 12.634 -1.832 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.711 11.969 -4.107 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.630 10.573 -3.006 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -7.207 11.281 -3.431 1.00 0.00 H new ATOM 554 N LEU A 40 -5.934 14.847 -2.344 1.00 0.00 N ATOM 555 CA LEU A 40 -6.449 16.181 -2.635 1.00 0.00 C ATOM 556 C LEU A 40 -6.635 16.377 -4.136 1.00 0.00 C ATOM 557 O LEU A 40 -6.185 15.561 -4.940 1.00 0.00 O ATOM 558 CB LEU A 40 -5.501 17.248 -2.082 1.00 0.00 C ATOM 559 CG LEU A 40 -5.586 17.470 -0.572 1.00 0.00 C ATOM 560 CD1 LEU A 40 -4.412 18.307 -0.089 1.00 0.00 C ATOM 561 CD2 LEU A 40 -6.904 18.137 -0.206 1.00 0.00 C ATOM 0 H LEU A 40 -4.937 14.817 -2.130 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.420 16.282 -2.151 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.478 16.970 -2.336 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.709 18.192 -2.585 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.542 16.500 -0.078 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.489 18.455 0.988 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.479 17.792 -0.319 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -4.425 19.275 -0.590 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.948 18.288 0.873 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -6.977 19.101 -0.710 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.733 17.501 -0.518 1.00 0.00 H new ATOM 573 N ASP A 41 -7.300 17.467 -4.507 1.00 0.00 N ATOM 574 CA ASP A 41 -7.545 17.772 -5.912 1.00 0.00 C ATOM 575 C ASP A 41 -6.405 18.600 -6.495 1.00 0.00 C ATOM 576 O ASP A 41 -6.088 18.489 -7.680 1.00 0.00 O ATOM 577 CB ASP A 41 -8.868 18.522 -6.069 1.00 0.00 C ATOM 578 CG ASP A 41 -8.963 19.725 -5.152 1.00 0.00 C ATOM 579 OD1 ASP A 41 -8.379 20.777 -5.488 1.00 0.00 O ATOM 580 OD2 ASP A 41 -9.622 19.617 -4.096 1.00 0.00 O ATOM 0 H ASP A 41 -7.679 18.153 -3.854 1.00 0.00 H new ATOM 0 HA ASP A 41 -7.602 16.830 -6.458 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -8.977 18.848 -7.103 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -9.694 17.843 -5.860 1.00 0.00 H new ATOM 585 N ASN A 42 -5.793 19.429 -5.657 1.00 0.00 N ATOM 586 CA ASN A 42 -4.688 20.277 -6.091 1.00 0.00 C ATOM 587 C ASN A 42 -3.484 19.434 -6.498 1.00 0.00 C ATOM 588 O ASN A 42 -2.729 19.805 -7.397 1.00 0.00 O ATOM 589 CB ASN A 42 -4.293 21.245 -4.975 1.00 0.00 C ATOM 590 CG ASN A 42 -3.398 22.364 -5.471 1.00 0.00 C ATOM 591 OD1 ASN A 42 -3.790 23.156 -6.328 1.00 0.00 O ATOM 592 ND2 ASN A 42 -2.186 22.435 -4.933 1.00 0.00 N ATOM 0 H ASN A 42 -6.043 19.532 -4.673 1.00 0.00 H new ATOM 0 HA ASN A 42 -5.019 20.848 -6.958 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -5.193 21.672 -4.533 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -3.780 20.696 -4.186 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -1.539 23.167 -5.227 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -1.902 21.758 -4.225 1.00 0.00 H new ATOM 599 N GLY A 43 -3.309 18.298 -5.830 1.00 0.00 N ATOM 600 CA GLY A 43 -2.195 17.420 -6.137 1.00 0.00 C ATOM 601 C GLY A 43 -1.371 17.081 -4.911 1.00 0.00 C ATOM 602 O GLY A 43 -0.141 17.057 -4.968 1.00 0.00 O ATOM 0 H GLY A 43 -3.919 17.970 -5.081 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.573 16.500 -6.583 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.556 17.895 -6.881 1.00 0.00 H new ATOM 606 N LEU A 44 -2.049 16.818 -3.798 1.00 0.00 N ATOM 607 CA LEU A 44 -1.372 16.478 -2.552 1.00 0.00 C ATOM 608 C LEU A 44 -2.123 15.379 -1.808 1.00 0.00 C ATOM 609 O LEU A 44 -3.197 14.951 -2.231 1.00 0.00 O ATOM 610 CB LEU A 44 -1.243 17.716 -1.664 1.00 0.00 C ATOM 611 CG LEU A 44 -0.449 18.871 -2.274 1.00 0.00 C ATOM 612 CD1 LEU A 44 -0.960 20.205 -1.750 1.00 0.00 C ATOM 613 CD2 LEU A 44 1.034 18.713 -1.978 1.00 0.00 C ATOM 0 H LEU A 44 -3.067 16.834 -3.734 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.376 16.110 -2.797 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.243 18.073 -1.417 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.769 17.424 -0.727 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.587 18.851 -3.355 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.383 21.016 -2.195 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.011 20.321 -2.013 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.852 20.235 -0.666 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.584 19.544 -2.420 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.191 18.707 -0.899 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.392 17.775 -2.402 1.00 0.00 H new ATOM 625 N PHE A 45 -1.551 14.925 -0.698 1.00 0.00 N ATOM 626 CA PHE A 45 -2.166 13.876 0.106 1.00 0.00 C ATOM 627 C PHE A 45 -2.080 14.208 1.592 1.00 0.00 C ATOM 628 O PHE A 45 -0.990 14.352 2.143 1.00 0.00 O ATOM 629 CB PHE A 45 -1.491 12.532 -0.170 1.00 0.00 C ATOM 630 CG PHE A 45 -1.822 11.959 -1.518 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.286 12.511 -2.670 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.670 10.869 -1.633 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.589 11.986 -3.913 1.00 0.00 C ATOM 634 CE2 PHE A 45 -2.976 10.340 -2.872 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.436 10.899 -4.013 1.00 0.00 C ATOM 0 H PHE A 45 -0.662 15.268 -0.335 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.218 13.809 -0.171 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.411 12.655 -0.092 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.788 11.821 0.601 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.624 13.361 -2.597 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.096 10.428 -0.744 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.164 12.425 -4.804 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.637 9.490 -2.948 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.675 10.487 -4.982 1.00 0.00 H new ATOM 645 N THR A 46 -3.238 14.326 2.234 1.00 0.00 N ATOM 646 CA THR A 46 -3.296 14.640 3.657 1.00 0.00 C ATOM 647 C THR A 46 -4.118 13.600 4.410 1.00 0.00 C ATOM 648 O THR A 46 -4.835 12.804 3.805 1.00 0.00 O ATOM 649 CB THR A 46 -3.894 16.033 3.867 1.00 0.00 C ATOM 650 OG1 THR A 46 -3.914 16.369 5.244 1.00 0.00 O ATOM 651 CG2 THR A 46 -5.307 16.163 3.341 1.00 0.00 C ATOM 0 H THR A 46 -4.149 14.209 1.791 1.00 0.00 H new ATOM 0 HA THR A 46 -2.280 14.625 4.050 1.00 0.00 H new ATOM 0 HB THR A 46 -3.251 16.711 3.305 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.298 17.263 5.357 1.00 0.00 H new ATOM 0 HG21 THR A 46 -5.671 17.174 3.522 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.317 15.960 2.270 1.00 0.00 H new ATOM 0 HG23 THR A 46 -5.953 15.448 3.852 1.00 0.00 H new ATOM 659 N LEU A 47 -4.010 13.613 5.735 1.00 0.00 N ATOM 660 CA LEU A 47 -4.744 12.670 6.573 1.00 0.00 C ATOM 661 C LEU A 47 -6.245 12.768 6.319 1.00 0.00 C ATOM 662 O LEU A 47 -6.857 13.810 6.553 1.00 0.00 O ATOM 663 CB LEU A 47 -4.447 12.932 8.051 1.00 0.00 C ATOM 664 CG LEU A 47 -4.720 11.752 8.985 1.00 0.00 C ATOM 665 CD1 LEU A 47 -3.940 10.526 8.539 1.00 0.00 C ATOM 666 CD2 LEU A 47 -4.369 12.118 10.419 1.00 0.00 C ATOM 0 H LEU A 47 -3.421 14.266 6.252 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.416 11.663 6.316 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.400 13.220 8.150 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -5.044 13.782 8.381 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.783 11.515 8.940 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.147 9.697 9.216 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.240 10.252 7.527 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.873 10.748 8.554 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.569 11.268 11.071 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.313 12.381 10.479 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.973 12.968 10.736 1.00 0.00 H new ATOM 678 N GLY A 48 -6.830 11.678 5.836 1.00 0.00 N ATOM 679 CA GLY A 48 -8.255 11.663 5.557 1.00 0.00 C ATOM 680 C GLY A 48 -9.095 11.677 6.819 1.00 0.00 C ATOM 681 O GLY A 48 -8.638 11.253 7.881 1.00 0.00 O ATOM 0 H GLY A 48 -6.344 10.805 5.632 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.511 12.528 4.945 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.498 10.776 4.973 1.00 0.00 H new ATOM 685 N ALA A 49 -10.325 12.164 6.702 1.00 0.00 N ATOM 686 CA ALA A 49 -11.232 12.233 7.843 1.00 0.00 C ATOM 687 C ALA A 49 -11.547 10.837 8.378 1.00 0.00 C ATOM 688 O ALA A 49 -12.219 10.048 7.714 1.00 0.00 O ATOM 689 CB ALA A 49 -12.515 12.948 7.450 1.00 0.00 C ATOM 0 H ALA A 49 -10.718 12.517 5.829 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.740 12.797 8.636 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -13.184 12.993 8.309 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -12.281 13.960 7.118 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -13.001 12.404 6.640 1.00 0.00 H new ATOM 695 N PRO A 50 -11.063 10.507 9.592 1.00 0.00 N ATOM 696 CA PRO A 50 -11.303 9.197 10.205 1.00 0.00 C ATOM 697 C PRO A 50 -12.783 8.828 10.225 1.00 0.00 C ATOM 698 O PRO A 50 -13.646 9.690 10.388 1.00 0.00 O ATOM 699 CB PRO A 50 -10.777 9.368 11.632 1.00 0.00 C ATOM 700 CG PRO A 50 -9.760 10.451 11.533 1.00 0.00 C ATOM 701 CD PRO A 50 -10.251 11.382 10.459 1.00 0.00 C ATOM 0 HA PRO A 50 -10.816 8.395 9.651 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.578 9.639 12.320 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -10.336 8.444 12.005 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -9.652 10.974 12.483 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -8.781 10.045 11.280 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -10.843 12.197 10.874 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.425 11.835 9.911 1.00 0.00 H new ATOM 709 N HIS A 51 -13.069 7.540 10.057 1.00 0.00 N ATOM 710 CA HIS A 51 -14.444 7.057 10.057 1.00 0.00 C ATOM 711 C HIS A 51 -15.052 7.143 11.452 1.00 0.00 C ATOM 712 O HIS A 51 -14.334 7.171 12.452 1.00 0.00 O ATOM 713 CB HIS A 51 -14.499 5.613 9.553 1.00 0.00 C ATOM 714 CG HIS A 51 -13.789 5.406 8.250 1.00 0.00 C ATOM 715 ND1 HIS A 51 -14.433 5.578 7.049 1.00 0.00 N ATOM 716 CD2 HIS A 51 -12.505 5.043 8.018 1.00 0.00 C ATOM 717 CE1 HIS A 51 -13.533 5.320 6.116 1.00 0.00 C ATOM 718 NE2 HIS A 51 -12.349 4.990 6.655 1.00 0.00 N ATOM 0 H HIS A 51 -12.367 6.813 9.919 1.00 0.00 H new ATOM 0 HA HIS A 51 -15.025 7.692 9.388 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -14.060 4.957 10.305 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -15.542 5.315 9.441 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -11.750 4.835 8.762 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -13.726 5.369 5.054 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -11.497 4.747 6.149 1.00 0.00 H new ATOM 726 N ARG A 52 -16.379 7.183 11.513 1.00 0.00 N ATOM 727 CA ARG A 52 -17.083 7.266 12.787 1.00 0.00 C ATOM 728 C ARG A 52 -17.267 5.880 13.398 1.00 0.00 C ATOM 729 O ARG A 52 -17.249 5.720 14.619 1.00 0.00 O ATOM 730 CB ARG A 52 -18.444 7.941 12.598 1.00 0.00 C ATOM 731 CG ARG A 52 -18.634 9.178 13.461 1.00 0.00 C ATOM 732 CD ARG A 52 -20.085 9.630 13.474 1.00 0.00 C ATOM 733 NE ARG A 52 -20.258 10.898 14.179 1.00 0.00 N ATOM 734 CZ ARG A 52 -20.187 11.027 15.501 1.00 0.00 C ATOM 735 NH1 ARG A 52 -19.947 9.970 16.266 1.00 0.00 N ATOM 736 NH2 ARG A 52 -20.357 12.218 16.061 1.00 0.00 N ATOM 0 H ARG A 52 -16.988 7.159 10.695 1.00 0.00 H new ATOM 0 HA ARG A 52 -16.481 7.866 13.469 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -18.561 8.218 11.550 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -19.231 7.223 12.828 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -18.309 8.966 14.479 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.004 9.985 13.086 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -20.441 9.734 12.449 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -20.699 8.865 13.949 1.00 0.00 H new ATOM 0 HE ARG A 52 -20.444 11.734 13.625 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -19.816 9.052 15.841 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -19.894 10.075 17.279 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -20.542 13.034 15.478 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -20.303 12.317 17.075 1.00 0.00 H new ATOM 750 N GLU A 53 -17.443 4.879 12.540 1.00 0.00 N ATOM 751 CA GLU A 53 -17.630 3.506 12.994 1.00 0.00 C ATOM 752 C GLU A 53 -16.336 2.709 12.859 1.00 0.00 C ATOM 753 O GLU A 53 -15.387 3.149 12.210 1.00 0.00 O ATOM 754 CB GLU A 53 -18.749 2.832 12.197 1.00 0.00 C ATOM 755 CG GLU A 53 -20.023 2.620 12.997 1.00 0.00 C ATOM 756 CD GLU A 53 -20.308 1.155 13.266 1.00 0.00 C ATOM 757 OE1 GLU A 53 -19.347 0.357 13.284 1.00 0.00 O ATOM 758 OE2 GLU A 53 -21.491 0.807 13.460 1.00 0.00 O ATOM 0 H GLU A 53 -17.460 4.994 11.527 1.00 0.00 H new ATOM 0 HA GLU A 53 -17.910 3.530 14.047 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -18.977 3.440 11.321 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -18.394 1.868 11.832 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -19.944 3.151 13.946 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -20.863 3.056 12.457 1.00 0.00 H new ATOM 765 N VAL A 54 -16.306 1.531 13.475 1.00 0.00 N ATOM 766 CA VAL A 54 -15.130 0.672 13.424 1.00 0.00 C ATOM 767 C VAL A 54 -15.033 -0.044 12.080 1.00 0.00 C ATOM 768 O VAL A 54 -14.098 0.183 11.311 1.00 0.00 O ATOM 769 CB VAL A 54 -15.152 -0.378 14.551 1.00 0.00 C ATOM 770 CG1 VAL A 54 -13.834 -1.136 14.599 1.00 0.00 C ATOM 771 CG2 VAL A 54 -15.446 0.281 15.889 1.00 0.00 C ATOM 0 H VAL A 54 -17.083 1.150 14.015 1.00 0.00 H new ATOM 0 HA VAL A 54 -14.261 1.316 13.555 1.00 0.00 H new ATOM 0 HB VAL A 54 -15.948 -1.093 14.342 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -13.867 -1.873 15.401 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -13.670 -1.642 13.647 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -13.019 -0.437 14.783 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -15.458 -0.476 16.673 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -14.674 1.019 16.109 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -16.417 0.774 15.846 1.00 0.00 H new ATOM 781 N ASP A 55 -16.004 -0.908 11.804 1.00 0.00 N ATOM 782 CA ASP A 55 -16.028 -1.657 10.553 1.00 0.00 C ATOM 783 C ASP A 55 -16.584 -0.802 9.419 1.00 0.00 C ATOM 784 O ASP A 55 -17.767 -0.882 9.090 1.00 0.00 O ATOM 785 CB ASP A 55 -16.867 -2.927 10.710 1.00 0.00 C ATOM 786 CG ASP A 55 -16.031 -4.126 11.111 1.00 0.00 C ATOM 787 OD1 ASP A 55 -15.504 -4.130 12.243 1.00 0.00 O ATOM 788 OD2 ASP A 55 -15.904 -5.061 10.293 1.00 0.00 O ATOM 0 H ASP A 55 -16.785 -1.107 12.430 1.00 0.00 H new ATOM 0 HA ASP A 55 -15.004 -1.936 10.305 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -17.639 -2.759 11.461 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -17.377 -3.141 9.771 1.00 0.00 H new ATOM 793 N GLU A 56 -15.721 0.015 8.824 1.00 0.00 N ATOM 794 CA GLU A 56 -16.126 0.886 7.725 1.00 0.00 C ATOM 795 C GLU A 56 -15.133 0.799 6.570 1.00 0.00 C ATOM 796 O GLU A 56 -13.967 0.461 6.764 1.00 0.00 O ATOM 797 CB GLU A 56 -16.240 2.332 8.208 1.00 0.00 C ATOM 798 CG GLU A 56 -17.336 3.122 7.512 1.00 0.00 C ATOM 799 CD GLU A 56 -18.718 2.557 7.774 1.00 0.00 C ATOM 800 OE1 GLU A 56 -19.213 2.705 8.911 1.00 0.00 O ATOM 801 OE2 GLU A 56 -19.305 1.965 6.844 1.00 0.00 O ATOM 0 H GLU A 56 -14.738 0.093 9.084 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.101 0.553 7.369 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -16.428 2.334 9.282 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -15.286 2.835 8.051 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -17.301 4.158 7.848 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -17.148 3.129 6.438 1.00 0.00 H new ATOM 808 N GLY A 57 -15.606 1.110 5.366 1.00 0.00 N ATOM 809 CA GLY A 57 -14.747 1.061 4.198 1.00 0.00 C ATOM 810 C GLY A 57 -14.262 2.436 3.776 1.00 0.00 C ATOM 811 O GLY A 57 -14.964 3.429 3.971 1.00 0.00 O ATOM 0 H GLY A 57 -16.568 1.395 5.180 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.887 0.425 4.409 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -15.289 0.601 3.372 1.00 0.00 H new ATOM 815 N PRO A 58 -13.055 2.527 3.192 1.00 0.00 N ATOM 816 CA PRO A 58 -12.489 3.803 2.745 1.00 0.00 C ATOM 817 C PRO A 58 -13.196 4.352 1.511 1.00 0.00 C ATOM 818 O PRO A 58 -13.826 3.606 0.761 1.00 0.00 O ATOM 819 CB PRO A 58 -11.038 3.450 2.417 1.00 0.00 C ATOM 820 CG PRO A 58 -11.072 2.003 2.067 1.00 0.00 C ATOM 821 CD PRO A 58 -12.150 1.394 2.921 1.00 0.00 C ATOM 0 HA PRO A 58 -12.593 4.582 3.500 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.662 4.049 1.588 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.383 3.637 3.268 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -11.288 1.863 1.008 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -10.108 1.532 2.261 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.664 0.585 2.402 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.744 0.975 3.842 1.00 0.00 H new ATOM 829 N SER A 59 -13.087 5.661 1.307 1.00 0.00 N ATOM 830 CA SER A 59 -13.715 6.312 0.164 1.00 0.00 C ATOM 831 C SER A 59 -12.960 5.993 -1.126 1.00 0.00 C ATOM 832 O SER A 59 -11.812 5.552 -1.088 1.00 0.00 O ATOM 833 CB SER A 59 -13.767 7.826 0.382 1.00 0.00 C ATOM 834 OG SER A 59 -15.020 8.357 -0.009 1.00 0.00 O ATOM 0 H SER A 59 -12.569 6.292 1.919 1.00 0.00 H new ATOM 0 HA SER A 59 -14.732 5.931 0.070 1.00 0.00 H new ATOM 0 HB2 SER A 59 -13.586 8.051 1.433 1.00 0.00 H new ATOM 0 HB3 SER A 59 -12.972 8.306 -0.189 1.00 0.00 H new ATOM 0 HG SER A 59 -15.027 9.325 0.142 1.00 0.00 H new ATOM 840 N PRO A 60 -13.598 6.214 -2.289 1.00 0.00 N ATOM 841 CA PRO A 60 -12.979 5.946 -3.591 1.00 0.00 C ATOM 842 C PRO A 60 -11.585 6.563 -3.720 1.00 0.00 C ATOM 843 O PRO A 60 -10.635 5.877 -4.098 1.00 0.00 O ATOM 844 CB PRO A 60 -13.949 6.584 -4.588 1.00 0.00 C ATOM 845 CG PRO A 60 -15.267 6.571 -3.894 1.00 0.00 C ATOM 846 CD PRO A 60 -14.970 6.740 -2.428 1.00 0.00 C ATOM 0 HA PRO A 60 -12.825 4.879 -3.753 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -13.645 7.600 -4.842 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -13.987 6.020 -5.520 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -15.906 7.376 -4.257 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -15.795 5.636 -4.079 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -15.031 7.785 -2.124 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.676 6.186 -1.809 1.00 0.00 H new ATOM 854 N PRO A 61 -11.433 7.865 -3.408 1.00 0.00 N ATOM 855 CA PRO A 61 -10.135 8.543 -3.498 1.00 0.00 C ATOM 856 C PRO A 61 -9.128 8.003 -2.488 1.00 0.00 C ATOM 857 O PRO A 61 -7.918 8.102 -2.689 1.00 0.00 O ATOM 858 CB PRO A 61 -10.467 10.007 -3.192 1.00 0.00 C ATOM 859 CG PRO A 61 -11.734 9.956 -2.412 1.00 0.00 C ATOM 860 CD PRO A 61 -12.498 8.776 -2.945 1.00 0.00 C ATOM 0 HA PRO A 61 -9.669 8.396 -4.473 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.670 10.482 -2.620 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.590 10.584 -4.108 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -11.533 9.842 -1.347 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.304 10.877 -2.532 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.115 8.315 -2.174 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -13.165 9.062 -3.758 1.00 0.00 H new ATOM 868 N GLU A 62 -9.635 7.429 -1.401 1.00 0.00 N ATOM 869 CA GLU A 62 -8.780 6.871 -0.361 1.00 0.00 C ATOM 870 C GLU A 62 -8.198 5.529 -0.798 1.00 0.00 C ATOM 871 O GLU A 62 -7.092 5.162 -0.402 1.00 0.00 O ATOM 872 CB GLU A 62 -9.565 6.700 0.940 1.00 0.00 C ATOM 873 CG GLU A 62 -9.636 7.965 1.779 1.00 0.00 C ATOM 874 CD GLU A 62 -10.648 7.863 2.903 1.00 0.00 C ATOM 875 OE1 GLU A 62 -10.978 6.727 3.304 1.00 0.00 O ATOM 876 OE2 GLU A 62 -11.112 8.919 3.383 1.00 0.00 O ATOM 0 H GLU A 62 -10.634 7.339 -1.218 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.958 7.566 -0.191 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.578 6.374 0.703 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -9.105 5.908 1.531 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.652 8.174 2.199 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.894 8.808 1.138 1.00 0.00 H new ATOM 883 N GLN A 63 -8.954 4.801 -1.616 1.00 0.00 N ATOM 884 CA GLN A 63 -8.514 3.501 -2.106 1.00 0.00 C ATOM 885 C GLN A 63 -7.361 3.653 -3.094 1.00 0.00 C ATOM 886 O GLN A 63 -7.343 4.583 -3.901 1.00 0.00 O ATOM 887 CB GLN A 63 -9.678 2.764 -2.773 1.00 0.00 C ATOM 888 CG GLN A 63 -10.891 2.600 -1.873 1.00 0.00 C ATOM 889 CD GLN A 63 -11.757 1.422 -2.272 1.00 0.00 C ATOM 890 OE1 GLN A 63 -11.361 0.594 -3.092 1.00 0.00 O ATOM 891 NE2 GLN A 63 -12.950 1.341 -1.693 1.00 0.00 N ATOM 0 H GLN A 63 -9.873 5.090 -1.952 1.00 0.00 H new ATOM 0 HA GLN A 63 -8.164 2.919 -1.254 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -9.973 3.306 -3.671 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.338 1.779 -3.093 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.560 2.470 -0.843 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -11.488 3.512 -1.904 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.239 2.049 -1.018 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -13.577 0.570 -1.923 1.00 0.00 H new ATOM 900 N PHE A 64 -6.403 2.736 -3.024 1.00 0.00 N ATOM 901 CA PHE A 64 -5.247 2.770 -3.914 1.00 0.00 C ATOM 902 C PHE A 64 -5.104 1.452 -4.669 1.00 0.00 C ATOM 903 O PHE A 64 -5.706 0.444 -4.298 1.00 0.00 O ATOM 904 CB PHE A 64 -3.972 3.056 -3.117 1.00 0.00 C ATOM 905 CG PHE A 64 -3.953 4.418 -2.484 1.00 0.00 C ATOM 906 CD1 PHE A 64 -4.461 4.611 -1.209 1.00 0.00 C ATOM 907 CD2 PHE A 64 -3.428 5.505 -3.164 1.00 0.00 C ATOM 908 CE1 PHE A 64 -4.445 5.863 -0.625 1.00 0.00 C ATOM 909 CE2 PHE A 64 -3.409 6.759 -2.584 1.00 0.00 C ATOM 910 CZ PHE A 64 -3.919 6.939 -1.313 1.00 0.00 C ATOM 0 H PHE A 64 -6.403 1.961 -2.361 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.401 3.569 -4.639 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.863 2.301 -2.339 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.111 2.959 -3.778 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -4.874 3.774 -0.666 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -3.029 5.371 -4.159 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -4.844 6.000 0.369 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -2.996 7.598 -3.124 1.00 0.00 H new ATOM 0 HZ PHE A 64 -3.907 7.919 -0.858 1.00 0.00 H new ATOM 920 N THR A 65 -4.305 1.468 -5.731 1.00 0.00 N ATOM 921 CA THR A 65 -4.085 0.275 -6.540 1.00 0.00 C ATOM 922 C THR A 65 -2.596 -0.036 -6.658 1.00 0.00 C ATOM 923 O THR A 65 -1.824 0.765 -7.185 1.00 0.00 O ATOM 924 CB THR A 65 -4.690 0.459 -7.933 1.00 0.00 C ATOM 925 OG1 THR A 65 -5.810 1.325 -7.881 1.00 0.00 O ATOM 926 CG2 THR A 65 -5.143 -0.839 -8.565 1.00 0.00 C ATOM 0 H THR A 65 -3.799 2.294 -6.051 1.00 0.00 H new ATOM 0 HA THR A 65 -4.575 -0.564 -6.046 1.00 0.00 H new ATOM 0 HB THR A 65 -3.891 0.881 -8.542 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.365 1.190 -8.677 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.562 -0.637 -9.551 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.292 -1.512 -8.664 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.902 -1.304 -7.936 1.00 0.00 H new ATOM 934 N ALA A 66 -2.199 -1.204 -6.163 1.00 0.00 N ATOM 935 CA ALA A 66 -0.803 -1.622 -6.213 1.00 0.00 C ATOM 936 C ALA A 66 -0.449 -2.187 -7.584 1.00 0.00 C ATOM 937 O ALA A 66 -1.315 -2.684 -8.304 1.00 0.00 O ATOM 938 CB ALA A 66 -0.522 -2.649 -5.128 1.00 0.00 C ATOM 0 H ALA A 66 -2.825 -1.878 -5.722 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.179 -0.745 -6.038 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.524 -2.953 -5.176 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.728 -2.212 -4.151 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.160 -3.520 -5.277 1.00 0.00 H new ATOM 944 N VAL A 67 0.830 -2.109 -7.939 1.00 0.00 N ATOM 945 CA VAL A 67 1.299 -2.612 -9.224 1.00 0.00 C ATOM 946 C VAL A 67 2.666 -3.273 -9.089 1.00 0.00 C ATOM 947 O VAL A 67 3.694 -2.597 -9.061 1.00 0.00 O ATOM 948 CB VAL A 67 1.387 -1.486 -10.270 1.00 0.00 C ATOM 949 CG1 VAL A 67 1.683 -2.058 -11.648 1.00 0.00 C ATOM 950 CG2 VAL A 67 0.102 -0.672 -10.288 1.00 0.00 C ATOM 0 H VAL A 67 1.560 -1.702 -7.354 1.00 0.00 H new ATOM 0 HA VAL A 67 0.572 -3.352 -9.559 1.00 0.00 H new ATOM 0 HB VAL A 67 2.207 -0.823 -9.994 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.741 -1.247 -12.374 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.633 -2.592 -11.624 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.887 -2.745 -11.935 1.00 0.00 H new ATOM 0 HG21 VAL A 67 0.183 0.119 -11.033 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -0.737 -1.322 -10.538 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.062 -0.229 -9.306 1.00 0.00 H new ATOM 960 N LYS A 68 2.669 -4.600 -9.006 1.00 0.00 N ATOM 961 CA LYS A 68 3.909 -5.355 -8.874 1.00 0.00 C ATOM 962 C LYS A 68 4.799 -5.159 -10.098 1.00 0.00 C ATOM 963 O LYS A 68 4.310 -5.071 -11.224 1.00 0.00 O ATOM 964 CB LYS A 68 3.606 -6.842 -8.678 1.00 0.00 C ATOM 965 CG LYS A 68 3.727 -7.301 -7.234 1.00 0.00 C ATOM 966 CD LYS A 68 3.850 -8.813 -7.134 1.00 0.00 C ATOM 967 CE LYS A 68 5.188 -9.297 -7.665 1.00 0.00 C ATOM 968 NZ LYS A 68 5.309 -10.779 -7.603 1.00 0.00 N ATOM 0 H LYS A 68 1.826 -5.174 -9.028 1.00 0.00 H new ATOM 0 HA LYS A 68 4.442 -4.983 -7.999 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.596 -7.049 -9.033 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.287 -7.428 -9.295 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.598 -6.834 -6.775 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.854 -6.969 -6.672 1.00 0.00 H new ATOM 0 HD2 LYS A 68 3.737 -9.121 -6.094 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.043 -9.283 -7.695 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.310 -8.966 -8.696 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.993 -8.843 -7.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 6.236 -11.067 -7.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 5.218 -11.094 -6.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 4.557 -11.213 -8.175 1.00 0.00 H new ATOM 982 N LEU A 69 6.106 -5.094 -9.870 1.00 0.00 N ATOM 983 CA LEU A 69 7.063 -4.910 -10.955 1.00 0.00 C ATOM 984 C LEU A 69 8.228 -5.887 -10.827 1.00 0.00 C ATOM 985 O LEU A 69 8.363 -6.813 -11.626 1.00 0.00 O ATOM 986 CB LEU A 69 7.582 -3.470 -10.970 1.00 0.00 C ATOM 987 CG LEU A 69 6.501 -2.391 -10.876 1.00 0.00 C ATOM 988 CD1 LEU A 69 7.059 -1.130 -10.238 1.00 0.00 C ATOM 989 CD2 LEU A 69 5.932 -2.087 -12.254 1.00 0.00 C ATOM 0 H LEU A 69 6.527 -5.166 -8.944 1.00 0.00 H new ATOM 0 HA LEU A 69 6.550 -5.110 -11.896 1.00 0.00 H new ATOM 0 HB2 LEU A 69 8.276 -3.341 -10.139 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.151 -3.314 -11.887 1.00 0.00 H new ATOM 0 HG LEU A 69 5.695 -2.765 -10.245 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.276 -0.374 -10.180 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.418 -1.358 -9.235 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.884 -0.751 -10.841 1.00 0.00 H new ATOM 0 HD21 LEU A 69 5.165 -1.318 -12.169 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.730 -1.733 -12.907 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.493 -2.992 -12.674 1.00 0.00 H new ATOM 1001 N SER A 70 9.068 -5.674 -9.818 1.00 0.00 N ATOM 1002 CA SER A 70 10.222 -6.538 -9.588 1.00 0.00 C ATOM 1003 C SER A 70 11.017 -6.074 -8.372 1.00 0.00 C ATOM 1004 O SER A 70 10.867 -4.941 -7.915 1.00 0.00 O ATOM 1005 CB SER A 70 11.125 -6.561 -10.822 1.00 0.00 C ATOM 1006 OG SER A 70 11.013 -5.356 -11.560 1.00 0.00 O ATOM 0 H SER A 70 8.972 -4.912 -9.147 1.00 0.00 H new ATOM 0 HA SER A 70 9.854 -7.546 -9.397 1.00 0.00 H new ATOM 0 HB2 SER A 70 12.161 -6.708 -10.516 1.00 0.00 H new ATOM 0 HB3 SER A 70 10.857 -7.406 -11.457 1.00 0.00 H new ATOM 0 HG SER A 70 11.601 -5.396 -12.343 1.00 0.00 H new ATOM 1012 N ASP A 71 11.865 -6.957 -7.854 1.00 0.00 N ATOM 1013 CA ASP A 71 12.688 -6.639 -6.692 1.00 0.00 C ATOM 1014 C ASP A 71 11.821 -6.246 -5.499 1.00 0.00 C ATOM 1015 O ASP A 71 12.194 -5.381 -4.707 1.00 0.00 O ATOM 1016 CB ASP A 71 13.660 -5.507 -7.025 1.00 0.00 C ATOM 1017 CG ASP A 71 14.821 -5.974 -7.881 1.00 0.00 C ATOM 1018 OD1 ASP A 71 15.165 -7.173 -7.813 1.00 0.00 O ATOM 1019 OD2 ASP A 71 15.386 -5.141 -8.621 1.00 0.00 O ATOM 0 H ASP A 71 12.000 -7.899 -8.221 1.00 0.00 H new ATOM 0 HA ASP A 71 13.255 -7.531 -6.426 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.124 -4.714 -7.546 1.00 0.00 H new ATOM 0 HB3 ASP A 71 14.044 -5.078 -6.100 1.00 0.00 H new ATOM 1024 N SER A 72 10.664 -6.887 -5.377 1.00 0.00 N ATOM 1025 CA SER A 72 9.745 -6.604 -4.279 1.00 0.00 C ATOM 1026 C SER A 72 9.309 -5.142 -4.299 1.00 0.00 C ATOM 1027 O SER A 72 9.166 -4.512 -3.252 1.00 0.00 O ATOM 1028 CB SER A 72 10.404 -6.934 -2.938 1.00 0.00 C ATOM 1029 OG SER A 72 10.887 -8.266 -2.921 1.00 0.00 O ATOM 0 H SER A 72 10.340 -7.606 -6.024 1.00 0.00 H new ATOM 0 HA SER A 72 8.862 -7.230 -4.406 1.00 0.00 H new ATOM 0 HB2 SER A 72 11.227 -6.243 -2.754 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.684 -6.795 -2.131 1.00 0.00 H new ATOM 0 HG SER A 72 11.305 -8.451 -2.054 1.00 0.00 H new ATOM 1035 N ARG A 73 9.102 -4.609 -5.499 1.00 0.00 N ATOM 1036 CA ARG A 73 8.683 -3.221 -5.657 1.00 0.00 C ATOM 1037 C ARG A 73 7.325 -3.137 -6.346 1.00 0.00 C ATOM 1038 O ARG A 73 7.098 -3.776 -7.372 1.00 0.00 O ATOM 1039 CB ARG A 73 9.725 -2.441 -6.462 1.00 0.00 C ATOM 1040 CG ARG A 73 11.152 -2.670 -5.992 1.00 0.00 C ATOM 1041 CD ARG A 73 11.378 -2.100 -4.601 1.00 0.00 C ATOM 1042 NE ARG A 73 11.760 -0.692 -4.642 1.00 0.00 N ATOM 1043 CZ ARG A 73 12.915 -0.251 -5.137 1.00 0.00 C ATOM 1044 NH1 ARG A 73 13.801 -1.106 -5.632 1.00 0.00 N ATOM 1045 NH2 ARG A 73 13.184 1.047 -5.137 1.00 0.00 N ATOM 0 H ARG A 73 9.218 -5.117 -6.376 1.00 0.00 H new ATOM 0 HA ARG A 73 8.594 -2.779 -4.664 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.647 -2.724 -7.512 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.497 -1.377 -6.401 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.368 -3.738 -5.988 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.846 -2.207 -6.693 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.468 -2.212 -4.011 1.00 0.00 H new ATOM 0 HD3 ARG A 73 12.157 -2.672 -4.097 1.00 0.00 H new ATOM 0 HE ARG A 73 11.104 -0.005 -4.270 1.00 0.00 H new ATOM 0 HH11 ARG A 73 13.599 -2.106 -5.634 1.00 0.00 H new ATOM 0 HH12 ARG A 73 14.684 -0.763 -6.010 1.00 0.00 H new ATOM 0 HH21 ARG A 73 12.506 1.708 -4.758 1.00 0.00 H new ATOM 0 HH22 ARG A 73 14.069 1.384 -5.516 1.00 0.00 H new ATOM 1059 N ILE A 74 6.425 -2.343 -5.774 1.00 0.00 N ATOM 1060 CA ILE A 74 5.090 -2.175 -6.334 1.00 0.00 C ATOM 1061 C ILE A 74 4.764 -0.701 -6.546 1.00 0.00 C ATOM 1062 O ILE A 74 5.347 0.173 -5.902 1.00 0.00 O ATOM 1063 CB ILE A 74 4.016 -2.799 -5.423 1.00 0.00 C ATOM 1064 CG1 ILE A 74 4.218 -2.349 -3.975 1.00 0.00 C ATOM 1065 CG2 ILE A 74 4.053 -4.317 -5.522 1.00 0.00 C ATOM 1066 CD1 ILE A 74 3.079 -2.734 -3.056 1.00 0.00 C ATOM 0 H ILE A 74 6.597 -1.807 -4.924 1.00 0.00 H new ATOM 0 HA ILE A 74 5.084 -2.688 -7.296 1.00 0.00 H new ATOM 0 HB ILE A 74 3.036 -2.457 -5.756 1.00 0.00 H new ATOM 0 HG12 ILE A 74 5.143 -2.782 -3.594 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.341 -1.266 -3.954 1.00 0.00 H new ATOM 0 HG21 ILE A 74 3.288 -4.743 -4.872 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.864 -4.619 -6.552 1.00 0.00 H new ATOM 0 HG23 ILE A 74 5.034 -4.678 -5.213 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.291 -2.382 -2.046 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.155 -2.279 -3.412 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.969 -3.818 -3.047 1.00 0.00 H new ATOM 1078 N ALA A 75 3.831 -0.430 -7.452 1.00 0.00 N ATOM 1079 CA ALA A 75 3.428 0.940 -7.749 1.00 0.00 C ATOM 1080 C ALA A 75 2.008 1.211 -7.265 1.00 0.00 C ATOM 1081 O ALA A 75 1.088 0.443 -7.547 1.00 0.00 O ATOM 1082 CB ALA A 75 3.540 1.210 -9.242 1.00 0.00 C ATOM 0 H ALA A 75 3.339 -1.141 -7.994 1.00 0.00 H new ATOM 0 HA ALA A 75 4.099 1.614 -7.218 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.236 2.236 -9.450 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.572 1.065 -9.562 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.892 0.522 -9.786 1.00 0.00 H new ATOM 1088 N LEU A 76 1.837 2.308 -6.534 1.00 0.00 N ATOM 1089 CA LEU A 76 0.528 2.680 -6.011 1.00 0.00 C ATOM 1090 C LEU A 76 -0.178 3.650 -6.951 1.00 0.00 C ATOM 1091 O LEU A 76 0.451 4.532 -7.536 1.00 0.00 O ATOM 1092 CB LEU A 76 0.669 3.307 -4.623 1.00 0.00 C ATOM 1093 CG LEU A 76 0.931 2.317 -3.487 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.361 3.052 -2.227 1.00 0.00 C ATOM 1095 CD2 LEU A 76 -0.308 1.475 -3.219 1.00 0.00 C ATOM 0 H LEU A 76 2.588 2.954 -6.291 1.00 0.00 H new ATOM 0 HA LEU A 76 -0.075 1.775 -5.933 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.484 4.030 -4.649 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.242 3.862 -4.398 1.00 0.00 H new ATOM 0 HG LEU A 76 1.740 1.652 -3.789 1.00 0.00 H new ATOM 0 HD11 LEU A 76 1.543 2.331 -1.430 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.275 3.611 -2.426 1.00 0.00 H new ATOM 0 HD13 LEU A 76 0.574 3.741 -1.921 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -0.104 0.776 -2.408 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.136 2.126 -2.938 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -0.572 0.920 -4.119 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.489 3.482 -7.090 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.283 4.343 -7.960 1.00 0.00 C ATOM 1109 C LYS A 77 -3.496 4.893 -7.216 1.00 0.00 C ATOM 1110 O LYS A 77 -4.255 4.141 -6.604 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.737 3.571 -9.200 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.415 4.443 -10.246 1.00 0.00 C ATOM 1113 CD LYS A 77 -4.813 3.943 -10.571 1.00 0.00 C ATOM 1114 CE LYS A 77 -4.773 2.604 -11.290 1.00 0.00 C ATOM 1115 NZ LYS A 77 -6.137 2.045 -11.502 1.00 0.00 N ATOM 0 H LYS A 77 -2.024 2.758 -6.611 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.659 5.180 -8.272 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.873 3.083 -9.651 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.425 2.782 -8.895 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -3.470 5.470 -9.884 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.813 4.457 -11.154 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -5.389 3.846 -9.651 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -5.327 4.676 -11.193 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -4.276 2.724 -12.253 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -4.178 1.899 -10.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -6.065 1.132 -11.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -6.602 1.906 -10.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -6.698 2.706 -12.077 1.00 0.00 H new ATOM 1129 N SER A 78 -3.673 6.209 -7.274 1.00 0.00 N ATOM 1130 CA SER A 78 -4.794 6.859 -6.606 1.00 0.00 C ATOM 1131 C SER A 78 -6.078 6.696 -7.414 1.00 0.00 C ATOM 1132 O SER A 78 -6.038 6.503 -8.630 1.00 0.00 O ATOM 1133 CB SER A 78 -4.497 8.345 -6.394 1.00 0.00 C ATOM 1134 OG SER A 78 -3.674 8.853 -7.430 1.00 0.00 O ATOM 0 H SER A 78 -3.055 6.846 -7.777 1.00 0.00 H new ATOM 0 HA SER A 78 -4.933 6.381 -5.636 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.432 8.905 -6.360 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.005 8.487 -5.432 1.00 0.00 H new ATOM 0 HG SER A 78 -3.500 9.804 -7.273 1.00 0.00 H new ATOM 1140 N GLY A 79 -7.214 6.772 -6.730 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.494 6.631 -7.399 1.00 0.00 C ATOM 1142 C GLY A 79 -8.697 7.662 -8.492 1.00 0.00 C ATOM 1143 O GLY A 79 -9.409 7.414 -9.465 1.00 0.00 O ATOM 0 H GLY A 79 -7.272 6.929 -5.724 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.567 5.632 -7.829 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -9.295 6.722 -6.666 1.00 0.00 H new ATOM 1147 N TYR A 80 -8.069 8.823 -8.332 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.185 9.896 -9.312 1.00 0.00 C ATOM 1149 C TYR A 80 -7.642 9.457 -10.668 1.00 0.00 C ATOM 1150 O TYR A 80 -8.166 9.844 -11.712 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.437 11.139 -8.826 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.258 12.021 -7.913 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -9.401 12.661 -8.377 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -7.890 12.214 -6.588 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -10.155 13.467 -7.545 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -8.638 13.019 -5.750 1.00 0.00 C ATOM 1157 CZ TYR A 80 -9.769 13.643 -6.233 1.00 0.00 C ATOM 1158 OH TYR A 80 -10.517 14.446 -5.401 1.00 0.00 O ATOM 0 H TYR A 80 -7.475 9.044 -7.533 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.242 10.138 -9.427 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.534 10.827 -8.301 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.118 11.722 -9.690 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -9.705 12.526 -9.405 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -7.005 11.727 -6.206 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -11.042 13.956 -7.920 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -8.338 13.159 -4.722 1.00 0.00 H new ATOM 0 HH TYR A 80 -10.110 14.463 -4.510 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.589 8.646 -10.644 1.00 0.00 N ATOM 1169 CA GLY A 81 -5.994 8.167 -11.879 1.00 0.00 C ATOM 1170 C GLY A 81 -4.529 8.542 -12.002 1.00 0.00 C ATOM 1171 O GLY A 81 -4.052 8.854 -13.093 1.00 0.00 O ATOM 0 H GLY A 81 -6.137 8.312 -9.793 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.094 7.083 -11.930 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.543 8.578 -12.726 1.00 0.00 H new ATOM 1175 N LYS A 82 -3.815 8.510 -10.882 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.397 8.848 -10.871 1.00 0.00 C ATOM 1177 C LYS A 82 -1.612 7.878 -9.993 1.00 0.00 C ATOM 1178 O LYS A 82 -2.189 7.149 -9.187 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.196 10.280 -10.372 1.00 0.00 C ATOM 1180 CG LYS A 82 -2.638 11.339 -11.368 1.00 0.00 C ATOM 1181 CD LYS A 82 -3.215 12.557 -10.666 1.00 0.00 C ATOM 1182 CE LYS A 82 -3.907 13.489 -11.647 1.00 0.00 C ATOM 1183 NZ LYS A 82 -4.226 14.806 -11.030 1.00 0.00 N ATOM 0 H LYS A 82 -4.195 8.254 -9.971 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.024 8.770 -11.892 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -2.750 10.413 -9.443 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.142 10.430 -10.139 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -1.789 11.640 -11.982 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.385 10.918 -12.041 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.925 12.237 -9.904 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.418 13.094 -10.153 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.268 13.641 -12.517 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -4.825 13.023 -12.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.697 15.413 -11.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.857 14.664 -10.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -3.347 15.262 -10.712 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.293 7.877 -10.155 1.00 0.00 N ATOM 1198 CA TYR A 83 0.573 6.999 -9.376 1.00 0.00 C ATOM 1199 C TYR A 83 1.276 7.776 -8.269 1.00 0.00 C ATOM 1200 O TYR A 83 1.829 8.850 -8.505 1.00 0.00 O ATOM 1201 CB TYR A 83 1.607 6.332 -10.284 1.00 0.00 C ATOM 1202 CG TYR A 83 1.060 5.164 -11.073 1.00 0.00 C ATOM 1203 CD1 TYR A 83 0.380 5.365 -12.267 1.00 0.00 C ATOM 1204 CD2 TYR A 83 1.224 3.860 -10.623 1.00 0.00 C ATOM 1205 CE1 TYR A 83 -0.121 4.300 -12.991 1.00 0.00 C ATOM 1206 CE2 TYR A 83 0.726 2.789 -11.341 1.00 0.00 C ATOM 1207 CZ TYR A 83 0.055 3.015 -12.524 1.00 0.00 C ATOM 1208 OH TYR A 83 -0.443 1.951 -13.242 1.00 0.00 O ATOM 0 H TYR A 83 0.200 8.474 -10.819 1.00 0.00 H new ATOM 0 HA TYR A 83 -0.047 6.228 -8.918 1.00 0.00 H new ATOM 0 HB2 TYR A 83 2.001 7.075 -10.978 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.444 5.988 -9.676 1.00 0.00 H new ATOM 0 HD1 TYR A 83 0.240 6.370 -12.636 1.00 0.00 H new ATOM 0 HD2 TYR A 83 1.749 3.680 -9.697 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -0.648 4.473 -13.918 1.00 0.00 H new ATOM 0 HE2 TYR A 83 0.862 1.781 -10.977 1.00 0.00 H new ATOM 0 HH TYR A 83 0.121 1.163 -13.093 1.00 0.00 H new ATOM 1218 N LEU A 84 1.252 7.226 -7.059 1.00 0.00 N ATOM 1219 CA LEU A 84 1.888 7.870 -5.915 1.00 0.00 C ATOM 1220 C LEU A 84 3.385 8.042 -6.150 1.00 0.00 C ATOM 1221 O LEU A 84 4.133 7.065 -6.195 1.00 0.00 O ATOM 1222 CB LEU A 84 1.650 7.051 -4.645 1.00 0.00 C ATOM 1223 CG LEU A 84 0.264 7.216 -4.019 1.00 0.00 C ATOM 1224 CD1 LEU A 84 0.114 6.310 -2.807 1.00 0.00 C ATOM 1225 CD2 LEU A 84 0.024 8.667 -3.634 1.00 0.00 C ATOM 0 H LEU A 84 0.800 6.337 -6.845 1.00 0.00 H new ATOM 0 HA LEU A 84 1.442 8.857 -5.791 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.804 5.997 -4.876 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.401 7.329 -3.906 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.484 6.927 -4.757 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.878 6.441 -2.375 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.243 5.271 -3.111 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.870 6.567 -2.065 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.967 8.767 -3.190 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.778 8.982 -2.913 1.00 0.00 H new ATOM 0 HD23 LEU A 84 0.088 9.295 -4.523 1.00 0.00 H new ATOM 1237 N GLY A 85 3.815 9.290 -6.300 1.00 0.00 N ATOM 1238 CA GLY A 85 5.220 9.569 -6.530 1.00 0.00 C ATOM 1239 C GLY A 85 5.772 10.599 -5.565 1.00 0.00 C ATOM 1240 O GLY A 85 5.134 11.621 -5.305 1.00 0.00 O ATOM 0 H GLY A 85 3.215 10.114 -6.266 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.791 8.645 -6.436 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.354 9.924 -7.552 1.00 0.00 H new ATOM 1244 N ILE A 86 6.959 10.333 -5.033 1.00 0.00 N ATOM 1245 CA ILE A 86 7.598 11.245 -4.091 1.00 0.00 C ATOM 1246 C ILE A 86 8.419 12.302 -4.820 1.00 0.00 C ATOM 1247 O ILE A 86 9.186 11.987 -5.732 1.00 0.00 O ATOM 1248 CB ILE A 86 8.512 10.489 -3.107 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.475 9.576 -3.868 1.00 0.00 C ATOM 1250 CG2 ILE A 86 7.679 9.685 -2.121 1.00 0.00 C ATOM 1251 CD1 ILE A 86 10.833 9.449 -3.213 1.00 0.00 C ATOM 0 H ILE A 86 7.499 9.492 -5.238 1.00 0.00 H new ATOM 0 HA ILE A 86 6.799 11.731 -3.532 1.00 0.00 H new ATOM 0 HB ILE A 86 9.099 11.218 -2.548 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.030 8.585 -3.957 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.603 9.960 -4.880 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.339 9.157 -1.433 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.031 10.358 -1.558 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.069 8.963 -2.664 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.463 8.787 -3.807 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.299 10.432 -3.148 1.00 0.00 H new ATOM 0 HD13 ILE A 86 10.716 9.036 -2.211 1.00 0.00 H new ATOM 1263 N ASN A 87 8.255 13.556 -4.415 1.00 0.00 N ATOM 1264 CA ASN A 87 8.982 14.660 -5.031 1.00 0.00 C ATOM 1265 C ASN A 87 10.467 14.587 -4.692 1.00 0.00 C ATOM 1266 O ASN A 87 10.883 13.798 -3.843 1.00 0.00 O ATOM 1267 CB ASN A 87 8.407 15.999 -4.567 1.00 0.00 C ATOM 1268 CG ASN A 87 7.119 16.355 -5.285 1.00 0.00 C ATOM 1269 OD1 ASN A 87 6.912 15.973 -6.437 1.00 0.00 O ATOM 1270 ND2 ASN A 87 6.247 17.090 -4.606 1.00 0.00 N ATOM 0 H ASN A 87 7.625 13.834 -3.663 1.00 0.00 H new ATOM 0 HA ASN A 87 8.869 14.579 -6.112 1.00 0.00 H new ATOM 0 HB2 ASN A 87 8.222 15.960 -3.493 1.00 0.00 H new ATOM 0 HB3 ASN A 87 9.143 16.785 -4.735 1.00 0.00 H new ATOM 0 HD21 ASN A 87 5.363 17.361 -5.037 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.461 17.384 -3.653 1.00 0.00 H new ATOM 1277 N SER A 88 11.264 15.412 -5.362 1.00 0.00 N ATOM 1278 CA SER A 88 12.703 15.440 -5.133 1.00 0.00 C ATOM 1279 C SER A 88 13.017 15.805 -3.686 1.00 0.00 C ATOM 1280 O SER A 88 14.017 15.358 -3.125 1.00 0.00 O ATOM 1281 CB SER A 88 13.372 16.438 -6.078 1.00 0.00 C ATOM 1282 OG SER A 88 14.772 16.490 -5.860 1.00 0.00 O ATOM 0 H SER A 88 10.937 16.071 -6.069 1.00 0.00 H new ATOM 0 HA SER A 88 13.096 14.443 -5.331 1.00 0.00 H new ATOM 0 HB2 SER A 88 13.172 16.155 -7.111 1.00 0.00 H new ATOM 0 HB3 SER A 88 12.941 17.428 -5.930 1.00 0.00 H new ATOM 0 HG SER A 88 15.176 17.135 -6.478 1.00 0.00 H new ATOM 1288 N ASP A 89 12.155 16.620 -3.085 1.00 0.00 N ATOM 1289 CA ASP A 89 12.340 17.044 -1.703 1.00 0.00 C ATOM 1290 C ASP A 89 12.068 15.894 -0.738 1.00 0.00 C ATOM 1291 O ASP A 89 12.672 15.813 0.331 1.00 0.00 O ATOM 1292 CB ASP A 89 11.420 18.224 -1.381 1.00 0.00 C ATOM 1293 CG ASP A 89 11.586 19.369 -2.361 1.00 0.00 C ATOM 1294 OD1 ASP A 89 11.217 19.198 -3.543 1.00 0.00 O ATOM 1295 OD2 ASP A 89 12.083 20.438 -1.948 1.00 0.00 O ATOM 0 H ASP A 89 11.322 16.999 -3.534 1.00 0.00 H new ATOM 0 HA ASP A 89 13.377 17.357 -1.582 1.00 0.00 H new ATOM 0 HB2 ASP A 89 10.383 17.887 -1.392 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.629 18.579 -0.372 1.00 0.00 H new ATOM 1300 N GLY A 90 11.156 15.008 -1.124 1.00 0.00 N ATOM 1301 CA GLY A 90 10.820 13.874 -0.283 1.00 0.00 C ATOM 1302 C GLY A 90 9.395 13.933 0.229 1.00 0.00 C ATOM 1303 O GLY A 90 9.106 13.476 1.335 1.00 0.00 O ATOM 0 H GLY A 90 10.643 15.055 -2.005 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.962 12.952 -0.848 1.00 0.00 H new ATOM 0 HA3 GLY A 90 11.506 13.838 0.564 1.00 0.00 H new ATOM 1307 N LEU A 91 8.501 14.499 -0.575 1.00 0.00 N ATOM 1308 CA LEU A 91 7.098 14.616 -0.196 1.00 0.00 C ATOM 1309 C LEU A 91 6.237 13.636 -0.987 1.00 0.00 C ATOM 1310 O LEU A 91 6.390 13.499 -2.200 1.00 0.00 O ATOM 1311 CB LEU A 91 6.604 16.046 -0.426 1.00 0.00 C ATOM 1312 CG LEU A 91 5.206 16.344 0.122 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.296 16.922 1.526 1.00 0.00 C ATOM 1314 CD2 LEU A 91 4.463 17.296 -0.802 1.00 0.00 C ATOM 0 H LEU A 91 8.723 14.884 -1.493 1.00 0.00 H new ATOM 0 HA LEU A 91 7.012 14.374 0.863 1.00 0.00 H new ATOM 0 HB2 LEU A 91 7.312 16.737 0.032 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.609 16.248 -1.497 1.00 0.00 H new ATOM 0 HG LEU A 91 4.648 15.409 0.171 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.293 17.128 1.900 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.788 16.206 2.184 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.871 17.848 1.502 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.471 17.497 -0.397 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.018 18.231 -0.884 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.367 16.844 -1.789 1.00 0.00 H new ATOM 1326 N VAL A 92 5.334 12.955 -0.290 1.00 0.00 N ATOM 1327 CA VAL A 92 4.449 11.987 -0.926 1.00 0.00 C ATOM 1328 C VAL A 92 3.326 12.686 -1.684 1.00 0.00 C ATOM 1329 O VAL A 92 2.480 13.351 -1.086 1.00 0.00 O ATOM 1330 CB VAL A 92 3.834 11.021 0.106 1.00 0.00 C ATOM 1331 CG1 VAL A 92 3.044 9.925 -0.590 1.00 0.00 C ATOM 1332 CG2 VAL A 92 4.917 10.427 0.995 1.00 0.00 C ATOM 0 H VAL A 92 5.196 13.056 0.716 1.00 0.00 H new ATOM 0 HA VAL A 92 5.058 11.416 -1.627 1.00 0.00 H new ATOM 0 HB VAL A 92 3.147 11.585 0.738 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.618 9.254 0.156 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.241 10.372 -1.177 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.705 9.362 -1.249 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.463 9.748 1.717 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.632 9.879 0.381 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.433 11.228 1.525 1.00 0.00 H new ATOM 1342 N VAL A 93 3.325 12.533 -3.003 1.00 0.00 N ATOM 1343 CA VAL A 93 2.305 13.149 -3.843 1.00 0.00 C ATOM 1344 C VAL A 93 1.882 12.213 -4.971 1.00 0.00 C ATOM 1345 O VAL A 93 2.392 11.098 -5.089 1.00 0.00 O ATOM 1346 CB VAL A 93 2.804 14.474 -4.452 1.00 0.00 C ATOM 1347 CG1 VAL A 93 2.838 15.568 -3.398 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.176 14.288 -5.083 1.00 0.00 C ATOM 0 H VAL A 93 4.019 11.988 -3.514 1.00 0.00 H new ATOM 0 HA VAL A 93 1.448 13.352 -3.201 1.00 0.00 H new ATOM 0 HB VAL A 93 2.108 14.778 -5.234 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.193 16.495 -3.848 1.00 0.00 H new ATOM 0 HG12 VAL A 93 1.835 15.719 -2.998 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.510 15.275 -2.591 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.512 15.234 -5.508 1.00 0.00 H new ATOM 0 HG22 VAL A 93 4.885 13.959 -4.323 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.115 13.537 -5.871 1.00 0.00 H new ATOM 1358 N GLY A 94 0.947 12.673 -5.794 1.00 0.00 N ATOM 1359 CA GLY A 94 0.471 11.863 -6.901 1.00 0.00 C ATOM 1360 C GLY A 94 -0.056 12.702 -8.049 1.00 0.00 C ATOM 1361 O GLY A 94 -1.261 12.918 -8.167 1.00 0.00 O ATOM 0 H GLY A 94 0.510 13.591 -5.715 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.283 11.231 -7.260 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.318 11.199 -6.548 1.00 0.00 H new ATOM 1365 N ARG A 95 0.851 13.176 -8.897 1.00 0.00 N ATOM 1366 CA ARG A 95 0.473 13.996 -10.042 1.00 0.00 C ATOM 1367 C ARG A 95 1.142 13.493 -11.317 1.00 0.00 C ATOM 1368 O ARG A 95 1.500 14.279 -12.193 1.00 0.00 O ATOM 1369 CB ARG A 95 0.852 15.458 -9.796 1.00 0.00 C ATOM 1370 CG ARG A 95 2.318 15.655 -9.444 1.00 0.00 C ATOM 1371 CD ARG A 95 2.733 17.111 -9.576 1.00 0.00 C ATOM 1372 NE ARG A 95 2.471 17.868 -8.354 1.00 0.00 N ATOM 1373 CZ ARG A 95 2.407 19.197 -8.305 1.00 0.00 C ATOM 1374 NH1 ARG A 95 2.585 19.919 -9.404 1.00 0.00 N ATOM 1375 NH2 ARG A 95 2.164 19.806 -7.152 1.00 0.00 N ATOM 0 H ARG A 95 1.853 13.006 -8.813 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.607 13.924 -10.168 1.00 0.00 H new ATOM 0 HB2 ARG A 95 0.620 16.040 -10.688 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.236 15.853 -8.988 1.00 0.00 H new ATOM 0 HG2 ARG A 95 2.497 15.316 -8.424 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.936 15.039 -10.097 1.00 0.00 H new ATOM 0 HD2 ARG A 95 3.795 17.165 -9.815 1.00 0.00 H new ATOM 0 HD3 ARG A 95 2.196 17.567 -10.407 1.00 0.00 H new ATOM 0 HE ARG A 95 2.329 17.348 -7.488 1.00 0.00 H new ATOM 0 HH11 ARG A 95 2.772 19.456 -10.293 1.00 0.00 H new ATOM 0 HH12 ARG A 95 2.535 20.937 -9.359 1.00 0.00 H new ATOM 0 HH21 ARG A 95 2.026 19.256 -6.304 1.00 0.00 H new ATOM 0 HH22 ARG A 95 2.115 20.824 -7.113 1.00 0.00 H new ATOM 1389 N SER A 96 1.306 12.178 -11.413 1.00 0.00 N ATOM 1390 CA SER A 96 1.932 11.570 -12.582 1.00 0.00 C ATOM 1391 C SER A 96 1.282 10.229 -12.910 1.00 0.00 C ATOM 1392 O SER A 96 0.831 9.511 -12.017 1.00 0.00 O ATOM 1393 CB SER A 96 3.430 11.379 -12.342 1.00 0.00 C ATOM 1394 OG SER A 96 4.150 12.564 -12.638 1.00 0.00 O ATOM 0 H SER A 96 1.015 11.513 -10.696 1.00 0.00 H new ATOM 0 HA SER A 96 1.790 12.240 -13.430 1.00 0.00 H new ATOM 0 HB2 SER A 96 3.602 11.095 -11.304 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.799 10.561 -12.961 1.00 0.00 H new ATOM 0 HG SER A 96 3.549 13.335 -12.579 1.00 0.00 H new ATOM 1400 N ASP A 97 1.239 9.898 -14.196 1.00 0.00 N ATOM 1401 CA ASP A 97 0.645 8.642 -14.643 1.00 0.00 C ATOM 1402 C ASP A 97 1.714 7.696 -15.180 1.00 0.00 C ATOM 1403 O ASP A 97 1.456 6.902 -16.084 1.00 0.00 O ATOM 1404 CB ASP A 97 -0.407 8.907 -15.720 1.00 0.00 C ATOM 1405 CG ASP A 97 0.099 9.832 -16.808 1.00 0.00 C ATOM 1406 OD1 ASP A 97 0.130 11.059 -16.577 1.00 0.00 O ATOM 1407 OD2 ASP A 97 0.463 9.330 -17.893 1.00 0.00 O ATOM 0 H ASP A 97 1.608 10.481 -14.947 1.00 0.00 H new ATOM 0 HA ASP A 97 0.165 8.169 -13.786 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -0.713 7.960 -16.165 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -1.293 9.344 -15.259 1.00 0.00 H new ATOM 1412 N ALA A 98 2.915 7.787 -14.619 1.00 0.00 N ATOM 1413 CA ALA A 98 4.024 6.940 -15.042 1.00 0.00 C ATOM 1414 C ALA A 98 4.739 6.332 -13.841 1.00 0.00 C ATOM 1415 O ALA A 98 5.080 7.035 -12.889 1.00 0.00 O ATOM 1416 CB ALA A 98 5.000 7.736 -15.895 1.00 0.00 C ATOM 0 H ALA A 98 3.145 8.439 -13.870 1.00 0.00 H new ATOM 0 HA ALA A 98 3.619 6.124 -15.640 1.00 0.00 H new ATOM 0 HB1 ALA A 98 5.823 7.091 -16.204 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.486 8.116 -16.778 1.00 0.00 H new ATOM 0 HB3 ALA A 98 5.392 8.572 -15.315 1.00 0.00 H new ATOM 1422 N ILE A 99 4.965 5.024 -13.893 1.00 0.00 N ATOM 1423 CA ILE A 99 5.641 4.321 -12.809 1.00 0.00 C ATOM 1424 C ILE A 99 7.148 4.552 -12.859 1.00 0.00 C ATOM 1425 O ILE A 99 7.904 3.694 -13.315 1.00 0.00 O ATOM 1426 CB ILE A 99 5.362 2.807 -12.861 1.00 0.00 C ATOM 1427 CG1 ILE A 99 3.863 2.546 -13.011 1.00 0.00 C ATOM 1428 CG2 ILE A 99 5.902 2.126 -11.611 1.00 0.00 C ATOM 1429 CD1 ILE A 99 3.531 1.114 -13.367 1.00 0.00 C ATOM 0 H ILE A 99 4.690 4.429 -14.674 1.00 0.00 H new ATOM 0 HA ILE A 99 5.246 4.723 -11.876 1.00 0.00 H new ATOM 0 HB ILE A 99 5.872 2.389 -13.729 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.362 2.805 -12.078 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.463 3.205 -13.781 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.697 1.057 -11.662 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.978 2.287 -11.545 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.418 2.546 -10.730 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.450 1.003 -13.457 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.003 0.856 -14.315 1.00 0.00 H new ATOM 0 HD13 ILE A 99 3.900 0.450 -12.586 1.00 0.00 H new ATOM 1441 N GLY A 100 7.578 5.718 -12.389 1.00 0.00 N ATOM 1442 CA GLY A 100 8.992 6.042 -12.391 1.00 0.00 C ATOM 1443 C GLY A 100 9.700 5.559 -11.138 1.00 0.00 C ATOM 1444 O GLY A 100 9.061 5.034 -10.226 1.00 0.00 O ATOM 0 H GLY A 100 6.972 6.444 -12.007 1.00 0.00 H new ATOM 0 HA2 GLY A 100 9.463 5.594 -13.266 1.00 0.00 H new ATOM 0 HA3 GLY A 100 9.114 7.121 -12.480 1.00 0.00 H new ATOM 1448 N PRO A 101 11.031 5.726 -11.062 1.00 0.00 N ATOM 1449 CA PRO A 101 11.817 5.297 -9.899 1.00 0.00 C ATOM 1450 C PRO A 101 11.255 5.841 -8.590 1.00 0.00 C ATOM 1451 O PRO A 101 11.169 5.122 -7.594 1.00 0.00 O ATOM 1452 CB PRO A 101 13.204 5.884 -10.171 1.00 0.00 C ATOM 1453 CG PRO A 101 13.274 6.024 -11.652 1.00 0.00 C ATOM 1454 CD PRO A 101 11.875 6.343 -12.103 1.00 0.00 C ATOM 0 HA PRO A 101 11.815 4.213 -9.782 1.00 0.00 H new ATOM 0 HB2 PRO A 101 13.330 6.847 -9.676 1.00 0.00 H new ATOM 0 HB3 PRO A 101 13.991 5.229 -9.798 1.00 0.00 H new ATOM 0 HG2 PRO A 101 13.966 6.816 -11.937 1.00 0.00 H new ATOM 0 HG3 PRO A 101 13.633 5.105 -12.115 1.00 0.00 H new ATOM 0 HD2 PRO A 101 11.710 7.418 -12.169 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.666 5.927 -13.089 1.00 0.00 H new ATOM 1462 N ARG A 102 10.874 7.114 -8.598 1.00 0.00 N ATOM 1463 CA ARG A 102 10.320 7.754 -7.411 1.00 0.00 C ATOM 1464 C ARG A 102 8.932 7.206 -7.094 1.00 0.00 C ATOM 1465 O ARG A 102 8.538 7.120 -5.932 1.00 0.00 O ATOM 1466 CB ARG A 102 10.250 9.269 -7.609 1.00 0.00 C ATOM 1467 CG ARG A 102 11.603 9.955 -7.540 1.00 0.00 C ATOM 1468 CD ARG A 102 11.468 11.417 -7.146 1.00 0.00 C ATOM 1469 NE ARG A 102 12.605 12.214 -7.603 1.00 0.00 N ATOM 1470 CZ ARG A 102 13.807 12.187 -7.031 1.00 0.00 C ATOM 1471 NH1 ARG A 102 14.034 11.403 -5.984 1.00 0.00 N ATOM 1472 NH2 ARG A 102 14.785 12.944 -7.509 1.00 0.00 N ATOM 0 H ARG A 102 10.939 7.723 -9.414 1.00 0.00 H new ATOM 0 HA ARG A 102 10.978 7.534 -6.570 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.794 9.480 -8.576 1.00 0.00 H new ATOM 0 HB3 ARG A 102 9.596 9.696 -6.849 1.00 0.00 H new ATOM 0 HG2 ARG A 102 12.237 9.440 -6.818 1.00 0.00 H new ATOM 0 HG3 ARG A 102 12.099 9.882 -8.508 1.00 0.00 H new ATOM 0 HD2 ARG A 102 10.548 11.823 -7.567 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.383 11.494 -6.062 1.00 0.00 H new ATOM 0 HE ARG A 102 12.470 12.827 -8.407 1.00 0.00 H new ATOM 0 HH11 ARG A 102 13.286 10.817 -5.614 1.00 0.00 H new ATOM 0 HH12 ARG A 102 14.957 11.386 -5.550 1.00 0.00 H new ATOM 0 HH21 ARG A 102 14.616 13.547 -8.314 1.00 0.00 H new ATOM 0 HH22 ARG A 102 15.706 12.924 -7.071 1.00 0.00 H new ATOM 1486 N GLU A 103 8.196 6.834 -8.137 1.00 0.00 N ATOM 1487 CA GLU A 103 6.852 6.294 -7.970 1.00 0.00 C ATOM 1488 C GLU A 103 6.899 4.885 -7.388 1.00 0.00 C ATOM 1489 O GLU A 103 5.976 4.459 -6.694 1.00 0.00 O ATOM 1490 CB GLU A 103 6.117 6.278 -9.312 1.00 0.00 C ATOM 1491 CG GLU A 103 5.519 7.623 -9.694 1.00 0.00 C ATOM 1492 CD GLU A 103 6.576 8.687 -9.917 1.00 0.00 C ATOM 1493 OE1 GLU A 103 7.215 9.105 -8.929 1.00 0.00 O ATOM 1494 OE2 GLU A 103 6.762 9.104 -11.080 1.00 0.00 O ATOM 0 H GLU A 103 8.508 6.897 -9.106 1.00 0.00 H new ATOM 0 HA GLU A 103 6.313 6.937 -7.274 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.810 5.963 -10.092 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.321 5.534 -9.272 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.926 7.509 -10.602 1.00 0.00 H new ATOM 0 HG3 GLU A 103 4.839 7.951 -8.908 1.00 0.00 H new ATOM 1501 N GLN A 104 7.981 4.166 -7.672 1.00 0.00 N ATOM 1502 CA GLN A 104 8.148 2.804 -7.177 1.00 0.00 C ATOM 1503 C GLN A 104 8.098 2.768 -5.653 1.00 0.00 C ATOM 1504 O GLN A 104 8.341 3.776 -4.990 1.00 0.00 O ATOM 1505 CB GLN A 104 9.473 2.219 -7.670 1.00 0.00 C ATOM 1506 CG GLN A 104 9.429 1.745 -9.113 1.00 0.00 C ATOM 1507 CD GLN A 104 10.720 1.081 -9.548 1.00 0.00 C ATOM 1508 OE1 GLN A 104 11.588 0.786 -8.727 1.00 0.00 O ATOM 1509 NE2 GLN A 104 10.854 0.842 -10.848 1.00 0.00 N ATOM 0 H GLN A 104 8.756 4.504 -8.243 1.00 0.00 H new ATOM 0 HA GLN A 104 7.326 2.201 -7.563 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.254 2.973 -7.568 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.752 1.382 -7.030 1.00 0.00 H new ATOM 0 HG2 GLN A 104 8.604 1.043 -9.236 1.00 0.00 H new ATOM 0 HG3 GLN A 104 9.224 2.595 -9.765 1.00 0.00 H new ATOM 0 HE21 GLN A 104 10.109 1.103 -11.494 1.00 0.00 H new ATOM 0 HE22 GLN A 104 11.702 0.397 -11.200 1.00 0.00 H new ATOM 1518 N TRP A 105 7.783 1.599 -5.104 1.00 0.00 N ATOM 1519 CA TRP A 105 7.700 1.430 -3.658 1.00 0.00 C ATOM 1520 C TRP A 105 8.346 0.116 -3.227 1.00 0.00 C ATOM 1521 O TRP A 105 8.847 -0.641 -4.057 1.00 0.00 O ATOM 1522 CB TRP A 105 6.241 1.470 -3.201 1.00 0.00 C ATOM 1523 CG TRP A 105 5.588 2.800 -3.413 1.00 0.00 C ATOM 1524 CD1 TRP A 105 4.840 3.183 -4.488 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.624 3.925 -2.526 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.407 4.478 -4.326 1.00 0.00 N ATOM 1527 CE2 TRP A 105 4.876 4.955 -3.129 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.215 4.161 -1.282 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 4.705 6.200 -2.529 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.044 5.397 -0.687 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.294 6.403 -1.311 1.00 0.00 C ATOM 0 H TRP A 105 7.581 0.755 -5.639 1.00 0.00 H new ATOM 0 HA TRP A 105 8.241 2.252 -3.189 1.00 0.00 H new ATOM 0 HB2 TRP A 105 5.678 0.707 -3.739 1.00 0.00 H new ATOM 0 HB3 TRP A 105 6.192 1.214 -2.143 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.620 2.560 -5.342 1.00 0.00 H new ATOM 0 HE1 TRP A 105 3.831 4.999 -4.988 1.00 0.00 H new ATOM 0 HE3 TRP A 105 6.795 3.392 -0.794 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.128 6.977 -3.008 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.496 5.591 0.275 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.179 7.358 -0.820 1.00 0.00 H new ATOM 1542 N GLU A 106 8.329 -0.147 -1.925 1.00 0.00 N ATOM 1543 CA GLU A 106 8.913 -1.370 -1.386 1.00 0.00 C ATOM 1544 C GLU A 106 8.364 -1.668 0.008 1.00 0.00 C ATOM 1545 O GLU A 106 8.945 -1.257 1.013 1.00 0.00 O ATOM 1546 CB GLU A 106 10.437 -1.250 -1.331 1.00 0.00 C ATOM 1547 CG GLU A 106 11.150 -2.592 -1.278 1.00 0.00 C ATOM 1548 CD GLU A 106 12.563 -2.478 -0.737 1.00 0.00 C ATOM 1549 OE1 GLU A 106 13.463 -2.084 -1.507 1.00 0.00 O ATOM 1550 OE2 GLU A 106 12.767 -2.783 0.457 1.00 0.00 O ATOM 0 H GLU A 106 7.918 0.469 -1.224 1.00 0.00 H new ATOM 0 HA GLU A 106 8.643 -2.194 -2.047 1.00 0.00 H new ATOM 0 HB2 GLU A 106 10.782 -0.699 -2.206 1.00 0.00 H new ATOM 0 HB3 GLU A 106 10.716 -0.665 -0.455 1.00 0.00 H new ATOM 0 HG2 GLU A 106 10.579 -3.279 -0.653 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.181 -3.023 -2.279 1.00 0.00 H new ATOM 1557 N PRO A 107 7.234 -2.393 0.087 1.00 0.00 N ATOM 1558 CA PRO A 107 6.611 -2.746 1.367 1.00 0.00 C ATOM 1559 C PRO A 107 7.593 -3.417 2.321 1.00 0.00 C ATOM 1560 O PRO A 107 8.662 -3.871 1.910 1.00 0.00 O ATOM 1561 CB PRO A 107 5.501 -3.720 0.968 1.00 0.00 C ATOM 1562 CG PRO A 107 5.183 -3.375 -0.446 1.00 0.00 C ATOM 1563 CD PRO A 107 6.478 -2.925 -1.062 1.00 0.00 C ATOM 0 HA PRO A 107 6.250 -1.867 1.901 1.00 0.00 H new ATOM 0 HB2 PRO A 107 5.831 -4.755 1.058 1.00 0.00 H new ATOM 0 HB3 PRO A 107 4.627 -3.608 1.609 1.00 0.00 H new ATOM 0 HG2 PRO A 107 4.777 -4.236 -0.976 1.00 0.00 H new ATOM 0 HG3 PRO A 107 4.432 -2.587 -0.496 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.004 -3.751 -1.542 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.317 -2.163 -1.825 1.00 0.00 H new ATOM 1571 N VAL A 108 7.226 -3.476 3.597 1.00 0.00 N ATOM 1572 CA VAL A 108 8.075 -4.091 4.609 1.00 0.00 C ATOM 1573 C VAL A 108 7.243 -4.841 5.644 1.00 0.00 C ATOM 1574 O VAL A 108 6.051 -4.579 5.803 1.00 0.00 O ATOM 1575 CB VAL A 108 8.943 -3.042 5.328 1.00 0.00 C ATOM 1576 CG1 VAL A 108 9.962 -3.717 6.232 1.00 0.00 C ATOM 1577 CG2 VAL A 108 9.633 -2.138 4.317 1.00 0.00 C ATOM 0 H VAL A 108 6.346 -3.105 3.954 1.00 0.00 H new ATOM 0 HA VAL A 108 8.725 -4.795 4.090 1.00 0.00 H new ATOM 0 HB VAL A 108 8.294 -2.426 5.950 1.00 0.00 H new ATOM 0 HG11 VAL A 108 10.565 -2.958 6.731 1.00 0.00 H new ATOM 0 HG12 VAL A 108 9.444 -4.318 6.980 1.00 0.00 H new ATOM 0 HG13 VAL A 108 10.609 -4.360 5.635 1.00 0.00 H new ATOM 0 HG21 VAL A 108 10.242 -1.403 4.843 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.269 -2.738 3.667 1.00 0.00 H new ATOM 0 HG23 VAL A 108 8.882 -1.624 3.716 1.00 0.00 H new ATOM 1587 N PHE A 109 7.879 -5.774 6.345 1.00 0.00 N ATOM 1588 CA PHE A 109 7.198 -6.562 7.365 1.00 0.00 C ATOM 1589 C PHE A 109 8.174 -7.011 8.449 1.00 0.00 C ATOM 1590 O PHE A 109 9.169 -7.676 8.164 1.00 0.00 O ATOM 1591 CB PHE A 109 6.526 -7.781 6.732 1.00 0.00 C ATOM 1592 CG PHE A 109 5.399 -7.430 5.802 1.00 0.00 C ATOM 1593 CD1 PHE A 109 5.650 -7.109 4.479 1.00 0.00 C ATOM 1594 CD2 PHE A 109 4.089 -7.423 6.254 1.00 0.00 C ATOM 1595 CE1 PHE A 109 4.616 -6.785 3.621 1.00 0.00 C ATOM 1596 CE2 PHE A 109 3.050 -7.100 5.401 1.00 0.00 C ATOM 1597 CZ PHE A 109 3.313 -6.781 4.083 1.00 0.00 C ATOM 0 H PHE A 109 8.866 -6.003 6.225 1.00 0.00 H new ATOM 0 HA PHE A 109 6.436 -5.933 7.826 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.274 -8.354 6.184 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.146 -8.428 7.523 1.00 0.00 H new ATOM 0 HD1 PHE A 109 6.666 -7.112 4.113 1.00 0.00 H new ATOM 0 HD2 PHE A 109 3.878 -7.672 7.283 1.00 0.00 H new ATOM 0 HE1 PHE A 109 4.826 -6.535 2.591 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.033 -7.097 5.765 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.503 -6.529 3.415 1.00 0.00 H new ATOM 1607 N GLN A 110 7.882 -6.641 9.691 1.00 0.00 N ATOM 1608 CA GLN A 110 8.734 -7.006 10.817 1.00 0.00 C ATOM 1609 C GLN A 110 7.899 -7.318 12.055 1.00 0.00 C ATOM 1610 O GLN A 110 7.079 -6.506 12.483 1.00 0.00 O ATOM 1611 CB GLN A 110 9.721 -5.878 11.124 1.00 0.00 C ATOM 1612 CG GLN A 110 11.090 -6.371 11.566 1.00 0.00 C ATOM 1613 CD GLN A 110 12.045 -6.556 10.404 1.00 0.00 C ATOM 1614 OE1 GLN A 110 12.496 -5.587 9.794 1.00 0.00 O ATOM 1615 NE2 GLN A 110 12.359 -7.808 10.091 1.00 0.00 N ATOM 0 H GLN A 110 7.062 -6.089 9.944 1.00 0.00 H new ATOM 0 HA GLN A 110 9.291 -7.902 10.542 1.00 0.00 H new ATOM 0 HB2 GLN A 110 9.837 -5.256 10.236 1.00 0.00 H new ATOM 0 HB3 GLN A 110 9.303 -5.243 11.905 1.00 0.00 H new ATOM 0 HG2 GLN A 110 11.517 -5.660 12.273 1.00 0.00 H new ATOM 0 HG3 GLN A 110 10.978 -7.318 12.094 1.00 0.00 H new ATOM 0 HE21 GLN A 110 11.962 -8.582 10.624 1.00 0.00 H new ATOM 0 HE22 GLN A 110 12.997 -7.996 9.318 1.00 0.00 H new ATOM 1624 N ASP A 111 8.114 -8.499 12.625 1.00 0.00 N ATOM 1625 CA ASP A 111 7.381 -8.919 13.815 1.00 0.00 C ATOM 1626 C ASP A 111 5.879 -8.937 13.552 1.00 0.00 C ATOM 1627 O ASP A 111 5.076 -8.731 14.462 1.00 0.00 O ATOM 1628 CB ASP A 111 7.695 -7.986 14.987 1.00 0.00 C ATOM 1629 CG ASP A 111 8.823 -8.508 15.855 1.00 0.00 C ATOM 1630 OD1 ASP A 111 8.596 -9.483 16.602 1.00 0.00 O ATOM 1631 OD2 ASP A 111 9.935 -7.942 15.787 1.00 0.00 O ATOM 0 H ASP A 111 8.789 -9.182 12.283 1.00 0.00 H new ATOM 0 HA ASP A 111 7.698 -9.931 14.069 1.00 0.00 H new ATOM 0 HB2 ASP A 111 7.962 -7.001 14.603 1.00 0.00 H new ATOM 0 HB3 ASP A 111 6.800 -7.859 15.596 1.00 0.00 H new ATOM 1636 N GLY A 112 5.504 -9.186 12.301 1.00 0.00 N ATOM 1637 CA GLY A 112 4.099 -9.226 11.941 1.00 0.00 C ATOM 1638 C GLY A 112 3.602 -7.904 11.388 1.00 0.00 C ATOM 1639 O GLY A 112 2.723 -7.876 10.528 1.00 0.00 O ATOM 0 H GLY A 112 6.149 -9.361 11.530 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.940 -10.009 11.200 1.00 0.00 H new ATOM 0 HA3 GLY A 112 3.510 -9.493 12.818 1.00 0.00 H new ATOM 1643 N LYS A 113 4.167 -6.808 11.882 1.00 0.00 N ATOM 1644 CA LYS A 113 3.776 -5.477 11.433 1.00 0.00 C ATOM 1645 C LYS A 113 4.142 -5.269 9.968 1.00 0.00 C ATOM 1646 O LYS A 113 4.707 -6.154 9.325 1.00 0.00 O ATOM 1647 CB LYS A 113 4.448 -4.407 12.295 1.00 0.00 C ATOM 1648 CG LYS A 113 4.270 -4.625 13.788 1.00 0.00 C ATOM 1649 CD LYS A 113 4.774 -3.434 14.587 1.00 0.00 C ATOM 1650 CE LYS A 113 4.550 -3.628 16.078 1.00 0.00 C ATOM 1651 NZ LYS A 113 3.138 -3.981 16.387 1.00 0.00 N ATOM 0 H LYS A 113 4.898 -6.815 12.594 1.00 0.00 H new ATOM 0 HA LYS A 113 2.694 -5.389 11.535 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.513 -4.384 12.065 1.00 0.00 H new ATOM 0 HB3 LYS A 113 4.043 -3.431 12.028 1.00 0.00 H new ATOM 0 HG2 LYS A 113 3.216 -4.794 14.009 1.00 0.00 H new ATOM 0 HG3 LYS A 113 4.807 -5.523 14.093 1.00 0.00 H new ATOM 0 HD2 LYS A 113 5.837 -3.288 14.394 1.00 0.00 H new ATOM 0 HD3 LYS A 113 4.263 -2.530 14.256 1.00 0.00 H new ATOM 0 HE2 LYS A 113 5.209 -4.415 16.444 1.00 0.00 H new ATOM 0 HE3 LYS A 113 4.820 -2.714 16.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 2.954 -3.824 17.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 2.500 -3.384 15.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 2.972 -4.981 16.156 1.00 0.00 H new ATOM 1665 N MET A 114 3.817 -4.091 9.445 1.00 0.00 N ATOM 1666 CA MET A 114 4.112 -3.764 8.055 1.00 0.00 C ATOM 1667 C MET A 114 4.360 -2.268 7.890 1.00 0.00 C ATOM 1668 O MET A 114 3.888 -1.458 8.689 1.00 0.00 O ATOM 1669 CB MET A 114 2.959 -4.205 7.153 1.00 0.00 C ATOM 1670 CG MET A 114 1.596 -3.729 7.627 1.00 0.00 C ATOM 1671 SD MET A 114 0.272 -4.875 7.201 1.00 0.00 S ATOM 1672 CE MET A 114 -0.080 -5.597 8.802 1.00 0.00 C ATOM 0 H MET A 114 3.349 -3.347 9.963 1.00 0.00 H new ATOM 0 HA MET A 114 5.017 -4.298 7.764 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.134 -3.830 6.145 1.00 0.00 H new ATOM 0 HB3 MET A 114 2.953 -5.293 7.092 1.00 0.00 H new ATOM 0 HG2 MET A 114 1.619 -3.593 8.708 1.00 0.00 H new ATOM 0 HG3 MET A 114 1.383 -2.755 7.187 1.00 0.00 H new ATOM 0 HE1 MET A 114 -0.419 -6.625 8.671 1.00 0.00 H new ATOM 0 HE2 MET A 114 0.823 -5.588 9.412 1.00 0.00 H new ATOM 0 HE3 MET A 114 -0.859 -5.018 9.299 1.00 0.00 H new ATOM 1682 N ALA A 115 5.102 -1.907 6.849 1.00 0.00 N ATOM 1683 CA ALA A 115 5.413 -0.510 6.579 1.00 0.00 C ATOM 1684 C ALA A 115 5.853 -0.314 5.132 1.00 0.00 C ATOM 1685 O ALA A 115 6.553 -1.155 4.566 1.00 0.00 O ATOM 1686 CB ALA A 115 6.489 -0.016 7.535 1.00 0.00 C ATOM 0 H ALA A 115 5.499 -2.564 6.178 1.00 0.00 H new ATOM 0 HA ALA A 115 4.507 0.076 6.736 1.00 0.00 H new ATOM 0 HB1 ALA A 115 6.712 1.030 7.323 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.135 -0.110 8.562 1.00 0.00 H new ATOM 0 HB3 ALA A 115 7.392 -0.613 7.407 1.00 0.00 H new ATOM 1692 N LEU A 116 5.439 0.800 4.538 1.00 0.00 N ATOM 1693 CA LEU A 116 5.790 1.106 3.157 1.00 0.00 C ATOM 1694 C LEU A 116 7.003 2.028 3.094 1.00 0.00 C ATOM 1695 O LEU A 116 7.043 3.065 3.758 1.00 0.00 O ATOM 1696 CB LEU A 116 4.606 1.755 2.437 1.00 0.00 C ATOM 1697 CG LEU A 116 4.706 1.773 0.912 1.00 0.00 C ATOM 1698 CD1 LEU A 116 4.152 0.483 0.325 1.00 0.00 C ATOM 1699 CD2 LEU A 116 3.969 2.977 0.345 1.00 0.00 C ATOM 0 H LEU A 116 4.860 1.506 4.992 1.00 0.00 H new ATOM 0 HA LEU A 116 6.041 0.170 2.659 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.695 1.227 2.720 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.503 2.781 2.791 1.00 0.00 H new ATOM 0 HG LEU A 116 5.758 1.851 0.637 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.232 0.514 -0.762 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.722 -0.364 0.706 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.105 0.374 0.609 1.00 0.00 H new ATOM 0 HD21 LEU A 116 4.050 2.975 -0.742 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.918 2.928 0.631 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.410 3.892 0.740 1.00 0.00 H new ATOM 1711 N LEU A 117 7.991 1.646 2.291 1.00 0.00 N ATOM 1712 CA LEU A 117 9.206 2.439 2.141 1.00 0.00 C ATOM 1713 C LEU A 117 9.262 3.091 0.763 1.00 0.00 C ATOM 1714 O LEU A 117 9.176 2.412 -0.260 1.00 0.00 O ATOM 1715 CB LEU A 117 10.441 1.563 2.355 1.00 0.00 C ATOM 1716 CG LEU A 117 11.772 2.318 2.390 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.111 2.734 3.813 1.00 0.00 C ATOM 1718 CD2 LEU A 117 12.885 1.464 1.802 1.00 0.00 C ATOM 0 H LEU A 117 7.974 0.792 1.734 1.00 0.00 H new ATOM 0 HA LEU A 117 9.193 3.226 2.895 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.324 1.019 3.293 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.483 0.820 1.559 1.00 0.00 H new ATOM 0 HG LEU A 117 11.674 3.218 1.783 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.060 3.270 3.819 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.325 3.384 4.199 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.190 1.847 4.442 1.00 0.00 H new ATOM 0 HD21 LEU A 117 13.824 2.017 1.835 1.00 0.00 H new ATOM 0 HD22 LEU A 117 12.984 0.546 2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.646 1.216 0.768 1.00 0.00 H new ATOM 1730 N ALA A 118 9.405 4.412 0.745 1.00 0.00 N ATOM 1731 CA ALA A 118 9.472 5.157 -0.506 1.00 0.00 C ATOM 1732 C ALA A 118 10.734 4.809 -1.287 1.00 0.00 C ATOM 1733 O ALA A 118 11.617 4.115 -0.784 1.00 0.00 O ATOM 1734 CB ALA A 118 9.411 6.653 -0.233 1.00 0.00 C ATOM 0 H ALA A 118 9.477 4.989 1.583 1.00 0.00 H new ATOM 0 HA ALA A 118 8.613 4.875 -1.114 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.462 7.197 -1.176 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.476 6.892 0.274 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.251 6.942 0.399 1.00 0.00 H new ATOM 1740 N SER A 119 10.810 5.297 -2.521 1.00 0.00 N ATOM 1741 CA SER A 119 11.964 5.042 -3.375 1.00 0.00 C ATOM 1742 C SER A 119 13.181 5.847 -2.920 1.00 0.00 C ATOM 1743 O SER A 119 14.285 5.658 -3.431 1.00 0.00 O ATOM 1744 CB SER A 119 11.632 5.381 -4.829 1.00 0.00 C ATOM 1745 OG SER A 119 12.802 5.407 -5.629 1.00 0.00 O ATOM 0 H SER A 119 10.086 5.871 -2.952 1.00 0.00 H new ATOM 0 HA SER A 119 12.208 3.982 -3.298 1.00 0.00 H new ATOM 0 HB2 SER A 119 10.933 4.645 -5.226 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.135 6.350 -4.875 1.00 0.00 H new ATOM 0 HG SER A 119 12.588 5.091 -6.532 1.00 0.00 H new ATOM 1751 N ASN A 120 12.977 6.747 -1.959 1.00 0.00 N ATOM 1752 CA ASN A 120 14.063 7.573 -1.445 1.00 0.00 C ATOM 1753 C ASN A 120 14.662 6.970 -0.177 1.00 0.00 C ATOM 1754 O ASN A 120 15.234 7.683 0.648 1.00 0.00 O ATOM 1755 CB ASN A 120 13.561 8.990 -1.162 1.00 0.00 C ATOM 1756 CG ASN A 120 12.375 9.005 -0.217 1.00 0.00 C ATOM 1757 OD1 ASN A 120 11.967 7.966 0.302 1.00 0.00 O ATOM 1758 ND2 ASN A 120 11.813 10.187 0.009 1.00 0.00 N ATOM 0 H ASN A 120 12.071 6.921 -1.523 1.00 0.00 H new ATOM 0 HA ASN A 120 14.843 7.613 -2.205 1.00 0.00 H new ATOM 0 HB2 ASN A 120 14.371 9.581 -0.734 1.00 0.00 H new ATOM 0 HB3 ASN A 120 13.280 9.467 -2.101 1.00 0.00 H new ATOM 0 HD21 ASN A 120 11.010 10.259 0.634 1.00 0.00 H new ATOM 0 HD22 ASN A 120 12.184 11.023 -0.443 1.00 0.00 H new ATOM 1765 N SER A 121 14.528 5.656 -0.026 1.00 0.00 N ATOM 1766 CA SER A 121 15.059 4.960 1.143 1.00 0.00 C ATOM 1767 C SER A 121 14.519 5.566 2.435 1.00 0.00 C ATOM 1768 O SER A 121 15.214 5.607 3.450 1.00 0.00 O ATOM 1769 CB SER A 121 16.587 5.012 1.142 1.00 0.00 C ATOM 1770 OG SER A 121 17.100 4.945 -0.178 1.00 0.00 O ATOM 0 H SER A 121 14.056 5.051 -0.698 1.00 0.00 H new ATOM 0 HA SER A 121 14.736 3.920 1.091 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.923 5.933 1.619 1.00 0.00 H new ATOM 0 HB3 SER A 121 16.982 4.185 1.731 1.00 0.00 H new ATOM 0 HG SER A 121 18.079 4.982 -0.151 1.00 0.00 H new ATOM 1776 N CYS A 122 13.278 6.037 2.390 1.00 0.00 N ATOM 1777 CA CYS A 122 12.648 6.641 3.558 1.00 0.00 C ATOM 1778 C CYS A 122 11.208 6.163 3.711 1.00 0.00 C ATOM 1779 O CYS A 122 10.455 6.107 2.739 1.00 0.00 O ATOM 1780 CB CYS A 122 12.681 8.168 3.450 1.00 0.00 C ATOM 1781 SG CYS A 122 14.227 8.914 4.016 1.00 0.00 S ATOM 0 H CYS A 122 12.689 6.012 1.558 1.00 0.00 H new ATOM 0 HA CYS A 122 13.209 6.333 4.440 1.00 0.00 H new ATOM 0 HB2 CYS A 122 12.512 8.452 2.411 1.00 0.00 H new ATOM 0 HB3 CYS A 122 11.857 8.581 4.031 1.00 0.00 H new ATOM 0 HG CYS A 122 14.160 10.206 3.884 1.00 0.00 H new ATOM 1787 N PHE A 123 10.832 5.817 4.938 1.00 0.00 N ATOM 1788 CA PHE A 123 9.482 5.342 5.219 1.00 0.00 C ATOM 1789 C PHE A 123 8.467 6.470 5.057 1.00 0.00 C ATOM 1790 O PHE A 123 8.837 7.637 4.924 1.00 0.00 O ATOM 1791 CB PHE A 123 9.404 4.768 6.634 1.00 0.00 C ATOM 1792 CG PHE A 123 10.023 3.405 6.763 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.292 2.266 6.462 1.00 0.00 C ATOM 1794 CD2 PHE A 123 11.336 3.263 7.185 1.00 0.00 C ATOM 1795 CE1 PHE A 123 9.859 1.012 6.579 1.00 0.00 C ATOM 1796 CE2 PHE A 123 11.908 2.011 7.304 1.00 0.00 C ATOM 1797 CZ PHE A 123 11.169 0.883 7.001 1.00 0.00 C ATOM 0 H PHE A 123 11.443 5.857 5.754 1.00 0.00 H new ATOM 0 HA PHE A 123 9.243 4.555 4.504 1.00 0.00 H new ATOM 0 HB2 PHE A 123 9.902 5.451 7.322 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.359 4.714 6.938 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.268 2.360 6.132 1.00 0.00 H new ATOM 0 HD2 PHE A 123 11.918 4.141 7.423 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.279 0.133 6.341 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.932 1.914 7.634 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.614 -0.097 7.094 1.00 0.00 H new ATOM 1807 N ILE A 124 7.187 6.113 5.069 1.00 0.00 N ATOM 1808 CA ILE A 124 6.119 7.096 4.923 1.00 0.00 C ATOM 1809 C ILE A 124 5.507 7.448 6.275 1.00 0.00 C ATOM 1810 O ILE A 124 5.618 6.686 7.235 1.00 0.00 O ATOM 1811 CB ILE A 124 5.008 6.583 3.988 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.532 5.200 4.433 1.00 0.00 C ATOM 1813 CG2 ILE A 124 5.503 6.542 2.550 1.00 0.00 C ATOM 1814 CD1 ILE A 124 3.032 5.018 4.339 1.00 0.00 C ATOM 0 H ILE A 124 6.864 5.152 5.178 1.00 0.00 H new ATOM 0 HA ILE A 124 6.568 7.988 4.487 1.00 0.00 H new ATOM 0 HB ILE A 124 4.164 7.270 4.042 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.021 4.442 3.821 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.847 5.030 5.463 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.707 6.177 1.901 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.796 7.544 2.237 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.362 5.875 2.480 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.766 4.014 4.670 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.536 5.753 4.973 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.713 5.156 3.306 1.00 0.00 H new ATOM 1826 N ARG A 125 4.863 8.608 6.341 1.00 0.00 N ATOM 1827 CA ARG A 125 4.232 9.063 7.575 1.00 0.00 C ATOM 1828 C ARG A 125 3.492 10.377 7.354 1.00 0.00 C ATOM 1829 O ARG A 125 3.990 11.276 6.676 1.00 0.00 O ATOM 1830 CB ARG A 125 5.282 9.235 8.675 1.00 0.00 C ATOM 1831 CG ARG A 125 4.697 9.244 10.077 1.00 0.00 C ATOM 1832 CD ARG A 125 5.550 10.065 11.030 1.00 0.00 C ATOM 1833 NE ARG A 125 4.812 10.449 12.232 1.00 0.00 N ATOM 1834 CZ ARG A 125 4.473 9.598 13.198 1.00 0.00 C ATOM 1835 NH1 ARG A 125 4.802 8.314 13.106 1.00 0.00 N ATOM 1836 NH2 ARG A 125 3.803 10.030 14.257 1.00 0.00 N ATOM 0 H ARG A 125 4.764 9.250 5.555 1.00 0.00 H new ATOM 0 HA ARG A 125 3.510 8.308 7.885 1.00 0.00 H new ATOM 0 HB2 ARG A 125 6.011 8.428 8.599 1.00 0.00 H new ATOM 0 HB3 ARG A 125 5.821 10.168 8.509 1.00 0.00 H new ATOM 0 HG2 ARG A 125 3.686 9.651 10.048 1.00 0.00 H new ATOM 0 HG3 ARG A 125 4.618 8.221 10.446 1.00 0.00 H new ATOM 0 HD2 ARG A 125 6.432 9.491 11.314 1.00 0.00 H new ATOM 0 HD3 ARG A 125 5.904 10.961 10.520 1.00 0.00 H new ATOM 0 HE ARG A 125 4.541 11.427 12.337 1.00 0.00 H new ATOM 0 HH11 ARG A 125 5.317 7.976 12.293 1.00 0.00 H new ATOM 0 HH12 ARG A 125 4.540 7.666 13.849 1.00 0.00 H new ATOM 0 HH21 ARG A 125 3.547 11.015 14.332 1.00 0.00 H new ATOM 0 HH22 ARG A 125 3.543 9.378 14.997 1.00 0.00 H new ATOM 1850 N CYS A 126 2.298 10.483 7.929 1.00 0.00 N ATOM 1851 CA CYS A 126 1.489 11.688 7.795 1.00 0.00 C ATOM 1852 C CYS A 126 1.991 12.788 8.725 1.00 0.00 C ATOM 1853 O CYS A 126 2.822 12.544 9.599 1.00 0.00 O ATOM 1854 CB CYS A 126 0.021 11.379 8.096 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.256 10.621 9.715 1.00 0.00 S ATOM 0 H CYS A 126 1.870 9.748 8.492 1.00 0.00 H new ATOM 0 HA CYS A 126 1.575 12.040 6.767 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.554 12.303 8.036 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.365 10.713 7.324 1.00 0.00 H new ATOM 0 HG CYS A 126 -1.328 11.123 10.252 1.00 0.00 H new ATOM 1861 N ASN A 127 1.482 14.001 8.529 1.00 0.00 N ATOM 1862 CA ASN A 127 1.879 15.139 9.350 1.00 0.00 C ATOM 1863 C ASN A 127 0.701 15.656 10.169 1.00 0.00 C ATOM 1864 O ASN A 127 -0.435 15.219 9.986 1.00 0.00 O ATOM 1865 CB ASN A 127 2.436 16.259 8.469 1.00 0.00 C ATOM 1866 CG ASN A 127 3.945 16.201 8.346 1.00 0.00 C ATOM 1867 OD1 ASN A 127 4.613 15.475 9.083 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.492 16.969 7.410 1.00 0.00 N ATOM 0 H ASN A 127 0.794 14.220 7.809 1.00 0.00 H new ATOM 0 HA ASN A 127 2.657 14.807 10.038 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.990 16.192 7.476 1.00 0.00 H new ATOM 0 HB3 ASN A 127 2.145 17.224 8.885 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.504 16.972 7.280 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.900 17.555 6.821 1.00 0.00 H new ATOM 1875 N GLU A 128 0.981 16.590 11.072 1.00 0.00 N ATOM 1876 CA GLU A 128 -0.056 17.167 11.920 1.00 0.00 C ATOM 1877 C GLU A 128 -0.772 18.306 11.202 1.00 0.00 C ATOM 1878 O GLU A 128 -1.961 18.542 11.423 1.00 0.00 O ATOM 1879 CB GLU A 128 0.551 17.676 13.228 1.00 0.00 C ATOM 1880 CG GLU A 128 1.135 16.574 14.098 1.00 0.00 C ATOM 1881 CD GLU A 128 2.166 17.092 15.081 1.00 0.00 C ATOM 1882 OE1 GLU A 128 2.851 18.084 14.754 1.00 0.00 O ATOM 1883 OE2 GLU A 128 2.289 16.506 16.177 1.00 0.00 O ATOM 0 H GLU A 128 1.916 16.963 11.235 1.00 0.00 H new ATOM 0 HA GLU A 128 -0.784 16.387 12.144 1.00 0.00 H new ATOM 0 HB2 GLU A 128 1.334 18.399 12.998 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -0.216 18.205 13.793 1.00 0.00 H new ATOM 0 HG2 GLU A 128 0.330 16.084 14.646 1.00 0.00 H new ATOM 0 HG3 GLU A 128 1.594 15.818 13.461 1.00 0.00 H new ATOM 1890 N ALA A 129 -0.043 19.010 10.343 1.00 0.00 N ATOM 1891 CA ALA A 129 -0.610 20.124 9.593 1.00 0.00 C ATOM 1892 C ALA A 129 -1.505 19.627 8.463 1.00 0.00 C ATOM 1893 O ALA A 129 -2.627 20.104 8.291 1.00 0.00 O ATOM 1894 CB ALA A 129 0.501 21.006 9.041 1.00 0.00 C ATOM 0 H ALA A 129 0.942 18.829 10.149 1.00 0.00 H new ATOM 0 HA ALA A 129 -1.224 20.714 10.273 1.00 0.00 H new ATOM 0 HB1 ALA A 129 0.065 21.834 8.483 1.00 0.00 H new ATOM 0 HB2 ALA A 129 1.098 21.398 9.865 1.00 0.00 H new ATOM 0 HB3 ALA A 129 1.137 20.418 8.380 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.001 18.667 7.696 1.00 0.00 N ATOM 1901 CA GLY A 130 -1.767 18.121 6.592 1.00 0.00 C ATOM 1902 C GLY A 130 -0.917 17.874 5.361 1.00 0.00 C ATOM 1903 O GLY A 130 -1.320 18.204 4.244 1.00 0.00 O ATOM 0 H GLY A 130 -0.075 18.257 7.819 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.230 17.185 6.903 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -2.575 18.808 6.340 1.00 0.00 H new ATOM 1907 N ASP A 131 0.260 17.294 5.564 1.00 0.00 N ATOM 1908 CA ASP A 131 1.169 17.002 4.461 1.00 0.00 C ATOM 1909 C ASP A 131 1.987 15.747 4.747 1.00 0.00 C ATOM 1910 O ASP A 131 2.968 15.788 5.488 1.00 0.00 O ATOM 1911 CB ASP A 131 2.103 18.190 4.218 1.00 0.00 C ATOM 1912 CG ASP A 131 1.363 19.413 3.712 1.00 0.00 C ATOM 1913 OD1 ASP A 131 0.775 20.137 4.543 1.00 0.00 O ATOM 1914 OD2 ASP A 131 1.372 19.648 2.485 1.00 0.00 O ATOM 0 H ASP A 131 0.608 17.016 6.482 1.00 0.00 H new ATOM 0 HA ASP A 131 0.572 16.827 3.566 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.619 18.439 5.145 1.00 0.00 H new ATOM 0 HB3 ASP A 131 2.867 17.906 3.495 1.00 0.00 H new ATOM 1919 N ILE A 132 1.575 14.633 4.151 1.00 0.00 N ATOM 1920 CA ILE A 132 2.269 13.364 4.339 1.00 0.00 C ATOM 1921 C ILE A 132 3.617 13.366 3.626 1.00 0.00 C ATOM 1922 O ILE A 132 3.686 13.536 2.408 1.00 0.00 O ATOM 1923 CB ILE A 132 1.428 12.179 3.823 1.00 0.00 C ATOM 1924 CG1 ILE A 132 0.011 12.241 4.397 1.00 0.00 C ATOM 1925 CG2 ILE A 132 2.093 10.859 4.184 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -1.028 11.592 3.509 1.00 0.00 C ATOM 0 H ILE A 132 0.764 14.583 3.534 1.00 0.00 H new ATOM 0 HA ILE A 132 2.427 13.246 5.411 1.00 0.00 H new ATOM 0 HB ILE A 132 1.363 12.246 2.737 1.00 0.00 H new ATOM 0 HG12 ILE A 132 0.001 11.753 5.372 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.261 13.284 4.560 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.487 10.033 3.813 1.00 0.00 H new ATOM 0 HG22 ILE A 132 3.083 10.815 3.731 1.00 0.00 H new ATOM 0 HG23 ILE A 132 2.186 10.783 5.267 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -2.009 11.673 3.978 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -1.045 12.095 2.542 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -0.779 10.540 3.367 1.00 0.00 H new ATOM 1938 N GLU A 133 4.687 13.177 4.392 1.00 0.00 N ATOM 1939 CA GLU A 133 6.033 13.158 3.833 1.00 0.00 C ATOM 1940 C GLU A 133 6.809 11.941 4.325 1.00 0.00 C ATOM 1941 O GLU A 133 6.521 11.399 5.392 1.00 0.00 O ATOM 1942 CB GLU A 133 6.780 14.439 4.207 1.00 0.00 C ATOM 1943 CG GLU A 133 6.630 14.826 5.669 1.00 0.00 C ATOM 1944 CD GLU A 133 7.693 15.806 6.126 1.00 0.00 C ATOM 1945 OE1 GLU A 133 8.112 16.651 5.308 1.00 0.00 O ATOM 1946 OE2 GLU A 133 8.105 15.728 7.302 1.00 0.00 O ATOM 0 H GLU A 133 4.647 13.035 5.401 1.00 0.00 H new ATOM 0 HA GLU A 133 5.949 13.098 2.748 1.00 0.00 H new ATOM 0 HB2 GLU A 133 7.839 14.312 3.980 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.417 15.257 3.584 1.00 0.00 H new ATOM 0 HG2 GLU A 133 5.645 15.266 5.825 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.680 13.928 6.285 1.00 0.00 H new ATOM 1953 N ALA A 134 7.796 11.518 3.542 1.00 0.00 N ATOM 1954 CA ALA A 134 8.614 10.365 3.899 1.00 0.00 C ATOM 1955 C ALA A 134 9.500 10.673 5.100 1.00 0.00 C ATOM 1956 O ALA A 134 10.438 11.466 5.006 1.00 0.00 O ATOM 1957 CB ALA A 134 9.461 9.932 2.712 1.00 0.00 C ATOM 0 H ALA A 134 8.049 11.956 2.656 1.00 0.00 H new ATOM 0 HA ALA A 134 7.947 9.547 4.173 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.067 9.070 2.992 1.00 0.00 H new ATOM 0 HB2 ALA A 134 8.811 9.663 1.880 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.113 10.752 2.412 1.00 0.00 H new ATOM 1963 N LYS A 135 9.197 10.041 6.229 1.00 0.00 N ATOM 1964 CA LYS A 135 9.967 10.249 7.451 1.00 0.00 C ATOM 1965 C LYS A 135 11.399 9.751 7.283 1.00 0.00 C ATOM 1966 O LYS A 135 11.756 9.195 6.244 1.00 0.00 O ATOM 1967 CB LYS A 135 9.297 9.531 8.626 1.00 0.00 C ATOM 1968 CG LYS A 135 9.143 10.401 9.863 1.00 0.00 C ATOM 1969 CD LYS A 135 10.006 9.900 11.011 1.00 0.00 C ATOM 1970 CE LYS A 135 10.346 11.019 11.983 1.00 0.00 C ATOM 1971 NZ LYS A 135 11.126 12.107 11.330 1.00 0.00 N ATOM 0 H LYS A 135 8.425 9.381 6.324 1.00 0.00 H new ATOM 0 HA LYS A 135 9.997 11.319 7.657 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.313 9.181 8.314 1.00 0.00 H new ATOM 0 HB3 LYS A 135 9.883 8.648 8.883 1.00 0.00 H new ATOM 0 HG2 LYS A 135 9.417 11.428 9.622 1.00 0.00 H new ATOM 0 HG3 LYS A 135 8.098 10.414 10.172 1.00 0.00 H new ATOM 0 HD2 LYS A 135 9.483 9.104 11.540 1.00 0.00 H new ATOM 0 HD3 LYS A 135 10.925 9.469 10.615 1.00 0.00 H new ATOM 0 HE2 LYS A 135 9.426 11.431 12.398 1.00 0.00 H new ATOM 0 HE3 LYS A 135 10.918 10.613 12.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 11.593 12.684 12.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 11.845 11.691 10.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 10.485 12.707 10.772 1.00 0.00 H new ATOM 1985 N ASN A 136 12.216 9.955 8.312 1.00 0.00 N ATOM 1986 CA ASN A 136 13.609 9.527 8.278 1.00 0.00 C ATOM 1987 C ASN A 136 13.710 8.019 8.072 1.00 0.00 C ATOM 1988 O ASN A 136 12.698 7.321 8.017 1.00 0.00 O ATOM 1989 CB ASN A 136 14.319 9.926 9.574 1.00 0.00 C ATOM 1990 CG ASN A 136 15.010 11.271 9.463 1.00 0.00 C ATOM 1991 OD1 ASN A 136 14.581 12.253 10.068 1.00 0.00 O ATOM 1992 ND2 ASN A 136 16.085 11.321 8.686 1.00 0.00 N ATOM 0 H ASN A 136 11.937 10.414 9.179 1.00 0.00 H new ATOM 0 HA ASN A 136 14.095 10.023 7.438 1.00 0.00 H new ATOM 0 HB2 ASN A 136 13.594 9.959 10.387 1.00 0.00 H new ATOM 0 HB3 ASN A 136 15.054 9.163 9.833 1.00 0.00 H new ATOM 0 HD21 ASN A 136 16.591 12.199 8.572 1.00 0.00 H new ATOM 0 HD22 ASN A 136 16.405 10.481 8.203 1.00 0.00 H new ATOM 1999 N LYS A 137 14.937 7.522 7.960 1.00 0.00 N ATOM 2000 CA LYS A 137 15.169 6.096 7.761 1.00 0.00 C ATOM 2001 C LYS A 137 14.757 5.299 8.994 1.00 0.00 C ATOM 2002 O LYS A 137 14.331 4.149 8.888 1.00 0.00 O ATOM 2003 CB LYS A 137 16.643 5.838 7.439 1.00 0.00 C ATOM 2004 CG LYS A 137 16.851 4.853 6.300 1.00 0.00 C ATOM 2005 CD LYS A 137 18.319 4.745 5.919 1.00 0.00 C ATOM 2006 CE LYS A 137 18.494 4.507 4.427 1.00 0.00 C ATOM 2007 NZ LYS A 137 19.403 3.361 4.150 1.00 0.00 N ATOM 0 H LYS A 137 15.786 8.085 8.004 1.00 0.00 H new ATOM 0 HA LYS A 137 14.558 5.768 6.920 1.00 0.00 H new ATOM 0 HB2 LYS A 137 17.122 6.783 7.183 1.00 0.00 H new ATOM 0 HB3 LYS A 137 17.141 5.460 8.332 1.00 0.00 H new ATOM 0 HG2 LYS A 137 16.477 3.872 6.593 1.00 0.00 H new ATOM 0 HG3 LYS A 137 16.271 5.170 5.433 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.838 5.660 6.205 1.00 0.00 H new ATOM 0 HD3 LYS A 137 18.781 3.929 6.475 1.00 0.00 H new ATOM 0 HE2 LYS A 137 17.521 4.317 3.973 1.00 0.00 H new ATOM 0 HE3 LYS A 137 18.893 5.408 3.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 19.496 3.232 3.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 20.339 3.553 4.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 19.010 2.496 4.573 1.00 0.00 H new ATOM 2021 N THR A 138 14.885 5.919 10.163 1.00 0.00 N ATOM 2022 CA THR A 138 14.524 5.266 11.417 1.00 0.00 C ATOM 2023 C THR A 138 13.054 4.858 11.415 1.00 0.00 C ATOM 2024 O THR A 138 12.166 5.706 11.323 1.00 0.00 O ATOM 2025 CB THR A 138 14.808 6.194 12.599 1.00 0.00 C ATOM 2026 OG1 THR A 138 14.656 7.550 12.220 1.00 0.00 O ATOM 2027 CG2 THR A 138 16.200 6.029 13.170 1.00 0.00 C ATOM 0 H THR A 138 15.235 6.871 10.268 1.00 0.00 H new ATOM 0 HA THR A 138 15.131 4.366 11.517 1.00 0.00 H new ATOM 0 HB THR A 138 14.084 5.915 13.365 1.00 0.00 H new ATOM 0 HG1 THR A 138 14.840 8.128 12.990 1.00 0.00 H new ATOM 0 HG21 THR A 138 16.335 6.717 14.005 1.00 0.00 H new ATOM 0 HG22 THR A 138 16.331 5.005 13.519 1.00 0.00 H new ATOM 0 HG23 THR A 138 16.938 6.247 12.398 1.00 0.00 H new ATOM 2035 N ALA A 139 12.807 3.557 11.519 1.00 0.00 N ATOM 2036 CA ALA A 139 11.444 3.038 11.528 1.00 0.00 C ATOM 2037 C ALA A 139 11.028 2.614 12.933 1.00 0.00 C ATOM 2038 O ALA A 139 11.493 1.599 13.449 1.00 0.00 O ATOM 2039 CB ALA A 139 11.320 1.868 10.563 1.00 0.00 C ATOM 0 H ALA A 139 13.531 2.843 11.598 1.00 0.00 H new ATOM 0 HA ALA A 139 10.775 3.835 11.204 1.00 0.00 H new ATOM 0 HB1 ALA A 139 10.298 1.490 10.579 1.00 0.00 H new ATOM 0 HB2 ALA A 139 11.568 2.200 9.555 1.00 0.00 H new ATOM 0 HB3 ALA A 139 12.005 1.075 10.863 1.00 0.00 H new ATOM 2045 N GLY A 140 10.148 3.399 13.546 1.00 0.00 N ATOM 2046 CA GLY A 140 9.685 3.089 14.886 1.00 0.00 C ATOM 2047 C GLY A 140 8.363 2.347 14.884 1.00 0.00 C ATOM 2048 O GLY A 140 7.774 2.115 13.828 1.00 0.00 O ATOM 0 H GLY A 140 9.747 4.244 13.139 1.00 0.00 H new ATOM 0 HA2 GLY A 140 10.436 2.486 15.396 1.00 0.00 H new ATOM 0 HA3 GLY A 140 9.579 4.013 15.454 1.00 0.00 H new ATOM 2052 N GLU A 141 7.897 1.972 16.071 1.00 0.00 N ATOM 2053 CA GLU A 141 6.635 1.250 16.204 1.00 0.00 C ATOM 2054 C GLU A 141 5.477 2.076 15.651 1.00 0.00 C ATOM 2055 O GLU A 141 4.600 1.551 14.965 1.00 0.00 O ATOM 2056 CB GLU A 141 6.376 0.900 17.671 1.00 0.00 C ATOM 2057 CG GLU A 141 6.774 -0.521 18.036 1.00 0.00 C ATOM 2058 CD GLU A 141 7.012 -0.696 19.523 1.00 0.00 C ATOM 2059 OE1 GLU A 141 7.540 0.244 20.154 1.00 0.00 O ATOM 2060 OE2 GLU A 141 6.672 -1.773 20.055 1.00 0.00 O ATOM 0 H GLU A 141 8.373 2.156 16.954 1.00 0.00 H new ATOM 0 HA GLU A 141 6.708 0.328 15.627 1.00 0.00 H new ATOM 0 HB2 GLU A 141 6.925 1.597 18.305 1.00 0.00 H new ATOM 0 HB3 GLU A 141 5.317 1.039 17.888 1.00 0.00 H new ATOM 0 HG2 GLU A 141 5.991 -1.208 17.714 1.00 0.00 H new ATOM 0 HG3 GLU A 141 7.679 -0.792 17.493 1.00 0.00 H new ATOM 2067 N GLU A 142 5.481 3.369 15.954 1.00 0.00 N ATOM 2068 CA GLU A 142 4.432 4.267 15.487 1.00 0.00 C ATOM 2069 C GLU A 142 4.394 4.311 13.962 1.00 0.00 C ATOM 2070 O GLU A 142 3.324 4.417 13.362 1.00 0.00 O ATOM 2071 CB GLU A 142 4.651 5.676 16.044 1.00 0.00 C ATOM 2072 CG GLU A 142 6.048 6.220 15.791 1.00 0.00 C ATOM 2073 CD GLU A 142 6.628 6.923 17.002 1.00 0.00 C ATOM 2074 OE1 GLU A 142 6.048 7.943 17.431 1.00 0.00 O ATOM 2075 OE2 GLU A 142 7.662 6.453 17.522 1.00 0.00 O ATOM 0 H GLU A 142 6.199 3.819 16.521 1.00 0.00 H new ATOM 0 HA GLU A 142 3.476 3.887 15.847 1.00 0.00 H new ATOM 0 HB2 GLU A 142 3.921 6.351 15.598 1.00 0.00 H new ATOM 0 HB3 GLU A 142 4.463 5.667 17.118 1.00 0.00 H new ATOM 0 HG2 GLU A 142 6.706 5.401 15.501 1.00 0.00 H new ATOM 0 HG3 GLU A 142 6.017 6.915 14.952 1.00 0.00 H new ATOM 2082 N GLU A 143 5.566 4.230 13.344 1.00 0.00 N ATOM 2083 CA GLU A 143 5.667 4.259 11.889 1.00 0.00 C ATOM 2084 C GLU A 143 4.983 3.042 11.269 1.00 0.00 C ATOM 2085 O GLU A 143 4.535 3.088 10.124 1.00 0.00 O ATOM 2086 CB GLU A 143 7.136 4.311 11.461 1.00 0.00 C ATOM 2087 CG GLU A 143 7.534 5.630 10.818 1.00 0.00 C ATOM 2088 CD GLU A 143 8.534 6.409 11.651 1.00 0.00 C ATOM 2089 OE1 GLU A 143 8.311 6.544 12.872 1.00 0.00 O ATOM 2090 OE2 GLU A 143 9.540 6.883 11.083 1.00 0.00 O ATOM 0 H GLU A 143 6.460 4.144 13.827 1.00 0.00 H new ATOM 0 HA GLU A 143 5.160 5.155 11.532 1.00 0.00 H new ATOM 0 HB2 GLU A 143 7.767 4.136 12.333 1.00 0.00 H new ATOM 0 HB3 GLU A 143 7.331 3.500 10.759 1.00 0.00 H new ATOM 0 HG2 GLU A 143 7.960 5.436 9.834 1.00 0.00 H new ATOM 0 HG3 GLU A 143 6.643 6.238 10.665 1.00 0.00 H new ATOM 2097 N MET A 144 4.909 1.955 12.032 1.00 0.00 N ATOM 2098 CA MET A 144 4.281 0.727 11.556 1.00 0.00 C ATOM 2099 C MET A 144 2.846 0.986 11.105 1.00 0.00 C ATOM 2100 O MET A 144 1.990 1.359 11.907 1.00 0.00 O ATOM 2101 CB MET A 144 4.298 -0.338 12.654 1.00 0.00 C ATOM 2102 CG MET A 144 5.691 -0.660 13.168 1.00 0.00 C ATOM 2103 SD MET A 144 6.566 -1.832 12.113 1.00 0.00 S ATOM 2104 CE MET A 144 7.746 -0.748 11.311 1.00 0.00 C ATOM 0 H MET A 144 5.276 1.900 12.982 1.00 0.00 H new ATOM 0 HA MET A 144 4.851 0.367 10.700 1.00 0.00 H new ATOM 0 HB2 MET A 144 3.682 0.001 13.487 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.841 -1.250 12.271 1.00 0.00 H new ATOM 0 HG2 MET A 144 6.270 0.261 13.240 1.00 0.00 H new ATOM 0 HG3 MET A 144 5.617 -1.069 14.176 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.364 -1.327 10.624 1.00 0.00 H new ATOM 0 HE2 MET A 144 7.212 0.024 10.756 1.00 0.00 H new ATOM 0 HE3 MET A 144 8.381 -0.281 12.064 1.00 0.00 H new ATOM 2114 N ILE A 145 2.592 0.785 9.815 1.00 0.00 N ATOM 2115 CA ILE A 145 1.261 0.996 9.257 1.00 0.00 C ATOM 2116 C ILE A 145 0.573 -0.331 8.961 1.00 0.00 C ATOM 2117 O ILE A 145 1.138 -1.400 9.192 1.00 0.00 O ATOM 2118 CB ILE A 145 1.322 1.829 7.963 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.288 1.191 6.963 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.740 3.260 8.272 1.00 0.00 C ATOM 2121 CD1 ILE A 145 1.893 1.405 5.518 1.00 0.00 C ATOM 0 H ILE A 145 3.290 0.477 9.138 1.00 0.00 H new ATOM 0 HA ILE A 145 0.686 1.541 10.006 1.00 0.00 H new ATOM 0 HB ILE A 145 0.328 1.850 7.516 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.286 1.600 7.123 1.00 0.00 H new ATOM 0 HG13 ILE A 145 2.347 0.121 7.160 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.778 3.836 7.347 1.00 0.00 H new ATOM 0 HG22 ILE A 145 1.017 3.712 8.951 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.725 3.259 8.740 1.00 0.00 H new ATOM 0 HD11 ILE A 145 2.623 0.925 4.866 1.00 0.00 H new ATOM 0 HD12 ILE A 145 0.909 0.971 5.342 1.00 0.00 H new ATOM 0 HD13 ILE A 145 1.862 2.473 5.304 1.00 0.00 H new ATOM 2133 N LYS A 146 -0.651 -0.255 8.448 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.418 -1.453 8.121 1.00 0.00 C ATOM 2135 C LYS A 146 -2.020 -1.347 6.724 1.00 0.00 C ATOM 2136 O LYS A 146 -2.978 -0.605 6.504 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.526 -1.671 9.152 1.00 0.00 C ATOM 2138 CG LYS A 146 -2.017 -2.164 10.497 1.00 0.00 C ATOM 2139 CD LYS A 146 -3.109 -2.877 11.278 1.00 0.00 C ATOM 2140 CE LYS A 146 -2.559 -4.078 12.032 1.00 0.00 C ATOM 2141 NZ LYS A 146 -1.315 -3.744 12.778 1.00 0.00 N ATOM 0 H LYS A 146 -1.133 0.622 8.250 1.00 0.00 H new ATOM 0 HA LYS A 146 -0.740 -2.306 8.141 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.065 -0.735 9.298 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.242 -2.392 8.757 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -1.177 -2.841 10.343 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -1.644 -1.320 11.078 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -3.567 -2.182 11.982 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -3.893 -3.203 10.595 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -3.312 -4.445 12.729 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -2.355 -4.885 11.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -1.213 -4.388 13.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -0.494 -3.847 12.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -1.368 -2.763 13.120 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.454 -2.094 5.782 1.00 0.00 N ATOM 2156 CA ILE A 147 -1.936 -2.084 4.406 1.00 0.00 C ATOM 2157 C ILE A 147 -2.973 -3.179 4.180 1.00 0.00 C ATOM 2158 O ILE A 147 -2.670 -4.367 4.287 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.781 -2.272 3.403 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.377 -1.329 3.739 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.273 -2.037 1.982 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.613 -2.046 4.236 1.00 0.00 C ATOM 0 H ILE A 147 -0.661 -2.714 5.946 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.396 -1.110 4.239 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.418 -3.297 3.476 1.00 0.00 H new ATOM 0 HG12 ILE A 147 0.634 -0.751 2.851 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.049 -0.619 4.498 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.447 -2.173 1.284 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -2.066 -2.748 1.749 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.659 -1.021 1.894 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.393 -1.317 4.455 1.00 0.00 H new ATOM 0 HD12 ILE A 147 1.372 -2.602 5.142 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.966 -2.736 3.470 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.198 -2.771 3.865 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.281 -3.717 3.624 1.00 0.00 C ATOM 2176 C ARG A 148 -5.418 -4.018 2.135 1.00 0.00 C ATOM 2177 O ARG A 148 -4.954 -3.251 1.292 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.599 -3.166 4.169 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.588 -2.939 5.672 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.642 -1.927 6.091 1.00 0.00 C ATOM 2181 NE ARG A 148 -7.191 -1.097 7.206 1.00 0.00 N ATOM 2182 CZ ARG A 148 -7.195 -1.495 8.476 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -7.624 -2.710 8.796 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -6.768 -0.678 9.428 1.00 0.00 N ATOM 0 H ARG A 148 -4.465 -1.791 3.771 1.00 0.00 H new ATOM 0 HA ARG A 148 -5.042 -4.645 4.143 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.824 -2.224 3.669 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.403 -3.858 3.920 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -6.766 -3.884 6.185 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.603 -2.589 5.981 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -7.891 -1.290 5.242 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -8.555 -2.451 6.375 1.00 0.00 H new ATOM 0 HE ARG A 148 -6.853 -0.157 6.999 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -7.953 -3.343 8.067 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -7.625 -3.010 9.771 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -6.436 0.256 9.187 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -6.771 -0.983 10.401 1.00 0.00 H new ATOM 2198 N SER A 149 -6.058 -5.139 1.821 1.00 0.00 N ATOM 2199 CA SER A 149 -6.258 -5.542 0.434 1.00 0.00 C ATOM 2200 C SER A 149 -7.679 -6.049 0.212 1.00 0.00 C ATOM 2201 O SER A 149 -8.165 -6.906 0.949 1.00 0.00 O ATOM 2202 CB SER A 149 -5.250 -6.627 0.047 1.00 0.00 C ATOM 2203 OG SER A 149 -5.534 -7.154 -1.237 1.00 0.00 O ATOM 0 H SER A 149 -6.447 -5.785 2.508 1.00 0.00 H new ATOM 0 HA SER A 149 -6.102 -4.668 -0.198 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.242 -6.212 0.058 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.273 -7.428 0.785 1.00 0.00 H new ATOM 0 HG SER A 149 -5.264 -8.095 -1.271 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.340 -5.512 -0.809 1.00 0.00 N ATOM 2210 CA CYS A 150 -9.706 -5.909 -1.128 1.00 0.00 C ATOM 2211 C CYS A 150 -9.747 -6.733 -2.412 1.00 0.00 C ATOM 2212 O CYS A 150 -10.719 -6.680 -3.165 1.00 0.00 O ATOM 2213 CB CYS A 150 -10.599 -4.675 -1.273 1.00 0.00 C ATOM 2214 SG CYS A 150 -10.122 -3.574 -2.625 1.00 0.00 S ATOM 0 H CYS A 150 -7.952 -4.801 -1.429 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.079 -6.524 -0.309 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -11.628 -5.000 -1.429 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -10.580 -4.114 -0.338 1.00 0.00 H new ATOM 0 HG CYS A 150 -9.901 -2.382 -2.156 1.00 0.00 H new ATOM 2220 N ALA A 151 -8.686 -7.495 -2.653 1.00 0.00 N ATOM 2221 CA ALA A 151 -8.601 -8.332 -3.845 1.00 0.00 C ATOM 2222 C ALA A 151 -9.345 -9.647 -3.646 1.00 0.00 C ATOM 2223 O ALA A 151 -9.598 -10.064 -2.516 1.00 0.00 O ATOM 2224 CB ALA A 151 -7.146 -8.595 -4.201 1.00 0.00 C ATOM 0 H ALA A 151 -7.873 -7.551 -2.039 1.00 0.00 H new ATOM 0 HA ALA A 151 -9.075 -7.798 -4.669 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -7.097 -9.221 -5.092 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -6.642 -7.648 -4.394 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -6.655 -9.105 -3.372 1.00 0.00 H new