USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1033 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 82 CYS SG : rot -64:sc= 0.223 USER MOD Set 1.2: A 102 THR OG1 : rot 123:sc= 1.4 USER MOD Set 2.1: A 28 LYS NZ :NH3+ 165:sc= 1 (180deg=0.267) USER MOD Set 2.2: A 67 SER OG : rot -150:sc= -0.0866 USER MOD Set 3.1: A 25 LYS NZ :NH3+ 176:sc= 1.39 (180deg=0.835) USER MOD Set 3.2: A 29 THR OG1 : rot 66:sc= 1.37 USER MOD Set 4.1: A 9 GLN : amide:sc= 0.171 X(o=-6.9,f=-7.3) USER MOD Set 4.2: A 11 GLN : amide:sc= -7.11! C(o=-6.9!,f=-7.3!) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 HIS : no HD1:sc= -0.214 X(o=-0.21,f=0) USER MOD Single : A 16 HIS : no HD1:sc= -0.0826 X(o=-0.083,f=-0.083) USER MOD Single : A 17 ASN : amide:sc= -0.118 X(o=-0.12,f=-0.12) USER MOD Single : A 32 SER OG : rot 73:sc= 0.883 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot -105:sc= 0.539 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc=-0.00195 USER MOD Single : A 47 SER OG : rot 79:sc= 1.2 USER MOD Single : A 51 ASN : amide:sc= -0.392 K(o=-0.39,f=-1) USER MOD Single : A 54 THR OG1 : rot -75:sc= 1.38 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 60 THR OG1 : rot 82:sc= 1.25 USER MOD Single : A 71 HIS : no HD1:sc= 0 X(o=0,f=-0.0032) USER MOD Single : A 75 LYS NZ :NH3+ -178:sc= -0.188 (180deg=-0.192) USER MOD Single : A 76 SER OG : rot 101:sc= 0.292 USER MOD Single : A 81 ASN : amide:sc= -0.0678 X(o=-0.068,f=-0.4) USER MOD Single : A 85 THR OG1 : rot 88:sc= 0.478 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= 0.725 K(o=0.73,f=-1.8!) USER MOD Single : A 90 GLN : amide:sc= 1.62 K(o=1.6,f=-0.41) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 ASN : amide:sc= 0.0701 K(o=0.07,f=-1.2) USER MOD Single : A 100 MET CE :methyl -140:sc= -0.127 (180deg=-1.41) USER MOD Single : A 104 SER OG : rot 160:sc= 0 USER MOD Single : A 106 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 107 TYR OH : rot 100:sc= 1.04 USER MOD Single : A 108 SER OG : rot -123:sc= 1.38 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0852 USER MOD Single : A 113 GLN : amide:sc= -7.01! C(o=-7!,f=-9!) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= 0.674 K(o=0.67,f=-0.6) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.0302 X(o=-0.03,f=-0.039) USER MOD Single : A 125 GLN : amide:sc= -2.15! C(o=-2.1!,f=-1.9!) USER MOD Single : A 129 THR OG1 : rot -140:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 165:sc= -0.0193 (180deg=-0.163) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 3.948 7.016 3.904 1.00 0.00 N ATOM 2 CA PRO A 1 4.579 7.067 2.614 1.00 0.00 C ATOM 3 C PRO A 1 6.003 7.551 2.789 1.00 0.00 C ATOM 4 O PRO A 1 6.434 7.773 3.921 1.00 0.00 O ATOM 5 CB PRO A 1 3.793 8.011 1.742 1.00 0.00 C ATOM 6 CG PRO A 1 2.455 8.032 2.393 1.00 0.00 C ATOM 7 CD PRO A 1 2.708 7.800 3.868 1.00 0.00 C ATOM 0 H2 PRO A 1 4.577 7.386 4.617 1.00 0.00 H new ATOM 0 H3 PRO A 1 3.745 6.049 4.158 1.00 0.00 H new ATOM 0 HA PRO A 1 4.601 6.083 2.145 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.243 9.003 1.713 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.736 7.657 0.713 1.00 0.00 H new ATOM 0 HG2 PRO A 1 1.955 8.986 2.228 1.00 0.00 H new ATOM 0 HG3 PRO A 1 1.808 7.258 1.981 1.00 0.00 H new ATOM 0 HD2 PRO A 1 2.817 8.742 4.406 1.00 0.00 H new ATOM 0 HD3 PRO A 1 1.883 7.261 4.333 1.00 0.00 H new ATOM 17 N VAL A 2 6.704 7.714 1.688 1.00 0.00 N ATOM 18 CA VAL A 2 8.088 8.176 1.628 1.00 0.00 C ATOM 19 C VAL A 2 8.233 8.979 0.344 1.00 0.00 C ATOM 20 O VAL A 2 7.686 8.590 -0.687 1.00 0.00 O ATOM 21 CB VAL A 2 9.124 6.979 1.583 1.00 0.00 C ATOM 22 CG1 VAL A 2 10.561 7.487 1.583 1.00 0.00 C ATOM 23 CG2 VAL A 2 8.937 5.997 2.738 1.00 0.00 C ATOM 0 H VAL A 2 6.314 7.522 0.765 1.00 0.00 H new ATOM 0 HA VAL A 2 8.301 8.762 2.522 1.00 0.00 H new ATOM 0 HB VAL A 2 8.927 6.449 0.651 1.00 0.00 H new ATOM 0 HG11 VAL A 2 11.246 6.640 1.552 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.724 8.118 0.709 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.742 8.067 2.488 1.00 0.00 H new ATOM 0 HG21 VAL A 2 9.673 5.197 2.658 1.00 0.00 H new ATOM 0 HG22 VAL A 2 9.071 6.520 3.685 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.934 5.573 2.696 1.00 0.00 H new ATOM 33 N THR A 3 8.885 10.101 0.416 1.00 0.00 N ATOM 34 CA THR A 3 9.151 10.899 -0.746 1.00 0.00 C ATOM 35 C THR A 3 10.615 11.336 -0.704 1.00 0.00 C ATOM 36 O THR A 3 11.178 11.523 0.392 1.00 0.00 O ATOM 37 CB THR A 3 8.159 12.109 -0.835 1.00 0.00 C ATOM 38 OG1 THR A 3 8.492 12.986 -1.918 1.00 0.00 O ATOM 39 CG2 THR A 3 8.089 12.880 0.475 1.00 0.00 C ATOM 0 H THR A 3 9.249 10.491 1.285 1.00 0.00 H new ATOM 0 HA THR A 3 8.989 10.316 -1.653 1.00 0.00 H new ATOM 0 HB THR A 3 7.171 11.691 -1.030 1.00 0.00 H new ATOM 0 HG1 THR A 3 7.853 13.728 -1.946 1.00 0.00 H new ATOM 0 HG21 THR A 3 7.391 13.711 0.372 1.00 0.00 H new ATOM 0 HG22 THR A 3 7.748 12.217 1.270 1.00 0.00 H new ATOM 0 HG23 THR A 3 9.078 13.266 0.723 1.00 0.00 H new ATOM 47 N GLU A 4 11.248 11.468 -1.863 1.00 0.00 N ATOM 48 CA GLU A 4 12.669 11.781 -1.925 1.00 0.00 C ATOM 49 C GLU A 4 12.973 12.802 -3.019 1.00 0.00 C ATOM 50 O GLU A 4 12.301 12.861 -4.044 1.00 0.00 O ATOM 51 CB GLU A 4 13.497 10.513 -2.127 1.00 0.00 C ATOM 52 CG GLU A 4 13.105 9.706 -3.338 1.00 0.00 C ATOM 53 CD GLU A 4 13.930 8.466 -3.482 1.00 0.00 C ATOM 54 OE1 GLU A 4 13.885 7.588 -2.577 1.00 0.00 O ATOM 55 OE2 GLU A 4 14.674 8.353 -4.469 1.00 0.00 O ATOM 0 H GLU A 4 10.799 11.363 -2.773 1.00 0.00 H new ATOM 0 HA GLU A 4 12.947 12.227 -0.970 1.00 0.00 H new ATOM 0 HB2 GLU A 4 14.548 10.789 -2.213 1.00 0.00 H new ATOM 0 HB3 GLU A 4 13.403 9.886 -1.240 1.00 0.00 H new ATOM 0 HG2 GLU A 4 12.052 9.433 -3.266 1.00 0.00 H new ATOM 0 HG3 GLU A 4 13.215 10.319 -4.232 1.00 0.00 H new ATOM 62 N THR A 5 13.885 13.660 -2.733 1.00 0.00 N ATOM 63 CA THR A 5 14.298 14.638 -3.697 1.00 0.00 C ATOM 64 C THR A 5 15.764 14.330 -3.975 1.00 0.00 C ATOM 65 O THR A 5 16.386 13.579 -3.207 1.00 0.00 O ATOM 66 CB THR A 5 14.136 16.109 -3.153 1.00 0.00 C ATOM 67 OG1 THR A 5 14.298 17.057 -4.217 1.00 0.00 O ATOM 68 CG2 THR A 5 15.157 16.431 -2.051 1.00 0.00 C ATOM 0 H THR A 5 14.367 13.712 -1.836 1.00 0.00 H new ATOM 0 HA THR A 5 13.683 14.585 -4.595 1.00 0.00 H new ATOM 0 HB THR A 5 13.133 16.180 -2.732 1.00 0.00 H new ATOM 0 HG1 THR A 5 14.193 17.965 -3.865 1.00 0.00 H new ATOM 0 HG21 THR A 5 15.009 17.454 -1.706 1.00 0.00 H new ATOM 0 HG22 THR A 5 15.021 15.743 -1.217 1.00 0.00 H new ATOM 0 HG23 THR A 5 16.167 16.325 -2.448 1.00 0.00 H new ATOM 76 N VAL A 6 16.353 14.895 -4.978 1.00 0.00 N ATOM 77 CA VAL A 6 17.731 14.697 -5.294 1.00 0.00 C ATOM 78 C VAL A 6 18.371 16.056 -5.319 1.00 0.00 C ATOM 79 O VAL A 6 17.855 16.984 -5.949 1.00 0.00 O ATOM 80 CB VAL A 6 17.898 13.992 -6.691 1.00 0.00 C ATOM 81 CG1 VAL A 6 19.357 13.783 -7.053 1.00 0.00 C ATOM 82 CG2 VAL A 6 17.172 12.651 -6.710 1.00 0.00 C ATOM 0 H VAL A 6 15.874 15.527 -5.620 1.00 0.00 H new ATOM 0 HA VAL A 6 18.201 14.051 -4.553 1.00 0.00 H new ATOM 0 HB VAL A 6 17.456 14.656 -7.434 1.00 0.00 H new ATOM 0 HG11 VAL A 6 19.424 13.294 -8.025 1.00 0.00 H new ATOM 0 HG12 VAL A 6 19.863 14.748 -7.097 1.00 0.00 H new ATOM 0 HG13 VAL A 6 19.833 13.158 -6.298 1.00 0.00 H new ATOM 0 HG21 VAL A 6 17.301 12.181 -7.685 1.00 0.00 H new ATOM 0 HG22 VAL A 6 17.585 12.003 -5.937 1.00 0.00 H new ATOM 0 HG23 VAL A 6 16.110 12.809 -6.521 1.00 0.00 H new ATOM 92 N ASP A 7 19.434 16.201 -4.574 1.00 0.00 N ATOM 93 CA ASP A 7 20.192 17.444 -4.583 1.00 0.00 C ATOM 94 C ASP A 7 21.033 17.453 -5.851 1.00 0.00 C ATOM 95 O ASP A 7 21.159 16.407 -6.474 1.00 0.00 O ATOM 96 CB ASP A 7 21.056 17.573 -3.290 1.00 0.00 C ATOM 97 CG ASP A 7 22.056 18.719 -3.325 1.00 0.00 C ATOM 98 OD1 ASP A 7 21.687 19.866 -2.988 1.00 0.00 O ATOM 99 OD2 ASP A 7 23.221 18.486 -3.725 1.00 0.00 O ATOM 0 H ASP A 7 19.802 15.482 -3.951 1.00 0.00 H new ATOM 0 HA ASP A 7 19.529 18.310 -4.585 1.00 0.00 H new ATOM 0 HB2 ASP A 7 20.394 17.708 -2.435 1.00 0.00 H new ATOM 0 HB3 ASP A 7 21.595 16.639 -3.131 1.00 0.00 H new ATOM 104 N GLY A 8 21.612 18.604 -6.191 1.00 0.00 N ATOM 105 CA GLY A 8 22.396 18.828 -7.412 1.00 0.00 C ATOM 106 C GLY A 8 23.315 17.692 -7.840 1.00 0.00 C ATOM 107 O GLY A 8 23.608 17.558 -9.023 1.00 0.00 O ATOM 0 H GLY A 8 21.548 19.437 -5.606 1.00 0.00 H new ATOM 0 HA2 GLY A 8 21.705 19.036 -8.229 1.00 0.00 H new ATOM 0 HA3 GLY A 8 23.001 19.723 -7.271 1.00 0.00 H new ATOM 111 N GLN A 9 23.797 16.901 -6.903 1.00 0.00 N ATOM 112 CA GLN A 9 24.561 15.724 -7.264 1.00 0.00 C ATOM 113 C GLN A 9 23.575 14.595 -7.701 1.00 0.00 C ATOM 114 O GLN A 9 22.831 14.759 -8.671 1.00 0.00 O ATOM 115 CB GLN A 9 25.470 15.274 -6.112 1.00 0.00 C ATOM 116 CG GLN A 9 26.284 16.410 -5.514 1.00 0.00 C ATOM 117 CD GLN A 9 27.290 15.966 -4.464 1.00 0.00 C ATOM 118 OE1 GLN A 9 28.428 15.675 -4.777 1.00 0.00 O ATOM 119 NE2 GLN A 9 26.877 15.871 -3.236 1.00 0.00 N ATOM 0 H GLN A 9 23.676 17.048 -5.901 1.00 0.00 H new ATOM 0 HA GLN A 9 25.219 15.961 -8.100 1.00 0.00 H new ATOM 0 HB2 GLN A 9 24.859 14.823 -5.330 1.00 0.00 H new ATOM 0 HB3 GLN A 9 26.148 14.501 -6.473 1.00 0.00 H new ATOM 0 HG2 GLN A 9 26.814 16.924 -6.316 1.00 0.00 H new ATOM 0 HG3 GLN A 9 25.603 17.134 -5.066 1.00 0.00 H new ATOM 0 HE21 GLN A 9 25.917 16.122 -3.000 1.00 0.00 H new ATOM 0 HE22 GLN A 9 27.513 15.546 -2.508 1.00 0.00 H new ATOM 128 N GLY A 10 23.556 13.484 -6.999 1.00 0.00 N ATOM 129 CA GLY A 10 22.613 12.430 -7.324 1.00 0.00 C ATOM 130 C GLY A 10 22.196 11.651 -6.110 1.00 0.00 C ATOM 131 O GLY A 10 21.760 10.505 -6.206 1.00 0.00 O ATOM 0 H GLY A 10 24.172 13.285 -6.210 1.00 0.00 H new ATOM 0 HA2 GLY A 10 21.732 12.865 -7.795 1.00 0.00 H new ATOM 0 HA3 GLY A 10 23.062 11.754 -8.051 1.00 0.00 H new ATOM 135 N GLN A 11 22.314 12.268 -4.972 1.00 0.00 N ATOM 136 CA GLN A 11 21.899 11.656 -3.738 1.00 0.00 C ATOM 137 C GLN A 11 20.437 11.983 -3.516 1.00 0.00 C ATOM 138 O GLN A 11 20.002 13.151 -3.723 1.00 0.00 O ATOM 139 CB GLN A 11 22.760 12.109 -2.519 1.00 0.00 C ATOM 140 CG GLN A 11 22.659 13.582 -2.106 1.00 0.00 C ATOM 141 CD GLN A 11 23.167 14.512 -3.151 1.00 0.00 C ATOM 142 OE1 GLN A 11 24.312 14.854 -3.171 1.00 0.00 O ATOM 143 NE2 GLN A 11 22.322 14.864 -4.067 1.00 0.00 N ATOM 0 H GLN A 11 22.699 13.207 -4.869 1.00 0.00 H new ATOM 0 HA GLN A 11 22.043 10.579 -3.819 1.00 0.00 H new ATOM 0 HB2 GLN A 11 22.482 11.497 -1.661 1.00 0.00 H new ATOM 0 HB3 GLN A 11 23.804 11.890 -2.742 1.00 0.00 H new ATOM 0 HG2 GLN A 11 21.619 13.822 -1.887 1.00 0.00 H new ATOM 0 HG3 GLN A 11 23.222 13.736 -1.185 1.00 0.00 H new ATOM 0 HE21 GLN A 11 21.353 14.551 -4.014 1.00 0.00 H new ATOM 0 HE22 GLN A 11 22.626 15.454 -4.841 1.00 0.00 H new ATOM 152 N ALA A 12 19.694 10.997 -3.123 1.00 0.00 N ATOM 153 CA ALA A 12 18.272 11.108 -2.930 1.00 0.00 C ATOM 154 C ALA A 12 17.949 11.062 -1.462 1.00 0.00 C ATOM 155 O ALA A 12 18.430 10.202 -0.720 1.00 0.00 O ATOM 156 CB ALA A 12 17.554 10.018 -3.666 1.00 0.00 C ATOM 0 H ALA A 12 20.063 10.068 -2.921 1.00 0.00 H new ATOM 0 HA ALA A 12 17.936 12.064 -3.332 1.00 0.00 H new ATOM 0 HB1 ALA A 12 16.480 10.119 -3.508 1.00 0.00 H new ATOM 0 HB2 ALA A 12 17.773 10.093 -4.731 1.00 0.00 H new ATOM 0 HB3 ALA A 12 17.886 9.048 -3.295 1.00 0.00 H new ATOM 162 N TRP A 13 17.188 12.019 -1.046 1.00 0.00 N ATOM 163 CA TRP A 13 16.865 12.237 0.335 1.00 0.00 C ATOM 164 C TRP A 13 15.688 13.158 0.437 1.00 0.00 C ATOM 165 O TRP A 13 15.479 13.960 -0.449 1.00 0.00 O ATOM 166 CB TRP A 13 18.092 12.833 1.079 1.00 0.00 C ATOM 167 CG TRP A 13 18.689 14.102 0.483 1.00 0.00 C ATOM 168 CD1 TRP A 13 18.721 14.475 -0.830 1.00 0.00 C ATOM 169 CD2 TRP A 13 19.413 15.102 1.191 1.00 0.00 C ATOM 170 NE1 TRP A 13 19.380 15.638 -0.978 1.00 0.00 N ATOM 171 CE2 TRP A 13 19.824 16.057 0.246 1.00 0.00 C ATOM 172 CE3 TRP A 13 19.744 15.289 2.529 1.00 0.00 C ATOM 173 CZ2 TRP A 13 20.556 17.188 0.605 1.00 0.00 C ATOM 174 CZ3 TRP A 13 20.467 16.407 2.883 1.00 0.00 C ATOM 175 CH2 TRP A 13 20.867 17.340 1.930 1.00 0.00 C ATOM 0 H TRP A 13 16.757 12.696 -1.675 1.00 0.00 H new ATOM 0 HA TRP A 13 16.608 11.286 0.802 1.00 0.00 H new ATOM 0 HB2 TRP A 13 17.800 13.042 2.108 1.00 0.00 H new ATOM 0 HB3 TRP A 13 18.872 12.073 1.117 1.00 0.00 H new ATOM 0 HD1 TRP A 13 18.278 13.913 -1.639 1.00 0.00 H new ATOM 0 HE1 TRP A 13 19.525 16.128 -1.861 1.00 0.00 H new ATOM 0 HE3 TRP A 13 19.440 14.571 3.276 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 20.865 17.915 -0.132 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 20.728 16.563 3.919 1.00 0.00 H new ATOM 0 HH2 TRP A 13 21.436 18.203 2.243 1.00 0.00 H new ATOM 186 N ARG A 14 14.917 13.009 1.469 1.00 0.00 N ATOM 187 CA ARG A 14 13.801 13.876 1.779 1.00 0.00 C ATOM 188 C ARG A 14 13.192 13.360 3.067 1.00 0.00 C ATOM 189 O ARG A 14 13.892 13.281 4.069 1.00 0.00 O ATOM 190 CB ARG A 14 12.750 14.037 0.652 1.00 0.00 C ATOM 191 CG ARG A 14 11.952 15.340 0.718 1.00 0.00 C ATOM 192 CD ARG A 14 10.786 15.374 -0.280 1.00 0.00 C ATOM 193 NE ARG A 14 11.158 15.115 -1.692 1.00 0.00 N ATOM 194 CZ ARG A 14 10.583 15.720 -2.758 1.00 0.00 C ATOM 195 NH1 ARG A 14 9.896 16.836 -2.594 1.00 0.00 N ATOM 196 NH2 ARG A 14 10.764 15.227 -3.998 1.00 0.00 N ATOM 0 H ARG A 14 15.044 12.258 2.147 1.00 0.00 H new ATOM 0 HA ARG A 14 14.177 14.893 1.890 1.00 0.00 H new ATOM 0 HB2 ARG A 14 13.256 13.983 -0.312 1.00 0.00 H new ATOM 0 HB3 ARG A 14 12.057 13.197 0.695 1.00 0.00 H new ATOM 0 HG2 ARG A 14 11.564 15.472 1.728 1.00 0.00 H new ATOM 0 HG3 ARG A 14 12.618 16.179 0.520 1.00 0.00 H new ATOM 0 HD2 ARG A 14 10.045 14.635 0.026 1.00 0.00 H new ATOM 0 HD3 ARG A 14 10.306 16.351 -0.220 1.00 0.00 H new ATOM 0 HE ARG A 14 11.897 14.435 -1.872 1.00 0.00 H new ATOM 0 HH11 ARG A 14 9.798 17.243 -1.664 1.00 0.00 H new ATOM 0 HH12 ARG A 14 9.463 17.291 -3.398 1.00 0.00 H new ATOM 0 HH21 ARG A 14 11.336 14.394 -4.137 1.00 0.00 H new ATOM 0 HH22 ARG A 14 10.329 15.686 -4.798 1.00 0.00 H new ATOM 210 N HIS A 15 11.930 13.015 3.083 1.00 0.00 N ATOM 211 CA HIS A 15 11.306 12.589 4.317 1.00 0.00 C ATOM 212 C HIS A 15 10.503 11.335 4.089 1.00 0.00 C ATOM 213 O HIS A 15 9.889 11.166 3.030 1.00 0.00 O ATOM 214 CB HIS A 15 10.357 13.677 4.890 1.00 0.00 C ATOM 215 CG HIS A 15 11.013 14.938 5.379 1.00 0.00 C ATOM 216 ND1 HIS A 15 10.892 15.401 6.665 1.00 0.00 N ATOM 217 CD2 HIS A 15 11.795 15.830 4.743 1.00 0.00 C ATOM 218 CE1 HIS A 15 11.573 16.516 6.798 1.00 0.00 C ATOM 219 NE2 HIS A 15 12.135 16.800 5.645 1.00 0.00 N ATOM 0 H HIS A 15 11.317 13.019 2.268 1.00 0.00 H new ATOM 0 HA HIS A 15 12.108 12.406 5.032 1.00 0.00 H new ATOM 0 HB2 HIS A 15 9.635 13.943 4.118 1.00 0.00 H new ATOM 0 HB3 HIS A 15 9.794 13.241 5.716 1.00 0.00 H new ATOM 0 HD2 HIS A 15 12.099 15.787 3.708 1.00 0.00 H new ATOM 0 HE1 HIS A 15 11.657 17.101 7.702 1.00 0.00 H new ATOM 0 HE2 HIS A 15 12.726 17.609 5.454 1.00 0.00 H new ATOM 228 N HIS A 16 10.512 10.451 5.053 1.00 0.00 N ATOM 229 CA HIS A 16 9.597 9.337 5.035 1.00 0.00 C ATOM 230 C HIS A 16 8.431 9.864 5.806 1.00 0.00 C ATOM 231 O HIS A 16 8.500 10.030 7.014 1.00 0.00 O ATOM 232 CB HIS A 16 10.210 8.001 5.600 1.00 0.00 C ATOM 233 CG HIS A 16 10.704 8.008 7.023 1.00 0.00 C ATOM 234 ND1 HIS A 16 11.969 8.390 7.372 1.00 0.00 N ATOM 235 CD2 HIS A 16 10.095 7.632 8.174 1.00 0.00 C ATOM 236 CE1 HIS A 16 12.128 8.252 8.673 1.00 0.00 C ATOM 237 NE2 HIS A 16 11.006 7.793 9.185 1.00 0.00 N ATOM 0 H HIS A 16 11.139 10.479 5.857 1.00 0.00 H new ATOM 0 HA HIS A 16 9.321 9.023 4.028 1.00 0.00 H new ATOM 0 HB2 HIS A 16 9.455 7.220 5.510 1.00 0.00 H new ATOM 0 HB3 HIS A 16 11.042 7.715 4.957 1.00 0.00 H new ATOM 0 HD2 HIS A 16 9.082 7.273 8.275 1.00 0.00 H new ATOM 0 HE1 HIS A 16 13.028 8.478 9.226 1.00 0.00 H new ATOM 0 HE2 HIS A 16 10.842 7.591 10.171 1.00 0.00 H new ATOM 246 N ASN A 17 7.379 10.160 5.126 1.00 0.00 N ATOM 247 CA ASN A 17 6.345 11.066 5.527 1.00 0.00 C ATOM 248 C ASN A 17 5.304 10.976 4.431 1.00 0.00 C ATOM 249 O ASN A 17 5.626 10.468 3.370 1.00 0.00 O ATOM 250 CB ASN A 17 7.016 12.461 5.541 1.00 0.00 C ATOM 251 CG ASN A 17 6.143 13.636 5.155 1.00 0.00 C ATOM 252 OD1 ASN A 17 5.458 14.225 5.983 1.00 0.00 O ATOM 253 ND2 ASN A 17 6.197 13.997 3.901 1.00 0.00 N ATOM 0 H ASN A 17 7.200 9.749 4.209 1.00 0.00 H new ATOM 0 HA ASN A 17 5.889 10.862 6.496 1.00 0.00 H new ATOM 0 HB2 ASN A 17 7.407 12.641 6.542 1.00 0.00 H new ATOM 0 HB3 ASN A 17 7.871 12.435 4.865 1.00 0.00 H new ATOM 0 HD21 ASN A 17 5.655 14.798 3.577 1.00 0.00 H new ATOM 0 HD22 ASN A 17 6.781 13.478 3.245 1.00 0.00 H new ATOM 260 N GLY A 18 4.099 11.427 4.629 1.00 0.00 N ATOM 261 CA GLY A 18 3.214 11.428 3.497 1.00 0.00 C ATOM 262 C GLY A 18 1.769 11.419 3.830 1.00 0.00 C ATOM 263 O GLY A 18 1.003 10.691 3.223 1.00 0.00 O ATOM 0 H GLY A 18 3.720 11.780 5.508 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.426 12.308 2.890 1.00 0.00 H new ATOM 0 HA3 GLY A 18 3.435 10.556 2.882 1.00 0.00 H new ATOM 267 N PHE A 19 1.370 12.203 4.769 1.00 0.00 N ATOM 268 CA PHE A 19 -0.019 12.295 5.050 1.00 0.00 C ATOM 269 C PHE A 19 -0.530 13.635 4.623 1.00 0.00 C ATOM 270 O PHE A 19 -0.653 14.569 5.433 1.00 0.00 O ATOM 271 CB PHE A 19 -0.391 11.970 6.508 1.00 0.00 C ATOM 272 CG PHE A 19 -0.031 10.568 6.920 1.00 0.00 C ATOM 273 CD1 PHE A 19 -0.821 9.497 6.532 1.00 0.00 C ATOM 274 CD2 PHE A 19 1.097 10.319 7.674 1.00 0.00 C ATOM 275 CE1 PHE A 19 -0.484 8.201 6.887 1.00 0.00 C ATOM 276 CE2 PHE A 19 1.441 9.028 8.042 1.00 0.00 C ATOM 277 CZ PHE A 19 0.651 7.965 7.645 1.00 0.00 C ATOM 0 H PHE A 19 1.976 12.783 5.349 1.00 0.00 H new ATOM 0 HA PHE A 19 -0.514 11.518 4.468 1.00 0.00 H new ATOM 0 HB2 PHE A 19 0.112 12.675 7.169 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.463 12.116 6.643 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -1.710 9.675 5.946 1.00 0.00 H new ATOM 0 HD2 PHE A 19 1.722 11.144 7.983 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -1.106 7.376 6.573 1.00 0.00 H new ATOM 0 HE2 PHE A 19 2.325 8.853 8.638 1.00 0.00 H new ATOM 0 HZ PHE A 19 0.917 6.956 7.924 1.00 0.00 H new ATOM 287 N ASP A 20 -0.688 13.781 3.320 1.00 0.00 N ATOM 288 CA ASP A 20 -1.315 14.933 2.735 1.00 0.00 C ATOM 289 C ASP A 20 -2.764 14.618 2.878 1.00 0.00 C ATOM 290 O ASP A 20 -3.226 13.600 2.325 1.00 0.00 O ATOM 291 CB ASP A 20 -0.967 15.051 1.220 1.00 0.00 C ATOM 292 CG ASP A 20 0.526 15.141 0.913 1.00 0.00 C ATOM 293 OD1 ASP A 20 1.217 14.088 0.886 1.00 0.00 O ATOM 294 OD2 ASP A 20 1.040 16.269 0.672 1.00 0.00 O ATOM 0 H ASP A 20 -0.378 13.090 2.637 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.003 15.867 3.202 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.380 14.188 0.698 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -1.461 15.934 0.815 1.00 0.00 H new ATOM 299 N PHE A 21 -3.483 15.425 3.628 1.00 0.00 N ATOM 300 CA PHE A 21 -4.834 15.076 4.004 1.00 0.00 C ATOM 301 C PHE A 21 -5.725 14.843 2.801 1.00 0.00 C ATOM 302 O PHE A 21 -6.532 13.950 2.833 1.00 0.00 O ATOM 303 CB PHE A 21 -5.454 16.087 4.960 1.00 0.00 C ATOM 304 CG PHE A 21 -6.569 15.482 5.756 1.00 0.00 C ATOM 305 CD1 PHE A 21 -6.279 14.547 6.743 1.00 0.00 C ATOM 306 CD2 PHE A 21 -7.889 15.821 5.519 1.00 0.00 C ATOM 307 CE1 PHE A 21 -7.291 13.959 7.473 1.00 0.00 C ATOM 308 CE2 PHE A 21 -8.905 15.239 6.251 1.00 0.00 C ATOM 309 CZ PHE A 21 -8.606 14.305 7.227 1.00 0.00 C ATOM 0 H PHE A 21 -3.156 16.322 3.987 1.00 0.00 H new ATOM 0 HA PHE A 21 -4.758 14.130 4.541 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.688 16.466 5.636 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.831 16.939 4.395 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -5.252 14.278 6.940 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -8.127 16.547 4.755 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -7.056 13.230 8.235 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -9.932 15.513 6.062 1.00 0.00 H new ATOM 0 HZ PHE A 21 -9.401 13.846 7.797 1.00 0.00 H new ATOM 319 N ALA A 22 -5.521 15.621 1.740 1.00 0.00 N ATOM 320 CA ALA A 22 -6.259 15.504 0.487 1.00 0.00 C ATOM 321 C ALA A 22 -6.365 14.054 -0.015 1.00 0.00 C ATOM 322 O ALA A 22 -7.430 13.637 -0.421 1.00 0.00 O ATOM 323 CB ALA A 22 -5.603 16.361 -0.576 1.00 0.00 C ATOM 0 H ALA A 22 -4.823 16.365 1.728 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.274 15.850 0.684 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.158 16.270 -1.510 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -5.602 17.402 -0.254 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -4.577 16.028 -0.730 1.00 0.00 H new ATOM 329 N VAL A 23 -5.275 13.297 0.064 1.00 0.00 N ATOM 330 CA VAL A 23 -5.244 11.908 -0.433 1.00 0.00 C ATOM 331 C VAL A 23 -6.206 11.013 0.366 1.00 0.00 C ATOM 332 O VAL A 23 -7.134 10.413 -0.194 1.00 0.00 O ATOM 333 CB VAL A 23 -3.805 11.327 -0.359 1.00 0.00 C ATOM 334 CG1 VAL A 23 -3.763 9.890 -0.855 1.00 0.00 C ATOM 335 CG2 VAL A 23 -2.840 12.202 -1.155 1.00 0.00 C ATOM 0 H VAL A 23 -4.394 13.615 0.467 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.566 11.925 -1.474 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.494 11.324 0.686 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -2.743 9.512 -0.790 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.418 9.273 -0.239 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.099 9.853 -1.891 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -1.835 11.784 -1.095 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -3.156 12.237 -2.197 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -2.838 13.211 -0.742 1.00 0.00 H new ATOM 345 N ILE A 24 -5.992 10.976 1.674 1.00 0.00 N ATOM 346 CA ILE A 24 -6.789 10.162 2.600 1.00 0.00 C ATOM 347 C ILE A 24 -8.242 10.647 2.576 1.00 0.00 C ATOM 348 O ILE A 24 -9.190 9.854 2.602 1.00 0.00 O ATOM 349 CB ILE A 24 -6.238 10.293 4.051 1.00 0.00 C ATOM 350 CG1 ILE A 24 -4.727 9.970 4.120 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.035 9.449 5.057 1.00 0.00 C ATOM 352 CD1 ILE A 24 -4.338 8.539 3.769 1.00 0.00 C ATOM 0 H ILE A 24 -5.256 11.512 2.133 1.00 0.00 H new ATOM 0 HA ILE A 24 -6.732 9.119 2.289 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.367 11.336 4.338 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.199 10.645 3.447 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.374 10.185 5.129 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.612 9.575 6.053 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.075 9.774 5.061 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.984 8.398 4.771 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -3.257 8.425 3.850 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.828 7.850 4.456 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -4.650 8.317 2.749 1.00 0.00 H new ATOM 364 N LYS A 25 -8.390 11.953 2.497 1.00 0.00 N ATOM 365 CA LYS A 25 -9.676 12.603 2.464 1.00 0.00 C ATOM 366 C LYS A 25 -10.444 12.198 1.236 1.00 0.00 C ATOM 367 O LYS A 25 -11.551 11.756 1.335 1.00 0.00 O ATOM 368 CB LYS A 25 -9.512 14.109 2.403 1.00 0.00 C ATOM 369 CG LYS A 25 -10.831 14.871 2.447 1.00 0.00 C ATOM 370 CD LYS A 25 -10.738 16.170 1.673 1.00 0.00 C ATOM 371 CE LYS A 25 -10.853 15.925 0.149 1.00 0.00 C ATOM 372 NZ LYS A 25 -12.198 15.370 -0.267 1.00 0.00 N ATOM 0 H LYS A 25 -7.603 12.601 2.453 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.207 12.307 3.369 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.888 14.432 3.237 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.981 14.371 1.488 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.626 14.252 2.030 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.099 15.080 3.483 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.530 16.846 1.996 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.790 16.661 1.894 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -10.676 16.863 -0.377 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.070 15.233 -0.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -12.236 15.292 -1.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.331 14.429 0.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.952 16.007 0.060 1.00 0.00 H new ATOM 386 N GLU A 26 -9.832 12.370 0.072 1.00 0.00 N ATOM 387 CA GLU A 26 -10.500 12.147 -1.197 1.00 0.00 C ATOM 388 C GLU A 26 -10.891 10.691 -1.345 1.00 0.00 C ATOM 389 O GLU A 26 -11.970 10.372 -1.864 1.00 0.00 O ATOM 390 CB GLU A 26 -9.607 12.556 -2.360 1.00 0.00 C ATOM 391 CG GLU A 26 -10.383 12.863 -3.620 1.00 0.00 C ATOM 392 CD GLU A 26 -11.152 14.153 -3.496 1.00 0.00 C ATOM 393 OE1 GLU A 26 -12.132 14.216 -2.735 1.00 0.00 O ATOM 394 OE2 GLU A 26 -10.781 15.135 -4.158 1.00 0.00 O ATOM 0 H GLU A 26 -8.860 12.668 -0.016 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.400 12.762 -1.211 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.027 13.433 -2.074 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.896 11.756 -2.564 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -9.697 12.927 -4.464 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.073 12.046 -3.832 1.00 0.00 H new ATOM 401 N LEU A 27 -10.024 9.815 -0.877 1.00 0.00 N ATOM 402 CA LEU A 27 -10.298 8.398 -0.944 1.00 0.00 C ATOM 403 C LEU A 27 -11.436 8.063 0.038 1.00 0.00 C ATOM 404 O LEU A 27 -12.206 7.149 -0.186 1.00 0.00 O ATOM 405 CB LEU A 27 -9.024 7.573 -0.666 1.00 0.00 C ATOM 406 CG LEU A 27 -9.067 6.084 -1.046 1.00 0.00 C ATOM 407 CD1 LEU A 27 -9.457 5.926 -2.502 1.00 0.00 C ATOM 408 CD2 LEU A 27 -7.706 5.451 -0.824 1.00 0.00 C ATOM 0 H LEU A 27 -9.131 10.059 -0.450 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.620 8.132 -1.951 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.195 8.037 -1.201 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -8.797 7.646 0.398 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.807 5.588 -0.417 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -9.484 4.867 -2.759 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.442 6.364 -2.664 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -8.726 6.433 -3.132 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.747 4.396 -1.096 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -6.964 5.957 -1.442 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.428 5.545 0.226 1.00 0.00 H new ATOM 420 N LYS A 28 -11.578 8.865 1.084 1.00 0.00 N ATOM 421 CA LYS A 28 -12.634 8.654 2.047 1.00 0.00 C ATOM 422 C LYS A 28 -13.941 9.272 1.544 1.00 0.00 C ATOM 423 O LYS A 28 -15.050 8.795 1.856 1.00 0.00 O ATOM 424 CB LYS A 28 -12.261 9.192 3.434 1.00 0.00 C ATOM 425 CG LYS A 28 -13.262 8.782 4.513 1.00 0.00 C ATOM 426 CD LYS A 28 -12.764 9.071 5.914 1.00 0.00 C ATOM 427 CE LYS A 28 -13.672 8.410 6.952 1.00 0.00 C ATOM 428 NZ LYS A 28 -13.791 6.943 6.726 1.00 0.00 N ATOM 0 H LYS A 28 -10.974 9.663 1.282 1.00 0.00 H new ATOM 0 HA LYS A 28 -12.778 7.579 2.155 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.270 8.828 3.706 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.201 10.280 3.394 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.202 9.310 4.350 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.474 7.717 4.420 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -11.744 8.703 6.027 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -12.734 10.148 6.081 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -13.276 8.593 7.951 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -14.661 8.866 6.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -14.193 6.493 7.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -14.413 6.767 5.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -12.850 6.544 6.536 1.00 0.00 H new ATOM 442 N THR A 29 -13.806 10.325 0.777 1.00 0.00 N ATOM 443 CA THR A 29 -14.923 10.945 0.136 1.00 0.00 C ATOM 444 C THR A 29 -15.499 9.942 -0.878 1.00 0.00 C ATOM 445 O THR A 29 -16.705 9.667 -0.886 1.00 0.00 O ATOM 446 CB THR A 29 -14.496 12.282 -0.526 1.00 0.00 C ATOM 447 OG1 THR A 29 -13.867 13.126 0.481 1.00 0.00 O ATOM 448 CG2 THR A 29 -15.696 13.010 -1.114 1.00 0.00 C ATOM 0 H THR A 29 -12.911 10.773 0.583 1.00 0.00 H new ATOM 0 HA THR A 29 -15.697 11.200 0.860 1.00 0.00 H new ATOM 0 HB THR A 29 -13.798 12.065 -1.334 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.029 12.713 0.777 1.00 0.00 H new ATOM 0 HG21 THR A 29 -15.367 13.943 -1.571 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.168 12.382 -1.870 1.00 0.00 H new ATOM 0 HG23 THR A 29 -16.414 13.227 -0.323 1.00 0.00 H new ATOM 456 N ALA A 30 -14.617 9.331 -1.684 1.00 0.00 N ATOM 457 CA ALA A 30 -14.979 8.292 -2.593 1.00 0.00 C ATOM 458 C ALA A 30 -15.544 7.100 -1.841 1.00 0.00 C ATOM 459 O ALA A 30 -16.437 6.472 -2.318 1.00 0.00 O ATOM 460 CB ALA A 30 -13.788 7.895 -3.437 1.00 0.00 C ATOM 0 H ALA A 30 -13.625 9.566 -1.704 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.757 8.663 -3.261 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.078 7.102 -4.126 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.440 8.758 -4.004 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -12.986 7.538 -2.790 1.00 0.00 H new ATOM 466 N ALA A 31 -14.975 6.773 -0.693 1.00 0.00 N ATOM 467 CA ALA A 31 -15.502 5.701 0.143 1.00 0.00 C ATOM 468 C ALA A 31 -16.987 5.900 0.408 1.00 0.00 C ATOM 469 O ALA A 31 -17.776 4.975 0.274 1.00 0.00 O ATOM 470 CB ALA A 31 -14.803 5.688 1.482 1.00 0.00 C ATOM 0 H ALA A 31 -14.147 7.234 -0.316 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.336 4.764 -0.389 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -15.207 4.883 2.095 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.735 5.530 1.333 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.962 6.642 1.985 1.00 0.00 H new ATOM 476 N SER A 32 -17.347 7.126 0.743 1.00 0.00 N ATOM 477 CA SER A 32 -18.696 7.453 1.127 1.00 0.00 C ATOM 478 C SER A 32 -19.612 7.535 -0.104 1.00 0.00 C ATOM 479 O SER A 32 -20.694 6.952 -0.129 1.00 0.00 O ATOM 480 CB SER A 32 -18.694 8.793 1.877 1.00 0.00 C ATOM 481 OG SER A 32 -17.703 8.804 2.919 1.00 0.00 O ATOM 0 H SER A 32 -16.706 7.920 0.754 1.00 0.00 H new ATOM 0 HA SER A 32 -19.080 6.668 1.778 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.498 9.605 1.176 1.00 0.00 H new ATOM 0 HB3 SER A 32 -19.679 8.974 2.307 1.00 0.00 H new ATOM 0 HG SER A 32 -16.810 8.863 2.520 1.00 0.00 H new ATOM 487 N GLN A 33 -19.161 8.241 -1.136 1.00 0.00 N ATOM 488 CA GLN A 33 -19.940 8.503 -2.336 1.00 0.00 C ATOM 489 C GLN A 33 -19.935 7.343 -3.323 1.00 0.00 C ATOM 490 O GLN A 33 -20.974 6.867 -3.757 1.00 0.00 O ATOM 491 CB GLN A 33 -19.303 9.696 -3.032 1.00 0.00 C ATOM 492 CG GLN A 33 -19.303 10.966 -2.246 1.00 0.00 C ATOM 493 CD GLN A 33 -20.626 11.627 -2.319 1.00 0.00 C ATOM 494 OE1 GLN A 33 -21.518 11.397 -1.500 1.00 0.00 O ATOM 495 NE2 GLN A 33 -20.773 12.443 -3.308 1.00 0.00 N ATOM 0 H GLN A 33 -18.228 8.653 -1.160 1.00 0.00 H new ATOM 0 HA GLN A 33 -20.973 8.673 -2.033 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -18.273 9.443 -3.282 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -19.826 9.870 -3.972 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.053 10.756 -1.206 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -18.534 11.637 -2.629 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -20.003 12.599 -3.959 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -21.659 12.932 -3.439 1.00 0.00 H new ATOM 504 N TYR A 34 -18.756 6.899 -3.642 1.00 0.00 N ATOM 505 CA TYR A 34 -18.500 5.982 -4.732 1.00 0.00 C ATOM 506 C TYR A 34 -18.478 4.526 -4.275 1.00 0.00 C ATOM 507 O TYR A 34 -19.073 3.660 -4.914 1.00 0.00 O ATOM 508 CB TYR A 34 -17.163 6.401 -5.424 1.00 0.00 C ATOM 509 CG TYR A 34 -17.281 7.637 -6.315 1.00 0.00 C ATOM 510 CD1 TYR A 34 -17.225 8.908 -5.771 1.00 0.00 C ATOM 511 CD2 TYR A 34 -17.447 7.522 -7.693 1.00 0.00 C ATOM 512 CE1 TYR A 34 -17.337 10.036 -6.551 1.00 0.00 C ATOM 513 CE2 TYR A 34 -17.558 8.652 -8.496 1.00 0.00 C ATOM 514 CZ TYR A 34 -17.496 9.912 -7.915 1.00 0.00 C ATOM 515 OH TYR A 34 -17.607 11.049 -8.702 1.00 0.00 O ATOM 0 H TYR A 34 -17.911 7.170 -3.138 1.00 0.00 H new ATOM 0 HA TYR A 34 -19.317 6.044 -5.451 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -16.413 6.590 -4.656 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -16.801 5.567 -6.025 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -17.090 9.018 -4.705 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -17.490 6.542 -8.144 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -17.300 11.015 -6.096 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -17.691 8.551 -9.563 1.00 0.00 H new ATOM 0 HH TYR A 34 -17.713 10.788 -9.641 1.00 0.00 H new ATOM 525 N GLY A 35 -17.851 4.277 -3.151 1.00 0.00 N ATOM 526 CA GLY A 35 -17.669 2.930 -2.685 1.00 0.00 C ATOM 527 C GLY A 35 -16.524 2.252 -3.445 1.00 0.00 C ATOM 528 O GLY A 35 -16.181 2.667 -4.558 1.00 0.00 O ATOM 0 H GLY A 35 -17.458 4.995 -2.542 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.453 2.934 -1.617 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.590 2.364 -2.821 1.00 0.00 H new ATOM 532 N ALA A 36 -15.972 1.178 -2.910 1.00 0.00 N ATOM 533 CA ALA A 36 -14.825 0.567 -3.559 1.00 0.00 C ATOM 534 C ALA A 36 -15.298 -0.503 -4.474 1.00 0.00 C ATOM 535 O ALA A 36 -15.560 -1.616 -4.067 1.00 0.00 O ATOM 536 CB ALA A 36 -13.827 0.044 -2.582 1.00 0.00 C ATOM 0 H ALA A 36 -16.287 0.721 -2.054 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.307 1.335 -4.133 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -12.990 -0.402 -3.120 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.464 0.862 -1.960 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.296 -0.711 -1.951 1.00 0.00 H new ATOM 542 N THR A 37 -15.354 -0.127 -5.712 1.00 0.00 N ATOM 543 CA THR A 37 -15.901 -0.878 -6.816 1.00 0.00 C ATOM 544 C THR A 37 -15.893 0.036 -8.006 1.00 0.00 C ATOM 545 O THR A 37 -15.568 -0.372 -9.125 1.00 0.00 O ATOM 546 CB THR A 37 -17.352 -1.368 -6.585 1.00 0.00 C ATOM 547 OG1 THR A 37 -18.104 -0.489 -5.732 1.00 0.00 O ATOM 548 CG2 THR A 37 -17.447 -2.797 -6.111 1.00 0.00 C ATOM 0 H THR A 37 -14.993 0.780 -6.008 1.00 0.00 H new ATOM 0 HA THR A 37 -15.293 -1.773 -6.949 1.00 0.00 H new ATOM 0 HB THR A 37 -17.809 -1.343 -7.574 1.00 0.00 H new ATOM 0 HG1 THR A 37 -18.203 -0.898 -4.847 1.00 0.00 H new ATOM 0 HG21 THR A 37 -18.494 -3.065 -5.972 1.00 0.00 H new ATOM 0 HG22 THR A 37 -16.998 -3.457 -6.853 1.00 0.00 H new ATOM 0 HG23 THR A 37 -16.917 -2.902 -5.164 1.00 0.00 H new ATOM 556 N ALA A 38 -16.220 1.297 -7.735 1.00 0.00 N ATOM 557 CA ALA A 38 -16.219 2.333 -8.727 1.00 0.00 C ATOM 558 C ALA A 38 -14.787 2.585 -9.164 1.00 0.00 C ATOM 559 O ALA A 38 -13.931 2.860 -8.316 1.00 0.00 O ATOM 560 CB ALA A 38 -16.833 3.593 -8.148 1.00 0.00 C ATOM 0 H ALA A 38 -16.494 1.617 -6.806 1.00 0.00 H new ATOM 0 HA ALA A 38 -16.810 2.031 -9.591 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -16.831 4.379 -8.903 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -17.858 3.389 -7.839 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -16.252 3.918 -7.285 1.00 0.00 H new ATOM 566 N PRO A 39 -14.512 2.483 -10.484 1.00 0.00 N ATOM 567 CA PRO A 39 -13.158 2.614 -11.059 1.00 0.00 C ATOM 568 C PRO A 39 -12.366 3.805 -10.520 1.00 0.00 C ATOM 569 O PRO A 39 -11.159 3.717 -10.315 1.00 0.00 O ATOM 570 CB PRO A 39 -13.436 2.792 -12.542 1.00 0.00 C ATOM 571 CG PRO A 39 -14.689 2.038 -12.781 1.00 0.00 C ATOM 572 CD PRO A 39 -15.520 2.226 -11.551 1.00 0.00 C ATOM 0 HA PRO A 39 -12.538 1.753 -10.809 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -13.552 3.845 -12.800 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -12.618 2.403 -13.148 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -15.208 2.412 -13.664 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -14.483 0.982 -12.956 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -16.212 3.061 -11.658 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.119 1.342 -11.332 1.00 0.00 H new ATOM 580 N TYR A 40 -13.063 4.897 -10.269 1.00 0.00 N ATOM 581 CA TYR A 40 -12.470 6.110 -9.743 1.00 0.00 C ATOM 582 C TYR A 40 -11.681 5.869 -8.443 1.00 0.00 C ATOM 583 O TYR A 40 -10.482 6.184 -8.365 1.00 0.00 O ATOM 584 CB TYR A 40 -13.563 7.180 -9.528 1.00 0.00 C ATOM 585 CG TYR A 40 -13.100 8.444 -8.817 1.00 0.00 C ATOM 586 CD1 TYR A 40 -12.315 9.391 -9.460 1.00 0.00 C ATOM 587 CD2 TYR A 40 -13.463 8.684 -7.497 1.00 0.00 C ATOM 588 CE1 TYR A 40 -11.904 10.544 -8.804 1.00 0.00 C ATOM 589 CE2 TYR A 40 -13.056 9.823 -6.840 1.00 0.00 C ATOM 590 CZ TYR A 40 -12.278 10.749 -7.493 1.00 0.00 C ATOM 591 OH TYR A 40 -11.875 11.883 -6.829 1.00 0.00 O ATOM 0 H TYR A 40 -14.068 4.967 -10.427 1.00 0.00 H new ATOM 0 HA TYR A 40 -11.752 6.468 -10.481 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -13.973 7.458 -10.499 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -14.376 6.736 -8.954 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -12.019 9.229 -10.486 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.076 7.963 -6.977 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -11.296 11.274 -9.317 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -13.347 9.989 -5.813 1.00 0.00 H new ATOM 0 HH TYR A 40 -12.227 11.869 -5.915 1.00 0.00 H new ATOM 601 N THR A 41 -12.324 5.288 -7.425 1.00 0.00 N ATOM 602 CA THR A 41 -11.714 5.147 -6.132 1.00 0.00 C ATOM 603 C THR A 41 -10.521 4.189 -6.141 1.00 0.00 C ATOM 604 O THR A 41 -9.508 4.474 -5.512 1.00 0.00 O ATOM 605 CB THR A 41 -12.749 4.772 -5.034 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.141 4.791 -3.745 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.326 3.406 -5.270 1.00 0.00 C ATOM 0 H THR A 41 -13.270 4.912 -7.489 1.00 0.00 H new ATOM 0 HA THR A 41 -11.317 6.130 -5.877 1.00 0.00 H new ATOM 0 HB THR A 41 -13.548 5.512 -5.080 1.00 0.00 H new ATOM 0 HG1 THR A 41 -12.807 4.554 -3.066 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.046 3.174 -4.485 1.00 0.00 H new ATOM 0 HG22 THR A 41 -13.826 3.384 -6.238 1.00 0.00 H new ATOM 0 HG23 THR A 41 -12.526 2.666 -5.258 1.00 0.00 H new ATOM 615 N LEU A 42 -10.602 3.084 -6.868 1.00 0.00 N ATOM 616 CA LEU A 42 -9.471 2.186 -6.893 1.00 0.00 C ATOM 617 C LEU A 42 -8.333 2.695 -7.734 1.00 0.00 C ATOM 618 O LEU A 42 -7.188 2.328 -7.507 1.00 0.00 O ATOM 619 CB LEU A 42 -9.764 0.659 -7.040 1.00 0.00 C ATOM 620 CG LEU A 42 -10.819 0.151 -8.035 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.215 0.409 -7.527 1.00 0.00 C ATOM 622 CD2 LEU A 42 -10.632 0.727 -9.414 1.00 0.00 C ATOM 0 H LEU A 42 -11.407 2.800 -7.426 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.124 2.214 -5.860 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.822 0.176 -7.298 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.051 0.292 -6.055 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.679 -0.927 -8.119 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -12.940 0.039 -8.252 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.357 -0.105 -6.577 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.358 1.480 -7.385 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -11.402 0.337 -10.079 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -10.709 1.813 -9.368 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -9.649 0.448 -9.794 1.00 0.00 H new ATOM 634 N ALA A 43 -8.648 3.597 -8.675 1.00 0.00 N ATOM 635 CA ALA A 43 -7.621 4.287 -9.440 1.00 0.00 C ATOM 636 C ALA A 43 -6.777 5.114 -8.495 1.00 0.00 C ATOM 637 O ALA A 43 -5.573 5.248 -8.661 1.00 0.00 O ATOM 638 CB ALA A 43 -8.219 5.165 -10.531 1.00 0.00 C ATOM 0 H ALA A 43 -9.603 3.859 -8.918 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.000 3.542 -9.938 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -7.418 5.662 -11.078 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -8.799 4.548 -11.218 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -8.869 5.914 -10.079 1.00 0.00 H new ATOM 644 N ILE A 44 -7.423 5.641 -7.491 1.00 0.00 N ATOM 645 CA ILE A 44 -6.745 6.369 -6.450 1.00 0.00 C ATOM 646 C ILE A 44 -5.886 5.386 -5.620 1.00 0.00 C ATOM 647 O ILE A 44 -4.705 5.624 -5.442 1.00 0.00 O ATOM 648 CB ILE A 44 -7.751 7.084 -5.540 1.00 0.00 C ATOM 649 CG1 ILE A 44 -8.672 7.963 -6.382 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.029 7.921 -4.479 1.00 0.00 C ATOM 651 CD1 ILE A 44 -9.850 8.488 -5.625 1.00 0.00 C ATOM 0 H ILE A 44 -8.434 5.579 -7.370 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.105 7.124 -6.906 1.00 0.00 H new ATOM 0 HB ILE A 44 -8.350 6.334 -5.023 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.100 8.803 -6.776 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.027 7.389 -7.238 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -7.764 8.418 -3.846 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -6.403 7.271 -3.867 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -6.406 8.669 -4.968 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -10.461 9.104 -6.285 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -10.445 7.654 -5.253 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -9.504 9.089 -4.784 1.00 0.00 H new ATOM 663 N VAL A 45 -6.491 4.253 -5.193 1.00 0.00 N ATOM 664 CA VAL A 45 -5.800 3.196 -4.398 1.00 0.00 C ATOM 665 C VAL A 45 -4.439 2.825 -5.046 1.00 0.00 C ATOM 666 O VAL A 45 -3.374 2.904 -4.397 1.00 0.00 O ATOM 667 CB VAL A 45 -6.700 1.896 -4.255 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.018 0.813 -3.433 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.036 2.215 -3.620 1.00 0.00 C ATOM 0 H VAL A 45 -7.470 4.041 -5.386 1.00 0.00 H new ATOM 0 HA VAL A 45 -5.622 3.601 -3.402 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.854 1.526 -5.269 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -6.672 -0.056 -3.363 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.083 0.526 -3.914 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -5.810 1.192 -2.433 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -8.627 1.303 -3.537 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.876 2.635 -2.627 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -8.569 2.938 -4.238 1.00 0.00 H new ATOM 679 N GLU A 46 -4.476 2.485 -6.331 1.00 0.00 N ATOM 680 CA GLU A 46 -3.269 2.128 -7.071 1.00 0.00 C ATOM 681 C GLU A 46 -2.318 3.320 -7.276 1.00 0.00 C ATOM 682 O GLU A 46 -1.099 3.147 -7.288 1.00 0.00 O ATOM 683 CB GLU A 46 -3.606 1.453 -8.408 1.00 0.00 C ATOM 684 CG GLU A 46 -4.641 2.192 -9.221 1.00 0.00 C ATOM 685 CD GLU A 46 -4.872 1.592 -10.575 1.00 0.00 C ATOM 686 OE1 GLU A 46 -4.154 1.950 -11.527 1.00 0.00 O ATOM 687 OE2 GLU A 46 -5.778 0.768 -10.724 1.00 0.00 O ATOM 0 H GLU A 46 -5.332 2.449 -6.884 1.00 0.00 H new ATOM 0 HA GLU A 46 -2.736 1.406 -6.452 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -2.694 1.360 -8.997 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.964 0.442 -8.214 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.582 2.205 -8.672 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.327 3.229 -9.340 1.00 0.00 H new ATOM 694 N SER A 47 -2.855 4.534 -7.362 1.00 0.00 N ATOM 695 CA SER A 47 -2.021 5.718 -7.581 1.00 0.00 C ATOM 696 C SER A 47 -1.306 6.147 -6.312 1.00 0.00 C ATOM 697 O SER A 47 -0.256 6.806 -6.360 1.00 0.00 O ATOM 698 CB SER A 47 -2.838 6.868 -8.140 1.00 0.00 C ATOM 699 OG SER A 47 -3.372 6.511 -9.413 1.00 0.00 O ATOM 0 H SER A 47 -3.854 4.726 -7.285 1.00 0.00 H new ATOM 0 HA SER A 47 -1.264 5.442 -8.315 1.00 0.00 H new ATOM 0 HB2 SER A 47 -3.647 7.118 -7.454 1.00 0.00 H new ATOM 0 HB3 SER A 47 -2.214 7.757 -8.234 1.00 0.00 H new ATOM 0 HG SER A 47 -4.159 5.940 -9.289 1.00 0.00 H new ATOM 705 N VAL A 48 -1.857 5.779 -5.178 1.00 0.00 N ATOM 706 CA VAL A 48 -1.219 6.079 -3.926 1.00 0.00 C ATOM 707 C VAL A 48 -0.104 5.061 -3.694 1.00 0.00 C ATOM 708 O VAL A 48 0.939 5.381 -3.185 1.00 0.00 O ATOM 709 CB VAL A 48 -2.220 6.093 -2.739 1.00 0.00 C ATOM 710 CG1 VAL A 48 -1.520 6.515 -1.469 1.00 0.00 C ATOM 711 CG2 VAL A 48 -3.378 7.039 -3.026 1.00 0.00 C ATOM 0 H VAL A 48 -2.740 5.275 -5.101 1.00 0.00 H new ATOM 0 HA VAL A 48 -0.802 7.085 -3.978 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.613 5.084 -2.612 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.233 6.521 -0.645 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.715 5.814 -1.247 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.106 7.515 -1.597 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.069 7.035 -2.183 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -2.995 8.048 -3.176 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -3.901 6.712 -3.925 1.00 0.00 H new ATOM 721 N ALA A 49 -0.312 3.843 -4.166 1.00 0.00 N ATOM 722 CA ALA A 49 0.719 2.816 -4.051 1.00 0.00 C ATOM 723 C ALA A 49 1.729 2.937 -5.185 1.00 0.00 C ATOM 724 O ALA A 49 2.643 2.148 -5.304 1.00 0.00 O ATOM 725 CB ALA A 49 0.098 1.429 -3.999 1.00 0.00 C ATOM 0 H ALA A 49 -1.171 3.541 -4.626 1.00 0.00 H new ATOM 0 HA ALA A 49 1.255 2.969 -3.114 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.886 0.681 -3.913 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -0.564 1.359 -3.136 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -0.473 1.252 -4.910 1.00 0.00 H new ATOM 731 N ASP A 50 1.533 3.944 -6.018 1.00 0.00 N ATOM 732 CA ASP A 50 2.448 4.273 -7.114 1.00 0.00 C ATOM 733 C ASP A 50 3.699 4.935 -6.542 1.00 0.00 C ATOM 734 O ASP A 50 4.766 5.007 -7.189 1.00 0.00 O ATOM 735 CB ASP A 50 1.732 5.188 -8.124 1.00 0.00 C ATOM 736 CG ASP A 50 2.621 5.772 -9.198 1.00 0.00 C ATOM 737 OD1 ASP A 50 2.789 5.145 -10.269 1.00 0.00 O ATOM 738 OD2 ASP A 50 3.104 6.903 -9.014 1.00 0.00 O ATOM 0 H ASP A 50 0.728 4.567 -5.958 1.00 0.00 H new ATOM 0 HA ASP A 50 2.752 3.368 -7.640 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.934 4.621 -8.603 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.260 6.006 -7.580 1.00 0.00 H new ATOM 743 N ASN A 51 3.599 5.364 -5.294 1.00 0.00 N ATOM 744 CA ASN A 51 4.719 5.961 -4.636 1.00 0.00 C ATOM 745 C ASN A 51 5.137 5.078 -3.491 1.00 0.00 C ATOM 746 O ASN A 51 4.524 4.035 -3.253 1.00 0.00 O ATOM 747 CB ASN A 51 4.443 7.405 -4.156 1.00 0.00 C ATOM 748 CG ASN A 51 3.484 7.546 -2.980 1.00 0.00 C ATOM 749 OD1 ASN A 51 3.889 7.502 -1.821 1.00 0.00 O ATOM 750 ND2 ASN A 51 2.242 7.807 -3.270 1.00 0.00 N ATOM 0 H ASN A 51 2.752 5.304 -4.730 1.00 0.00 H new ATOM 0 HA ASN A 51 5.530 6.045 -5.360 1.00 0.00 H new ATOM 0 HB2 ASN A 51 5.393 7.863 -3.881 1.00 0.00 H new ATOM 0 HB3 ASN A 51 4.044 7.976 -4.995 1.00 0.00 H new ATOM 0 HD21 ASN A 51 1.570 7.983 -2.523 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.941 7.835 -4.244 1.00 0.00 H new ATOM 757 N TRP A 52 6.166 5.480 -2.794 1.00 0.00 N ATOM 758 CA TRP A 52 6.690 4.702 -1.712 1.00 0.00 C ATOM 759 C TRP A 52 5.732 4.720 -0.532 1.00 0.00 C ATOM 760 O TRP A 52 5.508 5.755 0.079 1.00 0.00 O ATOM 761 CB TRP A 52 8.086 5.193 -1.315 1.00 0.00 C ATOM 762 CG TRP A 52 9.103 5.066 -2.412 1.00 0.00 C ATOM 763 CD1 TRP A 52 9.768 3.934 -2.777 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.581 6.105 -3.278 1.00 0.00 C ATOM 765 NE1 TRP A 52 10.621 4.202 -3.814 1.00 0.00 N ATOM 766 CE2 TRP A 52 10.522 5.523 -4.147 1.00 0.00 C ATOM 767 CE3 TRP A 52 9.294 7.470 -3.421 1.00 0.00 C ATOM 768 CZ2 TRP A 52 11.195 6.251 -5.120 1.00 0.00 C ATOM 769 CZ3 TRP A 52 9.964 8.189 -4.386 1.00 0.00 C ATOM 770 CH2 TRP A 52 10.895 7.581 -5.232 1.00 0.00 C ATOM 0 H TRP A 52 6.662 6.355 -2.963 1.00 0.00 H new ATOM 0 HA TRP A 52 6.790 3.668 -2.042 1.00 0.00 H new ATOM 0 HB2 TRP A 52 8.021 6.238 -1.010 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.427 4.628 -0.447 1.00 0.00 H new ATOM 0 HD1 TRP A 52 9.641 2.966 -2.315 1.00 0.00 H new ATOM 0 HE1 TRP A 52 11.233 3.523 -4.266 1.00 0.00 H new ATOM 0 HE3 TRP A 52 8.562 7.948 -2.787 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 11.927 5.785 -5.763 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 9.765 9.245 -4.491 1.00 0.00 H new ATOM 0 HH2 TRP A 52 11.388 8.173 -5.989 1.00 0.00 H new ATOM 781 N LEU A 53 5.214 3.564 -0.211 1.00 0.00 N ATOM 782 CA LEU A 53 4.250 3.366 0.843 1.00 0.00 C ATOM 783 C LEU A 53 4.768 2.237 1.727 1.00 0.00 C ATOM 784 O LEU A 53 5.366 1.281 1.218 1.00 0.00 O ATOM 785 CB LEU A 53 2.888 3.000 0.220 1.00 0.00 C ATOM 786 CG LEU A 53 1.711 3.984 0.439 1.00 0.00 C ATOM 787 CD1 LEU A 53 2.038 5.368 -0.055 1.00 0.00 C ATOM 788 CD2 LEU A 53 0.472 3.490 -0.264 1.00 0.00 C ATOM 0 H LEU A 53 5.460 2.700 -0.694 1.00 0.00 H new ATOM 0 HA LEU A 53 4.116 4.269 1.439 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.031 2.881 -0.854 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.590 2.027 0.612 1.00 0.00 H new ATOM 0 HG LEU A 53 1.533 4.034 1.513 1.00 0.00 H new ATOM 0 HD11 LEU A 53 1.187 6.026 0.117 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.907 5.750 0.481 1.00 0.00 H new ATOM 0 HD13 LEU A 53 2.258 5.331 -1.122 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -0.344 4.193 -0.099 1.00 0.00 H new ATOM 0 HD22 LEU A 53 0.669 3.406 -1.333 1.00 0.00 H new ATOM 0 HD23 LEU A 53 0.194 2.513 0.131 1.00 0.00 H new ATOM 800 N THR A 54 4.579 2.351 3.018 1.00 0.00 N ATOM 801 CA THR A 54 5.095 1.369 3.953 1.00 0.00 C ATOM 802 C THR A 54 3.940 0.556 4.528 1.00 0.00 C ATOM 803 O THR A 54 2.832 1.055 4.584 1.00 0.00 O ATOM 804 CB THR A 54 5.842 2.063 5.139 1.00 0.00 C ATOM 805 OG1 THR A 54 4.925 2.872 5.909 1.00 0.00 O ATOM 806 CG2 THR A 54 6.964 2.959 4.628 1.00 0.00 C ATOM 0 H THR A 54 4.068 3.119 3.453 1.00 0.00 H new ATOM 0 HA THR A 54 5.791 0.725 3.415 1.00 0.00 H new ATOM 0 HB THR A 54 6.262 1.276 5.766 1.00 0.00 H new ATOM 0 HG1 THR A 54 4.718 3.692 5.414 1.00 0.00 H new ATOM 0 HG21 THR A 54 7.467 3.429 5.473 1.00 0.00 H new ATOM 0 HG22 THR A 54 7.681 2.360 4.066 1.00 0.00 H new ATOM 0 HG23 THR A 54 6.547 3.729 3.979 1.00 0.00 H new ATOM 814 N PRO A 55 4.171 -0.717 4.940 1.00 0.00 N ATOM 815 CA PRO A 55 3.159 -1.541 5.641 1.00 0.00 C ATOM 816 C PRO A 55 2.443 -0.784 6.788 1.00 0.00 C ATOM 817 O PRO A 55 1.220 -0.942 6.987 1.00 0.00 O ATOM 818 CB PRO A 55 4.003 -2.671 6.221 1.00 0.00 C ATOM 819 CG PRO A 55 5.075 -2.870 5.211 1.00 0.00 C ATOM 820 CD PRO A 55 5.404 -1.495 4.676 1.00 0.00 C ATOM 0 HA PRO A 55 2.358 -1.855 4.972 1.00 0.00 H new ATOM 0 HB2 PRO A 55 4.415 -2.403 7.194 1.00 0.00 H new ATOM 0 HB3 PRO A 55 3.414 -3.577 6.363 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.953 -3.334 5.660 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.740 -3.530 4.411 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.267 -1.063 5.183 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.640 -1.524 3.612 1.00 0.00 H new ATOM 828 N THR A 56 3.207 0.028 7.517 1.00 0.00 N ATOM 829 CA THR A 56 2.698 0.837 8.608 1.00 0.00 C ATOM 830 C THR A 56 1.629 1.851 8.109 1.00 0.00 C ATOM 831 O THR A 56 0.449 1.867 8.594 1.00 0.00 O ATOM 832 CB THR A 56 3.875 1.599 9.265 1.00 0.00 C ATOM 833 OG1 THR A 56 4.883 0.654 9.668 1.00 0.00 O ATOM 834 CG2 THR A 56 3.423 2.397 10.485 1.00 0.00 C ATOM 0 H THR A 56 4.209 0.139 7.359 1.00 0.00 H new ATOM 0 HA THR A 56 2.222 0.179 9.336 1.00 0.00 H new ATOM 0 HB THR A 56 4.274 2.300 8.531 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.632 1.131 10.083 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.278 2.917 10.917 1.00 0.00 H new ATOM 0 HG22 THR A 56 2.669 3.125 10.185 1.00 0.00 H new ATOM 0 HG23 THR A 56 2.998 1.720 11.226 1.00 0.00 H new ATOM 842 N ASP A 57 1.971 2.616 7.070 1.00 0.00 N ATOM 843 CA ASP A 57 1.024 3.587 6.534 1.00 0.00 C ATOM 844 C ASP A 57 -0.050 2.930 5.745 1.00 0.00 C ATOM 845 O ASP A 57 -1.141 3.429 5.698 1.00 0.00 O ATOM 846 CB ASP A 57 1.668 4.757 5.765 1.00 0.00 C ATOM 847 CG ASP A 57 2.355 4.399 4.476 1.00 0.00 C ATOM 848 OD1 ASP A 57 1.699 4.153 3.506 1.00 0.00 O ATOM 849 OD2 ASP A 57 3.610 4.477 4.425 1.00 0.00 O ATOM 0 H ASP A 57 2.873 2.583 6.595 1.00 0.00 H new ATOM 0 HA ASP A 57 0.568 4.048 7.410 1.00 0.00 H new ATOM 0 HB2 ASP A 57 0.894 5.494 5.549 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.394 5.240 6.419 1.00 0.00 H new ATOM 854 N TRP A 58 0.259 1.788 5.160 1.00 0.00 N ATOM 855 CA TRP A 58 -0.714 0.965 4.489 1.00 0.00 C ATOM 856 C TRP A 58 -1.901 0.658 5.398 1.00 0.00 C ATOM 857 O TRP A 58 -3.042 1.015 5.086 1.00 0.00 O ATOM 858 CB TRP A 58 -0.082 -0.355 3.995 1.00 0.00 C ATOM 859 CG TRP A 58 0.425 -0.339 2.575 1.00 0.00 C ATOM 860 CD1 TRP A 58 0.341 0.675 1.672 1.00 0.00 C ATOM 861 CD2 TRP A 58 1.055 -1.426 1.887 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.888 0.278 0.464 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.328 -0.991 0.575 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.415 -2.723 2.250 1.00 0.00 C ATOM 865 CZ2 TRP A 58 1.943 -1.795 -0.364 1.00 0.00 C ATOM 866 CZ3 TRP A 58 2.027 -3.523 1.305 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.277 -3.053 0.015 1.00 0.00 C ATOM 0 H TRP A 58 1.205 1.407 5.140 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.071 1.528 3.627 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.747 -0.611 4.656 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -0.822 -1.150 4.090 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.089 1.646 1.869 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.948 0.854 -0.376 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.220 -3.093 3.246 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.150 -1.436 -1.361 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.317 -4.529 1.569 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.749 -3.709 -0.701 1.00 0.00 H new ATOM 878 N ASN A 59 -1.633 0.036 6.537 1.00 0.00 N ATOM 879 CA ASN A 59 -2.702 -0.365 7.469 1.00 0.00 C ATOM 880 C ASN A 59 -3.489 0.858 7.914 1.00 0.00 C ATOM 881 O ASN A 59 -4.716 0.836 7.970 1.00 0.00 O ATOM 882 CB ASN A 59 -2.125 -1.098 8.684 1.00 0.00 C ATOM 883 CG ASN A 59 -3.201 -1.714 9.561 1.00 0.00 C ATOM 884 OD1 ASN A 59 -4.270 -2.097 9.073 1.00 0.00 O ATOM 885 ND2 ASN A 59 -2.922 -1.858 10.832 1.00 0.00 N ATOM 0 H ASN A 59 -0.692 -0.206 6.846 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.372 -1.050 6.949 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.447 -1.881 8.343 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -1.534 -0.400 9.277 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -3.598 -2.299 11.456 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -2.029 -1.529 11.198 1.00 0.00 H new ATOM 892 N THR A 60 -2.752 1.934 8.072 1.00 0.00 N ATOM 893 CA THR A 60 -3.345 3.180 8.520 1.00 0.00 C ATOM 894 C THR A 60 -4.284 3.784 7.429 1.00 0.00 C ATOM 895 O THR A 60 -5.440 4.185 7.705 1.00 0.00 O ATOM 896 CB THR A 60 -2.224 4.172 8.894 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.345 3.542 9.852 1.00 0.00 O ATOM 898 CG2 THR A 60 -2.800 5.439 9.508 1.00 0.00 C ATOM 0 H THR A 60 -1.748 1.975 7.899 1.00 0.00 H new ATOM 0 HA THR A 60 -3.958 2.983 9.399 1.00 0.00 H new ATOM 0 HB THR A 60 -1.679 4.442 7.990 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.709 2.964 9.381 1.00 0.00 H new ATOM 0 HG21 THR A 60 -1.989 6.121 9.763 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.467 5.919 8.792 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.357 5.185 10.410 1.00 0.00 H new ATOM 906 N LEU A 61 -3.801 3.762 6.212 1.00 0.00 N ATOM 907 CA LEU A 61 -4.483 4.301 5.074 1.00 0.00 C ATOM 908 C LEU A 61 -5.806 3.590 4.871 1.00 0.00 C ATOM 909 O LEU A 61 -6.854 4.225 4.996 1.00 0.00 O ATOM 910 CB LEU A 61 -3.563 4.190 3.845 1.00 0.00 C ATOM 911 CG LEU A 61 -3.911 5.007 2.591 1.00 0.00 C ATOM 912 CD1 LEU A 61 -2.664 5.199 1.764 1.00 0.00 C ATOM 913 CD2 LEU A 61 -4.930 4.316 1.720 1.00 0.00 C ATOM 0 H LEU A 61 -2.894 3.355 5.985 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.714 5.354 5.232 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.558 4.474 4.157 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.522 3.140 3.555 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.326 5.956 2.932 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.904 5.778 0.872 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -1.916 5.731 2.352 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.269 4.227 1.469 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -5.142 4.934 0.847 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.538 3.352 1.396 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -5.848 4.162 2.287 1.00 0.00 H new ATOM 925 N VAL A 62 -5.753 2.266 4.637 1.00 0.00 N ATOM 926 CA VAL A 62 -6.971 1.459 4.373 1.00 0.00 C ATOM 927 C VAL A 62 -8.036 1.657 5.447 1.00 0.00 C ATOM 928 O VAL A 62 -9.199 1.950 5.152 1.00 0.00 O ATOM 929 CB VAL A 62 -6.665 -0.090 4.204 1.00 0.00 C ATOM 930 CG1 VAL A 62 -5.792 -0.628 5.321 1.00 0.00 C ATOM 931 CG2 VAL A 62 -7.955 -0.894 4.183 1.00 0.00 C ATOM 0 H VAL A 62 -4.886 1.729 4.624 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.357 1.829 3.423 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.134 -0.195 3.258 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.611 -1.691 5.161 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.841 -0.095 5.329 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.296 -0.486 6.277 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.722 -1.952 4.066 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.494 -0.742 5.118 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.575 -0.565 3.349 1.00 0.00 H new ATOM 941 N ARG A 63 -7.599 1.554 6.675 1.00 0.00 N ATOM 942 CA ARG A 63 -8.498 1.606 7.842 1.00 0.00 C ATOM 943 C ARG A 63 -9.159 2.971 8.041 1.00 0.00 C ATOM 944 O ARG A 63 -10.189 3.073 8.728 1.00 0.00 O ATOM 945 CB ARG A 63 -7.794 1.178 9.119 1.00 0.00 C ATOM 946 CG ARG A 63 -6.815 2.189 9.652 1.00 0.00 C ATOM 947 CD ARG A 63 -6.043 1.636 10.811 1.00 0.00 C ATOM 948 NE ARG A 63 -5.163 2.656 11.380 1.00 0.00 N ATOM 949 CZ ARG A 63 -4.163 2.440 12.240 1.00 0.00 C ATOM 950 NH1 ARG A 63 -3.870 1.193 12.653 1.00 0.00 N ATOM 951 NH2 ARG A 63 -3.462 3.474 12.683 1.00 0.00 N ATOM 0 H ARG A 63 -6.615 1.431 6.914 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.292 0.893 7.621 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -8.544 0.977 9.884 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -7.268 0.242 8.934 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.126 2.485 8.861 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -7.349 3.087 9.962 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -6.732 1.276 11.575 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -5.452 0.780 10.486 1.00 0.00 H new ATOM 0 HE ARG A 63 -5.328 3.621 11.094 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.413 0.401 12.309 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.105 1.040 13.310 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -3.689 4.417 12.367 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -2.696 3.327 13.340 1.00 0.00 H new ATOM 965 N ALA A 64 -8.594 4.008 7.471 1.00 0.00 N ATOM 966 CA ALA A 64 -9.186 5.319 7.622 1.00 0.00 C ATOM 967 C ALA A 64 -9.991 5.692 6.386 1.00 0.00 C ATOM 968 O ALA A 64 -11.161 6.097 6.498 1.00 0.00 O ATOM 969 CB ALA A 64 -8.107 6.360 7.904 1.00 0.00 C ATOM 0 H ALA A 64 -7.743 3.975 6.909 1.00 0.00 H new ATOM 0 HA ALA A 64 -9.868 5.294 8.472 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -8.568 7.341 8.015 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.582 6.100 8.823 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.399 6.384 7.076 1.00 0.00 H new ATOM 975 N VAL A 65 -9.339 5.601 5.253 1.00 0.00 N ATOM 976 CA VAL A 65 -9.955 5.950 3.963 1.00 0.00 C ATOM 977 C VAL A 65 -11.337 5.318 3.750 1.00 0.00 C ATOM 978 O VAL A 65 -12.277 6.005 3.402 1.00 0.00 O ATOM 979 CB VAL A 65 -9.040 5.685 2.739 1.00 0.00 C ATOM 980 CG1 VAL A 65 -7.773 6.508 2.833 1.00 0.00 C ATOM 981 CG2 VAL A 65 -8.727 4.205 2.558 1.00 0.00 C ATOM 0 H VAL A 65 -8.371 5.287 5.182 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.097 7.029 4.031 1.00 0.00 H new ATOM 0 HB VAL A 65 -9.589 5.997 1.850 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.144 6.308 1.965 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.028 7.567 2.860 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.233 6.242 3.742 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.084 4.073 1.688 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.218 3.829 3.446 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.655 3.652 2.410 1.00 0.00 H new ATOM 991 N LEU A 66 -11.496 4.053 4.023 1.00 0.00 N ATOM 992 CA LEU A 66 -12.780 3.447 3.840 1.00 0.00 C ATOM 993 C LEU A 66 -13.285 2.928 5.158 1.00 0.00 C ATOM 994 O LEU A 66 -12.591 3.038 6.186 1.00 0.00 O ATOM 995 CB LEU A 66 -12.814 2.389 2.700 1.00 0.00 C ATOM 996 CG LEU A 66 -13.039 2.908 1.242 1.00 0.00 C ATOM 997 CD1 LEU A 66 -11.944 3.810 0.706 1.00 0.00 C ATOM 998 CD2 LEU A 66 -13.232 1.772 0.310 1.00 0.00 C ATOM 0 H LEU A 66 -10.764 3.432 4.368 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.469 4.217 3.493 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.872 1.841 2.721 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.604 1.673 2.928 1.00 0.00 H new ATOM 0 HG LEU A 66 -13.937 3.523 1.303 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -12.191 4.117 -0.310 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -11.856 4.692 1.341 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -10.997 3.270 0.702 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -13.387 2.152 -0.700 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -12.348 1.134 0.326 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -14.103 1.193 0.617 1.00 0.00 H new ATOM 1010 N SER A 67 -14.490 2.436 5.184 1.00 0.00 N ATOM 1011 CA SER A 67 -15.061 1.987 6.421 1.00 0.00 C ATOM 1012 C SER A 67 -15.987 0.796 6.206 1.00 0.00 C ATOM 1013 O SER A 67 -16.708 0.712 5.183 1.00 0.00 O ATOM 1014 CB SER A 67 -15.801 3.155 7.104 1.00 0.00 C ATOM 1015 OG SER A 67 -14.912 4.262 7.297 1.00 0.00 O ATOM 0 H SER A 67 -15.093 2.336 4.368 1.00 0.00 H new ATOM 0 HA SER A 67 -14.257 1.650 7.075 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.650 3.463 6.493 1.00 0.00 H new ATOM 0 HB3 SER A 67 -16.201 2.829 8.064 1.00 0.00 H new ATOM 0 HG SER A 67 -15.185 4.766 8.092 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.900 -0.163 7.105 1.00 0.00 N ATOM 1022 CA GLY A 68 -16.797 -1.293 7.097 1.00 0.00 C ATOM 1023 C GLY A 68 -16.313 -2.414 6.213 1.00 0.00 C ATOM 1024 O GLY A 68 -16.008 -3.502 6.684 1.00 0.00 O ATOM 0 H GLY A 68 -15.209 -0.179 7.856 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -16.916 -1.664 8.115 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.781 -0.968 6.759 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.246 -2.149 4.937 1.00 0.00 N ATOM 1029 CA GLY A 69 -15.852 -3.166 3.994 1.00 0.00 C ATOM 1030 C GLY A 69 -14.360 -3.248 3.780 1.00 0.00 C ATOM 1031 O GLY A 69 -13.834 -4.314 3.434 1.00 0.00 O ATOM 0 H GLY A 69 -16.458 -1.241 4.525 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.214 -4.133 4.343 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.337 -2.970 3.038 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.688 -2.126 4.014 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.247 -1.940 3.709 1.00 0.00 C ATOM 1037 C ASP A 70 -11.368 -3.131 4.106 1.00 0.00 C ATOM 1038 O ASP A 70 -10.876 -3.863 3.237 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.709 -0.627 4.353 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.826 -0.558 5.875 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -12.932 -0.280 6.390 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.839 -0.835 6.589 1.00 0.00 O ATOM 0 H ASP A 70 -14.122 -1.300 4.426 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.183 -1.866 2.623 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.661 -0.509 4.079 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.248 0.218 3.924 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.255 -3.357 5.379 1.00 0.00 N ATOM 1048 CA HIS A 71 -10.398 -4.343 5.941 1.00 0.00 C ATOM 1049 C HIS A 71 -10.756 -5.744 5.460 1.00 0.00 C ATOM 1050 O HIS A 71 -9.864 -6.515 5.103 1.00 0.00 O ATOM 1051 CB HIS A 71 -10.477 -4.238 7.461 1.00 0.00 C ATOM 1052 CG HIS A 71 -9.420 -4.965 8.202 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -9.683 -5.977 9.079 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -8.097 -4.766 8.253 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -8.565 -6.363 9.640 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -7.593 -5.643 9.154 1.00 0.00 N ATOM 0 H HIS A 71 -11.781 -2.835 6.080 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.375 -4.162 5.612 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -10.433 -3.185 7.739 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -11.448 -4.613 7.785 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -7.536 -4.041 7.682 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -8.465 -7.144 10.379 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -6.610 -5.727 9.411 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.038 -6.062 5.415 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.446 -7.393 5.040 1.00 0.00 C ATOM 1067 C LEU A 72 -12.028 -7.807 3.614 1.00 0.00 C ATOM 1068 O LEU A 72 -11.366 -8.805 3.455 1.00 0.00 O ATOM 1069 CB LEU A 72 -13.916 -7.761 5.472 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.081 -6.811 5.111 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.464 -6.897 3.651 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.285 -7.083 5.990 1.00 0.00 C ATOM 0 H LEU A 72 -12.802 -5.422 5.632 1.00 0.00 H new ATOM 0 HA LEU A 72 -11.846 -8.060 5.658 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.147 -8.736 5.044 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -13.917 -7.880 6.555 1.00 0.00 H new ATOM 0 HG LEU A 72 -14.730 -5.795 5.293 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.286 -6.211 3.450 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.607 -6.628 3.034 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -15.775 -7.915 3.416 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.094 -6.404 5.720 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.613 -8.113 5.849 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.015 -6.928 7.035 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.327 -7.028 2.600 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.884 -7.446 1.261 1.00 0.00 C ATOM 1086 C LEU A 73 -10.515 -6.976 0.865 1.00 0.00 C ATOM 1087 O LEU A 73 -9.688 -7.806 0.500 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.889 -7.264 0.156 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.745 -8.507 -0.217 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -12.882 -9.665 -0.694 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -14.609 -8.960 0.933 1.00 0.00 C ATOM 0 H LEU A 73 -12.843 -6.150 2.651 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.799 -8.525 1.393 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.565 -6.457 0.440 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.358 -6.936 -0.737 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.393 -8.195 -1.036 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.518 -10.514 -0.945 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.319 -9.360 -1.576 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.189 -9.952 0.097 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.191 -9.831 0.630 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -13.977 -9.223 1.781 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.285 -8.154 1.220 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.261 -5.656 0.914 1.00 0.00 N ATOM 1104 CA TRP A 74 -8.939 -5.118 0.622 1.00 0.00 C ATOM 1105 C TRP A 74 -7.866 -5.894 1.406 1.00 0.00 C ATOM 1106 O TRP A 74 -6.847 -6.287 0.894 1.00 0.00 O ATOM 1107 CB TRP A 74 -8.834 -3.621 1.048 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.523 -2.512 0.210 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.526 -2.587 -0.718 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.143 -1.150 0.236 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -10.850 -1.326 -1.174 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.010 -0.424 -0.584 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.177 -0.501 0.918 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -9.914 0.963 -0.733 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.049 0.890 0.784 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -8.936 1.608 -0.025 1.00 0.00 C ATOM 0 H TRP A 74 -10.958 -4.951 1.153 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.783 -5.212 -0.453 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.226 -3.547 2.063 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -7.773 -3.374 1.097 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -10.996 -3.502 -1.046 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.591 -1.104 -1.839 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.506 -1.049 1.563 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -10.586 1.505 -1.382 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.261 1.409 1.309 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -8.848 2.682 -0.092 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.125 -6.107 2.634 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.133 -6.669 3.502 1.00 0.00 C ATOM 1129 C LYS A 75 -7.035 -8.164 3.588 1.00 0.00 C ATOM 1130 O LYS A 75 -5.926 -8.675 3.593 1.00 0.00 O ATOM 1131 CB LYS A 75 -6.933 -5.903 4.791 1.00 0.00 C ATOM 1132 CG LYS A 75 -6.588 -4.441 4.523 1.00 0.00 C ATOM 1133 CD LYS A 75 -5.291 -4.289 3.701 1.00 0.00 C ATOM 1134 CE LYS A 75 -4.022 -4.537 4.544 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.778 -3.497 5.558 1.00 0.00 N ATOM 0 H LYS A 75 -9.020 -5.904 3.079 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.217 -6.488 2.940 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -7.839 -5.960 5.394 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.135 -6.366 5.371 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -7.412 -3.967 3.989 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -6.478 -3.916 5.472 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.310 -4.989 2.866 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.250 -3.286 3.276 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -4.108 -5.504 5.040 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -3.160 -4.595 3.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.894 -3.707 6.064 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.699 -2.570 5.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -4.568 -3.479 6.234 1.00 0.00 H new ATOM 1149 N SER A 76 -8.147 -8.890 3.630 1.00 0.00 N ATOM 1150 CA SER A 76 -8.035 -10.335 3.689 1.00 0.00 C ATOM 1151 C SER A 76 -7.416 -10.852 2.393 1.00 0.00 C ATOM 1152 O SER A 76 -6.604 -11.794 2.401 1.00 0.00 O ATOM 1153 CB SER A 76 -9.382 -10.965 3.994 1.00 0.00 C ATOM 1154 OG SER A 76 -9.858 -10.492 5.257 1.00 0.00 O ATOM 0 H SER A 76 -9.097 -8.518 3.625 1.00 0.00 H new ATOM 0 HA SER A 76 -7.372 -10.622 4.505 1.00 0.00 H new ATOM 0 HB2 SER A 76 -10.097 -10.718 3.209 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.291 -12.051 4.012 1.00 0.00 H new ATOM 0 HG SER A 76 -10.525 -9.788 5.113 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.720 -10.166 1.300 1.00 0.00 N ATOM 1161 CA GLU A 77 -7.124 -10.485 0.039 1.00 0.00 C ATOM 1162 C GLU A 77 -5.682 -10.038 0.017 1.00 0.00 C ATOM 1163 O GLU A 77 -4.876 -10.653 -0.655 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.881 -9.858 -1.125 1.00 0.00 C ATOM 1165 CG GLU A 77 -9.295 -10.355 -1.338 1.00 0.00 C ATOM 1166 CD GLU A 77 -9.357 -11.776 -1.797 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -9.041 -12.030 -2.973 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -9.759 -12.660 -1.029 1.00 0.00 O ATOM 0 H GLU A 77 -8.378 -9.387 1.275 1.00 0.00 H new ATOM 0 HA GLU A 77 -7.172 -11.567 -0.081 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.915 -8.779 -0.972 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -7.313 -10.033 -2.039 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.852 -10.256 -0.406 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.789 -9.720 -2.074 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.345 -8.962 0.756 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.959 -8.503 0.812 1.00 0.00 C ATOM 1177 C PHE A 78 -3.092 -9.576 1.317 1.00 0.00 C ATOM 1178 O PHE A 78 -2.118 -9.960 0.669 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.800 -7.233 1.680 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.363 -6.883 1.981 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.524 -6.443 0.983 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -1.856 -7.017 3.270 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.207 -6.140 1.254 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -0.543 -6.712 3.548 1.00 0.00 C ATOM 1185 CZ PHE A 78 0.282 -6.272 2.540 1.00 0.00 C ATOM 0 H PHE A 78 -6.003 -8.411 1.308 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.660 -8.241 -0.203 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.271 -6.393 1.169 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.335 -7.375 2.619 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -1.901 -6.334 -0.023 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.501 -7.365 4.063 1.00 0.00 H new ATOM 0 HE1 PHE A 78 0.443 -5.799 0.461 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.163 -6.818 4.553 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.313 -6.029 2.753 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.489 -10.098 2.424 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.764 -11.097 3.108 1.00 0.00 C ATOM 1197 C PHE A 79 -2.558 -12.340 2.264 1.00 0.00 C ATOM 1198 O PHE A 79 -1.428 -12.847 2.168 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.422 -11.370 4.439 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.184 -10.238 5.422 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -1.905 -9.939 5.866 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.223 -9.436 5.848 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -1.679 -8.880 6.722 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.002 -8.368 6.693 1.00 0.00 C ATOM 1205 CZ PHE A 79 -2.731 -8.090 7.133 1.00 0.00 C ATOM 0 H PHE A 79 -4.356 -9.829 2.889 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.755 -10.734 3.306 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.494 -11.508 4.294 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.034 -12.300 4.854 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.073 -10.544 5.537 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.228 -9.648 5.514 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.678 -8.670 7.070 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -4.829 -7.750 7.009 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.557 -7.257 7.798 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.597 -12.765 1.591 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.499 -13.926 0.734 1.00 0.00 C ATOM 1217 C GLU A 80 -2.629 -13.635 -0.498 1.00 0.00 C ATOM 1218 O GLU A 80 -1.660 -14.338 -0.738 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.877 -14.383 0.301 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.817 -14.666 1.455 1.00 0.00 C ATOM 1221 CD GLU A 80 -5.338 -15.754 2.388 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -4.483 -15.493 3.251 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -5.853 -16.887 2.292 1.00 0.00 O ATOM 0 H GLU A 80 -4.519 -12.329 1.617 1.00 0.00 H new ATOM 0 HA GLU A 80 -3.024 -14.723 1.306 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.320 -13.618 -0.337 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.777 -15.284 -0.304 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.960 -13.749 2.027 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.791 -14.948 1.055 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.958 -12.561 -1.234 1.00 0.00 N ATOM 1231 CA ASN A 81 -2.255 -12.196 -2.491 1.00 0.00 C ATOM 1232 C ASN A 81 -0.771 -11.991 -2.282 1.00 0.00 C ATOM 1233 O ASN A 81 0.053 -12.477 -3.070 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.815 -10.917 -3.143 1.00 0.00 C ATOM 1235 CG ASN A 81 -4.241 -11.005 -3.643 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -4.750 -12.076 -4.001 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.897 -9.863 -3.711 1.00 0.00 N ATOM 0 H ASN A 81 -3.712 -11.921 -0.984 1.00 0.00 H new ATOM 0 HA ASN A 81 -2.425 -13.045 -3.153 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.753 -10.105 -2.419 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -2.172 -10.647 -3.981 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.853 -9.844 -4.067 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.449 -8.998 -3.408 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.415 -11.277 -1.235 1.00 0.00 N ATOM 1245 CA CYS A 82 0.981 -10.987 -0.999 1.00 0.00 C ATOM 1246 C CYS A 82 1.747 -12.251 -0.642 1.00 0.00 C ATOM 1247 O CYS A 82 2.789 -12.531 -1.221 1.00 0.00 O ATOM 1248 CB CYS A 82 1.170 -9.895 0.078 1.00 0.00 C ATOM 1249 SG CYS A 82 0.503 -10.320 1.704 1.00 0.00 S ATOM 0 H CYS A 82 -1.061 -10.893 -0.545 1.00 0.00 H new ATOM 0 HA CYS A 82 1.392 -10.593 -1.929 1.00 0.00 H new ATOM 0 HB2 CYS A 82 2.234 -9.684 0.180 1.00 0.00 H new ATOM 0 HB3 CYS A 82 0.695 -8.977 -0.267 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.787 -10.457 1.622 1.00 0.00 H new ATOM 1255 N ARG A 83 1.188 -13.053 0.262 1.00 0.00 N ATOM 1256 CA ARG A 83 1.862 -14.263 0.725 1.00 0.00 C ATOM 1257 C ARG A 83 1.957 -15.269 -0.428 1.00 0.00 C ATOM 1258 O ARG A 83 2.918 -16.009 -0.545 1.00 0.00 O ATOM 1259 CB ARG A 83 1.064 -14.868 1.865 1.00 0.00 C ATOM 1260 CG ARG A 83 1.886 -15.446 3.006 1.00 0.00 C ATOM 1261 CD ARG A 83 2.636 -14.355 3.761 1.00 0.00 C ATOM 1262 NE ARG A 83 1.726 -13.289 4.231 1.00 0.00 N ATOM 1263 CZ ARG A 83 1.100 -13.272 5.425 1.00 0.00 C ATOM 1264 NH1 ARG A 83 1.223 -14.280 6.261 1.00 0.00 N ATOM 1265 NH2 ARG A 83 0.355 -12.237 5.761 1.00 0.00 N ATOM 0 H ARG A 83 0.275 -12.888 0.686 1.00 0.00 H new ATOM 0 HA ARG A 83 2.866 -14.017 1.070 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.403 -14.102 2.269 1.00 0.00 H new ATOM 0 HB3 ARG A 83 0.429 -15.657 1.462 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.231 -15.981 3.693 1.00 0.00 H new ATOM 0 HG3 ARG A 83 2.597 -16.172 2.612 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.154 -14.793 4.614 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.398 -13.923 3.113 1.00 0.00 H new ATOM 0 HE ARG A 83 1.558 -12.504 3.602 1.00 0.00 H new ATOM 0 HH11 ARG A 83 1.796 -15.085 6.009 1.00 0.00 H new ATOM 0 HH12 ARG A 83 0.745 -14.257 7.162 1.00 0.00 H new ATOM 0 HH21 ARG A 83 0.253 -11.452 5.118 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -0.120 -12.222 6.664 1.00 0.00 H new ATOM 1279 N ASP A 84 0.951 -15.244 -1.272 1.00 0.00 N ATOM 1280 CA ASP A 84 0.836 -16.073 -2.477 1.00 0.00 C ATOM 1281 C ASP A 84 2.016 -15.832 -3.403 1.00 0.00 C ATOM 1282 O ASP A 84 2.762 -16.747 -3.770 1.00 0.00 O ATOM 1283 CB ASP A 84 -0.426 -15.641 -3.198 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.769 -16.462 -4.382 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -1.225 -17.624 -4.211 1.00 0.00 O ATOM 1286 OD2 ASP A 84 -0.598 -15.978 -5.499 1.00 0.00 O ATOM 0 H ASP A 84 0.151 -14.624 -1.143 1.00 0.00 H new ATOM 0 HA ASP A 84 0.812 -17.127 -2.201 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -1.259 -15.673 -2.496 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -0.313 -14.603 -3.512 1.00 0.00 H new ATOM 1291 N THR A 85 2.173 -14.593 -3.742 1.00 0.00 N ATOM 1292 CA THR A 85 3.220 -14.100 -4.602 1.00 0.00 C ATOM 1293 C THR A 85 4.610 -14.310 -3.944 1.00 0.00 C ATOM 1294 O THR A 85 5.619 -14.607 -4.623 1.00 0.00 O ATOM 1295 CB THR A 85 2.902 -12.619 -4.858 1.00 0.00 C ATOM 1296 OG1 THR A 85 1.637 -12.548 -5.552 1.00 0.00 O ATOM 1297 CG2 THR A 85 3.983 -11.885 -5.645 1.00 0.00 C ATOM 0 H THR A 85 1.549 -13.856 -3.415 1.00 0.00 H new ATOM 0 HA THR A 85 3.262 -14.640 -5.548 1.00 0.00 H new ATOM 0 HB THR A 85 2.855 -12.115 -3.893 1.00 0.00 H new ATOM 0 HG1 THR A 85 0.907 -12.514 -4.899 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.688 -10.845 -5.786 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.923 -11.924 -5.095 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.112 -12.361 -6.617 1.00 0.00 H new ATOM 1305 N ALA A 86 4.606 -14.256 -2.638 1.00 0.00 N ATOM 1306 CA ALA A 86 5.794 -14.510 -1.871 1.00 0.00 C ATOM 1307 C ALA A 86 6.213 -15.964 -2.042 1.00 0.00 C ATOM 1308 O ALA A 86 7.385 -16.241 -2.297 1.00 0.00 O ATOM 1309 CB ALA A 86 5.586 -14.168 -0.418 1.00 0.00 C ATOM 0 H ALA A 86 3.782 -14.035 -2.079 1.00 0.00 H new ATOM 0 HA ALA A 86 6.595 -13.870 -2.240 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.501 -14.370 0.138 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.331 -13.112 -0.326 1.00 0.00 H new ATOM 0 HB3 ALA A 86 4.775 -14.774 -0.014 1.00 0.00 H new ATOM 1315 N LYS A 87 5.230 -16.888 -1.973 1.00 0.00 N ATOM 1316 CA LYS A 87 5.476 -18.333 -2.150 1.00 0.00 C ATOM 1317 C LYS A 87 6.100 -18.609 -3.514 1.00 0.00 C ATOM 1318 O LYS A 87 6.953 -19.494 -3.643 1.00 0.00 O ATOM 1319 CB LYS A 87 4.189 -19.162 -2.020 1.00 0.00 C ATOM 1320 CG LYS A 87 3.438 -19.030 -0.703 1.00 0.00 C ATOM 1321 CD LYS A 87 2.278 -20.028 -0.618 1.00 0.00 C ATOM 1322 CE LYS A 87 1.183 -19.735 -1.641 1.00 0.00 C ATOM 1323 NZ LYS A 87 0.164 -20.798 -1.665 1.00 0.00 N ATOM 0 H LYS A 87 4.253 -16.655 -1.795 1.00 0.00 H new ATOM 0 HA LYS A 87 6.161 -18.630 -1.356 1.00 0.00 H new ATOM 0 HB2 LYS A 87 3.515 -18.879 -2.829 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.441 -20.212 -2.168 1.00 0.00 H new ATOM 0 HG2 LYS A 87 4.124 -19.196 0.127 1.00 0.00 H new ATOM 0 HG3 LYS A 87 3.055 -18.015 -0.601 1.00 0.00 H new ATOM 0 HD2 LYS A 87 2.658 -21.037 -0.776 1.00 0.00 H new ATOM 0 HD3 LYS A 87 1.852 -20.001 0.385 1.00 0.00 H new ATOM 0 HE2 LYS A 87 0.710 -18.782 -1.405 1.00 0.00 H new ATOM 0 HE3 LYS A 87 1.627 -19.634 -2.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -0.564 -20.566 -2.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 0.612 -21.703 -1.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -0.277 -20.877 -0.727 1.00 0.00 H new ATOM 1337 N ARG A 88 5.678 -17.854 -4.530 1.00 0.00 N ATOM 1338 CA ARG A 88 6.263 -17.982 -5.871 1.00 0.00 C ATOM 1339 C ARG A 88 7.747 -17.698 -5.846 1.00 0.00 C ATOM 1340 O ARG A 88 8.552 -18.518 -6.285 1.00 0.00 O ATOM 1341 CB ARG A 88 5.589 -17.070 -6.906 1.00 0.00 C ATOM 1342 CG ARG A 88 4.403 -17.679 -7.645 1.00 0.00 C ATOM 1343 CD ARG A 88 3.295 -18.091 -6.715 1.00 0.00 C ATOM 1344 NE ARG A 88 2.078 -18.430 -7.443 1.00 0.00 N ATOM 1345 CZ ARG A 88 0.890 -18.495 -6.881 1.00 0.00 C ATOM 1346 NH1 ARG A 88 0.789 -18.728 -5.589 1.00 0.00 N ATOM 1347 NH2 ARG A 88 -0.194 -18.415 -7.621 1.00 0.00 N ATOM 0 H ARG A 88 4.941 -17.153 -4.454 1.00 0.00 H new ATOM 0 HA ARG A 88 6.091 -19.015 -6.175 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.254 -16.164 -6.402 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.336 -16.769 -7.640 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.019 -16.957 -8.366 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.739 -18.547 -8.212 1.00 0.00 H new ATOM 0 HD2 ARG A 88 3.616 -18.949 -6.124 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.087 -17.281 -6.015 1.00 0.00 H new ATOM 0 HE ARG A 88 2.151 -18.627 -8.441 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.630 -18.857 -5.027 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -0.130 -18.779 -5.150 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -0.114 -18.302 -8.632 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -1.114 -18.466 -7.184 1.00 0.00 H new ATOM 1361 N ASN A 89 8.128 -16.580 -5.278 1.00 0.00 N ATOM 1362 CA ASN A 89 9.537 -16.247 -5.260 1.00 0.00 C ATOM 1363 C ASN A 89 10.337 -17.081 -4.244 1.00 0.00 C ATOM 1364 O ASN A 89 11.554 -17.178 -4.344 1.00 0.00 O ATOM 1365 CB ASN A 89 9.817 -14.734 -5.142 1.00 0.00 C ATOM 1366 CG ASN A 89 9.399 -13.968 -6.389 1.00 0.00 C ATOM 1367 OD1 ASN A 89 9.376 -14.518 -7.484 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.102 -12.709 -6.251 1.00 0.00 N ATOM 0 H ASN A 89 7.508 -15.902 -4.834 1.00 0.00 H new ATOM 0 HA ASN A 89 9.907 -16.531 -6.245 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.285 -14.335 -4.278 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.880 -14.577 -4.962 1.00 0.00 H new ATOM 0 HD21 ASN A 89 8.842 -12.154 -7.066 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.129 -12.277 -5.327 1.00 0.00 H new ATOM 1375 N GLN A 90 9.654 -17.694 -3.272 1.00 0.00 N ATOM 1376 CA GLN A 90 10.341 -18.588 -2.333 1.00 0.00 C ATOM 1377 C GLN A 90 10.674 -19.905 -3.002 1.00 0.00 C ATOM 1378 O GLN A 90 11.786 -20.411 -2.864 1.00 0.00 O ATOM 1379 CB GLN A 90 9.542 -18.873 -1.042 1.00 0.00 C ATOM 1380 CG GLN A 90 9.050 -17.668 -0.250 1.00 0.00 C ATOM 1381 CD GLN A 90 10.040 -16.544 -0.157 1.00 0.00 C ATOM 1382 OE1 GLN A 90 10.881 -16.497 0.731 1.00 0.00 O ATOM 1383 NE2 GLN A 90 9.900 -15.601 -1.038 1.00 0.00 N ATOM 0 H GLN A 90 8.651 -17.592 -3.116 1.00 0.00 H new ATOM 0 HA GLN A 90 11.249 -18.060 -2.041 1.00 0.00 H new ATOM 0 HB2 GLN A 90 8.676 -19.480 -1.307 1.00 0.00 H new ATOM 0 HB3 GLN A 90 10.166 -19.478 -0.384 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.136 -17.294 -0.711 1.00 0.00 H new ATOM 0 HG3 GLN A 90 8.790 -17.992 0.758 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.186 -15.681 -1.762 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.505 -14.780 -1.007 1.00 0.00 H new ATOM 1392 N GLN A 91 9.727 -20.469 -3.742 1.00 0.00 N ATOM 1393 CA GLN A 91 9.965 -21.741 -4.422 1.00 0.00 C ATOM 1394 C GLN A 91 10.984 -21.584 -5.551 1.00 0.00 C ATOM 1395 O GLN A 91 11.674 -22.542 -5.924 1.00 0.00 O ATOM 1396 CB GLN A 91 8.659 -22.356 -4.939 1.00 0.00 C ATOM 1397 CG GLN A 91 7.974 -21.576 -6.046 1.00 0.00 C ATOM 1398 CD GLN A 91 6.654 -22.173 -6.422 1.00 0.00 C ATOM 1399 OE1 GLN A 91 6.581 -23.046 -7.281 1.00 0.00 O ATOM 1400 NE2 GLN A 91 5.610 -21.717 -5.796 1.00 0.00 N ATOM 0 H GLN A 91 8.798 -20.074 -3.887 1.00 0.00 H new ATOM 0 HA GLN A 91 10.384 -22.429 -3.688 1.00 0.00 H new ATOM 0 HB2 GLN A 91 8.868 -23.363 -5.301 1.00 0.00 H new ATOM 0 HB3 GLN A 91 7.966 -22.455 -4.103 1.00 0.00 H new ATOM 0 HG2 GLN A 91 7.827 -20.545 -5.725 1.00 0.00 H new ATOM 0 HG3 GLN A 91 8.621 -21.547 -6.923 1.00 0.00 H new ATOM 0 HE21 GLN A 91 5.717 -20.990 -5.088 1.00 0.00 H new ATOM 0 HE22 GLN A 91 4.684 -22.086 -6.012 1.00 0.00 H new ATOM 1409 N ALA A 92 11.071 -20.373 -6.088 1.00 0.00 N ATOM 1410 CA ALA A 92 12.069 -20.035 -7.085 1.00 0.00 C ATOM 1411 C ALA A 92 13.419 -19.810 -6.394 1.00 0.00 C ATOM 1412 O ALA A 92 14.476 -19.796 -7.034 1.00 0.00 O ATOM 1413 CB ALA A 92 11.647 -18.789 -7.839 1.00 0.00 C ATOM 0 H ALA A 92 10.451 -19.601 -5.842 1.00 0.00 H new ATOM 0 HA ALA A 92 12.164 -20.854 -7.798 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.402 -18.542 -8.586 1.00 0.00 H new ATOM 0 HB2 ALA A 92 10.693 -18.969 -8.334 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.543 -17.959 -7.140 1.00 0.00 H new ATOM 1419 N GLY A 93 13.357 -19.616 -5.092 1.00 0.00 N ATOM 1420 CA GLY A 93 14.536 -19.462 -4.275 1.00 0.00 C ATOM 1421 C GLY A 93 15.201 -18.136 -4.443 1.00 0.00 C ATOM 1422 O GLY A 93 16.416 -18.052 -4.664 1.00 0.00 O ATOM 0 H GLY A 93 12.481 -19.561 -4.572 1.00 0.00 H new ATOM 0 HA2 GLY A 93 14.264 -19.594 -3.228 1.00 0.00 H new ATOM 0 HA3 GLY A 93 15.246 -20.251 -4.522 1.00 0.00 H new ATOM 1426 N ASN A 94 14.423 -17.104 -4.330 1.00 0.00 N ATOM 1427 CA ASN A 94 14.915 -15.751 -4.515 1.00 0.00 C ATOM 1428 C ASN A 94 15.412 -15.155 -3.216 1.00 0.00 C ATOM 1429 O ASN A 94 16.296 -14.297 -3.227 1.00 0.00 O ATOM 1430 CB ASN A 94 13.824 -14.847 -5.119 1.00 0.00 C ATOM 1431 CG ASN A 94 13.505 -15.135 -6.578 1.00 0.00 C ATOM 1432 OD1 ASN A 94 13.658 -16.253 -7.059 1.00 0.00 O ATOM 1433 ND2 ASN A 94 13.028 -14.139 -7.283 1.00 0.00 N ATOM 0 H ASN A 94 13.429 -17.163 -4.108 1.00 0.00 H new ATOM 0 HA ASN A 94 15.754 -15.808 -5.208 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.912 -14.957 -4.532 1.00 0.00 H new ATOM 0 HB3 ASN A 94 14.139 -13.808 -5.027 1.00 0.00 H new ATOM 0 HD21 ASN A 94 12.772 -14.282 -8.260 1.00 0.00 H new ATOM 0 HD22 ASN A 94 12.912 -13.221 -6.855 1.00 0.00 H new ATOM 1440 N GLY A 95 14.892 -15.641 -2.087 1.00 0.00 N ATOM 1441 CA GLY A 95 15.207 -15.017 -0.807 1.00 0.00 C ATOM 1442 C GLY A 95 14.728 -13.593 -0.851 1.00 0.00 C ATOM 1443 O GLY A 95 15.495 -12.644 -0.654 1.00 0.00 O ATOM 0 H GLY A 95 14.266 -16.445 -2.034 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.724 -15.556 0.008 1.00 0.00 H new ATOM 0 HA3 GLY A 95 16.280 -15.052 -0.620 1.00 0.00 H new ATOM 1447 N TRP A 96 13.468 -13.450 -1.141 1.00 0.00 N ATOM 1448 CA TRP A 96 12.897 -12.192 -1.481 1.00 0.00 C ATOM 1449 C TRP A 96 11.452 -12.240 -1.049 1.00 0.00 C ATOM 1450 O TRP A 96 11.015 -13.274 -0.566 1.00 0.00 O ATOM 1451 CB TRP A 96 13.017 -12.072 -3.007 1.00 0.00 C ATOM 1452 CG TRP A 96 13.091 -10.692 -3.582 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.683 -9.595 -3.044 1.00 0.00 C ATOM 1454 CD2 TRP A 96 12.627 -10.308 -4.868 1.00 0.00 C ATOM 1455 NE1 TRP A 96 13.568 -8.533 -3.906 1.00 0.00 N ATOM 1456 CE2 TRP A 96 12.925 -8.955 -5.043 1.00 0.00 C ATOM 1457 CE3 TRP A 96 11.970 -10.988 -5.888 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 12.589 -8.263 -6.200 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 11.637 -10.305 -7.034 1.00 0.00 C ATOM 1460 CH2 TRP A 96 11.949 -8.958 -7.182 1.00 0.00 C ATOM 0 H TRP A 96 12.801 -14.222 -1.146 1.00 0.00 H new ATOM 0 HA TRP A 96 13.383 -11.340 -1.005 1.00 0.00 H new ATOM 0 HB2 TRP A 96 13.908 -12.616 -3.319 1.00 0.00 H new ATOM 0 HB3 TRP A 96 12.161 -12.578 -3.454 1.00 0.00 H new ATOM 0 HD1 TRP A 96 14.172 -9.563 -2.081 1.00 0.00 H new ATOM 0 HE1 TRP A 96 13.905 -7.586 -3.731 1.00 0.00 H new ATOM 0 HE3 TRP A 96 11.726 -12.035 -5.782 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 12.826 -7.216 -6.316 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 11.125 -10.823 -7.832 1.00 0.00 H new ATOM 0 HH2 TRP A 96 11.678 -8.451 -8.096 1.00 0.00 H new ATOM 1471 N ASP A 97 10.745 -11.150 -1.203 1.00 0.00 N ATOM 1472 CA ASP A 97 9.305 -11.027 -0.879 1.00 0.00 C ATOM 1473 C ASP A 97 8.924 -11.310 0.554 1.00 0.00 C ATOM 1474 O ASP A 97 9.007 -10.423 1.372 1.00 0.00 O ATOM 1475 CB ASP A 97 8.410 -11.856 -1.818 1.00 0.00 C ATOM 1476 CG ASP A 97 8.491 -11.422 -3.241 1.00 0.00 C ATOM 1477 OD1 ASP A 97 9.517 -11.702 -3.871 1.00 0.00 O ATOM 1478 OD2 ASP A 97 7.548 -10.815 -3.737 1.00 0.00 O ATOM 0 H ASP A 97 11.146 -10.286 -1.567 1.00 0.00 H new ATOM 0 HA ASP A 97 9.123 -9.964 -1.037 1.00 0.00 H new ATOM 0 HB2 ASP A 97 8.695 -12.906 -1.748 1.00 0.00 H new ATOM 0 HB3 ASP A 97 7.376 -11.784 -1.481 1.00 0.00 H new ATOM 1483 N PHE A 98 8.701 -12.590 0.847 1.00 0.00 N ATOM 1484 CA PHE A 98 7.979 -13.103 2.027 1.00 0.00 C ATOM 1485 C PHE A 98 8.170 -12.340 3.347 1.00 0.00 C ATOM 1486 O PHE A 98 7.192 -12.095 4.037 1.00 0.00 O ATOM 1487 CB PHE A 98 8.255 -14.612 2.196 1.00 0.00 C ATOM 1488 CG PHE A 98 7.579 -15.259 3.378 1.00 0.00 C ATOM 1489 CD1 PHE A 98 6.238 -15.648 3.318 1.00 0.00 C ATOM 1490 CD2 PHE A 98 8.285 -15.488 4.546 1.00 0.00 C ATOM 1491 CE1 PHE A 98 5.638 -16.246 4.408 1.00 0.00 C ATOM 1492 CE2 PHE A 98 7.688 -16.081 5.632 1.00 0.00 C ATOM 1493 CZ PHE A 98 6.362 -16.461 5.563 1.00 0.00 C ATOM 0 H PHE A 98 9.033 -13.341 0.242 1.00 0.00 H new ATOM 0 HA PHE A 98 6.927 -12.926 1.803 1.00 0.00 H new ATOM 0 HB2 PHE A 98 7.938 -15.127 1.289 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.331 -14.760 2.287 1.00 0.00 H new ATOM 0 HD1 PHE A 98 5.669 -15.480 2.416 1.00 0.00 H new ATOM 0 HD2 PHE A 98 9.323 -15.196 4.605 1.00 0.00 H new ATOM 0 HE1 PHE A 98 4.602 -16.546 4.357 1.00 0.00 H new ATOM 0 HE2 PHE A 98 8.254 -16.249 6.536 1.00 0.00 H new ATOM 0 HZ PHE A 98 5.890 -16.928 6.415 1.00 0.00 H new ATOM 1503 N ASP A 99 9.373 -11.987 3.715 1.00 0.00 N ATOM 1504 CA ASP A 99 9.578 -11.273 4.964 1.00 0.00 C ATOM 1505 C ASP A 99 9.421 -9.750 4.799 1.00 0.00 C ATOM 1506 O ASP A 99 8.733 -9.110 5.575 1.00 0.00 O ATOM 1507 CB ASP A 99 10.960 -11.625 5.539 1.00 0.00 C ATOM 1508 CG ASP A 99 12.084 -11.311 4.588 1.00 0.00 C ATOM 1509 OD1 ASP A 99 12.250 -12.022 3.573 1.00 0.00 O ATOM 1510 OD2 ASP A 99 12.805 -10.336 4.821 1.00 0.00 O ATOM 0 H ASP A 99 10.221 -12.175 3.181 1.00 0.00 H new ATOM 0 HA ASP A 99 8.804 -11.590 5.663 1.00 0.00 H new ATOM 0 HB2 ASP A 99 11.112 -11.076 6.468 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.986 -12.686 5.787 1.00 0.00 H new ATOM 1515 N MET A 100 10.088 -9.185 3.817 1.00 0.00 N ATOM 1516 CA MET A 100 10.035 -7.738 3.532 1.00 0.00 C ATOM 1517 C MET A 100 8.637 -7.313 3.083 1.00 0.00 C ATOM 1518 O MET A 100 8.111 -6.274 3.499 1.00 0.00 O ATOM 1519 CB MET A 100 11.059 -7.404 2.461 1.00 0.00 C ATOM 1520 CG MET A 100 12.481 -7.687 2.895 1.00 0.00 C ATOM 1521 SD MET A 100 13.667 -7.455 1.575 1.00 0.00 S ATOM 1522 CE MET A 100 13.189 -8.793 0.485 1.00 0.00 C ATOM 0 H MET A 100 10.691 -9.706 3.180 1.00 0.00 H new ATOM 0 HA MET A 100 10.267 -7.191 4.446 1.00 0.00 H new ATOM 0 HB2 MET A 100 10.838 -7.980 1.562 1.00 0.00 H new ATOM 0 HB3 MET A 100 10.969 -6.351 2.195 1.00 0.00 H new ATOM 0 HG2 MET A 100 12.739 -7.033 3.728 1.00 0.00 H new ATOM 0 HG3 MET A 100 12.547 -8.711 3.261 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.082 -9.259 0.068 1.00 0.00 H new ATOM 0 HE2 MET A 100 12.621 -9.535 1.047 1.00 0.00 H new ATOM 0 HE3 MET A 100 12.573 -8.401 -0.324 1.00 0.00 H new ATOM 1532 N LEU A 101 8.070 -8.110 2.237 1.00 0.00 N ATOM 1533 CA LEU A 101 6.743 -7.939 1.730 1.00 0.00 C ATOM 1534 C LEU A 101 5.774 -8.532 2.726 1.00 0.00 C ATOM 1535 O LEU A 101 5.924 -9.665 3.093 1.00 0.00 O ATOM 1536 CB LEU A 101 6.661 -8.628 0.321 1.00 0.00 C ATOM 1537 CG LEU A 101 5.282 -9.006 -0.279 1.00 0.00 C ATOM 1538 CD1 LEU A 101 5.383 -9.071 -1.794 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.843 -10.384 0.221 1.00 0.00 C ATOM 0 H LEU A 101 8.538 -8.935 1.863 1.00 0.00 H new ATOM 0 HA LEU A 101 6.484 -6.888 1.601 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.154 -7.967 -0.392 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.254 -9.541 0.372 1.00 0.00 H new ATOM 0 HG LEU A 101 4.559 -8.250 0.027 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.412 -9.337 -2.212 1.00 0.00 H new ATOM 0 HD12 LEU A 101 5.691 -8.099 -2.180 1.00 0.00 H new ATOM 0 HD13 LEU A 101 6.119 -9.824 -2.078 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.873 -10.635 -0.209 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.578 -11.131 -0.079 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.765 -10.369 1.308 1.00 0.00 H new ATOM 1551 N THR A 102 4.862 -7.691 3.212 1.00 0.00 N ATOM 1552 CA THR A 102 3.751 -8.033 4.131 1.00 0.00 C ATOM 1553 C THR A 102 4.229 -8.130 5.593 1.00 0.00 C ATOM 1554 O THR A 102 5.407 -7.930 5.896 1.00 0.00 O ATOM 1555 CB THR A 102 2.916 -9.325 3.712 1.00 0.00 C ATOM 1556 OG1 THR A 102 1.565 -9.231 4.235 1.00 0.00 O ATOM 1557 CG2 THR A 102 3.511 -10.626 4.264 1.00 0.00 C ATOM 0 H THR A 102 4.869 -6.700 2.970 1.00 0.00 H new ATOM 0 HA THR A 102 3.055 -7.199 4.046 1.00 0.00 H new ATOM 0 HB THR A 102 2.937 -9.355 2.623 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.923 -9.300 3.498 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.899 -11.470 3.945 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.526 -10.751 3.887 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.531 -10.583 5.353 1.00 0.00 H new ATOM 1565 N GLY A 103 3.299 -8.399 6.492 1.00 0.00 N ATOM 1566 CA GLY A 103 3.619 -8.550 7.889 1.00 0.00 C ATOM 1567 C GLY A 103 4.149 -9.940 8.187 1.00 0.00 C ATOM 1568 O GLY A 103 3.528 -10.715 8.901 1.00 0.00 O ATOM 0 H GLY A 103 2.310 -8.517 6.271 1.00 0.00 H new ATOM 0 HA2 GLY A 103 4.362 -7.806 8.176 1.00 0.00 H new ATOM 0 HA3 GLY A 103 2.730 -8.361 8.490 1.00 0.00 H new ATOM 1572 N SER A 104 5.238 -10.272 7.576 1.00 0.00 N ATOM 1573 CA SER A 104 5.925 -11.511 7.806 1.00 0.00 C ATOM 1574 C SER A 104 7.404 -11.199 7.918 1.00 0.00 C ATOM 1575 O SER A 104 8.272 -12.032 7.686 1.00 0.00 O ATOM 1576 CB SER A 104 5.617 -12.499 6.681 1.00 0.00 C ATOM 1577 OG SER A 104 4.220 -12.774 6.666 1.00 0.00 O ATOM 0 H SER A 104 5.691 -9.676 6.883 1.00 0.00 H new ATOM 0 HA SER A 104 5.593 -11.986 8.729 1.00 0.00 H new ATOM 0 HB2 SER A 104 5.928 -12.085 5.722 1.00 0.00 H new ATOM 0 HB3 SER A 104 6.179 -13.421 6.827 1.00 0.00 H new ATOM 0 HG SER A 104 3.966 -13.130 5.789 1.00 0.00 H new ATOM 1583 N GLY A 105 7.666 -10.019 8.443 1.00 0.00 N ATOM 1584 CA GLY A 105 8.993 -9.516 8.549 1.00 0.00 C ATOM 1585 C GLY A 105 9.266 -9.060 9.936 1.00 0.00 C ATOM 1586 O GLY A 105 8.778 -8.017 10.359 1.00 0.00 O ATOM 0 H GLY A 105 6.950 -9.389 8.806 1.00 0.00 H new ATOM 0 HA2 GLY A 105 9.706 -10.291 8.268 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.131 -8.688 7.854 1.00 0.00 H new ATOM 1590 N ASN A 106 10.000 -9.858 10.654 1.00 0.00 N ATOM 1591 CA ASN A 106 10.352 -9.568 12.023 1.00 0.00 C ATOM 1592 C ASN A 106 11.446 -8.533 12.046 1.00 0.00 C ATOM 1593 O ASN A 106 11.420 -7.577 12.814 1.00 0.00 O ATOM 1594 CB ASN A 106 10.885 -10.828 12.677 1.00 0.00 C ATOM 1595 CG ASN A 106 11.097 -10.683 14.181 1.00 0.00 C ATOM 1596 OD1 ASN A 106 10.376 -9.955 14.873 1.00 0.00 O ATOM 1597 ND2 ASN A 106 12.094 -11.342 14.691 1.00 0.00 N ATOM 0 H ASN A 106 10.378 -10.739 10.307 1.00 0.00 H new ATOM 0 HA ASN A 106 9.472 -9.204 12.553 1.00 0.00 H new ATOM 0 HB2 ASN A 106 10.190 -11.647 12.492 1.00 0.00 H new ATOM 0 HB3 ASN A 106 11.831 -11.100 12.208 1.00 0.00 H new ATOM 0 HD21 ASN A 106 12.299 -11.266 15.687 1.00 0.00 H new ATOM 0 HD22 ASN A 106 12.672 -11.935 14.095 1.00 0.00 H new ATOM 1604 N TYR A 107 12.398 -8.736 11.188 1.00 0.00 N ATOM 1605 CA TYR A 107 13.568 -7.915 11.128 1.00 0.00 C ATOM 1606 C TYR A 107 13.431 -6.835 10.049 1.00 0.00 C ATOM 1607 O TYR A 107 13.762 -5.677 10.282 1.00 0.00 O ATOM 1608 CB TYR A 107 14.830 -8.811 10.900 1.00 0.00 C ATOM 1609 CG TYR A 107 14.842 -9.592 9.581 1.00 0.00 C ATOM 1610 CD1 TYR A 107 13.938 -10.633 9.322 1.00 0.00 C ATOM 1611 CD2 TYR A 107 15.738 -9.255 8.584 1.00 0.00 C ATOM 1612 CE1 TYR A 107 13.950 -11.299 8.111 1.00 0.00 C ATOM 1613 CE2 TYR A 107 15.749 -9.911 7.381 1.00 0.00 C ATOM 1614 CZ TYR A 107 14.863 -10.926 7.144 1.00 0.00 C ATOM 1615 OH TYR A 107 14.873 -11.556 5.925 1.00 0.00 O ATOM 0 H TYR A 107 12.384 -9.488 10.499 1.00 0.00 H new ATOM 0 HA TYR A 107 13.686 -7.395 12.079 1.00 0.00 H new ATOM 0 HB2 TYR A 107 15.717 -8.179 10.938 1.00 0.00 H new ATOM 0 HB3 TYR A 107 14.908 -9.519 11.725 1.00 0.00 H new ATOM 0 HD1 TYR A 107 13.223 -10.918 10.079 1.00 0.00 H new ATOM 0 HD2 TYR A 107 16.445 -8.457 8.757 1.00 0.00 H new ATOM 0 HE1 TYR A 107 13.253 -12.102 7.923 1.00 0.00 H new ATOM 0 HE2 TYR A 107 16.459 -9.626 6.618 1.00 0.00 H new ATOM 0 HH TYR A 107 14.406 -11.001 5.266 1.00 0.00 H new ATOM 1625 N SER A 108 12.968 -7.254 8.879 1.00 0.00 N ATOM 1626 CA SER A 108 12.820 -6.455 7.680 1.00 0.00 C ATOM 1627 C SER A 108 12.168 -5.056 7.893 1.00 0.00 C ATOM 1628 O SER A 108 12.885 -4.034 7.873 1.00 0.00 O ATOM 1629 CB SER A 108 12.033 -7.313 6.726 1.00 0.00 C ATOM 1630 OG SER A 108 12.482 -8.660 6.871 1.00 0.00 O ATOM 0 H SER A 108 12.669 -8.219 8.738 1.00 0.00 H new ATOM 0 HA SER A 108 13.804 -6.193 7.292 1.00 0.00 H new ATOM 0 HB2 SER A 108 10.967 -7.242 6.940 1.00 0.00 H new ATOM 0 HB3 SER A 108 12.176 -6.972 5.701 1.00 0.00 H new ATOM 0 HG SER A 108 12.784 -8.999 6.003 1.00 0.00 H new ATOM 1636 N SER A 109 10.832 -5.022 8.039 1.00 0.00 N ATOM 1637 CA SER A 109 10.084 -3.787 8.309 1.00 0.00 C ATOM 1638 C SER A 109 10.348 -2.714 7.197 1.00 0.00 C ATOM 1639 O SER A 109 10.725 -3.058 6.048 1.00 0.00 O ATOM 1640 CB SER A 109 10.454 -3.251 9.721 1.00 0.00 C ATOM 1641 OG SER A 109 10.202 -4.231 10.743 1.00 0.00 O ATOM 0 H SER A 109 10.242 -5.852 7.973 1.00 0.00 H new ATOM 0 HA SER A 109 9.017 -4.007 8.292 1.00 0.00 H new ATOM 0 HB2 SER A 109 11.507 -2.968 9.739 1.00 0.00 H new ATOM 0 HB3 SER A 109 9.878 -2.350 9.931 1.00 0.00 H new ATOM 0 HG SER A 109 10.447 -3.862 11.617 1.00 0.00 H new ATOM 1647 N THR A 110 10.129 -1.442 7.538 1.00 0.00 N ATOM 1648 CA THR A 110 10.308 -0.309 6.639 1.00 0.00 C ATOM 1649 C THR A 110 11.710 -0.308 5.996 1.00 0.00 C ATOM 1650 O THR A 110 11.855 -0.038 4.825 1.00 0.00 O ATOM 1651 CB THR A 110 10.173 0.975 7.452 1.00 0.00 C ATOM 1652 OG1 THR A 110 9.081 0.824 8.378 1.00 0.00 O ATOM 1653 CG2 THR A 110 9.905 2.169 6.560 1.00 0.00 C ATOM 0 H THR A 110 9.815 -1.169 8.469 1.00 0.00 H new ATOM 0 HA THR A 110 9.558 -0.379 5.851 1.00 0.00 H new ATOM 0 HB THR A 110 11.110 1.150 7.981 1.00 0.00 H new ATOM 0 HG1 THR A 110 8.986 1.643 8.908 1.00 0.00 H new ATOM 0 HG21 THR A 110 9.814 3.067 7.171 1.00 0.00 H new ATOM 0 HG22 THR A 110 10.729 2.290 5.857 1.00 0.00 H new ATOM 0 HG23 THR A 110 8.978 2.010 6.009 1.00 0.00 H new ATOM 1661 N ASP A 111 12.713 -0.649 6.781 1.00 0.00 N ATOM 1662 CA ASP A 111 14.113 -0.612 6.359 1.00 0.00 C ATOM 1663 C ASP A 111 14.373 -1.376 5.070 1.00 0.00 C ATOM 1664 O ASP A 111 14.935 -0.842 4.111 1.00 0.00 O ATOM 1665 CB ASP A 111 15.023 -1.154 7.470 1.00 0.00 C ATOM 1666 CG ASP A 111 15.075 -0.256 8.680 1.00 0.00 C ATOM 1667 OD1 ASP A 111 14.082 -0.182 9.428 1.00 0.00 O ATOM 1668 OD2 ASP A 111 16.095 0.433 8.877 1.00 0.00 O ATOM 0 H ASP A 111 12.585 -0.964 7.743 1.00 0.00 H new ATOM 0 HA ASP A 111 14.343 0.435 6.163 1.00 0.00 H new ATOM 0 HB2 ASP A 111 14.671 -2.140 7.771 1.00 0.00 H new ATOM 0 HB3 ASP A 111 16.031 -1.282 7.076 1.00 0.00 H new ATOM 1673 N ALA A 112 13.873 -2.567 5.005 1.00 0.00 N ATOM 1674 CA ALA A 112 14.216 -3.454 3.941 1.00 0.00 C ATOM 1675 C ALA A 112 13.588 -3.002 2.654 1.00 0.00 C ATOM 1676 O ALA A 112 14.237 -2.959 1.600 1.00 0.00 O ATOM 1677 CB ALA A 112 13.824 -4.856 4.295 1.00 0.00 C ATOM 0 H ALA A 112 13.218 -2.952 5.685 1.00 0.00 H new ATOM 0 HA ALA A 112 15.296 -3.438 3.794 1.00 0.00 H new ATOM 0 HB1 ALA A 112 14.090 -5.526 3.477 1.00 0.00 H new ATOM 0 HB2 ALA A 112 14.348 -5.163 5.200 1.00 0.00 H new ATOM 0 HB3 ALA A 112 12.748 -4.901 4.466 1.00 0.00 H new ATOM 1683 N GLN A 113 12.358 -2.595 2.758 1.00 0.00 N ATOM 1684 CA GLN A 113 11.641 -2.109 1.621 1.00 0.00 C ATOM 1685 C GLN A 113 12.085 -0.723 1.194 1.00 0.00 C ATOM 1686 O GLN A 113 11.952 -0.350 0.042 1.00 0.00 O ATOM 1687 CB GLN A 113 10.125 -2.222 1.804 1.00 0.00 C ATOM 1688 CG GLN A 113 9.512 -1.846 3.162 1.00 0.00 C ATOM 1689 CD GLN A 113 9.117 -0.364 3.349 1.00 0.00 C ATOM 1690 OE1 GLN A 113 8.175 -0.084 4.062 1.00 0.00 O ATOM 1691 NE2 GLN A 113 9.847 0.575 2.799 1.00 0.00 N ATOM 0 H GLN A 113 11.827 -2.591 3.629 1.00 0.00 H new ATOM 0 HA GLN A 113 11.898 -2.765 0.790 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.654 -1.597 1.045 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.843 -3.253 1.589 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.624 -2.459 3.318 1.00 0.00 H new ATOM 0 HG3 GLN A 113 10.224 -2.111 3.944 1.00 0.00 H new ATOM 0 HE21 GLN A 113 10.635 0.324 2.202 1.00 0.00 H new ATOM 0 HE22 GLN A 113 9.627 1.557 2.968 1.00 0.00 H new ATOM 1700 N MET A 114 12.595 0.053 2.146 1.00 0.00 N ATOM 1701 CA MET A 114 13.103 1.390 1.878 1.00 0.00 C ATOM 1702 C MET A 114 14.376 1.310 1.073 1.00 0.00 C ATOM 1703 O MET A 114 14.750 2.266 0.392 1.00 0.00 O ATOM 1704 CB MET A 114 13.346 2.136 3.198 1.00 0.00 C ATOM 1705 CG MET A 114 13.755 3.598 3.064 1.00 0.00 C ATOM 1706 SD MET A 114 13.860 4.414 4.671 1.00 0.00 S ATOM 1707 CE MET A 114 14.243 6.094 4.188 1.00 0.00 C ATOM 0 H MET A 114 12.667 -0.229 3.124 1.00 0.00 H new ATOM 0 HA MET A 114 12.362 1.941 1.299 1.00 0.00 H new ATOM 0 HB2 MET A 114 12.436 2.086 3.796 1.00 0.00 H new ATOM 0 HB3 MET A 114 14.122 1.610 3.754 1.00 0.00 H new ATOM 0 HG2 MET A 114 14.720 3.661 2.561 1.00 0.00 H new ATOM 0 HG3 MET A 114 13.033 4.121 2.437 1.00 0.00 H new ATOM 0 HE1 MET A 114 14.338 6.716 5.078 1.00 0.00 H new ATOM 0 HE2 MET A 114 15.181 6.108 3.634 1.00 0.00 H new ATOM 0 HE3 MET A 114 13.443 6.483 3.557 1.00 0.00 H new ATOM 1717 N GLN A 115 15.062 0.161 1.148 1.00 0.00 N ATOM 1718 CA GLN A 115 16.265 -0.003 0.350 1.00 0.00 C ATOM 1719 C GLN A 115 15.900 -0.124 -1.123 1.00 0.00 C ATOM 1720 O GLN A 115 16.697 0.223 -2.000 1.00 0.00 O ATOM 1721 CB GLN A 115 17.183 -1.137 0.830 1.00 0.00 C ATOM 1722 CG GLN A 115 17.665 -1.004 2.291 1.00 0.00 C ATOM 1723 CD GLN A 115 17.800 0.443 2.760 1.00 0.00 C ATOM 1724 OE1 GLN A 115 18.823 1.088 2.576 1.00 0.00 O ATOM 1725 NE2 GLN A 115 16.773 0.917 3.428 1.00 0.00 N ATOM 0 H GLN A 115 14.810 -0.636 1.732 1.00 0.00 H new ATOM 0 HA GLN A 115 16.865 0.897 0.485 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.655 -2.084 0.721 1.00 0.00 H new ATOM 0 HB3 GLN A 115 18.055 -1.181 0.177 1.00 0.00 H new ATOM 0 HG2 GLN A 115 16.966 -1.525 2.945 1.00 0.00 H new ATOM 0 HG3 GLN A 115 18.629 -1.502 2.394 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.940 0.343 3.557 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.809 1.859 3.818 1.00 0.00 H new ATOM 1734 N TYR A 116 14.702 -0.648 -1.368 1.00 0.00 N ATOM 1735 CA TYR A 116 14.031 -0.573 -2.646 1.00 0.00 C ATOM 1736 C TYR A 116 14.617 -1.443 -3.765 1.00 0.00 C ATOM 1737 O TYR A 116 15.546 -1.045 -4.488 1.00 0.00 O ATOM 1738 CB TYR A 116 13.846 0.910 -3.077 1.00 0.00 C ATOM 1739 CG TYR A 116 13.081 1.129 -4.359 1.00 0.00 C ATOM 1740 CD1 TYR A 116 11.725 0.903 -4.417 1.00 0.00 C ATOM 1741 CD2 TYR A 116 13.716 1.581 -5.508 1.00 0.00 C ATOM 1742 CE1 TYR A 116 11.015 1.115 -5.579 1.00 0.00 C ATOM 1743 CE2 TYR A 116 13.006 1.793 -6.680 1.00 0.00 C ATOM 1744 CZ TYR A 116 11.652 1.557 -6.704 1.00 0.00 C ATOM 1745 OH TYR A 116 10.927 1.751 -7.860 1.00 0.00 O ATOM 0 H TYR A 116 14.164 -1.148 -0.660 1.00 0.00 H new ATOM 0 HA TYR A 116 13.052 -1.023 -2.481 1.00 0.00 H new ATOM 0 HB2 TYR A 116 13.334 1.441 -2.275 1.00 0.00 H new ATOM 0 HB3 TYR A 116 14.831 1.364 -3.181 1.00 0.00 H new ATOM 0 HD1 TYR A 116 11.208 0.553 -3.536 1.00 0.00 H new ATOM 0 HD2 TYR A 116 14.779 1.770 -5.489 1.00 0.00 H new ATOM 0 HE1 TYR A 116 9.951 0.931 -5.600 1.00 0.00 H new ATOM 0 HE2 TYR A 116 13.513 2.141 -7.568 1.00 0.00 H new ATOM 0 HH TYR A 116 11.523 2.068 -8.571 1.00 0.00 H new ATOM 1755 N ASP A 117 14.105 -2.646 -3.860 1.00 0.00 N ATOM 1756 CA ASP A 117 14.310 -3.467 -5.022 1.00 0.00 C ATOM 1757 C ASP A 117 13.134 -3.170 -5.921 1.00 0.00 C ATOM 1758 O ASP A 117 11.990 -3.232 -5.451 1.00 0.00 O ATOM 1759 CB ASP A 117 14.346 -4.982 -4.704 1.00 0.00 C ATOM 1760 CG ASP A 117 15.602 -5.465 -4.017 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.623 -5.702 -4.719 1.00 0.00 O ATOM 1762 OD2 ASP A 117 15.592 -5.674 -2.776 1.00 0.00 O ATOM 0 H ASP A 117 13.536 -3.080 -3.134 1.00 0.00 H new ATOM 0 HA ASP A 117 15.277 -3.240 -5.472 1.00 0.00 H new ATOM 0 HB2 ASP A 117 13.490 -5.225 -4.074 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.224 -5.535 -5.635 1.00 0.00 H new ATOM 1767 N PRO A 118 13.370 -2.809 -7.189 1.00 0.00 N ATOM 1768 CA PRO A 118 12.296 -2.425 -8.122 1.00 0.00 C ATOM 1769 C PRO A 118 11.163 -3.465 -8.190 1.00 0.00 C ATOM 1770 O PRO A 118 10.002 -3.142 -7.922 1.00 0.00 O ATOM 1771 CB PRO A 118 13.021 -2.333 -9.469 1.00 0.00 C ATOM 1772 CG PRO A 118 14.432 -2.017 -9.106 1.00 0.00 C ATOM 1773 CD PRO A 118 14.698 -2.723 -7.821 1.00 0.00 C ATOM 0 HA PRO A 118 11.805 -1.501 -7.816 1.00 0.00 H new ATOM 0 HB2 PRO A 118 12.953 -3.270 -10.022 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.589 -1.557 -10.101 1.00 0.00 H new ATOM 0 HG2 PRO A 118 15.118 -2.352 -9.884 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.574 -0.942 -8.996 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.127 -3.711 -7.988 1.00 0.00 H new ATOM 0 HD3 PRO A 118 15.403 -2.171 -7.199 1.00 0.00 H new ATOM 1781 N GLY A 119 11.505 -4.702 -8.540 1.00 0.00 N ATOM 1782 CA GLY A 119 10.554 -5.801 -8.554 1.00 0.00 C ATOM 1783 C GLY A 119 9.866 -6.060 -7.233 1.00 0.00 C ATOM 1784 O GLY A 119 8.729 -6.487 -7.224 1.00 0.00 O ATOM 0 H GLY A 119 12.449 -4.967 -8.821 1.00 0.00 H new ATOM 0 HA2 GLY A 119 9.795 -5.597 -9.309 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.073 -6.709 -8.861 1.00 0.00 H new ATOM 1788 N LEU A 120 10.524 -5.751 -6.129 1.00 0.00 N ATOM 1789 CA LEU A 120 9.946 -5.988 -4.805 1.00 0.00 C ATOM 1790 C LEU A 120 8.836 -4.989 -4.608 1.00 0.00 C ATOM 1791 O LEU A 120 7.718 -5.342 -4.193 1.00 0.00 O ATOM 1792 CB LEU A 120 11.002 -5.818 -3.700 1.00 0.00 C ATOM 1793 CG LEU A 120 10.531 -6.034 -2.247 1.00 0.00 C ATOM 1794 CD1 LEU A 120 10.057 -7.470 -2.024 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.636 -5.674 -1.262 1.00 0.00 C ATOM 0 H LEU A 120 11.456 -5.337 -6.116 1.00 0.00 H new ATOM 0 HA LEU A 120 9.570 -7.009 -4.745 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.817 -6.514 -3.900 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.415 -4.812 -3.777 1.00 0.00 H new ATOM 0 HG LEU A 120 9.683 -5.372 -2.071 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.732 -7.589 -0.991 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.225 -7.687 -2.694 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.876 -8.159 -2.229 1.00 0.00 H new ATOM 0 HD21 LEU A 120 11.282 -5.834 -0.244 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.507 -6.303 -1.446 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.911 -4.627 -1.390 1.00 0.00 H new ATOM 1807 N PHE A 121 9.150 -3.731 -4.922 1.00 0.00 N ATOM 1808 CA PHE A 121 8.171 -2.661 -4.910 1.00 0.00 C ATOM 1809 C PHE A 121 6.998 -3.023 -5.827 1.00 0.00 C ATOM 1810 O PHE A 121 5.855 -2.822 -5.475 1.00 0.00 O ATOM 1811 CB PHE A 121 8.798 -1.339 -5.359 1.00 0.00 C ATOM 1812 CG PHE A 121 7.840 -0.167 -5.416 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.450 0.487 -4.254 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.332 0.276 -6.633 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.573 1.550 -4.309 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.457 1.338 -6.691 1.00 0.00 C ATOM 1817 CZ PHE A 121 6.078 1.975 -5.530 1.00 0.00 C ATOM 0 H PHE A 121 10.088 -3.434 -5.190 1.00 0.00 H new ATOM 0 HA PHE A 121 7.809 -2.536 -3.889 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.613 -1.091 -4.679 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.238 -1.479 -6.347 1.00 0.00 H new ATOM 0 HD1 PHE A 121 7.837 0.160 -3.300 1.00 0.00 H new ATOM 0 HD2 PHE A 121 7.628 -0.220 -7.546 1.00 0.00 H new ATOM 0 HE1 PHE A 121 6.273 2.050 -3.400 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.070 1.670 -7.643 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.393 2.809 -5.572 1.00 0.00 H new ATOM 1827 N ALA A 122 7.310 -3.588 -6.986 1.00 0.00 N ATOM 1828 CA ALA A 122 6.296 -4.003 -7.923 1.00 0.00 C ATOM 1829 C ALA A 122 5.404 -5.092 -7.326 1.00 0.00 C ATOM 1830 O ALA A 122 4.184 -4.993 -7.414 1.00 0.00 O ATOM 1831 CB ALA A 122 6.920 -4.449 -9.231 1.00 0.00 C ATOM 0 H ALA A 122 8.266 -3.767 -7.293 1.00 0.00 H new ATOM 0 HA ALA A 122 5.660 -3.144 -8.136 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.135 -4.757 -9.922 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.483 -3.623 -9.666 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.591 -5.288 -9.047 1.00 0.00 H new ATOM 1837 N GLN A 123 6.006 -6.124 -6.705 1.00 0.00 N ATOM 1838 CA GLN A 123 5.221 -7.191 -6.096 1.00 0.00 C ATOM 1839 C GLN A 123 4.320 -6.645 -4.995 1.00 0.00 C ATOM 1840 O GLN A 123 3.108 -6.875 -5.025 1.00 0.00 O ATOM 1841 CB GLN A 123 6.093 -8.329 -5.531 1.00 0.00 C ATOM 1842 CG GLN A 123 7.123 -8.933 -6.498 1.00 0.00 C ATOM 1843 CD GLN A 123 6.563 -9.297 -7.867 1.00 0.00 C ATOM 1844 OE1 GLN A 123 6.073 -10.407 -8.095 1.00 0.00 O ATOM 1845 NE2 GLN A 123 6.690 -8.390 -8.805 1.00 0.00 N ATOM 0 H GLN A 123 7.016 -6.233 -6.617 1.00 0.00 H new ATOM 0 HA GLN A 123 4.610 -7.610 -6.896 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.623 -7.953 -4.656 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.435 -9.127 -5.187 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.939 -8.223 -6.630 1.00 0.00 H new ATOM 0 HG3 GLN A 123 7.549 -9.828 -6.044 1.00 0.00 H new ATOM 0 HE21 GLN A 123 7.099 -7.482 -8.584 1.00 0.00 H new ATOM 0 HE22 GLN A 123 6.380 -8.592 -9.755 1.00 0.00 H new ATOM 1854 N ILE A 124 4.898 -5.893 -4.043 1.00 0.00 N ATOM 1855 CA ILE A 124 4.121 -5.357 -2.924 1.00 0.00 C ATOM 1856 C ILE A 124 2.996 -4.419 -3.411 1.00 0.00 C ATOM 1857 O ILE A 124 1.877 -4.484 -2.909 1.00 0.00 O ATOM 1858 CB ILE A 124 5.008 -4.636 -1.825 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.701 -3.400 -2.383 1.00 0.00 C ATOM 1860 CG2 ILE A 124 6.037 -5.582 -1.239 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.528 -2.646 -1.367 1.00 0.00 C ATOM 0 H ILE A 124 5.888 -5.648 -4.029 1.00 0.00 H new ATOM 0 HA ILE A 124 3.671 -6.225 -2.442 1.00 0.00 H new ATOM 0 HB ILE A 124 4.330 -4.321 -1.032 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.345 -3.700 -3.210 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.947 -2.728 -2.793 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.629 -5.057 -0.489 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.531 -6.428 -0.775 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.693 -5.942 -2.031 1.00 0.00 H new ATOM 0 HD11 ILE A 124 6.988 -1.780 -1.843 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.887 -2.313 -0.551 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.306 -3.300 -0.974 1.00 0.00 H new ATOM 1873 N GLN A 125 3.295 -3.599 -4.420 1.00 0.00 N ATOM 1874 CA GLN A 125 2.355 -2.640 -4.955 1.00 0.00 C ATOM 1875 C GLN A 125 1.177 -3.342 -5.602 1.00 0.00 C ATOM 1876 O GLN A 125 0.004 -3.034 -5.302 1.00 0.00 O ATOM 1877 CB GLN A 125 3.034 -1.808 -6.012 1.00 0.00 C ATOM 1878 CG GLN A 125 2.178 -0.692 -6.518 1.00 0.00 C ATOM 1879 CD GLN A 125 2.673 -0.112 -7.812 1.00 0.00 C ATOM 1880 OE1 GLN A 125 3.272 -0.795 -8.636 1.00 0.00 O ATOM 1881 NE2 GLN A 125 2.455 1.140 -7.992 1.00 0.00 N ATOM 0 H GLN A 125 4.203 -3.589 -4.884 1.00 0.00 H new ATOM 0 HA GLN A 125 2.003 -2.017 -4.133 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.956 -1.394 -5.604 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.315 -2.450 -6.847 1.00 0.00 H new ATOM 0 HG2 GLN A 125 1.160 -1.056 -6.656 1.00 0.00 H new ATOM 0 HG3 GLN A 125 2.136 0.096 -5.766 1.00 0.00 H new ATOM 0 HE21 GLN A 125 1.953 1.677 -7.285 1.00 0.00 H new ATOM 0 HE22 GLN A 125 2.784 1.598 -8.842 1.00 0.00 H new ATOM 1890 N ALA A 126 1.491 -4.277 -6.489 1.00 0.00 N ATOM 1891 CA ALA A 126 0.487 -4.984 -7.250 1.00 0.00 C ATOM 1892 C ALA A 126 -0.405 -5.782 -6.340 1.00 0.00 C ATOM 1893 O ALA A 126 -1.626 -5.697 -6.446 1.00 0.00 O ATOM 1894 CB ALA A 126 1.111 -5.865 -8.329 1.00 0.00 C ATOM 0 H ALA A 126 2.448 -4.561 -6.696 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.126 -4.241 -7.760 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.323 -6.380 -8.879 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.688 -5.246 -9.016 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.768 -6.600 -7.864 1.00 0.00 H new ATOM 1900 N ALA A 127 0.205 -6.501 -5.391 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.549 -7.311 -4.454 1.00 0.00 C ATOM 1902 C ALA A 127 -1.444 -6.434 -3.609 1.00 0.00 C ATOM 1903 O ALA A 127 -2.579 -6.828 -3.292 1.00 0.00 O ATOM 1904 CB ALA A 127 0.385 -8.129 -3.567 1.00 0.00 C ATOM 0 H ALA A 127 1.216 -6.532 -5.259 1.00 0.00 H new ATOM 0 HA ALA A 127 -1.170 -8.004 -5.022 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -0.204 -8.728 -2.873 1.00 0.00 H new ATOM 0 HB2 ALA A 127 0.993 -8.787 -4.188 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.034 -7.457 -3.006 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.948 -5.226 -3.254 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.722 -4.323 -2.452 1.00 0.00 C ATOM 1912 C ALA A 128 -2.992 -3.907 -3.140 1.00 0.00 C ATOM 1913 O ALA A 128 -4.002 -4.282 -2.710 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.921 -3.098 -2.021 1.00 0.00 C ATOM 0 H ALA A 128 -0.025 -4.881 -3.519 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.991 -4.875 -1.552 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.551 -2.446 -1.416 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.059 -3.415 -1.434 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.580 -2.557 -2.904 1.00 0.00 H new ATOM 1920 N THR A 129 -2.929 -3.225 -4.261 1.00 0.00 N ATOM 1921 CA THR A 129 -4.190 -2.784 -4.913 1.00 0.00 C ATOM 1922 C THR A 129 -5.129 -3.981 -5.291 1.00 0.00 C ATOM 1923 O THR A 129 -6.425 -3.893 -5.167 1.00 0.00 O ATOM 1924 CB THR A 129 -3.960 -1.787 -6.116 1.00 0.00 C ATOM 1925 OG1 THR A 129 -5.180 -1.550 -6.849 1.00 0.00 O ATOM 1926 CG2 THR A 129 -2.850 -2.249 -7.055 1.00 0.00 C ATOM 0 H THR A 129 -2.069 -2.961 -4.742 1.00 0.00 H new ATOM 0 HA THR A 129 -4.721 -2.208 -4.155 1.00 0.00 H new ATOM 0 HB THR A 129 -3.637 -0.845 -5.673 1.00 0.00 H new ATOM 0 HG1 THR A 129 -4.984 -1.519 -7.809 1.00 0.00 H new ATOM 0 HG21 THR A 129 -2.734 -1.528 -7.864 1.00 0.00 H new ATOM 0 HG22 THR A 129 -1.914 -2.327 -6.501 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.108 -3.223 -7.472 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.474 -5.130 -5.550 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.135 -6.363 -6.001 1.00 0.00 C ATOM 1936 C LYS A 130 -6.058 -6.831 -4.906 1.00 0.00 C ATOM 1937 O LYS A 130 -7.029 -7.486 -5.134 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.075 -7.446 -6.290 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.598 -8.736 -6.899 1.00 0.00 C ATOM 1940 CD LYS A 130 -5.239 -8.471 -8.236 1.00 0.00 C ATOM 1941 CE LYS A 130 -5.750 -9.731 -8.889 1.00 0.00 C ATOM 1942 NZ LYS A 130 -6.382 -9.443 -10.205 1.00 0.00 N ATOM 0 H LYS A 130 -3.463 -5.225 -5.450 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.700 -6.176 -6.914 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.327 -7.026 -6.963 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.565 -7.687 -5.357 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -3.780 -9.447 -7.017 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -5.323 -9.194 -6.226 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -6.065 -7.771 -8.108 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -4.515 -7.992 -8.895 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -4.926 -10.432 -9.025 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -6.475 -10.214 -8.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -6.723 -10.330 -10.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -7.183 -8.793 -10.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -5.683 -9.004 -10.837 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.658 -6.530 -3.725 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.373 -6.715 -2.511 1.00 0.00 C ATOM 1958 C ALA A 131 -7.288 -5.541 -2.267 1.00 0.00 C ATOM 1959 O ALA A 131 -8.508 -5.704 -2.235 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.317 -6.787 -1.490 1.00 0.00 C ATOM 0 H ALA A 131 -4.742 -6.111 -3.567 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.007 -7.602 -2.513 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.769 -6.930 -0.509 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.655 -7.624 -1.710 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.744 -5.860 -1.494 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.685 -4.346 -2.207 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.301 -3.064 -1.839 1.00 0.00 C ATOM 1968 C TRP A 132 -8.346 -2.537 -2.857 1.00 0.00 C ATOM 1969 O TRP A 132 -8.513 -1.336 -3.046 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.257 -1.963 -1.531 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.319 -2.286 -0.402 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -4.858 -3.491 -0.128 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -4.730 -1.420 0.594 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -3.956 -3.475 0.828 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -3.854 -2.227 1.321 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -4.805 -0.051 0.937 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.077 -1.748 2.335 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.035 0.398 1.958 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.178 -0.447 2.625 1.00 0.00 C ATOM 0 H TRP A 132 -5.694 -4.242 -2.427 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.845 -3.295 -0.923 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.670 -1.776 -2.430 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -6.783 -1.038 -1.295 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.185 -4.389 -0.632 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.418 -4.281 1.146 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.459 0.620 0.400 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.407 -2.395 2.882 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.095 1.435 2.253 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -2.562 -0.043 3.415 1.00 0.00 H new ATOM 1990 N ARG A 133 -8.969 -3.426 -3.542 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.144 -3.089 -4.338 1.00 0.00 C ATOM 1992 C ARG A 133 -11.521 -3.726 -3.892 1.00 0.00 C ATOM 1993 O ARG A 133 -12.518 -3.011 -3.807 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.882 -3.270 -5.848 1.00 0.00 C ATOM 1995 CG ARG A 133 -11.090 -2.968 -6.766 1.00 0.00 C ATOM 1996 CD ARG A 133 -12.089 -4.109 -6.814 1.00 0.00 C ATOM 1997 NE ARG A 133 -13.426 -3.676 -7.239 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.973 -3.937 -8.452 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -13.234 -4.424 -9.440 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -15.244 -3.699 -8.657 1.00 0.00 N ATOM 0 H ARG A 133 -8.699 -4.409 -3.582 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.291 -2.030 -4.125 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.055 -2.622 -6.137 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.559 -4.296 -6.024 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.591 -2.066 -6.415 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.732 -2.761 -7.775 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.726 -4.876 -7.498 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -12.157 -4.568 -5.828 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.984 -3.140 -6.574 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -12.241 -4.607 -9.292 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -13.658 -4.616 -10.348 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -15.819 -3.318 -7.906 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -15.659 -3.894 -9.568 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.545 -5.040 -3.601 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.807 -5.922 -3.613 1.00 0.00 C ATOM 2016 C LYS A 134 -14.028 -5.619 -2.735 1.00 0.00 C ATOM 2017 O LYS A 134 -14.688 -6.553 -2.280 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.508 -7.405 -3.507 1.00 0.00 C ATOM 2019 CG LYS A 134 -12.124 -8.018 -4.813 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.842 -7.465 -5.304 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.724 -7.925 -4.445 1.00 0.00 C ATOM 2022 NZ LYS A 134 -9.373 -9.344 -4.722 1.00 0.00 N ATOM 0 H LYS A 134 -10.703 -5.556 -3.345 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.143 -5.607 -4.601 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -11.702 -7.557 -2.790 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.385 -7.920 -3.114 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -12.038 -9.099 -4.700 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.908 -7.836 -5.548 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.672 -7.780 -6.334 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.884 -6.376 -5.306 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -8.851 -7.294 -4.612 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -10.000 -7.815 -3.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.446 -9.560 -4.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -10.094 -9.968 -4.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.334 -9.498 -5.750 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.404 -4.427 -2.570 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.493 -4.142 -1.663 1.00 0.00 C ATOM 2038 C LEU A 135 -16.848 -4.216 -2.338 1.00 0.00 C ATOM 2039 O LEU A 135 -16.934 -4.440 -3.543 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.274 -2.802 -1.045 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.638 -2.772 0.331 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.420 -3.649 0.386 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.237 -1.382 0.579 1.00 0.00 C ATOM 0 H LEU A 135 -13.997 -3.615 -3.034 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.500 -4.909 -0.889 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -14.649 -2.216 -1.719 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.238 -2.296 -0.983 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.344 -3.137 1.077 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -12.986 -3.607 1.385 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.701 -4.677 0.156 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.688 -3.301 -0.343 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -13.772 -1.307 1.562 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.525 -1.067 -0.184 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.116 -0.738 0.544 1.00 0.00 H new ATOM 2055 N PRO A 136 -17.933 -4.161 -1.549 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.297 -4.053 -2.077 1.00 0.00 C ATOM 2057 C PRO A 136 -19.519 -2.731 -2.871 1.00 0.00 C ATOM 2058 O PRO A 136 -18.575 -2.038 -3.264 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.144 -4.054 -0.799 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.316 -4.750 0.202 1.00 0.00 C ATOM 2061 CD PRO A 136 -17.937 -4.317 -0.077 1.00 0.00 C ATOM 0 HA PRO A 136 -19.539 -4.850 -2.781 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -20.380 -3.039 -0.480 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -21.093 -4.568 -0.954 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -19.616 -4.484 1.216 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -19.416 -5.832 0.113 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -17.696 -3.382 0.429 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -17.207 -5.056 0.253 1.00 0.00 H new ATOM 2069 N VAL A 137 -20.754 -2.315 -2.976 1.00 0.00 N ATOM 2070 CA VAL A 137 -21.065 -1.176 -3.834 1.00 0.00 C ATOM 2071 C VAL A 137 -20.990 0.119 -3.045 1.00 0.00 C ATOM 2072 O VAL A 137 -21.008 1.217 -3.608 1.00 0.00 O ATOM 2073 CB VAL A 137 -22.433 -1.311 -4.536 1.00 0.00 C ATOM 2074 CG1 VAL A 137 -22.443 -2.554 -5.415 1.00 0.00 C ATOM 2075 CG2 VAL A 137 -23.565 -1.364 -3.530 1.00 0.00 C ATOM 0 H VAL A 137 -21.552 -2.729 -2.495 1.00 0.00 H new ATOM 0 HA VAL A 137 -20.312 -1.158 -4.622 1.00 0.00 H new ATOM 0 HB VAL A 137 -22.586 -0.430 -5.160 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -23.411 -2.644 -5.908 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -21.659 -2.474 -6.168 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -22.266 -3.436 -4.800 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -24.515 -1.459 -4.056 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -23.427 -2.222 -2.872 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -23.568 -0.449 -2.938 1.00 0.00 H new ATOM 2085 N LYS A 138 -20.871 -0.043 -1.743 1.00 0.00 N ATOM 2086 CA LYS A 138 -20.823 1.034 -0.775 1.00 0.00 C ATOM 2087 C LYS A 138 -20.692 0.351 0.572 1.00 0.00 C ATOM 2088 O LYS A 138 -19.754 0.578 1.337 1.00 0.00 O ATOM 2089 CB LYS A 138 -22.159 1.822 -0.818 1.00 0.00 C ATOM 2090 CG LYS A 138 -22.048 3.368 -0.738 1.00 0.00 C ATOM 2091 CD LYS A 138 -21.711 3.907 0.658 1.00 0.00 C ATOM 2092 CE LYS A 138 -20.302 3.592 1.129 1.00 0.00 C ATOM 2093 NZ LYS A 138 -20.082 3.984 2.530 1.00 0.00 N ATOM 0 H LYS A 138 -20.802 -0.965 -1.313 1.00 0.00 H new ATOM 0 HA LYS A 138 -20.006 1.728 -0.970 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -22.679 1.564 -1.740 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -22.784 1.481 0.007 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -21.282 3.702 -1.438 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -22.991 3.805 -1.065 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -21.848 4.988 0.659 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -22.421 3.495 1.375 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -20.115 2.524 1.019 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -19.584 4.109 0.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -19.107 3.750 2.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -20.235 5.008 2.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -20.748 3.472 3.143 1.00 0.00 H new ATOM 2107 N GLY A 139 -21.596 -0.555 0.791 1.00 0.00 N ATOM 2108 CA GLY A 139 -21.704 -1.279 2.019 1.00 0.00 C ATOM 2109 C GLY A 139 -23.083 -1.826 2.067 1.00 0.00 C ATOM 2110 O GLY A 139 -23.300 -3.018 2.245 1.00 0.00 O ATOM 0 H GLY A 139 -22.299 -0.818 0.100 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -20.967 -2.081 2.062 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -21.516 -0.627 2.872 1.00 0.00 H new ATOM 2114 N ASP A 140 -24.005 -0.945 1.841 1.00 0.00 N ATOM 2115 CA ASP A 140 -25.386 -1.267 1.653 1.00 0.00 C ATOM 2116 C ASP A 140 -25.839 -0.648 0.369 1.00 0.00 C ATOM 2117 O ASP A 140 -25.987 0.592 0.317 1.00 0.00 O ATOM 2118 CB ASP A 140 -26.258 -0.822 2.817 1.00 0.00 C ATOM 2119 CG ASP A 140 -27.731 -0.868 2.462 1.00 0.00 C ATOM 2120 OD1 ASP A 140 -28.244 -1.940 2.094 1.00 0.00 O ATOM 2121 OD2 ASP A 140 -28.398 0.198 2.521 1.00 0.00 O ATOM 2122 OXT ASP A 140 -25.985 -1.364 -0.614 1.00 0.00 O ATOM 0 H ASP A 140 -23.811 0.055 1.780 1.00 0.00 H new ATOM 0 HA ASP A 140 -25.490 -2.351 1.608 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -26.071 -1.463 3.678 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -25.985 0.192 3.109 1.00 0.00 H new TER 2127 ASP A 140