USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=30 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 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 144 MET CE :methyl 172:sc= 0 (180deg=0) USER MOD Set 2.1: A 136 ASN : amide:sc= -0.0251 K(o=0.032,f=-0.77) USER MOD Set 2.2: A 137 LYS NZ :NH3+ 149:sc= 0.0568 (180deg=0) USER MOD Set 3.1: A 65 THR OG1 : rot -170:sc= 0 USER MOD Set 3.2: A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot -130:sc= -0.387 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 ASN : amide:sc= -1.74 K(o=-1.7,f=-5.4!) 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 -168:sc= -2.91! (180deg=-3.76!) USER MOD Single : A 33 LYS NZ :NH3+ 158:sc= -0.148 (180deg=-0.808) USER MOD Single : A 36 TYR OH : rot -37:sc= 0.295 USER MOD Single : A 38 HIS : no HD1:sc= -0.0127 K(o=-0.013,f=-1.1) USER MOD Single : A 42 ASN : amide:sc= -0.123 K(o=-0.12,f=-1.5!) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.212 USER MOD Single : A 51 HIS : no HD1:sc= -0.0134 X(o=-0.013,f=-0.006) USER MOD Single : A 59 SER OG : rot 180:sc= -1.42 USER MOD Single : A 63 GLN : amide:sc= 1.19 K(o=1.2,f=-0.63) USER MOD Single : A 68 LYS NZ :NH3+ -105:sc= -0.0118 (180deg=-0.409) USER MOD Single : A 70 SER OG : rot 180:sc= -0.0603 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot -48:sc= 0.149 USER MOD Single : A 80 TYR OH : rot 31:sc= 0.558 USER MOD Single : A 82 LYS NZ :NH3+ -165:sc= -0.387 (180deg=-0.734) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -0.249 K(o=-0.25,f=-2.5!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= -1.63 K(o=-1.6,f=-3.9!) USER MOD Single : A 110 GLN : amide:sc= -0.0747 K(o=-0.075,f=-1.6!) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 SER OG : rot -21:sc= 0.458 USER MOD Single : A 120 ASN : amide:sc= -0.671 K(o=-0.67,f=-1.2) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 180:sc= -0.79 USER MOD Single : A 126 CYS SG : rot -110:sc= -3.8! USER MOD Single : A 127 ASN : amide:sc= -0.835 K(o=-0.83,f=-3.6!) USER MOD Single : A 135 LYS NZ :NH3+ 142:sc= -0.124 (180deg=-0.772) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0751 USER MOD Single : A 146 LYS NZ :NH3+ -163:sc= -0.202 (180deg=-0.627) USER MOD Single : A 149 SER OG : rot -124:sc= 0.671 USER MOD Single : A 150 CYS SG : rot -120:sc= 0.859 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -7.539 -10.131 10.131 1.00 0.00 N ATOM 88 CA ASP A 9 -8.461 -9.021 10.340 1.00 0.00 C ATOM 89 C ASP A 9 -9.260 -8.732 9.074 1.00 0.00 C ATOM 90 O ASP A 9 -8.713 -8.259 8.078 1.00 0.00 O ATOM 91 CB ASP A 9 -7.695 -7.769 10.772 1.00 0.00 C ATOM 92 CG ASP A 9 -7.583 -7.651 12.280 1.00 0.00 C ATOM 93 OD1 ASP A 9 -7.345 -8.685 12.940 1.00 0.00 O ATOM 94 OD2 ASP A 9 -7.734 -6.526 12.800 1.00 0.00 O ATOM 0 HA ASP A 9 -9.157 -9.303 11.130 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -6.696 -7.789 10.337 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -8.197 -6.885 10.377 1.00 0.00 H new ATOM 99 N ILE A 10 -10.557 -9.019 9.120 1.00 0.00 N ATOM 100 CA ILE A 10 -11.431 -8.789 7.976 1.00 0.00 C ATOM 101 C ILE A 10 -12.584 -7.859 8.344 1.00 0.00 C ATOM 102 O ILE A 10 -13.216 -8.020 9.389 1.00 0.00 O ATOM 103 CB ILE A 10 -12.003 -10.115 7.432 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.832 -9.862 6.171 1.00 0.00 C ATOM 105 CG2 ILE A 10 -12.841 -10.811 8.494 1.00 0.00 C ATOM 106 CD1 ILE A 10 -12.683 -10.944 5.124 1.00 0.00 C ATOM 0 H ILE A 10 -11.025 -9.411 9.937 1.00 0.00 H new ATOM 0 HA ILE A 10 -10.825 -8.320 7.201 1.00 0.00 H new ATOM 0 HB ILE A 10 -11.171 -10.769 7.171 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -13.883 -9.777 6.448 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -12.538 -8.906 5.738 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -13.236 -11.744 8.092 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -12.221 -11.025 9.365 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -13.667 -10.164 8.787 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -13.298 -10.700 4.258 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -11.639 -11.014 4.819 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -13.005 -11.899 5.539 1.00 0.00 H new ATOM 118 N VAL A 11 -12.851 -6.886 7.480 1.00 0.00 N ATOM 119 CA VAL A 11 -13.928 -5.931 7.713 1.00 0.00 C ATOM 120 C VAL A 11 -14.804 -5.777 6.476 1.00 0.00 C ATOM 121 O VAL A 11 -14.554 -4.919 5.628 1.00 0.00 O ATOM 122 CB VAL A 11 -13.376 -4.549 8.112 1.00 0.00 C ATOM 123 CG1 VAL A 11 -14.505 -3.627 8.545 1.00 0.00 C ATOM 124 CG2 VAL A 11 -12.337 -4.686 9.215 1.00 0.00 C ATOM 0 H VAL A 11 -12.336 -6.738 6.612 1.00 0.00 H new ATOM 0 HA VAL A 11 -14.528 -6.326 8.533 1.00 0.00 H new ATOM 0 HB VAL A 11 -12.891 -4.107 7.241 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -14.095 -2.656 8.823 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -15.209 -3.502 7.722 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -15.021 -4.061 9.401 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -11.959 -3.700 9.483 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -12.794 -5.150 10.089 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -11.513 -5.307 8.864 1.00 0.00 H new ATOM 134 N GLY A 12 -15.832 -6.614 6.377 1.00 0.00 N ATOM 135 CA GLY A 12 -16.730 -6.554 5.239 1.00 0.00 C ATOM 136 C GLY A 12 -16.119 -7.151 3.986 1.00 0.00 C ATOM 137 O GLY A 12 -16.355 -8.316 3.667 1.00 0.00 O ATOM 0 H GLY A 12 -16.059 -7.332 7.065 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -17.651 -7.085 5.479 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -17.001 -5.516 5.048 1.00 0.00 H new ATOM 141 N ILE A 13 -15.330 -6.351 3.276 1.00 0.00 N ATOM 142 CA ILE A 13 -14.683 -6.806 2.053 1.00 0.00 C ATOM 143 C ILE A 13 -13.230 -6.347 1.996 1.00 0.00 C ATOM 144 O ILE A 13 -12.683 -6.113 0.918 1.00 0.00 O ATOM 145 CB ILE A 13 -15.421 -6.292 0.800 1.00 0.00 C ATOM 146 CG1 ILE A 13 -15.523 -4.766 0.832 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.801 -6.923 0.705 1.00 0.00 C ATOM 148 CD1 ILE A 13 -14.535 -4.075 -0.082 1.00 0.00 C ATOM 0 H ILE A 13 -15.124 -5.384 3.528 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.718 -7.895 2.065 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.852 -6.578 -0.085 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -16.534 -4.472 0.550 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -15.364 -4.421 1.853 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -17.311 -6.551 -0.184 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.702 -8.007 0.640 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -17.381 -6.664 1.591 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -14.664 -2.995 -0.008 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -13.520 -4.340 0.213 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -14.708 -4.391 -1.111 1.00 0.00 H new ATOM 160 N TRP A 14 -12.609 -6.220 3.165 1.00 0.00 N ATOM 161 CA TRP A 14 -11.218 -5.789 3.249 1.00 0.00 C ATOM 162 C TRP A 14 -10.442 -6.652 4.238 1.00 0.00 C ATOM 163 O TRP A 14 -10.686 -6.604 5.444 1.00 0.00 O ATOM 164 CB TRP A 14 -11.142 -4.319 3.665 1.00 0.00 C ATOM 165 CG TRP A 14 -11.783 -3.389 2.682 1.00 0.00 C ATOM 166 CD1 TRP A 14 -13.092 -3.001 2.654 1.00 0.00 C ATOM 167 CD2 TRP A 14 -11.145 -2.730 1.583 1.00 0.00 C ATOM 168 NE1 TRP A 14 -13.307 -2.140 1.604 1.00 0.00 N ATOM 169 CE2 TRP A 14 -12.127 -1.958 0.932 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.839 -2.715 1.086 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.842 -1.183 -0.189 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.557 -1.945 -0.027 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.555 -1.188 -0.654 1.00 0.00 C ATOM 0 H TRP A 14 -13.047 -6.409 4.066 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.767 -5.903 2.263 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -11.624 -4.198 4.635 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -10.096 -4.038 3.791 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -13.848 -3.323 3.355 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -14.199 -1.707 1.364 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -9.063 -3.295 1.563 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.610 -0.599 -0.674 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.551 -1.927 -0.419 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -10.304 -0.596 -1.522 1.00 0.00 H new ATOM 184 N TRP A 15 -9.505 -7.439 3.722 1.00 0.00 N ATOM 185 CA TRP A 15 -8.692 -8.313 4.560 1.00 0.00 C ATOM 186 C TRP A 15 -7.240 -7.844 4.589 1.00 0.00 C ATOM 187 O TRP A 15 -6.709 -7.374 3.583 1.00 0.00 O ATOM 188 CB TRP A 15 -8.764 -9.754 4.051 1.00 0.00 C ATOM 189 CG TRP A 15 -8.591 -9.871 2.567 1.00 0.00 C ATOM 190 CD1 TRP A 15 -9.540 -9.649 1.612 1.00 0.00 C ATOM 191 CD2 TRP A 15 -7.396 -10.239 1.869 1.00 0.00 C ATOM 192 NE1 TRP A 15 -9.009 -9.856 0.362 1.00 0.00 N ATOM 193 CE2 TRP A 15 -7.694 -10.219 0.494 1.00 0.00 C ATOM 194 CE3 TRP A 15 -6.102 -10.583 2.272 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -6.747 -10.530 -0.479 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -5.162 -10.891 1.307 1.00 0.00 C ATOM 197 CH2 TRP A 15 -5.489 -10.862 -0.055 1.00 0.00 C ATOM 0 H TRP A 15 -9.289 -7.490 2.726 1.00 0.00 H new ATOM 0 HA TRP A 15 -9.088 -8.273 5.575 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.994 -10.345 4.547 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.726 -10.183 4.332 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -10.560 -9.354 1.810 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.511 -9.756 -0.520 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.842 -10.608 3.320 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.996 -10.510 -1.530 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -4.160 -11.158 1.607 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.732 -11.107 -0.786 1.00 0.00 H new ATOM 208 N THR A 16 -6.605 -7.974 5.749 1.00 0.00 N ATOM 209 CA THR A 16 -5.215 -7.563 5.908 1.00 0.00 C ATOM 210 C THR A 16 -4.275 -8.547 5.219 1.00 0.00 C ATOM 211 O THR A 16 -4.632 -9.701 4.983 1.00 0.00 O ATOM 212 CB THR A 16 -4.860 -7.456 7.393 1.00 0.00 C ATOM 213 OG1 THR A 16 -6.017 -7.187 8.165 1.00 0.00 O ATOM 214 CG2 THR A 16 -3.847 -6.372 7.688 1.00 0.00 C ATOM 0 H THR A 16 -7.030 -8.360 6.592 1.00 0.00 H new ATOM 0 HA THR A 16 -5.095 -6.585 5.441 1.00 0.00 H new ATOM 0 HB THR A 16 -4.424 -8.419 7.658 1.00 0.00 H new ATOM 0 HG1 THR A 16 -5.843 -6.429 8.762 1.00 0.00 H new ATOM 0 HG21 THR A 16 -3.640 -6.349 8.758 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.925 -6.578 7.144 1.00 0.00 H new ATOM 0 HG23 THR A 16 -4.245 -5.407 7.375 1.00 0.00 H new ATOM 222 N VAL A 17 -3.072 -8.082 4.898 1.00 0.00 N ATOM 223 CA VAL A 17 -2.081 -8.920 4.235 1.00 0.00 C ATOM 224 C VAL A 17 -1.081 -9.487 5.237 1.00 0.00 C ATOM 225 O VAL A 17 -1.047 -9.075 6.397 1.00 0.00 O ATOM 226 CB VAL A 17 -1.315 -8.136 3.153 1.00 0.00 C ATOM 227 CG1 VAL A 17 -2.204 -7.884 1.945 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.784 -6.826 3.717 1.00 0.00 C ATOM 0 H VAL A 17 -2.760 -7.129 5.087 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.625 -9.739 3.764 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.465 -8.736 2.830 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.645 -7.329 1.191 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.529 -8.837 1.527 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.076 -7.305 2.249 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.246 -6.286 2.938 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.617 -6.218 4.071 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -0.109 -7.034 4.547 1.00 0.00 H new ATOM 238 N SER A 18 -0.267 -10.434 4.783 1.00 0.00 N ATOM 239 CA SER A 18 0.735 -11.058 5.639 1.00 0.00 C ATOM 240 C SER A 18 2.121 -10.968 5.009 1.00 0.00 C ATOM 241 O SER A 18 3.099 -10.637 5.679 1.00 0.00 O ATOM 242 CB SER A 18 0.375 -12.521 5.900 1.00 0.00 C ATOM 243 OG SER A 18 0.699 -12.898 7.227 1.00 0.00 O ATOM 0 H SER A 18 -0.282 -10.786 3.826 1.00 0.00 H new ATOM 0 HA SER A 18 0.751 -10.521 6.587 1.00 0.00 H new ATOM 0 HB2 SER A 18 -0.690 -12.673 5.725 1.00 0.00 H new ATOM 0 HB3 SER A 18 0.908 -13.161 5.197 1.00 0.00 H new ATOM 0 HG SER A 18 0.457 -13.837 7.369 1.00 0.00 H new ATOM 249 N ASN A 19 2.198 -11.266 3.715 1.00 0.00 N ATOM 250 CA ASN A 19 3.463 -11.218 2.993 1.00 0.00 C ATOM 251 C ASN A 19 3.369 -10.286 1.790 1.00 0.00 C ATOM 252 O ASN A 19 2.313 -9.712 1.518 1.00 0.00 O ATOM 253 CB ASN A 19 3.869 -12.621 2.536 1.00 0.00 C ATOM 254 CG ASN A 19 2.719 -13.378 1.899 1.00 0.00 C ATOM 255 OD1 ASN A 19 1.701 -13.639 2.541 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.877 -13.737 0.630 1.00 0.00 N ATOM 0 H ASN A 19 1.398 -11.543 3.146 1.00 0.00 H new ATOM 0 HA ASN A 19 4.224 -10.831 3.671 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.689 -12.544 1.822 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.242 -13.185 3.391 1.00 0.00 H new ATOM 0 HD21 ASN A 19 2.138 -14.250 0.149 1.00 0.00 H new ATOM 0 HD22 ASN A 19 3.737 -13.500 0.136 1.00 0.00 H new ATOM 263 N PHE A 20 4.477 -10.139 1.071 1.00 0.00 N ATOM 264 CA PHE A 20 4.519 -9.277 -0.103 1.00 0.00 C ATOM 265 C PHE A 20 3.638 -9.829 -1.218 1.00 0.00 C ATOM 266 O PHE A 20 3.056 -9.073 -1.997 1.00 0.00 O ATOM 267 CB PHE A 20 5.958 -9.129 -0.602 1.00 0.00 C ATOM 268 CG PHE A 20 6.095 -8.198 -1.773 1.00 0.00 C ATOM 269 CD1 PHE A 20 5.741 -8.611 -3.048 1.00 0.00 C ATOM 270 CD2 PHE A 20 6.578 -6.911 -1.599 1.00 0.00 C ATOM 271 CE1 PHE A 20 5.865 -7.758 -4.127 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.704 -6.052 -2.675 1.00 0.00 C ATOM 273 CZ PHE A 20 6.348 -6.477 -3.940 1.00 0.00 C ATOM 0 H PHE A 20 5.359 -10.607 1.282 1.00 0.00 H new ATOM 0 HA PHE A 20 4.138 -8.297 0.185 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.582 -8.766 0.215 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.339 -10.111 -0.882 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.364 -9.612 -3.199 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.859 -6.575 -0.612 1.00 0.00 H new ATOM 0 HE1 PHE A 20 5.585 -8.092 -5.115 1.00 0.00 H new ATOM 0 HE2 PHE A 20 7.080 -5.051 -2.527 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.447 -5.809 -4.782 1.00 0.00 H new ATOM 283 N GLY A 21 3.542 -11.152 -1.289 1.00 0.00 N ATOM 284 CA GLY A 21 2.730 -11.784 -2.313 1.00 0.00 C ATOM 285 C GLY A 21 1.268 -11.389 -2.221 1.00 0.00 C ATOM 286 O GLY A 21 0.558 -11.375 -3.226 1.00 0.00 O ATOM 0 H GLY A 21 4.012 -11.799 -0.656 1.00 0.00 H new ATOM 0 HA2 GLY A 21 3.115 -11.513 -3.296 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.817 -12.867 -2.224 1.00 0.00 H new ATOM 290 N GLU A 22 0.818 -11.069 -1.012 1.00 0.00 N ATOM 291 CA GLU A 22 -0.568 -10.674 -0.793 1.00 0.00 C ATOM 292 C GLU A 22 -0.840 -9.289 -1.372 1.00 0.00 C ATOM 293 O GLU A 22 -1.955 -8.991 -1.799 1.00 0.00 O ATOM 294 CB GLU A 22 -0.894 -10.687 0.702 1.00 0.00 C ATOM 295 CG GLU A 22 -0.588 -12.012 1.380 1.00 0.00 C ATOM 296 CD GLU A 22 -1.252 -13.187 0.691 1.00 0.00 C ATOM 297 OE1 GLU A 22 -0.909 -13.462 -0.478 1.00 0.00 O ATOM 298 OE2 GLU A 22 -2.117 -13.833 1.321 1.00 0.00 O ATOM 0 H GLU A 22 1.393 -11.076 -0.170 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.208 -11.393 -1.305 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -0.328 -9.897 1.196 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.950 -10.455 0.837 1.00 0.00 H new ATOM 0 HG2 GLU A 22 0.491 -12.167 1.396 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -0.919 -11.970 2.418 1.00 0.00 H new ATOM 305 N ILE A 23 0.188 -8.446 -1.384 1.00 0.00 N ATOM 306 CA ILE A 23 0.059 -7.093 -1.910 1.00 0.00 C ATOM 307 C ILE A 23 -0.110 -7.107 -3.426 1.00 0.00 C ATOM 308 O ILE A 23 0.869 -7.083 -4.171 1.00 0.00 O ATOM 309 CB ILE A 23 1.284 -6.230 -1.550 1.00 0.00 C ATOM 310 CG1 ILE A 23 1.583 -6.329 -0.054 1.00 0.00 C ATOM 311 CG2 ILE A 23 1.050 -4.782 -1.955 1.00 0.00 C ATOM 312 CD1 ILE A 23 2.782 -5.513 0.379 1.00 0.00 C ATOM 0 H ILE A 23 1.119 -8.677 -1.036 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.829 -6.659 -1.451 1.00 0.00 H new ATOM 0 HB ILE A 23 2.148 -6.605 -2.099 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.708 -5.999 0.506 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.752 -7.374 0.206 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.924 -4.185 -1.694 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.881 -4.728 -3.031 1.00 0.00 H new ATOM 0 HG23 ILE A 23 0.176 -4.394 -1.431 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.934 -5.631 1.452 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.668 -5.858 -0.153 1.00 0.00 H new ATOM 0 HD13 ILE A 23 2.608 -4.461 0.151 1.00 0.00 H new ATOM 324 N SER A 24 -1.361 -7.148 -3.875 1.00 0.00 N ATOM 325 CA SER A 24 -1.660 -7.165 -5.302 1.00 0.00 C ATOM 326 C SER A 24 -3.069 -6.645 -5.569 1.00 0.00 C ATOM 327 O SER A 24 -4.010 -6.975 -4.847 1.00 0.00 O ATOM 328 CB SER A 24 -1.513 -8.583 -5.858 1.00 0.00 C ATOM 329 OG SER A 24 -2.455 -9.463 -5.270 1.00 0.00 O ATOM 0 H SER A 24 -2.183 -7.170 -3.271 1.00 0.00 H new ATOM 0 HA SER A 24 -0.949 -6.509 -5.805 1.00 0.00 H new ATOM 0 HB2 SER A 24 -1.650 -8.569 -6.939 1.00 0.00 H new ATOM 0 HB3 SER A 24 -0.503 -8.948 -5.669 1.00 0.00 H new ATOM 0 HG SER A 24 -2.341 -10.362 -5.644 1.00 0.00 H new ATOM 335 N GLY A 25 -3.207 -5.833 -6.612 1.00 0.00 N ATOM 336 CA GLY A 25 -4.504 -5.282 -6.955 1.00 0.00 C ATOM 337 C GLY A 25 -4.829 -4.027 -6.168 1.00 0.00 C ATOM 338 O GLY A 25 -3.992 -3.134 -6.036 1.00 0.00 O ATOM 0 H GLY A 25 -2.444 -5.547 -7.225 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.528 -5.055 -8.021 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.274 -6.032 -6.771 1.00 0.00 H new ATOM 342 N THR A 26 -6.049 -3.960 -5.643 1.00 0.00 N ATOM 343 CA THR A 26 -6.483 -2.805 -4.865 1.00 0.00 C ATOM 344 C THR A 26 -6.223 -3.022 -3.378 1.00 0.00 C ATOM 345 O THR A 26 -6.607 -4.047 -2.814 1.00 0.00 O ATOM 346 CB THR A 26 -7.969 -2.535 -5.101 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.315 -2.778 -6.453 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.379 -1.116 -4.769 1.00 0.00 C ATOM 0 H THR A 26 -6.753 -4.691 -5.742 1.00 0.00 H new ATOM 0 HA THR A 26 -5.907 -1.940 -5.193 1.00 0.00 H new ATOM 0 HB THR A 26 -8.496 -3.214 -4.431 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.270 -2.601 -6.583 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.445 -0.991 -4.959 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.171 -0.914 -3.718 1.00 0.00 H new ATOM 0 HG23 THR A 26 -7.816 -0.420 -5.391 1.00 0.00 H new ATOM 356 N ILE A 27 -5.570 -2.051 -2.749 1.00 0.00 N ATOM 357 CA ILE A 27 -5.261 -2.135 -1.326 1.00 0.00 C ATOM 358 C ILE A 27 -5.576 -0.823 -0.617 1.00 0.00 C ATOM 359 O ILE A 27 -5.843 0.193 -1.258 1.00 0.00 O ATOM 360 CB ILE A 27 -3.778 -2.487 -1.094 1.00 0.00 C ATOM 361 CG1 ILE A 27 -2.874 -1.478 -1.804 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.487 -3.900 -1.576 1.00 0.00 C ATOM 363 CD1 ILE A 27 -1.509 -1.338 -1.167 1.00 0.00 C ATOM 0 H ILE A 27 -5.244 -1.197 -3.202 1.00 0.00 H new ATOM 0 HA ILE A 27 -5.885 -2.927 -0.913 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.572 -2.440 -0.025 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -2.752 -1.781 -2.844 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -3.365 -0.505 -1.811 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.436 -4.133 -1.405 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.109 -4.607 -1.028 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.707 -3.974 -2.641 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -0.922 -0.607 -1.722 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -1.621 -1.005 -0.135 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -0.999 -2.301 -1.184 1.00 0.00 H new ATOM 375 N ALA A 28 -5.545 -0.853 0.711 1.00 0.00 N ATOM 376 CA ALA A 28 -5.827 0.334 1.508 1.00 0.00 C ATOM 377 C ALA A 28 -4.877 0.435 2.697 1.00 0.00 C ATOM 378 O ALA A 28 -4.872 -0.425 3.576 1.00 0.00 O ATOM 379 CB ALA A 28 -7.272 0.316 1.987 1.00 0.00 C ATOM 0 H ALA A 28 -5.327 -1.686 1.257 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.674 1.210 0.877 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.469 1.208 2.581 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.940 0.298 1.126 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.442 -0.571 2.597 1.00 0.00 H new ATOM 385 N ILE A 29 -4.073 1.494 2.716 1.00 0.00 N ATOM 386 CA ILE A 29 -3.118 1.708 3.795 1.00 0.00 C ATOM 387 C ILE A 29 -3.735 2.532 4.920 1.00 0.00 C ATOM 388 O ILE A 29 -4.461 3.494 4.671 1.00 0.00 O ATOM 389 CB ILE A 29 -1.848 2.419 3.291 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.317 1.735 2.027 1.00 0.00 C ATOM 391 CG2 ILE A 29 -0.784 2.440 4.379 1.00 0.00 C ATOM 392 CD1 ILE A 29 -1.283 2.642 0.817 1.00 0.00 C ATOM 0 H ILE A 29 -4.065 2.216 1.996 1.00 0.00 H new ATOM 0 HA ILE A 29 -2.847 0.723 4.175 1.00 0.00 H new ATOM 0 HB ILE A 29 -2.103 3.449 3.041 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.311 1.363 2.220 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -1.940 0.869 1.804 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.107 2.946 4.007 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.166 2.971 5.251 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.530 1.418 4.660 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -0.896 2.091 -0.040 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.291 2.994 0.598 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.637 3.496 1.021 1.00 0.00 H new ATOM 404 N GLU A 30 -3.442 2.147 6.158 1.00 0.00 N ATOM 405 CA GLU A 30 -3.969 2.850 7.322 1.00 0.00 C ATOM 406 C GLU A 30 -2.838 3.331 8.225 1.00 0.00 C ATOM 407 O GLU A 30 -2.046 2.533 8.723 1.00 0.00 O ATOM 408 CB GLU A 30 -4.914 1.940 8.109 1.00 0.00 C ATOM 409 CG GLU A 30 -5.907 2.696 8.976 1.00 0.00 C ATOM 410 CD GLU A 30 -6.799 1.773 9.781 1.00 0.00 C ATOM 411 OE1 GLU A 30 -6.347 1.280 10.836 1.00 0.00 O ATOM 412 OE2 GLU A 30 -7.952 1.542 9.357 1.00 0.00 O ATOM 0 H GLU A 30 -2.843 1.352 6.381 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.523 3.720 6.970 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.462 1.308 7.410 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.323 1.277 8.742 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.364 3.354 9.655 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.526 3.332 8.343 1.00 0.00 H new ATOM 419 N MET A 31 -2.770 4.643 8.431 1.00 0.00 N ATOM 420 CA MET A 31 -1.736 5.231 9.275 1.00 0.00 C ATOM 421 C MET A 31 -2.237 5.411 10.704 1.00 0.00 C ATOM 422 O MET A 31 -1.585 4.990 11.659 1.00 0.00 O ATOM 423 CB MET A 31 -1.289 6.579 8.706 1.00 0.00 C ATOM 424 CG MET A 31 -1.048 6.555 7.205 1.00 0.00 C ATOM 425 SD MET A 31 -0.574 8.168 6.552 1.00 0.00 S ATOM 426 CE MET A 31 1.097 7.835 6.004 1.00 0.00 C ATOM 0 H MET A 31 -3.418 5.318 8.025 1.00 0.00 H new ATOM 0 HA MET A 31 -0.885 4.550 9.290 1.00 0.00 H new ATOM 0 HB2 MET A 31 -2.047 7.329 8.932 1.00 0.00 H new ATOM 0 HB3 MET A 31 -0.373 6.890 9.208 1.00 0.00 H new ATOM 0 HG2 MET A 31 -0.265 5.831 6.978 1.00 0.00 H new ATOM 0 HG3 MET A 31 -1.953 6.215 6.701 1.00 0.00 H new ATOM 0 HE1 MET A 31 1.599 8.775 5.774 1.00 0.00 H new ATOM 0 HE2 MET A 31 1.642 7.316 6.793 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.069 7.210 5.111 1.00 0.00 H new ATOM 436 N ASP A 32 -3.400 6.039 10.843 1.00 0.00 N ATOM 437 CA ASP A 32 -3.989 6.275 12.156 1.00 0.00 C ATOM 438 C ASP A 32 -5.074 5.247 12.457 1.00 0.00 C ATOM 439 O ASP A 32 -5.464 4.468 11.587 1.00 0.00 O ATOM 440 CB ASP A 32 -4.575 7.687 12.229 1.00 0.00 C ATOM 441 CG ASP A 32 -4.378 8.325 13.589 1.00 0.00 C ATOM 442 OD1 ASP A 32 -3.273 8.186 14.156 1.00 0.00 O ATOM 443 OD2 ASP A 32 -5.327 8.964 14.090 1.00 0.00 O ATOM 0 H ASP A 32 -3.953 6.394 10.063 1.00 0.00 H new ATOM 0 HA ASP A 32 -3.202 6.176 12.903 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -4.108 8.311 11.467 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -5.640 7.648 12.000 1.00 0.00 H new ATOM 448 N LYS A 33 -5.558 5.250 13.694 1.00 0.00 N ATOM 449 CA LYS A 33 -6.597 4.316 14.111 1.00 0.00 C ATOM 450 C LYS A 33 -7.961 4.750 13.581 1.00 0.00 C ATOM 451 O LYS A 33 -8.753 5.358 14.302 1.00 0.00 O ATOM 452 CB LYS A 33 -6.637 4.211 15.637 1.00 0.00 C ATOM 453 CG LYS A 33 -5.945 2.971 16.179 1.00 0.00 C ATOM 454 CD LYS A 33 -5.543 3.149 17.634 1.00 0.00 C ATOM 455 CE LYS A 33 -6.732 2.974 18.566 1.00 0.00 C ATOM 456 NZ LYS A 33 -7.355 1.629 18.423 1.00 0.00 N ATOM 0 H LYS A 33 -5.247 5.889 14.426 1.00 0.00 H new ATOM 0 HA LYS A 33 -6.360 3.337 13.695 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.167 5.096 16.066 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -7.676 4.210 15.966 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -6.610 2.112 16.087 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -5.060 2.755 15.580 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.769 2.425 17.890 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -5.112 4.140 17.775 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -6.409 3.117 19.597 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -7.475 3.743 18.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -7.890 1.401 19.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -7.999 1.630 17.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -6.612 0.916 18.278 1.00 0.00 H new ATOM 470 N GLY A 34 -8.229 4.432 12.319 1.00 0.00 N ATOM 471 CA GLY A 34 -9.498 4.797 11.715 1.00 0.00 C ATOM 472 C GLY A 34 -9.330 5.705 10.512 1.00 0.00 C ATOM 473 O GLY A 34 -10.167 5.711 9.609 1.00 0.00 O ATOM 0 H GLY A 34 -7.591 3.928 11.703 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -10.026 3.893 11.412 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -10.120 5.296 12.458 1.00 0.00 H new ATOM 477 N ALA A 35 -8.247 6.475 10.500 1.00 0.00 N ATOM 478 CA ALA A 35 -7.974 7.390 9.399 1.00 0.00 C ATOM 479 C ALA A 35 -7.236 6.684 8.267 1.00 0.00 C ATOM 480 O ALA A 35 -6.586 5.661 8.479 1.00 0.00 O ATOM 481 CB ALA A 35 -7.167 8.582 9.893 1.00 0.00 C ATOM 0 H ALA A 35 -7.545 6.483 11.240 1.00 0.00 H new ATOM 0 HA ALA A 35 -8.928 7.745 9.010 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -6.970 9.258 9.061 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.731 9.109 10.663 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.222 8.234 10.310 1.00 0.00 H new ATOM 487 N TYR A 36 -7.341 7.238 7.063 1.00 0.00 N ATOM 488 CA TYR A 36 -6.683 6.661 5.897 1.00 0.00 C ATOM 489 C TYR A 36 -5.993 7.744 5.072 1.00 0.00 C ATOM 490 O TYR A 36 -6.198 8.936 5.299 1.00 0.00 O ATOM 491 CB TYR A 36 -7.698 5.913 5.030 1.00 0.00 C ATOM 492 CG TYR A 36 -8.058 4.545 5.562 1.00 0.00 C ATOM 493 CD1 TYR A 36 -8.812 4.405 6.720 1.00 0.00 C ATOM 494 CD2 TYR A 36 -7.643 3.392 4.906 1.00 0.00 C ATOM 495 CE1 TYR A 36 -9.143 3.156 7.209 1.00 0.00 C ATOM 496 CE2 TYR A 36 -7.970 2.140 5.389 1.00 0.00 C ATOM 497 CZ TYR A 36 -8.721 2.026 6.540 1.00 0.00 C ATOM 498 OH TYR A 36 -9.049 0.781 7.025 1.00 0.00 O ATOM 0 H TYR A 36 -7.875 8.085 6.870 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.927 5.958 6.247 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.605 6.512 4.949 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -7.295 5.807 4.023 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -9.145 5.287 7.247 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -7.055 3.476 4.004 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -9.730 3.065 8.111 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -7.639 1.254 4.867 1.00 0.00 H new ATOM 0 HH TYR A 36 -9.021 0.794 8.005 1.00 0.00 H new ATOM 508 N ILE A 37 -5.176 7.320 4.114 1.00 0.00 N ATOM 509 CA ILE A 37 -4.456 8.253 3.256 1.00 0.00 C ATOM 510 C ILE A 37 -5.370 8.828 2.181 1.00 0.00 C ATOM 511 O ILE A 37 -5.849 8.104 1.307 1.00 0.00 O ATOM 512 CB ILE A 37 -3.247 7.578 2.579 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.413 6.820 3.614 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.396 8.613 1.860 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.428 5.849 3.003 1.00 0.00 C ATOM 0 H ILE A 37 -4.996 6.336 3.912 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.100 9.060 3.897 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.614 6.864 1.842 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.869 7.539 4.227 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -3.083 6.275 4.280 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.546 8.120 1.387 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.996 9.112 1.099 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.035 9.349 2.578 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.872 5.348 3.795 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.966 5.108 2.413 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.734 6.391 2.360 1.00 0.00 H new ATOM 527 N HIS A 38 -5.610 10.133 2.250 1.00 0.00 N ATOM 528 CA HIS A 38 -6.469 10.807 1.282 1.00 0.00 C ATOM 529 C HIS A 38 -5.649 11.698 0.354 1.00 0.00 C ATOM 530 O HIS A 38 -4.671 12.316 0.775 1.00 0.00 O ATOM 531 CB HIS A 38 -7.528 11.641 2.004 1.00 0.00 C ATOM 532 CG HIS A 38 -8.651 12.081 1.116 1.00 0.00 C ATOM 533 ND1 HIS A 38 -9.703 11.271 0.751 1.00 0.00 N ATOM 534 CD2 HIS A 38 -8.875 13.279 0.520 1.00 0.00 C ATOM 535 CE1 HIS A 38 -10.515 11.985 -0.041 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.058 13.211 -0.212 1.00 0.00 N ATOM 0 H HIS A 38 -5.222 10.746 2.967 1.00 0.00 H new ATOM 0 HA HIS A 38 -6.964 10.045 0.680 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -7.936 11.059 2.830 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -7.052 12.521 2.438 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.238 14.147 0.600 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -11.425 11.606 -0.482 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -10.483 13.955 -0.766 1.00 0.00 H new ATOM 544 N ALA A 39 -6.053 11.757 -0.911 1.00 0.00 N ATOM 545 CA ALA A 39 -5.355 12.572 -1.897 1.00 0.00 C ATOM 546 C ALA A 39 -6.172 13.806 -2.266 1.00 0.00 C ATOM 547 O ALA A 39 -7.393 13.825 -2.110 1.00 0.00 O ATOM 548 CB ALA A 39 -5.049 11.750 -3.139 1.00 0.00 C ATOM 0 H ALA A 39 -6.859 11.250 -1.276 1.00 0.00 H new ATOM 0 HA ALA A 39 -4.416 12.908 -1.456 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.528 12.371 -3.867 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -4.420 10.902 -2.868 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -5.980 11.386 -3.573 1.00 0.00 H new ATOM 554 N LEU A 40 -5.490 14.837 -2.756 1.00 0.00 N ATOM 555 CA LEU A 40 -6.153 16.075 -3.148 1.00 0.00 C ATOM 556 C LEU A 40 -6.036 16.305 -4.651 1.00 0.00 C ATOM 557 O LEU A 40 -5.026 15.958 -5.264 1.00 0.00 O ATOM 558 CB LEU A 40 -5.553 17.261 -2.391 1.00 0.00 C ATOM 559 CG LEU A 40 -5.846 17.285 -0.889 1.00 0.00 C ATOM 560 CD1 LEU A 40 -4.642 17.802 -0.117 1.00 0.00 C ATOM 561 CD2 LEU A 40 -7.072 18.139 -0.601 1.00 0.00 C ATOM 0 H LEU A 40 -4.479 14.839 -2.891 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.209 15.987 -2.894 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.473 17.256 -2.535 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.929 18.183 -2.834 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.050 16.266 -0.562 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.870 17.812 0.949 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.786 17.152 -0.299 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -4.406 18.814 -0.447 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.267 18.146 0.471 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -6.894 19.158 -0.944 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.934 17.726 -1.124 1.00 0.00 H new ATOM 573 N ASP A 41 -7.074 16.889 -5.238 1.00 0.00 N ATOM 574 CA ASP A 41 -7.087 17.166 -6.670 1.00 0.00 C ATOM 575 C ASP A 41 -5.926 18.074 -7.060 1.00 0.00 C ATOM 576 O ASP A 41 -5.379 17.964 -8.158 1.00 0.00 O ATOM 577 CB ASP A 41 -8.416 17.811 -7.073 1.00 0.00 C ATOM 578 CG ASP A 41 -9.014 17.177 -8.313 1.00 0.00 C ATOM 579 OD1 ASP A 41 -8.238 16.763 -9.200 1.00 0.00 O ATOM 580 OD2 ASP A 41 -10.256 17.093 -8.396 1.00 0.00 O ATOM 0 H ASP A 41 -7.918 17.180 -4.745 1.00 0.00 H new ATOM 0 HA ASP A 41 -6.975 16.220 -7.200 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -9.123 17.726 -6.248 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -8.261 18.875 -7.251 1.00 0.00 H new ATOM 585 N ASN A 42 -5.554 18.972 -6.154 1.00 0.00 N ATOM 586 CA ASN A 42 -4.457 19.900 -6.403 1.00 0.00 C ATOM 587 C ASN A 42 -3.143 19.150 -6.594 1.00 0.00 C ATOM 588 O ASN A 42 -2.257 19.602 -7.320 1.00 0.00 O ATOM 589 CB ASN A 42 -4.329 20.894 -5.247 1.00 0.00 C ATOM 590 CG ASN A 42 -4.160 22.321 -5.726 1.00 0.00 C ATOM 591 OD1 ASN A 42 -3.822 22.563 -6.885 1.00 0.00 O ATOM 592 ND2 ASN A 42 -4.393 23.278 -4.835 1.00 0.00 N ATOM 0 H ASN A 42 -5.996 19.077 -5.241 1.00 0.00 H new ATOM 0 HA ASN A 42 -4.678 20.447 -7.319 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -5.215 20.828 -4.616 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -3.475 20.618 -4.628 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -4.294 24.258 -5.101 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -4.671 23.033 -3.885 1.00 0.00 H new ATOM 599 N GLY A 43 -3.022 18.000 -5.938 1.00 0.00 N ATOM 600 CA GLY A 43 -1.812 17.206 -6.048 1.00 0.00 C ATOM 601 C GLY A 43 -1.257 16.798 -4.696 1.00 0.00 C ATOM 602 O GLY A 43 -0.543 15.802 -4.586 1.00 0.00 O ATOM 0 H GLY A 43 -3.741 17.604 -5.332 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -2.021 16.312 -6.636 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.057 17.775 -6.590 1.00 0.00 H new ATOM 606 N LEU A 44 -1.585 17.571 -3.665 1.00 0.00 N ATOM 607 CA LEU A 44 -1.113 17.286 -2.316 1.00 0.00 C ATOM 608 C LEU A 44 -1.867 16.103 -1.714 1.00 0.00 C ATOM 609 O LEU A 44 -2.897 15.679 -2.240 1.00 0.00 O ATOM 610 CB LEU A 44 -1.279 18.518 -1.423 1.00 0.00 C ATOM 611 CG LEU A 44 -0.829 19.837 -2.053 1.00 0.00 C ATOM 612 CD1 LEU A 44 -1.736 20.976 -1.612 1.00 0.00 C ATOM 613 CD2 LEU A 44 0.618 20.134 -1.692 1.00 0.00 C ATOM 0 H LEU A 44 -2.176 18.399 -3.739 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.056 17.029 -2.375 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.329 18.606 -1.142 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.715 18.361 -0.504 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.900 19.743 -3.137 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -1.401 21.906 -2.070 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.760 20.767 -1.923 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.698 21.072 -0.527 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.921 21.076 -2.149 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.715 20.208 -0.609 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.257 19.331 -2.059 1.00 0.00 H new ATOM 625 N PHE A 45 -1.347 15.576 -0.611 1.00 0.00 N ATOM 626 CA PHE A 45 -1.970 14.442 0.062 1.00 0.00 C ATOM 627 C PHE A 45 -2.162 14.729 1.547 1.00 0.00 C ATOM 628 O PHE A 45 -1.206 15.040 2.258 1.00 0.00 O ATOM 629 CB PHE A 45 -1.121 13.183 -0.122 1.00 0.00 C ATOM 630 CG PHE A 45 -1.384 12.466 -1.415 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.094 13.070 -2.628 1.00 0.00 C ATOM 632 CD2 PHE A 45 -1.920 11.188 -1.418 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.334 12.413 -3.819 1.00 0.00 C ATOM 634 CE2 PHE A 45 -2.162 10.526 -2.606 1.00 0.00 C ATOM 635 CZ PHE A 45 -1.869 11.140 -3.809 1.00 0.00 C ATOM 0 H PHE A 45 -0.496 15.916 -0.164 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.950 14.279 -0.387 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.067 13.455 -0.075 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.311 12.502 0.707 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.676 14.066 -2.642 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.151 10.704 -0.481 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.103 12.895 -4.758 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.580 9.530 -2.595 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.058 10.625 -4.739 1.00 0.00 H new ATOM 645 N THR A 46 -3.403 14.624 2.010 1.00 0.00 N ATOM 646 CA THR A 46 -3.721 14.873 3.411 1.00 0.00 C ATOM 647 C THR A 46 -4.292 13.622 4.069 1.00 0.00 C ATOM 648 O THR A 46 -4.660 12.663 3.390 1.00 0.00 O ATOM 649 CB THR A 46 -4.717 16.027 3.531 1.00 0.00 C ATOM 650 OG1 THR A 46 -5.044 16.268 4.889 1.00 0.00 O ATOM 651 CG2 THR A 46 -6.010 15.783 2.785 1.00 0.00 C ATOM 0 H THR A 46 -4.206 14.368 1.435 1.00 0.00 H new ATOM 0 HA THR A 46 -2.799 15.143 3.926 1.00 0.00 H new ATOM 0 HB THR A 46 -4.217 16.887 3.086 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.681 17.011 4.945 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.671 16.640 2.912 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.798 15.643 1.725 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.495 14.890 3.179 1.00 0.00 H new ATOM 659 N LEU A 47 -4.366 13.638 5.396 1.00 0.00 N ATOM 660 CA LEU A 47 -4.892 12.504 6.147 1.00 0.00 C ATOM 661 C LEU A 47 -6.414 12.567 6.230 1.00 0.00 C ATOM 662 O LEU A 47 -6.974 13.456 6.873 1.00 0.00 O ATOM 663 CB LEU A 47 -4.294 12.476 7.554 1.00 0.00 C ATOM 664 CG LEU A 47 -4.373 11.123 8.264 1.00 0.00 C ATOM 665 CD1 LEU A 47 -3.435 10.122 7.609 1.00 0.00 C ATOM 666 CD2 LEU A 47 -4.042 11.279 9.741 1.00 0.00 C ATOM 0 H LEU A 47 -4.068 14.424 5.974 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.611 11.591 5.623 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.248 12.777 7.494 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.805 13.220 8.165 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.392 10.746 8.177 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.504 9.165 8.127 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.716 9.990 6.564 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.411 10.492 7.666 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.103 10.308 10.232 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.033 11.677 9.848 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.753 11.964 10.203 1.00 0.00 H new ATOM 678 N GLY A 48 -7.077 11.620 5.575 1.00 0.00 N ATOM 679 CA GLY A 48 -8.528 11.586 5.588 1.00 0.00 C ATOM 680 C GLY A 48 -9.091 11.383 6.981 1.00 0.00 C ATOM 681 O GLY A 48 -8.517 10.655 7.790 1.00 0.00 O ATOM 0 H GLY A 48 -6.636 10.875 5.035 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.914 12.518 5.176 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.875 10.783 4.938 1.00 0.00 H new ATOM 685 N ALA A 49 -10.219 12.029 7.260 1.00 0.00 N ATOM 686 CA ALA A 49 -10.859 11.916 8.564 1.00 0.00 C ATOM 687 C ALA A 49 -11.233 10.468 8.870 1.00 0.00 C ATOM 688 O ALA A 49 -11.533 9.692 7.963 1.00 0.00 O ATOM 689 CB ALA A 49 -12.093 12.805 8.625 1.00 0.00 C ATOM 0 H ALA A 49 -10.707 12.635 6.601 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.147 12.247 9.320 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.561 12.711 9.605 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -11.802 13.843 8.460 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -12.800 12.499 7.854 1.00 0.00 H new ATOM 695 N PRO A 50 -11.219 10.083 10.158 1.00 0.00 N ATOM 696 CA PRO A 50 -11.557 8.720 10.578 1.00 0.00 C ATOM 697 C PRO A 50 -13.043 8.418 10.419 1.00 0.00 C ATOM 698 O PRO A 50 -13.893 9.252 10.729 1.00 0.00 O ATOM 699 CB PRO A 50 -11.161 8.695 12.056 1.00 0.00 C ATOM 700 CG PRO A 50 -11.258 10.114 12.497 1.00 0.00 C ATOM 701 CD PRO A 50 -10.872 10.945 11.304 1.00 0.00 C ATOM 0 HA PRO A 50 -11.048 7.969 9.974 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.827 8.054 12.634 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -10.151 8.307 12.189 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -12.269 10.352 12.828 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -10.593 10.307 13.339 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -11.419 11.888 11.277 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.810 11.192 11.313 1.00 0.00 H new ATOM 709 N HIS A 51 -13.349 7.220 9.932 1.00 0.00 N ATOM 710 CA HIS A 51 -14.733 6.807 9.732 1.00 0.00 C ATOM 711 C HIS A 51 -15.500 6.812 11.050 1.00 0.00 C ATOM 712 O HIS A 51 -14.902 6.835 12.127 1.00 0.00 O ATOM 713 CB HIS A 51 -14.786 5.414 9.103 1.00 0.00 C ATOM 714 CG HIS A 51 -14.070 5.322 7.792 1.00 0.00 C ATOM 715 ND1 HIS A 51 -14.690 5.654 6.612 1.00 0.00 N ATOM 716 CD2 HIS A 51 -12.798 4.931 7.529 1.00 0.00 C ATOM 717 CE1 HIS A 51 -13.791 5.461 5.663 1.00 0.00 C ATOM 718 NE2 HIS A 51 -12.628 5.023 6.172 1.00 0.00 N ATOM 0 H HIS A 51 -12.657 6.518 9.669 1.00 0.00 H new ATOM 0 HA HIS A 51 -15.204 7.521 9.057 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -14.351 4.694 9.797 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -15.828 5.129 8.959 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -12.061 4.609 8.250 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -13.969 5.634 4.612 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -11.781 4.801 5.649 1.00 0.00 H new ATOM 726 N ARG A 52 -16.825 6.790 10.959 1.00 0.00 N ATOM 727 CA ARG A 52 -17.673 6.791 12.144 1.00 0.00 C ATOM 728 C ARG A 52 -17.990 5.366 12.587 1.00 0.00 C ATOM 729 O ARG A 52 -17.728 4.988 13.729 1.00 0.00 O ATOM 730 CB ARG A 52 -18.971 7.556 11.868 1.00 0.00 C ATOM 731 CG ARG A 52 -19.112 8.829 12.690 1.00 0.00 C ATOM 732 CD ARG A 52 -20.371 8.807 13.543 1.00 0.00 C ATOM 733 NE ARG A 52 -20.998 10.124 13.627 1.00 0.00 N ATOM 734 CZ ARG A 52 -22.258 10.323 14.007 1.00 0.00 C ATOM 735 NH1 ARG A 52 -23.029 9.293 14.338 1.00 0.00 N ATOM 736 NH2 ARG A 52 -22.750 11.554 14.055 1.00 0.00 N ATOM 0 H ARG A 52 -17.335 6.771 10.076 1.00 0.00 H new ATOM 0 HA ARG A 52 -17.132 7.289 12.948 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -19.015 7.810 10.809 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -19.819 6.903 12.075 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -18.239 8.947 13.332 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -19.138 9.692 12.024 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -21.081 8.094 13.124 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -20.124 8.459 14.546 1.00 0.00 H new ATOM 0 HE ARG A 52 -20.437 10.939 13.380 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -22.656 8.344 14.302 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -23.994 9.451 14.629 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -22.163 12.348 13.801 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -23.716 11.706 14.346 1.00 0.00 H new ATOM 750 N GLU A 53 -18.556 4.581 11.677 1.00 0.00 N ATOM 751 CA GLU A 53 -18.907 3.197 11.974 1.00 0.00 C ATOM 752 C GLU A 53 -17.663 2.317 12.022 1.00 0.00 C ATOM 753 O GLU A 53 -16.597 2.705 11.544 1.00 0.00 O ATOM 754 CB GLU A 53 -19.886 2.663 10.927 1.00 0.00 C ATOM 755 CG GLU A 53 -21.128 3.521 10.760 1.00 0.00 C ATOM 756 CD GLU A 53 -21.739 3.401 9.377 1.00 0.00 C ATOM 757 OE1 GLU A 53 -21.541 2.351 8.730 1.00 0.00 O ATOM 758 OE2 GLU A 53 -22.416 4.356 8.942 1.00 0.00 O ATOM 0 H GLU A 53 -18.782 4.879 10.728 1.00 0.00 H new ATOM 0 HA GLU A 53 -19.384 3.171 12.954 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -19.374 2.590 9.968 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -20.187 1.653 11.206 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -21.868 3.232 11.506 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -20.873 4.563 10.951 1.00 0.00 H new ATOM 765 N VAL A 54 -17.806 1.130 12.602 1.00 0.00 N ATOM 766 CA VAL A 54 -16.694 0.194 12.712 1.00 0.00 C ATOM 767 C VAL A 54 -16.531 -0.621 11.432 1.00 0.00 C ATOM 768 O VAL A 54 -15.422 -1.014 11.071 1.00 0.00 O ATOM 769 CB VAL A 54 -16.884 -0.766 13.904 1.00 0.00 C ATOM 770 CG1 VAL A 54 -18.142 -1.602 13.725 1.00 0.00 C ATOM 771 CG2 VAL A 54 -15.663 -1.656 14.075 1.00 0.00 C ATOM 0 H VAL A 54 -18.681 0.794 13.003 1.00 0.00 H new ATOM 0 HA VAL A 54 -15.795 0.788 12.875 1.00 0.00 H new ATOM 0 HB VAL A 54 -16.999 -0.170 14.809 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -18.258 -2.272 14.577 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -19.009 -0.945 13.660 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -18.062 -2.188 12.810 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -15.817 -2.326 14.921 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -15.511 -2.244 13.170 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -14.784 -1.037 14.257 1.00 0.00 H new ATOM 781 N ASP A 55 -17.645 -0.870 10.750 1.00 0.00 N ATOM 782 CA ASP A 55 -17.625 -1.637 9.510 1.00 0.00 C ATOM 783 C ASP A 55 -17.867 -0.730 8.306 1.00 0.00 C ATOM 784 O ASP A 55 -19.001 -0.572 7.853 1.00 0.00 O ATOM 785 CB ASP A 55 -18.683 -2.744 9.555 1.00 0.00 C ATOM 786 CG ASP A 55 -18.073 -4.130 9.474 1.00 0.00 C ATOM 787 OD1 ASP A 55 -17.403 -4.426 8.462 1.00 0.00 O ATOM 788 OD2 ASP A 55 -18.264 -4.919 10.423 1.00 0.00 O ATOM 0 H ASP A 55 -18.571 -0.552 11.035 1.00 0.00 H new ATOM 0 HA ASP A 55 -16.640 -2.091 9.406 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -19.258 -2.656 10.477 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -19.382 -2.609 8.730 1.00 0.00 H new ATOM 793 N GLU A 56 -16.794 -0.138 7.793 1.00 0.00 N ATOM 794 CA GLU A 56 -16.890 0.752 6.643 1.00 0.00 C ATOM 795 C GLU A 56 -15.578 0.779 5.863 1.00 0.00 C ATOM 796 O GLU A 56 -14.507 0.972 6.438 1.00 0.00 O ATOM 797 CB GLU A 56 -17.255 2.167 7.095 1.00 0.00 C ATOM 798 CG GLU A 56 -18.008 2.967 6.044 1.00 0.00 C ATOM 799 CD GLU A 56 -19.247 3.640 6.599 1.00 0.00 C ATOM 800 OE1 GLU A 56 -19.110 4.709 7.231 1.00 0.00 O ATOM 801 OE2 GLU A 56 -20.355 3.099 6.402 1.00 0.00 O ATOM 0 H GLU A 56 -15.848 -0.259 8.156 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.674 0.373 5.988 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -17.863 2.105 7.997 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -16.343 2.701 7.361 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -17.345 3.724 5.625 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -18.294 2.306 5.226 1.00 0.00 H new ATOM 808 N GLY A 57 -15.671 0.583 4.552 1.00 0.00 N ATOM 809 CA GLY A 57 -14.486 0.589 3.716 1.00 0.00 C ATOM 810 C GLY A 57 -14.042 1.993 3.348 1.00 0.00 C ATOM 811 O GLY A 57 -14.803 2.947 3.507 1.00 0.00 O ATOM 0 H GLY A 57 -16.546 0.420 4.054 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.675 0.080 4.237 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -14.685 0.024 2.805 1.00 0.00 H new ATOM 815 N PRO A 58 -12.805 2.151 2.846 1.00 0.00 N ATOM 816 CA PRO A 58 -12.273 3.461 2.457 1.00 0.00 C ATOM 817 C PRO A 58 -12.957 4.018 1.212 1.00 0.00 C ATOM 818 O PRO A 58 -13.416 3.266 0.353 1.00 0.00 O ATOM 819 CB PRO A 58 -10.797 3.176 2.172 1.00 0.00 C ATOM 820 CG PRO A 58 -10.752 1.733 1.810 1.00 0.00 C ATOM 821 CD PRO A 58 -11.830 1.069 2.621 1.00 0.00 C ATOM 0 HA PRO A 58 -12.434 4.211 3.231 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.423 3.800 1.360 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.178 3.385 3.045 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -10.924 1.593 0.743 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -9.775 1.305 2.034 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -12.276 0.231 2.086 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.441 0.677 3.561 1.00 0.00 H new ATOM 829 N SER A 59 -13.019 5.342 1.121 1.00 0.00 N ATOM 830 CA SER A 59 -13.645 6.005 -0.016 1.00 0.00 C ATOM 831 C SER A 59 -12.892 5.695 -1.309 1.00 0.00 C ATOM 832 O SER A 59 -11.746 5.244 -1.276 1.00 0.00 O ATOM 833 CB SER A 59 -13.693 7.517 0.214 1.00 0.00 C ATOM 834 OG SER A 59 -14.944 8.055 -0.178 1.00 0.00 O ATOM 0 H SER A 59 -12.642 5.978 1.823 1.00 0.00 H new ATOM 0 HA SER A 59 -14.663 5.628 -0.112 1.00 0.00 H new ATOM 0 HB2 SER A 59 -13.515 7.733 1.267 1.00 0.00 H new ATOM 0 HB3 SER A 59 -12.894 7.999 -0.350 1.00 0.00 H new ATOM 0 HG SER A 59 -14.949 9.022 -0.019 1.00 0.00 H new ATOM 840 N PRO A 60 -13.527 5.932 -2.470 1.00 0.00 N ATOM 841 CA PRO A 60 -12.909 5.675 -3.775 1.00 0.00 C ATOM 842 C PRO A 60 -11.516 6.292 -3.900 1.00 0.00 C ATOM 843 O PRO A 60 -10.566 5.608 -4.283 1.00 0.00 O ATOM 844 CB PRO A 60 -13.881 6.318 -4.765 1.00 0.00 C ATOM 845 CG PRO A 60 -15.197 6.304 -4.068 1.00 0.00 C ATOM 846 CD PRO A 60 -14.896 6.469 -2.603 1.00 0.00 C ATOM 0 HA PRO A 60 -12.754 4.610 -3.946 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -13.576 7.334 -5.015 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -13.922 5.758 -5.699 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -15.837 7.110 -4.427 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -15.726 5.370 -4.254 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -14.949 7.514 -2.298 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.605 5.920 -1.983 1.00 0.00 H new ATOM 854 N PRO A 61 -11.363 7.593 -3.579 1.00 0.00 N ATOM 855 CA PRO A 61 -10.065 8.271 -3.667 1.00 0.00 C ATOM 856 C PRO A 61 -9.060 7.725 -2.657 1.00 0.00 C ATOM 857 O PRO A 61 -7.850 7.805 -2.867 1.00 0.00 O ATOM 858 CB PRO A 61 -10.397 9.733 -3.353 1.00 0.00 C ATOM 859 CG PRO A 61 -11.665 9.680 -2.575 1.00 0.00 C ATOM 860 CD PRO A 61 -12.428 8.501 -3.108 1.00 0.00 C ATOM 0 HA PRO A 61 -9.599 8.130 -4.642 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.600 10.204 -2.778 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.518 10.315 -4.266 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -11.465 9.566 -1.510 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.236 10.601 -2.695 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.041 8.036 -2.336 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -13.099 8.788 -3.918 1.00 0.00 H new ATOM 868 N GLU A 62 -9.570 7.168 -1.563 1.00 0.00 N ATOM 869 CA GLU A 62 -8.716 6.608 -0.522 1.00 0.00 C ATOM 870 C GLU A 62 -8.204 5.227 -0.922 1.00 0.00 C ATOM 871 O GLU A 62 -7.133 4.803 -0.489 1.00 0.00 O ATOM 872 CB GLU A 62 -9.480 6.517 0.800 1.00 0.00 C ATOM 873 CG GLU A 62 -9.767 7.870 1.430 1.00 0.00 C ATOM 874 CD GLU A 62 -10.453 7.752 2.778 1.00 0.00 C ATOM 875 OE1 GLU A 62 -10.368 6.669 3.394 1.00 0.00 O ATOM 876 OE2 GLU A 62 -11.075 8.742 3.217 1.00 0.00 O ATOM 0 H GLU A 62 -10.570 7.093 -1.375 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.860 7.271 -0.394 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.423 5.997 0.630 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.905 5.913 1.502 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.832 8.417 1.549 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -10.395 8.454 0.757 1.00 0.00 H new ATOM 883 N GLN A 63 -8.975 4.529 -1.750 1.00 0.00 N ATOM 884 CA GLN A 63 -8.598 3.196 -2.207 1.00 0.00 C ATOM 885 C GLN A 63 -7.432 3.267 -3.186 1.00 0.00 C ATOM 886 O GLN A 63 -7.566 3.790 -4.292 1.00 0.00 O ATOM 887 CB GLN A 63 -9.792 2.504 -2.867 1.00 0.00 C ATOM 888 CG GLN A 63 -10.904 2.147 -1.894 1.00 0.00 C ATOM 889 CD GLN A 63 -12.124 1.574 -2.589 1.00 0.00 C ATOM 890 OE1 GLN A 63 -12.023 1.002 -3.673 1.00 0.00 O ATOM 891 NE2 GLN A 63 -13.286 1.728 -1.965 1.00 0.00 N ATOM 0 H GLN A 63 -9.865 4.865 -2.118 1.00 0.00 H new ATOM 0 HA GLN A 63 -8.285 2.616 -1.339 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -10.195 3.155 -3.643 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.447 1.595 -3.361 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.530 1.424 -1.170 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -11.193 3.037 -1.335 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.323 2.210 -1.067 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -14.142 1.365 -2.384 1.00 0.00 H new ATOM 900 N PHE A 64 -6.285 2.735 -2.773 1.00 0.00 N ATOM 901 CA PHE A 64 -5.094 2.736 -3.616 1.00 0.00 C ATOM 902 C PHE A 64 -4.938 1.402 -4.338 1.00 0.00 C ATOM 903 O PHE A 64 -5.396 0.367 -3.855 1.00 0.00 O ATOM 904 CB PHE A 64 -3.848 3.023 -2.775 1.00 0.00 C ATOM 905 CG PHE A 64 -3.833 4.399 -2.173 1.00 0.00 C ATOM 906 CD1 PHE A 64 -4.441 4.641 -0.952 1.00 0.00 C ATOM 907 CD2 PHE A 64 -3.211 5.449 -2.829 1.00 0.00 C ATOM 908 CE1 PHE A 64 -4.429 5.906 -0.395 1.00 0.00 C ATOM 909 CE2 PHE A 64 -3.196 6.716 -2.277 1.00 0.00 C ATOM 910 CZ PHE A 64 -3.805 6.945 -1.059 1.00 0.00 C ATOM 0 H PHE A 64 -6.155 2.298 -1.860 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.208 3.522 -4.363 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.781 2.285 -1.976 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -2.963 2.898 -3.398 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -4.930 3.832 -0.429 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.733 5.276 -3.782 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -4.907 6.082 0.558 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -2.708 7.527 -2.798 1.00 0.00 H new ATOM 0 HZ PHE A 64 -3.794 7.934 -0.626 1.00 0.00 H new ATOM 920 N THR A 65 -4.288 1.435 -5.497 1.00 0.00 N ATOM 921 CA THR A 65 -4.072 0.228 -6.286 1.00 0.00 C ATOM 922 C THR A 65 -2.583 -0.086 -6.403 1.00 0.00 C ATOM 923 O THR A 65 -1.810 0.712 -6.933 1.00 0.00 O ATOM 924 CB THR A 65 -4.681 0.387 -7.680 1.00 0.00 C ATOM 925 OG1 THR A 65 -6.014 0.862 -7.592 1.00 0.00 O ATOM 926 CG2 THR A 65 -4.704 -0.900 -8.474 1.00 0.00 C ATOM 0 H THR A 65 -3.902 2.284 -5.910 1.00 0.00 H new ATOM 0 HA THR A 65 -4.562 -0.601 -5.776 1.00 0.00 H new ATOM 0 HB THR A 65 -4.039 1.101 -8.196 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.439 0.808 -8.473 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.148 -0.716 -9.452 1.00 0.00 H new ATOM 0 HG22 THR A 65 -3.686 -1.267 -8.601 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.295 -1.645 -7.942 1.00 0.00 H new ATOM 934 N ALA A 66 -2.188 -1.254 -5.905 1.00 0.00 N ATOM 935 CA ALA A 66 -0.793 -1.672 -5.955 1.00 0.00 C ATOM 936 C ALA A 66 -0.505 -2.478 -7.216 1.00 0.00 C ATOM 937 O ALA A 66 -1.357 -3.227 -7.694 1.00 0.00 O ATOM 938 CB ALA A 66 -0.443 -2.483 -4.716 1.00 0.00 C ATOM 0 H ALA A 66 -2.815 -1.927 -5.463 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.171 -0.777 -5.979 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.602 -2.790 -4.765 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.601 -1.874 -3.826 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.079 -3.367 -4.668 1.00 0.00 H new ATOM 944 N VAL A 67 0.702 -2.319 -7.752 1.00 0.00 N ATOM 945 CA VAL A 67 1.102 -3.032 -8.958 1.00 0.00 C ATOM 946 C VAL A 67 2.562 -3.466 -8.880 1.00 0.00 C ATOM 947 O VAL A 67 3.470 -2.636 -8.919 1.00 0.00 O ATOM 948 CB VAL A 67 0.905 -2.165 -10.216 1.00 0.00 C ATOM 949 CG1 VAL A 67 1.134 -2.987 -11.474 1.00 0.00 C ATOM 950 CG2 VAL A 67 -0.484 -1.543 -10.222 1.00 0.00 C ATOM 0 H VAL A 67 1.419 -1.703 -7.369 1.00 0.00 H new ATOM 0 HA VAL A 67 0.465 -3.913 -9.029 1.00 0.00 H new ATOM 0 HB VAL A 67 1.640 -1.360 -10.199 1.00 0.00 H new ATOM 0 HG11 VAL A 67 0.990 -2.357 -12.352 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.151 -3.380 -11.472 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.425 -3.815 -11.502 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.606 -0.934 -11.118 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.236 -2.332 -10.215 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.606 -0.917 -9.338 1.00 0.00 H new ATOM 960 N LYS A 68 2.780 -4.773 -8.770 1.00 0.00 N ATOM 961 CA LYS A 68 4.130 -5.317 -8.687 1.00 0.00 C ATOM 962 C LYS A 68 4.923 -5.001 -9.951 1.00 0.00 C ATOM 963 O LYS A 68 4.350 -4.824 -11.026 1.00 0.00 O ATOM 964 CB LYS A 68 4.081 -6.831 -8.468 1.00 0.00 C ATOM 965 CG LYS A 68 3.848 -7.227 -7.019 1.00 0.00 C ATOM 966 CD LYS A 68 3.727 -8.735 -6.866 1.00 0.00 C ATOM 967 CE LYS A 68 4.995 -9.443 -7.315 1.00 0.00 C ATOM 968 NZ LYS A 68 4.886 -9.947 -8.712 1.00 0.00 N ATOM 0 H LYS A 68 2.040 -5.474 -8.736 1.00 0.00 H new ATOM 0 HA LYS A 68 4.630 -4.850 -7.839 1.00 0.00 H new ATOM 0 HB2 LYS A 68 3.287 -7.254 -9.084 1.00 0.00 H new ATOM 0 HB3 LYS A 68 5.018 -7.270 -8.810 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.671 -6.863 -6.404 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.940 -6.749 -6.652 1.00 0.00 H new ATOM 0 HD2 LYS A 68 3.521 -8.981 -5.824 1.00 0.00 H new ATOM 0 HD3 LYS A 68 2.881 -9.095 -7.452 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.839 -8.757 -7.242 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.202 -10.276 -6.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 4.752 -10.978 -8.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 4.073 -9.498 -9.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 5.756 -9.717 -9.233 1.00 0.00 H new ATOM 982 N LEU A 69 6.242 -4.931 -9.814 1.00 0.00 N ATOM 983 CA LEU A 69 7.113 -4.636 -10.945 1.00 0.00 C ATOM 984 C LEU A 69 8.335 -5.550 -10.945 1.00 0.00 C ATOM 985 O LEU A 69 8.507 -6.372 -11.844 1.00 0.00 O ATOM 986 CB LEU A 69 7.558 -3.172 -10.905 1.00 0.00 C ATOM 987 CG LEU A 69 6.471 -2.177 -10.493 1.00 0.00 C ATOM 988 CD1 LEU A 69 7.091 -0.854 -10.071 1.00 0.00 C ATOM 989 CD2 LEU A 69 5.483 -1.967 -11.631 1.00 0.00 C ATOM 0 H LEU A 69 6.732 -5.075 -8.931 1.00 0.00 H new ATOM 0 HA LEU A 69 6.549 -4.813 -11.861 1.00 0.00 H new ATOM 0 HB2 LEU A 69 8.394 -3.081 -10.212 1.00 0.00 H new ATOM 0 HB3 LEU A 69 7.929 -2.894 -11.891 1.00 0.00 H new ATOM 0 HG LEU A 69 5.931 -2.589 -9.641 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.303 -0.159 -9.781 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.759 -1.018 -9.225 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.656 -0.435 -10.903 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.717 -1.257 -11.321 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.009 -1.576 -12.502 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.015 -2.918 -11.886 1.00 0.00 H new ATOM 1001 N SER A 70 9.178 -5.401 -9.929 1.00 0.00 N ATOM 1002 CA SER A 70 10.383 -6.215 -9.811 1.00 0.00 C ATOM 1003 C SER A 70 11.132 -5.894 -8.522 1.00 0.00 C ATOM 1004 O SER A 70 11.064 -4.774 -8.014 1.00 0.00 O ATOM 1005 CB SER A 70 11.298 -5.986 -11.016 1.00 0.00 C ATOM 1006 OG SER A 70 11.115 -4.690 -11.558 1.00 0.00 O ATOM 0 H SER A 70 9.050 -4.725 -9.176 1.00 0.00 H new ATOM 0 HA SER A 70 10.083 -7.262 -9.785 1.00 0.00 H new ATOM 0 HB2 SER A 70 12.338 -6.114 -10.716 1.00 0.00 H new ATOM 0 HB3 SER A 70 11.092 -6.735 -11.780 1.00 0.00 H new ATOM 0 HG SER A 70 11.712 -4.569 -12.325 1.00 0.00 H new ATOM 1012 N ASP A 71 11.846 -6.883 -7.996 1.00 0.00 N ATOM 1013 CA ASP A 71 12.608 -6.706 -6.766 1.00 0.00 C ATOM 1014 C ASP A 71 11.690 -6.335 -5.605 1.00 0.00 C ATOM 1015 O ASP A 71 12.072 -5.573 -4.717 1.00 0.00 O ATOM 1016 CB ASP A 71 13.675 -5.626 -6.952 1.00 0.00 C ATOM 1017 CG ASP A 71 14.965 -5.955 -6.228 1.00 0.00 C ATOM 1018 OD1 ASP A 71 15.644 -6.922 -6.635 1.00 0.00 O ATOM 1019 OD2 ASP A 71 15.296 -5.247 -5.253 1.00 0.00 O ATOM 0 H ASP A 71 11.913 -7.816 -8.403 1.00 0.00 H new ATOM 0 HA ASP A 71 13.096 -7.652 -6.532 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.880 -5.502 -8.015 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.291 -4.673 -6.588 1.00 0.00 H new ATOM 1024 N SER A 72 10.478 -6.879 -5.620 1.00 0.00 N ATOM 1025 CA SER A 72 9.504 -6.604 -4.568 1.00 0.00 C ATOM 1026 C SER A 72 9.169 -5.117 -4.511 1.00 0.00 C ATOM 1027 O SER A 72 9.069 -4.533 -3.432 1.00 0.00 O ATOM 1028 CB SER A 72 10.041 -7.072 -3.214 1.00 0.00 C ATOM 1029 OG SER A 72 9.789 -8.452 -3.014 1.00 0.00 O ATOM 0 H SER A 72 10.146 -7.512 -6.348 1.00 0.00 H new ATOM 0 HA SER A 72 8.591 -7.153 -4.799 1.00 0.00 H new ATOM 0 HB2 SER A 72 11.113 -6.883 -3.160 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.575 -6.495 -2.415 1.00 0.00 H new ATOM 0 HG SER A 72 10.143 -8.726 -2.142 1.00 0.00 H new ATOM 1035 N ARG A 73 8.998 -4.509 -5.680 1.00 0.00 N ATOM 1036 CA ARG A 73 8.674 -3.090 -5.764 1.00 0.00 C ATOM 1037 C ARG A 73 7.310 -2.880 -6.413 1.00 0.00 C ATOM 1038 O ARG A 73 7.145 -3.088 -7.615 1.00 0.00 O ATOM 1039 CB ARG A 73 9.749 -2.346 -6.559 1.00 0.00 C ATOM 1040 CG ARG A 73 11.167 -2.709 -6.150 1.00 0.00 C ATOM 1041 CD ARG A 73 11.608 -1.935 -4.918 1.00 0.00 C ATOM 1042 NE ARG A 73 11.627 -0.494 -5.154 1.00 0.00 N ATOM 1043 CZ ARG A 73 12.530 0.122 -5.912 1.00 0.00 C ATOM 1044 NH1 ARG A 73 13.489 -0.573 -6.511 1.00 0.00 N ATOM 1045 NH2 ARG A 73 12.474 1.438 -6.074 1.00 0.00 N ATOM 0 H ARG A 73 9.078 -4.977 -6.583 1.00 0.00 H new ATOM 0 HA ARG A 73 8.639 -2.691 -4.750 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.619 -2.561 -7.620 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.606 -1.273 -6.432 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.226 -3.779 -5.949 1.00 0.00 H new ATOM 0 HG3 ARG A 73 11.849 -2.501 -6.975 1.00 0.00 H new ATOM 0 HD2 ARG A 73 10.935 -2.158 -4.090 1.00 0.00 H new ATOM 0 HD3 ARG A 73 12.602 -2.266 -4.619 1.00 0.00 H new ATOM 0 HE ARG A 73 10.905 0.074 -4.711 1.00 0.00 H new ATOM 0 HH11 ARG A 73 13.536 -1.585 -6.391 1.00 0.00 H new ATOM 0 HH12 ARG A 73 14.179 -0.095 -7.091 1.00 0.00 H new ATOM 0 HH21 ARG A 73 11.738 1.977 -5.617 1.00 0.00 H new ATOM 0 HH22 ARG A 73 13.167 1.910 -6.655 1.00 0.00 H new ATOM 1059 N ILE A 74 6.335 -2.467 -5.610 1.00 0.00 N ATOM 1060 CA ILE A 74 4.984 -2.229 -6.106 1.00 0.00 C ATOM 1061 C ILE A 74 4.749 -0.747 -6.374 1.00 0.00 C ATOM 1062 O ILE A 74 5.435 0.111 -5.818 1.00 0.00 O ATOM 1063 CB ILE A 74 3.922 -2.733 -5.110 1.00 0.00 C ATOM 1064 CG1 ILE A 74 4.185 -2.159 -3.717 1.00 0.00 C ATOM 1065 CG2 ILE A 74 3.913 -4.254 -5.070 1.00 0.00 C ATOM 1066 CD1 ILE A 74 2.928 -1.959 -2.899 1.00 0.00 C ATOM 0 H ILE A 74 6.455 -2.290 -4.613 1.00 0.00 H new ATOM 0 HA ILE A 74 4.889 -2.784 -7.039 1.00 0.00 H new ATOM 0 HB ILE A 74 2.942 -2.392 -5.443 1.00 0.00 H new ATOM 0 HG12 ILE A 74 4.857 -2.827 -3.178 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.699 -1.203 -3.818 1.00 0.00 H new ATOM 0 HG21 ILE A 74 3.158 -4.595 -4.362 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.682 -4.643 -6.062 1.00 0.00 H new ATOM 0 HG23 ILE A 74 4.893 -4.616 -4.757 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.190 -1.549 -1.923 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.263 -1.267 -3.416 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.424 -2.916 -2.767 1.00 0.00 H new ATOM 1078 N ALA A 75 3.777 -0.453 -7.232 1.00 0.00 N ATOM 1079 CA ALA A 75 3.451 0.926 -7.574 1.00 0.00 C ATOM 1080 C ALA A 75 2.049 1.294 -7.098 1.00 0.00 C ATOM 1081 O ALA A 75 1.055 0.773 -7.603 1.00 0.00 O ATOM 1082 CB ALA A 75 3.573 1.140 -9.076 1.00 0.00 C ATOM 0 H ALA A 75 3.202 -1.152 -7.703 1.00 0.00 H new ATOM 0 HA ALA A 75 4.162 1.578 -7.066 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.327 2.174 -9.317 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.594 0.927 -9.392 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.886 0.473 -9.596 1.00 0.00 H new ATOM 1088 N LEU A 76 1.979 2.194 -6.123 1.00 0.00 N ATOM 1089 CA LEU A 76 0.699 2.632 -5.579 1.00 0.00 C ATOM 1090 C LEU A 76 0.014 3.615 -6.523 1.00 0.00 C ATOM 1091 O LEU A 76 0.669 4.438 -7.161 1.00 0.00 O ATOM 1092 CB LEU A 76 0.901 3.280 -4.207 1.00 0.00 C ATOM 1093 CG LEU A 76 1.004 2.301 -3.037 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.690 2.958 -1.850 1.00 0.00 C ATOM 1095 CD2 LEU A 76 -0.375 1.793 -2.644 1.00 0.00 C ATOM 0 H LEU A 76 2.793 2.634 -5.694 1.00 0.00 H new ATOM 0 HA LEU A 76 0.059 1.756 -5.470 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.809 3.883 -4.237 1.00 0.00 H new ATOM 0 HB3 LEU A 76 0.072 3.962 -4.018 1.00 0.00 H new ATOM 0 HG LEU A 76 1.607 1.449 -3.353 1.00 0.00 H new ATOM 0 HD11 LEU A 76 1.754 2.246 -1.027 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.693 3.272 -2.138 1.00 0.00 H new ATOM 0 HD13 LEU A 76 1.115 3.828 -1.533 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -0.282 1.097 -1.810 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.002 2.634 -2.347 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -0.830 1.283 -3.493 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.310 3.524 -6.604 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.084 4.406 -7.470 1.00 0.00 C ATOM 1109 C LYS A 77 -3.262 5.012 -6.716 1.00 0.00 C ATOM 1110 O LYS A 77 -4.133 4.293 -6.224 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.587 3.639 -8.695 1.00 0.00 C ATOM 1112 CG LYS A 77 -3.127 4.539 -9.796 1.00 0.00 C ATOM 1113 CD LYS A 77 -4.085 3.790 -10.709 1.00 0.00 C ATOM 1114 CE LYS A 77 -5.529 4.193 -10.457 1.00 0.00 C ATOM 1115 NZ LYS A 77 -6.452 3.026 -10.522 1.00 0.00 N ATOM 0 H LYS A 77 -1.868 2.849 -6.081 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.432 5.215 -7.799 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.772 3.037 -9.096 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.371 2.948 -8.384 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -3.639 5.392 -9.351 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.298 4.935 -10.383 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.827 3.989 -11.749 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -3.974 2.717 -10.553 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -5.608 4.664 -9.477 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -5.832 4.937 -11.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -7.426 3.344 -10.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -6.396 2.591 -11.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -6.179 2.327 -9.802 1.00 0.00 H new ATOM 1129 N SER A 78 -3.284 6.337 -6.628 1.00 0.00 N ATOM 1130 CA SER A 78 -4.357 7.041 -5.934 1.00 0.00 C ATOM 1131 C SER A 78 -5.710 6.733 -6.567 1.00 0.00 C ATOM 1132 O SER A 78 -5.800 6.474 -7.767 1.00 0.00 O ATOM 1133 CB SER A 78 -4.103 8.550 -5.955 1.00 0.00 C ATOM 1134 OG SER A 78 -3.964 9.024 -7.283 1.00 0.00 O ATOM 0 H SER A 78 -2.571 6.946 -7.029 1.00 0.00 H new ATOM 0 HA SER A 78 -4.373 6.696 -4.900 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.927 9.068 -5.465 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.201 8.778 -5.387 1.00 0.00 H new ATOM 0 HG SER A 78 -3.342 8.447 -7.773 1.00 0.00 H new ATOM 1140 N GLY A 79 -6.758 6.761 -5.752 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.093 6.482 -6.250 1.00 0.00 C ATOM 1142 C GLY A 79 -8.507 7.427 -7.362 1.00 0.00 C ATOM 1143 O GLY A 79 -9.315 7.070 -8.220 1.00 0.00 O ATOM 0 H GLY A 79 -6.708 6.972 -4.755 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.134 5.456 -6.615 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -8.807 6.557 -5.429 1.00 0.00 H new ATOM 1147 N TYR A 80 -7.953 8.635 -7.346 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.268 9.634 -8.361 1.00 0.00 C ATOM 1149 C TYR A 80 -7.889 9.134 -9.751 1.00 0.00 C ATOM 1150 O TYR A 80 -8.604 9.375 -10.725 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.538 10.945 -8.061 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.143 11.725 -6.916 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -7.717 11.520 -5.610 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -9.139 12.667 -7.141 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -8.266 12.231 -4.559 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -9.693 13.382 -6.097 1.00 0.00 C ATOM 1157 CZ TYR A 80 -9.254 13.160 -4.808 1.00 0.00 C ATOM 1158 OH TYR A 80 -9.804 13.870 -3.766 1.00 0.00 O ATOM 0 H TYR A 80 -7.284 8.946 -6.642 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.343 9.812 -8.339 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.495 10.726 -7.830 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.543 11.567 -8.956 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -6.944 10.793 -5.412 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -9.486 12.843 -8.149 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -7.923 12.060 -3.549 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -10.466 14.111 -6.289 1.00 0.00 H new ATOM 0 HH TYR A 80 -9.132 13.995 -3.064 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.760 8.438 -9.837 1.00 0.00 N ATOM 1169 CA GLY A 81 -6.306 7.915 -11.112 1.00 0.00 C ATOM 1170 C GLY A 81 -4.886 8.335 -11.438 1.00 0.00 C ATOM 1171 O GLY A 81 -4.585 8.702 -12.574 1.00 0.00 O ATOM 0 H GLY A 81 -6.151 8.227 -9.046 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -6.365 6.827 -11.097 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.974 8.260 -11.901 1.00 0.00 H new ATOM 1175 N LYS A 82 -4.012 8.282 -10.439 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.615 8.660 -10.624 1.00 0.00 C ATOM 1177 C LYS A 82 -1.701 7.805 -9.755 1.00 0.00 C ATOM 1178 O LYS A 82 -2.155 7.137 -8.827 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.418 10.140 -10.290 1.00 0.00 C ATOM 1180 CG LYS A 82 -2.758 11.074 -11.441 1.00 0.00 C ATOM 1181 CD LYS A 82 -3.518 12.300 -10.961 1.00 0.00 C ATOM 1182 CE LYS A 82 -3.882 13.219 -12.116 1.00 0.00 C ATOM 1183 NZ LYS A 82 -2.954 14.379 -12.217 1.00 0.00 N ATOM 0 H LYS A 82 -4.246 7.981 -9.493 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.354 8.492 -11.669 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.038 10.396 -9.430 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.381 10.303 -9.995 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -1.841 11.386 -11.940 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.357 10.540 -12.179 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -4.425 11.987 -10.444 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.911 12.845 -10.238 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.861 12.655 -13.049 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -4.902 13.580 -11.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -3.370 15.104 -12.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -2.796 14.781 -11.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -2.046 14.064 -12.615 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.407 7.830 -10.063 1.00 0.00 N ATOM 1198 CA TYR A 83 0.572 7.056 -9.308 1.00 0.00 C ATOM 1199 C TYR A 83 1.247 7.920 -8.249 1.00 0.00 C ATOM 1200 O TYR A 83 1.561 9.085 -8.489 1.00 0.00 O ATOM 1201 CB TYR A 83 1.624 6.470 -10.251 1.00 0.00 C ATOM 1202 CG TYR A 83 1.132 5.279 -11.043 1.00 0.00 C ATOM 1203 CD1 TYR A 83 1.189 3.997 -10.512 1.00 0.00 C ATOM 1204 CD2 TYR A 83 0.610 5.437 -12.321 1.00 0.00 C ATOM 1205 CE1 TYR A 83 0.741 2.906 -11.232 1.00 0.00 C ATOM 1206 CE2 TYR A 83 0.159 4.351 -13.046 1.00 0.00 C ATOM 1207 CZ TYR A 83 0.227 3.088 -12.498 1.00 0.00 C ATOM 1208 OH TYR A 83 -0.220 2.004 -13.218 1.00 0.00 O ATOM 0 H TYR A 83 -0.013 8.377 -10.829 1.00 0.00 H new ATOM 0 HA TYR A 83 0.048 6.242 -8.807 1.00 0.00 H new ATOM 0 HB2 TYR A 83 1.952 7.246 -10.943 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.496 6.173 -9.669 1.00 0.00 H new ATOM 0 HD1 TYR A 83 1.590 3.850 -9.520 1.00 0.00 H new ATOM 0 HD2 TYR A 83 0.556 6.425 -12.755 1.00 0.00 H new ATOM 0 HE1 TYR A 83 0.793 1.915 -10.805 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -0.245 4.491 -14.038 1.00 0.00 H new ATOM 0 HH TYR A 83 -0.552 2.305 -14.090 1.00 0.00 H new ATOM 1218 N LEU A 84 1.468 7.339 -7.073 1.00 0.00 N ATOM 1219 CA LEU A 84 2.107 8.056 -5.975 1.00 0.00 C ATOM 1220 C LEU A 84 3.603 8.215 -6.227 1.00 0.00 C ATOM 1221 O LEU A 84 4.366 7.254 -6.126 1.00 0.00 O ATOM 1222 CB LEU A 84 1.876 7.318 -4.654 1.00 0.00 C ATOM 1223 CG LEU A 84 0.409 7.121 -4.271 1.00 0.00 C ATOM 1224 CD1 LEU A 84 0.299 6.443 -2.915 1.00 0.00 C ATOM 1225 CD2 LEU A 84 -0.323 8.455 -4.265 1.00 0.00 C ATOM 0 H LEU A 84 1.214 6.375 -6.857 1.00 0.00 H new ATOM 0 HA LEU A 84 1.660 9.048 -5.912 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.355 6.341 -4.713 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.373 7.869 -3.856 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.059 6.476 -5.015 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.752 6.311 -2.658 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.788 5.470 -2.954 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.782 7.062 -2.159 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.366 8.297 -3.990 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.145 9.124 -3.542 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.273 8.902 -5.258 1.00 0.00 H new ATOM 1237 N GLY A 85 4.017 9.434 -6.554 1.00 0.00 N ATOM 1238 CA GLY A 85 5.420 9.698 -6.815 1.00 0.00 C ATOM 1239 C GLY A 85 6.016 10.689 -5.836 1.00 0.00 C ATOM 1240 O GLY A 85 5.484 11.784 -5.650 1.00 0.00 O ATOM 0 H GLY A 85 3.405 10.245 -6.643 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.978 8.763 -6.765 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.532 10.082 -7.829 1.00 0.00 H new ATOM 1244 N ILE A 86 7.123 10.306 -5.208 1.00 0.00 N ATOM 1245 CA ILE A 86 7.791 11.168 -4.242 1.00 0.00 C ATOM 1246 C ILE A 86 8.486 12.335 -4.936 1.00 0.00 C ATOM 1247 O ILE A 86 9.182 12.151 -5.935 1.00 0.00 O ATOM 1248 CB ILE A 86 8.828 10.387 -3.413 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.751 9.586 -4.333 1.00 0.00 C ATOM 1250 CG2 ILE A 86 8.130 9.468 -2.422 1.00 0.00 C ATOM 1251 CD1 ILE A 86 11.126 9.347 -3.749 1.00 0.00 C ATOM 0 H ILE A 86 7.576 9.403 -5.352 1.00 0.00 H new ATOM 0 HA ILE A 86 7.019 11.552 -3.575 1.00 0.00 H new ATOM 0 HB ILE A 86 9.434 11.099 -2.853 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.286 8.625 -4.553 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.854 10.115 -5.281 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.876 8.923 -1.844 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.511 10.062 -1.749 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.502 8.760 -2.963 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.726 8.773 -4.455 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.610 10.304 -3.555 1.00 0.00 H new ATOM 0 HD13 ILE A 86 11.033 8.791 -2.816 1.00 0.00 H new ATOM 1263 N ASN A 87 8.294 13.536 -4.400 1.00 0.00 N ATOM 1264 CA ASN A 87 8.902 14.733 -4.969 1.00 0.00 C ATOM 1265 C ASN A 87 10.372 14.836 -4.574 1.00 0.00 C ATOM 1266 O ASN A 87 10.863 14.051 -3.761 1.00 0.00 O ATOM 1267 CB ASN A 87 8.149 15.981 -4.506 1.00 0.00 C ATOM 1268 CG ASN A 87 7.063 16.395 -5.480 1.00 0.00 C ATOM 1269 OD1 ASN A 87 7.081 16.006 -6.648 1.00 0.00 O ATOM 1270 ND2 ASN A 87 6.111 17.189 -5.003 1.00 0.00 N ATOM 0 H ASN A 87 7.722 13.706 -3.573 1.00 0.00 H new ATOM 0 HA ASN A 87 8.840 14.662 -6.055 1.00 0.00 H new ATOM 0 HB2 ASN A 87 7.704 15.792 -3.529 1.00 0.00 H new ATOM 0 HB3 ASN A 87 8.854 16.803 -4.382 1.00 0.00 H new ATOM 0 HD21 ASN A 87 5.355 17.501 -5.612 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.136 17.487 -4.028 1.00 0.00 H new ATOM 1277 N SER A 88 11.069 15.807 -5.155 1.00 0.00 N ATOM 1278 CA SER A 88 12.483 16.012 -4.864 1.00 0.00 C ATOM 1279 C SER A 88 12.696 16.313 -3.384 1.00 0.00 C ATOM 1280 O SER A 88 13.728 15.964 -2.812 1.00 0.00 O ATOM 1281 CB SER A 88 13.039 17.156 -5.714 1.00 0.00 C ATOM 1282 OG SER A 88 14.455 17.176 -5.680 1.00 0.00 O ATOM 0 H SER A 88 10.678 16.464 -5.830 1.00 0.00 H new ATOM 0 HA SER A 88 13.016 15.093 -5.110 1.00 0.00 H new ATOM 0 HB2 SER A 88 12.699 17.047 -6.744 1.00 0.00 H new ATOM 0 HB3 SER A 88 12.650 18.107 -5.349 1.00 0.00 H new ATOM 0 HG SER A 88 14.785 17.915 -6.232 1.00 0.00 H new ATOM 1288 N ASP A 89 11.713 16.963 -2.769 1.00 0.00 N ATOM 1289 CA ASP A 89 11.793 17.311 -1.355 1.00 0.00 C ATOM 1290 C ASP A 89 11.493 16.098 -0.480 1.00 0.00 C ATOM 1291 O ASP A 89 12.087 15.926 0.585 1.00 0.00 O ATOM 1292 CB ASP A 89 10.818 18.447 -1.032 1.00 0.00 C ATOM 1293 CG ASP A 89 11.528 19.712 -0.595 1.00 0.00 C ATOM 1294 OD1 ASP A 89 12.611 20.005 -1.145 1.00 0.00 O ATOM 1295 OD2 ASP A 89 11.003 20.410 0.297 1.00 0.00 O ATOM 0 H ASP A 89 10.852 17.259 -3.228 1.00 0.00 H new ATOM 0 HA ASP A 89 12.809 17.645 -1.143 1.00 0.00 H new ATOM 0 HB2 ASP A 89 10.209 18.660 -1.911 1.00 0.00 H new ATOM 0 HB3 ASP A 89 10.138 18.125 -0.244 1.00 0.00 H new ATOM 1300 N GLY A 90 10.569 15.259 -0.936 1.00 0.00 N ATOM 1301 CA GLY A 90 10.207 14.072 -0.184 1.00 0.00 C ATOM 1302 C GLY A 90 8.749 14.070 0.232 1.00 0.00 C ATOM 1303 O GLY A 90 8.409 13.607 1.321 1.00 0.00 O ATOM 0 H GLY A 90 10.064 15.380 -1.814 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.410 13.187 -0.788 1.00 0.00 H new ATOM 0 HA3 GLY A 90 10.835 14.003 0.704 1.00 0.00 H new ATOM 1307 N LEU A 91 7.887 14.590 -0.635 1.00 0.00 N ATOM 1308 CA LEU A 91 6.458 14.647 -0.351 1.00 0.00 C ATOM 1309 C LEU A 91 5.692 13.646 -1.210 1.00 0.00 C ATOM 1310 O LEU A 91 5.972 13.491 -2.399 1.00 0.00 O ATOM 1311 CB LEU A 91 5.924 16.059 -0.596 1.00 0.00 C ATOM 1312 CG LEU A 91 4.612 16.388 0.119 1.00 0.00 C ATOM 1313 CD1 LEU A 91 4.887 16.999 1.484 1.00 0.00 C ATOM 1314 CD2 LEU A 91 3.765 17.328 -0.726 1.00 0.00 C ATOM 0 H LEU A 91 8.153 14.978 -1.540 1.00 0.00 H new ATOM 0 HA LEU A 91 6.311 14.387 0.697 1.00 0.00 H new ATOM 0 HB2 LEU A 91 6.681 16.777 -0.282 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.780 16.196 -1.668 1.00 0.00 H new ATOM 0 HG LEU A 91 4.057 15.461 0.263 1.00 0.00 H new ATOM 0 HD11 LEU A 91 3.942 17.226 1.978 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.453 16.293 2.091 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.463 17.916 1.363 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.836 17.551 -0.202 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.314 18.253 -0.902 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.538 16.854 -1.681 1.00 0.00 H new ATOM 1326 N VAL A 92 4.725 12.968 -0.599 1.00 0.00 N ATOM 1327 CA VAL A 92 3.918 11.981 -1.309 1.00 0.00 C ATOM 1328 C VAL A 92 2.838 12.657 -2.147 1.00 0.00 C ATOM 1329 O VAL A 92 1.826 13.117 -1.617 1.00 0.00 O ATOM 1330 CB VAL A 92 3.253 10.994 -0.332 1.00 0.00 C ATOM 1331 CG1 VAL A 92 2.581 9.861 -1.093 1.00 0.00 C ATOM 1332 CG2 VAL A 92 4.274 10.450 0.655 1.00 0.00 C ATOM 0 H VAL A 92 4.481 13.084 0.385 1.00 0.00 H new ATOM 0 HA VAL A 92 4.592 11.431 -1.966 1.00 0.00 H new ATOM 0 HB VAL A 92 2.487 11.528 0.230 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.116 9.173 -0.386 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.819 10.270 -1.756 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.326 9.327 -1.683 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.786 9.754 1.337 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.064 9.931 0.112 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.705 11.274 1.224 1.00 0.00 H new ATOM 1342 N VAL A 93 3.060 12.713 -3.456 1.00 0.00 N ATOM 1343 CA VAL A 93 2.105 13.333 -4.367 1.00 0.00 C ATOM 1344 C VAL A 93 1.652 12.350 -5.441 1.00 0.00 C ATOM 1345 O VAL A 93 2.140 11.222 -5.509 1.00 0.00 O ATOM 1346 CB VAL A 93 2.706 14.577 -5.046 1.00 0.00 C ATOM 1347 CG1 VAL A 93 2.978 15.668 -4.022 1.00 0.00 C ATOM 1348 CG2 VAL A 93 3.976 14.214 -5.800 1.00 0.00 C ATOM 0 H VAL A 93 3.893 12.337 -3.910 1.00 0.00 H new ATOM 0 HA VAL A 93 1.245 13.634 -3.769 1.00 0.00 H new ATOM 0 HB VAL A 93 1.982 14.960 -5.765 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.403 16.539 -4.522 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.045 15.949 -3.533 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.682 15.299 -3.276 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.386 15.106 -6.273 1.00 0.00 H new ATOM 0 HG22 VAL A 93 4.708 13.804 -5.104 1.00 0.00 H new ATOM 0 HG23 VAL A 93 3.746 13.471 -6.564 1.00 0.00 H new ATOM 1358 N GLY A 94 0.718 12.787 -6.278 1.00 0.00 N ATOM 1359 CA GLY A 94 0.215 11.934 -7.339 1.00 0.00 C ATOM 1360 C GLY A 94 -0.356 12.724 -8.499 1.00 0.00 C ATOM 1361 O GLY A 94 -1.533 13.089 -8.493 1.00 0.00 O ATOM 0 H GLY A 94 0.300 13.717 -6.241 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.021 11.296 -7.700 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.556 11.277 -6.937 1.00 0.00 H new ATOM 1365 N ARG A 95 0.478 12.991 -9.499 1.00 0.00 N ATOM 1366 CA ARG A 95 0.049 13.744 -10.673 1.00 0.00 C ATOM 1367 C ARG A 95 0.685 13.181 -11.940 1.00 0.00 C ATOM 1368 O ARG A 95 1.022 13.926 -12.862 1.00 0.00 O ATOM 1369 CB ARG A 95 0.414 15.221 -10.518 1.00 0.00 C ATOM 1370 CG ARG A 95 -0.119 15.849 -9.240 1.00 0.00 C ATOM 1371 CD ARG A 95 -0.702 17.230 -9.497 1.00 0.00 C ATOM 1372 NE ARG A 95 0.297 18.157 -10.026 1.00 0.00 N ATOM 1373 CZ ARG A 95 0.156 19.480 -10.022 1.00 0.00 C ATOM 1374 NH1 ARG A 95 -0.937 20.036 -9.516 1.00 0.00 N ATOM 1375 NH2 ARG A 95 1.112 20.250 -10.524 1.00 0.00 N ATOM 0 H ARG A 95 1.455 12.697 -9.520 1.00 0.00 H new ATOM 0 HA ARG A 95 -1.034 13.652 -10.759 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.499 15.322 -10.538 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.027 15.774 -11.374 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -0.885 15.204 -8.809 1.00 0.00 H new ATOM 0 HG3 ARG A 95 0.685 15.923 -8.507 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -1.530 17.149 -10.201 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -1.111 17.629 -8.569 1.00 0.00 H new ATOM 0 HE ARG A 95 1.152 17.767 -10.421 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -1.675 19.449 -9.127 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -1.040 21.051 -9.516 1.00 0.00 H new ATOM 0 HH21 ARG A 95 1.955 19.828 -10.913 1.00 0.00 H new ATOM 0 HH22 ARG A 95 1.004 21.264 -10.521 1.00 0.00 H new ATOM 1389 N SER A 96 0.846 11.863 -11.981 1.00 0.00 N ATOM 1390 CA SER A 96 1.441 11.199 -13.135 1.00 0.00 C ATOM 1391 C SER A 96 0.552 10.064 -13.630 1.00 0.00 C ATOM 1392 O SER A 96 -0.305 9.568 -12.897 1.00 0.00 O ATOM 1393 CB SER A 96 2.828 10.659 -12.781 1.00 0.00 C ATOM 1394 OG SER A 96 3.725 10.805 -13.868 1.00 0.00 O ATOM 0 H SER A 96 0.572 11.233 -11.227 1.00 0.00 H new ATOM 0 HA SER A 96 1.538 11.934 -13.934 1.00 0.00 H new ATOM 0 HB2 SER A 96 3.217 11.189 -11.911 1.00 0.00 H new ATOM 0 HB3 SER A 96 2.753 9.607 -12.506 1.00 0.00 H new ATOM 0 HG SER A 96 4.605 10.454 -13.616 1.00 0.00 H new ATOM 1400 N ASP A 97 0.759 9.656 -14.877 1.00 0.00 N ATOM 1401 CA ASP A 97 -0.025 8.578 -15.470 1.00 0.00 C ATOM 1402 C ASP A 97 0.879 7.435 -15.923 1.00 0.00 C ATOM 1403 O ASP A 97 0.584 6.749 -16.902 1.00 0.00 O ATOM 1404 CB ASP A 97 -0.835 9.102 -16.657 1.00 0.00 C ATOM 1405 CG ASP A 97 -2.126 9.770 -16.224 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -2.729 9.313 -15.232 1.00 0.00 O ATOM 1407 OD2 ASP A 97 -2.534 10.753 -16.880 1.00 0.00 O ATOM 0 H ASP A 97 1.463 10.055 -15.497 1.00 0.00 H new ATOM 0 HA ASP A 97 -0.709 8.199 -14.711 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -0.231 9.814 -17.220 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -1.064 8.276 -17.330 1.00 0.00 H new ATOM 1412 N ALA A 98 1.979 7.236 -15.205 1.00 0.00 N ATOM 1413 CA ALA A 98 2.924 6.176 -15.534 1.00 0.00 C ATOM 1414 C ALA A 98 3.674 5.704 -14.293 1.00 0.00 C ATOM 1415 O ALA A 98 3.450 6.205 -13.192 1.00 0.00 O ATOM 1416 CB ALA A 98 3.904 6.654 -16.595 1.00 0.00 C ATOM 0 H ALA A 98 2.238 7.795 -14.392 1.00 0.00 H new ATOM 0 HA ALA A 98 2.361 5.331 -15.929 1.00 0.00 H new ATOM 0 HB1 ALA A 98 4.604 5.853 -16.831 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.357 6.935 -17.495 1.00 0.00 H new ATOM 0 HB3 ALA A 98 4.454 7.517 -16.220 1.00 0.00 H new ATOM 1422 N ILE A 99 4.567 4.737 -14.480 1.00 0.00 N ATOM 1423 CA ILE A 99 5.351 4.196 -13.376 1.00 0.00 C ATOM 1424 C ILE A 99 6.819 4.589 -13.503 1.00 0.00 C ATOM 1425 O ILE A 99 7.580 3.954 -14.234 1.00 0.00 O ATOM 1426 CB ILE A 99 5.246 2.660 -13.310 1.00 0.00 C ATOM 1427 CG1 ILE A 99 3.780 2.222 -13.361 1.00 0.00 C ATOM 1428 CG2 ILE A 99 5.918 2.136 -12.050 1.00 0.00 C ATOM 1429 CD1 ILE A 99 3.518 1.106 -14.349 1.00 0.00 C ATOM 0 H ILE A 99 4.765 4.312 -15.386 1.00 0.00 H new ATOM 0 HA ILE A 99 4.941 4.619 -12.459 1.00 0.00 H new ATOM 0 HB ILE A 99 5.760 2.239 -14.174 1.00 0.00 H new ATOM 0 HG12 ILE A 99 3.471 1.897 -12.367 1.00 0.00 H new ATOM 0 HG13 ILE A 99 3.161 3.081 -13.622 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.835 1.050 -12.018 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.970 2.420 -12.054 1.00 0.00 H new ATOM 0 HG23 ILE A 99 5.431 2.563 -11.173 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.460 0.846 -14.332 1.00 0.00 H new ATOM 0 HD12 ILE A 99 3.795 1.434 -15.351 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.110 0.232 -14.077 1.00 0.00 H new ATOM 1441 N GLY A 100 7.211 5.637 -12.787 1.00 0.00 N ATOM 1442 CA GLY A 100 8.587 6.095 -12.834 1.00 0.00 C ATOM 1443 C GLY A 100 9.368 5.719 -11.589 1.00 0.00 C ATOM 1444 O GLY A 100 8.800 5.186 -10.635 1.00 0.00 O ATOM 0 H GLY A 100 6.600 6.178 -12.175 1.00 0.00 H new ATOM 0 HA2 GLY A 100 9.078 5.670 -13.709 1.00 0.00 H new ATOM 0 HA3 GLY A 100 8.602 7.178 -12.955 1.00 0.00 H new ATOM 1448 N PRO A 101 10.685 5.988 -11.565 1.00 0.00 N ATOM 1449 CA PRO A 101 11.536 5.668 -10.414 1.00 0.00 C ATOM 1450 C PRO A 101 10.979 6.226 -9.109 1.00 0.00 C ATOM 1451 O PRO A 101 10.841 5.503 -8.122 1.00 0.00 O ATOM 1452 CB PRO A 101 12.868 6.341 -10.757 1.00 0.00 C ATOM 1453 CG PRO A 101 12.877 6.425 -12.244 1.00 0.00 C ATOM 1454 CD PRO A 101 11.445 6.623 -12.658 1.00 0.00 C ATOM 0 HA PRO A 101 11.615 4.593 -10.254 1.00 0.00 H new ATOM 0 HB2 PRO A 101 12.940 7.330 -10.304 1.00 0.00 H new ATOM 0 HB3 PRO A 101 13.712 5.759 -10.388 1.00 0.00 H new ATOM 0 HG2 PRO A 101 13.499 7.253 -12.584 1.00 0.00 H new ATOM 0 HG3 PRO A 101 13.288 5.516 -12.683 1.00 0.00 H new ATOM 0 HD2 PRO A 101 11.198 7.680 -12.759 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.236 6.154 -13.619 1.00 0.00 H new ATOM 1462 N ARG A 102 10.661 7.516 -9.111 1.00 0.00 N ATOM 1463 CA ARG A 102 10.119 8.172 -7.926 1.00 0.00 C ATOM 1464 C ARG A 102 8.813 7.516 -7.489 1.00 0.00 C ATOM 1465 O ARG A 102 8.469 7.523 -6.306 1.00 0.00 O ATOM 1466 CB ARG A 102 9.888 9.659 -8.202 1.00 0.00 C ATOM 1467 CG ARG A 102 11.168 10.479 -8.222 1.00 0.00 C ATOM 1468 CD ARG A 102 10.969 11.807 -8.935 1.00 0.00 C ATOM 1469 NE ARG A 102 11.499 11.782 -10.296 1.00 0.00 N ATOM 1470 CZ ARG A 102 11.773 12.875 -11.005 1.00 0.00 C ATOM 1471 NH1 ARG A 102 11.568 14.080 -10.487 1.00 0.00 N ATOM 1472 NH2 ARG A 102 12.254 12.764 -12.235 1.00 0.00 N ATOM 0 H ARG A 102 10.769 8.128 -9.920 1.00 0.00 H new ATOM 0 HA ARG A 102 10.845 8.067 -7.120 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.381 9.768 -9.161 1.00 0.00 H new ATOM 0 HB3 ARG A 102 9.220 10.062 -7.441 1.00 0.00 H new ATOM 0 HG2 ARG A 102 11.501 10.660 -7.200 1.00 0.00 H new ATOM 0 HG3 ARG A 102 11.956 9.913 -8.719 1.00 0.00 H new ATOM 0 HD2 ARG A 102 9.906 12.047 -8.964 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.459 12.599 -8.369 1.00 0.00 H new ATOM 0 HE ARG A 102 11.669 10.874 -10.728 1.00 0.00 H new ATOM 0 HH11 ARG A 102 11.199 14.172 -9.541 1.00 0.00 H new ATOM 0 HH12 ARG A 102 11.780 14.914 -11.035 1.00 0.00 H new ATOM 0 HH21 ARG A 102 12.414 11.841 -12.639 1.00 0.00 H new ATOM 0 HH22 ARG A 102 12.464 13.602 -12.778 1.00 0.00 H new ATOM 1486 N GLU A 103 8.087 6.952 -8.448 1.00 0.00 N ATOM 1487 CA GLU A 103 6.817 6.294 -8.161 1.00 0.00 C ATOM 1488 C GLU A 103 7.038 4.914 -7.548 1.00 0.00 C ATOM 1489 O GLU A 103 6.184 4.402 -6.825 1.00 0.00 O ATOM 1490 CB GLU A 103 5.984 6.168 -9.439 1.00 0.00 C ATOM 1491 CG GLU A 103 5.311 7.465 -9.856 1.00 0.00 C ATOM 1492 CD GLU A 103 6.161 8.282 -10.809 1.00 0.00 C ATOM 1493 OE1 GLU A 103 7.327 8.573 -10.465 1.00 0.00 O ATOM 1494 OE2 GLU A 103 5.662 8.632 -11.900 1.00 0.00 O ATOM 0 H GLU A 103 8.356 6.937 -9.432 1.00 0.00 H new ATOM 0 HA GLU A 103 6.277 6.907 -7.439 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.627 5.825 -10.250 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.221 5.403 -9.292 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.356 7.239 -10.330 1.00 0.00 H new ATOM 0 HG3 GLU A 103 5.094 8.059 -8.968 1.00 0.00 H new ATOM 1501 N GLN A 104 8.188 4.314 -7.843 1.00 0.00 N ATOM 1502 CA GLN A 104 8.517 2.991 -7.320 1.00 0.00 C ATOM 1503 C GLN A 104 8.491 2.981 -5.795 1.00 0.00 C ATOM 1504 O GLN A 104 8.823 3.977 -5.151 1.00 0.00 O ATOM 1505 CB GLN A 104 9.893 2.550 -7.820 1.00 0.00 C ATOM 1506 CG GLN A 104 9.933 2.252 -9.311 1.00 0.00 C ATOM 1507 CD GLN A 104 11.346 2.167 -9.850 1.00 0.00 C ATOM 1508 OE1 GLN A 104 12.302 1.990 -9.095 1.00 0.00 O ATOM 1509 NE2 GLN A 104 11.486 2.293 -11.165 1.00 0.00 N ATOM 0 H GLN A 104 8.907 4.722 -8.441 1.00 0.00 H new ATOM 0 HA GLN A 104 7.763 2.291 -7.681 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.619 3.331 -7.595 1.00 0.00 H new ATOM 0 HB3 GLN A 104 10.201 1.660 -7.272 1.00 0.00 H new ATOM 0 HG2 GLN A 104 9.417 1.311 -9.504 1.00 0.00 H new ATOM 0 HG3 GLN A 104 9.389 3.029 -9.848 1.00 0.00 H new ATOM 0 HE21 GLN A 104 10.666 2.439 -11.754 1.00 0.00 H new ATOM 0 HE22 GLN A 104 12.414 2.244 -11.586 1.00 0.00 H new ATOM 1518 N TRP A 105 8.097 1.848 -5.223 1.00 0.00 N ATOM 1519 CA TRP A 105 8.028 1.704 -3.773 1.00 0.00 C ATOM 1520 C TRP A 105 8.720 0.422 -3.323 1.00 0.00 C ATOM 1521 O TRP A 105 9.242 -0.334 -4.142 1.00 0.00 O ATOM 1522 CB TRP A 105 6.571 1.702 -3.307 1.00 0.00 C ATOM 1523 CG TRP A 105 5.850 2.981 -3.606 1.00 0.00 C ATOM 1524 CD1 TRP A 105 5.008 3.220 -4.654 1.00 0.00 C ATOM 1525 CD2 TRP A 105 5.906 4.196 -2.849 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.538 4.510 -4.596 1.00 0.00 N ATOM 1527 CE2 TRP A 105 5.074 5.129 -3.496 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.577 4.584 -1.686 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 4.897 6.425 -3.019 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.401 5.872 -1.214 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.566 6.778 -1.880 1.00 0.00 C ATOM 0 H TRP A 105 7.820 1.015 -5.742 1.00 0.00 H new ATOM 0 HA TRP A 105 8.543 2.553 -3.323 1.00 0.00 H new ATOM 0 HB2 TRP A 105 6.045 0.876 -3.786 1.00 0.00 H new ATOM 0 HB3 TRP A 105 6.541 1.519 -2.233 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.749 2.501 -5.417 1.00 0.00 H new ATOM 0 HE1 TRP A 105 3.895 4.937 -5.263 1.00 0.00 H new ATOM 0 HE3 TRP A 105 7.221 3.891 -1.165 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.254 7.126 -3.530 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.916 6.184 -0.317 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.448 7.776 -1.486 1.00 0.00 H new ATOM 1542 N GLU A 106 8.720 0.182 -2.015 1.00 0.00 N ATOM 1543 CA GLU A 106 9.349 -1.010 -1.458 1.00 0.00 C ATOM 1544 C GLU A 106 8.843 -1.287 -0.044 1.00 0.00 C ATOM 1545 O GLU A 106 9.413 -0.804 0.934 1.00 0.00 O ATOM 1546 CB GLU A 106 10.870 -0.849 -1.443 1.00 0.00 C ATOM 1547 CG GLU A 106 11.621 -2.168 -1.364 1.00 0.00 C ATOM 1548 CD GLU A 106 12.881 -2.071 -0.526 1.00 0.00 C ATOM 1549 OE1 GLU A 106 13.568 -1.031 -0.606 1.00 0.00 O ATOM 1550 OE2 GLU A 106 13.180 -3.036 0.208 1.00 0.00 O ATOM 0 H GLU A 106 8.292 0.796 -1.322 1.00 0.00 H new ATOM 0 HA GLU A 106 9.084 -1.857 -2.091 1.00 0.00 H new ATOM 0 HB2 GLU A 106 11.180 -0.318 -2.343 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.153 -0.228 -0.593 1.00 0.00 H new ATOM 0 HG2 GLU A 106 10.966 -2.930 -0.942 1.00 0.00 H new ATOM 0 HG3 GLU A 106 11.883 -2.494 -2.371 1.00 0.00 H new ATOM 1557 N PRO A 107 7.760 -2.075 0.084 1.00 0.00 N ATOM 1558 CA PRO A 107 7.181 -2.415 1.389 1.00 0.00 C ATOM 1559 C PRO A 107 8.081 -3.346 2.195 1.00 0.00 C ATOM 1560 O PRO A 107 9.065 -3.874 1.678 1.00 0.00 O ATOM 1561 CB PRO A 107 5.872 -3.116 1.025 1.00 0.00 C ATOM 1562 CG PRO A 107 6.102 -3.669 -0.338 1.00 0.00 C ATOM 1563 CD PRO A 107 7.018 -2.697 -1.029 1.00 0.00 C ATOM 0 HA PRO A 107 7.046 -1.535 2.018 1.00 0.00 H new ATOM 0 HB2 PRO A 107 5.635 -3.906 1.738 1.00 0.00 H new ATOM 0 HB3 PRO A 107 5.034 -2.418 1.033 1.00 0.00 H new ATOM 0 HG2 PRO A 107 6.552 -4.660 -0.286 1.00 0.00 H new ATOM 0 HG3 PRO A 107 5.162 -3.773 -0.881 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.687 -3.202 -1.726 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.460 -1.957 -1.603 1.00 0.00 H new ATOM 1571 N VAL A 108 7.736 -3.545 3.462 1.00 0.00 N ATOM 1572 CA VAL A 108 8.515 -4.412 4.338 1.00 0.00 C ATOM 1573 C VAL A 108 7.619 -5.120 5.350 1.00 0.00 C ATOM 1574 O VAL A 108 6.522 -4.654 5.657 1.00 0.00 O ATOM 1575 CB VAL A 108 9.598 -3.623 5.095 1.00 0.00 C ATOM 1576 CG1 VAL A 108 10.525 -4.568 5.844 1.00 0.00 C ATOM 1577 CG2 VAL A 108 10.384 -2.742 4.135 1.00 0.00 C ATOM 0 H VAL A 108 6.923 -3.118 3.905 1.00 0.00 H new ATOM 0 HA VAL A 108 8.996 -5.153 3.700 1.00 0.00 H new ATOM 0 HB VAL A 108 9.108 -2.979 5.826 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.283 -3.991 6.373 1.00 0.00 H new ATOM 0 HG12 VAL A 108 9.948 -5.151 6.561 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.009 -5.240 5.136 1.00 0.00 H new ATOM 0 HG21 VAL A 108 11.145 -2.191 4.687 1.00 0.00 H new ATOM 0 HG22 VAL A 108 10.863 -3.364 3.379 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.707 -2.038 3.650 1.00 0.00 H new ATOM 1587 N PHE A 109 8.097 -6.249 5.865 1.00 0.00 N ATOM 1588 CA PHE A 109 7.342 -7.023 6.844 1.00 0.00 C ATOM 1589 C PHE A 109 8.280 -7.763 7.792 1.00 0.00 C ATOM 1590 O PHE A 109 9.016 -8.659 7.377 1.00 0.00 O ATOM 1591 CB PHE A 109 6.422 -8.021 6.137 1.00 0.00 C ATOM 1592 CG PHE A 109 5.343 -7.371 5.319 1.00 0.00 C ATOM 1593 CD1 PHE A 109 5.607 -6.908 4.040 1.00 0.00 C ATOM 1594 CD2 PHE A 109 4.063 -7.223 5.831 1.00 0.00 C ATOM 1595 CE1 PHE A 109 4.616 -6.310 3.285 1.00 0.00 C ATOM 1596 CE2 PHE A 109 3.068 -6.625 5.081 1.00 0.00 C ATOM 1597 CZ PHE A 109 3.345 -6.168 3.807 1.00 0.00 C ATOM 0 H PHE A 109 9.003 -6.648 5.621 1.00 0.00 H new ATOM 0 HA PHE A 109 6.735 -6.331 7.428 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.022 -8.659 5.489 1.00 0.00 H new ATOM 0 HB3 PHE A 109 5.961 -8.668 6.883 1.00 0.00 H new ATOM 0 HD1 PHE A 109 6.600 -7.016 3.628 1.00 0.00 H new ATOM 0 HD2 PHE A 109 3.841 -7.579 6.826 1.00 0.00 H new ATOM 0 HE1 PHE A 109 4.835 -5.954 2.289 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.075 -6.515 5.491 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.569 -5.700 3.220 1.00 0.00 H new ATOM 1607 N GLN A 110 8.250 -7.384 9.066 1.00 0.00 N ATOM 1608 CA GLN A 110 9.100 -8.014 10.069 1.00 0.00 C ATOM 1609 C GLN A 110 8.393 -8.082 11.419 1.00 0.00 C ATOM 1610 O GLN A 110 7.815 -7.098 11.879 1.00 0.00 O ATOM 1611 CB GLN A 110 10.416 -7.246 10.208 1.00 0.00 C ATOM 1612 CG GLN A 110 11.405 -7.900 11.160 1.00 0.00 C ATOM 1613 CD GLN A 110 12.382 -8.815 10.446 1.00 0.00 C ATOM 1614 OE1 GLN A 110 12.227 -9.104 9.260 1.00 0.00 O ATOM 1615 NE2 GLN A 110 13.396 -9.277 11.169 1.00 0.00 N ATOM 0 H GLN A 110 7.647 -6.645 9.427 1.00 0.00 H new ATOM 0 HA GLN A 110 9.313 -9.031 9.740 1.00 0.00 H new ATOM 0 HB2 GLN A 110 10.878 -7.153 9.225 1.00 0.00 H new ATOM 0 HB3 GLN A 110 10.202 -6.236 10.557 1.00 0.00 H new ATOM 0 HG2 GLN A 110 11.959 -7.126 11.691 1.00 0.00 H new ATOM 0 HG3 GLN A 110 10.858 -8.472 11.910 1.00 0.00 H new ATOM 0 HE21 GLN A 110 13.486 -9.011 12.150 1.00 0.00 H new ATOM 0 HE22 GLN A 110 14.085 -9.897 10.743 1.00 0.00 H new ATOM 1624 N ASP A 111 8.445 -9.253 12.049 1.00 0.00 N ATOM 1625 CA ASP A 111 7.811 -9.452 13.348 1.00 0.00 C ATOM 1626 C ASP A 111 6.316 -9.149 13.282 1.00 0.00 C ATOM 1627 O ASP A 111 5.699 -8.807 14.290 1.00 0.00 O ATOM 1628 CB ASP A 111 8.475 -8.567 14.403 1.00 0.00 C ATOM 1629 CG ASP A 111 9.752 -9.177 14.950 1.00 0.00 C ATOM 1630 OD1 ASP A 111 10.491 -9.808 14.166 1.00 0.00 O ATOM 1631 OD2 ASP A 111 10.011 -9.025 16.162 1.00 0.00 O ATOM 0 H ASP A 111 8.919 -10.077 11.681 1.00 0.00 H new ATOM 0 HA ASP A 111 7.937 -10.498 13.627 1.00 0.00 H new ATOM 0 HB2 ASP A 111 8.698 -7.593 13.968 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.777 -8.397 15.223 1.00 0.00 H new ATOM 1636 N GLY A 112 5.740 -9.277 12.091 1.00 0.00 N ATOM 1637 CA GLY A 112 4.323 -9.013 11.921 1.00 0.00 C ATOM 1638 C GLY A 112 4.047 -7.597 11.454 1.00 0.00 C ATOM 1639 O GLY A 112 3.057 -7.346 10.766 1.00 0.00 O ATOM 0 H GLY A 112 6.229 -9.559 11.241 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.910 -9.717 11.199 1.00 0.00 H new ATOM 0 HA3 GLY A 112 3.809 -9.187 12.866 1.00 0.00 H new ATOM 1643 N LYS A 113 4.920 -6.669 11.831 1.00 0.00 N ATOM 1644 CA LYS A 113 4.763 -5.271 11.447 1.00 0.00 C ATOM 1645 C LYS A 113 4.959 -5.092 9.945 1.00 0.00 C ATOM 1646 O LYS A 113 5.226 -6.055 9.225 1.00 0.00 O ATOM 1647 CB LYS A 113 5.761 -4.397 12.210 1.00 0.00 C ATOM 1648 CG LYS A 113 5.560 -4.420 13.718 1.00 0.00 C ATOM 1649 CD LYS A 113 6.843 -4.787 14.449 1.00 0.00 C ATOM 1650 CE LYS A 113 7.519 -3.559 15.038 1.00 0.00 C ATOM 1651 NZ LYS A 113 8.291 -2.803 14.014 1.00 0.00 N ATOM 0 H LYS A 113 5.743 -6.860 12.402 1.00 0.00 H new ATOM 0 HA LYS A 113 3.749 -4.963 11.701 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.773 -4.731 11.981 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.677 -3.370 11.856 1.00 0.00 H new ATOM 0 HG2 LYS A 113 5.216 -3.442 14.055 1.00 0.00 H new ATOM 0 HG3 LYS A 113 4.779 -5.137 13.971 1.00 0.00 H new ATOM 0 HD2 LYS A 113 6.619 -5.497 15.245 1.00 0.00 H new ATOM 0 HD3 LYS A 113 7.526 -5.285 13.760 1.00 0.00 H new ATOM 0 HE2 LYS A 113 6.765 -2.906 15.479 1.00 0.00 H new ATOM 0 HE3 LYS A 113 8.187 -3.864 15.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 8.736 -1.974 14.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 9.027 -3.417 13.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 7.650 -2.489 13.258 1.00 0.00 H new ATOM 1665 N MET A 114 4.824 -3.856 9.480 1.00 0.00 N ATOM 1666 CA MET A 114 4.986 -3.549 8.064 1.00 0.00 C ATOM 1667 C MET A 114 5.093 -2.044 7.842 1.00 0.00 C ATOM 1668 O MET A 114 4.261 -1.275 8.323 1.00 0.00 O ATOM 1669 CB MET A 114 3.810 -4.111 7.261 1.00 0.00 C ATOM 1670 CG MET A 114 2.452 -3.693 7.800 1.00 0.00 C ATOM 1671 SD MET A 114 1.085 -4.405 6.864 1.00 0.00 S ATOM 1672 CE MET A 114 0.512 -5.662 8.005 1.00 0.00 C ATOM 0 H MET A 114 4.603 -3.049 10.063 1.00 0.00 H new ATOM 0 HA MET A 114 5.909 -4.016 7.720 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.898 -3.782 6.225 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.871 -5.199 7.256 1.00 0.00 H new ATOM 0 HG2 MET A 114 2.370 -3.997 8.844 1.00 0.00 H new ATOM 0 HG3 MET A 114 2.375 -2.606 7.778 1.00 0.00 H new ATOM 0 HE1 MET A 114 -0.334 -6.192 7.568 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.318 -6.368 8.204 1.00 0.00 H new ATOM 0 HE3 MET A 114 0.203 -5.192 8.939 1.00 0.00 H new ATOM 1682 N ALA A 115 6.125 -1.629 7.114 1.00 0.00 N ATOM 1683 CA ALA A 115 6.341 -0.217 6.830 1.00 0.00 C ATOM 1684 C ALA A 115 6.724 -0.003 5.369 1.00 0.00 C ATOM 1685 O ALA A 115 7.637 -0.648 4.856 1.00 0.00 O ATOM 1686 CB ALA A 115 7.414 0.348 7.748 1.00 0.00 C ATOM 0 H ALA A 115 6.825 -2.252 6.710 1.00 0.00 H new ATOM 0 HA ALA A 115 5.406 0.312 7.014 1.00 0.00 H new ATOM 0 HB1 ALA A 115 7.565 1.404 7.524 1.00 0.00 H new ATOM 0 HB2 ALA A 115 7.100 0.238 8.786 1.00 0.00 H new ATOM 0 HB3 ALA A 115 8.348 -0.193 7.592 1.00 0.00 H new ATOM 1692 N LEU A 116 6.020 0.909 4.706 1.00 0.00 N ATOM 1693 CA LEU A 116 6.286 1.208 3.304 1.00 0.00 C ATOM 1694 C LEU A 116 7.505 2.116 3.164 1.00 0.00 C ATOM 1695 O LEU A 116 7.532 3.223 3.703 1.00 0.00 O ATOM 1696 CB LEU A 116 5.067 1.871 2.662 1.00 0.00 C ATOM 1697 CG LEU A 116 5.120 1.984 1.136 1.00 0.00 C ATOM 1698 CD1 LEU A 116 4.274 0.898 0.490 1.00 0.00 C ATOM 1699 CD2 LEU A 116 4.653 3.362 0.686 1.00 0.00 C ATOM 0 H LEU A 116 5.262 1.453 5.117 1.00 0.00 H new ATOM 0 HA LEU A 116 6.493 0.269 2.791 1.00 0.00 H new ATOM 0 HB2 LEU A 116 4.177 1.306 2.939 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.953 2.871 3.081 1.00 0.00 H new ATOM 0 HG LEU A 116 6.154 1.849 0.818 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.324 0.995 -0.595 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.652 -0.081 0.785 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.239 1.001 0.816 1.00 0.00 H new ATOM 0 HD21 LEU A 116 4.697 3.424 -0.401 1.00 0.00 H new ATOM 0 HD22 LEU A 116 3.627 3.525 1.017 1.00 0.00 H new ATOM 0 HD23 LEU A 116 5.300 4.125 1.120 1.00 0.00 H new ATOM 1711 N LEU A 117 8.510 1.641 2.437 1.00 0.00 N ATOM 1712 CA LEU A 117 9.730 2.410 2.226 1.00 0.00 C ATOM 1713 C LEU A 117 9.738 3.048 0.841 1.00 0.00 C ATOM 1714 O LEU A 117 9.649 2.355 -0.174 1.00 0.00 O ATOM 1715 CB LEU A 117 10.960 1.515 2.397 1.00 0.00 C ATOM 1716 CG LEU A 117 12.304 2.215 2.195 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.644 3.075 3.402 1.00 0.00 C ATOM 1718 CD2 LEU A 117 13.402 1.194 1.938 1.00 0.00 C ATOM 0 H LEU A 117 8.504 0.727 1.984 1.00 0.00 H new ATOM 0 HA LEU A 117 9.762 3.204 2.972 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.940 1.083 3.398 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.889 0.688 1.691 1.00 0.00 H new ATOM 0 HG LEU A 117 12.228 2.864 1.323 1.00 0.00 H new ATOM 0 HD11 LEU A 117 13.604 3.566 3.240 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.870 3.830 3.541 1.00 0.00 H new ATOM 0 HD13 LEU A 117 12.702 2.447 4.291 1.00 0.00 H new ATOM 0 HD21 LEU A 117 14.352 1.709 1.796 1.00 0.00 H new ATOM 0 HD22 LEU A 117 13.479 0.520 2.791 1.00 0.00 H new ATOM 0 HD23 LEU A 117 13.163 0.621 1.042 1.00 0.00 H new ATOM 1730 N ALA A 118 9.845 4.372 0.805 1.00 0.00 N ATOM 1731 CA ALA A 118 9.863 5.105 -0.455 1.00 0.00 C ATOM 1732 C ALA A 118 11.167 4.868 -1.211 1.00 0.00 C ATOM 1733 O ALA A 118 12.110 4.287 -0.675 1.00 0.00 O ATOM 1734 CB ALA A 118 9.662 6.591 -0.203 1.00 0.00 C ATOM 0 H ALA A 118 9.921 4.960 1.635 1.00 0.00 H new ATOM 0 HA ALA A 118 9.043 4.737 -1.072 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.678 7.126 -1.152 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.702 6.750 0.288 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.462 6.963 0.437 1.00 0.00 H new ATOM 1740 N SER A 119 11.210 5.323 -2.459 1.00 0.00 N ATOM 1741 CA SER A 119 12.396 5.164 -3.291 1.00 0.00 C ATOM 1742 C SER A 119 13.517 6.102 -2.846 1.00 0.00 C ATOM 1743 O SER A 119 14.645 6.004 -3.330 1.00 0.00 O ATOM 1744 CB SER A 119 12.052 5.425 -4.759 1.00 0.00 C ATOM 1745 OG SER A 119 13.177 5.213 -5.593 1.00 0.00 O ATOM 0 H SER A 119 10.436 5.805 -2.916 1.00 0.00 H new ATOM 0 HA SER A 119 12.746 4.138 -3.179 1.00 0.00 H new ATOM 0 HB2 SER A 119 11.238 4.768 -5.067 1.00 0.00 H new ATOM 0 HB3 SER A 119 11.697 6.449 -4.876 1.00 0.00 H new ATOM 0 HG SER A 119 13.996 5.272 -5.058 1.00 0.00 H new ATOM 1751 N ASN A 120 13.204 7.011 -1.925 1.00 0.00 N ATOM 1752 CA ASN A 120 14.192 7.960 -1.424 1.00 0.00 C ATOM 1753 C ASN A 120 14.821 7.466 -0.124 1.00 0.00 C ATOM 1754 O ASN A 120 15.300 8.260 0.685 1.00 0.00 O ATOM 1755 CB ASN A 120 13.545 9.329 -1.202 1.00 0.00 C ATOM 1756 CG ASN A 120 14.561 10.400 -0.857 1.00 0.00 C ATOM 1757 OD1 ASN A 120 15.677 10.403 -1.376 1.00 0.00 O ATOM 1758 ND2 ASN A 120 14.177 11.318 0.024 1.00 0.00 N ATOM 0 H ASN A 120 12.276 7.109 -1.512 1.00 0.00 H new ATOM 0 HA ASN A 120 14.980 8.051 -2.172 1.00 0.00 H new ATOM 0 HB2 ASN A 120 13.004 9.622 -2.102 1.00 0.00 H new ATOM 0 HB3 ASN A 120 12.812 9.255 -0.399 1.00 0.00 H new ATOM 0 HD21 ASN A 120 14.817 12.064 0.295 1.00 0.00 H new ATOM 0 HD22 ASN A 120 13.242 11.276 0.429 1.00 0.00 H new ATOM 1765 N SER A 121 14.821 6.149 0.070 1.00 0.00 N ATOM 1766 CA SER A 121 15.395 5.552 1.271 1.00 0.00 C ATOM 1767 C SER A 121 14.767 6.139 2.532 1.00 0.00 C ATOM 1768 O SER A 121 15.413 6.228 3.576 1.00 0.00 O ATOM 1769 CB SER A 121 16.909 5.766 1.297 1.00 0.00 C ATOM 1770 OG SER A 121 17.455 5.714 -0.010 1.00 0.00 O ATOM 0 H SER A 121 14.430 5.476 -0.589 1.00 0.00 H new ATOM 0 HA SER A 121 15.183 4.483 1.248 1.00 0.00 H new ATOM 0 HB2 SER A 121 17.135 6.731 1.751 1.00 0.00 H new ATOM 0 HB3 SER A 121 17.376 5.004 1.920 1.00 0.00 H new ATOM 0 HG SER A 121 18.424 5.855 0.034 1.00 0.00 H new ATOM 1776 N CYS A 122 13.503 6.538 2.428 1.00 0.00 N ATOM 1777 CA CYS A 122 12.789 7.116 3.561 1.00 0.00 C ATOM 1778 C CYS A 122 11.347 6.622 3.607 1.00 0.00 C ATOM 1779 O CYS A 122 10.617 6.713 2.620 1.00 0.00 O ATOM 1780 CB CYS A 122 12.815 8.644 3.480 1.00 0.00 C ATOM 1781 SG CYS A 122 14.245 9.401 4.286 1.00 0.00 S ATOM 0 H CYS A 122 12.953 6.472 1.572 1.00 0.00 H new ATOM 0 HA CYS A 122 13.291 6.798 4.475 1.00 0.00 H new ATOM 0 HB2 CYS A 122 12.802 8.942 2.432 1.00 0.00 H new ATOM 0 HB3 CYS A 122 11.905 9.037 3.934 1.00 0.00 H new ATOM 0 HG CYS A 122 14.179 10.693 4.163 1.00 0.00 H new ATOM 1787 N PHE A 123 10.943 6.098 4.760 1.00 0.00 N ATOM 1788 CA PHE A 123 9.588 5.589 4.937 1.00 0.00 C ATOM 1789 C PHE A 123 8.560 6.695 4.720 1.00 0.00 C ATOM 1790 O PHE A 123 8.915 7.840 4.436 1.00 0.00 O ATOM 1791 CB PHE A 123 9.424 4.990 6.335 1.00 0.00 C ATOM 1792 CG PHE A 123 10.199 3.720 6.537 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.743 2.523 6.009 1.00 0.00 C ATOM 1794 CD2 PHE A 123 11.384 3.723 7.255 1.00 0.00 C ATOM 1795 CE1 PHE A 123 10.454 1.352 6.194 1.00 0.00 C ATOM 1796 CE2 PHE A 123 12.100 2.556 7.444 1.00 0.00 C ATOM 1797 CZ PHE A 123 11.634 1.369 6.912 1.00 0.00 C ATOM 0 H PHE A 123 11.535 6.015 5.586 1.00 0.00 H new ATOM 0 HA PHE A 123 9.419 4.809 4.194 1.00 0.00 H new ATOM 0 HB2 PHE A 123 9.744 5.723 7.076 1.00 0.00 H new ATOM 0 HB3 PHE A 123 8.367 4.794 6.516 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.821 2.505 5.446 1.00 0.00 H new ATOM 0 HD2 PHE A 123 11.753 4.648 7.672 1.00 0.00 H new ATOM 0 HE1 PHE A 123 10.087 0.425 5.778 1.00 0.00 H new ATOM 0 HE2 PHE A 123 13.022 2.572 8.006 1.00 0.00 H new ATOM 0 HZ PHE A 123 12.192 0.456 7.057 1.00 0.00 H new ATOM 1807 N ILE A 124 7.285 6.346 4.857 1.00 0.00 N ATOM 1808 CA ILE A 124 6.206 7.310 4.677 1.00 0.00 C ATOM 1809 C ILE A 124 5.425 7.510 5.972 1.00 0.00 C ATOM 1810 O ILE A 124 5.424 6.646 6.848 1.00 0.00 O ATOM 1811 CB ILE A 124 5.232 6.865 3.566 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.585 5.525 3.925 1.00 0.00 C ATOM 1813 CG2 ILE A 124 5.961 6.769 2.234 1.00 0.00 C ATOM 1814 CD1 ILE A 124 3.167 5.656 4.436 1.00 0.00 C ATOM 0 H ILE A 124 6.974 5.403 5.092 1.00 0.00 H new ATOM 0 HA ILE A 124 6.670 8.252 4.386 1.00 0.00 H new ATOM 0 HB ILE A 124 4.443 7.611 3.475 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.587 4.882 3.045 1.00 0.00 H new ATOM 0 HG13 ILE A 124 5.191 5.029 4.683 1.00 0.00 H new ATOM 0 HG21 ILE A 124 5.262 6.454 1.459 1.00 0.00 H new ATOM 0 HG22 ILE A 124 6.375 7.743 1.975 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.768 6.041 2.313 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.772 4.668 4.670 1.00 0.00 H new ATOM 0 HD12 ILE A 124 3.160 6.272 5.335 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.546 6.123 3.671 1.00 0.00 H new ATOM 1826 N ARG A 125 4.763 8.658 6.085 1.00 0.00 N ATOM 1827 CA ARG A 125 3.978 8.973 7.274 1.00 0.00 C ATOM 1828 C ARG A 125 3.251 10.303 7.109 1.00 0.00 C ATOM 1829 O ARG A 125 3.690 11.172 6.355 1.00 0.00 O ATOM 1830 CB ARG A 125 4.881 9.020 8.509 1.00 0.00 C ATOM 1831 CG ARG A 125 5.968 10.080 8.428 1.00 0.00 C ATOM 1832 CD ARG A 125 5.782 11.156 9.488 1.00 0.00 C ATOM 1833 NE ARG A 125 6.599 12.336 9.218 1.00 0.00 N ATOM 1834 CZ ARG A 125 6.899 13.255 10.134 1.00 0.00 C ATOM 1835 NH1 ARG A 125 6.452 13.132 11.378 1.00 0.00 N ATOM 1836 NH2 ARG A 125 7.647 14.299 9.805 1.00 0.00 N ATOM 0 H ARG A 125 4.755 9.384 5.369 1.00 0.00 H new ATOM 0 HA ARG A 125 3.234 8.188 7.407 1.00 0.00 H new ATOM 0 HB2 ARG A 125 4.268 9.207 9.390 1.00 0.00 H new ATOM 0 HB3 ARG A 125 5.346 8.044 8.646 1.00 0.00 H new ATOM 0 HG2 ARG A 125 6.944 9.611 8.552 1.00 0.00 H new ATOM 0 HG3 ARG A 125 5.958 10.538 7.439 1.00 0.00 H new ATOM 0 HD2 ARG A 125 4.732 11.444 9.532 1.00 0.00 H new ATOM 0 HD3 ARG A 125 6.042 10.751 10.466 1.00 0.00 H new ATOM 0 HE ARG A 125 6.961 12.464 8.273 1.00 0.00 H new ATOM 0 HH11 ARG A 125 5.876 12.331 11.636 1.00 0.00 H new ATOM 0 HH12 ARG A 125 6.685 13.839 12.076 1.00 0.00 H new ATOM 0 HH21 ARG A 125 7.993 14.398 8.850 1.00 0.00 H new ATOM 0 HH22 ARG A 125 7.877 15.003 10.506 1.00 0.00 H new ATOM 1850 N CYS A 126 2.139 10.455 7.818 1.00 0.00 N ATOM 1851 CA CYS A 126 1.351 11.680 7.751 1.00 0.00 C ATOM 1852 C CYS A 126 1.688 12.610 8.912 1.00 0.00 C ATOM 1853 O CYS A 126 2.451 12.249 9.808 1.00 0.00 O ATOM 1854 CB CYS A 126 -0.143 11.353 7.762 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.663 10.326 9.156 1.00 0.00 S ATOM 0 H CYS A 126 1.762 9.745 8.446 1.00 0.00 H new ATOM 0 HA CYS A 126 1.598 12.188 6.819 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.708 12.285 7.780 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.399 10.843 6.833 1.00 0.00 H new ATOM 0 HG CYS A 126 -0.985 9.142 8.726 1.00 0.00 H new ATOM 1861 N ASN A 127 1.115 13.810 8.889 1.00 0.00 N ATOM 1862 CA ASN A 127 1.356 14.792 9.940 1.00 0.00 C ATOM 1863 C ASN A 127 0.040 15.334 10.490 1.00 0.00 C ATOM 1864 O ASN A 127 -1.039 14.942 10.044 1.00 0.00 O ATOM 1865 CB ASN A 127 2.210 15.943 9.404 1.00 0.00 C ATOM 1866 CG ASN A 127 3.651 15.535 9.174 1.00 0.00 C ATOM 1867 OD1 ASN A 127 4.230 14.785 9.961 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.240 16.025 8.089 1.00 0.00 N ATOM 0 H ASN A 127 0.481 14.125 8.155 1.00 0.00 H new ATOM 0 HA ASN A 127 1.892 14.297 10.750 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.783 16.303 8.468 1.00 0.00 H new ATOM 0 HB3 ASN A 127 2.179 16.774 10.109 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.209 15.783 7.881 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.723 16.643 7.463 1.00 0.00 H new ATOM 1875 N GLU A 128 0.137 16.236 11.460 1.00 0.00 N ATOM 1876 CA GLU A 128 -1.045 16.832 12.071 1.00 0.00 C ATOM 1877 C GLU A 128 -1.583 17.975 11.216 1.00 0.00 C ATOM 1878 O GLU A 128 -2.795 18.167 11.109 1.00 0.00 O ATOM 1879 CB GLU A 128 -0.717 17.342 13.475 1.00 0.00 C ATOM 1880 CG GLU A 128 -0.538 16.232 14.499 1.00 0.00 C ATOM 1881 CD GLU A 128 -1.725 16.103 15.433 1.00 0.00 C ATOM 1882 OE1 GLU A 128 -2.288 17.147 15.825 1.00 0.00 O ATOM 1883 OE2 GLU A 128 -2.092 14.959 15.774 1.00 0.00 O ATOM 0 H GLU A 128 1.022 16.571 11.840 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.813 16.062 12.141 1.00 0.00 H new ATOM 0 HB2 GLU A 128 0.196 17.937 13.433 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.515 18.006 13.807 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -0.384 15.286 13.980 1.00 0.00 H new ATOM 0 HG3 GLU A 128 0.361 16.424 15.085 1.00 0.00 H new ATOM 1890 N ALA A 129 -0.674 18.730 10.608 1.00 0.00 N ATOM 1891 CA ALA A 129 -1.057 19.854 9.761 1.00 0.00 C ATOM 1892 C ALA A 129 -1.770 19.375 8.501 1.00 0.00 C ATOM 1893 O ALA A 129 -2.619 20.076 7.952 1.00 0.00 O ATOM 1894 CB ALA A 129 0.168 20.679 9.396 1.00 0.00 C ATOM 0 H ALA A 129 0.333 18.584 10.686 1.00 0.00 H new ATOM 0 HA ALA A 129 -1.750 20.481 10.322 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -0.131 21.515 8.764 1.00 0.00 H new ATOM 0 HB2 ALA A 129 0.634 21.060 10.305 1.00 0.00 H new ATOM 0 HB3 ALA A 129 0.880 20.054 8.858 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.418 18.175 8.047 1.00 0.00 N ATOM 1901 CA GLY A 130 -2.033 17.624 6.855 1.00 0.00 C ATOM 1902 C GLY A 130 -1.043 17.441 5.721 1.00 0.00 C ATOM 1903 O GLY A 130 -1.403 17.550 4.550 1.00 0.00 O ATOM 0 H GLY A 130 -0.718 17.576 8.484 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.486 16.662 7.096 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -2.837 18.283 6.528 1.00 0.00 H new ATOM 1907 N ASP A 131 0.208 17.161 6.071 1.00 0.00 N ATOM 1908 CA ASP A 131 1.256 16.962 5.076 1.00 0.00 C ATOM 1909 C ASP A 131 1.871 15.572 5.204 1.00 0.00 C ATOM 1910 O ASP A 131 2.484 15.245 6.221 1.00 0.00 O ATOM 1911 CB ASP A 131 2.341 18.028 5.226 1.00 0.00 C ATOM 1912 CG ASP A 131 1.808 19.431 5.006 1.00 0.00 C ATOM 1913 OD1 ASP A 131 1.135 19.655 3.978 1.00 0.00 O ATOM 1914 OD2 ASP A 131 2.065 20.305 5.860 1.00 0.00 O ATOM 0 H ASP A 131 0.521 17.067 7.037 1.00 0.00 H new ATOM 0 HA ASP A 131 0.805 17.051 4.088 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.778 17.960 6.222 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.142 17.830 4.513 1.00 0.00 H new ATOM 1919 N ILE A 132 1.703 14.758 4.166 1.00 0.00 N ATOM 1920 CA ILE A 132 2.243 13.404 4.164 1.00 0.00 C ATOM 1921 C ILE A 132 3.600 13.354 3.470 1.00 0.00 C ATOM 1922 O ILE A 132 3.678 13.265 2.245 1.00 0.00 O ATOM 1923 CB ILE A 132 1.286 12.419 3.466 1.00 0.00 C ATOM 1924 CG1 ILE A 132 -0.137 12.589 4.002 1.00 0.00 C ATOM 1925 CG2 ILE A 132 1.764 10.988 3.659 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -1.180 11.851 3.191 1.00 0.00 C ATOM 0 H ILE A 132 1.198 15.013 3.317 1.00 0.00 H new ATOM 0 HA ILE A 132 2.360 13.109 5.207 1.00 0.00 H new ATOM 0 HB ILE A 132 1.280 12.637 2.398 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -0.173 12.236 5.033 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.386 13.650 4.020 1.00 0.00 H new ATOM 0 HG21 ILE A 132 1.077 10.305 3.160 1.00 0.00 H new ATOM 0 HG22 ILE A 132 2.761 10.877 3.232 1.00 0.00 H new ATOM 0 HG23 ILE A 132 1.797 10.756 4.723 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -2.165 12.016 3.628 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -1.172 12.220 2.165 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -0.956 10.784 3.194 1.00 0.00 H new ATOM 1938 N GLU A 133 4.665 13.413 4.261 1.00 0.00 N ATOM 1939 CA GLU A 133 6.021 13.374 3.723 1.00 0.00 C ATOM 1940 C GLU A 133 6.768 12.140 4.219 1.00 0.00 C ATOM 1941 O GLU A 133 6.319 11.460 5.141 1.00 0.00 O ATOM 1942 CB GLU A 133 6.785 14.640 4.116 1.00 0.00 C ATOM 1943 CG GLU A 133 6.613 15.024 5.577 1.00 0.00 C ATOM 1944 CD GLU A 133 7.423 16.249 5.956 1.00 0.00 C ATOM 1945 OE1 GLU A 133 7.330 17.268 5.239 1.00 0.00 O ATOM 1946 OE2 GLU A 133 8.149 16.190 6.971 1.00 0.00 O ATOM 0 H GLU A 133 4.617 13.488 5.277 1.00 0.00 H new ATOM 0 HA GLU A 133 5.953 13.322 2.636 1.00 0.00 H new ATOM 0 HB2 GLU A 133 7.845 14.494 3.910 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.449 15.466 3.490 1.00 0.00 H new ATOM 0 HG2 GLU A 133 5.559 15.214 5.778 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.912 14.186 6.207 1.00 0.00 H new ATOM 1953 N ALA A 134 7.910 11.857 3.600 1.00 0.00 N ATOM 1954 CA ALA A 134 8.719 10.706 3.979 1.00 0.00 C ATOM 1955 C ALA A 134 9.589 11.021 5.190 1.00 0.00 C ATOM 1956 O ALA A 134 10.282 12.038 5.221 1.00 0.00 O ATOM 1957 CB ALA A 134 9.582 10.260 2.808 1.00 0.00 C ATOM 0 H ALA A 134 8.295 12.409 2.834 1.00 0.00 H new ATOM 0 HA ALA A 134 8.046 9.893 4.251 1.00 0.00 H new ATOM 0 HB1 ALA A 134 10.181 9.399 3.105 1.00 0.00 H new ATOM 0 HB2 ALA A 134 8.943 9.985 1.969 1.00 0.00 H new ATOM 0 HB3 ALA A 134 10.241 11.076 2.510 1.00 0.00 H new ATOM 1963 N LYS A 135 9.550 10.142 6.185 1.00 0.00 N ATOM 1964 CA LYS A 135 10.337 10.325 7.399 1.00 0.00 C ATOM 1965 C LYS A 135 11.753 9.787 7.217 1.00 0.00 C ATOM 1966 O LYS A 135 12.055 9.135 6.216 1.00 0.00 O ATOM 1967 CB LYS A 135 9.657 9.628 8.582 1.00 0.00 C ATOM 1968 CG LYS A 135 9.145 10.590 9.641 1.00 0.00 C ATOM 1969 CD LYS A 135 10.100 10.683 10.820 1.00 0.00 C ATOM 1970 CE LYS A 135 9.432 11.315 12.030 1.00 0.00 C ATOM 1971 NZ LYS A 135 8.283 10.504 12.518 1.00 0.00 N ATOM 0 H LYS A 135 8.982 9.295 6.175 1.00 0.00 H new ATOM 0 HA LYS A 135 10.400 11.394 7.605 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.824 9.031 8.211 1.00 0.00 H new ATOM 0 HB3 LYS A 135 10.364 8.937 9.042 1.00 0.00 H new ATOM 0 HG2 LYS A 135 9.011 11.578 9.201 1.00 0.00 H new ATOM 0 HG3 LYS A 135 8.166 10.261 9.990 1.00 0.00 H new ATOM 0 HD2 LYS A 135 10.457 9.686 11.080 1.00 0.00 H new ATOM 0 HD3 LYS A 135 10.973 11.271 10.537 1.00 0.00 H new ATOM 0 HE2 LYS A 135 10.163 11.427 12.831 1.00 0.00 H new ATOM 0 HE3 LYS A 135 9.086 12.316 11.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 8.260 10.525 13.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 7.396 10.898 12.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 8.389 9.522 12.194 1.00 0.00 H new ATOM 1985 N ASN A 136 12.616 10.063 8.188 1.00 0.00 N ATOM 1986 CA ASN A 136 13.999 9.605 8.134 1.00 0.00 C ATOM 1987 C ASN A 136 14.069 8.081 8.149 1.00 0.00 C ATOM 1988 O ASN A 136 13.043 7.403 8.213 1.00 0.00 O ATOM 1989 CB ASN A 136 14.794 10.177 9.309 1.00 0.00 C ATOM 1990 CG ASN A 136 16.146 10.718 8.885 1.00 0.00 C ATOM 1991 OD1 ASN A 136 16.271 11.355 7.839 1.00 0.00 O ATOM 1992 ND2 ASN A 136 17.165 10.466 9.697 1.00 0.00 N ATOM 0 H ASN A 136 12.382 10.602 9.022 1.00 0.00 H new ATOM 0 HA ASN A 136 14.437 9.961 7.201 1.00 0.00 H new ATOM 0 HB2 ASN A 136 14.218 10.974 9.780 1.00 0.00 H new ATOM 0 HB3 ASN A 136 14.936 9.400 10.060 1.00 0.00 H new ATOM 0 HD21 ASN A 136 18.099 10.805 9.464 1.00 0.00 H new ATOM 0 HD22 ASN A 136 17.015 9.934 10.554 1.00 0.00 H new ATOM 1999 N LYS A 137 15.285 7.548 8.088 1.00 0.00 N ATOM 2000 CA LYS A 137 15.487 6.103 8.095 1.00 0.00 C ATOM 2001 C LYS A 137 14.942 5.484 9.378 1.00 0.00 C ATOM 2002 O LYS A 137 14.438 4.361 9.371 1.00 0.00 O ATOM 2003 CB LYS A 137 16.974 5.775 7.948 1.00 0.00 C ATOM 2004 CG LYS A 137 17.594 6.320 6.670 1.00 0.00 C ATOM 2005 CD LYS A 137 18.480 7.524 6.948 1.00 0.00 C ATOM 2006 CE LYS A 137 18.616 8.412 5.720 1.00 0.00 C ATOM 2007 NZ LYS A 137 17.760 9.626 5.816 1.00 0.00 N ATOM 0 H LYS A 137 16.145 8.094 8.033 1.00 0.00 H new ATOM 0 HA LYS A 137 14.943 5.681 7.250 1.00 0.00 H new ATOM 0 HB2 LYS A 137 17.513 6.179 8.805 1.00 0.00 H new ATOM 0 HB3 LYS A 137 17.103 4.693 7.972 1.00 0.00 H new ATOM 0 HG2 LYS A 137 18.181 5.539 6.188 1.00 0.00 H new ATOM 0 HG3 LYS A 137 16.805 6.601 5.973 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.062 8.102 7.772 1.00 0.00 H new ATOM 0 HD3 LYS A 137 19.467 7.186 7.265 1.00 0.00 H new ATOM 0 HE2 LYS A 137 19.658 8.711 5.601 1.00 0.00 H new ATOM 0 HE3 LYS A 137 18.344 7.845 4.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 18.214 10.412 5.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 16.831 9.430 5.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 17.636 9.885 6.816 1.00 0.00 H new ATOM 2021 N THR A 138 15.047 6.224 10.477 1.00 0.00 N ATOM 2022 CA THR A 138 14.565 5.747 11.768 1.00 0.00 C ATOM 2023 C THR A 138 13.050 5.564 11.749 1.00 0.00 C ATOM 2024 O THR A 138 12.298 6.538 11.746 1.00 0.00 O ATOM 2025 CB THR A 138 14.958 6.723 12.876 1.00 0.00 C ATOM 2026 OG1 THR A 138 14.969 8.055 12.390 1.00 0.00 O ATOM 2027 CG2 THR A 138 16.321 6.439 13.469 1.00 0.00 C ATOM 0 H THR A 138 15.461 7.156 10.499 1.00 0.00 H new ATOM 0 HA THR A 138 15.028 4.780 11.965 1.00 0.00 H new ATOM 0 HB THR A 138 14.207 6.593 13.655 1.00 0.00 H new ATOM 0 HG1 THR A 138 15.221 8.665 13.114 1.00 0.00 H new ATOM 0 HG21 THR A 138 16.537 7.169 14.249 1.00 0.00 H new ATOM 0 HG22 THR A 138 16.330 5.437 13.897 1.00 0.00 H new ATOM 0 HG23 THR A 138 17.079 6.507 12.688 1.00 0.00 H new ATOM 2035 N ALA A 139 12.611 4.310 11.737 1.00 0.00 N ATOM 2036 CA ALA A 139 11.187 4.000 11.719 1.00 0.00 C ATOM 2037 C ALA A 139 10.637 3.860 13.134 1.00 0.00 C ATOM 2038 O ALA A 139 11.222 3.175 13.973 1.00 0.00 O ATOM 2039 CB ALA A 139 10.935 2.727 10.924 1.00 0.00 C ATOM 0 H ALA A 139 13.221 3.492 11.739 1.00 0.00 H new ATOM 0 HA ALA A 139 10.666 4.827 11.236 1.00 0.00 H new ATOM 0 HB1 ALA A 139 9.867 2.507 10.918 1.00 0.00 H new ATOM 0 HB2 ALA A 139 11.283 2.863 9.900 1.00 0.00 H new ATOM 0 HB3 ALA A 139 11.474 1.898 11.383 1.00 0.00 H new ATOM 2045 N GLY A 140 9.509 4.514 13.392 1.00 0.00 N ATOM 2046 CA GLY A 140 8.899 4.450 14.707 1.00 0.00 C ATOM 2047 C GLY A 140 7.584 3.698 14.701 1.00 0.00 C ATOM 2048 O GLY A 140 7.140 3.219 13.656 1.00 0.00 O ATOM 0 H GLY A 140 9.007 5.087 12.714 1.00 0.00 H new ATOM 0 HA2 GLY A 140 9.587 3.966 15.400 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.733 5.462 15.077 1.00 0.00 H new ATOM 2052 N GLU A 141 6.958 3.593 15.868 1.00 0.00 N ATOM 2053 CA GLU A 141 5.685 2.893 15.994 1.00 0.00 C ATOM 2054 C GLU A 141 4.590 3.610 15.208 1.00 0.00 C ATOM 2055 O GLU A 141 3.671 2.978 14.689 1.00 0.00 O ATOM 2056 CB GLU A 141 5.284 2.780 17.464 1.00 0.00 C ATOM 2057 CG GLU A 141 5.975 1.643 18.199 1.00 0.00 C ATOM 2058 CD GLU A 141 7.174 2.112 19.002 1.00 0.00 C ATOM 2059 OE1 GLU A 141 6.974 2.623 20.124 1.00 0.00 O ATOM 2060 OE2 GLU A 141 8.313 1.968 18.507 1.00 0.00 O ATOM 0 H GLU A 141 7.312 3.984 16.741 1.00 0.00 H new ATOM 0 HA GLU A 141 5.807 1.892 15.581 1.00 0.00 H new ATOM 0 HB2 GLU A 141 5.513 3.719 17.967 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.205 2.640 17.528 1.00 0.00 H new ATOM 0 HG2 GLU A 141 5.262 1.160 18.867 1.00 0.00 H new ATOM 0 HG3 GLU A 141 6.296 0.891 17.478 1.00 0.00 H new ATOM 2067 N GLU A 142 4.696 4.932 15.129 1.00 0.00 N ATOM 2068 CA GLU A 142 3.716 5.735 14.408 1.00 0.00 C ATOM 2069 C GLU A 142 3.887 5.578 12.900 1.00 0.00 C ATOM 2070 O GLU A 142 2.918 5.654 12.144 1.00 0.00 O ATOM 2071 CB GLU A 142 3.846 7.208 14.798 1.00 0.00 C ATOM 2072 CG GLU A 142 5.261 7.748 14.671 1.00 0.00 C ATOM 2073 CD GLU A 142 5.963 7.863 16.011 1.00 0.00 C ATOM 2074 OE1 GLU A 142 5.336 8.361 16.969 1.00 0.00 O ATOM 2075 OE2 GLU A 142 7.140 7.454 16.101 1.00 0.00 O ATOM 0 H GLU A 142 5.451 5.470 15.555 1.00 0.00 H new ATOM 0 HA GLU A 142 2.722 5.381 14.681 1.00 0.00 H new ATOM 0 HB2 GLU A 142 3.182 7.802 14.170 1.00 0.00 H new ATOM 0 HB3 GLU A 142 3.509 7.334 15.827 1.00 0.00 H new ATOM 0 HG2 GLU A 142 5.838 7.094 14.017 1.00 0.00 H new ATOM 0 HG3 GLU A 142 5.231 8.728 14.195 1.00 0.00 H new ATOM 2082 N GLU A 143 5.125 5.359 12.470 1.00 0.00 N ATOM 2083 CA GLU A 143 5.423 5.190 11.052 1.00 0.00 C ATOM 2084 C GLU A 143 4.770 3.926 10.503 1.00 0.00 C ATOM 2085 O GLU A 143 4.428 3.855 9.324 1.00 0.00 O ATOM 2086 CB GLU A 143 6.936 5.135 10.832 1.00 0.00 C ATOM 2087 CG GLU A 143 7.577 6.503 10.661 1.00 0.00 C ATOM 2088 CD GLU A 143 8.604 6.530 9.546 1.00 0.00 C ATOM 2089 OE1 GLU A 143 8.202 6.656 8.371 1.00 0.00 O ATOM 2090 OE2 GLU A 143 9.812 6.427 9.850 1.00 0.00 O ATOM 0 H GLU A 143 5.938 5.294 13.083 1.00 0.00 H new ATOM 0 HA GLU A 143 5.015 6.047 10.516 1.00 0.00 H new ATOM 0 HB2 GLU A 143 7.400 4.629 11.679 1.00 0.00 H new ATOM 0 HB3 GLU A 143 7.144 4.532 9.948 1.00 0.00 H new ATOM 0 HG2 GLU A 143 6.801 7.240 10.454 1.00 0.00 H new ATOM 0 HG3 GLU A 143 8.054 6.796 11.596 1.00 0.00 H new ATOM 2097 N MET A 144 4.601 2.929 11.367 1.00 0.00 N ATOM 2098 CA MET A 144 3.990 1.666 10.968 1.00 0.00 C ATOM 2099 C MET A 144 2.587 1.891 10.413 1.00 0.00 C ATOM 2100 O MET A 144 1.808 2.670 10.962 1.00 0.00 O ATOM 2101 CB MET A 144 3.932 0.706 12.156 1.00 0.00 C ATOM 2102 CG MET A 144 5.293 0.172 12.573 1.00 0.00 C ATOM 2103 SD MET A 144 6.086 -0.797 11.276 1.00 0.00 S ATOM 2104 CE MET A 144 7.801 -0.337 11.511 1.00 0.00 C ATOM 0 H MET A 144 4.879 2.972 12.348 1.00 0.00 H new ATOM 0 HA MET A 144 4.605 1.226 10.183 1.00 0.00 H new ATOM 0 HB2 MET A 144 3.476 1.217 13.004 1.00 0.00 H new ATOM 0 HB3 MET A 144 3.283 -0.133 11.903 1.00 0.00 H new ATOM 0 HG2 MET A 144 5.939 1.007 12.844 1.00 0.00 H new ATOM 0 HG3 MET A 144 5.179 -0.445 13.464 1.00 0.00 H new ATOM 0 HE1 MET A 144 8.435 -0.959 10.879 1.00 0.00 H new ATOM 0 HE2 MET A 144 7.937 0.710 11.242 1.00 0.00 H new ATOM 0 HE3 MET A 144 8.077 -0.482 12.556 1.00 0.00 H new ATOM 2114 N ILE A 145 2.271 1.203 9.320 1.00 0.00 N ATOM 2115 CA ILE A 145 0.962 1.327 8.690 1.00 0.00 C ATOM 2116 C ILE A 145 0.310 -0.038 8.504 1.00 0.00 C ATOM 2117 O ILE A 145 0.954 -1.073 8.677 1.00 0.00 O ATOM 2118 CB ILE A 145 1.063 2.025 7.320 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.170 1.389 6.478 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.315 3.514 7.500 1.00 0.00 C ATOM 2121 CD1 ILE A 145 2.321 2.013 5.107 1.00 0.00 C ATOM 0 H ILE A 145 2.904 0.554 8.853 1.00 0.00 H new ATOM 0 HA ILE A 145 0.347 1.933 9.355 1.00 0.00 H new ATOM 0 HB ILE A 145 0.116 1.898 6.795 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.116 1.473 7.013 1.00 0.00 H new ATOM 0 HG13 ILE A 145 1.962 0.325 6.363 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.384 3.992 6.523 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.494 3.957 8.064 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.249 3.662 8.043 1.00 0.00 H new ATOM 0 HD11 ILE A 145 3.124 1.512 4.566 1.00 0.00 H new ATOM 0 HD12 ILE A 145 1.388 1.905 4.554 1.00 0.00 H new ATOM 0 HD13 ILE A 145 2.560 3.071 5.213 1.00 0.00 H new ATOM 2133 N LYS A 146 -0.971 -0.034 8.151 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.711 -1.273 7.942 1.00 0.00 C ATOM 2135 C LYS A 146 -2.280 -1.333 6.528 1.00 0.00 C ATOM 2136 O LYS A 146 -3.280 -0.684 6.222 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.842 -1.395 8.964 1.00 0.00 C ATOM 2138 CG LYS A 146 -2.356 -1.457 10.403 1.00 0.00 C ATOM 2139 CD LYS A 146 -3.517 -1.559 11.379 1.00 0.00 C ATOM 2140 CE LYS A 146 -3.783 -3.001 11.779 1.00 0.00 C ATOM 2141 NZ LYS A 146 -4.275 -3.815 10.633 1.00 0.00 N ATOM 0 H LYS A 146 -1.519 0.814 8.004 1.00 0.00 H new ATOM 0 HA LYS A 146 -1.021 -2.106 8.074 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.515 -0.545 8.853 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.423 -2.291 8.746 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -1.697 -2.316 10.529 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -1.767 -0.568 10.628 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -3.299 -0.968 12.268 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -4.413 -1.135 10.926 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -2.867 -3.443 12.172 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -4.519 -3.025 12.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -4.712 -4.689 10.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -4.980 -3.269 10.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -3.477 -4.056 10.011 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.636 -2.117 5.669 1.00 0.00 N ATOM 2156 CA ILE A 147 -2.077 -2.262 4.287 1.00 0.00 C ATOM 2157 C ILE A 147 -3.110 -3.376 4.155 1.00 0.00 C ATOM 2158 O ILE A 147 -2.820 -4.541 4.428 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.895 -2.560 3.346 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.248 -1.574 3.599 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.343 -2.498 1.894 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.569 -2.015 3.008 1.00 0.00 C ATOM 0 H ILE A 147 -0.807 -2.662 5.906 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.529 -1.313 3.999 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.533 -3.568 3.551 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -0.021 -0.604 3.182 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.368 -1.437 4.674 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.496 -2.711 1.242 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -2.127 -3.236 1.723 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.728 -1.502 1.674 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.333 -1.268 3.226 1.00 0.00 H new ATOM 0 HD12 ILE A 147 1.861 -2.971 3.443 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.466 -2.124 1.928 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.316 -3.011 3.731 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.392 -3.980 3.562 1.00 0.00 C ATOM 2176 C ARG A 148 -5.615 -4.291 2.085 1.00 0.00 C ATOM 2177 O ARG A 148 -5.068 -3.620 1.209 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.686 -3.453 4.185 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.751 -3.637 5.693 1.00 0.00 C ATOM 2180 CD ARG A 148 -8.026 -3.044 6.275 1.00 0.00 C ATOM 2181 NE ARG A 148 -7.753 -2.161 7.406 1.00 0.00 N ATOM 2182 CZ ARG A 148 -8.657 -1.834 8.327 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -9.894 -2.307 8.252 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -8.323 -1.027 9.326 1.00 0.00 N ATOM 0 H ARG A 148 -4.572 -2.051 3.498 1.00 0.00 H new ATOM 0 HA ARG A 148 -5.102 -4.900 4.070 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.787 -2.393 3.951 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.534 -3.963 3.728 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -6.700 -4.699 5.933 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.885 -3.164 6.156 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -8.554 -2.488 5.500 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -8.687 -3.849 6.595 1.00 0.00 H new ATOM 0 HE ARG A 148 -6.814 -1.772 7.495 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -10.158 -2.926 7.485 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -10.581 -2.052 8.961 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -7.374 -0.658 9.388 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -9.015 -0.776 10.032 1.00 0.00 H new ATOM 2198 N SER A 149 -6.422 -5.312 1.815 1.00 0.00 N ATOM 2199 CA SER A 149 -6.718 -5.710 0.444 1.00 0.00 C ATOM 2200 C SER A 149 -8.185 -6.099 0.294 1.00 0.00 C ATOM 2201 O SER A 149 -8.825 -6.530 1.252 1.00 0.00 O ATOM 2202 CB SER A 149 -5.824 -6.880 0.029 1.00 0.00 C ATOM 2203 OG SER A 149 -6.198 -7.381 -1.244 1.00 0.00 O ATOM 0 H SER A 149 -6.882 -5.878 2.527 1.00 0.00 H new ATOM 0 HA SER A 149 -6.519 -4.858 -0.207 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.784 -6.556 0.005 1.00 0.00 H new ATOM 0 HB3 SER A 149 -5.893 -7.675 0.771 1.00 0.00 H new ATOM 0 HG SER A 149 -6.397 -8.338 -1.173 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.712 -5.940 -0.916 1.00 0.00 N ATOM 2210 CA CYS A 150 -10.105 -6.274 -1.193 1.00 0.00 C ATOM 2211 C CYS A 150 -10.231 -7.031 -2.511 1.00 0.00 C ATOM 2212 O CYS A 150 -11.238 -6.916 -3.210 1.00 0.00 O ATOM 2213 CB CYS A 150 -10.956 -5.003 -1.237 1.00 0.00 C ATOM 2214 SG CYS A 150 -10.426 -3.804 -2.483 1.00 0.00 S ATOM 0 H CYS A 150 -8.196 -5.582 -1.720 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.466 -6.917 -0.390 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -11.992 -5.279 -1.431 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -10.931 -4.527 -0.257 1.00 0.00 H new ATOM 0 HG CYS A 150 -10.114 -2.684 -1.902 1.00 0.00 H new ATOM 2220 N ALA A 151 -9.202 -7.803 -2.844 1.00 0.00 N ATOM 2221 CA ALA A 151 -9.198 -8.579 -4.079 1.00 0.00 C ATOM 2222 C ALA A 151 -9.943 -9.898 -3.901 1.00 0.00 C ATOM 2223 O ALA A 151 -10.503 -10.167 -2.838 1.00 0.00 O ATOM 2224 CB ALA A 151 -7.770 -8.834 -4.535 1.00 0.00 C ATOM 0 H ALA A 151 -8.361 -7.908 -2.277 1.00 0.00 H new ATOM 0 HA ALA A 151 -9.715 -8.001 -4.845 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -7.781 -9.414 -5.458 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -7.269 -7.882 -4.711 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -7.235 -9.389 -3.764 1.00 0.00 H new