USER MOD reduce.3.24.130724 H: found=0, std=0, add=893, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 895 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 83 LYS NZ :NH3+ -158:sc= 0.752 (180deg=-0.182) USER MOD Set 1.2: A 133 TYR OH : rot 180:sc= 0.694 USER MOD Set 2.1: A 82 TYR OH : rot 24:sc= 1.28 USER MOD Set 2.2: A 99 HIS : no HE2:sc= 0.0325! C(o=1.3!,f=-7.9!) USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=-0.0035) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 76:sc= 0.4 USER MOD Single : A 22 TYR OH : rot 134:sc= -0.0283 USER MOD Single : A 39 SER OG : rot 180:sc= 0.0341 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -2.28! K(o=-2.3!,f=-0.32) USER MOD Single : A 48 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0211) USER MOD Single : A 50 THR OG1 : rot -77:sc= 1.22 USER MOD Single : A 60 LYS NZ :NH3+ 172:sc= 2.23 (180deg=2.09) USER MOD Single : A 61 SER OG : rot -92:sc= 1.25 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 173:sc= 1.5 (180deg=1.17) USER MOD Single : A 74 GLN : amide:sc= -0.221 K(o=-0.22,f=-0.77) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0.00122 USER MOD Single : A 81 ASN : amide:sc= 0.997 K(o=1,f=-1.6!) USER MOD Single : A 84 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 91 TYR OH : rot 180:sc= 0.784 USER MOD Single : A 94 SER OG : rot 84:sc= 0.964 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 SER OG : rot 36:sc= 1.11 USER MOD Single : A 115 TYR OH : rot 38:sc= 1.33 USER MOD Single : A 118 SER OG : rot -114:sc= 1.01 USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 77:sc= 0.189 USER MOD Single : A 123 ASN : amide:sc= -0.0274 K(o=-0.027,f=-1.7!) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N PRO A 2 -9.066 5.145 -13.460 1.00 0.00 N ATOM 21 CA PRO A 2 -8.540 4.461 -12.275 1.00 0.00 C ATOM 22 C PRO A 2 -9.308 4.843 -11.013 1.00 0.00 C ATOM 23 O PRO A 2 -9.913 5.915 -10.947 1.00 0.00 O ATOM 24 CB PRO A 2 -7.087 4.946 -12.177 1.00 0.00 C ATOM 25 CG PRO A 2 -6.778 5.543 -13.508 1.00 0.00 C ATOM 26 CD PRO A 2 -8.078 6.065 -14.042 1.00 0.00 C ATOM 0 HA PRO A 2 -8.629 3.378 -12.361 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -6.971 5.681 -11.380 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -6.412 4.121 -11.950 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -6.045 6.344 -13.415 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -6.352 4.798 -14.180 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -8.256 7.096 -13.735 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -8.103 6.048 -15.132 1.00 0.00 H new ATOM 34 N VAL A 3 -9.289 3.967 -10.020 1.00 0.00 N ATOM 35 CA VAL A 3 -9.971 4.233 -8.765 1.00 0.00 C ATOM 36 C VAL A 3 -9.085 5.084 -7.864 1.00 0.00 C ATOM 37 O VAL A 3 -8.074 4.611 -7.337 1.00 0.00 O ATOM 38 CB VAL A 3 -10.351 2.931 -8.028 1.00 0.00 C ATOM 39 CG1 VAL A 3 -11.231 3.236 -6.825 1.00 0.00 C ATOM 40 CG2 VAL A 3 -11.048 1.958 -8.967 1.00 0.00 C ATOM 0 H VAL A 3 -8.809 3.068 -10.060 1.00 0.00 H new ATOM 0 HA VAL A 3 -10.891 4.768 -8.999 1.00 0.00 H new ATOM 0 HB VAL A 3 -9.433 2.461 -7.675 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -11.489 2.306 -6.318 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -10.693 3.888 -6.137 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -12.142 3.733 -7.158 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -11.305 1.049 -8.423 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -11.956 2.417 -9.357 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -10.382 1.710 -9.794 1.00 0.00 H new ATOM 50 N GLU A 4 -9.455 6.343 -7.714 1.00 0.00 N ATOM 51 CA GLU A 4 -8.685 7.275 -6.909 1.00 0.00 C ATOM 52 C GLU A 4 -9.610 8.183 -6.108 1.00 0.00 C ATOM 53 O GLU A 4 -10.715 8.507 -6.549 1.00 0.00 O ATOM 54 CB GLU A 4 -7.755 8.101 -7.801 1.00 0.00 C ATOM 55 CG GLU A 4 -8.455 8.775 -8.971 1.00 0.00 C ATOM 56 CD GLU A 4 -7.497 9.544 -9.860 1.00 0.00 C ATOM 57 OE1 GLU A 4 -6.286 9.587 -9.545 1.00 0.00 O ATOM 58 OE2 GLU A 4 -7.950 10.120 -10.868 1.00 0.00 O ATOM 0 H GLU A 4 -10.289 6.746 -8.142 1.00 0.00 H new ATOM 0 HA GLU A 4 -8.076 6.707 -6.206 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.269 8.864 -7.193 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.968 7.453 -8.187 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -8.970 8.020 -9.565 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.217 9.455 -8.591 1.00 0.00 H new ATOM 65 N LEU A 5 -9.159 8.582 -4.929 1.00 0.00 N ATOM 66 CA LEU A 5 -9.955 9.426 -4.053 1.00 0.00 C ATOM 67 C LEU A 5 -9.408 10.848 -4.043 1.00 0.00 C ATOM 68 O LEU A 5 -8.401 11.122 -3.403 1.00 0.00 O ATOM 69 CB LEU A 5 -9.952 8.867 -2.629 1.00 0.00 C ATOM 70 CG LEU A 5 -10.915 9.554 -1.659 1.00 0.00 C ATOM 71 CD1 LEU A 5 -12.356 9.297 -2.071 1.00 0.00 C ATOM 72 CD2 LEU A 5 -10.668 9.076 -0.237 1.00 0.00 C ATOM 0 H LEU A 5 -8.243 8.334 -4.556 1.00 0.00 H new ATOM 0 HA LEU A 5 -10.978 9.440 -4.430 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -10.199 7.806 -2.671 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -8.941 8.943 -2.228 1.00 0.00 H new ATOM 0 HG LEU A 5 -10.736 10.629 -1.694 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -13.029 9.792 -1.371 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -12.523 9.689 -3.074 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -12.551 8.225 -2.064 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -11.362 9.575 0.440 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -10.821 7.998 -0.184 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -9.644 9.312 0.054 1.00 0.00 H new ATOM 84 N ARG A 6 -10.064 11.745 -4.759 1.00 0.00 N ATOM 85 CA ARG A 6 -9.644 13.139 -4.789 1.00 0.00 C ATOM 86 C ARG A 6 -9.989 13.828 -3.481 1.00 0.00 C ATOM 87 O ARG A 6 -10.936 13.440 -2.802 1.00 0.00 O ATOM 88 CB ARG A 6 -10.285 13.864 -5.970 1.00 0.00 C ATOM 89 CG ARG A 6 -9.570 13.604 -7.284 1.00 0.00 C ATOM 90 CD ARG A 6 -10.353 14.130 -8.473 1.00 0.00 C ATOM 91 NE ARG A 6 -11.516 13.295 -8.772 1.00 0.00 N ATOM 92 CZ ARG A 6 -11.564 12.433 -9.786 1.00 0.00 C ATOM 93 NH1 ARG A 6 -10.496 12.252 -10.554 1.00 0.00 N ATOM 94 NH2 ARG A 6 -12.670 11.737 -10.014 1.00 0.00 N ATOM 0 H ARG A 6 -10.886 11.536 -5.326 1.00 0.00 H new ATOM 0 HA ARG A 6 -8.562 13.172 -4.915 1.00 0.00 H new ATOM 0 HB2 ARG A 6 -11.325 13.551 -6.060 1.00 0.00 H new ATOM 0 HB3 ARG A 6 -10.291 14.936 -5.772 1.00 0.00 H new ATOM 0 HG2 ARG A 6 -8.587 14.075 -7.261 1.00 0.00 H new ATOM 0 HG3 ARG A 6 -9.408 12.533 -7.402 1.00 0.00 H new ATOM 0 HD2 ARG A 6 -10.681 15.150 -8.270 1.00 0.00 H new ATOM 0 HD3 ARG A 6 -9.702 14.172 -9.346 1.00 0.00 H new ATOM 0 HE ARG A 6 -12.336 13.377 -8.171 1.00 0.00 H new ATOM 0 HH11 ARG A 6 -9.639 12.773 -10.367 1.00 0.00 H new ATOM 0 HH12 ARG A 6 -10.532 11.592 -11.331 1.00 0.00 H new ATOM 0 HH21 ARG A 6 -13.484 11.862 -9.413 1.00 0.00 H new ATOM 0 HH22 ARG A 6 -12.706 11.077 -10.791 1.00 0.00 H new ATOM 108 N ALA A 7 -9.204 14.844 -3.131 1.00 0.00 N ATOM 109 CA ALA A 7 -9.375 15.561 -1.871 1.00 0.00 C ATOM 110 C ALA A 7 -10.803 16.059 -1.691 1.00 0.00 C ATOM 111 O ALA A 7 -11.355 15.993 -0.594 1.00 0.00 O ATOM 112 CB ALA A 7 -8.393 16.717 -1.787 1.00 0.00 C ATOM 0 H ALA A 7 -8.438 15.191 -3.708 1.00 0.00 H new ATOM 0 HA ALA A 7 -9.171 14.860 -1.061 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -8.531 17.244 -0.843 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -7.374 16.334 -1.843 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -8.568 17.404 -2.615 1.00 0.00 H new ATOM 118 N ASN A 8 -11.397 16.563 -2.760 1.00 0.00 N ATOM 119 CA ASN A 8 -12.806 16.919 -2.728 1.00 0.00 C ATOM 120 C ASN A 8 -13.641 15.753 -3.233 1.00 0.00 C ATOM 121 O ASN A 8 -13.902 15.625 -4.430 1.00 0.00 O ATOM 122 CB ASN A 8 -13.091 18.174 -3.555 1.00 0.00 C ATOM 123 CG ASN A 8 -14.547 18.598 -3.461 1.00 0.00 C ATOM 124 OD1 ASN A 8 -15.373 18.230 -4.297 1.00 0.00 O ATOM 125 ND2 ASN A 8 -14.876 19.361 -2.431 1.00 0.00 N ATOM 0 H ASN A 8 -10.932 16.734 -3.652 1.00 0.00 H new ATOM 0 HA ASN A 8 -13.076 17.140 -1.695 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -12.453 18.988 -3.210 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -12.834 17.987 -4.598 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -15.842 19.664 -2.309 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -14.163 19.646 -1.759 1.00 0.00 H new ATOM 132 N TRP A 9 -14.031 14.887 -2.317 1.00 0.00 N ATOM 133 CA TRP A 9 -14.779 13.698 -2.671 1.00 0.00 C ATOM 134 C TRP A 9 -16.180 13.729 -2.081 1.00 0.00 C ATOM 135 O TRP A 9 -16.460 14.478 -1.144 1.00 0.00 O ATOM 136 CB TRP A 9 -14.042 12.441 -2.197 1.00 0.00 C ATOM 137 CG TRP A 9 -13.679 12.457 -0.740 1.00 0.00 C ATOM 138 CD1 TRP A 9 -12.497 12.868 -0.197 1.00 0.00 C ATOM 139 CD2 TRP A 9 -14.499 12.037 0.360 1.00 0.00 C ATOM 140 NE1 TRP A 9 -12.535 12.741 1.168 1.00 0.00 N ATOM 141 CE2 TRP A 9 -13.750 12.232 1.534 1.00 0.00 C ATOM 142 CE3 TRP A 9 -15.792 11.521 0.468 1.00 0.00 C ATOM 143 CZ2 TRP A 9 -14.252 11.929 2.793 1.00 0.00 C ATOM 144 CZ3 TRP A 9 -16.288 11.219 1.720 1.00 0.00 C ATOM 145 CH2 TRP A 9 -15.520 11.424 2.870 1.00 0.00 C ATOM 0 H TRP A 9 -13.841 14.986 -1.320 1.00 0.00 H new ATOM 0 HA TRP A 9 -14.867 13.674 -3.757 1.00 0.00 H new ATOM 0 HB2 TRP A 9 -14.666 11.570 -2.395 1.00 0.00 H new ATOM 0 HB3 TRP A 9 -13.133 12.322 -2.786 1.00 0.00 H new ATOM 0 HD1 TRP A 9 -11.654 13.239 -0.760 1.00 0.00 H new ATOM 0 HE1 TRP A 9 -11.779 12.987 1.807 1.00 0.00 H new ATOM 0 HE3 TRP A 9 -16.394 11.361 -0.414 1.00 0.00 H new ATOM 0 HZ2 TRP A 9 -13.660 12.087 3.682 1.00 0.00 H new ATOM 0 HZ3 TRP A 9 -17.286 10.818 1.813 1.00 0.00 H new ATOM 0 HH2 TRP A 9 -15.936 11.179 3.836 1.00 0.00 H new ATOM 156 N SER A 10 -17.059 12.928 -2.651 1.00 0.00 N ATOM 157 CA SER A 10 -18.378 12.719 -2.092 1.00 0.00 C ATOM 158 C SER A 10 -18.458 11.296 -1.540 1.00 0.00 C ATOM 159 O SER A 10 -17.557 10.492 -1.788 1.00 0.00 O ATOM 160 CB SER A 10 -19.437 12.953 -3.168 1.00 0.00 C ATOM 161 OG SER A 10 -19.247 14.211 -3.794 1.00 0.00 O ATOM 0 H SER A 10 -16.880 12.407 -3.509 1.00 0.00 H new ATOM 0 HA SER A 10 -18.562 13.424 -1.281 1.00 0.00 H new ATOM 0 HB2 SER A 10 -19.387 12.159 -3.913 1.00 0.00 H new ATOM 0 HB3 SER A 10 -20.431 12.909 -2.723 1.00 0.00 H new ATOM 0 HG SER A 10 -19.934 14.342 -4.481 1.00 0.00 H new ATOM 167 N GLU A 11 -19.512 10.982 -0.791 1.00 0.00 N ATOM 168 CA GLU A 11 -19.664 9.648 -0.206 1.00 0.00 C ATOM 169 C GLU A 11 -19.583 8.563 -1.284 1.00 0.00 C ATOM 170 O GLU A 11 -19.017 7.491 -1.062 1.00 0.00 O ATOM 171 CB GLU A 11 -20.991 9.541 0.557 1.00 0.00 C ATOM 172 CG GLU A 11 -21.198 8.192 1.231 1.00 0.00 C ATOM 173 CD GLU A 11 -22.461 8.138 2.068 1.00 0.00 C ATOM 174 OE1 GLU A 11 -23.563 8.114 1.488 1.00 0.00 O ATOM 175 OE2 GLU A 11 -22.351 8.102 3.314 1.00 0.00 O ATOM 0 H GLU A 11 -20.271 11.628 -0.574 1.00 0.00 H new ATOM 0 HA GLU A 11 -18.844 9.494 0.496 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -21.030 10.325 1.313 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -21.814 9.723 -0.134 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -21.240 7.414 0.469 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -20.339 7.972 1.865 1.00 0.00 H new ATOM 182 N GLU A 12 -20.125 8.864 -2.456 1.00 0.00 N ATOM 183 CA GLU A 12 -20.084 7.946 -3.590 1.00 0.00 C ATOM 184 C GLU A 12 -18.644 7.653 -4.026 1.00 0.00 C ATOM 185 O GLU A 12 -18.321 6.518 -4.385 1.00 0.00 O ATOM 186 CB GLU A 12 -20.898 8.523 -4.747 1.00 0.00 C ATOM 187 CG GLU A 12 -22.392 8.504 -4.482 1.00 0.00 C ATOM 188 CD GLU A 12 -23.145 9.525 -5.308 1.00 0.00 C ATOM 189 OE1 GLU A 12 -23.359 9.291 -6.514 1.00 0.00 O ATOM 190 OE2 GLU A 12 -23.532 10.570 -4.746 1.00 0.00 O ATOM 0 H GLU A 12 -20.603 9.744 -2.649 1.00 0.00 H new ATOM 0 HA GLU A 12 -20.524 6.998 -3.282 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -20.580 9.549 -4.933 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -20.687 7.954 -5.653 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -22.782 7.509 -4.697 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -22.572 8.695 -3.424 1.00 0.00 H new ATOM 197 N ASP A 13 -17.784 8.669 -3.980 1.00 0.00 N ATOM 198 CA ASP A 13 -16.362 8.485 -4.282 1.00 0.00 C ATOM 199 C ASP A 13 -15.736 7.548 -3.269 1.00 0.00 C ATOM 200 O ASP A 13 -15.089 6.561 -3.627 1.00 0.00 O ATOM 201 CB ASP A 13 -15.589 9.811 -4.250 1.00 0.00 C ATOM 202 CG ASP A 13 -15.932 10.744 -5.389 1.00 0.00 C ATOM 203 OD1 ASP A 13 -15.460 10.503 -6.520 1.00 0.00 O ATOM 204 OD2 ASP A 13 -16.654 11.736 -5.153 1.00 0.00 O ATOM 0 H ASP A 13 -18.044 9.625 -3.738 1.00 0.00 H new ATOM 0 HA ASP A 13 -16.302 8.069 -5.287 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -15.791 10.316 -3.305 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -14.520 9.599 -4.276 1.00 0.00 H new ATOM 209 N LEU A 14 -15.949 7.867 -2.000 1.00 0.00 N ATOM 210 CA LEU A 14 -15.378 7.107 -0.899 1.00 0.00 C ATOM 211 C LEU A 14 -15.796 5.644 -0.979 1.00 0.00 C ATOM 212 O LEU A 14 -14.968 4.749 -0.817 1.00 0.00 O ATOM 213 CB LEU A 14 -15.820 7.702 0.439 1.00 0.00 C ATOM 214 CG LEU A 14 -15.185 7.070 1.678 1.00 0.00 C ATOM 215 CD1 LEU A 14 -13.692 7.357 1.721 1.00 0.00 C ATOM 216 CD2 LEU A 14 -15.864 7.574 2.939 1.00 0.00 C ATOM 0 H LEU A 14 -16.521 8.658 -1.706 1.00 0.00 H new ATOM 0 HA LEU A 14 -14.292 7.162 -0.973 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.591 8.768 0.437 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -16.903 7.609 0.519 1.00 0.00 H new ATOM 0 HG LEU A 14 -15.323 5.990 1.622 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -13.259 6.899 2.610 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -13.216 6.944 0.832 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -13.529 8.434 1.752 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -15.399 7.114 3.811 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -15.759 8.657 3.001 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -16.922 7.313 2.912 1.00 0.00 H new ATOM 228 N GLU A 15 -17.080 5.417 -1.245 1.00 0.00 N ATOM 229 CA GLU A 15 -17.626 4.073 -1.359 1.00 0.00 C ATOM 230 C GLU A 15 -16.861 3.259 -2.400 1.00 0.00 C ATOM 231 O GLU A 15 -16.399 2.154 -2.119 1.00 0.00 O ATOM 232 CB GLU A 15 -19.102 4.150 -1.748 1.00 0.00 C ATOM 233 CG GLU A 15 -19.783 2.797 -1.816 1.00 0.00 C ATOM 234 CD GLU A 15 -20.037 2.194 -0.450 1.00 0.00 C ATOM 235 OE1 GLU A 15 -19.102 1.622 0.148 1.00 0.00 O ATOM 236 OE2 GLU A 15 -21.183 2.288 0.033 1.00 0.00 O ATOM 0 H GLU A 15 -17.766 6.158 -1.387 1.00 0.00 H new ATOM 0 HA GLU A 15 -17.525 3.577 -0.394 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -19.627 4.776 -1.026 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -19.189 4.640 -2.718 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -20.731 2.900 -2.344 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -19.165 2.114 -2.400 1.00 0.00 H new ATOM 243 N THR A 16 -16.717 3.822 -3.595 1.00 0.00 N ATOM 244 CA THR A 16 -16.032 3.144 -4.686 1.00 0.00 C ATOM 245 C THR A 16 -14.577 2.843 -4.319 1.00 0.00 C ATOM 246 O THR A 16 -14.062 1.762 -4.612 1.00 0.00 O ATOM 247 CB THR A 16 -16.082 3.990 -5.974 1.00 0.00 C ATOM 248 OG1 THR A 16 -17.444 4.326 -6.281 1.00 0.00 O ATOM 249 CG2 THR A 16 -15.473 3.241 -7.149 1.00 0.00 C ATOM 0 H THR A 16 -17.068 4.750 -3.832 1.00 0.00 H new ATOM 0 HA THR A 16 -16.548 2.201 -4.863 1.00 0.00 H new ATOM 0 HB THR A 16 -15.502 4.897 -5.804 1.00 0.00 H new ATOM 0 HG1 THR A 16 -17.750 5.034 -5.677 1.00 0.00 H new ATOM 0 HG21 THR A 16 -15.523 3.863 -8.042 1.00 0.00 H new ATOM 0 HG22 THR A 16 -14.432 3.004 -6.929 1.00 0.00 H new ATOM 0 HG23 THR A 16 -16.027 2.318 -7.318 1.00 0.00 H new ATOM 257 N VAL A 17 -13.933 3.794 -3.655 1.00 0.00 N ATOM 258 CA VAL A 17 -12.548 3.631 -3.233 1.00 0.00 C ATOM 259 C VAL A 17 -12.425 2.519 -2.194 1.00 0.00 C ATOM 260 O VAL A 17 -11.603 1.616 -2.341 1.00 0.00 O ATOM 261 CB VAL A 17 -11.974 4.947 -2.663 1.00 0.00 C ATOM 262 CG1 VAL A 17 -10.560 4.750 -2.134 1.00 0.00 C ATOM 263 CG2 VAL A 17 -11.994 6.028 -3.729 1.00 0.00 C ATOM 0 H VAL A 17 -14.349 4.689 -3.396 1.00 0.00 H new ATOM 0 HA VAL A 17 -11.969 3.358 -4.115 1.00 0.00 H new ATOM 0 HB VAL A 17 -12.602 5.258 -1.828 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -10.184 5.694 -1.740 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -10.569 4.003 -1.340 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -9.913 4.411 -2.943 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -11.587 6.952 -3.318 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -11.389 5.712 -4.579 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -13.020 6.197 -4.057 1.00 0.00 H new ATOM 273 N ILE A 18 -13.261 2.578 -1.162 1.00 0.00 N ATOM 274 CA ILE A 18 -13.261 1.568 -0.109 1.00 0.00 C ATOM 275 C ILE A 18 -13.568 0.184 -0.683 1.00 0.00 C ATOM 276 O ILE A 18 -12.961 -0.818 -0.295 1.00 0.00 O ATOM 277 CB ILE A 18 -14.289 1.926 0.991 1.00 0.00 C ATOM 278 CG1 ILE A 18 -13.855 3.199 1.724 1.00 0.00 C ATOM 279 CG2 ILE A 18 -14.462 0.780 1.976 1.00 0.00 C ATOM 280 CD1 ILE A 18 -14.834 3.658 2.783 1.00 0.00 C ATOM 0 H ILE A 18 -13.950 3.318 -1.032 1.00 0.00 H new ATOM 0 HA ILE A 18 -12.266 1.547 0.335 1.00 0.00 H new ATOM 0 HB ILE A 18 -15.252 2.103 0.512 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -12.885 3.026 2.190 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -13.721 3.999 0.996 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -15.190 1.061 2.737 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -14.814 -0.105 1.446 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -13.506 0.562 2.452 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -14.458 4.564 3.258 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -15.799 3.864 2.321 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -14.951 2.877 3.534 1.00 0.00 H new ATOM 292 N ARG A 19 -14.489 0.146 -1.637 1.00 0.00 N ATOM 293 CA ARG A 19 -14.901 -1.102 -2.271 1.00 0.00 C ATOM 294 C ARG A 19 -13.746 -1.702 -3.080 1.00 0.00 C ATOM 295 O ARG A 19 -13.630 -2.923 -3.211 1.00 0.00 O ATOM 296 CB ARG A 19 -16.120 -0.834 -3.169 1.00 0.00 C ATOM 297 CG ARG A 19 -17.038 -2.035 -3.362 1.00 0.00 C ATOM 298 CD ARG A 19 -16.510 -3.008 -4.404 1.00 0.00 C ATOM 299 NE ARG A 19 -16.601 -2.472 -5.764 1.00 0.00 N ATOM 300 CZ ARG A 19 -16.396 -3.199 -6.863 1.00 0.00 C ATOM 301 NH1 ARG A 19 -16.124 -4.497 -6.763 1.00 0.00 N ATOM 302 NH2 ARG A 19 -16.485 -2.632 -8.063 1.00 0.00 N ATOM 0 H ARG A 19 -14.969 0.973 -1.992 1.00 0.00 H new ATOM 0 HA ARG A 19 -15.177 -1.825 -1.503 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -16.698 -0.016 -2.740 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -15.770 -0.500 -4.146 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -17.156 -2.555 -2.411 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -18.027 -1.688 -3.661 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -15.471 -3.248 -4.180 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -17.072 -3.940 -4.345 1.00 0.00 H new ATOM 0 HE ARG A 19 -16.835 -1.486 -5.877 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -16.072 -4.938 -5.845 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -15.967 -5.052 -7.605 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -16.710 -1.640 -8.143 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -16.328 -3.189 -8.903 1.00 0.00 H new ATOM 316 N ALA A 20 -12.886 -0.837 -3.610 1.00 0.00 N ATOM 317 CA ALA A 20 -11.748 -1.279 -4.408 1.00 0.00 C ATOM 318 C ALA A 20 -10.563 -1.662 -3.526 1.00 0.00 C ATOM 319 O ALA A 20 -9.843 -2.617 -3.831 1.00 0.00 O ATOM 320 CB ALA A 20 -11.343 -0.201 -5.402 1.00 0.00 C ATOM 0 H ALA A 20 -12.956 0.175 -3.501 1.00 0.00 H new ATOM 0 HA ALA A 20 -12.055 -2.168 -4.959 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.492 -0.548 -5.989 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -12.179 0.013 -6.067 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -11.066 0.705 -4.863 1.00 0.00 H new ATOM 326 N VAL A 21 -10.353 -0.911 -2.444 1.00 0.00 N ATOM 327 CA VAL A 21 -9.276 -1.205 -1.503 1.00 0.00 C ATOM 328 C VAL A 21 -9.525 -2.543 -0.817 1.00 0.00 C ATOM 329 O VAL A 21 -8.653 -3.415 -0.795 1.00 0.00 O ATOM 330 CB VAL A 21 -9.116 -0.101 -0.431 1.00 0.00 C ATOM 331 CG1 VAL A 21 -8.050 -0.487 0.587 1.00 0.00 C ATOM 332 CG2 VAL A 21 -8.765 1.229 -1.079 1.00 0.00 C ATOM 0 H VAL A 21 -10.915 -0.096 -2.199 1.00 0.00 H new ATOM 0 HA VAL A 21 -8.352 -1.248 -2.080 1.00 0.00 H new ATOM 0 HB VAL A 21 -10.068 0.005 0.088 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -7.954 0.304 1.331 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -8.337 -1.416 1.080 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -7.095 -0.625 0.080 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -8.657 1.992 -0.308 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.828 1.131 -1.626 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -9.559 1.519 -1.768 1.00 0.00 H new ATOM 342 N TYR A 22 -10.719 -2.708 -0.262 1.00 0.00 N ATOM 343 CA TYR A 22 -11.103 -3.982 0.321 1.00 0.00 C ATOM 344 C TYR A 22 -11.599 -4.906 -0.778 1.00 0.00 C ATOM 345 O TYR A 22 -12.802 -5.145 -0.920 1.00 0.00 O ATOM 346 CB TYR A 22 -12.170 -3.807 1.402 1.00 0.00 C ATOM 347 CG TYR A 22 -11.720 -2.943 2.557 1.00 0.00 C ATOM 348 CD1 TYR A 22 -10.769 -3.394 3.465 1.00 0.00 C ATOM 349 CD2 TYR A 22 -12.240 -1.671 2.733 1.00 0.00 C ATOM 350 CE1 TYR A 22 -10.355 -2.596 4.515 1.00 0.00 C ATOM 351 CE2 TYR A 22 -11.830 -0.870 3.776 1.00 0.00 C ATOM 352 CZ TYR A 22 -10.889 -1.336 4.665 1.00 0.00 C ATOM 353 OH TYR A 22 -10.477 -0.536 5.702 1.00 0.00 O ATOM 0 H TYR A 22 -11.432 -1.980 -0.204 1.00 0.00 H new ATOM 0 HA TYR A 22 -10.229 -4.422 0.801 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -13.061 -3.367 0.954 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -12.456 -4.788 1.782 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -10.348 -4.382 3.348 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -12.981 -1.301 2.040 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -9.616 -2.959 5.214 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -12.245 0.120 3.895 1.00 0.00 H new ATOM 0 HH TYR A 22 -10.291 0.365 5.366 1.00 0.00 H new ATOM 586 N LEU A 37 -11.535 -2.799 9.850 1.00 0.00 N ATOM 587 CA LEU A 37 -10.824 -1.547 9.611 1.00 0.00 C ATOM 588 C LEU A 37 -11.789 -0.415 9.263 1.00 0.00 C ATOM 589 O LEU A 37 -11.426 0.534 8.567 1.00 0.00 O ATOM 590 CB LEU A 37 -9.775 -1.728 8.511 1.00 0.00 C ATOM 591 CG LEU A 37 -8.688 -2.764 8.816 1.00 0.00 C ATOM 592 CD1 LEU A 37 -7.804 -2.979 7.599 1.00 0.00 C ATOM 593 CD2 LEU A 37 -7.853 -2.327 10.012 1.00 0.00 C ATOM 0 HA LEU A 37 -10.313 -1.270 10.533 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -10.282 -2.016 7.590 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -9.297 -0.766 8.324 1.00 0.00 H new ATOM 0 HG LEU A 37 -9.172 -3.709 9.063 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -7.037 -3.718 7.832 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -8.411 -3.336 6.767 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.329 -2.037 7.323 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -7.086 -3.075 10.213 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.378 -1.370 9.794 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -8.496 -2.222 10.886 1.00 0.00 H new ATOM 605 N VAL A 38 -13.007 -0.495 9.791 1.00 0.00 N ATOM 606 CA VAL A 38 -13.990 0.565 9.597 1.00 0.00 C ATOM 607 C VAL A 38 -13.515 1.843 10.290 1.00 0.00 C ATOM 608 O VAL A 38 -13.860 2.957 9.888 1.00 0.00 O ATOM 609 CB VAL A 38 -15.391 0.159 10.121 1.00 0.00 C ATOM 610 CG1 VAL A 38 -15.367 -0.097 11.622 1.00 0.00 C ATOM 611 CG2 VAL A 38 -16.432 1.213 9.767 1.00 0.00 C ATOM 0 H VAL A 38 -13.336 -1.279 10.354 1.00 0.00 H new ATOM 0 HA VAL A 38 -14.083 0.742 8.526 1.00 0.00 H new ATOM 0 HB VAL A 38 -15.671 -0.772 9.629 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -16.364 -0.380 11.959 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -14.667 -0.903 11.842 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -15.052 0.809 12.141 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -17.406 0.904 10.146 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -16.153 2.166 10.217 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -16.483 1.325 8.684 1.00 0.00 H new ATOM 621 N SER A 39 -12.693 1.668 11.317 1.00 0.00 N ATOM 622 CA SER A 39 -12.066 2.788 11.997 1.00 0.00 C ATOM 623 C SER A 39 -11.134 3.536 11.041 1.00 0.00 C ATOM 624 O SER A 39 -11.109 4.766 11.016 1.00 0.00 O ATOM 625 CB SER A 39 -11.298 2.279 13.216 1.00 0.00 C ATOM 626 OG SER A 39 -10.578 1.099 12.897 1.00 0.00 O ATOM 0 H SER A 39 -12.446 0.754 11.697 1.00 0.00 H new ATOM 0 HA SER A 39 -12.835 3.484 12.331 1.00 0.00 H new ATOM 0 HB2 SER A 39 -10.609 3.048 13.566 1.00 0.00 H new ATOM 0 HB3 SER A 39 -11.992 2.078 14.032 1.00 0.00 H new ATOM 0 HG SER A 39 -10.091 0.789 13.689 1.00 0.00 H new ATOM 632 N ALA A 40 -10.392 2.779 10.236 1.00 0.00 N ATOM 633 CA ALA A 40 -9.494 3.357 9.243 1.00 0.00 C ATOM 634 C ALA A 40 -10.292 4.080 8.166 1.00 0.00 C ATOM 635 O ALA A 40 -9.880 5.133 7.673 1.00 0.00 O ATOM 636 CB ALA A 40 -8.615 2.276 8.626 1.00 0.00 C ATOM 0 H ALA A 40 -10.396 1.759 10.254 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.848 4.082 9.738 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -7.951 2.725 7.887 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.021 1.801 9.407 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -9.243 1.528 8.142 1.00 0.00 H new ATOM 642 N GLU A 41 -11.442 3.508 7.816 1.00 0.00 N ATOM 643 CA GLU A 41 -12.370 4.142 6.886 1.00 0.00 C ATOM 644 C GLU A 41 -12.798 5.503 7.422 1.00 0.00 C ATOM 645 O GLU A 41 -12.837 6.488 6.689 1.00 0.00 O ATOM 646 CB GLU A 41 -13.602 3.260 6.666 1.00 0.00 C ATOM 647 CG GLU A 41 -13.294 1.929 6.001 1.00 0.00 C ATOM 648 CD GLU A 41 -14.518 1.043 5.873 1.00 0.00 C ATOM 649 OE1 GLU A 41 -15.514 1.478 5.260 1.00 0.00 O ATOM 650 OE2 GLU A 41 -14.485 -0.100 6.375 1.00 0.00 O ATOM 0 H GLU A 41 -11.753 2.602 8.165 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.862 4.275 5.931 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -14.079 3.073 7.628 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -14.321 3.803 6.053 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -12.876 2.110 5.011 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -12.531 1.407 6.578 1.00 0.00 H new ATOM 657 N SER A 42 -13.097 5.546 8.715 1.00 0.00 N ATOM 658 CA SER A 42 -13.483 6.784 9.376 1.00 0.00 C ATOM 659 C SER A 42 -12.332 7.787 9.372 1.00 0.00 C ATOM 660 O SER A 42 -12.542 8.981 9.149 1.00 0.00 O ATOM 661 CB SER A 42 -13.923 6.493 10.811 1.00 0.00 C ATOM 662 OG SER A 42 -14.272 7.687 11.496 1.00 0.00 O ATOM 0 H SER A 42 -13.079 4.731 9.329 1.00 0.00 H new ATOM 0 HA SER A 42 -14.317 7.222 8.827 1.00 0.00 H new ATOM 0 HB2 SER A 42 -14.776 5.814 10.802 1.00 0.00 H new ATOM 0 HB3 SER A 42 -13.119 5.987 11.345 1.00 0.00 H new ATOM 0 HG SER A 42 -14.551 7.470 12.410 1.00 0.00 H new ATOM 668 N LEU A 43 -11.118 7.299 9.615 1.00 0.00 N ATOM 669 CA LEU A 43 -9.932 8.151 9.608 1.00 0.00 C ATOM 670 C LEU A 43 -9.781 8.834 8.255 1.00 0.00 C ATOM 671 O LEU A 43 -9.550 10.041 8.178 1.00 0.00 O ATOM 672 CB LEU A 43 -8.676 7.333 9.920 1.00 0.00 C ATOM 673 CG LEU A 43 -8.681 6.599 11.261 1.00 0.00 C ATOM 674 CD1 LEU A 43 -7.396 5.805 11.437 1.00 0.00 C ATOM 675 CD2 LEU A 43 -8.860 7.583 12.406 1.00 0.00 C ATOM 0 H LEU A 43 -10.930 6.318 9.819 1.00 0.00 H new ATOM 0 HA LEU A 43 -10.054 8.911 10.380 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -8.535 6.600 9.126 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -7.814 8.000 9.895 1.00 0.00 H new ATOM 0 HG LEU A 43 -9.520 5.904 11.271 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -7.416 5.289 12.397 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.307 5.074 10.633 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -6.543 6.483 11.407 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -8.861 7.043 13.353 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -8.041 8.302 12.399 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -9.807 8.110 12.288 1.00 0.00 H new ATOM 687 N LEU A 44 -9.927 8.053 7.194 1.00 0.00 N ATOM 688 CA LEU A 44 -9.853 8.576 5.838 1.00 0.00 C ATOM 689 C LEU A 44 -11.031 9.510 5.565 1.00 0.00 C ATOM 690 O LEU A 44 -10.859 10.595 5.014 1.00 0.00 O ATOM 691 CB LEU A 44 -9.845 7.419 4.832 1.00 0.00 C ATOM 692 CG LEU A 44 -9.807 7.822 3.356 1.00 0.00 C ATOM 693 CD1 LEU A 44 -8.525 8.571 3.035 1.00 0.00 C ATOM 694 CD2 LEU A 44 -9.941 6.593 2.472 1.00 0.00 C ATOM 0 H LEU A 44 -10.098 7.049 7.248 1.00 0.00 H new ATOM 0 HA LEU A 44 -8.930 9.145 5.728 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -8.981 6.788 5.039 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -10.733 6.810 5.000 1.00 0.00 H new ATOM 0 HG LEU A 44 -10.647 8.488 3.159 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.519 8.848 1.981 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -8.467 9.471 3.647 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.668 7.932 3.247 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -9.913 6.893 1.425 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -9.119 5.907 2.675 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -10.888 6.096 2.681 1.00 0.00 H new ATOM 706 N ARG A 45 -12.217 9.089 5.985 1.00 0.00 N ATOM 707 CA ARG A 45 -13.440 9.844 5.736 1.00 0.00 C ATOM 708 C ARG A 45 -13.402 11.223 6.392 1.00 0.00 C ATOM 709 O ARG A 45 -13.878 12.202 5.825 1.00 0.00 O ATOM 710 CB ARG A 45 -14.659 9.069 6.246 1.00 0.00 C ATOM 711 CG ARG A 45 -15.981 9.748 5.925 1.00 0.00 C ATOM 712 CD ARG A 45 -17.170 8.918 6.371 1.00 0.00 C ATOM 713 NE ARG A 45 -18.414 9.437 5.806 1.00 0.00 N ATOM 714 CZ ARG A 45 -19.443 8.683 5.425 1.00 0.00 C ATOM 715 NH1 ARG A 45 -19.457 7.376 5.671 1.00 0.00 N ATOM 716 NH2 ARG A 45 -20.478 9.250 4.823 1.00 0.00 N ATOM 0 H ARG A 45 -12.359 8.222 6.504 1.00 0.00 H new ATOM 0 HA ARG A 45 -13.518 9.984 4.658 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -14.655 8.071 5.808 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -14.576 8.944 7.326 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -16.016 10.722 6.413 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -16.046 9.926 4.852 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -17.031 7.882 6.062 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -17.232 8.921 7.459 1.00 0.00 H new ATOM 0 HE ARG A 45 -18.500 10.447 5.696 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -18.673 6.940 6.157 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -20.252 6.810 5.374 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -20.482 10.256 4.655 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -21.271 8.680 4.527 1.00 0.00 H new ATOM 730 N ASN A 46 -12.834 11.301 7.585 1.00 0.00 N ATOM 731 CA ASN A 46 -12.825 12.556 8.322 1.00 0.00 C ATOM 732 C ASN A 46 -11.564 13.362 8.019 1.00 0.00 C ATOM 733 O ASN A 46 -11.297 14.383 8.658 1.00 0.00 O ATOM 734 CB ASN A 46 -12.952 12.294 9.826 1.00 0.00 C ATOM 735 CG ASN A 46 -13.720 13.396 10.537 1.00 0.00 C ATOM 736 OD1 ASN A 46 -13.502 13.661 11.717 1.00 0.00 O ATOM 737 ND2 ASN A 46 -14.638 14.039 9.827 1.00 0.00 N ATOM 0 H ASN A 46 -12.378 10.521 8.059 1.00 0.00 H new ATOM 0 HA ASN A 46 -13.684 13.145 7.999 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -13.456 11.341 9.986 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -11.957 12.206 10.263 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -15.190 14.780 10.259 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -14.792 13.792 8.849 1.00 0.00 H new ATOM 744 N GLY A 47 -10.798 12.905 7.035 1.00 0.00 N ATOM 745 CA GLY A 47 -9.623 13.637 6.598 1.00 0.00 C ATOM 746 C GLY A 47 -8.497 13.614 7.610 1.00 0.00 C ATOM 747 O GLY A 47 -7.730 14.573 7.718 1.00 0.00 O ATOM 0 H GLY A 47 -10.971 12.036 6.530 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.268 13.214 5.659 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.901 14.671 6.397 1.00 0.00 H new ATOM 751 N LYS A 48 -8.394 12.525 8.355 1.00 0.00 N ATOM 752 CA LYS A 48 -7.327 12.374 9.334 1.00 0.00 C ATOM 753 C LYS A 48 -6.100 11.749 8.687 1.00 0.00 C ATOM 754 O LYS A 48 -4.969 12.037 9.071 1.00 0.00 O ATOM 755 CB LYS A 48 -7.790 11.520 10.513 1.00 0.00 C ATOM 756 CG LYS A 48 -8.817 12.204 11.401 1.00 0.00 C ATOM 757 CD LYS A 48 -9.176 11.336 12.597 1.00 0.00 C ATOM 758 CE LYS A 48 -7.955 10.998 13.441 1.00 0.00 C ATOM 759 NZ LYS A 48 -7.369 12.199 14.085 1.00 0.00 N ATOM 0 H LYS A 48 -9.035 11.733 8.301 1.00 0.00 H new ATOM 0 HA LYS A 48 -7.065 13.364 9.707 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -8.214 10.591 10.132 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.923 11.251 11.117 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.423 13.160 11.747 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -9.715 12.420 10.823 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -9.911 11.853 13.213 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -9.643 10.415 12.249 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -8.234 10.276 14.208 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -7.202 10.521 12.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -6.594 11.911 14.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -7.001 12.840 13.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.101 12.689 14.638 1.00 0.00 H new ATOM 773 N ILE A 49 -6.339 10.897 7.698 1.00 0.00 N ATOM 774 CA ILE A 49 -5.264 10.241 6.968 1.00 0.00 C ATOM 775 C ILE A 49 -5.559 10.272 5.474 1.00 0.00 C ATOM 776 O ILE A 49 -6.679 10.582 5.066 1.00 0.00 O ATOM 777 CB ILE A 49 -5.072 8.771 7.408 1.00 0.00 C ATOM 778 CG1 ILE A 49 -6.343 7.959 7.138 1.00 0.00 C ATOM 779 CG2 ILE A 49 -4.687 8.691 8.880 1.00 0.00 C ATOM 780 CD1 ILE A 49 -6.199 6.479 7.432 1.00 0.00 C ATOM 0 H ILE A 49 -7.275 10.643 7.382 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.346 10.786 7.189 1.00 0.00 H new ATOM 0 HB ILE A 49 -4.259 8.344 6.822 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -7.156 8.362 7.742 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -6.629 8.086 6.094 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -4.558 7.647 9.166 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -3.754 9.230 9.042 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -5.474 9.138 9.487 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -7.140 5.972 7.216 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -5.409 6.059 6.809 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -5.944 6.340 8.483 1.00 0.00 H new ATOM 792 N THR A 50 -4.561 9.965 4.663 1.00 0.00 N ATOM 793 CA THR A 50 -4.760 9.876 3.229 1.00 0.00 C ATOM 794 C THR A 50 -4.966 8.421 2.825 1.00 0.00 C ATOM 795 O THR A 50 -5.008 7.531 3.679 1.00 0.00 O ATOM 796 CB THR A 50 -3.563 10.456 2.446 1.00 0.00 C ATOM 797 OG1 THR A 50 -2.392 9.664 2.676 1.00 0.00 O ATOM 798 CG2 THR A 50 -3.288 11.896 2.850 1.00 0.00 C ATOM 0 H THR A 50 -3.608 9.774 4.973 1.00 0.00 H new ATOM 0 HA THR A 50 -5.644 10.464 2.983 1.00 0.00 H new ATOM 0 HB THR A 50 -3.816 10.435 1.386 1.00 0.00 H new ATOM 0 HG1 THR A 50 -2.018 9.881 3.555 1.00 0.00 H new ATOM 0 HG21 THR A 50 -2.440 12.278 2.282 1.00 0.00 H new ATOM 0 HG22 THR A 50 -4.167 12.506 2.643 1.00 0.00 H new ATOM 0 HG23 THR A 50 -3.060 11.938 3.915 1.00 0.00 H new ATOM 806 N VAL A 51 -5.091 8.176 1.525 1.00 0.00 N ATOM 807 CA VAL A 51 -5.228 6.818 1.014 1.00 0.00 C ATOM 808 C VAL A 51 -3.983 5.996 1.349 1.00 0.00 C ATOM 809 O VAL A 51 -4.059 4.785 1.542 1.00 0.00 O ATOM 810 CB VAL A 51 -5.471 6.812 -0.512 1.00 0.00 C ATOM 811 CG1 VAL A 51 -5.571 5.392 -1.054 1.00 0.00 C ATOM 812 CG2 VAL A 51 -6.731 7.591 -0.844 1.00 0.00 C ATOM 0 H VAL A 51 -5.100 8.900 0.807 1.00 0.00 H new ATOM 0 HA VAL A 51 -6.095 6.367 1.497 1.00 0.00 H new ATOM 0 HB VAL A 51 -4.617 7.292 -0.990 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -5.742 5.424 -2.130 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -4.643 4.858 -0.850 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -6.400 4.875 -0.570 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.892 7.580 -1.922 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.585 7.132 -0.345 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.622 8.621 -0.504 1.00 0.00 H new ATOM 822 N ARG A 52 -2.848 6.676 1.470 1.00 0.00 N ATOM 823 CA ARG A 52 -1.586 6.015 1.783 1.00 0.00 C ATOM 824 C ARG A 52 -1.657 5.351 3.159 1.00 0.00 C ATOM 825 O ARG A 52 -1.358 4.165 3.301 1.00 0.00 O ATOM 826 CB ARG A 52 -0.432 7.022 1.739 1.00 0.00 C ATOM 827 CG ARG A 52 -0.427 7.880 0.486 1.00 0.00 C ATOM 828 CD ARG A 52 0.823 8.738 0.391 1.00 0.00 C ATOM 829 NE ARG A 52 1.044 9.553 1.585 1.00 0.00 N ATOM 830 CZ ARG A 52 1.701 10.714 1.573 1.00 0.00 C ATOM 831 NH1 ARG A 52 2.085 11.255 0.422 1.00 0.00 N ATOM 832 NH2 ARG A 52 1.954 11.346 2.707 1.00 0.00 N ATOM 0 H ARG A 52 -2.776 7.687 1.356 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.405 5.244 1.034 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.491 7.670 2.614 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.513 6.483 1.805 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.495 7.239 -0.393 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -1.308 8.521 0.482 1.00 0.00 H new ATOM 0 HD2 ARG A 52 1.688 8.095 0.231 1.00 0.00 H new ATOM 0 HD3 ARG A 52 0.745 9.390 -0.479 1.00 0.00 H new ATOM 0 HE ARG A 52 0.676 9.216 2.475 1.00 0.00 H new ATOM 0 HH11 ARG A 52 1.878 10.783 -0.458 1.00 0.00 H new ATOM 0 HH12 ARG A 52 2.587 12.143 0.418 1.00 0.00 H new ATOM 0 HH21 ARG A 52 1.647 10.946 3.593 1.00 0.00 H new ATOM 0 HH22 ARG A 52 2.457 12.234 2.695 1.00 0.00 H new ATOM 846 N GLU A 53 -2.079 6.115 4.162 1.00 0.00 N ATOM 847 CA GLU A 53 -2.217 5.595 5.519 1.00 0.00 C ATOM 848 C GLU A 53 -3.330 4.562 5.578 1.00 0.00 C ATOM 849 O GLU A 53 -3.257 3.594 6.336 1.00 0.00 O ATOM 850 CB GLU A 53 -2.518 6.715 6.524 1.00 0.00 C ATOM 851 CG GLU A 53 -1.394 7.722 6.712 1.00 0.00 C ATOM 852 CD GLU A 53 -1.150 8.570 5.485 1.00 0.00 C ATOM 853 OE1 GLU A 53 -1.964 9.470 5.212 1.00 0.00 O ATOM 854 OE2 GLU A 53 -0.147 8.330 4.785 1.00 0.00 O ATOM 0 H GLU A 53 -2.332 7.098 4.061 1.00 0.00 H new ATOM 0 HA GLU A 53 -1.267 5.132 5.788 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -3.412 7.246 6.198 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -2.749 6.265 7.490 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.633 8.371 7.554 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -0.477 7.191 6.968 1.00 0.00 H new ATOM 861 N PHE A 54 -4.358 4.781 4.769 1.00 0.00 N ATOM 862 CA PHE A 54 -5.495 3.876 4.702 1.00 0.00 C ATOM 863 C PHE A 54 -5.052 2.498 4.218 1.00 0.00 C ATOM 864 O PHE A 54 -5.295 1.490 4.878 1.00 0.00 O ATOM 865 CB PHE A 54 -6.566 4.458 3.774 1.00 0.00 C ATOM 866 CG PHE A 54 -7.831 3.652 3.709 1.00 0.00 C ATOM 867 CD1 PHE A 54 -8.676 3.580 4.802 1.00 0.00 C ATOM 868 CD2 PHE A 54 -8.181 2.979 2.550 1.00 0.00 C ATOM 869 CE1 PHE A 54 -9.845 2.849 4.741 1.00 0.00 C ATOM 870 CE2 PHE A 54 -9.348 2.246 2.486 1.00 0.00 C ATOM 871 CZ PHE A 54 -10.181 2.181 3.583 1.00 0.00 C ATOM 0 H PHE A 54 -4.426 5.585 4.145 1.00 0.00 H new ATOM 0 HA PHE A 54 -5.919 3.763 5.700 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -6.809 5.467 4.106 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -6.152 4.544 2.769 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -8.418 4.101 5.712 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -7.533 3.029 1.687 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -10.497 2.800 5.601 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -9.609 1.724 1.578 1.00 0.00 H new ATOM 0 HZ PHE A 54 -11.095 1.608 3.535 1.00 0.00 H new ATOM 881 N VAL A 55 -4.376 2.468 3.075 1.00 0.00 N ATOM 882 CA VAL A 55 -3.863 1.222 2.519 1.00 0.00 C ATOM 883 C VAL A 55 -2.819 0.607 3.448 1.00 0.00 C ATOM 884 O VAL A 55 -2.737 -0.616 3.584 1.00 0.00 O ATOM 885 CB VAL A 55 -3.245 1.437 1.119 1.00 0.00 C ATOM 886 CG1 VAL A 55 -2.672 0.139 0.570 1.00 0.00 C ATOM 887 CG2 VAL A 55 -4.284 2.001 0.163 1.00 0.00 C ATOM 0 H VAL A 55 -4.170 3.295 2.514 1.00 0.00 H new ATOM 0 HA VAL A 55 -4.708 0.540 2.422 1.00 0.00 H new ATOM 0 HB VAL A 55 -2.430 2.154 1.216 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -2.244 0.319 -0.416 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -1.896 -0.229 1.241 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -3.465 -0.604 0.491 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.834 2.147 -0.819 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -5.118 1.304 0.080 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -4.646 2.957 0.542 1.00 0.00 H new ATOM 897 N ARG A 56 -2.035 1.460 4.098 1.00 0.00 N ATOM 898 CA ARG A 56 -1.029 1.003 5.046 1.00 0.00 C ATOM 899 C ARG A 56 -1.689 0.266 6.208 1.00 0.00 C ATOM 900 O ARG A 56 -1.214 -0.784 6.634 1.00 0.00 O ATOM 901 CB ARG A 56 -0.200 2.183 5.562 1.00 0.00 C ATOM 902 CG ARG A 56 0.872 1.778 6.560 1.00 0.00 C ATOM 903 CD ARG A 56 1.808 2.933 6.894 1.00 0.00 C ATOM 904 NE ARG A 56 1.086 4.131 7.321 1.00 0.00 N ATOM 905 CZ ARG A 56 0.486 4.268 8.505 1.00 0.00 C ATOM 906 NH1 ARG A 56 0.545 3.296 9.407 1.00 0.00 N ATOM 907 NH2 ARG A 56 -0.157 5.391 8.791 1.00 0.00 N ATOM 0 H ARG A 56 -2.078 2.473 3.985 1.00 0.00 H new ATOM 0 HA ARG A 56 -0.360 0.312 4.532 1.00 0.00 H new ATOM 0 HB2 ARG A 56 0.272 2.683 4.716 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -0.866 2.908 6.030 1.00 0.00 H new ATOM 0 HG2 ARG A 56 0.399 1.419 7.474 1.00 0.00 H new ATOM 0 HG3 ARG A 56 1.451 0.949 6.154 1.00 0.00 H new ATOM 0 HD2 ARG A 56 2.494 2.625 7.683 1.00 0.00 H new ATOM 0 HD3 ARG A 56 2.414 3.170 6.020 1.00 0.00 H new ATOM 0 HE ARG A 56 1.038 4.915 6.670 1.00 0.00 H new ATOM 0 HH11 ARG A 56 1.052 2.436 9.198 1.00 0.00 H new ATOM 0 HH12 ARG A 56 0.083 3.409 10.310 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -0.192 6.147 8.107 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -0.617 5.499 9.695 1.00 0.00 H new ATOM 921 N ALA A 57 -2.799 0.804 6.696 1.00 0.00 N ATOM 922 CA ALA A 57 -3.532 0.183 7.795 1.00 0.00 C ATOM 923 C ALA A 57 -4.111 -1.160 7.365 1.00 0.00 C ATOM 924 O ALA A 57 -4.174 -2.100 8.154 1.00 0.00 O ATOM 925 CB ALA A 57 -4.640 1.104 8.288 1.00 0.00 C ATOM 0 H ALA A 57 -3.213 1.669 6.349 1.00 0.00 H new ATOM 0 HA ALA A 57 -2.834 0.011 8.615 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -5.175 0.624 9.107 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -4.206 2.041 8.638 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -5.333 1.308 7.472 1.00 0.00 H new ATOM 931 N VAL A 58 -4.524 -1.239 6.107 1.00 0.00 N ATOM 932 CA VAL A 58 -5.075 -2.469 5.558 1.00 0.00 C ATOM 933 C VAL A 58 -3.985 -3.526 5.384 1.00 0.00 C ATOM 934 O VAL A 58 -4.159 -4.684 5.768 1.00 0.00 O ATOM 935 CB VAL A 58 -5.770 -2.220 4.199 1.00 0.00 C ATOM 936 CG1 VAL A 58 -6.331 -3.513 3.627 1.00 0.00 C ATOM 937 CG2 VAL A 58 -6.873 -1.181 4.339 1.00 0.00 C ATOM 0 H VAL A 58 -4.487 -0.463 5.446 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.817 -2.832 6.269 1.00 0.00 H new ATOM 0 HB VAL A 58 -5.020 -1.838 3.507 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -6.814 -3.309 2.671 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.521 -4.227 3.479 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -7.061 -3.931 4.320 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.348 -1.022 3.371 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -7.616 -1.533 5.054 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.446 -0.242 4.692 1.00 0.00 H new ATOM 947 N ALA A 59 -2.857 -3.120 4.818 1.00 0.00 N ATOM 948 CA ALA A 59 -1.765 -4.046 4.533 1.00 0.00 C ATOM 949 C ALA A 59 -1.041 -4.476 5.805 1.00 0.00 C ATOM 950 O ALA A 59 -0.575 -5.607 5.909 1.00 0.00 O ATOM 951 CB ALA A 59 -0.786 -3.415 3.555 1.00 0.00 C ATOM 0 H ALA A 59 -2.672 -2.154 4.546 1.00 0.00 H new ATOM 0 HA ALA A 59 -2.197 -4.940 4.083 1.00 0.00 H new ATOM 0 HB1 ALA A 59 0.025 -4.114 3.349 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -1.303 -3.176 2.626 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -0.377 -2.502 3.988 1.00 0.00 H new ATOM 957 N LYS A 60 -0.957 -3.573 6.769 1.00 0.00 N ATOM 958 CA LYS A 60 -0.230 -3.841 8.004 1.00 0.00 C ATOM 959 C LYS A 60 -1.179 -4.216 9.138 1.00 0.00 C ATOM 960 O LYS A 60 -0.805 -4.159 10.313 1.00 0.00 O ATOM 961 CB LYS A 60 0.614 -2.628 8.400 1.00 0.00 C ATOM 962 CG LYS A 60 1.620 -2.220 7.332 1.00 0.00 C ATOM 963 CD LYS A 60 2.520 -1.086 7.801 1.00 0.00 C ATOM 964 CE LYS A 60 3.419 -1.534 8.937 1.00 0.00 C ATOM 965 NZ LYS A 60 4.354 -0.465 9.375 1.00 0.00 N ATOM 0 H LYS A 60 -1.383 -2.647 6.722 1.00 0.00 H new ATOM 0 HA LYS A 60 0.430 -4.689 7.824 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -0.047 -1.786 8.607 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.146 -2.851 9.325 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.232 -3.081 7.062 1.00 0.00 H new ATOM 0 HG3 LYS A 60 1.088 -1.912 6.432 1.00 0.00 H new ATOM 0 HD2 LYS A 60 3.129 -0.734 6.969 1.00 0.00 H new ATOM 0 HD3 LYS A 60 1.909 -0.244 8.127 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.805 -1.844 9.782 1.00 0.00 H new ATOM 0 HE3 LYS A 60 3.991 -2.407 8.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 4.851 -0.770 10.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 5.048 -0.281 8.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.819 0.404 9.573 1.00 0.00 H new ATOM 979 N SER A 61 -2.407 -4.585 8.786 1.00 0.00 N ATOM 980 CA SER A 61 -3.390 -5.020 9.771 1.00 0.00 C ATOM 981 C SER A 61 -2.954 -6.343 10.402 1.00 0.00 C ATOM 982 O SER A 61 -2.002 -6.970 9.941 1.00 0.00 O ATOM 983 CB SER A 61 -4.772 -5.157 9.119 1.00 0.00 C ATOM 984 OG SER A 61 -4.745 -6.063 8.027 1.00 0.00 O ATOM 0 H SER A 61 -2.745 -4.591 7.824 1.00 0.00 H new ATOM 0 HA SER A 61 -3.457 -4.269 10.558 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.493 -5.501 9.861 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.111 -4.180 8.774 1.00 0.00 H new ATOM 0 HG SER A 61 -4.567 -5.571 7.198 1.00 0.00 H new ATOM 990 N GLU A 62 -3.642 -6.771 11.453 1.00 0.00 N ATOM 991 CA GLU A 62 -3.244 -7.971 12.182 1.00 0.00 C ATOM 992 C GLU A 62 -3.700 -9.245 11.467 1.00 0.00 C ATOM 993 O GLU A 62 -4.497 -9.184 10.529 1.00 0.00 O ATOM 994 CB GLU A 62 -3.780 -7.930 13.615 1.00 0.00 C ATOM 995 CG GLU A 62 -5.287 -7.768 13.715 1.00 0.00 C ATOM 996 CD GLU A 62 -5.749 -7.629 15.148 1.00 0.00 C ATOM 997 OE1 GLU A 62 -5.870 -8.663 15.842 1.00 0.00 O ATOM 998 OE2 GLU A 62 -5.980 -6.486 15.596 1.00 0.00 O ATOM 0 H GLU A 62 -4.474 -6.309 11.819 1.00 0.00 H new ATOM 0 HA GLU A 62 -2.155 -7.991 12.218 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -3.491 -8.849 14.125 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -3.302 -7.107 14.146 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.595 -6.890 13.148 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.775 -8.629 13.259 1.00 0.00 H new ATOM 1005 N LEU A 63 -3.168 -10.389 11.925 1.00 0.00 N ATOM 1006 CA LEU A 63 -3.439 -11.706 11.328 1.00 0.00 C ATOM 1007 C LEU A 63 -2.741 -11.855 9.979 1.00 0.00 C ATOM 1008 O LEU A 63 -2.122 -10.907 9.488 1.00 0.00 O ATOM 1009 CB LEU A 63 -4.947 -11.950 11.168 1.00 0.00 C ATOM 1010 CG LEU A 63 -5.746 -11.981 12.470 1.00 0.00 C ATOM 1011 CD1 LEU A 63 -7.227 -12.160 12.179 1.00 0.00 C ATOM 1012 CD2 LEU A 63 -5.244 -13.094 13.374 1.00 0.00 C ATOM 0 H LEU A 63 -2.535 -10.426 12.724 1.00 0.00 H new ATOM 0 HA LEU A 63 -3.040 -12.456 12.011 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.358 -11.170 10.527 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.092 -12.898 10.650 1.00 0.00 H new ATOM 0 HG LEU A 63 -5.607 -11.030 12.984 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -7.782 -12.180 13.117 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -7.580 -11.331 11.566 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -7.382 -13.098 11.645 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -5.824 -13.102 14.297 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -5.355 -14.053 12.867 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.192 -12.927 13.607 1.00 0.00 H new ATOM 1024 N TYR A 64 -2.816 -13.065 9.412 1.00 0.00 N ATOM 1025 CA TYR A 64 -2.304 -13.345 8.067 1.00 0.00 C ATOM 1026 C TYR A 64 -0.815 -12.988 7.959 1.00 0.00 C ATOM 1027 O TYR A 64 -0.448 -12.030 7.279 1.00 0.00 O ATOM 1028 CB TYR A 64 -3.135 -12.553 7.043 1.00 0.00 C ATOM 1029 CG TYR A 64 -3.084 -13.073 5.623 1.00 0.00 C ATOM 1030 CD1 TYR A 64 -3.831 -14.180 5.247 1.00 0.00 C ATOM 1031 CD2 TYR A 64 -2.309 -12.444 4.656 1.00 0.00 C ATOM 1032 CE1 TYR A 64 -3.807 -14.649 3.947 1.00 0.00 C ATOM 1033 CE2 TYR A 64 -2.283 -12.906 3.353 1.00 0.00 C ATOM 1034 CZ TYR A 64 -3.032 -14.010 3.007 1.00 0.00 C ATOM 1035 OH TYR A 64 -3.018 -14.469 1.708 1.00 0.00 O ATOM 0 H TYR A 64 -3.232 -13.875 9.872 1.00 0.00 H new ATOM 0 HA TYR A 64 -2.396 -14.411 7.861 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -4.174 -12.546 7.372 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -2.793 -11.518 7.045 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -4.441 -14.684 5.982 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -1.718 -11.581 4.926 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -4.394 -15.513 3.671 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -1.679 -12.405 2.611 1.00 0.00 H new ATOM 0 HH TYR A 64 -2.422 -13.908 1.169 1.00 0.00 H new ATOM 1045 N LYS A 65 0.046 -13.751 8.648 1.00 0.00 N ATOM 1046 CA LYS A 65 1.490 -13.487 8.624 1.00 0.00 C ATOM 1047 C LYS A 65 2.315 -14.756 8.824 1.00 0.00 C ATOM 1048 O LYS A 65 1.763 -15.840 9.023 1.00 0.00 O ATOM 1049 CB LYS A 65 1.876 -12.466 9.693 1.00 0.00 C ATOM 1050 CG LYS A 65 1.283 -11.098 9.453 1.00 0.00 C ATOM 1051 CD LYS A 65 1.776 -10.075 10.449 1.00 0.00 C ATOM 1052 CE LYS A 65 1.033 -8.772 10.261 1.00 0.00 C ATOM 1053 NZ LYS A 65 -0.417 -8.941 10.514 1.00 0.00 N ATOM 0 H LYS A 65 -0.229 -14.547 9.223 1.00 0.00 H new ATOM 0 HA LYS A 65 1.713 -13.087 7.635 1.00 0.00 H new ATOM 0 HB2 LYS A 65 1.550 -12.830 10.668 1.00 0.00 H new ATOM 0 HB3 LYS A 65 2.962 -12.382 9.731 1.00 0.00 H new ATOM 0 HG2 LYS A 65 1.532 -10.769 8.444 1.00 0.00 H new ATOM 0 HG3 LYS A 65 0.196 -11.161 9.508 1.00 0.00 H new ATOM 0 HD2 LYS A 65 1.630 -10.444 11.464 1.00 0.00 H new ATOM 0 HD3 LYS A 65 2.846 -9.915 10.319 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.437 -8.019 10.937 1.00 0.00 H new ATOM 0 HE3 LYS A 65 1.188 -8.405 9.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -0.883 -8.012 10.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -0.829 -9.551 9.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.558 -9.379 11.446 1.00 0.00 H new ATOM 1185 N PHE A 73 7.017 -20.535 3.021 1.00 0.00 N ATOM 1186 CA PHE A 73 7.773 -19.751 2.037 1.00 0.00 C ATOM 1187 C PHE A 73 7.808 -18.261 2.387 1.00 0.00 C ATOM 1188 O PHE A 73 6.828 -17.537 2.199 1.00 0.00 O ATOM 1189 CB PHE A 73 7.218 -19.944 0.620 1.00 0.00 C ATOM 1190 CG PHE A 73 7.341 -21.350 0.107 1.00 0.00 C ATOM 1191 CD1 PHE A 73 8.538 -21.806 -0.415 1.00 0.00 C ATOM 1192 CD2 PHE A 73 6.258 -22.213 0.149 1.00 0.00 C ATOM 1193 CE1 PHE A 73 8.655 -23.097 -0.886 1.00 0.00 C ATOM 1194 CE2 PHE A 73 6.369 -23.506 -0.322 1.00 0.00 C ATOM 1195 CZ PHE A 73 7.569 -23.948 -0.840 1.00 0.00 C ATOM 0 HA PHE A 73 8.796 -20.126 2.067 1.00 0.00 H new ATOM 0 HB2 PHE A 73 6.167 -19.654 0.609 1.00 0.00 H new ATOM 0 HB3 PHE A 73 7.742 -19.272 -0.060 1.00 0.00 H new ATOM 0 HD1 PHE A 73 9.390 -21.144 -0.454 1.00 0.00 H new ATOM 0 HD2 PHE A 73 5.317 -21.871 0.554 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.595 -23.442 -1.290 1.00 0.00 H new ATOM 0 HE2 PHE A 73 5.518 -24.170 -0.285 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.659 -24.959 -1.209 1.00 0.00 H new ATOM 1205 N GLN A 74 8.950 -17.807 2.891 1.00 0.00 N ATOM 1206 CA GLN A 74 9.158 -16.393 3.192 1.00 0.00 C ATOM 1207 C GLN A 74 9.108 -15.552 1.923 1.00 0.00 C ATOM 1208 O GLN A 74 8.544 -14.460 1.914 1.00 0.00 O ATOM 1209 CB GLN A 74 10.502 -16.178 3.892 1.00 0.00 C ATOM 1210 CG GLN A 74 10.424 -16.223 5.409 1.00 0.00 C ATOM 1211 CD GLN A 74 9.492 -15.162 5.965 1.00 0.00 C ATOM 1212 OE1 GLN A 74 9.285 -14.118 5.353 1.00 0.00 O ATOM 1213 NE2 GLN A 74 8.950 -15.404 7.143 1.00 0.00 N ATOM 0 H GLN A 74 9.752 -18.401 3.101 1.00 0.00 H new ATOM 0 HA GLN A 74 8.354 -16.078 3.857 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.203 -16.940 3.552 1.00 0.00 H new ATOM 0 HB3 GLN A 74 10.908 -15.213 3.588 1.00 0.00 H new ATOM 0 HG2 GLN A 74 10.080 -17.208 5.725 1.00 0.00 H new ATOM 0 HG3 GLN A 74 11.421 -16.084 5.827 1.00 0.00 H new ATOM 0 HE21 GLN A 74 9.144 -16.283 7.623 1.00 0.00 H new ATOM 0 HE22 GLN A 74 8.337 -14.712 7.574 1.00 0.00 H new ATOM 1222 N THR A 75 9.686 -16.076 0.850 1.00 0.00 N ATOM 1223 CA THR A 75 9.721 -15.384 -0.430 1.00 0.00 C ATOM 1224 C THR A 75 8.313 -15.029 -0.912 1.00 0.00 C ATOM 1225 O THR A 75 8.099 -13.994 -1.548 1.00 0.00 O ATOM 1226 CB THR A 75 10.413 -16.260 -1.489 1.00 0.00 C ATOM 1227 OG1 THR A 75 11.665 -16.738 -0.977 1.00 0.00 O ATOM 1228 CG2 THR A 75 10.651 -15.480 -2.772 1.00 0.00 C ATOM 0 H THR A 75 10.142 -16.989 0.843 1.00 0.00 H new ATOM 0 HA THR A 75 10.283 -14.461 -0.289 1.00 0.00 H new ATOM 0 HB THR A 75 9.761 -17.103 -1.715 1.00 0.00 H new ATOM 0 HG1 THR A 75 12.103 -17.297 -1.653 1.00 0.00 H new ATOM 0 HG21 THR A 75 11.141 -16.123 -3.503 1.00 0.00 H new ATOM 0 HG22 THR A 75 9.697 -15.138 -3.172 1.00 0.00 H new ATOM 0 HG23 THR A 75 11.286 -14.619 -2.562 1.00 0.00 H new ATOM 1236 N ARG A 76 7.351 -15.877 -0.569 1.00 0.00 N ATOM 1237 CA ARG A 76 5.980 -15.705 -1.024 1.00 0.00 C ATOM 1238 C ARG A 76 5.349 -14.468 -0.386 1.00 0.00 C ATOM 1239 O ARG A 76 4.428 -13.877 -0.946 1.00 0.00 O ATOM 1240 CB ARG A 76 5.169 -16.961 -0.698 1.00 0.00 C ATOM 1241 CG ARG A 76 3.846 -17.072 -1.445 1.00 0.00 C ATOM 1242 CD ARG A 76 4.030 -16.976 -2.957 1.00 0.00 C ATOM 1243 NE ARG A 76 5.243 -17.658 -3.426 1.00 0.00 N ATOM 1244 CZ ARG A 76 5.321 -18.956 -3.730 1.00 0.00 C ATOM 1245 NH1 ARG A 76 4.257 -19.742 -3.620 1.00 0.00 N ATOM 1246 NH2 ARG A 76 6.474 -19.466 -4.146 1.00 0.00 N ATOM 0 H ARG A 76 7.498 -16.693 0.025 1.00 0.00 H new ATOM 0 HA ARG A 76 5.981 -15.557 -2.104 1.00 0.00 H new ATOM 0 HB2 ARG A 76 5.775 -17.838 -0.926 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.969 -16.981 0.373 1.00 0.00 H new ATOM 0 HG2 ARG A 76 3.369 -18.021 -1.198 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.174 -16.281 -1.111 1.00 0.00 H new ATOM 0 HD2 ARG A 76 3.161 -17.408 -3.453 1.00 0.00 H new ATOM 0 HD3 ARG A 76 4.073 -15.926 -3.247 1.00 0.00 H new ATOM 0 HE ARG A 76 6.090 -17.098 -3.527 1.00 0.00 H new ATOM 0 HH11 ARG A 76 3.369 -19.356 -3.301 1.00 0.00 H new ATOM 0 HH12 ARG A 76 4.328 -20.732 -3.855 1.00 0.00 H new ATOM 0 HH21 ARG A 76 7.295 -18.867 -4.232 1.00 0.00 H new ATOM 0 HH22 ARG A 76 6.539 -20.457 -4.379 1.00 0.00 H new ATOM 1260 N VAL A 77 5.865 -14.076 0.778 1.00 0.00 N ATOM 1261 CA VAL A 77 5.402 -12.869 1.461 1.00 0.00 C ATOM 1262 C VAL A 77 5.667 -11.648 0.587 1.00 0.00 C ATOM 1263 O VAL A 77 4.765 -10.866 0.297 1.00 0.00 O ATOM 1264 CB VAL A 77 6.118 -12.675 2.819 1.00 0.00 C ATOM 1265 CG1 VAL A 77 5.678 -11.387 3.497 1.00 0.00 C ATOM 1266 CG2 VAL A 77 5.878 -13.863 3.734 1.00 0.00 C ATOM 0 H VAL A 77 6.605 -14.578 1.269 1.00 0.00 H new ATOM 0 HA VAL A 77 4.333 -12.982 1.643 1.00 0.00 H new ATOM 0 HB VAL A 77 7.187 -12.604 2.618 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.199 -11.280 4.448 1.00 0.00 H new ATOM 0 HG12 VAL A 77 5.916 -10.538 2.856 1.00 0.00 H new ATOM 0 HG13 VAL A 77 4.603 -11.418 3.674 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.392 -13.702 4.682 1.00 0.00 H new ATOM 0 HG22 VAL A 77 4.809 -13.973 3.915 1.00 0.00 H new ATOM 0 HG23 VAL A 77 6.261 -14.768 3.263 1.00 0.00 H new ATOM 1276 N ILE A 78 6.915 -11.529 0.153 1.00 0.00 N ATOM 1277 CA ILE A 78 7.358 -10.424 -0.688 1.00 0.00 C ATOM 1278 C ILE A 78 6.522 -10.343 -1.962 1.00 0.00 C ATOM 1279 O ILE A 78 6.065 -9.269 -2.359 1.00 0.00 O ATOM 1280 CB ILE A 78 8.838 -10.607 -1.080 1.00 0.00 C ATOM 1281 CG1 ILE A 78 9.691 -10.850 0.165 1.00 0.00 C ATOM 1282 CG2 ILE A 78 9.342 -9.387 -1.840 1.00 0.00 C ATOM 1283 CD1 ILE A 78 11.100 -11.303 -0.148 1.00 0.00 C ATOM 0 H ILE A 78 7.652 -12.199 0.375 1.00 0.00 H new ATOM 0 HA ILE A 78 7.237 -9.504 -0.116 1.00 0.00 H new ATOM 0 HB ILE A 78 8.919 -11.477 -1.732 1.00 0.00 H new ATOM 0 HG12 ILE A 78 9.735 -9.932 0.751 1.00 0.00 H new ATOM 0 HG13 ILE A 78 9.206 -11.602 0.787 1.00 0.00 H new ATOM 0 HG21 ILE A 78 10.388 -9.533 -2.109 1.00 0.00 H new ATOM 0 HG22 ILE A 78 8.750 -9.252 -2.745 1.00 0.00 H new ATOM 0 HG23 ILE A 78 9.249 -8.502 -1.210 1.00 0.00 H new ATOM 0 HD11 ILE A 78 11.648 -11.456 0.782 1.00 0.00 H new ATOM 0 HD12 ILE A 78 11.066 -12.238 -0.707 1.00 0.00 H new ATOM 0 HD13 ILE A 78 11.603 -10.542 -0.744 1.00 0.00 H new ATOM 1295 N GLU A 79 6.321 -11.497 -2.585 1.00 0.00 N ATOM 1296 CA GLU A 79 5.582 -11.582 -3.836 1.00 0.00 C ATOM 1297 C GLU A 79 4.137 -11.117 -3.656 1.00 0.00 C ATOM 1298 O GLU A 79 3.606 -10.377 -4.484 1.00 0.00 O ATOM 1299 CB GLU A 79 5.620 -13.017 -4.363 1.00 0.00 C ATOM 1300 CG GLU A 79 7.033 -13.547 -4.572 1.00 0.00 C ATOM 1301 CD GLU A 79 7.055 -14.952 -5.133 1.00 0.00 C ATOM 1302 OE1 GLU A 79 7.012 -15.098 -6.375 1.00 0.00 O ATOM 1303 OE2 GLU A 79 7.107 -15.919 -4.342 1.00 0.00 O ATOM 0 H GLU A 79 6.663 -12.394 -2.240 1.00 0.00 H new ATOM 0 HA GLU A 79 6.056 -10.921 -4.562 1.00 0.00 H new ATOM 0 HB2 GLU A 79 5.096 -13.667 -3.663 1.00 0.00 H new ATOM 0 HB3 GLU A 79 5.079 -13.064 -5.308 1.00 0.00 H new ATOM 0 HG2 GLU A 79 7.569 -12.882 -5.249 1.00 0.00 H new ATOM 0 HG3 GLU A 79 7.566 -13.532 -3.621 1.00 0.00 H new ATOM 1310 N LEU A 80 3.512 -11.534 -2.562 1.00 0.00 N ATOM 1311 CA LEU A 80 2.128 -11.165 -2.295 1.00 0.00 C ATOM 1312 C LEU A 80 2.009 -9.686 -1.942 1.00 0.00 C ATOM 1313 O LEU A 80 1.050 -9.023 -2.345 1.00 0.00 O ATOM 1314 CB LEU A 80 1.536 -12.023 -1.176 1.00 0.00 C ATOM 1315 CG LEU A 80 1.385 -13.507 -1.507 1.00 0.00 C ATOM 1316 CD1 LEU A 80 0.760 -14.247 -0.339 1.00 0.00 C ATOM 1317 CD2 LEU A 80 0.553 -13.696 -2.768 1.00 0.00 C ATOM 0 H LEU A 80 3.939 -12.125 -1.849 1.00 0.00 H new ATOM 0 HA LEU A 80 1.561 -11.347 -3.208 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.167 -11.926 -0.293 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.556 -11.624 -0.913 1.00 0.00 H new ATOM 0 HG LEU A 80 2.376 -13.922 -1.689 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.659 -15.303 -0.590 1.00 0.00 H new ATOM 0 HD12 LEU A 80 1.396 -14.142 0.540 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.224 -13.828 -0.128 1.00 0.00 H new ATOM 0 HD21 LEU A 80 0.458 -14.760 -2.985 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -0.438 -13.267 -2.618 1.00 0.00 H new ATOM 0 HD23 LEU A 80 1.042 -13.197 -3.605 1.00 0.00 H new ATOM 1329 N ASN A 81 2.982 -9.165 -1.201 1.00 0.00 N ATOM 1330 CA ASN A 81 2.978 -7.750 -0.838 1.00 0.00 C ATOM 1331 C ASN A 81 3.063 -6.879 -2.080 1.00 0.00 C ATOM 1332 O ASN A 81 2.344 -5.884 -2.201 1.00 0.00 O ATOM 1333 CB ASN A 81 4.121 -7.406 0.125 1.00 0.00 C ATOM 1334 CG ASN A 81 3.905 -7.987 1.508 1.00 0.00 C ATOM 1335 OD1 ASN A 81 2.773 -8.254 1.906 1.00 0.00 O ATOM 1336 ND2 ASN A 81 4.975 -8.139 2.270 1.00 0.00 N ATOM 0 H ASN A 81 3.777 -9.694 -0.842 1.00 0.00 H new ATOM 0 HA ASN A 81 2.037 -7.550 -0.325 1.00 0.00 H new ATOM 0 HB2 ASN A 81 5.060 -7.781 -0.281 1.00 0.00 H new ATOM 0 HB3 ASN A 81 4.216 -6.323 0.200 1.00 0.00 H new ATOM 0 HD21 ASN A 81 4.877 -8.489 3.223 1.00 0.00 H new ATOM 0 HD22 ASN A 81 5.899 -7.907 1.905 1.00 0.00 H new ATOM 1343 N TYR A 82 3.923 -7.265 -3.014 1.00 0.00 N ATOM 1344 CA TYR A 82 4.051 -6.543 -4.270 1.00 0.00 C ATOM 1345 C TYR A 82 2.761 -6.608 -5.078 1.00 0.00 C ATOM 1346 O TYR A 82 2.312 -5.597 -5.609 1.00 0.00 O ATOM 1347 CB TYR A 82 5.229 -7.072 -5.087 1.00 0.00 C ATOM 1348 CG TYR A 82 6.499 -6.292 -4.842 1.00 0.00 C ATOM 1349 CD1 TYR A 82 7.354 -6.615 -3.798 1.00 0.00 C ATOM 1350 CD2 TYR A 82 6.830 -5.213 -5.652 1.00 0.00 C ATOM 1351 CE1 TYR A 82 8.503 -5.885 -3.568 1.00 0.00 C ATOM 1352 CE2 TYR A 82 7.979 -4.480 -5.432 1.00 0.00 C ATOM 1353 CZ TYR A 82 8.812 -4.819 -4.388 1.00 0.00 C ATOM 1354 OH TYR A 82 9.954 -4.084 -4.161 1.00 0.00 O ATOM 0 H TYR A 82 4.540 -8.072 -2.924 1.00 0.00 H new ATOM 0 HA TYR A 82 4.245 -5.497 -4.032 1.00 0.00 H new ATOM 0 HB2 TYR A 82 5.397 -8.120 -4.840 1.00 0.00 H new ATOM 0 HB3 TYR A 82 4.980 -7.030 -6.147 1.00 0.00 H new ATOM 0 HD1 TYR A 82 7.117 -7.450 -3.156 1.00 0.00 H new ATOM 0 HD2 TYR A 82 6.177 -4.943 -6.468 1.00 0.00 H new ATOM 0 HE1 TYR A 82 9.157 -6.147 -2.750 1.00 0.00 H new ATOM 0 HE2 TYR A 82 8.223 -3.646 -6.074 1.00 0.00 H new ATOM 0 HH TYR A 82 10.606 -4.633 -3.677 1.00 0.00 H new ATOM 1364 N LYS A 83 2.156 -7.789 -5.145 1.00 0.00 N ATOM 1365 CA LYS A 83 0.884 -7.962 -5.847 1.00 0.00 C ATOM 1366 C LYS A 83 -0.225 -7.127 -5.207 1.00 0.00 C ATOM 1367 O LYS A 83 -1.132 -6.652 -5.889 1.00 0.00 O ATOM 1368 CB LYS A 83 0.462 -9.436 -5.852 1.00 0.00 C ATOM 1369 CG LYS A 83 1.295 -10.328 -6.756 1.00 0.00 C ATOM 1370 CD LYS A 83 0.770 -11.753 -6.740 1.00 0.00 C ATOM 1371 CE LYS A 83 1.549 -12.661 -7.676 1.00 0.00 C ATOM 1372 NZ LYS A 83 1.434 -12.238 -9.098 1.00 0.00 N ATOM 0 H LYS A 83 2.524 -8.642 -4.723 1.00 0.00 H new ATOM 0 HA LYS A 83 1.034 -7.622 -6.872 1.00 0.00 H new ATOM 0 HB2 LYS A 83 0.517 -9.820 -4.833 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -0.581 -9.501 -6.161 1.00 0.00 H new ATOM 0 HG2 LYS A 83 1.276 -9.940 -7.774 1.00 0.00 H new ATOM 0 HG3 LYS A 83 2.335 -10.315 -6.429 1.00 0.00 H new ATOM 0 HD2 LYS A 83 0.824 -12.147 -5.725 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -0.282 -11.754 -7.027 1.00 0.00 H new ATOM 0 HE2 LYS A 83 2.599 -12.665 -7.384 1.00 0.00 H new ATOM 0 HE3 LYS A 83 1.186 -13.683 -7.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 1.643 -13.046 -9.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 0.468 -11.901 -9.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 2.110 -11.471 -9.288 1.00 0.00 H new ATOM 1386 N HIS A 84 -0.143 -6.955 -3.898 1.00 0.00 N ATOM 1387 CA HIS A 84 -1.178 -6.254 -3.149 1.00 0.00 C ATOM 1388 C HIS A 84 -1.017 -4.738 -3.240 1.00 0.00 C ATOM 1389 O HIS A 84 -2.000 -4.006 -3.154 1.00 0.00 O ATOM 1390 CB HIS A 84 -1.155 -6.704 -1.683 1.00 0.00 C ATOM 1391 CG HIS A 84 -2.193 -6.045 -0.825 1.00 0.00 C ATOM 1392 ND1 HIS A 84 -1.884 -5.351 0.325 1.00 0.00 N ATOM 1393 CD2 HIS A 84 -3.542 -5.983 -0.949 1.00 0.00 C ATOM 1394 CE1 HIS A 84 -2.994 -4.889 0.872 1.00 0.00 C ATOM 1395 NE2 HIS A 84 -4.015 -5.259 0.119 1.00 0.00 N ATOM 0 H HIS A 84 0.633 -7.292 -3.328 1.00 0.00 H new ATOM 0 HA HIS A 84 -2.141 -6.507 -3.592 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -1.298 -7.784 -1.643 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -0.169 -6.497 -1.266 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -4.134 -6.421 -1.739 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -3.057 -4.308 1.780 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -4.995 -5.042 0.301 1.00 0.00 H new ATOM 1404 N LEU A 85 0.211 -4.269 -3.396 1.00 0.00 N ATOM 1405 CA LEU A 85 0.468 -2.833 -3.410 1.00 0.00 C ATOM 1406 C LEU A 85 0.659 -2.297 -4.828 1.00 0.00 C ATOM 1407 O LEU A 85 -0.019 -1.356 -5.237 1.00 0.00 O ATOM 1408 CB LEU A 85 1.698 -2.505 -2.555 1.00 0.00 C ATOM 1409 CG LEU A 85 1.580 -2.878 -1.073 1.00 0.00 C ATOM 1410 CD1 LEU A 85 2.868 -2.550 -0.333 1.00 0.00 C ATOM 1411 CD2 LEU A 85 0.400 -2.159 -0.435 1.00 0.00 C ATOM 0 H LEU A 85 1.039 -4.853 -3.514 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.409 -2.343 -2.988 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.561 -3.021 -2.976 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.898 -1.436 -2.630 1.00 0.00 H new ATOM 0 HG LEU A 85 1.409 -3.952 -1.002 1.00 0.00 H new ATOM 0 HD11 LEU A 85 2.764 -2.822 0.717 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.693 -3.110 -0.773 1.00 0.00 H new ATOM 0 HD13 LEU A 85 3.071 -1.482 -0.412 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.331 -2.435 0.617 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.542 -1.082 -0.519 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -0.520 -2.444 -0.946 1.00 0.00 H new ATOM 1423 N LEU A 86 1.574 -2.900 -5.579 1.00 0.00 N ATOM 1424 CA LEU A 86 1.932 -2.387 -6.899 1.00 0.00 C ATOM 1425 C LEU A 86 1.338 -3.244 -8.009 1.00 0.00 C ATOM 1426 O LEU A 86 1.109 -2.773 -9.123 1.00 0.00 O ATOM 1427 CB LEU A 86 3.455 -2.337 -7.051 1.00 0.00 C ATOM 1428 CG LEU A 86 4.181 -1.430 -6.056 1.00 0.00 C ATOM 1429 CD1 LEU A 86 5.686 -1.579 -6.204 1.00 0.00 C ATOM 1430 CD2 LEU A 86 3.773 0.021 -6.260 1.00 0.00 C ATOM 0 H LEU A 86 2.080 -3.740 -5.299 1.00 0.00 H new ATOM 0 HA LEU A 86 1.522 -1.381 -6.985 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.847 -3.349 -6.949 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.692 -2.004 -8.061 1.00 0.00 H new ATOM 0 HG LEU A 86 3.898 -1.731 -5.047 1.00 0.00 H new ATOM 0 HD11 LEU A 86 6.188 -0.927 -5.489 1.00 0.00 H new ATOM 0 HD12 LEU A 86 5.970 -2.614 -6.013 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.981 -1.303 -7.216 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.300 0.651 -5.543 1.00 0.00 H new ATOM 0 HD22 LEU A 86 4.029 0.332 -7.273 1.00 0.00 H new ATOM 0 HD23 LEU A 86 2.698 0.121 -6.110 1.00 0.00 H new ATOM 1442 N GLY A 87 1.107 -4.511 -7.701 1.00 0.00 N ATOM 1443 CA GLY A 87 0.598 -5.434 -8.693 1.00 0.00 C ATOM 1444 C GLY A 87 1.672 -5.844 -9.673 1.00 0.00 C ATOM 1445 O GLY A 87 1.381 -6.400 -10.732 1.00 0.00 O ATOM 0 H GLY A 87 1.264 -4.917 -6.779 1.00 0.00 H new ATOM 0 HA2 GLY A 87 0.200 -6.319 -8.197 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -0.229 -4.971 -9.231 1.00 0.00 H new ATOM 1449 N ARG A 88 2.916 -5.569 -9.310 1.00 0.00 N ATOM 1450 CA ARG A 88 4.054 -5.853 -10.166 1.00 0.00 C ATOM 1451 C ARG A 88 5.038 -6.756 -9.436 1.00 0.00 C ATOM 1452 O ARG A 88 5.359 -6.514 -8.274 1.00 0.00 O ATOM 1453 CB ARG A 88 4.729 -4.544 -10.599 1.00 0.00 C ATOM 1454 CG ARG A 88 5.981 -4.738 -11.440 1.00 0.00 C ATOM 1455 CD ARG A 88 6.450 -3.428 -12.058 1.00 0.00 C ATOM 1456 NE ARG A 88 6.795 -2.413 -11.055 1.00 0.00 N ATOM 1457 CZ ARG A 88 6.561 -1.106 -11.211 1.00 0.00 C ATOM 1458 NH1 ARG A 88 5.967 -0.663 -12.315 1.00 0.00 N ATOM 1459 NH2 ARG A 88 6.938 -0.242 -10.273 1.00 0.00 N ATOM 0 H ARG A 88 3.163 -5.144 -8.416 1.00 0.00 H new ATOM 0 HA ARG A 88 3.710 -6.371 -11.061 1.00 0.00 H new ATOM 0 HB2 ARG A 88 4.013 -3.949 -11.165 1.00 0.00 H new ATOM 0 HB3 ARG A 88 4.988 -3.970 -9.709 1.00 0.00 H new ATOM 0 HG2 ARG A 88 6.776 -5.153 -10.820 1.00 0.00 H new ATOM 0 HG3 ARG A 88 5.781 -5.462 -12.230 1.00 0.00 H new ATOM 0 HD2 ARG A 88 7.319 -3.620 -12.687 1.00 0.00 H new ATOM 0 HD3 ARG A 88 5.666 -3.038 -12.708 1.00 0.00 H new ATOM 0 HE ARG A 88 7.238 -2.723 -10.190 1.00 0.00 H new ATOM 0 HH11 ARG A 88 5.689 -1.321 -13.044 1.00 0.00 H new ATOM 0 HH12 ARG A 88 5.789 0.334 -12.433 1.00 0.00 H new ATOM 0 HH21 ARG A 88 7.407 -0.576 -9.431 1.00 0.00 H new ATOM 0 HH22 ARG A 88 6.758 0.754 -10.395 1.00 0.00 H new ATOM 1473 N ALA A 89 5.489 -7.799 -10.119 1.00 0.00 N ATOM 1474 CA ALA A 89 6.419 -8.766 -9.546 1.00 0.00 C ATOM 1475 C ALA A 89 7.741 -8.103 -9.151 1.00 0.00 C ATOM 1476 O ALA A 89 8.103 -7.057 -9.703 1.00 0.00 O ATOM 1477 CB ALA A 89 6.672 -9.892 -10.540 1.00 0.00 C ATOM 0 H ALA A 89 5.222 -8.000 -11.083 1.00 0.00 H new ATOM 0 HA ALA A 89 5.969 -9.176 -8.642 1.00 0.00 H new ATOM 0 HB1 ALA A 89 7.367 -10.611 -10.106 1.00 0.00 H new ATOM 0 HB2 ALA A 89 5.731 -10.391 -10.771 1.00 0.00 H new ATOM 0 HB3 ALA A 89 7.099 -9.481 -11.455 1.00 0.00 H new ATOM 1483 N PRO A 90 8.474 -8.702 -8.186 1.00 0.00 N ATOM 1484 CA PRO A 90 9.781 -8.204 -7.746 1.00 0.00 C ATOM 1485 C PRO A 90 10.722 -7.944 -8.920 1.00 0.00 C ATOM 1486 O PRO A 90 10.731 -8.692 -9.902 1.00 0.00 O ATOM 1487 CB PRO A 90 10.330 -9.326 -6.852 1.00 0.00 C ATOM 1488 CG PRO A 90 9.409 -10.487 -7.046 1.00 0.00 C ATOM 1489 CD PRO A 90 8.085 -9.907 -7.444 1.00 0.00 C ATOM 0 HA PRO A 90 9.694 -7.248 -7.229 1.00 0.00 H new ATOM 0 HB2 PRO A 90 11.351 -9.585 -7.132 1.00 0.00 H new ATOM 0 HB3 PRO A 90 10.355 -9.017 -5.807 1.00 0.00 H new ATOM 0 HG2 PRO A 90 9.787 -11.160 -7.816 1.00 0.00 H new ATOM 0 HG3 PRO A 90 9.319 -11.070 -6.130 1.00 0.00 H new ATOM 0 HD2 PRO A 90 7.510 -10.596 -8.063 1.00 0.00 H new ATOM 0 HD3 PRO A 90 7.470 -9.668 -6.577 1.00 0.00 H new ATOM 1497 N TYR A 91 11.519 -6.893 -8.801 1.00 0.00 N ATOM 1498 CA TYR A 91 12.323 -6.406 -9.916 1.00 0.00 C ATOM 1499 C TYR A 91 13.444 -7.373 -10.292 1.00 0.00 C ATOM 1500 O TYR A 91 13.795 -7.494 -11.465 1.00 0.00 O ATOM 1501 CB TYR A 91 12.905 -5.033 -9.580 1.00 0.00 C ATOM 1502 CG TYR A 91 11.849 -3.985 -9.286 1.00 0.00 C ATOM 1503 CD1 TYR A 91 11.101 -3.420 -10.313 1.00 0.00 C ATOM 1504 CD2 TYR A 91 11.596 -3.568 -7.984 1.00 0.00 C ATOM 1505 CE1 TYR A 91 10.134 -2.467 -10.051 1.00 0.00 C ATOM 1506 CE2 TYR A 91 10.629 -2.615 -7.715 1.00 0.00 C ATOM 1507 CZ TYR A 91 9.901 -2.069 -8.752 1.00 0.00 C ATOM 1508 OH TYR A 91 8.937 -1.118 -8.489 1.00 0.00 O ATOM 0 H TYR A 91 11.628 -6.357 -7.940 1.00 0.00 H new ATOM 0 HA TYR A 91 11.664 -6.325 -10.780 1.00 0.00 H new ATOM 0 HB2 TYR A 91 13.563 -5.127 -8.716 1.00 0.00 H new ATOM 0 HB3 TYR A 91 13.520 -4.694 -10.413 1.00 0.00 H new ATOM 0 HD1 TYR A 91 11.278 -3.731 -11.332 1.00 0.00 H new ATOM 0 HD2 TYR A 91 12.163 -3.994 -7.170 1.00 0.00 H new ATOM 0 HE1 TYR A 91 9.564 -2.036 -10.861 1.00 0.00 H new ATOM 0 HE2 TYR A 91 10.445 -2.300 -6.698 1.00 0.00 H new ATOM 0 HH TYR A 91 8.897 -0.950 -7.524 1.00 0.00 H new ATOM 1518 N ASP A 92 14.002 -8.060 -9.304 1.00 0.00 N ATOM 1519 CA ASP A 92 15.108 -8.985 -9.546 1.00 0.00 C ATOM 1520 C ASP A 92 15.183 -10.024 -8.434 1.00 0.00 C ATOM 1521 O ASP A 92 14.529 -9.881 -7.401 1.00 0.00 O ATOM 1522 CB ASP A 92 16.430 -8.207 -9.632 1.00 0.00 C ATOM 1523 CG ASP A 92 17.604 -9.070 -10.064 1.00 0.00 C ATOM 1524 OD1 ASP A 92 17.782 -9.259 -11.283 1.00 0.00 O ATOM 1525 OD2 ASP A 92 18.344 -9.568 -9.185 1.00 0.00 O ATOM 0 H ASP A 92 13.710 -7.997 -8.329 1.00 0.00 H new ATOM 0 HA ASP A 92 14.935 -9.500 -10.491 1.00 0.00 H new ATOM 0 HB2 ASP A 92 16.314 -7.383 -10.336 1.00 0.00 H new ATOM 0 HB3 ASP A 92 16.649 -7.767 -8.659 1.00 0.00 H new ATOM 1530 N GLU A 93 15.971 -11.071 -8.648 1.00 0.00 N ATOM 1531 CA GLU A 93 16.198 -12.076 -7.624 1.00 0.00 C ATOM 1532 C GLU A 93 16.899 -11.439 -6.428 1.00 0.00 C ATOM 1533 O GLU A 93 16.554 -11.705 -5.278 1.00 0.00 O ATOM 1534 CB GLU A 93 17.049 -13.217 -8.184 1.00 0.00 C ATOM 1535 CG GLU A 93 17.163 -14.412 -7.253 1.00 0.00 C ATOM 1536 CD GLU A 93 15.867 -15.185 -7.137 1.00 0.00 C ATOM 1537 OE1 GLU A 93 14.950 -14.723 -6.429 1.00 0.00 O ATOM 1538 OE2 GLU A 93 15.759 -16.264 -7.757 1.00 0.00 O ATOM 0 H GLU A 93 16.463 -11.244 -9.525 1.00 0.00 H new ATOM 0 HA GLU A 93 15.238 -12.482 -7.303 1.00 0.00 H new ATOM 0 HB2 GLU A 93 16.621 -13.546 -9.131 1.00 0.00 H new ATOM 0 HB3 GLU A 93 18.049 -12.840 -8.400 1.00 0.00 H new ATOM 0 HG2 GLU A 93 17.947 -15.077 -7.615 1.00 0.00 H new ATOM 0 HG3 GLU A 93 17.467 -14.070 -6.264 1.00 0.00 H new ATOM 1545 N SER A 94 17.865 -10.570 -6.718 1.00 0.00 N ATOM 1546 CA SER A 94 18.598 -9.850 -5.686 1.00 0.00 C ATOM 1547 C SER A 94 17.664 -8.900 -4.949 1.00 0.00 C ATOM 1548 O SER A 94 17.800 -8.678 -3.747 1.00 0.00 O ATOM 1549 CB SER A 94 19.743 -9.065 -6.321 1.00 0.00 C ATOM 1550 OG SER A 94 20.370 -9.828 -7.339 1.00 0.00 O ATOM 0 H SER A 94 18.158 -10.348 -7.669 1.00 0.00 H new ATOM 0 HA SER A 94 19.006 -10.566 -4.973 1.00 0.00 H new ATOM 0 HB2 SER A 94 19.363 -8.133 -6.740 1.00 0.00 H new ATOM 0 HB3 SER A 94 20.474 -8.797 -5.558 1.00 0.00 H new ATOM 0 HG SER A 94 19.867 -9.734 -8.175 1.00 0.00 H new ATOM 1556 N GLU A 95 16.710 -8.349 -5.693 1.00 0.00 N ATOM 1557 CA GLU A 95 15.678 -7.495 -5.130 1.00 0.00 C ATOM 1558 C GLU A 95 14.905 -8.276 -4.073 1.00 0.00 C ATOM 1559 O GLU A 95 14.639 -7.779 -2.979 1.00 0.00 O ATOM 1560 CB GLU A 95 14.753 -7.031 -6.255 1.00 0.00 C ATOM 1561 CG GLU A 95 14.312 -5.584 -6.152 1.00 0.00 C ATOM 1562 CD GLU A 95 13.408 -5.336 -4.972 1.00 0.00 C ATOM 1563 OE1 GLU A 95 12.290 -5.889 -4.956 1.00 0.00 O ATOM 1564 OE2 GLU A 95 13.813 -4.589 -4.057 1.00 0.00 O ATOM 0 H GLU A 95 16.633 -8.484 -6.701 1.00 0.00 H new ATOM 0 HA GLU A 95 16.120 -6.618 -4.657 1.00 0.00 H new ATOM 0 HB2 GLU A 95 15.261 -7.175 -7.208 1.00 0.00 H new ATOM 0 HB3 GLU A 95 13.868 -7.667 -6.266 1.00 0.00 H new ATOM 0 HG2 GLU A 95 15.191 -4.945 -6.072 1.00 0.00 H new ATOM 0 HG3 GLU A 95 13.794 -5.300 -7.068 1.00 0.00 H new ATOM 1571 N VAL A 96 14.577 -9.520 -4.406 1.00 0.00 N ATOM 1572 CA VAL A 96 13.924 -10.419 -3.465 1.00 0.00 C ATOM 1573 C VAL A 96 14.812 -10.666 -2.248 1.00 0.00 C ATOM 1574 O VAL A 96 14.340 -10.652 -1.113 1.00 0.00 O ATOM 1575 CB VAL A 96 13.578 -11.774 -4.123 1.00 0.00 C ATOM 1576 CG1 VAL A 96 12.914 -12.712 -3.125 1.00 0.00 C ATOM 1577 CG2 VAL A 96 12.681 -11.571 -5.333 1.00 0.00 C ATOM 0 H VAL A 96 14.754 -9.928 -5.324 1.00 0.00 H new ATOM 0 HA VAL A 96 12.999 -9.936 -3.150 1.00 0.00 H new ATOM 0 HB VAL A 96 14.510 -12.232 -4.454 1.00 0.00 H new ATOM 0 HG11 VAL A 96 12.681 -13.658 -3.614 1.00 0.00 H new ATOM 0 HG12 VAL A 96 13.590 -12.892 -2.290 1.00 0.00 H new ATOM 0 HG13 VAL A 96 11.994 -12.258 -2.756 1.00 0.00 H new ATOM 0 HG21 VAL A 96 12.450 -12.538 -5.781 1.00 0.00 H new ATOM 0 HG22 VAL A 96 11.756 -11.084 -5.023 1.00 0.00 H new ATOM 0 HG23 VAL A 96 13.193 -10.945 -6.064 1.00 0.00 H new ATOM 1587 N ILE A 97 16.103 -10.881 -2.494 1.00 0.00 N ATOM 1588 CA ILE A 97 17.070 -11.107 -1.422 1.00 0.00 C ATOM 1589 C ILE A 97 17.092 -9.918 -0.463 1.00 0.00 C ATOM 1590 O ILE A 97 17.119 -10.091 0.760 1.00 0.00 O ATOM 1591 CB ILE A 97 18.497 -11.340 -1.980 1.00 0.00 C ATOM 1592 CG1 ILE A 97 18.503 -12.499 -2.984 1.00 0.00 C ATOM 1593 CG2 ILE A 97 19.479 -11.614 -0.849 1.00 0.00 C ATOM 1594 CD1 ILE A 97 18.035 -13.818 -2.409 1.00 0.00 C ATOM 0 H ILE A 97 16.505 -10.903 -3.431 1.00 0.00 H new ATOM 0 HA ILE A 97 16.757 -12.004 -0.888 1.00 0.00 H new ATOM 0 HB ILE A 97 18.811 -10.433 -2.497 1.00 0.00 H new ATOM 0 HG12 ILE A 97 17.866 -12.237 -3.829 1.00 0.00 H new ATOM 0 HG13 ILE A 97 19.514 -12.623 -3.373 1.00 0.00 H new ATOM 0 HG21 ILE A 97 20.475 -11.775 -1.263 1.00 0.00 H new ATOM 0 HG22 ILE A 97 19.501 -10.760 -0.171 1.00 0.00 H new ATOM 0 HG23 ILE A 97 19.165 -12.503 -0.302 1.00 0.00 H new ATOM 0 HD11 ILE A 97 18.069 -14.585 -3.183 1.00 0.00 H new ATOM 0 HD12 ILE A 97 18.686 -14.106 -1.583 1.00 0.00 H new ATOM 0 HD13 ILE A 97 17.012 -13.714 -2.046 1.00 0.00 H new ATOM 1606 N PHE A 98 17.055 -8.717 -1.028 1.00 0.00 N ATOM 1607 CA PHE A 98 17.015 -7.493 -0.238 1.00 0.00 C ATOM 1608 C PHE A 98 15.790 -7.479 0.675 1.00 0.00 C ATOM 1609 O PHE A 98 15.882 -7.115 1.848 1.00 0.00 O ATOM 1610 CB PHE A 98 17.000 -6.269 -1.160 1.00 0.00 C ATOM 1611 CG PHE A 98 16.903 -4.956 -0.431 1.00 0.00 C ATOM 1612 CD1 PHE A 98 18.013 -4.411 0.189 1.00 0.00 C ATOM 1613 CD2 PHE A 98 15.700 -4.267 -0.374 1.00 0.00 C ATOM 1614 CE1 PHE A 98 17.929 -3.204 0.856 1.00 0.00 C ATOM 1615 CE2 PHE A 98 15.609 -3.060 0.292 1.00 0.00 C ATOM 1616 CZ PHE A 98 16.727 -2.527 0.906 1.00 0.00 C ATOM 0 H PHE A 98 17.052 -8.565 -2.037 1.00 0.00 H new ATOM 0 HA PHE A 98 17.909 -7.457 0.385 1.00 0.00 H new ATOM 0 HB2 PHE A 98 17.907 -6.271 -1.765 1.00 0.00 H new ATOM 0 HB3 PHE A 98 16.158 -6.355 -1.847 1.00 0.00 H new ATOM 0 HD1 PHE A 98 18.956 -4.935 0.151 1.00 0.00 H new ATOM 0 HD2 PHE A 98 14.825 -4.679 -0.855 1.00 0.00 H new ATOM 0 HE1 PHE A 98 18.803 -2.791 1.338 1.00 0.00 H new ATOM 0 HE2 PHE A 98 14.667 -2.534 0.333 1.00 0.00 H new ATOM 0 HZ PHE A 98 16.660 -1.582 1.424 1.00 0.00 H new ATOM 1626 N HIS A 99 14.649 -7.890 0.134 1.00 0.00 N ATOM 1627 CA HIS A 99 13.403 -7.926 0.902 1.00 0.00 C ATOM 1628 C HIS A 99 13.418 -9.047 1.935 1.00 0.00 C ATOM 1629 O HIS A 99 12.875 -8.892 3.026 1.00 0.00 O ATOM 1630 CB HIS A 99 12.193 -8.079 -0.014 1.00 0.00 C ATOM 1631 CG HIS A 99 11.814 -6.822 -0.734 1.00 0.00 C ATOM 1632 ND1 HIS A 99 10.807 -5.989 -0.310 1.00 0.00 N ATOM 1633 CD2 HIS A 99 12.307 -6.268 -1.860 1.00 0.00 C ATOM 1634 CE1 HIS A 99 10.692 -4.977 -1.149 1.00 0.00 C ATOM 1635 NE2 HIS A 99 11.593 -5.121 -2.104 1.00 0.00 N ATOM 0 H HIS A 99 14.557 -8.203 -0.832 1.00 0.00 H new ATOM 0 HA HIS A 99 13.324 -6.974 1.427 1.00 0.00 H new ATOM 0 HB2 HIS A 99 12.401 -8.858 -0.748 1.00 0.00 H new ATOM 0 HB3 HIS A 99 11.342 -8.418 0.577 1.00 0.00 H new ATOM 0 HD1 HIS A 99 10.237 -6.131 0.524 1.00 0.00 H new ATOM 0 HD2 HIS A 99 13.116 -6.656 -2.461 1.00 0.00 H new ATOM 0 HE1 HIS A 99 9.981 -4.168 -1.068 1.00 0.00 H new ATOM 1644 N LEU A 100 14.035 -10.173 1.589 1.00 0.00 N ATOM 1645 CA LEU A 100 14.200 -11.275 2.535 1.00 0.00 C ATOM 1646 C LEU A 100 14.963 -10.790 3.758 1.00 0.00 C ATOM 1647 O LEU A 100 14.550 -11.014 4.895 1.00 0.00 O ATOM 1648 CB LEU A 100 14.943 -12.449 1.884 1.00 0.00 C ATOM 1649 CG LEU A 100 14.152 -13.218 0.822 1.00 0.00 C ATOM 1650 CD1 LEU A 100 15.049 -14.225 0.120 1.00 0.00 C ATOM 1651 CD2 LEU A 100 12.963 -13.926 1.453 1.00 0.00 C ATOM 0 H LEU A 100 14.428 -10.347 0.664 1.00 0.00 H new ATOM 0 HA LEU A 100 13.212 -11.623 2.837 1.00 0.00 H new ATOM 0 HB2 LEU A 100 15.858 -12.070 1.428 1.00 0.00 H new ATOM 0 HB3 LEU A 100 15.242 -13.147 2.666 1.00 0.00 H new ATOM 0 HG LEU A 100 13.782 -12.505 0.085 1.00 0.00 H new ATOM 0 HD11 LEU A 100 14.472 -14.764 -0.632 1.00 0.00 H new ATOM 0 HD12 LEU A 100 15.875 -13.702 -0.362 1.00 0.00 H new ATOM 0 HD13 LEU A 100 15.443 -14.932 0.850 1.00 0.00 H new ATOM 0 HD21 LEU A 100 12.412 -14.468 0.684 1.00 0.00 H new ATOM 0 HD22 LEU A 100 13.316 -14.628 2.208 1.00 0.00 H new ATOM 0 HD23 LEU A 100 12.307 -13.191 1.919 1.00 0.00 H new ATOM 1663 N ASP A 101 16.064 -10.098 3.504 1.00 0.00 N ATOM 1664 CA ASP A 101 16.868 -9.510 4.565 1.00 0.00 C ATOM 1665 C ASP A 101 16.084 -8.425 5.298 1.00 0.00 C ATOM 1666 O ASP A 101 16.207 -8.270 6.511 1.00 0.00 O ATOM 1667 CB ASP A 101 18.152 -8.927 3.981 1.00 0.00 C ATOM 1668 CG ASP A 101 18.982 -8.204 5.017 1.00 0.00 C ATOM 1669 OD1 ASP A 101 19.717 -8.876 5.774 1.00 0.00 O ATOM 1670 OD2 ASP A 101 18.913 -6.961 5.071 1.00 0.00 O ATOM 0 H ASP A 101 16.423 -9.929 2.564 1.00 0.00 H new ATOM 0 HA ASP A 101 17.123 -10.291 5.281 1.00 0.00 H new ATOM 0 HB2 ASP A 101 18.744 -9.729 3.541 1.00 0.00 H new ATOM 0 HB3 ASP A 101 17.901 -8.237 3.175 1.00 0.00 H new ATOM 1675 N LEU A 102 15.267 -7.686 4.553 1.00 0.00 N ATOM 1676 CA LEU A 102 14.436 -6.633 5.126 1.00 0.00 C ATOM 1677 C LEU A 102 13.433 -7.224 6.112 1.00 0.00 C ATOM 1678 O LEU A 102 13.218 -6.680 7.196 1.00 0.00 O ATOM 1679 CB LEU A 102 13.703 -5.873 4.013 1.00 0.00 C ATOM 1680 CG LEU A 102 12.859 -4.679 4.467 1.00 0.00 C ATOM 1681 CD1 LEU A 102 13.736 -3.602 5.086 1.00 0.00 C ATOM 1682 CD2 LEU A 102 12.064 -4.115 3.298 1.00 0.00 C ATOM 0 H LEU A 102 15.163 -7.799 3.545 1.00 0.00 H new ATOM 0 HA LEU A 102 15.079 -5.935 5.663 1.00 0.00 H new ATOM 0 HB2 LEU A 102 14.441 -5.519 3.293 1.00 0.00 H new ATOM 0 HB3 LEU A 102 13.054 -6.573 3.487 1.00 0.00 H new ATOM 0 HG LEU A 102 12.159 -5.025 5.227 1.00 0.00 H new ATOM 0 HD11 LEU A 102 13.115 -2.764 5.401 1.00 0.00 H new ATOM 0 HD12 LEU A 102 14.259 -4.011 5.950 1.00 0.00 H new ATOM 0 HD13 LEU A 102 14.464 -3.258 4.351 1.00 0.00 H new ATOM 0 HD21 LEU A 102 11.469 -3.267 3.638 1.00 0.00 H new ATOM 0 HD22 LEU A 102 12.749 -3.788 2.516 1.00 0.00 H new ATOM 0 HD23 LEU A 102 11.403 -4.886 2.902 1.00 0.00 H new ATOM 1694 N TYR A 103 12.839 -8.352 5.733 1.00 0.00 N ATOM 1695 CA TYR A 103 11.872 -9.046 6.578 1.00 0.00 C ATOM 1696 C TYR A 103 12.541 -9.518 7.866 1.00 0.00 C ATOM 1697 O TYR A 103 11.936 -9.490 8.936 1.00 0.00 O ATOM 1698 CB TYR A 103 11.273 -10.245 5.826 1.00 0.00 C ATOM 1699 CG TYR A 103 10.033 -10.843 6.467 1.00 0.00 C ATOM 1700 CD1 TYR A 103 10.123 -11.694 7.564 1.00 0.00 C ATOM 1701 CD2 TYR A 103 8.769 -10.566 5.958 1.00 0.00 C ATOM 1702 CE1 TYR A 103 8.992 -12.249 8.135 1.00 0.00 C ATOM 1703 CE2 TYR A 103 7.634 -11.116 6.524 1.00 0.00 C ATOM 1704 CZ TYR A 103 7.750 -11.956 7.611 1.00 0.00 C ATOM 1705 OH TYR A 103 6.619 -12.511 8.169 1.00 0.00 O ATOM 0 H TYR A 103 13.013 -8.808 4.837 1.00 0.00 H new ATOM 0 HA TYR A 103 11.070 -8.353 6.831 1.00 0.00 H new ATOM 0 HB2 TYR A 103 11.026 -9.933 4.811 1.00 0.00 H new ATOM 0 HB3 TYR A 103 12.033 -11.022 5.744 1.00 0.00 H new ATOM 0 HD1 TYR A 103 11.094 -11.925 7.977 1.00 0.00 H new ATOM 0 HD2 TYR A 103 8.672 -9.910 5.106 1.00 0.00 H new ATOM 0 HE1 TYR A 103 9.081 -12.908 8.986 1.00 0.00 H new ATOM 0 HE2 TYR A 103 6.660 -10.889 6.116 1.00 0.00 H new ATOM 0 HH TYR A 103 5.828 -12.201 7.681 1.00 0.00 H new ATOM 1715 N GLU A 104 13.794 -9.941 7.760 1.00 0.00 N ATOM 1716 CA GLU A 104 14.539 -10.403 8.924 1.00 0.00 C ATOM 1717 C GLU A 104 14.990 -9.225 9.783 1.00 0.00 C ATOM 1718 O GLU A 104 14.816 -9.235 10.999 1.00 0.00 O ATOM 1719 CB GLU A 104 15.760 -11.217 8.498 1.00 0.00 C ATOM 1720 CG GLU A 104 15.430 -12.406 7.618 1.00 0.00 C ATOM 1721 CD GLU A 104 16.649 -13.250 7.315 1.00 0.00 C ATOM 1722 OE1 GLU A 104 17.593 -12.736 6.673 1.00 0.00 O ATOM 1723 OE2 GLU A 104 16.681 -14.424 7.741 1.00 0.00 O ATOM 0 H GLU A 104 14.314 -9.974 6.883 1.00 0.00 H new ATOM 0 HA GLU A 104 13.874 -11.037 9.511 1.00 0.00 H new ATOM 0 HB2 GLU A 104 16.452 -10.564 7.965 1.00 0.00 H new ATOM 0 HB3 GLU A 104 16.278 -11.570 9.390 1.00 0.00 H new ATOM 0 HG2 GLU A 104 14.677 -13.022 8.110 1.00 0.00 H new ATOM 0 HG3 GLU A 104 14.993 -12.054 6.684 1.00 0.00 H new ATOM 1730 N ASN A 105 15.563 -8.213 9.138 1.00 0.00 N ATOM 1731 CA ASN A 105 16.133 -7.064 9.842 1.00 0.00 C ATOM 1732 C ASN A 105 15.056 -6.181 10.457 1.00 0.00 C ATOM 1733 O ASN A 105 15.019 -5.987 11.674 1.00 0.00 O ATOM 1734 CB ASN A 105 16.981 -6.221 8.883 1.00 0.00 C ATOM 1735 CG ASN A 105 18.464 -6.353 9.144 1.00 0.00 C ATOM 1736 OD1 ASN A 105 19.039 -5.594 9.926 1.00 0.00 O ATOM 1737 ND2 ASN A 105 19.094 -7.304 8.478 1.00 0.00 N ATOM 0 H ASN A 105 15.646 -8.164 8.123 1.00 0.00 H new ATOM 0 HA ASN A 105 16.755 -7.458 10.646 1.00 0.00 H new ATOM 0 HB2 ASN A 105 16.769 -6.522 7.857 1.00 0.00 H new ATOM 0 HB3 ASN A 105 16.692 -5.174 8.974 1.00 0.00 H new ATOM 0 HD21 ASN A 105 20.098 -7.433 8.601 1.00 0.00 H new ATOM 0 HD22 ASN A 105 18.576 -7.909 7.841 1.00 0.00 H new ATOM 1744 N GLU A 106 14.173 -5.671 9.616 1.00 0.00 N ATOM 1745 CA GLU A 106 13.186 -4.689 10.045 1.00 0.00 C ATOM 1746 C GLU A 106 11.817 -5.338 10.215 1.00 0.00 C ATOM 1747 O GLU A 106 11.051 -4.980 11.112 1.00 0.00 O ATOM 1748 CB GLU A 106 13.107 -3.560 9.019 1.00 0.00 C ATOM 1749 CG GLU A 106 14.448 -2.904 8.726 1.00 0.00 C ATOM 1750 CD GLU A 106 14.935 -2.016 9.853 1.00 0.00 C ATOM 1751 OE1 GLU A 106 15.428 -2.544 10.872 1.00 0.00 O ATOM 1752 OE2 GLU A 106 14.832 -0.780 9.720 1.00 0.00 O ATOM 0 H GLU A 106 14.118 -5.920 8.628 1.00 0.00 H new ATOM 0 HA GLU A 106 13.493 -4.282 11.009 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.695 -3.954 8.090 1.00 0.00 H new ATOM 0 HB3 GLU A 106 12.413 -2.801 9.380 1.00 0.00 H new ATOM 0 HG2 GLU A 106 15.191 -3.679 8.535 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.364 -2.311 7.815 1.00 0.00 H new ATOM 1759 N GLY A 107 11.517 -6.290 9.347 1.00 0.00 N ATOM 1760 CA GLY A 107 10.268 -7.009 9.442 1.00 0.00 C ATOM 1761 C GLY A 107 9.324 -6.690 8.303 1.00 0.00 C ATOM 1762 O GLY A 107 9.620 -5.851 7.444 1.00 0.00 O ATOM 0 H GLY A 107 12.119 -6.578 8.576 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.470 -8.080 9.453 1.00 0.00 H new ATOM 0 HA3 GLY A 107 9.785 -6.766 10.388 1.00 0.00 H new ATOM 1766 N PHE A 108 8.176 -7.356 8.307 1.00 0.00 N ATOM 1767 CA PHE A 108 7.146 -7.144 7.293 1.00 0.00 C ATOM 1768 C PHE A 108 6.650 -5.700 7.310 1.00 0.00 C ATOM 1769 O PHE A 108 6.147 -5.200 6.308 1.00 0.00 O ATOM 1770 CB PHE A 108 5.979 -8.117 7.513 1.00 0.00 C ATOM 1771 CG PHE A 108 5.503 -8.176 8.939 1.00 0.00 C ATOM 1772 CD1 PHE A 108 4.548 -7.291 9.404 1.00 0.00 C ATOM 1773 CD2 PHE A 108 6.023 -9.117 9.817 1.00 0.00 C ATOM 1774 CE1 PHE A 108 4.119 -7.339 10.716 1.00 0.00 C ATOM 1775 CE2 PHE A 108 5.600 -9.168 11.131 1.00 0.00 C ATOM 1776 CZ PHE A 108 4.646 -8.279 11.580 1.00 0.00 C ATOM 0 H PHE A 108 7.932 -8.055 9.008 1.00 0.00 H new ATOM 0 HA PHE A 108 7.584 -7.336 6.314 1.00 0.00 H new ATOM 0 HB2 PHE A 108 5.147 -7.823 6.873 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.285 -9.115 7.200 1.00 0.00 H new ATOM 0 HD1 PHE A 108 4.133 -6.553 8.733 1.00 0.00 H new ATOM 0 HD2 PHE A 108 6.767 -9.818 9.469 1.00 0.00 H new ATOM 0 HE1 PHE A 108 3.372 -6.642 11.066 1.00 0.00 H new ATOM 0 HE2 PHE A 108 6.015 -9.902 11.805 1.00 0.00 H new ATOM 0 HZ PHE A 108 4.311 -8.318 12.606 1.00 0.00 H new ATOM 1786 N ASP A 109 6.801 -5.039 8.456 1.00 0.00 N ATOM 1787 CA ASP A 109 6.463 -3.625 8.582 1.00 0.00 C ATOM 1788 C ASP A 109 7.175 -2.811 7.518 1.00 0.00 C ATOM 1789 O ASP A 109 6.538 -2.176 6.679 1.00 0.00 O ATOM 1790 CB ASP A 109 6.845 -3.095 9.969 1.00 0.00 C ATOM 1791 CG ASP A 109 5.715 -3.204 10.973 1.00 0.00 C ATOM 1792 OD1 ASP A 109 5.347 -4.336 11.341 1.00 0.00 O ATOM 1793 OD2 ASP A 109 5.188 -2.153 11.398 1.00 0.00 O ATOM 0 H ASP A 109 7.157 -5.463 9.313 1.00 0.00 H new ATOM 0 HA ASP A 109 5.386 -3.527 8.449 1.00 0.00 H new ATOM 0 HB2 ASP A 109 7.708 -3.649 10.339 1.00 0.00 H new ATOM 0 HB3 ASP A 109 7.149 -2.052 9.883 1.00 0.00 H new ATOM 1798 N ALA A 110 8.500 -2.866 7.540 1.00 0.00 N ATOM 1799 CA ALA A 110 9.317 -2.104 6.609 1.00 0.00 C ATOM 1800 C ALA A 110 9.125 -2.586 5.180 1.00 0.00 C ATOM 1801 O ALA A 110 9.272 -1.810 4.238 1.00 0.00 O ATOM 1802 CB ALA A 110 10.782 -2.180 6.999 1.00 0.00 C ATOM 0 H ALA A 110 9.033 -3.435 8.198 1.00 0.00 H new ATOM 0 HA ALA A 110 8.994 -1.064 6.659 1.00 0.00 H new ATOM 0 HB1 ALA A 110 11.377 -1.604 6.291 1.00 0.00 H new ATOM 0 HB2 ALA A 110 10.914 -1.771 8.001 1.00 0.00 H new ATOM 0 HB3 ALA A 110 11.109 -3.220 6.986 1.00 0.00 H new ATOM 1808 N ASP A 111 8.794 -3.863 5.015 1.00 0.00 N ATOM 1809 CA ASP A 111 8.548 -4.402 3.681 1.00 0.00 C ATOM 1810 C ASP A 111 7.337 -3.712 3.057 1.00 0.00 C ATOM 1811 O ASP A 111 7.370 -3.315 1.893 1.00 0.00 O ATOM 1812 CB ASP A 111 8.336 -5.917 3.720 1.00 0.00 C ATOM 1813 CG ASP A 111 8.356 -6.525 2.329 1.00 0.00 C ATOM 1814 OD1 ASP A 111 9.460 -6.674 1.765 1.00 0.00 O ATOM 1815 OD2 ASP A 111 7.277 -6.860 1.800 1.00 0.00 O ATOM 0 H ASP A 111 8.691 -4.535 5.775 1.00 0.00 H new ATOM 0 HA ASP A 111 9.428 -4.207 3.069 1.00 0.00 H new ATOM 0 HB2 ASP A 111 9.114 -6.377 4.329 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.383 -6.138 4.200 1.00 0.00 H new ATOM 1820 N ILE A 112 6.285 -3.545 3.851 1.00 0.00 N ATOM 1821 CA ILE A 112 5.105 -2.805 3.413 1.00 0.00 C ATOM 1822 C ILE A 112 5.448 -1.326 3.242 1.00 0.00 C ATOM 1823 O ILE A 112 5.085 -0.691 2.244 1.00 0.00 O ATOM 1824 CB ILE A 112 3.944 -2.926 4.433 1.00 0.00 C ATOM 1825 CG1 ILE A 112 3.598 -4.394 4.707 1.00 0.00 C ATOM 1826 CG2 ILE A 112 2.716 -2.171 3.940 1.00 0.00 C ATOM 1827 CD1 ILE A 112 3.038 -5.133 3.513 1.00 0.00 C ATOM 0 H ILE A 112 6.224 -3.911 4.801 1.00 0.00 H new ATOM 0 HA ILE A 112 4.787 -3.235 2.463 1.00 0.00 H new ATOM 0 HB ILE A 112 4.274 -2.478 5.370 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.495 -4.909 5.050 1.00 0.00 H new ATOM 0 HG13 ILE A 112 2.874 -4.439 5.520 1.00 0.00 H new ATOM 0 HG21 ILE A 112 1.912 -2.268 4.670 1.00 0.00 H new ATOM 0 HG22 ILE A 112 2.964 -1.117 3.811 1.00 0.00 H new ATOM 0 HG23 ILE A 112 2.392 -2.587 2.986 1.00 0.00 H new ATOM 0 HD11 ILE A 112 2.820 -6.164 3.792 1.00 0.00 H new ATOM 0 HD12 ILE A 112 2.121 -4.646 3.181 1.00 0.00 H new ATOM 0 HD13 ILE A 112 3.768 -5.123 2.704 1.00 0.00 H new ATOM 1839 N ASP A 113 6.160 -0.790 4.227 1.00 0.00 N ATOM 1840 CA ASP A 113 6.545 0.619 4.236 1.00 0.00 C ATOM 1841 C ASP A 113 7.474 0.968 3.076 1.00 0.00 C ATOM 1842 O ASP A 113 7.599 2.137 2.716 1.00 0.00 O ATOM 1843 CB ASP A 113 7.203 1.003 5.567 1.00 0.00 C ATOM 1844 CG ASP A 113 6.192 1.244 6.675 1.00 0.00 C ATOM 1845 OD1 ASP A 113 5.509 2.289 6.642 1.00 0.00 O ATOM 1846 OD2 ASP A 113 6.087 0.404 7.592 1.00 0.00 O ATOM 0 H ASP A 113 6.486 -1.315 5.038 1.00 0.00 H new ATOM 0 HA ASP A 113 5.627 1.195 4.115 1.00 0.00 H new ATOM 0 HB2 ASP A 113 7.887 0.210 5.871 1.00 0.00 H new ATOM 0 HB3 ASP A 113 7.801 1.903 5.425 1.00 0.00 H new ATOM 1851 N SER A 114 8.127 -0.037 2.497 1.00 0.00 N ATOM 1852 CA SER A 114 9.009 0.175 1.350 1.00 0.00 C ATOM 1853 C SER A 114 8.337 1.042 0.285 1.00 0.00 C ATOM 1854 O SER A 114 8.964 1.943 -0.272 1.00 0.00 O ATOM 1855 CB SER A 114 9.426 -1.165 0.745 1.00 0.00 C ATOM 1856 OG SER A 114 10.148 -1.947 1.680 1.00 0.00 O ATOM 0 H SER A 114 8.062 -1.008 2.803 1.00 0.00 H new ATOM 0 HA SER A 114 9.896 0.699 1.705 1.00 0.00 H new ATOM 0 HB2 SER A 114 8.541 -1.710 0.418 1.00 0.00 H new ATOM 0 HB3 SER A 114 10.039 -0.993 -0.139 1.00 0.00 H new ATOM 0 HG SER A 114 9.780 -1.806 2.577 1.00 0.00 H new ATOM 1862 N TYR A 115 7.062 0.775 0.017 1.00 0.00 N ATOM 1863 CA TYR A 115 6.303 1.571 -0.944 1.00 0.00 C ATOM 1864 C TYR A 115 5.636 2.782 -0.286 1.00 0.00 C ATOM 1865 O TYR A 115 5.777 3.909 -0.754 1.00 0.00 O ATOM 1866 CB TYR A 115 5.242 0.706 -1.638 1.00 0.00 C ATOM 1867 CG TYR A 115 4.161 1.511 -2.333 1.00 0.00 C ATOM 1868 CD1 TYR A 115 4.437 2.251 -3.475 1.00 0.00 C ATOM 1869 CD2 TYR A 115 2.865 1.544 -1.829 1.00 0.00 C ATOM 1870 CE1 TYR A 115 3.455 2.998 -4.094 1.00 0.00 C ATOM 1871 CE2 TYR A 115 1.879 2.292 -2.441 1.00 0.00 C ATOM 1872 CZ TYR A 115 2.178 3.016 -3.573 1.00 0.00 C ATOM 1873 OH TYR A 115 1.199 3.763 -4.185 1.00 0.00 O ATOM 0 H TYR A 115 6.534 0.017 0.449 1.00 0.00 H new ATOM 0 HA TYR A 115 7.011 1.941 -1.685 1.00 0.00 H new ATOM 0 HB2 TYR A 115 5.731 0.063 -2.370 1.00 0.00 H new ATOM 0 HB3 TYR A 115 4.778 0.053 -0.899 1.00 0.00 H new ATOM 0 HD1 TYR A 115 5.436 2.242 -3.886 1.00 0.00 H new ATOM 0 HD2 TYR A 115 2.626 0.974 -0.943 1.00 0.00 H new ATOM 0 HE1 TYR A 115 3.686 3.566 -4.983 1.00 0.00 H new ATOM 0 HE2 TYR A 115 0.879 2.309 -2.034 1.00 0.00 H new ATOM 0 HH TYR A 115 1.304 3.705 -5.158 1.00 0.00 H new ATOM 1883 N ILE A 116 4.918 2.543 0.801 1.00 0.00 N ATOM 1884 CA ILE A 116 4.029 3.552 1.373 1.00 0.00 C ATOM 1885 C ILE A 116 4.788 4.659 2.106 1.00 0.00 C ATOM 1886 O ILE A 116 4.341 5.809 2.153 1.00 0.00 O ATOM 1887 CB ILE A 116 3.014 2.897 2.335 1.00 0.00 C ATOM 1888 CG1 ILE A 116 2.282 1.758 1.621 1.00 0.00 C ATOM 1889 CG2 ILE A 116 2.017 3.930 2.846 1.00 0.00 C ATOM 1890 CD1 ILE A 116 1.333 0.983 2.508 1.00 0.00 C ATOM 0 H ILE A 116 4.931 1.658 1.308 1.00 0.00 H new ATOM 0 HA ILE A 116 3.503 4.012 0.537 1.00 0.00 H new ATOM 0 HB ILE A 116 3.553 2.491 3.191 1.00 0.00 H new ATOM 0 HG12 ILE A 116 1.723 2.170 0.781 1.00 0.00 H new ATOM 0 HG13 ILE A 116 3.019 1.070 1.207 1.00 0.00 H new ATOM 0 HG21 ILE A 116 1.310 3.450 3.522 1.00 0.00 H new ATOM 0 HG22 ILE A 116 2.550 4.718 3.378 1.00 0.00 H new ATOM 0 HG23 ILE A 116 1.477 4.362 2.004 1.00 0.00 H new ATOM 0 HD11 ILE A 116 0.854 0.194 1.927 1.00 0.00 H new ATOM 0 HD12 ILE A 116 1.888 0.539 3.335 1.00 0.00 H new ATOM 0 HD13 ILE A 116 0.572 1.656 2.902 1.00 0.00 H new ATOM 1902 N ASP A 117 5.937 4.324 2.673 1.00 0.00 N ATOM 1903 CA ASP A 117 6.697 5.289 3.458 1.00 0.00 C ATOM 1904 C ASP A 117 7.594 6.133 2.552 1.00 0.00 C ATOM 1905 O ASP A 117 8.114 7.170 2.967 1.00 0.00 O ATOM 1906 CB ASP A 117 7.535 4.568 4.522 1.00 0.00 C ATOM 1907 CG ASP A 117 8.084 5.505 5.578 1.00 0.00 C ATOM 1908 OD1 ASP A 117 7.349 5.816 6.540 1.00 0.00 O ATOM 1909 OD2 ASP A 117 9.251 5.932 5.459 1.00 0.00 O ATOM 0 H ASP A 117 6.362 3.399 2.606 1.00 0.00 H new ATOM 0 HA ASP A 117 5.995 5.955 3.960 1.00 0.00 H new ATOM 0 HB2 ASP A 117 6.923 3.806 5.004 1.00 0.00 H new ATOM 0 HB3 ASP A 117 8.363 4.052 4.036 1.00 0.00 H new ATOM 1914 N SER A 118 7.751 5.699 1.307 1.00 0.00 N ATOM 1915 CA SER A 118 8.604 6.398 0.361 1.00 0.00 C ATOM 1916 C SER A 118 7.772 7.270 -0.580 1.00 0.00 C ATOM 1917 O SER A 118 6.936 6.773 -1.343 1.00 0.00 O ATOM 1918 CB SER A 118 9.449 5.395 -0.429 1.00 0.00 C ATOM 1919 OG SER A 118 8.635 4.433 -1.071 1.00 0.00 O ATOM 0 H SER A 118 7.298 4.866 0.932 1.00 0.00 H new ATOM 0 HA SER A 118 9.275 7.053 0.917 1.00 0.00 H new ATOM 0 HB2 SER A 118 10.046 5.924 -1.172 1.00 0.00 H new ATOM 0 HB3 SER A 118 10.147 4.895 0.243 1.00 0.00 H new ATOM 0 HG SER A 118 8.808 3.549 -0.686 1.00 0.00 H new ATOM 1925 N PRO A 119 7.990 8.593 -0.534 1.00 0.00 N ATOM 1926 CA PRO A 119 7.248 9.546 -1.357 1.00 0.00 C ATOM 1927 C PRO A 119 7.440 9.302 -2.849 1.00 0.00 C ATOM 1928 O PRO A 119 6.490 9.386 -3.615 1.00 0.00 O ATOM 1929 CB PRO A 119 7.824 10.910 -0.962 1.00 0.00 C ATOM 1930 CG PRO A 119 9.127 10.613 -0.303 1.00 0.00 C ATOM 1931 CD PRO A 119 8.968 9.264 0.337 1.00 0.00 C ATOM 0 HA PRO A 119 6.174 9.463 -1.189 1.00 0.00 H new ATOM 0 HB2 PRO A 119 7.962 11.546 -1.836 1.00 0.00 H new ATOM 0 HB3 PRO A 119 7.153 11.439 -0.285 1.00 0.00 H new ATOM 0 HG2 PRO A 119 9.939 10.607 -1.030 1.00 0.00 H new ATOM 0 HG3 PRO A 119 9.370 11.372 0.441 1.00 0.00 H new ATOM 0 HD2 PRO A 119 9.913 8.722 0.374 1.00 0.00 H new ATOM 0 HD3 PRO A 119 8.606 9.345 1.362 1.00 0.00 H new ATOM 1939 N GLU A 120 8.664 8.969 -3.252 1.00 0.00 N ATOM 1940 CA GLU A 120 8.977 8.782 -4.667 1.00 0.00 C ATOM 1941 C GLU A 120 8.121 7.675 -5.279 1.00 0.00 C ATOM 1942 O GLU A 120 7.553 7.839 -6.358 1.00 0.00 O ATOM 1943 CB GLU A 120 10.461 8.452 -4.848 1.00 0.00 C ATOM 1944 CG GLU A 120 10.918 8.469 -6.299 1.00 0.00 C ATOM 1945 CD GLU A 120 10.751 9.832 -6.943 1.00 0.00 C ATOM 1946 OE1 GLU A 120 11.516 10.756 -6.594 1.00 0.00 O ATOM 1947 OE2 GLU A 120 9.857 9.991 -7.796 1.00 0.00 O ATOM 0 H GLU A 120 9.453 8.824 -2.622 1.00 0.00 H new ATOM 0 HA GLU A 120 8.753 9.715 -5.183 1.00 0.00 H new ATOM 0 HB2 GLU A 120 11.055 9.168 -4.281 1.00 0.00 H new ATOM 0 HB3 GLU A 120 10.659 7.467 -4.425 1.00 0.00 H new ATOM 0 HG2 GLU A 120 11.965 8.172 -6.350 1.00 0.00 H new ATOM 0 HG3 GLU A 120 10.349 7.731 -6.865 1.00 0.00 H new ATOM 1954 N TYR A 121 8.006 6.560 -4.571 1.00 0.00 N ATOM 1955 CA TYR A 121 7.277 5.409 -5.084 1.00 0.00 C ATOM 1956 C TYR A 121 5.776 5.664 -5.103 1.00 0.00 C ATOM 1957 O TYR A 121 5.079 5.208 -6.010 1.00 0.00 O ATOM 1958 CB TYR A 121 7.600 4.159 -4.265 1.00 0.00 C ATOM 1959 CG TYR A 121 8.972 3.601 -4.555 1.00 0.00 C ATOM 1960 CD1 TYR A 121 9.158 2.686 -5.583 1.00 0.00 C ATOM 1961 CD2 TYR A 121 10.079 3.988 -3.811 1.00 0.00 C ATOM 1962 CE1 TYR A 121 10.407 2.176 -5.865 1.00 0.00 C ATOM 1963 CE2 TYR A 121 11.334 3.480 -4.087 1.00 0.00 C ATOM 1964 CZ TYR A 121 11.492 2.574 -5.114 1.00 0.00 C ATOM 1965 OH TYR A 121 12.741 2.067 -5.396 1.00 0.00 O ATOM 0 H TYR A 121 8.407 6.428 -3.642 1.00 0.00 H new ATOM 0 HA TYR A 121 7.599 5.244 -6.112 1.00 0.00 H new ATOM 0 HB2 TYR A 121 7.528 4.398 -3.204 1.00 0.00 H new ATOM 0 HB3 TYR A 121 6.852 3.393 -4.471 1.00 0.00 H new ATOM 0 HD1 TYR A 121 8.310 2.369 -6.171 1.00 0.00 H new ATOM 0 HD2 TYR A 121 9.957 4.696 -3.005 1.00 0.00 H new ATOM 0 HE1 TYR A 121 10.535 1.468 -6.670 1.00 0.00 H new ATOM 0 HE2 TYR A 121 12.186 3.791 -3.501 1.00 0.00 H new ATOM 0 HH TYR A 121 13.397 2.449 -4.776 1.00 0.00 H new ATOM 1975 N THR A 122 5.283 6.403 -4.120 1.00 0.00 N ATOM 1976 CA THR A 122 3.862 6.721 -4.065 1.00 0.00 C ATOM 1977 C THR A 122 3.512 7.807 -5.089 1.00 0.00 C ATOM 1978 O THR A 122 2.604 7.639 -5.909 1.00 0.00 O ATOM 1979 CB THR A 122 3.441 7.179 -2.652 1.00 0.00 C ATOM 1980 OG1 THR A 122 3.865 6.216 -1.673 1.00 0.00 O ATOM 1981 CG2 THR A 122 1.932 7.349 -2.571 1.00 0.00 C ATOM 0 H THR A 122 5.838 6.791 -3.357 1.00 0.00 H new ATOM 0 HA THR A 122 3.313 5.811 -4.307 1.00 0.00 H new ATOM 0 HB THR A 122 3.917 8.138 -2.449 1.00 0.00 H new ATOM 0 HG1 THR A 122 4.826 6.319 -1.508 1.00 0.00 H new ATOM 0 HG21 THR A 122 1.656 7.672 -1.567 1.00 0.00 H new ATOM 0 HG22 THR A 122 1.611 8.098 -3.295 1.00 0.00 H new ATOM 0 HG23 THR A 122 1.446 6.399 -2.793 1.00 0.00 H new ATOM 1989 N ASN A 123 4.269 8.903 -5.066 1.00 0.00 N ATOM 1990 CA ASN A 123 4.052 10.023 -5.984 1.00 0.00 C ATOM 1991 C ASN A 123 4.229 9.584 -7.431 1.00 0.00 C ATOM 1992 O ASN A 123 3.768 10.260 -8.350 1.00 0.00 O ATOM 1993 CB ASN A 123 5.014 11.182 -5.689 1.00 0.00 C ATOM 1994 CG ASN A 123 4.737 11.885 -4.368 1.00 0.00 C ATOM 1995 OD1 ASN A 123 4.281 11.276 -3.402 1.00 0.00 O ATOM 1996 ND2 ASN A 123 5.025 13.178 -4.317 1.00 0.00 N ATOM 0 H ASN A 123 5.044 9.041 -4.417 1.00 0.00 H new ATOM 0 HA ASN A 123 3.028 10.365 -5.833 1.00 0.00 H new ATOM 0 HB2 ASN A 123 6.035 10.802 -5.681 1.00 0.00 H new ATOM 0 HB3 ASN A 123 4.951 11.910 -6.498 1.00 0.00 H new ATOM 0 HD21 ASN A 123 4.870 13.702 -3.456 1.00 0.00 H new ATOM 0 HD22 ASN A 123 5.402 13.649 -5.139 1.00 0.00 H new ATOM 2003 N SER A 124 4.921 8.464 -7.622 1.00 0.00 N ATOM 2004 CA SER A 124 5.162 7.908 -8.946 1.00 0.00 C ATOM 2005 C SER A 124 3.878 7.863 -9.780 1.00 0.00 C ATOM 2006 O SER A 124 3.861 8.333 -10.922 1.00 0.00 O ATOM 2007 CB SER A 124 5.761 6.504 -8.823 1.00 0.00 C ATOM 2008 OG SER A 124 6.104 5.970 -10.091 1.00 0.00 O ATOM 0 H SER A 124 5.329 7.918 -6.863 1.00 0.00 H new ATOM 0 HA SER A 124 5.869 8.559 -9.460 1.00 0.00 H new ATOM 0 HB2 SER A 124 6.648 6.540 -8.191 1.00 0.00 H new ATOM 0 HB3 SER A 124 5.046 5.845 -8.331 1.00 0.00 H new ATOM 0 HG SER A 124 6.485 5.074 -9.977 1.00 0.00 H new ATOM 2014 N PHE A 125 2.799 7.326 -9.216 1.00 0.00 N ATOM 2015 CA PHE A 125 1.553 7.208 -9.969 1.00 0.00 C ATOM 2016 C PHE A 125 0.357 7.804 -9.222 1.00 0.00 C ATOM 2017 O PHE A 125 -0.710 7.984 -9.809 1.00 0.00 O ATOM 2018 CB PHE A 125 1.278 5.751 -10.367 1.00 0.00 C ATOM 2019 CG PHE A 125 1.163 4.791 -9.220 1.00 0.00 C ATOM 2020 CD1 PHE A 125 2.285 4.152 -8.720 1.00 0.00 C ATOM 2021 CD2 PHE A 125 -0.071 4.507 -8.658 1.00 0.00 C ATOM 2022 CE1 PHE A 125 2.180 3.255 -7.677 1.00 0.00 C ATOM 2023 CE2 PHE A 125 -0.183 3.609 -7.618 1.00 0.00 C ATOM 2024 CZ PHE A 125 0.944 2.982 -7.125 1.00 0.00 C ATOM 0 H PHE A 125 2.760 6.972 -8.260 1.00 0.00 H new ATOM 0 HA PHE A 125 1.684 7.794 -10.879 1.00 0.00 H new ATOM 0 HB2 PHE A 125 0.354 5.716 -10.944 1.00 0.00 H new ATOM 0 HB3 PHE A 125 2.078 5.413 -11.025 1.00 0.00 H new ATOM 0 HD1 PHE A 125 3.253 4.358 -9.151 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -0.956 4.995 -9.039 1.00 0.00 H new ATOM 0 HE1 PHE A 125 3.063 2.767 -7.293 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -1.151 3.396 -7.189 1.00 0.00 H new ATOM 0 HZ PHE A 125 0.859 2.279 -6.309 1.00 0.00 H new ATOM 2034 N GLY A 126 0.521 8.112 -7.940 1.00 0.00 N ATOM 2035 CA GLY A 126 -0.553 8.768 -7.220 1.00 0.00 C ATOM 2036 C GLY A 126 -0.568 8.466 -5.736 1.00 0.00 C ATOM 2037 O GLY A 126 -0.262 7.354 -5.312 1.00 0.00 O ATOM 0 H GLY A 126 1.362 7.923 -7.395 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -0.467 9.845 -7.361 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -1.506 8.465 -7.653 1.00 0.00 H new ATOM 2041 N ASP A 127 -0.953 9.467 -4.954 1.00 0.00 N ATOM 2042 CA ASP A 127 -1.035 9.337 -3.503 1.00 0.00 C ATOM 2043 C ASP A 127 -2.403 8.818 -3.103 1.00 0.00 C ATOM 2044 O ASP A 127 -2.555 8.101 -2.114 1.00 0.00 O ATOM 2045 CB ASP A 127 -0.825 10.693 -2.820 1.00 0.00 C ATOM 2046 CG ASP A 127 0.491 11.348 -3.166 1.00 0.00 C ATOM 2047 OD1 ASP A 127 0.586 11.958 -4.257 1.00 0.00 O ATOM 2048 OD2 ASP A 127 1.423 11.278 -2.339 1.00 0.00 O ATOM 0 H ASP A 127 -1.216 10.388 -5.305 1.00 0.00 H new ATOM 0 HA ASP A 127 -0.256 8.642 -3.189 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -1.639 11.362 -3.101 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -0.881 10.559 -1.740 1.00 0.00 H new ATOM 2053 N TRP A 128 -3.398 9.203 -3.881 1.00 0.00 N ATOM 2054 CA TRP A 128 -4.781 8.901 -3.565 1.00 0.00 C ATOM 2055 C TRP A 128 -5.307 7.758 -4.430 1.00 0.00 C ATOM 2056 O TRP A 128 -6.518 7.576 -4.564 1.00 0.00 O ATOM 2057 CB TRP A 128 -5.638 10.152 -3.779 1.00 0.00 C ATOM 2058 CG TRP A 128 -5.229 11.329 -2.937 1.00 0.00 C ATOM 2059 CD1 TRP A 128 -4.309 12.287 -3.257 1.00 0.00 C ATOM 2060 CD2 TRP A 128 -5.738 11.679 -1.644 1.00 0.00 C ATOM 2061 NE1 TRP A 128 -4.214 13.208 -2.240 1.00 0.00 N ATOM 2062 CE2 TRP A 128 -5.081 12.856 -1.238 1.00 0.00 C ATOM 2063 CE3 TRP A 128 -6.686 11.113 -0.788 1.00 0.00 C ATOM 2064 CZ2 TRP A 128 -5.341 13.472 -0.017 1.00 0.00 C ATOM 2065 CZ3 TRP A 128 -6.944 11.726 0.423 1.00 0.00 C ATOM 2066 CH2 TRP A 128 -6.274 12.894 0.800 1.00 0.00 C ATOM 0 H TRP A 128 -3.271 9.731 -4.745 1.00 0.00 H new ATOM 0 HA TRP A 128 -4.837 8.589 -2.522 1.00 0.00 H new ATOM 0 HB2 TRP A 128 -5.590 10.437 -4.830 1.00 0.00 H new ATOM 0 HB3 TRP A 128 -6.678 9.908 -3.562 1.00 0.00 H new ATOM 0 HD1 TRP A 128 -3.740 12.317 -4.174 1.00 0.00 H new ATOM 0 HE1 TRP A 128 -3.598 14.021 -2.232 1.00 0.00 H new ATOM 0 HE3 TRP A 128 -7.209 10.211 -1.068 1.00 0.00 H new ATOM 0 HZ2 TRP A 128 -4.824 14.374 0.275 1.00 0.00 H new ATOM 0 HZ3 TRP A 128 -7.676 11.295 1.090 1.00 0.00 H new ATOM 0 HH2 TRP A 128 -6.497 13.348 1.754 1.00 0.00 H new ATOM 2077 N VAL A 129 -4.397 6.988 -5.003 1.00 0.00 N ATOM 2078 CA VAL A 129 -4.773 5.899 -5.894 1.00 0.00 C ATOM 2079 C VAL A 129 -4.873 4.580 -5.127 1.00 0.00 C ATOM 2080 O VAL A 129 -4.083 4.316 -4.220 1.00 0.00 O ATOM 2081 CB VAL A 129 -3.763 5.752 -7.057 1.00 0.00 C ATOM 2082 CG1 VAL A 129 -4.179 4.641 -8.012 1.00 0.00 C ATOM 2083 CG2 VAL A 129 -3.611 7.072 -7.801 1.00 0.00 C ATOM 0 H VAL A 129 -3.392 7.096 -4.868 1.00 0.00 H new ATOM 0 HA VAL A 129 -5.750 6.142 -6.312 1.00 0.00 H new ATOM 0 HB VAL A 129 -2.797 5.480 -6.631 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -3.450 4.562 -8.818 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -4.226 3.695 -7.472 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -5.159 4.869 -8.430 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -2.897 6.950 -8.616 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -4.576 7.374 -8.207 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -3.251 7.838 -7.114 1.00 0.00 H new ATOM 2093 N VAL A 130 -5.866 3.774 -5.482 1.00 0.00 N ATOM 2094 CA VAL A 130 -6.046 2.461 -4.881 1.00 0.00 C ATOM 2095 C VAL A 130 -5.017 1.475 -5.437 1.00 0.00 C ATOM 2096 O VAL A 130 -4.764 1.463 -6.643 1.00 0.00 O ATOM 2097 CB VAL A 130 -7.477 1.932 -5.142 1.00 0.00 C ATOM 2098 CG1 VAL A 130 -7.651 0.508 -4.632 1.00 0.00 C ATOM 2099 CG2 VAL A 130 -8.502 2.850 -4.501 1.00 0.00 C ATOM 0 H VAL A 130 -6.563 4.010 -6.188 1.00 0.00 H new ATOM 0 HA VAL A 130 -5.900 2.557 -3.805 1.00 0.00 H new ATOM 0 HB VAL A 130 -7.634 1.919 -6.221 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -8.668 0.171 -4.833 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -6.944 -0.149 -5.139 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -7.465 0.481 -3.558 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -9.504 2.466 -4.692 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -8.329 2.894 -3.426 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -8.410 3.850 -4.924 1.00 0.00 H new ATOM 2109 N PRO A 131 -4.406 0.657 -4.552 1.00 0.00 N ATOM 2110 CA PRO A 131 -3.415 -0.361 -4.915 1.00 0.00 C ATOM 2111 C PRO A 131 -3.753 -1.087 -6.215 1.00 0.00 C ATOM 2112 O PRO A 131 -4.793 -1.741 -6.337 1.00 0.00 O ATOM 2113 CB PRO A 131 -3.444 -1.340 -3.732 1.00 0.00 C ATOM 2114 CG PRO A 131 -4.419 -0.778 -2.742 1.00 0.00 C ATOM 2115 CD PRO A 131 -4.622 0.664 -3.107 1.00 0.00 C ATOM 0 HA PRO A 131 -2.437 0.086 -5.093 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -3.751 -2.334 -4.058 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -2.454 -1.442 -3.287 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -5.363 -1.322 -2.776 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -4.035 -0.870 -1.726 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -5.622 1.011 -2.848 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -3.915 1.316 -2.594 1.00 0.00 H new ATOM 2123 N TYR A 132 -2.850 -0.970 -7.171 1.00 0.00 N ATOM 2124 CA TYR A 132 -3.057 -1.501 -8.508 1.00 0.00 C ATOM 2125 C TYR A 132 -2.616 -2.954 -8.600 1.00 0.00 C ATOM 2126 O TYR A 132 -1.676 -3.364 -7.933 1.00 0.00 O ATOM 2127 CB TYR A 132 -2.242 -0.683 -9.510 1.00 0.00 C ATOM 2128 CG TYR A 132 -3.062 0.090 -10.514 1.00 0.00 C ATOM 2129 CD1 TYR A 132 -3.518 1.367 -10.227 1.00 0.00 C ATOM 2130 CD2 TYR A 132 -3.357 -0.450 -11.759 1.00 0.00 C ATOM 2131 CE1 TYR A 132 -4.245 2.089 -11.154 1.00 0.00 C ATOM 2132 CE2 TYR A 132 -4.089 0.262 -12.690 1.00 0.00 C ATOM 2133 CZ TYR A 132 -4.527 1.532 -12.383 1.00 0.00 C ATOM 2134 OH TYR A 132 -5.241 2.258 -13.309 1.00 0.00 O ATOM 0 H TYR A 132 -1.952 -0.504 -7.044 1.00 0.00 H new ATOM 0 HA TYR A 132 -4.122 -1.441 -8.733 1.00 0.00 H new ATOM 0 HB2 TYR A 132 -1.613 0.017 -8.960 1.00 0.00 H new ATOM 0 HB3 TYR A 132 -1.574 -1.356 -10.048 1.00 0.00 H new ATOM 0 HD1 TYR A 132 -3.302 1.805 -9.264 1.00 0.00 H new ATOM 0 HD2 TYR A 132 -3.009 -1.443 -12.004 1.00 0.00 H new ATOM 0 HE1 TYR A 132 -4.590 3.084 -10.917 1.00 0.00 H new ATOM 0 HE2 TYR A 132 -4.316 -0.174 -13.652 1.00 0.00 H new ATOM 0 HH TYR A 132 -5.355 1.726 -14.124 1.00 0.00 H new ATOM 2144 N TYR A 133 -3.340 -3.745 -9.375 1.00 0.00 N ATOM 2145 CA TYR A 133 -2.807 -5.003 -9.865 1.00 0.00 C ATOM 2146 C TYR A 133 -2.568 -4.860 -11.359 1.00 0.00 C ATOM 2147 O TYR A 133 -3.489 -4.532 -12.108 1.00 0.00 O ATOM 2148 CB TYR A 133 -3.734 -6.187 -9.577 1.00 0.00 C ATOM 2149 CG TYR A 133 -3.037 -7.524 -9.735 1.00 0.00 C ATOM 2150 CD1 TYR A 133 -2.178 -7.995 -8.750 1.00 0.00 C ATOM 2151 CD2 TYR A 133 -3.223 -8.306 -10.868 1.00 0.00 C ATOM 2152 CE1 TYR A 133 -1.526 -9.206 -8.887 1.00 0.00 C ATOM 2153 CE2 TYR A 133 -2.572 -9.520 -11.014 1.00 0.00 C ATOM 2154 CZ TYR A 133 -1.725 -9.964 -10.018 1.00 0.00 C ATOM 2155 OH TYR A 133 -1.071 -11.172 -10.155 1.00 0.00 O ATOM 0 H TYR A 133 -4.293 -3.539 -9.676 1.00 0.00 H new ATOM 0 HA TYR A 133 -1.875 -5.217 -9.342 1.00 0.00 H new ATOM 0 HB2 TYR A 133 -4.122 -6.101 -8.562 1.00 0.00 H new ATOM 0 HB3 TYR A 133 -4.590 -6.146 -10.250 1.00 0.00 H new ATOM 0 HD1 TYR A 133 -2.017 -7.404 -7.861 1.00 0.00 H new ATOM 0 HD2 TYR A 133 -3.886 -7.962 -11.648 1.00 0.00 H new ATOM 0 HE1 TYR A 133 -0.863 -9.556 -8.110 1.00 0.00 H new ATOM 0 HE2 TYR A 133 -2.726 -10.116 -11.902 1.00 0.00 H new ATOM 0 HH TYR A 133 -1.320 -11.584 -11.009 1.00 0.00 H new ATOM 2165 N ARG A 134 -1.336 -5.072 -11.791 1.00 0.00 N ATOM 2166 CA ARG A 134 -0.982 -4.865 -13.185 1.00 0.00 C ATOM 2167 C ARG A 134 -1.556 -5.989 -14.048 1.00 0.00 C ATOM 2168 O ARG A 134 -1.018 -7.097 -14.088 1.00 0.00 O ATOM 2169 CB ARG A 134 0.542 -4.788 -13.323 1.00 0.00 C ATOM 2170 CG ARG A 134 1.028 -3.871 -14.435 1.00 0.00 C ATOM 2171 CD ARG A 134 0.742 -4.439 -15.812 1.00 0.00 C ATOM 2172 NE ARG A 134 1.348 -3.628 -16.866 1.00 0.00 N ATOM 2173 CZ ARG A 134 2.432 -3.986 -17.547 1.00 0.00 C ATOM 2174 NH1 ARG A 134 3.040 -5.136 -17.281 1.00 0.00 N ATOM 2175 NH2 ARG A 134 2.919 -3.187 -18.486 1.00 0.00 N ATOM 0 H ARG A 134 -0.567 -5.386 -11.199 1.00 0.00 H new ATOM 0 HA ARG A 134 -1.409 -3.924 -13.532 1.00 0.00 H new ATOM 0 HB2 ARG A 134 0.963 -4.447 -12.377 1.00 0.00 H new ATOM 0 HB3 ARG A 134 0.929 -5.791 -13.501 1.00 0.00 H new ATOM 0 HG2 ARG A 134 0.546 -2.898 -14.338 1.00 0.00 H new ATOM 0 HG3 ARG A 134 2.100 -3.708 -14.327 1.00 0.00 H new ATOM 0 HD2 ARG A 134 1.123 -5.458 -15.872 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -0.336 -4.492 -15.967 1.00 0.00 H new ATOM 0 HE ARG A 134 0.913 -2.734 -17.093 1.00 0.00 H new ATOM 0 HH11 ARG A 134 2.676 -5.749 -16.552 1.00 0.00 H new ATOM 0 HH12 ARG A 134 3.872 -5.407 -17.806 1.00 0.00 H new ATOM 0 HH21 ARG A 134 2.462 -2.297 -18.686 1.00 0.00 H new ATOM 0 HH22 ARG A 134 3.751 -3.462 -19.008 1.00 0.00 H new