USER MOD reduce.3.24.130724 H: found=0, std=0, add=903, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 903 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 17 THR OG1 : rot 180:sc= 0.0171 USER MOD Set 1.2: A 101 ASN : amide:sc= -0.883 K(o=-0.87,f=-1.5!) USER MOD Set 2.1: A 76 SER OG : rot -172:sc= 1.01 USER MOD Set 2.2: A 78 TYR OH : rot 0:sc= -0.251! USER MOD Set 3.1: A 27 ASN : amide:sc= 0 X(o=-1.7,f=-1.7) USER MOD Set 3.2: A 41 GLN : amide:sc= -1.69! C(o=-1.7!,f=-2.8!) USER MOD Single : A 3 GLN : amide:sc= -0.0839 X(o=-0.084,f=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.0508 USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot -143:sc= -1.84! USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 13 THR OG1 : rot -68:sc= 0.772 USER MOD Single : A 18 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 28 THR OG1 : rot -15:sc= 0.607 USER MOD Single : A 31 THR OG1 : rot -89:sc= -0.627 USER MOD Single : A 32 SER OG : rot 42:sc= 0.388 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.0547 USER MOD Single : A 43 GLN : amide:sc= -0.677 X(o=-0.68,f=-0.89) USER MOD Single : A 44 THR OG1 : rot -170:sc= -2.58! USER MOD Single : A 47 SER OG : rot -34:sc= 0.0973 USER MOD Single : A 50 ASN : amide:sc= -0.0502 X(o=-0.05,f=0) USER MOD Single : A 51 ASN : amide:sc= -0.256 X(o=-0.26,f=-0.11) USER MOD Single : A 58 SER OG : rot 180:sc= -0.0473 USER MOD Single : A 66 HIS : no HD1:sc= -1.58 K(o=-1.6,f=-3.6!) USER MOD Single : A 67 TYR OH : rot 165:sc= -0.0449 USER MOD Single : A 69 THR OG1 : rot 75:sc= -0.937 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 180:sc= -0.247 USER MOD Single : A 88 THR OG1 : rot -63:sc= 0.845 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 139:sc= 1.57 USER MOD Single : A 92 SER OG : rot -125:sc= 0.985 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 125:sc= 0.247! USER MOD Single : A 100 TYR OH : rot 30:sc= -0.113 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -0.109 K(o=-0.11,f=-3!) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.133 X(o=-0.13,f=-0.13) USER MOD ----------------------------------------------------------------- ATOM 14 N TRP A 2 8.038 3.121 -2.220 1.00 0.00 N ATOM 15 CA TRP A 2 8.653 4.419 -1.819 1.00 0.00 C ATOM 16 C TRP A 2 9.274 5.078 -3.051 1.00 0.00 C ATOM 17 O TRP A 2 9.839 4.416 -3.893 1.00 0.00 O ATOM 18 CB TRP A 2 9.713 4.167 -0.747 1.00 0.00 C ATOM 19 CG TRP A 2 9.227 3.080 0.160 1.00 0.00 C ATOM 20 CD1 TRP A 2 9.570 1.775 0.067 1.00 0.00 C ATOM 21 CD2 TRP A 2 8.301 3.180 1.281 1.00 0.00 C ATOM 22 NE1 TRP A 2 8.920 1.070 1.066 1.00 0.00 N ATOM 23 CE2 TRP A 2 8.126 1.891 1.839 1.00 0.00 C ATOM 24 CE3 TRP A 2 7.606 4.254 1.863 1.00 0.00 C ATOM 25 CZ2 TRP A 2 7.290 1.676 2.936 1.00 0.00 C ATOM 26 CZ3 TRP A 2 6.763 4.042 2.966 1.00 0.00 C ATOM 27 CH2 TRP A 2 6.606 2.755 3.502 1.00 0.00 C ATOM 0 HA TRP A 2 7.895 5.085 -1.407 1.00 0.00 H new ATOM 0 HB2 TRP A 2 10.657 3.880 -1.209 1.00 0.00 H new ATOM 0 HB3 TRP A 2 9.900 5.078 -0.179 1.00 0.00 H new ATOM 0 HD1 TRP A 2 10.241 1.352 -0.666 1.00 0.00 H new ATOM 0 HE1 TRP A 2 9.017 0.065 1.212 1.00 0.00 H new ATOM 0 HE3 TRP A 2 7.721 5.249 1.459 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 7.173 0.683 3.344 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 6.233 4.874 3.404 1.00 0.00 H new ATOM 0 HH2 TRP A 2 5.957 2.598 4.351 1.00 0.00 H new ATOM 38 N GLN A 3 9.139 6.373 -3.169 1.00 0.00 N ATOM 39 CA GLN A 3 9.682 7.104 -4.357 1.00 0.00 C ATOM 40 C GLN A 3 10.962 6.445 -4.887 1.00 0.00 C ATOM 41 O GLN A 3 10.934 5.697 -5.846 1.00 0.00 O ATOM 42 CB GLN A 3 9.986 8.552 -3.968 1.00 0.00 C ATOM 43 CG GLN A 3 8.971 9.484 -4.634 1.00 0.00 C ATOM 44 CD GLN A 3 9.576 10.883 -4.774 1.00 0.00 C ATOM 45 OE1 GLN A 3 9.431 11.521 -5.798 1.00 0.00 O ATOM 46 NE2 GLN A 3 10.254 11.389 -3.781 1.00 0.00 N ATOM 0 H GLN A 3 8.669 6.965 -2.484 1.00 0.00 H new ATOM 0 HA GLN A 3 8.930 7.072 -5.145 1.00 0.00 H new ATOM 0 HB2 GLN A 3 9.943 8.665 -2.885 1.00 0.00 H new ATOM 0 HB3 GLN A 3 10.997 8.818 -4.277 1.00 0.00 H new ATOM 0 HG2 GLN A 3 8.694 9.096 -5.614 1.00 0.00 H new ATOM 0 HG3 GLN A 3 8.058 9.529 -4.040 1.00 0.00 H new ATOM 0 HE21 GLN A 3 10.376 10.854 -2.921 1.00 0.00 H new ATOM 0 HE22 GLN A 3 10.662 12.320 -3.864 1.00 0.00 H new ATOM 55 N THR A 4 12.085 6.735 -4.293 1.00 0.00 N ATOM 56 CA THR A 4 13.365 6.144 -4.786 1.00 0.00 C ATOM 57 C THR A 4 13.360 4.621 -4.626 1.00 0.00 C ATOM 58 O THR A 4 13.919 3.910 -5.438 1.00 0.00 O ATOM 59 CB THR A 4 14.532 6.735 -3.995 1.00 0.00 C ATOM 60 OG1 THR A 4 14.212 8.061 -3.598 1.00 0.00 O ATOM 61 CG2 THR A 4 15.784 6.750 -4.873 1.00 0.00 C ATOM 0 H THR A 4 12.175 7.355 -3.488 1.00 0.00 H new ATOM 0 HA THR A 4 13.473 6.380 -5.845 1.00 0.00 H new ATOM 0 HB THR A 4 14.717 6.128 -3.109 1.00 0.00 H new ATOM 0 HG1 THR A 4 14.959 8.440 -3.089 1.00 0.00 H new ATOM 0 HG21 THR A 4 16.618 7.171 -4.311 1.00 0.00 H new ATOM 0 HG22 THR A 4 16.028 5.732 -5.176 1.00 0.00 H new ATOM 0 HG23 THR A 4 15.600 7.358 -5.759 1.00 0.00 H new ATOM 69 N TYR A 5 12.749 4.104 -3.595 1.00 0.00 N ATOM 70 CA TYR A 5 12.740 2.621 -3.415 1.00 0.00 C ATOM 71 C TYR A 5 11.730 1.988 -4.376 1.00 0.00 C ATOM 72 O TYR A 5 11.518 0.792 -4.364 1.00 0.00 O ATOM 73 CB TYR A 5 12.358 2.264 -1.976 1.00 0.00 C ATOM 74 CG TYR A 5 13.009 3.231 -1.013 1.00 0.00 C ATOM 75 CD1 TYR A 5 14.178 3.909 -1.382 1.00 0.00 C ATOM 76 CD2 TYR A 5 12.444 3.447 0.252 1.00 0.00 C ATOM 77 CE1 TYR A 5 14.781 4.803 -0.490 1.00 0.00 C ATOM 78 CE2 TYR A 5 13.049 4.343 1.144 1.00 0.00 C ATOM 79 CZ TYR A 5 14.217 5.020 0.773 1.00 0.00 C ATOM 80 OH TYR A 5 14.814 5.901 1.651 1.00 0.00 O ATOM 0 H TYR A 5 12.260 4.636 -2.875 1.00 0.00 H new ATOM 0 HA TYR A 5 13.738 2.238 -3.627 1.00 0.00 H new ATOM 0 HB2 TYR A 5 11.275 2.296 -1.860 1.00 0.00 H new ATOM 0 HB3 TYR A 5 12.673 1.245 -1.750 1.00 0.00 H new ATOM 0 HD1 TYR A 5 14.614 3.742 -2.356 1.00 0.00 H new ATOM 0 HD2 TYR A 5 11.544 2.924 0.539 1.00 0.00 H new ATOM 0 HE1 TYR A 5 15.682 5.326 -0.776 1.00 0.00 H new ATOM 0 HE2 TYR A 5 12.614 4.511 2.118 1.00 0.00 H new ATOM 0 HH TYR A 5 14.296 5.936 2.482 1.00 0.00 H new ATOM 90 N VAL A 6 11.110 2.776 -5.210 1.00 0.00 N ATOM 91 CA VAL A 6 10.126 2.208 -6.170 1.00 0.00 C ATOM 92 C VAL A 6 10.855 1.896 -7.476 1.00 0.00 C ATOM 93 O VAL A 6 10.701 0.841 -8.058 1.00 0.00 O ATOM 94 CB VAL A 6 8.975 3.222 -6.391 1.00 0.00 C ATOM 95 CG1 VAL A 6 8.786 3.547 -7.881 1.00 0.00 C ATOM 96 CG2 VAL A 6 7.670 2.635 -5.844 1.00 0.00 C ATOM 0 H VAL A 6 11.242 3.786 -5.267 1.00 0.00 H new ATOM 0 HA VAL A 6 9.688 1.289 -5.781 1.00 0.00 H new ATOM 0 HB VAL A 6 9.234 4.142 -5.867 1.00 0.00 H new ATOM 0 HG11 VAL A 6 7.971 4.261 -7.997 1.00 0.00 H new ATOM 0 HG12 VAL A 6 9.705 3.978 -8.279 1.00 0.00 H new ATOM 0 HG13 VAL A 6 8.548 2.633 -8.425 1.00 0.00 H new ATOM 0 HG21 VAL A 6 6.858 3.346 -5.998 1.00 0.00 H new ATOM 0 HG22 VAL A 6 7.442 1.706 -6.366 1.00 0.00 H new ATOM 0 HG23 VAL A 6 7.780 2.435 -4.778 1.00 0.00 H new ATOM 106 N ASP A 7 11.644 2.813 -7.942 1.00 0.00 N ATOM 107 CA ASP A 7 12.378 2.577 -9.210 1.00 0.00 C ATOM 108 C ASP A 7 13.748 1.958 -8.922 1.00 0.00 C ATOM 109 O ASP A 7 14.763 2.459 -9.365 1.00 0.00 O ATOM 110 CB ASP A 7 12.568 3.909 -9.931 1.00 0.00 C ATOM 111 CG ASP A 7 12.295 3.726 -11.426 1.00 0.00 C ATOM 112 OD1 ASP A 7 13.025 2.977 -12.054 1.00 0.00 O ATOM 113 OD2 ASP A 7 11.360 4.338 -11.915 1.00 0.00 O ATOM 0 H ASP A 7 11.814 3.717 -7.501 1.00 0.00 H new ATOM 0 HA ASP A 7 11.804 1.891 -9.833 1.00 0.00 H new ATOM 0 HB2 ASP A 7 11.893 4.658 -9.517 1.00 0.00 H new ATOM 0 HB3 ASP A 7 13.583 4.275 -9.778 1.00 0.00 H new ATOM 118 N THR A 8 13.801 0.875 -8.193 1.00 0.00 N ATOM 119 CA THR A 8 15.130 0.258 -7.911 1.00 0.00 C ATOM 120 C THR A 8 14.987 -1.113 -7.234 1.00 0.00 C ATOM 121 O THR A 8 14.913 -2.131 -7.891 1.00 0.00 O ATOM 122 CB THR A 8 15.942 1.190 -7.008 1.00 0.00 C ATOM 123 OG1 THR A 8 15.069 2.122 -6.385 1.00 0.00 O ATOM 124 CG2 THR A 8 16.982 1.938 -7.847 1.00 0.00 C ATOM 0 H THR A 8 12.997 0.397 -7.787 1.00 0.00 H new ATOM 0 HA THR A 8 15.642 0.112 -8.862 1.00 0.00 H new ATOM 0 HB THR A 8 16.451 0.604 -6.243 1.00 0.00 H new ATOM 0 HG1 THR A 8 15.511 2.994 -6.324 1.00 0.00 H new ATOM 0 HG21 THR A 8 17.560 2.601 -7.203 1.00 0.00 H new ATOM 0 HG22 THR A 8 17.651 1.220 -8.322 1.00 0.00 H new ATOM 0 HG23 THR A 8 16.477 2.526 -8.614 1.00 0.00 H new ATOM 132 N ASN A 9 15.001 -1.153 -5.925 1.00 0.00 N ATOM 133 CA ASN A 9 14.923 -2.467 -5.213 1.00 0.00 C ATOM 134 C ASN A 9 13.517 -2.752 -4.678 1.00 0.00 C ATOM 135 O ASN A 9 12.725 -3.401 -5.324 1.00 0.00 O ATOM 136 CB ASN A 9 15.909 -2.448 -4.042 1.00 0.00 C ATOM 137 CG ASN A 9 17.286 -2.919 -4.518 1.00 0.00 C ATOM 138 OD1 ASN A 9 17.888 -2.301 -5.371 1.00 0.00 O ATOM 139 ND2 ASN A 9 17.811 -3.993 -3.997 1.00 0.00 N ATOM 0 H ASN A 9 15.063 -0.335 -5.319 1.00 0.00 H new ATOM 0 HA ASN A 9 15.171 -3.253 -5.926 1.00 0.00 H new ATOM 0 HB2 ASN A 9 15.981 -1.441 -3.631 1.00 0.00 H new ATOM 0 HB3 ASN A 9 15.550 -3.094 -3.241 1.00 0.00 H new ATOM 0 HD21 ASN A 9 18.728 -4.314 -4.307 1.00 0.00 H new ATOM 0 HD22 ASN A 9 17.304 -4.512 -3.280 1.00 0.00 H new ATOM 146 N LEU A 10 13.241 -2.303 -3.478 1.00 0.00 N ATOM 147 CA LEU A 10 11.919 -2.552 -2.811 1.00 0.00 C ATOM 148 C LEU A 10 10.810 -2.893 -3.808 1.00 0.00 C ATOM 149 O LEU A 10 10.025 -3.793 -3.583 1.00 0.00 O ATOM 150 CB LEU A 10 11.511 -1.310 -2.024 1.00 0.00 C ATOM 151 CG LEU A 10 11.460 -1.657 -0.537 1.00 0.00 C ATOM 152 CD1 LEU A 10 11.808 -0.420 0.286 1.00 0.00 C ATOM 153 CD2 LEU A 10 10.053 -2.134 -0.173 1.00 0.00 C ATOM 0 H LEU A 10 13.895 -1.758 -2.915 1.00 0.00 H new ATOM 0 HA LEU A 10 12.046 -3.411 -2.152 1.00 0.00 H new ATOM 0 HB2 LEU A 10 12.223 -0.503 -2.198 1.00 0.00 H new ATOM 0 HB3 LEU A 10 10.537 -0.954 -2.361 1.00 0.00 H new ATOM 0 HG LEU A 10 12.178 -2.449 -0.323 1.00 0.00 H new ATOM 0 HD11 LEU A 10 11.772 -0.667 1.347 1.00 0.00 H new ATOM 0 HD12 LEU A 10 12.811 -0.081 0.026 1.00 0.00 H new ATOM 0 HD13 LEU A 10 11.090 0.372 0.073 1.00 0.00 H new ATOM 0 HD21 LEU A 10 10.016 -2.382 0.888 1.00 0.00 H new ATOM 0 HD22 LEU A 10 9.334 -1.343 -0.386 1.00 0.00 H new ATOM 0 HD23 LEU A 10 9.805 -3.018 -0.761 1.00 0.00 H new ATOM 165 N VAL A 11 10.715 -2.186 -4.894 1.00 0.00 N ATOM 166 CA VAL A 11 9.626 -2.493 -5.862 1.00 0.00 C ATOM 167 C VAL A 11 10.132 -3.443 -6.947 1.00 0.00 C ATOM 168 O VAL A 11 9.446 -4.372 -7.323 1.00 0.00 O ATOM 169 CB VAL A 11 9.117 -1.195 -6.479 1.00 0.00 C ATOM 170 CG1 VAL A 11 8.247 -1.512 -7.694 1.00 0.00 C ATOM 171 CG2 VAL A 11 8.283 -0.451 -5.437 1.00 0.00 C ATOM 0 H VAL A 11 11.334 -1.418 -5.154 1.00 0.00 H new ATOM 0 HA VAL A 11 8.805 -2.984 -5.339 1.00 0.00 H new ATOM 0 HB VAL A 11 9.959 -0.579 -6.793 1.00 0.00 H new ATOM 0 HG11 VAL A 11 7.884 -0.583 -8.134 1.00 0.00 H new ATOM 0 HG12 VAL A 11 8.837 -2.057 -8.432 1.00 0.00 H new ATOM 0 HG13 VAL A 11 7.399 -2.123 -7.385 1.00 0.00 H new ATOM 0 HG21 VAL A 11 7.912 0.480 -5.865 1.00 0.00 H new ATOM 0 HG22 VAL A 11 7.440 -1.072 -5.135 1.00 0.00 H new ATOM 0 HG23 VAL A 11 8.901 -0.230 -4.567 1.00 0.00 H new ATOM 181 N GLY A 12 11.322 -3.238 -7.448 1.00 0.00 N ATOM 182 CA GLY A 12 11.842 -4.166 -8.493 1.00 0.00 C ATOM 183 C GLY A 12 11.558 -5.595 -8.039 1.00 0.00 C ATOM 184 O GLY A 12 11.148 -6.441 -8.809 1.00 0.00 O ATOM 0 H GLY A 12 11.949 -2.478 -7.183 1.00 0.00 H new ATOM 0 HA2 GLY A 12 11.362 -3.968 -9.451 1.00 0.00 H new ATOM 0 HA3 GLY A 12 12.912 -4.017 -8.636 1.00 0.00 H new ATOM 188 N THR A 13 11.753 -5.849 -6.774 1.00 0.00 N ATOM 189 CA THR A 13 11.482 -7.199 -6.206 1.00 0.00 C ATOM 190 C THR A 13 12.279 -7.377 -4.921 1.00 0.00 C ATOM 191 O THR A 13 12.756 -8.449 -4.610 1.00 0.00 O ATOM 192 CB THR A 13 11.868 -8.291 -7.195 1.00 0.00 C ATOM 193 OG1 THR A 13 12.099 -9.510 -6.502 1.00 0.00 O ATOM 194 CG2 THR A 13 13.132 -7.884 -7.958 1.00 0.00 C ATOM 0 H THR A 13 12.095 -5.165 -6.099 1.00 0.00 H new ATOM 0 HA THR A 13 10.415 -7.280 -5.998 1.00 0.00 H new ATOM 0 HB THR A 13 11.052 -8.430 -7.905 1.00 0.00 H new ATOM 0 HG1 THR A 13 12.905 -9.425 -5.951 1.00 0.00 H new ATOM 0 HG21 THR A 13 13.401 -8.671 -8.663 1.00 0.00 H new ATOM 0 HG22 THR A 13 12.946 -6.958 -8.502 1.00 0.00 H new ATOM 0 HG23 THR A 13 13.950 -7.734 -7.253 1.00 0.00 H new ATOM 202 N GLY A 14 12.396 -6.345 -4.140 1.00 0.00 N ATOM 203 CA GLY A 14 13.121 -6.485 -2.854 1.00 0.00 C ATOM 204 C GLY A 14 12.126 -7.005 -1.820 1.00 0.00 C ATOM 205 O GLY A 14 12.320 -6.872 -0.628 1.00 0.00 O ATOM 0 H GLY A 14 12.023 -5.416 -4.335 1.00 0.00 H new ATOM 0 HA2 GLY A 14 13.959 -7.174 -2.960 1.00 0.00 H new ATOM 0 HA3 GLY A 14 13.534 -5.526 -2.540 1.00 0.00 H new ATOM 209 N ALA A 15 11.045 -7.590 -2.284 1.00 0.00 N ATOM 210 CA ALA A 15 10.007 -8.112 -1.357 1.00 0.00 C ATOM 211 C ALA A 15 8.703 -8.233 -2.139 1.00 0.00 C ATOM 212 O ALA A 15 7.842 -9.027 -1.825 1.00 0.00 O ATOM 213 CB ALA A 15 9.818 -7.139 -0.193 1.00 0.00 C ATOM 0 H ALA A 15 10.843 -7.726 -3.274 1.00 0.00 H new ATOM 0 HA ALA A 15 10.306 -9.081 -0.957 1.00 0.00 H new ATOM 0 HB1 ALA A 15 9.056 -7.525 0.484 1.00 0.00 H new ATOM 0 HB2 ALA A 15 10.759 -7.028 0.345 1.00 0.00 H new ATOM 0 HB3 ALA A 15 9.503 -6.169 -0.577 1.00 0.00 H new ATOM 219 N VAL A 16 8.564 -7.446 -3.171 1.00 0.00 N ATOM 220 CA VAL A 16 7.334 -7.501 -4.001 1.00 0.00 C ATOM 221 C VAL A 16 7.728 -7.334 -5.468 1.00 0.00 C ATOM 222 O VAL A 16 8.500 -6.463 -5.815 1.00 0.00 O ATOM 223 CB VAL A 16 6.391 -6.366 -3.597 1.00 0.00 C ATOM 224 CG1 VAL A 16 5.773 -6.674 -2.232 1.00 0.00 C ATOM 225 CG2 VAL A 16 7.180 -5.057 -3.519 1.00 0.00 C ATOM 0 H VAL A 16 9.258 -6.763 -3.475 1.00 0.00 H new ATOM 0 HA VAL A 16 6.829 -8.456 -3.854 1.00 0.00 H new ATOM 0 HB VAL A 16 5.597 -6.270 -4.338 1.00 0.00 H new ATOM 0 HG11 VAL A 16 5.102 -5.865 -1.946 1.00 0.00 H new ATOM 0 HG12 VAL A 16 5.213 -7.607 -2.288 1.00 0.00 H new ATOM 0 HG13 VAL A 16 6.564 -6.770 -1.488 1.00 0.00 H new ATOM 0 HG21 VAL A 16 6.511 -4.246 -3.231 1.00 0.00 H new ATOM 0 HG22 VAL A 16 7.973 -5.154 -2.777 1.00 0.00 H new ATOM 0 HG23 VAL A 16 7.618 -4.838 -4.493 1.00 0.00 H new ATOM 235 N THR A 17 7.199 -8.151 -6.336 1.00 0.00 N ATOM 236 CA THR A 17 7.546 -8.022 -7.780 1.00 0.00 C ATOM 237 C THR A 17 6.725 -6.889 -8.400 1.00 0.00 C ATOM 238 O THR A 17 6.703 -6.712 -9.602 1.00 0.00 O ATOM 239 CB THR A 17 7.231 -9.337 -8.497 1.00 0.00 C ATOM 240 OG1 THR A 17 5.935 -9.781 -8.123 1.00 0.00 O ATOM 241 CG2 THR A 17 8.267 -10.393 -8.106 1.00 0.00 C ATOM 0 H THR A 17 6.544 -8.900 -6.110 1.00 0.00 H new ATOM 0 HA THR A 17 8.608 -7.798 -7.884 1.00 0.00 H new ATOM 0 HB THR A 17 7.263 -9.180 -9.575 1.00 0.00 H new ATOM 0 HG1 THR A 17 5.732 -10.622 -8.583 1.00 0.00 H new ATOM 0 HG21 THR A 17 8.043 -11.329 -8.617 1.00 0.00 H new ATOM 0 HG22 THR A 17 9.261 -10.052 -8.394 1.00 0.00 H new ATOM 0 HG23 THR A 17 8.236 -10.551 -7.028 1.00 0.00 H new ATOM 249 N GLN A 18 6.054 -6.118 -7.585 1.00 0.00 N ATOM 250 CA GLN A 18 5.231 -4.991 -8.109 1.00 0.00 C ATOM 251 C GLN A 18 4.930 -4.023 -6.965 1.00 0.00 C ATOM 252 O GLN A 18 5.114 -4.345 -5.808 1.00 0.00 O ATOM 253 CB GLN A 18 3.907 -5.525 -8.663 1.00 0.00 C ATOM 254 CG GLN A 18 4.174 -6.461 -9.841 1.00 0.00 C ATOM 255 CD GLN A 18 2.845 -6.865 -10.484 1.00 0.00 C ATOM 256 OE1 GLN A 18 1.880 -7.137 -9.795 1.00 0.00 O ATOM 257 NE2 GLN A 18 2.755 -6.915 -11.784 1.00 0.00 N ATOM 0 H GLN A 18 6.042 -6.223 -6.570 1.00 0.00 H new ATOM 0 HA GLN A 18 5.779 -4.484 -8.903 1.00 0.00 H new ATOM 0 HB2 GLN A 18 3.364 -6.056 -7.881 1.00 0.00 H new ATOM 0 HB3 GLN A 18 3.276 -4.696 -8.982 1.00 0.00 H new ATOM 0 HG2 GLN A 18 4.810 -5.966 -10.575 1.00 0.00 H new ATOM 0 HG3 GLN A 18 4.710 -7.347 -9.501 1.00 0.00 H new ATOM 0 HE21 GLN A 18 3.565 -6.687 -12.360 1.00 0.00 H new ATOM 0 HE22 GLN A 18 1.875 -7.182 -12.224 1.00 0.00 H new ATOM 266 N ALA A 19 4.459 -2.845 -7.271 1.00 0.00 N ATOM 267 CA ALA A 19 4.143 -1.879 -6.182 1.00 0.00 C ATOM 268 C ALA A 19 3.620 -0.573 -6.775 1.00 0.00 C ATOM 269 O ALA A 19 3.739 -0.325 -7.958 1.00 0.00 O ATOM 270 CB ALA A 19 5.406 -1.588 -5.373 1.00 0.00 C ATOM 0 H ALA A 19 4.281 -2.512 -8.219 1.00 0.00 H new ATOM 0 HA ALA A 19 3.381 -2.314 -5.536 1.00 0.00 H new ATOM 0 HB1 ALA A 19 5.173 -0.881 -4.577 1.00 0.00 H new ATOM 0 HB2 ALA A 19 5.781 -2.514 -4.938 1.00 0.00 H new ATOM 0 HB3 ALA A 19 6.166 -1.161 -6.027 1.00 0.00 H new ATOM 276 N ALA A 20 3.049 0.267 -5.957 1.00 0.00 N ATOM 277 CA ALA A 20 2.525 1.562 -6.467 1.00 0.00 C ATOM 278 C ALA A 20 2.256 2.497 -5.290 1.00 0.00 C ATOM 279 O ALA A 20 1.545 2.157 -4.366 1.00 0.00 O ATOM 280 CB ALA A 20 1.216 1.326 -7.224 1.00 0.00 C ATOM 0 H ALA A 20 2.923 0.111 -4.957 1.00 0.00 H new ATOM 0 HA ALA A 20 3.260 2.009 -7.137 1.00 0.00 H new ATOM 0 HB1 ALA A 20 0.835 2.277 -7.596 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.397 0.654 -8.063 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.483 0.879 -6.553 1.00 0.00 H new ATOM 286 N ILE A 21 2.808 3.677 -5.319 1.00 0.00 N ATOM 287 CA ILE A 21 2.563 4.629 -4.206 1.00 0.00 C ATOM 288 C ILE A 21 1.345 5.480 -4.553 1.00 0.00 C ATOM 289 O ILE A 21 1.391 6.328 -5.425 1.00 0.00 O ATOM 290 CB ILE A 21 3.784 5.523 -4.001 1.00 0.00 C ATOM 291 CG1 ILE A 21 5.050 4.656 -4.025 1.00 0.00 C ATOM 292 CG2 ILE A 21 3.663 6.233 -2.648 1.00 0.00 C ATOM 293 CD1 ILE A 21 6.208 5.403 -3.359 1.00 0.00 C ATOM 0 H ILE A 21 3.415 4.021 -6.063 1.00 0.00 H new ATOM 0 HA ILE A 21 2.381 4.079 -3.283 1.00 0.00 H new ATOM 0 HB ILE A 21 3.842 6.268 -4.795 1.00 0.00 H new ATOM 0 HG12 ILE A 21 4.867 3.715 -3.506 1.00 0.00 H new ATOM 0 HG13 ILE A 21 5.311 4.407 -5.054 1.00 0.00 H new ATOM 0 HG21 ILE A 21 4.531 6.873 -2.494 1.00 0.00 H new ATOM 0 HG22 ILE A 21 2.758 6.840 -2.635 1.00 0.00 H new ATOM 0 HG23 ILE A 21 3.614 5.491 -1.851 1.00 0.00 H new ATOM 0 HD11 ILE A 21 7.103 4.781 -3.380 1.00 0.00 H new ATOM 0 HD12 ILE A 21 6.399 6.332 -3.897 1.00 0.00 H new ATOM 0 HD13 ILE A 21 5.948 5.629 -2.325 1.00 0.00 H new ATOM 305 N LEU A 22 0.255 5.245 -3.882 1.00 0.00 N ATOM 306 CA LEU A 22 -0.985 6.016 -4.165 1.00 0.00 C ATOM 307 C LEU A 22 -1.061 7.201 -3.198 1.00 0.00 C ATOM 308 O LEU A 22 -1.409 7.054 -2.044 1.00 0.00 O ATOM 309 CB LEU A 22 -2.221 5.109 -3.996 1.00 0.00 C ATOM 310 CG LEU A 22 -1.802 3.626 -3.943 1.00 0.00 C ATOM 311 CD1 LEU A 22 -3.043 2.738 -3.851 1.00 0.00 C ATOM 312 CD2 LEU A 22 -1.017 3.256 -5.208 1.00 0.00 C ATOM 0 H LEU A 22 0.169 4.546 -3.144 1.00 0.00 H new ATOM 0 HA LEU A 22 -0.966 6.383 -5.191 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -2.752 5.375 -3.082 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -2.912 5.268 -4.824 1.00 0.00 H new ATOM 0 HG LEU A 22 -1.174 3.473 -3.065 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.740 1.692 -3.814 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.602 2.986 -2.949 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.674 2.902 -4.725 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.725 2.207 -5.161 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -1.643 3.420 -6.085 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -0.124 3.878 -5.277 1.00 0.00 H new ATOM 324 N GLY A 23 -0.714 8.371 -3.663 1.00 0.00 N ATOM 325 CA GLY A 23 -0.739 9.577 -2.784 1.00 0.00 C ATOM 326 C GLY A 23 -2.007 9.587 -1.928 1.00 0.00 C ATOM 327 O GLY A 23 -2.922 8.816 -2.141 1.00 0.00 O ATOM 0 H GLY A 23 -0.412 8.545 -4.622 1.00 0.00 H new ATOM 0 HA2 GLY A 23 0.141 9.585 -2.141 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -0.697 10.480 -3.393 1.00 0.00 H new ATOM 331 N LEU A 24 -2.066 10.463 -0.961 1.00 0.00 N ATOM 332 CA LEU A 24 -3.267 10.537 -0.087 1.00 0.00 C ATOM 333 C LEU A 24 -3.894 11.929 -0.200 1.00 0.00 C ATOM 334 O LEU A 24 -5.037 12.137 0.159 1.00 0.00 O ATOM 335 CB LEU A 24 -2.870 10.269 1.370 1.00 0.00 C ATOM 336 CG LEU A 24 -1.539 10.955 1.708 1.00 0.00 C ATOM 337 CD1 LEU A 24 -1.767 12.451 1.941 1.00 0.00 C ATOM 338 CD2 LEU A 24 -0.963 10.334 2.983 1.00 0.00 C ATOM 0 H LEU A 24 -1.329 11.133 -0.740 1.00 0.00 H new ATOM 0 HA LEU A 24 -3.989 9.784 -0.404 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -3.651 10.633 2.037 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -2.783 9.195 1.536 1.00 0.00 H new ATOM 0 HG LEU A 24 -0.845 10.820 0.878 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -0.818 12.931 2.180 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -2.184 12.900 1.039 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -2.462 12.588 2.769 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.017 10.817 3.228 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -1.665 10.473 3.805 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -0.796 9.269 2.825 1.00 0.00 H new ATOM 350 N ASP A 25 -3.153 12.882 -0.695 1.00 0.00 N ATOM 351 CA ASP A 25 -3.700 14.263 -0.829 1.00 0.00 C ATOM 352 C ASP A 25 -3.558 14.729 -2.282 1.00 0.00 C ATOM 353 O ASP A 25 -4.015 15.794 -2.648 1.00 0.00 O ATOM 354 CB ASP A 25 -2.919 15.207 0.088 1.00 0.00 C ATOM 355 CG ASP A 25 -3.640 15.324 1.432 1.00 0.00 C ATOM 356 OD1 ASP A 25 -4.777 15.766 1.436 1.00 0.00 O ATOM 357 OD2 ASP A 25 -3.043 14.970 2.436 1.00 0.00 O ATOM 0 H ASP A 25 -2.191 12.764 -1.013 1.00 0.00 H new ATOM 0 HA ASP A 25 -4.753 14.268 -0.548 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -1.907 14.831 0.238 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -2.829 16.190 -0.375 1.00 0.00 H new ATOM 362 N GLY A 26 -2.930 13.939 -3.111 1.00 0.00 N ATOM 363 CA GLY A 26 -2.760 14.336 -4.538 1.00 0.00 C ATOM 364 C GLY A 26 -3.465 13.320 -5.439 1.00 0.00 C ATOM 365 O GLY A 26 -4.634 13.453 -5.743 1.00 0.00 O ATOM 0 H GLY A 26 -2.527 13.036 -2.861 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.174 15.331 -4.701 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -1.700 14.386 -4.789 1.00 0.00 H new ATOM 369 N ASN A 27 -2.764 12.305 -5.865 1.00 0.00 N ATOM 370 CA ASN A 27 -3.397 11.282 -6.745 1.00 0.00 C ATOM 371 C ASN A 27 -2.441 10.101 -6.935 1.00 0.00 C ATOM 372 O ASN A 27 -2.830 8.954 -6.839 1.00 0.00 O ATOM 373 CB ASN A 27 -3.715 11.906 -8.105 1.00 0.00 C ATOM 374 CG ASN A 27 -5.043 11.348 -8.620 1.00 0.00 C ATOM 375 OD1 ASN A 27 -5.198 10.152 -8.765 1.00 0.00 O ATOM 376 ND2 ASN A 27 -6.016 12.170 -8.902 1.00 0.00 N ATOM 0 H ASN A 27 -1.782 12.140 -5.642 1.00 0.00 H new ATOM 0 HA ASN A 27 -4.318 10.928 -6.282 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -3.774 12.991 -8.015 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -2.916 11.687 -8.814 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -6.906 11.808 -9.244 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -5.886 13.174 -8.780 1.00 0.00 H new ATOM 383 N THR A 28 -1.194 10.374 -7.204 1.00 0.00 N ATOM 384 CA THR A 28 -0.215 9.269 -7.399 1.00 0.00 C ATOM 385 C THR A 28 1.204 9.839 -7.355 1.00 0.00 C ATOM 386 O THR A 28 1.517 10.804 -8.024 1.00 0.00 O ATOM 387 CB THR A 28 -0.455 8.602 -8.756 1.00 0.00 C ATOM 388 OG1 THR A 28 -1.761 8.036 -8.778 1.00 0.00 O ATOM 389 CG2 THR A 28 0.593 7.507 -8.977 1.00 0.00 C ATOM 0 H THR A 28 -0.811 11.315 -7.297 1.00 0.00 H new ATOM 0 HA THR A 28 -0.338 8.530 -6.608 1.00 0.00 H new ATOM 0 HB THR A 28 -0.371 9.343 -9.551 1.00 0.00 H new ATOM 0 HG1 THR A 28 -2.112 7.988 -7.864 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.424 7.031 -9.943 1.00 0.00 H new ATOM 0 HG22 THR A 28 1.590 7.948 -8.960 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.513 6.761 -8.186 1.00 0.00 H new ATOM 397 N TRP A 29 2.066 9.252 -6.570 1.00 0.00 N ATOM 398 CA TRP A 29 3.462 9.764 -6.483 1.00 0.00 C ATOM 399 C TRP A 29 4.366 8.951 -7.413 1.00 0.00 C ATOM 400 O TRP A 29 5.170 9.494 -8.144 1.00 0.00 O ATOM 401 CB TRP A 29 3.962 9.634 -5.045 1.00 0.00 C ATOM 402 CG TRP A 29 3.386 10.739 -4.216 1.00 0.00 C ATOM 403 CD1 TRP A 29 2.180 11.315 -4.420 1.00 0.00 C ATOM 404 CD2 TRP A 29 3.970 11.410 -3.063 1.00 0.00 C ATOM 405 NE1 TRP A 29 1.985 12.295 -3.462 1.00 0.00 N ATOM 406 CE2 TRP A 29 3.062 12.391 -2.603 1.00 0.00 C ATOM 407 CE3 TRP A 29 5.188 11.262 -2.376 1.00 0.00 C ATOM 408 CZ2 TRP A 29 3.350 13.199 -1.501 1.00 0.00 C ATOM 409 CZ3 TRP A 29 5.483 12.072 -1.268 1.00 0.00 C ATOM 410 CH2 TRP A 29 4.567 13.039 -0.831 1.00 0.00 C ATOM 0 H TRP A 29 1.864 8.441 -5.986 1.00 0.00 H new ATOM 0 HA TRP A 29 3.483 10.812 -6.783 1.00 0.00 H new ATOM 0 HB2 TRP A 29 3.672 8.667 -4.634 1.00 0.00 H new ATOM 0 HB3 TRP A 29 5.051 9.677 -5.022 1.00 0.00 H new ATOM 0 HD1 TRP A 29 1.483 11.053 -5.202 1.00 0.00 H new ATOM 0 HE1 TRP A 29 1.148 12.875 -3.398 1.00 0.00 H new ATOM 0 HE3 TRP A 29 5.901 10.520 -2.703 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 2.639 13.941 -1.169 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 6.422 11.949 -0.749 1.00 0.00 H new ATOM 0 HH2 TRP A 29 4.801 13.659 0.022 1.00 0.00 H new ATOM 421 N ALA A 30 4.240 7.653 -7.391 1.00 0.00 N ATOM 422 CA ALA A 30 5.095 6.811 -8.276 1.00 0.00 C ATOM 423 C ALA A 30 4.456 5.432 -8.439 1.00 0.00 C ATOM 424 O ALA A 30 3.495 5.103 -7.775 1.00 0.00 O ATOM 425 CB ALA A 30 6.484 6.659 -7.652 1.00 0.00 C ATOM 0 H ALA A 30 3.585 7.140 -6.801 1.00 0.00 H new ATOM 0 HA ALA A 30 5.186 7.288 -9.252 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.108 6.043 -8.300 1.00 0.00 H new ATOM 0 HB2 ALA A 30 6.940 7.642 -7.536 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.394 6.183 -6.676 1.00 0.00 H new ATOM 431 N THR A 31 4.980 4.623 -9.318 1.00 0.00 N ATOM 432 CA THR A 31 4.399 3.266 -9.518 1.00 0.00 C ATOM 433 C THR A 31 5.424 2.366 -10.209 1.00 0.00 C ATOM 434 O THR A 31 6.488 2.806 -10.599 1.00 0.00 O ATOM 435 CB THR A 31 3.143 3.368 -10.384 1.00 0.00 C ATOM 436 OG1 THR A 31 2.853 2.097 -10.946 1.00 0.00 O ATOM 437 CG2 THR A 31 3.375 4.385 -11.501 1.00 0.00 C ATOM 0 H THR A 31 5.784 4.843 -9.906 1.00 0.00 H new ATOM 0 HA THR A 31 4.137 2.840 -8.550 1.00 0.00 H new ATOM 0 HB THR A 31 2.302 3.692 -9.771 1.00 0.00 H new ATOM 0 HG1 THR A 31 3.320 2.004 -11.802 1.00 0.00 H new ATOM 0 HG21 THR A 31 2.480 4.458 -12.118 1.00 0.00 H new ATOM 0 HG22 THR A 31 3.596 5.360 -11.066 1.00 0.00 H new ATOM 0 HG23 THR A 31 4.215 4.064 -12.117 1.00 0.00 H new ATOM 445 N SER A 32 5.113 1.109 -10.366 1.00 0.00 N ATOM 446 CA SER A 32 6.068 0.182 -11.035 1.00 0.00 C ATOM 447 C SER A 32 5.324 -1.068 -11.506 1.00 0.00 C ATOM 448 O SER A 32 4.520 -1.632 -10.785 1.00 0.00 O ATOM 449 CB SER A 32 7.165 -0.216 -10.049 1.00 0.00 C ATOM 450 OG SER A 32 8.328 0.562 -10.299 1.00 0.00 O ATOM 0 H SER A 32 4.238 0.684 -10.060 1.00 0.00 H new ATOM 0 HA SER A 32 6.516 0.680 -11.895 1.00 0.00 H new ATOM 0 HB2 SER A 32 6.823 -0.061 -9.026 1.00 0.00 H new ATOM 0 HB3 SER A 32 7.394 -1.277 -10.151 1.00 0.00 H new ATOM 0 HG SER A 32 8.069 1.492 -10.466 1.00 0.00 H new ATOM 456 N ALA A 33 5.590 -1.495 -12.717 1.00 0.00 N ATOM 457 CA ALA A 33 4.912 -2.703 -13.278 1.00 0.00 C ATOM 458 C ALA A 33 3.593 -2.289 -13.932 1.00 0.00 C ATOM 459 O ALA A 33 3.020 -3.022 -14.713 1.00 0.00 O ATOM 460 CB ALA A 33 4.643 -3.729 -12.173 1.00 0.00 C ATOM 0 H ALA A 33 6.257 -1.051 -13.348 1.00 0.00 H new ATOM 0 HA ALA A 33 5.563 -3.159 -14.024 1.00 0.00 H new ATOM 0 HB1 ALA A 33 4.149 -4.602 -12.600 1.00 0.00 H new ATOM 0 HB2 ALA A 33 5.587 -4.032 -11.720 1.00 0.00 H new ATOM 0 HB3 ALA A 33 4.001 -3.285 -11.412 1.00 0.00 H new ATOM 466 N GLY A 34 3.108 -1.115 -13.630 1.00 0.00 N ATOM 467 CA GLY A 34 1.829 -0.661 -14.249 1.00 0.00 C ATOM 468 C GLY A 34 0.849 -0.212 -13.162 1.00 0.00 C ATOM 469 O GLY A 34 0.816 0.942 -12.781 1.00 0.00 O ATOM 0 H GLY A 34 3.539 -0.453 -12.985 1.00 0.00 H new ATOM 0 HA2 GLY A 34 2.021 0.161 -14.938 1.00 0.00 H new ATOM 0 HA3 GLY A 34 1.391 -1.471 -14.833 1.00 0.00 H new ATOM 473 N PHE A 35 0.043 -1.114 -12.668 1.00 0.00 N ATOM 474 CA PHE A 35 -0.944 -0.740 -11.615 1.00 0.00 C ATOM 475 C PHE A 35 -1.903 0.308 -12.178 1.00 0.00 C ATOM 476 O PHE A 35 -1.489 1.331 -12.686 1.00 0.00 O ATOM 477 CB PHE A 35 -0.217 -0.164 -10.399 1.00 0.00 C ATOM 478 CG PHE A 35 -0.757 -0.809 -9.145 1.00 0.00 C ATOM 479 CD1 PHE A 35 -1.951 -0.346 -8.578 1.00 0.00 C ATOM 480 CD2 PHE A 35 -0.067 -1.872 -8.553 1.00 0.00 C ATOM 481 CE1 PHE A 35 -2.453 -0.946 -7.417 1.00 0.00 C ATOM 482 CE2 PHE A 35 -0.568 -2.472 -7.393 1.00 0.00 C ATOM 483 CZ PHE A 35 -1.761 -2.010 -6.824 1.00 0.00 C ATOM 0 H PHE A 35 0.026 -2.094 -12.949 1.00 0.00 H new ATOM 0 HA PHE A 35 -1.501 -1.626 -11.310 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.855 -0.344 -10.482 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -0.356 0.916 -10.355 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -2.484 0.474 -9.036 1.00 0.00 H new ATOM 0 HD2 PHE A 35 0.853 -2.230 -8.992 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -3.373 -0.589 -6.979 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -0.034 -3.292 -6.936 1.00 0.00 H new ATOM 0 HZ PHE A 35 -2.148 -2.474 -5.928 1.00 0.00 H new ATOM 493 N ALA A 36 -3.181 0.063 -12.097 1.00 0.00 N ATOM 494 CA ALA A 36 -4.159 1.048 -12.636 1.00 0.00 C ATOM 495 C ALA A 36 -5.320 1.218 -11.654 1.00 0.00 C ATOM 496 O ALA A 36 -6.272 0.464 -11.667 1.00 0.00 O ATOM 497 CB ALA A 36 -4.696 0.549 -13.977 1.00 0.00 C ATOM 0 H ALA A 36 -3.590 -0.774 -11.682 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.662 2.008 -12.774 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.412 1.269 -14.373 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.871 0.434 -14.680 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.189 -0.413 -13.836 1.00 0.00 H new ATOM 503 N VAL A 37 -5.253 2.210 -10.808 1.00 0.00 N ATOM 504 CA VAL A 37 -6.356 2.436 -9.831 1.00 0.00 C ATOM 505 C VAL A 37 -7.183 3.641 -10.285 1.00 0.00 C ATOM 506 O VAL A 37 -6.872 4.774 -9.976 1.00 0.00 O ATOM 507 CB VAL A 37 -5.765 2.700 -8.447 1.00 0.00 C ATOM 508 CG1 VAL A 37 -6.850 2.510 -7.384 1.00 0.00 C ATOM 509 CG2 VAL A 37 -4.622 1.714 -8.192 1.00 0.00 C ATOM 0 H VAL A 37 -4.481 2.874 -10.751 1.00 0.00 H new ATOM 0 HA VAL A 37 -6.995 1.555 -9.781 1.00 0.00 H new ATOM 0 HB VAL A 37 -5.386 3.721 -8.398 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -6.429 2.698 -6.396 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -7.667 3.208 -7.569 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -7.228 1.489 -7.428 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -4.196 1.898 -7.206 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -5.004 0.694 -8.238 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.851 1.847 -8.951 1.00 0.00 H new ATOM 519 N THR A 38 -8.221 3.400 -11.038 1.00 0.00 N ATOM 520 CA THR A 38 -9.062 4.523 -11.546 1.00 0.00 C ATOM 521 C THR A 38 -10.266 4.828 -10.628 1.00 0.00 C ATOM 522 O THR A 38 -10.615 5.981 -10.467 1.00 0.00 O ATOM 523 CB THR A 38 -9.579 4.163 -12.940 1.00 0.00 C ATOM 524 OG1 THR A 38 -9.098 2.877 -13.305 1.00 0.00 O ATOM 525 CG2 THR A 38 -9.087 5.200 -13.953 1.00 0.00 C ATOM 0 H THR A 38 -8.525 2.470 -11.325 1.00 0.00 H new ATOM 0 HA THR A 38 -8.437 5.415 -11.573 1.00 0.00 H new ATOM 0 HB THR A 38 -10.669 4.155 -12.932 1.00 0.00 H new ATOM 0 HG1 THR A 38 -9.430 2.645 -14.197 1.00 0.00 H new ATOM 0 HG21 THR A 38 -9.456 4.942 -14.946 1.00 0.00 H new ATOM 0 HG22 THR A 38 -9.457 6.186 -13.673 1.00 0.00 H new ATOM 0 HG23 THR A 38 -7.997 5.211 -13.963 1.00 0.00 H new ATOM 533 N PRO A 39 -10.898 3.812 -10.076 1.00 0.00 N ATOM 534 CA PRO A 39 -12.082 4.017 -9.217 1.00 0.00 C ATOM 535 C PRO A 39 -11.788 4.982 -8.063 1.00 0.00 C ATOM 536 O PRO A 39 -12.237 6.111 -8.065 1.00 0.00 O ATOM 537 CB PRO A 39 -12.437 2.621 -8.692 1.00 0.00 C ATOM 538 CG PRO A 39 -11.542 1.603 -9.440 1.00 0.00 C ATOM 539 CD PRO A 39 -10.501 2.398 -10.241 1.00 0.00 C ATOM 0 HA PRO A 39 -12.904 4.470 -9.771 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -12.270 2.561 -7.617 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.491 2.403 -8.863 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -11.051 0.933 -8.734 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -12.142 0.981 -10.104 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -9.494 2.223 -9.863 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -10.503 2.106 -11.291 1.00 0.00 H new ATOM 547 N ALA A 40 -11.060 4.554 -7.069 1.00 0.00 N ATOM 548 CA ALA A 40 -10.780 5.465 -5.922 1.00 0.00 C ATOM 549 C ALA A 40 -9.462 5.060 -5.233 1.00 0.00 C ATOM 550 O ALA A 40 -9.481 4.392 -4.217 1.00 0.00 O ATOM 551 CB ALA A 40 -11.921 5.351 -4.910 1.00 0.00 C ATOM 0 H ALA A 40 -10.650 3.623 -7.000 1.00 0.00 H new ATOM 0 HA ALA A 40 -10.695 6.488 -6.288 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -11.727 6.013 -4.066 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -12.859 5.636 -5.386 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -11.991 4.323 -4.555 1.00 0.00 H new ATOM 557 N GLN A 41 -8.315 5.451 -5.749 1.00 0.00 N ATOM 558 CA GLN A 41 -7.043 5.063 -5.068 1.00 0.00 C ATOM 559 C GLN A 41 -6.870 5.932 -3.824 1.00 0.00 C ATOM 560 O GLN A 41 -6.865 5.448 -2.708 1.00 0.00 O ATOM 561 CB GLN A 41 -5.816 5.263 -5.984 1.00 0.00 C ATOM 562 CG GLN A 41 -6.226 5.740 -7.382 1.00 0.00 C ATOM 563 CD GLN A 41 -6.513 7.243 -7.346 1.00 0.00 C ATOM 564 OE1 GLN A 41 -5.723 8.013 -6.836 1.00 0.00 O ATOM 565 NE2 GLN A 41 -7.619 7.697 -7.871 1.00 0.00 N ATOM 0 H GLN A 41 -8.210 6.011 -6.595 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.105 4.006 -4.809 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -5.141 5.991 -5.534 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -5.266 4.326 -6.066 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -5.432 5.528 -8.098 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -7.110 5.198 -7.718 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -8.283 7.052 -8.299 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -7.819 8.697 -7.853 1.00 0.00 H new ATOM 574 N GLY A 42 -6.736 7.214 -4.010 1.00 0.00 N ATOM 575 CA GLY A 42 -6.568 8.126 -2.844 1.00 0.00 C ATOM 576 C GLY A 42 -7.941 8.633 -2.395 1.00 0.00 C ATOM 577 O GLY A 42 -8.072 9.278 -1.373 1.00 0.00 O ATOM 0 H GLY A 42 -6.735 7.672 -4.921 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -6.076 7.601 -2.025 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -5.928 8.966 -3.114 1.00 0.00 H new ATOM 581 N GLN A 43 -8.965 8.344 -3.151 1.00 0.00 N ATOM 582 CA GLN A 43 -10.330 8.807 -2.771 1.00 0.00 C ATOM 583 C GLN A 43 -10.910 7.868 -1.709 1.00 0.00 C ATOM 584 O GLN A 43 -11.503 8.300 -0.741 1.00 0.00 O ATOM 585 CB GLN A 43 -11.232 8.794 -4.007 1.00 0.00 C ATOM 586 CG GLN A 43 -12.358 9.815 -3.830 1.00 0.00 C ATOM 587 CD GLN A 43 -13.447 9.227 -2.932 1.00 0.00 C ATOM 588 OE1 GLN A 43 -13.669 9.701 -1.835 1.00 0.00 O ATOM 589 NE2 GLN A 43 -14.142 8.204 -3.353 1.00 0.00 N ATOM 0 H GLN A 43 -8.915 7.807 -4.016 1.00 0.00 H new ATOM 0 HA GLN A 43 -10.273 9.819 -2.370 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -10.650 9.030 -4.897 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -11.650 7.798 -4.154 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -11.965 10.732 -3.390 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -12.777 10.081 -4.800 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -13.957 7.805 -4.273 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -14.870 7.804 -2.761 1.00 0.00 H new ATOM 598 N THR A 44 -10.744 6.586 -1.886 1.00 0.00 N ATOM 599 CA THR A 44 -11.285 5.618 -0.891 1.00 0.00 C ATOM 600 C THR A 44 -10.388 5.602 0.348 1.00 0.00 C ATOM 601 O THR A 44 -10.848 5.739 1.463 1.00 0.00 O ATOM 602 CB THR A 44 -11.325 4.218 -1.509 1.00 0.00 C ATOM 603 OG1 THR A 44 -12.353 4.165 -2.487 1.00 0.00 O ATOM 604 CG2 THR A 44 -11.601 3.181 -0.419 1.00 0.00 C ATOM 0 H THR A 44 -10.256 6.167 -2.678 1.00 0.00 H new ATOM 0 HA THR A 44 -12.293 5.919 -0.605 1.00 0.00 H new ATOM 0 HB THR A 44 -10.365 4.000 -1.976 1.00 0.00 H new ATOM 0 HG1 THR A 44 -12.487 3.237 -2.771 1.00 0.00 H new ATOM 0 HG21 THR A 44 -11.629 2.186 -0.862 1.00 0.00 H new ATOM 0 HG22 THR A 44 -10.811 3.222 0.331 1.00 0.00 H new ATOM 0 HG23 THR A 44 -12.560 3.395 0.052 1.00 0.00 H new ATOM 612 N LEU A 45 -9.107 5.436 0.161 1.00 0.00 N ATOM 613 CA LEU A 45 -8.182 5.412 1.329 1.00 0.00 C ATOM 614 C LEU A 45 -8.307 6.724 2.107 1.00 0.00 C ATOM 615 O LEU A 45 -8.076 6.776 3.298 1.00 0.00 O ATOM 616 CB LEU A 45 -6.743 5.247 0.832 1.00 0.00 C ATOM 617 CG LEU A 45 -6.481 3.776 0.504 1.00 0.00 C ATOM 618 CD1 LEU A 45 -5.213 3.657 -0.343 1.00 0.00 C ATOM 619 CD2 LEU A 45 -6.302 2.987 1.803 1.00 0.00 C ATOM 0 H LEU A 45 -8.662 5.316 -0.749 1.00 0.00 H new ATOM 0 HA LEU A 45 -8.440 4.579 1.982 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -6.580 5.862 -0.053 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.043 5.591 1.593 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.327 3.374 -0.053 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -5.028 2.608 -0.576 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.340 4.217 -1.269 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -4.366 4.061 0.212 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -6.115 1.939 1.569 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -5.457 3.391 2.360 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -7.206 3.069 2.406 1.00 0.00 H new ATOM 631 N ALA A 46 -8.672 7.785 1.440 1.00 0.00 N ATOM 632 CA ALA A 46 -8.812 9.095 2.136 1.00 0.00 C ATOM 633 C ALA A 46 -9.987 9.039 3.115 1.00 0.00 C ATOM 634 O ALA A 46 -9.899 9.516 4.230 1.00 0.00 O ATOM 635 CB ALA A 46 -9.065 10.193 1.101 1.00 0.00 C ATOM 0 H ALA A 46 -8.880 7.801 0.441 1.00 0.00 H new ATOM 0 HA ALA A 46 -7.896 9.311 2.686 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -9.168 11.153 1.607 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -8.227 10.237 0.405 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -9.981 9.972 0.552 1.00 0.00 H new ATOM 641 N SER A 47 -11.086 8.463 2.711 1.00 0.00 N ATOM 642 CA SER A 47 -12.263 8.382 3.623 1.00 0.00 C ATOM 643 C SER A 47 -12.210 7.074 4.415 1.00 0.00 C ATOM 644 O SER A 47 -13.043 6.818 5.263 1.00 0.00 O ATOM 645 CB SER A 47 -13.551 8.422 2.799 1.00 0.00 C ATOM 646 OG SER A 47 -14.643 8.740 3.651 1.00 0.00 O ATOM 0 H SER A 47 -11.220 8.045 1.790 1.00 0.00 H new ATOM 0 HA SER A 47 -12.243 9.226 4.312 1.00 0.00 H new ATOM 0 HB2 SER A 47 -13.466 9.164 2.005 1.00 0.00 H new ATOM 0 HB3 SER A 47 -13.719 7.458 2.318 1.00 0.00 H new ATOM 0 HG SER A 47 -14.490 8.351 4.537 1.00 0.00 H new ATOM 652 N ALA A 48 -11.240 6.243 4.146 1.00 0.00 N ATOM 653 CA ALA A 48 -11.140 4.953 4.885 1.00 0.00 C ATOM 654 C ALA A 48 -10.307 5.150 6.152 1.00 0.00 C ATOM 655 O ALA A 48 -10.297 4.315 7.035 1.00 0.00 O ATOM 656 CB ALA A 48 -10.470 3.907 3.992 1.00 0.00 C ATOM 0 H ALA A 48 -10.514 6.401 3.448 1.00 0.00 H new ATOM 0 HA ALA A 48 -12.139 4.614 5.159 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -10.396 2.962 4.531 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.065 3.764 3.090 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.472 4.248 3.718 1.00 0.00 H new ATOM 662 N PHE A 49 -9.603 6.245 6.249 1.00 0.00 N ATOM 663 CA PHE A 49 -8.770 6.485 7.460 1.00 0.00 C ATOM 664 C PHE A 49 -9.611 7.165 8.544 1.00 0.00 C ATOM 665 O PHE A 49 -9.120 7.502 9.602 1.00 0.00 O ATOM 666 CB PHE A 49 -7.584 7.383 7.093 1.00 0.00 C ATOM 667 CG PHE A 49 -6.713 6.695 6.063 1.00 0.00 C ATOM 668 CD1 PHE A 49 -6.871 5.326 5.800 1.00 0.00 C ATOM 669 CD2 PHE A 49 -5.746 7.431 5.369 1.00 0.00 C ATOM 670 CE1 PHE A 49 -6.061 4.697 4.846 1.00 0.00 C ATOM 671 CE2 PHE A 49 -4.936 6.801 4.415 1.00 0.00 C ATOM 672 CZ PHE A 49 -5.093 5.435 4.154 1.00 0.00 C ATOM 0 H PHE A 49 -9.569 6.981 5.544 1.00 0.00 H new ATOM 0 HA PHE A 49 -8.403 5.531 7.838 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -7.945 8.333 6.700 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -6.998 7.609 7.984 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -7.618 4.757 6.334 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -5.624 8.485 5.569 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -6.183 3.643 4.644 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -4.190 7.370 3.881 1.00 0.00 H new ATOM 0 HZ PHE A 49 -4.468 4.950 3.419 1.00 0.00 H new ATOM 682 N ASN A 50 -10.877 7.365 8.295 1.00 0.00 N ATOM 683 CA ASN A 50 -11.740 8.018 9.319 1.00 0.00 C ATOM 684 C ASN A 50 -12.258 6.958 10.292 1.00 0.00 C ATOM 685 O ASN A 50 -12.308 7.170 11.488 1.00 0.00 O ATOM 686 CB ASN A 50 -12.922 8.705 8.632 1.00 0.00 C ATOM 687 CG ASN A 50 -13.035 10.147 9.131 1.00 0.00 C ATOM 688 OD1 ASN A 50 -13.144 11.067 8.346 1.00 0.00 O ATOM 689 ND2 ASN A 50 -13.014 10.385 10.414 1.00 0.00 N ATOM 0 H ASN A 50 -11.349 7.105 7.429 1.00 0.00 H new ATOM 0 HA ASN A 50 -11.160 8.762 9.864 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -12.785 8.693 7.551 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -13.844 8.163 8.843 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -13.089 11.343 10.756 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -12.923 9.613 11.074 1.00 0.00 H new ATOM 696 N ASN A 51 -12.644 5.818 9.789 1.00 0.00 N ATOM 697 CA ASN A 51 -13.158 4.741 10.682 1.00 0.00 C ATOM 698 C ASN A 51 -12.872 3.377 10.047 1.00 0.00 C ATOM 699 O ASN A 51 -12.889 3.228 8.842 1.00 0.00 O ATOM 700 CB ASN A 51 -14.671 4.906 10.884 1.00 0.00 C ATOM 701 CG ASN A 51 -15.274 5.694 9.718 1.00 0.00 C ATOM 702 OD1 ASN A 51 -15.988 6.656 9.924 1.00 0.00 O ATOM 703 ND2 ASN A 51 -15.016 5.326 8.493 1.00 0.00 N ATOM 0 H ASN A 51 -12.626 5.585 8.796 1.00 0.00 H new ATOM 0 HA ASN A 51 -12.660 4.807 11.649 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -15.145 3.927 10.956 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -14.866 5.424 11.823 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -15.413 5.845 7.710 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -14.417 4.519 8.318 1.00 0.00 H new ATOM 710 N ALA A 52 -12.604 2.383 10.849 1.00 0.00 N ATOM 711 CA ALA A 52 -12.311 1.032 10.290 1.00 0.00 C ATOM 712 C ALA A 52 -13.608 0.236 10.146 1.00 0.00 C ATOM 713 O ALA A 52 -13.612 -0.974 10.223 1.00 0.00 O ATOM 714 CB ALA A 52 -11.363 0.285 11.231 1.00 0.00 C ATOM 0 H ALA A 52 -12.575 2.448 11.867 1.00 0.00 H new ATOM 0 HA ALA A 52 -11.846 1.144 9.311 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -11.149 -0.703 10.823 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -10.434 0.846 11.332 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -11.831 0.179 12.210 1.00 0.00 H new ATOM 720 N ASP A 53 -14.711 0.900 9.939 1.00 0.00 N ATOM 721 CA ASP A 53 -15.999 0.164 9.794 1.00 0.00 C ATOM 722 C ASP A 53 -16.200 -0.293 8.339 1.00 0.00 C ATOM 723 O ASP A 53 -16.597 -1.418 8.108 1.00 0.00 O ATOM 724 CB ASP A 53 -17.168 1.057 10.223 1.00 0.00 C ATOM 725 CG ASP A 53 -16.859 1.691 11.581 1.00 0.00 C ATOM 726 OD1 ASP A 53 -15.727 2.100 11.780 1.00 0.00 O ATOM 727 OD2 ASP A 53 -17.761 1.757 12.401 1.00 0.00 O ATOM 0 H ASP A 53 -14.777 1.915 9.864 1.00 0.00 H new ATOM 0 HA ASP A 53 -15.966 -0.716 10.436 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -17.338 1.834 9.478 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -18.084 0.469 10.285 1.00 0.00 H new ATOM 732 N PRO A 54 -15.936 0.582 7.392 1.00 0.00 N ATOM 733 CA PRO A 54 -16.108 0.252 5.964 1.00 0.00 C ATOM 734 C PRO A 54 -15.071 -0.789 5.524 1.00 0.00 C ATOM 735 O PRO A 54 -15.386 -1.943 5.314 1.00 0.00 O ATOM 736 CB PRO A 54 -15.879 1.577 5.223 1.00 0.00 C ATOM 737 CG PRO A 54 -15.464 2.638 6.274 1.00 0.00 C ATOM 738 CD PRO A 54 -15.458 1.955 7.650 1.00 0.00 C ATOM 0 HA PRO A 54 -17.090 -0.173 5.757 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -15.102 1.463 4.467 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -16.786 1.887 4.704 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -14.478 3.040 6.042 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -16.160 3.477 6.266 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -14.459 1.951 8.085 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -16.109 2.475 8.353 1.00 0.00 H new ATOM 746 N ILE A 55 -13.840 -0.382 5.373 1.00 0.00 N ATOM 747 CA ILE A 55 -12.779 -1.336 4.935 1.00 0.00 C ATOM 748 C ILE A 55 -12.948 -2.674 5.658 1.00 0.00 C ATOM 749 O ILE A 55 -12.884 -3.727 5.055 1.00 0.00 O ATOM 750 CB ILE A 55 -11.392 -0.762 5.253 1.00 0.00 C ATOM 751 CG1 ILE A 55 -11.485 0.221 6.425 1.00 0.00 C ATOM 752 CG2 ILE A 55 -10.850 -0.037 4.022 1.00 0.00 C ATOM 753 CD1 ILE A 55 -10.084 0.499 6.974 1.00 0.00 C ATOM 0 H ILE A 55 -13.521 0.573 5.535 1.00 0.00 H new ATOM 0 HA ILE A 55 -12.870 -1.489 3.860 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.722 -1.577 5.526 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -11.949 1.151 6.097 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -12.119 -0.192 7.210 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.865 0.372 4.245 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -10.772 -0.739 3.191 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -11.526 0.774 3.750 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -10.152 1.198 7.807 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.636 -0.433 7.318 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -9.464 0.930 6.188 1.00 0.00 H new ATOM 765 N ARG A 56 -13.159 -2.644 6.943 1.00 0.00 N ATOM 766 CA ARG A 56 -13.327 -3.919 7.698 1.00 0.00 C ATOM 767 C ARG A 56 -14.274 -4.847 6.936 1.00 0.00 C ATOM 768 O ARG A 56 -13.942 -5.977 6.637 1.00 0.00 O ATOM 769 CB ARG A 56 -13.908 -3.625 9.081 1.00 0.00 C ATOM 770 CG ARG A 56 -13.998 -4.926 9.880 1.00 0.00 C ATOM 771 CD ARG A 56 -15.029 -4.773 11.000 1.00 0.00 C ATOM 772 NE ARG A 56 -14.471 -5.324 12.267 1.00 0.00 N ATOM 773 CZ ARG A 56 -15.030 -5.036 13.410 1.00 0.00 C ATOM 774 NH1 ARG A 56 -16.081 -4.262 13.452 1.00 0.00 N ATOM 775 NH2 ARG A 56 -14.536 -5.524 14.515 1.00 0.00 N ATOM 0 H ARG A 56 -13.223 -1.794 7.504 1.00 0.00 H new ATOM 0 HA ARG A 56 -12.356 -4.401 7.807 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -13.280 -2.905 9.606 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -14.896 -3.175 8.985 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -14.280 -5.749 9.223 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -13.024 -5.174 10.301 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -15.287 -3.722 11.130 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -15.948 -5.296 10.737 1.00 0.00 H new ATOM 0 HE ARG A 56 -13.650 -5.928 12.241 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -16.468 -3.880 12.589 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -16.515 -4.039 14.348 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -13.715 -6.129 14.483 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -14.971 -5.301 15.410 1.00 0.00 H new ATOM 789 N ALA A 57 -15.454 -4.385 6.624 1.00 0.00 N ATOM 790 CA ALA A 57 -16.418 -5.250 5.888 1.00 0.00 C ATOM 791 C ALA A 57 -16.170 -5.139 4.381 1.00 0.00 C ATOM 792 O ALA A 57 -15.377 -5.866 3.817 1.00 0.00 O ATOM 793 CB ALA A 57 -17.847 -4.804 6.202 1.00 0.00 C ATOM 0 H ALA A 57 -15.791 -3.448 6.846 1.00 0.00 H new ATOM 0 HA ALA A 57 -16.281 -6.285 6.200 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.552 -5.437 5.663 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -18.028 -4.889 7.274 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -17.981 -3.767 5.893 1.00 0.00 H new ATOM 799 N SER A 58 -16.847 -4.237 3.723 1.00 0.00 N ATOM 800 CA SER A 58 -16.653 -4.085 2.252 1.00 0.00 C ATOM 801 C SER A 58 -15.161 -4.146 1.918 1.00 0.00 C ATOM 802 O SER A 58 -14.665 -5.142 1.429 1.00 0.00 O ATOM 803 CB SER A 58 -17.219 -2.738 1.803 1.00 0.00 C ATOM 804 OG SER A 58 -16.596 -2.351 0.585 1.00 0.00 O ATOM 0 H SER A 58 -17.525 -3.599 4.140 1.00 0.00 H new ATOM 0 HA SER A 58 -17.171 -4.892 1.734 1.00 0.00 H new ATOM 0 HB2 SER A 58 -18.298 -2.811 1.666 1.00 0.00 H new ATOM 0 HB3 SER A 58 -17.045 -1.983 2.570 1.00 0.00 H new ATOM 0 HG SER A 58 -16.957 -1.488 0.292 1.00 0.00 H new ATOM 810 N GLY A 59 -14.443 -3.087 2.172 1.00 0.00 N ATOM 811 CA GLY A 59 -12.985 -3.081 1.861 1.00 0.00 C ATOM 812 C GLY A 59 -12.684 -1.937 0.893 1.00 0.00 C ATOM 813 O GLY A 59 -13.139 -0.825 1.075 1.00 0.00 O ATOM 0 H GLY A 59 -14.803 -2.225 2.582 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.406 -2.961 2.777 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.691 -4.034 1.420 1.00 0.00 H new ATOM 817 N PHE A 60 -11.929 -2.195 -0.139 1.00 0.00 N ATOM 818 CA PHE A 60 -11.619 -1.110 -1.113 1.00 0.00 C ATOM 819 C PHE A 60 -11.555 -1.694 -2.527 1.00 0.00 C ATOM 820 O PHE A 60 -11.280 -2.862 -2.717 1.00 0.00 O ATOM 821 CB PHE A 60 -10.280 -0.452 -0.759 1.00 0.00 C ATOM 822 CG PHE A 60 -9.273 -1.504 -0.352 1.00 0.00 C ATOM 823 CD1 PHE A 60 -9.455 -2.236 0.829 1.00 0.00 C ATOM 824 CD2 PHE A 60 -8.152 -1.742 -1.155 1.00 0.00 C ATOM 825 CE1 PHE A 60 -8.516 -3.205 1.204 1.00 0.00 C ATOM 826 CE2 PHE A 60 -7.214 -2.712 -0.781 1.00 0.00 C ATOM 827 CZ PHE A 60 -7.397 -3.442 0.399 1.00 0.00 C ATOM 0 H PHE A 60 -11.516 -3.103 -0.350 1.00 0.00 H new ATOM 0 HA PHE A 60 -12.404 -0.355 -1.069 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -9.905 0.109 -1.615 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -10.420 0.261 0.053 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -10.319 -2.053 1.450 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -8.010 -1.177 -2.064 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -8.656 -3.769 2.114 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -6.350 -2.897 -1.402 1.00 0.00 H new ATOM 0 HZ PHE A 60 -6.673 -4.189 0.688 1.00 0.00 H new ATOM 837 N ASP A 61 -11.821 -0.888 -3.520 1.00 0.00 N ATOM 838 CA ASP A 61 -11.790 -1.393 -4.921 1.00 0.00 C ATOM 839 C ASP A 61 -10.427 -1.110 -5.551 1.00 0.00 C ATOM 840 O ASP A 61 -9.943 0.005 -5.537 1.00 0.00 O ATOM 841 CB ASP A 61 -12.878 -0.694 -5.738 1.00 0.00 C ATOM 842 CG ASP A 61 -14.255 -1.122 -5.228 1.00 0.00 C ATOM 843 OD1 ASP A 61 -14.575 -0.792 -4.098 1.00 0.00 O ATOM 844 OD2 ASP A 61 -14.968 -1.771 -5.976 1.00 0.00 O ATOM 0 H ASP A 61 -12.058 0.099 -3.420 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.965 -2.469 -4.915 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.769 0.388 -5.658 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -12.774 -0.948 -6.793 1.00 0.00 H new ATOM 849 N LEU A 62 -9.813 -2.111 -6.118 1.00 0.00 N ATOM 850 CA LEU A 62 -8.491 -1.906 -6.769 1.00 0.00 C ATOM 851 C LEU A 62 -8.680 -1.975 -8.283 1.00 0.00 C ATOM 852 O LEU A 62 -8.075 -2.781 -8.961 1.00 0.00 O ATOM 853 CB LEU A 62 -7.520 -3.002 -6.320 1.00 0.00 C ATOM 854 CG LEU A 62 -7.033 -2.706 -4.901 1.00 0.00 C ATOM 855 CD1 LEU A 62 -6.331 -1.346 -4.874 1.00 0.00 C ATOM 856 CD2 LEU A 62 -8.229 -2.679 -3.949 1.00 0.00 C ATOM 0 H LEU A 62 -10.172 -3.065 -6.158 1.00 0.00 H new ATOM 0 HA LEU A 62 -8.082 -0.935 -6.488 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -8.013 -3.974 -6.351 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -6.672 -3.053 -7.003 1.00 0.00 H new ATOM 0 HG LEU A 62 -6.334 -3.482 -4.588 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -5.984 -1.136 -3.862 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -5.479 -1.363 -5.554 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -7.029 -0.570 -5.187 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -7.884 -2.468 -2.937 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.927 -1.903 -4.263 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.730 -3.647 -3.967 1.00 0.00 H new ATOM 868 N ALA A 63 -9.529 -1.137 -8.815 1.00 0.00 N ATOM 869 CA ALA A 63 -9.774 -1.151 -10.281 1.00 0.00 C ATOM 870 C ALA A 63 -10.081 -2.581 -10.732 1.00 0.00 C ATOM 871 O ALA A 63 -9.846 -2.948 -11.866 1.00 0.00 O ATOM 872 CB ALA A 63 -8.531 -0.640 -11.008 1.00 0.00 C ATOM 0 H ALA A 63 -10.064 -0.442 -8.293 1.00 0.00 H new ATOM 0 HA ALA A 63 -10.622 -0.507 -10.516 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.709 -0.650 -12.083 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -8.313 0.378 -10.685 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.683 -1.284 -10.775 1.00 0.00 H new ATOM 878 N GLY A 64 -10.603 -3.393 -9.852 1.00 0.00 N ATOM 879 CA GLY A 64 -10.918 -4.799 -10.237 1.00 0.00 C ATOM 880 C GLY A 64 -11.970 -5.386 -9.288 1.00 0.00 C ATOM 881 O GLY A 64 -13.156 -5.193 -9.465 1.00 0.00 O ATOM 0 H GLY A 64 -10.824 -3.145 -8.888 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -11.286 -4.829 -11.263 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -10.012 -5.404 -10.206 1.00 0.00 H new ATOM 885 N VAL A 65 -11.544 -6.118 -8.290 1.00 0.00 N ATOM 886 CA VAL A 65 -12.518 -6.732 -7.341 1.00 0.00 C ATOM 887 C VAL A 65 -12.375 -6.093 -5.957 1.00 0.00 C ATOM 888 O VAL A 65 -11.455 -5.343 -5.700 1.00 0.00 O ATOM 889 CB VAL A 65 -12.238 -8.233 -7.236 1.00 0.00 C ATOM 890 CG1 VAL A 65 -13.328 -8.903 -6.397 1.00 0.00 C ATOM 891 CG2 VAL A 65 -12.227 -8.848 -8.637 1.00 0.00 C ATOM 0 H VAL A 65 -10.563 -6.316 -8.092 1.00 0.00 H new ATOM 0 HA VAL A 65 -13.531 -6.566 -7.708 1.00 0.00 H new ATOM 0 HB VAL A 65 -11.269 -8.387 -6.761 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -13.126 -9.972 -6.324 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -13.338 -8.467 -5.398 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -14.298 -8.749 -6.870 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -12.028 -9.917 -8.564 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -13.196 -8.691 -9.111 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -11.449 -8.374 -9.236 1.00 0.00 H new ATOM 901 N HIS A 66 -13.284 -6.385 -5.064 1.00 0.00 N ATOM 902 CA HIS A 66 -13.209 -5.800 -3.697 1.00 0.00 C ATOM 903 C HIS A 66 -12.297 -6.658 -2.817 1.00 0.00 C ATOM 904 O HIS A 66 -12.411 -7.866 -2.776 1.00 0.00 O ATOM 905 CB HIS A 66 -14.609 -5.762 -3.083 1.00 0.00 C ATOM 906 CG HIS A 66 -15.494 -4.867 -3.907 1.00 0.00 C ATOM 907 ND1 HIS A 66 -16.051 -5.284 -5.106 1.00 0.00 N ATOM 908 CD2 HIS A 66 -15.929 -3.580 -3.717 1.00 0.00 C ATOM 909 CE1 HIS A 66 -16.784 -4.263 -5.588 1.00 0.00 C ATOM 910 NE2 HIS A 66 -16.744 -3.200 -4.780 1.00 0.00 N ATOM 0 H HIS A 66 -14.077 -7.006 -5.225 1.00 0.00 H new ATOM 0 HA HIS A 66 -12.806 -4.789 -3.760 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -15.027 -6.768 -3.043 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -14.558 -5.397 -2.057 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -15.678 -2.957 -2.872 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -17.337 -4.299 -6.515 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -17.210 -2.303 -4.913 1.00 0.00 H new ATOM 918 N TYR A 67 -11.395 -6.037 -2.105 1.00 0.00 N ATOM 919 CA TYR A 67 -10.479 -6.811 -1.220 1.00 0.00 C ATOM 920 C TYR A 67 -10.876 -6.574 0.239 1.00 0.00 C ATOM 921 O TYR A 67 -11.678 -5.709 0.539 1.00 0.00 O ATOM 922 CB TYR A 67 -9.037 -6.356 -1.453 1.00 0.00 C ATOM 923 CG TYR A 67 -8.569 -6.877 -2.793 1.00 0.00 C ATOM 924 CD1 TYR A 67 -8.704 -8.236 -3.098 1.00 0.00 C ATOM 925 CD2 TYR A 67 -8.008 -6.001 -3.730 1.00 0.00 C ATOM 926 CE1 TYR A 67 -8.278 -8.720 -4.340 1.00 0.00 C ATOM 927 CE2 TYR A 67 -7.583 -6.486 -4.974 1.00 0.00 C ATOM 928 CZ TYR A 67 -7.718 -7.844 -5.279 1.00 0.00 C ATOM 929 OH TYR A 67 -7.299 -8.320 -6.504 1.00 0.00 O ATOM 0 H TYR A 67 -11.253 -5.027 -2.098 1.00 0.00 H new ATOM 0 HA TYR A 67 -10.554 -7.875 -1.447 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -8.977 -5.268 -1.430 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -8.391 -6.728 -0.658 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -9.137 -8.911 -2.375 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -7.903 -4.952 -3.494 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -8.381 -9.769 -4.575 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -7.151 -5.811 -5.698 1.00 0.00 H new ATOM 0 HH TYR A 67 -7.162 -7.568 -7.118 1.00 0.00 H new ATOM 939 N VAL A 68 -10.334 -7.337 1.150 1.00 0.00 N ATOM 940 CA VAL A 68 -10.701 -7.154 2.583 1.00 0.00 C ATOM 941 C VAL A 68 -9.523 -6.558 3.353 1.00 0.00 C ATOM 942 O VAL A 68 -8.440 -6.389 2.826 1.00 0.00 O ATOM 943 CB VAL A 68 -11.073 -8.508 3.191 1.00 0.00 C ATOM 944 CG1 VAL A 68 -12.014 -8.297 4.377 1.00 0.00 C ATOM 945 CG2 VAL A 68 -11.773 -9.366 2.136 1.00 0.00 C ATOM 0 H VAL A 68 -9.656 -8.076 0.965 1.00 0.00 H new ATOM 0 HA VAL A 68 -11.551 -6.475 2.649 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.168 -9.012 3.530 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -12.278 -9.263 4.809 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -11.518 -7.686 5.131 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -12.919 -7.792 4.038 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -12.038 -10.331 2.569 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -12.677 -8.860 1.797 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -11.104 -9.520 1.290 1.00 0.00 H new ATOM 955 N THR A 69 -9.730 -6.237 4.599 1.00 0.00 N ATOM 956 CA THR A 69 -8.634 -5.649 5.416 1.00 0.00 C ATOM 957 C THR A 69 -8.282 -6.608 6.557 1.00 0.00 C ATOM 958 O THR A 69 -9.149 -7.147 7.216 1.00 0.00 O ATOM 959 CB THR A 69 -9.096 -4.313 5.997 1.00 0.00 C ATOM 960 OG1 THR A 69 -10.384 -3.996 5.486 1.00 0.00 O ATOM 961 CG2 THR A 69 -8.105 -3.215 5.608 1.00 0.00 C ATOM 0 H THR A 69 -10.616 -6.358 5.089 1.00 0.00 H new ATOM 0 HA THR A 69 -7.756 -5.489 4.790 1.00 0.00 H new ATOM 0 HB THR A 69 -9.144 -4.386 7.083 1.00 0.00 H new ATOM 0 HG1 THR A 69 -11.058 -4.552 5.930 1.00 0.00 H new ATOM 0 HG21 THR A 69 -8.436 -2.263 6.023 1.00 0.00 H new ATOM 0 HG22 THR A 69 -7.118 -3.459 6.002 1.00 0.00 H new ATOM 0 HG23 THR A 69 -8.054 -3.139 4.522 1.00 0.00 H new ATOM 969 N LEU A 70 -7.017 -6.824 6.797 1.00 0.00 N ATOM 970 CA LEU A 70 -6.615 -7.746 7.896 1.00 0.00 C ATOM 971 C LEU A 70 -6.467 -6.947 9.193 1.00 0.00 C ATOM 972 O LEU A 70 -7.092 -7.246 10.192 1.00 0.00 O ATOM 973 CB LEU A 70 -5.279 -8.407 7.546 1.00 0.00 C ATOM 974 CG LEU A 70 -5.014 -9.569 8.506 1.00 0.00 C ATOM 975 CD1 LEU A 70 -5.781 -10.806 8.035 1.00 0.00 C ATOM 976 CD2 LEU A 70 -3.516 -9.879 8.528 1.00 0.00 C ATOM 0 H LEU A 70 -6.246 -6.402 6.280 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.375 -8.517 8.025 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.299 -8.769 6.518 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -4.472 -7.677 7.611 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.345 -9.295 9.508 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -5.592 -11.633 8.719 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.849 -10.587 8.017 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -5.450 -11.080 7.033 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.326 -10.707 9.211 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -3.186 -10.153 7.526 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -2.967 -8.999 8.862 1.00 0.00 H new ATOM 988 N ARG A 71 -5.650 -5.930 9.186 1.00 0.00 N ATOM 989 CA ARG A 71 -5.470 -5.110 10.419 1.00 0.00 C ATOM 990 C ARG A 71 -5.450 -3.628 10.035 1.00 0.00 C ATOM 991 O ARG A 71 -4.410 -2.998 10.001 1.00 0.00 O ATOM 992 CB ARG A 71 -4.150 -5.473 11.118 1.00 0.00 C ATOM 993 CG ARG A 71 -3.618 -6.813 10.595 1.00 0.00 C ATOM 994 CD ARG A 71 -2.648 -6.559 9.439 1.00 0.00 C ATOM 995 NE ARG A 71 -1.500 -7.515 9.521 1.00 0.00 N ATOM 996 CZ ARG A 71 -0.823 -7.674 10.630 1.00 0.00 C ATOM 997 NH1 ARG A 71 -1.009 -6.874 11.646 1.00 0.00 N ATOM 998 NH2 ARG A 71 0.086 -8.607 10.701 1.00 0.00 N ATOM 0 H ARG A 71 -5.099 -5.631 8.381 1.00 0.00 H new ATOM 0 HA ARG A 71 -6.295 -5.310 11.103 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -3.412 -4.689 10.945 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -4.306 -5.532 12.195 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -3.113 -7.354 11.396 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -4.445 -7.439 10.260 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -3.164 -6.677 8.486 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -2.282 -5.533 9.478 1.00 0.00 H new ATOM 0 HE ARG A 71 -1.239 -8.054 8.695 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -1.688 -6.115 11.580 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -0.475 -7.008 12.505 1.00 0.00 H new ATOM 0 HH21 ARG A 71 0.265 -9.207 9.896 1.00 0.00 H new ATOM 0 HH22 ARG A 71 0.617 -8.737 11.562 1.00 0.00 H new ATOM 1012 N ALA A 72 -6.591 -3.068 9.741 1.00 0.00 N ATOM 1013 CA ALA A 72 -6.641 -1.629 9.353 1.00 0.00 C ATOM 1014 C ALA A 72 -7.124 -0.795 10.541 1.00 0.00 C ATOM 1015 O ALA A 72 -8.284 -0.443 10.632 1.00 0.00 O ATOM 1016 CB ALA A 72 -7.609 -1.450 8.180 1.00 0.00 C ATOM 0 H ALA A 72 -7.492 -3.545 9.753 1.00 0.00 H new ATOM 0 HA ALA A 72 -5.645 -1.299 9.058 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -7.646 -0.398 7.896 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -7.267 -2.043 7.332 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -8.604 -1.781 8.476 1.00 0.00 H new ATOM 1022 N ASP A 73 -6.246 -0.472 11.452 1.00 0.00 N ATOM 1023 CA ASP A 73 -6.659 0.341 12.631 1.00 0.00 C ATOM 1024 C ASP A 73 -5.462 0.537 13.565 1.00 0.00 C ATOM 1025 O ASP A 73 -5.247 1.608 14.100 1.00 0.00 O ATOM 1026 CB ASP A 73 -7.777 -0.381 13.386 1.00 0.00 C ATOM 1027 CG ASP A 73 -8.396 0.571 14.412 1.00 0.00 C ATOM 1028 OD1 ASP A 73 -9.050 1.514 13.996 1.00 0.00 O ATOM 1029 OD2 ASP A 73 -8.206 0.341 15.594 1.00 0.00 O ATOM 0 H ASP A 73 -5.261 -0.736 11.430 1.00 0.00 H new ATOM 0 HA ASP A 73 -7.018 1.312 12.290 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -8.539 -0.725 12.687 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -7.381 -1.265 13.886 1.00 0.00 H new ATOM 1034 N ASP A 74 -4.685 -0.490 13.771 1.00 0.00 N ATOM 1035 CA ASP A 74 -3.507 -0.369 14.677 1.00 0.00 C ATOM 1036 C ASP A 74 -2.560 0.716 14.155 1.00 0.00 C ATOM 1037 O ASP A 74 -2.573 1.838 14.619 1.00 0.00 O ATOM 1038 CB ASP A 74 -2.770 -1.708 14.734 1.00 0.00 C ATOM 1039 CG ASP A 74 -3.045 -2.388 16.077 1.00 0.00 C ATOM 1040 OD1 ASP A 74 -4.155 -2.860 16.265 1.00 0.00 O ATOM 1041 OD2 ASP A 74 -2.141 -2.427 16.895 1.00 0.00 O ATOM 0 H ASP A 74 -4.815 -1.410 13.350 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.847 -0.097 15.676 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -3.097 -2.350 13.916 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -1.699 -1.551 14.607 1.00 0.00 H new ATOM 1046 N ARG A 75 -1.736 0.391 13.195 1.00 0.00 N ATOM 1047 CA ARG A 75 -0.788 1.408 12.648 1.00 0.00 C ATOM 1048 C ARG A 75 -0.605 1.184 11.146 1.00 0.00 C ATOM 1049 O ARG A 75 -0.690 2.104 10.357 1.00 0.00 O ATOM 1050 CB ARG A 75 0.582 1.297 13.341 1.00 0.00 C ATOM 1051 CG ARG A 75 0.606 0.109 14.310 1.00 0.00 C ATOM 1052 CD ARG A 75 2.050 -0.356 14.513 1.00 0.00 C ATOM 1053 NE ARG A 75 2.179 -1.777 14.081 1.00 0.00 N ATOM 1054 CZ ARG A 75 3.361 -2.301 13.892 1.00 0.00 C ATOM 1055 NH1 ARG A 75 4.436 -1.590 14.102 1.00 0.00 N ATOM 1056 NH2 ARG A 75 3.468 -3.541 13.498 1.00 0.00 N ATOM 0 H ARG A 75 -1.677 -0.532 12.766 1.00 0.00 H new ATOM 0 HA ARG A 75 -1.202 2.400 12.831 1.00 0.00 H new ATOM 0 HB2 ARG A 75 1.365 1.177 12.592 1.00 0.00 H new ATOM 0 HB3 ARG A 75 0.797 2.218 13.882 1.00 0.00 H new ATOM 0 HG2 ARG A 75 0.168 0.397 15.266 1.00 0.00 H new ATOM 0 HG3 ARG A 75 0.002 -0.708 13.915 1.00 0.00 H new ATOM 0 HD2 ARG A 75 2.730 0.273 13.939 1.00 0.00 H new ATOM 0 HD3 ARG A 75 2.332 -0.256 15.561 1.00 0.00 H new ATOM 0 HE ARG A 75 1.343 -2.342 13.933 1.00 0.00 H new ATOM 0 HH11 ARG A 75 4.355 -0.622 14.415 1.00 0.00 H new ATOM 0 HH12 ARG A 75 5.357 -2.002 13.954 1.00 0.00 H new ATOM 0 HH21 ARG A 75 2.630 -4.099 13.338 1.00 0.00 H new ATOM 0 HH22 ARG A 75 4.390 -3.951 13.350 1.00 0.00 H new ATOM 1070 N SER A 76 -0.346 -0.031 10.743 1.00 0.00 N ATOM 1071 CA SER A 76 -0.149 -0.311 9.291 1.00 0.00 C ATOM 1072 C SER A 76 -1.489 -0.676 8.649 1.00 0.00 C ATOM 1073 O SER A 76 -2.533 -0.539 9.254 1.00 0.00 O ATOM 1074 CB SER A 76 0.827 -1.473 9.127 1.00 0.00 C ATOM 1075 OG SER A 76 1.750 -1.469 10.207 1.00 0.00 O ATOM 0 H SER A 76 -0.262 -0.842 11.356 1.00 0.00 H new ATOM 0 HA SER A 76 0.254 0.577 8.803 1.00 0.00 H new ATOM 0 HB2 SER A 76 0.284 -2.418 9.102 1.00 0.00 H new ATOM 0 HB3 SER A 76 1.358 -1.385 8.179 1.00 0.00 H new ATOM 0 HG SER A 76 2.451 -2.133 10.040 1.00 0.00 H new ATOM 1081 N ILE A 77 -1.473 -1.136 7.423 1.00 0.00 N ATOM 1082 CA ILE A 77 -2.758 -1.498 6.755 1.00 0.00 C ATOM 1083 C ILE A 77 -2.484 -2.383 5.532 1.00 0.00 C ATOM 1084 O ILE A 77 -2.772 -2.009 4.413 1.00 0.00 O ATOM 1085 CB ILE A 77 -3.497 -0.229 6.295 1.00 0.00 C ATOM 1086 CG1 ILE A 77 -2.841 1.022 6.891 1.00 0.00 C ATOM 1087 CG2 ILE A 77 -4.954 -0.297 6.757 1.00 0.00 C ATOM 1088 CD1 ILE A 77 -3.409 2.270 6.212 1.00 0.00 C ATOM 0 H ILE A 77 -0.633 -1.275 6.861 1.00 0.00 H new ATOM 0 HA ILE A 77 -3.376 -2.040 7.471 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.448 -0.171 5.208 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.023 1.065 7.965 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -1.761 0.980 6.753 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -5.481 0.601 6.433 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -5.433 -1.175 6.323 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -4.988 -0.365 7.844 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -2.942 3.159 6.636 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -3.204 2.228 5.142 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.486 2.314 6.373 1.00 0.00 H new ATOM 1100 N TYR A 78 -1.948 -3.560 5.730 1.00 0.00 N ATOM 1101 CA TYR A 78 -1.687 -4.456 4.563 1.00 0.00 C ATOM 1102 C TYR A 78 -2.900 -5.370 4.353 1.00 0.00 C ATOM 1103 O TYR A 78 -3.220 -6.190 5.191 1.00 0.00 O ATOM 1104 CB TYR A 78 -0.446 -5.326 4.806 1.00 0.00 C ATOM 1105 CG TYR A 78 0.423 -4.733 5.891 1.00 0.00 C ATOM 1106 CD1 TYR A 78 1.398 -3.773 5.574 1.00 0.00 C ATOM 1107 CD2 TYR A 78 0.266 -5.160 7.215 1.00 0.00 C ATOM 1108 CE1 TYR A 78 2.211 -3.246 6.584 1.00 0.00 C ATOM 1109 CE2 TYR A 78 1.078 -4.629 8.222 1.00 0.00 C ATOM 1110 CZ TYR A 78 2.051 -3.673 7.906 1.00 0.00 C ATOM 1111 OH TYR A 78 2.854 -3.154 8.900 1.00 0.00 O ATOM 0 H TYR A 78 -1.682 -3.937 6.640 1.00 0.00 H new ATOM 0 HA TYR A 78 -1.514 -3.838 3.682 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -0.752 -6.333 5.089 1.00 0.00 H new ATOM 0 HB3 TYR A 78 0.127 -5.415 3.883 1.00 0.00 H new ATOM 0 HD1 TYR A 78 1.520 -3.442 4.553 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -0.482 -5.900 7.459 1.00 0.00 H new ATOM 0 HE1 TYR A 78 2.963 -2.509 6.342 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.955 -4.956 9.244 1.00 0.00 H new ATOM 0 HH TYR A 78 3.478 -2.505 8.512 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.580 -5.236 3.246 1.00 0.00 N ATOM 1122 CA GLY A 79 -4.771 -6.099 2.993 1.00 0.00 C ATOM 1123 C GLY A 79 -4.364 -7.293 2.124 1.00 0.00 C ATOM 1124 O GLY A 79 -3.206 -7.659 2.062 1.00 0.00 O ATOM 0 H GLY A 79 -3.363 -4.568 2.507 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.187 -6.449 3.938 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.551 -5.523 2.495 1.00 0.00 H new ATOM 1128 N LYS A 80 -5.303 -7.903 1.451 1.00 0.00 N ATOM 1129 CA LYS A 80 -4.960 -9.070 0.589 1.00 0.00 C ATOM 1130 C LYS A 80 -5.482 -8.832 -0.829 1.00 0.00 C ATOM 1131 O LYS A 80 -6.380 -8.043 -1.047 1.00 0.00 O ATOM 1132 CB LYS A 80 -5.603 -10.338 1.157 1.00 0.00 C ATOM 1133 CG LYS A 80 -7.098 -10.098 1.372 1.00 0.00 C ATOM 1134 CD LYS A 80 -7.819 -11.440 1.516 1.00 0.00 C ATOM 1135 CE LYS A 80 -7.787 -12.187 0.180 1.00 0.00 C ATOM 1136 NZ LYS A 80 -9.089 -12.002 -0.522 1.00 0.00 N ATOM 0 H LYS A 80 -6.290 -7.644 1.461 1.00 0.00 H new ATOM 0 HA LYS A 80 -3.877 -9.190 0.565 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -5.452 -11.173 0.473 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -5.128 -10.609 2.100 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -7.254 -9.492 2.265 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -7.511 -9.540 0.532 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -7.341 -12.040 2.291 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -8.850 -11.278 1.829 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -6.971 -11.813 -0.439 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -7.599 -13.247 0.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -9.069 -12.509 -1.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -9.858 -12.379 0.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -9.250 -10.989 -0.695 1.00 0.00 H new ATOM 1150 N LYS A 81 -4.928 -9.514 -1.794 1.00 0.00 N ATOM 1151 CA LYS A 81 -5.392 -9.337 -3.198 1.00 0.00 C ATOM 1152 C LYS A 81 -5.812 -10.694 -3.765 1.00 0.00 C ATOM 1153 O LYS A 81 -5.761 -11.701 -3.087 1.00 0.00 O ATOM 1154 CB LYS A 81 -4.256 -8.762 -4.046 1.00 0.00 C ATOM 1155 CG LYS A 81 -4.159 -7.252 -3.823 1.00 0.00 C ATOM 1156 CD LYS A 81 -3.539 -6.593 -5.058 1.00 0.00 C ATOM 1157 CE LYS A 81 -4.612 -6.417 -6.134 1.00 0.00 C ATOM 1158 NZ LYS A 81 -4.074 -6.858 -7.453 1.00 0.00 N ATOM 0 H LYS A 81 -4.172 -10.188 -1.670 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.240 -8.652 -3.217 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -3.313 -9.240 -3.780 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -4.434 -8.973 -5.101 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -5.149 -6.837 -3.635 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -3.552 -7.042 -2.942 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -3.113 -5.626 -4.792 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -2.723 -7.206 -5.440 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.497 -6.999 -5.878 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -4.921 -5.373 -6.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.804 -6.738 -8.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -3.242 -6.284 -7.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -3.800 -7.860 -7.399 1.00 0.00 H new ATOM 1172 N GLY A 82 -6.222 -10.734 -5.004 1.00 0.00 N ATOM 1173 CA GLY A 82 -6.636 -12.033 -5.607 1.00 0.00 C ATOM 1174 C GLY A 82 -5.427 -12.967 -5.665 1.00 0.00 C ATOM 1175 O GLY A 82 -4.536 -12.793 -6.474 1.00 0.00 O ATOM 0 H GLY A 82 -6.288 -9.926 -5.623 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -7.432 -12.485 -5.015 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -7.035 -11.872 -6.609 1.00 0.00 H new ATOM 1179 N SER A 83 -5.381 -13.953 -4.812 1.00 0.00 N ATOM 1180 CA SER A 83 -4.220 -14.886 -4.819 1.00 0.00 C ATOM 1181 C SER A 83 -2.934 -14.077 -4.658 1.00 0.00 C ATOM 1182 O SER A 83 -1.855 -14.526 -4.992 1.00 0.00 O ATOM 1183 CB SER A 83 -4.182 -15.648 -6.145 1.00 0.00 C ATOM 1184 OG SER A 83 -5.466 -15.596 -6.754 1.00 0.00 O ATOM 0 H SER A 83 -6.096 -14.152 -4.112 1.00 0.00 H new ATOM 0 HA SER A 83 -4.314 -15.598 -3.999 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.435 -15.211 -6.807 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.890 -16.684 -5.974 1.00 0.00 H new ATOM 0 HG SER A 83 -5.444 -16.082 -7.605 1.00 0.00 H new ATOM 1190 N ALA A 84 -3.044 -12.881 -4.147 1.00 0.00 N ATOM 1191 CA ALA A 84 -1.837 -12.028 -3.960 1.00 0.00 C ATOM 1192 C ALA A 84 -1.897 -11.361 -2.584 1.00 0.00 C ATOM 1193 O ALA A 84 -2.658 -11.760 -1.724 1.00 0.00 O ATOM 1194 CB ALA A 84 -1.803 -10.952 -5.049 1.00 0.00 C ATOM 0 H ALA A 84 -3.923 -12.457 -3.850 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.939 -12.642 -4.028 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -0.921 -10.326 -4.915 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.765 -11.427 -6.029 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.699 -10.335 -4.979 1.00 0.00 H new ATOM 1200 N GLY A 85 -1.105 -10.348 -2.369 1.00 0.00 N ATOM 1201 CA GLY A 85 -1.122 -9.657 -1.050 1.00 0.00 C ATOM 1202 C GLY A 85 -0.812 -8.174 -1.253 1.00 0.00 C ATOM 1203 O GLY A 85 0.135 -7.813 -1.924 1.00 0.00 O ATOM 0 H GLY A 85 -0.447 -9.969 -3.050 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.097 -9.775 -0.577 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -0.387 -10.106 -0.382 1.00 0.00 H new ATOM 1207 N VAL A 86 -1.604 -7.310 -0.682 1.00 0.00 N ATOM 1208 CA VAL A 86 -1.354 -5.852 -0.845 1.00 0.00 C ATOM 1209 C VAL A 86 -0.749 -5.293 0.442 1.00 0.00 C ATOM 1210 O VAL A 86 -1.239 -5.535 1.527 1.00 0.00 O ATOM 1211 CB VAL A 86 -2.673 -5.140 -1.141 1.00 0.00 C ATOM 1212 CG1 VAL A 86 -3.727 -5.587 -0.129 1.00 0.00 C ATOM 1213 CG2 VAL A 86 -2.470 -3.626 -1.032 1.00 0.00 C ATOM 0 H VAL A 86 -2.413 -7.551 -0.110 1.00 0.00 H new ATOM 0 HA VAL A 86 -0.662 -5.691 -1.671 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.006 -5.390 -2.148 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.669 -5.081 -0.338 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.870 -6.665 -0.204 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.395 -5.335 0.878 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.410 -3.117 -1.243 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.139 -3.375 -0.024 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.715 -3.307 -1.751 1.00 0.00 H new ATOM 1223 N ILE A 87 0.313 -4.546 0.331 1.00 0.00 N ATOM 1224 CA ILE A 87 0.950 -3.969 1.545 1.00 0.00 C ATOM 1225 C ILE A 87 0.834 -2.446 1.498 1.00 0.00 C ATOM 1226 O ILE A 87 1.571 -1.783 0.800 1.00 0.00 O ATOM 1227 CB ILE A 87 2.426 -4.367 1.585 1.00 0.00 C ATOM 1228 CG1 ILE A 87 2.544 -5.894 1.560 1.00 0.00 C ATOM 1229 CG2 ILE A 87 3.068 -3.827 2.863 1.00 0.00 C ATOM 1230 CD1 ILE A 87 1.898 -6.481 2.816 1.00 0.00 C ATOM 0 H ILE A 87 0.768 -4.310 -0.551 1.00 0.00 H new ATOM 0 HA ILE A 87 0.449 -4.347 2.436 1.00 0.00 H new ATOM 0 HB ILE A 87 2.937 -3.948 0.718 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.057 -6.292 0.669 1.00 0.00 H new ATOM 0 HG13 ILE A 87 3.593 -6.187 1.508 1.00 0.00 H new ATOM 0 HG21 ILE A 87 4.120 -4.111 2.890 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.985 -2.740 2.881 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.557 -4.244 3.731 1.00 0.00 H new ATOM 0 HD11 ILE A 87 1.984 -7.567 2.795 1.00 0.00 H new ATOM 0 HD12 ILE A 87 2.404 -6.094 3.700 1.00 0.00 H new ATOM 0 HD13 ILE A 87 0.845 -6.201 2.849 1.00 0.00 H new ATOM 1242 N THR A 88 -0.087 -1.883 2.229 1.00 0.00 N ATOM 1243 CA THR A 88 -0.240 -0.401 2.212 1.00 0.00 C ATOM 1244 C THR A 88 0.034 0.159 3.608 1.00 0.00 C ATOM 1245 O THR A 88 -0.265 -0.464 4.607 1.00 0.00 O ATOM 1246 CB THR A 88 -1.667 -0.041 1.790 1.00 0.00 C ATOM 1247 OG1 THR A 88 -2.543 -0.215 2.893 1.00 0.00 O ATOM 1248 CG2 THR A 88 -2.106 -0.946 0.639 1.00 0.00 C ATOM 0 H THR A 88 -0.738 -2.382 2.835 1.00 0.00 H new ATOM 0 HA THR A 88 0.469 0.028 1.504 1.00 0.00 H new ATOM 0 HB THR A 88 -1.697 0.998 1.462 1.00 0.00 H new ATOM 0 HG1 THR A 88 -2.546 -1.157 3.163 1.00 0.00 H new ATOM 0 HG21 THR A 88 -3.122 -0.688 0.340 1.00 0.00 H new ATOM 0 HG22 THR A 88 -1.433 -0.810 -0.208 1.00 0.00 H new ATOM 0 HG23 THR A 88 -2.076 -1.986 0.963 1.00 0.00 H new ATOM 1256 N VAL A 89 0.600 1.332 3.687 1.00 0.00 N ATOM 1257 CA VAL A 89 0.890 1.926 5.022 1.00 0.00 C ATOM 1258 C VAL A 89 0.752 3.450 4.952 1.00 0.00 C ATOM 1259 O VAL A 89 1.123 4.073 3.976 1.00 0.00 O ATOM 1260 CB VAL A 89 2.317 1.564 5.442 1.00 0.00 C ATOM 1261 CG1 VAL A 89 2.436 1.647 6.964 1.00 0.00 C ATOM 1262 CG2 VAL A 89 2.642 0.139 4.985 1.00 0.00 C ATOM 0 H VAL A 89 0.873 1.903 2.887 1.00 0.00 H new ATOM 0 HA VAL A 89 0.182 1.533 5.752 1.00 0.00 H new ATOM 0 HB VAL A 89 3.017 2.261 4.981 1.00 0.00 H new ATOM 0 HG11 VAL A 89 3.452 1.389 7.264 1.00 0.00 H new ATOM 0 HG12 VAL A 89 2.207 2.661 7.292 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.734 0.950 7.422 1.00 0.00 H new ATOM 0 HG21 VAL A 89 3.658 -0.116 5.285 1.00 0.00 H new ATOM 0 HG22 VAL A 89 1.942 -0.559 5.444 1.00 0.00 H new ATOM 0 HG23 VAL A 89 2.558 0.077 3.900 1.00 0.00 H new ATOM 1272 N LYS A 90 0.224 4.052 5.984 1.00 0.00 N ATOM 1273 CA LYS A 90 0.067 5.535 5.986 1.00 0.00 C ATOM 1274 C LYS A 90 1.315 6.166 6.608 1.00 0.00 C ATOM 1275 O LYS A 90 1.694 5.848 7.718 1.00 0.00 O ATOM 1276 CB LYS A 90 -1.166 5.919 6.809 1.00 0.00 C ATOM 1277 CG LYS A 90 -2.194 6.611 5.909 1.00 0.00 C ATOM 1278 CD LYS A 90 -2.373 8.063 6.357 1.00 0.00 C ATOM 1279 CE LYS A 90 -2.920 8.097 7.785 1.00 0.00 C ATOM 1280 NZ LYS A 90 -2.295 9.227 8.528 1.00 0.00 N ATOM 0 H LYS A 90 -0.106 3.580 6.826 1.00 0.00 H new ATOM 0 HA LYS A 90 -0.058 5.894 4.965 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.605 5.029 7.261 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.878 6.582 7.625 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -1.864 6.578 4.871 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.147 6.085 5.957 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.419 8.589 6.310 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.056 8.580 5.683 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.004 8.214 7.768 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -2.708 7.154 8.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.666 9.251 9.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.264 9.097 8.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.519 10.123 8.050 1.00 0.00 H new ATOM 1294 N THR A 91 1.963 7.051 5.902 1.00 0.00 N ATOM 1295 CA THR A 91 3.190 7.690 6.456 1.00 0.00 C ATOM 1296 C THR A 91 2.865 9.107 6.930 1.00 0.00 C ATOM 1297 O THR A 91 3.021 9.435 8.090 1.00 0.00 O ATOM 1298 CB THR A 91 4.267 7.750 5.371 1.00 0.00 C ATOM 1299 OG1 THR A 91 3.656 7.626 4.095 1.00 0.00 O ATOM 1300 CG2 THR A 91 5.266 6.609 5.573 1.00 0.00 C ATOM 0 H THR A 91 1.697 7.359 4.967 1.00 0.00 H new ATOM 0 HA THR A 91 3.553 7.103 7.299 1.00 0.00 H new ATOM 0 HB THR A 91 4.793 8.703 5.434 1.00 0.00 H new ATOM 0 HG1 THR A 91 4.075 8.253 3.469 1.00 0.00 H new ATOM 0 HG21 THR A 91 6.032 6.655 4.799 1.00 0.00 H new ATOM 0 HG22 THR A 91 5.734 6.705 6.553 1.00 0.00 H new ATOM 0 HG23 THR A 91 4.745 5.654 5.512 1.00 0.00 H new ATOM 1308 N SER A 92 2.416 9.950 6.043 1.00 0.00 N ATOM 1309 CA SER A 92 2.087 11.346 6.445 1.00 0.00 C ATOM 1310 C SER A 92 1.322 12.035 5.313 1.00 0.00 C ATOM 1311 O SER A 92 0.161 12.369 5.448 1.00 0.00 O ATOM 1312 CB SER A 92 3.381 12.110 6.726 1.00 0.00 C ATOM 1313 OG SER A 92 3.080 13.484 6.937 1.00 0.00 O ATOM 0 H SER A 92 2.263 9.733 5.058 1.00 0.00 H new ATOM 0 HA SER A 92 1.470 11.332 7.343 1.00 0.00 H new ATOM 0 HB2 SER A 92 3.878 11.696 7.603 1.00 0.00 H new ATOM 0 HB3 SER A 92 4.070 12.001 5.888 1.00 0.00 H new ATOM 0 HG SER A 92 3.615 14.034 6.327 1.00 0.00 H new ATOM 1319 N LYS A 93 1.962 12.254 4.199 1.00 0.00 N ATOM 1320 CA LYS A 93 1.273 12.923 3.061 1.00 0.00 C ATOM 1321 C LYS A 93 1.285 11.999 1.844 1.00 0.00 C ATOM 1322 O LYS A 93 1.046 12.424 0.730 1.00 0.00 O ATOM 1323 CB LYS A 93 2.005 14.221 2.719 1.00 0.00 C ATOM 1324 CG LYS A 93 1.153 15.419 3.142 1.00 0.00 C ATOM 1325 CD LYS A 93 2.016 16.401 3.936 1.00 0.00 C ATOM 1326 CE LYS A 93 1.353 16.692 5.284 1.00 0.00 C ATOM 1327 NZ LYS A 93 2.311 17.420 6.163 1.00 0.00 N ATOM 0 H LYS A 93 2.934 11.998 4.027 1.00 0.00 H new ATOM 0 HA LYS A 93 0.243 13.145 3.339 1.00 0.00 H new ATOM 0 HB2 LYS A 93 2.969 14.251 3.226 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.206 14.265 1.649 1.00 0.00 H new ATOM 0 HG2 LYS A 93 0.737 15.912 2.263 1.00 0.00 H new ATOM 0 HG3 LYS A 93 0.311 15.085 3.749 1.00 0.00 H new ATOM 0 HD2 LYS A 93 3.011 15.984 4.091 1.00 0.00 H new ATOM 0 HD3 LYS A 93 2.143 17.326 3.374 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.453 17.289 5.137 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.044 15.760 5.758 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.860 17.618 7.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 3.158 16.835 6.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.585 18.316 5.711 1.00 0.00 H new ATOM 1341 N SER A 94 1.564 10.739 2.041 1.00 0.00 N ATOM 1342 CA SER A 94 1.593 9.801 0.885 1.00 0.00 C ATOM 1343 C SER A 94 1.303 8.375 1.360 1.00 0.00 C ATOM 1344 O SER A 94 1.542 8.026 2.499 1.00 0.00 O ATOM 1345 CB SER A 94 2.975 9.846 0.232 1.00 0.00 C ATOM 1346 OG SER A 94 2.830 10.067 -1.163 1.00 0.00 O ATOM 0 H SER A 94 1.772 10.321 2.948 1.00 0.00 H new ATOM 0 HA SER A 94 0.833 10.099 0.163 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.574 10.641 0.677 1.00 0.00 H new ATOM 0 HB3 SER A 94 3.504 8.910 0.410 1.00 0.00 H new ATOM 0 HG SER A 94 3.352 10.854 -1.426 1.00 0.00 H new ATOM 1352 N ILE A 95 0.795 7.550 0.488 1.00 0.00 N ATOM 1353 CA ILE A 95 0.493 6.144 0.871 1.00 0.00 C ATOM 1354 C ILE A 95 1.197 5.208 -0.110 1.00 0.00 C ATOM 1355 O ILE A 95 1.225 5.453 -1.299 1.00 0.00 O ATOM 1356 CB ILE A 95 -1.020 5.915 0.815 1.00 0.00 C ATOM 1357 CG1 ILE A 95 -1.725 6.988 1.648 1.00 0.00 C ATOM 1358 CG2 ILE A 95 -1.350 4.533 1.379 1.00 0.00 C ATOM 1359 CD1 ILE A 95 -3.236 6.896 1.431 1.00 0.00 C ATOM 0 H ILE A 95 0.575 7.791 -0.478 1.00 0.00 H new ATOM 0 HA ILE A 95 0.844 5.946 1.884 1.00 0.00 H new ATOM 0 HB ILE A 95 -1.359 5.973 -0.219 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -1.490 6.855 2.704 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -1.366 7.977 1.364 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -2.427 4.371 1.339 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -0.846 3.769 0.787 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -1.013 4.472 2.414 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.736 7.661 2.025 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -3.462 7.050 0.376 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -3.588 5.911 1.737 1.00 0.00 H new ATOM 1371 N LEU A 96 1.778 4.143 0.370 1.00 0.00 N ATOM 1372 CA LEU A 96 2.482 3.215 -0.560 1.00 0.00 C ATOM 1373 C LEU A 96 1.737 1.882 -0.630 1.00 0.00 C ATOM 1374 O LEU A 96 0.863 1.608 0.170 1.00 0.00 O ATOM 1375 CB LEU A 96 3.940 2.984 -0.125 1.00 0.00 C ATOM 1376 CG LEU A 96 4.142 3.227 1.381 1.00 0.00 C ATOM 1377 CD1 LEU A 96 3.939 4.709 1.709 1.00 0.00 C ATOM 1378 CD2 LEU A 96 3.160 2.377 2.191 1.00 0.00 C ATOM 0 H LEU A 96 1.796 3.877 1.354 1.00 0.00 H new ATOM 0 HA LEU A 96 2.496 3.674 -1.549 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.233 1.963 -0.369 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.595 3.647 -0.690 1.00 0.00 H new ATOM 0 HG LEU A 96 5.160 2.941 1.646 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.085 4.868 2.777 1.00 0.00 H new ATOM 0 HD12 LEU A 96 4.660 5.307 1.151 1.00 0.00 H new ATOM 0 HD13 LEU A 96 2.928 5.008 1.432 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.313 2.558 3.255 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.138 2.645 1.921 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.328 1.322 1.975 1.00 0.00 H new ATOM 1390 N VAL A 97 2.057 1.058 -1.593 1.00 0.00 N ATOM 1391 CA VAL A 97 1.338 -0.239 -1.714 1.00 0.00 C ATOM 1392 C VAL A 97 2.261 -1.336 -2.252 1.00 0.00 C ATOM 1393 O VAL A 97 2.175 -1.714 -3.402 1.00 0.00 O ATOM 1394 CB VAL A 97 0.169 -0.071 -2.684 1.00 0.00 C ATOM 1395 CG1 VAL A 97 -0.821 -1.222 -2.500 1.00 0.00 C ATOM 1396 CG2 VAL A 97 -0.535 1.258 -2.404 1.00 0.00 C ATOM 0 H VAL A 97 2.779 1.227 -2.294 1.00 0.00 H new ATOM 0 HA VAL A 97 0.987 -0.529 -0.724 1.00 0.00 H new ATOM 0 HB VAL A 97 0.543 -0.078 -3.708 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.654 -1.100 -3.193 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.319 -2.169 -2.699 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.197 -1.219 -1.477 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.369 1.380 -3.095 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -0.908 1.263 -1.380 1.00 0.00 H new ATOM 0 HG23 VAL A 97 0.170 2.078 -2.538 1.00 0.00 H new ATOM 1406 N GLY A 98 3.120 -1.881 -1.434 1.00 0.00 N ATOM 1407 CA GLY A 98 3.996 -2.982 -1.926 1.00 0.00 C ATOM 1408 C GLY A 98 3.088 -4.160 -2.283 1.00 0.00 C ATOM 1409 O GLY A 98 2.530 -4.803 -1.417 1.00 0.00 O ATOM 0 H GLY A 98 3.253 -1.616 -0.458 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.567 -2.659 -2.797 1.00 0.00 H new ATOM 0 HA3 GLY A 98 4.717 -3.270 -1.161 1.00 0.00 H new ATOM 1413 N VAL A 99 2.899 -4.431 -3.545 1.00 0.00 N ATOM 1414 CA VAL A 99 1.985 -5.547 -3.925 1.00 0.00 C ATOM 1415 C VAL A 99 2.766 -6.661 -4.630 1.00 0.00 C ATOM 1416 O VAL A 99 3.671 -6.412 -5.402 1.00 0.00 O ATOM 1417 CB VAL A 99 0.884 -5.017 -4.859 1.00 0.00 C ATOM 1418 CG1 VAL A 99 -0.448 -5.686 -4.513 1.00 0.00 C ATOM 1419 CG2 VAL A 99 0.729 -3.500 -4.689 1.00 0.00 C ATOM 0 H VAL A 99 3.333 -3.934 -4.323 1.00 0.00 H new ATOM 0 HA VAL A 99 1.533 -5.954 -3.021 1.00 0.00 H new ATOM 0 HB VAL A 99 1.163 -5.243 -5.888 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.227 -5.309 -5.176 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.356 -6.765 -4.637 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.711 -5.461 -3.479 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.053 -3.137 -5.356 1.00 0.00 H new ATOM 0 HG22 VAL A 99 0.460 -3.275 -3.657 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.671 -3.008 -4.933 1.00 0.00 H new ATOM 1429 N TYR A 100 2.406 -7.890 -4.369 1.00 0.00 N ATOM 1430 CA TYR A 100 3.099 -9.041 -5.019 1.00 0.00 C ATOM 1431 C TYR A 100 2.038 -9.959 -5.629 1.00 0.00 C ATOM 1432 O TYR A 100 0.858 -9.782 -5.403 1.00 0.00 O ATOM 1433 CB TYR A 100 3.905 -9.813 -3.970 1.00 0.00 C ATOM 1434 CG TYR A 100 2.958 -10.503 -3.019 1.00 0.00 C ATOM 1435 CD1 TYR A 100 2.293 -11.671 -3.415 1.00 0.00 C ATOM 1436 CD2 TYR A 100 2.742 -9.973 -1.743 1.00 0.00 C ATOM 1437 CE1 TYR A 100 1.413 -12.308 -2.532 1.00 0.00 C ATOM 1438 CE2 TYR A 100 1.862 -10.609 -0.860 1.00 0.00 C ATOM 1439 CZ TYR A 100 1.197 -11.776 -1.255 1.00 0.00 C ATOM 1440 OH TYR A 100 0.327 -12.401 -0.386 1.00 0.00 O ATOM 0 H TYR A 100 1.655 -8.148 -3.728 1.00 0.00 H new ATOM 0 HA TYR A 100 3.777 -8.684 -5.794 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.548 -10.546 -4.457 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.556 -9.132 -3.422 1.00 0.00 H new ATOM 0 HD1 TYR A 100 2.459 -12.080 -4.401 1.00 0.00 H new ATOM 0 HD2 TYR A 100 3.255 -9.072 -1.439 1.00 0.00 H new ATOM 0 HE1 TYR A 100 0.901 -13.209 -2.836 1.00 0.00 H new ATOM 0 HE2 TYR A 100 1.696 -10.200 0.126 1.00 0.00 H new ATOM 0 HH TYR A 100 0.319 -13.364 -0.567 1.00 0.00 H new ATOM 1450 N ASN A 101 2.430 -10.940 -6.401 1.00 0.00 N ATOM 1451 CA ASN A 101 1.404 -11.839 -7.000 1.00 0.00 C ATOM 1452 C ASN A 101 1.961 -13.245 -7.217 1.00 0.00 C ATOM 1453 O ASN A 101 2.856 -13.463 -8.010 1.00 0.00 O ATOM 1454 CB ASN A 101 0.938 -11.277 -8.338 1.00 0.00 C ATOM 1455 CG ASN A 101 2.146 -11.042 -9.248 1.00 0.00 C ATOM 1456 OD1 ASN A 101 2.530 -11.913 -10.001 1.00 0.00 O ATOM 1457 ND2 ASN A 101 2.764 -9.893 -9.210 1.00 0.00 N ATOM 0 H ASN A 101 3.399 -11.154 -6.638 1.00 0.00 H new ATOM 0 HA ASN A 101 0.565 -11.897 -6.307 1.00 0.00 H new ATOM 0 HB2 ASN A 101 0.243 -11.970 -8.812 1.00 0.00 H new ATOM 0 HB3 ASN A 101 0.400 -10.342 -8.183 1.00 0.00 H new ATOM 0 HD21 ASN A 101 3.570 -9.727 -9.813 1.00 0.00 H new ATOM 0 HD22 ASN A 101 2.441 -9.161 -8.577 1.00 0.00 H new ATOM 1464 N GLU A 102 1.411 -14.196 -6.518 1.00 0.00 N ATOM 1465 CA GLU A 102 1.854 -15.613 -6.656 1.00 0.00 C ATOM 1466 C GLU A 102 3.367 -15.656 -6.811 1.00 0.00 C ATOM 1467 O GLU A 102 3.914 -16.517 -7.473 1.00 0.00 O ATOM 1468 CB GLU A 102 1.192 -16.242 -7.885 1.00 0.00 C ATOM 1469 CG GLU A 102 1.494 -15.399 -9.128 1.00 0.00 C ATOM 1470 CD GLU A 102 0.907 -16.085 -10.362 1.00 0.00 C ATOM 1471 OE1 GLU A 102 0.187 -17.055 -10.191 1.00 0.00 O ATOM 1472 OE2 GLU A 102 1.185 -15.628 -11.458 1.00 0.00 O ATOM 0 H GLU A 102 0.659 -14.050 -5.844 1.00 0.00 H new ATOM 0 HA GLU A 102 1.564 -16.173 -5.767 1.00 0.00 H new ATOM 0 HB2 GLU A 102 1.559 -17.259 -8.026 1.00 0.00 H new ATOM 0 HB3 GLU A 102 0.115 -16.310 -7.734 1.00 0.00 H new ATOM 0 HG2 GLU A 102 1.069 -14.401 -9.016 1.00 0.00 H new ATOM 0 HG3 GLU A 102 2.571 -15.276 -9.245 1.00 0.00 H new ATOM 1479 N LYS A 103 4.048 -14.727 -6.211 1.00 0.00 N ATOM 1480 CA LYS A 103 5.533 -14.712 -6.334 1.00 0.00 C ATOM 1481 C LYS A 103 6.188 -14.511 -4.963 1.00 0.00 C ATOM 1482 O LYS A 103 7.315 -14.910 -4.747 1.00 0.00 O ATOM 1483 CB LYS A 103 5.952 -13.578 -7.271 1.00 0.00 C ATOM 1484 CG LYS A 103 6.273 -14.154 -8.652 1.00 0.00 C ATOM 1485 CD LYS A 103 7.540 -15.010 -8.567 1.00 0.00 C ATOM 1486 CE LYS A 103 7.304 -16.345 -9.276 1.00 0.00 C ATOM 1487 NZ LYS A 103 8.277 -16.492 -10.396 1.00 0.00 N ATOM 0 H LYS A 103 3.647 -13.980 -5.643 1.00 0.00 H new ATOM 0 HA LYS A 103 5.861 -15.670 -6.739 1.00 0.00 H new ATOM 0 HB2 LYS A 103 5.153 -12.841 -7.349 1.00 0.00 H new ATOM 0 HB3 LYS A 103 6.823 -13.062 -6.868 1.00 0.00 H new ATOM 0 HG2 LYS A 103 5.438 -14.756 -9.010 1.00 0.00 H new ATOM 0 HG3 LYS A 103 6.414 -13.347 -9.371 1.00 0.00 H new ATOM 0 HD2 LYS A 103 8.377 -14.485 -9.027 1.00 0.00 H new ATOM 0 HD3 LYS A 103 7.806 -15.182 -7.524 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.418 -17.168 -8.571 1.00 0.00 H new ATOM 0 HE3 LYS A 103 6.284 -16.391 -9.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 8.117 -17.399 -10.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 8.148 -15.713 -11.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 9.246 -16.466 -10.020 1.00 0.00 H new ATOM 1501 N ILE A 104 5.507 -13.897 -4.036 1.00 0.00 N ATOM 1502 CA ILE A 104 6.121 -13.680 -2.696 1.00 0.00 C ATOM 1503 C ILE A 104 5.094 -13.962 -1.597 1.00 0.00 C ATOM 1504 O ILE A 104 3.907 -13.773 -1.772 1.00 0.00 O ATOM 1505 CB ILE A 104 6.614 -12.231 -2.596 1.00 0.00 C ATOM 1506 CG1 ILE A 104 7.965 -12.109 -3.305 1.00 0.00 C ATOM 1507 CG2 ILE A 104 6.779 -11.833 -1.125 1.00 0.00 C ATOM 1508 CD1 ILE A 104 7.742 -11.987 -4.814 1.00 0.00 C ATOM 0 H ILE A 104 4.559 -13.538 -4.146 1.00 0.00 H new ATOM 0 HA ILE A 104 6.963 -14.360 -2.568 1.00 0.00 H new ATOM 0 HB ILE A 104 5.885 -11.571 -3.066 1.00 0.00 H new ATOM 0 HG12 ILE A 104 8.504 -11.237 -2.935 1.00 0.00 H new ATOM 0 HG13 ILE A 104 8.582 -12.981 -3.087 1.00 0.00 H new ATOM 0 HG21 ILE A 104 7.129 -10.803 -1.064 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.820 -11.921 -0.614 1.00 0.00 H new ATOM 0 HG23 ILE A 104 7.505 -12.492 -0.649 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.704 -11.900 -5.318 1.00 0.00 H new ATOM 0 HD12 ILE A 104 7.221 -12.872 -5.177 1.00 0.00 H new ATOM 0 HD13 ILE A 104 7.142 -11.101 -5.023 1.00 0.00 H new ATOM 1520 N GLN A 105 5.553 -14.413 -0.459 1.00 0.00 N ATOM 1521 CA GLN A 105 4.637 -14.711 0.662 1.00 0.00 C ATOM 1522 C GLN A 105 4.658 -13.541 1.656 1.00 0.00 C ATOM 1523 O GLN A 105 5.685 -12.925 1.859 1.00 0.00 O ATOM 1524 CB GLN A 105 5.137 -15.969 1.357 1.00 0.00 C ATOM 1525 CG GLN A 105 6.637 -15.837 1.628 1.00 0.00 C ATOM 1526 CD GLN A 105 7.417 -16.768 0.697 1.00 0.00 C ATOM 1527 OE1 GLN A 105 7.220 -16.751 -0.502 1.00 0.00 O ATOM 1528 NE2 GLN A 105 8.301 -17.582 1.203 1.00 0.00 N ATOM 0 H GLN A 105 6.539 -14.587 -0.264 1.00 0.00 H new ATOM 0 HA GLN A 105 3.620 -14.856 0.297 1.00 0.00 H new ATOM 0 HB2 GLN A 105 4.599 -16.119 2.293 1.00 0.00 H new ATOM 0 HB3 GLN A 105 4.944 -16.843 0.735 1.00 0.00 H new ATOM 0 HG2 GLN A 105 6.954 -14.805 1.474 1.00 0.00 H new ATOM 0 HG3 GLN A 105 6.851 -16.085 2.668 1.00 0.00 H new ATOM 0 HE21 GLN A 105 8.465 -17.595 2.210 1.00 0.00 H new ATOM 0 HE22 GLN A 105 8.828 -18.206 0.592 1.00 0.00 H new ATOM 1537 N PRO A 106 3.522 -13.271 2.249 1.00 0.00 N ATOM 1538 CA PRO A 106 3.391 -12.178 3.231 1.00 0.00 C ATOM 1539 C PRO A 106 4.212 -12.496 4.486 1.00 0.00 C ATOM 1540 O PRO A 106 4.805 -13.551 4.602 1.00 0.00 O ATOM 1541 CB PRO A 106 1.895 -12.134 3.570 1.00 0.00 C ATOM 1542 CG PRO A 106 1.209 -13.306 2.822 1.00 0.00 C ATOM 1543 CD PRO A 106 2.282 -14.023 1.988 1.00 0.00 C ATOM 0 HA PRO A 106 3.754 -11.226 2.844 1.00 0.00 H new ATOM 0 HB2 PRO A 106 1.743 -12.225 4.646 1.00 0.00 H new ATOM 0 HB3 PRO A 106 1.462 -11.181 3.267 1.00 0.00 H new ATOM 0 HG2 PRO A 106 0.752 -13.996 3.531 1.00 0.00 H new ATOM 0 HG3 PRO A 106 0.411 -12.934 2.179 1.00 0.00 H new ATOM 0 HD2 PRO A 106 2.382 -15.067 2.285 1.00 0.00 H new ATOM 0 HD3 PRO A 106 2.030 -14.016 0.928 1.00 0.00 H new ATOM 1551 N GLY A 107 4.246 -11.594 5.431 1.00 0.00 N ATOM 1552 CA GLY A 107 5.020 -11.846 6.681 1.00 0.00 C ATOM 1553 C GLY A 107 6.512 -11.619 6.428 1.00 0.00 C ATOM 1554 O GLY A 107 7.328 -11.764 7.316 1.00 0.00 O ATOM 0 H GLY A 107 3.770 -10.693 5.391 1.00 0.00 H new ATOM 0 HA2 GLY A 107 4.672 -11.183 7.474 1.00 0.00 H new ATOM 0 HA3 GLY A 107 4.852 -12.867 7.023 1.00 0.00 H new ATOM 1558 N THR A 108 6.878 -11.262 5.228 1.00 0.00 N ATOM 1559 CA THR A 108 8.320 -11.029 4.932 1.00 0.00 C ATOM 1560 C THR A 108 8.497 -9.647 4.301 1.00 0.00 C ATOM 1561 O THR A 108 9.382 -8.896 4.663 1.00 0.00 O ATOM 1562 CB THR A 108 8.821 -12.100 3.960 1.00 0.00 C ATOM 1563 OG1 THR A 108 8.736 -13.375 4.580 1.00 0.00 O ATOM 1564 CG2 THR A 108 10.275 -11.808 3.581 1.00 0.00 C ATOM 0 H THR A 108 6.244 -11.122 4.442 1.00 0.00 H new ATOM 0 HA THR A 108 8.892 -11.081 5.858 1.00 0.00 H new ATOM 0 HB THR A 108 8.206 -12.092 3.060 1.00 0.00 H new ATOM 0 HG1 THR A 108 9.055 -14.063 3.959 1.00 0.00 H new ATOM 0 HG21 THR A 108 10.631 -12.571 2.889 1.00 0.00 H new ATOM 0 HG22 THR A 108 10.338 -10.829 3.105 1.00 0.00 H new ATOM 0 HG23 THR A 108 10.893 -11.815 4.479 1.00 0.00 H new ATOM 1572 N ALA A 109 7.662 -9.306 3.358 1.00 0.00 N ATOM 1573 CA ALA A 109 7.782 -7.974 2.702 1.00 0.00 C ATOM 1574 C ALA A 109 7.147 -6.905 3.593 1.00 0.00 C ATOM 1575 O ALA A 109 7.662 -5.813 3.731 1.00 0.00 O ATOM 1576 CB ALA A 109 7.059 -8.005 1.356 1.00 0.00 C ATOM 0 H ALA A 109 6.902 -9.893 3.014 1.00 0.00 H new ATOM 0 HA ALA A 109 8.835 -7.740 2.548 1.00 0.00 H new ATOM 0 HB1 ALA A 109 7.145 -7.031 0.874 1.00 0.00 H new ATOM 0 HB2 ALA A 109 7.509 -8.766 0.719 1.00 0.00 H new ATOM 0 HB3 ALA A 109 6.006 -8.240 1.514 1.00 0.00 H new ATOM 1582 N ALA A 110 6.028 -7.208 4.192 1.00 0.00 N ATOM 1583 CA ALA A 110 5.358 -6.206 5.068 1.00 0.00 C ATOM 1584 C ALA A 110 6.321 -5.754 6.167 1.00 0.00 C ATOM 1585 O ALA A 110 6.118 -4.741 6.806 1.00 0.00 O ATOM 1586 CB ALA A 110 4.118 -6.840 5.703 1.00 0.00 C ATOM 0 H ALA A 110 5.549 -8.105 4.113 1.00 0.00 H new ATOM 0 HA ALA A 110 5.064 -5.342 4.472 1.00 0.00 H new ATOM 0 HB1 ALA A 110 3.625 -6.110 6.345 1.00 0.00 H new ATOM 0 HB2 ALA A 110 3.430 -7.158 4.919 1.00 0.00 H new ATOM 0 HB3 ALA A 110 4.415 -7.704 6.297 1.00 0.00 H new ATOM 1592 N ASN A 111 7.368 -6.498 6.395 1.00 0.00 N ATOM 1593 CA ASN A 111 8.340 -6.110 7.455 1.00 0.00 C ATOM 1594 C ASN A 111 9.249 -4.990 6.938 1.00 0.00 C ATOM 1595 O ASN A 111 9.494 -4.014 7.619 1.00 0.00 O ATOM 1596 CB ASN A 111 9.193 -7.322 7.832 1.00 0.00 C ATOM 1597 CG ASN A 111 8.634 -7.966 9.102 1.00 0.00 C ATOM 1598 OD1 ASN A 111 7.945 -8.966 9.040 1.00 0.00 O ATOM 1599 ND2 ASN A 111 8.902 -7.431 10.262 1.00 0.00 N ATOM 0 H ASN A 111 7.592 -7.357 5.893 1.00 0.00 H new ATOM 0 HA ASN A 111 7.796 -5.758 8.331 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.196 -8.045 7.016 1.00 0.00 H new ATOM 0 HB3 ASN A 111 10.227 -7.016 7.992 1.00 0.00 H new ATOM 0 HD21 ASN A 111 8.534 -7.852 11.115 1.00 0.00 H new ATOM 0 HD22 ASN A 111 9.480 -6.592 10.315 1.00 0.00 H new ATOM 1606 N VAL A 112 9.755 -5.124 5.742 1.00 0.00 N ATOM 1607 CA VAL A 112 10.651 -4.067 5.191 1.00 0.00 C ATOM 1608 C VAL A 112 9.835 -2.818 4.854 1.00 0.00 C ATOM 1609 O VAL A 112 10.359 -1.723 4.785 1.00 0.00 O ATOM 1610 CB VAL A 112 11.340 -4.585 3.926 1.00 0.00 C ATOM 1611 CG1 VAL A 112 10.303 -4.787 2.819 1.00 0.00 C ATOM 1612 CG2 VAL A 112 12.385 -3.567 3.465 1.00 0.00 C ATOM 0 H VAL A 112 9.587 -5.918 5.124 1.00 0.00 H new ATOM 0 HA VAL A 112 11.404 -3.813 5.937 1.00 0.00 H new ATOM 0 HB VAL A 112 11.825 -5.537 4.143 1.00 0.00 H new ATOM 0 HG11 VAL A 112 10.797 -5.156 1.920 1.00 0.00 H new ATOM 0 HG12 VAL A 112 9.558 -5.512 3.147 1.00 0.00 H new ATOM 0 HG13 VAL A 112 9.814 -3.837 2.601 1.00 0.00 H new ATOM 0 HG21 VAL A 112 12.877 -3.933 2.564 1.00 0.00 H new ATOM 0 HG22 VAL A 112 11.897 -2.616 3.251 1.00 0.00 H new ATOM 0 HG23 VAL A 112 13.126 -3.425 4.251 1.00 0.00 H new ATOM 1622 N VAL A 113 8.556 -2.967 4.641 1.00 0.00 N ATOM 1623 CA VAL A 113 7.717 -1.782 4.306 1.00 0.00 C ATOM 1624 C VAL A 113 7.557 -0.900 5.545 1.00 0.00 C ATOM 1625 O VAL A 113 7.473 0.309 5.452 1.00 0.00 O ATOM 1626 CB VAL A 113 6.339 -2.248 3.832 1.00 0.00 C ATOM 1627 CG1 VAL A 113 5.607 -1.083 3.165 1.00 0.00 C ATOM 1628 CG2 VAL A 113 6.507 -3.388 2.826 1.00 0.00 C ATOM 0 H VAL A 113 8.057 -3.856 4.684 1.00 0.00 H new ATOM 0 HA VAL A 113 8.200 -1.210 3.514 1.00 0.00 H new ATOM 0 HB VAL A 113 5.760 -2.598 4.686 1.00 0.00 H new ATOM 0 HG11 VAL A 113 4.625 -1.416 2.827 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.488 -0.270 3.881 1.00 0.00 H new ATOM 0 HG13 VAL A 113 6.185 -0.732 2.310 1.00 0.00 H new ATOM 0 HG21 VAL A 113 5.526 -3.722 2.487 1.00 0.00 H new ATOM 0 HG22 VAL A 113 7.086 -3.037 1.972 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.028 -4.219 3.301 1.00 0.00 H new ATOM 1638 N GLU A 114 7.509 -1.492 6.706 1.00 0.00 N ATOM 1639 CA GLU A 114 7.349 -0.685 7.946 1.00 0.00 C ATOM 1640 C GLU A 114 8.699 -0.089 8.358 1.00 0.00 C ATOM 1641 O GLU A 114 8.763 0.834 9.144 1.00 0.00 O ATOM 1642 CB GLU A 114 6.818 -1.576 9.071 1.00 0.00 C ATOM 1643 CG GLU A 114 5.631 -0.887 9.745 1.00 0.00 C ATOM 1644 CD GLU A 114 6.141 0.209 10.682 1.00 0.00 C ATOM 1645 OE1 GLU A 114 7.332 0.229 10.943 1.00 0.00 O ATOM 1646 OE2 GLU A 114 5.333 1.010 11.120 1.00 0.00 O ATOM 0 H GLU A 114 7.574 -2.500 6.849 1.00 0.00 H new ATOM 0 HA GLU A 114 6.643 0.124 7.758 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.513 -2.543 8.671 1.00 0.00 H new ATOM 0 HB3 GLU A 114 7.605 -1.767 9.801 1.00 0.00 H new ATOM 0 HG2 GLU A 114 4.971 -0.458 8.992 1.00 0.00 H new ATOM 0 HG3 GLU A 114 5.045 -1.615 10.305 1.00 0.00 H new ATOM 1653 N LYS A 115 9.778 -0.609 7.837 1.00 0.00 N ATOM 1654 CA LYS A 115 11.116 -0.066 8.209 1.00 0.00 C ATOM 1655 C LYS A 115 11.460 1.122 7.306 1.00 0.00 C ATOM 1656 O LYS A 115 11.685 2.222 7.774 1.00 0.00 O ATOM 1657 CB LYS A 115 12.178 -1.158 8.046 1.00 0.00 C ATOM 1658 CG LYS A 115 12.825 -1.450 9.401 1.00 0.00 C ATOM 1659 CD LYS A 115 13.934 -2.492 9.231 1.00 0.00 C ATOM 1660 CE LYS A 115 13.962 -3.416 10.451 1.00 0.00 C ATOM 1661 NZ LYS A 115 12.930 -4.479 10.295 1.00 0.00 N ATOM 0 H LYS A 115 9.791 -1.383 7.173 1.00 0.00 H new ATOM 0 HA LYS A 115 11.093 0.265 9.247 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.724 -2.064 7.646 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.936 -0.839 7.331 1.00 0.00 H new ATOM 0 HG2 LYS A 115 13.236 -0.533 9.823 1.00 0.00 H new ATOM 0 HG3 LYS A 115 12.074 -1.815 10.102 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.764 -3.074 8.325 1.00 0.00 H new ATOM 0 HD3 LYS A 115 14.898 -1.996 9.115 1.00 0.00 H new ATOM 0 HE2 LYS A 115 14.949 -3.866 10.557 1.00 0.00 H new ATOM 0 HE3 LYS A 115 13.774 -2.843 11.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 12.950 -5.106 11.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 11.990 -4.041 10.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 13.129 -5.033 9.437 1.00 0.00 H new ATOM 1675 N LEU A 116 11.511 0.914 6.019 1.00 0.00 N ATOM 1676 CA LEU A 116 11.847 2.040 5.097 1.00 0.00 C ATOM 1677 C LEU A 116 10.992 3.259 5.454 1.00 0.00 C ATOM 1678 O LEU A 116 11.438 4.386 5.371 1.00 0.00 O ATOM 1679 CB LEU A 116 11.562 1.622 3.650 1.00 0.00 C ATOM 1680 CG LEU A 116 12.848 1.120 2.982 1.00 0.00 C ATOM 1681 CD1 LEU A 116 13.964 2.152 3.156 1.00 0.00 C ATOM 1682 CD2 LEU A 116 13.274 -0.205 3.618 1.00 0.00 C ATOM 0 H LEU A 116 11.336 0.017 5.566 1.00 0.00 H new ATOM 0 HA LEU A 116 12.903 2.291 5.199 1.00 0.00 H new ATOM 0 HB2 LEU A 116 10.804 0.839 3.632 1.00 0.00 H new ATOM 0 HB3 LEU A 116 11.159 2.467 3.092 1.00 0.00 H new ATOM 0 HG LEU A 116 12.661 0.970 1.919 1.00 0.00 H new ATOM 0 HD11 LEU A 116 14.874 1.788 2.679 1.00 0.00 H new ATOM 0 HD12 LEU A 116 13.664 3.093 2.695 1.00 0.00 H new ATOM 0 HD13 LEU A 116 14.150 2.311 4.218 1.00 0.00 H new ATOM 0 HD21 LEU A 116 14.188 -0.560 3.142 1.00 0.00 H new ATOM 0 HD22 LEU A 116 13.454 -0.056 4.683 1.00 0.00 H new ATOM 0 HD23 LEU A 116 12.484 -0.944 3.483 1.00 0.00 H new ATOM 1694 N ALA A 117 9.769 3.045 5.854 1.00 0.00 N ATOM 1695 CA ALA A 117 8.893 4.196 6.217 1.00 0.00 C ATOM 1696 C ALA A 117 9.410 4.845 7.501 1.00 0.00 C ATOM 1697 O ALA A 117 9.396 6.047 7.644 1.00 0.00 O ATOM 1698 CB ALA A 117 7.461 3.707 6.442 1.00 0.00 C ATOM 0 H ALA A 117 9.338 2.125 5.945 1.00 0.00 H new ATOM 0 HA ALA A 117 8.904 4.924 5.406 1.00 0.00 H new ATOM 0 HB1 ALA A 117 6.825 4.552 6.707 1.00 0.00 H new ATOM 0 HB2 ALA A 117 7.087 3.244 5.529 1.00 0.00 H new ATOM 0 HB3 ALA A 117 7.449 2.976 7.251 1.00 0.00 H new ATOM 1704 N ASP A 118 9.859 4.056 8.439 1.00 0.00 N ATOM 1705 CA ASP A 118 10.372 4.631 9.715 1.00 0.00 C ATOM 1706 C ASP A 118 11.427 5.698 9.409 1.00 0.00 C ATOM 1707 O ASP A 118 11.550 6.682 10.110 1.00 0.00 O ATOM 1708 CB ASP A 118 11.005 3.521 10.554 1.00 0.00 C ATOM 1709 CG ASP A 118 10.347 3.488 11.935 1.00 0.00 C ATOM 1710 OD1 ASP A 118 9.766 4.490 12.316 1.00 0.00 O ATOM 1711 OD2 ASP A 118 10.437 2.461 12.586 1.00 0.00 O ATOM 0 H ASP A 118 9.893 3.038 8.377 1.00 0.00 H new ATOM 0 HA ASP A 118 9.547 5.082 10.266 1.00 0.00 H new ATOM 0 HB2 ASP A 118 10.881 2.559 10.057 1.00 0.00 H new ATOM 0 HB3 ASP A 118 12.077 3.692 10.654 1.00 0.00 H new ATOM 1716 N TYR A 119 12.187 5.510 8.366 1.00 0.00 N ATOM 1717 CA TYR A 119 13.231 6.512 8.013 1.00 0.00 C ATOM 1718 C TYR A 119 12.558 7.740 7.399 1.00 0.00 C ATOM 1719 O TYR A 119 12.687 8.844 7.889 1.00 0.00 O ATOM 1720 CB TYR A 119 14.196 5.900 6.996 1.00 0.00 C ATOM 1721 CG TYR A 119 14.661 4.553 7.491 1.00 0.00 C ATOM 1722 CD1 TYR A 119 13.909 3.410 7.201 1.00 0.00 C ATOM 1723 CD2 TYR A 119 15.842 4.446 8.232 1.00 0.00 C ATOM 1724 CE1 TYR A 119 14.341 2.157 7.655 1.00 0.00 C ATOM 1725 CE2 TYR A 119 16.274 3.195 8.686 1.00 0.00 C ATOM 1726 CZ TYR A 119 15.522 2.050 8.397 1.00 0.00 C ATOM 1727 OH TYR A 119 15.948 0.815 8.843 1.00 0.00 O ATOM 0 H TYR A 119 12.130 4.705 7.742 1.00 0.00 H new ATOM 0 HA TYR A 119 13.781 6.803 8.908 1.00 0.00 H new ATOM 0 HB2 TYR A 119 13.703 5.794 6.029 1.00 0.00 H new ATOM 0 HB3 TYR A 119 15.051 6.560 6.847 1.00 0.00 H new ATOM 0 HD1 TYR A 119 12.997 3.493 6.628 1.00 0.00 H new ATOM 0 HD2 TYR A 119 16.421 5.330 8.454 1.00 0.00 H new ATOM 0 HE1 TYR A 119 13.762 1.273 7.432 1.00 0.00 H new ATOM 0 HE2 TYR A 119 17.186 3.113 9.258 1.00 0.00 H new ATOM 0 HH TYR A 119 16.786 0.918 9.341 1.00 0.00 H new ATOM 1737 N LEU A 120 11.839 7.551 6.327 1.00 0.00 N ATOM 1738 CA LEU A 120 11.151 8.681 5.664 1.00 0.00 C ATOM 1739 C LEU A 120 9.954 9.149 6.507 1.00 0.00 C ATOM 1740 O LEU A 120 9.232 10.048 6.122 1.00 0.00 O ATOM 1741 CB LEU A 120 10.669 8.195 4.301 1.00 0.00 C ATOM 1742 CG LEU A 120 9.717 7.010 4.477 1.00 0.00 C ATOM 1743 CD1 LEU A 120 8.330 7.518 4.859 1.00 0.00 C ATOM 1744 CD2 LEU A 120 9.628 6.231 3.164 1.00 0.00 C ATOM 0 H LEU A 120 11.700 6.645 5.880 1.00 0.00 H new ATOM 0 HA LEU A 120 11.833 9.524 5.553 1.00 0.00 H new ATOM 0 HB2 LEU A 120 10.163 9.004 3.775 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.521 7.900 3.688 1.00 0.00 H new ATOM 0 HG LEU A 120 10.093 6.358 5.265 1.00 0.00 H new ATOM 0 HD11 LEU A 120 7.654 6.672 4.984 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.391 8.074 5.794 1.00 0.00 H new ATOM 0 HD13 LEU A 120 7.952 8.171 4.072 1.00 0.00 H new ATOM 0 HD21 LEU A 120 8.950 5.386 3.287 1.00 0.00 H new ATOM 0 HD22 LEU A 120 9.253 6.886 2.377 1.00 0.00 H new ATOM 0 HD23 LEU A 120 10.618 5.865 2.890 1.00 0.00 H new ATOM 1756 N ILE A 121 9.743 8.558 7.651 1.00 0.00 N ATOM 1757 CA ILE A 121 8.601 8.980 8.510 1.00 0.00 C ATOM 1758 C ILE A 121 9.068 10.108 9.436 1.00 0.00 C ATOM 1759 O ILE A 121 8.280 10.902 9.909 1.00 0.00 O ATOM 1760 CB ILE A 121 8.108 7.773 9.332 1.00 0.00 C ATOM 1761 CG1 ILE A 121 7.052 7.013 8.525 1.00 0.00 C ATOM 1762 CG2 ILE A 121 7.487 8.238 10.655 1.00 0.00 C ATOM 1763 CD1 ILE A 121 6.780 5.655 9.177 1.00 0.00 C ATOM 0 H ILE A 121 10.313 7.801 8.028 1.00 0.00 H new ATOM 0 HA ILE A 121 7.777 9.342 7.895 1.00 0.00 H new ATOM 0 HB ILE A 121 8.958 7.126 9.549 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.131 7.594 8.476 1.00 0.00 H new ATOM 0 HG13 ILE A 121 7.396 6.872 7.500 1.00 0.00 H new ATOM 0 HG21 ILE A 121 7.145 7.371 11.221 1.00 0.00 H new ATOM 0 HG22 ILE A 121 8.233 8.780 11.236 1.00 0.00 H new ATOM 0 HG23 ILE A 121 6.641 8.894 10.449 1.00 0.00 H new ATOM 0 HD11 ILE A 121 6.028 5.118 8.599 1.00 0.00 H new ATOM 0 HD12 ILE A 121 7.701 5.073 9.203 1.00 0.00 H new ATOM 0 HD13 ILE A 121 6.417 5.806 10.194 1.00 0.00 H new ATOM 1775 N GLY A 122 10.344 10.186 9.693 1.00 0.00 N ATOM 1776 CA GLY A 122 10.855 11.263 10.584 1.00 0.00 C ATOM 1777 C GLY A 122 10.404 12.620 10.043 1.00 0.00 C ATOM 1778 O GLY A 122 10.198 13.560 10.786 1.00 0.00 O ATOM 0 H GLY A 122 11.053 9.552 9.325 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.482 11.120 11.598 1.00 0.00 H new ATOM 0 HA3 GLY A 122 11.943 11.222 10.636 1.00 0.00 H new ATOM 1782 N GLN A 123 10.246 12.727 8.752 1.00 0.00 N ATOM 1783 CA GLN A 123 9.809 14.020 8.158 1.00 0.00 C ATOM 1784 C GLN A 123 8.285 14.031 8.026 1.00 0.00 C ATOM 1785 O GLN A 123 7.591 14.673 8.789 1.00 0.00 O ATOM 1786 CB GLN A 123 10.443 14.179 6.774 1.00 0.00 C ATOM 1787 CG GLN A 123 11.786 14.901 6.904 1.00 0.00 C ATOM 1788 CD GLN A 123 11.541 16.396 7.119 1.00 0.00 C ATOM 1789 OE1 GLN A 123 11.808 16.922 8.180 1.00 0.00 O ATOM 1790 NE2 GLN A 123 11.038 17.107 6.147 1.00 0.00 N ATOM 0 H GLN A 123 10.401 11.973 8.083 1.00 0.00 H new ATOM 0 HA GLN A 123 10.122 14.843 8.800 1.00 0.00 H new ATOM 0 HB2 GLN A 123 10.587 13.201 6.315 1.00 0.00 H new ATOM 0 HB3 GLN A 123 9.777 14.743 6.121 1.00 0.00 H new ATOM 0 HG2 GLN A 123 12.353 14.490 7.740 1.00 0.00 H new ATOM 0 HG3 GLN A 123 12.384 14.745 6.006 1.00 0.00 H new ATOM 0 HE21 GLN A 123 10.814 16.665 5.255 1.00 0.00 H new ATOM 0 HE22 GLN A 123 10.869 18.104 6.279 1.00 0.00 H new ATOM 1799 N GLY A 124 7.760 13.325 7.063 1.00 0.00 N ATOM 1800 CA GLY A 124 6.281 13.296 6.881 1.00 0.00 C ATOM 1801 C GLY A 124 5.945 13.531 5.408 1.00 0.00 C ATOM 1802 O GLY A 124 4.972 14.181 5.079 1.00 0.00 O ATOM 0 H GLY A 124 8.291 12.767 6.394 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.882 12.335 7.207 1.00 0.00 H new ATOM 0 HA3 GLY A 124 5.813 14.062 7.499 1.00 0.00 H new ATOM 1806 N PHE A 125 6.746 13.009 4.519 1.00 0.00 N ATOM 1807 CA PHE A 125 6.481 13.200 3.066 1.00 0.00 C ATOM 1808 C PHE A 125 6.061 14.649 2.809 1.00 0.00 C ATOM 1809 O PHE A 125 5.387 14.884 1.819 1.00 0.00 O ATOM 1810 CB PHE A 125 5.365 12.253 2.617 1.00 0.00 C ATOM 1811 CG PHE A 125 5.954 10.895 2.320 1.00 0.00 C ATOM 1812 CD1 PHE A 125 6.978 10.769 1.374 1.00 0.00 C ATOM 1813 CD2 PHE A 125 5.477 9.762 2.990 1.00 0.00 C ATOM 1814 CE1 PHE A 125 7.527 9.511 1.098 1.00 0.00 C ATOM 1815 CE2 PHE A 125 6.025 8.504 2.712 1.00 0.00 C ATOM 1816 CZ PHE A 125 7.049 8.378 1.768 1.00 0.00 C ATOM 1817 OXT PHE A 125 6.419 15.498 3.608 1.00 0.00 O ATOM 0 H PHE A 125 7.575 12.457 4.738 1.00 0.00 H new ATOM 0 HA PHE A 125 7.387 12.980 2.501 1.00 0.00 H new ATOM 0 HB2 PHE A 125 4.606 12.171 3.395 1.00 0.00 H new ATOM 0 HB3 PHE A 125 4.870 12.650 1.730 1.00 0.00 H new ATOM 0 HD1 PHE A 125 7.345 11.643 0.857 1.00 0.00 H new ATOM 0 HD2 PHE A 125 4.687 9.858 3.720 1.00 0.00 H new ATOM 0 HE1 PHE A 125 8.318 9.414 0.369 1.00 0.00 H new ATOM 0 HE2 PHE A 125 5.656 7.629 3.227 1.00 0.00 H new ATOM 0 HZ PHE A 125 7.471 7.407 1.556 1.00 0.00 H new