USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1058 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 ASN : amide:sc= -5.47! C(o=-5.8!,f=-13!) USER MOD Set 1.2: A 122 CYS SG : rot 62:sc= -0.361 USER MOD Set 2.1: A 65 THR OG1 : rot -160:sc=0.000443 USER MOD Set 2.2: A 77 LYS NZ :NH3+ -179:sc= 0.00029 (180deg=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.945 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -2.27 K(o=-2.3,f=-0.48) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -154:sc= -2.66! (180deg=-2.86!) USER MOD Single : A 33 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0283) USER MOD Single : A 36 TYR OH : rot -91:sc= 0.52 USER MOD Single : A 38 HIS : no HD1:sc= -0.0642 X(o=-0.064,f=-0.45) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.268 USER MOD Single : A 51 HIS : no HD1:sc=-0.00867 X(o=-0.0087,f=-0.016) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= -0.257 K(o=-0.26,f=-2.3!) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc=-0.00206 USER MOD Single : A 72 SER OG : rot -30:sc= 0.612 USER MOD Single : A 78 SER OG : rot 180:sc= 0.00844 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 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.46 K(o=-0.46,f=-1.8!) USER MOD Single : A 88 SER OG : rot 180:sc= 0.0433 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= -0.171 X(o=-0.17,f=-0.0015) USER MOD Single : A 110 GLN : amide:sc= -0.0954 X(o=-0.095,f=0) USER MOD Single : A 113 LYS NZ :NH3+ 159:sc= -0.338 (180deg=-0.951) USER MOD Single : A 114 MET CE :methyl -158:sc= 0 (180deg=-1.38) USER MOD Single : A 119 SER OG : rot 171:sc= 0.00328 USER MOD Single : A 121 SER OG : rot -28:sc= 0.751 USER MOD Single : A 126 CYS SG : rot 180:sc= 0.0316 USER MOD Single : A 127 ASN : amide:sc= -0.316 K(o=-0.32,f=-4.8!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 40:sc= 0.104 USER MOD Single : A 144 MET CE :methyl 161:sc= -5.04! (180deg=-5.16!) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= -0.162 USER MOD Single : A 150 CYS SG : rot -47:sc= 0.706 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -6.794 -9.184 10.753 1.00 0.00 N ATOM 88 CA ASP A 9 -7.741 -8.079 10.846 1.00 0.00 C ATOM 89 C ASP A 9 -8.523 -7.922 9.546 1.00 0.00 C ATOM 90 O ASP A 9 -7.949 -7.632 8.495 1.00 0.00 O ATOM 91 CB ASP A 9 -7.006 -6.777 11.178 1.00 0.00 C ATOM 92 CG ASP A 9 -7.513 -6.139 12.456 1.00 0.00 C ATOM 93 OD1 ASP A 9 -7.190 -6.655 13.547 1.00 0.00 O ATOM 94 OD2 ASP A 9 -8.234 -5.122 12.368 1.00 0.00 O ATOM 0 HA ASP A 9 -8.447 -8.302 11.646 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -5.939 -6.979 11.274 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -7.124 -6.075 10.353 1.00 0.00 H new ATOM 99 N ILE A 10 -9.836 -8.116 9.623 1.00 0.00 N ATOM 100 CA ILE A 10 -10.696 -7.996 8.452 1.00 0.00 C ATOM 101 C ILE A 10 -11.764 -6.927 8.662 1.00 0.00 C ATOM 102 O ILE A 10 -12.457 -6.918 9.680 1.00 0.00 O ATOM 103 CB ILE A 10 -11.380 -9.338 8.119 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.194 -9.219 6.829 1.00 0.00 C ATOM 105 CG2 ILE A 10 -12.266 -9.786 9.273 1.00 0.00 C ATOM 106 CD1 ILE A 10 -12.062 -10.420 5.917 1.00 0.00 C ATOM 0 H ILE A 10 -10.327 -8.357 10.484 1.00 0.00 H new ATOM 0 HA ILE A 10 -10.058 -7.706 7.617 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.607 -10.091 7.968 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -13.245 -9.080 7.084 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -11.876 -8.327 6.290 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.740 -10.734 9.021 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.660 -9.911 10.170 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.033 -9.034 9.456 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -12.666 -10.266 5.023 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -11.018 -10.548 5.632 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -12.407 -11.313 6.439 1.00 0.00 H new ATOM 118 N VAL A 11 -11.892 -6.026 7.693 1.00 0.00 N ATOM 119 CA VAL A 11 -12.874 -4.952 7.771 1.00 0.00 C ATOM 120 C VAL A 11 -13.849 -5.013 6.599 1.00 0.00 C ATOM 121 O VAL A 11 -13.622 -4.397 5.558 1.00 0.00 O ATOM 122 CB VAL A 11 -12.196 -3.570 7.787 1.00 0.00 C ATOM 123 CG1 VAL A 11 -13.218 -2.476 8.056 1.00 0.00 C ATOM 124 CG2 VAL A 11 -11.081 -3.534 8.822 1.00 0.00 C ATOM 0 H VAL A 11 -11.327 -6.019 6.844 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.420 -5.091 8.704 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.756 -3.391 6.806 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -12.720 -1.507 8.064 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -13.978 -2.488 7.274 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -13.690 -2.649 9.023 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -10.613 -2.549 8.819 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -11.495 -3.736 9.810 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.335 -4.291 8.580 1.00 0.00 H new ATOM 134 N GLY A 12 -14.933 -5.761 6.777 1.00 0.00 N ATOM 135 CA GLY A 12 -15.926 -5.888 5.726 1.00 0.00 C ATOM 136 C GLY A 12 -15.413 -6.675 4.536 1.00 0.00 C ATOM 137 O GLY A 12 -15.693 -7.866 4.403 1.00 0.00 O ATOM 0 H GLY A 12 -15.142 -6.281 7.629 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -16.814 -6.378 6.126 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.231 -4.895 5.397 1.00 0.00 H new ATOM 141 N ILE A 13 -14.660 -6.007 3.668 1.00 0.00 N ATOM 142 CA ILE A 13 -14.107 -6.652 2.482 1.00 0.00 C ATOM 143 C ILE A 13 -12.629 -6.319 2.315 1.00 0.00 C ATOM 144 O ILE A 13 -12.120 -6.250 1.196 1.00 0.00 O ATOM 145 CB ILE A 13 -14.864 -6.230 1.208 1.00 0.00 C ATOM 146 CG1 ILE A 13 -14.909 -4.705 1.096 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.271 -6.808 1.211 1.00 0.00 C ATOM 148 CD1 ILE A 13 -15.367 -4.212 -0.259 1.00 0.00 C ATOM 0 H ILE A 13 -14.419 -5.021 3.763 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.221 -7.727 2.624 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.333 -6.623 0.341 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -15.578 -4.312 1.862 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -13.917 -4.304 1.303 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -16.793 -6.501 0.305 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.217 -7.896 1.248 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -16.813 -6.442 2.083 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -15.375 -3.122 -0.266 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -14.685 -4.575 -1.028 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -16.372 -4.583 -0.461 1.00 0.00 H new ATOM 160 N TRP A 14 -11.943 -6.114 3.434 1.00 0.00 N ATOM 161 CA TRP A 14 -10.522 -5.788 3.412 1.00 0.00 C ATOM 162 C TRP A 14 -9.763 -6.589 4.465 1.00 0.00 C ATOM 163 O TRP A 14 -9.998 -6.436 5.664 1.00 0.00 O ATOM 164 CB TRP A 14 -10.316 -4.291 3.647 1.00 0.00 C ATOM 165 CG TRP A 14 -11.046 -3.429 2.664 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.346 -3.021 2.738 1.00 0.00 C ATOM 167 CD2 TRP A 14 -10.517 -2.870 1.455 1.00 0.00 C ATOM 168 NE1 TRP A 14 -12.658 -2.242 1.649 1.00 0.00 N ATOM 169 CE2 TRP A 14 -11.552 -2.134 0.848 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.268 -2.920 0.829 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.375 -1.454 -0.355 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.095 -2.245 -0.365 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.144 -1.520 -0.945 1.00 0.00 C ATOM 0 H TRP A 14 -12.348 -6.168 4.368 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.131 -6.051 2.429 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -10.647 -4.040 4.655 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.251 -4.066 3.596 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -13.030 -3.273 3.535 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -13.566 -1.814 1.467 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -8.454 -3.476 1.270 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.182 -0.895 -0.805 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.135 -2.277 -0.859 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -9.976 -1.002 -1.878 1.00 0.00 H new ATOM 184 N TRP A 15 -8.851 -7.443 4.010 1.00 0.00 N ATOM 185 CA TRP A 15 -8.057 -8.267 4.913 1.00 0.00 C ATOM 186 C TRP A 15 -6.581 -7.890 4.839 1.00 0.00 C ATOM 187 O TRP A 15 -6.049 -7.634 3.759 1.00 0.00 O ATOM 188 CB TRP A 15 -8.234 -9.748 4.574 1.00 0.00 C ATOM 189 CG TRP A 15 -8.024 -10.055 3.123 1.00 0.00 C ATOM 190 CD1 TRP A 15 -8.954 -9.977 2.126 1.00 0.00 C ATOM 191 CD2 TRP A 15 -6.809 -10.491 2.505 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.391 -10.337 0.927 1.00 0.00 N ATOM 193 CE2 TRP A 15 -7.074 -10.657 1.133 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.520 -10.757 2.979 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -6.099 -11.076 0.231 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.554 -11.172 2.082 1.00 0.00 C ATOM 197 CH2 TRP A 15 -4.848 -11.329 0.721 1.00 0.00 C ATOM 0 H TRP A 15 -8.644 -7.582 3.021 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.408 -8.089 5.929 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.533 -10.335 5.167 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.237 -10.062 4.863 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -9.982 -9.676 2.261 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -8.874 -10.362 0.029 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.284 -10.640 4.026 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.323 -11.197 -0.819 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.555 -11.379 2.436 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.071 -11.656 0.046 1.00 0.00 H new ATOM 208 N THR A 16 -5.925 -7.855 5.994 1.00 0.00 N ATOM 209 CA THR A 16 -4.510 -7.509 6.060 1.00 0.00 C ATOM 210 C THR A 16 -3.662 -8.545 5.331 1.00 0.00 C ATOM 211 O THR A 16 -3.786 -9.746 5.572 1.00 0.00 O ATOM 212 CB THR A 16 -4.058 -7.398 7.518 1.00 0.00 C ATOM 213 OG1 THR A 16 -4.890 -6.501 8.233 1.00 0.00 O ATOM 214 CG2 THR A 16 -2.631 -6.917 7.666 1.00 0.00 C ATOM 0 H THR A 16 -6.351 -8.062 6.897 1.00 0.00 H new ATOM 0 HA THR A 16 -4.374 -6.545 5.570 1.00 0.00 H new ATOM 0 HB THR A 16 -4.128 -8.408 7.921 1.00 0.00 H new ATOM 0 HG1 THR A 16 -4.587 -6.444 9.163 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.374 -6.861 8.724 1.00 0.00 H new ATOM 0 HG22 THR A 16 -1.958 -7.614 7.166 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.531 -5.930 7.215 1.00 0.00 H new ATOM 222 N VAL A 17 -2.800 -8.073 4.437 1.00 0.00 N ATOM 223 CA VAL A 17 -1.930 -8.957 3.671 1.00 0.00 C ATOM 224 C VAL A 17 -0.962 -9.701 4.583 1.00 0.00 C ATOM 225 O VAL A 17 -0.777 -9.332 5.743 1.00 0.00 O ATOM 226 CB VAL A 17 -1.125 -8.177 2.615 1.00 0.00 C ATOM 227 CG1 VAL A 17 -2.051 -7.607 1.551 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.312 -7.073 3.272 1.00 0.00 C ATOM 0 H VAL A 17 -2.685 -7.082 4.225 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.576 -9.676 3.167 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.433 -8.866 2.130 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.464 -7.059 0.814 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.584 -8.420 1.059 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.769 -6.932 2.017 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.250 -6.533 2.510 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.982 -6.384 3.785 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.380 -7.510 3.992 1.00 0.00 H new ATOM 238 N SER A 18 -0.346 -10.753 4.051 1.00 0.00 N ATOM 239 CA SER A 18 0.605 -11.551 4.816 1.00 0.00 C ATOM 240 C SER A 18 2.025 -11.352 4.296 1.00 0.00 C ATOM 241 O SER A 18 2.989 -11.413 5.057 1.00 0.00 O ATOM 242 CB SER A 18 0.228 -13.031 4.750 1.00 0.00 C ATOM 243 OG SER A 18 0.476 -13.676 5.987 1.00 0.00 O ATOM 0 H SER A 18 -0.489 -11.072 3.093 1.00 0.00 H new ATOM 0 HA SER A 18 0.568 -11.219 5.854 1.00 0.00 H new ATOM 0 HB2 SER A 18 -0.826 -13.130 4.490 1.00 0.00 H new ATOM 0 HB3 SER A 18 0.799 -13.520 3.960 1.00 0.00 H new ATOM 0 HG SER A 18 0.225 -14.621 5.919 1.00 0.00 H new ATOM 249 N ASN A 19 2.145 -11.113 2.993 1.00 0.00 N ATOM 250 CA ASN A 19 3.449 -10.907 2.372 1.00 0.00 C ATOM 251 C ASN A 19 3.304 -10.230 1.012 1.00 0.00 C ATOM 252 O ASN A 19 2.197 -9.908 0.581 1.00 0.00 O ATOM 253 CB ASN A 19 4.188 -12.240 2.216 1.00 0.00 C ATOM 254 CG ASN A 19 3.266 -13.378 1.820 1.00 0.00 C ATOM 255 OD1 ASN A 19 3.074 -14.329 2.579 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.689 -13.286 0.628 1.00 0.00 N ATOM 0 H ASN A 19 1.357 -11.057 2.348 1.00 0.00 H new ATOM 0 HA ASN A 19 4.031 -10.255 3.024 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.969 -12.132 1.463 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.683 -12.489 3.155 1.00 0.00 H new ATOM 0 HD21 ASN A 19 2.058 -14.021 0.309 1.00 0.00 H new ATOM 0 HD22 ASN A 19 2.876 -12.480 0.031 1.00 0.00 H new ATOM 263 N PHE A 20 4.432 -10.016 0.342 1.00 0.00 N ATOM 264 CA PHE A 20 4.436 -9.376 -0.971 1.00 0.00 C ATOM 265 C PHE A 20 3.574 -10.155 -1.960 1.00 0.00 C ATOM 266 O PHE A 20 2.852 -9.567 -2.765 1.00 0.00 O ATOM 267 CB PHE A 20 5.866 -9.264 -1.500 1.00 0.00 C ATOM 268 CG PHE A 20 6.025 -8.235 -2.585 1.00 0.00 C ATOM 269 CD1 PHE A 20 6.104 -6.888 -2.273 1.00 0.00 C ATOM 270 CD2 PHE A 20 6.099 -8.617 -3.915 1.00 0.00 C ATOM 271 CE1 PHE A 20 6.252 -5.940 -3.268 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.246 -7.675 -4.913 1.00 0.00 C ATOM 273 CZ PHE A 20 6.323 -6.334 -4.590 1.00 0.00 C ATOM 0 H PHE A 20 5.356 -10.276 0.686 1.00 0.00 H new ATOM 0 HA PHE A 20 4.016 -8.376 -0.862 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.532 -9.015 -0.674 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.181 -10.235 -1.882 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.049 -6.575 -1.241 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.041 -9.664 -4.174 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.312 -4.892 -3.012 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.301 -7.986 -5.946 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.438 -5.595 -5.369 1.00 0.00 H new ATOM 283 N GLY A 21 3.655 -11.479 -1.894 1.00 0.00 N ATOM 284 CA GLY A 21 2.878 -12.317 -2.789 1.00 0.00 C ATOM 285 C GLY A 21 1.392 -12.015 -2.730 1.00 0.00 C ATOM 286 O GLY A 21 0.666 -12.248 -3.695 1.00 0.00 O ATOM 0 H GLY A 21 4.245 -11.988 -1.236 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.233 -12.178 -3.810 1.00 0.00 H new ATOM 0 HA3 GLY A 21 3.042 -13.364 -2.534 1.00 0.00 H new ATOM 290 N GLU A 22 0.942 -11.493 -1.593 1.00 0.00 N ATOM 291 CA GLU A 22 -0.466 -11.158 -1.412 1.00 0.00 C ATOM 292 C GLU A 22 -0.772 -9.771 -1.969 1.00 0.00 C ATOM 293 O GLU A 22 -1.878 -9.509 -2.439 1.00 0.00 O ATOM 294 CB GLU A 22 -0.840 -11.218 0.070 1.00 0.00 C ATOM 295 CG GLU A 22 -0.658 -12.595 0.688 1.00 0.00 C ATOM 296 CD GLU A 22 -1.546 -13.643 0.046 1.00 0.00 C ATOM 297 OE1 GLU A 22 -2.584 -13.266 -0.538 1.00 0.00 O ATOM 298 OE2 GLU A 22 -1.204 -14.841 0.126 1.00 0.00 O ATOM 0 H GLU A 22 1.531 -11.293 -0.785 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.060 -11.889 -1.960 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.232 -10.499 0.619 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.879 -10.911 0.187 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.384 -12.898 0.591 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.877 -12.543 1.755 1.00 0.00 H new ATOM 305 N ILE A 23 0.218 -8.885 -1.914 1.00 0.00 N ATOM 306 CA ILE A 23 0.055 -7.525 -2.412 1.00 0.00 C ATOM 307 C ILE A 23 0.058 -7.496 -3.937 1.00 0.00 C ATOM 308 O ILE A 23 1.105 -7.633 -4.569 1.00 0.00 O ATOM 309 CB ILE A 23 1.169 -6.597 -1.890 1.00 0.00 C ATOM 310 CG1 ILE A 23 1.317 -6.742 -0.375 1.00 0.00 C ATOM 311 CG2 ILE A 23 0.872 -5.151 -2.262 1.00 0.00 C ATOM 312 CD1 ILE A 23 2.478 -5.958 0.197 1.00 0.00 C ATOM 0 H ILE A 23 1.141 -9.085 -1.529 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.907 -7.167 -2.045 1.00 0.00 H new ATOM 0 HB ILE A 23 2.110 -6.887 -2.357 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.395 -6.413 0.105 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.445 -7.796 -0.130 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.668 -4.508 -1.886 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.813 -5.059 -3.347 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.077 -4.849 -1.820 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.522 -6.108 1.276 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.408 -6.303 -0.255 1.00 0.00 H new ATOM 0 HD13 ILE A 23 2.342 -4.898 -0.017 1.00 0.00 H new ATOM 324 N SER A 24 -1.122 -7.316 -4.523 1.00 0.00 N ATOM 325 CA SER A 24 -1.255 -7.268 -5.974 1.00 0.00 C ATOM 326 C SER A 24 -2.673 -6.876 -6.377 1.00 0.00 C ATOM 327 O SER A 24 -3.554 -7.727 -6.495 1.00 0.00 O ATOM 328 CB SER A 24 -0.897 -8.624 -6.585 1.00 0.00 C ATOM 329 OG SER A 24 -0.728 -8.523 -7.988 1.00 0.00 O ATOM 0 H SER A 24 -1.999 -7.201 -4.015 1.00 0.00 H new ATOM 0 HA SER A 24 -0.566 -6.513 -6.352 1.00 0.00 H new ATOM 0 HB2 SER A 24 0.020 -9.000 -6.131 1.00 0.00 H new ATOM 0 HB3 SER A 24 -1.682 -9.346 -6.361 1.00 0.00 H new ATOM 0 HG SER A 24 -0.498 -9.403 -8.354 1.00 0.00 H new ATOM 335 N GLY A 25 -2.886 -5.580 -6.586 1.00 0.00 N ATOM 336 CA GLY A 25 -4.199 -5.097 -6.974 1.00 0.00 C ATOM 337 C GLY A 25 -4.660 -3.928 -6.126 1.00 0.00 C ATOM 338 O GLY A 25 -3.846 -3.243 -5.506 1.00 0.00 O ATOM 0 H GLY A 25 -2.173 -4.856 -6.494 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.177 -4.796 -8.021 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -4.921 -5.909 -6.891 1.00 0.00 H new ATOM 342 N THR A 26 -5.968 -3.700 -6.096 1.00 0.00 N ATOM 343 CA THR A 26 -6.537 -2.607 -5.317 1.00 0.00 C ATOM 344 C THR A 26 -6.341 -2.843 -3.823 1.00 0.00 C ATOM 345 O THR A 26 -6.858 -3.812 -3.266 1.00 0.00 O ATOM 346 CB THR A 26 -8.026 -2.449 -5.630 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.229 -2.251 -7.019 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.672 -1.291 -4.901 1.00 0.00 C ATOM 0 H THR A 26 -6.655 -4.258 -6.603 1.00 0.00 H new ATOM 0 HA THR A 26 -6.017 -1.690 -5.592 1.00 0.00 H new ATOM 0 HB THR A 26 -8.492 -3.375 -5.291 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.187 -2.154 -7.199 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.727 -1.236 -5.168 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.577 -1.440 -3.825 1.00 0.00 H new ATOM 0 HG23 THR A 26 -8.177 -0.362 -5.184 1.00 0.00 H new ATOM 356 N ILE A 27 -5.593 -1.953 -3.181 1.00 0.00 N ATOM 357 CA ILE A 27 -5.330 -2.065 -1.752 1.00 0.00 C ATOM 358 C ILE A 27 -5.389 -0.701 -1.073 1.00 0.00 C ATOM 359 O ILE A 27 -5.333 0.335 -1.734 1.00 0.00 O ATOM 360 CB ILE A 27 -3.953 -2.702 -1.482 1.00 0.00 C ATOM 361 CG1 ILE A 27 -2.844 -1.874 -2.136 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.924 -4.136 -1.991 1.00 0.00 C ATOM 363 CD1 ILE A 27 -2.051 -1.042 -1.151 1.00 0.00 C ATOM 0 H ILE A 27 -5.158 -1.146 -3.628 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.107 -2.708 -1.337 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.781 -2.716 -0.406 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -2.165 -2.544 -2.664 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -3.286 -1.215 -2.883 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.945 -4.573 -1.793 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.691 -4.719 -1.481 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -4.115 -4.145 -3.064 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.283 -0.482 -1.684 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -2.719 -0.348 -0.641 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.580 -1.697 -0.418 1.00 0.00 H new ATOM 375 N ALA A 28 -5.504 -0.708 0.251 1.00 0.00 N ATOM 376 CA ALA A 28 -5.571 0.528 1.020 1.00 0.00 C ATOM 377 C ALA A 28 -4.512 0.552 2.117 1.00 0.00 C ATOM 378 O ALA A 28 -3.957 -0.486 2.480 1.00 0.00 O ATOM 379 CB ALA A 28 -6.959 0.701 1.619 1.00 0.00 C ATOM 0 H ALA A 28 -5.553 -1.557 0.814 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.372 1.359 0.343 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -6.995 1.628 2.191 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.698 0.739 0.819 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.179 -0.140 2.277 1.00 0.00 H new ATOM 385 N ILE A 29 -4.237 1.741 2.640 1.00 0.00 N ATOM 386 CA ILE A 29 -3.244 1.900 3.696 1.00 0.00 C ATOM 387 C ILE A 29 -3.784 2.760 4.834 1.00 0.00 C ATOM 388 O ILE A 29 -4.281 3.864 4.609 1.00 0.00 O ATOM 389 CB ILE A 29 -1.948 2.537 3.159 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.489 1.820 1.886 1.00 0.00 C ATOM 391 CG2 ILE A 29 -0.858 2.497 4.220 1.00 0.00 C ATOM 392 CD1 ILE A 29 -1.743 2.613 0.623 1.00 0.00 C ATOM 0 H ILE A 29 -4.687 2.609 2.350 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.021 0.901 4.072 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.149 3.580 2.913 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.423 1.606 1.963 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -2.002 0.861 1.813 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.051 2.951 3.825 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.187 3.050 5.100 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.657 1.462 4.496 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.393 2.045 -0.239 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.811 2.805 0.522 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.208 3.561 0.675 1.00 0.00 H new ATOM 404 N GLU A 30 -3.682 2.247 6.056 1.00 0.00 N ATOM 405 CA GLU A 30 -4.160 2.969 7.230 1.00 0.00 C ATOM 406 C GLU A 30 -2.992 3.464 8.076 1.00 0.00 C ATOM 407 O GLU A 30 -2.269 2.671 8.680 1.00 0.00 O ATOM 408 CB GLU A 30 -5.071 2.071 8.071 1.00 0.00 C ATOM 409 CG GLU A 30 -6.005 2.844 8.988 1.00 0.00 C ATOM 410 CD GLU A 30 -6.588 1.978 10.089 1.00 0.00 C ATOM 411 OE1 GLU A 30 -7.397 1.081 9.773 1.00 0.00 O ATOM 412 OE2 GLU A 30 -6.234 2.199 11.266 1.00 0.00 O ATOM 0 H GLU A 30 -3.273 1.335 6.259 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.729 3.833 6.888 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.665 1.444 7.406 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.455 1.403 8.673 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.463 3.677 9.435 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.816 3.271 8.398 1.00 0.00 H new ATOM 419 N MET A 31 -2.813 4.781 8.114 1.00 0.00 N ATOM 420 CA MET A 31 -1.732 5.383 8.886 1.00 0.00 C ATOM 421 C MET A 31 -2.158 5.613 10.333 1.00 0.00 C ATOM 422 O MET A 31 -1.420 5.292 11.266 1.00 0.00 O ATOM 423 CB MET A 31 -1.301 6.707 8.253 1.00 0.00 C ATOM 424 CG MET A 31 -0.964 6.592 6.775 1.00 0.00 C ATOM 425 SD MET A 31 -0.266 8.113 6.103 1.00 0.00 S ATOM 426 CE MET A 31 1.216 7.487 5.316 1.00 0.00 C ATOM 0 H MET A 31 -3.402 5.451 7.620 1.00 0.00 H new ATOM 0 HA MET A 31 -0.888 4.693 8.880 1.00 0.00 H new ATOM 0 HB2 MET A 31 -2.100 7.438 8.379 1.00 0.00 H new ATOM 0 HB3 MET A 31 -0.431 7.090 8.787 1.00 0.00 H new ATOM 0 HG2 MET A 31 -0.256 5.776 6.630 1.00 0.00 H new ATOM 0 HG3 MET A 31 -1.866 6.334 6.219 1.00 0.00 H new ATOM 0 HE1 MET A 31 1.964 8.279 5.266 1.00 0.00 H new ATOM 0 HE2 MET A 31 1.610 6.652 5.895 1.00 0.00 H new ATOM 0 HE3 MET A 31 0.977 7.149 4.307 1.00 0.00 H new ATOM 436 N ASP A 32 -3.351 6.169 10.513 1.00 0.00 N ATOM 437 CA ASP A 32 -3.874 6.441 11.847 1.00 0.00 C ATOM 438 C ASP A 32 -4.858 5.357 12.277 1.00 0.00 C ATOM 439 O ASP A 32 -5.134 4.421 11.526 1.00 0.00 O ATOM 440 CB ASP A 32 -4.556 7.811 11.880 1.00 0.00 C ATOM 441 CG ASP A 32 -4.198 8.604 13.121 1.00 0.00 C ATOM 442 OD1 ASP A 32 -3.071 8.430 13.632 1.00 0.00 O ATOM 443 OD2 ASP A 32 -5.042 9.401 13.581 1.00 0.00 O ATOM 0 H ASP A 32 -3.974 6.440 9.752 1.00 0.00 H new ATOM 0 HA ASP A 32 -3.037 6.443 12.546 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -4.269 8.378 10.994 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -5.637 7.677 11.837 1.00 0.00 H new ATOM 448 N LYS A 33 -5.383 5.490 13.491 1.00 0.00 N ATOM 449 CA LYS A 33 -6.337 4.522 14.020 1.00 0.00 C ATOM 450 C LYS A 33 -7.765 4.898 13.637 1.00 0.00 C ATOM 451 O LYS A 33 -8.504 5.470 14.438 1.00 0.00 O ATOM 452 CB LYS A 33 -6.212 4.432 15.543 1.00 0.00 C ATOM 453 CG LYS A 33 -6.214 5.784 16.235 1.00 0.00 C ATOM 454 CD LYS A 33 -6.423 5.641 17.734 1.00 0.00 C ATOM 455 CE LYS A 33 -6.130 6.942 18.464 1.00 0.00 C ATOM 456 NZ LYS A 33 -4.668 7.204 18.569 1.00 0.00 N ATOM 0 H LYS A 33 -5.164 6.258 14.126 1.00 0.00 H new ATOM 0 HA LYS A 33 -6.108 3.549 13.585 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -7.036 3.833 15.932 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -5.290 3.907 15.793 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -5.269 6.293 16.045 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -7.002 6.408 15.814 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -7.450 5.335 17.932 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -5.776 4.853 18.119 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -6.610 7.768 17.940 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -6.564 6.903 19.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -4.505 8.014 19.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.191 6.363 18.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -4.285 7.418 17.626 1.00 0.00 H new ATOM 470 N GLY A 34 -8.146 4.572 12.405 1.00 0.00 N ATOM 471 CA GLY A 34 -9.484 4.884 11.936 1.00 0.00 C ATOM 472 C GLY A 34 -9.475 5.743 10.687 1.00 0.00 C ATOM 473 O GLY A 34 -10.409 5.695 9.887 1.00 0.00 O ATOM 0 H GLY A 34 -7.553 4.098 11.724 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -10.019 3.957 11.732 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -10.031 5.401 12.725 1.00 0.00 H new ATOM 477 N ALA A 35 -8.419 6.531 10.519 1.00 0.00 N ATOM 478 CA ALA A 35 -8.293 7.404 9.359 1.00 0.00 C ATOM 479 C ALA A 35 -7.511 6.722 8.242 1.00 0.00 C ATOM 480 O ALA A 35 -6.885 5.684 8.453 1.00 0.00 O ATOM 481 CB ALA A 35 -7.622 8.712 9.754 1.00 0.00 C ATOM 0 H ALA A 35 -7.637 6.583 11.172 1.00 0.00 H new ATOM 0 HA ALA A 35 -9.294 7.620 8.986 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -7.534 9.355 8.878 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -8.222 9.214 10.514 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.629 8.505 10.154 1.00 0.00 H new ATOM 487 N TYR A 36 -7.552 7.312 7.052 1.00 0.00 N ATOM 488 CA TYR A 36 -6.847 6.761 5.901 1.00 0.00 C ATOM 489 C TYR A 36 -6.237 7.871 5.053 1.00 0.00 C ATOM 490 O TYR A 36 -6.519 9.052 5.261 1.00 0.00 O ATOM 491 CB TYR A 36 -7.799 5.918 5.050 1.00 0.00 C ATOM 492 CG TYR A 36 -8.167 4.595 5.682 1.00 0.00 C ATOM 493 CD1 TYR A 36 -9.227 4.501 6.575 1.00 0.00 C ATOM 494 CD2 TYR A 36 -7.454 3.440 5.386 1.00 0.00 C ATOM 495 CE1 TYR A 36 -9.566 3.293 7.155 1.00 0.00 C ATOM 496 CE2 TYR A 36 -7.787 2.228 5.962 1.00 0.00 C ATOM 497 CZ TYR A 36 -8.843 2.160 6.845 1.00 0.00 C ATOM 498 OH TYR A 36 -9.179 0.956 7.421 1.00 0.00 O ATOM 0 H TYR A 36 -8.066 8.172 6.860 1.00 0.00 H new ATOM 0 HA TYR A 36 -6.041 6.127 6.270 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.709 6.488 4.865 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.337 5.732 4.080 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -9.795 5.386 6.820 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -6.626 3.490 4.695 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -10.393 3.237 7.847 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -7.223 1.339 5.721 1.00 0.00 H new ATOM 0 HH TYR A 36 -8.672 0.838 8.251 1.00 0.00 H new ATOM 508 N ILE A 37 -5.399 7.485 4.096 1.00 0.00 N ATOM 509 CA ILE A 37 -4.748 8.448 3.215 1.00 0.00 C ATOM 510 C ILE A 37 -5.722 8.985 2.172 1.00 0.00 C ATOM 511 O ILE A 37 -6.250 8.231 1.356 1.00 0.00 O ATOM 512 CB ILE A 37 -3.537 7.824 2.496 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.635 7.105 3.501 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.757 8.893 1.745 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.484 6.364 2.857 1.00 0.00 C ATOM 0 H ILE A 37 -5.155 6.512 3.911 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.404 9.269 3.844 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.899 7.093 1.773 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -2.238 7.834 4.207 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -3.235 6.399 4.076 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.905 8.436 1.242 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.405 9.364 1.005 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.402 9.646 2.448 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.887 5.878 3.629 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.874 5.611 2.172 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.861 7.068 2.306 1.00 0.00 H new ATOM 527 N HIS A 38 -5.957 10.292 2.206 1.00 0.00 N ATOM 528 CA HIS A 38 -6.869 10.930 1.263 1.00 0.00 C ATOM 529 C HIS A 38 -6.099 11.739 0.224 1.00 0.00 C ATOM 530 O HIS A 38 -5.006 12.238 0.496 1.00 0.00 O ATOM 531 CB HIS A 38 -7.851 11.837 2.006 1.00 0.00 C ATOM 532 CG HIS A 38 -9.107 12.114 1.239 1.00 0.00 C ATOM 533 ND1 HIS A 38 -10.005 11.141 0.861 1.00 0.00 N ATOM 534 CD2 HIS A 38 -9.610 13.288 0.781 1.00 0.00 C ATOM 535 CE1 HIS A 38 -11.003 11.740 0.197 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.812 13.043 0.121 1.00 0.00 N ATOM 0 H HIS A 38 -5.529 10.931 2.876 1.00 0.00 H new ATOM 0 HA HIS A 38 -7.426 10.147 0.748 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -8.111 11.375 2.958 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -7.358 12.782 2.234 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -9.152 14.258 0.908 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -11.854 11.223 -0.222 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -11.419 13.729 -0.328 1.00 0.00 H new ATOM 544 N ALA A 39 -6.676 11.866 -0.966 1.00 0.00 N ATOM 545 CA ALA A 39 -6.044 12.613 -2.046 1.00 0.00 C ATOM 546 C ALA A 39 -6.787 13.918 -2.316 1.00 0.00 C ATOM 547 O ALA A 39 -7.902 14.121 -1.835 1.00 0.00 O ATOM 548 CB ALA A 39 -5.985 11.767 -3.308 1.00 0.00 C ATOM 0 H ALA A 39 -7.581 11.461 -1.207 1.00 0.00 H new ATOM 0 HA ALA A 39 -5.027 12.859 -1.739 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.511 12.337 -4.107 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.406 10.864 -3.114 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -6.996 11.492 -3.609 1.00 0.00 H new ATOM 554 N LEU A 40 -6.161 14.800 -3.090 1.00 0.00 N ATOM 555 CA LEU A 40 -6.762 16.086 -3.424 1.00 0.00 C ATOM 556 C LEU A 40 -6.590 16.396 -4.907 1.00 0.00 C ATOM 557 O LEU A 40 -5.574 16.051 -5.510 1.00 0.00 O ATOM 558 CB LEU A 40 -6.139 17.199 -2.580 1.00 0.00 C ATOM 559 CG LEU A 40 -6.443 17.126 -1.083 1.00 0.00 C ATOM 560 CD1 LEU A 40 -5.586 18.121 -0.316 1.00 0.00 C ATOM 561 CD2 LEU A 40 -7.921 17.383 -0.827 1.00 0.00 C ATOM 0 H LEU A 40 -5.238 14.647 -3.497 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.828 16.030 -3.205 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -5.058 17.176 -2.717 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.488 18.160 -2.959 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.202 16.123 -0.730 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.816 18.055 0.747 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.532 17.892 -0.475 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.795 19.130 -0.670 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -8.120 17.327 0.243 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -8.187 18.374 -1.194 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -8.516 16.632 -1.346 1.00 0.00 H new ATOM 573 N ASP A 41 -7.590 17.051 -5.489 1.00 0.00 N ATOM 574 CA ASP A 41 -7.549 17.409 -6.902 1.00 0.00 C ATOM 575 C ASP A 41 -6.433 18.412 -7.178 1.00 0.00 C ATOM 576 O ASP A 41 -5.849 18.423 -8.261 1.00 0.00 O ATOM 577 CB ASP A 41 -8.894 17.992 -7.341 1.00 0.00 C ATOM 578 CG ASP A 41 -9.392 19.071 -6.398 1.00 0.00 C ATOM 579 OD1 ASP A 41 -9.779 18.732 -5.260 1.00 0.00 O ATOM 580 OD2 ASP A 41 -9.393 20.254 -6.798 1.00 0.00 O ATOM 0 H ASP A 41 -8.438 17.344 -5.004 1.00 0.00 H new ATOM 0 HA ASP A 41 -7.348 16.503 -7.474 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -8.797 18.407 -8.344 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -9.633 17.192 -7.396 1.00 0.00 H new ATOM 585 N ASN A 42 -6.143 19.253 -6.191 1.00 0.00 N ATOM 586 CA ASN A 42 -5.097 20.260 -6.328 1.00 0.00 C ATOM 587 C ASN A 42 -3.746 19.608 -6.602 1.00 0.00 C ATOM 588 O ASN A 42 -2.898 20.177 -7.291 1.00 0.00 O ATOM 589 CB ASN A 42 -5.016 21.117 -5.063 1.00 0.00 C ATOM 590 CG ASN A 42 -4.499 22.514 -5.343 1.00 0.00 C ATOM 591 OD1 ASN A 42 -5.222 23.362 -5.866 1.00 0.00 O ATOM 592 ND2 ASN A 42 -3.241 22.760 -4.995 1.00 0.00 N ATOM 0 H ASN A 42 -6.617 19.257 -5.288 1.00 0.00 H new ATOM 0 HA ASN A 42 -5.350 20.898 -7.175 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -6.004 21.183 -4.608 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -4.364 20.630 -4.338 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -2.838 23.682 -5.159 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -2.678 22.027 -4.564 1.00 0.00 H new ATOM 599 N GLY A 43 -3.550 18.411 -6.058 1.00 0.00 N ATOM 600 CA GLY A 43 -2.300 17.701 -6.255 1.00 0.00 C ATOM 601 C GLY A 43 -1.561 17.454 -4.954 1.00 0.00 C ATOM 602 O GLY A 43 -0.333 17.507 -4.910 1.00 0.00 O ATOM 0 H GLY A 43 -4.235 17.920 -5.484 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.501 16.747 -6.742 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.662 18.274 -6.928 1.00 0.00 H new ATOM 606 N LEU A 44 -2.313 17.185 -3.891 1.00 0.00 N ATOM 607 CA LEU A 44 -1.724 16.930 -2.583 1.00 0.00 C ATOM 608 C LEU A 44 -2.466 15.811 -1.860 1.00 0.00 C ATOM 609 O LEU A 44 -3.619 15.514 -2.173 1.00 0.00 O ATOM 610 CB LEU A 44 -1.744 18.203 -1.735 1.00 0.00 C ATOM 611 CG LEU A 44 -1.165 19.443 -2.416 1.00 0.00 C ATOM 612 CD1 LEU A 44 -1.668 20.708 -1.738 1.00 0.00 C ATOM 613 CD2 LEU A 44 0.356 19.397 -2.401 1.00 0.00 C ATOM 0 H LEU A 44 -3.332 17.138 -3.911 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.691 16.617 -2.732 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.774 18.413 -1.447 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -1.187 18.018 -0.816 1.00 0.00 H new ATOM 0 HG LEU A 44 -1.499 19.454 -3.454 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -1.245 21.581 -2.236 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.756 20.746 -1.800 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.364 20.705 -0.691 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.752 20.287 -2.890 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.709 19.362 -1.370 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.698 18.509 -2.932 1.00 0.00 H new ATOM 625 N PHE A 45 -1.798 15.193 -0.891 1.00 0.00 N ATOM 626 CA PHE A 45 -2.394 14.107 -0.123 1.00 0.00 C ATOM 627 C PHE A 45 -2.458 14.459 1.359 1.00 0.00 C ATOM 628 O PHE A 45 -1.446 14.806 1.969 1.00 0.00 O ATOM 629 CB PHE A 45 -1.595 12.818 -0.318 1.00 0.00 C ATOM 630 CG PHE A 45 -1.839 12.154 -1.644 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.269 12.659 -2.801 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.640 11.027 -1.732 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.493 12.052 -4.023 1.00 0.00 C ATOM 634 CE2 PHE A 45 -2.867 10.415 -2.950 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.292 10.928 -4.097 1.00 0.00 C ATOM 0 H PHE A 45 -0.843 15.426 -0.619 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.410 13.955 -0.486 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.532 13.041 -0.223 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.847 12.120 0.480 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.642 13.537 -2.748 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.092 10.622 -0.839 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.044 12.456 -4.918 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.493 9.537 -3.005 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.467 10.451 -5.050 1.00 0.00 H new ATOM 645 N THR A 46 -3.653 14.368 1.934 1.00 0.00 N ATOM 646 CA THR A 46 -3.849 14.677 3.345 1.00 0.00 C ATOM 647 C THR A 46 -4.480 13.497 4.077 1.00 0.00 C ATOM 648 O THR A 46 -4.969 12.555 3.453 1.00 0.00 O ATOM 649 CB THR A 46 -4.729 15.918 3.500 1.00 0.00 C ATOM 650 OG1 THR A 46 -4.966 16.198 4.868 1.00 0.00 O ATOM 651 CG2 THR A 46 -6.075 15.786 2.820 1.00 0.00 C ATOM 0 H THR A 46 -4.501 14.082 1.444 1.00 0.00 H new ATOM 0 HA THR A 46 -2.873 14.876 3.787 1.00 0.00 H new ATOM 0 HB THR A 46 -4.175 16.726 3.022 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.529 16.996 4.946 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.649 16.701 2.969 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.929 15.619 1.753 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.618 14.943 3.248 1.00 0.00 H new ATOM 659 N LEU A 47 -4.464 13.554 5.405 1.00 0.00 N ATOM 660 CA LEU A 47 -5.034 12.490 6.222 1.00 0.00 C ATOM 661 C LEU A 47 -6.552 12.618 6.304 1.00 0.00 C ATOM 662 O LEU A 47 -7.074 13.538 6.933 1.00 0.00 O ATOM 663 CB LEU A 47 -4.433 12.521 7.629 1.00 0.00 C ATOM 664 CG LEU A 47 -4.505 11.198 8.393 1.00 0.00 C ATOM 665 CD1 LEU A 47 -3.583 10.167 7.762 1.00 0.00 C ATOM 666 CD2 LEU A 47 -4.147 11.411 9.857 1.00 0.00 C ATOM 0 H LEU A 47 -4.062 14.326 5.938 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.793 11.537 5.751 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.389 12.824 7.555 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.946 13.287 8.210 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.527 10.822 8.339 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.647 9.232 8.319 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.883 9.995 6.728 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.557 10.534 7.786 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.203 10.460 10.387 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.135 11.808 9.930 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.847 12.117 10.304 1.00 0.00 H new ATOM 678 N GLY A 48 -7.254 11.690 5.663 1.00 0.00 N ATOM 679 CA GLY A 48 -8.705 11.717 5.677 1.00 0.00 C ATOM 680 C GLY A 48 -9.273 11.625 7.079 1.00 0.00 C ATOM 681 O GLY A 48 -8.534 11.418 8.042 1.00 0.00 O ATOM 0 H GLY A 48 -6.845 10.920 5.134 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -9.053 12.637 5.207 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -9.087 10.890 5.079 1.00 0.00 H new ATOM 685 N ALA A 49 -10.588 11.780 7.196 1.00 0.00 N ATOM 686 CA ALA A 49 -11.252 11.714 8.491 1.00 0.00 C ATOM 687 C ALA A 49 -11.487 10.265 8.914 1.00 0.00 C ATOM 688 O ALA A 49 -11.831 9.418 8.089 1.00 0.00 O ATOM 689 CB ALA A 49 -12.569 12.473 8.448 1.00 0.00 C ATOM 0 H ALA A 49 -11.214 11.952 6.409 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.601 12.180 9.230 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -13.054 12.415 9.422 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -12.379 13.517 8.198 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -13.219 12.032 7.692 1.00 0.00 H new ATOM 695 N PRO A 50 -11.303 9.957 10.211 1.00 0.00 N ATOM 696 CA PRO A 50 -11.498 8.601 10.734 1.00 0.00 C ATOM 697 C PRO A 50 -12.971 8.214 10.805 1.00 0.00 C ATOM 698 O PRO A 50 -13.783 8.929 11.393 1.00 0.00 O ATOM 699 CB PRO A 50 -10.898 8.676 12.138 1.00 0.00 C ATOM 700 CG PRO A 50 -11.042 10.105 12.533 1.00 0.00 C ATOM 701 CD PRO A 50 -10.892 10.904 11.266 1.00 0.00 C ATOM 0 HA PRO A 50 -11.036 7.847 10.097 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.425 8.019 12.830 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -9.852 8.368 12.139 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -12.012 10.286 12.996 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -10.283 10.386 13.263 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -11.522 11.793 11.275 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.866 11.242 11.124 1.00 0.00 H new ATOM 709 N HIS A 51 -13.309 7.078 10.203 1.00 0.00 N ATOM 710 CA HIS A 51 -14.685 6.596 10.200 1.00 0.00 C ATOM 711 C HIS A 51 -15.170 6.325 11.620 1.00 0.00 C ATOM 712 O HIS A 51 -14.368 6.134 12.535 1.00 0.00 O ATOM 713 CB HIS A 51 -14.799 5.323 9.359 1.00 0.00 C ATOM 714 CG HIS A 51 -14.634 5.561 7.889 1.00 0.00 C ATOM 715 ND1 HIS A 51 -15.679 5.393 7.014 1.00 0.00 N ATOM 716 CD2 HIS A 51 -13.536 5.948 7.197 1.00 0.00 C ATOM 717 CE1 HIS A 51 -15.200 5.680 5.818 1.00 0.00 C ATOM 718 NE2 HIS A 51 -13.903 6.022 5.878 1.00 0.00 N ATOM 0 H HIS A 51 -12.649 6.475 9.712 1.00 0.00 H new ATOM 0 HA HIS A 51 -15.314 7.371 9.762 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -14.045 4.609 9.690 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -15.772 4.865 9.538 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -12.559 6.158 7.606 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -15.778 5.644 4.906 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -13.306 6.286 5.094 1.00 0.00 H new ATOM 726 N ARG A 52 -16.487 6.310 11.798 1.00 0.00 N ATOM 727 CA ARG A 52 -17.077 6.063 13.108 1.00 0.00 C ATOM 728 C ARG A 52 -16.979 4.587 13.479 1.00 0.00 C ATOM 729 O ARG A 52 -16.296 4.222 14.436 1.00 0.00 O ATOM 730 CB ARG A 52 -18.541 6.508 13.124 1.00 0.00 C ATOM 731 CG ARG A 52 -18.973 7.133 14.440 1.00 0.00 C ATOM 732 CD ARG A 52 -20.482 7.300 14.512 1.00 0.00 C ATOM 733 NE ARG A 52 -21.014 6.911 15.816 1.00 0.00 N ATOM 734 CZ ARG A 52 -20.734 7.548 16.950 1.00 0.00 C ATOM 735 NH1 ARG A 52 -19.931 8.605 16.946 1.00 0.00 N ATOM 736 NH2 ARG A 52 -21.260 7.128 18.093 1.00 0.00 N ATOM 0 H ARG A 52 -17.165 6.466 11.052 1.00 0.00 H new ATOM 0 HA ARG A 52 -16.520 6.643 13.844 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -18.702 7.226 12.320 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -19.176 5.647 12.915 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -18.636 6.509 15.268 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.493 8.105 14.557 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -20.742 8.339 14.310 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -20.951 6.697 13.735 1.00 0.00 H new ATOM 0 HE ARG A 52 -21.636 6.104 15.859 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -19.525 8.933 16.070 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -19.720 9.089 17.819 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -21.879 6.317 18.102 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -21.046 7.616 18.963 1.00 0.00 H new ATOM 750 N GLU A 53 -17.665 3.743 12.717 1.00 0.00 N ATOM 751 CA GLU A 53 -17.655 2.306 12.966 1.00 0.00 C ATOM 752 C GLU A 53 -16.347 1.681 12.492 1.00 0.00 C ATOM 753 O GLU A 53 -15.651 2.239 11.645 1.00 0.00 O ATOM 754 CB GLU A 53 -18.837 1.638 12.261 1.00 0.00 C ATOM 755 CG GLU A 53 -20.163 2.344 12.496 1.00 0.00 C ATOM 756 CD GLU A 53 -21.189 2.030 11.424 1.00 0.00 C ATOM 757 OE1 GLU A 53 -20.990 2.460 10.269 1.00 0.00 O ATOM 758 OE2 GLU A 53 -22.189 1.352 11.739 1.00 0.00 O ATOM 0 H GLU A 53 -18.235 4.029 11.921 1.00 0.00 H new ATOM 0 HA GLU A 53 -17.744 2.148 14.041 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -18.638 1.603 11.190 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -18.918 0.606 12.604 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -20.558 2.052 13.469 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -19.996 3.421 12.530 1.00 0.00 H new ATOM 765 N VAL A 54 -16.018 0.518 13.047 1.00 0.00 N ATOM 766 CA VAL A 54 -14.793 -0.182 12.682 1.00 0.00 C ATOM 767 C VAL A 54 -14.938 -0.875 11.330 1.00 0.00 C ATOM 768 O VAL A 54 -14.136 -0.661 10.423 1.00 0.00 O ATOM 769 CB VAL A 54 -14.407 -1.229 13.743 1.00 0.00 C ATOM 770 CG1 VAL A 54 -13.031 -1.807 13.447 1.00 0.00 C ATOM 771 CG2 VAL A 54 -14.449 -0.619 15.135 1.00 0.00 C ATOM 0 H VAL A 54 -16.583 0.042 13.750 1.00 0.00 H new ATOM 0 HA VAL A 54 -14.006 0.569 12.620 1.00 0.00 H new ATOM 0 HB VAL A 54 -15.132 -2.042 13.706 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -12.775 -2.545 14.207 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -13.040 -2.284 12.467 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -12.291 -1.007 13.455 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -14.173 -1.374 15.871 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -13.748 0.214 15.189 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -15.456 -0.259 15.344 1.00 0.00 H new ATOM 781 N ASP A 55 -15.968 -1.706 11.205 1.00 0.00 N ATOM 782 CA ASP A 55 -16.218 -2.430 9.965 1.00 0.00 C ATOM 783 C ASP A 55 -16.784 -1.499 8.897 1.00 0.00 C ATOM 784 O ASP A 55 -17.984 -1.510 8.620 1.00 0.00 O ATOM 785 CB ASP A 55 -17.186 -3.589 10.214 1.00 0.00 C ATOM 786 CG ASP A 55 -17.377 -4.455 8.984 1.00 0.00 C ATOM 787 OD1 ASP A 55 -18.069 -4.008 8.044 1.00 0.00 O ATOM 788 OD2 ASP A 55 -16.836 -5.581 8.960 1.00 0.00 O ATOM 0 H ASP A 55 -16.642 -1.894 11.947 1.00 0.00 H new ATOM 0 HA ASP A 55 -15.269 -2.829 9.607 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -16.811 -4.203 11.033 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -18.151 -3.192 10.529 1.00 0.00 H new ATOM 793 N GLU A 56 -15.912 -0.694 8.299 1.00 0.00 N ATOM 794 CA GLU A 56 -16.324 0.244 7.260 1.00 0.00 C ATOM 795 C GLU A 56 -15.283 0.316 6.149 1.00 0.00 C ATOM 796 O GLU A 56 -14.085 0.416 6.412 1.00 0.00 O ATOM 797 CB GLU A 56 -16.546 1.634 7.859 1.00 0.00 C ATOM 798 CG GLU A 56 -17.706 1.697 8.840 1.00 0.00 C ATOM 799 CD GLU A 56 -18.889 2.471 8.295 1.00 0.00 C ATOM 800 OE1 GLU A 56 -19.533 1.981 7.343 1.00 0.00 O ATOM 801 OE2 GLU A 56 -19.174 3.569 8.819 1.00 0.00 O ATOM 0 H GLU A 56 -14.916 -0.672 8.516 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.261 -0.113 6.832 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -15.635 1.951 8.366 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -16.725 2.344 7.051 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -18.023 0.684 9.088 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -17.369 2.161 9.767 1.00 0.00 H new ATOM 808 N GLY A 57 -15.749 0.265 4.904 1.00 0.00 N ATOM 809 CA GLY A 57 -14.845 0.326 3.771 1.00 0.00 C ATOM 810 C GLY A 57 -14.429 1.746 3.436 1.00 0.00 C ATOM 811 O GLY A 57 -15.197 2.685 3.646 1.00 0.00 O ATOM 0 H GLY A 57 -16.736 0.183 4.661 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.957 -0.268 3.986 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -15.326 -0.123 2.902 1.00 0.00 H new ATOM 815 N PRO A 58 -13.208 1.939 2.910 1.00 0.00 N ATOM 816 CA PRO A 58 -12.703 3.267 2.549 1.00 0.00 C ATOM 817 C PRO A 58 -13.428 3.857 1.346 1.00 0.00 C ATOM 818 O PRO A 58 -14.033 3.132 0.555 1.00 0.00 O ATOM 819 CB PRO A 58 -11.232 3.012 2.211 1.00 0.00 C ATOM 820 CG PRO A 58 -11.177 1.580 1.806 1.00 0.00 C ATOM 821 CD PRO A 58 -12.224 0.877 2.626 1.00 0.00 C ATOM 0 HA PRO A 58 -12.851 3.988 3.353 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.892 3.664 1.406 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.590 3.205 3.070 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -11.376 1.468 0.740 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -10.189 1.160 1.992 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.674 0.049 2.078 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.805 0.463 3.543 1.00 0.00 H new ATOM 829 N SER A 59 -13.362 5.177 1.211 1.00 0.00 N ATOM 830 CA SER A 59 -14.009 5.869 0.103 1.00 0.00 C ATOM 831 C SER A 59 -13.256 5.617 -1.203 1.00 0.00 C ATOM 832 O SER A 59 -12.082 5.246 -1.189 1.00 0.00 O ATOM 833 CB SER A 59 -14.084 7.371 0.391 1.00 0.00 C ATOM 834 OG SER A 59 -15.428 7.822 0.415 1.00 0.00 O ATOM 0 H SER A 59 -12.865 5.790 1.857 1.00 0.00 H new ATOM 0 HA SER A 59 -15.021 5.480 -0.004 1.00 0.00 H new ATOM 0 HB2 SER A 59 -13.609 7.585 1.348 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.528 7.918 -0.370 1.00 0.00 H new ATOM 0 HG SER A 59 -15.447 8.784 0.603 1.00 0.00 H new ATOM 840 N PRO A 60 -13.923 5.813 -2.355 1.00 0.00 N ATOM 841 CA PRO A 60 -13.306 5.600 -3.667 1.00 0.00 C ATOM 842 C PRO A 60 -11.954 6.303 -3.807 1.00 0.00 C ATOM 843 O PRO A 60 -10.963 5.674 -4.177 1.00 0.00 O ATOM 844 CB PRO A 60 -14.329 6.182 -4.645 1.00 0.00 C ATOM 845 CG PRO A 60 -15.634 6.083 -3.931 1.00 0.00 C ATOM 846 CD PRO A 60 -15.327 6.253 -2.468 1.00 0.00 C ATOM 0 HA PRO A 60 -13.086 4.547 -3.843 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -14.093 7.216 -4.897 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -14.346 5.622 -5.580 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -16.325 6.852 -4.275 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -16.109 5.120 -4.120 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -15.450 7.288 -2.150 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.988 5.649 -1.847 1.00 0.00 H new ATOM 854 N PRO A 61 -11.883 7.616 -3.512 1.00 0.00 N ATOM 855 CA PRO A 61 -10.629 8.374 -3.614 1.00 0.00 C ATOM 856 C PRO A 61 -9.576 7.886 -2.624 1.00 0.00 C ATOM 857 O PRO A 61 -8.377 8.055 -2.846 1.00 0.00 O ATOM 858 CB PRO A 61 -11.044 9.811 -3.287 1.00 0.00 C ATOM 859 CG PRO A 61 -12.306 9.678 -2.508 1.00 0.00 C ATOM 860 CD PRO A 61 -13.001 8.466 -3.059 1.00 0.00 C ATOM 0 HA PRO A 61 -10.171 8.266 -4.597 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -10.275 10.322 -2.708 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -11.200 10.393 -4.195 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -12.098 9.560 -1.444 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.927 10.567 -2.615 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.604 7.968 -2.300 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -13.670 8.723 -3.880 1.00 0.00 H new ATOM 868 N GLU A 62 -10.029 7.280 -1.531 1.00 0.00 N ATOM 869 CA GLU A 62 -9.124 6.768 -0.510 1.00 0.00 C ATOM 870 C GLU A 62 -8.487 5.456 -0.955 1.00 0.00 C ATOM 871 O GLU A 62 -7.350 5.151 -0.597 1.00 0.00 O ATOM 872 CB GLU A 62 -9.873 6.567 0.811 1.00 0.00 C ATOM 873 CG GLU A 62 -9.310 7.387 1.960 1.00 0.00 C ATOM 874 CD GLU A 62 -10.240 7.428 3.157 1.00 0.00 C ATOM 875 OE1 GLU A 62 -10.806 6.371 3.505 1.00 0.00 O ATOM 876 OE2 GLU A 62 -10.401 8.517 3.747 1.00 0.00 O ATOM 0 H GLU A 62 -11.018 7.132 -1.330 1.00 0.00 H new ATOM 0 HA GLU A 62 -8.331 7.501 -0.361 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.921 6.829 0.668 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -9.842 5.511 1.080 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.350 6.969 2.264 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -9.120 8.404 1.617 1.00 0.00 H new ATOM 883 N GLN A 63 -9.230 4.681 -1.741 1.00 0.00 N ATOM 884 CA GLN A 63 -8.739 3.401 -2.237 1.00 0.00 C ATOM 885 C GLN A 63 -7.571 3.601 -3.196 1.00 0.00 C ATOM 886 O GLN A 63 -7.598 4.489 -4.048 1.00 0.00 O ATOM 887 CB GLN A 63 -9.865 2.638 -2.937 1.00 0.00 C ATOM 888 CG GLN A 63 -10.999 2.240 -2.008 1.00 0.00 C ATOM 889 CD GLN A 63 -11.813 1.080 -2.546 1.00 0.00 C ATOM 890 OE1 GLN A 63 -11.307 0.247 -3.296 1.00 0.00 O ATOM 891 NE2 GLN A 63 -13.083 1.020 -2.162 1.00 0.00 N ATOM 0 H GLN A 63 -10.174 4.918 -2.047 1.00 0.00 H new ATOM 0 HA GLN A 63 -8.389 2.818 -1.385 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -10.265 3.255 -3.742 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.452 1.741 -3.398 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.589 1.971 -1.035 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -11.654 3.097 -1.852 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.461 1.733 -1.538 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -13.680 0.261 -2.491 1.00 0.00 H new ATOM 900 N PHE A 64 -6.545 2.768 -3.052 1.00 0.00 N ATOM 901 CA PHE A 64 -5.366 2.852 -3.906 1.00 0.00 C ATOM 902 C PHE A 64 -5.183 1.567 -4.707 1.00 0.00 C ATOM 903 O PHE A 64 -5.748 0.527 -4.369 1.00 0.00 O ATOM 904 CB PHE A 64 -4.118 3.123 -3.063 1.00 0.00 C ATOM 905 CG PHE A 64 -4.049 4.524 -2.528 1.00 0.00 C ATOM 906 CD1 PHE A 64 -3.469 5.538 -3.276 1.00 0.00 C ATOM 907 CD2 PHE A 64 -4.562 4.829 -1.278 1.00 0.00 C ATOM 908 CE1 PHE A 64 -3.404 6.828 -2.786 1.00 0.00 C ATOM 909 CE2 PHE A 64 -4.499 6.119 -0.783 1.00 0.00 C ATOM 910 CZ PHE A 64 -3.919 7.118 -1.538 1.00 0.00 C ATOM 0 H PHE A 64 -6.507 2.027 -2.352 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.511 3.677 -4.604 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.094 2.422 -2.228 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.232 2.929 -3.667 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.064 5.317 -4.252 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -5.016 4.051 -0.683 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -2.951 7.609 -3.378 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.903 6.344 0.193 1.00 0.00 H new ATOM 0 HZ PHE A 64 -3.868 8.126 -1.153 1.00 0.00 H new ATOM 920 N THR A 65 -4.390 1.647 -5.771 1.00 0.00 N ATOM 921 CA THR A 65 -4.133 0.492 -6.621 1.00 0.00 C ATOM 922 C THR A 65 -2.654 0.118 -6.597 1.00 0.00 C ATOM 923 O THR A 65 -1.790 0.944 -6.890 1.00 0.00 O ATOM 924 CB THR A 65 -4.575 0.779 -8.057 1.00 0.00 C ATOM 925 OG1 THR A 65 -5.559 1.797 -8.084 1.00 0.00 O ATOM 926 CG2 THR A 65 -5.148 -0.432 -8.761 1.00 0.00 C ATOM 0 H THR A 65 -3.915 2.500 -6.064 1.00 0.00 H new ATOM 0 HA THR A 65 -4.709 -0.348 -6.233 1.00 0.00 H new ATOM 0 HB THR A 65 -3.671 1.089 -8.581 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.052 1.753 -8.930 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.441 -0.159 -9.775 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.395 -1.220 -8.801 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.020 -0.791 -8.215 1.00 0.00 H new ATOM 934 N ALA A 66 -2.371 -1.132 -6.248 1.00 0.00 N ATOM 935 CA ALA A 66 -0.997 -1.616 -6.187 1.00 0.00 C ATOM 936 C ALA A 66 -0.678 -2.516 -7.375 1.00 0.00 C ATOM 937 O ALA A 66 -1.433 -3.436 -7.690 1.00 0.00 O ATOM 938 CB ALA A 66 -0.758 -2.359 -4.880 1.00 0.00 C ATOM 0 H ALA A 66 -3.075 -1.828 -6.003 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.332 -0.754 -6.230 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.272 -2.715 -4.847 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.936 -1.686 -4.041 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.438 -3.208 -4.815 1.00 0.00 H new ATOM 944 N VAL A 67 0.444 -2.245 -8.033 1.00 0.00 N ATOM 945 CA VAL A 67 0.863 -3.031 -9.186 1.00 0.00 C ATOM 946 C VAL A 67 2.296 -3.525 -9.025 1.00 0.00 C ATOM 947 O VAL A 67 3.176 -2.779 -8.596 1.00 0.00 O ATOM 948 CB VAL A 67 0.756 -2.215 -10.490 1.00 0.00 C ATOM 949 CG1 VAL A 67 1.044 -3.094 -11.697 1.00 0.00 C ATOM 950 CG2 VAL A 67 -0.616 -1.570 -10.608 1.00 0.00 C ATOM 0 H VAL A 67 1.080 -1.486 -7.787 1.00 0.00 H new ATOM 0 HA VAL A 67 0.192 -3.888 -9.245 1.00 0.00 H new ATOM 0 HB VAL A 67 1.503 -1.422 -10.460 1.00 0.00 H new ATOM 0 HG11 VAL A 67 0.963 -2.500 -12.607 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.052 -3.502 -11.618 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.324 -3.911 -11.732 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.671 -0.999 -11.535 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.383 -2.345 -10.613 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.779 -0.904 -9.761 1.00 0.00 H new ATOM 960 N LYS A 68 2.524 -4.787 -9.373 1.00 0.00 N ATOM 961 CA LYS A 68 3.851 -5.381 -9.268 1.00 0.00 C ATOM 962 C LYS A 68 4.782 -4.825 -10.340 1.00 0.00 C ATOM 963 O LYS A 68 4.331 -4.375 -11.394 1.00 0.00 O ATOM 964 CB LYS A 68 3.762 -6.903 -9.394 1.00 0.00 C ATOM 965 CG LYS A 68 3.518 -7.610 -8.072 1.00 0.00 C ATOM 966 CD LYS A 68 3.803 -9.100 -8.176 1.00 0.00 C ATOM 967 CE LYS A 68 5.184 -9.441 -7.638 1.00 0.00 C ATOM 968 NZ LYS A 68 5.721 -10.691 -8.242 1.00 0.00 N ATOM 0 H LYS A 68 1.807 -5.418 -9.730 1.00 0.00 H new ATOM 0 HA LYS A 68 4.259 -5.127 -8.290 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.958 -7.155 -10.085 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.687 -7.278 -9.831 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.151 -7.170 -7.301 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.484 -7.457 -7.762 1.00 0.00 H new ATOM 0 HD2 LYS A 68 3.047 -9.656 -7.621 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.729 -9.414 -9.217 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.867 -8.616 -7.842 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.134 -9.553 -6.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 6.664 -10.889 -7.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 5.083 -11.483 -8.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 5.793 -10.575 -9.273 1.00 0.00 H new ATOM 982 N LEU A 69 6.082 -4.858 -10.066 1.00 0.00 N ATOM 983 CA LEU A 69 7.074 -4.356 -11.009 1.00 0.00 C ATOM 984 C LEU A 69 8.280 -5.288 -11.079 1.00 0.00 C ATOM 985 O LEU A 69 8.443 -6.034 -12.044 1.00 0.00 O ATOM 986 CB LEU A 69 7.520 -2.946 -10.613 1.00 0.00 C ATOM 987 CG LEU A 69 6.403 -1.900 -10.576 1.00 0.00 C ATOM 988 CD1 LEU A 69 6.910 -0.601 -9.969 1.00 0.00 C ATOM 989 CD2 LEU A 69 5.853 -1.660 -11.975 1.00 0.00 C ATOM 0 H LEU A 69 6.473 -5.227 -9.199 1.00 0.00 H new ATOM 0 HA LEU A 69 6.613 -4.317 -11.996 1.00 0.00 H new ATOM 0 HB2 LEU A 69 7.987 -2.992 -9.629 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.286 -2.613 -11.314 1.00 0.00 H new ATOM 0 HG LEU A 69 5.595 -2.278 -9.950 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.103 0.131 -9.951 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.256 -0.785 -8.952 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.735 -0.217 -10.569 1.00 0.00 H new ATOM 0 HD21 LEU A 69 5.060 -0.914 -11.931 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.652 -1.302 -12.624 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.452 -2.592 -12.373 1.00 0.00 H new ATOM 1001 N SER A 70 9.124 -5.240 -10.052 1.00 0.00 N ATOM 1002 CA SER A 70 10.314 -6.080 -10.000 1.00 0.00 C ATOM 1003 C SER A 70 11.105 -5.826 -8.720 1.00 0.00 C ATOM 1004 O SER A 70 11.082 -4.723 -8.175 1.00 0.00 O ATOM 1005 CB SER A 70 11.203 -5.823 -11.219 1.00 0.00 C ATOM 1006 OG SER A 70 11.199 -4.451 -11.574 1.00 0.00 O ATOM 0 H SER A 70 9.005 -4.628 -9.245 1.00 0.00 H new ATOM 0 HA SER A 70 9.991 -7.121 -10.008 1.00 0.00 H new ATOM 0 HB2 SER A 70 12.222 -6.143 -11.003 1.00 0.00 H new ATOM 0 HB3 SER A 70 10.853 -6.421 -12.061 1.00 0.00 H new ATOM 0 HG SER A 70 11.776 -4.313 -12.354 1.00 0.00 H new ATOM 1012 N ASP A 71 11.803 -6.853 -8.248 1.00 0.00 N ATOM 1013 CA ASP A 71 12.603 -6.740 -7.033 1.00 0.00 C ATOM 1014 C ASP A 71 11.727 -6.401 -5.830 1.00 0.00 C ATOM 1015 O ASP A 71 12.122 -5.627 -4.959 1.00 0.00 O ATOM 1016 CB ASP A 71 13.685 -5.673 -7.207 1.00 0.00 C ATOM 1017 CG ASP A 71 14.991 -6.060 -6.542 1.00 0.00 C ATOM 1018 OD1 ASP A 71 15.710 -6.915 -7.100 1.00 0.00 O ATOM 1019 OD2 ASP A 71 15.295 -5.508 -5.463 1.00 0.00 O ATOM 0 H ASP A 71 11.831 -7.773 -8.688 1.00 0.00 H new ATOM 0 HA ASP A 71 13.078 -7.704 -6.852 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.858 -5.505 -8.270 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.333 -4.730 -6.788 1.00 0.00 H new ATOM 1024 N SER A 72 10.536 -6.990 -5.787 1.00 0.00 N ATOM 1025 CA SER A 72 9.604 -6.753 -4.690 1.00 0.00 C ATOM 1026 C SER A 72 9.195 -5.284 -4.628 1.00 0.00 C ATOM 1027 O SER A 72 8.994 -4.732 -3.547 1.00 0.00 O ATOM 1028 CB SER A 72 10.229 -7.178 -3.360 1.00 0.00 C ATOM 1029 OG SER A 72 9.282 -7.837 -2.538 1.00 0.00 O ATOM 0 H SER A 72 10.193 -7.635 -6.499 1.00 0.00 H new ATOM 0 HA SER A 72 8.711 -7.351 -4.871 1.00 0.00 H new ATOM 0 HB2 SER A 72 11.075 -7.839 -3.547 1.00 0.00 H new ATOM 0 HB3 SER A 72 10.618 -6.302 -2.841 1.00 0.00 H new ATOM 0 HG SER A 72 8.386 -7.487 -2.726 1.00 0.00 H new ATOM 1035 N ARG A 73 9.073 -4.658 -5.794 1.00 0.00 N ATOM 1036 CA ARG A 73 8.686 -3.254 -5.870 1.00 0.00 C ATOM 1037 C ARG A 73 7.306 -3.104 -6.503 1.00 0.00 C ATOM 1038 O ARG A 73 7.086 -3.517 -7.641 1.00 0.00 O ATOM 1039 CB ARG A 73 9.719 -2.462 -6.675 1.00 0.00 C ATOM 1040 CG ARG A 73 11.157 -2.758 -6.280 1.00 0.00 C ATOM 1041 CD ARG A 73 11.594 -1.913 -5.095 1.00 0.00 C ATOM 1042 NE ARG A 73 11.654 -0.492 -5.426 1.00 0.00 N ATOM 1043 CZ ARG A 73 12.350 0.405 -4.731 1.00 0.00 C ATOM 1044 NH1 ARG A 73 13.046 0.033 -3.664 1.00 0.00 N ATOM 1045 NH2 ARG A 73 12.351 1.677 -5.105 1.00 0.00 N ATOM 0 H ARG A 73 9.236 -5.100 -6.698 1.00 0.00 H new ATOM 0 HA ARG A 73 8.645 -2.858 -4.855 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.589 -2.684 -7.734 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.528 -1.397 -6.547 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.257 -3.815 -6.031 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.815 -2.566 -7.127 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.900 -2.063 -4.268 1.00 0.00 H new ATOM 0 HD3 ARG A 73 12.574 -2.247 -4.754 1.00 0.00 H new ATOM 0 HE ARG A 73 11.131 -0.167 -6.239 1.00 0.00 H new ATOM 0 HH11 ARG A 73 13.049 -0.945 -3.373 1.00 0.00 H new ATOM 0 HH12 ARG A 73 13.578 0.725 -3.135 1.00 0.00 H new ATOM 0 HH21 ARG A 73 11.819 1.968 -5.925 1.00 0.00 H new ATOM 0 HH22 ARG A 73 12.884 2.365 -4.573 1.00 0.00 H new ATOM 1059 N ILE A 74 6.381 -2.510 -5.757 1.00 0.00 N ATOM 1060 CA ILE A 74 5.021 -2.306 -6.245 1.00 0.00 C ATOM 1061 C ILE A 74 4.729 -0.824 -6.454 1.00 0.00 C ATOM 1062 O ILE A 74 5.283 0.032 -5.764 1.00 0.00 O ATOM 1063 CB ILE A 74 3.979 -2.889 -5.271 1.00 0.00 C ATOM 1064 CG1 ILE A 74 4.276 -2.436 -3.841 1.00 0.00 C ATOM 1065 CG2 ILE A 74 3.958 -4.409 -5.361 1.00 0.00 C ATOM 1066 CD1 ILE A 74 3.173 -2.770 -2.860 1.00 0.00 C ATOM 0 H ILE A 74 6.547 -2.161 -4.813 1.00 0.00 H new ATOM 0 HA ILE A 74 4.947 -2.828 -7.199 1.00 0.00 H new ATOM 0 HB ILE A 74 2.994 -2.517 -5.552 1.00 0.00 H new ATOM 0 HG12 ILE A 74 5.203 -2.902 -3.506 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.441 -1.359 -3.837 1.00 0.00 H new ATOM 0 HG21 ILE A 74 3.217 -4.804 -4.667 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.701 -4.710 -6.377 1.00 0.00 H new ATOM 0 HG23 ILE A 74 4.942 -4.802 -5.104 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.452 -2.420 -1.866 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.249 -2.282 -3.171 1.00 0.00 H new ATOM 0 HD13 ILE A 74 3.023 -3.849 -2.835 1.00 0.00 H new ATOM 1078 N ALA A 75 3.854 -0.528 -7.411 1.00 0.00 N ATOM 1079 CA ALA A 75 3.487 0.850 -7.710 1.00 0.00 C ATOM 1080 C ALA A 75 2.078 1.161 -7.215 1.00 0.00 C ATOM 1081 O ALA A 75 1.130 0.437 -7.515 1.00 0.00 O ATOM 1082 CB ALA A 75 3.593 1.111 -9.205 1.00 0.00 C ATOM 0 H ALA A 75 3.387 -1.225 -7.992 1.00 0.00 H new ATOM 0 HA ALA A 75 4.181 1.508 -7.187 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.316 2.144 -9.415 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.618 0.936 -9.533 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.921 0.440 -9.740 1.00 0.00 H new ATOM 1088 N LEU A 76 1.949 2.243 -6.454 1.00 0.00 N ATOM 1089 CA LEU A 76 0.656 2.649 -5.916 1.00 0.00 C ATOM 1090 C LEU A 76 -0.010 3.681 -6.820 1.00 0.00 C ATOM 1091 O LEU A 76 0.659 4.378 -7.584 1.00 0.00 O ATOM 1092 CB LEU A 76 0.823 3.221 -4.507 1.00 0.00 C ATOM 1093 CG LEU A 76 0.831 2.183 -3.384 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.393 2.785 -2.105 1.00 0.00 C ATOM 1095 CD2 LEU A 76 -0.572 1.642 -3.150 1.00 0.00 C ATOM 0 H LEU A 76 2.724 2.854 -6.196 1.00 0.00 H new ATOM 0 HA LEU A 76 0.017 1.767 -5.869 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.756 3.783 -4.468 1.00 0.00 H new ATOM 0 HB3 LEU A 76 0.016 3.929 -4.321 1.00 0.00 H new ATOM 0 HG LEU A 76 1.473 1.355 -3.684 1.00 0.00 H new ATOM 0 HD11 LEU A 76 1.391 2.032 -1.317 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.414 3.124 -2.280 1.00 0.00 H new ATOM 0 HD13 LEU A 76 0.777 3.631 -1.800 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -0.548 0.905 -2.348 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.236 2.460 -2.871 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -0.938 1.173 -4.063 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.333 3.774 -6.728 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.091 4.722 -7.538 1.00 0.00 C ATOM 1109 C LYS A 77 -3.323 5.215 -6.784 1.00 0.00 C ATOM 1110 O LYS A 77 -4.054 4.426 -6.186 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.512 4.075 -8.858 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.010 5.071 -9.892 1.00 0.00 C ATOM 1113 CD LYS A 77 -3.014 4.472 -11.289 1.00 0.00 C ATOM 1114 CE LYS A 77 -4.422 4.116 -11.741 1.00 0.00 C ATOM 1115 NZ LYS A 77 -4.917 2.874 -11.086 1.00 0.00 N ATOM 0 H LYS A 77 -1.902 3.205 -6.101 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.449 5.577 -7.750 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.665 3.528 -9.271 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.297 3.345 -8.661 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -4.018 5.394 -9.631 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.377 5.958 -9.878 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -2.574 5.181 -11.991 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.389 3.579 -11.304 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -5.096 4.941 -11.512 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -4.434 3.986 -12.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -5.873 2.656 -11.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -4.278 2.085 -11.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -4.946 3.013 -10.056 1.00 0.00 H new ATOM 1129 N SER A 78 -3.545 6.525 -6.817 1.00 0.00 N ATOM 1130 CA SER A 78 -4.688 7.124 -6.139 1.00 0.00 C ATOM 1131 C SER A 78 -5.990 6.773 -6.850 1.00 0.00 C ATOM 1132 O SER A 78 -5.985 6.382 -8.018 1.00 0.00 O ATOM 1133 CB SER A 78 -4.525 8.643 -6.065 1.00 0.00 C ATOM 1134 OG SER A 78 -4.586 9.226 -7.355 1.00 0.00 O ATOM 0 H SER A 78 -2.948 7.192 -7.306 1.00 0.00 H new ATOM 0 HA SER A 78 -4.730 6.721 -5.127 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.307 9.065 -5.434 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.571 8.887 -5.597 1.00 0.00 H new ATOM 0 HG SER A 78 -4.481 10.197 -7.280 1.00 0.00 H new ATOM 1140 N GLY A 79 -7.104 6.916 -6.140 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.398 6.610 -6.721 1.00 0.00 C ATOM 1142 C GLY A 79 -8.740 7.517 -7.886 1.00 0.00 C ATOM 1143 O GLY A 79 -9.471 7.123 -8.794 1.00 0.00 O ATOM 0 H GLY A 79 -7.134 7.238 -5.173 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.406 5.573 -7.057 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -9.168 6.702 -5.955 1.00 0.00 H new ATOM 1147 N TYR A 80 -8.209 8.735 -7.860 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.461 9.702 -8.922 1.00 0.00 C ATOM 1149 C TYR A 80 -7.874 9.221 -10.245 1.00 0.00 C ATOM 1150 O TYR A 80 -8.504 9.340 -11.296 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.870 11.064 -8.552 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.801 11.924 -7.728 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -9.869 12.588 -8.318 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -8.611 12.072 -6.359 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -10.721 13.376 -7.567 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -9.460 12.857 -5.602 1.00 0.00 C ATOM 1157 CZ TYR A 80 -10.513 13.507 -6.212 1.00 0.00 C ATOM 1158 OH TYR A 80 -11.360 14.289 -5.461 1.00 0.00 O ATOM 0 H TYR A 80 -7.601 9.076 -7.115 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.540 9.803 -9.039 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.944 10.910 -7.997 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.609 11.598 -9.466 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -10.036 12.487 -9.380 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -7.787 11.565 -5.879 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -11.546 13.887 -8.041 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -9.300 12.961 -4.539 1.00 0.00 H new ATOM 0 HH TYR A 80 -11.074 14.274 -4.524 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.662 8.680 -10.187 1.00 0.00 N ATOM 1169 CA GLY A 81 -6.009 8.189 -11.387 1.00 0.00 C ATOM 1170 C GLY A 81 -4.594 8.712 -11.534 1.00 0.00 C ATOM 1171 O GLY A 81 -4.179 9.102 -12.625 1.00 0.00 O ATOM 0 H GLY A 81 -6.120 8.573 -9.330 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -5.990 7.099 -11.366 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.593 8.481 -12.260 1.00 0.00 H new ATOM 1175 N LYS A 82 -3.852 8.722 -10.431 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.475 9.201 -10.442 1.00 0.00 C ATOM 1177 C LYS A 82 -1.575 8.292 -9.610 1.00 0.00 C ATOM 1178 O LYS A 82 -1.950 7.860 -8.520 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.407 10.633 -9.907 1.00 0.00 C ATOM 1180 CG LYS A 82 -2.731 11.689 -10.952 1.00 0.00 C ATOM 1181 CD LYS A 82 -3.377 12.913 -10.325 1.00 0.00 C ATOM 1182 CE LYS A 82 -4.469 13.486 -11.213 1.00 0.00 C ATOM 1183 NZ LYS A 82 -4.005 14.685 -11.965 1.00 0.00 N ATOM 0 H LYS A 82 -4.181 8.404 -9.519 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.121 9.188 -11.473 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.102 10.734 -9.073 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.408 10.818 -9.513 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -1.818 11.983 -11.469 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.400 11.267 -11.702 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.798 12.647 -9.356 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.618 13.674 -10.144 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -4.802 12.723 -11.917 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -5.331 13.753 -10.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.780 15.044 -12.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -3.712 15.423 -11.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -3.199 14.426 -12.569 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.387 8.006 -10.132 1.00 0.00 N ATOM 1198 CA TYR A 83 0.567 7.149 -9.438 1.00 0.00 C ATOM 1199 C TYR A 83 1.285 7.918 -8.334 1.00 0.00 C ATOM 1200 O TYR A 83 1.813 9.006 -8.563 1.00 0.00 O ATOM 1201 CB TYR A 83 1.587 6.581 -10.426 1.00 0.00 C ATOM 1202 CG TYR A 83 1.104 5.346 -11.153 1.00 0.00 C ATOM 1203 CD1 TYR A 83 1.318 4.079 -10.626 1.00 0.00 C ATOM 1204 CD2 TYR A 83 0.436 5.448 -12.366 1.00 0.00 C ATOM 1205 CE1 TYR A 83 0.879 2.948 -11.287 1.00 0.00 C ATOM 1206 CE2 TYR A 83 -0.008 4.322 -13.033 1.00 0.00 C ATOM 1207 CZ TYR A 83 0.217 3.074 -12.490 1.00 0.00 C ATOM 1208 OH TYR A 83 -0.222 1.951 -13.152 1.00 0.00 O ATOM 0 H TYR A 83 -0.062 8.355 -11.034 1.00 0.00 H new ATOM 0 HA TYR A 83 0.015 6.326 -8.984 1.00 0.00 H new ATOM 0 HB2 TYR A 83 1.837 7.349 -11.158 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.505 6.341 -9.890 1.00 0.00 H new ATOM 0 HD1 TYR A 83 1.836 3.976 -9.684 1.00 0.00 H new ATOM 0 HD2 TYR A 83 0.261 6.423 -12.795 1.00 0.00 H new ATOM 0 HE1 TYR A 83 1.053 1.970 -10.864 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -0.528 4.419 -13.974 1.00 0.00 H new ATOM 0 HH TYR A 83 -0.670 2.215 -13.983 1.00 0.00 H new ATOM 1218 N LEU A 84 1.301 7.344 -7.134 1.00 0.00 N ATOM 1219 CA LEU A 84 1.954 7.977 -5.994 1.00 0.00 C ATOM 1220 C LEU A 84 3.458 8.089 -6.221 1.00 0.00 C ATOM 1221 O LEU A 84 4.182 7.095 -6.153 1.00 0.00 O ATOM 1222 CB LEU A 84 1.678 7.182 -4.716 1.00 0.00 C ATOM 1223 CG LEU A 84 0.226 7.208 -4.238 1.00 0.00 C ATOM 1224 CD1 LEU A 84 0.059 6.354 -2.992 1.00 0.00 C ATOM 1225 CD2 LEU A 84 -0.221 8.638 -3.973 1.00 0.00 C ATOM 0 H LEU A 84 0.870 6.443 -6.927 1.00 0.00 H new ATOM 0 HA LEU A 84 1.545 8.982 -5.885 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.972 6.145 -4.881 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.313 7.571 -3.920 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.404 6.792 -5.024 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.981 6.385 -2.667 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.339 5.325 -3.216 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.699 6.739 -2.198 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.257 8.638 -3.634 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.413 9.081 -3.205 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.140 9.221 -4.891 1.00 0.00 H new ATOM 1237 N GLY A 85 3.922 9.305 -6.492 1.00 0.00 N ATOM 1238 CA GLY A 85 5.337 9.524 -6.725 1.00 0.00 C ATOM 1239 C GLY A 85 5.971 10.401 -5.663 1.00 0.00 C ATOM 1240 O GLY A 85 5.374 11.383 -5.221 1.00 0.00 O ATOM 0 H GLY A 85 3.343 10.142 -6.554 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.851 8.563 -6.752 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.474 9.986 -7.703 1.00 0.00 H new ATOM 1244 N ILE A 86 7.185 10.045 -5.253 1.00 0.00 N ATOM 1245 CA ILE A 86 7.900 10.805 -4.237 1.00 0.00 C ATOM 1246 C ILE A 86 8.663 11.971 -4.858 1.00 0.00 C ATOM 1247 O ILE A 86 8.989 11.951 -6.045 1.00 0.00 O ATOM 1248 CB ILE A 86 8.891 9.915 -3.461 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.883 9.257 -4.423 1.00 0.00 C ATOM 1250 CG2 ILE A 86 8.140 8.862 -2.661 1.00 0.00 C ATOM 1251 CD1 ILE A 86 11.319 9.331 -3.954 1.00 0.00 C ATOM 0 H ILE A 86 7.693 9.235 -5.610 1.00 0.00 H new ATOM 0 HA ILE A 86 7.150 11.190 -3.546 1.00 0.00 H new ATOM 0 HB ILE A 86 9.451 10.540 -2.766 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.607 8.211 -4.558 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.803 9.736 -5.399 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.852 8.241 -2.118 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.472 9.351 -1.953 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.557 8.238 -3.338 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.966 8.845 -4.684 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.613 10.375 -3.846 1.00 0.00 H new ATOM 0 HD13 ILE A 86 11.414 8.826 -2.993 1.00 0.00 H new ATOM 1263 N ASN A 87 8.946 12.985 -4.046 1.00 0.00 N ATOM 1264 CA ASN A 87 9.671 14.160 -4.516 1.00 0.00 C ATOM 1265 C ASN A 87 11.090 14.182 -3.958 1.00 0.00 C ATOM 1266 O ASN A 87 11.417 13.435 -3.035 1.00 0.00 O ATOM 1267 CB ASN A 87 8.931 15.437 -4.111 1.00 0.00 C ATOM 1268 CG ASN A 87 8.016 15.946 -5.208 1.00 0.00 C ATOM 1269 OD1 ASN A 87 8.266 15.723 -6.393 1.00 0.00 O ATOM 1270 ND2 ASN A 87 6.949 16.633 -4.818 1.00 0.00 N ATOM 0 H ASN A 87 8.685 13.016 -3.061 1.00 0.00 H new ATOM 0 HA ASN A 87 9.728 14.111 -5.603 1.00 0.00 H new ATOM 0 HB2 ASN A 87 8.345 15.245 -3.212 1.00 0.00 H new ATOM 0 HB3 ASN A 87 9.657 16.210 -3.859 1.00 0.00 H new ATOM 0 HD21 ASN A 87 6.297 17.000 -5.511 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.781 16.794 -3.825 1.00 0.00 H new ATOM 1277 N SER A 88 11.930 15.042 -4.524 1.00 0.00 N ATOM 1278 CA SER A 88 13.315 15.162 -4.084 1.00 0.00 C ATOM 1279 C SER A 88 13.386 15.621 -2.631 1.00 0.00 C ATOM 1280 O SER A 88 14.228 15.156 -1.863 1.00 0.00 O ATOM 1281 CB SER A 88 14.075 16.142 -4.979 1.00 0.00 C ATOM 1282 OG SER A 88 13.255 17.239 -5.345 1.00 0.00 O ATOM 0 H SER A 88 11.675 15.667 -5.289 1.00 0.00 H new ATOM 0 HA SER A 88 13.780 14.179 -4.159 1.00 0.00 H new ATOM 0 HB2 SER A 88 14.961 16.504 -4.457 1.00 0.00 H new ATOM 0 HB3 SER A 88 14.421 15.627 -5.875 1.00 0.00 H new ATOM 0 HG SER A 88 13.764 17.852 -5.915 1.00 0.00 H new ATOM 1288 N ASP A 89 12.497 16.537 -2.261 1.00 0.00 N ATOM 1289 CA ASP A 89 12.459 17.060 -0.900 1.00 0.00 C ATOM 1290 C ASP A 89 12.084 15.966 0.092 1.00 0.00 C ATOM 1291 O ASP A 89 12.524 15.979 1.242 1.00 0.00 O ATOM 1292 CB ASP A 89 11.463 18.217 -0.803 1.00 0.00 C ATOM 1293 CG ASP A 89 11.922 19.296 0.158 1.00 0.00 C ATOM 1294 OD1 ASP A 89 12.060 18.999 1.362 1.00 0.00 O ATOM 1295 OD2 ASP A 89 12.144 20.439 -0.296 1.00 0.00 O ATOM 0 H ASP A 89 11.793 16.932 -2.884 1.00 0.00 H new ATOM 0 HA ASP A 89 13.455 17.426 -0.650 1.00 0.00 H new ATOM 0 HB2 ASP A 89 11.319 18.652 -1.792 1.00 0.00 H new ATOM 0 HB3 ASP A 89 10.495 17.834 -0.479 1.00 0.00 H new ATOM 1300 N GLY A 90 11.269 15.017 -0.359 1.00 0.00 N ATOM 1301 CA GLY A 90 10.848 13.928 0.503 1.00 0.00 C ATOM 1302 C GLY A 90 9.369 13.984 0.830 1.00 0.00 C ATOM 1303 O GLY A 90 8.944 13.521 1.889 1.00 0.00 O ATOM 0 H GLY A 90 10.893 14.983 -1.306 1.00 0.00 H new ATOM 0 HA2 GLY A 90 11.074 12.978 0.019 1.00 0.00 H new ATOM 0 HA3 GLY A 90 11.423 13.959 1.429 1.00 0.00 H new ATOM 1307 N LEU A 91 8.585 14.553 -0.079 1.00 0.00 N ATOM 1308 CA LEU A 91 7.145 14.669 0.120 1.00 0.00 C ATOM 1309 C LEU A 91 6.393 13.681 -0.766 1.00 0.00 C ATOM 1310 O LEU A 91 6.734 13.494 -1.934 1.00 0.00 O ATOM 1311 CB LEU A 91 6.680 16.096 -0.179 1.00 0.00 C ATOM 1312 CG LEU A 91 5.383 16.514 0.515 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.684 17.275 1.797 1.00 0.00 C ATOM 1314 CD2 LEU A 91 4.525 17.357 -0.418 1.00 0.00 C ATOM 0 H LEU A 91 8.922 14.941 -0.960 1.00 0.00 H new ATOM 0 HA LEU A 91 6.927 14.435 1.162 1.00 0.00 H new ATOM 0 HB2 LEU A 91 7.470 16.788 0.114 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.548 16.200 -1.256 1.00 0.00 H new ATOM 0 HG LEU A 91 4.826 15.613 0.773 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.749 17.564 2.277 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.256 16.639 2.472 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.263 18.168 1.562 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.606 17.645 0.093 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.075 18.252 -0.708 1.00 0.00 H new ATOM 0 HD23 LEU A 91 4.279 16.778 -1.308 1.00 0.00 H new ATOM 1326 N VAL A 92 5.367 13.051 -0.201 1.00 0.00 N ATOM 1327 CA VAL A 92 4.565 12.083 -0.940 1.00 0.00 C ATOM 1328 C VAL A 92 3.493 12.779 -1.771 1.00 0.00 C ATOM 1329 O VAL A 92 2.537 13.337 -1.230 1.00 0.00 O ATOM 1330 CB VAL A 92 3.889 11.074 0.007 1.00 0.00 C ATOM 1331 CG1 VAL A 92 3.213 9.966 -0.785 1.00 0.00 C ATOM 1332 CG2 VAL A 92 4.903 10.498 0.985 1.00 0.00 C ATOM 0 H VAL A 92 5.072 13.194 0.765 1.00 0.00 H new ATOM 0 HA VAL A 92 5.246 11.548 -1.603 1.00 0.00 H new ATOM 0 HB VAL A 92 3.123 11.598 0.579 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.741 9.263 -0.098 1.00 0.00 H new ATOM 0 HG12 VAL A 92 2.456 10.397 -1.440 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.957 9.442 -1.386 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.408 9.787 1.646 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.693 9.990 0.433 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.335 11.304 1.578 1.00 0.00 H new ATOM 1342 N VAL A 93 3.658 12.745 -3.090 1.00 0.00 N ATOM 1343 CA VAL A 93 2.704 13.374 -3.996 1.00 0.00 C ATOM 1344 C VAL A 93 2.249 12.401 -5.079 1.00 0.00 C ATOM 1345 O VAL A 93 2.884 11.372 -5.309 1.00 0.00 O ATOM 1346 CB VAL A 93 3.306 14.623 -4.666 1.00 0.00 C ATOM 1347 CG1 VAL A 93 3.470 15.746 -3.653 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.636 14.288 -5.323 1.00 0.00 C ATOM 0 H VAL A 93 4.443 12.289 -3.555 1.00 0.00 H new ATOM 0 HA VAL A 93 1.845 13.671 -3.394 1.00 0.00 H new ATOM 0 HB VAL A 93 2.620 14.963 -5.442 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.897 16.620 -4.145 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.497 16.004 -3.235 1.00 0.00 H new ATOM 0 HG13 VAL A 93 4.134 15.420 -2.853 1.00 0.00 H new ATOM 0 HG21 VAL A 93 5.046 15.183 -5.791 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.332 13.921 -4.569 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.484 13.519 -6.081 1.00 0.00 H new ATOM 1358 N GLY A 94 1.145 12.734 -5.739 1.00 0.00 N ATOM 1359 CA GLY A 94 0.624 11.880 -6.790 1.00 0.00 C ATOM 1360 C GLY A 94 0.028 12.670 -7.938 1.00 0.00 C ATOM 1361 O GLY A 94 -1.190 12.830 -8.024 1.00 0.00 O ATOM 0 H GLY A 94 0.602 13.580 -5.565 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.425 11.244 -7.168 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.137 11.220 -6.374 1.00 0.00 H new ATOM 1365 N ARG A 95 0.887 13.166 -8.822 1.00 0.00 N ATOM 1366 CA ARG A 95 0.438 13.944 -9.971 1.00 0.00 C ATOM 1367 C ARG A 95 1.110 13.460 -11.253 1.00 0.00 C ATOM 1368 O ARG A 95 1.425 14.254 -12.139 1.00 0.00 O ATOM 1369 CB ARG A 95 0.736 15.429 -9.756 1.00 0.00 C ATOM 1370 CG ARG A 95 2.196 15.719 -9.449 1.00 0.00 C ATOM 1371 CD ARG A 95 2.446 17.210 -9.284 1.00 0.00 C ATOM 1372 NE ARG A 95 1.688 17.771 -8.168 1.00 0.00 N ATOM 1373 CZ ARG A 95 1.941 18.958 -7.621 1.00 0.00 C ATOM 1374 NH1 ARG A 95 2.932 19.711 -8.085 1.00 0.00 N ATOM 1375 NH2 ARG A 95 1.203 19.394 -6.610 1.00 0.00 N ATOM 0 H ARG A 95 1.898 13.043 -8.765 1.00 0.00 H new ATOM 0 HA ARG A 95 -0.639 13.807 -10.072 1.00 0.00 H new ATOM 0 HB2 ARG A 95 0.444 15.982 -10.649 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.121 15.799 -8.936 1.00 0.00 H new ATOM 0 HG2 ARG A 95 2.488 15.197 -8.538 1.00 0.00 H new ATOM 0 HG3 ARG A 95 2.822 15.331 -10.253 1.00 0.00 H new ATOM 0 HD2 ARG A 95 3.510 17.384 -9.123 1.00 0.00 H new ATOM 0 HD3 ARG A 95 2.174 17.727 -10.204 1.00 0.00 H new ATOM 0 HE ARG A 95 0.919 17.220 -7.785 1.00 0.00 H new ATOM 0 HH11 ARG A 95 3.502 19.380 -8.863 1.00 0.00 H new ATOM 0 HH12 ARG A 95 3.123 20.620 -7.663 1.00 0.00 H new ATOM 0 HH21 ARG A 95 0.440 18.820 -6.250 1.00 0.00 H new ATOM 0 HH22 ARG A 95 1.398 20.304 -6.192 1.00 0.00 H new ATOM 1389 N SER A 96 1.328 12.152 -11.342 1.00 0.00 N ATOM 1390 CA SER A 96 1.962 11.561 -12.515 1.00 0.00 C ATOM 1391 C SER A 96 1.284 10.250 -12.898 1.00 0.00 C ATOM 1392 O SER A 96 1.055 9.388 -12.048 1.00 0.00 O ATOM 1393 CB SER A 96 3.450 11.323 -12.250 1.00 0.00 C ATOM 1394 OG SER A 96 4.227 12.432 -12.667 1.00 0.00 O ATOM 0 H SER A 96 1.075 11.481 -10.616 1.00 0.00 H new ATOM 0 HA SER A 96 1.855 12.259 -13.346 1.00 0.00 H new ATOM 0 HB2 SER A 96 3.609 11.143 -11.187 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.778 10.427 -12.777 1.00 0.00 H new ATOM 0 HG SER A 96 5.174 12.255 -12.485 1.00 0.00 H new ATOM 1400 N ASP A 97 0.967 10.104 -14.180 1.00 0.00 N ATOM 1401 CA ASP A 97 0.315 8.897 -14.674 1.00 0.00 C ATOM 1402 C ASP A 97 1.329 7.951 -15.309 1.00 0.00 C ATOM 1403 O ASP A 97 1.008 7.216 -16.243 1.00 0.00 O ATOM 1404 CB ASP A 97 -0.768 9.258 -15.691 1.00 0.00 C ATOM 1405 CG ASP A 97 -1.985 8.360 -15.583 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -1.873 7.166 -15.929 1.00 0.00 O ATOM 1407 OD2 ASP A 97 -3.049 8.851 -15.151 1.00 0.00 O ATOM 0 H ASP A 97 1.151 10.807 -14.896 1.00 0.00 H new ATOM 0 HA ASP A 97 -0.146 8.390 -13.826 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -1.071 10.295 -15.543 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -0.356 9.187 -16.697 1.00 0.00 H new ATOM 1412 N ALA A 98 2.555 7.973 -14.794 1.00 0.00 N ATOM 1413 CA ALA A 98 3.616 7.117 -15.310 1.00 0.00 C ATOM 1414 C ALA A 98 4.164 6.204 -14.219 1.00 0.00 C ATOM 1415 O ALA A 98 3.657 6.188 -13.097 1.00 0.00 O ATOM 1416 CB ALA A 98 4.732 7.961 -15.904 1.00 0.00 C ATOM 0 H ALA A 98 2.837 8.574 -14.020 1.00 0.00 H new ATOM 0 HA ALA A 98 3.193 6.489 -16.094 1.00 0.00 H new ATOM 0 HB1 ALA A 98 5.518 7.309 -16.286 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.336 8.567 -16.719 1.00 0.00 H new ATOM 0 HB3 ALA A 98 5.144 8.613 -15.134 1.00 0.00 H new ATOM 1422 N ILE A 99 5.201 5.443 -14.555 1.00 0.00 N ATOM 1423 CA ILE A 99 5.818 4.528 -13.603 1.00 0.00 C ATOM 1424 C ILE A 99 7.334 4.680 -13.597 1.00 0.00 C ATOM 1425 O ILE A 99 8.046 3.936 -14.271 1.00 0.00 O ATOM 1426 CB ILE A 99 5.462 3.063 -13.921 1.00 0.00 C ATOM 1427 CG1 ILE A 99 3.954 2.914 -14.133 1.00 0.00 C ATOM 1428 CG2 ILE A 99 5.939 2.147 -12.804 1.00 0.00 C ATOM 1429 CD1 ILE A 99 3.550 1.558 -14.668 1.00 0.00 C ATOM 0 H ILE A 99 5.631 5.442 -15.480 1.00 0.00 H new ATOM 0 HA ILE A 99 5.426 4.785 -12.619 1.00 0.00 H new ATOM 0 HB ILE A 99 5.968 2.774 -14.842 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.443 3.089 -13.186 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.615 3.685 -14.825 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.680 1.116 -13.044 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.020 2.234 -12.699 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.459 2.434 -11.868 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.468 1.524 -14.794 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.033 1.388 -15.631 1.00 0.00 H new ATOM 0 HD13 ILE A 99 3.858 0.783 -13.966 1.00 0.00 H new ATOM 1441 N GLY A 100 7.824 5.651 -12.832 1.00 0.00 N ATOM 1442 CA GLY A 100 9.253 5.884 -12.753 1.00 0.00 C ATOM 1443 C GLY A 100 9.843 5.432 -11.430 1.00 0.00 C ATOM 1444 O GLY A 100 9.240 4.623 -10.724 1.00 0.00 O ATOM 0 H GLY A 100 7.256 6.280 -12.265 1.00 0.00 H new ATOM 0 HA2 GLY A 100 9.749 5.357 -13.568 1.00 0.00 H new ATOM 0 HA3 GLY A 100 9.453 6.946 -12.892 1.00 0.00 H new ATOM 1448 N PRO A 101 11.033 5.940 -11.064 1.00 0.00 N ATOM 1449 CA PRO A 101 11.695 5.574 -9.808 1.00 0.00 C ATOM 1450 C PRO A 101 10.970 6.128 -8.587 1.00 0.00 C ATOM 1451 O PRO A 101 10.811 5.438 -7.580 1.00 0.00 O ATOM 1452 CB PRO A 101 13.083 6.206 -9.939 1.00 0.00 C ATOM 1453 CG PRO A 101 12.893 7.343 -10.881 1.00 0.00 C ATOM 1454 CD PRO A 101 11.823 6.909 -11.845 1.00 0.00 C ATOM 0 HA PRO A 101 11.716 4.494 -9.659 1.00 0.00 H new ATOM 0 HB2 PRO A 101 13.454 6.549 -8.974 1.00 0.00 H new ATOM 0 HB3 PRO A 101 13.809 5.490 -10.324 1.00 0.00 H new ATOM 0 HG2 PRO A 101 12.595 8.246 -10.348 1.00 0.00 H new ATOM 0 HG3 PRO A 101 13.820 7.574 -11.405 1.00 0.00 H new ATOM 0 HD2 PRO A 101 11.214 7.751 -12.175 1.00 0.00 H new ATOM 0 HD3 PRO A 101 12.248 6.453 -12.739 1.00 0.00 H new ATOM 1462 N ARG A 102 10.530 7.379 -8.684 1.00 0.00 N ATOM 1463 CA ARG A 102 9.822 8.026 -7.586 1.00 0.00 C ATOM 1464 C ARG A 102 8.471 7.362 -7.344 1.00 0.00 C ATOM 1465 O ARG A 102 7.996 7.294 -6.210 1.00 0.00 O ATOM 1466 CB ARG A 102 9.625 9.514 -7.885 1.00 0.00 C ATOM 1467 CG ARG A 102 10.911 10.321 -7.826 1.00 0.00 C ATOM 1468 CD ARG A 102 11.459 10.603 -9.216 1.00 0.00 C ATOM 1469 NE ARG A 102 12.916 10.507 -9.260 1.00 0.00 N ATOM 1470 CZ ARG A 102 13.665 11.038 -10.224 1.00 0.00 C ATOM 1471 NH1 ARG A 102 13.100 11.703 -11.223 1.00 0.00 N ATOM 1472 NH2 ARG A 102 14.984 10.904 -10.188 1.00 0.00 N ATOM 0 H ARG A 102 10.651 7.964 -9.511 1.00 0.00 H new ATOM 0 HA ARG A 102 10.426 7.920 -6.685 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.183 9.622 -8.876 1.00 0.00 H new ATOM 0 HB3 ARG A 102 8.913 9.928 -7.172 1.00 0.00 H new ATOM 0 HG2 ARG A 102 10.727 11.263 -7.309 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.656 9.778 -7.244 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.028 9.897 -9.926 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.152 11.600 -9.531 1.00 0.00 H new ATOM 0 HE ARG A 102 13.387 10.004 -8.508 1.00 0.00 H new ATOM 0 HH11 ARG A 102 12.086 11.810 -11.256 1.00 0.00 H new ATOM 0 HH12 ARG A 102 13.679 12.108 -11.959 1.00 0.00 H new ATOM 0 HH21 ARG A 102 15.424 10.394 -9.422 1.00 0.00 H new ATOM 0 HH22 ARG A 102 15.558 11.311 -10.926 1.00 0.00 H new ATOM 1486 N GLU A 103 7.857 6.872 -8.416 1.00 0.00 N ATOM 1487 CA GLU A 103 6.561 6.211 -8.320 1.00 0.00 C ATOM 1488 C GLU A 103 6.700 4.824 -7.700 1.00 0.00 C ATOM 1489 O GLU A 103 5.767 4.317 -7.076 1.00 0.00 O ATOM 1490 CB GLU A 103 5.918 6.101 -9.703 1.00 0.00 C ATOM 1491 CG GLU A 103 5.254 7.387 -10.170 1.00 0.00 C ATOM 1492 CD GLU A 103 6.094 8.141 -11.183 1.00 0.00 C ATOM 1493 OE1 GLU A 103 7.331 7.973 -11.172 1.00 0.00 O ATOM 1494 OE2 GLU A 103 5.513 8.901 -11.987 1.00 0.00 O ATOM 0 H GLU A 103 8.236 6.920 -9.362 1.00 0.00 H new ATOM 0 HA GLU A 103 5.922 6.814 -7.676 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.680 5.812 -10.427 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.175 5.304 -9.687 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.285 7.152 -10.610 1.00 0.00 H new ATOM 0 HG3 GLU A 103 5.067 8.029 -9.309 1.00 0.00 H new ATOM 1501 N GLN A 104 7.868 4.215 -7.875 1.00 0.00 N ATOM 1502 CA GLN A 104 8.126 2.886 -7.333 1.00 0.00 C ATOM 1503 C GLN A 104 8.058 2.894 -5.809 1.00 0.00 C ATOM 1504 O GLN A 104 8.046 3.954 -5.184 1.00 0.00 O ATOM 1505 CB GLN A 104 9.498 2.385 -7.791 1.00 0.00 C ATOM 1506 CG GLN A 104 9.515 1.882 -9.224 1.00 0.00 C ATOM 1507 CD GLN A 104 10.919 1.762 -9.783 1.00 0.00 C ATOM 1508 OE1 GLN A 104 11.790 1.140 -9.174 1.00 0.00 O ATOM 1509 NE2 GLN A 104 11.146 2.359 -10.947 1.00 0.00 N ATOM 0 H GLN A 104 8.651 4.621 -8.388 1.00 0.00 H new ATOM 0 HA GLN A 104 7.355 2.213 -7.708 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.223 3.193 -7.690 1.00 0.00 H new ATOM 0 HB3 GLN A 104 9.822 1.582 -7.129 1.00 0.00 H new ATOM 0 HG2 GLN A 104 9.025 0.909 -9.270 1.00 0.00 H new ATOM 0 HG3 GLN A 104 8.935 2.560 -9.850 1.00 0.00 H new ATOM 0 HE21 GLN A 104 10.394 2.864 -11.417 1.00 0.00 H new ATOM 0 HE22 GLN A 104 12.072 2.313 -11.372 1.00 0.00 H new ATOM 1518 N TRP A 105 8.015 1.704 -5.219 1.00 0.00 N ATOM 1519 CA TRP A 105 7.950 1.569 -3.769 1.00 0.00 C ATOM 1520 C TRP A 105 8.605 0.268 -3.315 1.00 0.00 C ATOM 1521 O TRP A 105 8.910 -0.602 -4.131 1.00 0.00 O ATOM 1522 CB TRP A 105 6.497 1.614 -3.295 1.00 0.00 C ATOM 1523 CG TRP A 105 5.792 2.884 -3.662 1.00 0.00 C ATOM 1524 CD1 TRP A 105 4.990 3.093 -4.747 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.826 4.123 -2.943 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.524 4.386 -4.748 1.00 0.00 N ATOM 1527 CE2 TRP A 105 5.022 5.038 -3.650 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.457 4.548 -1.770 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 4.834 6.350 -3.223 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.269 5.851 -1.347 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.463 6.738 -2.072 1.00 0.00 C ATOM 0 H TRP A 105 8.024 0.818 -5.724 1.00 0.00 H new ATOM 0 HA TRP A 105 8.494 2.404 -3.327 1.00 0.00 H new ATOM 0 HB2 TRP A 105 5.956 0.770 -3.723 1.00 0.00 H new ATOM 0 HB3 TRP A 105 6.472 1.493 -2.212 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.756 2.350 -5.495 1.00 0.00 H new ATOM 0 HE1 TRP A 105 3.908 4.794 -5.451 1.00 0.00 H new ATOM 0 HE3 TRP A 105 7.080 3.871 -1.205 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.214 7.036 -3.780 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.752 6.190 -0.442 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.336 7.749 -1.715 1.00 0.00 H new ATOM 1542 N GLU A 106 8.819 0.141 -2.010 1.00 0.00 N ATOM 1543 CA GLU A 106 9.439 -1.056 -1.451 1.00 0.00 C ATOM 1544 C GLU A 106 8.839 -1.397 -0.089 1.00 0.00 C ATOM 1545 O GLU A 106 9.282 -0.883 0.939 1.00 0.00 O ATOM 1546 CB GLU A 106 10.950 -0.856 -1.319 1.00 0.00 C ATOM 1547 CG GLU A 106 11.738 -2.157 -1.338 1.00 0.00 C ATOM 1548 CD GLU A 106 12.938 -2.124 -0.412 1.00 0.00 C ATOM 1549 OE1 GLU A 106 13.853 -1.309 -0.656 1.00 0.00 O ATOM 1550 OE2 GLU A 106 12.961 -2.912 0.556 1.00 0.00 O ATOM 0 H GLU A 106 8.573 0.851 -1.320 1.00 0.00 H new ATOM 0 HA GLU A 106 9.245 -1.886 -2.130 1.00 0.00 H new ATOM 0 HB2 GLU A 106 11.297 -0.219 -2.132 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.159 -0.328 -0.389 1.00 0.00 H new ATOM 0 HG2 GLU A 106 11.083 -2.979 -1.049 1.00 0.00 H new ATOM 0 HG3 GLU A 106 12.074 -2.360 -2.355 1.00 0.00 H new ATOM 1557 N PRO A 107 7.818 -2.273 -0.059 1.00 0.00 N ATOM 1558 CA PRO A 107 7.163 -2.677 1.188 1.00 0.00 C ATOM 1559 C PRO A 107 8.071 -3.533 2.066 1.00 0.00 C ATOM 1560 O PRO A 107 8.899 -4.292 1.564 1.00 0.00 O ATOM 1561 CB PRO A 107 5.958 -3.492 0.712 1.00 0.00 C ATOM 1562 CG PRO A 107 6.351 -3.999 -0.632 1.00 0.00 C ATOM 1563 CD PRO A 107 7.225 -2.936 -1.236 1.00 0.00 C ATOM 0 HA PRO A 107 6.895 -1.818 1.804 1.00 0.00 H new ATOM 0 HB2 PRO A 107 5.739 -4.312 1.396 1.00 0.00 H new ATOM 0 HB3 PRO A 107 5.061 -2.876 0.656 1.00 0.00 H new ATOM 0 HG2 PRO A 107 6.886 -4.945 -0.551 1.00 0.00 H new ATOM 0 HG3 PRO A 107 5.473 -4.182 -1.252 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.990 -3.365 -1.884 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.648 -2.238 -1.843 1.00 0.00 H new ATOM 1571 N VAL A 108 7.910 -3.405 3.378 1.00 0.00 N ATOM 1572 CA VAL A 108 8.716 -4.166 4.325 1.00 0.00 C ATOM 1573 C VAL A 108 7.845 -4.801 5.404 1.00 0.00 C ATOM 1574 O VAL A 108 6.793 -4.270 5.760 1.00 0.00 O ATOM 1575 CB VAL A 108 9.779 -3.278 4.998 1.00 0.00 C ATOM 1576 CG1 VAL A 108 10.741 -4.124 5.819 1.00 0.00 C ATOM 1577 CG2 VAL A 108 10.530 -2.461 3.959 1.00 0.00 C ATOM 0 H VAL A 108 7.228 -2.781 3.810 1.00 0.00 H new ATOM 0 HA VAL A 108 9.215 -4.951 3.756 1.00 0.00 H new ATOM 0 HB VAL A 108 9.273 -2.587 5.672 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.485 -3.479 6.287 1.00 0.00 H new ATOM 0 HG12 VAL A 108 10.188 -4.659 6.591 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.241 -4.841 5.168 1.00 0.00 H new ATOM 0 HG21 VAL A 108 11.277 -1.840 4.454 1.00 0.00 H new ATOM 0 HG22 VAL A 108 11.024 -3.132 3.256 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.828 -1.824 3.420 1.00 0.00 H new ATOM 1587 N PHE A 109 8.291 -5.943 5.920 1.00 0.00 N ATOM 1588 CA PHE A 109 7.554 -6.652 6.960 1.00 0.00 C ATOM 1589 C PHE A 109 8.455 -6.950 8.154 1.00 0.00 C ATOM 1590 O PHE A 109 9.617 -7.319 7.990 1.00 0.00 O ATOM 1591 CB PHE A 109 6.974 -7.955 6.406 1.00 0.00 C ATOM 1592 CG PHE A 109 5.860 -7.745 5.421 1.00 0.00 C ATOM 1593 CD1 PHE A 109 6.130 -7.590 4.070 1.00 0.00 C ATOM 1594 CD2 PHE A 109 4.541 -7.704 5.846 1.00 0.00 C ATOM 1595 CE1 PHE A 109 5.106 -7.397 3.163 1.00 0.00 C ATOM 1596 CE2 PHE A 109 3.513 -7.512 4.943 1.00 0.00 C ATOM 1597 CZ PHE A 109 3.796 -7.358 3.599 1.00 0.00 C ATOM 0 H PHE A 109 9.159 -6.397 5.635 1.00 0.00 H new ATOM 0 HA PHE A 109 6.737 -6.013 7.293 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.771 -8.522 5.925 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.606 -8.561 7.234 1.00 0.00 H new ATOM 0 HD1 PHE A 109 7.152 -7.620 3.723 1.00 0.00 H new ATOM 0 HD2 PHE A 109 4.314 -7.824 6.895 1.00 0.00 H new ATOM 0 HE1 PHE A 109 5.330 -7.277 2.113 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.490 -7.482 5.287 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.994 -7.207 2.891 1.00 0.00 H new ATOM 1607 N GLN A 110 7.910 -6.786 9.356 1.00 0.00 N ATOM 1608 CA GLN A 110 8.668 -7.038 10.577 1.00 0.00 C ATOM 1609 C GLN A 110 7.751 -7.503 11.704 1.00 0.00 C ATOM 1610 O GLN A 110 7.023 -6.706 12.295 1.00 0.00 O ATOM 1611 CB GLN A 110 9.420 -5.775 11.002 1.00 0.00 C ATOM 1612 CG GLN A 110 10.839 -6.043 11.477 1.00 0.00 C ATOM 1613 CD GLN A 110 11.472 -4.832 12.133 1.00 0.00 C ATOM 1614 OE1 GLN A 110 12.048 -4.929 13.217 1.00 0.00 O ATOM 1615 NE2 GLN A 110 11.368 -3.682 11.479 1.00 0.00 N ATOM 0 H GLN A 110 6.949 -6.481 9.510 1.00 0.00 H new ATOM 0 HA GLN A 110 9.387 -7.831 10.372 1.00 0.00 H new ATOM 0 HB2 GLN A 110 9.452 -5.081 10.162 1.00 0.00 H new ATOM 0 HB3 GLN A 110 8.865 -5.283 11.801 1.00 0.00 H new ATOM 0 HG2 GLN A 110 10.831 -6.872 12.184 1.00 0.00 H new ATOM 0 HG3 GLN A 110 11.450 -6.353 10.629 1.00 0.00 H new ATOM 0 HE21 GLN A 110 10.882 -3.647 10.583 1.00 0.00 H new ATOM 0 HE22 GLN A 110 11.774 -2.833 11.872 1.00 0.00 H new ATOM 1624 N ASP A 111 7.794 -8.799 11.998 1.00 0.00 N ATOM 1625 CA ASP A 111 6.969 -9.372 13.055 1.00 0.00 C ATOM 1626 C ASP A 111 5.487 -9.125 12.790 1.00 0.00 C ATOM 1627 O ASP A 111 4.732 -8.778 13.698 1.00 0.00 O ATOM 1628 CB ASP A 111 7.363 -8.783 14.411 1.00 0.00 C ATOM 1629 CG ASP A 111 8.709 -9.289 14.894 1.00 0.00 C ATOM 1630 OD1 ASP A 111 9.729 -8.976 14.245 1.00 0.00 O ATOM 1631 OD2 ASP A 111 8.742 -10.001 15.921 1.00 0.00 O ATOM 0 H ASP A 111 8.392 -9.472 11.519 1.00 0.00 H new ATOM 0 HA ASP A 111 7.139 -10.449 13.069 1.00 0.00 H new ATOM 0 HB2 ASP A 111 7.392 -7.696 14.337 1.00 0.00 H new ATOM 0 HB3 ASP A 111 6.599 -9.032 15.148 1.00 0.00 H new ATOM 1636 N GLY A 112 5.078 -9.306 11.539 1.00 0.00 N ATOM 1637 CA GLY A 112 3.687 -9.099 11.177 1.00 0.00 C ATOM 1638 C GLY A 112 3.423 -7.694 10.671 1.00 0.00 C ATOM 1639 O GLY A 112 2.730 -7.508 9.671 1.00 0.00 O ATOM 0 H GLY A 112 5.684 -9.592 10.770 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.404 -9.818 10.408 1.00 0.00 H new ATOM 0 HA3 GLY A 112 3.056 -9.294 12.044 1.00 0.00 H new ATOM 1643 N LYS A 113 3.977 -6.704 11.363 1.00 0.00 N ATOM 1644 CA LYS A 113 3.797 -5.308 10.978 1.00 0.00 C ATOM 1645 C LYS A 113 4.306 -5.065 9.561 1.00 0.00 C ATOM 1646 O LYS A 113 4.913 -5.945 8.950 1.00 0.00 O ATOM 1647 CB LYS A 113 4.525 -4.388 11.959 1.00 0.00 C ATOM 1648 CG LYS A 113 3.904 -4.365 13.346 1.00 0.00 C ATOM 1649 CD LYS A 113 3.949 -2.973 13.955 1.00 0.00 C ATOM 1650 CE LYS A 113 4.236 -3.025 15.447 1.00 0.00 C ATOM 1651 NZ LYS A 113 4.687 -1.707 15.972 1.00 0.00 N ATOM 0 H LYS A 113 4.554 -6.842 12.193 1.00 0.00 H new ATOM 0 HA LYS A 113 2.731 -5.084 11.005 1.00 0.00 H new ATOM 0 HB2 LYS A 113 5.564 -4.707 12.040 1.00 0.00 H new ATOM 0 HB3 LYS A 113 4.533 -3.375 11.557 1.00 0.00 H new ATOM 0 HG2 LYS A 113 2.870 -4.704 13.288 1.00 0.00 H new ATOM 0 HG3 LYS A 113 4.433 -5.064 13.994 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.717 -2.382 13.456 1.00 0.00 H new ATOM 0 HD3 LYS A 113 2.998 -2.469 13.784 1.00 0.00 H new ATOM 0 HE2 LYS A 113 3.338 -3.339 15.979 1.00 0.00 H new ATOM 0 HE3 LYS A 113 5.002 -3.775 15.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 4.533 -1.672 17.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 5.699 -1.580 15.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 4.144 -0.947 15.515 1.00 0.00 H new ATOM 1665 N MET A 114 4.055 -3.867 9.044 1.00 0.00 N ATOM 1666 CA MET A 114 4.489 -3.511 7.698 1.00 0.00 C ATOM 1667 C MET A 114 4.654 -2.001 7.561 1.00 0.00 C ATOM 1668 O MET A 114 3.924 -1.226 8.178 1.00 0.00 O ATOM 1669 CB MET A 114 3.483 -4.021 6.665 1.00 0.00 C ATOM 1670 CG MET A 114 2.039 -3.692 7.005 1.00 0.00 C ATOM 1671 SD MET A 114 0.924 -5.082 6.733 1.00 0.00 S ATOM 1672 CE MET A 114 0.451 -5.472 8.416 1.00 0.00 C ATOM 0 H MET A 114 3.554 -3.127 9.536 1.00 0.00 H new ATOM 0 HA MET A 114 5.456 -3.982 7.518 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.725 -3.592 5.693 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.588 -5.102 6.572 1.00 0.00 H new ATOM 0 HG2 MET A 114 1.978 -3.381 8.048 1.00 0.00 H new ATOM 0 HG3 MET A 114 1.712 -2.846 6.401 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.100 -6.503 8.466 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.312 -5.349 9.074 1.00 0.00 H new ATOM 0 HE3 MET A 114 -0.347 -4.801 8.734 1.00 0.00 H new ATOM 1682 N ALA A 115 5.621 -1.589 6.745 1.00 0.00 N ATOM 1683 CA ALA A 115 5.884 -0.173 6.524 1.00 0.00 C ATOM 1684 C ALA A 115 6.275 0.092 5.075 1.00 0.00 C ATOM 1685 O ALA A 115 7.219 -0.504 4.558 1.00 0.00 O ATOM 1686 CB ALA A 115 6.976 0.314 7.466 1.00 0.00 C ATOM 0 H ALA A 115 6.235 -2.217 6.226 1.00 0.00 H new ATOM 0 HA ALA A 115 4.968 0.379 6.732 1.00 0.00 H new ATOM 0 HB1 ALA A 115 7.162 1.373 7.290 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.658 0.168 8.498 1.00 0.00 H new ATOM 0 HB3 ALA A 115 7.891 -0.250 7.285 1.00 0.00 H new ATOM 1692 N LEU A 116 5.543 0.991 4.424 1.00 0.00 N ATOM 1693 CA LEU A 116 5.814 1.335 3.033 1.00 0.00 C ATOM 1694 C LEU A 116 7.030 2.249 2.924 1.00 0.00 C ATOM 1695 O LEU A 116 6.955 3.438 3.237 1.00 0.00 O ATOM 1696 CB LEU A 116 4.595 2.012 2.406 1.00 0.00 C ATOM 1697 CG LEU A 116 4.717 2.312 0.912 1.00 0.00 C ATOM 1698 CD1 LEU A 116 4.990 1.034 0.132 1.00 0.00 C ATOM 1699 CD2 LEU A 116 3.454 2.991 0.401 1.00 0.00 C ATOM 0 H LEU A 116 4.758 1.494 4.838 1.00 0.00 H new ATOM 0 HA LEU A 116 6.027 0.413 2.493 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.724 1.375 2.563 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.406 2.947 2.934 1.00 0.00 H new ATOM 0 HG LEU A 116 5.557 2.991 0.763 1.00 0.00 H new ATOM 0 HD11 LEU A 116 5.074 1.267 -0.930 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.921 0.587 0.480 1.00 0.00 H new ATOM 0 HD13 LEU A 116 4.171 0.332 0.286 1.00 0.00 H new ATOM 0 HD21 LEU A 116 3.558 3.198 -0.664 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.598 2.336 0.562 1.00 0.00 H new ATOM 0 HD23 LEU A 116 3.301 3.927 0.939 1.00 0.00 H new ATOM 1711 N LEU A 117 8.149 1.688 2.477 1.00 0.00 N ATOM 1712 CA LEU A 117 9.381 2.454 2.326 1.00 0.00 C ATOM 1713 C LEU A 117 9.448 3.108 0.950 1.00 0.00 C ATOM 1714 O LEU A 117 9.249 2.451 -0.071 1.00 0.00 O ATOM 1715 CB LEU A 117 10.598 1.550 2.534 1.00 0.00 C ATOM 1716 CG LEU A 117 11.953 2.245 2.386 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.472 2.696 3.742 1.00 0.00 C ATOM 1718 CD2 LEU A 117 12.955 1.320 1.711 1.00 0.00 C ATOM 0 H LEU A 117 8.228 0.706 2.213 1.00 0.00 H new ATOM 0 HA LEU A 117 9.387 3.238 3.083 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.539 1.110 3.530 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.548 0.729 1.819 1.00 0.00 H new ATOM 0 HG LEU A 117 11.821 3.126 1.758 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.437 3.188 3.617 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.764 3.394 4.189 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.588 1.830 4.393 1.00 0.00 H new ATOM 0 HD21 LEU A 117 13.913 1.830 1.614 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.083 0.420 2.313 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.588 1.046 0.722 1.00 0.00 H new ATOM 1730 N ALA A 118 9.728 4.407 0.932 1.00 0.00 N ATOM 1731 CA ALA A 118 9.821 5.151 -0.319 1.00 0.00 C ATOM 1732 C ALA A 118 11.095 4.794 -1.077 1.00 0.00 C ATOM 1733 O ALA A 118 12.024 4.218 -0.512 1.00 0.00 O ATOM 1734 CB ALA A 118 9.765 6.647 -0.048 1.00 0.00 C ATOM 0 H ALA A 118 9.894 4.966 1.769 1.00 0.00 H new ATOM 0 HA ALA A 118 8.971 4.874 -0.942 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.835 7.190 -0.990 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.823 6.893 0.443 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.596 6.931 0.598 1.00 0.00 H new ATOM 1740 N SER A 119 11.132 5.143 -2.358 1.00 0.00 N ATOM 1741 CA SER A 119 12.293 4.862 -3.195 1.00 0.00 C ATOM 1742 C SER A 119 13.512 5.661 -2.738 1.00 0.00 C ATOM 1743 O SER A 119 14.641 5.360 -3.127 1.00 0.00 O ATOM 1744 CB SER A 119 11.981 5.181 -4.658 1.00 0.00 C ATOM 1745 OG SER A 119 13.103 4.931 -5.486 1.00 0.00 O ATOM 0 H SER A 119 10.371 5.621 -2.840 1.00 0.00 H new ATOM 0 HA SER A 119 12.525 3.801 -3.099 1.00 0.00 H new ATOM 0 HB2 SER A 119 11.137 4.578 -4.993 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.683 6.225 -4.750 1.00 0.00 H new ATOM 0 HG SER A 119 12.838 5.004 -6.427 1.00 0.00 H new ATOM 1751 N ASN A 120 13.281 6.680 -1.913 1.00 0.00 N ATOM 1752 CA ASN A 120 14.367 7.516 -1.411 1.00 0.00 C ATOM 1753 C ASN A 120 14.832 7.048 -0.035 1.00 0.00 C ATOM 1754 O ASN A 120 15.358 7.835 0.752 1.00 0.00 O ATOM 1755 CB ASN A 120 13.920 8.978 -1.340 1.00 0.00 C ATOM 1756 CG ASN A 120 12.588 9.142 -0.633 1.00 0.00 C ATOM 1757 OD1 ASN A 120 11.579 8.569 -1.044 1.00 0.00 O ATOM 1758 ND2 ASN A 120 12.580 9.929 0.436 1.00 0.00 N ATOM 0 H ASN A 120 12.354 6.945 -1.579 1.00 0.00 H new ATOM 0 HA ASN A 120 15.205 7.429 -2.103 1.00 0.00 H new ATOM 0 HB2 ASN A 120 14.679 9.562 -0.819 1.00 0.00 H new ATOM 0 HB3 ASN A 120 13.844 9.381 -2.350 1.00 0.00 H new ATOM 0 HD21 ASN A 120 11.713 10.079 0.953 1.00 0.00 H new ATOM 0 HD22 ASN A 120 13.441 10.384 0.741 1.00 0.00 H new ATOM 1765 N SER A 121 14.639 5.764 0.251 1.00 0.00 N ATOM 1766 CA SER A 121 15.042 5.194 1.532 1.00 0.00 C ATOM 1767 C SER A 121 14.408 5.954 2.694 1.00 0.00 C ATOM 1768 O SER A 121 15.074 6.269 3.682 1.00 0.00 O ATOM 1769 CB SER A 121 16.566 5.215 1.664 1.00 0.00 C ATOM 1770 OG SER A 121 17.027 6.492 2.068 1.00 0.00 O ATOM 0 H SER A 121 14.205 5.098 -0.388 1.00 0.00 H new ATOM 0 HA SER A 121 14.694 4.162 1.567 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.881 4.465 2.390 1.00 0.00 H new ATOM 0 HB3 SER A 121 17.020 4.946 0.710 1.00 0.00 H new ATOM 0 HG SER A 121 16.399 7.179 1.761 1.00 0.00 H new ATOM 1776 N CYS A 122 13.118 6.246 2.571 1.00 0.00 N ATOM 1777 CA CYS A 122 12.394 6.968 3.610 1.00 0.00 C ATOM 1778 C CYS A 122 11.015 6.360 3.838 1.00 0.00 C ATOM 1779 O CYS A 122 10.283 6.082 2.887 1.00 0.00 O ATOM 1780 CB CYS A 122 12.257 8.445 3.235 1.00 0.00 C ATOM 1781 SG CYS A 122 13.829 9.335 3.151 1.00 0.00 S ATOM 0 H CYS A 122 12.552 5.993 1.761 1.00 0.00 H new ATOM 0 HA CYS A 122 12.964 6.886 4.536 1.00 0.00 H new ATOM 0 HB2 CYS A 122 11.758 8.519 2.269 1.00 0.00 H new ATOM 0 HB3 CYS A 122 11.613 8.936 3.964 1.00 0.00 H new ATOM 0 HG CYS A 122 14.574 8.813 2.222 1.00 0.00 H new ATOM 1787 N PHE A 123 10.666 6.154 5.104 1.00 0.00 N ATOM 1788 CA PHE A 123 9.374 5.578 5.457 1.00 0.00 C ATOM 1789 C PHE A 123 8.281 6.643 5.446 1.00 0.00 C ATOM 1790 O PHE A 123 8.376 7.649 6.149 1.00 0.00 O ATOM 1791 CB PHE A 123 9.444 4.917 6.834 1.00 0.00 C ATOM 1792 CG PHE A 123 10.003 3.523 6.804 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.303 2.495 6.194 1.00 0.00 C ATOM 1794 CD2 PHE A 123 11.229 3.241 7.387 1.00 0.00 C ATOM 1795 CE1 PHE A 123 9.815 1.212 6.165 1.00 0.00 C ATOM 1796 CE2 PHE A 123 11.745 1.960 7.361 1.00 0.00 C ATOM 1797 CZ PHE A 123 11.038 0.944 6.749 1.00 0.00 C ATOM 0 H PHE A 123 11.260 6.378 5.902 1.00 0.00 H new ATOM 0 HA PHE A 123 9.127 4.822 4.712 1.00 0.00 H new ATOM 0 HB2 PHE A 123 10.058 5.532 7.492 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.444 4.889 7.266 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.346 2.699 5.736 1.00 0.00 H new ATOM 0 HD2 PHE A 123 11.787 4.032 7.867 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.260 0.419 5.686 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.701 1.753 7.819 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.440 -0.058 6.727 1.00 0.00 H new ATOM 1807 N ILE A 124 7.247 6.415 4.643 1.00 0.00 N ATOM 1808 CA ILE A 124 6.138 7.356 4.541 1.00 0.00 C ATOM 1809 C ILE A 124 5.427 7.514 5.881 1.00 0.00 C ATOM 1810 O ILE A 124 5.537 6.658 6.759 1.00 0.00 O ATOM 1811 CB ILE A 124 5.114 6.905 3.481 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.681 5.459 3.737 1.00 0.00 C ATOM 1813 CG2 ILE A 124 5.699 7.051 2.085 1.00 0.00 C ATOM 1814 CD1 ILE A 124 3.181 5.263 3.706 1.00 0.00 C ATOM 0 H ILE A 124 7.154 5.587 4.054 1.00 0.00 H new ATOM 0 HA ILE A 124 6.563 8.314 4.242 1.00 0.00 H new ATOM 0 HB ILE A 124 4.234 7.544 3.553 1.00 0.00 H new ATOM 0 HG12 ILE A 124 5.139 4.813 2.988 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.061 5.141 4.708 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.964 6.729 1.347 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.959 8.094 1.907 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.594 6.435 1.999 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.947 4.215 3.895 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.717 5.883 4.473 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.797 5.550 2.727 1.00 0.00 H new ATOM 1826 N ARG A 125 4.696 8.614 6.031 1.00 0.00 N ATOM 1827 CA ARG A 125 3.967 8.885 7.264 1.00 0.00 C ATOM 1828 C ARG A 125 3.046 10.090 7.099 1.00 0.00 C ATOM 1829 O ARG A 125 3.065 10.760 6.065 1.00 0.00 O ATOM 1830 CB ARG A 125 4.942 9.129 8.416 1.00 0.00 C ATOM 1831 CG ARG A 125 5.894 10.289 8.172 1.00 0.00 C ATOM 1832 CD ARG A 125 5.932 11.242 9.357 1.00 0.00 C ATOM 1833 NE ARG A 125 6.897 12.322 9.161 1.00 0.00 N ATOM 1834 CZ ARG A 125 6.882 13.463 9.846 1.00 0.00 C ATOM 1835 NH1 ARG A 125 5.955 13.677 10.772 1.00 0.00 N ATOM 1836 NH2 ARG A 125 7.796 14.392 9.605 1.00 0.00 N ATOM 0 H ARG A 125 4.593 9.332 5.314 1.00 0.00 H new ATOM 0 HA ARG A 125 3.356 8.012 7.493 1.00 0.00 H new ATOM 0 HB2 ARG A 125 4.375 9.321 9.327 1.00 0.00 H new ATOM 0 HB3 ARG A 125 5.523 8.223 8.587 1.00 0.00 H new ATOM 0 HG2 ARG A 125 6.896 9.904 7.982 1.00 0.00 H new ATOM 0 HG3 ARG A 125 5.586 10.831 7.278 1.00 0.00 H new ATOM 0 HD2 ARG A 125 4.940 11.666 9.513 1.00 0.00 H new ATOM 0 HD3 ARG A 125 6.187 10.687 10.260 1.00 0.00 H new ATOM 0 HE ARG A 125 7.625 12.194 8.458 1.00 0.00 H new ATOM 0 HH11 ARG A 125 5.250 12.965 10.961 1.00 0.00 H new ATOM 0 HH12 ARG A 125 5.948 14.553 11.294 1.00 0.00 H new ATOM 0 HH21 ARG A 125 8.510 14.232 8.895 1.00 0.00 H new ATOM 0 HH22 ARG A 125 7.785 15.267 10.130 1.00 0.00 H new ATOM 1850 N CYS A 126 2.244 10.359 8.122 1.00 0.00 N ATOM 1851 CA CYS A 126 1.316 11.484 8.090 1.00 0.00 C ATOM 1852 C CYS A 126 1.684 12.524 9.145 1.00 0.00 C ATOM 1853 O CYS A 126 2.479 12.254 10.045 1.00 0.00 O ATOM 1854 CB CYS A 126 -0.117 10.998 8.316 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.320 9.959 9.783 1.00 0.00 S ATOM 0 H CYS A 126 2.217 9.814 8.984 1.00 0.00 H new ATOM 0 HA CYS A 126 1.384 11.950 7.107 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.774 11.864 8.403 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.442 10.438 7.439 1.00 0.00 H new ATOM 0 HG CYS A 126 -1.565 9.599 9.891 1.00 0.00 H new ATOM 1861 N ASN A 127 1.101 13.712 9.026 1.00 0.00 N ATOM 1862 CA ASN A 127 1.368 14.792 9.969 1.00 0.00 C ATOM 1863 C ASN A 127 0.070 15.331 10.560 1.00 0.00 C ATOM 1864 O ASN A 127 -0.987 15.255 9.934 1.00 0.00 O ATOM 1865 CB ASN A 127 2.136 15.922 9.279 1.00 0.00 C ATOM 1866 CG ASN A 127 3.638 15.759 9.404 1.00 0.00 C ATOM 1867 OD1 ASN A 127 4.168 15.591 10.503 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.335 15.808 8.274 1.00 0.00 N ATOM 0 H ASN A 127 0.441 13.951 8.286 1.00 0.00 H new ATOM 0 HA ASN A 127 1.976 14.391 10.780 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.863 15.952 8.224 1.00 0.00 H new ATOM 0 HB3 ASN A 127 1.839 16.877 9.713 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.350 15.705 8.296 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.856 15.949 7.385 1.00 0.00 H new ATOM 1875 N GLU A 128 0.158 15.877 11.769 1.00 0.00 N ATOM 1876 CA GLU A 128 -1.011 16.430 12.445 1.00 0.00 C ATOM 1877 C GLU A 128 -1.629 17.559 11.627 1.00 0.00 C ATOM 1878 O GLU A 128 -2.841 17.773 11.663 1.00 0.00 O ATOM 1879 CB GLU A 128 -0.627 16.941 13.835 1.00 0.00 C ATOM 1880 CG GLU A 128 -0.799 15.903 14.933 1.00 0.00 C ATOM 1881 CD GLU A 128 -0.530 16.466 16.314 1.00 0.00 C ATOM 1882 OE1 GLU A 128 -1.070 17.547 16.630 1.00 0.00 O ATOM 1883 OE2 GLU A 128 0.223 15.828 17.079 1.00 0.00 O ATOM 0 H GLU A 128 1.026 15.948 12.300 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.750 15.636 12.549 1.00 0.00 H new ATOM 0 HB2 GLU A 128 0.412 17.271 13.818 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.235 17.814 14.073 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -1.814 15.507 14.898 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -0.124 15.068 14.747 1.00 0.00 H new ATOM 1890 N ALA A 129 -0.789 18.278 10.891 1.00 0.00 N ATOM 1891 CA ALA A 129 -1.252 19.386 10.065 1.00 0.00 C ATOM 1892 C ALA A 129 -1.987 18.879 8.829 1.00 0.00 C ATOM 1893 O ALA A 129 -3.030 19.414 8.451 1.00 0.00 O ATOM 1894 CB ALA A 129 -0.080 20.268 9.659 1.00 0.00 C ATOM 0 H ALA A 129 0.217 18.113 10.850 1.00 0.00 H new ATOM 0 HA ALA A 129 -1.951 19.979 10.655 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -0.441 21.091 9.042 1.00 0.00 H new ATOM 0 HB2 ALA A 129 0.401 20.667 10.552 1.00 0.00 H new ATOM 0 HB3 ALA A 129 0.640 19.678 9.092 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.436 17.845 8.202 1.00 0.00 N ATOM 1901 CA GLY A 130 -2.053 17.283 7.015 1.00 0.00 C ATOM 1902 C GLY A 130 -1.085 17.177 5.853 1.00 0.00 C ATOM 1903 O GLY A 130 -1.423 17.524 4.721 1.00 0.00 O ATOM 0 H GLY A 130 -0.573 17.386 8.495 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.446 16.293 7.248 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -2.901 17.902 6.722 1.00 0.00 H new ATOM 1907 N ASP A 131 0.123 16.698 6.133 1.00 0.00 N ATOM 1908 CA ASP A 131 1.144 16.549 5.103 1.00 0.00 C ATOM 1909 C ASP A 131 1.757 15.153 5.142 1.00 0.00 C ATOM 1910 O ASP A 131 2.357 14.755 6.140 1.00 0.00 O ATOM 1911 CB ASP A 131 2.237 17.604 5.283 1.00 0.00 C ATOM 1912 CG ASP A 131 1.761 18.996 4.919 1.00 0.00 C ATOM 1913 OD1 ASP A 131 0.991 19.125 3.945 1.00 0.00 O ATOM 1914 OD2 ASP A 131 2.160 19.959 5.609 1.00 0.00 O ATOM 0 H ASP A 131 0.418 16.407 7.065 1.00 0.00 H new ATOM 0 HA ASP A 131 0.669 16.690 4.132 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.577 17.598 6.319 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.096 17.343 4.664 1.00 0.00 H new ATOM 1919 N ILE A 132 1.602 14.414 4.048 1.00 0.00 N ATOM 1920 CA ILE A 132 2.141 13.062 3.956 1.00 0.00 C ATOM 1921 C ILE A 132 3.540 13.069 3.351 1.00 0.00 C ATOM 1922 O ILE A 132 3.700 13.143 2.132 1.00 0.00 O ATOM 1923 CB ILE A 132 1.232 12.151 3.110 1.00 0.00 C ATOM 1924 CG1 ILE A 132 -0.222 12.278 3.565 1.00 0.00 C ATOM 1925 CG2 ILE A 132 1.699 10.706 3.201 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -0.431 11.928 5.022 1.00 0.00 C ATOM 0 H ILE A 132 1.108 14.729 3.213 1.00 0.00 H new ATOM 0 HA ILE A 132 2.189 12.671 4.972 1.00 0.00 H new ATOM 0 HB ILE A 132 1.294 12.467 2.069 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -0.560 13.300 3.393 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.845 11.628 2.950 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.047 10.074 2.598 1.00 0.00 H new ATOM 0 HG22 ILE A 132 2.721 10.630 2.831 1.00 0.00 H new ATOM 0 HG23 ILE A 132 1.664 10.377 4.240 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -1.485 12.040 5.276 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -0.124 10.897 5.196 1.00 0.00 H new ATOM 0 HD13 ILE A 132 0.165 12.594 5.645 1.00 0.00 H new ATOM 1938 N GLU A 133 4.552 12.992 4.210 1.00 0.00 N ATOM 1939 CA GLU A 133 5.939 12.991 3.759 1.00 0.00 C ATOM 1940 C GLU A 133 6.672 11.750 4.257 1.00 0.00 C ATOM 1941 O GLU A 133 6.129 10.967 5.037 1.00 0.00 O ATOM 1942 CB GLU A 133 6.656 14.251 4.246 1.00 0.00 C ATOM 1943 CG GLU A 133 6.487 14.509 5.734 1.00 0.00 C ATOM 1944 CD GLU A 133 7.257 15.729 6.204 1.00 0.00 C ATOM 1945 OE1 GLU A 133 8.320 16.022 5.618 1.00 0.00 O ATOM 1946 OE2 GLU A 133 6.796 16.390 7.159 1.00 0.00 O ATOM 0 H GLU A 133 4.437 12.930 5.222 1.00 0.00 H new ATOM 0 HA GLU A 133 5.941 12.979 2.669 1.00 0.00 H new ATOM 0 HB2 GLU A 133 7.719 14.165 4.019 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.280 15.111 3.691 1.00 0.00 H new ATOM 0 HG2 GLU A 133 5.429 14.643 5.958 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.823 13.635 6.291 1.00 0.00 H new ATOM 1953 N ALA A 134 7.908 11.576 3.801 1.00 0.00 N ATOM 1954 CA ALA A 134 8.716 10.430 4.200 1.00 0.00 C ATOM 1955 C ALA A 134 9.656 10.794 5.344 1.00 0.00 C ATOM 1956 O ALA A 134 10.361 11.800 5.286 1.00 0.00 O ATOM 1957 CB ALA A 134 9.506 9.903 3.012 1.00 0.00 C ATOM 0 H ALA A 134 8.372 12.214 3.155 1.00 0.00 H new ATOM 0 HA ALA A 134 8.044 9.647 4.552 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.105 9.047 3.324 1.00 0.00 H new ATOM 0 HB2 ALA A 134 8.818 9.596 2.225 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.162 10.687 2.635 1.00 0.00 H new ATOM 1963 N LYS A 135 9.661 9.965 6.384 1.00 0.00 N ATOM 1964 CA LYS A 135 10.515 10.200 7.543 1.00 0.00 C ATOM 1965 C LYS A 135 11.850 9.476 7.388 1.00 0.00 C ATOM 1966 O LYS A 135 12.091 8.804 6.385 1.00 0.00 O ATOM 1967 CB LYS A 135 9.813 9.737 8.821 1.00 0.00 C ATOM 1968 CG LYS A 135 9.884 10.747 9.954 1.00 0.00 C ATOM 1969 CD LYS A 135 9.991 10.061 11.306 1.00 0.00 C ATOM 1970 CE LYS A 135 10.392 11.040 12.399 1.00 0.00 C ATOM 1971 NZ LYS A 135 9.225 11.470 13.215 1.00 0.00 N ATOM 0 H LYS A 135 9.084 9.126 6.448 1.00 0.00 H new ATOM 0 HA LYS A 135 10.709 11.270 7.612 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.767 9.529 8.596 1.00 0.00 H new ATOM 0 HB3 LYS A 135 10.260 8.800 9.152 1.00 0.00 H new ATOM 0 HG2 LYS A 135 10.744 11.400 9.807 1.00 0.00 H new ATOM 0 HG3 LYS A 135 8.997 11.380 9.935 1.00 0.00 H new ATOM 0 HD2 LYS A 135 9.035 9.603 11.559 1.00 0.00 H new ATOM 0 HD3 LYS A 135 10.724 9.257 11.250 1.00 0.00 H new ATOM 0 HE2 LYS A 135 11.136 10.576 13.046 1.00 0.00 H new ATOM 0 HE3 LYS A 135 10.862 11.914 11.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 9.541 12.136 13.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 8.526 11.936 12.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 8.792 10.639 13.666 1.00 0.00 H new ATOM 1985 N ASN A 136 12.714 9.616 8.389 1.00 0.00 N ATOM 1986 CA ASN A 136 14.023 8.976 8.363 1.00 0.00 C ATOM 1987 C ASN A 136 13.884 7.460 8.247 1.00 0.00 C ATOM 1988 O ASN A 136 12.781 6.921 8.325 1.00 0.00 O ATOM 1989 CB ASN A 136 14.815 9.335 9.623 1.00 0.00 C ATOM 1990 CG ASN A 136 16.186 9.896 9.304 1.00 0.00 C ATOM 1991 OD1 ASN A 136 16.343 11.098 9.087 1.00 0.00 O ATOM 1992 ND2 ASN A 136 17.189 9.027 9.273 1.00 0.00 N ATOM 0 H ASN A 136 12.530 10.167 9.228 1.00 0.00 H new ATOM 0 HA ASN A 136 14.562 9.341 7.489 1.00 0.00 H new ATOM 0 HB2 ASN A 136 14.253 10.065 10.206 1.00 0.00 H new ATOM 0 HB3 ASN A 136 14.925 8.447 10.245 1.00 0.00 H new ATOM 0 HD21 ASN A 136 18.135 9.347 9.063 1.00 0.00 H new ATOM 0 HD22 ASN A 136 17.014 8.039 9.459 1.00 0.00 H new ATOM 1999 N LYS A 137 15.010 6.780 8.060 1.00 0.00 N ATOM 2000 CA LYS A 137 15.013 5.327 7.934 1.00 0.00 C ATOM 2001 C LYS A 137 14.460 4.672 9.196 1.00 0.00 C ATOM 2002 O LYS A 137 13.843 3.609 9.136 1.00 0.00 O ATOM 2003 CB LYS A 137 16.429 4.819 7.660 1.00 0.00 C ATOM 2004 CG LYS A 137 16.941 5.164 6.271 1.00 0.00 C ATOM 2005 CD LYS A 137 18.411 5.548 6.296 1.00 0.00 C ATOM 2006 CE LYS A 137 18.856 6.137 4.967 1.00 0.00 C ATOM 2007 NZ LYS A 137 20.283 5.831 4.673 1.00 0.00 N ATOM 0 H LYS A 137 15.932 7.211 7.992 1.00 0.00 H new ATOM 0 HA LYS A 137 14.371 5.059 7.095 1.00 0.00 H new ATOM 0 HB2 LYS A 137 17.107 5.239 8.403 1.00 0.00 H new ATOM 0 HB3 LYS A 137 16.449 3.737 7.787 1.00 0.00 H new ATOM 0 HG2 LYS A 137 16.798 4.311 5.608 1.00 0.00 H new ATOM 0 HG3 LYS A 137 16.356 5.987 5.861 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.586 6.271 7.092 1.00 0.00 H new ATOM 0 HD3 LYS A 137 19.014 4.669 6.526 1.00 0.00 H new ATOM 0 HE2 LYS A 137 18.228 5.744 4.167 1.00 0.00 H new ATOM 0 HE3 LYS A 137 18.712 7.217 4.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 20.547 6.250 3.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 20.885 6.228 5.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 20.416 4.800 4.632 1.00 0.00 H new ATOM 2021 N THR A 138 14.686 5.315 10.337 1.00 0.00 N ATOM 2022 CA THR A 138 14.210 4.796 11.615 1.00 0.00 C ATOM 2023 C THR A 138 12.691 4.659 11.615 1.00 0.00 C ATOM 2024 O THR A 138 11.969 5.651 11.522 1.00 0.00 O ATOM 2025 CB THR A 138 14.652 5.713 12.756 1.00 0.00 C ATOM 2026 OG1 THR A 138 14.415 7.070 12.430 1.00 0.00 O ATOM 2027 CG2 THR A 138 16.119 5.573 13.103 1.00 0.00 C ATOM 0 H THR A 138 15.196 6.196 10.403 1.00 0.00 H new ATOM 0 HA THR A 138 14.645 3.807 11.763 1.00 0.00 H new ATOM 0 HB THR A 138 14.061 5.406 13.618 1.00 0.00 H new ATOM 0 HG1 THR A 138 13.557 7.149 11.964 1.00 0.00 H new ATOM 0 HG21 THR A 138 16.366 6.251 13.920 1.00 0.00 H new ATOM 0 HG22 THR A 138 16.324 4.547 13.409 1.00 0.00 H new ATOM 0 HG23 THR A 138 16.724 5.820 12.231 1.00 0.00 H new ATOM 2035 N ALA A 139 12.213 3.423 11.721 1.00 0.00 N ATOM 2036 CA ALA A 139 10.781 3.156 11.735 1.00 0.00 C ATOM 2037 C ALA A 139 10.254 3.065 13.163 1.00 0.00 C ATOM 2038 O ALA A 139 10.573 2.128 13.894 1.00 0.00 O ATOM 2039 CB ALA A 139 10.475 1.875 10.974 1.00 0.00 C ATOM 0 H ALA A 139 12.798 2.591 11.798 1.00 0.00 H new ATOM 0 HA ALA A 139 10.277 3.987 11.242 1.00 0.00 H new ATOM 0 HB1 ALA A 139 9.401 1.688 10.993 1.00 0.00 H new ATOM 0 HB2 ALA A 139 10.807 1.977 9.941 1.00 0.00 H new ATOM 0 HB3 ALA A 139 10.997 1.040 11.442 1.00 0.00 H new ATOM 2045 N GLY A 140 9.444 4.043 13.553 1.00 0.00 N ATOM 2046 CA GLY A 140 8.886 4.054 14.892 1.00 0.00 C ATOM 2047 C GLY A 140 7.554 3.334 14.971 1.00 0.00 C ATOM 2048 O GLY A 140 7.012 2.906 13.953 1.00 0.00 O ATOM 0 H GLY A 140 9.164 4.828 12.966 1.00 0.00 H new ATOM 0 HA2 GLY A 140 9.590 3.585 15.580 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.758 5.085 15.221 1.00 0.00 H new ATOM 2052 N GLU A 141 7.027 3.201 16.184 1.00 0.00 N ATOM 2053 CA GLU A 141 5.751 2.528 16.392 1.00 0.00 C ATOM 2054 C GLU A 141 4.633 3.235 15.634 1.00 0.00 C ATOM 2055 O GLU A 141 3.689 2.599 15.163 1.00 0.00 O ATOM 2056 CB GLU A 141 5.417 2.474 17.885 1.00 0.00 C ATOM 2057 CG GLU A 141 6.328 1.553 18.679 1.00 0.00 C ATOM 2058 CD GLU A 141 6.286 1.834 20.168 1.00 0.00 C ATOM 2059 OE1 GLU A 141 5.172 1.902 20.729 1.00 0.00 O ATOM 2060 OE2 GLU A 141 7.367 1.988 20.774 1.00 0.00 O ATOM 0 H GLU A 141 7.464 3.550 17.037 1.00 0.00 H new ATOM 0 HA GLU A 141 5.838 1.511 16.009 1.00 0.00 H new ATOM 0 HB2 GLU A 141 5.481 3.480 18.300 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.385 2.144 18.006 1.00 0.00 H new ATOM 0 HG2 GLU A 141 6.037 0.518 18.500 1.00 0.00 H new ATOM 0 HG3 GLU A 141 7.352 1.663 18.321 1.00 0.00 H new ATOM 2067 N GLU A 142 4.745 4.555 15.518 1.00 0.00 N ATOM 2068 CA GLU A 142 3.743 5.348 14.816 1.00 0.00 C ATOM 2069 C GLU A 142 3.897 5.205 13.306 1.00 0.00 C ATOM 2070 O GLU A 142 2.909 5.169 12.571 1.00 0.00 O ATOM 2071 CB GLU A 142 3.858 6.820 15.215 1.00 0.00 C ATOM 2072 CG GLU A 142 3.404 7.102 16.638 1.00 0.00 C ATOM 2073 CD GLU A 142 1.895 7.124 16.776 1.00 0.00 C ATOM 2074 OE1 GLU A 142 1.225 6.321 16.092 1.00 0.00 O ATOM 2075 OE2 GLU A 142 1.383 7.944 17.566 1.00 0.00 O ATOM 0 H GLU A 142 5.519 5.097 15.901 1.00 0.00 H new ATOM 0 HA GLU A 142 2.758 4.977 15.099 1.00 0.00 H new ATOM 0 HB2 GLU A 142 4.895 7.138 15.103 1.00 0.00 H new ATOM 0 HB3 GLU A 142 3.264 7.422 14.527 1.00 0.00 H new ATOM 0 HG2 GLU A 142 3.815 6.343 17.303 1.00 0.00 H new ATOM 0 HG3 GLU A 142 3.808 8.061 16.961 1.00 0.00 H new ATOM 2082 N GLU A 143 5.141 5.124 12.848 1.00 0.00 N ATOM 2083 CA GLU A 143 5.426 4.984 11.424 1.00 0.00 C ATOM 2084 C GLU A 143 4.830 3.693 10.872 1.00 0.00 C ATOM 2085 O GLU A 143 4.473 3.615 9.696 1.00 0.00 O ATOM 2086 CB GLU A 143 6.936 5.007 11.181 1.00 0.00 C ATOM 2087 CG GLU A 143 7.513 6.409 11.070 1.00 0.00 C ATOM 2088 CD GLU A 143 7.766 7.044 12.423 1.00 0.00 C ATOM 2089 OE1 GLU A 143 8.500 6.441 13.233 1.00 0.00 O ATOM 2090 OE2 GLU A 143 7.231 8.145 12.671 1.00 0.00 O ATOM 0 H GLU A 143 5.969 5.153 13.442 1.00 0.00 H new ATOM 0 HA GLU A 143 4.967 5.825 10.903 1.00 0.00 H new ATOM 0 HB2 GLU A 143 7.435 4.481 11.995 1.00 0.00 H new ATOM 0 HB3 GLU A 143 7.157 4.459 10.265 1.00 0.00 H new ATOM 0 HG2 GLU A 143 8.448 6.370 10.511 1.00 0.00 H new ATOM 0 HG3 GLU A 143 6.827 7.036 10.501 1.00 0.00 H new ATOM 2097 N MET A 144 4.725 2.680 11.728 1.00 0.00 N ATOM 2098 CA MET A 144 4.172 1.392 11.324 1.00 0.00 C ATOM 2099 C MET A 144 2.750 1.550 10.797 1.00 0.00 C ATOM 2100 O MET A 144 1.917 2.214 11.415 1.00 0.00 O ATOM 2101 CB MET A 144 4.186 0.416 12.502 1.00 0.00 C ATOM 2102 CG MET A 144 5.583 0.065 12.984 1.00 0.00 C ATOM 2103 SD MET A 144 6.571 -0.751 11.715 1.00 0.00 S ATOM 2104 CE MET A 144 7.515 0.633 11.080 1.00 0.00 C ATOM 0 H MET A 144 5.015 2.727 12.705 1.00 0.00 H new ATOM 0 HA MET A 144 4.794 0.994 10.523 1.00 0.00 H new ATOM 0 HB2 MET A 144 3.624 0.850 13.329 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.670 -0.499 12.211 1.00 0.00 H new ATOM 0 HG2 MET A 144 6.091 0.974 13.306 1.00 0.00 H new ATOM 0 HG3 MET A 144 5.510 -0.585 13.856 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.390 0.262 10.546 1.00 0.00 H new ATOM 0 HE2 MET A 144 6.894 1.215 10.399 1.00 0.00 H new ATOM 0 HE3 MET A 144 7.836 1.265 11.908 1.00 0.00 H new ATOM 2114 N ILE A 145 2.477 0.934 9.651 1.00 0.00 N ATOM 2115 CA ILE A 145 1.155 1.006 9.040 1.00 0.00 C ATOM 2116 C ILE A 145 0.533 -0.380 8.912 1.00 0.00 C ATOM 2117 O ILE A 145 1.137 -1.380 9.299 1.00 0.00 O ATOM 2118 CB ILE A 145 1.215 1.659 7.645 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.221 0.926 6.757 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.579 3.131 7.765 1.00 0.00 C ATOM 2121 CD1 ILE A 145 1.929 1.054 5.278 1.00 0.00 C ATOM 0 H ILE A 145 3.154 0.379 9.127 1.00 0.00 H new ATOM 0 HA ILE A 145 0.537 1.621 9.695 1.00 0.00 H new ATOM 0 HB ILE A 145 0.231 1.585 7.183 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.220 1.314 6.957 1.00 0.00 H new ATOM 0 HG13 ILE A 145 2.230 -0.130 7.027 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.618 3.578 6.772 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.827 3.644 8.365 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.553 3.227 8.244 1.00 0.00 H new ATOM 0 HD11 ILE A 145 2.683 0.509 4.710 1.00 0.00 H new ATOM 0 HD12 ILE A 145 0.944 0.639 5.064 1.00 0.00 H new ATOM 0 HD13 ILE A 145 1.949 2.106 4.993 1.00 0.00 H new ATOM 2133 N LYS A 146 -0.678 -0.432 8.366 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.382 -1.697 8.187 1.00 0.00 C ATOM 2135 C LYS A 146 -2.040 -1.764 6.813 1.00 0.00 C ATOM 2136 O LYS A 146 -3.095 -1.170 6.590 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.436 -1.877 9.281 1.00 0.00 C ATOM 2138 CG LYS A 146 -1.846 -2.082 10.667 1.00 0.00 C ATOM 2139 CD LYS A 146 -2.410 -3.327 11.337 1.00 0.00 C ATOM 2140 CE LYS A 146 -2.069 -3.364 12.818 1.00 0.00 C ATOM 2141 NZ LYS A 146 -0.721 -3.948 13.063 1.00 0.00 N ATOM 0 H LYS A 146 -1.192 0.387 8.040 1.00 0.00 H new ATOM 0 HA LYS A 146 -0.653 -2.504 8.259 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.084 -1.001 9.297 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.063 -2.733 9.032 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -0.762 -2.167 10.593 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -2.055 -1.209 11.285 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -3.492 -3.351 11.211 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -2.012 -4.217 10.848 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -2.106 -2.353 13.224 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -2.820 -3.949 13.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -0.526 -3.955 14.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -0.693 -4.921 12.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -0.001 -3.375 12.578 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.411 -2.490 5.896 1.00 0.00 N ATOM 2156 CA ILE A 147 -1.937 -2.636 4.544 1.00 0.00 C ATOM 2157 C ILE A 147 -2.981 -3.745 4.476 1.00 0.00 C ATOM 2158 O ILE A 147 -2.783 -4.832 5.020 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.814 -2.942 3.533 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.341 -1.953 3.706 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.353 -2.892 2.112 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.638 -2.427 3.087 1.00 0.00 C ATOM 0 H ILE A 147 -0.536 -2.987 6.064 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.402 -1.686 4.283 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.438 -3.947 3.723 1.00 0.00 H new ATOM 0 HG12 ILE A 147 0.062 -0.999 3.260 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.499 -1.773 4.769 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.548 -3.110 1.410 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -2.145 -3.632 1.997 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.752 -1.898 1.909 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.413 -1.677 3.247 1.00 0.00 H new ATOM 0 HD12 ILE A 147 1.940 -3.366 3.550 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.496 -2.579 2.017 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.093 -3.464 3.806 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.169 -4.438 3.667 1.00 0.00 C ATOM 2176 C ARG A 148 -5.606 -4.564 2.211 1.00 0.00 C ATOM 2177 O ARG A 148 -5.814 -3.562 1.527 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.362 -4.038 4.537 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.026 -3.923 6.015 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.163 -3.285 6.797 1.00 0.00 C ATOM 2181 NE ARG A 148 -6.676 -2.496 7.925 1.00 0.00 N ATOM 2182 CZ ARG A 148 -6.135 -3.025 9.022 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -6.010 -4.340 9.141 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -5.718 -2.234 10.001 1.00 0.00 N ATOM 0 H ARG A 148 -4.273 -2.569 3.350 1.00 0.00 H new ATOM 0 HA ARG A 148 -4.794 -5.406 3.999 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.753 -3.083 4.186 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.157 -4.773 4.410 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -5.816 -4.913 6.419 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.120 -3.329 6.138 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -7.746 -2.647 6.133 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -7.834 -4.063 7.162 1.00 0.00 H new ATOM 0 HE ARG A 148 -6.754 -1.481 7.870 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -6.329 -4.953 8.390 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -5.595 -4.739 9.983 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -5.812 -1.222 9.914 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -5.304 -2.637 10.841 1.00 0.00 H new ATOM 2198 N SER A 149 -5.742 -5.800 1.745 1.00 0.00 N ATOM 2199 CA SER A 149 -6.154 -6.058 0.369 1.00 0.00 C ATOM 2200 C SER A 149 -7.648 -6.361 0.296 1.00 0.00 C ATOM 2201 O SER A 149 -8.285 -6.637 1.312 1.00 0.00 O ATOM 2202 CB SER A 149 -5.356 -7.224 -0.215 1.00 0.00 C ATOM 2203 OG SER A 149 -5.713 -7.463 -1.565 1.00 0.00 O ATOM 0 H SER A 149 -5.573 -6.640 2.299 1.00 0.00 H new ATOM 0 HA SER A 149 -5.954 -5.161 -0.218 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.290 -7.007 -0.151 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.534 -8.122 0.376 1.00 0.00 H new ATOM 0 HG SER A 149 -5.187 -8.212 -1.915 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.198 -6.308 -0.913 1.00 0.00 N ATOM 2210 CA CYS A 150 -9.617 -6.577 -1.119 1.00 0.00 C ATOM 2211 C CYS A 150 -9.814 -7.733 -2.095 1.00 0.00 C ATOM 2212 O CYS A 150 -10.795 -7.770 -2.838 1.00 0.00 O ATOM 2213 CB CYS A 150 -10.323 -5.326 -1.643 1.00 0.00 C ATOM 2214 SG CYS A 150 -9.650 -4.695 -3.198 1.00 0.00 S ATOM 0 H CYS A 150 -7.683 -6.082 -1.764 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.052 -6.856 -0.160 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -11.381 -5.550 -1.782 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -10.259 -4.543 -0.888 1.00 0.00 H new ATOM 0 HG CYS A 150 -8.353 -4.655 -3.125 1.00 0.00 H new ATOM 2220 N ALA A 151 -8.876 -8.674 -2.087 1.00 0.00 N ATOM 2221 CA ALA A 151 -8.947 -9.832 -2.972 1.00 0.00 C ATOM 2222 C ALA A 151 -9.887 -10.893 -2.411 1.00 0.00 C ATOM 2223 O ALA A 151 -10.506 -10.699 -1.365 1.00 0.00 O ATOM 2224 CB ALA A 151 -7.559 -10.414 -3.189 1.00 0.00 C ATOM 0 H ALA A 151 -8.058 -8.658 -1.478 1.00 0.00 H new ATOM 0 HA ALA A 151 -9.345 -9.503 -3.932 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -7.626 -11.277 -3.851 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -6.915 -9.660 -3.640 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -7.140 -10.723 -2.231 1.00 0.00 H new