USER MOD reduce.3.24.130724 H: found=0, std=0, add=857, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 702 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 77 GLN : amide:sc=-0.000681 K(o=-0.00068,f=-0.64) USER MOD Set 1.2: A 81 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 58 SER OG : rot -20:sc= 0.987 USER MOD Set 2.2: A 71 THR OG1 : rot 151:sc= -0.0296 USER MOD Set 3.1: A 20 SER OG : rot 170:sc= 0 USER MOD Set 3.2: A 36 GLN : amide:sc= -5.45! C(o=-5.4!,f=-4.1!) USER MOD Set 4.1: A 27 MET CE :methyl 155:sc= -1.07 (180deg=-1.76!) USER MOD Set 4.2: A 30 THR OG1 : rot -140:sc= -0.0768 USER MOD Set 5.1: A 9 HIS : no HD1:sc= -0.382 X(o=-4.2,f=-4.4) USER MOD Set 5.2: A 10 HIS : no HE2:sc= -1.65 K(o=-4.2,f=-4.8) USER MOD Set 5.3: A 55 TYR OH : rot -15:sc= -2.2! USER MOD Set 6.1: A 3 CYS SG : rot 180:sc= 0 USER MOD Set 6.2: A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 64:sc= 0.602 USER MOD Single : A 24 MET CE :methyl 178:sc= -4.4! (180deg=-4.44!) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 157:sc= -0.635 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 120:sc= -0.414 USER MOD Single : A 39 THR OG1 : rot -172:sc= 0.546 USER MOD Single : A 44 MET CE :methyl -171:sc= -1.04 (180deg=-1.31) USER MOD Single : A 45 ASN : amide:sc= -2.01! C(o=-2!,f=-1!) USER MOD Single : A 53 GLN : amide:sc= -1.31 K(o=-1.3,f=-3.8!) USER MOD Single : A 56 ASN : amide:sc= -4.49! C(o=-4.5!,f=-14!) USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 MET CE :methyl -178:sc= 0 (180deg=-0.00325) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= -5.85! C(o=-5.8!,f=-11!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -6.04! C(o=-6!,f=-13!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= -0.049 X(o=-0.049,f=-0.095) USER MOD Single : A 100 SER OG : rot -28:sc= -0.0185 USER MOD Single : A 102 SER OG : rot 104:sc= 0.217 USER MOD Single : A 104 SER OG : rot 180:sc= -0.24 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 3 13.446 10.411 4.473 1.00 0.00 N ATOM 2 CA CYS A 3 12.968 9.551 5.541 1.00 0.00 C ATOM 3 C CYS A 3 14.166 9.137 6.398 1.00 0.00 C ATOM 4 O CYS A 3 14.202 9.413 7.596 1.00 0.00 O ATOM 5 CB CYS A 3 12.211 8.338 4.997 1.00 0.00 C ATOM 6 SG CYS A 3 11.954 7.110 6.328 1.00 0.00 S ATOM 0 HA CYS A 3 12.253 10.097 6.156 1.00 0.00 H new ATOM 0 HB2 CYS A 3 11.250 8.652 4.590 1.00 0.00 H new ATOM 0 HB3 CYS A 3 12.772 7.887 4.178 1.00 0.00 H new ATOM 0 HG CYS A 3 11.309 6.086 5.855 1.00 0.00 H new ATOM 11 N THR A 4 15.119 8.484 5.750 1.00 0.00 N ATOM 12 CA THR A 4 16.316 8.030 6.437 1.00 0.00 C ATOM 13 C THR A 4 17.466 9.012 6.210 1.00 0.00 C ATOM 14 O THR A 4 18.529 8.880 6.816 1.00 0.00 O ATOM 15 CB THR A 4 16.625 6.609 5.960 1.00 0.00 C ATOM 16 OG1 THR A 4 15.674 5.798 6.645 1.00 0.00 O ATOM 17 CG2 THR A 4 17.979 6.104 6.465 1.00 0.00 C ATOM 0 H THR A 4 15.087 8.258 4.756 1.00 0.00 H new ATOM 0 HA THR A 4 16.166 8.000 7.516 1.00 0.00 H new ATOM 0 HB THR A 4 16.610 6.580 4.870 1.00 0.00 H new ATOM 0 HG1 THR A 4 15.802 4.860 6.392 1.00 0.00 H new ATOM 0 HG21 THR A 4 18.150 5.092 6.098 1.00 0.00 H new ATOM 0 HG22 THR A 4 18.770 6.760 6.102 1.00 0.00 H new ATOM 0 HG23 THR A 4 17.983 6.100 7.555 1.00 0.00 H new ATOM 25 N PHE A 5 17.217 9.973 5.334 1.00 0.00 N ATOM 26 CA PHE A 5 18.218 10.977 5.018 1.00 0.00 C ATOM 27 C PHE A 5 17.877 12.318 5.672 1.00 0.00 C ATOM 28 O PHE A 5 18.465 12.684 6.689 1.00 0.00 O ATOM 29 CB PHE A 5 18.215 11.150 3.499 1.00 0.00 C ATOM 30 CG PHE A 5 19.472 10.616 2.809 1.00 0.00 C ATOM 31 CD1 PHE A 5 20.650 11.285 2.930 1.00 0.00 C ATOM 32 CD2 PHE A 5 19.412 9.474 2.074 1.00 0.00 C ATOM 33 CE1 PHE A 5 21.817 10.789 2.290 1.00 0.00 C ATOM 34 CE2 PHE A 5 20.579 8.978 1.434 1.00 0.00 C ATOM 35 CZ PHE A 5 21.757 9.646 1.556 1.00 0.00 C ATOM 0 H PHE A 5 16.335 10.078 4.832 1.00 0.00 H new ATOM 0 HA PHE A 5 19.192 10.659 5.390 1.00 0.00 H new ATOM 0 HB2 PHE A 5 17.343 10.641 3.087 1.00 0.00 H new ATOM 0 HB3 PHE A 5 18.106 12.209 3.264 1.00 0.00 H new ATOM 0 HD1 PHE A 5 20.698 12.193 3.513 1.00 0.00 H new ATOM 0 HD2 PHE A 5 18.476 8.943 1.977 1.00 0.00 H new ATOM 0 HE1 PHE A 5 22.752 11.320 2.386 1.00 0.00 H new ATOM 0 HE2 PHE A 5 20.531 8.070 0.851 1.00 0.00 H new ATOM 0 HZ PHE A 5 22.645 9.269 1.070 1.00 0.00 H new ATOM 44 N PHE A 6 16.928 13.013 5.063 1.00 0.00 N ATOM 45 CA PHE A 6 16.501 14.305 5.574 1.00 0.00 C ATOM 46 C PHE A 6 15.012 14.290 5.925 1.00 0.00 C ATOM 47 O PHE A 6 14.644 14.442 7.089 1.00 0.00 O ATOM 48 CB PHE A 6 16.741 15.327 4.461 1.00 0.00 C ATOM 49 CG PHE A 6 16.363 16.760 4.841 1.00 0.00 C ATOM 50 CD1 PHE A 6 15.072 17.174 4.731 1.00 0.00 C ATOM 51 CD2 PHE A 6 17.318 17.619 5.287 1.00 0.00 C ATOM 52 CE1 PHE A 6 14.722 18.505 5.083 1.00 0.00 C ATOM 53 CE2 PHE A 6 16.967 18.949 5.639 1.00 0.00 C ATOM 54 CZ PHE A 6 15.677 19.364 5.530 1.00 0.00 C ATOM 0 H PHE A 6 16.442 12.706 4.220 1.00 0.00 H new ATOM 0 HA PHE A 6 17.057 14.551 6.479 1.00 0.00 H new ATOM 0 HB2 PHE A 6 17.794 15.302 4.180 1.00 0.00 H new ATOM 0 HB3 PHE A 6 16.169 15.032 3.581 1.00 0.00 H new ATOM 0 HD1 PHE A 6 14.314 16.491 4.376 1.00 0.00 H new ATOM 0 HD2 PHE A 6 18.343 17.290 5.373 1.00 0.00 H new ATOM 0 HE1 PHE A 6 13.697 18.835 4.996 1.00 0.00 H new ATOM 0 HE2 PHE A 6 17.725 19.631 5.994 1.00 0.00 H new ATOM 0 HZ PHE A 6 15.411 20.376 5.798 1.00 0.00 H new ATOM 63 N GLU A 7 14.196 14.108 4.898 1.00 0.00 N ATOM 64 CA GLU A 7 12.756 14.072 5.083 1.00 0.00 C ATOM 65 C GLU A 7 12.399 13.231 6.309 1.00 0.00 C ATOM 66 O GLU A 7 13.251 12.532 6.857 1.00 0.00 O ATOM 67 CB GLU A 7 12.055 13.541 3.831 1.00 0.00 C ATOM 68 CG GLU A 7 12.285 14.471 2.637 1.00 0.00 C ATOM 69 CD GLU A 7 11.613 15.827 2.861 1.00 0.00 C ATOM 70 OE1 GLU A 7 12.260 16.682 3.502 1.00 0.00 O ATOM 71 OE2 GLU A 7 10.466 15.977 2.384 1.00 0.00 O ATOM 0 H GLU A 7 14.505 13.984 3.934 1.00 0.00 H new ATOM 0 HA GLU A 7 12.406 15.090 5.251 1.00 0.00 H new ATOM 0 HB2 GLU A 7 12.427 12.544 3.597 1.00 0.00 H new ATOM 0 HB3 GLU A 7 10.986 13.445 4.021 1.00 0.00 H new ATOM 0 HG2 GLU A 7 13.355 14.612 2.482 1.00 0.00 H new ATOM 0 HG3 GLU A 7 11.890 14.011 1.731 1.00 0.00 H new ATOM 76 N LYS A 8 11.139 13.324 6.706 1.00 0.00 N ATOM 77 CA LYS A 8 10.659 12.580 7.858 1.00 0.00 C ATOM 78 C LYS A 8 9.514 11.662 7.426 1.00 0.00 C ATOM 79 O LYS A 8 9.698 10.453 7.297 1.00 0.00 O ATOM 80 CB LYS A 8 10.286 13.534 8.995 1.00 0.00 C ATOM 81 CG LYS A 8 10.430 12.849 10.356 1.00 0.00 C ATOM 82 CD LYS A 8 11.030 13.803 11.390 1.00 0.00 C ATOM 83 CE LYS A 8 12.556 13.828 11.291 1.00 0.00 C ATOM 84 NZ LYS A 8 13.166 13.433 12.581 1.00 0.00 N ATOM 0 H LYS A 8 10.435 13.904 6.250 1.00 0.00 H new ATOM 0 HA LYS A 8 11.448 11.941 8.254 1.00 0.00 H new ATOM 0 HB2 LYS A 8 10.925 14.416 8.959 1.00 0.00 H new ATOM 0 HB3 LYS A 8 9.260 13.878 8.864 1.00 0.00 H new ATOM 0 HG2 LYS A 8 9.454 12.503 10.698 1.00 0.00 H new ATOM 0 HG3 LYS A 8 11.064 11.968 10.258 1.00 0.00 H new ATOM 0 HD2 LYS A 8 10.635 14.807 11.236 1.00 0.00 H new ATOM 0 HD3 LYS A 8 10.732 13.494 12.392 1.00 0.00 H new ATOM 0 HE2 LYS A 8 12.886 13.151 10.503 1.00 0.00 H new ATOM 0 HE3 LYS A 8 12.892 14.827 11.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 14.202 13.455 12.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 12.865 14.095 13.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 12.860 12.471 12.830 1.00 0.00 H new ATOM 94 N HIS A 9 8.356 12.272 7.215 1.00 0.00 N ATOM 95 CA HIS A 9 7.181 11.524 6.801 1.00 0.00 C ATOM 96 C HIS A 9 7.009 11.639 5.285 1.00 0.00 C ATOM 97 O HIS A 9 6.374 10.788 4.663 1.00 0.00 O ATOM 98 CB HIS A 9 5.944 11.983 7.575 1.00 0.00 C ATOM 99 CG HIS A 9 5.923 13.462 7.877 1.00 0.00 C ATOM 100 ND1 HIS A 9 6.073 13.968 9.157 1.00 0.00 N ATOM 101 CD2 HIS A 9 5.769 14.538 7.053 1.00 0.00 C ATOM 102 CE1 HIS A 9 6.009 15.290 9.094 1.00 0.00 C ATOM 103 NE2 HIS A 9 5.820 15.642 7.789 1.00 0.00 N ATOM 0 H HIS A 9 8.207 13.275 7.323 1.00 0.00 H new ATOM 0 HA HIS A 9 7.314 10.468 7.038 1.00 0.00 H new ATOM 0 HB2 HIS A 9 5.053 11.727 7.001 1.00 0.00 H new ATOM 0 HB3 HIS A 9 5.889 11.430 8.513 1.00 0.00 H new ATOM 0 HD2 HIS A 9 5.629 14.499 5.983 1.00 0.00 H new ATOM 0 HE1 HIS A 9 6.092 15.970 9.929 1.00 0.00 H new ATOM 0 HE2 HIS A 9 5.732 16.595 7.437 1.00 0.00 H new ATOM 110 N HIS A 10 7.585 12.697 4.734 1.00 0.00 N ATOM 111 CA HIS A 10 7.503 12.935 3.303 1.00 0.00 C ATOM 112 C HIS A 10 8.052 11.722 2.550 1.00 0.00 C ATOM 113 O HIS A 10 7.665 11.466 1.410 1.00 0.00 O ATOM 114 CB HIS A 10 8.210 14.237 2.927 1.00 0.00 C ATOM 115 CG HIS A 10 7.863 15.405 3.819 1.00 0.00 C ATOM 116 ND1 HIS A 10 6.560 15.808 4.053 1.00 0.00 N ATOM 117 CD2 HIS A 10 8.662 16.250 4.532 1.00 0.00 C ATOM 118 CE1 HIS A 10 6.585 16.850 4.871 1.00 0.00 C ATOM 119 NE2 HIS A 10 7.889 17.123 5.166 1.00 0.00 N ATOM 0 H HIS A 10 8.111 13.400 5.253 1.00 0.00 H new ATOM 0 HA HIS A 10 6.461 13.060 3.010 1.00 0.00 H new ATOM 0 HB2 HIS A 10 9.288 14.076 2.960 1.00 0.00 H new ATOM 0 HB3 HIS A 10 7.957 14.492 1.898 1.00 0.00 H new ATOM 0 HD1 HIS A 10 5.723 15.376 3.662 1.00 0.00 H new ATOM 0 HD2 HIS A 10 9.741 16.215 4.574 1.00 0.00 H new ATOM 0 HE1 HIS A 10 5.724 17.389 5.240 1.00 0.00 H new ATOM 126 N ARG A 11 8.947 11.007 3.216 1.00 0.00 N ATOM 127 CA ARG A 11 9.554 9.827 2.624 1.00 0.00 C ATOM 128 C ARG A 11 9.194 8.581 3.435 1.00 0.00 C ATOM 129 O ARG A 11 9.783 7.519 3.242 1.00 0.00 O ATOM 130 CB ARG A 11 11.077 9.964 2.561 1.00 0.00 C ATOM 131 CG ARG A 11 11.516 10.611 1.247 1.00 0.00 C ATOM 132 CD ARG A 11 13.015 10.915 1.258 1.00 0.00 C ATOM 133 NE ARG A 11 13.787 9.662 1.097 1.00 0.00 N ATOM 134 CZ ARG A 11 15.103 9.618 0.849 1.00 0.00 C ATOM 135 NH1 ARG A 11 15.803 10.754 0.734 1.00 0.00 N ATOM 136 NH2 ARG A 11 15.719 8.435 0.717 1.00 0.00 N ATOM 0 H ARG A 11 9.266 11.222 4.160 1.00 0.00 H new ATOM 0 HA ARG A 11 9.167 9.729 1.610 1.00 0.00 H new ATOM 0 HB2 ARG A 11 11.427 10.565 3.401 1.00 0.00 H new ATOM 0 HB3 ARG A 11 11.538 8.981 2.658 1.00 0.00 H new ATOM 0 HG2 ARG A 11 11.282 9.947 0.415 1.00 0.00 H new ATOM 0 HG3 ARG A 11 10.956 11.532 1.086 1.00 0.00 H new ATOM 0 HD2 ARG A 11 13.260 11.608 0.453 1.00 0.00 H new ATOM 0 HD3 ARG A 11 13.289 11.403 2.194 1.00 0.00 H new ATOM 0 HE ARG A 11 13.286 8.777 1.180 1.00 0.00 H new ATOM 0 HH11 ARG A 11 15.334 11.654 0.835 1.00 0.00 H new ATOM 0 HH12 ARG A 11 16.805 10.719 0.545 1.00 0.00 H new ATOM 0 HH21 ARG A 11 15.186 7.570 0.805 1.00 0.00 H new ATOM 0 HH22 ARG A 11 16.721 8.400 0.528 1.00 0.00 H new ATOM 147 N LYS A 12 8.228 8.752 4.326 1.00 0.00 N ATOM 148 CA LYS A 12 7.782 7.654 5.166 1.00 0.00 C ATOM 149 C LYS A 12 6.561 6.990 4.526 1.00 0.00 C ATOM 150 O LYS A 12 6.489 5.765 4.442 1.00 0.00 O ATOM 151 CB LYS A 12 7.538 8.140 6.596 1.00 0.00 C ATOM 152 CG LYS A 12 7.413 6.959 7.563 1.00 0.00 C ATOM 153 CD LYS A 12 8.769 6.608 8.178 1.00 0.00 C ATOM 154 CE LYS A 12 8.593 5.856 9.498 1.00 0.00 C ATOM 155 NZ LYS A 12 9.888 5.744 10.208 1.00 0.00 N ATOM 0 H LYS A 12 7.742 9.635 4.484 1.00 0.00 H new ATOM 0 HA LYS A 12 8.557 6.892 5.240 1.00 0.00 H new ATOM 0 HB2 LYS A 12 8.358 8.786 6.909 1.00 0.00 H new ATOM 0 HB3 LYS A 12 6.629 8.740 6.630 1.00 0.00 H new ATOM 0 HG2 LYS A 12 6.704 7.205 8.353 1.00 0.00 H new ATOM 0 HG3 LYS A 12 7.014 6.093 7.035 1.00 0.00 H new ATOM 0 HD2 LYS A 12 9.342 5.997 7.480 1.00 0.00 H new ATOM 0 HD3 LYS A 12 9.342 7.519 8.348 1.00 0.00 H new ATOM 0 HE2 LYS A 12 7.871 6.377 10.127 1.00 0.00 H new ATOM 0 HE3 LYS A 12 8.190 4.862 9.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 9.750 5.231 11.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 10.567 5.227 9.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 10.258 6.695 10.408 1.00 0.00 H new ATOM 165 N TRP A 13 5.632 7.829 4.092 1.00 0.00 N ATOM 166 CA TRP A 13 4.417 7.338 3.461 1.00 0.00 C ATOM 167 C TRP A 13 4.821 6.402 2.321 1.00 0.00 C ATOM 168 O TRP A 13 4.169 5.386 2.085 1.00 0.00 O ATOM 169 CB TRP A 13 3.533 8.498 2.999 1.00 0.00 C ATOM 170 CG TRP A 13 2.033 8.216 3.102 1.00 0.00 C ATOM 171 CD1 TRP A 13 1.419 7.267 3.821 1.00 0.00 C ATOM 172 CD2 TRP A 13 0.975 8.932 2.429 1.00 0.00 C ATOM 173 NE1 TRP A 13 0.049 7.319 3.662 1.00 0.00 N ATOM 174 CE2 TRP A 13 -0.229 8.364 2.789 1.00 0.00 C ATOM 175 CE3 TRP A 13 1.035 10.025 1.546 1.00 0.00 C ATOM 176 CZ2 TRP A 13 -1.465 8.820 2.314 1.00 0.00 C ATOM 177 CZ3 TRP A 13 -0.208 10.469 1.080 1.00 0.00 C ATOM 178 CH2 TRP A 13 -1.430 9.908 1.433 1.00 0.00 C ATOM 0 H TRP A 13 5.695 8.844 4.164 1.00 0.00 H new ATOM 0 HA TRP A 13 3.812 6.777 4.173 1.00 0.00 H new ATOM 0 HB2 TRP A 13 3.768 9.380 3.594 1.00 0.00 H new ATOM 0 HB3 TRP A 13 3.777 8.738 1.964 1.00 0.00 H new ATOM 0 HD1 TRP A 13 1.932 6.551 4.446 1.00 0.00 H new ATOM 0 HE1 TRP A 13 -0.634 6.704 4.104 1.00 0.00 H new ATOM 0 HE3 TRP A 13 1.966 10.485 1.251 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 -2.395 8.358 2.611 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 -0.218 11.306 0.398 1.00 0.00 H new ATOM 0 HH2 TRP A 13 -2.348 10.309 1.030 1.00 0.00 H new ATOM 188 N ASP A 14 5.895 6.777 1.642 1.00 0.00 N ATOM 189 CA ASP A 14 6.394 5.985 0.532 1.00 0.00 C ATOM 190 C ASP A 14 7.100 4.741 1.076 1.00 0.00 C ATOM 191 O ASP A 14 7.186 3.722 0.391 1.00 0.00 O ATOM 192 CB ASP A 14 7.405 6.776 -0.301 1.00 0.00 C ATOM 193 CG ASP A 14 8.850 6.704 0.198 1.00 0.00 C ATOM 194 OD1 ASP A 14 9.460 5.628 0.018 1.00 0.00 O ATOM 195 OD2 ASP A 14 9.312 7.728 0.748 1.00 0.00 O ATOM 0 H ASP A 14 6.434 7.620 1.840 1.00 0.00 H new ATOM 0 HA ASP A 14 5.545 5.713 -0.096 1.00 0.00 H new ATOM 0 HB2 ASP A 14 7.372 6.411 -1.328 1.00 0.00 H new ATOM 0 HB3 ASP A 14 7.096 7.821 -0.324 1.00 0.00 H new ATOM 199 N ILE A 15 7.588 4.864 2.302 1.00 0.00 N ATOM 200 CA ILE A 15 8.283 3.763 2.945 1.00 0.00 C ATOM 201 C ILE A 15 7.262 2.723 3.411 1.00 0.00 C ATOM 202 O ILE A 15 7.537 1.525 3.390 1.00 0.00 O ATOM 203 CB ILE A 15 9.188 4.281 4.064 1.00 0.00 C ATOM 204 CG1 ILE A 15 10.635 3.835 3.851 1.00 0.00 C ATOM 205 CG2 ILE A 15 8.655 3.863 5.438 1.00 0.00 C ATOM 206 CD1 ILE A 15 11.215 4.445 2.575 1.00 0.00 C ATOM 0 H ILE A 15 7.515 5.710 2.867 1.00 0.00 H new ATOM 0 HA ILE A 15 8.945 3.265 2.236 1.00 0.00 H new ATOM 0 HB ILE A 15 9.180 5.371 4.033 1.00 0.00 H new ATOM 0 HG12 ILE A 15 11.240 4.131 4.708 1.00 0.00 H new ATOM 0 HG13 ILE A 15 10.679 2.748 3.791 1.00 0.00 H new ATOM 0 HG21 ILE A 15 9.317 4.244 6.216 1.00 0.00 H new ATOM 0 HG22 ILE A 15 7.655 4.272 5.580 1.00 0.00 H new ATOM 0 HG23 ILE A 15 8.614 2.775 5.497 1.00 0.00 H new ATOM 0 HD11 ILE A 15 12.245 4.111 2.448 1.00 0.00 H new ATOM 0 HD12 ILE A 15 10.622 4.127 1.718 1.00 0.00 H new ATOM 0 HD13 ILE A 15 11.192 5.532 2.649 1.00 0.00 H new ATOM 217 N LEU A 16 6.103 3.220 3.818 1.00 0.00 N ATOM 218 CA LEU A 16 5.039 2.348 4.289 1.00 0.00 C ATOM 219 C LEU A 16 4.349 1.699 3.087 1.00 0.00 C ATOM 220 O LEU A 16 3.842 0.583 3.186 1.00 0.00 O ATOM 221 CB LEU A 16 4.085 3.115 5.206 1.00 0.00 C ATOM 222 CG LEU A 16 2.917 2.312 5.781 1.00 0.00 C ATOM 223 CD1 LEU A 16 1.769 2.217 4.774 1.00 0.00 C ATOM 224 CD2 LEU A 16 3.380 0.932 6.254 1.00 0.00 C ATOM 0 H LEU A 16 5.877 4.215 3.832 1.00 0.00 H new ATOM 0 HA LEU A 16 5.448 1.541 4.897 1.00 0.00 H new ATOM 0 HB2 LEU A 16 4.661 3.525 6.035 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.680 3.961 4.650 1.00 0.00 H new ATOM 0 HG LEU A 16 2.536 2.841 6.655 1.00 0.00 H new ATOM 0 HD11 LEU A 16 0.951 1.641 5.208 1.00 0.00 H new ATOM 0 HD12 LEU A 16 1.417 3.219 4.528 1.00 0.00 H new ATOM 0 HD13 LEU A 16 2.120 1.723 3.868 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.530 0.382 6.658 1.00 0.00 H new ATOM 0 HD22 LEU A 16 3.802 0.382 5.413 1.00 0.00 H new ATOM 0 HD23 LEU A 16 4.138 1.048 7.028 1.00 0.00 H new ATOM 235 N LEU A 17 4.351 2.428 1.980 1.00 0.00 N ATOM 236 CA LEU A 17 3.731 1.937 0.761 1.00 0.00 C ATOM 237 C LEU A 17 4.766 1.161 -0.055 1.00 0.00 C ATOM 238 O LEU A 17 4.410 0.410 -0.963 1.00 0.00 O ATOM 239 CB LEU A 17 3.078 3.087 -0.008 1.00 0.00 C ATOM 240 CG LEU A 17 2.768 2.817 -1.482 1.00 0.00 C ATOM 241 CD1 LEU A 17 1.428 3.438 -1.883 1.00 0.00 C ATOM 242 CD2 LEU A 17 3.912 3.295 -2.379 1.00 0.00 C ATOM 0 H LEU A 17 4.772 3.354 1.902 1.00 0.00 H new ATOM 0 HA LEU A 17 2.924 1.243 0.996 1.00 0.00 H new ATOM 0 HB2 LEU A 17 2.149 3.353 0.495 1.00 0.00 H new ATOM 0 HB3 LEU A 17 3.733 3.956 0.052 1.00 0.00 H new ATOM 0 HG LEU A 17 2.678 1.740 -1.621 1.00 0.00 H new ATOM 0 HD11 LEU A 17 1.232 3.232 -2.935 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.632 3.010 -1.274 1.00 0.00 H new ATOM 0 HD13 LEU A 17 1.465 4.516 -1.726 1.00 0.00 H new ATOM 0 HD21 LEU A 17 3.667 3.091 -3.421 1.00 0.00 H new ATOM 0 HD22 LEU A 17 4.057 4.367 -2.243 1.00 0.00 H new ATOM 0 HD23 LEU A 17 4.828 2.768 -2.112 1.00 0.00 H new ATOM 253 N GLU A 18 6.027 1.368 0.296 1.00 0.00 N ATOM 254 CA GLU A 18 7.116 0.697 -0.393 1.00 0.00 C ATOM 255 C GLU A 18 7.555 -0.542 0.390 1.00 0.00 C ATOM 256 O GLU A 18 8.232 -1.415 -0.151 1.00 0.00 O ATOM 257 CB GLU A 18 8.292 1.649 -0.618 1.00 0.00 C ATOM 258 CG GLU A 18 9.463 0.925 -1.284 1.00 0.00 C ATOM 259 CD GLU A 18 10.561 0.605 -0.266 1.00 0.00 C ATOM 260 OE1 GLU A 18 11.117 1.576 0.292 1.00 0.00 O ATOM 261 OE2 GLU A 18 10.819 -0.602 -0.070 1.00 0.00 O ATOM 0 H GLU A 18 6.319 1.991 1.049 1.00 0.00 H new ATOM 0 HA GLU A 18 6.759 0.377 -1.372 1.00 0.00 H new ATOM 0 HB2 GLU A 18 7.974 2.484 -1.242 1.00 0.00 H new ATOM 0 HB3 GLU A 18 8.613 2.068 0.336 1.00 0.00 H new ATOM 0 HG2 GLU A 18 9.110 0.003 -1.745 1.00 0.00 H new ATOM 0 HG3 GLU A 18 9.872 1.545 -2.082 1.00 0.00 H new ATOM 266 N LYS A 19 7.152 -0.580 1.651 1.00 0.00 N ATOM 267 CA LYS A 19 7.496 -1.698 2.514 1.00 0.00 C ATOM 268 C LYS A 19 6.275 -2.606 2.676 1.00 0.00 C ATOM 269 O LYS A 19 6.410 -3.826 2.747 1.00 0.00 O ATOM 270 CB LYS A 19 8.068 -1.195 3.841 1.00 0.00 C ATOM 271 CG LYS A 19 9.445 -0.559 3.638 1.00 0.00 C ATOM 272 CD LYS A 19 10.094 -0.217 4.980 1.00 0.00 C ATOM 273 CE LYS A 19 11.603 -0.469 4.940 1.00 0.00 C ATOM 274 NZ LYS A 19 12.264 0.153 6.110 1.00 0.00 N ATOM 0 H LYS A 19 6.590 0.145 2.097 1.00 0.00 H new ATOM 0 HA LYS A 19 8.284 -2.300 2.061 1.00 0.00 H new ATOM 0 HB2 LYS A 19 7.388 -0.466 4.281 1.00 0.00 H new ATOM 0 HB3 LYS A 19 8.146 -2.024 4.545 1.00 0.00 H new ATOM 0 HG2 LYS A 19 10.087 -1.243 3.083 1.00 0.00 H new ATOM 0 HG3 LYS A 19 9.347 0.345 3.037 1.00 0.00 H new ATOM 0 HD2 LYS A 19 9.903 0.828 5.225 1.00 0.00 H new ATOM 0 HD3 LYS A 19 9.642 -0.817 5.770 1.00 0.00 H new ATOM 0 HE2 LYS A 19 11.798 -1.541 4.932 1.00 0.00 H new ATOM 0 HE3 LYS A 19 12.021 -0.062 4.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 13.287 -0.028 6.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 12.093 1.179 6.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 11.877 -0.255 6.985 1.00 0.00 H new ATOM 284 N SER A 20 5.111 -1.975 2.728 1.00 0.00 N ATOM 285 CA SER A 20 3.868 -2.710 2.880 1.00 0.00 C ATOM 286 C SER A 20 3.636 -3.605 1.661 1.00 0.00 C ATOM 287 O SER A 20 3.604 -4.829 1.782 1.00 0.00 O ATOM 288 CB SER A 20 2.685 -1.759 3.073 1.00 0.00 C ATOM 289 OG SER A 20 1.443 -2.456 3.137 1.00 0.00 O ATOM 0 H SER A 20 5.003 -0.963 2.667 1.00 0.00 H new ATOM 0 HA SER A 20 3.947 -3.333 3.771 1.00 0.00 H new ATOM 0 HB2 SER A 20 2.827 -1.186 3.989 1.00 0.00 H new ATOM 0 HB3 SER A 20 2.657 -1.044 2.251 1.00 0.00 H new ATOM 0 HG SER A 20 0.736 -1.839 3.420 1.00 0.00 H new ATOM 294 N THR A 21 3.480 -2.959 0.515 1.00 0.00 N ATOM 295 CA THR A 21 3.253 -3.681 -0.726 1.00 0.00 C ATOM 296 C THR A 21 4.337 -3.337 -1.749 1.00 0.00 C ATOM 297 O THR A 21 4.049 -3.176 -2.935 1.00 0.00 O ATOM 298 CB THR A 21 1.837 -3.357 -1.208 1.00 0.00 C ATOM 299 OG1 THR A 21 1.975 -2.105 -1.873 1.00 0.00 O ATOM 300 CG2 THR A 21 0.879 -3.062 -0.053 1.00 0.00 C ATOM 0 H THR A 21 3.506 -1.944 0.419 1.00 0.00 H new ATOM 0 HA THR A 21 3.323 -4.758 -0.576 1.00 0.00 H new ATOM 0 HB THR A 21 1.453 -4.192 -1.794 1.00 0.00 H new ATOM 0 HG1 THR A 21 2.557 -2.212 -2.654 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.111 -2.838 -0.450 1.00 0.00 H new ATOM 0 HG22 THR A 21 0.820 -3.931 0.602 1.00 0.00 H new ATOM 0 HG23 THR A 21 1.245 -2.206 0.513 1.00 0.00 H new ATOM 308 N GLY A 22 5.562 -3.233 -1.254 1.00 0.00 N ATOM 309 CA GLY A 22 6.690 -2.911 -2.111 1.00 0.00 C ATOM 310 C GLY A 22 7.829 -3.915 -1.919 1.00 0.00 C ATOM 311 O GLY A 22 8.859 -3.825 -2.584 1.00 0.00 O ATOM 0 H GLY A 22 5.798 -3.366 -0.271 1.00 0.00 H new ATOM 0 HA2 GLY A 22 6.371 -2.912 -3.153 1.00 0.00 H new ATOM 0 HA3 GLY A 22 7.046 -1.905 -1.888 1.00 0.00 H new ATOM 315 N VAL A 23 7.605 -4.846 -1.004 1.00 0.00 N ATOM 316 CA VAL A 23 8.600 -5.866 -0.716 1.00 0.00 C ATOM 317 C VAL A 23 7.966 -7.250 -0.872 1.00 0.00 C ATOM 318 O VAL A 23 8.567 -8.149 -1.459 1.00 0.00 O ATOM 319 CB VAL A 23 9.196 -5.636 0.675 1.00 0.00 C ATOM 320 CG1 VAL A 23 10.110 -4.408 0.683 1.00 0.00 C ATOM 321 CG2 VAL A 23 8.095 -5.507 1.729 1.00 0.00 C ATOM 0 H VAL A 23 6.750 -4.916 -0.452 1.00 0.00 H new ATOM 0 HA VAL A 23 9.426 -5.805 -1.425 1.00 0.00 H new ATOM 0 HB VAL A 23 9.801 -6.506 0.929 1.00 0.00 H new ATOM 0 HG11 VAL A 23 10.521 -4.267 1.683 1.00 0.00 H new ATOM 0 HG12 VAL A 23 10.924 -4.556 -0.026 1.00 0.00 H new ATOM 0 HG13 VAL A 23 9.537 -3.526 0.398 1.00 0.00 H new ATOM 0 HG21 VAL A 23 8.546 -5.344 2.708 1.00 0.00 H new ATOM 0 HG22 VAL A 23 7.451 -4.663 1.481 1.00 0.00 H new ATOM 0 HG23 VAL A 23 7.502 -6.422 1.750 1.00 0.00 H new ATOM 331 N MET A 24 6.760 -7.378 -0.338 1.00 0.00 N ATOM 332 CA MET A 24 6.038 -8.636 -0.412 1.00 0.00 C ATOM 333 C MET A 24 6.573 -9.635 0.617 1.00 0.00 C ATOM 334 O MET A 24 6.545 -10.843 0.386 1.00 0.00 O ATOM 335 CB MET A 24 6.179 -9.225 -1.817 1.00 0.00 C ATOM 336 CG MET A 24 5.126 -10.306 -2.067 1.00 0.00 C ATOM 337 SD MET A 24 5.851 -11.670 -2.961 1.00 0.00 S ATOM 338 CE MET A 24 6.961 -12.302 -1.715 1.00 0.00 C ATOM 0 H MET A 24 6.265 -6.630 0.148 1.00 0.00 H new ATOM 0 HA MET A 24 4.987 -8.444 -0.194 1.00 0.00 H new ATOM 0 HB2 MET A 24 6.076 -8.433 -2.559 1.00 0.00 H new ATOM 0 HB3 MET A 24 7.176 -9.648 -1.939 1.00 0.00 H new ATOM 0 HG2 MET A 24 4.721 -10.657 -1.118 1.00 0.00 H new ATOM 0 HG3 MET A 24 4.294 -9.890 -2.635 1.00 0.00 H new ATOM 0 HE1 MET A 24 7.472 -13.185 -2.098 1.00 0.00 H new ATOM 0 HE2 MET A 24 7.696 -11.538 -1.462 1.00 0.00 H new ATOM 0 HE3 MET A 24 6.393 -12.569 -0.824 1.00 0.00 H new ATOM 346 N GLU A 25 7.047 -9.095 1.729 1.00 0.00 N ATOM 347 CA GLU A 25 7.587 -9.924 2.793 1.00 0.00 C ATOM 348 C GLU A 25 8.226 -9.050 3.874 1.00 0.00 C ATOM 349 O GLU A 25 7.982 -9.249 5.063 1.00 0.00 O ATOM 350 CB GLU A 25 8.592 -10.937 2.242 1.00 0.00 C ATOM 351 CG GLU A 25 9.340 -10.367 1.034 1.00 0.00 C ATOM 352 CD GLU A 25 10.818 -10.761 1.068 1.00 0.00 C ATOM 353 OE1 GLU A 25 11.589 -10.018 1.712 1.00 0.00 O ATOM 354 OE2 GLU A 25 11.143 -11.797 0.449 1.00 0.00 O ATOM 0 H GLU A 25 7.069 -8.093 1.917 1.00 0.00 H new ATOM 0 HA GLU A 25 6.767 -10.483 3.243 1.00 0.00 H new ATOM 0 HB2 GLU A 25 9.305 -11.208 3.021 1.00 0.00 H new ATOM 0 HB3 GLU A 25 8.072 -11.851 1.954 1.00 0.00 H new ATOM 0 HG2 GLU A 25 8.884 -10.732 0.114 1.00 0.00 H new ATOM 0 HG3 GLU A 25 9.250 -9.281 1.025 1.00 0.00 H new ATOM 359 N ALA A 26 9.033 -8.100 3.422 1.00 0.00 N ATOM 360 CA ALA A 26 9.708 -7.195 4.337 1.00 0.00 C ATOM 361 C ALA A 26 8.668 -6.473 5.196 1.00 0.00 C ATOM 362 O ALA A 26 9.003 -5.897 6.229 1.00 0.00 O ATOM 363 CB ALA A 26 10.582 -6.224 3.540 1.00 0.00 C ATOM 0 H ALA A 26 9.234 -7.938 2.435 1.00 0.00 H new ATOM 0 HA ALA A 26 10.363 -7.748 5.010 1.00 0.00 H new ATOM 0 HB1 ALA A 26 11.089 -5.545 4.225 1.00 0.00 H new ATOM 0 HB2 ALA A 26 11.323 -6.785 2.971 1.00 0.00 H new ATOM 0 HB3 ALA A 26 9.957 -5.650 2.856 1.00 0.00 H new ATOM 369 N MET A 27 7.427 -6.529 4.736 1.00 0.00 N ATOM 370 CA MET A 27 6.334 -5.888 5.449 1.00 0.00 C ATOM 371 C MET A 27 4.980 -6.367 4.923 1.00 0.00 C ATOM 372 O MET A 27 3.973 -5.678 5.075 1.00 0.00 O ATOM 373 CB MET A 27 6.440 -4.371 5.286 1.00 0.00 C ATOM 374 CG MET A 27 6.517 -3.677 6.647 1.00 0.00 C ATOM 375 SD MET A 27 5.058 -4.046 7.606 1.00 0.00 S ATOM 376 CE MET A 27 5.762 -5.132 8.837 1.00 0.00 C ATOM 0 H MET A 27 7.153 -7.008 3.878 1.00 0.00 H new ATOM 0 HA MET A 27 6.406 -6.155 6.503 1.00 0.00 H new ATOM 0 HB2 MET A 27 7.325 -4.126 4.698 1.00 0.00 H new ATOM 0 HB3 MET A 27 5.577 -4.000 4.733 1.00 0.00 H new ATOM 0 HG2 MET A 27 7.407 -4.007 7.183 1.00 0.00 H new ATOM 0 HG3 MET A 27 6.609 -2.600 6.510 1.00 0.00 H new ATOM 0 HE1 MET A 27 5.149 -5.107 9.738 1.00 0.00 H new ATOM 0 HE2 MET A 27 5.795 -6.150 8.448 1.00 0.00 H new ATOM 0 HE3 MET A 27 6.773 -4.803 9.077 1.00 0.00 H new ATOM 384 N LYS A 28 4.999 -7.543 4.315 1.00 0.00 N ATOM 385 CA LYS A 28 3.786 -8.122 3.764 1.00 0.00 C ATOM 386 C LYS A 28 3.527 -9.478 4.423 1.00 0.00 C ATOM 387 O LYS A 28 2.467 -10.073 4.235 1.00 0.00 O ATOM 388 CB LYS A 28 3.865 -8.184 2.238 1.00 0.00 C ATOM 389 CG LYS A 28 3.142 -9.421 1.701 1.00 0.00 C ATOM 390 CD LYS A 28 3.973 -10.686 1.930 1.00 0.00 C ATOM 391 CE LYS A 28 3.103 -11.825 2.464 1.00 0.00 C ATOM 392 NZ LYS A 28 3.216 -13.016 1.592 1.00 0.00 N ATOM 0 H LYS A 28 5.837 -8.112 4.191 1.00 0.00 H new ATOM 0 HA LYS A 28 2.927 -7.489 3.989 1.00 0.00 H new ATOM 0 HB2 LYS A 28 3.421 -7.285 1.811 1.00 0.00 H new ATOM 0 HB3 LYS A 28 4.909 -8.204 1.925 1.00 0.00 H new ATOM 0 HG2 LYS A 28 2.175 -9.523 2.193 1.00 0.00 H new ATOM 0 HG3 LYS A 28 2.946 -9.298 0.636 1.00 0.00 H new ATOM 0 HD2 LYS A 28 4.443 -10.991 0.995 1.00 0.00 H new ATOM 0 HD3 LYS A 28 4.776 -10.475 2.637 1.00 0.00 H new ATOM 0 HE2 LYS A 28 3.409 -12.079 3.479 1.00 0.00 H new ATOM 0 HE3 LYS A 28 2.063 -11.503 2.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 2.619 -13.780 1.969 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 2.902 -12.773 0.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 4.206 -13.332 1.563 1.00 0.00 H new ATOM 402 N VAL A 29 4.516 -9.929 5.182 1.00 0.00 N ATOM 403 CA VAL A 29 4.410 -11.204 5.871 1.00 0.00 C ATOM 404 C VAL A 29 4.560 -10.981 7.376 1.00 0.00 C ATOM 405 O VAL A 29 5.405 -11.602 8.019 1.00 0.00 O ATOM 406 CB VAL A 29 5.436 -12.189 5.307 1.00 0.00 C ATOM 407 CG1 VAL A 29 6.837 -11.889 5.845 1.00 0.00 C ATOM 408 CG2 VAL A 29 5.032 -13.634 5.608 1.00 0.00 C ATOM 0 H VAL A 29 5.395 -9.434 5.335 1.00 0.00 H new ATOM 0 HA VAL A 29 3.428 -11.647 5.706 1.00 0.00 H new ATOM 0 HB VAL A 29 5.459 -12.066 4.224 1.00 0.00 H new ATOM 0 HG11 VAL A 29 7.547 -12.603 5.429 1.00 0.00 H new ATOM 0 HG12 VAL A 29 7.128 -10.879 5.558 1.00 0.00 H new ATOM 0 HG13 VAL A 29 6.835 -11.971 6.932 1.00 0.00 H new ATOM 0 HG21 VAL A 29 5.778 -14.314 5.196 1.00 0.00 H new ATOM 0 HG22 VAL A 29 4.967 -13.777 6.687 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.062 -13.842 5.156 1.00 0.00 H new ATOM 418 N THR A 30 3.727 -10.090 7.896 1.00 0.00 N ATOM 419 CA THR A 30 3.756 -9.777 9.315 1.00 0.00 C ATOM 420 C THR A 30 2.537 -10.376 10.018 1.00 0.00 C ATOM 421 O THR A 30 2.384 -10.236 11.231 1.00 0.00 O ATOM 422 CB THR A 30 3.857 -8.257 9.461 1.00 0.00 C ATOM 423 OG1 THR A 30 5.184 -8.040 9.931 1.00 0.00 O ATOM 424 CG2 THR A 30 2.969 -7.717 10.584 1.00 0.00 C ATOM 0 H THR A 30 3.028 -9.575 7.360 1.00 0.00 H new ATOM 0 HA THR A 30 4.623 -10.223 9.802 1.00 0.00 H new ATOM 0 HB THR A 30 3.580 -7.783 8.520 1.00 0.00 H new ATOM 0 HG1 THR A 30 5.179 -7.332 10.609 1.00 0.00 H new ATOM 0 HG21 THR A 30 3.078 -6.634 10.645 1.00 0.00 H new ATOM 0 HG22 THR A 30 1.928 -7.966 10.376 1.00 0.00 H new ATOM 0 HG23 THR A 30 3.267 -8.166 11.531 1.00 0.00 H new ATOM 432 N SER A 31 1.700 -11.031 9.228 1.00 0.00 N ATOM 433 CA SER A 31 0.499 -11.652 9.760 1.00 0.00 C ATOM 434 C SER A 31 -0.637 -11.554 8.739 1.00 0.00 C ATOM 435 O SER A 31 -1.654 -12.234 8.870 1.00 0.00 O ATOM 436 CB SER A 31 0.083 -11.004 11.082 1.00 0.00 C ATOM 437 OG SER A 31 -1.292 -11.233 11.379 1.00 0.00 O ATOM 0 H SER A 31 1.830 -11.145 8.223 1.00 0.00 H new ATOM 0 HA SER A 31 0.714 -12.703 9.954 1.00 0.00 H new ATOM 0 HB2 SER A 31 0.699 -11.400 11.889 1.00 0.00 H new ATOM 0 HB3 SER A 31 0.270 -9.931 11.035 1.00 0.00 H new ATOM 0 HG SER A 31 -1.437 -11.146 12.344 1.00 0.00 H new ATOM 442 N GLU A 32 -0.426 -10.702 7.747 1.00 0.00 N ATOM 443 CA GLU A 32 -1.420 -10.506 6.704 1.00 0.00 C ATOM 444 C GLU A 32 -2.501 -9.533 7.179 1.00 0.00 C ATOM 445 O GLU A 32 -2.586 -8.408 6.689 1.00 0.00 O ATOM 446 CB GLU A 32 -2.033 -11.840 6.274 1.00 0.00 C ATOM 447 CG GLU A 32 -2.105 -11.944 4.750 1.00 0.00 C ATOM 448 CD GLU A 32 -0.950 -12.786 4.203 1.00 0.00 C ATOM 449 OE1 GLU A 32 -1.146 -14.015 4.094 1.00 0.00 O ATOM 450 OE2 GLU A 32 0.102 -12.180 3.906 1.00 0.00 O ATOM 0 H GLU A 32 0.418 -10.139 7.643 1.00 0.00 H new ATOM 0 HA GLU A 32 -0.926 -10.074 5.834 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -1.438 -12.662 6.670 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -3.033 -11.938 6.696 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -3.055 -12.390 4.457 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -2.072 -10.947 4.312 1.00 0.00 H new ATOM 455 N GLU A 33 -3.300 -10.001 8.127 1.00 0.00 N ATOM 456 CA GLU A 33 -4.372 -9.186 8.673 1.00 0.00 C ATOM 457 C GLU A 33 -3.796 -8.045 9.512 1.00 0.00 C ATOM 458 O GLU A 33 -4.352 -6.947 9.541 1.00 0.00 O ATOM 459 CB GLU A 33 -5.343 -10.036 9.494 1.00 0.00 C ATOM 460 CG GLU A 33 -6.548 -10.460 8.654 1.00 0.00 C ATOM 461 CD GLU A 33 -7.725 -10.860 9.545 1.00 0.00 C ATOM 462 OE1 GLU A 33 -7.450 -11.329 10.671 1.00 0.00 O ATOM 463 OE2 GLU A 33 -8.873 -10.690 9.080 1.00 0.00 O ATOM 0 H GLU A 33 -3.226 -10.935 8.531 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.932 -8.753 7.844 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -4.829 -10.920 9.870 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -5.682 -9.471 10.362 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -6.845 -9.641 7.999 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -6.272 -11.297 8.013 1.00 0.00 H new ATOM 468 N LYS A 34 -2.688 -8.341 10.176 1.00 0.00 N ATOM 469 CA LYS A 34 -2.030 -7.353 11.014 1.00 0.00 C ATOM 470 C LYS A 34 -0.979 -6.609 10.189 1.00 0.00 C ATOM 471 O LYS A 34 -0.587 -5.496 10.535 1.00 0.00 O ATOM 472 CB LYS A 34 -1.470 -8.010 12.277 1.00 0.00 C ATOM 473 CG LYS A 34 -2.436 -7.853 13.452 1.00 0.00 C ATOM 474 CD LYS A 34 -1.698 -7.387 14.710 1.00 0.00 C ATOM 475 CE LYS A 34 -2.596 -7.497 15.944 1.00 0.00 C ATOM 476 NZ LYS A 34 -2.614 -6.217 16.688 1.00 0.00 N ATOM 0 H LYS A 34 -2.229 -9.252 10.150 1.00 0.00 H new ATOM 0 HA LYS A 34 -2.747 -6.609 11.361 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -1.288 -9.068 12.090 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -0.509 -7.561 12.529 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -3.214 -7.134 13.195 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -2.933 -8.803 13.648 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -0.801 -7.989 14.854 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -1.372 -6.355 14.584 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -3.609 -7.763 15.641 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -2.237 -8.296 16.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -3.228 -6.309 17.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -1.649 -5.979 16.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -2.978 -5.462 16.072 1.00 0.00 H new ATOM 486 N GLU A 35 -0.550 -7.255 9.115 1.00 0.00 N ATOM 487 CA GLU A 35 0.448 -6.668 8.237 1.00 0.00 C ATOM 488 C GLU A 35 -0.196 -5.625 7.322 1.00 0.00 C ATOM 489 O GLU A 35 0.501 -4.814 6.713 1.00 0.00 O ATOM 490 CB GLU A 35 1.162 -7.747 7.421 1.00 0.00 C ATOM 491 CG GLU A 35 1.993 -7.125 6.297 1.00 0.00 C ATOM 492 CD GLU A 35 1.101 -6.686 5.134 1.00 0.00 C ATOM 493 OE1 GLU A 35 -0.023 -7.228 5.045 1.00 0.00 O ATOM 494 OE2 GLU A 35 1.562 -5.819 4.360 1.00 0.00 O ATOM 0 H GLU A 35 -0.875 -8.180 8.833 1.00 0.00 H new ATOM 0 HA GLU A 35 1.196 -6.169 8.853 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.808 -8.334 8.074 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.428 -8.433 6.998 1.00 0.00 H new ATOM 0 HG2 GLU A 35 2.545 -6.267 6.680 1.00 0.00 H new ATOM 0 HG3 GLU A 35 2.730 -7.846 5.943 1.00 0.00 H new ATOM 499 N GLN A 36 -1.518 -5.679 7.255 1.00 0.00 N ATOM 500 CA GLN A 36 -2.263 -4.749 6.425 1.00 0.00 C ATOM 501 C GLN A 36 -2.986 -3.720 7.298 1.00 0.00 C ATOM 502 O GLN A 36 -3.088 -2.551 6.930 1.00 0.00 O ATOM 503 CB GLN A 36 -3.250 -5.490 5.520 1.00 0.00 C ATOM 504 CG GLN A 36 -3.334 -4.829 4.143 1.00 0.00 C ATOM 505 CD GLN A 36 -1.938 -4.522 3.595 1.00 0.00 C ATOM 506 OE1 GLN A 36 -1.608 -3.397 3.260 1.00 0.00 O ATOM 507 NE2 GLN A 36 -1.139 -5.583 3.525 1.00 0.00 N ATOM 0 H GLN A 36 -2.092 -6.353 7.762 1.00 0.00 H new ATOM 0 HA GLN A 36 -1.558 -4.221 5.783 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -2.939 -6.529 5.410 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -4.237 -5.500 5.983 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -3.863 -5.486 3.452 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -3.912 -3.907 4.213 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -1.479 -6.498 3.822 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -0.187 -5.482 3.174 1.00 0.00 H new ATOM 514 N LEU A 37 -3.470 -4.193 8.437 1.00 0.00 N ATOM 515 CA LEU A 37 -4.180 -3.329 9.365 1.00 0.00 C ATOM 516 C LEU A 37 -3.168 -2.517 10.175 1.00 0.00 C ATOM 517 O LEU A 37 -3.203 -1.288 10.165 1.00 0.00 O ATOM 518 CB LEU A 37 -5.144 -4.147 10.227 1.00 0.00 C ATOM 519 CG LEU A 37 -5.591 -3.495 11.536 1.00 0.00 C ATOM 520 CD1 LEU A 37 -6.329 -2.181 11.270 1.00 0.00 C ATOM 521 CD2 LEU A 37 -6.427 -4.464 12.375 1.00 0.00 C ATOM 0 H LEU A 37 -3.384 -5.164 8.738 1.00 0.00 H new ATOM 0 HA LEU A 37 -4.801 -2.615 8.823 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.031 -4.370 9.634 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.670 -5.100 10.462 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.702 -3.252 12.118 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -6.636 -1.738 12.217 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -5.668 -1.492 10.745 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -7.210 -2.376 10.658 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.732 -3.975 13.300 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.312 -4.761 11.813 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.833 -5.347 12.610 1.00 0.00 H new ATOM 532 N SER A 38 -2.290 -3.238 10.858 1.00 0.00 N ATOM 533 CA SER A 38 -1.270 -2.599 11.672 1.00 0.00 C ATOM 534 C SER A 38 -0.461 -1.618 10.823 1.00 0.00 C ATOM 535 O SER A 38 0.023 -0.606 11.328 1.00 0.00 O ATOM 536 CB SER A 38 -0.345 -3.637 12.310 1.00 0.00 C ATOM 537 OG SER A 38 -1.059 -4.788 12.753 1.00 0.00 O ATOM 0 H SER A 38 -2.264 -4.258 10.864 1.00 0.00 H new ATOM 0 HA SER A 38 -1.766 -2.052 12.474 1.00 0.00 H new ATOM 0 HB2 SER A 38 0.415 -3.937 11.589 1.00 0.00 H new ATOM 0 HB3 SER A 38 0.177 -3.187 13.154 1.00 0.00 H new ATOM 0 HG SER A 38 -0.717 -5.582 12.292 1.00 0.00 H new ATOM 542 N THR A 39 -0.338 -1.951 9.546 1.00 0.00 N ATOM 543 CA THR A 39 0.405 -1.112 8.622 1.00 0.00 C ATOM 544 C THR A 39 -0.511 -0.047 8.015 1.00 0.00 C ATOM 545 O THR A 39 -0.039 0.986 7.541 1.00 0.00 O ATOM 546 CB THR A 39 1.056 -2.020 7.577 1.00 0.00 C ATOM 547 OG1 THR A 39 -0.045 -2.554 6.847 1.00 0.00 O ATOM 548 CG2 THR A 39 1.720 -3.250 8.201 1.00 0.00 C ATOM 0 H THR A 39 -0.741 -2.791 9.130 1.00 0.00 H new ATOM 0 HA THR A 39 1.195 -0.563 9.134 1.00 0.00 H new ATOM 0 HB THR A 39 1.798 -1.452 7.016 1.00 0.00 H new ATOM 0 HG1 THR A 39 0.276 -3.244 6.229 1.00 0.00 H new ATOM 0 HG21 THR A 39 2.166 -3.860 7.416 1.00 0.00 H new ATOM 0 HG22 THR A 39 2.495 -2.931 8.897 1.00 0.00 H new ATOM 0 HG23 THR A 39 0.972 -3.836 8.735 1.00 0.00 H new ATOM 556 N ALA A 40 -1.803 -0.334 8.050 1.00 0.00 N ATOM 557 CA ALA A 40 -2.790 0.586 7.509 1.00 0.00 C ATOM 558 C ALA A 40 -3.107 1.658 8.553 1.00 0.00 C ATOM 559 O ALA A 40 -3.738 2.666 8.241 1.00 0.00 O ATOM 560 CB ALA A 40 -4.034 -0.194 7.078 1.00 0.00 C ATOM 0 H ALA A 40 -2.190 -1.191 8.445 1.00 0.00 H new ATOM 0 HA ALA A 40 -2.400 1.091 6.625 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -4.774 0.496 6.672 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -3.760 -0.922 6.315 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -4.455 -0.712 7.940 1.00 0.00 H new ATOM 566 N ILE A 41 -2.653 1.404 9.772 1.00 0.00 N ATOM 567 CA ILE A 41 -2.881 2.336 10.864 1.00 0.00 C ATOM 568 C ILE A 41 -1.533 2.772 11.445 1.00 0.00 C ATOM 569 O ILE A 41 -1.397 3.894 11.928 1.00 0.00 O ATOM 570 CB ILE A 41 -3.829 1.727 11.899 1.00 0.00 C ATOM 571 CG1 ILE A 41 -3.351 0.339 12.331 1.00 0.00 C ATOM 572 CG2 ILE A 41 -5.267 1.701 11.377 1.00 0.00 C ATOM 573 CD1 ILE A 41 -3.229 0.250 13.853 1.00 0.00 C ATOM 0 H ILE A 41 -2.129 0.567 10.027 1.00 0.00 H new ATOM 0 HA ILE A 41 -3.379 3.235 10.501 1.00 0.00 H new ATOM 0 HB ILE A 41 -3.820 2.361 12.786 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -4.050 -0.418 11.974 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -2.386 0.124 11.872 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -5.920 1.263 12.132 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -5.594 2.718 11.160 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -5.313 1.103 10.467 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -2.888 -0.747 14.133 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -2.511 0.991 14.204 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.201 0.442 14.308 1.00 0.00 H new ATOM 584 N ASP A 42 -0.574 1.861 11.380 1.00 0.00 N ATOM 585 CA ASP A 42 0.757 2.137 11.894 1.00 0.00 C ATOM 586 C ASP A 42 1.137 3.581 11.561 1.00 0.00 C ATOM 587 O ASP A 42 1.195 4.432 12.448 1.00 0.00 O ATOM 588 CB ASP A 42 1.796 1.215 11.254 1.00 0.00 C ATOM 589 CG ASP A 42 2.302 0.087 12.156 1.00 0.00 C ATOM 590 OD1 ASP A 42 1.910 0.090 13.343 1.00 0.00 O ATOM 591 OD2 ASP A 42 3.070 -0.753 11.637 1.00 0.00 O ATOM 0 H ASP A 42 -0.692 0.931 10.979 1.00 0.00 H new ATOM 0 HA ASP A 42 0.744 1.972 12.971 1.00 0.00 H new ATOM 0 HB2 ASP A 42 1.365 0.775 10.355 1.00 0.00 H new ATOM 0 HB3 ASP A 42 2.648 1.817 10.937 1.00 0.00 H new ATOM 595 N ARG A 43 1.387 3.814 10.281 1.00 0.00 N ATOM 596 CA ARG A 43 1.760 5.140 9.820 1.00 0.00 C ATOM 597 C ARG A 43 0.619 5.762 9.010 1.00 0.00 C ATOM 598 O ARG A 43 0.450 6.980 9.005 1.00 0.00 O ATOM 599 CB ARG A 43 3.021 5.089 8.956 1.00 0.00 C ATOM 600 CG ARG A 43 4.278 5.010 9.825 1.00 0.00 C ATOM 601 CD ARG A 43 5.223 3.915 9.324 1.00 0.00 C ATOM 602 NE ARG A 43 5.420 2.896 10.379 1.00 0.00 N ATOM 603 CZ ARG A 43 6.081 3.117 11.523 1.00 0.00 C ATOM 604 NH1 ARG A 43 6.613 4.323 11.767 1.00 0.00 N ATOM 605 NH2 ARG A 43 6.211 2.134 12.424 1.00 0.00 N ATOM 0 H ARG A 43 1.338 3.106 9.548 1.00 0.00 H new ATOM 0 HA ARG A 43 1.961 5.752 10.700 1.00 0.00 H new ATOM 0 HB2 ARG A 43 2.978 4.224 8.294 1.00 0.00 H new ATOM 0 HB3 ARG A 43 3.068 5.974 8.322 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.792 5.971 9.816 1.00 0.00 H new ATOM 0 HG3 ARG A 43 3.998 4.808 10.859 1.00 0.00 H new ATOM 0 HD2 ARG A 43 4.811 3.449 8.429 1.00 0.00 H new ATOM 0 HD3 ARG A 43 6.182 4.351 9.044 1.00 0.00 H new ATOM 0 HE ARG A 43 5.028 1.967 10.225 1.00 0.00 H new ATOM 0 HH11 ARG A 43 6.514 5.072 11.082 1.00 0.00 H new ATOM 0 HH12 ARG A 43 7.116 4.492 12.638 1.00 0.00 H new ATOM 0 HH21 ARG A 43 5.806 1.216 12.239 1.00 0.00 H new ATOM 0 HH22 ARG A 43 6.715 2.304 13.295 1.00 0.00 H new ATOM 616 N MET A 44 -0.131 4.896 8.346 1.00 0.00 N ATOM 617 CA MET A 44 -1.250 5.344 7.534 1.00 0.00 C ATOM 618 C MET A 44 -2.269 6.110 8.380 1.00 0.00 C ATOM 619 O MET A 44 -3.027 6.925 7.858 1.00 0.00 O ATOM 620 CB MET A 44 -1.929 4.134 6.887 1.00 0.00 C ATOM 621 CG MET A 44 -1.391 3.894 5.476 1.00 0.00 C ATOM 622 SD MET A 44 -2.358 4.812 4.289 1.00 0.00 S ATOM 623 CE MET A 44 -1.362 4.576 2.827 1.00 0.00 C ATOM 0 H MET A 44 0.014 3.886 8.353 1.00 0.00 H new ATOM 0 HA MET A 44 -0.870 6.014 6.762 1.00 0.00 H new ATOM 0 HB2 MET A 44 -1.762 3.248 7.499 1.00 0.00 H new ATOM 0 HB3 MET A 44 -3.006 4.295 6.847 1.00 0.00 H new ATOM 0 HG2 MET A 44 -0.346 4.199 5.420 1.00 0.00 H new ATOM 0 HG3 MET A 44 -1.426 2.830 5.241 1.00 0.00 H new ATOM 0 HE1 MET A 44 -1.734 5.215 2.026 1.00 0.00 H new ATOM 0 HE2 MET A 44 -0.326 4.836 3.046 1.00 0.00 H new ATOM 0 HE3 MET A 44 -1.416 3.533 2.514 1.00 0.00 H new ATOM 631 N ASN A 45 -2.253 5.820 9.673 1.00 0.00 N ATOM 632 CA ASN A 45 -3.167 6.472 10.597 1.00 0.00 C ATOM 633 C ASN A 45 -2.946 7.984 10.544 1.00 0.00 C ATOM 634 O ASN A 45 -3.614 8.687 9.788 1.00 0.00 O ATOM 635 CB ASN A 45 -2.921 6.007 12.034 1.00 0.00 C ATOM 636 CG ASN A 45 -3.622 6.928 13.035 1.00 0.00 C ATOM 637 OD1 ASN A 45 -4.835 7.067 13.045 1.00 0.00 O ATOM 638 ND2 ASN A 45 -2.796 7.546 13.874 1.00 0.00 N ATOM 0 H ASN A 45 -1.622 5.143 10.103 1.00 0.00 H new ATOM 0 HA ASN A 45 -4.185 6.214 10.304 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -3.284 4.987 12.157 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -1.850 5.991 12.237 1.00 0.00 H new ATOM 0 HD21 ASN A 45 -3.168 8.181 14.580 1.00 0.00 H new ATOM 0 HD22 ASN A 45 -1.791 7.385 13.811 1.00 0.00 H new ATOM 644 N GLU A 46 -2.004 8.442 11.358 1.00 0.00 N ATOM 645 CA GLU A 46 -1.686 9.858 11.413 1.00 0.00 C ATOM 646 C GLU A 46 -0.737 10.234 10.275 1.00 0.00 C ATOM 647 O GLU A 46 -0.678 11.394 9.868 1.00 0.00 O ATOM 648 CB GLU A 46 -1.090 10.233 12.771 1.00 0.00 C ATOM 649 CG GLU A 46 -1.174 11.743 13.009 1.00 0.00 C ATOM 650 CD GLU A 46 -2.241 12.074 14.056 1.00 0.00 C ATOM 651 OE1 GLU A 46 -2.045 11.654 15.217 1.00 0.00 O ATOM 652 OE2 GLU A 46 -3.227 12.739 13.671 1.00 0.00 O ATOM 0 H GLU A 46 -1.452 7.856 11.984 1.00 0.00 H new ATOM 0 HA GLU A 46 -2.610 10.423 11.290 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -1.622 9.706 13.563 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -0.050 9.911 12.817 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -0.205 12.117 13.341 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -1.408 12.250 12.073 1.00 0.00 H new ATOM 657 N GLY A 47 -0.017 9.232 9.791 1.00 0.00 N ATOM 658 CA GLY A 47 0.927 9.443 8.707 1.00 0.00 C ATOM 659 C GLY A 47 0.203 9.831 7.417 1.00 0.00 C ATOM 660 O GLY A 47 0.652 10.716 6.689 1.00 0.00 O ATOM 0 H GLY A 47 -0.069 8.271 10.130 1.00 0.00 H new ATOM 0 HA2 GLY A 47 1.633 10.227 8.982 1.00 0.00 H new ATOM 0 HA3 GLY A 47 1.507 8.535 8.543 1.00 0.00 H new ATOM 664 N LEU A 48 -0.908 9.150 7.172 1.00 0.00 N ATOM 665 CA LEU A 48 -1.698 9.412 5.982 1.00 0.00 C ATOM 666 C LEU A 48 -2.504 10.697 6.182 1.00 0.00 C ATOM 667 O LEU A 48 -2.478 11.589 5.336 1.00 0.00 O ATOM 668 CB LEU A 48 -2.558 8.196 5.631 1.00 0.00 C ATOM 669 CG LEU A 48 -4.037 8.289 6.007 1.00 0.00 C ATOM 670 CD1 LEU A 48 -4.757 9.332 5.149 1.00 0.00 C ATOM 671 CD2 LEU A 48 -4.712 6.917 5.927 1.00 0.00 C ATOM 0 H LEU A 48 -1.279 8.418 7.778 1.00 0.00 H new ATOM 0 HA LEU A 48 -1.048 9.573 5.122 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -2.487 8.024 4.557 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -2.133 7.321 6.123 1.00 0.00 H new ATOM 0 HG LEU A 48 -4.105 8.621 7.043 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -5.807 9.378 5.437 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.296 10.308 5.300 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -4.681 9.054 4.098 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -5.763 7.012 6.199 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -4.634 6.532 4.910 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -4.220 6.229 6.614 1.00 0.00 H new ATOM 682 N ASP A 49 -3.201 10.751 7.308 1.00 0.00 N ATOM 683 CA ASP A 49 -4.012 11.911 7.631 1.00 0.00 C ATOM 684 C ASP A 49 -3.124 13.157 7.663 1.00 0.00 C ATOM 685 O ASP A 49 -3.564 14.247 7.300 1.00 0.00 O ATOM 686 CB ASP A 49 -4.666 11.762 9.006 1.00 0.00 C ATOM 687 CG ASP A 49 -6.123 12.221 9.083 1.00 0.00 C ATOM 688 OD1 ASP A 49 -6.634 12.668 8.034 1.00 0.00 O ATOM 689 OD2 ASP A 49 -6.694 12.114 10.191 1.00 0.00 O ATOM 0 H ASP A 49 -3.220 10.009 8.008 1.00 0.00 H new ATOM 0 HA ASP A 49 -4.788 12.001 6.871 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -4.615 10.715 9.304 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -4.083 12.329 9.732 1.00 0.00 H new ATOM 693 N ALA A 50 -1.889 12.953 8.098 1.00 0.00 N ATOM 694 CA ALA A 50 -0.935 14.046 8.182 1.00 0.00 C ATOM 695 C ALA A 50 -0.348 14.311 6.794 1.00 0.00 C ATOM 696 O ALA A 50 -0.642 15.333 6.177 1.00 0.00 O ATOM 697 CB ALA A 50 0.141 13.706 9.215 1.00 0.00 C ATOM 0 H ALA A 50 -1.527 12.047 8.396 1.00 0.00 H new ATOM 0 HA ALA A 50 -1.427 14.961 8.513 1.00 0.00 H new ATOM 0 HB1 ALA A 50 0.857 14.526 9.278 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -0.324 13.555 10.189 1.00 0.00 H new ATOM 0 HB3 ALA A 50 0.659 12.795 8.915 1.00 0.00 H new ATOM 703 N PHE A 51 0.472 13.372 6.344 1.00 0.00 N ATOM 704 CA PHE A 51 1.103 13.493 5.041 1.00 0.00 C ATOM 705 C PHE A 51 0.100 13.964 3.987 1.00 0.00 C ATOM 706 O PHE A 51 0.436 14.774 3.124 1.00 0.00 O ATOM 707 CB PHE A 51 1.609 12.100 4.659 1.00 0.00 C ATOM 708 CG PHE A 51 2.559 12.089 3.460 1.00 0.00 C ATOM 709 CD1 PHE A 51 2.133 12.549 2.253 1.00 0.00 C ATOM 710 CD2 PHE A 51 3.828 11.622 3.601 1.00 0.00 C ATOM 711 CE1 PHE A 51 3.014 12.539 1.138 1.00 0.00 C ATOM 712 CE2 PHE A 51 4.708 11.612 2.488 1.00 0.00 C ATOM 713 CZ PHE A 51 4.284 12.071 1.279 1.00 0.00 C ATOM 0 H PHE A 51 0.714 12.525 6.858 1.00 0.00 H new ATOM 0 HA PHE A 51 1.912 14.223 5.086 1.00 0.00 H new ATOM 0 HB2 PHE A 51 2.119 11.662 5.517 1.00 0.00 H new ATOM 0 HB3 PHE A 51 0.753 11.462 4.437 1.00 0.00 H new ATOM 0 HD1 PHE A 51 1.125 12.922 2.142 1.00 0.00 H new ATOM 0 HD2 PHE A 51 4.166 11.259 4.560 1.00 0.00 H new ATOM 0 HE1 PHE A 51 2.676 12.903 0.179 1.00 0.00 H new ATOM 0 HE2 PHE A 51 5.716 11.240 2.600 1.00 0.00 H new ATOM 0 HZ PHE A 51 4.955 12.064 0.432 1.00 0.00 H new ATOM 722 N ILE A 52 -1.111 13.437 4.091 1.00 0.00 N ATOM 723 CA ILE A 52 -2.166 13.794 3.158 1.00 0.00 C ATOM 724 C ILE A 52 -2.506 15.277 3.322 1.00 0.00 C ATOM 725 O ILE A 52 -2.657 15.997 2.337 1.00 0.00 O ATOM 726 CB ILE A 52 -3.369 12.864 3.327 1.00 0.00 C ATOM 727 CG1 ILE A 52 -4.219 12.830 2.056 1.00 0.00 C ATOM 728 CG2 ILE A 52 -4.193 13.253 4.557 1.00 0.00 C ATOM 729 CD1 ILE A 52 -5.100 14.076 1.950 1.00 0.00 C ATOM 0 H ILE A 52 -1.385 12.765 4.808 1.00 0.00 H new ATOM 0 HA ILE A 52 -1.829 13.656 2.131 1.00 0.00 H new ATOM 0 HB ILE A 52 -2.998 11.853 3.493 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.570 12.764 1.183 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -4.845 11.937 2.057 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.042 12.577 4.655 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -3.570 13.185 5.449 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -4.554 14.275 4.444 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -5.693 14.025 1.037 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -5.765 14.126 2.813 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -4.471 14.966 1.925 1.00 0.00 H new ATOM 740 N GLN A 53 -2.618 15.689 4.576 1.00 0.00 N ATOM 741 CA GLN A 53 -2.938 17.073 4.883 1.00 0.00 C ATOM 742 C GLN A 53 -1.759 17.981 4.531 1.00 0.00 C ATOM 743 O GLN A 53 -1.883 19.205 4.556 1.00 0.00 O ATOM 744 CB GLN A 53 -3.333 17.233 6.353 1.00 0.00 C ATOM 745 CG GLN A 53 -2.134 17.662 7.200 1.00 0.00 C ATOM 746 CD GLN A 53 -2.107 19.181 7.382 1.00 0.00 C ATOM 747 OE1 GLN A 53 -2.975 19.902 6.920 1.00 0.00 O ATOM 748 NE2 GLN A 53 -1.065 19.623 8.081 1.00 0.00 N ATOM 0 H GLN A 53 -2.493 15.089 5.391 1.00 0.00 H new ATOM 0 HA GLN A 53 -3.794 17.370 4.277 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -4.128 17.973 6.441 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -3.731 16.291 6.731 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -2.180 17.176 8.175 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -1.211 17.333 6.723 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -0.374 18.963 8.439 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -0.957 20.622 8.259 1.00 0.00 H new ATOM 755 N LEU A 54 -0.639 17.348 4.212 1.00 0.00 N ATOM 756 CA LEU A 54 0.562 18.083 3.855 1.00 0.00 C ATOM 757 C LEU A 54 0.797 17.968 2.349 1.00 0.00 C ATOM 758 O LEU A 54 1.403 18.851 1.742 1.00 0.00 O ATOM 759 CB LEU A 54 1.747 17.614 4.701 1.00 0.00 C ATOM 760 CG LEU A 54 2.050 18.442 5.951 1.00 0.00 C ATOM 761 CD1 LEU A 54 2.140 17.549 7.191 1.00 0.00 C ATOM 762 CD2 LEU A 54 3.312 19.285 5.759 1.00 0.00 C ATOM 0 H LEU A 54 -0.539 16.333 4.194 1.00 0.00 H new ATOM 0 HA LEU A 54 0.441 19.143 4.078 1.00 0.00 H new ATOM 0 HB2 LEU A 54 1.564 16.584 5.008 1.00 0.00 H new ATOM 0 HB3 LEU A 54 2.636 17.605 4.071 1.00 0.00 H new ATOM 0 HG LEU A 54 1.223 19.134 6.111 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.356 18.162 8.066 1.00 0.00 H new ATOM 0 HD12 LEU A 54 1.192 17.031 7.336 1.00 0.00 H new ATOM 0 HD13 LEU A 54 2.936 16.817 7.055 1.00 0.00 H new ATOM 0 HD21 LEU A 54 3.504 19.864 6.663 1.00 0.00 H new ATOM 0 HD22 LEU A 54 4.160 18.630 5.560 1.00 0.00 H new ATOM 0 HD23 LEU A 54 3.172 19.963 4.917 1.00 0.00 H new ATOM 773 N TYR A 55 0.306 16.873 1.787 1.00 0.00 N ATOM 774 CA TYR A 55 0.455 16.631 0.362 1.00 0.00 C ATOM 775 C TYR A 55 -0.910 16.487 -0.316 1.00 0.00 C ATOM 776 O TYR A 55 -1.281 17.310 -1.151 1.00 0.00 O ATOM 777 CB TYR A 55 1.215 15.309 0.235 1.00 0.00 C ATOM 778 CG TYR A 55 2.734 15.452 0.343 1.00 0.00 C ATOM 779 CD1 TYR A 55 3.291 16.097 1.429 1.00 0.00 C ATOM 780 CD2 TYR A 55 3.547 14.936 -0.644 1.00 0.00 C ATOM 781 CE1 TYR A 55 4.721 16.232 1.531 1.00 0.00 C ATOM 782 CE2 TYR A 55 4.977 15.071 -0.542 1.00 0.00 C ATOM 783 CZ TYR A 55 5.494 15.712 0.540 1.00 0.00 C ATOM 784 OH TYR A 55 6.845 15.839 0.637 1.00 0.00 O ATOM 0 H TYR A 55 -0.196 16.143 2.293 1.00 0.00 H new ATOM 0 HA TYR A 55 0.977 17.461 -0.115 1.00 0.00 H new ATOM 0 HB2 TYR A 55 0.868 14.627 1.011 1.00 0.00 H new ATOM 0 HB3 TYR A 55 0.971 14.852 -0.724 1.00 0.00 H new ATOM 0 HD1 TYR A 55 2.654 16.500 2.202 1.00 0.00 H new ATOM 0 HD2 TYR A 55 3.111 14.431 -1.493 1.00 0.00 H new ATOM 0 HE1 TYR A 55 5.170 16.735 2.375 1.00 0.00 H new ATOM 0 HE2 TYR A 55 5.625 14.672 -1.308 1.00 0.00 H new ATOM 0 HH TYR A 55 7.062 16.511 1.316 1.00 0.00 H new ATOM 793 N ASN A 56 -1.619 15.437 0.070 1.00 0.00 N ATOM 794 CA ASN A 56 -2.934 15.175 -0.489 1.00 0.00 C ATOM 795 C ASN A 56 -2.801 14.912 -1.991 1.00 0.00 C ATOM 796 O ASN A 56 -3.716 15.207 -2.759 1.00 0.00 O ATOM 797 CB ASN A 56 -3.862 16.378 -0.300 1.00 0.00 C ATOM 798 CG ASN A 56 -5.257 16.086 -0.857 1.00 0.00 C ATOM 799 OD1 ASN A 56 -5.580 14.974 -1.243 1.00 0.00 O ATOM 800 ND2 ASN A 56 -6.063 17.143 -0.877 1.00 0.00 N ATOM 0 H ASN A 56 -1.307 14.757 0.764 1.00 0.00 H new ATOM 0 HA ASN A 56 -3.354 14.311 0.026 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -3.934 16.624 0.759 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -3.441 17.249 -0.802 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -7.015 17.052 -1.231 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -5.729 18.045 -0.539 1.00 0.00 H new ATOM 806 N GLU A 57 -1.656 14.358 -2.363 1.00 0.00 N ATOM 807 CA GLU A 57 -1.393 14.051 -3.758 1.00 0.00 C ATOM 808 C GLU A 57 -0.915 12.605 -3.902 1.00 0.00 C ATOM 809 O GLU A 57 -0.807 12.091 -5.015 1.00 0.00 O ATOM 810 CB GLU A 57 -0.375 15.027 -4.351 1.00 0.00 C ATOM 811 CG GLU A 57 -0.557 15.157 -5.865 1.00 0.00 C ATOM 812 CD GLU A 57 -1.920 15.762 -6.203 1.00 0.00 C ATOM 813 OE1 GLU A 57 -2.453 16.483 -5.332 1.00 0.00 O ATOM 814 OE2 GLU A 57 -2.399 15.490 -7.326 1.00 0.00 O ATOM 0 H GLU A 57 -0.901 14.114 -1.723 1.00 0.00 H new ATOM 0 HA GLU A 57 -2.322 14.163 -4.316 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -0.488 16.005 -3.882 1.00 0.00 H new ATOM 0 HB3 GLU A 57 0.635 14.682 -4.131 1.00 0.00 H new ATOM 0 HG2 GLU A 57 0.235 15.782 -6.278 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -0.465 14.176 -6.332 1.00 0.00 H new ATOM 819 N SER A 58 -0.640 11.989 -2.761 1.00 0.00 N ATOM 820 CA SER A 58 -0.176 10.613 -2.747 1.00 0.00 C ATOM 821 C SER A 58 1.354 10.577 -2.763 1.00 0.00 C ATOM 822 O SER A 58 1.951 9.552 -3.094 1.00 0.00 O ATOM 823 CB SER A 58 -0.738 9.829 -3.934 1.00 0.00 C ATOM 824 OG SER A 58 -0.831 8.434 -3.658 1.00 0.00 O ATOM 0 H SER A 58 -0.730 12.418 -1.840 1.00 0.00 H new ATOM 0 HA SER A 58 -0.535 10.141 -1.833 1.00 0.00 H new ATOM 0 HB2 SER A 58 -1.725 10.215 -4.188 1.00 0.00 H new ATOM 0 HB3 SER A 58 -0.101 9.984 -4.805 1.00 0.00 H new ATOM 0 HG SER A 58 -0.237 8.208 -2.912 1.00 0.00 H new ATOM 829 N GLU A 59 1.945 11.706 -2.404 1.00 0.00 N ATOM 830 CA GLU A 59 3.394 11.816 -2.374 1.00 0.00 C ATOM 831 C GLU A 59 3.907 12.428 -3.679 1.00 0.00 C ATOM 832 O GLU A 59 4.742 11.835 -4.359 1.00 0.00 O ATOM 833 CB GLU A 59 4.042 10.454 -2.114 1.00 0.00 C ATOM 834 CG GLU A 59 5.432 10.618 -1.499 1.00 0.00 C ATOM 835 CD GLU A 59 6.495 9.918 -2.349 1.00 0.00 C ATOM 836 OE1 GLU A 59 6.295 9.872 -3.581 1.00 0.00 O ATOM 837 OE2 GLU A 59 7.482 9.443 -1.747 1.00 0.00 O ATOM 0 H GLU A 59 1.447 12.553 -2.131 1.00 0.00 H new ATOM 0 HA GLU A 59 3.672 12.476 -1.552 1.00 0.00 H new ATOM 0 HB2 GLU A 59 3.411 9.869 -1.445 1.00 0.00 H new ATOM 0 HB3 GLU A 59 4.117 9.898 -3.049 1.00 0.00 H new ATOM 0 HG2 GLU A 59 5.672 11.678 -1.411 1.00 0.00 H new ATOM 0 HG3 GLU A 59 5.438 10.205 -0.490 1.00 0.00 H new ATOM 842 N ILE A 60 3.386 13.607 -3.987 1.00 0.00 N ATOM 843 CA ILE A 60 3.781 14.305 -5.198 1.00 0.00 C ATOM 844 C ILE A 60 5.053 15.111 -4.925 1.00 0.00 C ATOM 845 O ILE A 60 6.048 14.965 -5.632 1.00 0.00 O ATOM 846 CB ILE A 60 2.621 15.148 -5.733 1.00 0.00 C ATOM 847 CG1 ILE A 60 2.856 15.541 -7.193 1.00 0.00 C ATOM 848 CG2 ILE A 60 2.375 16.369 -4.843 1.00 0.00 C ATOM 849 CD1 ILE A 60 4.350 15.696 -7.485 1.00 0.00 C ATOM 0 H ILE A 60 2.694 14.096 -3.419 1.00 0.00 H new ATOM 0 HA ILE A 60 4.018 13.593 -5.988 1.00 0.00 H new ATOM 0 HB ILE A 60 1.716 14.541 -5.705 1.00 0.00 H new ATOM 0 HG12 ILE A 60 2.430 14.783 -7.850 1.00 0.00 H new ATOM 0 HG13 ILE A 60 2.340 16.477 -7.409 1.00 0.00 H new ATOM 0 HG21 ILE A 60 1.546 16.951 -5.245 1.00 0.00 H new ATOM 0 HG22 ILE A 60 2.131 16.040 -3.833 1.00 0.00 H new ATOM 0 HG23 ILE A 60 3.273 16.987 -4.816 1.00 0.00 H new ATOM 0 HD11 ILE A 60 4.490 15.976 -8.529 1.00 0.00 H new ATOM 0 HD12 ILE A 60 4.768 16.471 -6.843 1.00 0.00 H new ATOM 0 HD13 ILE A 60 4.859 14.752 -7.291 1.00 0.00 H new ATOM 860 N ASP A 61 4.978 15.945 -3.897 1.00 0.00 N ATOM 861 CA ASP A 61 6.110 16.773 -3.522 1.00 0.00 C ATOM 862 C ASP A 61 7.406 15.994 -3.753 1.00 0.00 C ATOM 863 O ASP A 61 8.381 16.541 -4.267 1.00 0.00 O ATOM 864 CB ASP A 61 6.046 17.157 -2.042 1.00 0.00 C ATOM 865 CG ASP A 61 6.544 18.566 -1.717 1.00 0.00 C ATOM 866 OD1 ASP A 61 7.777 18.761 -1.781 1.00 0.00 O ATOM 867 OD2 ASP A 61 5.681 19.417 -1.412 1.00 0.00 O ATOM 0 H ASP A 61 4.150 16.064 -3.313 1.00 0.00 H new ATOM 0 HA ASP A 61 6.082 17.677 -4.130 1.00 0.00 H new ATOM 0 HB2 ASP A 61 5.014 17.066 -1.703 1.00 0.00 H new ATOM 0 HB3 ASP A 61 6.634 16.439 -1.470 1.00 0.00 H new ATOM 871 N GLU A 62 7.375 14.729 -3.360 1.00 0.00 N ATOM 872 CA GLU A 62 8.536 13.868 -3.519 1.00 0.00 C ATOM 873 C GLU A 62 8.838 13.650 -5.002 1.00 0.00 C ATOM 874 O GLU A 62 8.014 13.104 -5.733 1.00 0.00 O ATOM 875 CB GLU A 62 8.331 12.533 -2.799 1.00 0.00 C ATOM 876 CG GLU A 62 9.452 12.276 -1.790 1.00 0.00 C ATOM 877 CD GLU A 62 10.616 11.529 -2.445 1.00 0.00 C ATOM 878 OE1 GLU A 62 10.388 10.370 -2.855 1.00 0.00 O ATOM 879 OE2 GLU A 62 11.708 12.133 -2.519 1.00 0.00 O ATOM 0 H GLU A 62 6.565 14.279 -2.932 1.00 0.00 H new ATOM 0 HA GLU A 62 9.394 14.362 -3.063 1.00 0.00 H new ATOM 0 HB2 GLU A 62 7.369 12.536 -2.286 1.00 0.00 H new ATOM 0 HB3 GLU A 62 8.301 11.723 -3.528 1.00 0.00 H new ATOM 0 HG2 GLU A 62 9.805 13.224 -1.384 1.00 0.00 H new ATOM 0 HG3 GLU A 62 9.067 11.694 -0.953 1.00 0.00 H new ATOM 884 N PRO A 63 10.053 14.102 -5.413 1.00 0.00 N ATOM 885 CA PRO A 63 10.473 13.961 -6.797 1.00 0.00 C ATOM 886 C PRO A 63 10.866 12.516 -7.107 1.00 0.00 C ATOM 887 O PRO A 63 12.003 12.112 -6.864 1.00 0.00 O ATOM 888 CB PRO A 63 11.627 14.938 -6.958 1.00 0.00 C ATOM 889 CG PRO A 63 12.111 15.248 -5.552 1.00 0.00 C ATOM 890 CD PRO A 63 11.055 14.754 -4.576 1.00 0.00 C ATOM 0 HA PRO A 63 9.675 14.187 -7.504 1.00 0.00 H new ATOM 0 HB2 PRO A 63 12.426 14.503 -7.559 1.00 0.00 H new ATOM 0 HB3 PRO A 63 11.302 15.845 -7.468 1.00 0.00 H new ATOM 0 HG2 PRO A 63 13.066 14.759 -5.361 1.00 0.00 H new ATOM 0 HG3 PRO A 63 12.271 16.319 -5.431 1.00 0.00 H new ATOM 0 HD2 PRO A 63 11.479 14.059 -3.852 1.00 0.00 H new ATOM 0 HD3 PRO A 63 10.622 15.579 -4.010 1.00 0.00 H new ATOM 895 N LEU A 64 9.906 11.776 -7.640 1.00 0.00 N ATOM 896 CA LEU A 64 10.137 10.383 -7.986 1.00 0.00 C ATOM 897 C LEU A 64 9.774 10.161 -9.455 1.00 0.00 C ATOM 898 O LEU A 64 10.651 9.942 -10.289 1.00 0.00 O ATOM 899 CB LEU A 64 9.391 9.460 -7.021 1.00 0.00 C ATOM 900 CG LEU A 64 10.256 8.714 -6.003 1.00 0.00 C ATOM 901 CD1 LEU A 64 10.739 7.378 -6.571 1.00 0.00 C ATOM 902 CD2 LEU A 64 11.416 9.588 -5.524 1.00 0.00 C ATOM 0 H LEU A 64 8.965 12.115 -7.841 1.00 0.00 H new ATOM 0 HA LEU A 64 11.192 10.133 -7.877 1.00 0.00 H new ATOM 0 HB2 LEU A 64 8.655 10.053 -6.478 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.838 8.725 -7.606 1.00 0.00 H new ATOM 0 HG LEU A 64 9.642 8.490 -5.131 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.352 6.867 -5.828 1.00 0.00 H new ATOM 0 HD12 LEU A 64 9.879 6.757 -6.821 1.00 0.00 H new ATOM 0 HD13 LEU A 64 11.331 7.557 -7.469 1.00 0.00 H new ATOM 0 HD21 LEU A 64 12.015 9.034 -4.801 1.00 0.00 H new ATOM 0 HD22 LEU A 64 12.038 9.865 -6.375 1.00 0.00 H new ATOM 0 HD23 LEU A 64 11.023 10.489 -5.054 1.00 0.00 H new ATOM 913 N ILE A 65 8.479 10.224 -9.728 1.00 0.00 N ATOM 914 CA ILE A 65 7.988 10.031 -11.082 1.00 0.00 C ATOM 915 C ILE A 65 6.854 11.020 -11.355 1.00 0.00 C ATOM 916 O ILE A 65 6.741 11.552 -12.458 1.00 0.00 O ATOM 917 CB ILE A 65 7.597 8.569 -11.307 1.00 0.00 C ATOM 918 CG1 ILE A 65 7.955 8.117 -12.725 1.00 0.00 C ATOM 919 CG2 ILE A 65 6.118 8.342 -10.990 1.00 0.00 C ATOM 920 CD1 ILE A 65 7.488 9.142 -13.761 1.00 0.00 C ATOM 0 H ILE A 65 7.754 10.406 -9.034 1.00 0.00 H new ATOM 0 HA ILE A 65 8.775 10.241 -11.806 1.00 0.00 H new ATOM 0 HB ILE A 65 8.173 7.952 -10.617 1.00 0.00 H new ATOM 0 HG12 ILE A 65 9.033 7.979 -12.805 1.00 0.00 H new ATOM 0 HG13 ILE A 65 7.494 7.151 -12.930 1.00 0.00 H new ATOM 0 HG21 ILE A 65 5.866 7.295 -11.158 1.00 0.00 H new ATOM 0 HG22 ILE A 65 5.926 8.599 -9.948 1.00 0.00 H new ATOM 0 HG23 ILE A 65 5.507 8.971 -11.637 1.00 0.00 H new ATOM 0 HD11 ILE A 65 7.755 8.797 -14.760 1.00 0.00 H new ATOM 0 HD12 ILE A 65 6.406 9.260 -13.694 1.00 0.00 H new ATOM 0 HD13 ILE A 65 7.970 10.100 -13.568 1.00 0.00 H new ATOM 931 N GLN A 66 6.042 11.237 -10.330 1.00 0.00 N ATOM 932 CA GLN A 66 4.920 12.153 -10.446 1.00 0.00 C ATOM 933 C GLN A 66 4.100 12.154 -9.153 1.00 0.00 C ATOM 934 O GLN A 66 4.112 13.131 -8.408 1.00 0.00 O ATOM 935 CB GLN A 66 4.045 11.799 -11.649 1.00 0.00 C ATOM 936 CG GLN A 66 3.539 13.061 -12.350 1.00 0.00 C ATOM 937 CD GLN A 66 2.937 12.727 -13.717 1.00 0.00 C ATOM 938 OE1 GLN A 66 1.732 12.723 -13.908 1.00 0.00 O ATOM 939 NE2 GLN A 66 3.839 12.448 -14.652 1.00 0.00 N ATOM 0 H GLN A 66 6.139 10.794 -9.416 1.00 0.00 H new ATOM 0 HA GLN A 66 5.311 13.158 -10.606 1.00 0.00 H new ATOM 0 HB2 GLN A 66 4.616 11.192 -12.352 1.00 0.00 H new ATOM 0 HB3 GLN A 66 3.198 11.196 -11.322 1.00 0.00 H new ATOM 0 HG2 GLN A 66 2.789 13.550 -11.728 1.00 0.00 H new ATOM 0 HG3 GLN A 66 4.361 13.767 -12.473 1.00 0.00 H new ATOM 0 HE21 GLN A 66 4.833 12.470 -14.424 1.00 0.00 H new ATOM 0 HE22 GLN A 66 3.537 12.212 -15.597 1.00 0.00 H new ATOM 946 N LEU A 67 3.408 11.046 -8.929 1.00 0.00 N ATOM 947 CA LEU A 67 2.584 10.907 -7.740 1.00 0.00 C ATOM 948 C LEU A 67 1.577 9.775 -7.952 1.00 0.00 C ATOM 949 O LEU A 67 1.368 8.952 -7.062 1.00 0.00 O ATOM 950 CB LEU A 67 1.938 12.246 -7.376 1.00 0.00 C ATOM 951 CG LEU A 67 0.930 12.800 -8.386 1.00 0.00 C ATOM 952 CD1 LEU A 67 1.576 12.987 -9.760 1.00 0.00 C ATOM 953 CD2 LEU A 67 -0.319 11.918 -8.454 1.00 0.00 C ATOM 0 H LEU A 67 3.401 10.237 -9.550 1.00 0.00 H new ATOM 0 HA LEU A 67 3.197 10.632 -6.882 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.436 12.136 -6.415 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.729 12.984 -7.240 1.00 0.00 H new ATOM 0 HG LEU A 67 0.611 13.785 -8.045 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.838 13.382 -10.458 1.00 0.00 H new ATOM 0 HD12 LEU A 67 2.409 13.686 -9.679 1.00 0.00 H new ATOM 0 HD13 LEU A 67 1.942 12.027 -10.123 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.019 12.334 -9.179 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -0.037 10.910 -8.759 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.792 11.881 -7.473 1.00 0.00 H new ATOM 964 N ASP A 68 0.981 9.771 -9.135 1.00 0.00 N ATOM 965 CA ASP A 68 0.001 8.753 -9.475 1.00 0.00 C ATOM 966 C ASP A 68 0.674 7.379 -9.462 1.00 0.00 C ATOM 967 O ASP A 68 0.330 6.523 -8.649 1.00 0.00 O ATOM 968 CB ASP A 68 -0.571 8.985 -10.874 1.00 0.00 C ATOM 969 CG ASP A 68 -2.082 8.777 -10.997 1.00 0.00 C ATOM 970 OD1 ASP A 68 -2.813 9.758 -10.743 1.00 0.00 O ATOM 971 OD2 ASP A 68 -2.471 7.640 -11.344 1.00 0.00 O ATOM 0 H ASP A 68 1.157 10.456 -9.870 1.00 0.00 H new ATOM 0 HA ASP A 68 -0.805 8.803 -8.743 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -0.333 10.003 -11.183 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -0.069 8.314 -11.571 1.00 0.00 H new ATOM 975 N ASP A 69 1.622 7.210 -10.373 1.00 0.00 N ATOM 976 CA ASP A 69 2.345 5.955 -10.477 1.00 0.00 C ATOM 977 C ASP A 69 3.261 5.797 -9.261 1.00 0.00 C ATOM 978 O ASP A 69 3.544 4.679 -8.834 1.00 0.00 O ATOM 979 CB ASP A 69 3.218 5.925 -11.732 1.00 0.00 C ATOM 980 CG ASP A 69 2.452 5.785 -13.050 1.00 0.00 C ATOM 981 OD1 ASP A 69 1.249 5.453 -12.974 1.00 0.00 O ATOM 982 OD2 ASP A 69 3.086 6.014 -14.102 1.00 0.00 O ATOM 0 H ASP A 69 1.906 7.922 -11.046 1.00 0.00 H new ATOM 0 HA ASP A 69 1.614 5.148 -10.526 1.00 0.00 H new ATOM 0 HB2 ASP A 69 3.808 6.841 -11.768 1.00 0.00 H new ATOM 0 HB3 ASP A 69 3.921 5.096 -11.648 1.00 0.00 H new ATOM 986 N ASP A 70 3.698 6.933 -8.738 1.00 0.00 N ATOM 987 CA ASP A 70 4.576 6.935 -7.580 1.00 0.00 C ATOM 988 C ASP A 70 3.992 6.019 -6.503 1.00 0.00 C ATOM 989 O ASP A 70 4.731 5.324 -5.807 1.00 0.00 O ATOM 990 CB ASP A 70 4.703 8.340 -6.988 1.00 0.00 C ATOM 991 CG ASP A 70 6.027 8.624 -6.276 1.00 0.00 C ATOM 992 OD1 ASP A 70 6.678 7.635 -5.875 1.00 0.00 O ATOM 993 OD2 ASP A 70 6.357 9.822 -6.146 1.00 0.00 O ATOM 0 H ASP A 70 3.461 7.859 -9.095 1.00 0.00 H new ATOM 0 HA ASP A 70 5.559 6.589 -7.900 1.00 0.00 H new ATOM 0 HB2 ASP A 70 4.575 9.068 -7.789 1.00 0.00 H new ATOM 0 HB3 ASP A 70 3.887 8.496 -6.282 1.00 0.00 H new ATOM 997 N THR A 71 2.672 6.049 -6.397 1.00 0.00 N ATOM 998 CA THR A 71 1.981 5.229 -5.416 1.00 0.00 C ATOM 999 C THR A 71 0.968 4.313 -6.104 1.00 0.00 C ATOM 1000 O THR A 71 0.993 3.098 -5.910 1.00 0.00 O ATOM 1001 CB THR A 71 1.350 6.163 -4.381 1.00 0.00 C ATOM 1002 OG1 THR A 71 1.244 7.412 -5.059 1.00 0.00 O ATOM 1003 CG2 THR A 71 2.286 6.454 -3.206 1.00 0.00 C ATOM 0 H THR A 71 2.062 6.628 -6.974 1.00 0.00 H new ATOM 0 HA THR A 71 2.673 4.565 -4.898 1.00 0.00 H new ATOM 0 HB THR A 71 0.427 5.720 -4.008 1.00 0.00 H new ATOM 0 HG1 THR A 71 0.483 7.915 -4.701 1.00 0.00 H new ATOM 0 HG21 THR A 71 1.789 7.121 -2.502 1.00 0.00 H new ATOM 0 HG22 THR A 71 2.541 5.521 -2.704 1.00 0.00 H new ATOM 0 HG23 THR A 71 3.196 6.928 -3.574 1.00 0.00 H new ATOM 1011 N ALA A 72 0.101 4.928 -6.895 1.00 0.00 N ATOM 1012 CA ALA A 72 -0.918 4.183 -7.614 1.00 0.00 C ATOM 1013 C ALA A 72 -0.278 2.958 -8.271 1.00 0.00 C ATOM 1014 O ALA A 72 -0.850 1.869 -8.250 1.00 0.00 O ATOM 1015 CB ALA A 72 -1.600 5.101 -8.630 1.00 0.00 C ATOM 0 H ALA A 72 0.084 5.935 -7.054 1.00 0.00 H new ATOM 0 HA ALA A 72 -1.688 3.826 -6.930 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -2.365 4.542 -9.170 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -2.063 5.939 -8.110 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -0.859 5.476 -9.336 1.00 0.00 H new ATOM 1021 N GLU A 73 0.898 3.177 -8.840 1.00 0.00 N ATOM 1022 CA GLU A 73 1.620 2.105 -9.502 1.00 0.00 C ATOM 1023 C GLU A 73 1.898 0.966 -8.519 1.00 0.00 C ATOM 1024 O GLU A 73 2.031 -0.189 -8.922 1.00 0.00 O ATOM 1025 CB GLU A 73 2.919 2.621 -10.123 1.00 0.00 C ATOM 1026 CG GLU A 73 3.364 1.729 -11.285 1.00 0.00 C ATOM 1027 CD GLU A 73 4.888 1.592 -11.318 1.00 0.00 C ATOM 1028 OE1 GLU A 73 5.488 1.654 -10.222 1.00 0.00 O ATOM 1029 OE2 GLU A 73 5.419 1.429 -12.437 1.00 0.00 O ATOM 0 H GLU A 73 1.369 4.082 -8.856 1.00 0.00 H new ATOM 0 HA GLU A 73 0.998 1.719 -10.309 1.00 0.00 H new ATOM 0 HB2 GLU A 73 2.776 3.642 -10.477 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.701 2.653 -9.364 1.00 0.00 H new ATOM 0 HG2 GLU A 73 2.909 0.744 -11.187 1.00 0.00 H new ATOM 0 HG3 GLU A 73 3.013 2.150 -12.227 1.00 0.00 H new ATOM 1034 N LEU A 74 1.979 1.330 -7.248 1.00 0.00 N ATOM 1035 CA LEU A 74 2.238 0.353 -6.204 1.00 0.00 C ATOM 1036 C LEU A 74 0.946 -0.402 -5.886 1.00 0.00 C ATOM 1037 O LEU A 74 0.911 -1.630 -5.946 1.00 0.00 O ATOM 1038 CB LEU A 74 2.872 1.027 -4.985 1.00 0.00 C ATOM 1039 CG LEU A 74 4.313 0.623 -4.670 1.00 0.00 C ATOM 1040 CD1 LEU A 74 4.475 -0.898 -4.695 1.00 0.00 C ATOM 1041 CD2 LEU A 74 5.297 1.321 -5.611 1.00 0.00 C ATOM 0 H LEU A 74 1.870 2.289 -6.917 1.00 0.00 H new ATOM 0 HA LEU A 74 2.964 -0.385 -6.545 1.00 0.00 H new ATOM 0 HB2 LEU A 74 2.843 2.106 -5.135 1.00 0.00 H new ATOM 0 HB3 LEU A 74 2.256 0.810 -4.113 1.00 0.00 H new ATOM 0 HG LEU A 74 4.546 0.954 -3.658 1.00 0.00 H new ATOM 0 HD11 LEU A 74 5.509 -1.158 -4.468 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.816 -1.346 -3.951 1.00 0.00 H new ATOM 0 HD13 LEU A 74 4.215 -1.275 -5.684 1.00 0.00 H new ATOM 0 HD21 LEU A 74 6.314 1.016 -5.365 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.074 1.044 -6.641 1.00 0.00 H new ATOM 0 HD23 LEU A 74 5.205 2.401 -5.498 1.00 0.00 H new ATOM 1052 N MET A 75 -0.084 0.362 -5.556 1.00 0.00 N ATOM 1053 CA MET A 75 -1.374 -0.220 -5.229 1.00 0.00 C ATOM 1054 C MET A 75 -2.045 -0.800 -6.475 1.00 0.00 C ATOM 1055 O MET A 75 -3.001 -1.566 -6.370 1.00 0.00 O ATOM 1056 CB MET A 75 -2.276 0.851 -4.613 1.00 0.00 C ATOM 1057 CG MET A 75 -1.458 1.858 -3.803 1.00 0.00 C ATOM 1058 SD MET A 75 -2.299 2.242 -2.276 1.00 0.00 S ATOM 1059 CE MET A 75 -2.259 4.025 -2.340 1.00 0.00 C ATOM 0 H MET A 75 -0.051 1.380 -5.508 1.00 0.00 H new ATOM 0 HA MET A 75 -1.217 -1.029 -4.515 1.00 0.00 H new ATOM 0 HB2 MET A 75 -2.821 1.370 -5.402 1.00 0.00 H new ATOM 0 HB3 MET A 75 -3.019 0.380 -3.970 1.00 0.00 H new ATOM 0 HG2 MET A 75 -0.470 1.449 -3.591 1.00 0.00 H new ATOM 0 HG3 MET A 75 -1.308 2.768 -4.384 1.00 0.00 H new ATOM 0 HE1 MET A 75 -2.715 4.432 -1.437 1.00 0.00 H new ATOM 0 HE2 MET A 75 -1.225 4.364 -2.409 1.00 0.00 H new ATOM 0 HE3 MET A 75 -2.813 4.370 -3.213 1.00 0.00 H new ATOM 1067 N LYS A 76 -1.519 -0.410 -7.627 1.00 0.00 N ATOM 1068 CA LYS A 76 -2.056 -0.880 -8.893 1.00 0.00 C ATOM 1069 C LYS A 76 -1.452 -2.248 -9.220 1.00 0.00 C ATOM 1070 O LYS A 76 -2.178 -3.200 -9.501 1.00 0.00 O ATOM 1071 CB LYS A 76 -1.841 0.165 -9.988 1.00 0.00 C ATOM 1072 CG LYS A 76 -2.350 -0.343 -11.339 1.00 0.00 C ATOM 1073 CD LYS A 76 -1.536 0.252 -12.490 1.00 0.00 C ATOM 1074 CE LYS A 76 -1.954 -0.359 -13.829 1.00 0.00 C ATOM 1075 NZ LYS A 76 -1.807 0.631 -14.919 1.00 0.00 N ATOM 0 H LYS A 76 -0.726 0.226 -7.710 1.00 0.00 H new ATOM 0 HA LYS A 76 -3.135 -1.015 -8.823 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -2.360 1.086 -9.723 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -0.781 0.406 -10.062 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -2.288 -1.431 -11.369 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -3.401 -0.080 -11.458 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -1.677 1.332 -12.519 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -0.474 0.073 -12.320 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -1.343 -1.236 -14.042 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.989 -0.697 -13.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -2.095 0.200 -15.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -2.409 1.456 -14.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -0.814 0.934 -14.981 1.00 0.00 H new ATOM 1085 N GLN A 77 -0.129 -2.302 -9.174 1.00 0.00 N ATOM 1086 CA GLN A 77 0.580 -3.537 -9.463 1.00 0.00 C ATOM 1087 C GLN A 77 0.140 -4.639 -8.499 1.00 0.00 C ATOM 1088 O GLN A 77 0.046 -5.803 -8.883 1.00 0.00 O ATOM 1089 CB GLN A 77 2.094 -3.326 -9.401 1.00 0.00 C ATOM 1090 CG GLN A 77 2.755 -3.704 -10.728 1.00 0.00 C ATOM 1091 CD GLN A 77 2.866 -5.223 -10.872 1.00 0.00 C ATOM 1092 OE1 GLN A 77 1.895 -5.923 -11.106 1.00 0.00 O ATOM 1093 NE2 GLN A 77 4.101 -5.692 -10.719 1.00 0.00 N ATOM 0 H GLN A 77 0.471 -1.510 -8.941 1.00 0.00 H new ATOM 0 HA GLN A 77 0.331 -3.848 -10.477 1.00 0.00 H new ATOM 0 HB2 GLN A 77 2.310 -2.284 -9.167 1.00 0.00 H new ATOM 0 HB3 GLN A 77 2.516 -3.928 -8.596 1.00 0.00 H new ATOM 0 HG2 GLN A 77 2.174 -3.298 -11.556 1.00 0.00 H new ATOM 0 HG3 GLN A 77 3.747 -3.256 -10.785 1.00 0.00 H new ATOM 0 HE21 GLN A 77 4.870 -5.050 -10.524 1.00 0.00 H new ATOM 0 HE22 GLN A 77 4.279 -6.693 -10.796 1.00 0.00 H new ATOM 1100 N ALA A 78 -0.117 -4.233 -7.264 1.00 0.00 N ATOM 1101 CA ALA A 78 -0.546 -5.173 -6.241 1.00 0.00 C ATOM 1102 C ALA A 78 -2.020 -5.519 -6.458 1.00 0.00 C ATOM 1103 O ALA A 78 -2.381 -6.693 -6.531 1.00 0.00 O ATOM 1104 CB ALA A 78 -0.285 -4.576 -4.857 1.00 0.00 C ATOM 0 H ALA A 78 -0.037 -3.266 -6.948 1.00 0.00 H new ATOM 0 HA ALA A 78 0.024 -6.100 -6.309 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -0.607 -5.281 -4.090 1.00 0.00 H new ATOM 0 HB2 ALA A 78 0.780 -4.376 -4.742 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -0.842 -3.645 -4.751 1.00 0.00 H new ATOM 1110 N ARG A 79 -2.832 -4.476 -6.554 1.00 0.00 N ATOM 1111 CA ARG A 79 -4.259 -4.656 -6.762 1.00 0.00 C ATOM 1112 C ARG A 79 -4.527 -5.208 -8.163 1.00 0.00 C ATOM 1113 O ARG A 79 -5.671 -5.492 -8.514 1.00 0.00 O ATOM 1114 CB ARG A 79 -5.011 -3.335 -6.589 1.00 0.00 C ATOM 1115 CG ARG A 79 -4.902 -2.473 -7.848 1.00 0.00 C ATOM 1116 CD ARG A 79 -6.126 -2.658 -8.746 1.00 0.00 C ATOM 1117 NE ARG A 79 -6.980 -1.450 -8.696 1.00 0.00 N ATOM 1118 CZ ARG A 79 -6.635 -0.265 -9.217 1.00 0.00 C ATOM 1119 NH1 ARG A 79 -5.453 -0.121 -9.832 1.00 0.00 N ATOM 1120 NH2 ARG A 79 -7.472 0.778 -9.123 1.00 0.00 N ATOM 0 H ARG A 79 -2.529 -3.504 -6.492 1.00 0.00 H new ATOM 0 HA ARG A 79 -4.616 -5.365 -6.015 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -6.060 -3.535 -6.371 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -4.606 -2.791 -5.735 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -4.807 -1.424 -7.568 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -3.999 -2.739 -8.398 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -5.809 -2.847 -9.772 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -6.696 -3.529 -8.423 1.00 0.00 H new ATOM 0 HE ARG A 79 -7.887 -1.524 -8.236 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -4.815 -0.914 -9.904 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -5.191 0.782 -10.228 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -8.372 0.669 -8.655 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -7.209 1.680 -9.520 1.00 0.00 H new ATOM 1131 N ASP A 80 -3.452 -5.343 -8.926 1.00 0.00 N ATOM 1132 CA ASP A 80 -3.557 -5.856 -10.282 1.00 0.00 C ATOM 1133 C ASP A 80 -2.849 -7.209 -10.367 1.00 0.00 C ATOM 1134 O ASP A 80 -3.105 -7.991 -11.281 1.00 0.00 O ATOM 1135 CB ASP A 80 -2.888 -4.909 -11.282 1.00 0.00 C ATOM 1136 CG ASP A 80 -2.931 -5.373 -12.739 1.00 0.00 C ATOM 1137 OD1 ASP A 80 -2.083 -6.221 -13.090 1.00 0.00 O ATOM 1138 OD2 ASP A 80 -3.813 -4.871 -13.470 1.00 0.00 O ATOM 0 H ASP A 80 -2.505 -5.106 -8.631 1.00 0.00 H new ATOM 0 HA ASP A 80 -4.615 -5.950 -10.526 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -3.368 -3.933 -11.213 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -1.847 -4.773 -10.990 1.00 0.00 H new ATOM 1142 N MET A 81 -1.975 -7.445 -9.400 1.00 0.00 N ATOM 1143 CA MET A 81 -1.229 -8.692 -9.355 1.00 0.00 C ATOM 1144 C MET A 81 -1.873 -9.680 -8.379 1.00 0.00 C ATOM 1145 O MET A 81 -2.061 -10.850 -8.710 1.00 0.00 O ATOM 1146 CB MET A 81 0.211 -8.409 -8.919 1.00 0.00 C ATOM 1147 CG MET A 81 0.974 -9.712 -8.674 1.00 0.00 C ATOM 1148 SD MET A 81 2.235 -9.925 -9.920 1.00 0.00 S ATOM 1149 CE MET A 81 3.654 -9.298 -9.037 1.00 0.00 C ATOM 0 H MET A 81 -1.766 -6.795 -8.642 1.00 0.00 H new ATOM 0 HA MET A 81 -1.237 -9.136 -10.351 1.00 0.00 H new ATOM 0 HB2 MET A 81 0.719 -7.824 -9.686 1.00 0.00 H new ATOM 0 HB3 MET A 81 0.208 -7.808 -8.010 1.00 0.00 H new ATOM 0 HG2 MET A 81 1.429 -9.696 -7.684 1.00 0.00 H new ATOM 0 HG3 MET A 81 0.285 -10.556 -8.695 1.00 0.00 H new ATOM 0 HE1 MET A 81 4.536 -9.359 -9.675 1.00 0.00 H new ATOM 0 HE2 MET A 81 3.479 -8.259 -8.758 1.00 0.00 H new ATOM 0 HE3 MET A 81 3.815 -9.893 -8.138 1.00 0.00 H new ATOM 1157 N TYR A 82 -2.192 -9.174 -7.198 1.00 0.00 N ATOM 1158 CA TYR A 82 -2.810 -9.997 -6.173 1.00 0.00 C ATOM 1159 C TYR A 82 -4.060 -9.321 -5.606 1.00 0.00 C ATOM 1160 O TYR A 82 -5.099 -9.961 -5.448 1.00 0.00 O ATOM 1161 CB TYR A 82 -1.771 -10.136 -5.059 1.00 0.00 C ATOM 1162 CG TYR A 82 -1.070 -11.495 -5.028 1.00 0.00 C ATOM 1163 CD1 TYR A 82 -1.794 -12.650 -5.236 1.00 0.00 C ATOM 1164 CD2 TYR A 82 0.288 -11.566 -4.791 1.00 0.00 C ATOM 1165 CE1 TYR A 82 -1.135 -13.930 -5.207 1.00 0.00 C ATOM 1166 CE2 TYR A 82 0.949 -12.846 -4.761 1.00 0.00 C ATOM 1167 CZ TYR A 82 0.205 -13.964 -4.971 1.00 0.00 C ATOM 1168 OH TYR A 82 0.827 -15.173 -4.943 1.00 0.00 O ATOM 0 H TYR A 82 -2.034 -8.203 -6.927 1.00 0.00 H new ATOM 0 HA TYR A 82 -3.112 -10.960 -6.586 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -1.021 -9.354 -5.177 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -2.258 -9.968 -4.099 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -2.857 -12.595 -5.421 1.00 0.00 H new ATOM 0 HD2 TYR A 82 0.855 -10.662 -4.628 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -1.691 -14.842 -5.369 1.00 0.00 H new ATOM 0 HE2 TYR A 82 2.011 -12.915 -4.576 1.00 0.00 H new ATOM 0 HH TYR A 82 1.782 -15.045 -4.765 1.00 0.00 H new ATOM 1177 N GLY A 83 -3.919 -8.036 -5.317 1.00 0.00 N ATOM 1178 CA GLY A 83 -5.024 -7.266 -4.771 1.00 0.00 C ATOM 1179 C GLY A 83 -4.515 -6.040 -4.010 1.00 0.00 C ATOM 1180 O GLY A 83 -5.244 -5.065 -3.839 1.00 0.00 O ATOM 0 H GLY A 83 -3.056 -7.508 -5.451 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -5.685 -6.949 -5.578 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -5.614 -7.894 -4.103 1.00 0.00 H new ATOM 1184 N GLN A 84 -3.267 -6.131 -3.572 1.00 0.00 N ATOM 1185 CA GLN A 84 -2.653 -5.042 -2.832 1.00 0.00 C ATOM 1186 C GLN A 84 -1.539 -5.576 -1.930 1.00 0.00 C ATOM 1187 O GLN A 84 -0.562 -4.877 -1.664 1.00 0.00 O ATOM 1188 CB GLN A 84 -3.697 -4.273 -2.021 1.00 0.00 C ATOM 1189 CG GLN A 84 -3.027 -3.366 -0.987 1.00 0.00 C ATOM 1190 CD GLN A 84 -2.225 -2.255 -1.668 1.00 0.00 C ATOM 1191 OE1 GLN A 84 -2.193 -2.133 -2.882 1.00 0.00 O ATOM 1192 NE2 GLN A 84 -1.582 -1.455 -0.823 1.00 0.00 N ATOM 0 H GLN A 84 -2.665 -6.942 -3.716 1.00 0.00 H new ATOM 0 HA GLN A 84 -2.212 -4.346 -3.546 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -4.314 -3.674 -2.691 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -4.362 -4.975 -1.518 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -3.785 -2.927 -0.338 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -2.368 -3.958 -0.352 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -1.652 -1.613 0.182 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -1.019 -0.683 -1.180 1.00 0.00 H new ATOM 1199 N GLU A 85 -1.725 -6.809 -1.482 1.00 0.00 N ATOM 1200 CA GLU A 85 -0.747 -7.445 -0.613 1.00 0.00 C ATOM 1201 C GLU A 85 -1.080 -8.927 -0.437 1.00 0.00 C ATOM 1202 O GLU A 85 -0.672 -9.546 0.545 1.00 0.00 O ATOM 1203 CB GLU A 85 -0.672 -6.734 0.739 1.00 0.00 C ATOM 1204 CG GLU A 85 0.338 -7.419 1.663 1.00 0.00 C ATOM 1205 CD GLU A 85 -0.373 -8.267 2.719 1.00 0.00 C ATOM 1206 OE1 GLU A 85 -1.553 -7.961 2.994 1.00 0.00 O ATOM 1207 OE2 GLU A 85 0.280 -9.203 3.228 1.00 0.00 O ATOM 0 H GLU A 85 -2.537 -7.385 -1.704 1.00 0.00 H new ATOM 0 HA GLU A 85 0.234 -7.367 -1.082 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -0.387 -5.692 0.591 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -1.656 -6.732 1.208 1.00 0.00 H new ATOM 0 HG2 GLU A 85 1.006 -8.049 1.075 1.00 0.00 H new ATOM 0 HG3 GLU A 85 0.957 -6.667 2.152 1.00 0.00 H new ATOM 1212 N LYS A 86 -1.817 -9.455 -1.402 1.00 0.00 N ATOM 1213 CA LYS A 86 -2.210 -10.854 -1.366 1.00 0.00 C ATOM 1214 C LYS A 86 -3.298 -11.047 -0.307 1.00 0.00 C ATOM 1215 O LYS A 86 -3.546 -12.167 0.135 1.00 0.00 O ATOM 1216 CB LYS A 86 -0.985 -11.748 -1.159 1.00 0.00 C ATOM 1217 CG LYS A 86 -1.179 -13.107 -1.835 1.00 0.00 C ATOM 1218 CD LYS A 86 -0.547 -14.227 -1.005 1.00 0.00 C ATOM 1219 CE LYS A 86 -1.622 -15.109 -0.367 1.00 0.00 C ATOM 1220 NZ LYS A 86 -1.236 -16.535 -0.447 1.00 0.00 N ATOM 0 H LYS A 86 -2.153 -8.939 -2.215 1.00 0.00 H new ATOM 0 HA LYS A 86 -2.639 -11.155 -2.322 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -0.100 -11.258 -1.565 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -0.810 -11.890 -0.093 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -2.243 -13.303 -1.967 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -0.733 -13.090 -2.829 1.00 0.00 H new ATOM 0 HD2 LYS A 86 0.098 -14.835 -1.639 1.00 0.00 H new ATOM 0 HD3 LYS A 86 0.084 -13.797 -0.228 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -1.765 -14.823 0.675 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -2.575 -14.955 -0.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -1.976 -17.120 -0.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -1.122 -16.809 -1.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -0.338 -16.680 0.056 1.00 0.00 H new ATOM 1230 N LEU A 87 -3.915 -9.937 0.068 1.00 0.00 N ATOM 1231 CA LEU A 87 -4.970 -9.969 1.067 1.00 0.00 C ATOM 1232 C LEU A 87 -6.229 -9.315 0.494 1.00 0.00 C ATOM 1233 O LEU A 87 -7.184 -9.051 1.224 1.00 0.00 O ATOM 1234 CB LEU A 87 -4.490 -9.338 2.375 1.00 0.00 C ATOM 1235 CG LEU A 87 -5.429 -9.484 3.575 1.00 0.00 C ATOM 1236 CD1 LEU A 87 -5.255 -10.848 4.244 1.00 0.00 C ATOM 1237 CD2 LEU A 87 -5.239 -8.331 4.562 1.00 0.00 C ATOM 0 H LEU A 87 -3.705 -9.010 -0.302 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.229 -10.999 1.314 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.528 -9.779 2.636 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.318 -8.276 2.201 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.456 -9.432 3.214 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.934 -10.926 5.093 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.480 -11.637 3.526 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.227 -10.955 4.590 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.918 -8.458 5.405 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.210 -8.326 4.922 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.454 -7.386 4.063 1.00 0.00 H new ATOM 1248 N ASN A 88 -6.191 -9.073 -0.808 1.00 0.00 N ATOM 1249 CA ASN A 88 -7.317 -8.454 -1.487 1.00 0.00 C ATOM 1250 C ASN A 88 -8.614 -8.846 -0.777 1.00 0.00 C ATOM 1251 O ASN A 88 -9.474 -8.001 -0.536 1.00 0.00 O ATOM 1252 CB ASN A 88 -7.412 -8.928 -2.939 1.00 0.00 C ATOM 1253 CG ASN A 88 -6.320 -9.952 -3.255 1.00 0.00 C ATOM 1254 OD1 ASN A 88 -5.145 -9.744 -3.001 1.00 0.00 O ATOM 1255 ND2 ASN A 88 -6.773 -11.067 -3.820 1.00 0.00 N ATOM 0 H ASN A 88 -5.398 -9.294 -1.411 1.00 0.00 H new ATOM 0 HA ASN A 88 -7.170 -7.374 -1.468 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -8.392 -9.370 -3.117 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -7.320 -8.074 -3.611 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -6.123 -11.813 -4.068 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -7.770 -11.176 -4.005 1.00 0.00 H new ATOM 1261 N GLU A 89 -8.714 -10.129 -0.462 1.00 0.00 N ATOM 1262 CA GLU A 89 -9.892 -10.644 0.215 1.00 0.00 C ATOM 1263 C GLU A 89 -10.374 -9.648 1.272 1.00 0.00 C ATOM 1264 O GLU A 89 -11.566 -9.360 1.360 1.00 0.00 O ATOM 1265 CB GLU A 89 -9.611 -12.012 0.840 1.00 0.00 C ATOM 1266 CG GLU A 89 -10.104 -13.141 -0.068 1.00 0.00 C ATOM 1267 CD GLU A 89 -11.379 -13.776 0.490 1.00 0.00 C ATOM 1268 OE1 GLU A 89 -11.387 -14.058 1.708 1.00 0.00 O ATOM 1269 OE2 GLU A 89 -12.317 -13.966 -0.314 1.00 0.00 O ATOM 0 H GLU A 89 -7.998 -10.827 -0.663 1.00 0.00 H new ATOM 0 HA GLU A 89 -10.684 -10.774 -0.523 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -8.541 -12.123 1.016 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -10.102 -12.080 1.811 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -10.295 -12.751 -1.068 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -9.328 -13.900 -0.165 1.00 0.00 H new ATOM 1274 N LYS A 90 -9.422 -9.148 2.046 1.00 0.00 N ATOM 1275 CA LYS A 90 -9.734 -8.190 3.093 1.00 0.00 C ATOM 1276 C LYS A 90 -9.092 -6.844 2.755 1.00 0.00 C ATOM 1277 O LYS A 90 -9.446 -5.819 3.336 1.00 0.00 O ATOM 1278 CB LYS A 90 -9.327 -8.741 4.462 1.00 0.00 C ATOM 1279 CG LYS A 90 -10.524 -8.785 5.414 1.00 0.00 C ATOM 1280 CD LYS A 90 -11.490 -9.907 5.029 1.00 0.00 C ATOM 1281 CE LYS A 90 -12.850 -9.714 5.702 1.00 0.00 C ATOM 1282 NZ LYS A 90 -13.930 -9.686 4.690 1.00 0.00 N ATOM 0 H LYS A 90 -8.434 -9.388 1.969 1.00 0.00 H new ATOM 0 HA LYS A 90 -10.810 -8.024 3.150 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.913 -9.743 4.346 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -8.541 -8.119 4.889 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -10.175 -8.935 6.436 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -11.045 -7.828 5.393 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -11.616 -9.928 3.946 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -11.070 -10.870 5.320 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -13.029 -10.522 6.411 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -12.852 -8.784 6.271 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -14.846 -9.554 5.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -13.766 -8.900 4.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -13.937 -10.584 4.165 1.00 0.00 H new ATOM 1292 N LEU A 91 -8.157 -6.890 1.816 1.00 0.00 N ATOM 1293 CA LEU A 91 -7.461 -5.686 1.394 1.00 0.00 C ATOM 1294 C LEU A 91 -8.460 -4.729 0.739 1.00 0.00 C ATOM 1295 O LEU A 91 -8.459 -3.532 1.028 1.00 0.00 O ATOM 1296 CB LEU A 91 -6.273 -6.040 0.499 1.00 0.00 C ATOM 1297 CG LEU A 91 -4.886 -5.849 1.118 1.00 0.00 C ATOM 1298 CD1 LEU A 91 -3.802 -6.483 0.245 1.00 0.00 C ATOM 1299 CD2 LEU A 91 -4.608 -4.369 1.392 1.00 0.00 C ATOM 0 H LEU A 91 -7.866 -7.742 1.336 1.00 0.00 H new ATOM 0 HA LEU A 91 -7.039 -5.168 2.255 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.372 -7.081 0.193 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -6.332 -5.435 -0.406 1.00 0.00 H new ATOM 0 HG LEU A 91 -4.867 -6.365 2.078 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -2.827 -6.332 0.709 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -3.995 -7.551 0.144 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -3.811 -6.018 -0.741 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -3.617 -4.260 1.832 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -4.653 -3.811 0.457 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -5.356 -3.980 2.083 1.00 0.00 H new ATOM 1310 N ASN A 92 -9.288 -5.290 -0.129 1.00 0.00 N ATOM 1311 CA ASN A 92 -10.289 -4.502 -0.828 1.00 0.00 C ATOM 1312 C ASN A 92 -10.834 -3.428 0.116 1.00 0.00 C ATOM 1313 O ASN A 92 -11.158 -2.323 -0.316 1.00 0.00 O ATOM 1314 CB ASN A 92 -11.461 -5.375 -1.279 1.00 0.00 C ATOM 1315 CG ASN A 92 -12.007 -4.903 -2.629 1.00 0.00 C ATOM 1316 OD1 ASN A 92 -11.595 -5.352 -3.686 1.00 0.00 O ATOM 1317 ND2 ASN A 92 -12.957 -3.976 -2.533 1.00 0.00 N ATOM 0 H ASN A 92 -9.286 -6.282 -0.365 1.00 0.00 H new ATOM 0 HA ASN A 92 -9.817 -4.054 -1.702 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -11.138 -6.413 -1.356 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -12.253 -5.342 -0.531 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -13.387 -3.597 -3.377 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -13.255 -3.644 -1.616 1.00 0.00 H new ATOM 1323 N THR A 93 -10.921 -3.792 1.387 1.00 0.00 N ATOM 1324 CA THR A 93 -11.423 -2.873 2.396 1.00 0.00 C ATOM 1325 C THR A 93 -10.275 -2.054 2.988 1.00 0.00 C ATOM 1326 O THR A 93 -10.436 -0.868 3.272 1.00 0.00 O ATOM 1327 CB THR A 93 -12.188 -3.690 3.439 1.00 0.00 C ATOM 1328 OG1 THR A 93 -13.356 -4.126 2.749 1.00 0.00 O ATOM 1329 CG2 THR A 93 -12.731 -2.823 4.578 1.00 0.00 C ATOM 0 H THR A 93 -10.653 -4.710 1.742 1.00 0.00 H new ATOM 0 HA THR A 93 -12.110 -2.146 1.964 1.00 0.00 H new ATOM 0 HB THR A 93 -11.534 -4.460 3.848 1.00 0.00 H new ATOM 0 HG1 THR A 93 -13.910 -4.665 3.351 1.00 0.00 H new ATOM 0 HG21 THR A 93 -13.265 -3.451 5.291 1.00 0.00 H new ATOM 0 HG22 THR A 93 -11.903 -2.325 5.083 1.00 0.00 H new ATOM 0 HG23 THR A 93 -13.412 -2.074 4.173 1.00 0.00 H new ATOM 1337 N ILE A 94 -9.142 -2.719 3.160 1.00 0.00 N ATOM 1338 CA ILE A 94 -7.968 -2.067 3.714 1.00 0.00 C ATOM 1339 C ILE A 94 -7.475 -0.998 2.737 1.00 0.00 C ATOM 1340 O ILE A 94 -7.092 0.096 3.150 1.00 0.00 O ATOM 1341 CB ILE A 94 -6.902 -3.102 4.080 1.00 0.00 C ATOM 1342 CG1 ILE A 94 -7.498 -4.223 4.935 1.00 0.00 C ATOM 1343 CG2 ILE A 94 -5.703 -2.439 4.760 1.00 0.00 C ATOM 1344 CD1 ILE A 94 -7.350 -3.914 6.427 1.00 0.00 C ATOM 0 H ILE A 94 -9.012 -3.703 2.925 1.00 0.00 H new ATOM 0 HA ILE A 94 -8.219 -1.559 4.645 1.00 0.00 H new ATOM 0 HB ILE A 94 -6.538 -3.557 3.159 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -8.552 -4.351 4.689 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -7.000 -5.165 4.704 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -4.961 -3.197 5.009 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -5.261 -1.707 4.085 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -6.032 -1.940 5.671 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -7.782 -4.727 7.011 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -6.293 -3.811 6.674 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -7.869 -2.984 6.659 1.00 0.00 H new ATOM 1355 N ILE A 95 -7.500 -1.351 1.460 1.00 0.00 N ATOM 1356 CA ILE A 95 -7.061 -0.435 0.421 1.00 0.00 C ATOM 1357 C ILE A 95 -8.155 0.605 0.169 1.00 0.00 C ATOM 1358 O ILE A 95 -7.864 1.787 -0.009 1.00 0.00 O ATOM 1359 CB ILE A 95 -6.644 -1.206 -0.832 1.00 0.00 C ATOM 1360 CG1 ILE A 95 -6.422 -0.257 -2.012 1.00 0.00 C ATOM 1361 CG2 ILE A 95 -7.656 -2.305 -1.162 1.00 0.00 C ATOM 1362 CD1 ILE A 95 -4.937 0.061 -2.188 1.00 0.00 C ATOM 0 H ILE A 95 -7.818 -2.259 1.121 1.00 0.00 H new ATOM 0 HA ILE A 95 -6.172 0.108 0.742 1.00 0.00 H new ATOM 0 HB ILE A 95 -5.692 -1.696 -0.630 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -6.811 -0.708 -2.924 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -6.979 0.666 -1.850 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -7.336 -2.838 -2.057 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -7.720 -3.003 -0.327 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -8.635 -1.858 -1.337 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -4.807 0.737 -3.033 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -4.557 0.534 -1.283 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -4.387 -0.861 -2.374 1.00 0.00 H new ATOM 1373 N LYS A 96 -9.390 0.126 0.159 1.00 0.00 N ATOM 1374 CA LYS A 96 -10.529 1.000 -0.070 1.00 0.00 C ATOM 1375 C LYS A 96 -10.628 2.011 1.073 1.00 0.00 C ATOM 1376 O LYS A 96 -11.149 3.111 0.890 1.00 0.00 O ATOM 1377 CB LYS A 96 -11.802 0.177 -0.274 1.00 0.00 C ATOM 1378 CG LYS A 96 -13.027 1.085 -0.399 1.00 0.00 C ATOM 1379 CD LYS A 96 -14.300 0.262 -0.617 1.00 0.00 C ATOM 1380 CE LYS A 96 -15.437 1.141 -1.141 1.00 0.00 C ATOM 1381 NZ LYS A 96 -15.977 0.591 -2.405 1.00 0.00 N ATOM 0 H LYS A 96 -9.627 -0.855 0.306 1.00 0.00 H new ATOM 0 HA LYS A 96 -10.394 1.570 -0.989 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.705 -0.434 -1.171 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -11.936 -0.507 0.564 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -13.130 1.689 0.503 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -12.889 1.775 -1.231 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -14.101 -0.542 -1.325 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -14.600 -0.206 0.321 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -16.230 1.202 -0.396 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -15.074 2.156 -1.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -16.748 1.200 -2.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -15.221 0.555 -3.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -16.342 -0.369 -2.238 1.00 0.00 H new ATOM 1391 N GLN A 97 -10.119 1.604 2.227 1.00 0.00 N ATOM 1392 CA GLN A 97 -10.144 2.463 3.400 1.00 0.00 C ATOM 1393 C GLN A 97 -8.952 3.420 3.381 1.00 0.00 C ATOM 1394 O GLN A 97 -9.099 4.607 3.672 1.00 0.00 O ATOM 1395 CB GLN A 97 -10.162 1.632 4.685 1.00 0.00 C ATOM 1396 CG GLN A 97 -11.560 1.076 4.959 1.00 0.00 C ATOM 1397 CD GLN A 97 -12.457 2.137 5.600 1.00 0.00 C ATOM 1398 OE1 GLN A 97 -13.194 2.848 4.937 1.00 0.00 O ATOM 1399 NE2 GLN A 97 -12.353 2.206 6.924 1.00 0.00 N ATOM 0 H GLN A 97 -9.687 0.692 2.375 1.00 0.00 H new ATOM 0 HA GLN A 97 -11.059 3.055 3.376 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -9.450 0.811 4.601 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -9.841 2.248 5.525 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -12.007 0.732 4.027 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -11.488 0.210 5.617 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -11.716 1.581 7.419 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -12.910 2.884 7.445 1.00 0.00 H new ATOM 1406 N ILE A 98 -7.796 2.870 3.038 1.00 0.00 N ATOM 1407 CA ILE A 98 -6.578 3.660 2.979 1.00 0.00 C ATOM 1408 C ILE A 98 -6.523 4.404 1.642 1.00 0.00 C ATOM 1409 O ILE A 98 -5.566 5.127 1.369 1.00 0.00 O ATOM 1410 CB ILE A 98 -5.355 2.782 3.243 1.00 0.00 C ATOM 1411 CG1 ILE A 98 -4.920 2.876 4.708 1.00 0.00 C ATOM 1412 CG2 ILE A 98 -4.214 3.124 2.283 1.00 0.00 C ATOM 1413 CD1 ILE A 98 -6.014 2.356 5.641 1.00 0.00 C ATOM 0 H ILE A 98 -7.677 1.886 2.798 1.00 0.00 H new ATOM 0 HA ILE A 98 -6.575 4.414 3.766 1.00 0.00 H new ATOM 0 HB ILE A 98 -5.632 1.745 3.054 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -4.007 2.300 4.857 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -4.688 3.912 4.956 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -3.357 2.484 2.494 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -4.542 2.964 1.256 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -3.928 4.168 2.414 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -5.678 2.435 6.675 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -6.919 2.949 5.507 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -6.226 1.313 5.407 1.00 0.00 H new ATOM 1424 N LEU A 99 -7.563 4.202 0.846 1.00 0.00 N ATOM 1425 CA LEU A 99 -7.645 4.845 -0.455 1.00 0.00 C ATOM 1426 C LEU A 99 -8.879 5.747 -0.496 1.00 0.00 C ATOM 1427 O LEU A 99 -8.937 6.690 -1.284 1.00 0.00 O ATOM 1428 CB LEU A 99 -7.609 3.799 -1.572 1.00 0.00 C ATOM 1429 CG LEU A 99 -7.439 4.341 -2.992 1.00 0.00 C ATOM 1430 CD1 LEU A 99 -5.985 4.226 -3.454 1.00 0.00 C ATOM 1431 CD2 LEU A 99 -8.404 3.653 -3.961 1.00 0.00 C ATOM 0 H LEU A 99 -8.355 3.603 1.077 1.00 0.00 H new ATOM 0 HA LEU A 99 -6.778 5.484 -0.620 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -6.792 3.107 -1.368 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -8.533 3.222 -1.533 1.00 0.00 H new ATOM 0 HG LEU A 99 -7.691 5.401 -2.984 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -5.893 4.619 -4.467 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -5.344 4.798 -2.783 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.681 3.179 -3.442 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -8.262 4.057 -4.964 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -8.207 2.581 -3.970 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -9.430 3.831 -3.640 1.00 0.00 H new ATOM 1442 N SER A 100 -9.837 5.425 0.361 1.00 0.00 N ATOM 1443 CA SER A 100 -11.068 6.195 0.432 1.00 0.00 C ATOM 1444 C SER A 100 -10.999 7.185 1.596 1.00 0.00 C ATOM 1445 O SER A 100 -11.829 8.086 1.700 1.00 0.00 O ATOM 1446 CB SER A 100 -12.283 5.279 0.585 1.00 0.00 C ATOM 1447 OG SER A 100 -13.509 5.997 0.487 1.00 0.00 O ATOM 0 H SER A 100 -9.786 4.642 1.012 1.00 0.00 H new ATOM 0 HA SER A 100 -11.180 6.748 -0.501 1.00 0.00 H new ATOM 0 HB2 SER A 100 -12.253 4.506 -0.183 1.00 0.00 H new ATOM 0 HB3 SER A 100 -12.236 4.772 1.549 1.00 0.00 H new ATOM 0 HG SER A 100 -13.371 6.921 0.782 1.00 0.00 H new ATOM 1452 N ILE A 101 -10.001 6.983 2.444 1.00 0.00 N ATOM 1453 CA ILE A 101 -9.813 7.847 3.599 1.00 0.00 C ATOM 1454 C ILE A 101 -9.452 9.255 3.123 1.00 0.00 C ATOM 1455 O ILE A 101 -9.368 10.183 3.925 1.00 0.00 O ATOM 1456 CB ILE A 101 -8.788 7.241 4.560 1.00 0.00 C ATOM 1457 CG1 ILE A 101 -9.482 6.518 5.716 1.00 0.00 C ATOM 1458 CG2 ILE A 101 -7.807 8.304 5.056 1.00 0.00 C ATOM 1459 CD1 ILE A 101 -10.779 5.854 5.247 1.00 0.00 C ATOM 0 H ILE A 101 -9.314 6.234 2.355 1.00 0.00 H new ATOM 0 HA ILE A 101 -10.739 7.930 4.168 1.00 0.00 H new ATOM 0 HB ILE A 101 -8.208 6.496 4.016 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -8.813 5.765 6.132 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -9.700 7.227 6.515 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -7.089 7.847 5.737 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -7.277 8.735 4.206 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -8.354 9.089 5.578 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -11.253 5.347 6.088 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -11.455 6.613 4.854 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -10.554 5.128 4.465 1.00 0.00 H new ATOM 1470 N SER A 102 -9.246 9.370 1.818 1.00 0.00 N ATOM 1471 CA SER A 102 -8.896 10.650 1.225 1.00 0.00 C ATOM 1472 C SER A 102 -7.377 10.764 1.089 1.00 0.00 C ATOM 1473 O SER A 102 -6.809 11.833 1.308 1.00 0.00 O ATOM 1474 CB SER A 102 -9.442 11.810 2.059 1.00 0.00 C ATOM 1475 OG SER A 102 -10.776 11.570 2.501 1.00 0.00 O ATOM 0 H SER A 102 -9.315 8.598 1.155 1.00 0.00 H new ATOM 0 HA SER A 102 -9.349 10.705 0.235 1.00 0.00 H new ATOM 0 HB2 SER A 102 -8.797 11.970 2.923 1.00 0.00 H new ATOM 0 HB3 SER A 102 -9.415 12.725 1.468 1.00 0.00 H new ATOM 0 HG SER A 102 -10.767 11.321 3.449 1.00 0.00 H new ATOM 1480 N VAL A 103 -6.762 9.648 0.725 1.00 0.00 N ATOM 1481 CA VAL A 103 -5.319 9.610 0.554 1.00 0.00 C ATOM 1482 C VAL A 103 -4.989 9.418 -0.927 1.00 0.00 C ATOM 1483 O VAL A 103 -3.971 9.911 -1.408 1.00 0.00 O ATOM 1484 CB VAL A 103 -4.716 8.524 1.447 1.00 0.00 C ATOM 1485 CG1 VAL A 103 -5.805 7.604 2.003 1.00 0.00 C ATOM 1486 CG2 VAL A 103 -3.654 7.721 0.693 1.00 0.00 C ATOM 0 H VAL A 103 -7.236 8.763 0.544 1.00 0.00 H new ATOM 0 HA VAL A 103 -4.872 10.554 0.866 1.00 0.00 H new ATOM 0 HB VAL A 103 -4.230 9.016 2.289 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -5.349 6.841 2.634 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -6.510 8.190 2.593 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -6.333 7.125 1.178 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -3.241 6.956 1.351 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -4.107 7.246 -0.177 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -2.856 8.388 0.368 1.00 0.00 H new ATOM 1496 N SER A 104 -5.870 8.701 -1.609 1.00 0.00 N ATOM 1497 CA SER A 104 -5.686 8.437 -3.025 1.00 0.00 C ATOM 1498 C SER A 104 -5.274 9.722 -3.747 1.00 0.00 C ATOM 1499 O SER A 104 -4.272 9.745 -4.460 1.00 0.00 O ATOM 1500 CB SER A 104 -6.958 7.862 -3.650 1.00 0.00 C ATOM 1501 OG SER A 104 -6.669 6.921 -4.680 1.00 0.00 O ATOM 0 H SER A 104 -6.714 8.294 -1.206 1.00 0.00 H new ATOM 0 HA SER A 104 -4.894 7.696 -3.134 1.00 0.00 H new ATOM 0 HB2 SER A 104 -7.556 7.380 -2.876 1.00 0.00 H new ATOM 0 HB3 SER A 104 -7.560 8.674 -4.059 1.00 0.00 H new ATOM 0 HG SER A 104 -7.507 6.576 -5.052 1.00 0.00 H new ATOM 1506 N GLU A 105 -6.069 10.761 -3.537 1.00 0.00 N ATOM 1507 CA GLU A 105 -5.800 12.047 -4.158 1.00 0.00 C ATOM 1508 C GLU A 105 -6.974 13.003 -3.931 1.00 0.00 C ATOM 1509 O GLU A 105 -7.257 13.855 -4.772 1.00 0.00 O ATOM 1510 CB GLU A 105 -5.507 11.884 -5.652 1.00 0.00 C ATOM 1511 CG GLU A 105 -4.148 12.488 -6.012 1.00 0.00 C ATOM 1512 CD GLU A 105 -3.788 12.194 -7.470 1.00 0.00 C ATOM 1513 OE1 GLU A 105 -3.281 11.079 -7.716 1.00 0.00 O ATOM 1514 OE2 GLU A 105 -4.028 13.093 -8.305 1.00 0.00 O ATOM 0 H GLU A 105 -6.900 10.738 -2.945 1.00 0.00 H new ATOM 0 HA GLU A 105 -4.913 12.475 -3.691 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.521 10.827 -5.916 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -6.290 12.368 -6.235 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -4.170 13.566 -5.849 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -3.379 12.082 -5.355 1.00 0.00 H new ATOM 1519 N GLU A 106 -7.625 12.827 -2.790 1.00 0.00 N ATOM 1520 CA GLU A 106 -8.762 13.663 -2.442 1.00 0.00 C ATOM 1521 C GLU A 106 -9.478 14.139 -3.708 1.00 0.00 C ATOM 1522 O GLU A 106 -9.898 15.292 -3.791 1.00 0.00 O ATOM 1523 CB GLU A 106 -8.326 14.850 -1.581 1.00 0.00 C ATOM 1524 CG GLU A 106 -9.538 15.563 -0.977 1.00 0.00 C ATOM 1525 CD GLU A 106 -9.932 14.939 0.362 1.00 0.00 C ATOM 1526 OE1 GLU A 106 -9.372 15.388 1.384 1.00 0.00 O ATOM 1527 OE2 GLU A 106 -10.785 14.025 0.333 1.00 0.00 O ATOM 0 H GLU A 106 -7.387 12.119 -2.096 1.00 0.00 H new ATOM 0 HA GLU A 106 -9.460 13.067 -1.855 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -7.669 14.504 -0.784 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -7.751 15.551 -2.186 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -9.310 16.619 -0.836 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -10.378 15.508 -1.669 1.00 0.00 H new ATOM 1532 N GLY A 107 -9.595 13.226 -4.662 1.00 0.00 N ATOM 1533 CA GLY A 107 -10.254 13.538 -5.919 1.00 0.00 C ATOM 1534 C GLY A 107 -11.671 12.962 -5.953 1.00 0.00 C ATOM 1535 O GLY A 107 -12.031 12.242 -6.882 1.00 0.00 O ATOM 0 H GLY A 107 -9.245 12.271 -4.589 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -10.294 14.619 -6.054 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -9.673 13.134 -6.748 1.00 0.00 H new ATOM 1539 N GLU A 108 -12.439 13.302 -4.927 1.00 0.00 N ATOM 1540 CA GLU A 108 -13.809 12.829 -4.829 1.00 0.00 C ATOM 1541 C GLU A 108 -13.835 11.306 -4.692 1.00 0.00 C ATOM 1542 O GLU A 108 -14.735 10.647 -5.211 1.00 0.00 O ATOM 1543 CB GLU A 108 -14.636 13.286 -6.032 1.00 0.00 C ATOM 1544 CG GLU A 108 -15.801 14.175 -5.592 1.00 0.00 C ATOM 1545 CD GLU A 108 -17.005 14.001 -6.519 1.00 0.00 C ATOM 1546 OE1 GLU A 108 -16.980 14.622 -7.603 1.00 0.00 O ATOM 1547 OE2 GLU A 108 -17.922 13.251 -6.123 1.00 0.00 O ATOM 0 H GLU A 108 -12.138 13.899 -4.157 1.00 0.00 H new ATOM 0 HA GLU A 108 -14.259 13.263 -3.936 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -14.000 13.833 -6.728 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -15.019 12.416 -6.566 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -16.086 13.927 -4.570 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -15.486 15.219 -5.591 1.00 0.00 H new ATOM 1552 N LYS A 109 -12.836 10.788 -3.992 1.00 0.00 N ATOM 1553 CA LYS A 109 -12.734 9.355 -3.781 1.00 0.00 C ATOM 1554 C LYS A 109 -11.904 8.736 -4.907 1.00 0.00 C ATOM 1555 O LYS A 109 -11.096 7.839 -4.668 1.00 0.00 O ATOM 1556 CB LYS A 109 -14.124 8.735 -3.629 1.00 0.00 C ATOM 1557 CG LYS A 109 -14.073 7.482 -2.753 1.00 0.00 C ATOM 1558 CD LYS A 109 -15.404 7.262 -2.032 1.00 0.00 C ATOM 1559 CE LYS A 109 -16.308 6.317 -2.826 1.00 0.00 C ATOM 1560 NZ LYS A 109 -16.647 5.123 -2.019 1.00 0.00 N ATOM 0 H LYS A 109 -12.090 11.336 -3.564 1.00 0.00 H new ATOM 0 HA LYS A 109 -12.213 9.144 -2.847 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -14.805 9.463 -3.189 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -14.522 8.480 -4.611 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -13.841 6.613 -3.369 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -13.271 7.578 -2.021 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -15.220 6.848 -1.041 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -15.907 8.218 -1.890 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -17.220 6.837 -3.118 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -15.807 6.012 -3.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -17.261 4.492 -2.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -15.775 4.619 -1.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -17.144 5.418 -1.154 1.00 0.00 H new