USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 693 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 141 CYS SG : rot 154:sc= 1.26 USER MOD Set 1.2: A 145 GLN : amide:sc= -0.0386 X(o=1.2,f=1.2) USER MOD Set 2.1: A 114 TYR OH : rot 133:sc= 0.838 USER MOD Set 2.2: A 118 GLN : amide:sc= 0.601 K(o=1.4,f=0.49) USER MOD Set 3.1: A 89 LYS NZ :NH3+ -145:sc= 0.799 (180deg=-0.0447) USER MOD Set 3.2: A 130 HIS : no HD1:sc= -1.83! K(o=-1!,f=-3.5) USER MOD Set 4.1: A 80 LYS NZ :NH3+ -156:sc= 1.22 (180deg=0) USER MOD Set 4.2: A 83 GLN : amide:sc= 1.03 K(o=2.2,f=-9.3!) USER MOD Set 4.3: A 102 GLN : amide:sc= 0 X(o=2.2,f=2.1) USER MOD Single : A 59 MET CE :methyl -178:sc= -0.52 (180deg=-0.555) USER MOD Single : A 69 CYS SG : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 148:sc= 0.848 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -0.426 K(o=-0.43,f=-2.6!) USER MOD Single : A 91 HIS : no HD1:sc= -0.0505 X(o=-0.051,f=0) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 51:sc= 0.136 USER MOD Single : A 96 SER OG : rot 109:sc= 1.37 USER MOD Single : A 99 THR OG1 : rot 180:sc= -0.205 USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 109 MET CE :methyl 165:sc= -0.0147 (180deg=-0.269) USER MOD Single : A 113 SER OG : rot 103:sc= 0.476 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 THR OG1 : rot -90:sc= 0 USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 MET CE :methyl -146:sc= -0.114 (180deg=-3!) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.0161 K(o=-0.016,f=-0.9) USER MOD Single : A 150 HIS : no HD1:sc= -0.951 K(o=-0.95,f=-0.2) USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 59 -1.797 11.795 2.419 1.00 0.00 N ATOM 2 CA MET A 59 -2.636 11.067 1.464 1.00 0.00 C ATOM 3 C MET A 59 -3.408 9.966 2.199 1.00 0.00 C ATOM 4 O MET A 59 -3.570 10.063 3.418 1.00 0.00 O ATOM 5 CB MET A 59 -1.822 10.618 0.243 1.00 0.00 C ATOM 6 CG MET A 59 -0.737 9.578 0.514 1.00 0.00 C ATOM 7 SD MET A 59 -1.221 7.830 0.596 1.00 0.00 S ATOM 8 CE MET A 59 -1.742 7.562 -1.118 1.00 0.00 C ATOM 0 HA MET A 59 -3.397 11.720 1.037 1.00 0.00 H new ATOM 0 HB2 MET A 59 -2.510 10.213 -0.500 1.00 0.00 H new ATOM 0 HB3 MET A 59 -1.354 11.497 -0.201 1.00 0.00 H new ATOM 0 HG2 MET A 59 0.020 9.677 -0.264 1.00 0.00 H new ATOM 0 HG3 MET A 59 -0.259 9.835 1.459 1.00 0.00 H new ATOM 0 HE1 MET A 59 -2.105 6.541 -1.232 1.00 0.00 H new ATOM 0 HE2 MET A 59 -2.539 8.261 -1.369 1.00 0.00 H new ATOM 0 HE3 MET A 59 -0.895 7.723 -1.785 1.00 0.00 H new ATOM 18 N ALA A 60 -3.975 8.995 1.482 1.00 0.00 N ATOM 19 CA ALA A 60 -4.772 7.911 2.033 1.00 0.00 C ATOM 20 C ALA A 60 -4.321 6.583 1.432 1.00 0.00 C ATOM 21 O ALA A 60 -4.339 6.410 0.213 1.00 0.00 O ATOM 22 CB ALA A 60 -6.242 8.171 1.708 1.00 0.00 C ATOM 0 H ALA A 60 -3.886 8.945 0.467 1.00 0.00 H new ATOM 0 HA ALA A 60 -4.642 7.861 3.114 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -6.853 7.365 2.115 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -6.550 9.119 2.150 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -6.373 8.215 0.627 1.00 0.00 H new ATOM 28 N GLY A 61 -3.930 5.642 2.283 1.00 0.00 N ATOM 29 CA GLY A 61 -3.582 4.272 1.951 1.00 0.00 C ATOM 30 C GLY A 61 -3.289 3.533 3.251 1.00 0.00 C ATOM 31 O GLY A 61 -3.727 2.401 3.448 1.00 0.00 O ATOM 0 H GLY A 61 -3.843 5.829 3.282 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -4.400 3.790 1.415 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.712 4.248 1.295 1.00 0.00 H new ATOM 35 N GLY A 62 -2.619 4.234 4.163 1.00 0.00 N ATOM 36 CA GLY A 62 -2.564 3.941 5.577 1.00 0.00 C ATOM 37 C GLY A 62 -1.521 4.852 6.192 1.00 0.00 C ATOM 38 O GLY A 62 -1.836 5.729 6.994 1.00 0.00 O ATOM 0 H GLY A 62 -2.076 5.061 3.914 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -3.537 4.105 6.040 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -2.304 2.895 5.742 1.00 0.00 H new ATOM 42 N ALA A 63 -0.278 4.672 5.754 1.00 0.00 N ATOM 43 CA ALA A 63 0.900 5.316 6.329 1.00 0.00 C ATOM 44 C ALA A 63 2.029 5.467 5.307 1.00 0.00 C ATOM 45 O ALA A 63 3.206 5.409 5.675 1.00 0.00 O ATOM 46 CB ALA A 63 1.360 4.499 7.543 1.00 0.00 C ATOM 0 H ALA A 63 -0.056 4.059 4.970 1.00 0.00 H new ATOM 0 HA ALA A 63 0.633 6.326 6.641 1.00 0.00 H new ATOM 0 HB1 ALA A 63 2.240 4.967 7.984 1.00 0.00 H new ATOM 0 HB2 ALA A 63 0.559 4.463 8.282 1.00 0.00 H new ATOM 0 HB3 ALA A 63 1.608 3.486 7.227 1.00 0.00 H new ATOM 52 N TRP A 64 1.683 5.643 4.035 1.00 0.00 N ATOM 53 CA TRP A 64 2.614 5.830 2.940 1.00 0.00 C ATOM 54 C TRP A 64 2.153 7.040 2.129 1.00 0.00 C ATOM 55 O TRP A 64 1.343 7.828 2.615 1.00 0.00 O ATOM 56 CB TRP A 64 2.732 4.524 2.137 1.00 0.00 C ATOM 57 CG TRP A 64 1.457 3.886 1.656 1.00 0.00 C ATOM 58 CD1 TRP A 64 0.819 2.905 2.328 1.00 0.00 C ATOM 59 CD2 TRP A 64 0.704 4.056 0.406 1.00 0.00 C ATOM 60 NE1 TRP A 64 -0.253 2.454 1.593 1.00 0.00 N ATOM 61 CE2 TRP A 64 -0.358 3.105 0.388 1.00 0.00 C ATOM 62 CE3 TRP A 64 0.814 4.874 -0.740 1.00 0.00 C ATOM 63 CZ2 TRP A 64 -1.222 2.940 -0.707 1.00 0.00 C ATOM 64 CZ3 TRP A 64 -0.048 4.730 -1.843 1.00 0.00 C ATOM 65 CH2 TRP A 64 -1.059 3.757 -1.836 1.00 0.00 C ATOM 0 H TRP A 64 0.709 5.659 3.733 1.00 0.00 H new ATOM 0 HA TRP A 64 3.624 6.047 3.287 1.00 0.00 H new ATOM 0 HB2 TRP A 64 3.359 4.720 1.267 1.00 0.00 H new ATOM 0 HB3 TRP A 64 3.260 3.797 2.754 1.00 0.00 H new ATOM 0 HD1 TRP A 64 1.107 2.530 3.299 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -0.893 1.724 1.905 1.00 0.00 H new ATOM 0 HE3 TRP A 64 1.582 5.632 -0.771 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -2.002 2.194 -0.680 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 0.070 5.374 -2.702 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -1.706 3.638 -2.692 1.00 0.00 H new ATOM 76 N GLY A 65 2.685 7.212 0.920 1.00 0.00 N ATOM 77 CA GLY A 65 2.246 8.242 0.000 1.00 0.00 C ATOM 78 C GLY A 65 3.432 8.710 -0.809 1.00 0.00 C ATOM 79 O GLY A 65 3.852 8.046 -1.757 1.00 0.00 O ATOM 0 H GLY A 65 3.440 6.631 0.555 1.00 0.00 H new ATOM 0 HA2 GLY A 65 1.469 7.853 -0.659 1.00 0.00 H new ATOM 0 HA3 GLY A 65 1.810 9.077 0.548 1.00 0.00 H new ATOM 83 N ARG A 66 4.058 9.778 -0.328 1.00 0.00 N ATOM 84 CA ARG A 66 5.274 10.396 -0.850 1.00 0.00 C ATOM 85 C ARG A 66 6.406 9.416 -1.152 1.00 0.00 C ATOM 86 O ARG A 66 7.166 9.647 -2.092 1.00 0.00 O ATOM 87 CB ARG A 66 5.707 11.497 0.135 1.00 0.00 C ATOM 88 CG ARG A 66 6.106 10.965 1.523 1.00 0.00 C ATOM 89 CD ARG A 66 6.148 12.082 2.577 1.00 0.00 C ATOM 90 NE ARG A 66 6.860 11.699 3.811 1.00 0.00 N ATOM 91 CZ ARG A 66 6.696 10.593 4.541 1.00 0.00 C ATOM 92 NH1 ARG A 66 5.659 9.787 4.354 1.00 0.00 N ATOM 93 NH2 ARG A 66 7.607 10.284 5.448 1.00 0.00 N ATOM 0 H ARG A 66 3.706 10.270 0.493 1.00 0.00 H new ATOM 0 HA ARG A 66 5.042 10.823 -1.826 1.00 0.00 H new ATOM 0 HB2 ARG A 66 6.549 12.042 -0.291 1.00 0.00 H new ATOM 0 HB3 ARG A 66 4.891 12.210 0.250 1.00 0.00 H new ATOM 0 HG2 ARG A 66 5.397 10.198 1.835 1.00 0.00 H new ATOM 0 HG3 ARG A 66 7.084 10.488 1.461 1.00 0.00 H new ATOM 0 HD2 ARG A 66 6.630 12.960 2.146 1.00 0.00 H new ATOM 0 HD3 ARG A 66 5.128 12.371 2.830 1.00 0.00 H new ATOM 0 HE ARG A 66 7.562 12.358 4.147 1.00 0.00 H new ATOM 0 HH11 ARG A 66 4.965 10.006 3.640 1.00 0.00 H new ATOM 0 HH12 ARG A 66 5.556 8.948 4.925 1.00 0.00 H new ATOM 0 HH21 ARG A 66 8.419 10.887 5.581 1.00 0.00 H new ATOM 0 HH22 ARG A 66 7.498 9.443 6.015 1.00 0.00 H new ATOM 107 N LEU A 67 6.496 8.300 -0.418 1.00 0.00 N ATOM 108 CA LEU A 67 7.489 7.251 -0.649 1.00 0.00 C ATOM 109 C LEU A 67 7.427 6.723 -2.087 1.00 0.00 C ATOM 110 O LEU A 67 8.447 6.288 -2.626 1.00 0.00 O ATOM 111 CB LEU A 67 7.309 6.069 0.323 1.00 0.00 C ATOM 112 CG LEU A 67 7.205 6.390 1.829 1.00 0.00 C ATOM 113 CD1 LEU A 67 7.235 5.078 2.627 1.00 0.00 C ATOM 114 CD2 LEU A 67 8.318 7.324 2.314 1.00 0.00 C ATOM 0 H LEU A 67 5.871 8.100 0.363 1.00 0.00 H new ATOM 0 HA LEU A 67 8.462 7.710 -0.475 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.408 5.529 0.032 1.00 0.00 H new ATOM 0 HB3 LEU A 67 8.148 5.388 0.182 1.00 0.00 H new ATOM 0 HG LEU A 67 6.263 6.914 1.991 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.162 5.298 3.692 1.00 0.00 H new ATOM 0 HD12 LEU A 67 6.395 4.451 2.328 1.00 0.00 H new ATOM 0 HD13 LEU A 67 8.169 4.553 2.428 1.00 0.00 H new ATOM 0 HD21 LEU A 67 8.194 7.515 3.380 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.287 6.857 2.139 1.00 0.00 H new ATOM 0 HD23 LEU A 67 8.266 8.266 1.768 1.00 0.00 H new ATOM 126 N ALA A 68 6.256 6.774 -2.730 1.00 0.00 N ATOM 127 CA ALA A 68 6.073 6.259 -4.074 1.00 0.00 C ATOM 128 C ALA A 68 6.919 7.040 -5.080 1.00 0.00 C ATOM 129 O ALA A 68 7.447 6.429 -6.000 1.00 0.00 O ATOM 130 CB ALA A 68 4.604 6.325 -4.495 1.00 0.00 C ATOM 0 H ALA A 68 5.411 7.177 -2.324 1.00 0.00 H new ATOM 0 HA ALA A 68 6.395 5.218 -4.066 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.497 5.933 -5.506 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.002 5.729 -3.809 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.265 7.360 -4.470 1.00 0.00 H new ATOM 136 N CYS A 69 7.083 8.358 -4.897 1.00 0.00 N ATOM 137 CA CYS A 69 7.878 9.190 -5.797 1.00 0.00 C ATOM 138 C CYS A 69 9.335 8.708 -5.831 1.00 0.00 C ATOM 139 O CYS A 69 9.970 8.701 -6.888 1.00 0.00 O ATOM 140 CB CYS A 69 7.807 10.661 -5.358 1.00 0.00 C ATOM 141 SG CYS A 69 6.142 11.347 -5.613 1.00 0.00 S ATOM 0 H CYS A 69 6.667 8.872 -4.120 1.00 0.00 H new ATOM 0 HA CYS A 69 7.468 9.106 -6.803 1.00 0.00 H new ATOM 0 HB2 CYS A 69 8.079 10.742 -4.306 1.00 0.00 H new ATOM 0 HB3 CYS A 69 8.534 11.246 -5.921 1.00 0.00 H new ATOM 0 HG CYS A 69 6.121 12.589 -5.229 1.00 0.00 H new ATOM 147 N TYR A 70 9.873 8.283 -4.684 1.00 0.00 N ATOM 148 CA TYR A 70 11.224 7.744 -4.590 1.00 0.00 C ATOM 149 C TYR A 70 11.278 6.456 -5.409 1.00 0.00 C ATOM 150 O TYR A 70 12.158 6.278 -6.252 1.00 0.00 O ATOM 151 CB TYR A 70 11.594 7.514 -3.111 1.00 0.00 C ATOM 152 CG TYR A 70 11.759 8.783 -2.286 1.00 0.00 C ATOM 153 CD1 TYR A 70 10.648 9.587 -1.964 1.00 0.00 C ATOM 154 CD2 TYR A 70 13.035 9.174 -1.842 1.00 0.00 C ATOM 155 CE1 TYR A 70 10.817 10.799 -1.275 1.00 0.00 C ATOM 156 CE2 TYR A 70 13.212 10.371 -1.131 1.00 0.00 C ATOM 157 CZ TYR A 70 12.103 11.207 -0.862 1.00 0.00 C ATOM 158 OH TYR A 70 12.254 12.407 -0.232 1.00 0.00 O ATOM 0 H TYR A 70 9.377 8.305 -3.793 1.00 0.00 H new ATOM 0 HA TYR A 70 11.956 8.444 -4.993 1.00 0.00 H new ATOM 0 HB2 TYR A 70 10.823 6.897 -2.651 1.00 0.00 H new ATOM 0 HB3 TYR A 70 12.524 6.947 -3.068 1.00 0.00 H new ATOM 0 HD1 TYR A 70 9.657 9.268 -2.250 1.00 0.00 H new ATOM 0 HD2 TYR A 70 13.888 8.546 -2.051 1.00 0.00 H new ATOM 0 HE1 TYR A 70 9.960 11.421 -1.061 1.00 0.00 H new ATOM 0 HE2 TYR A 70 14.196 10.654 -0.789 1.00 0.00 H new ATOM 0 HH TYR A 70 12.991 12.348 0.411 1.00 0.00 H new ATOM 168 N LEU A 71 10.294 5.581 -5.202 1.00 0.00 N ATOM 169 CA LEU A 71 10.164 4.297 -5.876 1.00 0.00 C ATOM 170 C LEU A 71 9.595 4.410 -7.303 1.00 0.00 C ATOM 171 O LEU A 71 9.170 3.396 -7.857 1.00 0.00 O ATOM 172 CB LEU A 71 9.329 3.350 -4.996 1.00 0.00 C ATOM 173 CG LEU A 71 9.914 3.049 -3.602 1.00 0.00 C ATOM 174 CD1 LEU A 71 9.086 1.936 -2.951 1.00 0.00 C ATOM 175 CD2 LEU A 71 11.389 2.623 -3.619 1.00 0.00 C ATOM 0 H LEU A 71 9.541 5.756 -4.536 1.00 0.00 H new ATOM 0 HA LEU A 71 11.164 3.884 -6.008 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.336 3.782 -4.868 1.00 0.00 H new ATOM 0 HB3 LEU A 71 9.200 2.407 -5.528 1.00 0.00 H new ATOM 0 HG LEU A 71 9.867 3.980 -3.037 1.00 0.00 H new ATOM 0 HD11 LEU A 71 9.489 1.713 -1.963 1.00 0.00 H new ATOM 0 HD12 LEU A 71 8.050 2.262 -2.855 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.129 1.041 -3.571 1.00 0.00 H new ATOM 0 HD21 LEU A 71 11.724 2.430 -2.600 1.00 0.00 H new ATOM 0 HD22 LEU A 71 11.499 1.717 -4.215 1.00 0.00 H new ATOM 0 HD23 LEU A 71 11.993 3.419 -4.054 1.00 0.00 H new ATOM 187 N GLU A 72 9.572 5.603 -7.905 1.00 0.00 N ATOM 188 CA GLU A 72 9.119 5.839 -9.269 1.00 0.00 C ATOM 189 C GLU A 72 10.259 6.402 -10.137 1.00 0.00 C ATOM 190 O GLU A 72 10.164 6.359 -11.366 1.00 0.00 O ATOM 191 CB GLU A 72 7.879 6.756 -9.215 1.00 0.00 C ATOM 192 CG GLU A 72 7.452 7.244 -10.602 1.00 0.00 C ATOM 193 CD GLU A 72 6.168 8.068 -10.619 1.00 0.00 C ATOM 194 OE1 GLU A 72 6.175 9.202 -10.097 1.00 0.00 O ATOM 195 OE2 GLU A 72 5.220 7.665 -11.340 1.00 0.00 O ATOM 0 H GLU A 72 9.879 6.455 -7.437 1.00 0.00 H new ATOM 0 HA GLU A 72 8.828 4.904 -9.747 1.00 0.00 H new ATOM 0 HB2 GLU A 72 7.052 6.217 -8.752 1.00 0.00 H new ATOM 0 HB3 GLU A 72 8.094 7.616 -8.581 1.00 0.00 H new ATOM 0 HG2 GLU A 72 8.258 7.843 -11.026 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.322 6.379 -11.253 1.00 0.00 H new ATOM 202 N PHE A 73 11.357 6.902 -9.545 1.00 0.00 N ATOM 203 CA PHE A 73 12.515 7.338 -10.329 1.00 0.00 C ATOM 204 C PHE A 73 13.056 6.136 -11.126 1.00 0.00 C ATOM 205 O PHE A 73 13.228 6.219 -12.349 1.00 0.00 O ATOM 206 CB PHE A 73 13.568 8.046 -9.446 1.00 0.00 C ATOM 207 CG PHE A 73 14.884 7.312 -9.286 1.00 0.00 C ATOM 208 CD1 PHE A 73 15.050 6.393 -8.238 1.00 0.00 C ATOM 209 CD2 PHE A 73 15.907 7.472 -10.241 1.00 0.00 C ATOM 210 CE1 PHE A 73 16.204 5.594 -8.189 1.00 0.00 C ATOM 211 CE2 PHE A 73 17.085 6.712 -10.156 1.00 0.00 C ATOM 212 CZ PHE A 73 17.228 5.763 -9.132 1.00 0.00 C ATOM 0 H PHE A 73 11.463 7.012 -8.536 1.00 0.00 H new ATOM 0 HA PHE A 73 12.218 8.098 -11.051 1.00 0.00 H new ATOM 0 HB2 PHE A 73 13.770 9.030 -9.870 1.00 0.00 H new ATOM 0 HB3 PHE A 73 13.139 8.207 -8.457 1.00 0.00 H new ATOM 0 HD1 PHE A 73 14.294 6.301 -7.473 1.00 0.00 H new ATOM 0 HD2 PHE A 73 15.785 8.184 -11.044 1.00 0.00 H new ATOM 0 HE1 PHE A 73 16.304 4.843 -7.419 1.00 0.00 H new ATOM 0 HE2 PHE A 73 17.877 6.857 -10.875 1.00 0.00 H new ATOM 0 HZ PHE A 73 18.125 5.164 -9.070 1.00 0.00 H new ATOM 222 N LEU A 74 13.262 5.028 -10.403 1.00 0.00 N ATOM 223 CA LEU A 74 13.588 3.692 -10.883 1.00 0.00 C ATOM 224 C LEU A 74 12.314 2.971 -11.324 1.00 0.00 C ATOM 225 O LEU A 74 11.187 3.379 -11.033 1.00 0.00 O ATOM 226 CB LEU A 74 14.425 2.911 -9.838 1.00 0.00 C ATOM 227 CG LEU A 74 13.991 2.956 -8.355 1.00 0.00 C ATOM 228 CD1 LEU A 74 12.629 2.322 -8.110 1.00 0.00 C ATOM 229 CD2 LEU A 74 15.013 2.224 -7.474 1.00 0.00 C ATOM 0 H LEU A 74 13.198 5.052 -9.385 1.00 0.00 H new ATOM 0 HA LEU A 74 14.225 3.764 -11.764 1.00 0.00 H new ATOM 0 HB2 LEU A 74 14.444 1.865 -10.145 1.00 0.00 H new ATOM 0 HB3 LEU A 74 15.450 3.279 -9.894 1.00 0.00 H new ATOM 0 HG LEU A 74 13.932 4.014 -8.098 1.00 0.00 H new ATOM 0 HD11 LEU A 74 12.383 2.386 -7.050 1.00 0.00 H new ATOM 0 HD12 LEU A 74 11.872 2.850 -8.691 1.00 0.00 H new ATOM 0 HD13 LEU A 74 12.655 1.275 -8.414 1.00 0.00 H new ATOM 0 HD21 LEU A 74 14.692 2.265 -6.433 1.00 0.00 H new ATOM 0 HD22 LEU A 74 15.087 1.183 -7.790 1.00 0.00 H new ATOM 0 HD23 LEU A 74 15.987 2.703 -7.572 1.00 0.00 H new ATOM 241 N LYS A 75 12.519 1.872 -12.041 1.00 0.00 N ATOM 242 CA LYS A 75 11.496 0.949 -12.518 1.00 0.00 C ATOM 243 C LYS A 75 11.992 -0.447 -12.175 1.00 0.00 C ATOM 244 O LYS A 75 12.889 -0.608 -11.344 1.00 0.00 O ATOM 245 CB LYS A 75 11.262 1.143 -14.031 1.00 0.00 C ATOM 246 CG LYS A 75 10.559 2.463 -14.374 1.00 0.00 C ATOM 247 CD LYS A 75 11.260 3.197 -15.512 1.00 0.00 C ATOM 248 CE LYS A 75 10.436 4.433 -15.863 1.00 0.00 C ATOM 249 NZ LYS A 75 11.100 5.254 -16.884 1.00 0.00 N ATOM 0 H LYS A 75 13.457 1.585 -12.321 1.00 0.00 H new ATOM 0 HA LYS A 75 10.529 1.125 -12.046 1.00 0.00 H new ATOM 0 HB2 LYS A 75 12.221 1.106 -14.547 1.00 0.00 H new ATOM 0 HB3 LYS A 75 10.665 0.313 -14.408 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.525 2.262 -14.653 1.00 0.00 H new ATOM 0 HG3 LYS A 75 10.533 3.101 -13.491 1.00 0.00 H new ATOM 0 HD2 LYS A 75 12.268 3.485 -15.214 1.00 0.00 H new ATOM 0 HD3 LYS A 75 11.358 2.546 -16.381 1.00 0.00 H new ATOM 0 HE2 LYS A 75 9.454 4.126 -16.224 1.00 0.00 H new ATOM 0 HE3 LYS A 75 10.273 5.029 -14.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 10.512 6.085 -17.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 12.026 5.567 -16.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 11.233 4.692 -17.749 1.00 0.00 H new ATOM 263 N LYS A 76 11.417 -1.476 -12.792 1.00 0.00 N ATOM 264 CA LYS A 76 11.769 -2.874 -12.564 1.00 0.00 C ATOM 265 C LYS A 76 13.210 -3.234 -12.935 1.00 0.00 C ATOM 266 O LYS A 76 13.601 -4.381 -12.730 1.00 0.00 O ATOM 267 CB LYS A 76 10.787 -3.768 -13.318 1.00 0.00 C ATOM 268 CG LYS A 76 9.394 -3.816 -12.680 1.00 0.00 C ATOM 269 CD LYS A 76 8.420 -2.875 -13.387 1.00 0.00 C ATOM 270 CE LYS A 76 7.898 -3.507 -14.680 1.00 0.00 C ATOM 271 NZ LYS A 76 7.150 -2.534 -15.494 1.00 0.00 N ATOM 0 H LYS A 76 10.675 -1.357 -13.482 1.00 0.00 H new ATOM 0 HA LYS A 76 11.700 -3.039 -11.489 1.00 0.00 H new ATOM 0 HB2 LYS A 76 10.696 -3.411 -14.344 1.00 0.00 H new ATOM 0 HB3 LYS A 76 11.191 -4.779 -13.367 1.00 0.00 H new ATOM 0 HG2 LYS A 76 9.010 -4.835 -12.720 1.00 0.00 H new ATOM 0 HG3 LYS A 76 9.466 -3.543 -11.627 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.584 -2.645 -12.726 1.00 0.00 H new ATOM 0 HD3 LYS A 76 8.917 -1.932 -13.613 1.00 0.00 H new ATOM 0 HE2 LYS A 76 8.735 -3.899 -15.258 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.254 -4.352 -14.438 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 6.811 -2.996 -16.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 6.337 -2.179 -14.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.773 -1.740 -15.745 1.00 0.00 H new ATOM 285 N GLU A 77 13.999 -2.308 -13.462 1.00 0.00 N ATOM 286 CA GLU A 77 15.460 -2.354 -13.416 1.00 0.00 C ATOM 287 C GLU A 77 15.943 -2.650 -11.998 1.00 0.00 C ATOM 288 O GLU A 77 16.793 -3.517 -11.847 1.00 0.00 O ATOM 289 CB GLU A 77 16.091 -1.030 -13.886 1.00 0.00 C ATOM 290 CG GLU A 77 16.301 -0.925 -15.396 1.00 0.00 C ATOM 291 CD GLU A 77 14.997 -1.122 -16.147 1.00 0.00 C ATOM 292 OE1 GLU A 77 14.000 -0.448 -15.795 1.00 0.00 O ATOM 293 OE2 GLU A 77 14.980 -1.982 -17.060 1.00 0.00 O ATOM 0 H GLU A 77 13.637 -1.485 -13.944 1.00 0.00 H new ATOM 0 HA GLU A 77 15.772 -3.150 -14.092 1.00 0.00 H new ATOM 0 HB2 GLU A 77 15.456 -0.205 -13.563 1.00 0.00 H new ATOM 0 HB3 GLU A 77 17.053 -0.905 -13.389 1.00 0.00 H new ATOM 0 HG2 GLU A 77 16.720 0.051 -15.640 1.00 0.00 H new ATOM 0 HG3 GLU A 77 17.026 -1.673 -15.718 1.00 0.00 H new ATOM 300 N GLU A 78 15.437 -1.961 -10.965 1.00 0.00 N ATOM 301 CA GLU A 78 16.025 -2.015 -9.621 1.00 0.00 C ATOM 302 C GLU A 78 14.966 -1.891 -8.522 1.00 0.00 C ATOM 303 O GLU A 78 15.256 -2.272 -7.395 1.00 0.00 O ATOM 304 CB GLU A 78 17.063 -0.886 -9.413 1.00 0.00 C ATOM 305 CG GLU A 78 17.761 -0.354 -10.666 1.00 0.00 C ATOM 306 CD GLU A 78 18.765 0.737 -10.319 1.00 0.00 C ATOM 307 OE1 GLU A 78 18.365 1.911 -10.161 1.00 0.00 O ATOM 308 OE2 GLU A 78 19.983 0.443 -10.320 1.00 0.00 O ATOM 0 H GLU A 78 14.618 -1.357 -11.037 1.00 0.00 H new ATOM 0 HA GLU A 78 16.509 -2.989 -9.548 1.00 0.00 H new ATOM 0 HB2 GLU A 78 16.563 -0.051 -8.922 1.00 0.00 H new ATOM 0 HB3 GLU A 78 17.827 -1.249 -8.726 1.00 0.00 H new ATOM 0 HG2 GLU A 78 18.271 -1.172 -11.176 1.00 0.00 H new ATOM 0 HG3 GLU A 78 17.018 0.040 -11.359 1.00 0.00 H new ATOM 315 N LEU A 79 13.735 -1.432 -8.805 1.00 0.00 N ATOM 316 CA LEU A 79 12.618 -1.508 -7.854 1.00 0.00 C ATOM 317 C LEU A 79 12.496 -2.917 -7.274 1.00 0.00 C ATOM 318 O LEU A 79 12.280 -3.108 -6.078 1.00 0.00 O ATOM 319 CB LEU A 79 11.291 -1.161 -8.559 1.00 0.00 C ATOM 320 CG LEU A 79 10.077 -1.191 -7.608 1.00 0.00 C ATOM 321 CD1 LEU A 79 10.188 -0.145 -6.491 1.00 0.00 C ATOM 322 CD2 LEU A 79 8.823 -0.916 -8.434 1.00 0.00 C ATOM 0 H LEU A 79 13.489 -1.000 -9.696 1.00 0.00 H new ATOM 0 HA LEU A 79 12.817 -0.796 -7.053 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.371 -0.170 -9.005 1.00 0.00 H new ATOM 0 HB3 LEU A 79 11.124 -1.865 -9.374 1.00 0.00 H new ATOM 0 HG LEU A 79 10.035 -2.170 -7.131 1.00 0.00 H new ATOM 0 HD11 LEU A 79 9.310 -0.205 -5.848 1.00 0.00 H new ATOM 0 HD12 LEU A 79 11.084 -0.337 -5.901 1.00 0.00 H new ATOM 0 HD13 LEU A 79 10.249 0.851 -6.930 1.00 0.00 H new ATOM 0 HD21 LEU A 79 7.948 -0.932 -7.784 1.00 0.00 H new ATOM 0 HD22 LEU A 79 8.906 0.063 -8.907 1.00 0.00 H new ATOM 0 HD23 LEU A 79 8.718 -1.682 -9.202 1.00 0.00 H new ATOM 334 N LYS A 80 12.625 -3.896 -8.167 1.00 0.00 N ATOM 335 CA LYS A 80 12.563 -5.317 -7.862 1.00 0.00 C ATOM 336 C LYS A 80 13.694 -5.659 -6.909 1.00 0.00 C ATOM 337 O LYS A 80 13.421 -6.194 -5.840 1.00 0.00 O ATOM 338 CB LYS A 80 12.585 -6.122 -9.173 1.00 0.00 C ATOM 339 CG LYS A 80 12.664 -7.659 -9.057 1.00 0.00 C ATOM 340 CD LYS A 80 11.511 -8.397 -8.355 1.00 0.00 C ATOM 341 CE LYS A 80 11.641 -8.305 -6.837 1.00 0.00 C ATOM 342 NZ LYS A 80 10.953 -9.385 -6.105 1.00 0.00 N ATOM 0 H LYS A 80 12.781 -3.711 -9.158 1.00 0.00 H new ATOM 0 HA LYS A 80 11.633 -5.582 -7.359 1.00 0.00 H new ATOM 0 HB2 LYS A 80 11.687 -5.872 -9.738 1.00 0.00 H new ATOM 0 HB3 LYS A 80 13.437 -5.784 -9.763 1.00 0.00 H new ATOM 0 HG2 LYS A 80 12.754 -8.064 -10.065 1.00 0.00 H new ATOM 0 HG3 LYS A 80 13.586 -7.906 -8.531 1.00 0.00 H new ATOM 0 HD2 LYS A 80 10.558 -7.970 -8.668 1.00 0.00 H new ATOM 0 HD3 LYS A 80 11.506 -9.444 -8.660 1.00 0.00 H new ATOM 0 HE2 LYS A 80 12.698 -8.318 -6.573 1.00 0.00 H new ATOM 0 HE3 LYS A 80 11.242 -7.346 -6.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 10.731 -9.064 -5.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 10.072 -9.633 -6.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 11.570 -10.221 -6.058 1.00 0.00 H new ATOM 356 N GLU A 81 14.937 -5.338 -7.260 1.00 0.00 N ATOM 357 CA GLU A 81 16.077 -5.577 -6.385 1.00 0.00 C ATOM 358 C GLU A 81 15.859 -4.942 -5.027 1.00 0.00 C ATOM 359 O GLU A 81 15.966 -5.647 -4.036 1.00 0.00 O ATOM 360 CB GLU A 81 17.398 -5.172 -7.051 1.00 0.00 C ATOM 361 CG GLU A 81 17.774 -6.346 -7.949 1.00 0.00 C ATOM 362 CD GLU A 81 18.899 -6.076 -8.937 1.00 0.00 C ATOM 363 OE1 GLU A 81 20.084 -6.013 -8.551 1.00 0.00 O ATOM 364 OE2 GLU A 81 18.571 -6.051 -10.143 1.00 0.00 O ATOM 0 H GLU A 81 15.179 -4.908 -8.153 1.00 0.00 H new ATOM 0 HA GLU A 81 16.160 -6.650 -6.210 1.00 0.00 H new ATOM 0 HB2 GLU A 81 17.282 -4.256 -7.630 1.00 0.00 H new ATOM 0 HB3 GLU A 81 18.172 -4.983 -6.307 1.00 0.00 H new ATOM 0 HG2 GLU A 81 18.061 -7.187 -7.318 1.00 0.00 H new ATOM 0 HG3 GLU A 81 16.889 -6.653 -8.507 1.00 0.00 H new ATOM 371 N PHE A 82 15.457 -3.679 -4.958 1.00 0.00 N ATOM 372 CA PHE A 82 15.285 -3.005 -3.685 1.00 0.00 C ATOM 373 C PHE A 82 14.249 -3.734 -2.833 1.00 0.00 C ATOM 374 O PHE A 82 14.511 -4.040 -1.677 1.00 0.00 O ATOM 375 CB PHE A 82 14.918 -1.545 -3.945 1.00 0.00 C ATOM 376 CG PHE A 82 14.805 -0.691 -2.701 1.00 0.00 C ATOM 377 CD1 PHE A 82 13.579 -0.616 -2.015 1.00 0.00 C ATOM 378 CD2 PHE A 82 15.908 0.058 -2.252 1.00 0.00 C ATOM 379 CE1 PHE A 82 13.426 0.276 -0.941 1.00 0.00 C ATOM 380 CE2 PHE A 82 15.758 0.941 -1.171 1.00 0.00 C ATOM 381 CZ PHE A 82 14.513 1.070 -0.535 1.00 0.00 C ATOM 0 H PHE A 82 15.245 -3.103 -5.773 1.00 0.00 H new ATOM 0 HA PHE A 82 16.215 -3.021 -3.116 1.00 0.00 H new ATOM 0 HB2 PHE A 82 15.669 -1.107 -4.603 1.00 0.00 H new ATOM 0 HB3 PHE A 82 13.968 -1.513 -4.479 1.00 0.00 H new ATOM 0 HD1 PHE A 82 12.754 -1.245 -2.315 1.00 0.00 H new ATOM 0 HD2 PHE A 82 16.867 -0.046 -2.737 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.478 0.352 -0.429 1.00 0.00 H new ATOM 0 HE2 PHE A 82 16.601 1.522 -0.828 1.00 0.00 H new ATOM 0 HZ PHE A 82 14.390 1.781 0.268 1.00 0.00 H new ATOM 391 N GLN A 83 13.084 -4.070 -3.385 1.00 0.00 N ATOM 392 CA GLN A 83 12.063 -4.811 -2.652 1.00 0.00 C ATOM 393 C GLN A 83 12.592 -6.181 -2.183 1.00 0.00 C ATOM 394 O GLN A 83 12.294 -6.601 -1.061 1.00 0.00 O ATOM 395 CB GLN A 83 10.811 -4.887 -3.540 1.00 0.00 C ATOM 396 CG GLN A 83 9.642 -5.699 -2.954 1.00 0.00 C ATOM 397 CD GLN A 83 9.409 -6.985 -3.740 1.00 0.00 C ATOM 398 OE1 GLN A 83 10.335 -7.742 -4.010 1.00 0.00 O ATOM 399 NE2 GLN A 83 8.188 -7.221 -4.185 1.00 0.00 N ATOM 0 H GLN A 83 12.824 -3.838 -4.344 1.00 0.00 H new ATOM 0 HA GLN A 83 11.791 -4.299 -1.729 1.00 0.00 H new ATOM 0 HB2 GLN A 83 10.464 -3.873 -3.740 1.00 0.00 H new ATOM 0 HB3 GLN A 83 11.091 -5.323 -4.499 1.00 0.00 H new ATOM 0 HG2 GLN A 83 9.851 -5.941 -1.912 1.00 0.00 H new ATOM 0 HG3 GLN A 83 8.735 -5.094 -2.965 1.00 0.00 H new ATOM 0 HE21 GLN A 83 7.428 -6.582 -3.952 1.00 0.00 H new ATOM 0 HE22 GLN A 83 8.005 -8.042 -4.762 1.00 0.00 H new ATOM 408 N LEU A 84 13.409 -6.862 -2.984 1.00 0.00 N ATOM 409 CA LEU A 84 13.842 -8.232 -2.729 1.00 0.00 C ATOM 410 C LEU A 84 15.027 -8.300 -1.787 1.00 0.00 C ATOM 411 O LEU A 84 15.004 -9.059 -0.815 1.00 0.00 O ATOM 412 CB LEU A 84 13.998 -8.955 -4.059 1.00 0.00 C ATOM 413 CG LEU A 84 15.403 -9.133 -4.650 1.00 0.00 C ATOM 414 CD1 LEU A 84 15.994 -10.383 -4.002 1.00 0.00 C ATOM 415 CD2 LEU A 84 15.335 -9.300 -6.168 1.00 0.00 C ATOM 0 H LEU A 84 13.795 -6.469 -3.843 1.00 0.00 H new ATOM 0 HA LEU A 84 13.078 -8.776 -2.174 1.00 0.00 H new ATOM 0 HB2 LEU A 84 13.560 -9.947 -3.947 1.00 0.00 H new ATOM 0 HB3 LEU A 84 13.397 -8.422 -4.795 1.00 0.00 H new ATOM 0 HG LEU A 84 16.021 -8.257 -4.452 1.00 0.00 H new ATOM 0 HD11 LEU A 84 16.998 -10.554 -4.391 1.00 0.00 H new ATOM 0 HD12 LEU A 84 16.042 -10.245 -2.922 1.00 0.00 H new ATOM 0 HD13 LEU A 84 15.365 -11.243 -4.230 1.00 0.00 H new ATOM 0 HD21 LEU A 84 16.342 -9.425 -6.566 1.00 0.00 H new ATOM 0 HD22 LEU A 84 14.738 -10.179 -6.411 1.00 0.00 H new ATOM 0 HD23 LEU A 84 14.877 -8.416 -6.611 1.00 0.00 H new ATOM 427 N LEU A 85 16.045 -7.483 -2.024 1.00 0.00 N ATOM 428 CA LEU A 85 17.176 -7.373 -1.137 1.00 0.00 C ATOM 429 C LEU A 85 16.678 -6.860 0.201 1.00 0.00 C ATOM 430 O LEU A 85 17.298 -7.222 1.193 1.00 0.00 O ATOM 431 CB LEU A 85 18.274 -6.453 -1.695 1.00 0.00 C ATOM 432 CG LEU A 85 18.892 -6.892 -3.039 1.00 0.00 C ATOM 433 CD1 LEU A 85 20.081 -5.988 -3.375 1.00 0.00 C ATOM 434 CD2 LEU A 85 19.361 -8.349 -3.067 1.00 0.00 C ATOM 0 H LEU A 85 16.101 -6.878 -2.844 1.00 0.00 H new ATOM 0 HA LEU A 85 17.632 -8.357 -1.027 1.00 0.00 H new ATOM 0 HB2 LEU A 85 17.858 -5.453 -1.816 1.00 0.00 H new ATOM 0 HB3 LEU A 85 19.072 -6.379 -0.956 1.00 0.00 H new ATOM 0 HG LEU A 85 18.096 -6.802 -3.778 1.00 0.00 H new ATOM 0 HD11 LEU A 85 20.517 -6.298 -4.324 1.00 0.00 H new ATOM 0 HD12 LEU A 85 19.742 -4.955 -3.452 1.00 0.00 H new ATOM 0 HD13 LEU A 85 20.831 -6.066 -2.588 1.00 0.00 H new ATOM 0 HD21 LEU A 85 19.782 -8.577 -4.046 1.00 0.00 H new ATOM 0 HD22 LEU A 85 20.121 -8.501 -2.301 1.00 0.00 H new ATOM 0 HD23 LEU A 85 18.514 -9.008 -2.874 1.00 0.00 H new ATOM 446 N LEU A 86 15.564 -6.112 0.266 1.00 0.00 N ATOM 447 CA LEU A 86 14.971 -5.659 1.519 1.00 0.00 C ATOM 448 C LEU A 86 14.326 -6.856 2.194 1.00 0.00 C ATOM 449 O LEU A 86 14.623 -7.117 3.354 1.00 0.00 O ATOM 450 CB LEU A 86 13.967 -4.524 1.268 1.00 0.00 C ATOM 451 CG LEU A 86 13.407 -3.821 2.513 1.00 0.00 C ATOM 452 CD1 LEU A 86 12.600 -2.612 2.038 1.00 0.00 C ATOM 453 CD2 LEU A 86 12.486 -4.696 3.364 1.00 0.00 C ATOM 0 H LEU A 86 15.051 -5.806 -0.561 1.00 0.00 H new ATOM 0 HA LEU A 86 15.737 -5.249 2.177 1.00 0.00 H new ATOM 0 HB2 LEU A 86 14.448 -3.775 0.640 1.00 0.00 H new ATOM 0 HB3 LEU A 86 13.130 -4.928 0.698 1.00 0.00 H new ATOM 0 HG LEU A 86 14.257 -3.555 3.141 1.00 0.00 H new ATOM 0 HD11 LEU A 86 12.187 -2.089 2.900 1.00 0.00 H new ATOM 0 HD12 LEU A 86 13.250 -1.937 1.481 1.00 0.00 H new ATOM 0 HD13 LEU A 86 11.787 -2.947 1.394 1.00 0.00 H new ATOM 0 HD21 LEU A 86 12.134 -4.125 4.223 1.00 0.00 H new ATOM 0 HD22 LEU A 86 11.633 -5.015 2.766 1.00 0.00 H new ATOM 0 HD23 LEU A 86 13.034 -5.572 3.711 1.00 0.00 H new ATOM 465 N ALA A 87 13.489 -7.617 1.482 1.00 0.00 N ATOM 466 CA ALA A 87 12.860 -8.813 2.029 1.00 0.00 C ATOM 467 C ALA A 87 13.912 -9.779 2.589 1.00 0.00 C ATOM 468 O ALA A 87 13.681 -10.410 3.624 1.00 0.00 O ATOM 469 CB ALA A 87 12.011 -9.490 0.948 1.00 0.00 C ATOM 0 H ALA A 87 13.232 -7.419 0.515 1.00 0.00 H new ATOM 0 HA ALA A 87 12.210 -8.523 2.855 1.00 0.00 H new ATOM 0 HB1 ALA A 87 11.542 -10.384 1.360 1.00 0.00 H new ATOM 0 HB2 ALA A 87 11.239 -8.800 0.606 1.00 0.00 H new ATOM 0 HB3 ALA A 87 12.647 -9.769 0.107 1.00 0.00 H new ATOM 475 N ASN A 88 15.083 -9.886 1.951 1.00 0.00 N ATOM 476 CA ASN A 88 16.205 -10.647 2.500 1.00 0.00 C ATOM 477 C ASN A 88 16.824 -9.928 3.704 1.00 0.00 C ATOM 478 O ASN A 88 17.026 -10.547 4.747 1.00 0.00 O ATOM 479 CB ASN A 88 17.255 -10.988 1.417 1.00 0.00 C ATOM 480 CG ASN A 88 17.346 -12.488 1.124 1.00 0.00 C ATOM 481 OD1 ASN A 88 16.764 -13.323 1.811 1.00 0.00 O ATOM 482 ND2 ASN A 88 18.050 -12.872 0.078 1.00 0.00 N ATOM 0 H ASN A 88 15.276 -9.451 1.049 1.00 0.00 H new ATOM 0 HA ASN A 88 15.814 -11.599 2.859 1.00 0.00 H new ATOM 0 HB2 ASN A 88 17.006 -10.458 0.498 1.00 0.00 H new ATOM 0 HB3 ASN A 88 18.232 -10.626 1.739 1.00 0.00 H new ATOM 0 HD21 ASN A 88 18.111 -13.862 -0.160 1.00 0.00 H new ATOM 0 HD22 ASN A 88 18.534 -12.179 -0.493 1.00 0.00 H new ATOM 489 N LYS A 89 17.085 -8.616 3.609 1.00 0.00 N ATOM 490 CA LYS A 89 17.608 -7.775 4.688 1.00 0.00 C ATOM 491 C LYS A 89 16.819 -8.007 5.968 1.00 0.00 C ATOM 492 O LYS A 89 17.435 -8.310 6.986 1.00 0.00 O ATOM 493 CB LYS A 89 17.535 -6.285 4.294 1.00 0.00 C ATOM 494 CG LYS A 89 18.606 -5.370 4.871 1.00 0.00 C ATOM 495 CD LYS A 89 18.764 -5.368 6.398 1.00 0.00 C ATOM 496 CE LYS A 89 19.846 -6.353 6.857 1.00 0.00 C ATOM 497 NZ LYS A 89 21.197 -5.815 6.601 1.00 0.00 N ATOM 0 H LYS A 89 16.931 -8.095 2.746 1.00 0.00 H new ATOM 0 HA LYS A 89 18.650 -8.045 4.858 1.00 0.00 H new ATOM 0 HB2 LYS A 89 17.581 -6.218 3.207 1.00 0.00 H new ATOM 0 HB3 LYS A 89 16.561 -5.901 4.596 1.00 0.00 H new ATOM 0 HG2 LYS A 89 19.564 -5.648 4.431 1.00 0.00 H new ATOM 0 HG3 LYS A 89 18.391 -4.351 4.550 1.00 0.00 H new ATOM 0 HD2 LYS A 89 19.019 -4.364 6.736 1.00 0.00 H new ATOM 0 HD3 LYS A 89 17.813 -5.629 6.863 1.00 0.00 H new ATOM 0 HE2 LYS A 89 19.728 -6.558 7.921 1.00 0.00 H new ATOM 0 HE3 LYS A 89 19.724 -7.302 6.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 21.837 -6.593 6.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 21.155 -5.128 5.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 21.552 -5.345 7.458 1.00 0.00 H new ATOM 511 N ALA A 90 15.489 -7.901 5.890 1.00 0.00 N ATOM 512 CA ALA A 90 14.500 -7.973 6.958 1.00 0.00 C ATOM 513 C ALA A 90 14.977 -7.233 8.217 1.00 0.00 C ATOM 514 O ALA A 90 15.702 -6.241 8.124 1.00 0.00 O ATOM 515 CB ALA A 90 14.083 -9.435 7.178 1.00 0.00 C ATOM 0 H ALA A 90 15.039 -7.748 4.987 1.00 0.00 H new ATOM 0 HA ALA A 90 13.594 -7.442 6.668 1.00 0.00 H new ATOM 0 HB1 ALA A 90 13.343 -9.486 7.977 1.00 0.00 H new ATOM 0 HB2 ALA A 90 13.652 -9.833 6.259 1.00 0.00 H new ATOM 0 HB3 ALA A 90 14.957 -10.025 7.454 1.00 0.00 H new ATOM 521 N HIS A 91 14.524 -7.650 9.401 1.00 0.00 N ATOM 522 CA HIS A 91 14.948 -7.075 10.677 1.00 0.00 C ATOM 523 C HIS A 91 15.010 -8.121 11.803 1.00 0.00 C ATOM 524 O HIS A 91 15.038 -7.748 12.975 1.00 0.00 O ATOM 525 CB HIS A 91 14.050 -5.875 11.040 1.00 0.00 C ATOM 526 CG HIS A 91 12.646 -6.213 11.488 1.00 0.00 C ATOM 527 ND1 HIS A 91 12.010 -5.678 12.587 1.00 0.00 N ATOM 528 CD2 HIS A 91 11.780 -7.102 10.905 1.00 0.00 C ATOM 529 CE1 HIS A 91 10.791 -6.230 12.666 1.00 0.00 C ATOM 530 NE2 HIS A 91 10.606 -7.104 11.661 1.00 0.00 N ATOM 0 H HIS A 91 13.845 -8.405 9.501 1.00 0.00 H new ATOM 0 HA HIS A 91 15.969 -6.713 10.560 1.00 0.00 H new ATOM 0 HB2 HIS A 91 14.537 -5.308 11.833 1.00 0.00 H new ATOM 0 HB3 HIS A 91 13.986 -5.218 10.172 1.00 0.00 H new ATOM 0 HD2 HIS A 91 11.971 -7.693 10.022 1.00 0.00 H new ATOM 0 HE1 HIS A 91 10.061 -6.005 13.429 1.00 0.00 H new ATOM 0 HE2 HIS A 91 9.770 -7.661 11.485 1.00 0.00 H new ATOM 538 N SER A 92 14.990 -9.421 11.491 1.00 0.00 N ATOM 539 CA SER A 92 14.904 -10.489 12.486 1.00 0.00 C ATOM 540 C SER A 92 15.715 -11.699 12.026 1.00 0.00 C ATOM 541 O SER A 92 16.288 -11.692 10.935 1.00 0.00 O ATOM 542 CB SER A 92 13.431 -10.856 12.701 1.00 0.00 C ATOM 543 OG SER A 92 13.259 -11.588 13.899 1.00 0.00 O ATOM 0 H SER A 92 15.034 -9.762 10.531 1.00 0.00 H new ATOM 0 HA SER A 92 15.322 -10.150 13.434 1.00 0.00 H new ATOM 0 HB2 SER A 92 12.828 -9.949 12.736 1.00 0.00 H new ATOM 0 HB3 SER A 92 13.073 -11.445 11.857 1.00 0.00 H new ATOM 0 HG SER A 92 12.311 -11.809 14.014 1.00 0.00 H new ATOM 549 N ARG A 93 15.793 -12.755 12.837 1.00 0.00 N ATOM 550 CA ARG A 93 16.251 -14.053 12.360 1.00 0.00 C ATOM 551 C ARG A 93 15.213 -14.562 11.371 1.00 0.00 C ATOM 552 O ARG A 93 14.174 -15.078 11.781 1.00 0.00 O ATOM 553 CB ARG A 93 16.487 -15.042 13.517 1.00 0.00 C ATOM 554 CG ARG A 93 17.958 -15.064 13.952 1.00 0.00 C ATOM 555 CD ARG A 93 18.367 -13.885 14.848 1.00 0.00 C ATOM 556 NE ARG A 93 19.831 -13.790 14.889 1.00 0.00 N ATOM 557 CZ ARG A 93 20.625 -13.109 15.721 1.00 0.00 C ATOM 558 NH1 ARG A 93 20.170 -12.317 16.686 1.00 0.00 N ATOM 559 NH2 ARG A 93 21.933 -13.220 15.541 1.00 0.00 N ATOM 0 H ARG A 93 15.544 -12.733 13.826 1.00 0.00 H new ATOM 0 HA ARG A 93 17.219 -13.955 11.868 1.00 0.00 H new ATOM 0 HB2 ARG A 93 15.861 -14.766 14.365 1.00 0.00 H new ATOM 0 HB3 ARG A 93 16.183 -16.042 13.209 1.00 0.00 H new ATOM 0 HG2 ARG A 93 18.154 -15.995 14.484 1.00 0.00 H new ATOM 0 HG3 ARG A 93 18.588 -15.066 13.063 1.00 0.00 H new ATOM 0 HD2 ARG A 93 17.942 -12.958 14.464 1.00 0.00 H new ATOM 0 HD3 ARG A 93 17.972 -14.024 15.854 1.00 0.00 H new ATOM 0 HE ARG A 93 20.318 -14.327 14.171 1.00 0.00 H new ATOM 0 HH11 ARG A 93 19.165 -12.204 16.822 1.00 0.00 H new ATOM 0 HH12 ARG A 93 20.825 -11.822 17.291 1.00 0.00 H new ATOM 0 HH21 ARG A 93 22.296 -13.808 14.791 1.00 0.00 H new ATOM 0 HH22 ARG A 93 22.576 -12.718 16.153 1.00 0.00 H new ATOM 573 N SER A 94 15.450 -14.360 10.079 1.00 0.00 N ATOM 574 CA SER A 94 14.608 -14.945 9.052 1.00 0.00 C ATOM 575 C SER A 94 14.837 -16.458 9.020 1.00 0.00 C ATOM 576 O SER A 94 15.786 -16.975 9.628 1.00 0.00 O ATOM 577 CB SER A 94 14.929 -14.300 7.704 1.00 0.00 C ATOM 578 OG SER A 94 13.768 -14.125 6.923 1.00 0.00 O ATOM 0 H SER A 94 16.220 -13.794 9.722 1.00 0.00 H new ATOM 0 HA SER A 94 13.556 -14.762 9.270 1.00 0.00 H new ATOM 0 HB2 SER A 94 15.408 -13.334 7.867 1.00 0.00 H new ATOM 0 HB3 SER A 94 15.642 -14.922 7.163 1.00 0.00 H new ATOM 0 HG SER A 94 14.008 -13.709 6.069 1.00 0.00 H new ATOM 584 N SER A 95 13.963 -17.160 8.311 1.00 0.00 N ATOM 585 CA SER A 95 14.034 -18.586 8.037 1.00 0.00 C ATOM 586 C SER A 95 15.068 -18.874 6.933 1.00 0.00 C ATOM 587 O SER A 95 15.733 -17.959 6.420 1.00 0.00 O ATOM 588 CB SER A 95 12.610 -19.073 7.692 1.00 0.00 C ATOM 589 OG SER A 95 11.814 -18.048 7.104 1.00 0.00 O ATOM 0 H SER A 95 13.142 -16.725 7.890 1.00 0.00 H new ATOM 0 HA SER A 95 14.381 -19.141 8.909 1.00 0.00 H new ATOM 0 HB2 SER A 95 12.674 -19.918 7.007 1.00 0.00 H new ATOM 0 HB3 SER A 95 12.123 -19.433 8.598 1.00 0.00 H new ATOM 0 HG SER A 95 12.304 -17.640 6.360 1.00 0.00 H new ATOM 595 N SER A 96 15.206 -20.142 6.542 1.00 0.00 N ATOM 596 CA SER A 96 15.884 -20.533 5.310 1.00 0.00 C ATOM 597 C SER A 96 15.257 -19.820 4.099 1.00 0.00 C ATOM 598 O SER A 96 14.121 -19.343 4.176 1.00 0.00 O ATOM 599 CB SER A 96 15.881 -22.064 5.151 1.00 0.00 C ATOM 600 OG SER A 96 14.964 -22.718 6.014 1.00 0.00 O ATOM 0 H SER A 96 14.846 -20.932 7.078 1.00 0.00 H new ATOM 0 HA SER A 96 16.926 -20.219 5.365 1.00 0.00 H new ATOM 0 HB2 SER A 96 15.638 -22.314 4.118 1.00 0.00 H new ATOM 0 HB3 SER A 96 16.884 -22.444 5.344 1.00 0.00 H new ATOM 0 HG SER A 96 14.214 -23.069 5.489 1.00 0.00 H new ATOM 606 N GLY A 97 15.999 -19.725 2.991 1.00 0.00 N ATOM 607 CA GLY A 97 15.553 -18.975 1.819 1.00 0.00 C ATOM 608 C GLY A 97 14.445 -19.703 1.063 1.00 0.00 C ATOM 609 O GLY A 97 13.448 -19.080 0.708 1.00 0.00 O ATOM 0 H GLY A 97 16.915 -20.161 2.884 1.00 0.00 H new ATOM 0 HA2 GLY A 97 15.195 -17.994 2.131 1.00 0.00 H new ATOM 0 HA3 GLY A 97 16.399 -18.808 1.152 1.00 0.00 H new ATOM 613 N GLU A 98 14.670 -21.003 0.822 1.00 0.00 N ATOM 614 CA GLU A 98 13.742 -22.039 0.364 1.00 0.00 C ATOM 615 C GLU A 98 12.794 -21.622 -0.779 1.00 0.00 C ATOM 616 O GLU A 98 11.676 -21.177 -0.551 1.00 0.00 O ATOM 617 CB GLU A 98 13.075 -22.729 1.567 1.00 0.00 C ATOM 618 CG GLU A 98 12.169 -21.848 2.446 1.00 0.00 C ATOM 619 CD GLU A 98 11.861 -22.467 3.810 1.00 0.00 C ATOM 620 OE1 GLU A 98 12.806 -22.741 4.591 1.00 0.00 O ATOM 621 OE2 GLU A 98 10.662 -22.597 4.142 1.00 0.00 O ATOM 0 H GLU A 98 15.603 -21.391 0.958 1.00 0.00 H new ATOM 0 HA GLU A 98 14.337 -22.799 -0.143 1.00 0.00 H new ATOM 0 HB2 GLU A 98 12.482 -23.565 1.196 1.00 0.00 H new ATOM 0 HB3 GLU A 98 13.859 -23.149 2.198 1.00 0.00 H new ATOM 0 HG2 GLU A 98 12.648 -20.880 2.594 1.00 0.00 H new ATOM 0 HG3 GLU A 98 11.233 -21.663 1.919 1.00 0.00 H new ATOM 628 N THR A 99 13.206 -21.898 -2.024 1.00 0.00 N ATOM 629 CA THR A 99 12.518 -21.495 -3.262 1.00 0.00 C ATOM 630 C THR A 99 12.335 -19.958 -3.319 1.00 0.00 C ATOM 631 O THR A 99 12.839 -19.250 -2.442 1.00 0.00 O ATOM 632 CB THR A 99 11.280 -22.408 -3.471 1.00 0.00 C ATOM 633 OG1 THR A 99 11.319 -23.008 -4.751 1.00 0.00 O ATOM 634 CG2 THR A 99 9.881 -21.838 -3.212 1.00 0.00 C ATOM 0 H THR A 99 14.059 -22.427 -2.205 1.00 0.00 H new ATOM 0 HA THR A 99 13.117 -21.669 -4.156 1.00 0.00 H new ATOM 0 HB THR A 99 11.398 -23.129 -2.662 1.00 0.00 H new ATOM 0 HG1 THR A 99 10.533 -23.582 -4.867 1.00 0.00 H new ATOM 0 HG21 THR A 99 9.133 -22.607 -3.406 1.00 0.00 H new ATOM 0 HG22 THR A 99 9.807 -21.513 -2.174 1.00 0.00 H new ATOM 0 HG23 THR A 99 9.707 -20.988 -3.872 1.00 0.00 H new ATOM 642 N PRO A 100 11.805 -19.369 -4.406 1.00 0.00 N ATOM 643 CA PRO A 100 11.440 -17.960 -4.380 1.00 0.00 C ATOM 644 C PRO A 100 10.065 -17.807 -3.728 1.00 0.00 C ATOM 645 O PRO A 100 9.178 -18.646 -3.905 1.00 0.00 O ATOM 646 CB PRO A 100 11.413 -17.552 -5.854 1.00 0.00 C ATOM 647 CG PRO A 100 11.045 -18.843 -6.595 1.00 0.00 C ATOM 648 CD PRO A 100 11.599 -19.965 -5.711 1.00 0.00 C ATOM 0 HA PRO A 100 12.128 -17.339 -3.806 1.00 0.00 H new ATOM 0 HB2 PRO A 100 10.681 -16.766 -6.036 1.00 0.00 H new ATOM 0 HB3 PRO A 100 12.380 -17.168 -6.179 1.00 0.00 H new ATOM 0 HG2 PRO A 100 9.966 -18.934 -6.722 1.00 0.00 H new ATOM 0 HG3 PRO A 100 11.486 -18.868 -7.591 1.00 0.00 H new ATOM 0 HD2 PRO A 100 10.901 -20.800 -5.654 1.00 0.00 H new ATOM 0 HD3 PRO A 100 12.533 -20.357 -6.115 1.00 0.00 H new ATOM 656 N ALA A 101 9.813 -16.652 -3.119 1.00 0.00 N ATOM 657 CA ALA A 101 8.599 -16.395 -2.360 1.00 0.00 C ATOM 658 C ALA A 101 8.351 -14.889 -2.356 1.00 0.00 C ATOM 659 O ALA A 101 8.600 -14.226 -1.349 1.00 0.00 O ATOM 660 CB ALA A 101 8.754 -16.973 -0.941 1.00 0.00 C ATOM 0 H ALA A 101 10.456 -15.860 -3.141 1.00 0.00 H new ATOM 0 HA ALA A 101 7.734 -16.882 -2.810 1.00 0.00 H new ATOM 0 HB1 ALA A 101 7.846 -16.782 -0.369 1.00 0.00 H new ATOM 0 HB2 ALA A 101 8.925 -18.048 -1.003 1.00 0.00 H new ATOM 0 HB3 ALA A 101 9.601 -16.499 -0.445 1.00 0.00 H new ATOM 666 N GLN A 102 7.900 -14.340 -3.485 1.00 0.00 N ATOM 667 CA GLN A 102 7.759 -12.909 -3.699 1.00 0.00 C ATOM 668 C GLN A 102 6.318 -12.546 -4.105 1.00 0.00 C ATOM 669 O GLN A 102 5.593 -13.398 -4.626 1.00 0.00 O ATOM 670 CB GLN A 102 8.828 -12.467 -4.710 1.00 0.00 C ATOM 671 CG GLN A 102 8.620 -13.001 -6.131 1.00 0.00 C ATOM 672 CD GLN A 102 9.860 -12.773 -6.991 1.00 0.00 C ATOM 673 OE1 GLN A 102 10.912 -13.373 -6.784 1.00 0.00 O ATOM 674 NE2 GLN A 102 9.801 -11.865 -7.950 1.00 0.00 N ATOM 0 H GLN A 102 7.617 -14.896 -4.292 1.00 0.00 H new ATOM 0 HA GLN A 102 7.929 -12.358 -2.774 1.00 0.00 H new ATOM 0 HB2 GLN A 102 8.849 -11.378 -4.744 1.00 0.00 H new ATOM 0 HB3 GLN A 102 9.805 -12.793 -4.352 1.00 0.00 H new ATOM 0 HG2 GLN A 102 8.391 -14.066 -6.093 1.00 0.00 H new ATOM 0 HG3 GLN A 102 7.762 -12.507 -6.587 1.00 0.00 H new ATOM 0 HE21 GLN A 102 8.930 -11.364 -8.125 1.00 0.00 H new ATOM 0 HE22 GLN A 102 10.627 -11.665 -8.514 1.00 0.00 H new ATOM 683 N PRO A 103 5.867 -11.306 -3.859 1.00 0.00 N ATOM 684 CA PRO A 103 4.476 -10.893 -4.011 1.00 0.00 C ATOM 685 C PRO A 103 4.157 -10.359 -5.416 1.00 0.00 C ATOM 686 O PRO A 103 5.042 -10.065 -6.225 1.00 0.00 O ATOM 687 CB PRO A 103 4.316 -9.801 -2.950 1.00 0.00 C ATOM 688 CG PRO A 103 5.670 -9.100 -2.991 1.00 0.00 C ATOM 689 CD PRO A 103 6.625 -10.273 -3.179 1.00 0.00 C ATOM 0 HA PRO A 103 3.787 -11.728 -3.885 1.00 0.00 H new ATOM 0 HB2 PRO A 103 3.499 -9.120 -3.189 1.00 0.00 H new ATOM 0 HB3 PRO A 103 4.105 -10.219 -1.966 1.00 0.00 H new ATOM 0 HG2 PRO A 103 5.735 -8.385 -3.811 1.00 0.00 H new ATOM 0 HG3 PRO A 103 5.874 -8.551 -2.072 1.00 0.00 H new ATOM 0 HD2 PRO A 103 7.494 -9.977 -3.767 1.00 0.00 H new ATOM 0 HD3 PRO A 103 6.996 -10.631 -2.219 1.00 0.00 H new ATOM 697 N GLU A 104 2.868 -10.149 -5.677 1.00 0.00 N ATOM 698 CA GLU A 104 2.323 -9.619 -6.923 1.00 0.00 C ATOM 699 C GLU A 104 2.182 -8.100 -6.803 1.00 0.00 C ATOM 700 O GLU A 104 1.077 -7.555 -6.755 1.00 0.00 O ATOM 701 CB GLU A 104 0.979 -10.298 -7.225 1.00 0.00 C ATOM 702 CG GLU A 104 1.183 -11.763 -7.608 1.00 0.00 C ATOM 703 CD GLU A 104 -0.169 -12.440 -7.802 1.00 0.00 C ATOM 704 OE1 GLU A 104 -0.740 -12.943 -6.810 1.00 0.00 O ATOM 705 OE2 GLU A 104 -0.718 -12.440 -8.932 1.00 0.00 O ATOM 0 H GLU A 104 2.141 -10.354 -4.991 1.00 0.00 H new ATOM 0 HA GLU A 104 2.995 -9.831 -7.755 1.00 0.00 H new ATOM 0 HB2 GLU A 104 0.330 -10.233 -6.352 1.00 0.00 H new ATOM 0 HB3 GLU A 104 0.475 -9.772 -8.036 1.00 0.00 H new ATOM 0 HG2 GLU A 104 1.768 -11.830 -8.525 1.00 0.00 H new ATOM 0 HG3 GLU A 104 1.749 -12.276 -6.830 1.00 0.00 H new ATOM 712 N LYS A 105 3.311 -7.405 -6.675 1.00 0.00 N ATOM 713 CA LYS A 105 3.381 -5.952 -6.528 1.00 0.00 C ATOM 714 C LYS A 105 4.499 -5.418 -7.412 1.00 0.00 C ATOM 715 O LYS A 105 5.640 -5.848 -7.276 1.00 0.00 O ATOM 716 CB LYS A 105 3.606 -5.555 -5.056 1.00 0.00 C ATOM 717 CG LYS A 105 2.305 -5.504 -4.238 1.00 0.00 C ATOM 718 CD LYS A 105 1.880 -6.821 -3.575 1.00 0.00 C ATOM 719 CE LYS A 105 0.363 -6.795 -3.356 1.00 0.00 C ATOM 720 NZ LYS A 105 -0.181 -8.108 -2.957 1.00 0.00 N ATOM 0 H LYS A 105 4.229 -7.850 -6.671 1.00 0.00 H new ATOM 0 HA LYS A 105 2.433 -5.513 -6.840 1.00 0.00 H new ATOM 0 HB2 LYS A 105 4.290 -6.267 -4.595 1.00 0.00 H new ATOM 0 HB3 LYS A 105 4.089 -4.579 -5.019 1.00 0.00 H new ATOM 0 HG2 LYS A 105 2.416 -4.748 -3.461 1.00 0.00 H new ATOM 0 HG3 LYS A 105 1.499 -5.172 -4.893 1.00 0.00 H new ATOM 0 HD2 LYS A 105 2.156 -7.667 -4.204 1.00 0.00 H new ATOM 0 HD3 LYS A 105 2.397 -6.949 -2.624 1.00 0.00 H new ATOM 0 HE2 LYS A 105 0.124 -6.059 -2.588 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -0.126 -6.468 -4.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -1.209 -8.031 -2.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 0.020 -8.807 -3.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 0.263 -8.412 -2.067 1.00 0.00 H new ATOM 734 N THR A 106 4.190 -4.473 -8.305 1.00 0.00 N ATOM 735 CA THR A 106 5.172 -3.906 -9.230 1.00 0.00 C ATOM 736 C THR A 106 4.879 -2.422 -9.541 1.00 0.00 C ATOM 737 O THR A 106 5.229 -1.915 -10.612 1.00 0.00 O ATOM 738 CB THR A 106 5.306 -4.847 -10.452 1.00 0.00 C ATOM 739 OG1 THR A 106 6.496 -4.589 -11.166 1.00 0.00 O ATOM 740 CG2 THR A 106 4.099 -4.820 -11.395 1.00 0.00 C ATOM 0 H THR A 106 3.254 -4.081 -8.406 1.00 0.00 H new ATOM 0 HA THR A 106 6.160 -3.862 -8.772 1.00 0.00 H new ATOM 0 HB THR A 106 5.345 -5.855 -10.038 1.00 0.00 H new ATOM 0 HG1 THR A 106 6.557 -5.198 -11.932 1.00 0.00 H new ATOM 0 HG21 THR A 106 4.270 -5.505 -12.225 1.00 0.00 H new ATOM 0 HG22 THR A 106 3.205 -5.125 -10.851 1.00 0.00 H new ATOM 0 HG23 THR A 106 3.961 -3.810 -11.781 1.00 0.00 H new ATOM 748 N SER A 107 4.262 -1.693 -8.603 1.00 0.00 N ATOM 749 CA SER A 107 4.271 -0.231 -8.581 1.00 0.00 C ATOM 750 C SER A 107 4.989 0.176 -7.302 1.00 0.00 C ATOM 751 O SER A 107 4.706 -0.422 -6.262 1.00 0.00 O ATOM 752 CB SER A 107 2.850 0.345 -8.537 1.00 0.00 C ATOM 753 OG SER A 107 1.919 -0.358 -9.334 1.00 0.00 O ATOM 0 H SER A 107 3.739 -2.108 -7.832 1.00 0.00 H new ATOM 0 HA SER A 107 4.757 0.145 -9.481 1.00 0.00 H new ATOM 0 HB2 SER A 107 2.501 0.345 -7.504 1.00 0.00 H new ATOM 0 HB3 SER A 107 2.880 1.384 -8.864 1.00 0.00 H new ATOM 0 HG SER A 107 1.038 0.063 -9.256 1.00 0.00 H new ATOM 759 N GLY A 108 5.840 1.201 -7.335 1.00 0.00 N ATOM 760 CA GLY A 108 6.455 1.777 -6.144 1.00 0.00 C ATOM 761 C GLY A 108 5.420 2.085 -5.058 1.00 0.00 C ATOM 762 O GLY A 108 5.610 1.711 -3.902 1.00 0.00 O ATOM 0 H GLY A 108 6.124 1.659 -8.201 1.00 0.00 H new ATOM 0 HA2 GLY A 108 7.200 1.086 -5.750 1.00 0.00 H new ATOM 0 HA3 GLY A 108 6.981 2.693 -6.414 1.00 0.00 H new ATOM 766 N MET A 109 4.295 2.709 -5.421 1.00 0.00 N ATOM 767 CA MET A 109 3.211 3.018 -4.486 1.00 0.00 C ATOM 768 C MET A 109 2.629 1.769 -3.810 1.00 0.00 C ATOM 769 O MET A 109 2.322 1.806 -2.621 1.00 0.00 O ATOM 770 CB MET A 109 2.115 3.847 -5.186 1.00 0.00 C ATOM 771 CG MET A 109 1.400 3.088 -6.307 1.00 0.00 C ATOM 772 SD MET A 109 0.279 4.067 -7.341 1.00 0.00 S ATOM 773 CE MET A 109 1.461 5.159 -8.173 1.00 0.00 C ATOM 0 H MET A 109 4.111 3.015 -6.376 1.00 0.00 H new ATOM 0 HA MET A 109 3.641 3.618 -3.684 1.00 0.00 H new ATOM 0 HB2 MET A 109 1.380 4.163 -4.445 1.00 0.00 H new ATOM 0 HB3 MET A 109 2.562 4.752 -5.598 1.00 0.00 H new ATOM 0 HG2 MET A 109 2.154 2.636 -6.951 1.00 0.00 H new ATOM 0 HG3 MET A 109 0.831 2.272 -5.861 1.00 0.00 H new ATOM 0 HE1 MET A 109 0.978 5.634 -9.027 1.00 0.00 H new ATOM 0 HE2 MET A 109 1.802 5.925 -7.476 1.00 0.00 H new ATOM 0 HE3 MET A 109 2.315 4.576 -8.517 1.00 0.00 H new ATOM 783 N GLU A 110 2.492 0.651 -4.530 1.00 0.00 N ATOM 784 CA GLU A 110 1.844 -0.536 -3.979 1.00 0.00 C ATOM 785 C GLU A 110 2.852 -1.413 -3.234 1.00 0.00 C ATOM 786 O GLU A 110 2.488 -2.095 -2.274 1.00 0.00 O ATOM 787 CB GLU A 110 1.133 -1.303 -5.107 1.00 0.00 C ATOM 788 CG GLU A 110 0.140 -2.372 -4.613 1.00 0.00 C ATOM 789 CD GLU A 110 -0.936 -1.836 -3.656 1.00 0.00 C ATOM 790 OE1 GLU A 110 -1.517 -0.761 -3.929 1.00 0.00 O ATOM 791 OE2 GLU A 110 -1.192 -2.483 -2.612 1.00 0.00 O ATOM 0 H GLU A 110 2.820 0.546 -5.490 1.00 0.00 H new ATOM 0 HA GLU A 110 1.094 -0.233 -3.249 1.00 0.00 H new ATOM 0 HB2 GLU A 110 0.600 -0.590 -5.736 1.00 0.00 H new ATOM 0 HB3 GLU A 110 1.884 -1.783 -5.735 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -0.349 -2.824 -5.476 1.00 0.00 H new ATOM 0 HG3 GLU A 110 0.696 -3.164 -4.111 1.00 0.00 H new ATOM 798 N VAL A 111 4.129 -1.350 -3.618 1.00 0.00 N ATOM 799 CA VAL A 111 5.234 -1.841 -2.812 1.00 0.00 C ATOM 800 C VAL A 111 5.204 -1.105 -1.465 1.00 0.00 C ATOM 801 O VAL A 111 5.265 -1.768 -0.436 1.00 0.00 O ATOM 802 CB VAL A 111 6.560 -1.709 -3.600 1.00 0.00 C ATOM 803 CG1 VAL A 111 7.800 -1.995 -2.748 1.00 0.00 C ATOM 804 CG2 VAL A 111 6.596 -2.686 -4.792 1.00 0.00 C ATOM 0 H VAL A 111 4.422 -0.950 -4.510 1.00 0.00 H new ATOM 0 HA VAL A 111 5.144 -2.905 -2.592 1.00 0.00 H new ATOM 0 HB VAL A 111 6.587 -0.672 -3.935 1.00 0.00 H new ATOM 0 HG11 VAL A 111 8.695 -1.885 -3.360 1.00 0.00 H new ATOM 0 HG12 VAL A 111 7.840 -1.291 -1.917 1.00 0.00 H new ATOM 0 HG13 VAL A 111 7.748 -3.012 -2.360 1.00 0.00 H new ATOM 0 HG21 VAL A 111 7.538 -2.572 -5.328 1.00 0.00 H new ATOM 0 HG22 VAL A 111 6.508 -3.709 -4.427 1.00 0.00 H new ATOM 0 HG23 VAL A 111 5.767 -2.469 -5.466 1.00 0.00 H new ATOM 814 N ALA A 112 5.019 0.219 -1.431 1.00 0.00 N ATOM 815 CA ALA A 112 4.912 0.951 -0.171 1.00 0.00 C ATOM 816 C ALA A 112 3.773 0.421 0.708 1.00 0.00 C ATOM 817 O ALA A 112 3.970 0.132 1.890 1.00 0.00 O ATOM 818 CB ALA A 112 4.724 2.444 -0.448 1.00 0.00 C ATOM 0 H ALA A 112 4.941 0.803 -2.264 1.00 0.00 H new ATOM 0 HA ALA A 112 5.840 0.800 0.380 1.00 0.00 H new ATOM 0 HB1 ALA A 112 4.645 2.982 0.497 1.00 0.00 H new ATOM 0 HB2 ALA A 112 5.579 2.820 -1.010 1.00 0.00 H new ATOM 0 HB3 ALA A 112 3.814 2.595 -1.028 1.00 0.00 H new ATOM 824 N SER A 113 2.591 0.236 0.118 1.00 0.00 N ATOM 825 CA SER A 113 1.438 -0.321 0.808 1.00 0.00 C ATOM 826 C SER A 113 1.731 -1.710 1.390 1.00 0.00 C ATOM 827 O SER A 113 1.259 -2.022 2.486 1.00 0.00 O ATOM 828 CB SER A 113 0.249 -0.330 -0.164 1.00 0.00 C ATOM 829 OG SER A 113 -0.969 -0.161 0.530 1.00 0.00 O ATOM 0 H SER A 113 2.411 0.471 -0.858 1.00 0.00 H new ATOM 0 HA SER A 113 1.191 0.303 1.667 1.00 0.00 H new ATOM 0 HB2 SER A 113 0.368 0.467 -0.898 1.00 0.00 H new ATOM 0 HB3 SER A 113 0.231 -1.270 -0.715 1.00 0.00 H new ATOM 0 HG SER A 113 -1.284 0.760 0.418 1.00 0.00 H new ATOM 835 N TYR A 114 2.526 -2.521 0.689 1.00 0.00 N ATOM 836 CA TYR A 114 2.938 -3.844 1.142 1.00 0.00 C ATOM 837 C TYR A 114 3.910 -3.684 2.308 1.00 0.00 C ATOM 838 O TYR A 114 3.818 -4.416 3.291 1.00 0.00 O ATOM 839 CB TYR A 114 3.518 -4.655 -0.041 1.00 0.00 C ATOM 840 CG TYR A 114 4.752 -5.495 0.245 1.00 0.00 C ATOM 841 CD1 TYR A 114 6.021 -4.893 0.196 1.00 0.00 C ATOM 842 CD2 TYR A 114 4.651 -6.866 0.548 1.00 0.00 C ATOM 843 CE1 TYR A 114 7.171 -5.621 0.507 1.00 0.00 C ATOM 844 CE2 TYR A 114 5.809 -7.610 0.849 1.00 0.00 C ATOM 845 CZ TYR A 114 7.076 -6.979 0.870 1.00 0.00 C ATOM 846 OH TYR A 114 8.190 -7.636 1.290 1.00 0.00 O ATOM 0 H TYR A 114 2.906 -2.269 -0.224 1.00 0.00 H new ATOM 0 HA TYR A 114 2.084 -4.415 1.507 1.00 0.00 H new ATOM 0 HB2 TYR A 114 2.736 -5.316 -0.416 1.00 0.00 H new ATOM 0 HB3 TYR A 114 3.759 -3.959 -0.844 1.00 0.00 H new ATOM 0 HD1 TYR A 114 6.108 -3.854 -0.086 1.00 0.00 H new ATOM 0 HD2 TYR A 114 3.685 -7.348 0.550 1.00 0.00 H new ATOM 0 HE1 TYR A 114 8.138 -5.141 0.469 1.00 0.00 H new ATOM 0 HE2 TYR A 114 5.730 -8.665 1.064 1.00 0.00 H new ATOM 0 HH TYR A 114 7.985 -8.138 2.107 1.00 0.00 H new ATOM 856 N LEU A 115 4.833 -2.728 2.221 1.00 0.00 N ATOM 857 CA LEU A 115 5.932 -2.631 3.160 1.00 0.00 C ATOM 858 C LEU A 115 5.442 -2.150 4.526 1.00 0.00 C ATOM 859 O LEU A 115 5.882 -2.696 5.538 1.00 0.00 O ATOM 860 CB LEU A 115 7.036 -1.736 2.576 1.00 0.00 C ATOM 861 CG LEU A 115 8.382 -1.973 3.280 1.00 0.00 C ATOM 862 CD1 LEU A 115 8.986 -3.325 2.887 1.00 0.00 C ATOM 863 CD2 LEU A 115 9.407 -0.892 2.924 1.00 0.00 C ATOM 0 H LEU A 115 4.834 -2.007 1.500 1.00 0.00 H new ATOM 0 HA LEU A 115 6.362 -3.620 3.321 1.00 0.00 H new ATOM 0 HB2 LEU A 115 7.142 -1.935 1.510 1.00 0.00 H new ATOM 0 HB3 LEU A 115 6.750 -0.689 2.678 1.00 0.00 H new ATOM 0 HG LEU A 115 8.170 -1.948 4.349 1.00 0.00 H new ATOM 0 HD11 LEU A 115 9.937 -3.462 3.402 1.00 0.00 H new ATOM 0 HD12 LEU A 115 8.302 -4.125 3.170 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.149 -3.351 1.810 1.00 0.00 H new ATOM 0 HD21 LEU A 115 10.345 -1.095 3.441 1.00 0.00 H new ATOM 0 HD22 LEU A 115 9.579 -0.894 1.848 1.00 0.00 H new ATOM 0 HD23 LEU A 115 9.028 0.083 3.229 1.00 0.00 H new ATOM 875 N VAL A 116 4.502 -1.199 4.584 1.00 0.00 N ATOM 876 CA VAL A 116 3.860 -0.850 5.852 1.00 0.00 C ATOM 877 C VAL A 116 3.087 -2.060 6.390 1.00 0.00 C ATOM 878 O VAL A 116 3.203 -2.348 7.585 1.00 0.00 O ATOM 879 CB VAL A 116 3.001 0.430 5.740 1.00 0.00 C ATOM 880 CG1 VAL A 116 2.244 0.690 7.048 1.00 0.00 C ATOM 881 CG2 VAL A 116 3.863 1.667 5.452 1.00 0.00 C ATOM 0 H VAL A 116 4.174 -0.665 3.779 1.00 0.00 H new ATOM 0 HA VAL A 116 4.631 -0.602 6.582 1.00 0.00 H new ATOM 0 HB VAL A 116 2.305 0.266 4.917 1.00 0.00 H new ATOM 0 HG11 VAL A 116 1.645 1.595 6.948 1.00 0.00 H new ATOM 0 HG12 VAL A 116 1.590 -0.155 7.264 1.00 0.00 H new ATOM 0 HG13 VAL A 116 2.957 0.815 7.863 1.00 0.00 H new ATOM 0 HG21 VAL A 116 3.224 2.547 5.380 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.582 1.806 6.260 1.00 0.00 H new ATOM 0 HG23 VAL A 116 4.396 1.528 4.512 1.00 0.00 H new ATOM 891 N ALA A 117 2.347 -2.793 5.547 1.00 0.00 N ATOM 892 CA ALA A 117 1.594 -3.957 6.007 1.00 0.00 C ATOM 893 C ALA A 117 2.527 -4.997 6.648 1.00 0.00 C ATOM 894 O ALA A 117 2.185 -5.576 7.683 1.00 0.00 O ATOM 895 CB ALA A 117 0.790 -4.564 4.852 1.00 0.00 C ATOM 0 H ALA A 117 2.257 -2.598 4.550 1.00 0.00 H new ATOM 0 HA ALA A 117 0.890 -3.633 6.774 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.235 -5.430 5.211 1.00 0.00 H new ATOM 0 HB2 ALA A 117 0.093 -3.821 4.464 1.00 0.00 H new ATOM 0 HB3 ALA A 117 1.470 -4.873 4.058 1.00 0.00 H new ATOM 901 N GLN A 118 3.713 -5.208 6.072 1.00 0.00 N ATOM 902 CA GLN A 118 4.747 -6.105 6.575 1.00 0.00 C ATOM 903 C GLN A 118 5.333 -5.592 7.899 1.00 0.00 C ATOM 904 O GLN A 118 5.282 -6.302 8.907 1.00 0.00 O ATOM 905 CB GLN A 118 5.860 -6.245 5.520 1.00 0.00 C ATOM 906 CG GLN A 118 5.428 -6.917 4.209 1.00 0.00 C ATOM 907 CD GLN A 118 5.856 -8.375 4.128 1.00 0.00 C ATOM 908 OE1 GLN A 118 6.874 -8.707 3.528 1.00 0.00 O ATOM 909 NE2 GLN A 118 5.084 -9.282 4.696 1.00 0.00 N ATOM 0 H GLN A 118 3.986 -4.738 5.209 1.00 0.00 H new ATOM 0 HA GLN A 118 4.298 -7.080 6.766 1.00 0.00 H new ATOM 0 HB2 GLN A 118 6.250 -5.253 5.291 1.00 0.00 H new ATOM 0 HB3 GLN A 118 6.680 -6.819 5.952 1.00 0.00 H new ATOM 0 HG2 GLN A 118 4.344 -6.855 4.114 1.00 0.00 H new ATOM 0 HG3 GLN A 118 5.854 -6.370 3.368 1.00 0.00 H new ATOM 0 HE21 GLN A 118 4.240 -8.995 5.192 1.00 0.00 H new ATOM 0 HE22 GLN A 118 5.331 -10.270 4.639 1.00 0.00 H new ATOM 918 N TYR A 119 5.920 -4.390 7.885 1.00 0.00 N ATOM 919 CA TYR A 119 6.887 -3.920 8.881 1.00 0.00 C ATOM 920 C TYR A 119 6.398 -2.776 9.769 1.00 0.00 C ATOM 921 O TYR A 119 7.049 -2.469 10.771 1.00 0.00 O ATOM 922 CB TYR A 119 8.135 -3.423 8.144 1.00 0.00 C ATOM 923 CG TYR A 119 8.927 -4.503 7.453 1.00 0.00 C ATOM 924 CD1 TYR A 119 9.794 -5.328 8.194 1.00 0.00 C ATOM 925 CD2 TYR A 119 8.787 -4.682 6.070 1.00 0.00 C ATOM 926 CE1 TYR A 119 10.490 -6.362 7.540 1.00 0.00 C ATOM 927 CE2 TYR A 119 9.471 -5.716 5.417 1.00 0.00 C ATOM 928 CZ TYR A 119 10.332 -6.560 6.148 1.00 0.00 C ATOM 929 OH TYR A 119 11.000 -7.559 5.512 1.00 0.00 O ATOM 0 H TYR A 119 5.729 -3.699 7.160 1.00 0.00 H new ATOM 0 HA TYR A 119 7.074 -4.771 9.537 1.00 0.00 H new ATOM 0 HB2 TYR A 119 7.833 -2.682 7.404 1.00 0.00 H new ATOM 0 HB3 TYR A 119 8.784 -2.915 8.857 1.00 0.00 H new ATOM 0 HD1 TYR A 119 9.924 -5.169 9.254 1.00 0.00 H new ATOM 0 HD2 TYR A 119 8.149 -4.019 5.505 1.00 0.00 H new ATOM 0 HE1 TYR A 119 11.148 -7.007 8.103 1.00 0.00 H new ATOM 0 HE2 TYR A 119 9.339 -5.866 4.356 1.00 0.00 H new ATOM 0 HH TYR A 119 10.772 -7.550 4.559 1.00 0.00 H new ATOM 939 N GLY A 120 5.297 -2.125 9.414 1.00 0.00 N ATOM 940 CA GLY A 120 4.838 -0.890 10.021 1.00 0.00 C ATOM 941 C GLY A 120 5.697 0.291 9.572 1.00 0.00 C ATOM 942 O GLY A 120 6.851 0.137 9.176 1.00 0.00 O ATOM 0 H GLY A 120 4.682 -2.456 8.671 1.00 0.00 H new ATOM 0 HA2 GLY A 120 3.797 -0.712 9.750 1.00 0.00 H new ATOM 0 HA3 GLY A 120 4.874 -0.979 11.107 1.00 0.00 H new ATOM 946 N GLU A 121 5.129 1.491 9.658 1.00 0.00 N ATOM 947 CA GLU A 121 5.660 2.753 9.119 1.00 0.00 C ATOM 948 C GLU A 121 7.033 3.168 9.666 1.00 0.00 C ATOM 949 O GLU A 121 7.698 4.022 9.081 1.00 0.00 O ATOM 950 CB GLU A 121 4.630 3.858 9.360 1.00 0.00 C ATOM 951 CG GLU A 121 4.343 4.097 10.855 1.00 0.00 C ATOM 952 CD GLU A 121 4.701 5.503 11.342 1.00 0.00 C ATOM 953 OE1 GLU A 121 5.754 6.059 10.957 1.00 0.00 O ATOM 954 OE2 GLU A 121 3.923 6.076 12.143 1.00 0.00 O ATOM 0 H GLU A 121 4.235 1.623 10.131 1.00 0.00 H new ATOM 0 HA GLU A 121 5.829 2.590 8.055 1.00 0.00 H new ATOM 0 HB2 GLU A 121 4.988 4.785 8.912 1.00 0.00 H new ATOM 0 HB3 GLU A 121 3.700 3.597 8.854 1.00 0.00 H new ATOM 0 HG2 GLU A 121 3.285 3.917 11.044 1.00 0.00 H new ATOM 0 HG3 GLU A 121 4.901 3.368 11.442 1.00 0.00 H new ATOM 961 N GLN A 122 7.469 2.552 10.763 1.00 0.00 N ATOM 962 CA GLN A 122 8.839 2.598 11.236 1.00 0.00 C ATOM 963 C GLN A 122 9.730 1.888 10.209 1.00 0.00 C ATOM 964 O GLN A 122 10.316 2.543 9.351 1.00 0.00 O ATOM 965 CB GLN A 122 8.897 1.958 12.632 1.00 0.00 C ATOM 966 CG GLN A 122 8.313 2.848 13.742 1.00 0.00 C ATOM 967 CD GLN A 122 9.394 3.638 14.478 1.00 0.00 C ATOM 968 OE1 GLN A 122 10.040 3.114 15.385 1.00 0.00 O ATOM 969 NE2 GLN A 122 9.606 4.897 14.144 1.00 0.00 N ATOM 0 H GLN A 122 6.858 1.994 11.359 1.00 0.00 H new ATOM 0 HA GLN A 122 9.205 3.620 11.334 1.00 0.00 H new ATOM 0 HB2 GLN A 122 8.354 1.013 12.612 1.00 0.00 H new ATOM 0 HB3 GLN A 122 9.934 1.725 12.873 1.00 0.00 H new ATOM 0 HG2 GLN A 122 7.592 3.540 13.308 1.00 0.00 H new ATOM 0 HG3 GLN A 122 7.770 2.227 14.455 1.00 0.00 H new ATOM 0 HE21 GLN A 122 9.066 5.323 13.391 1.00 0.00 H new ATOM 0 HE22 GLN A 122 10.310 5.444 14.639 1.00 0.00 H new ATOM 978 N ARG A 123 9.837 0.554 10.263 1.00 0.00 N ATOM 979 CA ARG A 123 10.791 -0.188 9.430 1.00 0.00 C ATOM 980 C ARG A 123 10.445 -0.080 7.942 1.00 0.00 C ATOM 981 O ARG A 123 11.351 -0.199 7.119 1.00 0.00 O ATOM 982 CB ARG A 123 10.903 -1.655 9.896 1.00 0.00 C ATOM 983 CG ARG A 123 11.949 -1.903 10.991 1.00 0.00 C ATOM 984 CD ARG A 123 11.410 -1.501 12.368 1.00 0.00 C ATOM 985 NE ARG A 123 12.441 -1.636 13.405 1.00 0.00 N ATOM 986 CZ ARG A 123 12.478 -0.997 14.580 1.00 0.00 C ATOM 987 NH1 ARG A 123 11.458 -0.247 15.000 1.00 0.00 N ATOM 988 NH2 ARG A 123 13.561 -1.117 15.322 1.00 0.00 N ATOM 0 H ARG A 123 9.273 -0.034 10.876 1.00 0.00 H new ATOM 0 HA ARG A 123 11.772 0.270 9.555 1.00 0.00 H new ATOM 0 HB2 ARG A 123 9.929 -1.981 10.262 1.00 0.00 H new ATOM 0 HB3 ARG A 123 11.144 -2.278 9.035 1.00 0.00 H new ATOM 0 HG2 ARG A 123 12.229 -2.956 11.000 1.00 0.00 H new ATOM 0 HG3 ARG A 123 12.853 -1.335 10.771 1.00 0.00 H new ATOM 0 HD2 ARG A 123 11.056 -0.470 12.336 1.00 0.00 H new ATOM 0 HD3 ARG A 123 10.553 -2.124 12.621 1.00 0.00 H new ATOM 0 HE ARG A 123 13.206 -2.282 13.210 1.00 0.00 H new ATOM 0 HH11 ARG A 123 10.624 -0.150 14.421 1.00 0.00 H new ATOM 0 HH12 ARG A 123 11.512 0.230 15.900 1.00 0.00 H new ATOM 0 HH21 ARG A 123 14.342 -1.686 14.996 1.00 0.00 H new ATOM 0 HH22 ARG A 123 13.618 -0.641 16.222 1.00 0.00 H new ATOM 1002 N ALA A 124 9.190 0.210 7.583 1.00 0.00 N ATOM 1003 CA ALA A 124 8.788 0.459 6.205 1.00 0.00 C ATOM 1004 C ALA A 124 9.431 1.717 5.604 1.00 0.00 C ATOM 1005 O ALA A 124 9.279 1.964 4.406 1.00 0.00 O ATOM 1006 CB ALA A 124 7.267 0.527 6.105 1.00 0.00 C ATOM 0 H ALA A 124 8.422 0.278 8.251 1.00 0.00 H new ATOM 0 HA ALA A 124 9.154 -0.380 5.613 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.978 0.714 5.071 1.00 0.00 H new ATOM 0 HB2 ALA A 124 6.838 -0.419 6.437 1.00 0.00 H new ATOM 0 HB3 ALA A 124 6.897 1.335 6.736 1.00 0.00 H new ATOM 1012 N TRP A 125 10.167 2.504 6.386 1.00 0.00 N ATOM 1013 CA TRP A 125 11.206 3.357 5.834 1.00 0.00 C ATOM 1014 C TRP A 125 12.553 2.998 6.449 1.00 0.00 C ATOM 1015 O TRP A 125 13.496 2.732 5.722 1.00 0.00 O ATOM 1016 CB TRP A 125 10.803 4.828 5.947 1.00 0.00 C ATOM 1017 CG TRP A 125 11.331 5.748 4.881 1.00 0.00 C ATOM 1018 CD1 TRP A 125 11.833 6.973 5.135 1.00 0.00 C ATOM 1019 CD2 TRP A 125 11.363 5.604 3.419 1.00 0.00 C ATOM 1020 NE1 TRP A 125 12.124 7.623 3.952 1.00 0.00 N ATOM 1021 CE2 TRP A 125 11.900 6.810 2.862 1.00 0.00 C ATOM 1022 CE3 TRP A 125 10.974 4.605 2.494 1.00 0.00 C ATOM 1023 CZ2 TRP A 125 12.042 7.011 1.477 1.00 0.00 C ATOM 1024 CZ3 TRP A 125 11.118 4.790 1.104 1.00 0.00 C ATOM 1025 CH2 TRP A 125 11.652 5.986 0.596 1.00 0.00 C ATOM 0 H TRP A 125 10.061 2.566 7.399 1.00 0.00 H new ATOM 0 HA TRP A 125 11.324 3.183 4.764 1.00 0.00 H new ATOM 0 HB2 TRP A 125 9.715 4.886 5.940 1.00 0.00 H new ATOM 0 HB3 TRP A 125 11.136 5.200 6.916 1.00 0.00 H new ATOM 0 HD1 TRP A 125 11.986 7.386 6.121 1.00 0.00 H new ATOM 0 HE1 TRP A 125 12.462 8.584 3.892 1.00 0.00 H new ATOM 0 HE3 TRP A 125 10.557 3.679 2.862 1.00 0.00 H new ATOM 0 HZ2 TRP A 125 12.444 7.938 1.096 1.00 0.00 H new ATOM 0 HZ3 TRP A 125 10.816 4.007 0.425 1.00 0.00 H new ATOM 0 HH2 TRP A 125 11.763 6.118 -0.470 1.00 0.00 H new ATOM 1036 N ASP A 126 12.646 2.866 7.771 1.00 0.00 N ATOM 1037 CA ASP A 126 13.897 2.700 8.522 1.00 0.00 C ATOM 1038 C ASP A 126 14.815 1.576 8.012 1.00 0.00 C ATOM 1039 O ASP A 126 16.033 1.726 8.044 1.00 0.00 O ATOM 1040 CB ASP A 126 13.572 2.500 10.015 1.00 0.00 C ATOM 1041 CG ASP A 126 14.567 3.201 10.930 1.00 0.00 C ATOM 1042 OD1 ASP A 126 14.444 4.442 11.083 1.00 0.00 O ATOM 1043 OD2 ASP A 126 15.433 2.546 11.546 1.00 0.00 O ATOM 0 H ASP A 126 11.824 2.871 8.374 1.00 0.00 H new ATOM 0 HA ASP A 126 14.468 3.616 8.368 1.00 0.00 H new ATOM 0 HB2 ASP A 126 12.569 2.876 10.218 1.00 0.00 H new ATOM 0 HB3 ASP A 126 13.564 1.434 10.242 1.00 0.00 H new ATOM 1048 N LEU A 127 14.252 0.467 7.518 1.00 0.00 N ATOM 1049 CA LEU A 127 14.965 -0.687 6.970 1.00 0.00 C ATOM 1050 C LEU A 127 15.155 -0.513 5.461 1.00 0.00 C ATOM 1051 O LEU A 127 16.207 -0.817 4.894 1.00 0.00 O ATOM 1052 CB LEU A 127 14.154 -1.943 7.371 1.00 0.00 C ATOM 1053 CG LEU A 127 13.836 -3.034 6.330 1.00 0.00 C ATOM 1054 CD1 LEU A 127 15.092 -3.702 5.784 1.00 0.00 C ATOM 1055 CD2 LEU A 127 12.966 -4.113 6.989 1.00 0.00 C ATOM 0 H LEU A 127 13.240 0.347 7.489 1.00 0.00 H new ATOM 0 HA LEU A 127 15.974 -0.790 7.370 1.00 0.00 H new ATOM 0 HB2 LEU A 127 14.690 -2.425 8.188 1.00 0.00 H new ATOM 0 HB3 LEU A 127 13.203 -1.596 7.775 1.00 0.00 H new ATOM 0 HG LEU A 127 13.320 -2.552 5.500 1.00 0.00 H new ATOM 0 HD11 LEU A 127 14.812 -4.462 5.055 1.00 0.00 H new ATOM 0 HD12 LEU A 127 15.723 -2.954 5.304 1.00 0.00 H new ATOM 0 HD13 LEU A 127 15.641 -4.168 6.602 1.00 0.00 H new ATOM 0 HD21 LEU A 127 12.735 -4.890 6.260 1.00 0.00 H new ATOM 0 HD22 LEU A 127 13.505 -4.552 7.829 1.00 0.00 H new ATOM 0 HD23 LEU A 127 12.039 -3.665 7.347 1.00 0.00 H new ATOM 1067 N ALA A 128 14.135 0.016 4.800 1.00 0.00 N ATOM 1068 CA ALA A 128 14.223 0.417 3.402 1.00 0.00 C ATOM 1069 C ALA A 128 15.418 1.354 3.161 1.00 0.00 C ATOM 1070 O ALA A 128 16.131 1.177 2.179 1.00 0.00 O ATOM 1071 CB ALA A 128 12.900 1.044 2.966 1.00 0.00 C ATOM 0 H ALA A 128 13.220 0.180 5.219 1.00 0.00 H new ATOM 0 HA ALA A 128 14.400 -0.466 2.788 1.00 0.00 H new ATOM 0 HB1 ALA A 128 12.967 1.344 1.920 1.00 0.00 H new ATOM 0 HB2 ALA A 128 12.096 0.317 3.085 1.00 0.00 H new ATOM 0 HB3 ALA A 128 12.692 1.919 3.582 1.00 0.00 H new ATOM 1077 N LEU A 129 15.684 2.300 4.066 1.00 0.00 N ATOM 1078 CA LEU A 129 16.849 3.168 4.013 1.00 0.00 C ATOM 1079 C LEU A 129 18.136 2.355 4.039 1.00 0.00 C ATOM 1080 O LEU A 129 18.958 2.582 3.165 1.00 0.00 O ATOM 1081 CB LEU A 129 16.818 4.217 5.133 1.00 0.00 C ATOM 1082 CG LEU A 129 16.106 5.516 4.692 1.00 0.00 C ATOM 1083 CD1 LEU A 129 14.818 5.735 5.466 1.00 0.00 C ATOM 1084 CD2 LEU A 129 17.008 6.737 4.863 1.00 0.00 C ATOM 0 H LEU A 129 15.081 2.482 4.868 1.00 0.00 H new ATOM 0 HA LEU A 129 16.820 3.709 3.067 1.00 0.00 H new ATOM 0 HB2 LEU A 129 16.309 3.803 6.003 1.00 0.00 H new ATOM 0 HB3 LEU A 129 17.838 4.449 5.440 1.00 0.00 H new ATOM 0 HG LEU A 129 15.869 5.396 3.635 1.00 0.00 H new ATOM 0 HD11 LEU A 129 14.344 6.657 5.130 1.00 0.00 H new ATOM 0 HD12 LEU A 129 14.143 4.897 5.294 1.00 0.00 H new ATOM 0 HD13 LEU A 129 15.041 5.809 6.530 1.00 0.00 H new ATOM 0 HD21 LEU A 129 16.474 7.632 4.543 1.00 0.00 H new ATOM 0 HD22 LEU A 129 17.289 6.838 5.911 1.00 0.00 H new ATOM 0 HD23 LEU A 129 17.906 6.614 4.257 1.00 0.00 H new ATOM 1096 N HIS A 130 18.309 1.371 4.929 1.00 0.00 N ATOM 1097 CA HIS A 130 19.491 0.502 4.876 1.00 0.00 C ATOM 1098 C HIS A 130 19.670 -0.082 3.466 1.00 0.00 C ATOM 1099 O HIS A 130 20.786 -0.136 2.953 1.00 0.00 O ATOM 1100 CB HIS A 130 19.394 -0.623 5.925 1.00 0.00 C ATOM 1101 CG HIS A 130 20.409 -1.725 5.727 1.00 0.00 C ATOM 1102 ND1 HIS A 130 21.556 -1.917 6.454 1.00 0.00 N ATOM 1103 CD2 HIS A 130 20.415 -2.647 4.713 1.00 0.00 C ATOM 1104 CE1 HIS A 130 22.249 -2.906 5.878 1.00 0.00 C ATOM 1105 NE2 HIS A 130 21.570 -3.424 4.840 1.00 0.00 N ATOM 0 H HIS A 130 17.657 1.158 5.684 1.00 0.00 H new ATOM 0 HA HIS A 130 20.368 1.106 5.110 1.00 0.00 H new ATOM 0 HB2 HIS A 130 19.525 -0.194 6.918 1.00 0.00 H new ATOM 0 HB3 HIS A 130 18.393 -1.053 5.893 1.00 0.00 H new ATOM 0 HD2 HIS A 130 19.659 -2.754 3.949 1.00 0.00 H new ATOM 0 HE1 HIS A 130 23.222 -3.243 6.203 1.00 0.00 H new ATOM 0 HE2 HIS A 130 21.842 -4.220 4.263 1.00 0.00 H new ATOM 1113 N THR A 131 18.579 -0.540 2.848 1.00 0.00 N ATOM 1114 CA THR A 131 18.604 -1.251 1.570 1.00 0.00 C ATOM 1115 C THR A 131 19.154 -0.367 0.438 1.00 0.00 C ATOM 1116 O THR A 131 19.681 -0.885 -0.546 1.00 0.00 O ATOM 1117 CB THR A 131 17.186 -1.764 1.262 1.00 0.00 C ATOM 1118 OG1 THR A 131 16.653 -2.448 2.392 1.00 0.00 O ATOM 1119 CG2 THR A 131 17.145 -2.713 0.061 1.00 0.00 C ATOM 0 H THR A 131 17.640 -0.425 3.228 1.00 0.00 H new ATOM 0 HA THR A 131 19.283 -2.101 1.643 1.00 0.00 H new ATOM 0 HB THR A 131 16.589 -0.884 1.022 1.00 0.00 H new ATOM 0 HG1 THR A 131 16.884 -3.399 2.338 1.00 0.00 H new ATOM 0 HG21 THR A 131 16.120 -3.042 -0.108 1.00 0.00 H new ATOM 0 HG22 THR A 131 17.510 -2.194 -0.825 1.00 0.00 H new ATOM 0 HG23 THR A 131 17.776 -3.579 0.260 1.00 0.00 H new ATOM 1127 N TRP A 132 19.105 0.959 0.587 1.00 0.00 N ATOM 1128 CA TRP A 132 19.660 1.885 -0.397 1.00 0.00 C ATOM 1129 C TRP A 132 21.142 1.600 -0.589 1.00 0.00 C ATOM 1130 O TRP A 132 21.630 1.582 -1.720 1.00 0.00 O ATOM 1131 CB TRP A 132 19.458 3.356 0.020 1.00 0.00 C ATOM 1132 CG TRP A 132 20.700 4.202 0.023 1.00 0.00 C ATOM 1133 CD1 TRP A 132 21.237 4.725 -1.097 1.00 0.00 C ATOM 1134 CD2 TRP A 132 21.653 4.517 1.099 1.00 0.00 C ATOM 1135 NE1 TRP A 132 22.417 5.360 -0.797 1.00 0.00 N ATOM 1136 CE2 TRP A 132 22.703 5.305 0.544 1.00 0.00 C ATOM 1137 CE3 TRP A 132 21.751 4.246 2.482 1.00 0.00 C ATOM 1138 CZ2 TRP A 132 23.752 5.829 1.311 1.00 0.00 C ATOM 1139 CZ3 TRP A 132 22.802 4.757 3.267 1.00 0.00 C ATOM 1140 CH2 TRP A 132 23.797 5.560 2.687 1.00 0.00 C ATOM 0 H TRP A 132 18.680 1.418 1.393 1.00 0.00 H new ATOM 0 HA TRP A 132 19.128 1.733 -1.336 1.00 0.00 H new ATOM 0 HB2 TRP A 132 18.731 3.810 -0.653 1.00 0.00 H new ATOM 0 HB3 TRP A 132 19.023 3.376 1.019 1.00 0.00 H new ATOM 0 HD1 TRP A 132 20.804 4.655 -2.084 1.00 0.00 H new ATOM 0 HE1 TRP A 132 23.010 5.818 -1.489 1.00 0.00 H new ATOM 0 HE3 TRP A 132 20.998 3.629 2.950 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 24.518 6.434 0.848 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 22.843 4.530 4.322 1.00 0.00 H new ATOM 0 HH2 TRP A 132 24.591 5.967 3.295 1.00 0.00 H new ATOM 1151 N GLU A 133 21.839 1.415 0.533 1.00 0.00 N ATOM 1152 CA GLU A 133 23.290 1.401 0.600 1.00 0.00 C ATOM 1153 C GLU A 133 23.837 0.284 -0.284 1.00 0.00 C ATOM 1154 O GLU A 133 24.861 0.460 -0.948 1.00 0.00 O ATOM 1155 CB GLU A 133 23.729 1.242 2.065 1.00 0.00 C ATOM 1156 CG GLU A 133 25.068 1.939 2.360 1.00 0.00 C ATOM 1157 CD GLU A 133 26.213 1.017 2.779 1.00 0.00 C ATOM 1158 OE1 GLU A 133 26.407 -0.078 2.210 1.00 0.00 O ATOM 1159 OE2 GLU A 133 27.036 1.445 3.627 1.00 0.00 O ATOM 0 H GLU A 133 21.394 1.268 1.439 1.00 0.00 H new ATOM 0 HA GLU A 133 23.694 2.342 0.227 1.00 0.00 H new ATOM 0 HB2 GLU A 133 22.959 1.652 2.718 1.00 0.00 H new ATOM 0 HB3 GLU A 133 23.816 0.181 2.301 1.00 0.00 H new ATOM 0 HG2 GLU A 133 25.375 2.489 1.470 1.00 0.00 H new ATOM 0 HG3 GLU A 133 24.909 2.673 3.150 1.00 0.00 H new ATOM 1166 N GLN A 134 23.078 -0.815 -0.355 1.00 0.00 N ATOM 1167 CA GLN A 134 23.307 -1.974 -1.195 1.00 0.00 C ATOM 1168 C GLN A 134 23.362 -1.571 -2.672 1.00 0.00 C ATOM 1169 O GLN A 134 24.293 -2.003 -3.351 1.00 0.00 O ATOM 1170 CB GLN A 134 22.213 -3.037 -0.962 1.00 0.00 C ATOM 1171 CG GLN A 134 21.944 -3.408 0.510 1.00 0.00 C ATOM 1172 CD GLN A 134 23.131 -4.077 1.198 1.00 0.00 C ATOM 1173 OE1 GLN A 134 23.909 -3.430 1.895 1.00 0.00 O ATOM 1174 NE2 GLN A 134 23.306 -5.377 1.020 1.00 0.00 N ATOM 0 H GLN A 134 22.236 -0.915 0.212 1.00 0.00 H new ATOM 0 HA GLN A 134 24.270 -2.407 -0.924 1.00 0.00 H new ATOM 0 HB2 GLN A 134 21.283 -2.677 -1.403 1.00 0.00 H new ATOM 0 HB3 GLN A 134 22.492 -3.943 -1.501 1.00 0.00 H new ATOM 0 HG2 GLN A 134 21.677 -2.506 1.060 1.00 0.00 H new ATOM 0 HG3 GLN A 134 21.084 -4.076 0.556 1.00 0.00 H new ATOM 0 HE21 GLN A 134 22.654 -5.905 0.439 1.00 0.00 H new ATOM 0 HE22 GLN A 134 24.093 -5.851 1.464 1.00 0.00 H new ATOM 1183 N MET A 135 22.402 -0.776 -3.176 1.00 0.00 N ATOM 1184 CA MET A 135 22.391 -0.380 -4.589 1.00 0.00 C ATOM 1185 C MET A 135 23.301 0.821 -4.867 1.00 0.00 C ATOM 1186 O MET A 135 23.877 0.909 -5.948 1.00 0.00 O ATOM 1187 CB MET A 135 20.966 -0.074 -5.068 1.00 0.00 C ATOM 1188 CG MET A 135 20.026 -1.258 -4.865 1.00 0.00 C ATOM 1189 SD MET A 135 18.807 -1.553 -6.179 1.00 0.00 S ATOM 1190 CE MET A 135 17.834 -0.037 -6.108 1.00 0.00 C ATOM 0 H MET A 135 21.629 -0.399 -2.627 1.00 0.00 H new ATOM 0 HA MET A 135 22.781 -1.230 -5.148 1.00 0.00 H new ATOM 0 HB2 MET A 135 20.581 0.791 -4.528 1.00 0.00 H new ATOM 0 HB3 MET A 135 20.989 0.193 -6.124 1.00 0.00 H new ATOM 0 HG2 MET A 135 20.630 -2.158 -4.750 1.00 0.00 H new ATOM 0 HG3 MET A 135 19.490 -1.112 -3.927 1.00 0.00 H new ATOM 0 HE1 MET A 135 16.794 -0.261 -6.347 1.00 0.00 H new ATOM 0 HE2 MET A 135 17.893 0.387 -5.105 1.00 0.00 H new ATOM 0 HE3 MET A 135 18.226 0.681 -6.829 1.00 0.00 H new ATOM 1200 N GLY A 136 23.478 1.735 -3.907 1.00 0.00 N ATOM 1201 CA GLY A 136 24.341 2.904 -4.074 1.00 0.00 C ATOM 1202 C GLY A 136 23.637 4.140 -4.644 1.00 0.00 C ATOM 1203 O GLY A 136 24.309 5.047 -5.140 1.00 0.00 O ATOM 0 H GLY A 136 23.026 1.683 -2.994 1.00 0.00 H new ATOM 0 HA2 GLY A 136 24.773 3.162 -3.107 1.00 0.00 H new ATOM 0 HA3 GLY A 136 25.168 2.638 -4.732 1.00 0.00 H new ATOM 1207 N LEU A 137 22.300 4.209 -4.600 1.00 0.00 N ATOM 1208 CA LEU A 137 21.556 5.369 -5.099 1.00 0.00 C ATOM 1209 C LEU A 137 21.584 6.485 -4.061 1.00 0.00 C ATOM 1210 O LEU A 137 20.624 6.655 -3.307 1.00 0.00 O ATOM 1211 CB LEU A 137 20.096 5.022 -5.457 1.00 0.00 C ATOM 1212 CG LEU A 137 19.818 4.234 -6.742 1.00 0.00 C ATOM 1213 CD1 LEU A 137 20.570 4.774 -7.957 1.00 0.00 C ATOM 1214 CD2 LEU A 137 20.107 2.754 -6.562 1.00 0.00 C ATOM 0 H LEU A 137 21.710 3.469 -4.221 1.00 0.00 H new ATOM 0 HA LEU A 137 22.044 5.699 -6.016 1.00 0.00 H new ATOM 0 HB2 LEU A 137 19.678 4.455 -4.625 1.00 0.00 H new ATOM 0 HB3 LEU A 137 19.540 5.957 -5.517 1.00 0.00 H new ATOM 0 HG LEU A 137 18.754 4.366 -6.941 1.00 0.00 H new ATOM 0 HD11 LEU A 137 20.328 4.171 -8.832 1.00 0.00 H new ATOM 0 HD12 LEU A 137 20.276 5.808 -8.137 1.00 0.00 H new ATOM 0 HD13 LEU A 137 21.643 4.729 -7.770 1.00 0.00 H new ATOM 0 HD21 LEU A 137 19.899 2.227 -7.493 1.00 0.00 H new ATOM 0 HD22 LEU A 137 21.155 2.618 -6.294 1.00 0.00 H new ATOM 0 HD23 LEU A 137 19.475 2.354 -5.769 1.00 0.00 H new ATOM 1226 N ARG A 138 22.673 7.254 -4.018 1.00 0.00 N ATOM 1227 CA ARG A 138 22.913 8.285 -3.019 1.00 0.00 C ATOM 1228 C ARG A 138 21.686 9.160 -2.790 1.00 0.00 C ATOM 1229 O ARG A 138 21.272 9.347 -1.645 1.00 0.00 O ATOM 1230 CB ARG A 138 24.105 9.131 -3.473 1.00 0.00 C ATOM 1231 CG ARG A 138 24.703 9.987 -2.355 1.00 0.00 C ATOM 1232 CD ARG A 138 25.675 10.966 -3.022 1.00 0.00 C ATOM 1233 NE ARG A 138 26.615 11.574 -2.071 1.00 0.00 N ATOM 1234 CZ ARG A 138 26.328 12.395 -1.057 1.00 0.00 C ATOM 1235 NH1 ARG A 138 25.103 12.859 -0.850 1.00 0.00 N ATOM 1236 NH2 ARG A 138 27.304 12.758 -0.238 1.00 0.00 N ATOM 0 H ARG A 138 23.430 7.171 -4.697 1.00 0.00 H new ATOM 0 HA ARG A 138 23.132 7.806 -2.065 1.00 0.00 H new ATOM 0 HB2 ARG A 138 24.878 8.473 -3.870 1.00 0.00 H new ATOM 0 HB3 ARG A 138 23.790 9.781 -4.289 1.00 0.00 H new ATOM 0 HG2 ARG A 138 23.921 10.524 -1.818 1.00 0.00 H new ATOM 0 HG3 ARG A 138 25.221 9.364 -1.626 1.00 0.00 H new ATOM 0 HD2 ARG A 138 26.236 10.442 -3.796 1.00 0.00 H new ATOM 0 HD3 ARG A 138 25.107 11.753 -3.518 1.00 0.00 H new ATOM 0 HE ARG A 138 27.600 11.343 -2.200 1.00 0.00 H new ATOM 0 HH11 ARG A 138 24.343 12.590 -1.476 1.00 0.00 H new ATOM 0 HH12 ARG A 138 24.920 13.484 -0.065 1.00 0.00 H new ATOM 0 HH21 ARG A 138 28.251 12.411 -0.388 1.00 0.00 H new ATOM 0 HH22 ARG A 138 27.108 13.384 0.543 1.00 0.00 H new ATOM 1250 N SER A 139 21.084 9.665 -3.868 1.00 0.00 N ATOM 1251 CA SER A 139 19.967 10.589 -3.796 1.00 0.00 C ATOM 1252 C SER A 139 18.754 10.031 -3.067 1.00 0.00 C ATOM 1253 O SER A 139 17.987 10.818 -2.528 1.00 0.00 O ATOM 1254 CB SER A 139 19.574 11.048 -5.201 1.00 0.00 C ATOM 1255 OG SER A 139 20.624 11.838 -5.725 1.00 0.00 O ATOM 0 H SER A 139 21.366 9.438 -4.822 1.00 0.00 H new ATOM 0 HA SER A 139 20.311 11.438 -3.205 1.00 0.00 H new ATOM 0 HB2 SER A 139 19.391 10.187 -5.844 1.00 0.00 H new ATOM 0 HB3 SER A 139 18.648 11.623 -5.167 1.00 0.00 H new ATOM 0 HG SER A 139 20.388 12.139 -6.627 1.00 0.00 H new ATOM 1261 N LEU A 140 18.563 8.714 -3.006 1.00 0.00 N ATOM 1262 CA LEU A 140 17.379 8.130 -2.385 1.00 0.00 C ATOM 1263 C LEU A 140 17.475 8.289 -0.877 1.00 0.00 C ATOM 1264 O LEU A 140 16.518 8.715 -0.228 1.00 0.00 O ATOM 1265 CB LEU A 140 17.256 6.649 -2.773 1.00 0.00 C ATOM 1266 CG LEU A 140 16.607 6.405 -4.143 1.00 0.00 C ATOM 1267 CD1 LEU A 140 15.090 6.598 -4.086 1.00 0.00 C ATOM 1268 CD2 LEU A 140 17.119 7.295 -5.276 1.00 0.00 C ATOM 0 H LEU A 140 19.219 8.029 -3.382 1.00 0.00 H new ATOM 0 HA LEU A 140 16.486 8.646 -2.738 1.00 0.00 H new ATOM 0 HB2 LEU A 140 18.250 6.201 -2.770 1.00 0.00 H new ATOM 0 HB3 LEU A 140 16.672 6.133 -2.011 1.00 0.00 H new ATOM 0 HG LEU A 140 16.885 5.375 -4.367 1.00 0.00 H new ATOM 0 HD11 LEU A 140 14.663 6.418 -5.072 1.00 0.00 H new ATOM 0 HD12 LEU A 140 14.661 5.896 -3.371 1.00 0.00 H new ATOM 0 HD13 LEU A 140 14.864 7.618 -3.774 1.00 0.00 H new ATOM 0 HD21 LEU A 140 16.598 7.044 -6.200 1.00 0.00 H new ATOM 0 HD22 LEU A 140 16.935 8.341 -5.029 1.00 0.00 H new ATOM 0 HD23 LEU A 140 18.189 7.136 -5.408 1.00 0.00 H new ATOM 1280 N CYS A 141 18.634 7.952 -0.318 1.00 0.00 N ATOM 1281 CA CYS A 141 18.916 8.136 1.097 1.00 0.00 C ATOM 1282 C CYS A 141 19.038 9.614 1.446 1.00 0.00 C ATOM 1283 O CYS A 141 18.535 10.041 2.487 1.00 0.00 O ATOM 1284 CB CYS A 141 20.203 7.394 1.418 1.00 0.00 C ATOM 1285 SG CYS A 141 20.472 7.289 3.199 1.00 0.00 S ATOM 0 H CYS A 141 19.408 7.541 -0.841 1.00 0.00 H new ATOM 0 HA CYS A 141 18.095 7.738 1.693 1.00 0.00 H new ATOM 0 HB2 CYS A 141 20.162 6.391 0.994 1.00 0.00 H new ATOM 0 HB3 CYS A 141 21.045 7.903 0.950 1.00 0.00 H new ATOM 0 HG CYS A 141 21.208 6.251 3.466 1.00 0.00 H new ATOM 1291 N ALA A 142 19.700 10.379 0.573 1.00 0.00 N ATOM 1292 CA ALA A 142 19.900 11.804 0.743 1.00 0.00 C ATOM 1293 C ALA A 142 18.538 12.504 0.785 1.00 0.00 C ATOM 1294 O ALA A 142 18.177 13.037 1.826 1.00 0.00 O ATOM 1295 CB ALA A 142 20.837 12.328 -0.349 1.00 0.00 C ATOM 0 H ALA A 142 20.115 10.010 -0.283 1.00 0.00 H new ATOM 0 HA ALA A 142 20.391 12.022 1.692 1.00 0.00 H new ATOM 0 HB1 ALA A 142 20.985 13.400 -0.218 1.00 0.00 H new ATOM 0 HB2 ALA A 142 21.798 11.818 -0.280 1.00 0.00 H new ATOM 0 HB3 ALA A 142 20.396 12.140 -1.328 1.00 0.00 H new ATOM 1301 N GLN A 143 17.725 12.443 -0.275 1.00 0.00 N ATOM 1302 CA GLN A 143 16.388 13.034 -0.284 1.00 0.00 C ATOM 1303 C GLN A 143 15.475 12.441 0.788 1.00 0.00 C ATOM 1304 O GLN A 143 14.525 13.104 1.189 1.00 0.00 O ATOM 1305 CB GLN A 143 15.718 12.908 -1.666 1.00 0.00 C ATOM 1306 CG GLN A 143 16.172 14.016 -2.631 1.00 0.00 C ATOM 1307 CD GLN A 143 15.501 15.371 -2.344 1.00 0.00 C ATOM 1308 OE1 GLN A 143 14.702 15.520 -1.420 1.00 0.00 O ATOM 1309 NE2 GLN A 143 15.776 16.392 -3.136 1.00 0.00 N ATOM 0 H GLN A 143 17.978 11.982 -1.149 1.00 0.00 H new ATOM 0 HA GLN A 143 16.530 14.090 -0.056 1.00 0.00 H new ATOM 0 HB2 GLN A 143 15.954 11.934 -2.096 1.00 0.00 H new ATOM 0 HB3 GLN A 143 14.635 12.951 -1.549 1.00 0.00 H new ATOM 0 HG2 GLN A 143 17.254 14.130 -2.562 1.00 0.00 H new ATOM 0 HG3 GLN A 143 15.948 13.714 -3.654 1.00 0.00 H new ATOM 0 HE21 GLN A 143 16.437 16.278 -3.904 1.00 0.00 H new ATOM 0 HE22 GLN A 143 15.327 17.294 -2.979 1.00 0.00 H new ATOM 1318 N ALA A 144 15.708 11.224 1.285 1.00 0.00 N ATOM 1319 CA ALA A 144 14.939 10.702 2.411 1.00 0.00 C ATOM 1320 C ALA A 144 15.277 11.421 3.723 1.00 0.00 C ATOM 1321 O ALA A 144 14.595 11.166 4.713 1.00 0.00 O ATOM 1322 CB ALA A 144 15.151 9.190 2.537 1.00 0.00 C ATOM 0 H ALA A 144 16.419 10.587 0.926 1.00 0.00 H new ATOM 0 HA ALA A 144 13.884 10.893 2.213 1.00 0.00 H new ATOM 0 HB1 ALA A 144 14.573 8.811 3.380 1.00 0.00 H new ATOM 0 HB2 ALA A 144 14.822 8.699 1.621 1.00 0.00 H new ATOM 0 HB3 ALA A 144 16.209 8.983 2.700 1.00 0.00 H new ATOM 1328 N GLN A 145 16.323 12.256 3.773 1.00 0.00 N ATOM 1329 CA GLN A 145 16.913 12.791 4.997 1.00 0.00 C ATOM 1330 C GLN A 145 17.417 14.229 4.783 1.00 0.00 C ATOM 1331 O GLN A 145 18.294 14.708 5.504 1.00 0.00 O ATOM 1332 CB GLN A 145 18.026 11.845 5.470 1.00 0.00 C ATOM 1333 CG GLN A 145 17.450 10.494 5.920 1.00 0.00 C ATOM 1334 CD GLN A 145 18.516 9.617 6.538 1.00 0.00 C ATOM 1335 OE1 GLN A 145 18.541 9.405 7.740 1.00 0.00 O ATOM 1336 NE2 GLN A 145 19.433 9.121 5.726 1.00 0.00 N ATOM 0 H GLN A 145 16.795 12.586 2.931 1.00 0.00 H new ATOM 0 HA GLN A 145 16.155 12.847 5.779 1.00 0.00 H new ATOM 0 HB2 GLN A 145 18.741 11.688 4.663 1.00 0.00 H new ATOM 0 HB3 GLN A 145 18.572 12.304 6.295 1.00 0.00 H new ATOM 0 HG2 GLN A 145 16.650 10.660 6.642 1.00 0.00 H new ATOM 0 HG3 GLN A 145 17.007 9.983 5.065 1.00 0.00 H new ATOM 0 HE21 GLN A 145 19.387 9.315 4.726 1.00 0.00 H new ATOM 0 HE22 GLN A 145 20.187 8.544 6.100 1.00 0.00 H new ATOM 1345 N GLU A 146 16.900 14.906 3.756 1.00 0.00 N ATOM 1346 CA GLU A 146 17.231 16.251 3.336 1.00 0.00 C ATOM 1347 C GLU A 146 15.927 16.888 2.858 1.00 0.00 C ATOM 1348 O GLU A 146 15.601 16.823 1.672 1.00 0.00 O ATOM 1349 CB GLU A 146 18.274 16.203 2.203 1.00 0.00 C ATOM 1350 CG GLU A 146 19.645 15.732 2.695 1.00 0.00 C ATOM 1351 CD GLU A 146 20.784 15.987 1.700 1.00 0.00 C ATOM 1352 OE1 GLU A 146 20.586 15.926 0.464 1.00 0.00 O ATOM 1353 OE2 GLU A 146 21.921 16.223 2.175 1.00 0.00 O ATOM 0 H GLU A 146 16.187 14.489 3.158 1.00 0.00 H new ATOM 0 HA GLU A 146 17.665 16.834 4.148 1.00 0.00 H new ATOM 0 HB2 GLU A 146 17.923 15.534 1.417 1.00 0.00 H new ATOM 0 HB3 GLU A 146 18.371 17.194 1.759 1.00 0.00 H new ATOM 0 HG2 GLU A 146 19.876 16.236 3.633 1.00 0.00 H new ATOM 0 HG3 GLU A 146 19.596 14.665 2.910 1.00 0.00 H new ATOM 1360 N GLY A 147 15.134 17.450 3.772 1.00 0.00 N ATOM 1361 CA GLY A 147 13.876 18.134 3.464 1.00 0.00 C ATOM 1362 C GLY A 147 12.711 17.182 3.170 1.00 0.00 C ATOM 1363 O GLY A 147 11.588 17.449 3.601 1.00 0.00 O ATOM 0 H GLY A 147 15.353 17.442 4.768 1.00 0.00 H new ATOM 0 HA2 GLY A 147 13.607 18.775 4.304 1.00 0.00 H new ATOM 0 HA3 GLY A 147 14.028 18.784 2.603 1.00 0.00 H new ATOM 1367 N ALA A 148 12.979 16.060 2.491 1.00 0.00 N ATOM 1368 CA ALA A 148 12.060 14.964 2.200 1.00 0.00 C ATOM 1369 C ALA A 148 10.790 15.377 1.448 1.00 0.00 C ATOM 1370 O ALA A 148 9.733 14.751 1.598 1.00 0.00 O ATOM 1371 CB ALA A 148 11.810 14.140 3.468 1.00 0.00 C ATOM 0 H ALA A 148 13.908 15.887 2.106 1.00 0.00 H new ATOM 0 HA ALA A 148 12.549 14.312 1.476 1.00 0.00 H new ATOM 0 HB1 ALA A 148 11.123 13.324 3.242 1.00 0.00 H new ATOM 0 HB2 ALA A 148 12.754 13.731 3.828 1.00 0.00 H new ATOM 0 HB3 ALA A 148 11.375 14.778 4.237 1.00 0.00 H new ATOM 1377 N GLY A 149 10.885 16.389 0.592 1.00 0.00 N ATOM 1378 CA GLY A 149 9.780 16.935 -0.172 1.00 0.00 C ATOM 1379 C GLY A 149 9.345 18.244 0.461 1.00 0.00 C ATOM 1380 O GLY A 149 10.071 18.808 1.283 1.00 0.00 O ATOM 0 H GLY A 149 11.768 16.866 0.408 1.00 0.00 H new ATOM 0 HA2 GLY A 149 10.081 17.098 -1.207 1.00 0.00 H new ATOM 0 HA3 GLY A 149 8.949 16.230 -0.189 1.00 0.00 H new ATOM 1384 N HIS A 150 8.173 18.730 0.057 1.00 0.00 N ATOM 1385 CA HIS A 150 7.399 19.758 0.735 1.00 0.00 C ATOM 1386 C HIS A 150 5.976 19.660 0.177 1.00 0.00 C ATOM 1387 O HIS A 150 5.706 20.114 -0.940 1.00 0.00 O ATOM 1388 CB HIS A 150 8.029 21.153 0.544 1.00 0.00 C ATOM 1389 CG HIS A 150 8.858 21.689 1.703 1.00 0.00 C ATOM 1390 ND1 HIS A 150 9.411 22.951 1.771 1.00 0.00 N ATOM 1391 CD2 HIS A 150 9.217 21.040 2.858 1.00 0.00 C ATOM 1392 CE1 HIS A 150 10.094 23.051 2.924 1.00 0.00 C ATOM 1393 NE2 HIS A 150 10.007 21.906 3.623 1.00 0.00 N ATOM 0 H HIS A 150 7.719 18.399 -0.794 1.00 0.00 H new ATOM 0 HA HIS A 150 7.386 19.607 1.814 1.00 0.00 H new ATOM 0 HB2 HIS A 150 8.662 21.123 -0.343 1.00 0.00 H new ATOM 0 HB3 HIS A 150 7.228 21.864 0.340 1.00 0.00 H new ATOM 0 HD2 HIS A 150 8.938 20.033 3.130 1.00 0.00 H new ATOM 0 HE1 HIS A 150 10.637 23.928 3.244 1.00 0.00 H new ATOM 0 HE2 HIS A 150 10.432 21.708 4.529 1.00 0.00 H new ATOM 1401 N SER A 151 5.096 19.008 0.944 1.00 0.00 N ATOM 1402 CA SER A 151 3.733 18.592 0.620 1.00 0.00 C ATOM 1403 C SER A 151 3.664 17.633 -0.575 1.00 0.00 C ATOM 1404 O SER A 151 3.409 16.445 -0.371 1.00 0.00 O ATOM 1405 CB SER A 151 2.798 19.806 0.500 1.00 0.00 C ATOM 1406 OG SER A 151 1.454 19.399 0.661 1.00 0.00 O ATOM 0 H SER A 151 5.346 18.734 1.894 1.00 0.00 H new ATOM 0 HA SER A 151 3.365 18.000 1.458 1.00 0.00 H new ATOM 0 HB2 SER A 151 3.055 20.549 1.255 1.00 0.00 H new ATOM 0 HB3 SER A 151 2.929 20.281 -0.472 1.00 0.00 H new ATOM 0 HG SER A 151 0.865 20.178 0.585 1.00 0.00 H new TER 1412 SER A 151