USER MOD reduce.3.24.130724 H: found=0, std=0, add=920, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 918 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 116 TYR OH : rot 180:sc= -0.468 USER MOD Set 1.2: A 117 GLN : amide:sc= -2.73! C(o=-3.2!,f=-2.9!) USER MOD Set 2.1: A 109 HIS : no HD1:sc= -3.48! C(o=-3.4!,f=-4.7!) USER MOD Set 2.2: A 110 GLN : amide:sc= 0.13 K(o=-3.4,f=-1.4) USER MOD Set 3.1: A 68 GLN : amide:sc= -4.24! C(o=-5!,f=-3.1!) USER MOD Set 3.2: A 69 GLN : amide:sc= -0.758 K(o=-5,f=-3.1) USER MOD Set 4.1: A 46 THR OG1 : rot 180:sc= -1.07 USER MOD Set 4.2: A 47 HIS : no HD1:sc= -2.95 K(o=-4,f=-3.1!) USER MOD Set 5.1: A 8 CYS SG : rot 152:sc= -0.437! USER MOD Set 5.2: A 34 CYS SG : rot 104:sc= -0.185 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 102:sc= 0.0414 USER MOD Single : A 18 GLN : amide:sc= -0.205 X(o=-0.21,f=0) USER MOD Single : A 20 CYS SG : rot 79:sc= -4.13! USER MOD Single : A 21 GLN : amide:sc= -4.61! C(o=-4.6!,f=-6.5!) USER MOD Single : A 25 SER OG : rot -52:sc= 0.107 USER MOD Single : A 29 TYR OH : rot 70:sc= -2.56! USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 GLN : amide:sc= 0 K(o=0,f=0.78) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 MET CE :methyl -127:sc= -0.109 (180deg=-0.743) USER MOD Single : A 43 TYR OH : rot 130:sc= -1.19 USER MOD Single : A 45 GLN : amide:sc= -1.15 K(o=-1.2,f=-3.1!) USER MOD Single : A 50 GLN : amide:sc= -0.0465 X(o=-0.047,f=-0.047) USER MOD Single : A 53 CYS SG : rot 6:sc= -1.57! USER MOD Single : A 60 ASN : amide:sc= 0.636 K(o=0.64,f=-2!) USER MOD Single : A 62 SER OG : rot 180:sc= 0.0114 USER MOD Single : A 71 CYS SG : rot 32:sc= -5.4! USER MOD Single : A 99 TYR OH : rot -14:sc= 0.862 USER MOD Single : A 100 HIS : no HD1:sc= -16.3! C(o=-16!,f=-27!) USER MOD Single : A 101 SER OG : rot 180:sc= -0.019 USER MOD Single : A 105 HIS : no HE2:sc= -1.54 X(o=-1.5,f=-1.2) USER MOD Single : A 113 GLN : amide:sc= -0.872 K(o=-0.87,f=-2.2!) USER MOD Single : A 133 THR OG1 : rot 150:sc= 0.062 USER MOD Single : A 134 MET CE :methyl -159:sc= -0.0742 (180deg=-0.704) USER MOD ----------------------------------------------------------------- ATOM 50 N GLN A 4 4.053 5.010 15.754 1.00 0.00 N ATOM 51 CA GLN A 4 4.628 4.133 14.696 1.00 0.00 C ATOM 52 C GLN A 4 3.636 3.956 13.544 1.00 0.00 C ATOM 53 O GLN A 4 2.437 4.069 13.714 1.00 0.00 O ATOM 54 CB GLN A 4 4.912 2.794 15.381 1.00 0.00 C ATOM 55 CG GLN A 4 5.929 3.008 16.506 1.00 0.00 C ATOM 56 CD GLN A 4 6.658 1.695 16.804 1.00 0.00 C ATOM 57 OE1 GLN A 4 6.050 0.644 16.848 1.00 0.00 O ATOM 58 NE2 GLN A 4 7.947 1.713 17.012 1.00 0.00 N ATOM 0 HA GLN A 4 5.533 4.561 14.264 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.990 2.375 15.784 1.00 0.00 H new ATOM 0 HB3 GLN A 4 5.298 2.077 14.657 1.00 0.00 H new ATOM 0 HG2 GLN A 4 6.647 3.776 16.218 1.00 0.00 H new ATOM 0 HG3 GLN A 4 5.423 3.365 17.403 1.00 0.00 H new ATOM 0 HE21 GLN A 4 8.457 2.595 16.975 1.00 0.00 H new ATOM 0 HE22 GLN A 4 8.444 0.845 17.211 1.00 0.00 H new ATOM 67 N ILE A 5 4.137 3.682 12.373 1.00 0.00 N ATOM 68 CA ILE A 5 3.251 3.496 11.189 1.00 0.00 C ATOM 69 C ILE A 5 3.276 2.032 10.739 1.00 0.00 C ATOM 70 O ILE A 5 4.323 1.417 10.678 1.00 0.00 O ATOM 71 CB ILE A 5 3.868 4.384 10.106 1.00 0.00 C ATOM 72 CG1 ILE A 5 3.891 5.840 10.577 1.00 0.00 C ATOM 73 CG2 ILE A 5 3.041 4.279 8.826 1.00 0.00 C ATOM 74 CD1 ILE A 5 4.527 6.718 9.496 1.00 0.00 C ATOM 0 H ILE A 5 5.134 3.578 12.183 1.00 0.00 H new ATOM 0 HA ILE A 5 2.213 3.753 11.401 1.00 0.00 H new ATOM 0 HB ILE A 5 4.888 4.052 9.911 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.877 6.181 10.787 1.00 0.00 H new ATOM 0 HG13 ILE A 5 4.455 5.924 11.506 1.00 0.00 H new ATOM 0 HG21 ILE A 5 3.481 4.912 8.055 1.00 0.00 H new ATOM 0 HG22 ILE A 5 3.030 3.244 8.484 1.00 0.00 H new ATOM 0 HG23 ILE A 5 2.020 4.606 9.024 1.00 0.00 H new ATOM 0 HD11 ILE A 5 4.543 7.755 9.832 1.00 0.00 H new ATOM 0 HD12 ILE A 5 5.547 6.382 9.308 1.00 0.00 H new ATOM 0 HD13 ILE A 5 3.945 6.643 8.578 1.00 0.00 H new ATOM 86 N ALA A 6 2.144 1.461 10.413 1.00 0.00 N ATOM 87 CA ALA A 6 2.142 0.048 9.963 1.00 0.00 C ATOM 88 C ALA A 6 2.232 -0.014 8.442 1.00 0.00 C ATOM 89 O ALA A 6 1.288 0.280 7.735 1.00 0.00 O ATOM 90 CB ALA A 6 0.816 -0.519 10.439 1.00 0.00 C ATOM 0 H ALA A 6 1.230 1.913 10.441 1.00 0.00 H new ATOM 0 HA ALA A 6 2.988 -0.513 10.359 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.740 -1.565 10.143 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.757 -0.444 11.525 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -0.002 0.045 9.992 1.00 0.00 H new ATOM 96 N ILE A 7 3.365 -0.391 7.939 1.00 0.00 N ATOM 97 CA ILE A 7 3.531 -0.470 6.461 1.00 0.00 C ATOM 98 C ILE A 7 3.820 -1.909 6.035 1.00 0.00 C ATOM 99 O ILE A 7 4.709 -2.556 6.553 1.00 0.00 O ATOM 100 CB ILE A 7 4.724 0.434 6.159 1.00 0.00 C ATOM 101 CG1 ILE A 7 4.427 1.840 6.677 1.00 0.00 C ATOM 102 CG2 ILE A 7 4.969 0.494 4.651 1.00 0.00 C ATOM 103 CD1 ILE A 7 5.485 2.810 6.154 1.00 0.00 C ATOM 0 H ILE A 7 4.188 -0.649 8.484 1.00 0.00 H new ATOM 0 HA ILE A 7 2.635 -0.161 5.923 1.00 0.00 H new ATOM 0 HB ILE A 7 5.612 0.034 6.648 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.436 2.157 6.352 1.00 0.00 H new ATOM 0 HG13 ILE A 7 4.422 1.844 7.767 1.00 0.00 H new ATOM 0 HG21 ILE A 7 5.822 1.141 4.446 1.00 0.00 H new ATOM 0 HG22 ILE A 7 5.176 -0.508 4.276 1.00 0.00 H new ATOM 0 HG23 ILE A 7 4.084 0.892 4.154 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.273 3.813 6.524 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.470 2.496 6.501 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.468 2.814 5.064 1.00 0.00 H new ATOM 115 N CYS A 8 3.076 -2.415 5.095 1.00 0.00 N ATOM 116 CA CYS A 8 3.308 -3.810 4.636 1.00 0.00 C ATOM 117 C CYS A 8 3.754 -3.810 3.172 1.00 0.00 C ATOM 118 O CYS A 8 3.046 -3.346 2.300 1.00 0.00 O ATOM 119 CB CYS A 8 1.952 -4.495 4.781 1.00 0.00 C ATOM 120 SG CYS A 8 2.155 -6.282 4.601 1.00 0.00 S ATOM 0 H CYS A 8 2.317 -1.923 4.624 1.00 0.00 H new ATOM 0 HA CYS A 8 4.086 -4.316 5.207 1.00 0.00 H new ATOM 0 HB2 CYS A 8 1.518 -4.264 5.754 1.00 0.00 H new ATOM 0 HB3 CYS A 8 1.261 -4.119 4.027 1.00 0.00 H new ATOM 0 HG CYS A 8 1.228 -6.894 5.276 1.00 0.00 H new ATOM 126 N ILE A 9 4.922 -4.318 2.893 1.00 0.00 N ATOM 127 CA ILE A 9 5.399 -4.330 1.482 1.00 0.00 C ATOM 128 C ILE A 9 5.415 -5.746 0.925 1.00 0.00 C ATOM 129 O ILE A 9 5.591 -6.712 1.641 1.00 0.00 O ATOM 130 CB ILE A 9 6.824 -3.792 1.539 1.00 0.00 C ATOM 131 CG1 ILE A 9 7.389 -3.674 0.109 1.00 0.00 C ATOM 132 CG2 ILE A 9 7.685 -4.741 2.370 1.00 0.00 C ATOM 133 CD1 ILE A 9 8.012 -4.995 -0.343 1.00 0.00 C ATOM 0 H ILE A 9 5.563 -4.723 3.575 1.00 0.00 H new ATOM 0 HA ILE A 9 4.749 -3.738 0.838 1.00 0.00 H new ATOM 0 HB ILE A 9 6.829 -2.805 2.001 1.00 0.00 H new ATOM 0 HG12 ILE A 9 6.593 -3.389 -0.578 1.00 0.00 H new ATOM 0 HG13 ILE A 9 8.138 -2.883 0.074 1.00 0.00 H new ATOM 0 HG21 ILE A 9 8.706 -4.361 2.414 1.00 0.00 H new ATOM 0 HG22 ILE A 9 7.279 -4.811 3.379 1.00 0.00 H new ATOM 0 HG23 ILE A 9 7.685 -5.729 1.910 1.00 0.00 H new ATOM 0 HD11 ILE A 9 8.403 -4.886 -1.355 1.00 0.00 H new ATOM 0 HD12 ILE A 9 8.824 -5.265 0.333 1.00 0.00 H new ATOM 0 HD13 ILE A 9 7.254 -5.778 -0.330 1.00 0.00 H new ATOM 145 N TRP A 10 5.267 -5.865 -0.359 1.00 0.00 N ATOM 146 CA TRP A 10 5.311 -7.210 -0.989 1.00 0.00 C ATOM 147 C TRP A 10 6.291 -7.184 -2.156 1.00 0.00 C ATOM 148 O TRP A 10 6.017 -6.623 -3.198 1.00 0.00 O ATOM 149 CB TRP A 10 3.899 -7.508 -1.493 1.00 0.00 C ATOM 150 CG TRP A 10 3.970 -8.658 -2.449 1.00 0.00 C ATOM 151 CD1 TRP A 10 4.924 -9.621 -2.429 1.00 0.00 C ATOM 152 CD2 TRP A 10 3.095 -8.974 -3.567 1.00 0.00 C ATOM 153 NE1 TRP A 10 4.686 -10.510 -3.464 1.00 0.00 N ATOM 154 CE2 TRP A 10 3.569 -10.153 -4.192 1.00 0.00 C ATOM 155 CE3 TRP A 10 1.948 -8.361 -4.096 1.00 0.00 C ATOM 156 CZ2 TRP A 10 2.925 -10.703 -5.298 1.00 0.00 C ATOM 157 CZ3 TRP A 10 1.297 -8.912 -5.210 1.00 0.00 C ATOM 158 CH2 TRP A 10 1.786 -10.080 -5.811 1.00 0.00 C ATOM 0 H TRP A 10 5.117 -5.088 -1.003 1.00 0.00 H new ATOM 0 HA TRP A 10 5.637 -7.974 -0.284 1.00 0.00 H new ATOM 0 HB2 TRP A 10 3.242 -7.749 -0.658 1.00 0.00 H new ATOM 0 HB3 TRP A 10 3.479 -6.631 -1.986 1.00 0.00 H new ATOM 0 HD1 TRP A 10 5.737 -9.685 -1.721 1.00 0.00 H new ATOM 0 HE1 TRP A 10 5.264 -11.326 -3.663 1.00 0.00 H new ATOM 0 HE3 TRP A 10 1.564 -7.459 -3.642 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 3.304 -11.605 -5.755 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 0.414 -8.433 -5.607 1.00 0.00 H new ATOM 0 HH2 TRP A 10 1.282 -10.498 -6.670 1.00 0.00 H new ATOM 169 N VAL A 11 7.425 -7.786 -1.994 1.00 0.00 N ATOM 170 CA VAL A 11 8.417 -7.797 -3.094 1.00 0.00 C ATOM 171 C VAL A 11 9.242 -9.081 -3.019 1.00 0.00 C ATOM 172 O VAL A 11 9.802 -9.409 -1.991 1.00 0.00 O ATOM 173 CB VAL A 11 9.282 -6.567 -2.834 1.00 0.00 C ATOM 174 CG1 VAL A 11 9.965 -6.715 -1.480 1.00 0.00 C ATOM 175 CG2 VAL A 11 10.344 -6.443 -3.921 1.00 0.00 C ATOM 0 H VAL A 11 7.711 -8.273 -1.145 1.00 0.00 H new ATOM 0 HA VAL A 11 7.966 -7.769 -4.086 1.00 0.00 H new ATOM 0 HB VAL A 11 8.655 -5.675 -2.840 1.00 0.00 H new ATOM 0 HG11 VAL A 11 10.585 -5.839 -1.288 1.00 0.00 H new ATOM 0 HG12 VAL A 11 9.210 -6.803 -0.699 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.590 -7.608 -1.483 1.00 0.00 H new ATOM 0 HG21 VAL A 11 10.959 -5.563 -3.730 1.00 0.00 H new ATOM 0 HG22 VAL A 11 10.973 -7.333 -3.918 1.00 0.00 H new ATOM 0 HG23 VAL A 11 9.860 -6.344 -4.893 1.00 0.00 H new ATOM 185 N GLU A 12 9.317 -9.813 -4.092 1.00 0.00 N ATOM 186 CA GLU A 12 10.104 -11.079 -4.069 1.00 0.00 C ATOM 187 C GLU A 12 11.599 -10.766 -4.179 1.00 0.00 C ATOM 188 O GLU A 12 12.433 -11.648 -4.155 1.00 0.00 O ATOM 189 CB GLU A 12 9.611 -11.874 -5.277 1.00 0.00 C ATOM 190 CG GLU A 12 8.137 -12.231 -5.089 1.00 0.00 C ATOM 191 CD GLU A 12 7.697 -13.165 -6.219 1.00 0.00 C ATOM 192 OE1 GLU A 12 8.483 -13.371 -7.129 1.00 0.00 O ATOM 193 OE2 GLU A 12 6.582 -13.657 -6.153 1.00 0.00 O ATOM 0 H GLU A 12 8.870 -9.593 -4.982 1.00 0.00 H new ATOM 0 HA GLU A 12 9.972 -11.641 -3.144 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.741 -11.289 -6.188 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.203 -12.781 -5.394 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.988 -12.714 -4.123 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.528 -11.327 -5.091 1.00 0.00 H new ATOM 200 N SER A 13 11.938 -9.512 -4.289 1.00 0.00 N ATOM 201 CA SER A 13 13.372 -9.129 -4.388 1.00 0.00 C ATOM 202 C SER A 13 13.849 -8.608 -3.031 1.00 0.00 C ATOM 203 O SER A 13 13.381 -7.594 -2.548 1.00 0.00 O ATOM 204 CB SER A 13 13.413 -8.020 -5.439 1.00 0.00 C ATOM 205 OG SER A 13 14.735 -7.894 -5.949 1.00 0.00 O ATOM 0 H SER A 13 11.280 -8.733 -4.315 1.00 0.00 H new ATOM 0 HA SER A 13 14.017 -9.963 -4.662 1.00 0.00 H new ATOM 0 HB2 SER A 13 12.720 -8.247 -6.249 1.00 0.00 H new ATOM 0 HB3 SER A 13 13.091 -7.076 -4.999 1.00 0.00 H new ATOM 0 HG SER A 13 14.759 -7.184 -6.624 1.00 0.00 H new ATOM 211 N THR A 14 14.766 -9.288 -2.405 1.00 0.00 N ATOM 212 CA THR A 14 15.248 -8.811 -1.082 1.00 0.00 C ATOM 213 C THR A 14 15.874 -7.427 -1.243 1.00 0.00 C ATOM 214 O THR A 14 15.742 -6.572 -0.388 1.00 0.00 O ATOM 215 CB THR A 14 16.292 -9.832 -0.637 1.00 0.00 C ATOM 216 OG1 THR A 14 15.808 -11.146 -0.892 1.00 0.00 O ATOM 217 CG2 THR A 14 16.565 -9.673 0.860 1.00 0.00 C ATOM 0 H THR A 14 15.199 -10.145 -2.748 1.00 0.00 H new ATOM 0 HA THR A 14 14.446 -8.724 -0.349 1.00 0.00 H new ATOM 0 HB THR A 14 17.216 -9.668 -1.192 1.00 0.00 H new ATOM 0 HG1 THR A 14 16.230 -11.499 -1.703 1.00 0.00 H new ATOM 0 HG21 THR A 14 17.311 -10.404 1.173 1.00 0.00 H new ATOM 0 HG22 THR A 14 16.937 -8.668 1.057 1.00 0.00 H new ATOM 0 HG23 THR A 14 15.642 -9.834 1.417 1.00 0.00 H new ATOM 225 N ALA A 15 16.548 -7.194 -2.340 1.00 0.00 N ATOM 226 CA ALA A 15 17.169 -5.859 -2.559 1.00 0.00 C ATOM 227 C ALA A 15 16.077 -4.789 -2.548 1.00 0.00 C ATOM 228 O ALA A 15 16.170 -3.809 -1.837 1.00 0.00 O ATOM 229 CB ALA A 15 17.843 -5.948 -3.930 1.00 0.00 C ATOM 0 H ALA A 15 16.693 -7.870 -3.090 1.00 0.00 H new ATOM 0 HA ALA A 15 17.890 -5.593 -1.786 1.00 0.00 H new ATOM 0 HB1 ALA A 15 18.324 -4.998 -4.161 1.00 0.00 H new ATOM 0 HB2 ALA A 15 18.592 -6.740 -3.917 1.00 0.00 H new ATOM 0 HB3 ALA A 15 17.094 -6.170 -4.690 1.00 0.00 H new ATOM 235 N ILE A 16 15.024 -4.979 -3.300 1.00 0.00 N ATOM 236 CA ILE A 16 13.925 -3.977 -3.280 1.00 0.00 C ATOM 237 C ILE A 16 13.286 -3.999 -1.898 1.00 0.00 C ATOM 238 O ILE A 16 12.990 -2.975 -1.318 1.00 0.00 O ATOM 239 CB ILE A 16 12.921 -4.423 -4.342 1.00 0.00 C ATOM 240 CG1 ILE A 16 13.519 -4.223 -5.737 1.00 0.00 C ATOM 241 CG2 ILE A 16 11.652 -3.581 -4.215 1.00 0.00 C ATOM 242 CD1 ILE A 16 12.717 -5.034 -6.756 1.00 0.00 C ATOM 0 H ILE A 16 14.881 -5.776 -3.920 1.00 0.00 H new ATOM 0 HA ILE A 16 14.274 -2.965 -3.486 1.00 0.00 H new ATOM 0 HB ILE A 16 12.686 -5.477 -4.198 1.00 0.00 H new ATOM 0 HG12 ILE A 16 13.503 -3.166 -6.003 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.562 -4.538 -5.746 1.00 0.00 H new ATOM 0 HG21 ILE A 16 10.931 -3.894 -4.970 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.222 -3.719 -3.223 1.00 0.00 H new ATOM 0 HG23 ILE A 16 11.897 -2.529 -4.361 1.00 0.00 H new ATOM 0 HD11 ILE A 16 13.142 -4.892 -7.750 1.00 0.00 H new ATOM 0 HD12 ILE A 16 12.756 -6.091 -6.492 1.00 0.00 H new ATOM 0 HD13 ILE A 16 11.680 -4.698 -6.754 1.00 0.00 H new ATOM 254 N LEU A 17 13.100 -5.169 -1.350 1.00 0.00 N ATOM 255 CA LEU A 17 12.515 -5.251 0.008 1.00 0.00 C ATOM 256 C LEU A 17 13.387 -4.432 0.953 1.00 0.00 C ATOM 257 O LEU A 17 12.906 -3.659 1.757 1.00 0.00 O ATOM 258 CB LEU A 17 12.563 -6.739 0.375 1.00 0.00 C ATOM 259 CG LEU A 17 12.497 -6.917 1.895 1.00 0.00 C ATOM 260 CD1 LEU A 17 13.900 -6.750 2.475 1.00 0.00 C ATOM 261 CD2 LEU A 17 11.553 -5.876 2.515 1.00 0.00 C ATOM 0 H LEU A 17 13.328 -6.063 -1.785 1.00 0.00 H new ATOM 0 HA LEU A 17 11.497 -4.866 0.067 1.00 0.00 H new ATOM 0 HB2 LEU A 17 11.731 -7.263 -0.095 1.00 0.00 H new ATOM 0 HB3 LEU A 17 13.480 -7.186 -0.010 1.00 0.00 H new ATOM 0 HG LEU A 17 12.115 -7.912 2.125 1.00 0.00 H new ATOM 0 HD11 LEU A 17 13.864 -6.875 3.557 1.00 0.00 H new ATOM 0 HD12 LEU A 17 14.563 -7.501 2.045 1.00 0.00 H new ATOM 0 HD13 LEU A 17 14.276 -5.755 2.237 1.00 0.00 H new ATOM 0 HD21 LEU A 17 11.517 -6.016 3.595 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.919 -4.874 2.291 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.553 -5.999 2.100 1.00 0.00 H new ATOM 273 N GLN A 18 14.678 -4.589 0.842 1.00 0.00 N ATOM 274 CA GLN A 18 15.606 -3.812 1.714 1.00 0.00 C ATOM 275 C GLN A 18 15.525 -2.326 1.382 1.00 0.00 C ATOM 276 O GLN A 18 15.380 -1.492 2.254 1.00 0.00 O ATOM 277 CB GLN A 18 17.005 -4.328 1.385 1.00 0.00 C ATOM 278 CG GLN A 18 17.231 -5.700 2.017 1.00 0.00 C ATOM 279 CD GLN A 18 18.701 -6.089 1.844 1.00 0.00 C ATOM 280 OE1 GLN A 18 19.560 -5.585 2.541 1.00 0.00 O ATOM 281 NE2 GLN A 18 19.027 -6.962 0.931 1.00 0.00 N ATOM 0 H GLN A 18 15.131 -5.223 0.184 1.00 0.00 H new ATOM 0 HA GLN A 18 15.356 -3.932 2.768 1.00 0.00 H new ATOM 0 HB2 GLN A 18 17.130 -4.394 0.304 1.00 0.00 H new ATOM 0 HB3 GLN A 18 17.754 -3.625 1.750 1.00 0.00 H new ATOM 0 HG2 GLN A 18 16.970 -5.675 3.075 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.587 -6.443 1.546 1.00 0.00 H new ATOM 0 HE21 GLN A 18 18.304 -7.384 0.347 1.00 0.00 H new ATOM 0 HE22 GLN A 18 20.004 -7.223 0.801 1.00 0.00 H new ATOM 290 N ASP A 19 15.630 -1.984 0.126 1.00 0.00 N ATOM 291 CA ASP A 19 15.573 -0.547 -0.256 1.00 0.00 C ATOM 292 C ASP A 19 14.244 0.065 0.196 1.00 0.00 C ATOM 293 O ASP A 19 14.203 1.159 0.722 1.00 0.00 O ATOM 294 CB ASP A 19 15.682 -0.538 -1.781 1.00 0.00 C ATOM 295 CG ASP A 19 16.977 -1.236 -2.208 1.00 0.00 C ATOM 296 OD1 ASP A 19 17.712 -1.667 -1.336 1.00 0.00 O ATOM 297 OD2 ASP A 19 17.211 -1.325 -3.402 1.00 0.00 O ATOM 0 H ASP A 19 15.752 -2.636 -0.648 1.00 0.00 H new ATOM 0 HA ASP A 19 16.366 0.039 0.210 1.00 0.00 H new ATOM 0 HB2 ASP A 19 14.822 -1.044 -2.220 1.00 0.00 H new ATOM 0 HB3 ASP A 19 15.671 0.487 -2.150 1.00 0.00 H new ATOM 302 N CYS A 20 13.160 -0.637 0.002 1.00 0.00 N ATOM 303 CA CYS A 20 11.839 -0.095 0.429 1.00 0.00 C ATOM 304 C CYS A 20 11.812 0.095 1.947 1.00 0.00 C ATOM 305 O CYS A 20 11.333 1.093 2.448 1.00 0.00 O ATOM 306 CB CYS A 20 10.814 -1.153 0.013 1.00 0.00 C ATOM 307 SG CYS A 20 10.627 -1.149 -1.788 1.00 0.00 S ATOM 0 H CYS A 20 13.132 -1.559 -0.432 1.00 0.00 H new ATOM 0 HA CYS A 20 11.632 0.875 -0.023 1.00 0.00 H new ATOM 0 HB2 CYS A 20 11.136 -2.138 0.352 1.00 0.00 H new ATOM 0 HB3 CYS A 20 9.854 -0.950 0.488 1.00 0.00 H new ATOM 0 HG CYS A 20 11.624 -1.785 -2.329 1.00 0.00 H new ATOM 313 N GLN A 21 12.319 -0.855 2.686 1.00 0.00 N ATOM 314 CA GLN A 21 12.315 -0.723 4.169 1.00 0.00 C ATOM 315 C GLN A 21 13.407 0.245 4.615 1.00 0.00 C ATOM 316 O GLN A 21 13.231 1.015 5.539 1.00 0.00 O ATOM 317 CB GLN A 21 12.581 -2.131 4.688 1.00 0.00 C ATOM 318 CG GLN A 21 11.370 -3.011 4.376 1.00 0.00 C ATOM 319 CD GLN A 21 11.410 -4.264 5.245 1.00 0.00 C ATOM 320 OE1 GLN A 21 10.402 -4.906 5.457 1.00 0.00 O ATOM 321 NE2 GLN A 21 12.542 -4.638 5.762 1.00 0.00 N ATOM 0 H GLN A 21 12.735 -1.714 2.327 1.00 0.00 H new ATOM 0 HA GLN A 21 11.375 -0.325 4.551 1.00 0.00 H new ATOM 0 HB2 GLN A 21 13.476 -2.542 4.221 1.00 0.00 H new ATOM 0 HB3 GLN A 21 12.764 -2.108 5.762 1.00 0.00 H new ATOM 0 HG2 GLN A 21 10.449 -2.458 4.560 1.00 0.00 H new ATOM 0 HG3 GLN A 21 11.371 -3.287 3.322 1.00 0.00 H new ATOM 0 HE21 GLN A 21 13.388 -4.097 5.583 1.00 0.00 H new ATOM 0 HE22 GLN A 21 12.585 -5.472 6.347 1.00 0.00 H new ATOM 330 N ARG A 22 14.532 0.218 3.957 1.00 0.00 N ATOM 331 CA ARG A 22 15.634 1.143 4.334 1.00 0.00 C ATOM 332 C ARG A 22 15.111 2.575 4.395 1.00 0.00 C ATOM 333 O ARG A 22 15.352 3.299 5.340 1.00 0.00 O ATOM 334 CB ARG A 22 16.648 1.000 3.208 1.00 0.00 C ATOM 335 CG ARG A 22 17.676 -0.067 3.579 1.00 0.00 C ATOM 336 CD ARG A 22 18.302 -0.632 2.304 1.00 0.00 C ATOM 337 NE ARG A 22 19.580 -1.246 2.751 1.00 0.00 N ATOM 338 CZ ARG A 22 20.314 -1.921 1.908 1.00 0.00 C ATOM 339 NH1 ARG A 22 19.929 -2.067 0.672 1.00 0.00 N ATOM 340 NH2 ARG A 22 21.441 -2.447 2.299 1.00 0.00 N ATOM 0 H ARG A 22 14.735 -0.405 3.175 1.00 0.00 H new ATOM 0 HA ARG A 22 16.062 0.915 5.310 1.00 0.00 H new ATOM 0 HB2 ARG A 22 16.142 0.726 2.282 1.00 0.00 H new ATOM 0 HB3 ARG A 22 17.146 1.953 3.030 1.00 0.00 H new ATOM 0 HG2 ARG A 22 18.448 0.362 4.217 1.00 0.00 H new ATOM 0 HG3 ARG A 22 17.199 -0.865 4.148 1.00 0.00 H new ATOM 0 HD2 ARG A 22 17.650 -1.370 1.836 1.00 0.00 H new ATOM 0 HD3 ARG A 22 18.476 0.152 1.567 1.00 0.00 H new ATOM 0 HE ARG A 22 19.884 -1.140 3.719 1.00 0.00 H new ATOM 0 HH11 ARG A 22 19.051 -1.653 0.359 1.00 0.00 H new ATOM 0 HH12 ARG A 22 20.506 -2.595 0.017 1.00 0.00 H new ATOM 0 HH21 ARG A 22 21.750 -2.331 3.264 1.00 0.00 H new ATOM 0 HH22 ARG A 22 22.014 -2.974 1.640 1.00 0.00 H new ATOM 354 N ALA A 23 14.388 2.985 3.392 1.00 0.00 N ATOM 355 CA ALA A 23 13.840 4.367 3.393 1.00 0.00 C ATOM 356 C ALA A 23 12.715 4.472 4.435 1.00 0.00 C ATOM 357 O ALA A 23 12.623 5.442 5.158 1.00 0.00 O ATOM 358 CB ALA A 23 13.326 4.587 1.965 1.00 0.00 C ATOM 0 H ALA A 23 14.154 2.424 2.573 1.00 0.00 H new ATOM 0 HA ALA A 23 14.577 5.124 3.661 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.904 5.588 1.881 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.151 4.481 1.261 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.557 3.848 1.737 1.00 0.00 H new ATOM 364 N LEU A 24 11.861 3.478 4.525 1.00 0.00 N ATOM 365 CA LEU A 24 10.759 3.528 5.530 1.00 0.00 C ATOM 366 C LEU A 24 11.216 2.968 6.876 1.00 0.00 C ATOM 367 O LEU A 24 10.477 2.286 7.561 1.00 0.00 O ATOM 368 CB LEU A 24 9.674 2.652 4.930 1.00 0.00 C ATOM 369 CG LEU A 24 9.280 3.235 3.584 1.00 0.00 C ATOM 370 CD1 LEU A 24 8.064 2.503 3.048 1.00 0.00 C ATOM 371 CD2 LEU A 24 8.955 4.719 3.753 1.00 0.00 C ATOM 0 H LEU A 24 11.882 2.638 3.946 1.00 0.00 H new ATOM 0 HA LEU A 24 10.423 4.546 5.726 1.00 0.00 H new ATOM 0 HB2 LEU A 24 10.034 1.630 4.810 1.00 0.00 H new ATOM 0 HB3 LEU A 24 8.810 2.610 5.593 1.00 0.00 H new ATOM 0 HG LEU A 24 10.105 3.121 2.881 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.783 2.923 2.082 1.00 0.00 H new ATOM 0 HD12 LEU A 24 8.299 1.445 2.929 1.00 0.00 H new ATOM 0 HD13 LEU A 24 7.235 2.614 3.747 1.00 0.00 H new ATOM 0 HD21 LEU A 24 8.672 5.141 2.789 1.00 0.00 H new ATOM 0 HD22 LEU A 24 8.130 4.833 4.456 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.832 5.242 4.135 1.00 0.00 H new ATOM 383 N SER A 25 12.423 3.254 7.265 1.00 0.00 N ATOM 384 CA SER A 25 12.928 2.746 8.571 1.00 0.00 C ATOM 385 C SER A 25 12.774 3.821 9.645 1.00 0.00 C ATOM 386 O SER A 25 13.418 3.776 10.674 1.00 0.00 O ATOM 387 CB SER A 25 14.407 2.430 8.348 1.00 0.00 C ATOM 388 OG SER A 25 14.862 1.574 9.387 1.00 0.00 O ATOM 0 H SER A 25 13.086 3.820 6.735 1.00 0.00 H new ATOM 0 HA SER A 25 12.375 1.868 8.906 1.00 0.00 H new ATOM 0 HB2 SER A 25 14.547 1.952 7.379 1.00 0.00 H new ATOM 0 HB3 SER A 25 14.991 3.351 8.337 1.00 0.00 H new ATOM 0 HG SER A 25 14.638 1.967 10.256 1.00 0.00 H new ATOM 394 N ALA A 26 11.922 4.788 9.422 1.00 0.00 N ATOM 395 CA ALA A 26 11.737 5.852 10.446 1.00 0.00 C ATOM 396 C ALA A 26 11.495 5.196 11.806 1.00 0.00 C ATOM 397 O ALA A 26 10.982 4.096 11.887 1.00 0.00 O ATOM 398 CB ALA A 26 10.505 6.640 9.992 1.00 0.00 C ATOM 0 H ALA A 26 11.352 4.885 8.582 1.00 0.00 H new ATOM 0 HA ALA A 26 12.605 6.504 10.545 1.00 0.00 H new ATOM 0 HB1 ALA A 26 10.306 7.444 10.700 1.00 0.00 H new ATOM 0 HB2 ALA A 26 10.688 7.063 9.004 1.00 0.00 H new ATOM 0 HB3 ALA A 26 9.643 5.974 9.948 1.00 0.00 H new ATOM 404 N ASP A 27 11.862 5.844 12.876 1.00 0.00 N ATOM 405 CA ASP A 27 11.650 5.229 14.219 1.00 0.00 C ATOM 406 C ASP A 27 10.184 4.830 14.389 1.00 0.00 C ATOM 407 O ASP A 27 9.839 4.044 15.249 1.00 0.00 O ATOM 408 CB ASP A 27 12.023 6.317 15.223 1.00 0.00 C ATOM 409 CG ASP A 27 13.536 6.531 15.218 1.00 0.00 C ATOM 410 OD1 ASP A 27 14.148 6.286 14.191 1.00 0.00 O ATOM 411 OD2 ASP A 27 14.060 6.939 16.242 1.00 0.00 O ATOM 0 H ASP A 27 12.297 6.767 12.881 1.00 0.00 H new ATOM 0 HA ASP A 27 12.247 4.328 14.356 1.00 0.00 H new ATOM 0 HB2 ASP A 27 11.514 7.247 14.970 1.00 0.00 H new ATOM 0 HB3 ASP A 27 11.690 6.033 16.221 1.00 0.00 H new ATOM 416 N ARG A 28 9.318 5.381 13.585 1.00 0.00 N ATOM 417 CA ARG A 28 7.871 5.051 13.704 1.00 0.00 C ATOM 418 C ARG A 28 7.408 4.200 12.512 1.00 0.00 C ATOM 419 O ARG A 28 6.377 4.458 11.929 1.00 0.00 O ATOM 420 CB ARG A 28 7.167 6.412 13.698 1.00 0.00 C ATOM 421 CG ARG A 28 7.447 7.131 12.375 1.00 0.00 C ATOM 422 CD ARG A 28 6.320 8.126 12.082 1.00 0.00 C ATOM 423 NE ARG A 28 6.646 9.333 12.887 1.00 0.00 N ATOM 424 CZ ARG A 28 5.858 10.373 12.852 1.00 0.00 C ATOM 425 NH1 ARG A 28 4.787 10.363 12.103 1.00 0.00 N ATOM 426 NH2 ARG A 28 6.142 11.426 13.568 1.00 0.00 N ATOM 0 H ARG A 28 9.551 6.047 12.849 1.00 0.00 H new ATOM 0 HA ARG A 28 7.651 4.471 14.601 1.00 0.00 H new ATOM 0 HB2 ARG A 28 6.093 6.278 13.830 1.00 0.00 H new ATOM 0 HB3 ARG A 28 7.518 7.018 14.534 1.00 0.00 H new ATOM 0 HG2 ARG A 28 8.402 7.653 12.429 1.00 0.00 H new ATOM 0 HG3 ARG A 28 7.525 6.406 11.565 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.271 8.363 11.019 1.00 0.00 H new ATOM 0 HD3 ARG A 28 5.350 7.716 12.363 1.00 0.00 H new ATOM 0 HE ARG A 28 7.485 9.348 13.466 1.00 0.00 H new ATOM 0 HH11 ARG A 28 4.564 9.540 11.543 1.00 0.00 H new ATOM 0 HH12 ARG A 28 4.174 11.178 12.079 1.00 0.00 H new ATOM 0 HH21 ARG A 28 6.978 11.435 14.153 1.00 0.00 H new ATOM 0 HH22 ARG A 28 5.528 12.240 13.543 1.00 0.00 H new ATOM 440 N TYR A 29 8.158 3.193 12.136 1.00 0.00 N ATOM 441 CA TYR A 29 7.736 2.357 10.978 1.00 0.00 C ATOM 442 C TYR A 29 7.663 0.873 11.355 1.00 0.00 C ATOM 443 O TYR A 29 8.580 0.316 11.924 1.00 0.00 O ATOM 444 CB TYR A 29 8.815 2.581 9.920 1.00 0.00 C ATOM 445 CG TYR A 29 8.375 3.680 8.987 1.00 0.00 C ATOM 446 CD1 TYR A 29 8.275 4.992 9.456 1.00 0.00 C ATOM 447 CD2 TYR A 29 8.053 3.386 7.660 1.00 0.00 C ATOM 448 CE1 TYR A 29 7.857 6.016 8.597 1.00 0.00 C ATOM 449 CE2 TYR A 29 7.634 4.406 6.803 1.00 0.00 C ATOM 450 CZ TYR A 29 7.535 5.720 7.268 1.00 0.00 C ATOM 451 OH TYR A 29 7.119 6.724 6.416 1.00 0.00 O ATOM 0 H TYR A 29 9.035 2.918 12.578 1.00 0.00 H new ATOM 0 HA TYR A 29 6.741 2.632 10.628 1.00 0.00 H new ATOM 0 HB2 TYR A 29 9.758 2.848 10.396 1.00 0.00 H new ATOM 0 HB3 TYR A 29 8.989 1.662 9.361 1.00 0.00 H new ATOM 0 HD1 TYR A 29 8.521 5.217 10.483 1.00 0.00 H new ATOM 0 HD2 TYR A 29 8.128 2.371 7.297 1.00 0.00 H new ATOM 0 HE1 TYR A 29 7.783 7.031 8.959 1.00 0.00 H new ATOM 0 HE2 TYR A 29 7.386 4.178 5.777 1.00 0.00 H new ATOM 0 HH TYR A 29 7.873 7.317 6.217 1.00 0.00 H new ATOM 461 N GLN A 30 6.584 0.226 11.002 1.00 0.00 N ATOM 462 CA GLN A 30 6.441 -1.235 11.292 1.00 0.00 C ATOM 463 C GLN A 30 6.366 -1.978 9.962 1.00 0.00 C ATOM 464 O GLN A 30 5.305 -2.163 9.402 1.00 0.00 O ATOM 465 CB GLN A 30 5.130 -1.381 12.064 1.00 0.00 C ATOM 466 CG GLN A 30 5.112 -0.389 13.224 1.00 0.00 C ATOM 467 CD GLN A 30 3.846 -0.600 14.056 1.00 0.00 C ATOM 468 OE1 GLN A 30 3.903 -1.143 15.140 1.00 0.00 O ATOM 469 NE2 GLN A 30 2.697 -0.195 13.588 1.00 0.00 N ATOM 0 H GLN A 30 5.789 0.648 10.522 1.00 0.00 H new ATOM 0 HA GLN A 30 7.274 -1.639 11.867 1.00 0.00 H new ATOM 0 HB2 GLN A 30 4.283 -1.199 11.402 1.00 0.00 H new ATOM 0 HB3 GLN A 30 5.028 -2.399 12.440 1.00 0.00 H new ATOM 0 HG2 GLN A 30 5.996 -0.525 13.847 1.00 0.00 H new ATOM 0 HG3 GLN A 30 5.144 0.632 12.844 1.00 0.00 H new ATOM 0 HE21 GLN A 30 2.650 0.261 12.677 1.00 0.00 H new ATOM 0 HE22 GLN A 30 1.846 -0.335 14.133 1.00 0.00 H new ATOM 478 N LEU A 31 7.492 -2.355 9.429 1.00 0.00 N ATOM 479 CA LEU A 31 7.501 -3.029 8.103 1.00 0.00 C ATOM 480 C LEU A 31 7.246 -4.534 8.188 1.00 0.00 C ATOM 481 O LEU A 31 7.820 -5.241 8.991 1.00 0.00 O ATOM 482 CB LEU A 31 8.907 -2.782 7.560 1.00 0.00 C ATOM 483 CG LEU A 31 9.294 -1.318 7.770 1.00 0.00 C ATOM 484 CD1 LEU A 31 10.540 -0.998 6.941 1.00 0.00 C ATOM 485 CD2 LEU A 31 8.135 -0.418 7.335 1.00 0.00 C ATOM 0 H LEU A 31 8.409 -2.225 9.856 1.00 0.00 H new ATOM 0 HA LEU A 31 6.704 -2.635 7.472 1.00 0.00 H new ATOM 0 HB2 LEU A 31 9.621 -3.432 8.065 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.946 -3.029 6.499 1.00 0.00 H new ATOM 0 HG LEU A 31 9.509 -1.142 8.824 1.00 0.00 H new ATOM 0 HD11 LEU A 31 10.818 0.046 7.089 1.00 0.00 H new ATOM 0 HD12 LEU A 31 11.362 -1.641 7.257 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.329 -1.171 5.886 1.00 0.00 H new ATOM 0 HD21 LEU A 31 8.409 0.626 7.484 1.00 0.00 H new ATOM 0 HD22 LEU A 31 7.917 -0.589 6.281 1.00 0.00 H new ATOM 0 HD23 LEU A 31 7.251 -0.649 7.930 1.00 0.00 H new ATOM 497 N GLN A 32 6.421 -5.020 7.306 1.00 0.00 N ATOM 498 CA GLN A 32 6.138 -6.478 7.237 1.00 0.00 C ATOM 499 C GLN A 32 6.387 -6.921 5.795 1.00 0.00 C ATOM 500 O GLN A 32 5.851 -6.353 4.865 1.00 0.00 O ATOM 501 CB GLN A 32 4.666 -6.639 7.625 1.00 0.00 C ATOM 502 CG GLN A 32 4.575 -7.426 8.933 1.00 0.00 C ATOM 503 CD GLN A 32 4.454 -8.921 8.625 1.00 0.00 C ATOM 504 OE1 GLN A 32 3.372 -9.422 8.402 1.00 0.00 O ATOM 505 NE2 GLN A 32 5.530 -9.660 8.604 1.00 0.00 N ATOM 0 H GLN A 32 5.922 -4.457 6.617 1.00 0.00 H new ATOM 0 HA GLN A 32 6.763 -7.079 7.897 1.00 0.00 H new ATOM 0 HB2 GLN A 32 4.199 -5.661 7.742 1.00 0.00 H new ATOM 0 HB3 GLN A 32 4.124 -7.159 6.835 1.00 0.00 H new ATOM 0 HG2 GLN A 32 5.459 -7.240 9.543 1.00 0.00 H new ATOM 0 HG3 GLN A 32 3.713 -7.092 9.511 1.00 0.00 H new ATOM 0 HE21 GLN A 32 6.441 -9.240 8.791 1.00 0.00 H new ATOM 0 HE22 GLN A 32 5.460 -10.657 8.400 1.00 0.00 H new ATOM 514 N VAL A 33 7.221 -7.896 5.591 1.00 0.00 N ATOM 515 CA VAL A 33 7.525 -8.321 4.194 1.00 0.00 C ATOM 516 C VAL A 33 6.659 -9.505 3.772 1.00 0.00 C ATOM 517 O VAL A 33 6.493 -10.459 4.503 1.00 0.00 O ATOM 518 CB VAL A 33 8.996 -8.721 4.225 1.00 0.00 C ATOM 519 CG1 VAL A 33 9.527 -8.812 2.795 1.00 0.00 C ATOM 520 CG2 VAL A 33 9.793 -7.668 4.997 1.00 0.00 C ATOM 0 H VAL A 33 7.705 -8.417 6.323 1.00 0.00 H new ATOM 0 HA VAL A 33 7.321 -7.527 3.476 1.00 0.00 H new ATOM 0 HB VAL A 33 9.101 -9.689 4.715 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.579 -9.098 2.815 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.958 -9.560 2.243 1.00 0.00 H new ATOM 0 HG13 VAL A 33 9.424 -7.843 2.306 1.00 0.00 H new ATOM 0 HG21 VAL A 33 10.845 -7.953 5.020 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.689 -6.701 4.505 1.00 0.00 H new ATOM 0 HG23 VAL A 33 9.413 -7.599 6.016 1.00 0.00 H new ATOM 530 N CYS A 34 6.117 -9.452 2.587 1.00 0.00 N ATOM 531 CA CYS A 34 5.271 -10.582 2.098 1.00 0.00 C ATOM 532 C CYS A 34 6.007 -11.336 0.988 1.00 0.00 C ATOM 533 O CYS A 34 6.323 -10.782 -0.045 1.00 0.00 O ATOM 534 CB CYS A 34 4.002 -9.927 1.551 1.00 0.00 C ATOM 535 SG CYS A 34 3.018 -9.269 2.923 1.00 0.00 S ATOM 0 H CYS A 34 6.222 -8.675 1.934 1.00 0.00 H new ATOM 0 HA CYS A 34 5.045 -11.302 2.884 1.00 0.00 H new ATOM 0 HB2 CYS A 34 4.263 -9.125 0.860 1.00 0.00 H new ATOM 0 HB3 CYS A 34 3.418 -10.655 0.988 1.00 0.00 H new ATOM 0 HG CYS A 34 3.154 -7.977 2.974 1.00 0.00 H new ATOM 541 N GLU A 35 6.288 -12.593 1.189 1.00 0.00 N ATOM 542 CA GLU A 35 7.007 -13.368 0.141 1.00 0.00 C ATOM 543 C GLU A 35 6.119 -13.547 -1.090 1.00 0.00 C ATOM 544 O GLU A 35 6.598 -13.658 -2.199 1.00 0.00 O ATOM 545 CB GLU A 35 7.313 -14.718 0.785 1.00 0.00 C ATOM 546 CG GLU A 35 8.220 -14.514 2.000 1.00 0.00 C ATOM 547 CD GLU A 35 9.590 -13.992 1.549 1.00 0.00 C ATOM 548 OE1 GLU A 35 9.644 -12.886 1.034 1.00 0.00 O ATOM 549 OE2 GLU A 35 10.563 -14.704 1.732 1.00 0.00 O ATOM 0 H GLU A 35 6.051 -13.116 2.032 1.00 0.00 H new ATOM 0 HA GLU A 35 7.913 -12.864 -0.195 1.00 0.00 H new ATOM 0 HB2 GLU A 35 6.387 -15.206 1.088 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.798 -15.375 0.063 1.00 0.00 H new ATOM 0 HG2 GLU A 35 7.762 -13.807 2.692 1.00 0.00 H new ATOM 0 HG3 GLU A 35 8.339 -15.455 2.538 1.00 0.00 H new ATOM 556 N SER A 36 4.831 -13.582 -0.907 1.00 0.00 N ATOM 557 CA SER A 36 3.929 -13.758 -2.078 1.00 0.00 C ATOM 558 C SER A 36 2.855 -12.671 -2.089 1.00 0.00 C ATOM 559 O SER A 36 2.927 -11.707 -1.355 1.00 0.00 O ATOM 560 CB SER A 36 3.300 -15.135 -1.887 1.00 0.00 C ATOM 561 OG SER A 36 4.260 -16.137 -2.201 1.00 0.00 O ATOM 0 H SER A 36 4.365 -13.497 -0.004 1.00 0.00 H new ATOM 0 HA SER A 36 4.462 -13.682 -3.026 1.00 0.00 H new ATOM 0 HB2 SER A 36 2.958 -15.252 -0.859 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.425 -15.240 -2.528 1.00 0.00 H new ATOM 0 HG SER A 36 3.860 -17.023 -2.078 1.00 0.00 H new ATOM 567 N GLY A 37 1.847 -12.830 -2.900 1.00 0.00 N ATOM 568 CA GLY A 37 0.761 -11.821 -2.937 1.00 0.00 C ATOM 569 C GLY A 37 -0.377 -12.374 -2.102 1.00 0.00 C ATOM 570 O GLY A 37 -1.158 -11.655 -1.521 1.00 0.00 O ATOM 0 H GLY A 37 1.731 -13.617 -3.538 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.106 -10.867 -2.538 1.00 0.00 H new ATOM 0 HA3 GLY A 37 0.436 -11.639 -3.962 1.00 0.00 H new ATOM 574 N GLU A 38 -0.432 -13.670 -2.011 1.00 0.00 N ATOM 575 CA GLU A 38 -1.462 -14.333 -1.189 1.00 0.00 C ATOM 576 C GLU A 38 -1.189 -14.016 0.273 1.00 0.00 C ATOM 577 O GLU A 38 -2.087 -13.820 1.069 1.00 0.00 O ATOM 578 CB GLU A 38 -1.239 -15.815 -1.468 1.00 0.00 C ATOM 579 CG GLU A 38 -1.861 -16.187 -2.811 1.00 0.00 C ATOM 580 CD GLU A 38 -1.760 -17.699 -3.013 1.00 0.00 C ATOM 581 OE1 GLU A 38 -1.066 -18.334 -2.236 1.00 0.00 O ATOM 582 OE2 GLU A 38 -2.377 -18.195 -3.940 1.00 0.00 O ATOM 0 H GLU A 38 0.210 -14.306 -2.484 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.483 -14.020 -1.409 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.172 -16.036 -1.477 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.682 -16.415 -0.673 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -2.905 -15.873 -2.841 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -1.348 -15.665 -3.619 1.00 0.00 H new ATOM 589 N MET A 39 0.065 -13.964 0.616 1.00 0.00 N ATOM 590 CA MET A 39 0.453 -13.660 2.014 1.00 0.00 C ATOM 591 C MET A 39 -0.018 -12.254 2.399 1.00 0.00 C ATOM 592 O MET A 39 -0.587 -12.046 3.453 1.00 0.00 O ATOM 593 CB MET A 39 1.981 -13.740 2.004 1.00 0.00 C ATOM 594 CG MET A 39 2.417 -15.206 1.912 1.00 0.00 C ATOM 595 SD MET A 39 2.064 -16.043 3.476 1.00 0.00 S ATOM 596 CE MET A 39 3.421 -15.317 4.429 1.00 0.00 C ATOM 0 H MET A 39 0.845 -14.121 -0.022 1.00 0.00 H new ATOM 0 HA MET A 39 0.008 -14.344 2.737 1.00 0.00 H new ATOM 0 HB2 MET A 39 2.379 -13.178 1.159 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.385 -13.286 2.909 1.00 0.00 H new ATOM 0 HG2 MET A 39 1.891 -15.702 1.096 1.00 0.00 H new ATOM 0 HG3 MET A 39 3.482 -15.266 1.688 1.00 0.00 H new ATOM 0 HE1 MET A 39 4.003 -16.111 4.897 1.00 0.00 H new ATOM 0 HE2 MET A 39 4.064 -14.739 3.765 1.00 0.00 H new ATOM 0 HE3 MET A 39 3.015 -14.663 5.200 1.00 0.00 H new ATOM 606 N LEU A 40 0.207 -11.291 1.548 1.00 0.00 N ATOM 607 CA LEU A 40 -0.238 -9.905 1.863 1.00 0.00 C ATOM 608 C LEU A 40 -1.758 -9.867 2.042 1.00 0.00 C ATOM 609 O LEU A 40 -2.269 -9.162 2.891 1.00 0.00 O ATOM 610 CB LEU A 40 0.209 -9.064 0.664 1.00 0.00 C ATOM 611 CG LEU A 40 -0.572 -7.750 0.626 1.00 0.00 C ATOM 612 CD1 LEU A 40 -0.245 -6.918 1.862 1.00 0.00 C ATOM 613 CD2 LEU A 40 -0.172 -6.961 -0.620 1.00 0.00 C ATOM 0 H LEU A 40 0.678 -11.404 0.651 1.00 0.00 H new ATOM 0 HA LEU A 40 0.188 -9.527 2.793 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.278 -8.860 0.731 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.048 -9.619 -0.260 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.640 -7.969 0.605 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.804 -5.983 1.830 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.520 -7.474 2.758 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.823 -6.701 1.883 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.727 -6.023 -0.651 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.897 -6.749 -0.589 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.400 -7.547 -1.510 1.00 0.00 H new ATOM 625 N LEU A 41 -2.495 -10.625 1.267 1.00 0.00 N ATOM 626 CA LEU A 41 -3.975 -10.616 1.436 1.00 0.00 C ATOM 627 C LEU A 41 -4.312 -11.056 2.862 1.00 0.00 C ATOM 628 O LEU A 41 -5.089 -10.426 3.551 1.00 0.00 O ATOM 629 CB LEU A 41 -4.515 -11.636 0.431 1.00 0.00 C ATOM 630 CG LEU A 41 -4.086 -11.257 -0.985 1.00 0.00 C ATOM 631 CD1 LEU A 41 -4.424 -12.403 -1.940 1.00 0.00 C ATOM 632 CD2 LEU A 41 -4.832 -10.000 -1.428 1.00 0.00 C ATOM 0 H LEU A 41 -2.139 -11.240 0.535 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.407 -9.629 1.270 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -4.145 -12.631 0.677 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.603 -11.676 0.491 1.00 0.00 H new ATOM 0 HG LEU A 41 -3.013 -11.068 -0.999 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.119 -12.136 -2.952 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -3.896 -13.304 -1.628 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -5.498 -12.587 -1.922 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.524 -9.731 -2.439 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -5.905 -10.190 -1.414 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.600 -9.180 -0.748 1.00 0.00 H new ATOM 644 N GLU A 42 -3.720 -12.126 3.318 1.00 0.00 N ATOM 645 CA GLU A 42 -4.000 -12.586 4.705 1.00 0.00 C ATOM 646 C GLU A 42 -3.593 -11.499 5.699 1.00 0.00 C ATOM 647 O GLU A 42 -4.283 -11.236 6.664 1.00 0.00 O ATOM 648 CB GLU A 42 -3.145 -13.842 4.884 1.00 0.00 C ATOM 649 CG GLU A 42 -3.535 -14.552 6.182 1.00 0.00 C ATOM 650 CD GLU A 42 -4.899 -15.221 6.008 1.00 0.00 C ATOM 651 OE1 GLU A 42 -5.890 -14.510 5.996 1.00 0.00 O ATOM 652 OE2 GLU A 42 -4.930 -16.435 5.890 1.00 0.00 O ATOM 0 H GLU A 42 -3.059 -12.698 2.793 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.056 -12.794 4.877 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -3.284 -14.512 4.036 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -2.089 -13.574 4.908 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -2.783 -15.297 6.441 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -3.571 -13.837 7.004 1.00 0.00 H new ATOM 659 N TYR A 43 -2.480 -10.856 5.470 1.00 0.00 N ATOM 660 CA TYR A 43 -2.041 -9.781 6.402 1.00 0.00 C ATOM 661 C TYR A 43 -2.996 -8.584 6.322 1.00 0.00 C ATOM 662 O TYR A 43 -3.375 -8.011 7.325 1.00 0.00 O ATOM 663 CB TYR A 43 -0.644 -9.379 5.925 1.00 0.00 C ATOM 664 CG TYR A 43 -0.235 -8.109 6.622 1.00 0.00 C ATOM 665 CD1 TYR A 43 0.397 -8.167 7.870 1.00 0.00 C ATOM 666 CD2 TYR A 43 -0.489 -6.870 6.023 1.00 0.00 C ATOM 667 CE1 TYR A 43 0.775 -6.987 8.517 1.00 0.00 C ATOM 668 CE2 TYR A 43 -0.111 -5.691 6.670 1.00 0.00 C ATOM 669 CZ TYR A 43 0.521 -5.749 7.918 1.00 0.00 C ATOM 670 OH TYR A 43 0.899 -4.585 8.554 1.00 0.00 O ATOM 0 H TYR A 43 -1.858 -11.029 4.680 1.00 0.00 H new ATOM 0 HA TYR A 43 -2.036 -10.118 7.439 1.00 0.00 H new ATOM 0 HB2 TYR A 43 0.070 -10.174 6.140 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -0.642 -9.233 4.845 1.00 0.00 H new ATOM 0 HD1 TYR A 43 0.592 -9.123 8.333 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -0.977 -6.825 5.061 1.00 0.00 H new ATOM 0 HE1 TYR A 43 1.263 -7.031 9.479 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -0.306 -4.735 6.208 1.00 0.00 H new ATOM 0 HH TYR A 43 1.400 -4.019 7.930 1.00 0.00 H new ATOM 680 N ALA A 44 -3.382 -8.199 5.133 1.00 0.00 N ATOM 681 CA ALA A 44 -4.302 -7.036 4.978 1.00 0.00 C ATOM 682 C ALA A 44 -5.758 -7.465 5.201 1.00 0.00 C ATOM 683 O ALA A 44 -6.628 -6.650 5.441 1.00 0.00 O ATOM 684 CB ALA A 44 -4.101 -6.581 3.531 1.00 0.00 C ATOM 0 H ALA A 44 -3.098 -8.643 4.260 1.00 0.00 H new ATOM 0 HA ALA A 44 -4.094 -6.246 5.700 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -4.743 -5.724 3.327 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -3.059 -6.299 3.380 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.358 -7.396 2.854 1.00 0.00 H new ATOM 690 N GLN A 45 -6.030 -8.737 5.113 1.00 0.00 N ATOM 691 CA GLN A 45 -7.429 -9.224 5.304 1.00 0.00 C ATOM 692 C GLN A 45 -7.875 -9.090 6.757 1.00 0.00 C ATOM 693 O GLN A 45 -9.015 -9.356 7.085 1.00 0.00 O ATOM 694 CB GLN A 45 -7.388 -10.700 4.922 1.00 0.00 C ATOM 695 CG GLN A 45 -7.666 -10.844 3.432 1.00 0.00 C ATOM 696 CD GLN A 45 -7.399 -12.287 3.003 1.00 0.00 C ATOM 697 OE1 GLN A 45 -7.135 -13.138 3.829 1.00 0.00 O ATOM 698 NE2 GLN A 45 -7.460 -12.606 1.739 1.00 0.00 N ATOM 0 H GLN A 45 -5.343 -9.465 4.916 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.131 -8.645 4.704 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -6.413 -11.123 5.164 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.128 -11.257 5.497 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.700 -10.574 3.216 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -7.033 -10.161 2.865 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -7.681 -11.894 1.043 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.286 -13.568 1.447 1.00 0.00 H new ATOM 707 N THR A 46 -6.998 -8.716 7.639 1.00 0.00 N ATOM 708 CA THR A 46 -7.415 -8.614 9.067 1.00 0.00 C ATOM 709 C THR A 46 -6.897 -7.318 9.699 1.00 0.00 C ATOM 710 O THR A 46 -7.054 -7.086 10.881 1.00 0.00 O ATOM 711 CB THR A 46 -6.802 -9.851 9.733 1.00 0.00 C ATOM 712 OG1 THR A 46 -5.435 -9.608 10.026 1.00 0.00 O ATOM 713 CG2 THR A 46 -6.906 -11.054 8.784 1.00 0.00 C ATOM 0 H THR A 46 -6.026 -8.479 7.443 1.00 0.00 H new ATOM 0 HA THR A 46 -8.498 -8.583 9.185 1.00 0.00 H new ATOM 0 HB THR A 46 -7.342 -10.064 10.655 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.046 -10.400 10.453 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.469 -11.932 9.260 1.00 0.00 H new ATOM 0 HG22 THR A 46 -7.954 -11.248 8.556 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.368 -10.837 7.861 1.00 0.00 H new ATOM 721 N HIS A 47 -6.286 -6.471 8.917 1.00 0.00 N ATOM 722 CA HIS A 47 -5.756 -5.185 9.461 1.00 0.00 C ATOM 723 C HIS A 47 -5.949 -4.067 8.424 1.00 0.00 C ATOM 724 O HIS A 47 -5.201 -3.113 8.383 1.00 0.00 O ATOM 725 CB HIS A 47 -4.264 -5.459 9.688 1.00 0.00 C ATOM 726 CG HIS A 47 -4.042 -6.004 11.079 1.00 0.00 C ATOM 727 ND1 HIS A 47 -3.397 -5.280 12.072 1.00 0.00 N ATOM 728 CD2 HIS A 47 -4.356 -7.213 11.649 1.00 0.00 C ATOM 729 CE1 HIS A 47 -3.341 -6.057 13.172 1.00 0.00 C ATOM 730 NE2 HIS A 47 -3.912 -7.246 12.967 1.00 0.00 N ATOM 0 H HIS A 47 -6.129 -6.614 7.919 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.260 -4.865 10.373 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.900 -6.172 8.948 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -3.693 -4.540 9.554 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -4.871 -8.019 11.148 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.889 -5.755 14.105 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -4.003 -8.013 13.633 1.00 0.00 H new ATOM 738 N ARG A 48 -6.937 -4.196 7.574 1.00 0.00 N ATOM 739 CA ARG A 48 -7.154 -3.151 6.511 1.00 0.00 C ATOM 740 C ARG A 48 -6.962 -1.759 7.098 1.00 0.00 C ATOM 741 O ARG A 48 -6.156 -0.980 6.630 1.00 0.00 O ATOM 742 CB ARG A 48 -8.609 -3.282 6.011 1.00 0.00 C ATOM 743 CG ARG A 48 -9.114 -4.715 6.147 1.00 0.00 C ATOM 744 CD ARG A 48 -10.411 -4.884 5.352 1.00 0.00 C ATOM 745 NE ARG A 48 -11.374 -5.490 6.314 1.00 0.00 N ATOM 746 CZ ARG A 48 -11.229 -6.730 6.694 1.00 0.00 C ATOM 747 NH1 ARG A 48 -10.226 -7.439 6.250 1.00 0.00 N ATOM 748 NH2 ARG A 48 -12.087 -7.259 7.521 1.00 0.00 N ATOM 0 H ARG A 48 -7.601 -4.971 7.565 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.442 -3.295 5.698 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -9.253 -2.611 6.580 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.667 -2.971 4.968 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.360 -5.412 5.783 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -9.286 -4.952 7.197 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -10.774 -3.926 4.980 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -10.262 -5.527 4.484 1.00 0.00 H new ATOM 0 HE ARG A 48 -12.149 -4.934 6.677 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -9.554 -7.024 5.605 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -10.115 -8.408 6.548 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -12.869 -6.704 7.869 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -11.976 -8.228 7.820 1.00 0.00 H new ATOM 762 N ASP A 49 -7.696 -1.440 8.122 1.00 0.00 N ATOM 763 CA ASP A 49 -7.550 -0.082 8.739 1.00 0.00 C ATOM 764 C ASP A 49 -6.239 0.008 9.519 1.00 0.00 C ATOM 765 O ASP A 49 -5.698 1.075 9.721 1.00 0.00 O ATOM 766 CB ASP A 49 -8.741 0.097 9.681 1.00 0.00 C ATOM 767 CG ASP A 49 -8.907 1.588 9.984 1.00 0.00 C ATOM 768 OD1 ASP A 49 -7.910 2.289 9.954 1.00 0.00 O ATOM 769 OD2 ASP A 49 -10.026 2.003 10.238 1.00 0.00 O ATOM 0 H ASP A 49 -8.387 -2.049 8.561 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.530 0.697 7.977 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -9.648 -0.299 9.223 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -8.580 -0.461 10.604 1.00 0.00 H new ATOM 774 N GLN A 50 -5.732 -1.105 9.968 1.00 0.00 N ATOM 775 CA GLN A 50 -4.462 -1.087 10.744 1.00 0.00 C ATOM 776 C GLN A 50 -3.269 -0.786 9.825 1.00 0.00 C ATOM 777 O GLN A 50 -2.289 -0.205 10.246 1.00 0.00 O ATOM 778 CB GLN A 50 -4.354 -2.490 11.338 1.00 0.00 C ATOM 779 CG GLN A 50 -5.585 -2.771 12.199 1.00 0.00 C ATOM 780 CD GLN A 50 -5.551 -1.876 13.437 1.00 0.00 C ATOM 781 OE1 GLN A 50 -4.844 -2.156 14.386 1.00 0.00 O ATOM 782 NE2 GLN A 50 -6.285 -0.801 13.466 1.00 0.00 N ATOM 0 H GLN A 50 -6.143 -2.028 9.831 1.00 0.00 H new ATOM 0 HA GLN A 50 -4.456 -0.314 11.513 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -4.277 -3.230 10.541 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -3.449 -2.574 11.939 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -6.494 -2.585 11.626 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -5.604 -3.820 12.495 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -6.878 -0.567 12.670 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -6.267 -0.193 14.285 1.00 0.00 H new ATOM 791 N ILE A 51 -3.337 -1.168 8.577 1.00 0.00 N ATOM 792 CA ILE A 51 -2.189 -0.886 7.665 1.00 0.00 C ATOM 793 C ILE A 51 -2.152 0.599 7.312 1.00 0.00 C ATOM 794 O ILE A 51 -3.109 1.151 6.811 1.00 0.00 O ATOM 795 CB ILE A 51 -2.437 -1.717 6.402 1.00 0.00 C ATOM 796 CG1 ILE A 51 -2.679 -3.188 6.767 1.00 0.00 C ATOM 797 CG2 ILE A 51 -1.219 -1.626 5.482 1.00 0.00 C ATOM 798 CD1 ILE A 51 -1.834 -3.580 7.982 1.00 0.00 C ATOM 0 H ILE A 51 -4.126 -1.656 8.154 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.237 -1.139 8.132 1.00 0.00 H new ATOM 0 HB ILE A 51 -3.318 -1.325 5.895 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.735 -3.347 6.984 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.428 -3.826 5.920 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.396 -2.218 4.584 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.050 -0.586 5.204 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.341 -2.010 6.002 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.016 -4.626 8.230 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.778 -3.440 7.751 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.106 -2.954 8.832 1.00 0.00 H new ATOM 810 N ASP A 52 -1.055 1.253 7.573 1.00 0.00 N ATOM 811 CA ASP A 52 -0.961 2.703 7.254 1.00 0.00 C ATOM 812 C ASP A 52 -0.483 2.913 5.807 1.00 0.00 C ATOM 813 O ASP A 52 -0.882 3.852 5.153 1.00 0.00 O ATOM 814 CB ASP A 52 0.048 3.254 8.262 1.00 0.00 C ATOM 815 CG ASP A 52 -0.534 3.132 9.674 1.00 0.00 C ATOM 816 OD1 ASP A 52 -1.322 2.226 9.890 1.00 0.00 O ATOM 817 OD2 ASP A 52 -0.180 3.942 10.514 1.00 0.00 O ATOM 0 H ASP A 52 -0.220 0.845 7.993 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.923 3.210 7.325 1.00 0.00 H new ATOM 0 HB2 ASP A 52 0.986 2.704 8.194 1.00 0.00 H new ATOM 0 HB3 ASP A 52 0.273 4.297 8.037 1.00 0.00 H new ATOM 822 N CYS A 53 0.364 2.050 5.300 1.00 0.00 N ATOM 823 CA CYS A 53 0.850 2.224 3.895 1.00 0.00 C ATOM 824 C CYS A 53 1.221 0.874 3.272 1.00 0.00 C ATOM 825 O CYS A 53 1.831 0.036 3.906 1.00 0.00 O ATOM 826 CB CYS A 53 2.088 3.112 4.016 1.00 0.00 C ATOM 827 SG CYS A 53 2.454 3.847 2.406 1.00 0.00 S ATOM 0 H CYS A 53 0.737 1.239 5.793 1.00 0.00 H new ATOM 0 HA CYS A 53 0.086 2.661 3.253 1.00 0.00 H new ATOM 0 HB2 CYS A 53 1.918 3.894 4.756 1.00 0.00 H new ATOM 0 HB3 CYS A 53 2.938 2.525 4.363 1.00 0.00 H new ATOM 0 HG CYS A 53 1.506 3.549 1.567 1.00 0.00 H new ATOM 833 N LEU A 54 0.861 0.653 2.029 1.00 0.00 N ATOM 834 CA LEU A 54 1.206 -0.653 1.385 1.00 0.00 C ATOM 835 C LEU A 54 2.208 -0.447 0.244 1.00 0.00 C ATOM 836 O LEU A 54 1.996 0.357 -0.640 1.00 0.00 O ATOM 837 CB LEU A 54 -0.120 -1.180 0.834 1.00 0.00 C ATOM 838 CG LEU A 54 0.138 -2.324 -0.152 1.00 0.00 C ATOM 839 CD1 LEU A 54 1.115 -3.335 0.457 1.00 0.00 C ATOM 840 CD2 LEU A 54 -1.185 -3.029 -0.465 1.00 0.00 C ATOM 0 H LEU A 54 0.350 1.311 1.440 1.00 0.00 H new ATOM 0 HA LEU A 54 1.669 -1.345 2.089 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.750 -1.530 1.652 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -0.662 -0.376 0.336 1.00 0.00 H new ATOM 0 HG LEU A 54 0.569 -1.916 -1.066 1.00 0.00 H new ATOM 0 HD11 LEU A 54 1.291 -4.144 -0.252 1.00 0.00 H new ATOM 0 HD12 LEU A 54 2.059 -2.838 0.683 1.00 0.00 H new ATOM 0 HD13 LEU A 54 0.691 -3.743 1.375 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -1.006 -3.844 -1.166 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.611 -3.429 0.455 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.881 -2.316 -0.907 1.00 0.00 H new ATOM 852 N ILE A 55 3.289 -1.182 0.242 1.00 0.00 N ATOM 853 CA ILE A 55 4.281 -1.032 -0.861 1.00 0.00 C ATOM 854 C ILE A 55 4.094 -2.166 -1.868 1.00 0.00 C ATOM 855 O ILE A 55 3.894 -3.303 -1.490 1.00 0.00 O ATOM 856 CB ILE A 55 5.639 -1.189 -0.199 1.00 0.00 C ATOM 857 CG1 ILE A 55 5.849 -0.127 0.872 1.00 0.00 C ATOM 858 CG2 ILE A 55 6.739 -1.056 -1.255 1.00 0.00 C ATOM 859 CD1 ILE A 55 7.044 -0.546 1.727 1.00 0.00 C ATOM 0 H ILE A 55 3.526 -1.875 0.952 1.00 0.00 H new ATOM 0 HA ILE A 55 4.174 -0.080 -1.381 1.00 0.00 H new ATOM 0 HB ILE A 55 5.681 -2.173 0.269 1.00 0.00 H new ATOM 0 HG12 ILE A 55 6.031 0.845 0.414 1.00 0.00 H new ATOM 0 HG13 ILE A 55 4.956 -0.027 1.489 1.00 0.00 H new ATOM 0 HG21 ILE A 55 7.714 -1.168 -0.781 1.00 0.00 H new ATOM 0 HG22 ILE A 55 6.612 -1.830 -2.012 1.00 0.00 H new ATOM 0 HG23 ILE A 55 6.675 -0.075 -1.725 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.215 0.200 2.503 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.839 -1.511 2.190 1.00 0.00 H new ATOM 0 HD13 ILE A 55 7.931 -0.626 1.098 1.00 0.00 H new ATOM 871 N LEU A 56 4.166 -1.884 -3.138 1.00 0.00 N ATOM 872 CA LEU A 56 3.999 -2.977 -4.137 1.00 0.00 C ATOM 873 C LEU A 56 4.961 -2.803 -5.310 1.00 0.00 C ATOM 874 O LEU A 56 5.448 -1.725 -5.581 1.00 0.00 O ATOM 875 CB LEU A 56 2.556 -2.866 -4.617 1.00 0.00 C ATOM 876 CG LEU A 56 1.622 -3.244 -3.476 1.00 0.00 C ATOM 877 CD1 LEU A 56 0.181 -2.958 -3.884 1.00 0.00 C ATOM 878 CD2 LEU A 56 1.781 -4.735 -3.178 1.00 0.00 C ATOM 0 H LEU A 56 4.331 -0.955 -3.525 1.00 0.00 H new ATOM 0 HA LEU A 56 4.215 -3.952 -3.700 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.348 -1.850 -4.952 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.392 -3.523 -5.471 1.00 0.00 H new ATOM 0 HG LEU A 56 1.868 -2.662 -2.588 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.489 -3.228 -3.068 1.00 0.00 H new ATOM 0 HD12 LEU A 56 0.070 -1.897 -4.108 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.070 -3.544 -4.768 1.00 0.00 H new ATOM 0 HD21 LEU A 56 1.116 -5.016 -2.362 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.528 -5.313 -4.067 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.813 -4.941 -2.893 1.00 0.00 H new ATOM 890 N VAL A 57 5.216 -3.867 -6.019 1.00 0.00 N ATOM 891 CA VAL A 57 6.125 -3.790 -7.195 1.00 0.00 C ATOM 892 C VAL A 57 5.393 -4.331 -8.422 1.00 0.00 C ATOM 893 O VAL A 57 5.076 -5.502 -8.500 1.00 0.00 O ATOM 894 CB VAL A 57 7.318 -4.674 -6.841 1.00 0.00 C ATOM 895 CG1 VAL A 57 8.243 -4.785 -8.051 1.00 0.00 C ATOM 896 CG2 VAL A 57 8.085 -4.049 -5.676 1.00 0.00 C ATOM 0 H VAL A 57 4.831 -4.793 -5.832 1.00 0.00 H new ATOM 0 HA VAL A 57 6.444 -2.772 -7.421 1.00 0.00 H new ATOM 0 HB VAL A 57 6.965 -5.665 -6.557 1.00 0.00 H new ATOM 0 HG11 VAL A 57 9.096 -5.416 -7.800 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.698 -5.226 -8.886 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.596 -3.793 -8.331 1.00 0.00 H new ATOM 0 HG21 VAL A 57 8.937 -4.679 -5.422 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.439 -3.059 -5.963 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.427 -3.963 -4.811 1.00 0.00 H new ATOM 906 N ALA A 58 5.104 -3.488 -9.369 1.00 0.00 N ATOM 907 CA ALA A 58 4.367 -3.950 -10.581 1.00 0.00 C ATOM 908 C ALA A 58 5.156 -5.033 -11.323 1.00 0.00 C ATOM 909 O ALA A 58 4.627 -5.721 -12.173 1.00 0.00 O ATOM 910 CB ALA A 58 4.221 -2.700 -11.444 1.00 0.00 C ATOM 0 H ALA A 58 5.345 -2.497 -9.359 1.00 0.00 H new ATOM 0 HA ALA A 58 3.404 -4.395 -10.331 1.00 0.00 H new ATOM 0 HB1 ALA A 58 3.687 -2.951 -12.361 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.663 -1.942 -10.895 1.00 0.00 H new ATOM 0 HB3 ALA A 58 5.209 -2.313 -11.694 1.00 0.00 H new ATOM 916 N ALA A 59 6.412 -5.184 -11.020 1.00 0.00 N ATOM 917 CA ALA A 59 7.226 -6.219 -11.719 1.00 0.00 C ATOM 918 C ALA A 59 6.679 -7.626 -11.444 1.00 0.00 C ATOM 919 O ALA A 59 7.051 -8.578 -12.098 1.00 0.00 O ATOM 920 CB ALA A 59 8.636 -6.066 -11.149 1.00 0.00 C ATOM 0 H ALA A 59 6.912 -4.637 -10.319 1.00 0.00 H new ATOM 0 HA ALA A 59 7.205 -6.089 -12.801 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.298 -6.796 -11.615 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.004 -5.060 -11.353 1.00 0.00 H new ATOM 0 HB3 ALA A 59 8.613 -6.233 -10.072 1.00 0.00 H new ATOM 926 N ASN A 60 5.801 -7.773 -10.487 1.00 0.00 N ATOM 927 CA ASN A 60 5.247 -9.130 -10.195 1.00 0.00 C ATOM 928 C ASN A 60 4.145 -9.477 -11.209 1.00 0.00 C ATOM 929 O ASN A 60 3.525 -8.596 -11.773 1.00 0.00 O ATOM 930 CB ASN A 60 4.700 -9.033 -8.770 1.00 0.00 C ATOM 931 CG ASN A 60 5.817 -9.380 -7.780 1.00 0.00 C ATOM 932 OD1 ASN A 60 6.955 -9.560 -8.169 1.00 0.00 O ATOM 933 ND2 ASN A 60 5.540 -9.482 -6.508 1.00 0.00 N ATOM 0 H ASN A 60 5.445 -7.020 -9.899 1.00 0.00 H new ATOM 0 HA ASN A 60 5.993 -9.920 -10.276 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.326 -8.027 -8.578 1.00 0.00 H new ATOM 0 HB3 ASN A 60 3.859 -9.715 -8.643 1.00 0.00 H new ATOM 0 HD21 ASN A 60 6.278 -9.712 -5.842 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.586 -9.331 -6.180 1.00 0.00 H new ATOM 940 N PRO A 61 3.955 -10.754 -11.428 1.00 0.00 N ATOM 941 CA PRO A 61 2.942 -11.217 -12.412 1.00 0.00 C ATOM 942 C PRO A 61 1.508 -11.059 -11.887 1.00 0.00 C ATOM 943 O PRO A 61 0.773 -10.202 -12.334 1.00 0.00 O ATOM 944 CB PRO A 61 3.295 -12.684 -12.627 1.00 0.00 C ATOM 945 CG PRO A 61 4.017 -13.106 -11.385 1.00 0.00 C ATOM 946 CD PRO A 61 4.660 -11.874 -10.791 1.00 0.00 C ATOM 0 HA PRO A 61 2.964 -10.633 -13.332 1.00 0.00 H new ATOM 0 HB2 PRO A 61 2.399 -13.285 -12.784 1.00 0.00 H new ATOM 0 HB3 PRO A 61 3.923 -12.812 -13.509 1.00 0.00 H new ATOM 0 HG2 PRO A 61 3.325 -13.558 -10.674 1.00 0.00 H new ATOM 0 HG3 PRO A 61 4.771 -13.858 -11.617 1.00 0.00 H new ATOM 0 HD2 PRO A 61 4.548 -11.850 -9.707 1.00 0.00 H new ATOM 0 HD3 PRO A 61 5.729 -11.842 -11.001 1.00 0.00 H new ATOM 954 N SER A 62 1.091 -11.879 -10.960 1.00 0.00 N ATOM 955 CA SER A 62 -0.310 -11.759 -10.445 1.00 0.00 C ATOM 956 C SER A 62 -0.439 -10.588 -9.459 1.00 0.00 C ATOM 957 O SER A 62 -1.431 -10.456 -8.771 1.00 0.00 O ATOM 958 CB SER A 62 -0.615 -13.087 -9.748 1.00 0.00 C ATOM 959 OG SER A 62 -0.033 -14.155 -10.485 1.00 0.00 O ATOM 0 H SER A 62 1.651 -12.620 -10.539 1.00 0.00 H new ATOM 0 HA SER A 62 -1.011 -11.559 -11.255 1.00 0.00 H new ATOM 0 HB2 SER A 62 -0.221 -13.075 -8.732 1.00 0.00 H new ATOM 0 HB3 SER A 62 -1.693 -13.230 -9.670 1.00 0.00 H new ATOM 0 HG SER A 62 -0.227 -15.005 -10.038 1.00 0.00 H new ATOM 965 N PHE A 63 0.547 -9.731 -9.393 1.00 0.00 N ATOM 966 CA PHE A 63 0.472 -8.562 -8.465 1.00 0.00 C ATOM 967 C PHE A 63 -0.885 -7.867 -8.615 1.00 0.00 C ATOM 968 O PHE A 63 -1.585 -7.626 -7.651 1.00 0.00 O ATOM 969 CB PHE A 63 1.621 -7.652 -8.922 1.00 0.00 C ATOM 970 CG PHE A 63 1.325 -6.202 -8.605 1.00 0.00 C ATOM 971 CD1 PHE A 63 1.104 -5.796 -7.282 1.00 0.00 C ATOM 972 CD2 PHE A 63 1.278 -5.260 -9.641 1.00 0.00 C ATOM 973 CE1 PHE A 63 0.836 -4.452 -6.999 1.00 0.00 C ATOM 974 CE2 PHE A 63 1.010 -3.917 -9.357 1.00 0.00 C ATOM 975 CZ PHE A 63 0.789 -3.512 -8.035 1.00 0.00 C ATOM 0 H PHE A 63 1.404 -9.790 -9.943 1.00 0.00 H new ATOM 0 HA PHE A 63 0.562 -8.835 -7.414 1.00 0.00 H new ATOM 0 HB2 PHE A 63 2.546 -7.954 -8.430 1.00 0.00 H new ATOM 0 HB3 PHE A 63 1.777 -7.769 -9.994 1.00 0.00 H new ATOM 0 HD1 PHE A 63 1.141 -6.520 -6.481 1.00 0.00 H new ATOM 0 HD2 PHE A 63 1.449 -5.571 -10.661 1.00 0.00 H new ATOM 0 HE1 PHE A 63 0.665 -4.139 -5.979 1.00 0.00 H new ATOM 0 HE2 PHE A 63 0.974 -3.193 -10.157 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.582 -2.475 -7.815 1.00 0.00 H new ATOM 985 N ARG A 64 -1.262 -7.555 -9.821 1.00 0.00 N ATOM 986 CA ARG A 64 -2.575 -6.892 -10.047 1.00 0.00 C ATOM 987 C ARG A 64 -3.658 -7.622 -9.265 1.00 0.00 C ATOM 988 O ARG A 64 -4.301 -7.076 -8.391 1.00 0.00 O ATOM 989 CB ARG A 64 -2.829 -7.063 -11.543 1.00 0.00 C ATOM 990 CG ARG A 64 -3.385 -5.765 -12.115 1.00 0.00 C ATOM 991 CD ARG A 64 -2.289 -4.713 -12.074 1.00 0.00 C ATOM 992 NE ARG A 64 -1.765 -4.654 -13.466 1.00 0.00 N ATOM 993 CZ ARG A 64 -2.511 -4.186 -14.428 1.00 0.00 C ATOM 994 NH1 ARG A 64 -3.710 -3.742 -14.170 1.00 0.00 N ATOM 995 NH2 ARG A 64 -2.055 -4.160 -15.650 1.00 0.00 N ATOM 0 H ARG A 64 -0.715 -7.731 -10.664 1.00 0.00 H new ATOM 0 HA ARG A 64 -2.580 -5.849 -9.731 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.903 -7.330 -12.052 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -3.532 -7.878 -11.713 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -3.726 -5.917 -13.139 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -4.249 -5.435 -11.537 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -2.681 -3.746 -11.758 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -1.505 -4.986 -11.368 1.00 0.00 H new ATOM 0 HE ARG A 64 -0.820 -4.980 -13.668 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -4.066 -3.760 -13.214 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -4.292 -3.376 -14.924 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -1.117 -4.505 -15.852 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -2.637 -3.794 -16.404 1.00 0.00 H new ATOM 1009 N ALA A 65 -3.851 -8.862 -9.588 1.00 0.00 N ATOM 1010 CA ALA A 65 -4.882 -9.676 -8.890 1.00 0.00 C ATOM 1011 C ALA A 65 -4.775 -9.470 -7.377 1.00 0.00 C ATOM 1012 O ALA A 65 -5.756 -9.279 -6.691 1.00 0.00 O ATOM 1013 CB ALA A 65 -4.544 -11.120 -9.261 1.00 0.00 C ATOM 0 H ALA A 65 -3.334 -9.356 -10.315 1.00 0.00 H new ATOM 0 HA ALA A 65 -5.898 -9.405 -9.176 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.258 -11.794 -8.787 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -4.596 -11.239 -10.343 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -3.537 -11.358 -8.918 1.00 0.00 H new ATOM 1019 N VAL A 66 -3.585 -9.509 -6.853 1.00 0.00 N ATOM 1020 CA VAL A 66 -3.400 -9.319 -5.385 1.00 0.00 C ATOM 1021 C VAL A 66 -3.916 -7.942 -4.952 1.00 0.00 C ATOM 1022 O VAL A 66 -4.566 -7.804 -3.932 1.00 0.00 O ATOM 1023 CB VAL A 66 -1.890 -9.445 -5.188 1.00 0.00 C ATOM 1024 CG1 VAL A 66 -1.504 -9.107 -3.742 1.00 0.00 C ATOM 1025 CG2 VAL A 66 -1.476 -10.882 -5.508 1.00 0.00 C ATOM 0 H VAL A 66 -2.725 -9.665 -7.379 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.953 -10.041 -4.784 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.379 -8.747 -5.851 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.425 -9.203 -3.622 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.805 -8.085 -3.514 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.007 -9.794 -3.061 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.400 -10.989 -5.372 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.996 -11.568 -4.840 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.736 -11.114 -6.541 1.00 0.00 H new ATOM 1035 N VAL A 67 -3.649 -6.923 -5.721 1.00 0.00 N ATOM 1036 CA VAL A 67 -4.148 -5.573 -5.341 1.00 0.00 C ATOM 1037 C VAL A 67 -5.663 -5.521 -5.521 1.00 0.00 C ATOM 1038 O VAL A 67 -6.363 -4.862 -4.777 1.00 0.00 O ATOM 1039 CB VAL A 67 -3.456 -4.592 -6.282 1.00 0.00 C ATOM 1040 CG1 VAL A 67 -3.606 -3.174 -5.729 1.00 0.00 C ATOM 1041 CG2 VAL A 67 -1.972 -4.943 -6.376 1.00 0.00 C ATOM 0 H VAL A 67 -3.112 -6.966 -6.587 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.934 -5.331 -4.300 1.00 0.00 H new ATOM 0 HB VAL A 67 -3.909 -4.651 -7.272 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.113 -2.469 -6.398 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -4.664 -2.923 -5.653 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -3.148 -3.118 -4.741 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.475 -4.244 -7.048 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.520 -4.879 -5.386 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.862 -5.957 -6.761 1.00 0.00 H new ATOM 1051 N GLN A 68 -6.189 -6.221 -6.492 1.00 0.00 N ATOM 1052 CA GLN A 68 -7.660 -6.203 -6.672 1.00 0.00 C ATOM 1053 C GLN A 68 -8.301 -6.763 -5.405 1.00 0.00 C ATOM 1054 O GLN A 68 -9.336 -6.307 -4.977 1.00 0.00 O ATOM 1055 CB GLN A 68 -7.952 -7.068 -7.913 1.00 0.00 C ATOM 1056 CG GLN A 68 -8.310 -8.506 -7.513 1.00 0.00 C ATOM 1057 CD GLN A 68 -9.798 -8.594 -7.170 1.00 0.00 C ATOM 1058 OE1 GLN A 68 -10.642 -8.204 -7.952 1.00 0.00 O ATOM 1059 NE2 GLN A 68 -10.159 -9.102 -6.023 1.00 0.00 N ATOM 0 H GLN A 68 -5.669 -6.794 -7.156 1.00 0.00 H new ATOM 0 HA GLN A 68 -8.067 -5.204 -6.827 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -8.773 -6.630 -8.480 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -7.081 -7.076 -8.568 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -8.075 -9.189 -8.329 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -7.711 -8.815 -6.656 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.452 -9.430 -5.365 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -11.148 -9.171 -5.785 1.00 0.00 H new ATOM 1068 N GLN A 69 -7.671 -7.729 -4.783 1.00 0.00 N ATOM 1069 CA GLN A 69 -8.237 -8.287 -3.527 1.00 0.00 C ATOM 1070 C GLN A 69 -8.236 -7.197 -2.458 1.00 0.00 C ATOM 1071 O GLN A 69 -9.244 -6.924 -1.834 1.00 0.00 O ATOM 1072 CB GLN A 69 -7.305 -9.428 -3.134 1.00 0.00 C ATOM 1073 CG GLN A 69 -7.631 -10.668 -3.968 1.00 0.00 C ATOM 1074 CD GLN A 69 -9.019 -11.189 -3.588 1.00 0.00 C ATOM 1075 OE1 GLN A 69 -9.844 -11.436 -4.442 1.00 0.00 O ATOM 1076 NE2 GLN A 69 -9.310 -11.368 -2.329 1.00 0.00 N ATOM 0 H GLN A 69 -6.795 -8.150 -5.092 1.00 0.00 H new ATOM 0 HA GLN A 69 -9.262 -8.639 -3.644 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -6.267 -9.134 -3.292 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -7.415 -9.652 -2.073 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -7.601 -10.423 -5.030 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -6.882 -11.441 -3.798 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -8.616 -11.160 -1.611 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -10.231 -11.716 -2.063 1.00 0.00 H new ATOM 1085 N LEU A 70 -7.123 -6.542 -2.258 1.00 0.00 N ATOM 1086 CA LEU A 70 -7.103 -5.452 -1.246 1.00 0.00 C ATOM 1087 C LEU A 70 -8.285 -4.522 -1.542 1.00 0.00 C ATOM 1088 O LEU A 70 -9.056 -4.187 -0.672 1.00 0.00 O ATOM 1089 CB LEU A 70 -5.762 -4.729 -1.440 1.00 0.00 C ATOM 1090 CG LEU A 70 -4.668 -5.430 -0.619 1.00 0.00 C ATOM 1091 CD1 LEU A 70 -3.397 -5.557 -1.457 1.00 0.00 C ATOM 1092 CD2 LEU A 70 -4.351 -4.610 0.637 1.00 0.00 C ATOM 0 H LEU A 70 -6.242 -6.712 -2.743 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.194 -5.806 -0.219 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.490 -4.724 -2.496 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.852 -3.688 -1.129 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.024 -6.419 -0.332 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.624 -6.054 -0.872 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -3.608 -6.143 -2.352 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.051 -4.565 -1.746 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.575 -5.113 1.214 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.002 -3.619 0.346 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.250 -4.514 1.245 1.00 0.00 H new ATOM 1104 N CYS A 71 -8.446 -4.131 -2.780 1.00 0.00 N ATOM 1105 CA CYS A 71 -9.599 -3.253 -3.152 1.00 0.00 C ATOM 1106 C CYS A 71 -10.906 -4.050 -3.065 1.00 0.00 C ATOM 1107 O CYS A 71 -11.937 -3.541 -2.671 1.00 0.00 O ATOM 1108 CB CYS A 71 -9.336 -2.841 -4.603 1.00 0.00 C ATOM 1109 SG CYS A 71 -7.895 -1.754 -4.678 1.00 0.00 S ATOM 0 H CYS A 71 -7.828 -4.382 -3.552 1.00 0.00 H new ATOM 0 HA CYS A 71 -9.692 -2.391 -2.491 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -9.168 -3.726 -5.217 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -10.209 -2.331 -5.010 1.00 0.00 H new ATOM 0 HG CYS A 71 -7.055 -2.082 -3.742 1.00 0.00 H new ATOM 1115 N PHE A 72 -10.854 -5.297 -3.445 1.00 0.00 N ATOM 1116 CA PHE A 72 -12.067 -6.168 -3.410 1.00 0.00 C ATOM 1117 C PHE A 72 -12.592 -6.281 -1.981 1.00 0.00 C ATOM 1118 O PHE A 72 -13.758 -6.064 -1.717 1.00 0.00 O ATOM 1119 CB PHE A 72 -11.551 -7.521 -3.907 1.00 0.00 C ATOM 1120 CG PHE A 72 -12.679 -8.511 -4.061 1.00 0.00 C ATOM 1121 CD1 PHE A 72 -13.380 -8.584 -5.272 1.00 0.00 C ATOM 1122 CD2 PHE A 72 -13.002 -9.376 -3.010 1.00 0.00 C ATOM 1123 CE1 PHE A 72 -14.409 -9.522 -5.429 1.00 0.00 C ATOM 1124 CE2 PHE A 72 -14.028 -10.316 -3.170 1.00 0.00 C ATOM 1125 CZ PHE A 72 -14.732 -10.388 -4.377 1.00 0.00 C ATOM 0 H PHE A 72 -10.010 -5.758 -3.784 1.00 0.00 H new ATOM 0 HA PHE A 72 -12.891 -5.785 -4.012 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -11.044 -7.391 -4.863 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.813 -7.912 -3.206 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -13.127 -7.918 -6.084 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -12.461 -9.319 -2.077 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -14.953 -9.577 -6.361 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -14.276 -10.986 -2.360 1.00 0.00 H new ATOM 0 HZ PHE A 72 -15.525 -11.112 -4.497 1.00 0.00 H new ATOM 1135 N GLU A 73 -11.734 -6.613 -1.055 1.00 0.00 N ATOM 1136 CA GLU A 73 -12.176 -6.730 0.360 1.00 0.00 C ATOM 1137 C GLU A 73 -12.372 -5.330 0.951 1.00 0.00 C ATOM 1138 O GLU A 73 -12.919 -5.167 2.024 1.00 0.00 O ATOM 1139 CB GLU A 73 -11.044 -7.476 1.067 1.00 0.00 C ATOM 1140 CG GLU A 73 -10.656 -8.707 0.243 1.00 0.00 C ATOM 1141 CD GLU A 73 -10.063 -9.777 1.161 1.00 0.00 C ATOM 1142 OE1 GLU A 73 -10.800 -10.303 1.979 1.00 0.00 O ATOM 1143 OE2 GLU A 73 -8.884 -10.057 1.027 1.00 0.00 O ATOM 0 H GLU A 73 -10.746 -6.808 -1.219 1.00 0.00 H new ATOM 0 HA GLU A 73 -13.125 -7.256 0.468 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -10.182 -6.820 1.190 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -11.360 -7.778 2.066 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -11.531 -9.102 -0.273 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -9.932 -8.430 -0.523 1.00 0.00 H new ATOM 1150 N GLY A 74 -11.940 -4.316 0.246 1.00 0.00 N ATOM 1151 CA GLY A 74 -12.116 -2.921 0.751 1.00 0.00 C ATOM 1152 C GLY A 74 -10.822 -2.416 1.397 1.00 0.00 C ATOM 1153 O GLY A 74 -10.767 -1.316 1.908 1.00 0.00 O ATOM 0 H GLY A 74 -11.473 -4.394 -0.657 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.399 -2.264 -0.071 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -12.928 -2.891 1.478 1.00 0.00 H new ATOM 1157 N VAL A 75 -9.784 -3.202 1.374 1.00 0.00 N ATOM 1158 CA VAL A 75 -8.499 -2.758 1.983 1.00 0.00 C ATOM 1159 C VAL A 75 -7.853 -1.675 1.111 1.00 0.00 C ATOM 1160 O VAL A 75 -7.064 -1.962 0.232 1.00 0.00 O ATOM 1161 CB VAL A 75 -7.627 -4.017 2.011 1.00 0.00 C ATOM 1162 CG1 VAL A 75 -6.462 -3.808 2.972 1.00 0.00 C ATOM 1163 CG2 VAL A 75 -8.453 -5.213 2.490 1.00 0.00 C ATOM 0 H VAL A 75 -9.769 -4.134 0.960 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.632 -2.330 2.976 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.252 -4.210 1.006 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -5.842 -4.704 2.992 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -5.864 -2.960 2.640 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.847 -3.611 3.973 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.826 -6.105 2.507 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.831 -5.016 3.493 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -9.291 -5.372 1.811 1.00 0.00 H new ATOM 1173 N VAL A 76 -8.178 -0.433 1.348 1.00 0.00 N ATOM 1174 CA VAL A 76 -7.575 0.660 0.530 1.00 0.00 C ATOM 1175 C VAL A 76 -6.627 1.492 1.396 1.00 0.00 C ATOM 1176 O VAL A 76 -7.009 2.039 2.412 1.00 0.00 O ATOM 1177 CB VAL A 76 -8.758 1.504 0.050 1.00 0.00 C ATOM 1178 CG1 VAL A 76 -8.306 2.439 -1.080 1.00 0.00 C ATOM 1179 CG2 VAL A 76 -9.862 0.576 -0.465 1.00 0.00 C ATOM 0 H VAL A 76 -8.832 -0.128 2.069 1.00 0.00 H new ATOM 0 HA VAL A 76 -6.991 0.280 -0.308 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.136 2.103 0.879 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -9.152 3.037 -1.418 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.519 3.098 -0.714 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.925 1.847 -1.912 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -10.708 1.172 -0.808 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.479 -0.021 -1.293 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.186 -0.085 0.339 1.00 0.00 H new ATOM 1189 N VAL A 77 -5.388 1.573 1.004 1.00 0.00 N ATOM 1190 CA VAL A 77 -4.390 2.349 1.797 1.00 0.00 C ATOM 1191 C VAL A 77 -3.465 3.128 0.867 1.00 0.00 C ATOM 1192 O VAL A 77 -3.396 2.843 -0.308 1.00 0.00 O ATOM 1193 CB VAL A 77 -3.574 1.284 2.523 1.00 0.00 C ATOM 1194 CG1 VAL A 77 -4.480 0.485 3.455 1.00 0.00 C ATOM 1195 CG2 VAL A 77 -2.944 0.344 1.483 1.00 0.00 C ATOM 0 H VAL A 77 -5.019 1.132 0.162 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.867 3.063 2.468 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.791 1.760 3.113 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.892 -0.274 3.971 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.930 1.155 4.187 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.266 0.003 2.873 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -2.358 -0.421 1.992 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -3.731 -0.131 0.898 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -2.295 0.917 0.821 1.00 0.00 H new ATOM 1205 N PRO A 78 -2.731 4.048 1.434 1.00 0.00 N ATOM 1206 CA PRO A 78 -1.751 4.820 0.637 1.00 0.00 C ATOM 1207 C PRO A 78 -0.709 3.839 0.125 1.00 0.00 C ATOM 1208 O PRO A 78 0.278 3.561 0.776 1.00 0.00 O ATOM 1209 CB PRO A 78 -1.158 5.798 1.648 1.00 0.00 C ATOM 1210 CG PRO A 78 -1.393 5.147 2.969 1.00 0.00 C ATOM 1211 CD PRO A 78 -2.720 4.445 2.844 1.00 0.00 C ATOM 0 HA PRO A 78 -2.162 5.345 -0.225 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.095 5.961 1.468 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -1.644 6.772 1.592 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -0.597 4.441 3.205 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -1.414 5.884 3.771 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -2.789 3.584 3.509 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -3.553 5.104 3.088 1.00 0.00 H new ATOM 1219 N ALA A 79 -0.954 3.265 -1.010 1.00 0.00 N ATOM 1220 CA ALA A 79 -0.014 2.250 -1.537 1.00 0.00 C ATOM 1221 C ALA A 79 0.980 2.854 -2.526 1.00 0.00 C ATOM 1222 O ALA A 79 0.609 3.435 -3.525 1.00 0.00 O ATOM 1223 CB ALA A 79 -0.915 1.237 -2.229 1.00 0.00 C ATOM 0 H ALA A 79 -1.766 3.455 -1.597 1.00 0.00 H new ATOM 0 HA ALA A 79 0.595 1.810 -0.747 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.306 0.440 -2.655 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.611 0.815 -1.504 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.474 1.731 -3.024 1.00 0.00 H new ATOM 1229 N ILE A 80 2.247 2.693 -2.259 1.00 0.00 N ATOM 1230 CA ILE A 80 3.279 3.227 -3.191 1.00 0.00 C ATOM 1231 C ILE A 80 3.675 2.128 -4.179 1.00 0.00 C ATOM 1232 O ILE A 80 4.056 1.038 -3.795 1.00 0.00 O ATOM 1233 CB ILE A 80 4.460 3.626 -2.305 1.00 0.00 C ATOM 1234 CG1 ILE A 80 3.953 4.500 -1.152 1.00 0.00 C ATOM 1235 CG2 ILE A 80 5.477 4.414 -3.135 1.00 0.00 C ATOM 1236 CD1 ILE A 80 5.050 4.650 -0.099 1.00 0.00 C ATOM 0 H ILE A 80 2.612 2.215 -1.435 1.00 0.00 H new ATOM 0 HA ILE A 80 2.926 4.078 -3.774 1.00 0.00 H new ATOM 0 HB ILE A 80 4.936 2.731 -1.904 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.660 5.480 -1.528 1.00 0.00 H new ATOM 0 HG13 ILE A 80 3.066 4.051 -0.705 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.319 4.699 -2.504 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.833 3.794 -3.958 1.00 0.00 H new ATOM 0 HG23 ILE A 80 5.004 5.311 -3.535 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.686 5.272 0.719 1.00 0.00 H new ATOM 0 HD12 ILE A 80 5.322 3.667 0.285 1.00 0.00 H new ATOM 0 HD13 ILE A 80 5.925 5.118 -0.549 1.00 0.00 H new ATOM 1248 N VAL A 81 3.561 2.399 -5.447 1.00 0.00 N ATOM 1249 CA VAL A 81 3.898 1.370 -6.473 1.00 0.00 C ATOM 1250 C VAL A 81 5.247 1.689 -7.130 1.00 0.00 C ATOM 1251 O VAL A 81 5.572 2.831 -7.389 1.00 0.00 O ATOM 1252 CB VAL A 81 2.751 1.456 -7.478 1.00 0.00 C ATOM 1253 CG1 VAL A 81 2.894 0.355 -8.528 1.00 0.00 C ATOM 1254 CG2 VAL A 81 1.426 1.274 -6.730 1.00 0.00 C ATOM 0 H VAL A 81 3.247 3.294 -5.822 1.00 0.00 H new ATOM 0 HA VAL A 81 4.000 0.369 -6.055 1.00 0.00 H new ATOM 0 HB VAL A 81 2.773 2.426 -7.975 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.072 0.423 -9.241 1.00 0.00 H new ATOM 0 HG12 VAL A 81 3.841 0.474 -9.054 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.871 -0.619 -8.039 1.00 0.00 H new ATOM 0 HG21 VAL A 81 0.598 1.333 -7.437 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.416 0.300 -6.240 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.320 2.059 -5.981 1.00 0.00 H new ATOM 1264 N VAL A 82 6.040 0.681 -7.376 1.00 0.00 N ATOM 1265 CA VAL A 82 7.384 0.903 -7.987 1.00 0.00 C ATOM 1266 C VAL A 82 7.372 0.583 -9.487 1.00 0.00 C ATOM 1267 O VAL A 82 6.668 -0.298 -9.942 1.00 0.00 O ATOM 1268 CB VAL A 82 8.294 -0.068 -7.238 1.00 0.00 C ATOM 1269 CG1 VAL A 82 9.758 0.232 -7.562 1.00 0.00 C ATOM 1270 CG2 VAL A 82 8.062 0.090 -5.734 1.00 0.00 C ATOM 0 H VAL A 82 5.813 -0.294 -7.179 1.00 0.00 H new ATOM 0 HA VAL A 82 7.710 1.940 -7.905 1.00 0.00 H new ATOM 0 HB VAL A 82 8.065 -1.089 -7.544 1.00 0.00 H new ATOM 0 HG11 VAL A 82 10.400 -0.465 -7.024 1.00 0.00 H new ATOM 0 HG12 VAL A 82 9.923 0.124 -8.634 1.00 0.00 H new ATOM 0 HG13 VAL A 82 9.996 1.252 -7.260 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.708 -0.600 -5.192 1.00 0.00 H new ATOM 0 HG22 VAL A 82 8.292 1.113 -5.436 1.00 0.00 H new ATOM 0 HG23 VAL A 82 7.020 -0.130 -5.501 1.00 0.00 H new ATOM 1280 N GLY A 83 8.150 1.299 -10.257 1.00 0.00 N ATOM 1281 CA GLY A 83 8.192 1.052 -11.726 1.00 0.00 C ATOM 1282 C GLY A 83 7.456 2.187 -12.445 1.00 0.00 C ATOM 1283 O GLY A 83 7.152 3.206 -11.858 1.00 0.00 O ATOM 0 H GLY A 83 8.760 2.047 -9.928 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.225 0.997 -12.069 1.00 0.00 H new ATOM 0 HA3 GLY A 83 7.727 0.094 -11.960 1.00 0.00 H new ATOM 1492 N LEU A 98 -3.318 -0.211 -11.034 1.00 0.00 N ATOM 1493 CA LEU A 98 -2.683 -1.289 -10.232 1.00 0.00 C ATOM 1494 C LEU A 98 -3.334 -1.315 -8.859 1.00 0.00 C ATOM 1495 O LEU A 98 -3.502 -2.350 -8.247 1.00 0.00 O ATOM 1496 CB LEU A 98 -1.205 -0.901 -10.141 1.00 0.00 C ATOM 1497 CG LEU A 98 -0.611 -0.820 -11.551 1.00 0.00 C ATOM 1498 CD1 LEU A 98 0.846 -0.368 -11.467 1.00 0.00 C ATOM 1499 CD2 LEU A 98 -0.676 -2.201 -12.210 1.00 0.00 C ATOM 0 HA LEU A 98 -2.796 -2.281 -10.669 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.100 0.059 -9.635 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.661 -1.635 -9.547 1.00 0.00 H new ATOM 0 HG LEU A 98 -1.180 -0.104 -12.144 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.268 -0.311 -12.471 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.896 0.614 -10.996 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.416 -1.084 -10.875 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.254 -2.146 -13.213 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.106 -2.915 -11.615 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.714 -2.527 -12.271 1.00 0.00 H new ATOM 1511 N TYR A 99 -3.732 -0.166 -8.391 1.00 0.00 N ATOM 1512 CA TYR A 99 -4.416 -0.088 -7.075 1.00 0.00 C ATOM 1513 C TYR A 99 -5.510 0.989 -7.147 1.00 0.00 C ATOM 1514 O TYR A 99 -6.277 1.027 -8.089 1.00 0.00 O ATOM 1515 CB TYR A 99 -3.321 0.273 -6.061 1.00 0.00 C ATOM 1516 CG TYR A 99 -3.713 -0.190 -4.667 1.00 0.00 C ATOM 1517 CD1 TYR A 99 -5.060 -0.412 -4.341 1.00 0.00 C ATOM 1518 CD2 TYR A 99 -2.722 -0.389 -3.691 1.00 0.00 C ATOM 1519 CE1 TYR A 99 -5.409 -0.828 -3.045 1.00 0.00 C ATOM 1520 CE2 TYR A 99 -3.076 -0.803 -2.398 1.00 0.00 C ATOM 1521 CZ TYR A 99 -4.419 -1.021 -2.079 1.00 0.00 C ATOM 1522 OH TYR A 99 -4.770 -1.427 -0.807 1.00 0.00 O ATOM 0 H TYR A 99 -3.611 0.727 -8.868 1.00 0.00 H new ATOM 0 HA TYR A 99 -4.903 -1.020 -6.788 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.379 -0.191 -6.353 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -3.159 1.351 -6.060 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -5.828 -0.263 -5.086 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -1.684 -0.223 -3.937 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -6.446 -0.999 -2.795 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.311 -0.953 -1.650 1.00 0.00 H new ATOM 0 HH TYR A 99 -5.735 -1.310 -0.681 1.00 0.00 H new ATOM 1532 N HIS A 100 -5.598 1.866 -6.182 1.00 0.00 N ATOM 1533 CA HIS A 100 -6.658 2.919 -6.251 1.00 0.00 C ATOM 1534 C HIS A 100 -6.081 4.221 -6.828 1.00 0.00 C ATOM 1535 O HIS A 100 -4.900 4.323 -7.092 1.00 0.00 O ATOM 1536 CB HIS A 100 -7.155 3.105 -4.814 1.00 0.00 C ATOM 1537 CG HIS A 100 -6.003 3.381 -3.893 1.00 0.00 C ATOM 1538 ND1 HIS A 100 -5.523 4.674 -3.665 1.00 0.00 N ATOM 1539 CD2 HIS A 100 -5.228 2.551 -3.119 1.00 0.00 C ATOM 1540 CE1 HIS A 100 -4.503 4.582 -2.789 1.00 0.00 C ATOM 1541 NE2 HIS A 100 -4.305 3.323 -2.447 1.00 0.00 N ATOM 0 H HIS A 100 -4.994 1.901 -5.361 1.00 0.00 H new ATOM 0 HA HIS A 100 -7.479 2.633 -6.909 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -7.867 3.929 -4.773 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -7.684 2.210 -4.487 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -5.326 1.478 -3.049 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -3.929 5.419 -2.420 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -3.594 2.982 -1.800 1.00 0.00 H new ATOM 1549 N SER A 101 -6.909 5.204 -7.058 1.00 0.00 N ATOM 1550 CA SER A 101 -6.413 6.483 -7.654 1.00 0.00 C ATOM 1551 C SER A 101 -5.482 7.237 -6.693 1.00 0.00 C ATOM 1552 O SER A 101 -4.779 8.144 -7.091 1.00 0.00 O ATOM 1553 CB SER A 101 -7.677 7.298 -7.927 1.00 0.00 C ATOM 1554 OG SER A 101 -8.158 7.847 -6.708 1.00 0.00 O ATOM 0 H SER A 101 -7.909 5.179 -6.859 1.00 0.00 H new ATOM 0 HA SER A 101 -5.825 6.303 -8.554 1.00 0.00 H new ATOM 0 HB2 SER A 101 -7.462 8.096 -8.638 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.440 6.665 -8.380 1.00 0.00 H new ATOM 0 HG SER A 101 -8.967 8.371 -6.882 1.00 0.00 H new ATOM 1560 N ALA A 102 -5.471 6.884 -5.439 1.00 0.00 N ATOM 1561 CA ALA A 102 -4.583 7.605 -4.477 1.00 0.00 C ATOM 1562 C ALA A 102 -3.192 6.952 -4.412 1.00 0.00 C ATOM 1563 O ALA A 102 -2.216 7.589 -4.068 1.00 0.00 O ATOM 1564 CB ALA A 102 -5.296 7.508 -3.130 1.00 0.00 C ATOM 0 H ALA A 102 -6.033 6.133 -5.037 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.416 8.640 -4.776 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -4.705 8.016 -2.368 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -6.276 7.979 -3.202 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -5.417 6.460 -2.857 1.00 0.00 H new ATOM 1570 N GLU A 103 -3.092 5.689 -4.732 1.00 0.00 N ATOM 1571 CA GLU A 103 -1.770 4.998 -4.683 1.00 0.00 C ATOM 1572 C GLU A 103 -0.681 5.854 -5.343 1.00 0.00 C ATOM 1573 O GLU A 103 -0.896 6.465 -6.371 1.00 0.00 O ATOM 1574 CB GLU A 103 -1.987 3.713 -5.482 1.00 0.00 C ATOM 1575 CG GLU A 103 -2.082 4.051 -6.975 1.00 0.00 C ATOM 1576 CD GLU A 103 -2.406 2.784 -7.774 1.00 0.00 C ATOM 1577 OE1 GLU A 103 -1.504 1.991 -7.983 1.00 0.00 O ATOM 1578 OE2 GLU A 103 -3.552 2.632 -8.169 1.00 0.00 O ATOM 0 H GLU A 103 -3.873 5.103 -5.027 1.00 0.00 H new ATOM 0 HA GLU A 103 -1.440 4.811 -3.661 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -1.165 3.019 -5.307 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -2.899 3.216 -5.152 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -2.854 4.803 -7.139 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -1.141 4.480 -7.321 1.00 0.00 H new ATOM 1585 N LEU A 104 0.492 5.892 -4.766 1.00 0.00 N ATOM 1586 CA LEU A 104 1.594 6.696 -5.369 1.00 0.00 C ATOM 1587 C LEU A 104 2.562 5.780 -6.119 1.00 0.00 C ATOM 1588 O LEU A 104 2.565 4.579 -5.935 1.00 0.00 O ATOM 1589 CB LEU A 104 2.293 7.374 -4.192 1.00 0.00 C ATOM 1590 CG LEU A 104 1.672 8.750 -3.963 1.00 0.00 C ATOM 1591 CD1 LEU A 104 0.227 8.588 -3.493 1.00 0.00 C ATOM 1592 CD2 LEU A 104 2.469 9.498 -2.898 1.00 0.00 C ATOM 0 H LEU A 104 0.733 5.402 -3.905 1.00 0.00 H new ATOM 0 HA LEU A 104 1.224 7.426 -6.089 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.194 6.763 -3.294 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.359 7.472 -4.395 1.00 0.00 H new ATOM 0 HG LEU A 104 1.690 9.314 -4.896 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.215 9.571 -3.330 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -0.345 8.054 -4.252 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.209 8.023 -2.561 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.026 10.480 -2.735 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.451 8.932 -1.966 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.500 9.616 -3.231 1.00 0.00 H new ATOM 1604 N HIS A 105 3.374 6.336 -6.971 1.00 0.00 N ATOM 1605 CA HIS A 105 4.336 5.501 -7.748 1.00 0.00 C ATOM 1606 C HIS A 105 5.773 5.928 -7.435 1.00 0.00 C ATOM 1607 O HIS A 105 6.039 7.073 -7.136 1.00 0.00 O ATOM 1608 CB HIS A 105 3.996 5.782 -9.215 1.00 0.00 C ATOM 1609 CG HIS A 105 2.502 5.763 -9.391 1.00 0.00 C ATOM 1610 ND1 HIS A 105 1.827 6.737 -10.111 1.00 0.00 N ATOM 1611 CD2 HIS A 105 1.537 4.909 -8.919 1.00 0.00 C ATOM 1612 CE1 HIS A 105 0.514 6.449 -10.050 1.00 0.00 C ATOM 1613 NE2 HIS A 105 0.283 5.344 -9.336 1.00 0.00 N ATOM 0 H HIS A 105 3.415 7.336 -7.165 1.00 0.00 H new ATOM 0 HA HIS A 105 4.262 4.441 -7.507 1.00 0.00 H new ATOM 0 HB2 HIS A 105 4.397 6.751 -9.514 1.00 0.00 H new ATOM 0 HB3 HIS A 105 4.459 5.033 -9.858 1.00 0.00 H new ATOM 0 HD1 HIS A 105 2.249 7.528 -10.598 1.00 0.00 H new ATOM 0 HD2 HIS A 105 1.723 4.033 -8.316 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -0.258 7.039 -10.521 1.00 0.00 H new ATOM 1621 N LEU A 106 6.701 5.011 -7.496 1.00 0.00 N ATOM 1622 CA LEU A 106 8.121 5.364 -7.199 1.00 0.00 C ATOM 1623 C LEU A 106 9.051 4.730 -8.236 1.00 0.00 C ATOM 1624 O LEU A 106 8.982 3.545 -8.501 1.00 0.00 O ATOM 1625 CB LEU A 106 8.383 4.786 -5.805 1.00 0.00 C ATOM 1626 CG LEU A 106 9.832 5.051 -5.389 1.00 0.00 C ATOM 1627 CD1 LEU A 106 10.102 6.557 -5.388 1.00 0.00 C ATOM 1628 CD2 LEU A 106 10.060 4.498 -3.981 1.00 0.00 C ATOM 0 H LEU A 106 6.538 4.034 -7.738 1.00 0.00 H new ATOM 0 HA LEU A 106 8.301 6.438 -7.234 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.701 5.235 -5.083 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.187 3.714 -5.805 1.00 0.00 H new ATOM 0 HG LEU A 106 10.506 4.563 -6.093 1.00 0.00 H new ATOM 0 HD11 LEU A 106 11.135 6.741 -5.091 1.00 0.00 H new ATOM 0 HD12 LEU A 106 9.935 6.957 -6.388 1.00 0.00 H new ATOM 0 HD13 LEU A 106 9.429 7.047 -4.684 1.00 0.00 H new ATOM 0 HD21 LEU A 106 11.091 4.684 -3.680 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.383 4.990 -3.283 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.869 3.425 -3.976 1.00 0.00 H new ATOM 1640 N GLY A 107 9.924 5.501 -8.825 1.00 0.00 N ATOM 1641 CA GLY A 107 10.853 4.926 -9.837 1.00 0.00 C ATOM 1642 C GLY A 107 11.560 3.714 -9.230 1.00 0.00 C ATOM 1643 O GLY A 107 11.712 3.612 -8.029 1.00 0.00 O ATOM 0 H GLY A 107 10.034 6.500 -8.650 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.302 4.632 -10.730 1.00 0.00 H new ATOM 0 HA3 GLY A 107 11.584 5.673 -10.145 1.00 0.00 H new ATOM 1647 N ILE A 108 11.984 2.791 -10.046 1.00 0.00 N ATOM 1648 CA ILE A 108 12.667 1.585 -9.525 1.00 0.00 C ATOM 1649 C ILE A 108 13.999 1.957 -8.864 1.00 0.00 C ATOM 1650 O ILE A 108 14.276 1.576 -7.743 1.00 0.00 O ATOM 1651 CB ILE A 108 12.895 0.738 -10.772 1.00 0.00 C ATOM 1652 CG1 ILE A 108 11.565 0.482 -11.487 1.00 0.00 C ATOM 1653 CG2 ILE A 108 13.483 -0.588 -10.351 1.00 0.00 C ATOM 1654 CD1 ILE A 108 10.582 -0.162 -10.511 1.00 0.00 C ATOM 0 H ILE A 108 11.884 2.825 -11.060 1.00 0.00 H new ATOM 0 HA ILE A 108 12.090 1.065 -8.760 1.00 0.00 H new ATOM 0 HB ILE A 108 13.570 1.263 -11.448 1.00 0.00 H new ATOM 0 HG12 ILE A 108 11.157 1.419 -11.867 1.00 0.00 H new ATOM 0 HG13 ILE A 108 11.721 -0.170 -12.347 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.653 -1.207 -11.232 1.00 0.00 H new ATOM 0 HG22 ILE A 108 14.430 -0.420 -9.838 1.00 0.00 H new ATOM 0 HG23 ILE A 108 12.791 -1.096 -9.679 1.00 0.00 H new ATOM 0 HD11 ILE A 108 9.634 -0.345 -11.017 1.00 0.00 H new ATOM 0 HD12 ILE A 108 10.991 -1.107 -10.153 1.00 0.00 H new ATOM 0 HD13 ILE A 108 10.418 0.506 -9.665 1.00 0.00 H new ATOM 1666 N HIS A 109 14.824 2.702 -9.546 1.00 0.00 N ATOM 1667 CA HIS A 109 16.135 3.103 -8.960 1.00 0.00 C ATOM 1668 C HIS A 109 15.921 4.219 -7.940 1.00 0.00 C ATOM 1669 O HIS A 109 16.843 4.669 -7.288 1.00 0.00 O ATOM 1670 CB HIS A 109 16.955 3.626 -10.140 1.00 0.00 C ATOM 1671 CG HIS A 109 16.395 4.951 -10.587 1.00 0.00 C ATOM 1672 ND1 HIS A 109 17.146 6.114 -10.566 1.00 0.00 N ATOM 1673 CD2 HIS A 109 15.153 5.316 -11.049 1.00 0.00 C ATOM 1674 CE1 HIS A 109 16.357 7.115 -10.998 1.00 0.00 C ATOM 1675 NE2 HIS A 109 15.131 6.682 -11.305 1.00 0.00 N ATOM 0 H HIS A 109 14.646 3.052 -10.488 1.00 0.00 H new ATOM 0 HA HIS A 109 16.631 2.277 -8.450 1.00 0.00 H new ATOM 0 HB2 HIS A 109 18.000 3.739 -9.850 1.00 0.00 H new ATOM 0 HB3 HIS A 109 16.928 2.911 -10.962 1.00 0.00 H new ATOM 0 HD2 HIS A 109 14.320 4.643 -11.192 1.00 0.00 H new ATOM 0 HE1 HIS A 109 16.676 8.143 -11.086 1.00 0.00 H new ATOM 0 HE2 HIS A 109 14.347 7.235 -11.652 1.00 0.00 H new ATOM 1683 N GLN A 110 14.711 4.684 -7.812 1.00 0.00 N ATOM 1684 CA GLN A 110 14.445 5.788 -6.850 1.00 0.00 C ATOM 1685 C GLN A 110 13.967 5.243 -5.509 1.00 0.00 C ATOM 1686 O GLN A 110 13.268 5.910 -4.775 1.00 0.00 O ATOM 1687 CB GLN A 110 13.362 6.643 -7.507 1.00 0.00 C ATOM 1688 CG GLN A 110 14.022 7.651 -8.450 1.00 0.00 C ATOM 1689 CD GLN A 110 12.948 8.416 -9.228 1.00 0.00 C ATOM 1690 OE1 GLN A 110 12.852 8.292 -10.433 1.00 0.00 O ATOM 1691 NE2 GLN A 110 12.133 9.209 -8.589 1.00 0.00 N ATOM 0 H GLN A 110 13.898 4.349 -8.329 1.00 0.00 H new ATOM 0 HA GLN A 110 15.346 6.365 -6.640 1.00 0.00 H new ATOM 0 HB2 GLN A 110 12.667 6.010 -8.060 1.00 0.00 H new ATOM 0 HB3 GLN A 110 12.782 7.165 -6.746 1.00 0.00 H new ATOM 0 HG2 GLN A 110 14.636 8.348 -7.880 1.00 0.00 H new ATOM 0 HG3 GLN A 110 14.686 7.134 -9.142 1.00 0.00 H new ATOM 0 HE21 GLN A 110 12.212 9.314 -7.578 1.00 0.00 H new ATOM 0 HE22 GLN A 110 11.416 9.724 -9.101 1.00 0.00 H new ATOM 1700 N LEU A 111 14.346 4.046 -5.169 1.00 0.00 N ATOM 1701 CA LEU A 111 13.908 3.498 -3.860 1.00 0.00 C ATOM 1702 C LEU A 111 14.633 4.236 -2.746 1.00 0.00 C ATOM 1703 O LEU A 111 15.802 4.031 -2.491 1.00 0.00 O ATOM 1704 CB LEU A 111 14.272 2.008 -3.891 1.00 0.00 C ATOM 1705 CG LEU A 111 13.185 1.171 -4.609 1.00 0.00 C ATOM 1706 CD1 LEU A 111 12.521 0.236 -3.606 1.00 0.00 C ATOM 1707 CD2 LEU A 111 12.097 2.059 -5.232 1.00 0.00 C ATOM 0 H LEU A 111 14.932 3.430 -5.732 1.00 0.00 H new ATOM 0 HA LEU A 111 12.840 3.622 -3.681 1.00 0.00 H new ATOM 0 HB2 LEU A 111 15.228 1.877 -4.399 1.00 0.00 H new ATOM 0 HB3 LEU A 111 14.400 1.643 -2.872 1.00 0.00 H new ATOM 0 HG LEU A 111 13.676 0.610 -5.405 1.00 0.00 H new ATOM 0 HD11 LEU A 111 11.755 -0.354 -4.110 1.00 0.00 H new ATOM 0 HD12 LEU A 111 13.270 -0.431 -3.179 1.00 0.00 H new ATOM 0 HD13 LEU A 111 12.062 0.823 -2.810 1.00 0.00 H new ATOM 0 HD21 LEU A 111 11.354 1.432 -5.726 1.00 0.00 H new ATOM 0 HD22 LEU A 111 11.615 2.646 -4.450 1.00 0.00 H new ATOM 0 HD23 LEU A 111 12.549 2.730 -5.963 1.00 0.00 H new ATOM 1719 N GLU A 112 13.921 5.111 -2.108 1.00 0.00 N ATOM 1720 CA GLU A 112 14.493 5.934 -1.006 1.00 0.00 C ATOM 1721 C GLU A 112 13.470 7.012 -0.634 1.00 0.00 C ATOM 1722 O GLU A 112 13.408 7.470 0.488 1.00 0.00 O ATOM 1723 CB GLU A 112 15.747 6.574 -1.591 1.00 0.00 C ATOM 1724 CG GLU A 112 15.371 7.256 -2.900 1.00 0.00 C ATOM 1725 CD GLU A 112 16.630 7.774 -3.596 1.00 0.00 C ATOM 1726 OE1 GLU A 112 17.269 8.654 -3.044 1.00 0.00 O ATOM 1727 OE2 GLU A 112 16.935 7.279 -4.669 1.00 0.00 O ATOM 0 H GLU A 112 12.938 5.299 -2.307 1.00 0.00 H new ATOM 0 HA GLU A 112 14.726 5.355 -0.112 1.00 0.00 H new ATOM 0 HB2 GLU A 112 16.165 7.299 -0.892 1.00 0.00 H new ATOM 0 HB3 GLU A 112 16.514 5.819 -1.763 1.00 0.00 H new ATOM 0 HG2 GLU A 112 14.849 6.554 -3.549 1.00 0.00 H new ATOM 0 HG3 GLU A 112 14.686 8.081 -2.707 1.00 0.00 H new ATOM 1734 N GLN A 113 12.653 7.403 -1.583 1.00 0.00 N ATOM 1735 CA GLN A 113 11.609 8.434 -1.305 1.00 0.00 C ATOM 1736 C GLN A 113 10.409 7.774 -0.621 1.00 0.00 C ATOM 1737 O GLN A 113 9.489 8.431 -0.180 1.00 0.00 O ATOM 1738 CB GLN A 113 11.211 8.982 -2.676 1.00 0.00 C ATOM 1739 CG GLN A 113 12.371 9.799 -3.251 1.00 0.00 C ATOM 1740 CD GLN A 113 12.029 10.262 -4.668 1.00 0.00 C ATOM 1741 OE1 GLN A 113 10.891 10.192 -5.088 1.00 0.00 O ATOM 1742 NE2 GLN A 113 12.979 10.733 -5.429 1.00 0.00 N ATOM 0 H GLN A 113 12.666 7.050 -2.540 1.00 0.00 H new ATOM 0 HA GLN A 113 11.967 9.225 -0.646 1.00 0.00 H new ATOM 0 HB2 GLN A 113 10.960 8.162 -3.349 1.00 0.00 H new ATOM 0 HB3 GLN A 113 10.321 9.605 -2.587 1.00 0.00 H new ATOM 0 HG2 GLN A 113 12.570 10.662 -2.615 1.00 0.00 H new ATOM 0 HG3 GLN A 113 13.280 9.197 -3.265 1.00 0.00 H new ATOM 0 HE21 GLN A 113 13.934 10.791 -5.075 1.00 0.00 H new ATOM 0 HE22 GLN A 113 12.766 11.043 -6.377 1.00 0.00 H new ATOM 1751 N LEU A 114 10.422 6.470 -0.528 1.00 0.00 N ATOM 1752 CA LEU A 114 9.295 5.746 0.125 1.00 0.00 C ATOM 1753 C LEU A 114 8.787 6.494 1.360 1.00 0.00 C ATOM 1754 O LEU A 114 7.602 6.682 1.500 1.00 0.00 O ATOM 1755 CB LEU A 114 9.880 4.398 0.528 1.00 0.00 C ATOM 1756 CG LEU A 114 10.081 3.533 -0.718 1.00 0.00 C ATOM 1757 CD1 LEU A 114 11.574 3.439 -1.049 1.00 0.00 C ATOM 1758 CD2 LEU A 114 9.519 2.133 -0.457 1.00 0.00 C ATOM 0 H LEU A 114 11.171 5.873 -0.879 1.00 0.00 H new ATOM 0 HA LEU A 114 8.440 5.651 -0.545 1.00 0.00 H new ATOM 0 HB2 LEU A 114 10.831 4.542 1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.213 3.895 1.228 1.00 0.00 H new ATOM 0 HG LEU A 114 9.558 3.984 -1.562 1.00 0.00 H new ATOM 0 HD11 LEU A 114 11.712 2.822 -1.937 1.00 0.00 H new ATOM 0 HD12 LEU A 114 11.969 4.438 -1.236 1.00 0.00 H new ATOM 0 HD13 LEU A 114 12.105 2.990 -0.210 1.00 0.00 H new ATOM 0 HD21 LEU A 114 9.660 1.513 -1.343 1.00 0.00 H new ATOM 0 HD22 LEU A 114 10.041 1.683 0.388 1.00 0.00 H new ATOM 0 HD23 LEU A 114 8.455 2.204 -0.230 1.00 0.00 H new ATOM 1770 N PRO A 115 9.679 6.892 2.230 1.00 0.00 N ATOM 1771 CA PRO A 115 9.250 7.616 3.452 1.00 0.00 C ATOM 1772 C PRO A 115 8.572 8.930 3.067 1.00 0.00 C ATOM 1773 O PRO A 115 7.415 9.142 3.369 1.00 0.00 O ATOM 1774 CB PRO A 115 10.550 7.818 4.228 1.00 0.00 C ATOM 1775 CG PRO A 115 11.617 7.745 3.189 1.00 0.00 C ATOM 1776 CD PRO A 115 11.137 6.728 2.188 1.00 0.00 C ATOM 0 HA PRO A 115 8.513 7.082 4.052 1.00 0.00 H new ATOM 0 HB2 PRO A 115 10.561 8.779 4.742 1.00 0.00 H new ATOM 0 HB3 PRO A 115 10.683 7.048 4.989 1.00 0.00 H new ATOM 0 HG2 PRO A 115 11.773 8.716 2.718 1.00 0.00 H new ATOM 0 HG3 PRO A 115 12.570 7.446 3.626 1.00 0.00 H new ATOM 0 HD2 PRO A 115 11.537 6.921 1.192 1.00 0.00 H new ATOM 0 HD3 PRO A 115 11.438 5.717 2.463 1.00 0.00 H new ATOM 1784 N TYR A 116 9.251 9.803 2.377 1.00 0.00 N ATOM 1785 CA TYR A 116 8.577 11.066 1.965 1.00 0.00 C ATOM 1786 C TYR A 116 7.376 10.701 1.084 1.00 0.00 C ATOM 1787 O TYR A 116 6.361 11.369 1.092 1.00 0.00 O ATOM 1788 CB TYR A 116 9.655 11.891 1.230 1.00 0.00 C ATOM 1789 CG TYR A 116 9.301 12.120 -0.222 1.00 0.00 C ATOM 1790 CD1 TYR A 116 8.113 12.780 -0.569 1.00 0.00 C ATOM 1791 CD2 TYR A 116 10.174 11.677 -1.217 1.00 0.00 C ATOM 1792 CE1 TYR A 116 7.802 12.991 -1.916 1.00 0.00 C ATOM 1793 CE2 TYR A 116 9.865 11.891 -2.565 1.00 0.00 C ATOM 1794 CZ TYR A 116 8.678 12.547 -2.917 1.00 0.00 C ATOM 1795 OH TYR A 116 8.372 12.761 -4.247 1.00 0.00 O ATOM 0 H TYR A 116 10.223 9.702 2.085 1.00 0.00 H new ATOM 0 HA TYR A 116 8.184 11.656 2.793 1.00 0.00 H new ATOM 0 HB2 TYR A 116 9.779 12.852 1.729 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.612 11.374 1.293 1.00 0.00 H new ATOM 0 HD1 TYR A 116 7.440 13.124 0.202 1.00 0.00 H new ATOM 0 HD2 TYR A 116 11.088 11.169 -0.947 1.00 0.00 H new ATOM 0 HE1 TYR A 116 6.886 13.496 -2.186 1.00 0.00 H new ATOM 0 HE2 TYR A 116 10.542 11.550 -3.334 1.00 0.00 H new ATOM 0 HH TYR A 116 9.084 12.392 -4.810 1.00 0.00 H new ATOM 1805 N GLN A 117 7.471 9.621 0.353 1.00 0.00 N ATOM 1806 CA GLN A 117 6.320 9.190 -0.483 1.00 0.00 C ATOM 1807 C GLN A 117 5.224 8.674 0.445 1.00 0.00 C ATOM 1808 O GLN A 117 4.064 8.980 0.289 1.00 0.00 O ATOM 1809 CB GLN A 117 6.852 8.065 -1.376 1.00 0.00 C ATOM 1810 CG GLN A 117 7.674 8.662 -2.523 1.00 0.00 C ATOM 1811 CD GLN A 117 6.745 9.392 -3.497 1.00 0.00 C ATOM 1812 OE1 GLN A 117 5.564 9.115 -3.554 1.00 0.00 O ATOM 1813 NE2 GLN A 117 7.234 10.317 -4.279 1.00 0.00 N ATOM 0 H GLN A 117 8.295 9.022 0.301 1.00 0.00 H new ATOM 0 HA GLN A 117 5.905 9.996 -1.088 1.00 0.00 H new ATOM 0 HB2 GLN A 117 7.469 7.383 -0.790 1.00 0.00 H new ATOM 0 HB3 GLN A 117 6.023 7.481 -1.775 1.00 0.00 H new ATOM 0 HG2 GLN A 117 8.419 9.353 -2.128 1.00 0.00 H new ATOM 0 HG3 GLN A 117 8.216 7.873 -3.044 1.00 0.00 H new ATOM 0 HE21 GLN A 117 8.226 10.552 -4.233 1.00 0.00 H new ATOM 0 HE22 GLN A 117 6.624 10.805 -4.935 1.00 0.00 H new ATOM 1822 N VAL A 118 5.605 7.905 1.430 1.00 0.00 N ATOM 1823 CA VAL A 118 4.612 7.372 2.407 1.00 0.00 C ATOM 1824 C VAL A 118 3.842 8.539 3.027 1.00 0.00 C ATOM 1825 O VAL A 118 2.628 8.572 3.012 1.00 0.00 O ATOM 1826 CB VAL A 118 5.458 6.639 3.466 1.00 0.00 C ATOM 1827 CG1 VAL A 118 4.759 6.668 4.832 1.00 0.00 C ATOM 1828 CG2 VAL A 118 5.658 5.182 3.043 1.00 0.00 C ATOM 0 H VAL A 118 6.570 7.621 1.601 1.00 0.00 H new ATOM 0 HA VAL A 118 3.877 6.706 1.955 1.00 0.00 H new ATOM 0 HB VAL A 118 6.421 7.143 3.547 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.372 6.145 5.566 1.00 0.00 H new ATOM 0 HG12 VAL A 118 4.619 7.702 5.147 1.00 0.00 H new ATOM 0 HG13 VAL A 118 3.789 6.177 4.755 1.00 0.00 H new ATOM 0 HG21 VAL A 118 6.257 4.664 3.793 1.00 0.00 H new ATOM 0 HG22 VAL A 118 4.688 4.693 2.952 1.00 0.00 H new ATOM 0 HG23 VAL A 118 6.172 5.149 2.082 1.00 0.00 H new ATOM 1838 N ASP A 119 4.540 9.505 3.559 1.00 0.00 N ATOM 1839 CA ASP A 119 3.843 10.673 4.162 1.00 0.00 C ATOM 1840 C ASP A 119 2.965 11.334 3.100 1.00 0.00 C ATOM 1841 O ASP A 119 1.842 11.726 3.358 1.00 0.00 O ATOM 1842 CB ASP A 119 4.963 11.615 4.604 1.00 0.00 C ATOM 1843 CG ASP A 119 5.781 10.953 5.716 1.00 0.00 C ATOM 1844 OD1 ASP A 119 5.416 9.861 6.124 1.00 0.00 O ATOM 1845 OD2 ASP A 119 6.757 11.548 6.140 1.00 0.00 O ATOM 0 H ASP A 119 5.559 9.535 3.602 1.00 0.00 H new ATOM 0 HA ASP A 119 3.198 10.401 4.997 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.607 11.853 3.757 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.542 12.556 4.959 1.00 0.00 H new ATOM 1850 N ALA A 120 3.463 11.434 1.895 1.00 0.00 N ATOM 1851 CA ALA A 120 2.655 12.041 0.798 1.00 0.00 C ATOM 1852 C ALA A 120 1.524 11.086 0.423 1.00 0.00 C ATOM 1853 O ALA A 120 0.407 11.490 0.168 1.00 0.00 O ATOM 1854 CB ALA A 120 3.622 12.206 -0.377 1.00 0.00 C ATOM 0 H ALA A 120 4.395 11.121 1.624 1.00 0.00 H new ATOM 0 HA ALA A 120 2.209 12.994 1.084 1.00 0.00 H new ATOM 0 HB1 ALA A 120 3.095 12.648 -1.222 1.00 0.00 H new ATOM 0 HB2 ALA A 120 4.445 12.856 -0.082 1.00 0.00 H new ATOM 0 HB3 ALA A 120 4.015 11.231 -0.664 1.00 0.00 H new ATOM 1860 N ALA A 121 1.816 9.815 0.390 1.00 0.00 N ATOM 1861 CA ALA A 121 0.778 8.809 0.035 1.00 0.00 C ATOM 1862 C ALA A 121 -0.348 8.823 1.072 1.00 0.00 C ATOM 1863 O ALA A 121 -1.511 8.727 0.736 1.00 0.00 O ATOM 1864 CB ALA A 121 1.512 7.466 0.044 1.00 0.00 C ATOM 0 H ALA A 121 2.737 9.428 0.596 1.00 0.00 H new ATOM 0 HA ALA A 121 0.315 9.011 -0.931 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.814 6.668 -0.209 1.00 0.00 H new ATOM 0 HB2 ALA A 121 2.319 7.488 -0.688 1.00 0.00 H new ATOM 0 HB3 ALA A 121 1.926 7.285 1.036 1.00 0.00 H new ATOM 1870 N LEU A 122 -0.019 8.950 2.329 1.00 0.00 N ATOM 1871 CA LEU A 122 -1.087 8.978 3.368 1.00 0.00 C ATOM 1872 C LEU A 122 -1.998 10.179 3.127 1.00 0.00 C ATOM 1873 O LEU A 122 -3.202 10.048 3.028 1.00 0.00 O ATOM 1874 CB LEU A 122 -0.349 9.122 4.695 1.00 0.00 C ATOM 1875 CG LEU A 122 0.630 7.963 4.852 1.00 0.00 C ATOM 1876 CD1 LEU A 122 1.831 8.420 5.679 1.00 0.00 C ATOM 1877 CD2 LEU A 122 -0.067 6.805 5.566 1.00 0.00 C ATOM 0 H LEU A 122 0.935 9.035 2.679 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.712 8.085 3.352 1.00 0.00 H new ATOM 0 HB2 LEU A 122 0.185 10.072 4.727 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -1.060 9.128 5.521 1.00 0.00 H new ATOM 0 HG LEU A 122 0.969 7.636 3.869 1.00 0.00 H new ATOM 0 HD11 LEU A 122 2.531 7.592 5.792 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.327 9.249 5.173 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.493 8.746 6.663 1.00 0.00 H new ATOM 0 HD21 LEU A 122 0.630 5.975 5.680 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -0.403 7.134 6.549 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -0.926 6.480 4.979 1.00 0.00 H new ATOM 1889 N ALA A 123 -1.429 11.348 3.007 1.00 0.00 N ATOM 1890 CA ALA A 123 -2.268 12.550 2.745 1.00 0.00 C ATOM 1891 C ALA A 123 -2.987 12.365 1.410 1.00 0.00 C ATOM 1892 O ALA A 123 -4.147 12.692 1.262 1.00 0.00 O ATOM 1893 CB ALA A 123 -1.285 13.721 2.679 1.00 0.00 C ATOM 0 H ALA A 123 -0.426 11.521 3.079 1.00 0.00 H new ATOM 0 HA ALA A 123 -3.026 12.718 3.510 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -1.832 14.645 2.488 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -0.753 13.803 3.627 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -0.569 13.550 1.875 1.00 0.00 H new ATOM 1899 N GLU A 124 -2.301 11.826 0.440 1.00 0.00 N ATOM 1900 CA GLU A 124 -2.936 11.598 -0.888 1.00 0.00 C ATOM 1901 C GLU A 124 -4.129 10.652 -0.735 1.00 0.00 C ATOM 1902 O GLU A 124 -5.175 10.855 -1.318 1.00 0.00 O ATOM 1903 CB GLU A 124 -1.847 10.951 -1.744 1.00 0.00 C ATOM 1904 CG GLU A 124 -2.295 10.940 -3.206 1.00 0.00 C ATOM 1905 CD GLU A 124 -2.411 12.379 -3.715 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -1.439 13.108 -3.600 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -3.469 12.728 -4.211 1.00 0.00 O ATOM 0 H GLU A 124 -1.326 11.533 0.510 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.308 12.519 -1.336 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -0.912 11.502 -1.642 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -1.656 9.934 -1.402 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -1.579 10.385 -3.813 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.254 10.431 -3.300 1.00 0.00 H new ATOM 1914 N PHE A 125 -3.976 9.617 0.049 1.00 0.00 N ATOM 1915 CA PHE A 125 -5.100 8.658 0.236 1.00 0.00 C ATOM 1916 C PHE A 125 -6.316 9.375 0.829 1.00 0.00 C ATOM 1917 O PHE A 125 -7.440 9.133 0.437 1.00 0.00 O ATOM 1918 CB PHE A 125 -4.573 7.603 1.206 1.00 0.00 C ATOM 1919 CG PHE A 125 -5.578 6.478 1.286 1.00 0.00 C ATOM 1920 CD1 PHE A 125 -6.621 6.533 2.217 1.00 0.00 C ATOM 1921 CD2 PHE A 125 -5.473 5.388 0.414 1.00 0.00 C ATOM 1922 CE1 PHE A 125 -7.560 5.498 2.277 1.00 0.00 C ATOM 1923 CE2 PHE A 125 -6.409 4.351 0.474 1.00 0.00 C ATOM 1924 CZ PHE A 125 -7.455 4.406 1.405 1.00 0.00 C ATOM 0 H PHE A 125 -3.124 9.396 0.565 1.00 0.00 H new ATOM 0 HA PHE A 125 -5.421 8.215 -0.707 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.608 7.225 0.867 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.415 8.040 2.192 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -6.701 7.374 2.889 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -4.669 5.348 -0.306 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -8.366 5.540 2.995 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -6.326 3.508 -0.197 1.00 0.00 H new ATOM 0 HZ PHE A 125 -8.180 3.607 1.450 1.00 0.00 H new ATOM 1934 N LEU A 126 -6.105 10.265 1.760 1.00 0.00 N ATOM 1935 CA LEU A 126 -7.255 10.999 2.355 1.00 0.00 C ATOM 1936 C LEU A 126 -7.831 11.950 1.306 1.00 0.00 C ATOM 1937 O LEU A 126 -9.008 12.253 1.295 1.00 0.00 O ATOM 1938 CB LEU A 126 -6.670 11.780 3.531 1.00 0.00 C ATOM 1939 CG LEU A 126 -5.976 10.817 4.495 1.00 0.00 C ATOM 1940 CD1 LEU A 126 -5.514 11.585 5.733 1.00 0.00 C ATOM 1941 CD2 LEU A 126 -6.958 9.724 4.920 1.00 0.00 C ATOM 0 H LEU A 126 -5.189 10.514 2.133 1.00 0.00 H new ATOM 0 HA LEU A 126 -8.058 10.339 2.681 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.959 12.523 3.169 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.461 12.322 4.050 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.117 10.365 4.000 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -5.019 10.901 6.422 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.817 12.368 5.436 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -6.376 12.034 6.225 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.463 9.038 5.607 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -7.816 10.178 5.416 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -7.296 9.176 4.040 1.00 0.00 H new ATOM 1953 N ARG A 127 -6.995 12.414 0.418 1.00 0.00 N ATOM 1954 CA ARG A 127 -7.459 13.345 -0.650 1.00 0.00 C ATOM 1955 C ARG A 127 -8.537 12.678 -1.510 1.00 0.00 C ATOM 1956 O ARG A 127 -9.513 13.298 -1.890 1.00 0.00 O ATOM 1957 CB ARG A 127 -6.206 13.633 -1.477 1.00 0.00 C ATOM 1958 CG ARG A 127 -6.121 15.132 -1.751 1.00 0.00 C ATOM 1959 CD ARG A 127 -7.407 15.582 -2.444 1.00 0.00 C ATOM 1960 NE ARG A 127 -7.270 17.053 -2.615 1.00 0.00 N ATOM 1961 CZ ARG A 127 -8.304 17.766 -2.984 1.00 0.00 C ATOM 1962 NH1 ARG A 127 -9.462 17.192 -3.177 1.00 0.00 N ATOM 1963 NH2 ARG A 127 -8.185 19.052 -3.153 1.00 0.00 N ATOM 0 H ARG A 127 -6.001 12.186 0.386 1.00 0.00 H new ATOM 0 HA ARG A 127 -7.905 14.254 -0.247 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -5.317 13.298 -0.942 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -6.240 13.081 -2.416 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -5.984 15.679 -0.818 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -5.258 15.352 -2.379 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -7.530 15.084 -3.406 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -8.283 15.336 -1.844 1.00 0.00 H new ATOM 0 HE ARG A 127 -6.372 17.506 -2.445 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -9.562 16.186 -3.040 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -10.266 17.750 -3.464 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -7.285 19.506 -2.998 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -8.992 19.605 -3.441 1.00 0.00 H new ATOM 1977 N LEU A 128 -8.378 11.420 -1.814 1.00 0.00 N ATOM 1978 CA LEU A 128 -9.405 10.721 -2.635 1.00 0.00 C ATOM 1979 C LEU A 128 -10.315 9.887 -1.729 1.00 0.00 C ATOM 1980 O LEU A 128 -11.106 9.093 -2.193 1.00 0.00 O ATOM 1981 CB LEU A 128 -8.620 9.822 -3.601 1.00 0.00 C ATOM 1982 CG LEU A 128 -7.947 10.670 -4.693 1.00 0.00 C ATOM 1983 CD1 LEU A 128 -8.920 11.736 -5.206 1.00 0.00 C ATOM 1984 CD2 LEU A 128 -6.704 11.353 -4.121 1.00 0.00 C ATOM 0 H LEU A 128 -7.583 10.847 -1.530 1.00 0.00 H new ATOM 0 HA LEU A 128 -10.045 11.418 -3.177 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -7.865 9.259 -3.052 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -9.291 9.095 -4.058 1.00 0.00 H new ATOM 0 HG LEU A 128 -7.660 10.019 -5.519 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -8.433 12.331 -5.979 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -9.803 11.252 -5.623 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -9.217 12.385 -4.382 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -6.229 11.953 -4.897 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -6.992 11.997 -3.290 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -6.003 10.597 -3.768 1.00 0.00 H new ATOM 1996 N ALA A 129 -10.213 10.064 -0.436 1.00 0.00 N ATOM 1997 CA ALA A 129 -11.078 9.281 0.496 1.00 0.00 C ATOM 1998 C ALA A 129 -12.503 9.855 0.515 1.00 0.00 C ATOM 1999 O ALA A 129 -12.678 11.047 0.664 1.00 0.00 O ATOM 2000 CB ALA A 129 -10.446 9.438 1.874 1.00 0.00 C ATOM 0 H ALA A 129 -9.569 10.716 0.013 1.00 0.00 H new ATOM 0 HA ALA A 129 -11.147 8.237 0.191 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -11.033 8.886 2.608 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -9.429 9.047 1.854 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -10.424 10.493 2.146 1.00 0.00 H new ATOM 2006 N PRO A 130 -13.480 8.993 0.374 1.00 0.00 N ATOM 2007 CA PRO A 130 -13.221 7.541 0.197 1.00 0.00 C ATOM 2008 C PRO A 130 -12.635 7.284 -1.198 1.00 0.00 C ATOM 2009 O PRO A 130 -13.201 7.673 -2.200 1.00 0.00 O ATOM 2010 CB PRO A 130 -14.602 6.909 0.349 1.00 0.00 C ATOM 2011 CG PRO A 130 -15.567 7.997 0.008 1.00 0.00 C ATOM 2012 CD PRO A 130 -14.913 9.301 0.374 1.00 0.00 C ATOM 0 HA PRO A 130 -12.503 7.133 0.908 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -14.720 6.054 -0.317 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -14.760 6.546 1.365 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -15.813 7.974 -1.054 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -16.501 7.868 0.555 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -15.153 10.083 -0.346 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -15.245 9.654 1.350 1.00 0.00 H new ATOM 2020 N VAL A 131 -11.497 6.646 -1.268 1.00 0.00 N ATOM 2021 CA VAL A 131 -10.881 6.387 -2.601 1.00 0.00 C ATOM 2022 C VAL A 131 -11.781 5.471 -3.425 1.00 0.00 C ATOM 2023 O VAL A 131 -12.636 4.780 -2.906 1.00 0.00 O ATOM 2024 CB VAL A 131 -9.524 5.729 -2.322 1.00 0.00 C ATOM 2025 CG1 VAL A 131 -8.687 5.734 -3.603 1.00 0.00 C ATOM 2026 CG2 VAL A 131 -8.786 6.513 -1.231 1.00 0.00 C ATOM 0 H VAL A 131 -10.971 6.296 -0.467 1.00 0.00 H new ATOM 0 HA VAL A 131 -10.754 7.305 -3.176 1.00 0.00 H new ATOM 0 HB VAL A 131 -9.680 4.703 -1.988 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -7.721 5.267 -3.409 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -9.209 5.177 -4.381 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -8.533 6.761 -3.933 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -7.822 6.044 -1.034 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -8.629 7.539 -1.563 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -9.382 6.515 -0.318 1.00 0.00 H new ATOM 2036 N GLU A 132 -11.602 5.482 -4.712 1.00 0.00 N ATOM 2037 CA GLU A 132 -12.450 4.636 -5.599 1.00 0.00 C ATOM 2038 C GLU A 132 -11.736 3.335 -5.951 1.00 0.00 C ATOM 2039 O GLU A 132 -10.938 3.284 -6.866 1.00 0.00 O ATOM 2040 CB GLU A 132 -12.660 5.478 -6.856 1.00 0.00 C ATOM 2041 CG GLU A 132 -13.571 6.662 -6.534 1.00 0.00 C ATOM 2042 CD GLU A 132 -13.620 7.600 -7.741 1.00 0.00 C ATOM 2043 OE1 GLU A 132 -13.355 7.134 -8.837 1.00 0.00 O ATOM 2044 OE2 GLU A 132 -13.918 8.767 -7.548 1.00 0.00 O ATOM 0 H GLU A 132 -10.900 6.044 -5.194 1.00 0.00 H new ATOM 0 HA GLU A 132 -13.389 4.358 -5.120 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -11.701 5.836 -7.231 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.103 4.869 -7.644 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -14.573 6.310 -6.291 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.199 7.195 -5.659 1.00 0.00 H new ATOM 2051 N THR A 133 -12.020 2.279 -5.245 1.00 0.00 N ATOM 2052 CA THR A 133 -11.356 0.988 -5.559 1.00 0.00 C ATOM 2053 C THR A 133 -12.340 0.036 -6.261 1.00 0.00 C ATOM 2054 O THR A 133 -13.026 -0.740 -5.624 1.00 0.00 O ATOM 2055 CB THR A 133 -10.911 0.428 -4.206 1.00 0.00 C ATOM 2056 OG1 THR A 133 -11.791 0.885 -3.187 1.00 0.00 O ATOM 2057 CG2 THR A 133 -9.487 0.903 -3.911 1.00 0.00 C ATOM 0 H THR A 133 -12.680 2.254 -4.468 1.00 0.00 H new ATOM 0 HA THR A 133 -10.512 1.111 -6.237 1.00 0.00 H new ATOM 0 HB THR A 133 -10.934 -0.661 -4.234 1.00 0.00 H new ATOM 0 HG1 THR A 133 -11.839 0.216 -2.472 1.00 0.00 H new ATOM 0 HG21 THR A 133 -9.164 0.507 -2.948 1.00 0.00 H new ATOM 0 HG22 THR A 133 -8.816 0.548 -4.693 1.00 0.00 H new ATOM 0 HG23 THR A 133 -9.466 1.992 -3.881 1.00 0.00 H new ATOM 2065 N MET A 134 -12.407 0.091 -7.570 1.00 0.00 N ATOM 2066 CA MET A 134 -13.342 -0.811 -8.316 1.00 0.00 C ATOM 2067 C MET A 134 -12.571 -1.992 -8.914 1.00 0.00 C ATOM 2068 O MET A 134 -12.916 -2.494 -9.966 1.00 0.00 O ATOM 2069 CB MET A 134 -13.931 0.043 -9.442 1.00 0.00 C ATOM 2070 CG MET A 134 -14.602 1.287 -8.864 1.00 0.00 C ATOM 2071 SD MET A 134 -15.545 2.120 -10.166 1.00 0.00 S ATOM 2072 CE MET A 134 -14.134 2.684 -11.149 1.00 0.00 C ATOM 0 H MET A 134 -11.856 0.720 -8.153 1.00 0.00 H new ATOM 0 HA MET A 134 -14.115 -1.216 -7.663 1.00 0.00 H new ATOM 0 HB2 MET A 134 -13.144 0.335 -10.137 1.00 0.00 H new ATOM 0 HB3 MET A 134 -14.656 -0.540 -10.009 1.00 0.00 H new ATOM 0 HG2 MET A 134 -15.262 1.009 -8.042 1.00 0.00 H new ATOM 0 HG3 MET A 134 -13.851 1.962 -8.455 1.00 0.00 H new ATOM 0 HE1 MET A 134 -14.441 3.517 -11.781 1.00 0.00 H new ATOM 0 HE2 MET A 134 -13.334 3.009 -10.484 1.00 0.00 H new ATOM 0 HE3 MET A 134 -13.776 1.866 -11.775 1.00 0.00 H new ATOM 2082 N ALA A 135 -11.525 -2.420 -8.258 1.00 0.00 N ATOM 2083 CA ALA A 135 -10.705 -3.560 -8.776 1.00 0.00 C ATOM 2084 C ALA A 135 -11.567 -4.562 -9.549 1.00 0.00 C ATOM 2085 O ALA A 135 -12.324 -5.278 -8.914 1.00 0.00 O ATOM 2086 CB ALA A 135 -10.123 -4.221 -7.526 1.00 0.00 C ATOM 2087 OXT ALA A 135 -11.456 -4.593 -10.764 1.00 0.00 O ATOM 0 H ALA A 135 -11.199 -2.026 -7.376 1.00 0.00 H new ATOM 0 HA ALA A 135 -9.937 -3.218 -9.469 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -9.505 -5.071 -7.818 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -9.513 -3.499 -6.983 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -10.935 -4.566 -6.885 1.00 0.00 H new