USER MOD reduce.3.24.130724 H: found=0, std=0, add=965, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 963 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 51 THR OG1 : rot -170:sc= -0.0135 USER MOD Set 1.2: A 91 TYR OH : rot 180:sc= 0.00311 USER MOD Set 2.1: A 29 ASN : amide:sc= -3.44! K(o=-7.2!,f=-4.2) USER MOD Set 2.2: A 73 ASN : amide:sc= -3.78 K(o=-7.2,f=-11!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= -3.18! C(o=-3.2!,f=-11!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot -102:sc= 0.00553 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -123:sc= -0.017 (180deg=-2.09!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 HIS : no HD1:sc= -1.19 K(o=-1.2,f=-0.26) USER MOD Single : A 36 SER OG : rot 40:sc= -0.343 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= -0.675 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.606 K(o=-0.61,f=-1.4) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot -43:sc= 0.293 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 148:sc= 1.97 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.143 K(o=-0.14,f=-1.1!) USER MOD Single : A 99 ASN : amide:sc= -0.879 K(o=-0.88,f=-6!) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 ASN : amide:sc=-0.00202 X(o=-0.002,f=0) USER MOD Single : A 116 ASN : amide:sc= -1.33 K(o=-1.3,f=-3.7!) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.452 -7.264 16.432 1.00 0.00 N ATOM 2 CA GLY A 1 -3.518 -6.289 16.576 1.00 0.00 C ATOM 3 C GLY A 1 -3.191 -5.219 17.599 1.00 0.00 C ATOM 4 O GLY A 1 -3.893 -5.071 18.598 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.724 -7.973 15.722 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.582 -6.784 16.126 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.286 -7.734 17.345 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.709 -5.819 15.611 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.436 -6.799 16.869 1.00 0.00 H new ATOM 8 N SER A 2 -2.120 -4.472 17.350 1.00 0.00 N ATOM 9 CA SER A 2 -1.697 -3.414 18.260 1.00 0.00 C ATOM 10 C SER A 2 -2.567 -2.172 18.091 1.00 0.00 C ATOM 11 O SER A 2 -3.134 -1.939 17.023 1.00 0.00 O ATOM 12 CB SER A 2 -0.229 -3.059 18.017 1.00 0.00 C ATOM 13 OG SER A 2 0.241 -2.141 18.989 1.00 0.00 O ATOM 0 H SER A 2 -1.529 -4.580 16.525 1.00 0.00 H new ATOM 0 HA SER A 2 -1.810 -3.780 19.280 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.377 -3.965 18.045 1.00 0.00 H new ATOM 0 HB3 SER A 2 -0.115 -2.630 17.022 1.00 0.00 H new ATOM 0 HG SER A 2 1.182 -1.931 18.813 1.00 0.00 H new ATOM 19 N SER A 3 -2.668 -1.379 19.152 1.00 0.00 N ATOM 20 CA SER A 3 -3.472 -0.163 19.124 1.00 0.00 C ATOM 21 C SER A 3 -2.582 1.075 19.065 1.00 0.00 C ATOM 22 O SER A 3 -1.400 1.020 19.400 1.00 0.00 O ATOM 23 CB SER A 3 -4.378 -0.096 20.355 1.00 0.00 C ATOM 24 OG SER A 3 -5.356 0.920 20.214 1.00 0.00 O ATOM 0 H SER A 3 -2.203 -1.557 20.042 1.00 0.00 H new ATOM 0 HA SER A 3 -4.091 -0.187 18.227 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.868 -1.059 20.503 1.00 0.00 H new ATOM 0 HB3 SER A 3 -3.776 0.095 21.243 1.00 0.00 H new ATOM 0 HG SER A 3 -5.923 0.941 21.013 1.00 0.00 H new ATOM 30 N GLY A 4 -3.162 2.193 18.637 1.00 0.00 N ATOM 31 CA GLY A 4 -2.408 3.429 18.542 1.00 0.00 C ATOM 32 C GLY A 4 -3.039 4.556 19.336 1.00 0.00 C ATOM 33 O GLY A 4 -4.177 4.442 19.791 1.00 0.00 O ATOM 0 H GLY A 4 -4.140 2.264 18.355 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -1.393 3.260 18.901 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -2.331 3.725 17.496 1.00 0.00 H new ATOM 37 N SER A 5 -2.298 5.646 19.505 1.00 0.00 N ATOM 38 CA SER A 5 -2.790 6.796 20.255 1.00 0.00 C ATOM 39 C SER A 5 -3.468 7.800 19.327 1.00 0.00 C ATOM 40 O SER A 5 -3.437 7.652 18.105 1.00 0.00 O ATOM 41 CB SER A 5 -1.640 7.473 21.003 1.00 0.00 C ATOM 42 OG SER A 5 -0.626 7.894 20.108 1.00 0.00 O ATOM 0 H SER A 5 -1.355 5.757 19.133 1.00 0.00 H new ATOM 0 HA SER A 5 -3.525 6.440 20.977 1.00 0.00 H new ATOM 0 HB2 SER A 5 -2.019 8.331 21.558 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.220 6.781 21.733 1.00 0.00 H new ATOM 0 HG SER A 5 0.096 8.325 20.611 1.00 0.00 H new ATOM 48 N SER A 6 -4.081 8.821 19.917 1.00 0.00 N ATOM 49 CA SER A 6 -4.771 9.848 19.145 1.00 0.00 C ATOM 50 C SER A 6 -4.194 11.229 19.440 1.00 0.00 C ATOM 51 O SER A 6 -3.751 11.504 20.554 1.00 0.00 O ATOM 52 CB SER A 6 -6.268 9.831 19.458 1.00 0.00 C ATOM 53 OG SER A 6 -7.010 10.477 18.437 1.00 0.00 O ATOM 0 H SER A 6 -4.114 8.959 20.927 1.00 0.00 H new ATOM 0 HA SER A 6 -4.626 9.631 18.087 1.00 0.00 H new ATOM 0 HB2 SER A 6 -6.609 8.801 19.564 1.00 0.00 H new ATOM 0 HB3 SER A 6 -6.449 10.326 20.412 1.00 0.00 H new ATOM 0 HG SER A 6 -7.964 10.451 18.660 1.00 0.00 H new ATOM 59 N GLY A 7 -4.203 12.095 18.432 1.00 0.00 N ATOM 60 CA GLY A 7 -3.678 13.438 18.602 1.00 0.00 C ATOM 61 C GLY A 7 -3.688 14.232 17.311 1.00 0.00 C ATOM 62 O GLY A 7 -4.742 14.444 16.713 1.00 0.00 O ATOM 0 H GLY A 7 -4.564 11.891 17.500 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.269 13.963 19.353 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.658 13.381 18.982 1.00 0.00 H new ATOM 66 N GLN A 8 -2.510 14.673 16.881 1.00 0.00 N ATOM 67 CA GLN A 8 -2.388 15.451 15.653 1.00 0.00 C ATOM 68 C GLN A 8 -2.746 14.605 14.436 1.00 0.00 C ATOM 69 O GLN A 8 -2.431 13.416 14.377 1.00 0.00 O ATOM 70 CB GLN A 8 -0.966 15.997 15.510 1.00 0.00 C ATOM 71 CG GLN A 8 0.094 14.913 15.400 1.00 0.00 C ATOM 72 CD GLN A 8 0.091 14.228 14.048 1.00 0.00 C ATOM 73 OE1 GLN A 8 -0.359 14.797 13.052 1.00 0.00 O ATOM 74 NE2 GLN A 8 0.594 13.000 14.004 1.00 0.00 N ATOM 0 H GLN A 8 -1.627 14.505 17.364 1.00 0.00 H new ATOM 0 HA GLN A 8 -3.086 16.286 15.710 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -0.917 16.632 14.626 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -0.740 16.628 16.369 1.00 0.00 H new ATOM 0 HG2 GLN A 8 1.076 15.351 15.579 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -0.070 14.169 16.180 1.00 0.00 H new ATOM 0 HE21 GLN A 8 0.956 12.566 14.853 1.00 0.00 H new ATOM 0 HE22 GLN A 8 0.618 12.490 13.121 1.00 0.00 H new ATOM 83 N LYS A 9 -3.406 15.226 13.464 1.00 0.00 N ATOM 84 CA LYS A 9 -3.807 14.533 12.246 1.00 0.00 C ATOM 85 C LYS A 9 -3.312 15.275 11.009 1.00 0.00 C ATOM 86 O LYS A 9 -4.018 15.366 10.004 1.00 0.00 O ATOM 87 CB LYS A 9 -5.330 14.390 12.193 1.00 0.00 C ATOM 88 CG LYS A 9 -6.058 15.710 12.007 1.00 0.00 C ATOM 89 CD LYS A 9 -6.386 16.359 13.341 1.00 0.00 C ATOM 90 CE LYS A 9 -7.431 17.453 13.186 1.00 0.00 C ATOM 91 NZ LYS A 9 -8.815 16.919 13.311 1.00 0.00 N ATOM 0 H LYS A 9 -3.675 16.209 13.497 1.00 0.00 H new ATOM 0 HA LYS A 9 -3.355 13.541 12.258 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.595 13.720 11.375 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -5.675 13.921 13.114 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -5.442 16.386 11.414 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.978 15.543 11.447 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.750 15.602 14.035 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -5.479 16.780 13.775 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -7.268 18.221 13.943 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -7.313 17.933 12.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -9.498 17.695 13.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -8.979 16.205 12.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -8.936 16.484 14.248 1.00 0.00 H new ATOM 105 N ARG A 10 -2.095 15.803 11.088 1.00 0.00 N ATOM 106 CA ARG A 10 -1.506 16.537 9.975 1.00 0.00 C ATOM 107 C ARG A 10 -0.325 15.774 9.384 1.00 0.00 C ATOM 108 O ARG A 10 0.832 16.085 9.667 1.00 0.00 O ATOM 109 CB ARG A 10 -1.053 17.925 10.433 1.00 0.00 C ATOM 110 CG ARG A 10 -0.248 17.907 11.723 1.00 0.00 C ATOM 111 CD ARG A 10 0.041 19.315 12.218 1.00 0.00 C ATOM 112 NE ARG A 10 1.057 19.329 13.267 1.00 0.00 N ATOM 113 CZ ARG A 10 1.323 20.390 14.019 1.00 0.00 C ATOM 114 NH1 ARG A 10 0.650 21.519 13.840 1.00 0.00 N ATOM 115 NH2 ARG A 10 2.263 20.325 14.954 1.00 0.00 N ATOM 0 H ARG A 10 -1.497 15.736 11.912 1.00 0.00 H new ATOM 0 HA ARG A 10 -2.268 16.648 9.203 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -0.452 18.380 9.646 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -1.930 18.557 10.570 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -0.796 17.357 12.488 1.00 0.00 H new ATOM 0 HG3 ARG A 10 0.691 17.377 11.560 1.00 0.00 H new ATOM 0 HD2 ARG A 10 0.374 19.932 11.383 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -0.878 19.762 12.598 1.00 0.00 H new ATOM 0 HE ARG A 10 1.592 18.476 13.431 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -0.074 21.573 13.123 1.00 0.00 H new ATOM 0 HH12 ARG A 10 0.856 22.333 14.419 1.00 0.00 H new ATOM 0 HH21 ARG A 10 2.782 19.459 15.096 1.00 0.00 H new ATOM 0 HH22 ARG A 10 2.466 21.141 15.531 1.00 0.00 H new ATOM 129 N ALA A 11 -0.624 14.772 8.564 1.00 0.00 N ATOM 130 CA ALA A 11 0.413 13.965 7.933 1.00 0.00 C ATOM 131 C ALA A 11 -0.130 13.233 6.710 1.00 0.00 C ATOM 132 O ALA A 11 -1.339 13.054 6.568 1.00 0.00 O ATOM 133 CB ALA A 11 0.991 12.973 8.931 1.00 0.00 C ATOM 0 H ALA A 11 -1.576 14.500 8.321 1.00 0.00 H new ATOM 0 HA ALA A 11 1.207 14.633 7.601 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.764 12.377 8.446 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.424 13.514 9.772 1.00 0.00 H new ATOM 0 HB3 ALA A 11 0.199 12.316 9.291 1.00 0.00 H new ATOM 139 N TRP A 12 0.772 12.812 5.830 1.00 0.00 N ATOM 140 CA TRP A 12 0.383 12.100 4.619 1.00 0.00 C ATOM 141 C TRP A 12 0.403 10.592 4.844 1.00 0.00 C ATOM 142 O TRP A 12 0.845 9.832 3.981 1.00 0.00 O ATOM 143 CB TRP A 12 1.315 12.468 3.464 1.00 0.00 C ATOM 144 CG TRP A 12 2.603 11.701 3.473 1.00 0.00 C ATOM 145 CD1 TRP A 12 3.265 11.223 4.567 1.00 0.00 C ATOM 146 CD2 TRP A 12 3.385 11.327 2.333 1.00 0.00 C ATOM 147 NE1 TRP A 12 4.411 10.573 4.177 1.00 0.00 N ATOM 148 CE2 TRP A 12 4.507 10.622 2.812 1.00 0.00 C ATOM 149 CE3 TRP A 12 3.246 11.516 0.956 1.00 0.00 C ATOM 150 CZ2 TRP A 12 5.483 10.109 1.961 1.00 0.00 C ATOM 151 CZ3 TRP A 12 4.215 11.007 0.112 1.00 0.00 C ATOM 152 CH2 TRP A 12 5.321 10.309 0.617 1.00 0.00 C ATOM 0 H TRP A 12 1.777 12.952 5.933 1.00 0.00 H new ATOM 0 HA TRP A 12 -0.634 12.397 4.364 1.00 0.00 H new ATOM 0 HB2 TRP A 12 0.800 12.289 2.520 1.00 0.00 H new ATOM 0 HB3 TRP A 12 1.535 13.535 3.510 1.00 0.00 H new ATOM 0 HD1 TRP A 12 2.936 11.339 5.589 1.00 0.00 H new ATOM 0 HE1 TRP A 12 5.081 10.126 4.803 1.00 0.00 H new ATOM 0 HE3 TRP A 12 2.396 12.051 0.558 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 6.337 9.573 2.348 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 4.119 11.149 -0.954 1.00 0.00 H new ATOM 0 HH2 TRP A 12 6.060 9.921 -0.069 1.00 0.00 H new ATOM 163 N ILE A 13 -0.078 10.165 6.007 1.00 0.00 N ATOM 164 CA ILE A 13 -0.116 8.747 6.343 1.00 0.00 C ATOM 165 C ILE A 13 -0.891 7.954 5.296 1.00 0.00 C ATOM 166 O ILE A 13 -1.513 8.527 4.401 1.00 0.00 O ATOM 167 CB ILE A 13 -0.754 8.513 7.725 1.00 0.00 C ATOM 168 CG1 ILE A 13 -2.198 9.021 7.736 1.00 0.00 C ATOM 169 CG2 ILE A 13 0.063 9.199 8.809 1.00 0.00 C ATOM 170 CD1 ILE A 13 -3.067 8.349 8.776 1.00 0.00 C ATOM 0 H ILE A 13 -0.447 10.781 6.732 1.00 0.00 H new ATOM 0 HA ILE A 13 0.917 8.400 6.366 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.763 7.442 7.928 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -2.195 10.096 7.916 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -2.637 8.864 6.751 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -0.401 9.024 9.780 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.075 8.795 8.812 1.00 0.00 H new ATOM 0 HG23 ILE A 13 0.101 10.271 8.613 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -4.076 8.758 8.726 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -3.100 7.277 8.584 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -2.651 8.527 9.768 1.00 0.00 H new ATOM 182 N THR A 14 -0.851 6.631 5.415 1.00 0.00 N ATOM 183 CA THR A 14 -1.550 5.758 4.480 1.00 0.00 C ATOM 184 C THR A 14 -2.404 4.734 5.218 1.00 0.00 C ATOM 185 O THR A 14 -2.376 4.657 6.445 1.00 0.00 O ATOM 186 CB THR A 14 -0.563 5.017 3.558 1.00 0.00 C ATOM 187 OG1 THR A 14 0.387 4.287 4.342 1.00 0.00 O ATOM 188 CG2 THR A 14 0.167 5.996 2.650 1.00 0.00 C ATOM 0 H THR A 14 -0.342 6.140 6.150 1.00 0.00 H new ATOM 0 HA THR A 14 -2.194 6.395 3.874 1.00 0.00 H new ATOM 0 HB THR A 14 -1.130 4.323 2.938 1.00 0.00 H new ATOM 0 HG1 THR A 14 1.010 3.818 3.748 1.00 0.00 H new ATOM 0 HG21 THR A 14 0.859 5.450 2.008 1.00 0.00 H new ATOM 0 HG22 THR A 14 -0.557 6.529 2.034 1.00 0.00 H new ATOM 0 HG23 THR A 14 0.723 6.710 3.257 1.00 0.00 H new ATOM 196 N ALA A 15 -3.163 3.948 4.461 1.00 0.00 N ATOM 197 CA ALA A 15 -4.024 2.926 5.043 1.00 0.00 C ATOM 198 C ALA A 15 -3.359 1.555 4.995 1.00 0.00 C ATOM 199 O ALA A 15 -2.609 1.234 4.072 1.00 0.00 O ATOM 200 CB ALA A 15 -5.363 2.891 4.322 1.00 0.00 C ATOM 0 H ALA A 15 -3.199 4.000 3.443 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.194 3.182 6.089 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.996 2.123 4.767 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.851 3.861 4.413 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.203 2.663 3.268 1.00 0.00 H new ATOM 206 N PRO A 16 -3.636 0.726 6.012 1.00 0.00 N ATOM 207 CA PRO A 16 -3.074 -0.625 6.108 1.00 0.00 C ATOM 208 C PRO A 16 -3.646 -1.567 5.055 1.00 0.00 C ATOM 209 O PRO A 16 -4.859 -1.632 4.859 1.00 0.00 O ATOM 210 CB PRO A 16 -3.483 -1.080 7.511 1.00 0.00 C ATOM 211 CG PRO A 16 -4.703 -0.286 7.826 1.00 0.00 C ATOM 212 CD PRO A 16 -4.521 1.042 7.146 1.00 0.00 C ATOM 0 HA PRO A 16 -1.997 -0.631 5.940 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -3.690 -2.150 7.536 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -2.690 -0.892 8.235 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -5.600 -0.789 7.465 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -4.819 -0.160 8.902 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -5.472 1.455 6.810 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -4.072 1.777 7.814 1.00 0.00 H new ATOM 220 N VAL A 17 -2.764 -2.297 4.379 1.00 0.00 N ATOM 221 CA VAL A 17 -3.181 -3.237 3.346 1.00 0.00 C ATOM 222 C VAL A 17 -3.203 -4.665 3.879 1.00 0.00 C ATOM 223 O VAL A 17 -2.159 -5.299 4.030 1.00 0.00 O ATOM 224 CB VAL A 17 -2.252 -3.174 2.120 1.00 0.00 C ATOM 225 CG1 VAL A 17 -2.686 -4.182 1.067 1.00 0.00 C ATOM 226 CG2 VAL A 17 -2.226 -1.766 1.544 1.00 0.00 C ATOM 0 H VAL A 17 -1.756 -2.255 4.529 1.00 0.00 H new ATOM 0 HA VAL A 17 -4.188 -2.948 3.045 1.00 0.00 H new ATOM 0 HB VAL A 17 -1.242 -3.431 2.438 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -2.017 -4.122 0.208 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.648 -5.187 1.488 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.705 -3.960 0.749 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.565 -1.739 0.678 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -3.233 -1.478 1.241 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.862 -1.070 2.300 1.00 0.00 H new ATOM 236 N ALA A 18 -4.401 -5.167 4.163 1.00 0.00 N ATOM 237 CA ALA A 18 -4.560 -6.521 4.678 1.00 0.00 C ATOM 238 C ALA A 18 -5.075 -7.463 3.595 1.00 0.00 C ATOM 239 O ALA A 18 -6.171 -7.276 3.065 1.00 0.00 O ATOM 240 CB ALA A 18 -5.500 -6.524 5.874 1.00 0.00 C ATOM 0 H ALA A 18 -5.276 -4.656 4.045 1.00 0.00 H new ATOM 0 HA ALA A 18 -3.582 -6.879 4.999 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.609 -7.542 6.248 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -5.090 -5.890 6.660 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.475 -6.142 5.571 1.00 0.00 H new ATOM 246 N LEU A 19 -4.278 -8.475 3.269 1.00 0.00 N ATOM 247 CA LEU A 19 -4.654 -9.446 2.248 1.00 0.00 C ATOM 248 C LEU A 19 -4.746 -10.849 2.839 1.00 0.00 C ATOM 249 O LEU A 19 -4.403 -11.068 4.001 1.00 0.00 O ATOM 250 CB LEU A 19 -3.640 -9.428 1.102 1.00 0.00 C ATOM 251 CG LEU A 19 -3.378 -8.066 0.459 1.00 0.00 C ATOM 252 CD1 LEU A 19 -2.249 -8.163 -0.555 1.00 0.00 C ATOM 253 CD2 LEU A 19 -4.643 -7.533 -0.197 1.00 0.00 C ATOM 0 H LEU A 19 -3.368 -8.644 3.697 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.635 -9.170 1.862 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.694 -9.819 1.475 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.985 -10.113 0.327 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.077 -7.368 1.241 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.077 -7.184 -1.002 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.340 -8.499 -0.056 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.520 -8.875 -1.334 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.437 -6.563 -0.649 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.975 -8.229 -0.967 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -5.425 -7.424 0.555 1.00 0.00 H new ATOM 265 N ARG A 20 -5.208 -11.797 2.030 1.00 0.00 N ATOM 266 CA ARG A 20 -5.344 -13.180 2.472 1.00 0.00 C ATOM 267 C ARG A 20 -4.363 -14.085 1.735 1.00 0.00 C ATOM 268 O ARG A 20 -4.348 -14.129 0.505 1.00 0.00 O ATOM 269 CB ARG A 20 -6.776 -13.671 2.248 1.00 0.00 C ATOM 270 CG ARG A 20 -6.988 -15.125 2.637 1.00 0.00 C ATOM 271 CD ARG A 20 -8.448 -15.529 2.505 1.00 0.00 C ATOM 272 NE ARG A 20 -8.758 -16.033 1.169 1.00 0.00 N ATOM 273 CZ ARG A 20 -9.993 -16.141 0.693 1.00 0.00 C ATOM 274 NH1 ARG A 20 -11.029 -15.782 1.438 1.00 0.00 N ATOM 275 NH2 ARG A 20 -10.194 -16.609 -0.533 1.00 0.00 N ATOM 0 H ARG A 20 -5.494 -11.633 1.065 1.00 0.00 H new ATOM 0 HA ARG A 20 -5.117 -13.219 3.537 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -7.460 -13.046 2.823 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -7.035 -13.543 1.197 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -6.373 -15.765 2.004 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -6.658 -15.280 3.664 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -8.680 -16.295 3.244 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -9.083 -14.671 2.725 1.00 0.00 H new ATOM 0 HE ARG A 20 -7.984 -16.317 0.569 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -10.879 -15.421 2.380 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -11.976 -15.866 1.069 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -9.400 -16.886 -1.110 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -11.143 -16.692 -0.898 1.00 0.00 H new ATOM 289 N GLU A 21 -3.544 -14.806 2.495 1.00 0.00 N ATOM 290 CA GLU A 21 -2.559 -15.709 1.913 1.00 0.00 C ATOM 291 C GLU A 21 -3.234 -16.942 1.320 1.00 0.00 C ATOM 292 O GLU A 21 -4.254 -17.409 1.826 1.00 0.00 O ATOM 293 CB GLU A 21 -1.536 -16.133 2.969 1.00 0.00 C ATOM 294 CG GLU A 21 -2.124 -16.992 4.076 1.00 0.00 C ATOM 295 CD GLU A 21 -1.199 -17.117 5.271 1.00 0.00 C ATOM 296 OE1 GLU A 21 -1.224 -16.218 6.138 1.00 0.00 O ATOM 297 OE2 GLU A 21 -0.451 -18.114 5.339 1.00 0.00 O ATOM 0 H GLU A 21 -3.544 -14.782 3.515 1.00 0.00 H new ATOM 0 HA GLU A 21 -2.045 -15.177 1.112 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -0.731 -16.684 2.482 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -1.091 -15.241 3.410 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -3.073 -16.563 4.399 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.341 -17.986 3.684 1.00 0.00 H new ATOM 304 N GLY A 22 -2.658 -17.465 0.242 1.00 0.00 N ATOM 305 CA GLY A 22 -3.218 -18.638 -0.404 1.00 0.00 C ATOM 306 C GLY A 22 -3.854 -18.316 -1.741 1.00 0.00 C ATOM 307 O GLY A 22 -3.606 -18.999 -2.734 1.00 0.00 O ATOM 0 H GLY A 22 -1.813 -17.097 -0.196 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.432 -19.379 -0.548 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -3.964 -19.088 0.251 1.00 0.00 H new ATOM 311 N GLU A 23 -4.678 -17.273 -1.767 1.00 0.00 N ATOM 312 CA GLU A 23 -5.354 -16.864 -2.993 1.00 0.00 C ATOM 313 C GLU A 23 -4.687 -15.631 -3.596 1.00 0.00 C ATOM 314 O GLU A 23 -4.371 -14.675 -2.889 1.00 0.00 O ATOM 315 CB GLU A 23 -6.831 -16.575 -2.715 1.00 0.00 C ATOM 316 CG GLU A 23 -7.622 -16.206 -3.959 1.00 0.00 C ATOM 317 CD GLU A 23 -9.114 -16.419 -3.785 1.00 0.00 C ATOM 318 OE1 GLU A 23 -9.509 -17.522 -3.354 1.00 0.00 O ATOM 319 OE2 GLU A 23 -9.885 -15.482 -4.080 1.00 0.00 O ATOM 0 H GLU A 23 -4.893 -16.696 -0.954 1.00 0.00 H new ATOM 0 HA GLU A 23 -5.280 -17.682 -3.709 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -7.284 -17.452 -2.253 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -6.904 -15.761 -1.993 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -7.434 -15.162 -4.208 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -7.269 -16.803 -4.800 1.00 0.00 H new ATOM 326 N ASP A 24 -4.476 -15.662 -4.907 1.00 0.00 N ATOM 327 CA ASP A 24 -3.848 -14.548 -5.607 1.00 0.00 C ATOM 328 C ASP A 24 -4.729 -13.304 -5.550 1.00 0.00 C ATOM 329 O ASP A 24 -5.938 -13.375 -5.778 1.00 0.00 O ATOM 330 CB ASP A 24 -3.569 -14.924 -7.063 1.00 0.00 C ATOM 331 CG ASP A 24 -4.840 -15.194 -7.845 1.00 0.00 C ATOM 332 OD1 ASP A 24 -5.463 -14.221 -8.319 1.00 0.00 O ATOM 333 OD2 ASP A 24 -5.211 -16.378 -7.983 1.00 0.00 O ATOM 0 H ASP A 24 -4.731 -16.447 -5.507 1.00 0.00 H new ATOM 0 HA ASP A 24 -2.904 -14.326 -5.110 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.015 -14.118 -7.544 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -2.933 -15.809 -7.091 1.00 0.00 H new ATOM 338 N LEU A 25 -4.117 -12.165 -5.243 1.00 0.00 N ATOM 339 CA LEU A 25 -4.846 -10.905 -5.154 1.00 0.00 C ATOM 340 C LEU A 25 -4.853 -10.184 -6.499 1.00 0.00 C ATOM 341 O LEU A 25 -4.165 -9.179 -6.679 1.00 0.00 O ATOM 342 CB LEU A 25 -4.223 -10.007 -4.084 1.00 0.00 C ATOM 343 CG LEU A 25 -4.554 -10.361 -2.634 1.00 0.00 C ATOM 344 CD1 LEU A 25 -6.060 -10.442 -2.435 1.00 0.00 C ATOM 345 CD2 LEU A 25 -3.891 -11.673 -2.241 1.00 0.00 C ATOM 0 H LEU A 25 -3.118 -12.089 -5.052 1.00 0.00 H new ATOM 0 HA LEU A 25 -5.876 -11.128 -4.877 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -3.140 -10.030 -4.204 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -4.542 -8.981 -4.268 1.00 0.00 H new ATOM 0 HG LEU A 25 -4.165 -9.573 -1.989 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -6.277 -10.695 -1.397 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -6.511 -9.479 -2.676 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -6.473 -11.210 -3.089 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -4.137 -11.909 -1.206 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -4.250 -12.471 -2.891 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.810 -11.580 -2.344 1.00 0.00 H new ATOM 357 N SER A 26 -5.637 -10.703 -7.438 1.00 0.00 N ATOM 358 CA SER A 26 -5.732 -10.111 -8.767 1.00 0.00 C ATOM 359 C SER A 26 -7.023 -9.310 -8.913 1.00 0.00 C ATOM 360 O SER A 26 -7.911 -9.381 -8.064 1.00 0.00 O ATOM 361 CB SER A 26 -5.670 -11.199 -9.840 1.00 0.00 C ATOM 362 OG SER A 26 -6.913 -11.869 -9.960 1.00 0.00 O ATOM 0 H SER A 26 -6.216 -11.532 -7.303 1.00 0.00 H new ATOM 0 HA SER A 26 -4.887 -9.435 -8.897 1.00 0.00 H new ATOM 0 HB2 SER A 26 -5.399 -10.755 -10.798 1.00 0.00 H new ATOM 0 HB3 SER A 26 -4.889 -11.917 -9.590 1.00 0.00 H new ATOM 0 HG SER A 26 -6.861 -12.737 -9.509 1.00 0.00 H new ATOM 368 N LYS A 27 -7.119 -8.547 -9.997 1.00 0.00 N ATOM 369 CA LYS A 27 -8.299 -7.733 -10.258 1.00 0.00 C ATOM 370 C LYS A 27 -8.699 -6.941 -9.017 1.00 0.00 C ATOM 371 O LYS A 27 -9.865 -6.583 -8.845 1.00 0.00 O ATOM 372 CB LYS A 27 -9.464 -8.616 -10.709 1.00 0.00 C ATOM 373 CG LYS A 27 -10.378 -7.948 -11.722 1.00 0.00 C ATOM 374 CD LYS A 27 -9.961 -8.268 -13.147 1.00 0.00 C ATOM 375 CE LYS A 27 -10.793 -7.496 -14.159 1.00 0.00 C ATOM 376 NZ LYS A 27 -10.608 -8.016 -15.542 1.00 0.00 N ATOM 0 H LYS A 27 -6.392 -8.476 -10.709 1.00 0.00 H new ATOM 0 HA LYS A 27 -8.055 -7.029 -11.054 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -9.067 -9.534 -11.141 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -10.051 -8.902 -9.836 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -11.404 -8.277 -11.560 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.362 -6.869 -11.571 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -8.907 -8.026 -13.281 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -10.068 -9.338 -13.327 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -11.846 -7.558 -13.886 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -10.517 -6.442 -14.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -11.192 -7.463 -16.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -9.607 -7.934 -15.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -10.895 -9.015 -15.579 1.00 0.00 H new ATOM 390 N LYS A 28 -7.726 -6.670 -8.155 1.00 0.00 N ATOM 391 CA LYS A 28 -7.975 -5.918 -6.930 1.00 0.00 C ATOM 392 C LYS A 28 -7.133 -4.646 -6.892 1.00 0.00 C ATOM 393 O LYS A 28 -7.550 -3.632 -6.334 1.00 0.00 O ATOM 394 CB LYS A 28 -7.667 -6.782 -5.705 1.00 0.00 C ATOM 395 CG LYS A 28 -8.714 -7.849 -5.435 1.00 0.00 C ATOM 396 CD LYS A 28 -8.829 -8.154 -3.951 1.00 0.00 C ATOM 397 CE LYS A 28 -9.664 -9.401 -3.702 1.00 0.00 C ATOM 398 NZ LYS A 28 -8.962 -10.637 -4.147 1.00 0.00 N ATOM 0 H LYS A 28 -6.756 -6.960 -8.282 1.00 0.00 H new ATOM 0 HA LYS A 28 -9.028 -5.637 -6.914 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.698 -7.262 -5.844 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -7.582 -6.139 -4.829 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -9.680 -7.517 -5.815 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -8.455 -8.759 -5.976 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -7.834 -8.291 -3.528 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -9.279 -7.305 -3.438 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.895 -9.477 -2.639 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -10.614 -9.313 -4.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -9.553 -11.142 -4.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -8.055 -10.382 -4.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -8.788 -11.252 -3.326 1.00 0.00 H new ATOM 412 N ASN A 29 -5.948 -4.707 -7.491 1.00 0.00 N ATOM 413 CA ASN A 29 -5.049 -3.560 -7.526 1.00 0.00 C ATOM 414 C ASN A 29 -5.706 -2.375 -8.228 1.00 0.00 C ATOM 415 O ASN A 29 -6.628 -2.530 -9.029 1.00 0.00 O ATOM 416 CB ASN A 29 -3.745 -3.929 -8.236 1.00 0.00 C ATOM 417 CG ASN A 29 -3.945 -4.997 -9.294 1.00 0.00 C ATOM 418 OD1 ASN A 29 -4.192 -4.691 -10.461 1.00 0.00 O ATOM 419 ND2 ASN A 29 -3.838 -6.257 -8.889 1.00 0.00 N ATOM 0 H ASN A 29 -5.588 -5.539 -7.959 1.00 0.00 H new ATOM 0 HA ASN A 29 -4.826 -3.273 -6.498 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -3.322 -3.038 -8.699 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -3.021 -4.281 -7.501 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -3.962 -7.019 -9.555 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -3.632 -6.463 -7.911 1.00 0.00 H new ATOM 426 N PRO A 30 -5.221 -1.163 -7.922 1.00 0.00 N ATOM 427 CA PRO A 30 -4.125 -0.966 -6.969 1.00 0.00 C ATOM 428 C PRO A 30 -4.542 -1.269 -5.534 1.00 0.00 C ATOM 429 O PRO A 30 -5.640 -0.909 -5.108 1.00 0.00 O ATOM 430 CB PRO A 30 -3.782 0.518 -7.124 1.00 0.00 C ATOM 431 CG PRO A 30 -5.038 1.146 -7.622 1.00 0.00 C ATOM 432 CD PRO A 30 -5.707 0.110 -8.482 1.00 0.00 C ATOM 0 HA PRO A 30 -3.287 -1.634 -7.168 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.471 0.954 -6.175 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -2.961 0.664 -7.826 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -5.682 1.440 -6.793 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -4.823 2.048 -8.194 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -6.793 0.184 -8.429 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.431 0.219 -9.531 1.00 0.00 H new ATOM 440 N ILE A 31 -3.661 -1.933 -4.794 1.00 0.00 N ATOM 441 CA ILE A 31 -3.938 -2.283 -3.407 1.00 0.00 C ATOM 442 C ILE A 31 -3.315 -1.272 -2.450 1.00 0.00 C ATOM 443 O ILE A 31 -3.742 -1.143 -1.303 1.00 0.00 O ATOM 444 CB ILE A 31 -3.411 -3.689 -3.064 1.00 0.00 C ATOM 445 CG1 ILE A 31 -1.897 -3.755 -3.272 1.00 0.00 C ATOM 446 CG2 ILE A 31 -4.113 -4.739 -3.913 1.00 0.00 C ATOM 447 CD1 ILE A 31 -1.258 -4.990 -2.677 1.00 0.00 C ATOM 0 H ILE A 31 -2.749 -2.240 -5.132 1.00 0.00 H new ATOM 0 HA ILE A 31 -5.022 -2.272 -3.290 1.00 0.00 H new ATOM 0 HB ILE A 31 -3.624 -3.895 -2.015 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -1.684 -3.724 -4.340 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -1.439 -2.870 -2.830 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -3.730 -5.727 -3.659 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -5.185 -4.705 -3.721 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.927 -4.538 -4.968 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.184 -4.969 -2.863 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -1.440 -5.012 -1.603 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.689 -5.880 -3.136 1.00 0.00 H new ATOM 459 N ALA A 32 -2.304 -0.556 -2.930 1.00 0.00 N ATOM 460 CA ALA A 32 -1.624 0.446 -2.119 1.00 0.00 C ATOM 461 C ALA A 32 -0.873 1.443 -2.995 1.00 0.00 C ATOM 462 O ALA A 32 -0.274 1.071 -4.004 1.00 0.00 O ATOM 463 CB ALA A 32 -0.671 -0.224 -1.141 1.00 0.00 C ATOM 0 H ALA A 32 -1.938 -0.651 -3.877 1.00 0.00 H new ATOM 0 HA ALA A 32 -2.378 0.994 -1.555 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -0.170 0.537 -0.542 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.231 -0.891 -0.486 1.00 0.00 H new ATOM 0 HB3 ALA A 32 0.073 -0.799 -1.693 1.00 0.00 H new ATOM 469 N LYS A 33 -0.908 2.712 -2.602 1.00 0.00 N ATOM 470 CA LYS A 33 -0.229 3.764 -3.350 1.00 0.00 C ATOM 471 C LYS A 33 0.221 4.888 -2.422 1.00 0.00 C ATOM 472 O LYS A 33 -0.402 5.140 -1.390 1.00 0.00 O ATOM 473 CB LYS A 33 -1.152 4.323 -4.435 1.00 0.00 C ATOM 474 CG LYS A 33 -2.379 5.031 -3.885 1.00 0.00 C ATOM 475 CD LYS A 33 -3.224 5.628 -4.998 1.00 0.00 C ATOM 476 CE LYS A 33 -2.518 6.795 -5.670 1.00 0.00 C ATOM 477 NZ LYS A 33 -3.481 7.725 -6.322 1.00 0.00 N ATOM 0 H LYS A 33 -1.400 3.037 -1.769 1.00 0.00 H new ATOM 0 HA LYS A 33 0.653 3.330 -3.820 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -0.589 5.020 -5.056 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -1.473 3.507 -5.083 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -2.979 4.326 -3.309 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -2.068 5.820 -3.200 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -3.446 4.860 -5.739 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.178 5.964 -4.592 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -1.932 7.340 -4.930 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.818 6.416 -6.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.960 8.507 -6.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.023 7.212 -7.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -4.133 8.107 -5.607 1.00 0.00 H new ATOM 491 N ILE A 34 1.304 5.560 -2.797 1.00 0.00 N ATOM 492 CA ILE A 34 1.835 6.659 -1.999 1.00 0.00 C ATOM 493 C ILE A 34 0.908 7.869 -2.045 1.00 0.00 C ATOM 494 O ILE A 34 0.554 8.353 -3.120 1.00 0.00 O ATOM 495 CB ILE A 34 3.235 7.080 -2.482 1.00 0.00 C ATOM 496 CG1 ILE A 34 4.131 5.851 -2.650 1.00 0.00 C ATOM 497 CG2 ILE A 34 3.857 8.067 -1.506 1.00 0.00 C ATOM 498 CD1 ILE A 34 5.392 6.126 -3.440 1.00 0.00 C ATOM 0 H ILE A 34 1.831 5.363 -3.648 1.00 0.00 H new ATOM 0 HA ILE A 34 1.907 6.298 -0.973 1.00 0.00 H new ATOM 0 HB ILE A 34 3.137 7.570 -3.451 1.00 0.00 H new ATOM 0 HG12 ILE A 34 4.404 5.473 -1.665 1.00 0.00 H new ATOM 0 HG13 ILE A 34 3.565 5.064 -3.147 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.846 8.355 -1.861 1.00 0.00 H new ATOM 0 HG22 ILE A 34 3.226 8.953 -1.432 1.00 0.00 H new ATOM 0 HG23 ILE A 34 3.945 7.601 -0.524 1.00 0.00 H new ATOM 0 HD11 ILE A 34 5.979 5.211 -3.519 1.00 0.00 H new ATOM 0 HD12 ILE A 34 5.127 6.475 -4.438 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.980 6.891 -2.932 1.00 0.00 H new ATOM 510 N HIS A 35 0.520 8.355 -0.870 1.00 0.00 N ATOM 511 CA HIS A 35 -0.364 9.511 -0.775 1.00 0.00 C ATOM 512 C HIS A 35 0.405 10.805 -1.027 1.00 0.00 C ATOM 513 O HIS A 35 0.365 11.730 -0.216 1.00 0.00 O ATOM 514 CB HIS A 35 -1.030 9.559 0.601 1.00 0.00 C ATOM 515 CG HIS A 35 -2.132 8.559 0.768 1.00 0.00 C ATOM 516 ND1 HIS A 35 -3.280 8.818 1.487 1.00 0.00 N ATOM 517 CD2 HIS A 35 -2.258 7.295 0.303 1.00 0.00 C ATOM 518 CE1 HIS A 35 -4.064 7.755 1.458 1.00 0.00 C ATOM 519 NE2 HIS A 35 -3.467 6.816 0.746 1.00 0.00 N ATOM 0 H HIS A 35 0.804 7.966 0.029 1.00 0.00 H new ATOM 0 HA HIS A 35 -1.135 9.412 -1.540 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -0.274 9.386 1.367 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -1.430 10.559 0.767 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -1.541 6.762 -0.304 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -5.029 7.668 1.935 1.00 0.00 H new ATOM 0 HE2 HIS A 35 -3.842 5.887 0.556 1.00 0.00 H new ATOM 528 N SER A 36 1.104 10.862 -2.156 1.00 0.00 N ATOM 529 CA SER A 36 1.885 12.040 -2.512 1.00 0.00 C ATOM 530 C SER A 36 0.974 13.230 -2.800 1.00 0.00 C ATOM 531 O SER A 36 -0.245 13.141 -2.656 1.00 0.00 O ATOM 532 CB SER A 36 2.761 11.747 -3.732 1.00 0.00 C ATOM 533 OG SER A 36 3.756 12.743 -3.897 1.00 0.00 O ATOM 0 H SER A 36 1.145 10.106 -2.840 1.00 0.00 H new ATOM 0 HA SER A 36 2.524 12.291 -1.666 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.234 10.772 -3.618 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.140 11.698 -4.626 1.00 0.00 H new ATOM 0 HG SER A 36 4.113 12.997 -3.020 1.00 0.00 H new ATOM 539 N ASP A 37 1.576 14.342 -3.206 1.00 0.00 N ATOM 540 CA ASP A 37 0.820 15.551 -3.515 1.00 0.00 C ATOM 541 C ASP A 37 1.690 16.561 -4.256 1.00 0.00 C ATOM 542 O ASP A 37 2.876 16.323 -4.489 1.00 0.00 O ATOM 543 CB ASP A 37 0.271 16.177 -2.231 1.00 0.00 C ATOM 544 CG ASP A 37 -1.024 15.531 -1.780 1.00 0.00 C ATOM 545 OD1 ASP A 37 -2.027 15.636 -2.516 1.00 0.00 O ATOM 546 OD2 ASP A 37 -1.035 14.921 -0.690 1.00 0.00 O ATOM 0 H ASP A 37 2.585 14.432 -3.329 1.00 0.00 H new ATOM 0 HA ASP A 37 -0.014 15.274 -4.160 1.00 0.00 H new ATOM 0 HB2 ASP A 37 1.014 16.086 -1.439 1.00 0.00 H new ATOM 0 HB3 ASP A 37 0.106 17.242 -2.392 1.00 0.00 H new ATOM 551 N LEU A 38 1.094 17.689 -4.625 1.00 0.00 N ATOM 552 CA LEU A 38 1.813 18.736 -5.342 1.00 0.00 C ATOM 553 C LEU A 38 2.339 18.220 -6.678 1.00 0.00 C ATOM 554 O LEU A 38 3.315 18.741 -7.216 1.00 0.00 O ATOM 555 CB LEU A 38 2.973 19.258 -4.493 1.00 0.00 C ATOM 556 CG LEU A 38 2.651 20.430 -3.564 1.00 0.00 C ATOM 557 CD1 LEU A 38 3.658 20.502 -2.426 1.00 0.00 C ATOM 558 CD2 LEU A 38 2.630 21.737 -4.343 1.00 0.00 C ATOM 0 H LEU A 38 0.114 17.902 -4.439 1.00 0.00 H new ATOM 0 HA LEU A 38 1.117 19.552 -5.537 1.00 0.00 H new ATOM 0 HB2 LEU A 38 3.353 18.435 -3.888 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.779 19.561 -5.162 1.00 0.00 H new ATOM 0 HG LEU A 38 1.662 20.269 -3.136 1.00 0.00 H new ATOM 0 HD11 LEU A 38 3.413 21.342 -1.776 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.625 19.576 -1.851 1.00 0.00 H new ATOM 0 HD13 LEU A 38 4.659 20.640 -2.834 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.399 22.560 -3.667 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.606 21.905 -4.799 1.00 0.00 H new ATOM 0 HD23 LEU A 38 1.870 21.684 -5.122 1.00 0.00 H new ATOM 570 N ALA A 39 1.683 17.193 -7.208 1.00 0.00 N ATOM 571 CA ALA A 39 2.081 16.608 -8.483 1.00 0.00 C ATOM 572 C ALA A 39 1.560 17.436 -9.653 1.00 0.00 C ATOM 573 O ALA A 39 2.339 17.994 -10.425 1.00 0.00 O ATOM 574 CB ALA A 39 1.582 15.175 -8.585 1.00 0.00 C ATOM 0 H ALA A 39 0.874 16.749 -6.774 1.00 0.00 H new ATOM 0 HA ALA A 39 3.170 16.606 -8.529 1.00 0.00 H new ATOM 0 HB1 ALA A 39 1.886 14.751 -9.542 1.00 0.00 H new ATOM 0 HB2 ALA A 39 2.007 14.583 -7.774 1.00 0.00 H new ATOM 0 HB3 ALA A 39 0.495 15.162 -8.512 1.00 0.00 H new ATOM 580 N GLU A 40 0.238 17.510 -9.778 1.00 0.00 N ATOM 581 CA GLU A 40 -0.385 18.269 -10.855 1.00 0.00 C ATOM 582 C GLU A 40 -0.659 19.706 -10.421 1.00 0.00 C ATOM 583 O GLU A 40 -0.630 20.627 -11.236 1.00 0.00 O ATOM 584 CB GLU A 40 -1.690 17.599 -11.292 1.00 0.00 C ATOM 585 CG GLU A 40 -2.769 17.614 -10.223 1.00 0.00 C ATOM 586 CD GLU A 40 -3.942 16.717 -10.566 1.00 0.00 C ATOM 587 OE1 GLU A 40 -3.831 15.490 -10.357 1.00 0.00 O ATOM 588 OE2 GLU A 40 -4.971 17.240 -11.043 1.00 0.00 O ATOM 0 H GLU A 40 -0.421 17.054 -9.147 1.00 0.00 H new ATOM 0 HA GLU A 40 0.306 18.288 -11.698 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -2.066 18.102 -12.183 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -1.482 16.566 -11.572 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -2.339 17.296 -9.273 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -3.125 18.635 -10.086 1.00 0.00 H new ATOM 595 N GLU A 41 -0.925 19.888 -9.132 1.00 0.00 N ATOM 596 CA GLU A 41 -1.206 21.212 -8.589 1.00 0.00 C ATOM 597 C GLU A 41 -0.231 22.246 -9.146 1.00 0.00 C ATOM 598 O GLU A 41 -0.621 23.364 -9.484 1.00 0.00 O ATOM 599 CB GLU A 41 -1.125 21.190 -7.062 1.00 0.00 C ATOM 600 CG GLU A 41 -2.091 20.211 -6.415 1.00 0.00 C ATOM 601 CD GLU A 41 -3.463 20.813 -6.183 1.00 0.00 C ATOM 602 OE1 GLU A 41 -3.591 21.673 -5.287 1.00 0.00 O ATOM 603 OE2 GLU A 41 -4.409 20.424 -6.900 1.00 0.00 O ATOM 0 H GLU A 41 -0.952 19.136 -8.444 1.00 0.00 H new ATOM 0 HA GLU A 41 -2.216 21.492 -8.887 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -0.108 20.934 -6.764 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.326 22.191 -6.681 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -2.188 19.329 -7.049 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -1.680 19.876 -5.463 1.00 0.00 H new ATOM 610 N ARG A 42 1.038 21.864 -9.239 1.00 0.00 N ATOM 611 CA ARG A 42 2.070 22.757 -9.753 1.00 0.00 C ATOM 612 C ARG A 42 2.644 22.227 -11.063 1.00 0.00 C ATOM 613 O ARG A 42 2.789 22.968 -12.035 1.00 0.00 O ATOM 614 CB ARG A 42 3.189 22.924 -8.724 1.00 0.00 C ATOM 615 CG ARG A 42 2.956 24.069 -7.752 1.00 0.00 C ATOM 616 CD ARG A 42 4.261 24.551 -7.136 1.00 0.00 C ATOM 617 NE ARG A 42 4.035 25.377 -5.953 1.00 0.00 N ATOM 618 CZ ARG A 42 4.964 26.161 -5.416 1.00 0.00 C ATOM 619 NH1 ARG A 42 6.174 26.225 -5.954 1.00 0.00 N ATOM 620 NH2 ARG A 42 4.682 26.883 -4.339 1.00 0.00 N ATOM 0 H ARG A 42 1.377 20.942 -8.965 1.00 0.00 H new ATOM 0 HA ARG A 42 1.613 23.728 -9.943 1.00 0.00 H new ATOM 0 HB2 ARG A 42 3.295 21.997 -8.161 1.00 0.00 H new ATOM 0 HB3 ARG A 42 4.131 23.089 -9.247 1.00 0.00 H new ATOM 0 HG2 ARG A 42 2.470 24.895 -8.271 1.00 0.00 H new ATOM 0 HG3 ARG A 42 2.277 23.745 -6.963 1.00 0.00 H new ATOM 0 HD2 ARG A 42 4.874 23.691 -6.866 1.00 0.00 H new ATOM 0 HD3 ARG A 42 4.822 25.123 -7.876 1.00 0.00 H new ATOM 0 HE ARG A 42 3.114 25.351 -5.515 1.00 0.00 H new ATOM 0 HH11 ARG A 42 6.394 25.672 -6.782 1.00 0.00 H new ATOM 0 HH12 ARG A 42 6.885 26.828 -5.540 1.00 0.00 H new ATOM 0 HH21 ARG A 42 3.752 26.836 -3.923 1.00 0.00 H new ATOM 0 HH22 ARG A 42 5.395 27.485 -3.927 1.00 0.00 H new ATOM 634 N GLY A 43 2.971 20.938 -11.082 1.00 0.00 N ATOM 635 CA GLY A 43 3.527 20.331 -12.277 1.00 0.00 C ATOM 636 C GLY A 43 4.760 19.500 -11.986 1.00 0.00 C ATOM 637 O GLY A 43 5.716 19.499 -12.762 1.00 0.00 O ATOM 0 H GLY A 43 2.861 20.304 -10.291 1.00 0.00 H new ATOM 0 HA2 GLY A 43 2.771 19.701 -12.746 1.00 0.00 H new ATOM 0 HA3 GLY A 43 3.780 21.113 -12.993 1.00 0.00 H new ATOM 641 N LEU A 44 4.742 18.790 -10.862 1.00 0.00 N ATOM 642 CA LEU A 44 5.868 17.952 -10.468 1.00 0.00 C ATOM 643 C LEU A 44 5.690 16.525 -10.979 1.00 0.00 C ATOM 644 O LEU A 44 4.571 16.083 -11.240 1.00 0.00 O ATOM 645 CB LEU A 44 6.017 17.945 -8.946 1.00 0.00 C ATOM 646 CG LEU A 44 6.197 19.312 -8.284 1.00 0.00 C ATOM 647 CD1 LEU A 44 5.904 19.225 -6.794 1.00 0.00 C ATOM 648 CD2 LEU A 44 7.604 19.839 -8.523 1.00 0.00 C ATOM 0 H LEU A 44 3.959 18.779 -10.208 1.00 0.00 H new ATOM 0 HA LEU A 44 6.772 18.368 -10.913 1.00 0.00 H new ATOM 0 HB2 LEU A 44 5.136 17.469 -8.517 1.00 0.00 H new ATOM 0 HB3 LEU A 44 6.874 17.323 -8.687 1.00 0.00 H new ATOM 0 HG LEU A 44 5.489 20.009 -8.733 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.037 20.207 -6.339 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.877 18.892 -6.644 1.00 0.00 H new ATOM 0 HD13 LEU A 44 6.588 18.514 -6.330 1.00 0.00 H new ATOM 0 HD21 LEU A 44 7.714 20.812 -8.045 1.00 0.00 H new ATOM 0 HD22 LEU A 44 8.330 19.143 -8.101 1.00 0.00 H new ATOM 0 HD23 LEU A 44 7.778 19.939 -9.594 1.00 0.00 H new ATOM 660 N LYS A 45 6.801 15.809 -11.119 1.00 0.00 N ATOM 661 CA LYS A 45 6.769 14.432 -11.595 1.00 0.00 C ATOM 662 C LYS A 45 7.294 13.475 -10.529 1.00 0.00 C ATOM 663 O LYS A 45 8.494 13.204 -10.463 1.00 0.00 O ATOM 664 CB LYS A 45 7.598 14.293 -12.873 1.00 0.00 C ATOM 665 CG LYS A 45 6.798 14.518 -14.145 1.00 0.00 C ATOM 666 CD LYS A 45 7.399 13.768 -15.322 1.00 0.00 C ATOM 667 CE LYS A 45 6.712 14.137 -16.627 1.00 0.00 C ATOM 668 NZ LYS A 45 5.528 13.274 -16.894 1.00 0.00 N ATOM 0 H LYS A 45 7.735 16.161 -10.909 1.00 0.00 H new ATOM 0 HA LYS A 45 5.733 14.173 -11.812 1.00 0.00 H new ATOM 0 HB2 LYS A 45 8.422 15.006 -12.841 1.00 0.00 H new ATOM 0 HB3 LYS A 45 8.040 13.297 -12.903 1.00 0.00 H new ATOM 0 HG2 LYS A 45 5.769 14.192 -13.991 1.00 0.00 H new ATOM 0 HG3 LYS A 45 6.764 15.584 -14.371 1.00 0.00 H new ATOM 0 HD2 LYS A 45 8.463 13.993 -15.393 1.00 0.00 H new ATOM 0 HD3 LYS A 45 7.311 12.695 -15.154 1.00 0.00 H new ATOM 0 HE2 LYS A 45 6.400 15.181 -16.591 1.00 0.00 H new ATOM 0 HE3 LYS A 45 7.421 14.045 -17.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 5.087 13.557 -17.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 5.829 12.280 -16.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 4.839 13.381 -16.122 1.00 0.00 H new ATOM 682 N ILE A 46 6.390 12.968 -9.698 1.00 0.00 N ATOM 683 CA ILE A 46 6.763 12.040 -8.638 1.00 0.00 C ATOM 684 C ILE A 46 7.108 10.667 -9.205 1.00 0.00 C ATOM 685 O ILE A 46 6.364 10.111 -10.014 1.00 0.00 O ATOM 686 CB ILE A 46 5.635 11.886 -7.601 1.00 0.00 C ATOM 687 CG1 ILE A 46 5.484 13.171 -6.785 1.00 0.00 C ATOM 688 CG2 ILE A 46 5.912 10.701 -6.688 1.00 0.00 C ATOM 689 CD1 ILE A 46 4.494 14.150 -7.375 1.00 0.00 C ATOM 0 H ILE A 46 5.394 13.184 -9.738 1.00 0.00 H new ATOM 0 HA ILE A 46 7.641 12.459 -8.147 1.00 0.00 H new ATOM 0 HB ILE A 46 4.699 11.701 -8.129 1.00 0.00 H new ATOM 0 HG12 ILE A 46 5.169 12.914 -5.773 1.00 0.00 H new ATOM 0 HG13 ILE A 46 6.457 13.656 -6.703 1.00 0.00 H new ATOM 0 HG21 ILE A 46 5.106 10.606 -5.961 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.974 9.790 -7.283 1.00 0.00 H new ATOM 0 HG23 ILE A 46 6.856 10.857 -6.165 1.00 0.00 H new ATOM 0 HD11 ILE A 46 4.439 15.037 -6.744 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.818 14.436 -8.376 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.511 13.683 -7.432 1.00 0.00 H new ATOM 701 N THR A 47 8.241 10.122 -8.774 1.00 0.00 N ATOM 702 CA THR A 47 8.685 8.813 -9.237 1.00 0.00 C ATOM 703 C THR A 47 7.943 7.694 -8.517 1.00 0.00 C ATOM 704 O THR A 47 7.913 6.555 -8.983 1.00 0.00 O ATOM 705 CB THR A 47 10.200 8.627 -9.028 1.00 0.00 C ATOM 706 OG1 THR A 47 10.921 9.638 -9.741 1.00 0.00 O ATOM 707 CG2 THR A 47 10.646 7.251 -9.499 1.00 0.00 C ATOM 0 H THR A 47 8.868 10.567 -8.104 1.00 0.00 H new ATOM 0 HA THR A 47 8.464 8.764 -10.303 1.00 0.00 H new ATOM 0 HB THR A 47 10.411 8.715 -7.962 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.883 9.514 -9.601 1.00 0.00 H new ATOM 0 HG21 THR A 47 11.719 7.143 -9.342 1.00 0.00 H new ATOM 0 HG22 THR A 47 10.117 6.484 -8.934 1.00 0.00 H new ATOM 0 HG23 THR A 47 10.422 7.139 -10.560 1.00 0.00 H new ATOM 715 N TYR A 48 7.343 8.025 -7.379 1.00 0.00 N ATOM 716 CA TYR A 48 6.601 7.046 -6.593 1.00 0.00 C ATOM 717 C TYR A 48 7.454 5.812 -6.314 1.00 0.00 C ATOM 718 O TYR A 48 6.953 4.688 -6.289 1.00 0.00 O ATOM 719 CB TYR A 48 5.320 6.640 -7.323 1.00 0.00 C ATOM 720 CG TYR A 48 4.171 7.599 -7.108 1.00 0.00 C ATOM 721 CD1 TYR A 48 3.832 8.034 -5.833 1.00 0.00 C ATOM 722 CD2 TYR A 48 3.424 8.071 -8.181 1.00 0.00 C ATOM 723 CE1 TYR A 48 2.782 8.909 -5.632 1.00 0.00 C ATOM 724 CE2 TYR A 48 2.375 8.948 -7.990 1.00 0.00 C ATOM 725 CZ TYR A 48 2.057 9.364 -6.714 1.00 0.00 C ATOM 726 OH TYR A 48 1.011 10.237 -6.519 1.00 0.00 O ATOM 0 H TYR A 48 7.356 8.964 -6.980 1.00 0.00 H new ATOM 0 HA TYR A 48 6.338 7.506 -5.641 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.527 6.568 -8.391 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.021 5.647 -6.989 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.399 7.682 -4.984 1.00 0.00 H new ATOM 0 HD2 TYR A 48 3.668 7.746 -9.182 1.00 0.00 H new ATOM 0 HE1 TYR A 48 2.530 9.235 -4.634 1.00 0.00 H new ATOM 0 HE2 TYR A 48 1.806 9.306 -8.835 1.00 0.00 H new ATOM 0 HH TYR A 48 0.606 10.461 -7.383 1.00 0.00 H new ATOM 736 N LYS A 49 8.748 6.031 -6.103 1.00 0.00 N ATOM 737 CA LYS A 49 9.673 4.939 -5.823 1.00 0.00 C ATOM 738 C LYS A 49 9.278 4.205 -4.545 1.00 0.00 C ATOM 739 O LYS A 49 8.522 4.728 -3.727 1.00 0.00 O ATOM 740 CB LYS A 49 11.101 5.473 -5.697 1.00 0.00 C ATOM 741 CG LYS A 49 11.504 5.802 -4.270 1.00 0.00 C ATOM 742 CD LYS A 49 12.827 6.548 -4.221 1.00 0.00 C ATOM 743 CE LYS A 49 14.003 5.591 -4.111 1.00 0.00 C ATOM 744 NZ LYS A 49 15.274 6.220 -4.566 1.00 0.00 N ATOM 0 H LYS A 49 9.180 6.955 -6.121 1.00 0.00 H new ATOM 0 HA LYS A 49 9.627 4.235 -6.654 1.00 0.00 H new ATOM 0 HB2 LYS A 49 11.793 4.734 -6.100 1.00 0.00 H new ATOM 0 HB3 LYS A 49 11.200 6.369 -6.309 1.00 0.00 H new ATOM 0 HG2 LYS A 49 10.727 6.407 -3.802 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.583 4.881 -3.692 1.00 0.00 H new ATOM 0 HD2 LYS A 49 12.935 7.158 -5.118 1.00 0.00 H new ATOM 0 HD3 LYS A 49 12.830 7.229 -3.370 1.00 0.00 H new ATOM 0 HE2 LYS A 49 14.110 5.264 -3.077 1.00 0.00 H new ATOM 0 HE3 LYS A 49 13.804 4.701 -4.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 16.052 5.536 -4.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 15.181 6.509 -5.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 15.477 7.055 -3.980 1.00 0.00 H new ATOM 758 N TYR A 50 9.797 2.993 -4.381 1.00 0.00 N ATOM 759 CA TYR A 50 9.498 2.188 -3.203 1.00 0.00 C ATOM 760 C TYR A 50 10.756 1.504 -2.676 1.00 0.00 C ATOM 761 O TYR A 50 11.787 1.470 -3.349 1.00 0.00 O ATOM 762 CB TYR A 50 8.434 1.139 -3.533 1.00 0.00 C ATOM 763 CG TYR A 50 7.020 1.608 -3.271 1.00 0.00 C ATOM 764 CD1 TYR A 50 6.489 2.692 -3.959 1.00 0.00 C ATOM 765 CD2 TYR A 50 6.217 0.967 -2.336 1.00 0.00 C ATOM 766 CE1 TYR A 50 5.198 3.124 -3.723 1.00 0.00 C ATOM 767 CE2 TYR A 50 4.925 1.391 -2.094 1.00 0.00 C ATOM 768 CZ TYR A 50 4.420 2.470 -2.790 1.00 0.00 C ATOM 769 OH TYR A 50 3.133 2.896 -2.551 1.00 0.00 O ATOM 0 H TYR A 50 10.426 2.547 -5.049 1.00 0.00 H new ATOM 0 HA TYR A 50 9.116 2.853 -2.428 1.00 0.00 H new ATOM 0 HB2 TYR A 50 8.526 0.858 -4.582 1.00 0.00 H new ATOM 0 HB3 TYR A 50 8.625 0.242 -2.944 1.00 0.00 H new ATOM 0 HD1 TYR A 50 7.095 3.205 -4.690 1.00 0.00 H new ATOM 0 HD2 TYR A 50 6.610 0.123 -1.789 1.00 0.00 H new ATOM 0 HE1 TYR A 50 4.800 3.969 -4.266 1.00 0.00 H new ATOM 0 HE2 TYR A 50 4.314 0.881 -1.364 1.00 0.00 H new ATOM 0 HH TYR A 50 2.722 2.327 -1.867 1.00 0.00 H new ATOM 779 N THR A 51 10.664 0.959 -1.467 1.00 0.00 N ATOM 780 CA THR A 51 11.793 0.277 -0.849 1.00 0.00 C ATOM 781 C THR A 51 11.320 -0.809 0.111 1.00 0.00 C ATOM 782 O THR A 51 10.213 -0.742 0.643 1.00 0.00 O ATOM 783 CB THR A 51 12.696 1.263 -0.085 1.00 0.00 C ATOM 784 OG1 THR A 51 12.063 1.663 1.136 1.00 0.00 O ATOM 785 CG2 THR A 51 12.995 2.491 -0.932 1.00 0.00 C ATOM 0 H THR A 51 9.819 0.977 -0.897 1.00 0.00 H new ATOM 0 HA THR A 51 12.367 -0.179 -1.656 1.00 0.00 H new ATOM 0 HB THR A 51 13.636 0.759 0.141 1.00 0.00 H new ATOM 0 HG1 THR A 51 12.564 2.404 1.537 1.00 0.00 H new ATOM 0 HG21 THR A 51 13.634 3.173 -0.371 1.00 0.00 H new ATOM 0 HG22 THR A 51 13.503 2.187 -1.847 1.00 0.00 H new ATOM 0 HG23 THR A 51 12.062 2.994 -1.185 1.00 0.00 H new ATOM 793 N GLY A 52 12.168 -1.810 0.329 1.00 0.00 N ATOM 794 CA GLY A 52 11.818 -2.896 1.226 1.00 0.00 C ATOM 795 C GLY A 52 11.777 -4.238 0.523 1.00 0.00 C ATOM 796 O GLY A 52 11.779 -4.304 -0.706 1.00 0.00 O ATOM 0 H GLY A 52 13.090 -1.888 -0.099 1.00 0.00 H new ATOM 0 HA2 GLY A 52 12.541 -2.938 2.040 1.00 0.00 H new ATOM 0 HA3 GLY A 52 10.845 -2.694 1.674 1.00 0.00 H new ATOM 800 N LYS A 53 11.742 -5.313 1.304 1.00 0.00 N ATOM 801 CA LYS A 53 11.701 -6.661 0.750 1.00 0.00 C ATOM 802 C LYS A 53 10.759 -6.729 -0.448 1.00 0.00 C ATOM 803 O LYS A 53 9.862 -5.898 -0.592 1.00 0.00 O ATOM 804 CB LYS A 53 11.256 -7.661 1.819 1.00 0.00 C ATOM 805 CG LYS A 53 11.455 -9.112 1.416 1.00 0.00 C ATOM 806 CD LYS A 53 11.204 -10.054 2.582 1.00 0.00 C ATOM 807 CE LYS A 53 12.430 -10.177 3.473 1.00 0.00 C ATOM 808 NZ LYS A 53 12.398 -11.420 4.292 1.00 0.00 N ATOM 0 H LYS A 53 11.741 -5.276 2.323 1.00 0.00 H new ATOM 0 HA LYS A 53 12.706 -6.919 0.415 1.00 0.00 H new ATOM 0 HB2 LYS A 53 11.810 -7.469 2.738 1.00 0.00 H new ATOM 0 HB3 LYS A 53 10.202 -7.496 2.042 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.780 -9.359 0.596 1.00 0.00 H new ATOM 0 HG3 LYS A 53 12.471 -9.252 1.046 1.00 0.00 H new ATOM 0 HD2 LYS A 53 10.361 -9.691 3.170 1.00 0.00 H new ATOM 0 HD3 LYS A 53 10.928 -11.038 2.203 1.00 0.00 H new ATOM 0 HE2 LYS A 53 13.329 -10.171 2.857 1.00 0.00 H new ATOM 0 HE3 LYS A 53 12.489 -9.310 4.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.251 -11.467 4.885 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 11.554 -11.414 4.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 12.367 -12.249 3.664 1.00 0.00 H new ATOM 822 N GLY A 54 10.967 -7.724 -1.304 1.00 0.00 N ATOM 823 CA GLY A 54 10.128 -7.882 -2.477 1.00 0.00 C ATOM 824 C GLY A 54 10.592 -7.031 -3.642 1.00 0.00 C ATOM 825 O GLY A 54 10.406 -7.399 -4.802 1.00 0.00 O ATOM 0 H GLY A 54 11.702 -8.424 -1.206 1.00 0.00 H new ATOM 0 HA2 GLY A 54 10.122 -8.930 -2.777 1.00 0.00 H new ATOM 0 HA3 GLY A 54 9.102 -7.617 -2.224 1.00 0.00 H new ATOM 829 N ILE A 55 11.196 -5.888 -3.333 1.00 0.00 N ATOM 830 CA ILE A 55 11.688 -4.982 -4.363 1.00 0.00 C ATOM 831 C ILE A 55 13.196 -4.786 -4.249 1.00 0.00 C ATOM 832 O ILE A 55 13.917 -4.830 -5.246 1.00 0.00 O ATOM 833 CB ILE A 55 10.995 -3.609 -4.282 1.00 0.00 C ATOM 834 CG1 ILE A 55 9.481 -3.767 -4.434 1.00 0.00 C ATOM 835 CG2 ILE A 55 11.545 -2.674 -5.350 1.00 0.00 C ATOM 836 CD1 ILE A 55 8.687 -2.693 -3.725 1.00 0.00 C ATOM 0 H ILE A 55 11.356 -5.568 -2.378 1.00 0.00 H new ATOM 0 HA ILE A 55 11.456 -5.441 -5.324 1.00 0.00 H new ATOM 0 HB ILE A 55 11.199 -3.173 -3.304 1.00 0.00 H new ATOM 0 HG12 ILE A 55 9.227 -3.755 -5.494 1.00 0.00 H new ATOM 0 HG13 ILE A 55 9.185 -4.742 -4.046 1.00 0.00 H new ATOM 0 HG21 ILE A 55 11.045 -1.708 -5.280 1.00 0.00 H new ATOM 0 HG22 ILE A 55 12.616 -2.540 -5.200 1.00 0.00 H new ATOM 0 HG23 ILE A 55 11.368 -3.104 -6.336 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.622 -2.869 -3.876 1.00 0.00 H new ATOM 0 HD12 ILE A 55 8.912 -2.719 -2.659 1.00 0.00 H new ATOM 0 HD13 ILE A 55 8.954 -1.716 -4.129 1.00 0.00 H new ATOM 848 N THR A 56 13.668 -4.569 -3.025 1.00 0.00 N ATOM 849 CA THR A 56 15.090 -4.367 -2.779 1.00 0.00 C ATOM 850 C THR A 56 15.755 -5.654 -2.305 1.00 0.00 C ATOM 851 O THR A 56 16.911 -5.921 -2.628 1.00 0.00 O ATOM 852 CB THR A 56 15.328 -3.263 -1.731 1.00 0.00 C ATOM 853 OG1 THR A 56 14.745 -3.643 -0.480 1.00 0.00 O ATOM 854 CG2 THR A 56 14.733 -1.941 -2.194 1.00 0.00 C ATOM 0 H THR A 56 13.086 -4.529 -2.189 1.00 0.00 H new ATOM 0 HA THR A 56 15.534 -4.060 -3.726 1.00 0.00 H new ATOM 0 HB THR A 56 16.403 -3.135 -1.606 1.00 0.00 H new ATOM 0 HG1 THR A 56 14.902 -2.937 0.182 1.00 0.00 H new ATOM 0 HG21 THR A 56 14.913 -1.176 -1.438 1.00 0.00 H new ATOM 0 HG22 THR A 56 15.199 -1.641 -3.132 1.00 0.00 H new ATOM 0 HG23 THR A 56 13.660 -2.058 -2.343 1.00 0.00 H new ATOM 862 N GLU A 57 15.015 -6.448 -1.536 1.00 0.00 N ATOM 863 CA GLU A 57 15.535 -7.708 -1.017 1.00 0.00 C ATOM 864 C GLU A 57 14.638 -8.874 -1.421 1.00 0.00 C ATOM 865 O GLU A 57 13.434 -8.721 -1.631 1.00 0.00 O ATOM 866 CB GLU A 57 15.655 -7.646 0.507 1.00 0.00 C ATOM 867 CG GLU A 57 16.800 -6.775 0.993 1.00 0.00 C ATOM 868 CD GLU A 57 18.148 -7.457 0.863 1.00 0.00 C ATOM 869 OE1 GLU A 57 18.740 -7.400 -0.235 1.00 0.00 O ATOM 870 OE2 GLU A 57 18.612 -8.049 1.860 1.00 0.00 O ATOM 0 H GLU A 57 14.055 -6.241 -1.259 1.00 0.00 H new ATOM 0 HA GLU A 57 16.524 -7.868 -1.446 1.00 0.00 H new ATOM 0 HB2 GLU A 57 14.721 -7.267 0.921 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.789 -8.656 0.894 1.00 0.00 H new ATOM 0 HG2 GLU A 57 16.811 -5.845 0.424 1.00 0.00 H new ATOM 0 HG3 GLU A 57 16.631 -6.508 2.036 1.00 0.00 H new ATOM 877 N PRO A 58 15.237 -10.069 -1.535 1.00 0.00 N ATOM 878 CA PRO A 58 14.512 -11.285 -1.915 1.00 0.00 C ATOM 879 C PRO A 58 13.558 -11.757 -0.822 1.00 0.00 C ATOM 880 O PRO A 58 13.703 -11.414 0.352 1.00 0.00 O ATOM 881 CB PRO A 58 15.627 -12.310 -2.130 1.00 0.00 C ATOM 882 CG PRO A 58 16.755 -11.826 -1.287 1.00 0.00 C ATOM 883 CD PRO A 58 16.668 -10.325 -1.300 1.00 0.00 C ATOM 0 HA PRO A 58 13.884 -11.128 -2.792 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.309 -13.309 -1.831 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.914 -12.368 -3.180 1.00 0.00 H new ATOM 0 HG2 PRO A 58 16.676 -12.213 -0.271 1.00 0.00 H new ATOM 0 HG3 PRO A 58 17.712 -12.165 -1.684 1.00 0.00 H new ATOM 0 HD2 PRO A 58 17.004 -9.895 -0.356 1.00 0.00 H new ATOM 0 HD3 PRO A 58 17.288 -9.893 -2.086 1.00 0.00 H new ATOM 891 N PRO A 59 12.560 -12.562 -1.214 1.00 0.00 N ATOM 892 CA PRO A 59 12.378 -12.976 -2.608 1.00 0.00 C ATOM 893 C PRO A 59 11.930 -11.824 -3.501 1.00 0.00 C ATOM 894 O PRO A 59 11.129 -10.983 -3.091 1.00 0.00 O ATOM 895 CB PRO A 59 11.283 -14.043 -2.521 1.00 0.00 C ATOM 896 CG PRO A 59 10.526 -13.708 -1.282 1.00 0.00 C ATOM 897 CD PRO A 59 11.532 -13.130 -0.325 1.00 0.00 C ATOM 0 HA PRO A 59 13.307 -13.334 -3.052 1.00 0.00 H new ATOM 0 HB2 PRO A 59 10.637 -14.020 -3.398 1.00 0.00 H new ATOM 0 HB3 PRO A 59 11.710 -15.045 -2.466 1.00 0.00 H new ATOM 0 HG2 PRO A 59 9.731 -12.992 -1.492 1.00 0.00 H new ATOM 0 HG3 PRO A 59 10.053 -14.596 -0.862 1.00 0.00 H new ATOM 0 HD2 PRO A 59 11.087 -12.367 0.314 1.00 0.00 H new ATOM 0 HD3 PRO A 59 11.947 -13.894 0.332 1.00 0.00 H new ATOM 905 N PHE A 60 12.450 -11.792 -4.723 1.00 0.00 N ATOM 906 CA PHE A 60 12.104 -10.743 -5.674 1.00 0.00 C ATOM 907 C PHE A 60 10.963 -11.189 -6.585 1.00 0.00 C ATOM 908 O PHE A 60 10.656 -12.376 -6.678 1.00 0.00 O ATOM 909 CB PHE A 60 13.324 -10.364 -6.515 1.00 0.00 C ATOM 910 CG PHE A 60 14.439 -9.755 -5.713 1.00 0.00 C ATOM 911 CD1 PHE A 60 14.431 -8.405 -5.404 1.00 0.00 C ATOM 912 CD2 PHE A 60 15.495 -10.534 -5.268 1.00 0.00 C ATOM 913 CE1 PHE A 60 15.456 -7.842 -4.667 1.00 0.00 C ATOM 914 CE2 PHE A 60 16.523 -9.977 -4.530 1.00 0.00 C ATOM 915 CZ PHE A 60 16.502 -8.630 -4.228 1.00 0.00 C ATOM 0 H PHE A 60 13.113 -12.481 -5.078 1.00 0.00 H new ATOM 0 HA PHE A 60 11.775 -9.870 -5.110 1.00 0.00 H new ATOM 0 HB2 PHE A 60 13.696 -11.254 -7.023 1.00 0.00 H new ATOM 0 HB3 PHE A 60 13.017 -9.660 -7.289 1.00 0.00 H new ATOM 0 HD1 PHE A 60 13.614 -7.785 -5.743 1.00 0.00 H new ATOM 0 HD2 PHE A 60 15.515 -11.589 -5.500 1.00 0.00 H new ATOM 0 HE1 PHE A 60 15.439 -6.787 -4.435 1.00 0.00 H new ATOM 0 HE2 PHE A 60 17.341 -10.595 -4.190 1.00 0.00 H new ATOM 0 HZ PHE A 60 17.302 -8.193 -3.649 1.00 0.00 H new ATOM 925 N GLY A 61 10.338 -10.226 -7.256 1.00 0.00 N ATOM 926 CA GLY A 61 9.239 -10.538 -8.150 1.00 0.00 C ATOM 927 C GLY A 61 7.922 -10.694 -7.417 1.00 0.00 C ATOM 928 O GLY A 61 7.178 -11.646 -7.658 1.00 0.00 O ATOM 0 H GLY A 61 10.574 -9.235 -7.196 1.00 0.00 H new ATOM 0 HA2 GLY A 61 9.145 -9.748 -8.895 1.00 0.00 H new ATOM 0 HA3 GLY A 61 9.463 -11.459 -8.688 1.00 0.00 H new ATOM 932 N ILE A 62 7.632 -9.759 -6.518 1.00 0.00 N ATOM 933 CA ILE A 62 6.396 -9.798 -5.747 1.00 0.00 C ATOM 934 C ILE A 62 5.580 -8.526 -5.952 1.00 0.00 C ATOM 935 O ILE A 62 4.407 -8.581 -6.319 1.00 0.00 O ATOM 936 CB ILE A 62 6.676 -9.978 -4.243 1.00 0.00 C ATOM 937 CG1 ILE A 62 7.536 -11.222 -4.007 1.00 0.00 C ATOM 938 CG2 ILE A 62 5.370 -10.076 -3.469 1.00 0.00 C ATOM 939 CD1 ILE A 62 7.917 -11.427 -2.558 1.00 0.00 C ATOM 0 H ILE A 62 8.237 -8.965 -6.306 1.00 0.00 H new ATOM 0 HA ILE A 62 5.826 -10.655 -6.107 1.00 0.00 H new ATOM 0 HB ILE A 62 7.224 -9.107 -3.884 1.00 0.00 H new ATOM 0 HG12 ILE A 62 6.995 -12.100 -4.360 1.00 0.00 H new ATOM 0 HG13 ILE A 62 8.444 -11.145 -4.606 1.00 0.00 H new ATOM 0 HG21 ILE A 62 5.585 -10.203 -2.408 1.00 0.00 H new ATOM 0 HG22 ILE A 62 4.791 -9.164 -3.616 1.00 0.00 H new ATOM 0 HG23 ILE A 62 4.797 -10.931 -3.828 1.00 0.00 H new ATOM 0 HD11 ILE A 62 8.526 -12.327 -2.466 1.00 0.00 H new ATOM 0 HD12 ILE A 62 8.486 -10.566 -2.206 1.00 0.00 H new ATOM 0 HD13 ILE A 62 7.015 -11.536 -1.956 1.00 0.00 H new ATOM 951 N PHE A 63 6.211 -7.381 -5.714 1.00 0.00 N ATOM 952 CA PHE A 63 5.544 -6.094 -5.873 1.00 0.00 C ATOM 953 C PHE A 63 6.153 -5.305 -7.028 1.00 0.00 C ATOM 954 O PHE A 63 7.373 -5.237 -7.174 1.00 0.00 O ATOM 955 CB PHE A 63 5.641 -5.282 -4.579 1.00 0.00 C ATOM 956 CG PHE A 63 5.103 -6.003 -3.377 1.00 0.00 C ATOM 957 CD1 PHE A 63 3.760 -6.336 -3.296 1.00 0.00 C ATOM 958 CD2 PHE A 63 5.940 -6.349 -2.328 1.00 0.00 C ATOM 959 CE1 PHE A 63 3.263 -7.000 -2.190 1.00 0.00 C ATOM 960 CE2 PHE A 63 5.448 -7.012 -1.220 1.00 0.00 C ATOM 961 CZ PHE A 63 4.108 -7.339 -1.151 1.00 0.00 C ATOM 0 H PHE A 63 7.183 -7.318 -5.411 1.00 0.00 H new ATOM 0 HA PHE A 63 4.494 -6.282 -6.098 1.00 0.00 H new ATOM 0 HB2 PHE A 63 6.684 -5.022 -4.400 1.00 0.00 H new ATOM 0 HB3 PHE A 63 5.097 -4.346 -4.705 1.00 0.00 H new ATOM 0 HD1 PHE A 63 3.095 -6.074 -4.105 1.00 0.00 H new ATOM 0 HD2 PHE A 63 6.989 -6.097 -2.377 1.00 0.00 H new ATOM 0 HE1 PHE A 63 2.214 -7.254 -2.138 1.00 0.00 H new ATOM 0 HE2 PHE A 63 6.111 -7.274 -0.409 1.00 0.00 H new ATOM 0 HZ PHE A 63 3.722 -7.859 -0.287 1.00 0.00 H new ATOM 971 N VAL A 64 5.292 -4.710 -7.849 1.00 0.00 N ATOM 972 CA VAL A 64 5.744 -3.925 -8.992 1.00 0.00 C ATOM 973 C VAL A 64 5.236 -2.491 -8.909 1.00 0.00 C ATOM 974 O VAL A 64 4.116 -2.242 -8.461 1.00 0.00 O ATOM 975 CB VAL A 64 5.276 -4.548 -10.321 1.00 0.00 C ATOM 976 CG1 VAL A 64 5.881 -5.931 -10.505 1.00 0.00 C ATOM 977 CG2 VAL A 64 3.757 -4.611 -10.373 1.00 0.00 C ATOM 0 H VAL A 64 4.279 -4.757 -7.744 1.00 0.00 H new ATOM 0 HA VAL A 64 6.834 -3.923 -8.964 1.00 0.00 H new ATOM 0 HB VAL A 64 5.620 -3.916 -11.140 1.00 0.00 H new ATOM 0 HG11 VAL A 64 5.539 -6.355 -11.449 1.00 0.00 H new ATOM 0 HG12 VAL A 64 6.968 -5.854 -10.514 1.00 0.00 H new ATOM 0 HG13 VAL A 64 5.570 -6.576 -9.684 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.443 -5.054 -11.318 1.00 0.00 H new ATOM 0 HG22 VAL A 64 3.390 -5.220 -9.547 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.348 -3.604 -10.291 1.00 0.00 H new ATOM 987 N PHE A 65 6.066 -1.548 -9.344 1.00 0.00 N ATOM 988 CA PHE A 65 5.701 -0.137 -9.319 1.00 0.00 C ATOM 989 C PHE A 65 6.475 0.644 -10.376 1.00 0.00 C ATOM 990 O PHE A 65 7.583 0.266 -10.754 1.00 0.00 O ATOM 991 CB PHE A 65 5.967 0.456 -7.933 1.00 0.00 C ATOM 992 CG PHE A 65 7.367 0.973 -7.762 1.00 0.00 C ATOM 993 CD1 PHE A 65 7.792 2.099 -8.448 1.00 0.00 C ATOM 994 CD2 PHE A 65 8.257 0.334 -6.914 1.00 0.00 C ATOM 995 CE1 PHE A 65 9.079 2.579 -8.292 1.00 0.00 C ATOM 996 CE2 PHE A 65 9.545 0.808 -6.754 1.00 0.00 C ATOM 997 CZ PHE A 65 9.957 1.931 -7.445 1.00 0.00 C ATOM 0 H PHE A 65 6.996 -1.736 -9.718 1.00 0.00 H new ATOM 0 HA PHE A 65 4.637 -0.059 -9.542 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.263 1.269 -7.753 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.774 -0.306 -7.177 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.110 2.608 -9.113 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.940 -0.545 -6.372 1.00 0.00 H new ATOM 0 HE1 PHE A 65 9.397 3.459 -8.831 1.00 0.00 H new ATOM 0 HE2 PHE A 65 10.229 0.301 -6.089 1.00 0.00 H new ATOM 0 HZ PHE A 65 10.964 2.302 -7.323 1.00 0.00 H new ATOM 1007 N ASN A 66 5.883 1.736 -10.849 1.00 0.00 N ATOM 1008 CA ASN A 66 6.516 2.571 -11.864 1.00 0.00 C ATOM 1009 C ASN A 66 6.310 4.051 -11.556 1.00 0.00 C ATOM 1010 O ASN A 66 5.712 4.408 -10.542 1.00 0.00 O ATOM 1011 CB ASN A 66 5.953 2.242 -13.248 1.00 0.00 C ATOM 1012 CG ASN A 66 6.011 0.759 -13.559 1.00 0.00 C ATOM 1013 OD1 ASN A 66 7.014 0.096 -13.292 1.00 0.00 O ATOM 1014 ND2 ASN A 66 4.933 0.231 -14.125 1.00 0.00 N ATOM 0 H ASN A 66 4.966 2.063 -10.546 1.00 0.00 H new ATOM 0 HA ASN A 66 7.586 2.362 -11.856 1.00 0.00 H new ATOM 0 HB2 ASN A 66 4.919 2.582 -13.307 1.00 0.00 H new ATOM 0 HB3 ASN A 66 6.513 2.791 -14.005 1.00 0.00 H new ATOM 0 HD21 ASN A 66 4.913 -0.762 -14.357 1.00 0.00 H new ATOM 0 HD22 ASN A 66 4.124 0.818 -14.328 1.00 0.00 H new ATOM 1021 N LYS A 67 6.809 4.908 -12.441 1.00 0.00 N ATOM 1022 CA LYS A 67 6.679 6.350 -12.267 1.00 0.00 C ATOM 1023 C LYS A 67 5.667 6.927 -13.252 1.00 0.00 C ATOM 1024 O LYS A 67 5.242 8.075 -13.118 1.00 0.00 O ATOM 1025 CB LYS A 67 8.036 7.031 -12.456 1.00 0.00 C ATOM 1026 CG LYS A 67 8.674 6.753 -13.806 1.00 0.00 C ATOM 1027 CD LYS A 67 9.609 5.557 -13.745 1.00 0.00 C ATOM 1028 CE LYS A 67 10.697 5.646 -14.804 1.00 0.00 C ATOM 1029 NZ LYS A 67 11.621 4.479 -14.749 1.00 0.00 N ATOM 0 H LYS A 67 7.307 4.629 -13.286 1.00 0.00 H new ATOM 0 HA LYS A 67 6.323 6.539 -11.254 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.912 8.107 -12.337 1.00 0.00 H new ATOM 0 HB3 LYS A 67 8.713 6.699 -11.669 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.895 6.570 -14.547 1.00 0.00 H new ATOM 0 HG3 LYS A 67 9.227 7.632 -14.136 1.00 0.00 H new ATOM 0 HD2 LYS A 67 10.065 5.501 -12.757 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.038 4.639 -13.885 1.00 0.00 H new ATOM 0 HE2 LYS A 67 10.239 5.700 -15.792 1.00 0.00 H new ATOM 0 HE3 LYS A 67 11.265 6.566 -14.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 12.348 4.577 -15.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 12.077 4.441 -13.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 11.083 3.603 -14.907 1.00 0.00 H new ATOM 1043 N ASP A 68 5.285 6.125 -14.239 1.00 0.00 N ATOM 1044 CA ASP A 68 4.320 6.555 -15.244 1.00 0.00 C ATOM 1045 C ASP A 68 2.895 6.451 -14.710 1.00 0.00 C ATOM 1046 O ASP A 68 2.172 7.445 -14.640 1.00 0.00 O ATOM 1047 CB ASP A 68 4.466 5.715 -16.514 1.00 0.00 C ATOM 1048 CG ASP A 68 3.586 6.215 -17.643 1.00 0.00 C ATOM 1049 OD1 ASP A 68 3.655 7.422 -17.959 1.00 0.00 O ATOM 1050 OD2 ASP A 68 2.830 5.400 -18.211 1.00 0.00 O ATOM 0 H ASP A 68 5.629 5.173 -14.365 1.00 0.00 H new ATOM 0 HA ASP A 68 4.523 7.599 -15.483 1.00 0.00 H new ATOM 0 HB2 ASP A 68 5.507 5.727 -16.836 1.00 0.00 H new ATOM 0 HB3 ASP A 68 4.213 4.678 -16.292 1.00 0.00 H new ATOM 1055 N THR A 69 2.496 5.239 -14.336 1.00 0.00 N ATOM 1056 CA THR A 69 1.157 5.003 -13.811 1.00 0.00 C ATOM 1057 C THR A 69 1.103 5.260 -12.309 1.00 0.00 C ATOM 1058 O THR A 69 0.197 5.931 -11.817 1.00 0.00 O ATOM 1059 CB THR A 69 0.689 3.563 -14.092 1.00 0.00 C ATOM 1060 OG1 THR A 69 -0.664 3.393 -13.655 1.00 0.00 O ATOM 1061 CG2 THR A 69 1.585 2.555 -13.387 1.00 0.00 C ATOM 0 H THR A 69 3.082 4.405 -14.387 1.00 0.00 H new ATOM 0 HA THR A 69 0.490 5.699 -14.320 1.00 0.00 H new ATOM 0 HB THR A 69 0.748 3.389 -15.166 1.00 0.00 H new ATOM 0 HG1 THR A 69 -0.954 2.475 -13.839 1.00 0.00 H new ATOM 0 HG21 THR A 69 1.235 1.545 -13.600 1.00 0.00 H new ATOM 0 HG22 THR A 69 2.609 2.667 -13.743 1.00 0.00 H new ATOM 0 HG23 THR A 69 1.554 2.730 -12.312 1.00 0.00 H new ATOM 1069 N GLY A 70 2.079 4.720 -11.585 1.00 0.00 N ATOM 1070 CA GLY A 70 2.123 4.902 -10.146 1.00 0.00 C ATOM 1071 C GLY A 70 1.112 4.036 -9.421 1.00 0.00 C ATOM 1072 O GLY A 70 0.121 4.539 -8.892 1.00 0.00 O ATOM 0 H GLY A 70 2.840 4.160 -11.970 1.00 0.00 H new ATOM 0 HA2 GLY A 70 3.124 4.667 -9.784 1.00 0.00 H new ATOM 0 HA3 GLY A 70 1.936 5.949 -9.909 1.00 0.00 H new ATOM 1076 N GLU A 71 1.362 2.731 -9.397 1.00 0.00 N ATOM 1077 CA GLU A 71 0.464 1.793 -8.733 1.00 0.00 C ATOM 1078 C GLU A 71 1.221 0.555 -8.264 1.00 0.00 C ATOM 1079 O GLU A 71 2.033 -0.008 -9.000 1.00 0.00 O ATOM 1080 CB GLU A 71 -0.670 1.385 -9.676 1.00 0.00 C ATOM 1081 CG GLU A 71 -1.482 2.559 -10.196 1.00 0.00 C ATOM 1082 CD GLU A 71 -2.135 3.356 -9.084 1.00 0.00 C ATOM 1083 OE1 GLU A 71 -2.127 2.880 -7.929 1.00 0.00 O ATOM 1084 OE2 GLU A 71 -2.655 4.455 -9.368 1.00 0.00 O ATOM 0 H GLU A 71 2.179 2.299 -9.829 1.00 0.00 H new ATOM 0 HA GLU A 71 0.040 2.290 -7.860 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -0.250 0.842 -10.522 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -1.335 0.697 -9.154 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -0.833 3.216 -10.776 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.252 2.191 -10.874 1.00 0.00 H new ATOM 1091 N LEU A 72 0.951 0.134 -7.033 1.00 0.00 N ATOM 1092 CA LEU A 72 1.606 -1.038 -6.463 1.00 0.00 C ATOM 1093 C LEU A 72 0.698 -2.261 -6.541 1.00 0.00 C ATOM 1094 O LEU A 72 -0.160 -2.465 -5.683 1.00 0.00 O ATOM 1095 CB LEU A 72 1.997 -0.771 -5.009 1.00 0.00 C ATOM 1096 CG LEU A 72 2.818 -1.864 -4.323 1.00 0.00 C ATOM 1097 CD1 LEU A 72 4.265 -1.817 -4.791 1.00 0.00 C ATOM 1098 CD2 LEU A 72 2.740 -1.720 -2.810 1.00 0.00 C ATOM 0 H LEU A 72 0.282 0.587 -6.410 1.00 0.00 H new ATOM 0 HA LEU A 72 2.506 -1.239 -7.044 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.564 0.159 -4.971 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.086 -0.613 -4.432 1.00 0.00 H new ATOM 0 HG LEU A 72 2.400 -2.832 -4.597 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.834 -2.602 -4.293 1.00 0.00 H new ATOM 0 HD12 LEU A 72 4.304 -1.970 -5.870 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.695 -0.846 -4.547 1.00 0.00 H new ATOM 0 HD21 LEU A 72 3.330 -2.506 -2.339 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.132 -0.746 -2.516 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.702 -1.804 -2.490 1.00 0.00 H new ATOM 1110 N ASN A 73 0.895 -3.073 -7.575 1.00 0.00 N ATOM 1111 CA ASN A 73 0.095 -4.277 -7.764 1.00 0.00 C ATOM 1112 C ASN A 73 0.874 -5.520 -7.343 1.00 0.00 C ATOM 1113 O ASN A 73 2.023 -5.710 -7.741 1.00 0.00 O ATOM 1114 CB ASN A 73 -0.336 -4.404 -9.227 1.00 0.00 C ATOM 1115 CG ASN A 73 -0.884 -5.780 -9.551 1.00 0.00 C ATOM 1116 OD1 ASN A 73 -1.318 -6.513 -8.662 1.00 0.00 O ATOM 1117 ND2 ASN A 73 -0.867 -6.137 -10.830 1.00 0.00 N ATOM 0 H ASN A 73 1.602 -2.919 -8.294 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.792 -4.195 -7.136 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -1.095 -3.653 -9.446 1.00 0.00 H new ATOM 0 HB3 ASN A 73 0.516 -4.194 -9.873 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -1.223 -7.051 -11.109 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -0.498 -5.497 -11.533 1.00 0.00 H new ATOM 1124 N VAL A 74 0.240 -6.363 -6.535 1.00 0.00 N ATOM 1125 CA VAL A 74 0.872 -7.589 -6.061 1.00 0.00 C ATOM 1126 C VAL A 74 0.792 -8.691 -7.111 1.00 0.00 C ATOM 1127 O VAL A 74 -0.246 -8.885 -7.745 1.00 0.00 O ATOM 1128 CB VAL A 74 0.221 -8.088 -4.757 1.00 0.00 C ATOM 1129 CG1 VAL A 74 -1.259 -8.367 -4.972 1.00 0.00 C ATOM 1130 CG2 VAL A 74 0.937 -9.329 -4.246 1.00 0.00 C ATOM 0 H VAL A 74 -0.711 -6.220 -6.195 1.00 0.00 H new ATOM 0 HA VAL A 74 1.918 -7.351 -5.868 1.00 0.00 H new ATOM 0 HB VAL A 74 0.313 -7.307 -4.003 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.702 -8.719 -4.040 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.759 -7.452 -5.289 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.377 -9.131 -5.741 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.464 -9.668 -3.324 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.878 -10.118 -4.996 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.983 -9.091 -4.051 1.00 0.00 H new ATOM 1140 N THR A 75 1.894 -9.412 -7.290 1.00 0.00 N ATOM 1141 CA THR A 75 1.949 -10.495 -8.264 1.00 0.00 C ATOM 1142 C THR A 75 2.486 -11.774 -7.633 1.00 0.00 C ATOM 1143 O THR A 75 3.192 -12.548 -8.280 1.00 0.00 O ATOM 1144 CB THR A 75 2.831 -10.121 -9.470 1.00 0.00 C ATOM 1145 OG1 THR A 75 4.192 -9.967 -9.053 1.00 0.00 O ATOM 1146 CG2 THR A 75 2.345 -8.833 -10.118 1.00 0.00 C ATOM 0 H THR A 75 2.761 -9.265 -6.773 1.00 0.00 H new ATOM 0 HA THR A 75 0.929 -10.664 -8.608 1.00 0.00 H new ATOM 0 HB THR A 75 2.765 -10.925 -10.203 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.222 -9.465 -8.212 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.984 -8.589 -10.967 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.319 -8.963 -10.461 1.00 0.00 H new ATOM 0 HG23 THR A 75 2.384 -8.022 -9.390 1.00 0.00 H new ATOM 1154 N SER A 76 2.146 -11.992 -6.367 1.00 0.00 N ATOM 1155 CA SER A 76 2.597 -13.178 -5.648 1.00 0.00 C ATOM 1156 C SER A 76 1.614 -13.548 -4.541 1.00 0.00 C ATOM 1157 O SER A 76 0.825 -12.716 -4.093 1.00 0.00 O ATOM 1158 CB SER A 76 3.987 -12.942 -5.053 1.00 0.00 C ATOM 1159 OG SER A 76 4.716 -14.154 -4.965 1.00 0.00 O ATOM 0 H SER A 76 1.560 -11.363 -5.818 1.00 0.00 H new ATOM 0 HA SER A 76 2.648 -14.005 -6.356 1.00 0.00 H new ATOM 0 HB2 SER A 76 4.534 -12.229 -5.670 1.00 0.00 H new ATOM 0 HB3 SER A 76 3.891 -12.499 -4.062 1.00 0.00 H new ATOM 0 HG SER A 76 5.601 -13.976 -4.583 1.00 0.00 H new ATOM 1165 N ILE A 77 1.670 -14.802 -4.105 1.00 0.00 N ATOM 1166 CA ILE A 77 0.786 -15.283 -3.050 1.00 0.00 C ATOM 1167 C ILE A 77 1.467 -15.213 -1.687 1.00 0.00 C ATOM 1168 O ILE A 77 2.239 -16.100 -1.321 1.00 0.00 O ATOM 1169 CB ILE A 77 0.333 -16.732 -3.311 1.00 0.00 C ATOM 1170 CG1 ILE A 77 -0.526 -16.800 -4.576 1.00 0.00 C ATOM 1171 CG2 ILE A 77 -0.433 -17.271 -2.113 1.00 0.00 C ATOM 1172 CD1 ILE A 77 0.283 -16.870 -5.852 1.00 0.00 C ATOM 0 H ILE A 77 2.318 -15.503 -4.466 1.00 0.00 H new ATOM 0 HA ILE A 77 -0.088 -14.632 -3.051 1.00 0.00 H new ATOM 0 HB ILE A 77 1.216 -17.353 -3.461 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.175 -17.674 -4.518 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -1.174 -15.924 -4.613 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.746 -18.296 -2.313 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.209 -17.253 -1.232 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.312 -16.651 -1.934 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.391 -16.916 -6.708 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.912 -15.984 -5.933 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.911 -17.761 -5.836 1.00 0.00 H new ATOM 1184 N LEU A 78 1.176 -14.155 -0.940 1.00 0.00 N ATOM 1185 CA LEU A 78 1.759 -13.969 0.384 1.00 0.00 C ATOM 1186 C LEU A 78 1.768 -15.280 1.164 1.00 0.00 C ATOM 1187 O LEU A 78 0.870 -16.109 1.014 1.00 0.00 O ATOM 1188 CB LEU A 78 0.981 -12.906 1.162 1.00 0.00 C ATOM 1189 CG LEU A 78 0.816 -11.553 0.468 1.00 0.00 C ATOM 1190 CD1 LEU A 78 -0.112 -10.653 1.267 1.00 0.00 C ATOM 1191 CD2 LEU A 78 2.170 -10.887 0.271 1.00 0.00 C ATOM 0 H LEU A 78 0.539 -13.412 -1.228 1.00 0.00 H new ATOM 0 HA LEU A 78 2.789 -13.636 0.256 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.010 -13.301 1.385 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.482 -12.744 2.116 1.00 0.00 H new ATOM 0 HG LEU A 78 0.370 -11.721 -0.512 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.217 -9.695 0.758 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.090 -11.126 1.356 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.305 -10.492 2.261 1.00 0.00 H new ATOM 0 HD21 LEU A 78 2.034 -9.926 -0.224 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.644 -10.732 1.240 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.803 -11.526 -0.345 1.00 0.00 H new ATOM 1203 N ASP A 79 2.787 -15.460 1.997 1.00 0.00 N ATOM 1204 CA ASP A 79 2.912 -16.669 2.803 1.00 0.00 C ATOM 1205 C ASP A 79 3.427 -16.340 4.201 1.00 0.00 C ATOM 1206 O ASP A 79 4.563 -15.896 4.365 1.00 0.00 O ATOM 1207 CB ASP A 79 3.850 -17.667 2.122 1.00 0.00 C ATOM 1208 CG ASP A 79 3.124 -18.569 1.144 1.00 0.00 C ATOM 1209 OD1 ASP A 79 2.058 -19.108 1.511 1.00 0.00 O ATOM 1210 OD2 ASP A 79 3.621 -18.737 0.011 1.00 0.00 O ATOM 0 H ASP A 79 3.539 -14.784 2.132 1.00 0.00 H new ATOM 0 HA ASP A 79 1.923 -17.117 2.896 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.635 -17.123 1.596 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.339 -18.278 2.881 1.00 0.00 H new ATOM 1215 N ARG A 80 2.583 -16.559 5.204 1.00 0.00 N ATOM 1216 CA ARG A 80 2.952 -16.283 6.587 1.00 0.00 C ATOM 1217 C ARG A 80 4.121 -17.161 7.023 1.00 0.00 C ATOM 1218 O ARG A 80 5.043 -16.695 7.691 1.00 0.00 O ATOM 1219 CB ARG A 80 1.755 -16.513 7.512 1.00 0.00 C ATOM 1220 CG ARG A 80 1.845 -15.752 8.824 1.00 0.00 C ATOM 1221 CD ARG A 80 0.652 -16.044 9.721 1.00 0.00 C ATOM 1222 NE ARG A 80 0.857 -15.556 11.082 1.00 0.00 N ATOM 1223 CZ ARG A 80 0.183 -16.007 12.134 1.00 0.00 C ATOM 1224 NH1 ARG A 80 -0.734 -16.953 11.982 1.00 0.00 N ATOM 1225 NH2 ARG A 80 0.426 -15.513 13.341 1.00 0.00 N ATOM 0 H ARG A 80 1.639 -16.927 5.085 1.00 0.00 H new ATOM 0 HA ARG A 80 3.259 -15.239 6.654 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.843 -16.218 6.993 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.670 -17.579 7.725 1.00 0.00 H new ATOM 0 HG2 ARG A 80 2.765 -16.024 9.341 1.00 0.00 H new ATOM 0 HG3 ARG A 80 1.897 -14.682 8.622 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -0.240 -15.580 9.300 1.00 0.00 H new ATOM 0 HD3 ARG A 80 0.471 -17.119 9.745 1.00 0.00 H new ATOM 0 HE ARG A 80 1.556 -14.829 11.233 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -0.923 -17.336 11.056 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -1.250 -17.298 12.791 1.00 0.00 H new ATOM 0 HH21 ARG A 80 1.131 -14.786 13.462 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -0.092 -15.860 14.148 1.00 0.00 H new ATOM 1239 N GLU A 81 4.075 -18.433 6.640 1.00 0.00 N ATOM 1240 CA GLU A 81 5.130 -19.375 6.993 1.00 0.00 C ATOM 1241 C GLU A 81 6.507 -18.778 6.718 1.00 0.00 C ATOM 1242 O GLU A 81 7.411 -18.870 7.547 1.00 0.00 O ATOM 1243 CB GLU A 81 4.963 -20.679 6.210 1.00 0.00 C ATOM 1244 CG GLU A 81 3.864 -21.578 6.753 1.00 0.00 C ATOM 1245 CD GLU A 81 4.296 -22.349 7.985 1.00 0.00 C ATOM 1246 OE1 GLU A 81 5.516 -22.548 8.163 1.00 0.00 O ATOM 1247 OE2 GLU A 81 3.414 -22.752 8.771 1.00 0.00 O ATOM 0 H GLU A 81 3.319 -18.834 6.086 1.00 0.00 H new ATOM 0 HA GLU A 81 5.051 -19.586 8.059 1.00 0.00 H new ATOM 0 HB2 GLU A 81 4.746 -20.442 5.168 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.907 -21.224 6.223 1.00 0.00 H new ATOM 0 HG2 GLU A 81 2.991 -20.972 6.996 1.00 0.00 H new ATOM 0 HG3 GLU A 81 3.559 -22.281 5.978 1.00 0.00 H new ATOM 1254 N GLU A 82 6.658 -18.166 5.547 1.00 0.00 N ATOM 1255 CA GLU A 82 7.925 -17.555 5.163 1.00 0.00 C ATOM 1256 C GLU A 82 7.950 -16.075 5.535 1.00 0.00 C ATOM 1257 O GLU A 82 8.781 -15.637 6.332 1.00 0.00 O ATOM 1258 CB GLU A 82 8.160 -17.718 3.659 1.00 0.00 C ATOM 1259 CG GLU A 82 9.473 -17.123 3.180 1.00 0.00 C ATOM 1260 CD GLU A 82 9.812 -17.525 1.758 1.00 0.00 C ATOM 1261 OE1 GLU A 82 9.082 -17.111 0.834 1.00 0.00 O ATOM 1262 OE2 GLU A 82 10.808 -18.255 1.570 1.00 0.00 O ATOM 0 H GLU A 82 5.919 -18.080 4.849 1.00 0.00 H new ATOM 0 HA GLU A 82 8.723 -18.062 5.706 1.00 0.00 H new ATOM 0 HB2 GLU A 82 8.139 -18.779 3.409 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.339 -17.247 3.118 1.00 0.00 H new ATOM 0 HG2 GLU A 82 9.419 -16.036 3.243 1.00 0.00 H new ATOM 0 HG3 GLU A 82 10.276 -17.442 3.845 1.00 0.00 H new ATOM 1269 N THR A 83 7.034 -15.308 4.952 1.00 0.00 N ATOM 1270 CA THR A 83 6.952 -13.878 5.219 1.00 0.00 C ATOM 1271 C THR A 83 5.694 -13.539 6.011 1.00 0.00 C ATOM 1272 O THR A 83 4.584 -13.514 5.479 1.00 0.00 O ATOM 1273 CB THR A 83 6.959 -13.061 3.914 1.00 0.00 C ATOM 1274 OG1 THR A 83 6.009 -13.603 2.991 1.00 0.00 O ATOM 1275 CG2 THR A 83 8.343 -13.061 3.283 1.00 0.00 C ATOM 0 H THR A 83 6.338 -15.654 4.291 1.00 0.00 H new ATOM 0 HA THR A 83 7.831 -13.615 5.807 1.00 0.00 H new ATOM 0 HB THR A 83 6.686 -12.033 4.154 1.00 0.00 H new ATOM 0 HG1 THR A 83 5.635 -12.881 2.444 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.323 -12.478 2.362 1.00 0.00 H new ATOM 0 HG22 THR A 83 9.059 -12.620 3.977 1.00 0.00 H new ATOM 0 HG23 THR A 83 8.640 -14.085 3.057 1.00 0.00 H new ATOM 1283 N PRO A 84 5.868 -13.270 7.314 1.00 0.00 N ATOM 1284 CA PRO A 84 4.758 -12.925 8.206 1.00 0.00 C ATOM 1285 C PRO A 84 4.173 -11.551 7.900 1.00 0.00 C ATOM 1286 O PRO A 84 3.032 -11.257 8.258 1.00 0.00 O ATOM 1287 CB PRO A 84 5.402 -12.935 9.594 1.00 0.00 C ATOM 1288 CG PRO A 84 6.844 -12.655 9.345 1.00 0.00 C ATOM 1289 CD PRO A 84 7.163 -13.281 8.015 1.00 0.00 C ATOM 0 HA PRO A 84 3.923 -13.618 8.103 1.00 0.00 H new ATOM 0 HB2 PRO A 84 4.958 -12.179 10.242 1.00 0.00 H new ATOM 0 HB3 PRO A 84 5.265 -13.897 10.087 1.00 0.00 H new ATOM 0 HG2 PRO A 84 7.036 -11.582 9.328 1.00 0.00 H new ATOM 0 HG3 PRO A 84 7.466 -13.077 10.134 1.00 0.00 H new ATOM 0 HD2 PRO A 84 7.918 -12.711 7.473 1.00 0.00 H new ATOM 0 HD3 PRO A 84 7.549 -14.294 8.130 1.00 0.00 H new ATOM 1297 N PHE A 85 4.961 -10.712 7.235 1.00 0.00 N ATOM 1298 CA PHE A 85 4.521 -9.368 6.881 1.00 0.00 C ATOM 1299 C PHE A 85 5.478 -8.728 5.880 1.00 0.00 C ATOM 1300 O PHE A 85 6.632 -9.140 5.757 1.00 0.00 O ATOM 1301 CB PHE A 85 4.418 -8.495 8.134 1.00 0.00 C ATOM 1302 CG PHE A 85 5.583 -8.649 9.069 1.00 0.00 C ATOM 1303 CD1 PHE A 85 6.811 -8.083 8.766 1.00 0.00 C ATOM 1304 CD2 PHE A 85 5.452 -9.361 10.250 1.00 0.00 C ATOM 1305 CE1 PHE A 85 7.886 -8.222 9.624 1.00 0.00 C ATOM 1306 CE2 PHE A 85 6.522 -9.503 11.113 1.00 0.00 C ATOM 1307 CZ PHE A 85 7.741 -8.934 10.799 1.00 0.00 C ATOM 0 H PHE A 85 5.908 -10.940 6.931 1.00 0.00 H new ATOM 0 HA PHE A 85 3.537 -9.446 6.418 1.00 0.00 H new ATOM 0 HB2 PHE A 85 4.339 -7.450 7.834 1.00 0.00 H new ATOM 0 HB3 PHE A 85 3.500 -8.744 8.666 1.00 0.00 H new ATOM 0 HD1 PHE A 85 6.930 -7.526 7.848 1.00 0.00 H new ATOM 0 HD2 PHE A 85 4.502 -9.811 10.499 1.00 0.00 H new ATOM 0 HE1 PHE A 85 8.837 -7.775 9.376 1.00 0.00 H new ATOM 0 HE2 PHE A 85 6.405 -10.058 12.032 1.00 0.00 H new ATOM 0 HZ PHE A 85 8.579 -9.046 11.471 1.00 0.00 H new ATOM 1317 N PHE A 86 4.990 -7.719 5.165 1.00 0.00 N ATOM 1318 CA PHE A 86 5.800 -7.023 4.173 1.00 0.00 C ATOM 1319 C PHE A 86 5.831 -5.523 4.451 1.00 0.00 C ATOM 1320 O PHE A 86 4.872 -4.806 4.162 1.00 0.00 O ATOM 1321 CB PHE A 86 5.256 -7.281 2.767 1.00 0.00 C ATOM 1322 CG PHE A 86 5.583 -8.648 2.238 1.00 0.00 C ATOM 1323 CD1 PHE A 86 6.832 -8.918 1.702 1.00 0.00 C ATOM 1324 CD2 PHE A 86 4.642 -9.664 2.277 1.00 0.00 C ATOM 1325 CE1 PHE A 86 7.137 -10.175 1.216 1.00 0.00 C ATOM 1326 CE2 PHE A 86 4.941 -10.924 1.792 1.00 0.00 C ATOM 1327 CZ PHE A 86 6.190 -11.179 1.260 1.00 0.00 C ATOM 0 H PHE A 86 4.037 -7.366 5.255 1.00 0.00 H new ATOM 0 HA PHE A 86 6.818 -7.408 4.238 1.00 0.00 H new ATOM 0 HB2 PHE A 86 4.174 -7.153 2.776 1.00 0.00 H new ATOM 0 HB3 PHE A 86 5.660 -6.531 2.087 1.00 0.00 H new ATOM 0 HD1 PHE A 86 7.576 -8.136 1.664 1.00 0.00 H new ATOM 0 HD2 PHE A 86 3.664 -9.470 2.691 1.00 0.00 H new ATOM 0 HE1 PHE A 86 8.115 -10.372 0.802 1.00 0.00 H new ATOM 0 HE2 PHE A 86 4.199 -11.708 1.829 1.00 0.00 H new ATOM 0 HZ PHE A 86 6.425 -12.162 0.879 1.00 0.00 H new ATOM 1337 N LEU A 87 6.939 -5.055 5.015 1.00 0.00 N ATOM 1338 CA LEU A 87 7.097 -3.640 5.334 1.00 0.00 C ATOM 1339 C LEU A 87 7.762 -2.893 4.183 1.00 0.00 C ATOM 1340 O LEU A 87 8.944 -3.093 3.899 1.00 0.00 O ATOM 1341 CB LEU A 87 7.924 -3.474 6.610 1.00 0.00 C ATOM 1342 CG LEU A 87 7.160 -3.614 7.928 1.00 0.00 C ATOM 1343 CD1 LEU A 87 8.126 -3.822 9.084 1.00 0.00 C ATOM 1344 CD2 LEU A 87 6.288 -2.391 8.172 1.00 0.00 C ATOM 0 H LEU A 87 7.741 -5.635 5.261 1.00 0.00 H new ATOM 0 HA LEU A 87 6.105 -3.216 5.493 1.00 0.00 H new ATOM 0 HB2 LEU A 87 8.726 -4.212 6.598 1.00 0.00 H new ATOM 0 HB3 LEU A 87 8.395 -2.491 6.589 1.00 0.00 H new ATOM 0 HG LEU A 87 6.513 -4.488 7.860 1.00 0.00 H new ATOM 0 HD11 LEU A 87 7.565 -3.920 10.014 1.00 0.00 H new ATOM 0 HD12 LEU A 87 8.707 -4.728 8.914 1.00 0.00 H new ATOM 0 HD13 LEU A 87 8.799 -2.967 9.154 1.00 0.00 H new ATOM 0 HD21 LEU A 87 5.752 -2.508 9.114 1.00 0.00 H new ATOM 0 HD22 LEU A 87 6.915 -1.501 8.220 1.00 0.00 H new ATOM 0 HD23 LEU A 87 5.571 -2.287 7.357 1.00 0.00 H new ATOM 1356 N LEU A 88 6.996 -2.031 3.523 1.00 0.00 N ATOM 1357 CA LEU A 88 7.511 -1.252 2.403 1.00 0.00 C ATOM 1358 C LEU A 88 7.377 0.244 2.673 1.00 0.00 C ATOM 1359 O LEU A 88 6.568 0.667 3.498 1.00 0.00 O ATOM 1360 CB LEU A 88 6.768 -1.617 1.117 1.00 0.00 C ATOM 1361 CG LEU A 88 6.517 -3.108 0.888 1.00 0.00 C ATOM 1362 CD1 LEU A 88 5.284 -3.315 0.022 1.00 0.00 C ATOM 1363 CD2 LEU A 88 7.734 -3.763 0.250 1.00 0.00 C ATOM 0 H LEU A 88 6.016 -1.854 3.744 1.00 0.00 H new ATOM 0 HA LEU A 88 8.568 -1.489 2.284 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.807 -1.103 1.118 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.336 -1.230 0.271 1.00 0.00 H new ATOM 0 HG LEU A 88 6.341 -3.579 1.855 1.00 0.00 H new ATOM 0 HD11 LEU A 88 5.121 -4.382 -0.130 1.00 0.00 H new ATOM 0 HD12 LEU A 88 4.415 -2.882 0.517 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.431 -2.829 -0.943 1.00 0.00 H new ATOM 0 HD21 LEU A 88 7.537 -4.824 0.095 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.942 -3.288 -0.709 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.596 -3.647 0.907 1.00 0.00 H new ATOM 1375 N THR A 89 8.176 1.041 1.970 1.00 0.00 N ATOM 1376 CA THR A 89 8.147 2.489 2.133 1.00 0.00 C ATOM 1377 C THR A 89 8.326 3.196 0.794 1.00 0.00 C ATOM 1378 O THR A 89 9.273 2.921 0.058 1.00 0.00 O ATOM 1379 CB THR A 89 9.242 2.967 3.104 1.00 0.00 C ATOM 1380 OG1 THR A 89 9.175 2.221 4.325 1.00 0.00 O ATOM 1381 CG2 THR A 89 9.091 4.451 3.402 1.00 0.00 C ATOM 0 H THR A 89 8.851 0.708 1.282 1.00 0.00 H new ATOM 0 HA THR A 89 7.171 2.741 2.547 1.00 0.00 H new ATOM 0 HB THR A 89 10.211 2.804 2.632 1.00 0.00 H new ATOM 0 HG1 THR A 89 9.876 2.530 4.936 1.00 0.00 H new ATOM 0 HG21 THR A 89 9.876 4.766 4.090 1.00 0.00 H new ATOM 0 HG22 THR A 89 9.172 5.018 2.475 1.00 0.00 H new ATOM 0 HG23 THR A 89 8.117 4.634 3.855 1.00 0.00 H new ATOM 1389 N GLY A 90 7.411 4.110 0.486 1.00 0.00 N ATOM 1390 CA GLY A 90 7.487 4.843 -0.764 1.00 0.00 C ATOM 1391 C GLY A 90 8.037 6.244 -0.582 1.00 0.00 C ATOM 1392 O GLY A 90 7.914 6.832 0.493 1.00 0.00 O ATOM 0 H GLY A 90 6.619 4.356 1.080 1.00 0.00 H new ATOM 0 HA2 GLY A 90 8.118 4.296 -1.464 1.00 0.00 H new ATOM 0 HA3 GLY A 90 6.494 4.901 -1.209 1.00 0.00 H new ATOM 1396 N TYR A 91 8.647 6.779 -1.633 1.00 0.00 N ATOM 1397 CA TYR A 91 9.223 8.118 -1.583 1.00 0.00 C ATOM 1398 C TYR A 91 8.850 8.918 -2.828 1.00 0.00 C ATOM 1399 O TYR A 91 9.127 8.501 -3.953 1.00 0.00 O ATOM 1400 CB TYR A 91 10.744 8.038 -1.452 1.00 0.00 C ATOM 1401 CG TYR A 91 11.209 7.096 -0.363 1.00 0.00 C ATOM 1402 CD1 TYR A 91 11.093 5.720 -0.512 1.00 0.00 C ATOM 1403 CD2 TYR A 91 11.765 7.584 0.813 1.00 0.00 C ATOM 1404 CE1 TYR A 91 11.515 4.857 0.481 1.00 0.00 C ATOM 1405 CE2 TYR A 91 12.192 6.728 1.810 1.00 0.00 C ATOM 1406 CZ TYR A 91 12.064 5.365 1.639 1.00 0.00 C ATOM 1407 OH TYR A 91 12.488 4.508 2.629 1.00 0.00 O ATOM 0 H TYR A 91 8.756 6.306 -2.530 1.00 0.00 H new ATOM 0 HA TYR A 91 8.817 8.628 -0.710 1.00 0.00 H new ATOM 0 HB2 TYR A 91 11.166 7.716 -2.404 1.00 0.00 H new ATOM 0 HB3 TYR A 91 11.136 9.035 -1.250 1.00 0.00 H new ATOM 0 HD1 TYR A 91 10.666 5.318 -1.419 1.00 0.00 H new ATOM 0 HD2 TYR A 91 11.865 8.651 0.950 1.00 0.00 H new ATOM 0 HE1 TYR A 91 11.415 3.790 0.351 1.00 0.00 H new ATOM 0 HE2 TYR A 91 12.623 7.123 2.718 1.00 0.00 H new ATOM 0 HH TYR A 91 12.851 5.027 3.377 1.00 0.00 H new ATOM 1417 N ALA A 92 8.221 10.070 -2.617 1.00 0.00 N ATOM 1418 CA ALA A 92 7.813 10.930 -3.721 1.00 0.00 C ATOM 1419 C ALA A 92 8.954 11.844 -4.155 1.00 0.00 C ATOM 1420 O ALA A 92 9.156 12.916 -3.583 1.00 0.00 O ATOM 1421 CB ALA A 92 6.596 11.753 -3.326 1.00 0.00 C ATOM 0 H ALA A 92 7.983 10.429 -1.692 1.00 0.00 H new ATOM 0 HA ALA A 92 7.550 10.295 -4.567 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.302 12.391 -4.160 1.00 0.00 H new ATOM 0 HB2 ALA A 92 5.773 11.086 -3.072 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.840 12.373 -2.463 1.00 0.00 H new ATOM 1427 N LEU A 93 9.696 11.415 -5.169 1.00 0.00 N ATOM 1428 CA LEU A 93 10.818 12.195 -5.680 1.00 0.00 C ATOM 1429 C LEU A 93 10.338 13.263 -6.658 1.00 0.00 C ATOM 1430 O LEU A 93 9.707 12.954 -7.669 1.00 0.00 O ATOM 1431 CB LEU A 93 11.832 11.278 -6.366 1.00 0.00 C ATOM 1432 CG LEU A 93 12.133 9.959 -5.654 1.00 0.00 C ATOM 1433 CD1 LEU A 93 13.016 9.074 -6.520 1.00 0.00 C ATOM 1434 CD2 LEU A 93 12.791 10.217 -4.307 1.00 0.00 C ATOM 0 H LEU A 93 9.541 10.531 -5.654 1.00 0.00 H new ATOM 0 HA LEU A 93 11.298 12.690 -4.836 1.00 0.00 H new ATOM 0 HB2 LEU A 93 11.468 11.052 -7.368 1.00 0.00 H new ATOM 0 HB3 LEU A 93 12.767 11.826 -6.483 1.00 0.00 H new ATOM 0 HG LEU A 93 11.191 9.439 -5.481 1.00 0.00 H new ATOM 0 HD11 LEU A 93 13.220 8.140 -5.997 1.00 0.00 H new ATOM 0 HD12 LEU A 93 12.507 8.860 -7.460 1.00 0.00 H new ATOM 0 HD13 LEU A 93 13.956 9.587 -6.725 1.00 0.00 H new ATOM 0 HD21 LEU A 93 12.998 9.267 -3.815 1.00 0.00 H new ATOM 0 HD22 LEU A 93 13.725 10.759 -4.456 1.00 0.00 H new ATOM 0 HD23 LEU A 93 12.123 10.811 -3.683 1.00 0.00 H new ATOM 1446 N ASP A 94 10.643 14.519 -6.351 1.00 0.00 N ATOM 1447 CA ASP A 94 10.246 15.633 -7.204 1.00 0.00 C ATOM 1448 C ASP A 94 10.650 15.378 -8.653 1.00 0.00 C ATOM 1449 O ASP A 94 11.196 14.325 -8.980 1.00 0.00 O ATOM 1450 CB ASP A 94 10.877 16.934 -6.707 1.00 0.00 C ATOM 1451 CG ASP A 94 10.043 18.152 -7.056 1.00 0.00 C ATOM 1452 OD1 ASP A 94 9.058 18.422 -6.337 1.00 0.00 O ATOM 1453 OD2 ASP A 94 10.376 18.834 -8.047 1.00 0.00 O ATOM 0 H ASP A 94 11.164 14.791 -5.517 1.00 0.00 H new ATOM 0 HA ASP A 94 9.161 15.725 -7.159 1.00 0.00 H new ATOM 0 HB2 ASP A 94 11.005 16.883 -5.626 1.00 0.00 H new ATOM 0 HB3 ASP A 94 11.871 17.041 -7.141 1.00 0.00 H new ATOM 1458 N ALA A 95 10.378 16.350 -9.518 1.00 0.00 N ATOM 1459 CA ALA A 95 10.714 16.232 -10.931 1.00 0.00 C ATOM 1460 C ALA A 95 12.203 15.962 -11.121 1.00 0.00 C ATOM 1461 O ALA A 95 12.625 15.460 -12.163 1.00 0.00 O ATOM 1462 CB ALA A 95 10.306 17.493 -11.678 1.00 0.00 C ATOM 0 H ALA A 95 9.926 17.228 -9.264 1.00 0.00 H new ATOM 0 HA ALA A 95 10.162 15.386 -11.340 1.00 0.00 H new ATOM 0 HB1 ALA A 95 10.563 17.391 -12.732 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.231 17.642 -11.580 1.00 0.00 H new ATOM 0 HB3 ALA A 95 10.831 18.351 -11.258 1.00 0.00 H new ATOM 1468 N ARG A 96 12.994 16.297 -10.107 1.00 0.00 N ATOM 1469 CA ARG A 96 14.437 16.092 -10.163 1.00 0.00 C ATOM 1470 C ARG A 96 14.795 14.650 -9.816 1.00 0.00 C ATOM 1471 O ARG A 96 15.649 14.040 -10.458 1.00 0.00 O ATOM 1472 CB ARG A 96 15.147 17.050 -9.206 1.00 0.00 C ATOM 1473 CG ARG A 96 15.512 18.384 -9.837 1.00 0.00 C ATOM 1474 CD ARG A 96 16.691 19.032 -9.130 1.00 0.00 C ATOM 1475 NE ARG A 96 17.970 18.584 -9.675 1.00 0.00 N ATOM 1476 CZ ARG A 96 18.503 19.067 -10.791 1.00 0.00 C ATOM 1477 NH1 ARG A 96 17.870 20.009 -11.478 1.00 0.00 N ATOM 1478 NH2 ARG A 96 19.670 18.609 -11.224 1.00 0.00 N ATOM 0 H ARG A 96 12.660 16.712 -9.237 1.00 0.00 H new ATOM 0 HA ARG A 96 14.769 16.295 -11.181 1.00 0.00 H new ATOM 0 HB2 ARG A 96 14.506 17.229 -8.343 1.00 0.00 H new ATOM 0 HB3 ARG A 96 16.054 16.573 -8.835 1.00 0.00 H new ATOM 0 HG2 ARG A 96 15.755 18.235 -10.889 1.00 0.00 H new ATOM 0 HG3 ARG A 96 14.652 19.053 -9.799 1.00 0.00 H new ATOM 0 HD2 ARG A 96 16.618 20.116 -9.222 1.00 0.00 H new ATOM 0 HD3 ARG A 96 16.649 18.799 -8.066 1.00 0.00 H new ATOM 0 HE ARG A 96 18.482 17.860 -9.170 1.00 0.00 H new ATOM 0 HH11 ARG A 96 16.972 20.364 -11.149 1.00 0.00 H new ATOM 0 HH12 ARG A 96 18.281 20.379 -12.335 1.00 0.00 H new ATOM 0 HH21 ARG A 96 20.160 17.884 -10.699 1.00 0.00 H new ATOM 0 HH22 ARG A 96 20.078 18.981 -12.082 1.00 0.00 H new ATOM 1492 N GLY A 97 14.135 14.111 -8.795 1.00 0.00 N ATOM 1493 CA GLY A 97 14.398 12.746 -8.379 1.00 0.00 C ATOM 1494 C GLY A 97 15.133 12.674 -7.056 1.00 0.00 C ATOM 1495 O GLY A 97 16.014 11.835 -6.872 1.00 0.00 O ATOM 0 H GLY A 97 13.423 14.596 -8.249 1.00 0.00 H new ATOM 0 HA2 GLY A 97 13.454 12.207 -8.297 1.00 0.00 H new ATOM 0 HA3 GLY A 97 14.987 12.243 -9.146 1.00 0.00 H new ATOM 1499 N ASN A 98 14.772 13.558 -6.131 1.00 0.00 N ATOM 1500 CA ASN A 98 15.405 13.593 -4.818 1.00 0.00 C ATOM 1501 C ASN A 98 14.357 13.640 -3.710 1.00 0.00 C ATOM 1502 O ASN A 98 13.241 14.115 -3.917 1.00 0.00 O ATOM 1503 CB ASN A 98 16.334 14.803 -4.709 1.00 0.00 C ATOM 1504 CG ASN A 98 15.668 16.087 -5.163 1.00 0.00 C ATOM 1505 OD1 ASN A 98 14.586 16.438 -4.692 1.00 0.00 O ATOM 1506 ND2 ASN A 98 16.312 16.794 -6.085 1.00 0.00 N ATOM 0 H ASN A 98 14.044 14.260 -6.267 1.00 0.00 H new ATOM 0 HA ASN A 98 15.991 12.682 -4.700 1.00 0.00 H new ATOM 0 HB2 ASN A 98 16.662 14.913 -3.676 1.00 0.00 H new ATOM 0 HB3 ASN A 98 17.226 14.628 -5.310 1.00 0.00 H new ATOM 0 HD21 ASN A 98 15.912 17.666 -6.431 1.00 0.00 H new ATOM 0 HD22 ASN A 98 17.207 16.465 -6.447 1.00 0.00 H new ATOM 1513 N ASN A 99 14.726 13.146 -2.532 1.00 0.00 N ATOM 1514 CA ASN A 99 13.818 13.133 -1.391 1.00 0.00 C ATOM 1515 C ASN A 99 13.259 14.527 -1.124 1.00 0.00 C ATOM 1516 O ASN A 99 13.811 15.287 -0.328 1.00 0.00 O ATOM 1517 CB ASN A 99 14.539 12.613 -0.146 1.00 0.00 C ATOM 1518 CG ASN A 99 15.816 13.377 0.144 1.00 0.00 C ATOM 1519 OD1 ASN A 99 16.578 13.704 -0.766 1.00 0.00 O ATOM 1520 ND2 ASN A 99 16.057 13.666 1.418 1.00 0.00 N ATOM 0 H ASN A 99 15.647 12.750 -2.343 1.00 0.00 H new ATOM 0 HA ASN A 99 12.987 12.468 -1.627 1.00 0.00 H new ATOM 0 HB2 ASN A 99 13.872 12.685 0.713 1.00 0.00 H new ATOM 0 HB3 ASN A 99 14.773 11.557 -0.280 1.00 0.00 H new ATOM 0 HD21 ASN A 99 16.901 14.178 1.674 1.00 0.00 H new ATOM 0 HD22 ASN A 99 15.398 13.376 2.140 1.00 0.00 H new ATOM 1527 N VAL A 100 12.160 14.856 -1.795 1.00 0.00 N ATOM 1528 CA VAL A 100 11.524 16.158 -1.629 1.00 0.00 C ATOM 1529 C VAL A 100 10.502 16.130 -0.498 1.00 0.00 C ATOM 1530 O VAL A 100 10.203 17.160 0.106 1.00 0.00 O ATOM 1531 CB VAL A 100 10.827 16.611 -2.926 1.00 0.00 C ATOM 1532 CG1 VAL A 100 9.560 15.803 -3.161 1.00 0.00 C ATOM 1533 CG2 VAL A 100 10.518 18.100 -2.871 1.00 0.00 C ATOM 0 H VAL A 100 11.691 14.239 -2.459 1.00 0.00 H new ATOM 0 HA VAL A 100 12.314 16.868 -1.383 1.00 0.00 H new ATOM 0 HB VAL A 100 11.502 16.434 -3.763 1.00 0.00 H new ATOM 0 HG11 VAL A 100 9.081 16.137 -4.081 1.00 0.00 H new ATOM 0 HG12 VAL A 100 9.813 14.746 -3.246 1.00 0.00 H new ATOM 0 HG13 VAL A 100 8.877 15.946 -2.324 1.00 0.00 H new ATOM 0 HG21 VAL A 100 10.026 18.404 -3.795 1.00 0.00 H new ATOM 0 HG22 VAL A 100 9.861 18.304 -2.026 1.00 0.00 H new ATOM 0 HG23 VAL A 100 11.446 18.660 -2.753 1.00 0.00 H new ATOM 1543 N GLU A 101 9.970 14.945 -0.218 1.00 0.00 N ATOM 1544 CA GLU A 101 8.980 14.784 0.841 1.00 0.00 C ATOM 1545 C GLU A 101 9.240 13.510 1.640 1.00 0.00 C ATOM 1546 O GLU A 101 9.378 12.425 1.074 1.00 0.00 O ATOM 1547 CB GLU A 101 7.569 14.749 0.250 1.00 0.00 C ATOM 1548 CG GLU A 101 7.100 16.091 -0.286 1.00 0.00 C ATOM 1549 CD GLU A 101 6.737 17.065 0.818 1.00 0.00 C ATOM 1550 OE1 GLU A 101 7.518 17.183 1.786 1.00 0.00 O ATOM 1551 OE2 GLU A 101 5.672 17.709 0.716 1.00 0.00 O ATOM 0 H GLU A 101 10.207 14.083 -0.709 1.00 0.00 H new ATOM 0 HA GLU A 101 9.063 15.638 1.514 1.00 0.00 H new ATOM 0 HB2 GLU A 101 7.540 14.015 -0.556 1.00 0.00 H new ATOM 0 HB3 GLU A 101 6.872 14.409 1.016 1.00 0.00 H new ATOM 0 HG2 GLU A 101 7.885 16.525 -0.905 1.00 0.00 H new ATOM 0 HG3 GLU A 101 6.234 15.938 -0.930 1.00 0.00 H new ATOM 1558 N LYS A 102 9.307 13.650 2.960 1.00 0.00 N ATOM 1559 CA LYS A 102 9.550 12.512 3.839 1.00 0.00 C ATOM 1560 C LYS A 102 8.702 11.314 3.425 1.00 0.00 C ATOM 1561 O LYS A 102 7.577 11.455 2.944 1.00 0.00 O ATOM 1562 CB LYS A 102 9.245 12.889 5.290 1.00 0.00 C ATOM 1563 CG LYS A 102 7.778 12.752 5.659 1.00 0.00 C ATOM 1564 CD LYS A 102 7.477 13.402 6.999 1.00 0.00 C ATOM 1565 CE LYS A 102 7.171 14.883 6.844 1.00 0.00 C ATOM 1566 NZ LYS A 102 6.315 15.392 7.952 1.00 0.00 N ATOM 0 H LYS A 102 9.196 14.541 3.445 1.00 0.00 H new ATOM 0 HA LYS A 102 10.601 12.237 3.754 1.00 0.00 H new ATOM 0 HB2 LYS A 102 9.838 12.259 5.953 1.00 0.00 H new ATOM 0 HB3 LYS A 102 9.560 13.918 5.463 1.00 0.00 H new ATOM 0 HG2 LYS A 102 7.163 13.211 4.885 1.00 0.00 H new ATOM 0 HG3 LYS A 102 7.508 11.697 5.697 1.00 0.00 H new ATOM 0 HD2 LYS A 102 6.629 12.901 7.465 1.00 0.00 H new ATOM 0 HD3 LYS A 102 8.329 13.273 7.666 1.00 0.00 H new ATOM 0 HE2 LYS A 102 8.104 15.446 6.818 1.00 0.00 H new ATOM 0 HE3 LYS A 102 6.670 15.052 5.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 6.129 16.405 7.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 5.414 14.873 7.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 6.804 15.254 8.860 1.00 0.00 H new ATOM 1580 N PRO A 103 9.251 10.105 3.615 1.00 0.00 N ATOM 1581 CA PRO A 103 8.561 8.859 3.270 1.00 0.00 C ATOM 1582 C PRO A 103 7.379 8.576 4.192 1.00 0.00 C ATOM 1583 O PRO A 103 6.990 9.423 4.997 1.00 0.00 O ATOM 1584 CB PRO A 103 9.644 7.792 3.447 1.00 0.00 C ATOM 1585 CG PRO A 103 10.596 8.379 4.432 1.00 0.00 C ATOM 1586 CD PRO A 103 10.588 9.862 4.183 1.00 0.00 C ATOM 0 HA PRO A 103 8.137 8.893 2.266 1.00 0.00 H new ATOM 0 HB2 PRO A 103 9.222 6.856 3.814 1.00 0.00 H new ATOM 0 HB3 PRO A 103 10.139 7.570 2.502 1.00 0.00 H new ATOM 0 HG2 PRO A 103 10.289 8.153 5.453 1.00 0.00 H new ATOM 0 HG3 PRO A 103 11.597 7.967 4.301 1.00 0.00 H new ATOM 0 HD2 PRO A 103 10.742 10.425 5.104 1.00 0.00 H new ATOM 0 HD3 PRO A 103 11.378 10.158 3.493 1.00 0.00 H new ATOM 1594 N LEU A 104 6.812 7.381 4.069 1.00 0.00 N ATOM 1595 CA LEU A 104 5.675 6.985 4.892 1.00 0.00 C ATOM 1596 C LEU A 104 5.742 5.502 5.239 1.00 0.00 C ATOM 1597 O LEU A 104 6.308 4.705 4.490 1.00 0.00 O ATOM 1598 CB LEU A 104 4.364 7.292 4.166 1.00 0.00 C ATOM 1599 CG LEU A 104 4.095 6.483 2.897 1.00 0.00 C ATOM 1600 CD1 LEU A 104 5.299 6.529 1.970 1.00 0.00 C ATOM 1601 CD2 LEU A 104 3.741 5.045 3.246 1.00 0.00 C ATOM 0 H LEU A 104 7.121 6.669 3.407 1.00 0.00 H new ATOM 0 HA LEU A 104 5.713 7.557 5.819 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.540 7.126 4.860 1.00 0.00 H new ATOM 0 HB3 LEU A 104 4.355 8.351 3.907 1.00 0.00 H new ATOM 0 HG LEU A 104 3.246 6.928 2.378 1.00 0.00 H new ATOM 0 HD11 LEU A 104 5.089 5.948 1.072 1.00 0.00 H new ATOM 0 HD12 LEU A 104 5.506 7.563 1.693 1.00 0.00 H new ATOM 0 HD13 LEU A 104 6.167 6.110 2.479 1.00 0.00 H new ATOM 0 HD21 LEU A 104 3.553 4.484 2.330 1.00 0.00 H new ATOM 0 HD22 LEU A 104 4.569 4.588 3.788 1.00 0.00 H new ATOM 0 HD23 LEU A 104 2.847 5.031 3.870 1.00 0.00 H new ATOM 1613 N GLU A 105 5.160 5.137 6.377 1.00 0.00 N ATOM 1614 CA GLU A 105 5.153 3.748 6.821 1.00 0.00 C ATOM 1615 C GLU A 105 4.006 2.976 6.176 1.00 0.00 C ATOM 1616 O GLU A 105 2.893 3.488 6.048 1.00 0.00 O ATOM 1617 CB GLU A 105 5.037 3.677 8.345 1.00 0.00 C ATOM 1618 CG GLU A 105 5.424 2.326 8.922 1.00 0.00 C ATOM 1619 CD GLU A 105 5.585 2.360 10.430 1.00 0.00 C ATOM 1620 OE1 GLU A 105 6.012 3.409 10.956 1.00 0.00 O ATOM 1621 OE2 GLU A 105 5.285 1.339 11.082 1.00 0.00 O ATOM 0 H GLU A 105 4.687 5.784 7.008 1.00 0.00 H new ATOM 0 HA GLU A 105 6.094 3.291 6.514 1.00 0.00 H new ATOM 0 HB2 GLU A 105 5.671 4.446 8.786 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.011 3.906 8.634 1.00 0.00 H new ATOM 0 HG2 GLU A 105 4.664 1.591 8.658 1.00 0.00 H new ATOM 0 HG3 GLU A 105 6.358 1.995 8.468 1.00 0.00 H new ATOM 1628 N LEU A 106 4.285 1.742 5.771 1.00 0.00 N ATOM 1629 CA LEU A 106 3.277 0.898 5.139 1.00 0.00 C ATOM 1630 C LEU A 106 3.539 -0.576 5.431 1.00 0.00 C ATOM 1631 O LEU A 106 4.565 -1.125 5.030 1.00 0.00 O ATOM 1632 CB LEU A 106 3.260 1.135 3.628 1.00 0.00 C ATOM 1633 CG LEU A 106 2.543 0.076 2.790 1.00 0.00 C ATOM 1634 CD1 LEU A 106 1.041 0.318 2.795 1.00 0.00 C ATOM 1635 CD2 LEU A 106 3.079 0.069 1.366 1.00 0.00 C ATOM 0 H LEU A 106 5.201 1.304 5.869 1.00 0.00 H new ATOM 0 HA LEU A 106 2.305 1.164 5.554 1.00 0.00 H new ATOM 0 HB2 LEU A 106 2.790 2.100 3.437 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.290 1.208 3.280 1.00 0.00 H new ATOM 0 HG LEU A 106 2.735 -0.901 3.234 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.547 -0.445 2.194 1.00 0.00 H new ATOM 0 HD12 LEU A 106 0.668 0.271 3.818 1.00 0.00 H new ATOM 0 HD13 LEU A 106 0.830 1.302 2.377 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.557 -0.691 0.784 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.919 1.047 0.912 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.146 -0.154 1.380 1.00 0.00 H new ATOM 1647 N ARG A 107 2.605 -1.210 6.131 1.00 0.00 N ATOM 1648 CA ARG A 107 2.735 -2.621 6.476 1.00 0.00 C ATOM 1649 C ARG A 107 1.565 -3.427 5.918 1.00 0.00 C ATOM 1650 O ARG A 107 0.413 -3.001 5.994 1.00 0.00 O ATOM 1651 CB ARG A 107 2.807 -2.792 7.995 1.00 0.00 C ATOM 1652 CG ARG A 107 1.541 -2.361 8.717 1.00 0.00 C ATOM 1653 CD ARG A 107 1.829 -1.963 10.156 1.00 0.00 C ATOM 1654 NE ARG A 107 2.170 -0.548 10.275 1.00 0.00 N ATOM 1655 CZ ARG A 107 1.274 0.431 10.218 1.00 0.00 C ATOM 1656 NH1 ARG A 107 -0.010 0.150 10.045 1.00 0.00 N ATOM 1657 NH2 ARG A 107 1.662 1.695 10.335 1.00 0.00 N ATOM 0 H ARG A 107 1.750 -0.770 6.471 1.00 0.00 H new ATOM 0 HA ARG A 107 3.657 -2.995 6.031 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.008 -3.838 8.225 1.00 0.00 H new ATOM 0 HB3 ARG A 107 3.648 -2.214 8.378 1.00 0.00 H new ATOM 0 HG2 ARG A 107 1.088 -1.521 8.190 1.00 0.00 H new ATOM 0 HG3 ARG A 107 0.817 -3.175 8.701 1.00 0.00 H new ATOM 0 HD2 ARG A 107 0.957 -2.179 10.773 1.00 0.00 H new ATOM 0 HD3 ARG A 107 2.650 -2.567 10.542 1.00 0.00 H new ATOM 0 HE ARG A 107 3.150 -0.298 10.409 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -0.312 -0.820 9.955 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -0.696 0.904 10.002 1.00 0.00 H new ATOM 0 HH21 ARG A 107 2.649 1.915 10.469 1.00 0.00 H new ATOM 0 HH22 ARG A 107 0.973 2.446 10.291 1.00 0.00 H new ATOM 1671 N ILE A 108 1.871 -4.592 5.357 1.00 0.00 N ATOM 1672 CA ILE A 108 0.846 -5.457 4.787 1.00 0.00 C ATOM 1673 C ILE A 108 0.617 -6.687 5.660 1.00 0.00 C ATOM 1674 O ILE A 108 1.386 -7.647 5.614 1.00 0.00 O ATOM 1675 CB ILE A 108 1.222 -5.914 3.365 1.00 0.00 C ATOM 1676 CG1 ILE A 108 1.438 -4.701 2.458 1.00 0.00 C ATOM 1677 CG2 ILE A 108 0.140 -6.821 2.797 1.00 0.00 C ATOM 1678 CD1 ILE A 108 2.320 -4.991 1.263 1.00 0.00 C ATOM 0 H ILE A 108 2.820 -4.958 5.285 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.072 -4.871 4.741 1.00 0.00 H new ATOM 0 HB ILE A 108 2.153 -6.479 3.414 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.470 -4.343 2.107 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.884 -3.895 3.042 1.00 0.00 H new ATOM 0 HG21 ILE A 108 0.420 -7.136 1.792 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.029 -7.698 3.434 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.805 -6.279 2.758 1.00 0.00 H new ATOM 0 HD11 ILE A 108 2.430 -4.087 0.664 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.301 -5.321 1.606 1.00 0.00 H new ATOM 0 HD13 ILE A 108 1.865 -5.775 0.657 1.00 0.00 H new ATOM 1690 N LYS A 109 -0.448 -6.652 6.454 1.00 0.00 N ATOM 1691 CA LYS A 109 -0.782 -7.764 7.336 1.00 0.00 C ATOM 1692 C LYS A 109 -1.119 -9.014 6.531 1.00 0.00 C ATOM 1693 O LYS A 109 -2.059 -9.018 5.735 1.00 0.00 O ATOM 1694 CB LYS A 109 -1.962 -7.390 8.236 1.00 0.00 C ATOM 1695 CG LYS A 109 -2.449 -8.536 9.107 1.00 0.00 C ATOM 1696 CD LYS A 109 -3.125 -8.028 10.370 1.00 0.00 C ATOM 1697 CE LYS A 109 -3.745 -9.166 11.166 1.00 0.00 C ATOM 1698 NZ LYS A 109 -2.760 -9.802 12.084 1.00 0.00 N ATOM 0 H LYS A 109 -1.095 -5.865 6.505 1.00 0.00 H new ATOM 0 HA LYS A 109 0.088 -7.977 7.957 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -1.671 -6.557 8.876 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -2.786 -7.041 7.614 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -3.148 -9.152 8.542 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -1.607 -9.174 9.375 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -2.396 -7.505 10.989 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -3.897 -7.305 10.105 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -4.588 -8.788 11.744 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -4.139 -9.916 10.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -3.221 -10.573 12.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -1.967 -10.186 11.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -2.402 -9.092 12.755 1.00 0.00 H new ATOM 1712 N VAL A 110 -0.347 -10.075 6.743 1.00 0.00 N ATOM 1713 CA VAL A 110 -0.566 -11.333 6.039 1.00 0.00 C ATOM 1714 C VAL A 110 -1.576 -12.206 6.774 1.00 0.00 C ATOM 1715 O VAL A 110 -1.208 -13.030 7.613 1.00 0.00 O ATOM 1716 CB VAL A 110 0.749 -12.118 5.872 1.00 0.00 C ATOM 1717 CG1 VAL A 110 0.489 -13.459 5.201 1.00 0.00 C ATOM 1718 CG2 VAL A 110 1.759 -11.303 5.078 1.00 0.00 C ATOM 0 H VAL A 110 0.436 -10.088 7.397 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.958 -11.080 5.054 1.00 0.00 H new ATOM 0 HB VAL A 110 1.166 -12.308 6.861 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.429 -13.999 5.091 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.197 -14.045 5.813 1.00 0.00 H new ATOM 0 HG13 VAL A 110 0.048 -13.294 4.218 1.00 0.00 H new ATOM 0 HG21 VAL A 110 2.682 -11.873 4.970 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.352 -11.080 4.092 1.00 0.00 H new ATOM 0 HG23 VAL A 110 1.968 -10.371 5.603 1.00 0.00 H new ATOM 1728 N LEU A 111 -2.852 -12.021 6.455 1.00 0.00 N ATOM 1729 CA LEU A 111 -3.918 -12.793 7.084 1.00 0.00 C ATOM 1730 C LEU A 111 -3.736 -14.285 6.826 1.00 0.00 C ATOM 1731 O LEU A 111 -3.274 -14.689 5.759 1.00 0.00 O ATOM 1732 CB LEU A 111 -5.282 -12.336 6.563 1.00 0.00 C ATOM 1733 CG LEU A 111 -5.657 -10.882 6.847 1.00 0.00 C ATOM 1734 CD1 LEU A 111 -6.977 -10.530 6.179 1.00 0.00 C ATOM 1735 CD2 LEU A 111 -5.734 -10.634 8.347 1.00 0.00 C ATOM 0 H LEU A 111 -3.174 -11.343 5.764 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.871 -12.621 8.159 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.307 -12.493 5.485 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.048 -12.979 6.997 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.881 -10.240 6.432 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -7.227 -9.491 6.393 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.888 -10.668 5.101 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.764 -11.179 6.563 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -6.002 -9.594 8.530 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.489 -11.286 8.785 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -4.766 -10.845 8.801 1.00 0.00 H new ATOM 1747 N ASP A 112 -4.104 -15.099 7.809 1.00 0.00 N ATOM 1748 CA ASP A 112 -3.984 -16.548 7.688 1.00 0.00 C ATOM 1749 C ASP A 112 -5.003 -17.096 6.693 1.00 0.00 C ATOM 1750 O ASP A 112 -5.851 -16.359 6.189 1.00 0.00 O ATOM 1751 CB ASP A 112 -4.175 -17.213 9.052 1.00 0.00 C ATOM 1752 CG ASP A 112 -2.949 -17.086 9.935 1.00 0.00 C ATOM 1753 OD1 ASP A 112 -2.700 -15.975 10.448 1.00 0.00 O ATOM 1754 OD2 ASP A 112 -2.240 -18.098 10.113 1.00 0.00 O ATOM 0 H ASP A 112 -4.488 -14.781 8.699 1.00 0.00 H new ATOM 0 HA ASP A 112 -2.984 -16.776 7.319 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -5.030 -16.763 9.556 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -4.408 -18.268 8.909 1.00 0.00 H new ATOM 1759 N ILE A 113 -4.912 -18.392 6.415 1.00 0.00 N ATOM 1760 CA ILE A 113 -5.826 -19.038 5.481 1.00 0.00 C ATOM 1761 C ILE A 113 -7.191 -19.271 6.120 1.00 0.00 C ATOM 1762 O ILE A 113 -8.215 -19.271 5.438 1.00 0.00 O ATOM 1763 CB ILE A 113 -5.266 -20.384 4.986 1.00 0.00 C ATOM 1764 CG1 ILE A 113 -6.230 -21.025 3.985 1.00 0.00 C ATOM 1765 CG2 ILE A 113 -5.016 -21.318 6.161 1.00 0.00 C ATOM 1766 CD1 ILE A 113 -6.158 -20.416 2.602 1.00 0.00 C ATOM 0 H ILE A 113 -4.215 -19.015 6.823 1.00 0.00 H new ATOM 0 HA ILE A 113 -5.936 -18.365 4.630 1.00 0.00 H new ATOM 0 HB ILE A 113 -4.316 -20.203 4.483 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -6.013 -22.091 3.916 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -7.248 -20.931 4.362 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -4.620 -22.265 5.795 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -4.296 -20.863 6.841 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -5.952 -21.496 6.690 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -6.868 -20.919 1.945 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -6.404 -19.356 2.658 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -5.150 -20.534 2.205 1.00 0.00 H new ATOM 1778 N ASN A 114 -7.197 -19.469 7.434 1.00 0.00 N ATOM 1779 CA ASN A 114 -8.436 -19.703 8.166 1.00 0.00 C ATOM 1780 C ASN A 114 -8.894 -18.434 8.880 1.00 0.00 C ATOM 1781 O ASN A 114 -9.331 -18.480 10.030 1.00 0.00 O ATOM 1782 CB ASN A 114 -8.248 -20.832 9.181 1.00 0.00 C ATOM 1783 CG ASN A 114 -8.527 -22.198 8.585 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -9.676 -22.548 8.317 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -7.472 -22.977 8.373 1.00 0.00 N ATOM 0 H ASN A 114 -6.358 -19.472 8.014 1.00 0.00 H new ATOM 0 HA ASN A 114 -9.203 -19.993 7.448 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -7.228 -20.807 9.563 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -8.911 -20.667 10.031 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -7.597 -23.907 7.973 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -6.537 -22.645 8.611 1.00 0.00 H new ATOM 1792 N ASP A 115 -8.792 -17.304 8.189 1.00 0.00 N ATOM 1793 CA ASP A 115 -9.197 -16.023 8.755 1.00 0.00 C ATOM 1794 C ASP A 115 -10.484 -15.524 8.105 1.00 0.00 C ATOM 1795 O ASP A 115 -10.983 -16.124 7.153 1.00 0.00 O ATOM 1796 CB ASP A 115 -8.086 -14.987 8.574 1.00 0.00 C ATOM 1797 CG ASP A 115 -7.091 -15.000 9.719 1.00 0.00 C ATOM 1798 OD1 ASP A 115 -7.014 -16.026 10.426 1.00 0.00 O ATOM 1799 OD2 ASP A 115 -6.391 -13.983 9.908 1.00 0.00 O ATOM 0 H ASP A 115 -8.432 -17.249 7.236 1.00 0.00 H new ATOM 0 HA ASP A 115 -9.380 -16.166 9.820 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -7.562 -15.180 7.638 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -8.529 -13.994 8.492 1.00 0.00 H new ATOM 1804 N ASN A 116 -11.017 -14.424 8.627 1.00 0.00 N ATOM 1805 CA ASN A 116 -12.247 -13.846 8.098 1.00 0.00 C ATOM 1806 C ASN A 116 -12.198 -12.322 8.152 1.00 0.00 C ATOM 1807 O ASN A 116 -11.681 -11.741 9.105 1.00 0.00 O ATOM 1808 CB ASN A 116 -13.455 -14.357 8.886 1.00 0.00 C ATOM 1809 CG ASN A 116 -14.608 -13.372 8.880 1.00 0.00 C ATOM 1810 OD1 ASN A 116 -14.952 -12.810 7.840 1.00 0.00 O ATOM 1811 ND2 ASN A 116 -15.211 -13.159 10.043 1.00 0.00 N ATOM 0 H ASN A 116 -10.617 -13.915 9.415 1.00 0.00 H new ATOM 0 HA ASN A 116 -12.345 -14.152 7.057 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -13.788 -15.304 8.462 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -13.156 -14.556 9.915 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -15.993 -12.507 10.100 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -14.892 -13.647 10.880 1.00 0.00 H new ATOM 1818 N GLU A 117 -12.741 -11.681 7.121 1.00 0.00 N ATOM 1819 CA GLU A 117 -12.760 -10.225 7.051 1.00 0.00 C ATOM 1820 C GLU A 117 -14.192 -9.700 7.014 1.00 0.00 C ATOM 1821 O GLU A 117 -15.101 -10.341 6.486 1.00 0.00 O ATOM 1822 CB GLU A 117 -11.995 -9.742 5.817 1.00 0.00 C ATOM 1823 CG GLU A 117 -10.492 -9.945 5.914 1.00 0.00 C ATOM 1824 CD GLU A 117 -9.735 -9.232 4.810 1.00 0.00 C ATOM 1825 OE1 GLU A 117 -9.612 -7.992 4.880 1.00 0.00 O ATOM 1826 OE2 GLU A 117 -9.265 -9.916 3.877 1.00 0.00 O ATOM 0 H GLU A 117 -13.173 -12.147 6.323 1.00 0.00 H new ATOM 0 HA GLU A 117 -12.273 -9.837 7.946 1.00 0.00 H new ATOM 0 HB2 GLU A 117 -12.368 -10.269 4.939 1.00 0.00 H new ATOM 0 HB3 GLU A 117 -12.201 -8.683 5.664 1.00 0.00 H new ATOM 0 HG2 GLU A 117 -10.142 -9.584 6.881 1.00 0.00 H new ATOM 0 HG3 GLU A 117 -10.270 -11.011 5.872 1.00 0.00 H new ATOM 1833 N PRO A 118 -14.399 -8.505 7.588 1.00 0.00 N ATOM 1834 CA PRO A 118 -15.718 -7.867 7.633 1.00 0.00 C ATOM 1835 C PRO A 118 -16.182 -7.397 6.259 1.00 0.00 C ATOM 1836 O PRO A 118 -15.375 -7.217 5.347 1.00 0.00 O ATOM 1837 CB PRO A 118 -15.501 -6.670 8.562 1.00 0.00 C ATOM 1838 CG PRO A 118 -14.047 -6.365 8.453 1.00 0.00 C ATOM 1839 CD PRO A 118 -13.362 -7.686 8.235 1.00 0.00 C ATOM 0 HA PRO A 118 -16.492 -8.555 7.974 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -16.108 -5.817 8.258 1.00 0.00 H new ATOM 0 HB3 PRO A 118 -15.779 -6.910 9.588 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -13.852 -5.683 7.625 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -13.681 -5.880 9.358 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -12.480 -7.582 7.603 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -13.030 -8.127 9.175 1.00 0.00 H new ATOM 1847 N VAL A 119 -17.489 -7.199 6.117 1.00 0.00 N ATOM 1848 CA VAL A 119 -18.061 -6.748 4.854 1.00 0.00 C ATOM 1849 C VAL A 119 -17.353 -5.496 4.346 1.00 0.00 C ATOM 1850 O VAL A 119 -16.943 -4.641 5.130 1.00 0.00 O ATOM 1851 CB VAL A 119 -19.566 -6.453 4.992 1.00 0.00 C ATOM 1852 CG1 VAL A 119 -19.789 -5.173 5.783 1.00 0.00 C ATOM 1853 CG2 VAL A 119 -20.220 -6.363 3.622 1.00 0.00 C ATOM 0 H VAL A 119 -18.171 -7.344 6.861 1.00 0.00 H new ATOM 0 HA VAL A 119 -17.922 -7.557 4.137 1.00 0.00 H new ATOM 0 HB VAL A 119 -20.030 -7.275 5.537 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -20.858 -4.981 5.870 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -19.357 -5.280 6.778 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -19.311 -4.339 5.268 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -21.283 -6.154 3.739 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -19.754 -5.562 3.048 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -20.092 -7.308 3.095 1.00 0.00 H new ATOM 1863 N PHE A 120 -17.215 -5.395 3.028 1.00 0.00 N ATOM 1864 CA PHE A 120 -16.557 -4.248 2.414 1.00 0.00 C ATOM 1865 C PHE A 120 -16.841 -2.972 3.202 1.00 0.00 C ATOM 1866 O PHE A 120 -17.991 -2.664 3.514 1.00 0.00 O ATOM 1867 CB PHE A 120 -17.021 -4.081 0.966 1.00 0.00 C ATOM 1868 CG PHE A 120 -16.674 -5.247 0.086 1.00 0.00 C ATOM 1869 CD1 PHE A 120 -15.380 -5.420 -0.378 1.00 0.00 C ATOM 1870 CD2 PHE A 120 -17.641 -6.171 -0.276 1.00 0.00 C ATOM 1871 CE1 PHE A 120 -15.057 -6.493 -1.188 1.00 0.00 C ATOM 1872 CE2 PHE A 120 -17.324 -7.246 -1.085 1.00 0.00 C ATOM 1873 CZ PHE A 120 -16.030 -7.406 -1.542 1.00 0.00 C ATOM 0 H PHE A 120 -17.550 -6.094 2.365 1.00 0.00 H new ATOM 0 HA PHE A 120 -15.482 -4.429 2.425 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -18.101 -3.936 0.954 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -16.573 -3.178 0.552 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -14.615 -4.709 -0.104 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -18.654 -6.050 0.078 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -14.045 -6.617 -1.543 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -18.087 -7.960 -1.359 1.00 0.00 H new ATOM 0 HZ PHE A 120 -15.780 -8.244 -2.175 1.00 0.00 H new ATOM 1883 N THR A 121 -15.783 -2.234 3.522 1.00 0.00 N ATOM 1884 CA THR A 121 -15.916 -0.993 4.275 1.00 0.00 C ATOM 1885 C THR A 121 -17.210 -0.269 3.917 1.00 0.00 C ATOM 1886 O THR A 121 -17.658 -0.311 2.771 1.00 0.00 O ATOM 1887 CB THR A 121 -14.726 -0.050 4.019 1.00 0.00 C ATOM 1888 OG1 THR A 121 -14.828 1.107 4.858 1.00 0.00 O ATOM 1889 CG2 THR A 121 -14.679 0.379 2.560 1.00 0.00 C ATOM 0 H THR A 121 -14.824 -2.474 3.271 1.00 0.00 H new ATOM 0 HA THR A 121 -15.934 -1.264 5.331 1.00 0.00 H new ATOM 0 HB THR A 121 -13.808 -0.589 4.253 1.00 0.00 H new ATOM 0 HG1 THR A 121 -14.067 1.701 4.690 1.00 0.00 H new ATOM 0 HG21 THR A 121 -13.830 1.045 2.404 1.00 0.00 H new ATOM 0 HG22 THR A 121 -14.572 -0.501 1.925 1.00 0.00 H new ATOM 0 HG23 THR A 121 -15.601 0.901 2.304 1.00 0.00 H new ATOM 1897 N GLN A 122 -17.804 0.394 4.903 1.00 0.00 N ATOM 1898 CA GLN A 122 -19.046 1.127 4.691 1.00 0.00 C ATOM 1899 C GLN A 122 -19.025 1.857 3.352 1.00 0.00 C ATOM 1900 O GLN A 122 -17.995 2.394 2.942 1.00 0.00 O ATOM 1901 CB GLN A 122 -19.274 2.126 5.826 1.00 0.00 C ATOM 1902 CG GLN A 122 -20.687 2.687 5.869 1.00 0.00 C ATOM 1903 CD GLN A 122 -21.639 1.810 6.657 1.00 0.00 C ATOM 1904 OE1 GLN A 122 -22.310 0.942 6.098 1.00 0.00 O ATOM 1905 NE2 GLN A 122 -21.704 2.033 7.965 1.00 0.00 N ATOM 0 H GLN A 122 -17.445 0.439 5.857 1.00 0.00 H new ATOM 0 HA GLN A 122 -19.865 0.408 4.680 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -19.056 1.639 6.777 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -18.568 2.950 5.721 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -20.665 3.683 6.312 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -21.060 2.799 4.851 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -21.130 2.763 8.387 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -22.328 1.474 8.547 1.00 0.00 H new ATOM 1914 N ASP A 123 -20.168 1.873 2.674 1.00 0.00 N ATOM 1915 CA ASP A 123 -20.281 2.538 1.382 1.00 0.00 C ATOM 1916 C ASP A 123 -19.517 3.859 1.381 1.00 0.00 C ATOM 1917 O ASP A 123 -18.462 3.977 0.756 1.00 0.00 O ATOM 1918 CB ASP A 123 -21.751 2.784 1.038 1.00 0.00 C ATOM 1919 CG ASP A 123 -21.973 2.972 -0.450 1.00 0.00 C ATOM 1920 OD1 ASP A 123 -21.543 4.014 -0.988 1.00 0.00 O ATOM 1921 OD2 ASP A 123 -22.577 2.077 -1.077 1.00 0.00 O ATOM 0 H ASP A 123 -21.029 1.433 2.998 1.00 0.00 H new ATOM 0 HA ASP A 123 -19.843 1.886 0.626 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -22.349 1.943 1.388 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -22.103 3.668 1.570 1.00 0.00 H new TER 1926 ASP A 123