USER MOD reduce.3.24.130724 H: found=0, std=0, add=650, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 651 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 36 ASN : amide:sc= -0.841 K(o=-0.84,f=-7.9!) USER MOD Set 1.2: A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 MET CE :methyl -167:sc= -0.0178 (180deg=-0.235) USER MOD Single : A 23 SER OG : rot -59:sc= 0.158 USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 34 GLN : amide:sc= 0.165 X(o=0.17,f=-0.026) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot -106:sc= 0.668 USER MOD Single : A 68 GLN :FLIP amide:sc= 0 F(o=-0.54,f=0) USER MOD Single : A 82 HIS : no HD1:sc= -0.0861 X(o=-0.086,f=0) USER MOD Single : A 84 GLN : amide:sc= -1.83! C(o=-1.8!,f=-7.2!) USER MOD Single : A 85 GLN : amide:sc= -0.0123 X(o=-0.012,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 0.292 X(o=0.29,f=-0.071) USER MOD Single : A 91 LYS NZ :NH3+ 151:sc= 0.885 (180deg=-0.123) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 THR OG1 : rot 41:sc= 0.275 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 102 SER OG : rot 180:sc= -0.977 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 GLN : amide:sc= -0.248 X(o=-0.25,f=-0.33) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 21 20.001 5.696 -29.525 1.00 0.00 N ATOM 2 CA MET A 21 20.547 4.396 -29.976 1.00 0.00 C ATOM 3 C MET A 21 20.296 3.339 -28.889 1.00 0.00 C ATOM 4 O MET A 21 21.008 3.305 -27.880 1.00 0.00 O ATOM 5 CB MET A 21 22.062 4.524 -30.299 1.00 0.00 C ATOM 6 CG MET A 21 22.385 5.546 -31.403 1.00 0.00 C ATOM 7 SD MET A 21 21.631 5.130 -32.999 1.00 0.00 S ATOM 8 CE MET A 21 22.474 3.605 -33.423 1.00 0.00 C ATOM 0 HA MET A 21 20.043 4.086 -30.891 1.00 0.00 H new ATOM 0 HB2 MET A 21 22.594 4.807 -29.390 1.00 0.00 H new ATOM 0 HB3 MET A 21 22.442 3.548 -30.600 1.00 0.00 H new ATOM 0 HG2 MET A 21 22.039 6.531 -31.090 1.00 0.00 H new ATOM 0 HG3 MET A 21 23.466 5.611 -31.525 1.00 0.00 H new ATOM 0 HE1 MET A 21 22.284 3.363 -34.469 1.00 0.00 H new ATOM 0 HE2 MET A 21 23.546 3.727 -33.268 1.00 0.00 H new ATOM 0 HE3 MET A 21 22.105 2.797 -32.790 1.00 0.00 H new ATOM 18 N ALA A 22 19.254 2.501 -29.077 1.00 0.00 N ATOM 19 CA ALA A 22 18.852 1.478 -28.092 1.00 0.00 C ATOM 20 C ALA A 22 19.861 0.315 -28.072 1.00 0.00 C ATOM 21 O ALA A 22 19.715 -0.674 -28.798 1.00 0.00 O ATOM 22 CB ALA A 22 17.424 0.991 -28.388 1.00 0.00 C ATOM 0 H ALA A 22 18.671 2.516 -29.914 1.00 0.00 H new ATOM 0 HA ALA A 22 18.853 1.923 -27.097 1.00 0.00 H new ATOM 0 HB1 ALA A 22 17.138 0.237 -27.655 1.00 0.00 H new ATOM 0 HB2 ALA A 22 16.733 1.832 -28.331 1.00 0.00 H new ATOM 0 HB3 ALA A 22 17.387 0.558 -29.388 1.00 0.00 H new ATOM 28 N SER A 23 20.885 0.456 -27.219 1.00 0.00 N ATOM 29 CA SER A 23 22.027 -0.461 -27.166 1.00 0.00 C ATOM 30 C SER A 23 22.560 -0.550 -25.725 1.00 0.00 C ATOM 31 O SER A 23 22.737 0.478 -25.063 1.00 0.00 O ATOM 32 CB SER A 23 23.129 0.024 -28.144 1.00 0.00 C ATOM 33 OG SER A 23 23.429 1.401 -27.952 1.00 0.00 O ATOM 0 H SER A 23 20.942 1.217 -26.542 1.00 0.00 H new ATOM 0 HA SER A 23 21.712 -1.459 -27.472 1.00 0.00 H new ATOM 0 HB2 SER A 23 24.032 -0.569 -27.999 1.00 0.00 H new ATOM 0 HB3 SER A 23 22.802 -0.138 -29.171 1.00 0.00 H new ATOM 0 HG SER A 23 22.618 1.935 -28.088 1.00 0.00 H new ATOM 39 N GLY A 24 22.789 -1.787 -25.240 1.00 0.00 N ATOM 40 CA GLY A 24 23.328 -2.031 -23.896 1.00 0.00 C ATOM 41 C GLY A 24 22.246 -2.205 -22.829 1.00 0.00 C ATOM 42 O GLY A 24 22.371 -3.066 -21.946 1.00 0.00 O ATOM 0 H GLY A 24 22.605 -2.639 -25.770 1.00 0.00 H new ATOM 0 HA2 GLY A 24 23.951 -2.925 -23.920 1.00 0.00 H new ATOM 0 HA3 GLY A 24 23.974 -1.199 -23.615 1.00 0.00 H new ATOM 46 N TRP A 25 21.178 -1.383 -22.922 1.00 0.00 N ATOM 47 CA TRP A 25 20.092 -1.322 -21.914 1.00 0.00 C ATOM 48 C TRP A 25 19.389 -2.690 -21.731 1.00 0.00 C ATOM 49 O TRP A 25 19.076 -3.095 -20.608 1.00 0.00 O ATOM 50 CB TRP A 25 19.056 -0.226 -22.313 1.00 0.00 C ATOM 51 CG TRP A 25 18.241 -0.558 -23.550 1.00 0.00 C ATOM 52 CD1 TRP A 25 18.686 -0.619 -24.836 1.00 0.00 C ATOM 53 CD2 TRP A 25 16.840 -0.896 -23.599 1.00 0.00 C ATOM 54 NE1 TRP A 25 17.663 -0.976 -25.671 1.00 0.00 N ATOM 55 CE2 TRP A 25 16.522 -1.148 -24.938 1.00 0.00 C ATOM 56 CE3 TRP A 25 15.832 -1.006 -22.637 1.00 0.00 C ATOM 57 CZ2 TRP A 25 15.243 -1.511 -25.348 1.00 0.00 C ATOM 58 CZ3 TRP A 25 14.560 -1.368 -23.043 1.00 0.00 C ATOM 59 CH2 TRP A 25 14.276 -1.617 -24.390 1.00 0.00 C ATOM 0 H TRP A 25 21.043 -0.739 -23.702 1.00 0.00 H new ATOM 0 HA TRP A 25 20.544 -1.062 -20.957 1.00 0.00 H new ATOM 0 HB2 TRP A 25 18.376 -0.064 -21.477 1.00 0.00 H new ATOM 0 HB3 TRP A 25 19.584 0.713 -22.481 1.00 0.00 H new ATOM 0 HD1 TRP A 25 19.699 -0.415 -25.151 1.00 0.00 H new ATOM 0 HE1 TRP A 25 17.739 -1.095 -26.681 1.00 0.00 H new ATOM 0 HE3 TRP A 25 16.042 -0.812 -21.596 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 15.023 -1.702 -26.388 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 13.774 -1.460 -22.308 1.00 0.00 H new ATOM 0 HH2 TRP A 25 13.274 -1.898 -24.677 1.00 0.00 H new ATOM 70 N ALA A 26 19.153 -3.372 -22.866 1.00 0.00 N ATOM 71 CA ALA A 26 18.487 -4.688 -22.922 1.00 0.00 C ATOM 72 C ALA A 26 18.748 -5.348 -24.280 1.00 0.00 C ATOM 73 O ALA A 26 18.073 -6.316 -24.652 1.00 0.00 O ATOM 74 CB ALA A 26 16.971 -4.541 -22.687 1.00 0.00 C ATOM 0 H ALA A 26 19.423 -3.020 -23.784 1.00 0.00 H new ATOM 0 HA ALA A 26 18.897 -5.319 -22.133 1.00 0.00 H new ATOM 0 HB1 ALA A 26 16.499 -5.522 -22.732 1.00 0.00 H new ATOM 0 HB2 ALA A 26 16.796 -4.099 -21.706 1.00 0.00 H new ATOM 0 HB3 ALA A 26 16.544 -3.897 -23.456 1.00 0.00 H new ATOM 80 N ASN A 27 19.751 -4.830 -25.010 1.00 0.00 N ATOM 81 CA ASN A 27 20.069 -5.281 -26.367 1.00 0.00 C ATOM 82 C ASN A 27 21.025 -6.477 -26.270 1.00 0.00 C ATOM 83 O ASN A 27 22.232 -6.371 -26.525 1.00 0.00 O ATOM 84 CB ASN A 27 20.660 -4.119 -27.212 1.00 0.00 C ATOM 85 CG ASN A 27 20.635 -4.420 -28.713 1.00 0.00 C ATOM 86 OD1 ASN A 27 21.566 -5.005 -29.270 1.00 0.00 O ATOM 87 ND2 ASN A 27 19.547 -4.043 -29.373 1.00 0.00 N ATOM 0 H ASN A 27 20.362 -4.087 -24.671 1.00 0.00 H new ATOM 0 HA ASN A 27 19.162 -5.600 -26.881 1.00 0.00 H new ATOM 0 HB2 ASN A 27 20.095 -3.207 -27.017 1.00 0.00 H new ATOM 0 HB3 ASN A 27 21.687 -3.931 -26.899 1.00 0.00 H new ATOM 0 HD21 ASN A 27 19.464 -4.236 -30.371 1.00 0.00 H new ATOM 0 HD22 ASN A 27 18.794 -3.561 -28.882 1.00 0.00 H new ATOM 94 N ASP A 28 20.452 -7.607 -25.828 1.00 0.00 N ATOM 95 CA ASP A 28 21.187 -8.855 -25.541 1.00 0.00 C ATOM 96 C ASP A 28 20.362 -10.063 -26.002 1.00 0.00 C ATOM 97 O ASP A 28 19.130 -9.993 -26.064 1.00 0.00 O ATOM 98 CB ASP A 28 21.463 -9.011 -24.013 1.00 0.00 C ATOM 99 CG ASP A 28 22.323 -7.885 -23.418 1.00 0.00 C ATOM 100 OD1 ASP A 28 23.565 -8.009 -23.433 1.00 0.00 O ATOM 101 OD2 ASP A 28 21.763 -6.874 -22.929 1.00 0.00 O ATOM 0 H ASP A 28 19.449 -7.684 -25.656 1.00 0.00 H new ATOM 0 HA ASP A 28 22.136 -8.808 -26.076 1.00 0.00 H new ATOM 0 HB2 ASP A 28 20.511 -9.046 -23.483 1.00 0.00 H new ATOM 0 HB3 ASP A 28 21.960 -9.965 -23.839 1.00 0.00 H new ATOM 106 N ASP A 29 21.048 -11.184 -26.281 1.00 0.00 N ATOM 107 CA ASP A 29 20.404 -12.502 -26.464 1.00 0.00 C ATOM 108 C ASP A 29 19.891 -13.013 -25.107 1.00 0.00 C ATOM 109 O ASP A 29 18.922 -13.763 -25.055 1.00 0.00 O ATOM 110 CB ASP A 29 21.402 -13.517 -27.084 1.00 0.00 C ATOM 111 CG ASP A 29 21.735 -13.201 -28.551 1.00 0.00 C ATOM 112 OD1 ASP A 29 22.664 -12.406 -28.808 1.00 0.00 O ATOM 113 OD2 ASP A 29 21.058 -13.742 -29.453 1.00 0.00 O ATOM 0 H ASP A 29 22.062 -11.206 -26.386 1.00 0.00 H new ATOM 0 HA ASP A 29 19.563 -12.395 -27.149 1.00 0.00 H new ATOM 0 HB2 ASP A 29 22.322 -13.519 -26.499 1.00 0.00 H new ATOM 0 HB3 ASP A 29 20.981 -14.520 -27.019 1.00 0.00 H new ATOM 118 N ALA A 30 20.550 -12.561 -24.016 1.00 0.00 N ATOM 119 CA ALA A 30 20.170 -12.889 -22.619 1.00 0.00 C ATOM 120 C ALA A 30 18.788 -12.303 -22.227 1.00 0.00 C ATOM 121 O ALA A 30 18.168 -12.751 -21.258 1.00 0.00 O ATOM 122 CB ALA A 30 21.260 -12.396 -21.651 1.00 0.00 C ATOM 0 H ALA A 30 21.367 -11.954 -24.079 1.00 0.00 H new ATOM 0 HA ALA A 30 20.083 -13.973 -22.549 1.00 0.00 H new ATOM 0 HB1 ALA A 30 20.975 -12.640 -20.628 1.00 0.00 H new ATOM 0 HB2 ALA A 30 22.206 -12.882 -21.890 1.00 0.00 H new ATOM 0 HB3 ALA A 30 21.372 -11.316 -21.749 1.00 0.00 H new ATOM 128 N VAL A 31 18.326 -11.305 -22.994 1.00 0.00 N ATOM 129 CA VAL A 31 17.020 -10.639 -22.800 1.00 0.00 C ATOM 130 C VAL A 31 16.039 -11.097 -23.900 1.00 0.00 C ATOM 131 O VAL A 31 14.847 -11.327 -23.641 1.00 0.00 O ATOM 132 CB VAL A 31 17.187 -9.068 -22.830 1.00 0.00 C ATOM 133 CG1 VAL A 31 15.832 -8.333 -22.657 1.00 0.00 C ATOM 134 CG2 VAL A 31 18.215 -8.599 -21.763 1.00 0.00 C ATOM 0 H VAL A 31 18.854 -10.928 -23.781 1.00 0.00 H new ATOM 0 HA VAL A 31 16.621 -10.918 -21.825 1.00 0.00 H new ATOM 0 HB VAL A 31 17.570 -8.804 -23.816 1.00 0.00 H new ATOM 0 HG11 VAL A 31 15.996 -7.256 -22.684 1.00 0.00 H new ATOM 0 HG12 VAL A 31 15.158 -8.618 -23.465 1.00 0.00 H new ATOM 0 HG13 VAL A 31 15.388 -8.608 -21.700 1.00 0.00 H new ATOM 0 HG21 VAL A 31 18.312 -7.514 -21.804 1.00 0.00 H new ATOM 0 HG22 VAL A 31 17.872 -8.896 -20.772 1.00 0.00 H new ATOM 0 HG23 VAL A 31 19.183 -9.058 -21.964 1.00 0.00 H new ATOM 144 N ASN A 32 16.575 -11.258 -25.128 1.00 0.00 N ATOM 145 CA ASN A 32 15.790 -11.642 -26.321 1.00 0.00 C ATOM 146 C ASN A 32 15.241 -13.077 -26.199 1.00 0.00 C ATOM 147 O ASN A 32 14.185 -13.387 -26.754 1.00 0.00 O ATOM 148 CB ASN A 32 16.649 -11.516 -27.608 1.00 0.00 C ATOM 149 CG ASN A 32 15.843 -11.734 -28.899 1.00 0.00 C ATOM 150 OD1 ASN A 32 14.687 -11.316 -29.004 1.00 0.00 O ATOM 151 ND2 ASN A 32 16.428 -12.418 -29.874 1.00 0.00 N ATOM 0 H ASN A 32 17.568 -11.125 -25.321 1.00 0.00 H new ATOM 0 HA ASN A 32 14.945 -10.957 -26.387 1.00 0.00 H new ATOM 0 HB2 ASN A 32 17.107 -10.527 -27.636 1.00 0.00 H new ATOM 0 HB3 ASN A 32 17.461 -12.242 -27.567 1.00 0.00 H new ATOM 0 HD21 ASN A 32 15.921 -12.610 -30.738 1.00 0.00 H new ATOM 0 HD22 ASN A 32 17.385 -12.752 -29.760 1.00 0.00 H new ATOM 158 N GLU A 33 15.971 -13.943 -25.460 1.00 0.00 N ATOM 159 CA GLU A 33 15.547 -15.341 -25.190 1.00 0.00 C ATOM 160 C GLU A 33 14.211 -15.383 -24.417 1.00 0.00 C ATOM 161 O GLU A 33 13.391 -16.279 -24.636 1.00 0.00 O ATOM 162 CB GLU A 33 16.647 -16.111 -24.406 1.00 0.00 C ATOM 163 CG GLU A 33 17.083 -15.440 -23.085 1.00 0.00 C ATOM 164 CD GLU A 33 18.112 -16.265 -22.298 1.00 0.00 C ATOM 165 OE1 GLU A 33 19.311 -16.219 -22.646 1.00 0.00 O ATOM 166 OE2 GLU A 33 17.728 -16.976 -21.342 1.00 0.00 O ATOM 0 H GLU A 33 16.865 -13.697 -25.035 1.00 0.00 H new ATOM 0 HA GLU A 33 15.398 -15.830 -26.152 1.00 0.00 H new ATOM 0 HB2 GLU A 33 16.283 -17.114 -24.186 1.00 0.00 H new ATOM 0 HB3 GLU A 33 17.521 -16.223 -25.047 1.00 0.00 H new ATOM 0 HG2 GLU A 33 17.505 -14.459 -23.305 1.00 0.00 H new ATOM 0 HG3 GLU A 33 16.204 -15.276 -22.461 1.00 0.00 H new ATOM 173 N GLN A 34 13.999 -14.382 -23.539 1.00 0.00 N ATOM 174 CA GLN A 34 12.763 -14.247 -22.747 1.00 0.00 C ATOM 175 C GLN A 34 11.596 -13.784 -23.648 1.00 0.00 C ATOM 176 O GLN A 34 10.454 -14.238 -23.485 1.00 0.00 O ATOM 177 CB GLN A 34 12.982 -13.264 -21.563 1.00 0.00 C ATOM 178 CG GLN A 34 11.773 -13.098 -20.617 1.00 0.00 C ATOM 179 CD GLN A 34 11.347 -14.405 -19.936 1.00 0.00 C ATOM 180 OE1 GLN A 34 11.834 -14.745 -18.863 1.00 0.00 O ATOM 181 NE2 GLN A 34 10.439 -15.153 -20.560 1.00 0.00 N ATOM 0 H GLN A 34 14.681 -13.645 -23.360 1.00 0.00 H new ATOM 0 HA GLN A 34 12.503 -15.221 -22.332 1.00 0.00 H new ATOM 0 HB2 GLN A 34 13.836 -13.608 -20.979 1.00 0.00 H new ATOM 0 HB3 GLN A 34 13.245 -12.286 -21.967 1.00 0.00 H new ATOM 0 HG2 GLN A 34 12.019 -12.362 -19.852 1.00 0.00 H new ATOM 0 HG3 GLN A 34 10.930 -12.701 -21.183 1.00 0.00 H new ATOM 0 HE21 GLN A 34 10.051 -14.846 -21.452 1.00 0.00 H new ATOM 0 HE22 GLN A 34 10.132 -16.033 -20.146 1.00 0.00 H new ATOM 190 N ILE A 35 11.913 -12.897 -24.615 1.00 0.00 N ATOM 191 CA ILE A 35 10.943 -12.408 -25.623 1.00 0.00 C ATOM 192 C ILE A 35 10.604 -13.542 -26.621 1.00 0.00 C ATOM 193 O ILE A 35 9.503 -13.597 -27.168 1.00 0.00 O ATOM 194 CB ILE A 35 11.507 -11.147 -26.399 1.00 0.00 C ATOM 195 CG1 ILE A 35 11.954 -10.041 -25.389 1.00 0.00 C ATOM 196 CG2 ILE A 35 10.468 -10.584 -27.412 1.00 0.00 C ATOM 197 CD1 ILE A 35 12.610 -8.817 -26.010 1.00 0.00 C ATOM 0 H ILE A 35 12.846 -12.499 -24.720 1.00 0.00 H new ATOM 0 HA ILE A 35 10.036 -12.102 -25.102 1.00 0.00 H new ATOM 0 HB ILE A 35 12.377 -11.470 -26.971 1.00 0.00 H new ATOM 0 HG12 ILE A 35 11.081 -9.716 -24.822 1.00 0.00 H new ATOM 0 HG13 ILE A 35 12.650 -10.483 -24.677 1.00 0.00 H new ATOM 0 HG21 ILE A 35 10.891 -9.720 -27.925 1.00 0.00 H new ATOM 0 HG22 ILE A 35 10.218 -11.353 -28.143 1.00 0.00 H new ATOM 0 HG23 ILE A 35 9.566 -10.284 -26.879 1.00 0.00 H new ATOM 0 HD11 ILE A 35 12.882 -8.112 -25.224 1.00 0.00 H new ATOM 0 HD12 ILE A 35 13.506 -9.120 -26.552 1.00 0.00 H new ATOM 0 HD13 ILE A 35 11.913 -8.341 -26.699 1.00 0.00 H new ATOM 209 N ASN A 36 11.572 -14.455 -26.816 1.00 0.00 N ATOM 210 CA ASN A 36 11.448 -15.617 -27.722 1.00 0.00 C ATOM 211 C ASN A 36 10.461 -16.653 -27.132 1.00 0.00 C ATOM 212 O ASN A 36 10.330 -16.775 -25.908 1.00 0.00 O ATOM 213 CB ASN A 36 12.865 -16.248 -27.926 1.00 0.00 C ATOM 214 CG ASN A 36 12.980 -17.345 -29.003 1.00 0.00 C ATOM 215 OD1 ASN A 36 12.032 -18.056 -29.330 1.00 0.00 O ATOM 216 ND2 ASN A 36 14.175 -17.515 -29.537 1.00 0.00 N ATOM 0 H ASN A 36 12.475 -14.408 -26.344 1.00 0.00 H new ATOM 0 HA ASN A 36 11.055 -15.297 -28.687 1.00 0.00 H new ATOM 0 HB2 ASN A 36 13.562 -15.448 -28.178 1.00 0.00 H new ATOM 0 HB3 ASN A 36 13.192 -16.668 -26.975 1.00 0.00 H new ATOM 0 HD21 ASN A 36 14.323 -18.246 -30.233 1.00 0.00 H new ATOM 0 HD22 ASN A 36 14.950 -16.916 -29.254 1.00 0.00 H new ATOM 223 N SER A 37 9.811 -17.424 -28.021 1.00 0.00 N ATOM 224 CA SER A 37 8.866 -18.502 -27.659 1.00 0.00 C ATOM 225 C SER A 37 9.596 -19.801 -27.205 1.00 0.00 C ATOM 226 O SER A 37 8.992 -20.879 -27.173 1.00 0.00 O ATOM 227 CB SER A 37 7.957 -18.798 -28.884 1.00 0.00 C ATOM 228 OG SER A 37 7.323 -17.618 -29.353 1.00 0.00 O ATOM 0 H SER A 37 9.927 -17.316 -29.029 1.00 0.00 H new ATOM 0 HA SER A 37 8.269 -18.165 -26.812 1.00 0.00 H new ATOM 0 HB2 SER A 37 8.553 -19.236 -29.685 1.00 0.00 H new ATOM 0 HB3 SER A 37 7.202 -19.535 -28.610 1.00 0.00 H new ATOM 0 HG SER A 37 6.759 -17.834 -30.125 1.00 0.00 H new ATOM 234 N THR A 38 10.881 -19.685 -26.838 1.00 0.00 N ATOM 235 CA THR A 38 11.696 -20.813 -26.370 1.00 0.00 C ATOM 236 C THR A 38 11.324 -21.203 -24.925 1.00 0.00 C ATOM 237 O THR A 38 11.175 -22.389 -24.615 1.00 0.00 O ATOM 238 CB THR A 38 13.211 -20.449 -26.460 1.00 0.00 C ATOM 239 OG1 THR A 38 13.570 -20.195 -27.830 1.00 0.00 O ATOM 240 CG2 THR A 38 14.113 -21.554 -25.890 1.00 0.00 C ATOM 0 H THR A 38 11.386 -18.799 -26.858 1.00 0.00 H new ATOM 0 HA THR A 38 11.496 -21.671 -27.012 1.00 0.00 H new ATOM 0 HB THR A 38 13.365 -19.554 -25.857 1.00 0.00 H new ATOM 0 HG1 THR A 38 14.521 -19.965 -27.882 1.00 0.00 H new ATOM 0 HG21 THR A 38 15.157 -21.252 -25.976 1.00 0.00 H new ATOM 0 HG22 THR A 38 13.868 -21.718 -24.841 1.00 0.00 H new ATOM 0 HG23 THR A 38 13.955 -22.477 -26.448 1.00 0.00 H new ATOM 248 N ILE A 39 11.148 -20.180 -24.066 1.00 0.00 N ATOM 249 CA ILE A 39 10.916 -20.369 -22.615 1.00 0.00 C ATOM 250 C ILE A 39 9.568 -21.081 -22.382 1.00 0.00 C ATOM 251 O ILE A 39 9.470 -22.026 -21.587 1.00 0.00 O ATOM 252 CB ILE A 39 10.938 -18.994 -21.832 1.00 0.00 C ATOM 253 CG1 ILE A 39 12.163 -18.109 -22.253 1.00 0.00 C ATOM 254 CG2 ILE A 39 10.907 -19.212 -20.295 1.00 0.00 C ATOM 255 CD1 ILE A 39 13.524 -18.773 -22.132 1.00 0.00 C ATOM 0 H ILE A 39 11.162 -19.202 -24.354 1.00 0.00 H new ATOM 0 HA ILE A 39 11.728 -20.986 -22.230 1.00 0.00 H new ATOM 0 HB ILE A 39 10.032 -18.454 -22.107 1.00 0.00 H new ATOM 0 HG12 ILE A 39 12.023 -17.794 -23.287 1.00 0.00 H new ATOM 0 HG13 ILE A 39 12.163 -17.206 -21.642 1.00 0.00 H new ATOM 0 HG21 ILE A 39 10.923 -18.246 -19.790 1.00 0.00 H new ATOM 0 HG22 ILE A 39 9.999 -19.749 -20.022 1.00 0.00 H new ATOM 0 HG23 ILE A 39 11.777 -19.794 -19.992 1.00 0.00 H new ATOM 0 HD11 ILE A 39 14.299 -18.075 -22.448 1.00 0.00 H new ATOM 0 HD12 ILE A 39 13.697 -19.062 -21.095 1.00 0.00 H new ATOM 0 HD13 ILE A 39 13.554 -19.659 -22.766 1.00 0.00 H new ATOM 267 N GLU A 40 8.550 -20.635 -23.136 1.00 0.00 N ATOM 268 CA GLU A 40 7.183 -21.183 -23.064 1.00 0.00 C ATOM 269 C GLU A 40 7.138 -22.615 -23.636 1.00 0.00 C ATOM 270 O GLU A 40 6.404 -23.467 -23.131 1.00 0.00 O ATOM 271 CB GLU A 40 6.195 -20.248 -23.814 1.00 0.00 C ATOM 272 CG GLU A 40 6.427 -20.156 -25.336 1.00 0.00 C ATOM 273 CD GLU A 40 5.506 -19.164 -26.057 1.00 0.00 C ATOM 274 OE1 GLU A 40 5.680 -17.941 -25.870 1.00 0.00 O ATOM 275 OE2 GLU A 40 4.614 -19.594 -26.816 1.00 0.00 O ATOM 0 H GLU A 40 8.651 -19.881 -23.816 1.00 0.00 H new ATOM 0 HA GLU A 40 6.880 -21.236 -22.018 1.00 0.00 H new ATOM 0 HB2 GLU A 40 5.178 -20.598 -23.635 1.00 0.00 H new ATOM 0 HB3 GLU A 40 6.268 -19.247 -23.388 1.00 0.00 H new ATOM 0 HG2 GLU A 40 7.463 -19.869 -25.517 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.289 -21.145 -25.773 1.00 0.00 H new ATOM 282 N ASP A 41 7.953 -22.857 -24.686 1.00 0.00 N ATOM 283 CA ASP A 41 8.060 -24.174 -25.350 1.00 0.00 C ATOM 284 C ASP A 41 8.815 -25.186 -24.467 1.00 0.00 C ATOM 285 O ASP A 41 8.577 -26.402 -24.546 1.00 0.00 O ATOM 286 CB ASP A 41 8.749 -24.032 -26.731 1.00 0.00 C ATOM 287 CG ASP A 41 8.906 -25.372 -27.481 1.00 0.00 C ATOM 288 OD1 ASP A 41 7.876 -25.958 -27.892 1.00 0.00 O ATOM 289 OD2 ASP A 41 10.050 -25.862 -27.641 1.00 0.00 O ATOM 0 H ASP A 41 8.555 -22.144 -25.097 1.00 0.00 H new ATOM 0 HA ASP A 41 7.050 -24.555 -25.503 1.00 0.00 H new ATOM 0 HB2 ASP A 41 8.170 -23.345 -27.348 1.00 0.00 H new ATOM 0 HB3 ASP A 41 9.733 -23.584 -26.593 1.00 0.00 H new ATOM 294 N ALA A 42 9.717 -24.671 -23.621 1.00 0.00 N ATOM 295 CA ALA A 42 10.485 -25.490 -22.673 1.00 0.00 C ATOM 296 C ALA A 42 9.560 -26.040 -21.567 1.00 0.00 C ATOM 297 O ALA A 42 9.740 -27.169 -21.098 1.00 0.00 O ATOM 298 CB ALA A 42 11.643 -24.671 -22.087 1.00 0.00 C ATOM 0 H ALA A 42 9.935 -23.676 -23.574 1.00 0.00 H new ATOM 0 HA ALA A 42 10.912 -26.343 -23.200 1.00 0.00 H new ATOM 0 HB1 ALA A 42 12.206 -25.287 -21.386 1.00 0.00 H new ATOM 0 HB2 ALA A 42 12.301 -24.344 -22.892 1.00 0.00 H new ATOM 0 HB3 ALA A 42 11.246 -23.800 -21.567 1.00 0.00 H new ATOM 304 N ILE A 43 8.563 -25.231 -21.164 1.00 0.00 N ATOM 305 CA ILE A 43 7.536 -25.652 -20.184 1.00 0.00 C ATOM 306 C ILE A 43 6.358 -26.374 -20.911 1.00 0.00 C ATOM 307 O ILE A 43 5.574 -27.107 -20.286 1.00 0.00 O ATOM 308 CB ILE A 43 7.022 -24.433 -19.321 1.00 0.00 C ATOM 309 CG1 ILE A 43 8.207 -23.523 -18.849 1.00 0.00 C ATOM 310 CG2 ILE A 43 6.204 -24.909 -18.087 1.00 0.00 C ATOM 311 CD1 ILE A 43 9.203 -24.186 -17.905 1.00 0.00 C ATOM 0 H ILE A 43 8.444 -24.276 -21.502 1.00 0.00 H new ATOM 0 HA ILE A 43 7.996 -26.358 -19.493 1.00 0.00 H new ATOM 0 HB ILE A 43 6.368 -23.848 -19.967 1.00 0.00 H new ATOM 0 HG12 ILE A 43 8.745 -23.171 -19.729 1.00 0.00 H new ATOM 0 HG13 ILE A 43 7.793 -22.644 -18.355 1.00 0.00 H new ATOM 0 HG21 ILE A 43 5.867 -24.043 -17.518 1.00 0.00 H new ATOM 0 HG22 ILE A 43 5.339 -25.481 -18.423 1.00 0.00 H new ATOM 0 HG23 ILE A 43 6.832 -25.537 -17.455 1.00 0.00 H new ATOM 0 HD11 ILE A 43 9.983 -23.472 -17.639 1.00 0.00 H new ATOM 0 HD12 ILE A 43 8.687 -24.513 -17.002 1.00 0.00 H new ATOM 0 HD13 ILE A 43 9.653 -25.048 -18.398 1.00 0.00 H new ATOM 323 N ALA A 44 6.261 -26.173 -22.243 1.00 0.00 N ATOM 324 CA ALA A 44 5.273 -26.860 -23.106 1.00 0.00 C ATOM 325 C ALA A 44 5.619 -28.351 -23.260 1.00 0.00 C ATOM 326 O ALA A 44 4.731 -29.208 -23.283 1.00 0.00 O ATOM 327 CB ALA A 44 5.199 -26.192 -24.489 1.00 0.00 C ATOM 0 H ALA A 44 6.866 -25.529 -22.752 1.00 0.00 H new ATOM 0 HA ALA A 44 4.298 -26.778 -22.625 1.00 0.00 H new ATOM 0 HB1 ALA A 44 4.467 -26.713 -25.106 1.00 0.00 H new ATOM 0 HB2 ALA A 44 4.901 -25.150 -24.374 1.00 0.00 H new ATOM 0 HB3 ALA A 44 6.177 -26.239 -24.968 1.00 0.00 H new ATOM 333 N ARG A 45 6.922 -28.648 -23.379 1.00 0.00 N ATOM 334 CA ARG A 45 7.416 -30.038 -23.439 1.00 0.00 C ATOM 335 C ARG A 45 7.515 -30.638 -22.021 1.00 0.00 C ATOM 336 O ARG A 45 7.530 -31.868 -21.858 1.00 0.00 O ATOM 337 CB ARG A 45 8.788 -30.092 -24.161 1.00 0.00 C ATOM 338 CG ARG A 45 9.959 -29.456 -23.378 1.00 0.00 C ATOM 339 CD ARG A 45 11.298 -29.528 -24.127 1.00 0.00 C ATOM 340 NE ARG A 45 11.319 -28.690 -25.342 1.00 0.00 N ATOM 341 CZ ARG A 45 12.425 -28.356 -26.027 1.00 0.00 C ATOM 342 NH1 ARG A 45 13.634 -28.733 -25.614 1.00 0.00 N ATOM 343 NH2 ARG A 45 12.317 -27.628 -27.118 1.00 0.00 N ATOM 0 H ARG A 45 7.657 -27.943 -23.436 1.00 0.00 H new ATOM 0 HA ARG A 45 6.706 -30.636 -24.010 1.00 0.00 H new ATOM 0 HB2 ARG A 45 9.032 -31.134 -24.369 1.00 0.00 H new ATOM 0 HB3 ARG A 45 8.696 -29.588 -25.123 1.00 0.00 H new ATOM 0 HG2 ARG A 45 9.723 -28.413 -23.168 1.00 0.00 H new ATOM 0 HG3 ARG A 45 10.060 -29.959 -22.417 1.00 0.00 H new ATOM 0 HD2 ARG A 45 12.100 -29.213 -23.460 1.00 0.00 H new ATOM 0 HD3 ARG A 45 11.500 -30.563 -24.402 1.00 0.00 H new ATOM 0 HE ARG A 45 10.426 -28.338 -25.687 1.00 0.00 H new ATOM 0 HH11 ARG A 45 13.733 -29.286 -24.763 1.00 0.00 H new ATOM 0 HH12 ARG A 45 14.461 -28.469 -26.149 1.00 0.00 H new ATOM 0 HH21 ARG A 45 11.398 -27.322 -27.438 1.00 0.00 H new ATOM 0 HH22 ARG A 45 13.152 -27.370 -27.644 1.00 0.00 H new ATOM 357 N ALA A 46 7.597 -29.751 -21.000 1.00 0.00 N ATOM 358 CA ALA A 46 7.669 -30.158 -19.588 1.00 0.00 C ATOM 359 C ALA A 46 6.312 -30.706 -19.110 1.00 0.00 C ATOM 360 O ALA A 46 6.176 -31.909 -18.891 1.00 0.00 O ATOM 361 CB ALA A 46 8.138 -28.992 -18.701 1.00 0.00 C ATOM 0 H ALA A 46 7.615 -28.740 -21.138 1.00 0.00 H new ATOM 0 HA ALA A 46 8.405 -30.957 -19.502 1.00 0.00 H new ATOM 0 HB1 ALA A 46 8.182 -29.320 -17.662 1.00 0.00 H new ATOM 0 HB2 ALA A 46 9.128 -28.666 -19.021 1.00 0.00 H new ATOM 0 HB3 ALA A 46 7.437 -28.162 -18.790 1.00 0.00 H new ATOM 367 N ARG A 47 5.293 -29.828 -18.980 1.00 0.00 N ATOM 368 CA ARG A 47 3.953 -30.224 -18.459 1.00 0.00 C ATOM 369 C ARG A 47 2.829 -29.895 -19.458 1.00 0.00 C ATOM 370 O ARG A 47 1.679 -30.305 -19.257 1.00 0.00 O ATOM 371 CB ARG A 47 3.710 -29.570 -17.055 1.00 0.00 C ATOM 372 CG ARG A 47 3.422 -28.030 -17.006 1.00 0.00 C ATOM 373 CD ARG A 47 1.917 -27.705 -17.116 1.00 0.00 C ATOM 374 NE ARG A 47 1.589 -26.309 -16.770 1.00 0.00 N ATOM 375 CZ ARG A 47 0.384 -25.892 -16.340 1.00 0.00 C ATOM 376 NH1 ARG A 47 -0.620 -26.753 -16.167 1.00 0.00 N ATOM 377 NH2 ARG A 47 0.190 -24.612 -16.074 1.00 0.00 N ATOM 0 H ARG A 47 5.366 -28.841 -19.226 1.00 0.00 H new ATOM 0 HA ARG A 47 3.937 -31.307 -18.335 1.00 0.00 H new ATOM 0 HB2 ARG A 47 2.869 -30.083 -16.588 1.00 0.00 H new ATOM 0 HB3 ARG A 47 4.587 -29.767 -16.438 1.00 0.00 H new ATOM 0 HG2 ARG A 47 3.811 -27.621 -16.074 1.00 0.00 H new ATOM 0 HG3 ARG A 47 3.957 -27.538 -17.818 1.00 0.00 H new ATOM 0 HD2 ARG A 47 1.583 -27.906 -18.134 1.00 0.00 H new ATOM 0 HD3 ARG A 47 1.360 -28.374 -16.460 1.00 0.00 H new ATOM 0 HE ARG A 47 2.327 -25.611 -16.863 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -0.481 -27.745 -16.361 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -1.527 -26.420 -15.840 1.00 0.00 H new ATOM 0 HH21 ARG A 47 0.952 -23.945 -16.195 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -0.722 -24.291 -15.748 1.00 0.00 H new ATOM 391 N GLY A 48 3.168 -29.173 -20.535 1.00 0.00 N ATOM 392 CA GLY A 48 2.176 -28.721 -21.519 1.00 0.00 C ATOM 393 C GLY A 48 1.518 -27.409 -21.120 1.00 0.00 C ATOM 394 O GLY A 48 0.295 -27.268 -21.211 1.00 0.00 O ATOM 0 H GLY A 48 4.125 -28.889 -20.747 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.659 -28.602 -22.489 1.00 0.00 H new ATOM 0 HA3 GLY A 48 1.410 -29.487 -21.637 1.00 0.00 H new ATOM 398 N GLU A 49 2.355 -26.461 -20.663 1.00 0.00 N ATOM 399 CA GLU A 49 1.927 -25.113 -20.216 1.00 0.00 C ATOM 400 C GLU A 49 1.213 -24.366 -21.357 1.00 0.00 C ATOM 401 O GLU A 49 0.024 -24.042 -21.278 1.00 0.00 O ATOM 402 CB GLU A 49 3.190 -24.327 -19.773 1.00 0.00 C ATOM 403 CG GLU A 49 2.954 -22.911 -19.205 1.00 0.00 C ATOM 404 CD GLU A 49 2.263 -22.908 -17.835 1.00 0.00 C ATOM 405 OE1 GLU A 49 2.844 -23.451 -16.867 1.00 0.00 O ATOM 406 OE2 GLU A 49 1.131 -22.393 -17.713 1.00 0.00 O ATOM 0 H GLU A 49 3.362 -26.606 -20.591 1.00 0.00 H new ATOM 0 HA GLU A 49 1.227 -25.204 -19.386 1.00 0.00 H new ATOM 0 HB2 GLU A 49 3.711 -24.915 -19.018 1.00 0.00 H new ATOM 0 HB3 GLU A 49 3.859 -24.244 -20.630 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.912 -22.398 -19.121 1.00 0.00 H new ATOM 0 HG3 GLU A 49 2.348 -22.342 -19.910 1.00 0.00 H new ATOM 413 N ILE A 50 1.983 -24.132 -22.421 1.00 0.00 N ATOM 414 CA ILE A 50 1.572 -23.404 -23.620 1.00 0.00 C ATOM 415 C ILE A 50 1.588 -24.413 -24.793 1.00 0.00 C ATOM 416 O ILE A 50 2.247 -25.453 -24.687 1.00 0.00 O ATOM 417 CB ILE A 50 2.586 -22.195 -23.853 1.00 0.00 C ATOM 418 CG1 ILE A 50 2.552 -21.205 -22.649 1.00 0.00 C ATOM 419 CG2 ILE A 50 2.360 -21.423 -25.179 1.00 0.00 C ATOM 420 CD1 ILE A 50 1.204 -20.536 -22.395 1.00 0.00 C ATOM 0 H ILE A 50 2.948 -24.458 -22.472 1.00 0.00 H new ATOM 0 HA ILE A 50 0.572 -22.981 -23.530 1.00 0.00 H new ATOM 0 HB ILE A 50 3.571 -22.655 -23.931 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.848 -21.743 -21.748 1.00 0.00 H new ATOM 0 HG13 ILE A 50 3.299 -20.429 -22.816 1.00 0.00 H new ATOM 0 HG21 ILE A 50 3.090 -20.618 -25.260 1.00 0.00 H new ATOM 0 HG22 ILE A 50 2.477 -22.105 -26.021 1.00 0.00 H new ATOM 0 HG23 ILE A 50 1.354 -21.003 -25.189 1.00 0.00 H new ATOM 0 HD11 ILE A 50 1.285 -19.868 -21.538 1.00 0.00 H new ATOM 0 HD12 ILE A 50 0.910 -19.964 -23.275 1.00 0.00 H new ATOM 0 HD13 ILE A 50 0.452 -21.298 -22.190 1.00 0.00 H new ATOM 432 N PRO A 51 0.814 -24.190 -25.896 1.00 0.00 N ATOM 433 CA PRO A 51 1.033 -24.926 -27.163 1.00 0.00 C ATOM 434 C PRO A 51 2.448 -24.651 -27.757 1.00 0.00 C ATOM 435 O PRO A 51 3.232 -23.872 -27.198 1.00 0.00 O ATOM 436 CB PRO A 51 -0.118 -24.417 -28.084 1.00 0.00 C ATOM 437 CG PRO A 51 -0.600 -23.142 -27.460 1.00 0.00 C ATOM 438 CD PRO A 51 -0.368 -23.296 -25.970 1.00 0.00 C ATOM 0 HA PRO A 51 1.009 -26.008 -27.037 1.00 0.00 H new ATOM 0 HB2 PRO A 51 0.239 -24.246 -29.099 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -0.922 -25.150 -28.148 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -0.055 -22.284 -27.854 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -1.655 -22.976 -27.676 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -0.176 -22.335 -25.492 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.234 -23.732 -25.472 1.00 0.00 H new ATOM 446 N ARG A 52 2.764 -25.282 -28.896 1.00 0.00 N ATOM 447 CA ARG A 52 4.094 -25.149 -29.557 1.00 0.00 C ATOM 448 C ARG A 52 4.187 -23.842 -30.386 1.00 0.00 C ATOM 449 O ARG A 52 4.848 -23.807 -31.433 1.00 0.00 O ATOM 450 CB ARG A 52 4.350 -26.385 -30.469 1.00 0.00 C ATOM 451 CG ARG A 52 4.328 -27.751 -29.749 1.00 0.00 C ATOM 452 CD ARG A 52 4.722 -28.915 -30.682 1.00 0.00 C ATOM 453 NE ARG A 52 6.105 -28.761 -31.189 1.00 0.00 N ATOM 454 CZ ARG A 52 6.527 -28.980 -32.449 1.00 0.00 C ATOM 455 NH1 ARG A 52 5.690 -29.377 -33.393 1.00 0.00 N ATOM 456 NH2 ARG A 52 7.802 -28.798 -32.751 1.00 0.00 N ATOM 0 H ARG A 52 2.119 -25.897 -29.392 1.00 0.00 H new ATOM 0 HA ARG A 52 4.859 -25.103 -28.782 1.00 0.00 H new ATOM 0 HB2 ARG A 52 3.598 -26.396 -31.258 1.00 0.00 H new ATOM 0 HB3 ARG A 52 5.319 -26.264 -30.954 1.00 0.00 H new ATOM 0 HG2 ARG A 52 5.011 -27.722 -28.900 1.00 0.00 H new ATOM 0 HG3 ARG A 52 3.330 -27.932 -29.349 1.00 0.00 H new ATOM 0 HD2 ARG A 52 4.634 -29.859 -30.145 1.00 0.00 H new ATOM 0 HD3 ARG A 52 4.029 -28.960 -31.522 1.00 0.00 H new ATOM 0 HE ARG A 52 6.809 -28.458 -30.516 1.00 0.00 H new ATOM 0 HH11 ARG A 52 4.705 -29.523 -33.173 1.00 0.00 H new ATOM 0 HH12 ARG A 52 6.030 -29.537 -34.341 1.00 0.00 H new ATOM 0 HH21 ARG A 52 8.458 -28.494 -32.032 1.00 0.00 H new ATOM 0 HH22 ARG A 52 8.129 -28.962 -33.703 1.00 0.00 H new ATOM 470 N GLY A 53 3.556 -22.759 -29.881 1.00 0.00 N ATOM 471 CA GLY A 53 3.328 -21.545 -30.663 1.00 0.00 C ATOM 472 C GLY A 53 2.320 -21.760 -31.790 1.00 0.00 C ATOM 473 O GLY A 53 2.224 -20.950 -32.713 1.00 0.00 O ATOM 0 H GLY A 53 3.197 -22.711 -28.927 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.970 -20.754 -30.005 1.00 0.00 H new ATOM 0 HA3 GLY A 53 4.274 -21.205 -31.085 1.00 0.00 H new ATOM 477 N GLU A 54 1.569 -22.871 -31.706 1.00 0.00 N ATOM 478 CA GLU A 54 0.643 -23.319 -32.752 1.00 0.00 C ATOM 479 C GLU A 54 -0.791 -23.291 -32.241 1.00 0.00 C ATOM 480 O GLU A 54 -1.038 -23.204 -31.030 1.00 0.00 O ATOM 481 CB GLU A 54 1.015 -24.760 -33.212 1.00 0.00 C ATOM 482 CG GLU A 54 2.351 -24.876 -33.967 1.00 0.00 C ATOM 483 CD GLU A 54 2.374 -24.055 -35.270 1.00 0.00 C ATOM 484 OE1 GLU A 54 1.694 -24.454 -36.240 1.00 0.00 O ATOM 485 OE2 GLU A 54 3.047 -23.002 -35.321 1.00 0.00 O ATOM 0 H GLU A 54 1.591 -23.490 -30.896 1.00 0.00 H new ATOM 0 HA GLU A 54 0.724 -22.641 -33.602 1.00 0.00 H new ATOM 0 HB2 GLU A 54 1.053 -25.407 -32.335 1.00 0.00 H new ATOM 0 HB3 GLU A 54 0.218 -25.138 -33.853 1.00 0.00 H new ATOM 0 HG2 GLU A 54 3.160 -24.541 -33.318 1.00 0.00 H new ATOM 0 HG3 GLU A 54 2.542 -25.924 -34.200 1.00 0.00 H new ATOM 492 N SER A 55 -1.729 -23.341 -33.187 1.00 0.00 N ATOM 493 CA SER A 55 -3.154 -23.485 -32.913 1.00 0.00 C ATOM 494 C SER A 55 -3.428 -24.908 -32.394 1.00 0.00 C ATOM 495 O SER A 55 -3.285 -25.883 -33.138 1.00 0.00 O ATOM 496 CB SER A 55 -3.934 -23.193 -34.205 1.00 0.00 C ATOM 497 OG SER A 55 -3.653 -21.891 -34.694 1.00 0.00 O ATOM 0 H SER A 55 -1.513 -23.281 -34.182 1.00 0.00 H new ATOM 0 HA SER A 55 -3.477 -22.780 -32.147 1.00 0.00 H new ATOM 0 HB2 SER A 55 -3.676 -23.932 -34.963 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.003 -23.290 -34.017 1.00 0.00 H new ATOM 0 HG SER A 55 -4.421 -21.306 -34.526 1.00 0.00 H new ATOM 503 N LEU A 56 -3.780 -25.011 -31.104 1.00 0.00 N ATOM 504 CA LEU A 56 -3.934 -26.311 -30.403 1.00 0.00 C ATOM 505 C LEU A 56 -5.250 -27.035 -30.812 1.00 0.00 C ATOM 506 O LEU A 56 -6.033 -26.513 -31.612 1.00 0.00 O ATOM 507 CB LEU A 56 -3.805 -26.094 -28.847 1.00 0.00 C ATOM 508 CG LEU A 56 -4.582 -24.879 -28.220 1.00 0.00 C ATOM 509 CD1 LEU A 56 -6.091 -25.044 -28.337 1.00 0.00 C ATOM 510 CD2 LEU A 56 -4.186 -24.600 -26.753 1.00 0.00 C ATOM 0 H LEU A 56 -3.967 -24.202 -30.511 1.00 0.00 H new ATOM 0 HA LEU A 56 -3.130 -26.979 -30.711 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -4.144 -27.003 -28.351 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -2.748 -25.977 -28.610 1.00 0.00 H new ATOM 0 HG LEU A 56 -4.284 -24.011 -28.808 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -6.587 -24.182 -27.891 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.368 -25.118 -29.388 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -6.399 -25.950 -27.815 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -4.756 -23.751 -26.377 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -4.401 -25.479 -26.145 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -3.121 -24.374 -26.700 1.00 0.00 H new ATOM 522 N ASP A 57 -5.481 -28.229 -30.235 1.00 0.00 N ATOM 523 CA ASP A 57 -6.656 -29.088 -30.542 1.00 0.00 C ATOM 524 C ASP A 57 -7.700 -29.056 -29.394 1.00 0.00 C ATOM 525 O ASP A 57 -8.845 -29.503 -29.554 1.00 0.00 O ATOM 526 CB ASP A 57 -6.161 -30.546 -30.786 1.00 0.00 C ATOM 527 CG ASP A 57 -7.267 -31.537 -31.207 1.00 0.00 C ATOM 528 OD1 ASP A 57 -7.543 -31.659 -32.420 1.00 0.00 O ATOM 529 OD2 ASP A 57 -7.865 -32.194 -30.331 1.00 0.00 O ATOM 0 H ASP A 57 -4.857 -28.634 -29.537 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.148 -28.706 -31.436 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -5.392 -30.530 -31.558 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -5.690 -30.913 -29.874 1.00 0.00 H new ATOM 534 N GLU A 58 -7.315 -28.436 -28.265 1.00 0.00 N ATOM 535 CA GLU A 58 -8.021 -28.560 -26.961 1.00 0.00 C ATOM 536 C GLU A 58 -8.128 -27.187 -26.269 1.00 0.00 C ATOM 537 O GLU A 58 -7.125 -26.637 -25.800 1.00 0.00 O ATOM 538 CB GLU A 58 -7.265 -29.546 -26.032 1.00 0.00 C ATOM 539 CG GLU A 58 -7.218 -30.998 -26.530 1.00 0.00 C ATOM 540 CD GLU A 58 -6.275 -31.876 -25.694 1.00 0.00 C ATOM 541 OE1 GLU A 58 -6.703 -32.365 -24.632 1.00 0.00 O ATOM 542 OE2 GLU A 58 -5.101 -32.069 -26.086 1.00 0.00 O ATOM 0 H GLU A 58 -6.498 -27.827 -28.223 1.00 0.00 H new ATOM 0 HA GLU A 58 -9.024 -28.941 -27.154 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -6.243 -29.189 -25.902 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -7.736 -29.530 -25.049 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -8.222 -31.421 -26.503 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -6.895 -31.012 -27.571 1.00 0.00 H new ATOM 549 N CYS A 59 -9.349 -26.638 -26.261 1.00 0.00 N ATOM 550 CA CYS A 59 -9.717 -25.380 -25.561 1.00 0.00 C ATOM 551 C CYS A 59 -9.197 -25.316 -24.107 1.00 0.00 C ATOM 552 O CYS A 59 -9.455 -26.217 -23.330 1.00 0.00 O ATOM 553 CB CYS A 59 -11.250 -25.296 -25.566 1.00 0.00 C ATOM 554 SG CYS A 59 -11.963 -23.922 -24.629 1.00 0.00 S ATOM 0 H CYS A 59 -10.137 -27.061 -26.752 1.00 0.00 H new ATOM 0 HA CYS A 59 -9.254 -24.542 -26.082 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -11.588 -25.221 -26.600 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -11.648 -26.229 -25.167 1.00 0.00 H new ATOM 559 N GLU A 60 -8.476 -24.242 -23.742 1.00 0.00 N ATOM 560 CA GLU A 60 -7.951 -24.058 -22.360 1.00 0.00 C ATOM 561 C GLU A 60 -9.057 -23.667 -21.339 1.00 0.00 C ATOM 562 O GLU A 60 -8.798 -23.608 -20.133 1.00 0.00 O ATOM 563 CB GLU A 60 -6.828 -22.990 -22.362 1.00 0.00 C ATOM 564 CG GLU A 60 -7.282 -21.601 -22.855 1.00 0.00 C ATOM 565 CD GLU A 60 -6.211 -20.513 -22.726 1.00 0.00 C ATOM 566 OE1 GLU A 60 -5.033 -20.763 -23.069 1.00 0.00 O ATOM 567 OE2 GLU A 60 -6.546 -19.392 -22.313 1.00 0.00 O ATOM 0 H GLU A 60 -8.238 -23.482 -24.379 1.00 0.00 H new ATOM 0 HA GLU A 60 -7.552 -25.020 -22.039 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -6.431 -22.893 -21.351 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -6.011 -23.339 -22.993 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -7.583 -21.678 -23.900 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -8.164 -21.297 -22.291 1.00 0.00 H new ATOM 574 N GLU A 61 -10.286 -23.399 -21.825 1.00 0.00 N ATOM 575 CA GLU A 61 -11.423 -22.986 -20.966 1.00 0.00 C ATOM 576 C GLU A 61 -12.271 -24.183 -20.540 1.00 0.00 C ATOM 577 O GLU A 61 -12.745 -24.238 -19.404 1.00 0.00 O ATOM 578 CB GLU A 61 -12.326 -21.974 -21.703 1.00 0.00 C ATOM 579 CG GLU A 61 -11.609 -20.715 -22.176 1.00 0.00 C ATOM 580 CD GLU A 61 -11.016 -19.856 -21.046 1.00 0.00 C ATOM 581 OE1 GLU A 61 -11.766 -19.473 -20.127 1.00 0.00 O ATOM 582 OE2 GLU A 61 -9.809 -19.537 -21.083 1.00 0.00 O ATOM 0 H GLU A 61 -10.521 -23.461 -22.816 1.00 0.00 H new ATOM 0 HA GLU A 61 -10.996 -22.522 -20.077 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -12.774 -22.467 -22.565 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -13.142 -21.685 -21.041 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -10.807 -21.003 -22.856 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.309 -20.107 -22.748 1.00 0.00 H new ATOM 589 N CYS A 62 -12.480 -25.137 -21.465 1.00 0.00 N ATOM 590 CA CYS A 62 -13.417 -26.256 -21.220 1.00 0.00 C ATOM 591 C CYS A 62 -12.988 -27.554 -21.939 1.00 0.00 C ATOM 592 O CYS A 62 -13.773 -28.495 -22.033 1.00 0.00 O ATOM 593 CB CYS A 62 -14.854 -25.824 -21.617 1.00 0.00 C ATOM 594 SG CYS A 62 -15.177 -25.687 -23.402 1.00 0.00 S ATOM 0 H CYS A 62 -12.022 -25.160 -22.376 1.00 0.00 H new ATOM 0 HA CYS A 62 -13.399 -26.489 -20.155 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -15.558 -26.540 -21.194 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -15.064 -24.860 -21.154 1.00 0.00 H new ATOM 599 N GLY A 63 -11.718 -27.600 -22.406 1.00 0.00 N ATOM 600 CA GLY A 63 -11.139 -28.770 -23.117 1.00 0.00 C ATOM 601 C GLY A 63 -11.883 -29.206 -24.379 1.00 0.00 C ATOM 602 O GLY A 63 -11.642 -30.296 -24.902 1.00 0.00 O ATOM 0 H GLY A 63 -11.062 -26.826 -22.301 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -10.109 -28.537 -23.386 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -11.105 -29.613 -22.426 1.00 0.00 H new ATOM 606 N ALA A 64 -12.749 -28.320 -24.886 1.00 0.00 N ATOM 607 CA ALA A 64 -13.648 -28.606 -26.014 1.00 0.00 C ATOM 608 C ALA A 64 -12.866 -28.604 -27.346 1.00 0.00 C ATOM 609 O ALA A 64 -11.875 -27.859 -27.461 1.00 0.00 O ATOM 610 CB ALA A 64 -14.781 -27.569 -26.033 1.00 0.00 C ATOM 0 H ALA A 64 -12.847 -27.373 -24.521 1.00 0.00 H new ATOM 0 HA ALA A 64 -14.081 -29.599 -25.891 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -15.450 -27.777 -26.868 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -15.339 -27.623 -25.098 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -14.359 -26.571 -26.147 1.00 0.00 H new ATOM 616 N PRO A 65 -13.303 -29.414 -28.369 1.00 0.00 N ATOM 617 CA PRO A 65 -12.580 -29.549 -29.653 1.00 0.00 C ATOM 618 C PRO A 65 -12.435 -28.201 -30.382 1.00 0.00 C ATOM 619 O PRO A 65 -13.429 -27.542 -30.684 1.00 0.00 O ATOM 620 CB PRO A 65 -13.462 -30.536 -30.472 1.00 0.00 C ATOM 621 CG PRO A 65 -14.812 -30.456 -29.831 1.00 0.00 C ATOM 622 CD PRO A 65 -14.536 -30.253 -28.364 1.00 0.00 C ATOM 0 HA PRO A 65 -11.559 -29.903 -29.513 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -13.505 -30.251 -31.523 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -13.064 -31.550 -30.433 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -15.395 -29.631 -30.241 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -15.385 -31.367 -30.002 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -15.364 -29.751 -27.863 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -14.378 -31.200 -27.848 1.00 0.00 H new ATOM 630 N ILE A 66 -11.191 -27.781 -30.582 1.00 0.00 N ATOM 631 CA ILE A 66 -10.856 -26.599 -31.381 1.00 0.00 C ATOM 632 C ILE A 66 -11.101 -26.891 -32.879 1.00 0.00 C ATOM 633 O ILE A 66 -10.453 -27.786 -33.424 1.00 0.00 O ATOM 634 CB ILE A 66 -9.356 -26.206 -31.135 1.00 0.00 C ATOM 635 CG1 ILE A 66 -9.126 -25.895 -29.637 1.00 0.00 C ATOM 636 CG2 ILE A 66 -8.915 -25.018 -32.031 1.00 0.00 C ATOM 637 CD1 ILE A 66 -9.614 -24.553 -29.180 1.00 0.00 C ATOM 0 H ILE A 66 -10.376 -28.253 -30.192 1.00 0.00 H new ATOM 0 HA ILE A 66 -11.492 -25.766 -31.082 1.00 0.00 H new ATOM 0 HB ILE A 66 -8.735 -27.057 -31.413 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -9.619 -26.664 -29.043 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -8.059 -25.966 -29.428 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -7.871 -24.778 -31.829 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -9.028 -25.292 -33.080 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.535 -24.149 -31.814 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.406 -24.433 -28.117 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -9.103 -23.770 -29.741 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -10.688 -24.479 -29.350 1.00 0.00 H new ATOM 649 N PRO A 67 -12.045 -26.167 -33.561 1.00 0.00 N ATOM 650 CA PRO A 67 -12.276 -26.335 -35.009 1.00 0.00 C ATOM 651 C PRO A 67 -11.165 -25.654 -35.829 1.00 0.00 C ATOM 652 O PRO A 67 -10.563 -24.662 -35.377 1.00 0.00 O ATOM 653 CB PRO A 67 -13.656 -25.669 -35.234 1.00 0.00 C ATOM 654 CG PRO A 67 -13.735 -24.611 -34.182 1.00 0.00 C ATOM 655 CD PRO A 67 -12.954 -25.137 -32.986 1.00 0.00 C ATOM 0 HA PRO A 67 -12.262 -27.377 -35.329 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -13.732 -25.242 -36.234 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -14.467 -26.391 -35.133 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -13.311 -23.673 -34.541 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -14.771 -24.409 -33.911 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -12.393 -24.341 -32.496 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -13.618 -25.567 -32.236 1.00 0.00 H new ATOM 663 N GLN A 68 -10.919 -26.184 -37.041 1.00 0.00 N ATOM 664 CA GLN A 68 -9.856 -25.692 -37.939 1.00 0.00 C ATOM 665 C GLN A 68 -10.105 -24.230 -38.355 1.00 0.00 C ATOM 666 O GLN A 68 -9.166 -23.526 -38.718 1.00 0.00 O ATOM 667 CB GLN A 68 -9.710 -26.617 -39.182 1.00 0.00 C ATOM 668 CG GLN A 68 -10.857 -26.538 -40.231 1.00 0.00 C ATOM 669 CD GLN A 68 -10.474 -25.781 -41.512 1.00 0.00 C ATOM 670 OE1 GLN A 68 -10.610 -24.460 -41.512 1.00 0.00 O flip ATOM 671 NE2 GLN A 68 -10.012 -26.376 -42.483 1.00 0.00 N flip ATOM 0 H GLN A 68 -11.451 -26.965 -37.426 1.00 0.00 H new ATOM 0 HA GLN A 68 -8.915 -25.718 -37.389 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -8.771 -26.376 -39.681 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -9.632 -27.648 -38.836 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -11.165 -27.549 -40.496 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -11.720 -26.051 -39.776 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.917 -27.391 -42.461 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.724 -25.855 -43.311 1.00 0.00 H new ATOM 680 N ALA A 69 -11.388 -23.800 -38.280 1.00 0.00 N ATOM 681 CA ALA A 69 -11.820 -22.425 -38.597 1.00 0.00 C ATOM 682 C ALA A 69 -11.178 -21.415 -37.631 1.00 0.00 C ATOM 683 O ALA A 69 -10.684 -20.370 -38.044 1.00 0.00 O ATOM 684 CB ALA A 69 -13.353 -22.330 -38.543 1.00 0.00 C ATOM 0 H ALA A 69 -12.156 -24.407 -37.995 1.00 0.00 H new ATOM 0 HA ALA A 69 -11.490 -22.180 -39.606 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -13.663 -21.312 -38.778 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -13.786 -23.018 -39.269 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -13.699 -22.593 -37.543 1.00 0.00 H new ATOM 690 N ARG A 70 -11.175 -21.754 -36.337 1.00 0.00 N ATOM 691 CA ARG A 70 -10.540 -20.919 -35.292 1.00 0.00 C ATOM 692 C ARG A 70 -9.011 -20.912 -35.451 1.00 0.00 C ATOM 693 O ARG A 70 -8.350 -19.916 -35.144 1.00 0.00 O ATOM 694 CB ARG A 70 -10.966 -21.401 -33.883 1.00 0.00 C ATOM 695 CG ARG A 70 -12.484 -21.265 -33.586 1.00 0.00 C ATOM 696 CD ARG A 70 -12.997 -19.804 -33.564 1.00 0.00 C ATOM 697 NE ARG A 70 -13.014 -19.166 -34.896 1.00 0.00 N ATOM 698 CZ ARG A 70 -12.893 -17.854 -35.138 1.00 0.00 C ATOM 699 NH1 ARG A 70 -12.760 -16.985 -34.143 1.00 0.00 N ATOM 700 NH2 ARG A 70 -12.914 -17.422 -36.384 1.00 0.00 N ATOM 0 H ARG A 70 -11.607 -22.606 -35.979 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.883 -19.891 -35.411 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -10.679 -22.446 -33.768 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -10.411 -20.834 -33.136 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -13.042 -21.823 -34.338 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -12.697 -21.728 -32.623 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -14.005 -19.787 -33.149 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -12.367 -19.216 -32.896 1.00 0.00 H new ATOM 0 HE ARG A 70 -13.128 -19.779 -35.703 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -12.749 -17.313 -33.177 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -12.669 -15.989 -34.344 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -13.022 -18.085 -37.152 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -12.823 -16.425 -36.580 1.00 0.00 H new ATOM 714 N ARG A 71 -8.480 -22.040 -35.953 1.00 0.00 N ATOM 715 CA ARG A 71 -7.038 -22.240 -36.177 1.00 0.00 C ATOM 716 C ARG A 71 -6.522 -21.398 -37.357 1.00 0.00 C ATOM 717 O ARG A 71 -5.427 -20.826 -37.284 1.00 0.00 O ATOM 718 CB ARG A 71 -6.738 -23.742 -36.424 1.00 0.00 C ATOM 719 CG ARG A 71 -7.254 -24.688 -35.322 1.00 0.00 C ATOM 720 CD ARG A 71 -6.852 -26.149 -35.572 1.00 0.00 C ATOM 721 NE ARG A 71 -7.585 -27.083 -34.705 1.00 0.00 N ATOM 722 CZ ARG A 71 -7.148 -28.290 -34.331 1.00 0.00 C ATOM 723 NH1 ARG A 71 -5.925 -28.708 -34.639 1.00 0.00 N ATOM 724 NH2 ARG A 71 -7.941 -29.070 -33.632 1.00 0.00 N ATOM 0 H ARG A 71 -9.046 -22.847 -36.217 1.00 0.00 H new ATOM 0 HA ARG A 71 -6.516 -21.909 -35.279 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -7.182 -24.036 -37.375 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.660 -23.873 -36.522 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.862 -24.366 -34.357 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -8.340 -24.617 -35.265 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -7.039 -26.402 -36.616 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -5.781 -26.263 -35.403 1.00 0.00 H new ATOM 0 HE ARG A 71 -8.499 -26.787 -34.362 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -5.299 -28.104 -35.171 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -5.613 -29.633 -34.343 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -8.877 -28.752 -33.381 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -7.620 -29.993 -33.340 1.00 0.00 H new ATOM 738 N GLU A 72 -7.329 -21.310 -38.436 1.00 0.00 N ATOM 739 CA GLU A 72 -6.921 -20.621 -39.682 1.00 0.00 C ATOM 740 C GLU A 72 -7.158 -19.115 -39.559 1.00 0.00 C ATOM 741 O GLU A 72 -6.434 -18.314 -40.160 1.00 0.00 O ATOM 742 CB GLU A 72 -7.598 -21.240 -40.945 1.00 0.00 C ATOM 743 CG GLU A 72 -9.147 -21.302 -40.963 1.00 0.00 C ATOM 744 CD GLU A 72 -9.849 -20.025 -41.465 1.00 0.00 C ATOM 745 OE1 GLU A 72 -9.775 -19.741 -42.675 1.00 0.00 O ATOM 746 OE2 GLU A 72 -10.502 -19.325 -40.670 1.00 0.00 O ATOM 0 H GLU A 72 -8.268 -21.707 -38.470 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.851 -20.773 -39.821 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -7.273 -20.670 -41.815 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -7.218 -22.254 -41.068 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -9.454 -22.137 -41.592 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -9.498 -21.517 -39.954 1.00 0.00 H new ATOM 753 N ALA A 73 -8.175 -18.747 -38.771 1.00 0.00 N ATOM 754 CA ALA A 73 -8.450 -17.349 -38.410 1.00 0.00 C ATOM 755 C ALA A 73 -7.356 -16.802 -37.477 1.00 0.00 C ATOM 756 O ALA A 73 -6.842 -15.693 -37.682 1.00 0.00 O ATOM 757 CB ALA A 73 -9.832 -17.237 -37.744 1.00 0.00 C ATOM 0 H ALA A 73 -8.833 -19.412 -38.364 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.450 -16.750 -39.320 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -10.026 -16.197 -37.481 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.599 -17.585 -38.436 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -9.852 -17.849 -36.843 1.00 0.00 H new ATOM 763 N ILE A 74 -7.002 -17.605 -36.448 1.00 0.00 N ATOM 764 CA ILE A 74 -6.093 -17.182 -35.365 1.00 0.00 C ATOM 765 C ILE A 74 -4.937 -18.198 -35.217 1.00 0.00 C ATOM 766 O ILE A 74 -5.162 -19.313 -34.720 1.00 0.00 O ATOM 767 CB ILE A 74 -6.859 -17.043 -33.991 1.00 0.00 C ATOM 768 CG1 ILE A 74 -8.131 -16.156 -34.169 1.00 0.00 C ATOM 769 CG2 ILE A 74 -5.926 -16.489 -32.876 1.00 0.00 C ATOM 770 CD1 ILE A 74 -8.948 -15.945 -32.913 1.00 0.00 C ATOM 0 H ILE A 74 -7.339 -18.562 -36.348 1.00 0.00 H new ATOM 0 HA ILE A 74 -5.690 -16.205 -35.630 1.00 0.00 H new ATOM 0 HB ILE A 74 -7.179 -18.035 -33.674 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -7.825 -15.183 -34.553 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -8.769 -16.611 -34.927 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.484 -16.405 -31.943 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -5.084 -17.167 -32.736 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -5.556 -15.506 -33.167 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -9.809 -15.317 -33.140 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -9.291 -16.908 -32.536 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -8.333 -15.458 -32.156 1.00 0.00 H new ATOM 782 N PRO A 75 -3.690 -17.849 -35.684 1.00 0.00 N ATOM 783 CA PRO A 75 -2.482 -18.652 -35.401 1.00 0.00 C ATOM 784 C PRO A 75 -2.150 -18.607 -33.890 1.00 0.00 C ATOM 785 O PRO A 75 -1.899 -17.530 -33.329 1.00 0.00 O ATOM 786 CB PRO A 75 -1.380 -17.977 -36.267 1.00 0.00 C ATOM 787 CG PRO A 75 -1.864 -16.571 -36.472 1.00 0.00 C ATOM 788 CD PRO A 75 -3.375 -16.667 -36.533 1.00 0.00 C ATOM 0 HA PRO A 75 -2.593 -19.710 -35.641 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -0.414 -17.994 -35.762 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.252 -18.494 -37.218 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -1.545 -15.923 -35.656 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -1.460 -16.147 -37.392 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -3.849 -15.763 -36.152 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.726 -16.804 -37.556 1.00 0.00 H new ATOM 796 N GLY A 76 -2.199 -19.778 -33.243 1.00 0.00 N ATOM 797 CA GLY A 76 -2.016 -19.881 -31.793 1.00 0.00 C ATOM 798 C GLY A 76 -3.319 -19.687 -31.026 1.00 0.00 C ATOM 799 O GLY A 76 -3.312 -19.151 -29.907 1.00 0.00 O ATOM 0 H GLY A 76 -2.365 -20.672 -33.706 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -1.598 -20.858 -31.551 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -1.292 -19.135 -31.467 1.00 0.00 H new ATOM 803 N VAL A 77 -4.449 -20.121 -31.633 1.00 0.00 N ATOM 804 CA VAL A 77 -5.765 -20.100 -30.964 1.00 0.00 C ATOM 805 C VAL A 77 -5.763 -21.096 -29.792 1.00 0.00 C ATOM 806 O VAL A 77 -5.145 -22.164 -29.878 1.00 0.00 O ATOM 807 CB VAL A 77 -6.959 -20.430 -31.942 1.00 0.00 C ATOM 808 CG1 VAL A 77 -6.858 -21.859 -32.515 1.00 0.00 C ATOM 809 CG2 VAL A 77 -8.328 -20.217 -31.247 1.00 0.00 C ATOM 0 H VAL A 77 -4.472 -20.489 -32.584 1.00 0.00 H new ATOM 0 HA VAL A 77 -5.924 -19.084 -30.602 1.00 0.00 H new ATOM 0 HB VAL A 77 -6.886 -19.734 -32.778 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -7.700 -22.044 -33.183 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.925 -21.964 -33.069 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.878 -22.581 -31.698 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -9.131 -20.452 -31.945 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -8.400 -20.870 -30.378 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -8.417 -19.178 -30.929 1.00 0.00 H new ATOM 819 N ARG A 78 -6.447 -20.728 -28.700 1.00 0.00 N ATOM 820 CA ARG A 78 -6.534 -21.551 -27.485 1.00 0.00 C ATOM 821 C ARG A 78 -7.979 -21.648 -26.949 1.00 0.00 C ATOM 822 O ARG A 78 -8.229 -22.235 -25.897 1.00 0.00 O ATOM 823 CB ARG A 78 -5.498 -21.047 -26.422 1.00 0.00 C ATOM 824 CG ARG A 78 -5.232 -19.515 -26.355 1.00 0.00 C ATOM 825 CD ARG A 78 -6.455 -18.709 -25.922 1.00 0.00 C ATOM 826 NE ARG A 78 -6.182 -17.273 -25.761 1.00 0.00 N ATOM 827 CZ ARG A 78 -6.668 -16.507 -24.765 1.00 0.00 C ATOM 828 NH1 ARG A 78 -7.325 -17.049 -23.745 1.00 0.00 N ATOM 829 NH2 ARG A 78 -6.460 -15.204 -24.774 1.00 0.00 N ATOM 0 H ARG A 78 -6.958 -19.848 -28.634 1.00 0.00 H new ATOM 0 HA ARG A 78 -6.264 -22.577 -27.734 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -5.837 -21.374 -25.439 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -4.548 -21.546 -26.614 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -4.415 -19.325 -25.659 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -4.904 -19.167 -27.334 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -7.247 -18.840 -26.660 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -6.828 -19.108 -24.979 1.00 0.00 H new ATOM 0 HE ARG A 78 -5.582 -16.825 -26.453 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -7.467 -18.058 -23.709 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -7.687 -16.456 -22.998 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -5.931 -14.777 -25.535 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -6.828 -14.624 -24.020 1.00 0.00 H new ATOM 843 N LEU A 79 -8.936 -21.125 -27.722 1.00 0.00 N ATOM 844 CA LEU A 79 -10.365 -21.076 -27.337 1.00 0.00 C ATOM 845 C LEU A 79 -11.230 -21.766 -28.407 1.00 0.00 C ATOM 846 O LEU A 79 -11.101 -21.458 -29.598 1.00 0.00 O ATOM 847 CB LEU A 79 -10.803 -19.601 -27.170 1.00 0.00 C ATOM 848 CG LEU A 79 -9.974 -18.766 -26.160 1.00 0.00 C ATOM 849 CD1 LEU A 79 -10.273 -17.259 -26.259 1.00 0.00 C ATOM 850 CD2 LEU A 79 -10.167 -19.276 -24.738 1.00 0.00 C ATOM 0 H LEU A 79 -8.748 -20.719 -28.639 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.499 -21.602 -26.392 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -10.754 -19.114 -28.144 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -11.847 -19.584 -26.858 1.00 0.00 H new ATOM 0 HG LEU A 79 -8.925 -18.895 -26.427 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -9.667 -16.719 -25.531 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -10.035 -16.906 -27.262 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -11.329 -17.083 -26.054 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -9.574 -18.672 -24.051 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -11.220 -19.206 -24.466 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -9.845 -20.316 -24.677 1.00 0.00 H new ATOM 862 N CYS A 80 -12.081 -22.732 -27.976 1.00 0.00 N ATOM 863 CA CYS A 80 -13.055 -23.410 -28.876 1.00 0.00 C ATOM 864 C CYS A 80 -14.081 -22.382 -29.335 1.00 0.00 C ATOM 865 O CYS A 80 -14.279 -21.418 -28.615 1.00 0.00 O ATOM 866 CB CYS A 80 -13.760 -24.588 -28.159 1.00 0.00 C ATOM 867 SG CYS A 80 -15.003 -24.090 -26.920 1.00 0.00 S ATOM 0 H CYS A 80 -12.114 -23.060 -27.011 1.00 0.00 H new ATOM 0 HA CYS A 80 -12.524 -23.824 -29.733 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -14.244 -25.215 -28.908 1.00 0.00 H new ATOM 0 HB3 CYS A 80 -13.004 -25.202 -27.669 1.00 0.00 H new ATOM 872 N ILE A 81 -14.774 -22.623 -30.469 1.00 0.00 N ATOM 873 CA ILE A 81 -15.626 -21.605 -31.153 1.00 0.00 C ATOM 874 C ILE A 81 -16.648 -20.925 -30.198 1.00 0.00 C ATOM 875 O ILE A 81 -17.012 -19.774 -30.398 1.00 0.00 O ATOM 876 CB ILE A 81 -16.381 -22.241 -32.384 1.00 0.00 C ATOM 877 CG1 ILE A 81 -17.140 -21.158 -33.222 1.00 0.00 C ATOM 878 CG2 ILE A 81 -17.335 -23.376 -31.937 1.00 0.00 C ATOM 879 CD1 ILE A 81 -17.918 -21.699 -34.413 1.00 0.00 C ATOM 0 H ILE A 81 -14.764 -23.526 -30.942 1.00 0.00 H new ATOM 0 HA ILE A 81 -14.947 -20.827 -31.504 1.00 0.00 H new ATOM 0 HB ILE A 81 -15.624 -22.681 -33.033 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -17.831 -20.629 -32.565 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -16.418 -20.425 -33.581 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -17.839 -23.792 -32.809 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -16.762 -24.159 -31.441 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -18.077 -22.977 -31.246 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -18.409 -20.875 -34.931 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -17.234 -22.201 -35.097 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -18.669 -22.408 -34.065 1.00 0.00 H new ATOM 891 N HIS A 82 -17.027 -21.636 -29.129 1.00 0.00 N ATOM 892 CA HIS A 82 -17.981 -21.154 -28.108 1.00 0.00 C ATOM 893 C HIS A 82 -17.301 -20.125 -27.161 1.00 0.00 C ATOM 894 O HIS A 82 -17.820 -19.021 -26.957 1.00 0.00 O ATOM 895 CB HIS A 82 -18.553 -22.360 -27.312 1.00 0.00 C ATOM 896 CG HIS A 82 -19.009 -23.500 -28.183 1.00 0.00 C ATOM 897 ND1 HIS A 82 -20.275 -23.600 -28.706 1.00 0.00 N ATOM 898 CD2 HIS A 82 -18.328 -24.568 -28.659 1.00 0.00 C ATOM 899 CE1 HIS A 82 -20.349 -24.671 -29.467 1.00 0.00 C ATOM 900 NE2 HIS A 82 -19.181 -25.279 -29.453 1.00 0.00 N ATOM 0 H HIS A 82 -16.678 -22.576 -28.941 1.00 0.00 H new ATOM 0 HA HIS A 82 -18.807 -20.645 -28.605 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -17.790 -22.724 -26.623 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -19.393 -22.019 -26.707 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -17.297 -24.813 -28.449 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -21.222 -24.997 -30.012 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -18.952 -26.138 -29.952 1.00 0.00 H new ATOM 909 N CYS A 83 -16.118 -20.492 -26.611 1.00 0.00 N ATOM 910 CA CYS A 83 -15.314 -19.592 -25.744 1.00 0.00 C ATOM 911 C CYS A 83 -14.552 -18.551 -26.591 1.00 0.00 C ATOM 912 O CYS A 83 -14.026 -17.576 -26.051 1.00 0.00 O ATOM 913 CB CYS A 83 -14.302 -20.386 -24.882 1.00 0.00 C ATOM 914 SG CYS A 83 -15.005 -21.768 -23.923 1.00 0.00 S ATOM 0 H CYS A 83 -15.697 -21.410 -26.753 1.00 0.00 H new ATOM 0 HA CYS A 83 -16.012 -19.081 -25.081 1.00 0.00 H new ATOM 0 HB2 CYS A 83 -13.524 -20.779 -25.536 1.00 0.00 H new ATOM 0 HB3 CYS A 83 -13.819 -19.695 -24.191 1.00 0.00 H new ATOM 919 N GLN A 84 -14.425 -18.801 -27.903 1.00 0.00 N ATOM 920 CA GLN A 84 -13.695 -17.914 -28.810 1.00 0.00 C ATOM 921 C GLN A 84 -14.610 -16.788 -29.294 1.00 0.00 C ATOM 922 O GLN A 84 -14.203 -15.645 -29.259 1.00 0.00 O ATOM 923 CB GLN A 84 -13.079 -18.687 -30.026 1.00 0.00 C ATOM 924 CG GLN A 84 -11.687 -18.186 -30.509 1.00 0.00 C ATOM 925 CD GLN A 84 -11.566 -16.667 -30.627 1.00 0.00 C ATOM 926 OE1 GLN A 84 -11.894 -16.085 -31.653 1.00 0.00 O ATOM 927 NE2 GLN A 84 -11.068 -16.016 -29.580 1.00 0.00 N ATOM 0 H GLN A 84 -14.825 -19.621 -28.360 1.00 0.00 H new ATOM 0 HA GLN A 84 -12.863 -17.485 -28.251 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -12.993 -19.740 -29.758 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -13.776 -18.627 -30.862 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -10.925 -18.546 -29.817 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -11.472 -18.632 -31.480 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -10.804 -16.529 -28.739 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -10.950 -15.004 -29.618 1.00 0.00 H new ATOM 936 N GLN A 85 -15.844 -17.136 -29.734 1.00 0.00 N ATOM 937 CA GLN A 85 -16.758 -16.179 -30.409 1.00 0.00 C ATOM 938 C GLN A 85 -17.053 -14.952 -29.528 1.00 0.00 C ATOM 939 O GLN A 85 -17.158 -13.839 -30.040 1.00 0.00 O ATOM 940 CB GLN A 85 -18.080 -16.852 -30.859 1.00 0.00 C ATOM 941 CG GLN A 85 -18.965 -17.401 -29.721 1.00 0.00 C ATOM 942 CD GLN A 85 -20.229 -18.087 -30.235 1.00 0.00 C ATOM 943 OE1 GLN A 85 -21.284 -17.464 -30.373 1.00 0.00 O ATOM 944 NE2 GLN A 85 -20.115 -19.367 -30.563 1.00 0.00 N ATOM 0 H GLN A 85 -16.231 -18.074 -29.634 1.00 0.00 H new ATOM 0 HA GLN A 85 -16.237 -15.838 -31.303 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -18.660 -16.127 -31.430 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -17.838 -17.672 -31.536 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -18.388 -18.110 -29.127 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -19.245 -16.583 -29.057 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -19.225 -19.849 -30.434 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -20.917 -19.869 -30.944 1.00 0.00 H new ATOM 953 N GLU A 86 -17.148 -15.176 -28.203 1.00 0.00 N ATOM 954 CA GLU A 86 -17.303 -14.099 -27.206 1.00 0.00 C ATOM 955 C GLU A 86 -16.095 -13.126 -27.266 1.00 0.00 C ATOM 956 O GLU A 86 -16.278 -11.913 -27.353 1.00 0.00 O ATOM 957 CB GLU A 86 -17.479 -14.705 -25.781 1.00 0.00 C ATOM 958 CG GLU A 86 -16.352 -15.662 -25.367 1.00 0.00 C ATOM 959 CD GLU A 86 -16.477 -16.212 -23.942 1.00 0.00 C ATOM 960 OE1 GLU A 86 -17.147 -17.247 -23.746 1.00 0.00 O ATOM 961 OE2 GLU A 86 -15.904 -15.611 -23.009 1.00 0.00 O ATOM 0 H GLU A 86 -17.119 -16.110 -27.793 1.00 0.00 H new ATOM 0 HA GLU A 86 -18.200 -13.526 -27.439 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -17.537 -13.893 -25.056 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -18.429 -15.238 -25.739 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -16.328 -16.499 -26.065 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -15.398 -15.142 -25.460 1.00 0.00 H new ATOM 968 N LYS A 87 -14.870 -13.693 -27.313 1.00 0.00 N ATOM 969 CA LYS A 87 -13.601 -12.930 -27.349 1.00 0.00 C ATOM 970 C LYS A 87 -13.326 -12.347 -28.741 1.00 0.00 C ATOM 971 O LYS A 87 -12.625 -11.354 -28.868 1.00 0.00 O ATOM 972 CB LYS A 87 -12.423 -13.848 -26.925 1.00 0.00 C ATOM 973 CG LYS A 87 -12.554 -14.427 -25.503 1.00 0.00 C ATOM 974 CD LYS A 87 -12.653 -13.326 -24.427 1.00 0.00 C ATOM 975 CE LYS A 87 -12.788 -13.885 -23.005 1.00 0.00 C ATOM 976 NZ LYS A 87 -12.906 -12.796 -22.004 1.00 0.00 N ATOM 0 H LYS A 87 -14.732 -14.703 -27.327 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.694 -12.098 -26.651 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -12.345 -14.672 -27.635 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -11.494 -13.282 -26.991 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -13.439 -15.062 -25.452 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -11.694 -15.062 -25.291 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -11.767 -12.694 -24.480 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -13.511 -12.690 -24.644 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -13.665 -14.530 -22.948 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -11.921 -14.503 -22.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -12.996 -13.207 -21.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.058 -12.195 -22.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.747 -12.221 -22.214 1.00 0.00 H new ATOM 990 N ASP A 88 -13.886 -12.993 -29.768 1.00 0.00 N ATOM 991 CA ASP A 88 -13.675 -12.668 -31.187 1.00 0.00 C ATOM 992 C ASP A 88 -14.292 -11.298 -31.529 1.00 0.00 C ATOM 993 O ASP A 88 -13.794 -10.576 -32.404 1.00 0.00 O ATOM 994 CB ASP A 88 -14.293 -13.789 -32.066 1.00 0.00 C ATOM 995 CG ASP A 88 -13.942 -13.672 -33.561 1.00 0.00 C ATOM 996 OD1 ASP A 88 -12.840 -14.109 -33.952 1.00 0.00 O ATOM 997 OD2 ASP A 88 -14.767 -13.176 -34.357 1.00 0.00 O ATOM 0 H ASP A 88 -14.519 -13.782 -29.634 1.00 0.00 H new ATOM 0 HA ASP A 88 -12.605 -12.607 -31.388 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -13.952 -14.756 -31.697 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -15.377 -13.769 -31.954 1.00 0.00 H new ATOM 1002 N LEU A 89 -15.372 -10.960 -30.805 1.00 0.00 N ATOM 1003 CA LEU A 89 -16.064 -9.659 -30.922 1.00 0.00 C ATOM 1004 C LEU A 89 -15.228 -8.546 -30.254 1.00 0.00 C ATOM 1005 O LEU A 89 -15.236 -7.388 -30.693 1.00 0.00 O ATOM 1006 CB LEU A 89 -17.466 -9.728 -30.240 1.00 0.00 C ATOM 1007 CG LEU A 89 -18.312 -11.010 -30.516 1.00 0.00 C ATOM 1008 CD1 LEU A 89 -19.658 -10.979 -29.770 1.00 0.00 C ATOM 1009 CD2 LEU A 89 -18.516 -11.269 -32.029 1.00 0.00 C ATOM 0 H LEU A 89 -15.794 -11.583 -30.117 1.00 0.00 H new ATOM 0 HA LEU A 89 -16.188 -9.432 -31.981 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -17.326 -9.637 -29.163 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -18.045 -8.862 -30.561 1.00 0.00 H new ATOM 0 HG LEU A 89 -17.735 -11.848 -30.124 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -20.216 -11.889 -29.989 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -19.478 -10.913 -28.697 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -20.234 -10.113 -30.095 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -19.111 -12.172 -32.167 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -19.035 -10.421 -32.477 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -17.546 -11.396 -32.510 1.00 0.00 H new ATOM 1021 N GLN A 90 -14.521 -8.925 -29.172 1.00 0.00 N ATOM 1022 CA GLN A 90 -13.813 -7.979 -28.281 1.00 0.00 C ATOM 1023 C GLN A 90 -12.453 -7.602 -28.873 1.00 0.00 C ATOM 1024 O GLN A 90 -12.071 -6.424 -28.883 1.00 0.00 O ATOM 1025 CB GLN A 90 -13.630 -8.603 -26.859 1.00 0.00 C ATOM 1026 CG GLN A 90 -14.862 -9.367 -26.336 1.00 0.00 C ATOM 1027 CD GLN A 90 -16.141 -8.537 -26.237 1.00 0.00 C ATOM 1028 OE1 GLN A 90 -16.118 -7.347 -25.934 1.00 0.00 O ATOM 1029 NE2 GLN A 90 -17.272 -9.161 -26.528 1.00 0.00 N ATOM 0 H GLN A 90 -14.423 -9.900 -28.888 1.00 0.00 H new ATOM 0 HA GLN A 90 -14.415 -7.075 -28.190 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -12.778 -9.283 -26.881 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -13.385 -7.808 -26.155 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -15.049 -10.218 -26.991 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -14.630 -9.769 -25.350 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -17.259 -10.150 -26.776 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -18.156 -8.652 -26.504 1.00 0.00 H new ATOM 1038 N LYS A 91 -11.739 -8.629 -29.372 1.00 0.00 N ATOM 1039 CA LYS A 91 -10.401 -8.473 -29.942 1.00 0.00 C ATOM 1040 C LYS A 91 -10.501 -7.683 -31.273 1.00 0.00 C ATOM 1041 O LYS A 91 -11.426 -7.923 -32.057 1.00 0.00 O ATOM 1042 CB LYS A 91 -9.678 -9.865 -30.089 1.00 0.00 C ATOM 1043 CG LYS A 91 -10.297 -10.883 -31.091 1.00 0.00 C ATOM 1044 CD LYS A 91 -9.827 -10.663 -32.549 1.00 0.00 C ATOM 1045 CE LYS A 91 -10.645 -11.446 -33.574 1.00 0.00 C ATOM 1046 NZ LYS A 91 -10.395 -12.908 -33.517 1.00 0.00 N ATOM 0 H LYS A 91 -12.081 -9.590 -29.388 1.00 0.00 H new ATOM 0 HA LYS A 91 -9.774 -7.893 -29.265 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -8.646 -9.680 -30.388 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.646 -10.335 -29.106 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.035 -11.894 -30.780 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -11.384 -10.808 -31.051 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -9.884 -9.600 -32.785 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -8.780 -10.953 -32.633 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.705 -11.257 -33.406 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -10.410 -11.081 -34.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -11.247 -13.418 -33.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -9.601 -13.149 -34.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -10.161 -13.182 -32.541 1.00 0.00 H new ATOM 1060 N PRO A 92 -9.572 -6.721 -31.538 1.00 0.00 N ATOM 1061 CA PRO A 92 -9.665 -5.827 -32.720 1.00 0.00 C ATOM 1062 C PRO A 92 -9.350 -6.527 -34.066 1.00 0.00 C ATOM 1063 O PRO A 92 -9.809 -6.064 -35.115 1.00 0.00 O ATOM 1064 CB PRO A 92 -8.628 -4.723 -32.382 1.00 0.00 C ATOM 1065 CG PRO A 92 -7.608 -5.403 -31.524 1.00 0.00 C ATOM 1066 CD PRO A 92 -8.379 -6.406 -30.694 1.00 0.00 C ATOM 0 HA PRO A 92 -10.678 -5.456 -32.877 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -8.176 -4.316 -33.286 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -9.095 -3.890 -31.856 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -6.851 -5.897 -32.132 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -7.088 -4.685 -30.889 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -7.786 -7.298 -30.490 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -8.669 -5.989 -29.730 1.00 0.00 H new ATOM 1074 N ALA A 93 -8.557 -7.632 -34.007 1.00 0.00 N ATOM 1075 CA ALA A 93 -8.032 -8.378 -35.192 1.00 0.00 C ATOM 1076 C ALA A 93 -6.941 -7.578 -35.942 1.00 0.00 C ATOM 1077 O ALA A 93 -6.514 -7.959 -37.039 1.00 0.00 O ATOM 1078 CB ALA A 93 -9.164 -8.842 -36.141 1.00 0.00 C ATOM 0 H ALA A 93 -8.258 -8.039 -33.121 1.00 0.00 H new ATOM 0 HA ALA A 93 -7.557 -9.281 -34.807 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -8.733 -9.379 -36.986 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -9.844 -9.501 -35.601 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -9.713 -7.973 -36.505 1.00 0.00 H new ATOM 1084 N TYR A 94 -6.472 -6.489 -35.315 1.00 0.00 N ATOM 1085 CA TYR A 94 -5.355 -5.671 -35.810 1.00 0.00 C ATOM 1086 C TYR A 94 -4.500 -5.221 -34.622 1.00 0.00 C ATOM 1087 O TYR A 94 -4.871 -5.447 -33.461 1.00 0.00 O ATOM 1088 CB TYR A 94 -5.874 -4.446 -36.627 1.00 0.00 C ATOM 1089 CG TYR A 94 -6.797 -3.471 -35.860 1.00 0.00 C ATOM 1090 CD1 TYR A 94 -6.281 -2.498 -34.990 1.00 0.00 C ATOM 1091 CD2 TYR A 94 -8.183 -3.530 -36.001 1.00 0.00 C ATOM 1092 CE1 TYR A 94 -7.109 -1.632 -34.301 1.00 0.00 C ATOM 1093 CE2 TYR A 94 -9.015 -2.664 -35.314 1.00 0.00 C ATOM 1094 CZ TYR A 94 -8.475 -1.720 -34.463 1.00 0.00 C ATOM 1095 OH TYR A 94 -9.311 -0.861 -33.772 1.00 0.00 O ATOM 0 H TYR A 94 -6.864 -6.147 -34.437 1.00 0.00 H new ATOM 0 HA TYR A 94 -4.743 -6.269 -36.485 1.00 0.00 H new ATOM 0 HB2 TYR A 94 -5.014 -3.888 -36.996 1.00 0.00 H new ATOM 0 HB3 TYR A 94 -6.412 -4.816 -37.500 1.00 0.00 H new ATOM 0 HD1 TYR A 94 -5.212 -2.424 -34.856 1.00 0.00 H new ATOM 0 HD2 TYR A 94 -8.616 -4.267 -36.661 1.00 0.00 H new ATOM 0 HE1 TYR A 94 -6.688 -0.890 -33.639 1.00 0.00 H new ATOM 0 HE2 TYR A 94 -10.085 -2.726 -35.443 1.00 0.00 H new ATOM 0 HH TYR A 94 -10.243 -1.057 -34.002 1.00 0.00 H new ATOM 1105 N THR A 95 -3.366 -4.570 -34.908 1.00 0.00 N ATOM 1106 CA THR A 95 -2.559 -3.889 -33.890 1.00 0.00 C ATOM 1107 C THR A 95 -2.483 -2.387 -34.221 1.00 0.00 C ATOM 1108 O THR A 95 -1.804 -1.989 -35.171 1.00 0.00 O ATOM 1109 CB THR A 95 -1.119 -4.505 -33.769 1.00 0.00 C ATOM 1110 OG1 THR A 95 -0.502 -4.573 -35.056 1.00 0.00 O ATOM 1111 CG2 THR A 95 -1.135 -5.913 -33.142 1.00 0.00 C ATOM 0 H THR A 95 -2.983 -4.501 -35.851 1.00 0.00 H new ATOM 0 HA THR A 95 -3.042 -4.027 -32.923 1.00 0.00 H new ATOM 0 HB THR A 95 -0.548 -3.849 -33.111 1.00 0.00 H new ATOM 0 HG1 THR A 95 -0.704 -3.757 -35.559 1.00 0.00 H new ATOM 0 HG21 THR A 95 -0.116 -6.295 -33.080 1.00 0.00 H new ATOM 0 HG22 THR A 95 -1.564 -5.861 -32.141 1.00 0.00 H new ATOM 0 HG23 THR A 95 -1.736 -6.580 -33.760 1.00 0.00 H new ATOM 1119 N GLY A 96 -3.220 -1.564 -33.446 1.00 0.00 N ATOM 1120 CA GLY A 96 -3.100 -0.093 -33.514 1.00 0.00 C ATOM 1121 C GLY A 96 -1.908 0.422 -32.700 1.00 0.00 C ATOM 1122 O GLY A 96 -1.725 1.629 -32.539 1.00 0.00 O ATOM 0 H GLY A 96 -3.905 -1.894 -32.766 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -2.989 0.214 -34.554 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -4.017 0.364 -33.143 1.00 0.00 H new ATOM 1126 N TYR A 97 -1.107 -0.525 -32.182 1.00 0.00 N ATOM 1127 CA TYR A 97 0.056 -0.282 -31.320 1.00 0.00 C ATOM 1128 C TYR A 97 1.156 -1.295 -31.693 1.00 0.00 C ATOM 1129 O TYR A 97 0.849 -2.458 -31.973 1.00 0.00 O ATOM 1130 CB TYR A 97 -0.334 -0.389 -29.806 1.00 0.00 C ATOM 1131 CG TYR A 97 -1.224 -1.602 -29.447 1.00 0.00 C ATOM 1132 CD1 TYR A 97 -2.549 -1.652 -29.874 1.00 0.00 C ATOM 1133 CD2 TYR A 97 -0.749 -2.676 -28.698 1.00 0.00 C ATOM 1134 CE1 TYR A 97 -3.365 -2.721 -29.578 1.00 0.00 C ATOM 1135 CE2 TYR A 97 -1.561 -3.751 -28.395 1.00 0.00 C ATOM 1136 CZ TYR A 97 -2.868 -3.770 -28.833 1.00 0.00 C ATOM 1137 OH TYR A 97 -3.681 -4.837 -28.521 1.00 0.00 O ATOM 0 H TYR A 97 -1.260 -1.517 -32.361 1.00 0.00 H new ATOM 0 HA TYR A 97 0.428 0.731 -31.476 1.00 0.00 H new ATOM 0 HB2 TYR A 97 0.579 -0.439 -29.213 1.00 0.00 H new ATOM 0 HB3 TYR A 97 -0.854 0.524 -29.514 1.00 0.00 H new ATOM 0 HD1 TYR A 97 -2.947 -0.831 -30.452 1.00 0.00 H new ATOM 0 HD2 TYR A 97 0.273 -2.668 -28.348 1.00 0.00 H new ATOM 0 HE1 TYR A 97 -4.387 -2.738 -29.927 1.00 0.00 H new ATOM 0 HE2 TYR A 97 -1.173 -4.576 -27.816 1.00 0.00 H new ATOM 0 HH TYR A 97 -3.176 -5.490 -27.993 1.00 0.00 H new ATOM 1147 N ASN A 98 2.425 -0.847 -31.703 1.00 0.00 N ATOM 1148 CA ASN A 98 3.577 -1.668 -32.160 1.00 0.00 C ATOM 1149 C ASN A 98 3.829 -2.874 -31.221 1.00 0.00 C ATOM 1150 O ASN A 98 4.258 -3.948 -31.674 1.00 0.00 O ATOM 1151 CB ASN A 98 4.856 -0.788 -32.266 1.00 0.00 C ATOM 1152 CG ASN A 98 6.078 -1.526 -32.840 1.00 0.00 C ATOM 1153 OD1 ASN A 98 5.951 -2.412 -33.693 1.00 0.00 O ATOM 1154 ND2 ASN A 98 7.266 -1.170 -32.367 1.00 0.00 N ATOM 0 H ASN A 98 2.687 0.090 -31.397 1.00 0.00 H new ATOM 0 HA ASN A 98 3.333 -2.064 -33.146 1.00 0.00 H new ATOM 0 HB2 ASN A 98 4.639 0.076 -32.893 1.00 0.00 H new ATOM 0 HB3 ASN A 98 5.106 -0.408 -31.275 1.00 0.00 H new ATOM 0 HD21 ASN A 98 8.110 -1.632 -32.707 1.00 0.00 H new ATOM 0 HD22 ASN A 98 7.335 -0.435 -31.663 1.00 0.00 H new ATOM 1161 N ARG A 99 3.565 -2.684 -29.913 1.00 0.00 N ATOM 1162 CA ARG A 99 3.720 -3.756 -28.911 1.00 0.00 C ATOM 1163 C ARG A 99 2.618 -4.838 -29.093 1.00 0.00 C ATOM 1164 O ARG A 99 1.522 -4.741 -28.546 1.00 0.00 O ATOM 1165 CB ARG A 99 3.754 -3.171 -27.464 1.00 0.00 C ATOM 1166 CG ARG A 99 2.569 -2.259 -27.077 1.00 0.00 C ATOM 1167 CD ARG A 99 2.675 -1.730 -25.639 1.00 0.00 C ATOM 1168 NE ARG A 99 1.562 -0.822 -25.298 1.00 0.00 N ATOM 1169 CZ ARG A 99 1.610 0.168 -24.392 1.00 0.00 C ATOM 1170 NH1 ARG A 99 2.726 0.435 -23.714 1.00 0.00 N ATOM 1171 NH2 ARG A 99 0.536 0.898 -24.176 1.00 0.00 N ATOM 0 H ARG A 99 3.243 -1.797 -29.526 1.00 0.00 H new ATOM 0 HA ARG A 99 4.680 -4.247 -29.070 1.00 0.00 H new ATOM 0 HB2 ARG A 99 3.794 -4.001 -26.758 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.678 -2.605 -27.343 1.00 0.00 H new ATOM 0 HG2 ARG A 99 2.523 -1.417 -27.767 1.00 0.00 H new ATOM 0 HG3 ARG A 99 1.637 -2.814 -27.188 1.00 0.00 H new ATOM 0 HD2 ARG A 99 2.683 -2.570 -24.944 1.00 0.00 H new ATOM 0 HD3 ARG A 99 3.622 -1.205 -25.515 1.00 0.00 H new ATOM 0 HE ARG A 99 0.681 -0.958 -25.793 1.00 0.00 H new ATOM 0 HH11 ARG A 99 3.567 -0.118 -23.879 1.00 0.00 H new ATOM 0 HH12 ARG A 99 2.739 1.192 -23.031 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -0.322 0.709 -24.695 1.00 0.00 H new ATOM 0 HH22 ARG A 99 0.562 1.652 -23.490 1.00 0.00 H new ATOM 1185 N ARG A 100 2.957 -5.873 -29.883 1.00 0.00 N ATOM 1186 CA ARG A 100 2.013 -6.924 -30.337 1.00 0.00 C ATOM 1187 C ARG A 100 1.440 -7.760 -29.171 1.00 0.00 C ATOM 1188 O ARG A 100 0.298 -8.234 -29.246 1.00 0.00 O ATOM 1189 CB ARG A 100 2.728 -7.845 -31.368 1.00 0.00 C ATOM 1190 CG ARG A 100 3.986 -8.565 -30.824 1.00 0.00 C ATOM 1191 CD ARG A 100 4.737 -9.364 -31.901 1.00 0.00 C ATOM 1192 NE ARG A 100 3.887 -10.403 -32.519 1.00 0.00 N ATOM 1193 CZ ARG A 100 4.028 -10.891 -33.764 1.00 0.00 C ATOM 1194 NH1 ARG A 100 4.950 -10.415 -34.588 1.00 0.00 N ATOM 1195 NH2 ARG A 100 3.229 -11.855 -34.181 1.00 0.00 N ATOM 0 H ARG A 100 3.906 -6.009 -30.232 1.00 0.00 H new ATOM 0 HA ARG A 100 1.163 -6.426 -30.804 1.00 0.00 H new ATOM 0 HB2 ARG A 100 2.019 -8.595 -31.719 1.00 0.00 H new ATOM 0 HB3 ARG A 100 3.013 -7.247 -32.233 1.00 0.00 H new ATOM 0 HG2 ARG A 100 4.661 -7.827 -30.391 1.00 0.00 H new ATOM 0 HG3 ARG A 100 3.692 -9.239 -30.019 1.00 0.00 H new ATOM 0 HD2 ARG A 100 5.095 -8.683 -32.673 1.00 0.00 H new ATOM 0 HD3 ARG A 100 5.616 -9.832 -31.457 1.00 0.00 H new ATOM 0 HE ARG A 100 3.128 -10.782 -31.953 1.00 0.00 H new ATOM 0 HH11 ARG A 100 5.569 -9.665 -34.282 1.00 0.00 H new ATOM 0 HH12 ARG A 100 5.041 -10.799 -35.529 1.00 0.00 H new ATOM 0 HH21 ARG A 100 2.510 -12.226 -33.560 1.00 0.00 H new ATOM 0 HH22 ARG A 100 3.331 -12.229 -35.124 1.00 0.00 H new ATOM 1209 N GLY A 101 2.241 -7.931 -28.103 1.00 0.00 N ATOM 1210 CA GLY A 101 1.832 -8.739 -26.955 1.00 0.00 C ATOM 1211 C GLY A 101 2.803 -8.624 -25.793 1.00 0.00 C ATOM 1212 O GLY A 101 3.249 -9.634 -25.238 1.00 0.00 O ATOM 0 H GLY A 101 3.170 -7.519 -28.018 1.00 0.00 H new ATOM 0 HA2 GLY A 101 0.840 -8.427 -26.629 1.00 0.00 H new ATOM 0 HA3 GLY A 101 1.754 -9.783 -27.258 1.00 0.00 H new ATOM 1216 N SER A 102 3.142 -7.376 -25.434 1.00 0.00 N ATOM 1217 CA SER A 102 4.000 -7.069 -24.279 1.00 0.00 C ATOM 1218 C SER A 102 3.253 -6.126 -23.324 1.00 0.00 C ATOM 1219 O SER A 102 3.111 -4.923 -23.594 1.00 0.00 O ATOM 1220 CB SER A 102 5.345 -6.463 -24.747 1.00 0.00 C ATOM 1221 OG SER A 102 5.145 -5.317 -25.554 1.00 0.00 O ATOM 0 H SER A 102 2.827 -6.548 -25.939 1.00 0.00 H new ATOM 0 HA SER A 102 4.231 -7.989 -23.742 1.00 0.00 H new ATOM 0 HB2 SER A 102 5.947 -6.197 -23.878 1.00 0.00 H new ATOM 0 HB3 SER A 102 5.907 -7.210 -25.307 1.00 0.00 H new ATOM 0 HG SER A 102 6.013 -4.957 -25.832 1.00 0.00 H new ATOM 1227 N LYS A 103 2.720 -6.712 -22.248 1.00 0.00 N ATOM 1228 CA LYS A 103 2.032 -5.992 -21.175 1.00 0.00 C ATOM 1229 C LYS A 103 2.486 -6.572 -19.820 1.00 0.00 C ATOM 1230 O LYS A 103 2.373 -7.781 -19.581 1.00 0.00 O ATOM 1231 CB LYS A 103 0.484 -6.079 -21.358 1.00 0.00 C ATOM 1232 CG LYS A 103 -0.087 -7.512 -21.572 1.00 0.00 C ATOM 1233 CD LYS A 103 -1.637 -7.558 -21.609 1.00 0.00 C ATOM 1234 CE LYS A 103 -2.272 -7.155 -20.268 1.00 0.00 C ATOM 1235 NZ LYS A 103 -3.753 -7.174 -20.325 1.00 0.00 N ATOM 0 H LYS A 103 2.756 -7.720 -22.096 1.00 0.00 H new ATOM 0 HA LYS A 103 2.292 -4.934 -21.208 1.00 0.00 H new ATOM 0 HB2 LYS A 103 0.007 -5.644 -20.480 1.00 0.00 H new ATOM 0 HB3 LYS A 103 0.202 -5.463 -22.212 1.00 0.00 H new ATOM 0 HG2 LYS A 103 0.304 -7.915 -22.506 1.00 0.00 H new ATOM 0 HG3 LYS A 103 0.269 -8.160 -20.772 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -1.998 -6.892 -22.393 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -1.961 -8.565 -21.872 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -1.931 -7.835 -19.487 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -1.933 -6.156 -19.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -4.140 -6.896 -19.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -4.081 -6.507 -21.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -4.079 -8.133 -20.563 1.00 0.00 H new ATOM 1249 N ASP A 104 3.034 -5.702 -18.960 1.00 0.00 N ATOM 1250 CA ASP A 104 3.574 -6.087 -17.646 1.00 0.00 C ATOM 1251 C ASP A 104 2.425 -6.421 -16.670 1.00 0.00 C ATOM 1252 O ASP A 104 1.759 -5.513 -16.147 1.00 0.00 O ATOM 1253 CB ASP A 104 4.472 -4.948 -17.095 1.00 0.00 C ATOM 1254 CG ASP A 104 5.176 -5.301 -15.769 1.00 0.00 C ATOM 1255 OD1 ASP A 104 6.096 -6.147 -15.790 1.00 0.00 O ATOM 1256 OD2 ASP A 104 4.822 -4.733 -14.710 1.00 0.00 O ATOM 0 H ASP A 104 3.116 -4.705 -19.157 1.00 0.00 H new ATOM 0 HA ASP A 104 4.186 -6.983 -17.755 1.00 0.00 H new ATOM 0 HB2 ASP A 104 5.226 -4.698 -17.841 1.00 0.00 H new ATOM 0 HB3 ASP A 104 3.863 -4.056 -16.947 1.00 0.00 H new ATOM 1261 N SER A 105 2.182 -7.730 -16.480 1.00 0.00 N ATOM 1262 CA SER A 105 1.095 -8.249 -15.636 1.00 0.00 C ATOM 1263 C SER A 105 1.334 -9.742 -15.350 1.00 0.00 C ATOM 1264 O SER A 105 2.120 -10.399 -16.049 1.00 0.00 O ATOM 1265 CB SER A 105 -0.284 -8.042 -16.336 1.00 0.00 C ATOM 1266 OG SER A 105 -1.382 -8.452 -15.516 1.00 0.00 O ATOM 0 H SER A 105 2.742 -8.464 -16.914 1.00 0.00 H new ATOM 0 HA SER A 105 1.083 -7.703 -14.693 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.402 -6.990 -16.596 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.302 -8.605 -17.269 1.00 0.00 H new ATOM 0 HG SER A 105 -2.223 -8.302 -15.996 1.00 0.00 H new ATOM 1272 N GLN A 106 0.647 -10.264 -14.326 1.00 0.00 N ATOM 1273 CA GLN A 106 0.693 -11.688 -13.958 1.00 0.00 C ATOM 1274 C GLN A 106 -0.652 -12.101 -13.342 1.00 0.00 C ATOM 1275 O GLN A 106 -1.301 -11.292 -12.668 1.00 0.00 O ATOM 1276 CB GLN A 106 1.855 -11.956 -12.958 1.00 0.00 C ATOM 1277 CG GLN A 106 2.092 -13.448 -12.645 1.00 0.00 C ATOM 1278 CD GLN A 106 3.220 -13.719 -11.644 1.00 0.00 C ATOM 1279 OE1 GLN A 106 3.502 -12.908 -10.759 1.00 0.00 O ATOM 1280 NE2 GLN A 106 3.859 -14.877 -11.757 1.00 0.00 N ATOM 0 H GLN A 106 0.039 -9.708 -13.725 1.00 0.00 H new ATOM 0 HA GLN A 106 0.874 -12.282 -14.854 1.00 0.00 H new ATOM 0 HB2 GLN A 106 2.773 -11.532 -13.364 1.00 0.00 H new ATOM 0 HB3 GLN A 106 1.646 -11.430 -12.026 1.00 0.00 H new ATOM 0 HG2 GLN A 106 1.168 -13.875 -12.255 1.00 0.00 H new ATOM 0 HG3 GLN A 106 2.317 -13.970 -13.575 1.00 0.00 H new ATOM 0 HE21 GLN A 106 3.605 -15.529 -12.499 1.00 0.00 H new ATOM 0 HE22 GLN A 106 4.604 -15.114 -11.102 1.00 0.00 H new ATOM 1289 N LEU A 107 -1.053 -13.369 -13.573 1.00 0.00 N ATOM 1290 CA LEU A 107 -2.318 -13.932 -13.042 1.00 0.00 C ATOM 1291 C LEU A 107 -2.336 -13.943 -11.497 1.00 0.00 C ATOM 1292 O LEU A 107 -3.408 -13.910 -10.876 1.00 0.00 O ATOM 1293 CB LEU A 107 -2.587 -15.371 -13.594 1.00 0.00 C ATOM 1294 CG LEU A 107 -1.703 -16.554 -13.036 1.00 0.00 C ATOM 1295 CD1 LEU A 107 -2.274 -17.928 -13.460 1.00 0.00 C ATOM 1296 CD2 LEU A 107 -0.223 -16.429 -13.468 1.00 0.00 C ATOM 0 H LEU A 107 -0.513 -14.031 -14.130 1.00 0.00 H new ATOM 0 HA LEU A 107 -3.118 -13.278 -13.388 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -3.632 -15.614 -13.399 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -2.463 -15.342 -14.677 1.00 0.00 H new ATOM 0 HG LEU A 107 -1.736 -16.485 -11.949 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -1.644 -18.723 -13.061 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -3.286 -18.037 -13.071 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -2.295 -17.993 -14.548 1.00 0.00 H new ATOM 0 HD21 LEU A 107 0.347 -17.264 -13.061 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -0.159 -16.442 -14.556 1.00 0.00 H new ATOM 0 HD23 LEU A 107 0.188 -15.492 -13.092 1.00 0.00 H new ATOM 1308 N ARG A 108 -1.134 -13.999 -10.900 1.00 0.00 N ATOM 1309 CA ARG A 108 -0.942 -13.930 -9.447 1.00 0.00 C ATOM 1310 C ARG A 108 -1.098 -12.466 -8.976 1.00 0.00 C ATOM 1311 O ARG A 108 -0.248 -11.629 -9.350 1.00 0.00 O ATOM 1312 CB ARG A 108 0.454 -14.485 -9.066 1.00 0.00 C ATOM 1313 CG ARG A 108 0.725 -15.923 -9.557 1.00 0.00 C ATOM 1314 CD ARG A 108 2.126 -16.417 -9.160 1.00 0.00 C ATOM 1315 NE ARG A 108 2.416 -17.776 -9.645 1.00 0.00 N ATOM 1316 CZ ARG A 108 3.440 -18.534 -9.231 1.00 0.00 C ATOM 1317 NH1 ARG A 108 4.264 -18.120 -8.271 1.00 0.00 N ATOM 1318 NH2 ARG A 108 3.619 -19.714 -9.776 1.00 0.00 N ATOM 1319 OXT ARG A 108 -2.064 -12.152 -8.248 1.00 0.00 O ATOM 0 H ARG A 108 -0.262 -14.094 -11.420 1.00 0.00 H new ATOM 0 HA ARG A 108 -1.696 -14.541 -8.951 1.00 0.00 H new ATOM 0 HB2 ARG A 108 1.218 -13.824 -9.476 1.00 0.00 H new ATOM 0 HB3 ARG A 108 0.558 -14.459 -7.981 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -0.027 -16.595 -9.142 1.00 0.00 H new ATOM 0 HG3 ARG A 108 0.622 -15.960 -10.641 1.00 0.00 H new ATOM 0 HD2 ARG A 108 2.873 -15.729 -9.555 1.00 0.00 H new ATOM 0 HD3 ARG A 108 2.218 -16.398 -8.074 1.00 0.00 H new ATOM 0 HE ARG A 108 1.791 -18.170 -10.348 1.00 0.00 H new ATOM 0 HH11 ARG A 108 4.122 -17.209 -7.835 1.00 0.00 H new ATOM 0 HH12 ARG A 108 5.037 -18.714 -7.971 1.00 0.00 H new ATOM 0 HH21 ARG A 108 2.983 -20.042 -10.503 1.00 0.00 H new ATOM 0 HH22 ARG A 108 4.394 -20.304 -9.472 1.00 0.00 H new TER 1333 ARG A 108 HETATM 1334 ZN ZN A 109 -14.302 -23.866 -24.673 1.00 0.00 ZN