USER MOD reduce.3.24.130724 H: found=0, std=0, add=1063, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1058 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 114 MET CE :methyl 165:sc= 0 (180deg=-0.149) USER MOD Set 1.2: A 115 THR OG1 : rot 72:sc= 0.797 USER MOD Set 2.1: A 60 CYS SG : rot 180:sc= -0.431 USER MOD Set 2.2: A 88 THR OG1 : rot -82:sc= 0.00114 USER MOD Set 3.1: A 54 THR OG1 : rot -114:sc= 1.49 USER MOD Set 3.2: A 56 THR OG1 : rot 80:sc= 1.28 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0.0502 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot -50:sc= -0.179 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -97:sc= 0.468 USER MOD Single : A 38 HIS : no HD1:sc= -1.59 K(o=-1.6,f=-2.2) USER MOD Single : A 45 THR OG1 : rot 100:sc= 1.2 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot 76:sc= 0.424 USER MOD Single : A 49 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0024) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 GLN : amide:sc= -0.661 K(o=-0.66,f=0) USER MOD Single : A 69 CYS SG : rot -68:sc= 0.613 USER MOD Single : A 73 CYS SG : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 151:sc= 0.281 USER MOD Single : A 77 ASN : amide:sc= -1.84 K(o=-1.8,f=-4.3!) USER MOD Single : A 87 GLN : amide:sc= 0.139 X(o=0.14,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -0.306 K(o=-0.31,f=-5.2!) USER MOD Single : A 102 ASN : amide:sc= -1.19 K(o=-1.2,f=-3.1!) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc=0.000171 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 119 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ -155:sc= -0.0542 (180deg=-0.386) USER MOD Single : A 122 GLN : amide:sc= -0.927 K(o=-0.93,f=-2!) USER MOD Single : A 123 THR OG1 : rot -150:sc= -0.953 USER MOD Single : A 134 CYS SG : rot -10:sc= 0.0106 USER MOD Single : A 136 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 4.276 7.120 1.309 1.00 1.12 N ATOM 2 CA ALA A 1 3.822 6.173 0.298 1.00 0.51 C ATOM 3 C ALA A 1 4.974 5.308 -0.201 1.00 44.40 C ATOM 4 O ALA A 1 5.996 5.821 -0.656 1.00 24.35 O ATOM 5 CB ALA A 1 3.173 6.912 -0.863 1.00 12.31 C ATOM 0 H1 ALA A 1 3.472 7.696 1.631 1.00 1.12 H new ATOM 0 H2 ALA A 1 4.676 6.601 2.117 1.00 1.12 H new ATOM 0 H3 ALA A 1 5.005 7.740 0.901 1.00 1.12 H new ATOM 0 HA ALA A 1 3.082 5.517 0.756 1.00 0.51 H new ATOM 0 HB1 ALA A 1 2.839 6.193 -1.611 1.00 12.31 H new ATOM 0 HB2 ALA A 1 2.318 7.482 -0.499 1.00 12.31 H new ATOM 0 HB3 ALA A 1 3.897 7.592 -1.312 1.00 12.31 H new ATOM 11 N GLY A 2 4.802 3.993 -0.112 1.00 65.14 N ATOM 12 CA GLY A 2 5.837 3.078 -0.558 1.00 60.12 C ATOM 13 C GLY A 2 5.586 1.653 -0.105 1.00 54.42 C ATOM 14 O GLY A 2 4.881 1.422 0.878 1.00 22.01 O ATOM 0 H GLY A 2 3.965 3.545 0.261 1.00 65.14 H new ATOM 0 HA2 GLY A 2 5.897 3.105 -1.646 1.00 60.12 H new ATOM 0 HA3 GLY A 2 6.802 3.412 -0.177 1.00 60.12 H new ATOM 18 N HIS A 3 6.161 0.695 -0.824 1.00 42.03 N ATOM 19 CA HIS A 3 5.995 -0.715 -0.491 1.00 71.32 C ATOM 20 C HIS A 3 7.325 -1.335 -0.072 1.00 74.14 C ATOM 21 O HIS A 3 7.366 -2.217 0.784 1.00 23.44 O ATOM 22 CB HIS A 3 5.416 -1.478 -1.683 1.00 44.15 C ATOM 23 CG HIS A 3 4.914 -2.845 -1.333 1.00 52.45 C ATOM 24 ND1 HIS A 3 3.608 -3.096 -0.970 1.00 14.12 N ATOM 25 CD2 HIS A 3 5.550 -4.039 -1.295 1.00 11.22 C ATOM 26 CE1 HIS A 3 3.463 -4.385 -0.721 1.00 35.12 C ATOM 27 NE2 HIS A 3 4.626 -4.980 -0.911 1.00 44.11 N ATOM 0 H HIS A 3 6.746 0.869 -1.641 1.00 42.03 H new ATOM 0 HA HIS A 3 5.302 -0.785 0.347 1.00 71.32 H new ATOM 0 HB2 HIS A 3 4.599 -0.899 -2.112 1.00 44.15 H new ATOM 0 HB3 HIS A 3 6.182 -1.567 -2.453 1.00 44.15 H new ATOM 0 HD2 HIS A 3 6.590 -4.218 -1.524 1.00 11.22 H new ATOM 0 HE1 HIS A 3 2.548 -4.870 -0.414 1.00 35.12 H new ATOM 0 HE2 HIS A 3 4.809 -5.976 -0.792 1.00 44.11 H new ATOM 35 N MET A 4 8.408 -0.868 -0.683 1.00 43.33 N ATOM 36 CA MET A 4 9.739 -1.376 -0.373 1.00 24.30 C ATOM 37 C MET A 4 10.450 -0.468 0.625 1.00 15.43 C ATOM 38 O MET A 4 11.679 -0.421 0.672 1.00 51.54 O ATOM 39 CB MET A 4 10.572 -1.500 -1.650 1.00 42.54 C ATOM 40 CG MET A 4 10.656 -0.208 -2.448 1.00 22.30 C ATOM 41 SD MET A 4 12.353 0.352 -2.686 1.00 64.23 S ATOM 42 CE MET A 4 12.087 2.075 -3.096 1.00 71.00 C ATOM 0 H MET A 4 8.390 -0.139 -1.396 1.00 43.33 H new ATOM 0 HA MET A 4 9.627 -2.363 0.077 1.00 24.30 H new ATOM 0 HB2 MET A 4 11.580 -1.821 -1.387 1.00 42.54 H new ATOM 0 HB3 MET A 4 10.143 -2.279 -2.280 1.00 42.54 H new ATOM 0 HG2 MET A 4 10.186 -0.355 -3.421 1.00 22.30 H new ATOM 0 HG3 MET A 4 10.090 0.569 -1.935 1.00 22.30 H new ATOM 0 HE1 MET A 4 13.047 2.560 -3.272 1.00 71.00 H new ATOM 0 HE2 MET A 4 11.475 2.145 -3.995 1.00 71.00 H new ATOM 0 HE3 MET A 4 11.576 2.571 -2.270 1.00 71.00 H new ATOM 52 N VAL A 5 9.668 0.253 1.423 1.00 53.42 N ATOM 53 CA VAL A 5 10.222 1.160 2.421 1.00 41.22 C ATOM 54 C VAL A 5 9.500 1.016 3.756 1.00 62.02 C ATOM 55 O VAL A 5 8.656 1.833 4.125 1.00 61.22 O ATOM 56 CB VAL A 5 10.134 2.627 1.958 1.00 74.54 C ATOM 57 CG1 VAL A 5 8.709 2.973 1.552 1.00 43.34 C ATOM 58 CG2 VAL A 5 10.627 3.561 3.052 1.00 45.14 C ATOM 0 H VAL A 5 8.649 0.226 1.397 1.00 53.42 H new ATOM 0 HA VAL A 5 11.270 0.889 2.547 1.00 41.22 H new ATOM 0 HB VAL A 5 10.776 2.755 1.087 1.00 74.54 H new ATOM 0 HG11 VAL A 5 8.665 4.013 1.228 1.00 43.34 H new ATOM 0 HG12 VAL A 5 8.396 2.324 0.734 1.00 43.34 H new ATOM 0 HG13 VAL A 5 8.043 2.830 2.403 1.00 43.34 H new ATOM 0 HG21 VAL A 5 10.558 4.593 2.708 1.00 45.14 H new ATOM 0 HG22 VAL A 5 10.013 3.434 3.943 1.00 45.14 H new ATOM 0 HG23 VAL A 5 11.665 3.327 3.290 1.00 45.14 H new ATOM 68 N PRO A 6 9.839 -0.048 4.499 1.00 14.25 N ATOM 69 CA PRO A 6 9.235 -0.324 5.807 1.00 60.15 C ATOM 70 C PRO A 6 9.669 0.680 6.869 1.00 33.22 C ATOM 71 O PRO A 6 10.645 1.407 6.688 1.00 42.24 O ATOM 72 CB PRO A 6 9.755 -1.723 6.149 1.00 54.25 C ATOM 73 CG PRO A 6 11.030 -1.850 5.389 1.00 53.55 C ATOM 74 CD PRO A 6 10.837 -1.062 4.122 1.00 72.31 C ATOM 0 HA PRO A 6 8.148 -0.254 5.777 1.00 60.15 H new ATOM 0 HB2 PRO A 6 9.920 -1.833 7.221 1.00 54.25 H new ATOM 0 HB3 PRO A 6 9.041 -2.493 5.856 1.00 54.25 H new ATOM 0 HG2 PRO A 6 11.869 -1.461 5.966 1.00 53.55 H new ATOM 0 HG3 PRO A 6 11.251 -2.894 5.169 1.00 53.55 H new ATOM 0 HD2 PRO A 6 11.768 -0.604 3.788 1.00 72.31 H new ATOM 0 HD3 PRO A 6 10.481 -1.692 3.307 1.00 72.31 H new ATOM 82 N ARG A 7 8.937 0.714 7.978 1.00 21.32 N ATOM 83 CA ARG A 7 9.246 1.629 9.070 1.00 43.33 C ATOM 84 C ARG A 7 8.635 1.140 10.379 1.00 11.24 C ATOM 85 O ARG A 7 7.415 1.141 10.546 1.00 61.43 O ATOM 86 CB ARG A 7 8.732 3.033 8.747 1.00 14.43 C ATOM 87 CG ARG A 7 9.622 4.145 9.278 1.00 50.24 C ATOM 88 CD ARG A 7 8.840 5.433 9.487 1.00 23.45 C ATOM 89 NE ARG A 7 8.852 6.280 8.298 1.00 1.22 N ATOM 90 CZ ARG A 7 8.592 7.583 8.321 1.00 32.44 C ATOM 91 NH1 ARG A 7 8.301 8.184 9.467 1.00 64.31 N ATOM 92 NH2 ARG A 7 8.622 8.287 7.197 1.00 23.41 N ATOM 0 H ARG A 7 8.126 0.118 8.144 1.00 21.32 H new ATOM 0 HA ARG A 7 10.329 1.664 9.186 1.00 43.33 H new ATOM 0 HB2 ARG A 7 8.641 3.137 7.666 1.00 14.43 H new ATOM 0 HB3 ARG A 7 7.732 3.149 9.164 1.00 14.43 H new ATOM 0 HG2 ARG A 7 10.071 3.834 10.221 1.00 50.24 H new ATOM 0 HG3 ARG A 7 10.439 4.324 8.579 1.00 50.24 H new ATOM 0 HD2 ARG A 7 7.810 5.193 9.750 1.00 23.45 H new ATOM 0 HD3 ARG A 7 9.264 5.982 10.328 1.00 23.45 H new ATOM 0 HE ARG A 7 9.072 5.848 7.401 1.00 1.22 H new ATOM 0 HH11 ARG A 7 8.276 7.646 10.333 1.00 64.31 H new ATOM 0 HH12 ARG A 7 8.102 9.184 9.482 1.00 64.31 H new ATOM 0 HH21 ARG A 7 8.845 7.828 6.314 1.00 23.41 H new ATOM 0 HH22 ARG A 7 8.422 9.287 7.216 1.00 23.41 H new ATOM 106 N VAL A 8 9.491 0.723 11.307 1.00 70.33 N ATOM 107 CA VAL A 8 9.036 0.231 12.602 1.00 53.33 C ATOM 108 C VAL A 8 8.216 1.288 13.333 1.00 15.10 C ATOM 109 O VAL A 8 8.611 2.451 13.412 1.00 64.41 O ATOM 110 CB VAL A 8 10.221 -0.189 13.491 1.00 41.21 C ATOM 111 CG1 VAL A 8 11.193 0.968 13.667 1.00 61.00 C ATOM 112 CG2 VAL A 8 9.724 -0.688 14.839 1.00 24.41 C ATOM 0 H VAL A 8 10.504 0.716 11.186 1.00 70.33 H new ATOM 0 HA VAL A 8 8.411 -0.641 12.408 1.00 53.33 H new ATOM 0 HB VAL A 8 10.750 -1.005 12.999 1.00 41.21 H new ATOM 0 HG11 VAL A 8 12.024 0.652 14.298 1.00 61.00 H new ATOM 0 HG12 VAL A 8 11.574 1.275 12.693 1.00 61.00 H new ATOM 0 HG13 VAL A 8 10.679 1.807 14.136 1.00 61.00 H new ATOM 0 HG21 VAL A 8 10.574 -0.981 15.455 1.00 24.41 H new ATOM 0 HG22 VAL A 8 9.170 0.106 15.339 1.00 24.41 H new ATOM 0 HG23 VAL A 8 9.071 -1.548 14.690 1.00 24.41 H new ATOM 122 N MET A 9 7.071 0.876 13.867 1.00 75.40 N ATOM 123 CA MET A 9 6.195 1.787 14.594 1.00 14.10 C ATOM 124 C MET A 9 6.270 1.531 16.096 1.00 53.01 C ATOM 125 O MET A 9 6.443 2.460 16.885 1.00 24.43 O ATOM 126 CB MET A 9 4.751 1.636 14.111 1.00 61.44 C ATOM 127 CG MET A 9 4.038 2.962 13.901 1.00 20.41 C ATOM 128 SD MET A 9 3.582 3.758 15.453 1.00 34.53 S ATOM 129 CE MET A 9 1.862 4.150 15.140 1.00 22.50 C ATOM 0 H MET A 9 6.728 -0.083 13.810 1.00 75.40 H new ATOM 0 HA MET A 9 6.531 2.806 14.399 1.00 14.10 H new ATOM 0 HB2 MET A 9 4.746 1.078 13.175 1.00 61.44 H new ATOM 0 HB3 MET A 9 4.194 1.044 14.837 1.00 61.44 H new ATOM 0 HG2 MET A 9 4.683 3.630 13.330 1.00 20.41 H new ATOM 0 HG3 MET A 9 3.141 2.797 13.304 1.00 20.41 H new ATOM 0 HE1 MET A 9 1.438 4.648 16.012 1.00 22.50 H new ATOM 0 HE2 MET A 9 1.791 4.809 14.275 1.00 22.50 H new ATOM 0 HE3 MET A 9 1.310 3.231 14.943 1.00 22.50 H new ATOM 139 N ARG A 10 6.137 0.267 16.483 1.00 25.35 N ATOM 140 CA ARG A 10 6.189 -0.110 17.891 1.00 71.32 C ATOM 141 C ARG A 10 6.799 -1.499 18.060 1.00 55.12 C ATOM 142 O ARG A 10 6.622 -2.373 17.211 1.00 21.44 O ATOM 143 CB ARG A 10 4.786 -0.080 18.501 1.00 42.15 C ATOM 144 CG ARG A 10 4.018 1.196 18.197 1.00 74.22 C ATOM 145 CD ARG A 10 2.678 1.223 18.915 1.00 55.21 C ATOM 146 NE ARG A 10 2.282 2.580 19.285 1.00 63.43 N ATOM 147 CZ ARG A 10 1.072 2.897 19.730 1.00 75.23 C ATOM 148 NH1 ARG A 10 0.143 1.959 19.860 1.00 51.52 N ATOM 149 NH2 ARG A 10 0.788 4.154 20.046 1.00 71.20 N ATOM 0 H ARG A 10 5.993 -0.513 15.842 1.00 25.35 H new ATOM 0 HA ARG A 10 6.820 0.611 18.411 1.00 71.32 H new ATOM 0 HB2 ARG A 10 4.219 -0.933 18.129 1.00 42.15 H new ATOM 0 HB3 ARG A 10 4.866 -0.197 19.582 1.00 42.15 H new ATOM 0 HG2 ARG A 10 4.611 2.060 18.498 1.00 74.22 H new ATOM 0 HG3 ARG A 10 3.858 1.278 17.122 1.00 74.22 H new ATOM 0 HD2 ARG A 10 1.914 0.785 18.273 1.00 55.21 H new ATOM 0 HD3 ARG A 10 2.734 0.605 19.811 1.00 55.21 H new ATOM 0 HE ARG A 10 2.973 3.325 19.197 1.00 63.43 H new ATOM 0 HH11 ARG A 10 0.358 0.992 19.618 1.00 51.52 H new ATOM 0 HH12 ARG A 10 -0.786 2.205 20.202 1.00 51.52 H new ATOM 0 HH21 ARG A 10 1.500 4.878 19.947 1.00 71.20 H new ATOM 0 HH22 ARG A 10 -0.142 4.396 20.388 1.00 71.20 H new ATOM 163 N VAL A 11 7.517 -1.694 19.161 1.00 62.22 N ATOM 164 CA VAL A 11 8.153 -2.976 19.442 1.00 73.03 C ATOM 165 C VAL A 11 8.129 -3.286 20.934 1.00 3.43 C ATOM 166 O VAL A 11 8.482 -2.442 21.760 1.00 31.52 O ATOM 167 CB VAL A 11 9.611 -3.000 18.946 1.00 31.04 C ATOM 168 CG1 VAL A 11 10.182 -4.407 19.036 1.00 5.25 C ATOM 169 CG2 VAL A 11 9.698 -2.470 17.523 1.00 24.31 C ATOM 0 H VAL A 11 7.673 -0.981 19.873 1.00 62.22 H new ATOM 0 HA VAL A 11 7.583 -3.736 18.907 1.00 73.03 H new ATOM 0 HB VAL A 11 10.206 -2.351 19.588 1.00 31.04 H new ATOM 0 HG11 VAL A 11 11.213 -4.405 18.681 1.00 5.25 H new ATOM 0 HG12 VAL A 11 10.155 -4.745 20.072 1.00 5.25 H new ATOM 0 HG13 VAL A 11 9.588 -5.081 18.419 1.00 5.25 H new ATOM 0 HG21 VAL A 11 10.735 -2.494 17.189 1.00 24.31 H new ATOM 0 HG22 VAL A 11 9.090 -3.092 16.865 1.00 24.31 H new ATOM 0 HG23 VAL A 11 9.331 -1.444 17.494 1.00 24.31 H new ATOM 179 N LEU A 12 7.712 -4.500 21.274 1.00 22.13 N ATOM 180 CA LEU A 12 7.643 -4.923 22.669 1.00 41.21 C ATOM 181 C LEU A 12 8.030 -6.391 22.813 1.00 61.23 C ATOM 182 O LEU A 12 7.955 -7.161 21.854 1.00 11.00 O ATOM 183 CB LEU A 12 6.234 -4.699 23.221 1.00 3.51 C ATOM 184 CG LEU A 12 6.137 -3.844 24.485 1.00 0.22 C ATOM 185 CD1 LEU A 12 4.712 -3.356 24.691 1.00 15.41 C ATOM 186 CD2 LEU A 12 6.614 -4.629 25.698 1.00 22.21 C ATOM 0 H LEU A 12 7.416 -5.209 20.603 1.00 22.13 H new ATOM 0 HA LEU A 12 8.351 -4.322 23.240 1.00 41.21 H new ATOM 0 HB2 LEU A 12 5.631 -4.231 22.443 1.00 3.51 H new ATOM 0 HB3 LEU A 12 5.788 -5.672 23.429 1.00 3.51 H new ATOM 0 HG LEU A 12 6.783 -2.975 24.363 1.00 0.22 H new ATOM 0 HD11 LEU A 12 4.662 -2.749 25.595 1.00 15.41 H new ATOM 0 HD12 LEU A 12 4.405 -2.756 23.834 1.00 15.41 H new ATOM 0 HD13 LEU A 12 4.045 -4.212 24.792 1.00 15.41 H new ATOM 0 HD21 LEU A 12 6.538 -4.005 26.588 1.00 22.21 H new ATOM 0 HD22 LEU A 12 5.994 -5.517 25.823 1.00 22.21 H new ATOM 0 HD23 LEU A 12 7.652 -4.928 25.552 1.00 22.21 H new ATOM 198 N LEU A 13 8.442 -6.774 24.016 1.00 4.32 N ATOM 199 CA LEU A 13 8.839 -8.151 24.287 1.00 63.11 C ATOM 200 C LEU A 13 7.922 -8.788 25.326 1.00 51.11 C ATOM 201 O LEU A 13 7.672 -8.212 26.385 1.00 13.44 O ATOM 202 CB LEU A 13 10.289 -8.199 24.772 1.00 1.14 C ATOM 203 CG LEU A 13 11.309 -7.448 23.916 1.00 51.24 C ATOM 204 CD1 LEU A 13 12.657 -7.391 24.617 1.00 11.25 C ATOM 205 CD2 LEU A 13 11.444 -8.104 22.549 1.00 22.24 C ATOM 0 H LEU A 13 8.510 -6.150 24.820 1.00 4.32 H new ATOM 0 HA LEU A 13 8.754 -8.716 23.359 1.00 63.11 H new ATOM 0 HB2 LEU A 13 10.326 -7.795 25.784 1.00 1.14 H new ATOM 0 HB3 LEU A 13 10.596 -9.243 24.834 1.00 1.14 H new ATOM 0 HG LEU A 13 10.954 -6.427 23.774 1.00 51.24 H new ATOM 0 HD11 LEU A 13 13.370 -6.853 23.992 1.00 11.25 H new ATOM 0 HD12 LEU A 13 12.549 -6.875 25.571 1.00 11.25 H new ATOM 0 HD13 LEU A 13 13.020 -8.404 24.791 1.00 11.25 H new ATOM 0 HD21 LEU A 13 12.174 -7.556 21.953 1.00 22.24 H new ATOM 0 HD22 LEU A 13 11.776 -9.135 22.671 1.00 22.24 H new ATOM 0 HD23 LEU A 13 10.479 -8.091 22.042 1.00 22.24 H new ATOM 217 N LEU A 14 7.425 -9.980 25.017 1.00 73.42 N ATOM 218 CA LEU A 14 6.536 -10.698 25.925 1.00 44.32 C ATOM 219 C LEU A 14 7.270 -11.845 26.611 1.00 24.22 C ATOM 220 O LEU A 14 7.489 -11.820 27.822 1.00 75.33 O ATOM 221 CB LEU A 14 5.323 -11.236 25.164 1.00 43.30 C ATOM 222 CG LEU A 14 4.501 -10.202 24.394 1.00 43.41 C ATOM 223 CD1 LEU A 14 3.145 -10.775 24.012 1.00 44.41 C ATOM 224 CD2 LEU A 14 4.333 -8.933 25.218 1.00 65.15 C ATOM 0 H LEU A 14 7.622 -10.470 24.145 1.00 73.42 H new ATOM 0 HA LEU A 14 6.196 -9.999 26.690 1.00 44.32 H new ATOM 0 HB2 LEU A 14 5.668 -11.994 24.460 1.00 43.30 H new ATOM 0 HB3 LEU A 14 4.666 -11.737 25.875 1.00 43.30 H new ATOM 0 HG LEU A 14 5.036 -9.949 23.479 1.00 43.41 H new ATOM 0 HD11 LEU A 14 2.574 -10.025 23.465 1.00 44.41 H new ATOM 0 HD12 LEU A 14 3.286 -11.654 23.383 1.00 44.41 H new ATOM 0 HD13 LEU A 14 2.602 -11.057 24.914 1.00 44.41 H new ATOM 0 HD21 LEU A 14 3.745 -8.208 24.654 1.00 65.15 H new ATOM 0 HD22 LEU A 14 3.820 -9.170 26.150 1.00 65.15 H new ATOM 0 HD23 LEU A 14 5.313 -8.511 25.440 1.00 65.15 H new ATOM 236 N GLY A 15 7.651 -12.850 25.828 1.00 21.22 N ATOM 237 CA GLY A 15 8.359 -13.992 26.378 1.00 55.12 C ATOM 238 C GLY A 15 9.487 -13.584 27.304 1.00 43.25 C ATOM 239 O GLY A 15 10.471 -12.986 26.868 1.00 42.34 O ATOM 0 H GLY A 15 7.482 -12.894 24.823 1.00 21.22 H new ATOM 0 HA2 GLY A 15 7.657 -14.623 26.922 1.00 55.12 H new ATOM 0 HA3 GLY A 15 8.762 -14.593 25.563 1.00 55.12 H new ATOM 243 N ASP A 16 9.345 -13.906 28.584 1.00 4.45 N ATOM 244 CA ASP A 16 10.361 -13.568 29.575 1.00 62.12 C ATOM 245 C ASP A 16 11.707 -14.184 29.205 1.00 72.23 C ATOM 246 O ASP A 16 11.843 -14.822 28.161 1.00 44.25 O ATOM 247 CB ASP A 16 9.931 -14.048 30.962 1.00 50.40 C ATOM 248 CG ASP A 16 10.096 -12.976 32.022 1.00 72.22 C ATOM 249 OD1 ASP A 16 9.664 -11.829 31.779 1.00 63.50 O ATOM 250 OD2 ASP A 16 10.656 -13.285 33.094 1.00 15.55 O ATOM 0 H ASP A 16 8.536 -14.401 28.961 1.00 4.45 H new ATOM 0 HA ASP A 16 10.470 -12.484 29.592 1.00 62.12 H new ATOM 0 HB2 ASP A 16 8.888 -14.363 30.927 1.00 50.40 H new ATOM 0 HB3 ASP A 16 10.519 -14.923 31.239 1.00 50.40 H new ATOM 255 N VAL A 17 12.699 -13.988 30.067 1.00 30.45 N ATOM 256 CA VAL A 17 14.034 -14.525 29.832 1.00 42.44 C ATOM 257 C VAL A 17 14.521 -15.333 31.029 1.00 71.43 C ATOM 258 O VAL A 17 15.633 -15.860 31.024 1.00 3.32 O ATOM 259 CB VAL A 17 15.046 -13.401 29.539 1.00 25.22 C ATOM 260 CG1 VAL A 17 14.925 -12.935 28.096 1.00 25.52 C ATOM 261 CG2 VAL A 17 14.846 -12.240 30.501 1.00 21.24 C ATOM 0 H VAL A 17 12.603 -13.461 30.935 1.00 30.45 H new ATOM 0 HA VAL A 17 13.964 -15.178 28.962 1.00 42.44 H new ATOM 0 HB VAL A 17 16.052 -13.795 29.685 1.00 25.22 H new ATOM 0 HG11 VAL A 17 15.648 -12.141 27.908 1.00 25.52 H new ATOM 0 HG12 VAL A 17 15.123 -13.772 27.426 1.00 25.52 H new ATOM 0 HG13 VAL A 17 13.918 -12.558 27.919 1.00 25.52 H new ATOM 0 HG21 VAL A 17 15.569 -11.455 30.280 1.00 21.24 H new ATOM 0 HG22 VAL A 17 13.836 -11.845 30.389 1.00 21.24 H new ATOM 0 HG23 VAL A 17 14.989 -12.587 31.524 1.00 21.24 H new ATOM 271 N ALA A 18 13.680 -15.429 32.053 1.00 14.41 N ATOM 272 CA ALA A 18 14.023 -16.176 33.257 1.00 51.33 C ATOM 273 C ALA A 18 14.437 -17.603 32.917 1.00 24.32 C ATOM 274 O ALA A 18 15.235 -18.216 33.628 1.00 13.24 O ATOM 275 CB ALA A 18 12.851 -16.181 34.227 1.00 52.11 C ATOM 0 H ALA A 18 12.755 -14.999 32.073 1.00 14.41 H new ATOM 0 HA ALA A 18 14.871 -15.683 33.732 1.00 51.33 H new ATOM 0 HB1 ALA A 18 13.121 -16.742 35.121 1.00 52.11 H new ATOM 0 HB2 ALA A 18 12.603 -15.156 34.503 1.00 52.11 H new ATOM 0 HB3 ALA A 18 11.988 -16.648 33.753 1.00 52.11 H new ATOM 281 N THR A 19 13.891 -18.130 31.826 1.00 52.25 N ATOM 282 CA THR A 19 14.202 -19.486 31.393 1.00 63.12 C ATOM 283 C THR A 19 15.522 -19.531 30.631 1.00 10.21 C ATOM 284 O THR A 19 16.189 -20.565 30.585 1.00 61.25 O ATOM 285 CB THR A 19 13.087 -20.061 30.499 1.00 1.21 C ATOM 286 OG1 THR A 19 12.435 -19.003 29.788 1.00 13.44 O ATOM 287 CG2 THR A 19 12.067 -20.824 31.330 1.00 21.42 C ATOM 0 H THR A 19 13.230 -17.637 31.225 1.00 52.25 H new ATOM 0 HA THR A 19 14.284 -20.094 32.294 1.00 63.12 H new ATOM 0 HB THR A 19 13.541 -20.750 29.787 1.00 1.21 H new ATOM 0 HG1 THR A 19 11.729 -19.377 29.221 1.00 13.44 H new ATOM 0 HG21 THR A 19 11.289 -21.221 30.677 1.00 21.42 H new ATOM 0 HG22 THR A 19 12.561 -21.646 31.847 1.00 21.42 H new ATOM 0 HG23 THR A 19 11.618 -20.152 32.062 1.00 21.42 H new ATOM 295 N LEU A 20 15.894 -18.403 30.035 1.00 22.25 N ATOM 296 CA LEU A 20 17.136 -18.313 29.276 1.00 62.24 C ATOM 297 C LEU A 20 18.155 -17.439 29.999 1.00 24.24 C ATOM 298 O LEU A 20 18.306 -16.251 29.713 1.00 63.54 O ATOM 299 CB LEU A 20 16.864 -17.749 27.880 1.00 34.30 C ATOM 300 CG LEU A 20 15.799 -16.655 27.794 1.00 33.34 C ATOM 301 CD1 LEU A 20 16.174 -15.626 26.739 1.00 22.34 C ATOM 302 CD2 LEU A 20 14.436 -17.260 27.491 1.00 72.21 C ATOM 0 H LEU A 20 15.353 -17.539 30.063 1.00 22.25 H new ATOM 0 HA LEU A 20 17.548 -19.318 29.182 1.00 62.24 H new ATOM 0 HB2 LEU A 20 17.798 -17.351 27.482 1.00 34.30 H new ATOM 0 HB3 LEU A 20 16.565 -18.571 27.230 1.00 34.30 H new ATOM 0 HG LEU A 20 15.744 -16.152 28.759 1.00 33.34 H new ATOM 0 HD11 LEU A 20 15.404 -14.856 26.692 1.00 22.34 H new ATOM 0 HD12 LEU A 20 17.129 -15.170 26.999 1.00 22.34 H new ATOM 0 HD13 LEU A 20 16.258 -16.114 25.768 1.00 22.34 H new ATOM 0 HD21 LEU A 20 13.691 -16.467 27.433 1.00 72.21 H new ATOM 0 HD22 LEU A 20 14.476 -17.790 26.539 1.00 72.21 H new ATOM 0 HD23 LEU A 20 14.163 -17.957 28.283 1.00 72.21 H new ATOM 314 N PRO A 21 18.874 -18.040 30.960 1.00 42.53 N ATOM 315 CA PRO A 21 19.894 -17.335 31.743 1.00 72.14 C ATOM 316 C PRO A 21 21.121 -16.980 30.910 1.00 11.40 C ATOM 317 O PRO A 21 21.117 -17.125 29.687 1.00 43.01 O ATOM 318 CB PRO A 21 20.262 -18.343 32.834 1.00 10.02 C ATOM 319 CG PRO A 21 19.937 -19.673 32.247 1.00 64.02 C ATOM 320 CD PRO A 21 18.747 -19.452 31.355 1.00 61.42 C ATOM 0 HA PRO A 21 19.527 -16.384 32.128 1.00 72.14 H new ATOM 0 HB2 PRO A 21 21.318 -18.274 33.097 1.00 10.02 H new ATOM 0 HB3 PRO A 21 19.694 -18.164 33.747 1.00 10.02 H new ATOM 0 HG2 PRO A 21 20.781 -20.067 31.681 1.00 64.02 H new ATOM 0 HG3 PRO A 21 19.710 -20.399 33.028 1.00 64.02 H new ATOM 0 HD2 PRO A 21 18.765 -20.114 30.490 1.00 61.42 H new ATOM 0 HD3 PRO A 21 17.811 -19.640 31.880 1.00 61.42 H new ATOM 328 N LEU A 22 22.169 -16.514 31.579 1.00 5.25 N ATOM 329 CA LEU A 22 23.405 -16.138 30.901 1.00 51.11 C ATOM 330 C LEU A 22 23.882 -17.256 29.980 1.00 41.15 C ATOM 331 O LEU A 22 24.307 -17.005 28.852 1.00 71.35 O ATOM 332 CB LEU A 22 24.492 -15.807 31.925 1.00 51.41 C ATOM 333 CG LEU A 22 25.820 -15.307 31.356 1.00 43.22 C ATOM 334 CD1 LEU A 22 25.863 -13.787 31.357 1.00 4.31 C ATOM 335 CD2 LEU A 22 26.988 -15.876 32.149 1.00 51.05 C ATOM 0 H LEU A 22 22.188 -16.387 32.591 1.00 5.25 H new ATOM 0 HA LEU A 22 23.204 -15.254 30.296 1.00 51.11 H new ATOM 0 HB2 LEU A 22 24.103 -15.050 32.606 1.00 51.41 H new ATOM 0 HB3 LEU A 22 24.687 -16.700 32.519 1.00 51.41 H new ATOM 0 HG LEU A 22 25.904 -15.651 30.325 1.00 43.22 H new ATOM 0 HD11 LEU A 22 26.816 -13.450 30.949 1.00 4.31 H new ATOM 0 HD12 LEU A 22 25.048 -13.400 30.745 1.00 4.31 H new ATOM 0 HD13 LEU A 22 25.756 -13.421 32.378 1.00 4.31 H new ATOM 0 HD21 LEU A 22 27.925 -15.510 31.730 1.00 51.05 H new ATOM 0 HD22 LEU A 22 26.908 -15.562 33.190 1.00 51.05 H new ATOM 0 HD23 LEU A 22 26.968 -16.965 32.096 1.00 51.05 H new ATOM 347 N ARG A 23 23.807 -18.490 30.467 1.00 51.00 N ATOM 348 CA ARG A 23 24.230 -19.647 29.687 1.00 41.31 C ATOM 349 C ARG A 23 23.396 -19.780 28.416 1.00 45.32 C ATOM 350 O ARG A 23 23.936 -19.910 27.317 1.00 42.01 O ATOM 351 CB ARG A 23 24.113 -20.923 30.523 1.00 53.35 C ATOM 352 CG ARG A 23 25.265 -21.123 31.493 1.00 20.31 C ATOM 353 CD ARG A 23 26.168 -22.267 31.057 1.00 11.32 C ATOM 354 NE ARG A 23 27.317 -22.425 31.944 1.00 45.11 N ATOM 355 CZ ARG A 23 27.240 -22.950 33.162 1.00 55.43 C ATOM 356 NH1 ARG A 23 26.073 -23.365 33.635 1.00 54.22 N ATOM 357 NH2 ARG A 23 28.330 -23.060 33.909 1.00 65.31 N ATOM 0 H ARG A 23 23.457 -18.715 31.398 1.00 51.00 H new ATOM 0 HA ARG A 23 25.272 -19.501 29.403 1.00 41.31 H new ATOM 0 HB2 ARG A 23 23.178 -20.896 31.083 1.00 53.35 H new ATOM 0 HB3 ARG A 23 24.059 -21.782 29.854 1.00 53.35 H new ATOM 0 HG2 ARG A 23 25.847 -20.204 31.562 1.00 20.31 H new ATOM 0 HG3 ARG A 23 24.872 -21.327 32.489 1.00 20.31 H new ATOM 0 HD2 ARG A 23 25.595 -23.194 31.037 1.00 11.32 H new ATOM 0 HD3 ARG A 23 26.517 -22.086 30.040 1.00 11.32 H new ATOM 0 HE ARG A 23 28.230 -22.115 31.610 1.00 45.11 H new ATOM 0 HH11 ARG A 23 25.232 -23.281 33.064 1.00 54.22 H new ATOM 0 HH12 ARG A 23 26.016 -23.768 34.570 1.00 54.22 H new ATOM 0 HH21 ARG A 23 29.229 -22.741 33.549 1.00 65.31 H new ATOM 0 HH22 ARG A 23 28.269 -23.463 34.844 1.00 65.31 H new ATOM 371 N LYS A 24 22.078 -19.747 28.573 1.00 14.34 N ATOM 372 CA LYS A 24 21.168 -19.863 27.440 1.00 50.43 C ATOM 373 C LYS A 24 21.362 -18.705 26.466 1.00 51.22 C ATOM 374 O LYS A 24 21.658 -18.913 25.289 1.00 33.11 O ATOM 375 CB LYS A 24 19.717 -19.897 27.925 1.00 20.11 C ATOM 376 CG LYS A 24 19.198 -21.299 28.192 1.00 60.43 C ATOM 377 CD LYS A 24 20.061 -22.030 29.207 1.00 40.21 C ATOM 378 CE LYS A 24 19.262 -23.079 29.965 1.00 4.35 C ATOM 379 NZ LYS A 24 19.981 -23.551 31.181 1.00 11.34 N ATOM 0 H LYS A 24 21.615 -19.641 29.476 1.00 14.34 H new ATOM 0 HA LYS A 24 21.393 -20.794 26.920 1.00 50.43 H new ATOM 0 HB2 LYS A 24 19.634 -19.308 28.838 1.00 20.11 H new ATOM 0 HB3 LYS A 24 19.082 -19.419 27.179 1.00 20.11 H new ATOM 0 HG2 LYS A 24 18.172 -21.245 28.557 1.00 60.43 H new ATOM 0 HG3 LYS A 24 19.175 -21.863 27.260 1.00 60.43 H new ATOM 0 HD2 LYS A 24 20.899 -22.507 28.698 1.00 40.21 H new ATOM 0 HD3 LYS A 24 20.483 -21.313 29.911 1.00 40.21 H new ATOM 0 HE2 LYS A 24 18.297 -22.663 30.252 1.00 4.35 H new ATOM 0 HE3 LYS A 24 19.061 -23.927 29.310 1.00 4.35 H new ATOM 0 HZ1 LYS A 24 19.404 -24.265 31.670 1.00 11.34 H new ATOM 0 HZ2 LYS A 24 20.891 -23.971 30.905 1.00 11.34 H new ATOM 0 HZ3 LYS A 24 20.150 -22.747 31.818 1.00 11.34 H new ATOM 393 N VAL A 25 21.195 -17.484 26.964 1.00 11.22 N ATOM 394 CA VAL A 25 21.354 -16.293 26.139 1.00 42.34 C ATOM 395 C VAL A 25 22.677 -16.322 25.381 1.00 1.24 C ATOM 396 O VAL A 25 22.725 -16.047 24.182 1.00 74.04 O ATOM 397 CB VAL A 25 21.289 -15.009 26.987 1.00 2.11 C ATOM 398 CG1 VAL A 25 21.490 -13.780 26.113 1.00 32.31 C ATOM 399 CG2 VAL A 25 19.967 -14.931 27.735 1.00 74.43 C ATOM 0 H VAL A 25 20.949 -17.294 27.936 1.00 11.22 H new ATOM 0 HA VAL A 25 20.530 -16.290 25.426 1.00 42.34 H new ATOM 0 HB VAL A 25 22.094 -15.038 27.721 1.00 2.11 H new ATOM 0 HG11 VAL A 25 21.441 -12.883 26.730 1.00 32.31 H new ATOM 0 HG12 VAL A 25 22.465 -13.834 25.628 1.00 32.31 H new ATOM 0 HG13 VAL A 25 20.709 -13.742 25.354 1.00 32.31 H new ATOM 0 HG21 VAL A 25 19.938 -14.018 28.329 1.00 74.43 H new ATOM 0 HG22 VAL A 25 19.144 -14.925 27.020 1.00 74.43 H new ATOM 0 HG23 VAL A 25 19.870 -15.795 28.393 1.00 74.43 H new ATOM 409 N LEU A 26 23.750 -16.657 26.089 1.00 21.02 N ATOM 410 CA LEU A 26 25.076 -16.723 25.484 1.00 71.10 C ATOM 411 C LEU A 26 25.090 -17.694 24.307 1.00 15.43 C ATOM 412 O LEU A 26 25.497 -17.338 23.202 1.00 73.33 O ATOM 413 CB LEU A 26 26.112 -17.151 26.525 1.00 43.34 C ATOM 414 CG LEU A 26 26.668 -16.039 27.415 1.00 40.42 C ATOM 415 CD1 LEU A 26 27.542 -16.622 28.515 1.00 54.43 C ATOM 416 CD2 LEU A 26 27.453 -15.033 26.585 1.00 54.02 C ATOM 0 H LEU A 26 23.728 -16.887 27.082 1.00 21.02 H new ATOM 0 HA LEU A 26 25.330 -15.729 25.115 1.00 71.10 H new ATOM 0 HB2 LEU A 26 25.662 -17.910 27.165 1.00 43.34 H new ATOM 0 HB3 LEU A 26 26.945 -17.624 26.006 1.00 43.34 H new ATOM 0 HG LEU A 26 25.830 -15.520 27.881 1.00 40.42 H new ATOM 0 HD11 LEU A 26 27.929 -15.816 29.138 1.00 54.43 H new ATOM 0 HD12 LEU A 26 26.950 -17.302 29.128 1.00 54.43 H new ATOM 0 HD13 LEU A 26 28.374 -17.166 28.068 1.00 54.43 H new ATOM 0 HD21 LEU A 26 27.841 -14.249 27.235 1.00 54.02 H new ATOM 0 HD22 LEU A 26 28.283 -15.538 26.090 1.00 54.02 H new ATOM 0 HD23 LEU A 26 26.798 -14.591 25.834 1.00 54.02 H new ATOM 428 N ALA A 27 24.640 -18.920 24.553 1.00 12.21 N ATOM 429 CA ALA A 27 24.596 -19.940 23.513 1.00 23.21 C ATOM 430 C ALA A 27 23.688 -19.515 22.364 1.00 4.31 C ATOM 431 O ALA A 27 24.123 -19.429 21.215 1.00 33.33 O ATOM 432 CB ALA A 27 24.129 -21.266 24.094 1.00 30.42 C ATOM 0 H ALA A 27 24.301 -19.231 25.463 1.00 12.21 H new ATOM 0 HA ALA A 27 25.604 -20.064 23.118 1.00 23.21 H new ATOM 0 HB1 ALA A 27 24.101 -22.019 23.306 1.00 30.42 H new ATOM 0 HB2 ALA A 27 24.819 -21.584 24.875 1.00 30.42 H new ATOM 0 HB3 ALA A 27 23.132 -21.147 24.518 1.00 30.42 H new ATOM 438 N VAL A 28 22.425 -19.249 22.681 1.00 21.33 N ATOM 439 CA VAL A 28 21.456 -18.832 21.675 1.00 32.22 C ATOM 440 C VAL A 28 21.987 -17.665 20.851 1.00 40.12 C ATOM 441 O VAL A 28 22.218 -17.794 19.648 1.00 14.04 O ATOM 442 CB VAL A 28 20.118 -18.424 22.320 1.00 31.10 C ATOM 443 CG1 VAL A 28 19.132 -17.960 21.258 1.00 25.50 C ATOM 444 CG2 VAL A 28 19.542 -19.578 23.126 1.00 34.23 C ATOM 0 H VAL A 28 22.049 -19.315 23.627 1.00 21.33 H new ATOM 0 HA VAL A 28 21.290 -19.688 21.021 1.00 32.22 H new ATOM 0 HB VAL A 28 20.301 -17.592 23.000 1.00 31.10 H new ATOM 0 HG11 VAL A 28 18.193 -17.676 21.733 1.00 25.50 H new ATOM 0 HG12 VAL A 28 19.545 -17.102 20.728 1.00 25.50 H new ATOM 0 HG13 VAL A 28 18.951 -18.770 20.551 1.00 25.50 H new ATOM 0 HG21 VAL A 28 18.597 -19.272 23.575 1.00 34.23 H new ATOM 0 HG22 VAL A 28 19.373 -20.432 22.470 1.00 34.23 H new ATOM 0 HG23 VAL A 28 20.243 -19.858 23.912 1.00 34.23 H new ATOM 454 N VAL A 29 22.180 -16.524 21.506 1.00 60.42 N ATOM 455 CA VAL A 29 22.686 -15.333 20.834 1.00 20.32 C ATOM 456 C VAL A 29 23.940 -15.649 20.026 1.00 11.24 C ATOM 457 O VAL A 29 24.127 -15.135 18.925 1.00 50.44 O ATOM 458 CB VAL A 29 23.006 -14.214 21.842 1.00 3.24 C ATOM 459 CG1 VAL A 29 23.603 -13.009 21.131 1.00 12.11 C ATOM 460 CG2 VAL A 29 21.757 -13.822 22.617 1.00 2.40 C ATOM 0 H VAL A 29 21.994 -16.400 22.501 1.00 60.42 H new ATOM 0 HA VAL A 29 21.900 -14.991 20.160 1.00 20.32 H new ATOM 0 HB VAL A 29 23.743 -14.588 22.552 1.00 3.24 H new ATOM 0 HG11 VAL A 29 23.823 -12.229 21.860 1.00 12.11 H new ATOM 0 HG12 VAL A 29 24.523 -13.303 20.626 1.00 12.11 H new ATOM 0 HG13 VAL A 29 22.892 -12.630 20.397 1.00 12.11 H new ATOM 0 HG21 VAL A 29 22.002 -13.030 23.325 1.00 2.40 H new ATOM 0 HG22 VAL A 29 20.995 -13.466 21.923 1.00 2.40 H new ATOM 0 HG23 VAL A 29 21.378 -14.689 23.159 1.00 2.40 H new ATOM 470 N GLY A 30 24.797 -16.499 20.583 1.00 64.33 N ATOM 471 CA GLY A 30 26.023 -16.870 19.900 1.00 43.50 C ATOM 472 C GLY A 30 25.765 -17.501 18.547 1.00 61.44 C ATOM 473 O GLY A 30 26.154 -16.956 17.513 1.00 12.22 O ATOM 0 H GLY A 30 24.665 -16.937 21.494 1.00 64.33 H new ATOM 0 HA2 GLY A 30 26.646 -15.985 19.772 1.00 43.50 H new ATOM 0 HA3 GLY A 30 26.585 -17.567 20.521 1.00 43.50 H new ATOM 477 N THR A 31 25.108 -18.657 18.550 1.00 21.23 N ATOM 478 CA THR A 31 24.801 -19.366 17.314 1.00 11.33 C ATOM 479 C THR A 31 24.024 -18.477 16.349 1.00 5.14 C ATOM 480 O THR A 31 24.417 -18.305 15.196 1.00 63.41 O ATOM 481 CB THR A 31 23.985 -20.643 17.587 1.00 20.41 C ATOM 482 OG1 THR A 31 24.401 -21.236 18.822 1.00 23.14 O ATOM 483 CG2 THR A 31 24.155 -21.646 16.455 1.00 13.34 C ATOM 0 H THR A 31 24.778 -19.122 19.396 1.00 21.23 H new ATOM 0 HA THR A 31 25.754 -19.642 16.863 1.00 11.33 H new ATOM 0 HB THR A 31 22.932 -20.368 17.653 1.00 20.41 H new ATOM 0 HG1 THR A 31 25.377 -21.322 18.831 1.00 23.14 H new ATOM 0 HG21 THR A 31 23.569 -22.540 16.670 1.00 13.34 H new ATOM 0 HG22 THR A 31 23.810 -21.202 15.521 1.00 13.34 H new ATOM 0 HG23 THR A 31 25.207 -21.915 16.362 1.00 13.34 H new ATOM 491 N ALA A 32 22.921 -17.913 16.829 1.00 32.23 N ATOM 492 CA ALA A 32 22.091 -17.039 16.009 1.00 33.54 C ATOM 493 C ALA A 32 22.925 -15.939 15.362 1.00 74.10 C ATOM 494 O ALA A 32 22.702 -15.576 14.207 1.00 34.44 O ATOM 495 CB ALA A 32 20.974 -16.434 16.847 1.00 73.42 C ATOM 0 H ALA A 32 22.581 -18.046 17.782 1.00 32.23 H new ATOM 0 HA ALA A 32 21.649 -17.639 15.213 1.00 33.54 H new ATOM 0 HB1 ALA A 32 20.362 -15.784 16.222 1.00 73.42 H new ATOM 0 HB2 ALA A 32 20.354 -17.231 17.257 1.00 73.42 H new ATOM 0 HB3 ALA A 32 21.405 -15.853 17.663 1.00 73.42 H new ATOM 501 N ALA A 33 23.885 -15.411 16.114 1.00 61.14 N ATOM 502 CA ALA A 33 24.753 -14.353 15.612 1.00 51.11 C ATOM 503 C ALA A 33 25.763 -14.900 14.610 1.00 64.53 C ATOM 504 O ALA A 33 26.177 -14.201 13.685 1.00 14.15 O ATOM 505 CB ALA A 33 25.469 -13.667 16.765 1.00 5.35 C ATOM 0 H ALA A 33 24.081 -15.699 17.073 1.00 61.14 H new ATOM 0 HA ALA A 33 24.131 -13.621 15.097 1.00 51.11 H new ATOM 0 HB1 ALA A 33 26.114 -12.879 16.376 1.00 5.35 H new ATOM 0 HB2 ALA A 33 24.734 -13.233 17.443 1.00 5.35 H new ATOM 0 HB3 ALA A 33 26.073 -14.397 17.304 1.00 5.35 H new ATOM 511 N ALA A 34 26.158 -16.155 14.800 1.00 72.34 N ATOM 512 CA ALA A 34 27.119 -16.797 13.911 1.00 0.32 C ATOM 513 C ALA A 34 26.657 -16.727 12.460 1.00 52.32 C ATOM 514 O ALA A 34 27.473 -16.669 11.540 1.00 22.04 O ATOM 515 CB ALA A 34 27.339 -18.243 14.328 1.00 61.41 C ATOM 0 H ALA A 34 25.827 -16.747 15.562 1.00 72.34 H new ATOM 0 HA ALA A 34 28.064 -16.260 13.990 1.00 0.32 H new ATOM 0 HB1 ALA A 34 28.059 -18.710 13.656 1.00 61.41 H new ATOM 0 HB2 ALA A 34 27.723 -18.273 15.348 1.00 61.41 H new ATOM 0 HB3 ALA A 34 26.394 -18.783 14.280 1.00 61.41 H new ATOM 521 N SER A 35 25.342 -16.733 12.261 1.00 5.22 N ATOM 522 CA SER A 35 24.772 -16.675 10.921 1.00 53.44 C ATOM 523 C SER A 35 24.255 -15.273 10.610 1.00 2.14 C ATOM 524 O SER A 35 23.387 -15.094 9.757 1.00 73.23 O ATOM 525 CB SER A 35 23.637 -17.691 10.782 1.00 14.10 C ATOM 526 OG SER A 35 23.887 -18.593 9.718 1.00 54.31 O ATOM 0 H SER A 35 24.652 -16.777 13.011 1.00 5.22 H new ATOM 0 HA SER A 35 25.559 -16.920 10.208 1.00 53.44 H new ATOM 0 HB2 SER A 35 23.525 -18.245 11.714 1.00 14.10 H new ATOM 0 HB3 SER A 35 22.697 -17.169 10.607 1.00 14.10 H new ATOM 0 HG SER A 35 23.148 -19.233 9.651 1.00 54.31 H new ATOM 532 N SER A 36 24.797 -14.281 11.311 1.00 75.32 N ATOM 533 CA SER A 36 24.389 -12.895 11.114 1.00 33.11 C ATOM 534 C SER A 36 24.457 -12.513 9.639 1.00 50.13 C ATOM 535 O SER A 36 25.515 -12.591 9.015 1.00 31.31 O ATOM 536 CB SER A 36 25.276 -11.959 11.937 1.00 53.32 C ATOM 537 OG SER A 36 26.631 -12.372 11.895 1.00 55.24 O ATOM 0 H SER A 36 25.519 -14.412 12.020 1.00 75.32 H new ATOM 0 HA SER A 36 23.357 -12.794 11.450 1.00 33.11 H new ATOM 0 HB2 SER A 36 25.191 -10.942 11.554 1.00 53.32 H new ATOM 0 HB3 SER A 36 24.930 -11.941 12.970 1.00 53.32 H new ATOM 0 HG SER A 36 26.835 -12.907 12.690 1.00 55.24 H new ATOM 543 N GLU A 37 23.320 -12.099 9.088 1.00 61.13 N ATOM 544 CA GLU A 37 23.251 -11.705 7.685 1.00 35.44 C ATOM 545 C GLU A 37 23.438 -10.199 7.533 1.00 12.44 C ATOM 546 O GLU A 37 23.059 -9.614 6.518 1.00 51.10 O ATOM 547 CB GLU A 37 21.910 -12.128 7.080 1.00 1.51 C ATOM 548 CG GLU A 37 21.954 -13.479 6.388 1.00 35.50 C ATOM 549 CD GLU A 37 20.608 -13.889 5.822 1.00 14.30 C ATOM 550 OE1 GLU A 37 19.716 -14.252 6.618 1.00 71.04 O ATOM 551 OE2 GLU A 37 20.446 -13.846 4.585 1.00 52.03 O ATOM 0 H GLU A 37 22.435 -12.028 9.591 1.00 61.13 H new ATOM 0 HA GLU A 37 24.057 -12.209 7.152 1.00 35.44 H new ATOM 0 HB2 GLU A 37 21.158 -12.158 7.869 1.00 1.51 H new ATOM 0 HB3 GLU A 37 21.590 -11.372 6.363 1.00 1.51 H new ATOM 0 HG2 GLU A 37 22.688 -13.447 5.583 1.00 35.50 H new ATOM 0 HG3 GLU A 37 22.291 -14.235 7.097 1.00 35.50 H new ATOM 558 N HIS A 38 24.024 -9.576 8.551 1.00 44.55 N ATOM 559 CA HIS A 38 24.262 -8.137 8.531 1.00 44.41 C ATOM 560 C HIS A 38 25.757 -7.833 8.558 1.00 43.30 C ATOM 561 O HIS A 38 26.578 -8.666 8.943 1.00 11.24 O ATOM 562 CB HIS A 38 23.573 -7.468 9.720 1.00 14.04 C ATOM 563 CG HIS A 38 23.565 -8.310 10.959 1.00 11.21 C ATOM 564 ND1 HIS A 38 24.455 -8.130 11.997 1.00 14.40 N ATOM 565 CD2 HIS A 38 22.767 -9.341 11.324 1.00 45.02 C ATOM 566 CE1 HIS A 38 24.206 -9.015 12.946 1.00 51.52 C ATOM 567 NE2 HIS A 38 23.186 -9.761 12.562 1.00 23.41 N ATOM 0 H HIS A 38 24.342 -10.045 9.399 1.00 44.55 H new ATOM 0 HA HIS A 38 23.844 -7.738 7.607 1.00 44.41 H new ATOM 0 HB2 HIS A 38 24.073 -6.524 9.935 1.00 14.04 H new ATOM 0 HB3 HIS A 38 22.545 -7.229 9.446 1.00 14.04 H new ATOM 0 HD2 HIS A 38 21.953 -9.756 10.749 1.00 45.02 H new ATOM 0 HE1 HIS A 38 24.745 -9.112 13.877 1.00 51.52 H new ATOM 0 HE2 HIS A 38 22.776 -10.525 13.098 1.00 23.41 H new ATOM 575 N PRO A 39 26.121 -6.612 8.139 1.00 43.24 N ATOM 576 CA PRO A 39 27.519 -6.170 8.105 1.00 33.32 C ATOM 577 C PRO A 39 28.097 -5.970 9.502 1.00 61.22 C ATOM 578 O PRO A 39 29.293 -5.723 9.660 1.00 24.41 O ATOM 579 CB PRO A 39 27.451 -4.836 7.358 1.00 4.11 C ATOM 580 CG PRO A 39 26.065 -4.343 7.588 1.00 14.41 C ATOM 581 CD PRO A 39 25.197 -5.568 7.665 1.00 34.13 C ATOM 0 HA PRO A 39 28.168 -6.906 7.631 1.00 33.32 H new ATOM 0 HB2 PRO A 39 28.190 -4.131 7.739 1.00 4.11 H new ATOM 0 HB3 PRO A 39 27.653 -4.967 6.295 1.00 4.11 H new ATOM 0 HG2 PRO A 39 26.005 -3.764 8.509 1.00 14.41 H new ATOM 0 HG3 PRO A 39 25.744 -3.688 6.778 1.00 14.41 H new ATOM 0 HD2 PRO A 39 24.363 -5.427 8.353 1.00 34.13 H new ATOM 0 HD3 PRO A 39 24.770 -5.820 6.694 1.00 34.13 H new ATOM 589 N LEU A 40 27.242 -6.078 10.512 1.00 35.33 N ATOM 590 CA LEU A 40 27.668 -5.910 11.897 1.00 10.22 C ATOM 591 C LEU A 40 27.936 -7.261 12.553 1.00 54.32 C ATOM 592 O LEU A 40 28.369 -7.329 13.702 1.00 32.52 O ATOM 593 CB LEU A 40 26.605 -5.147 12.690 1.00 73.24 C ATOM 594 CG LEU A 40 26.668 -3.622 12.603 1.00 44.11 C ATOM 595 CD1 LEU A 40 25.270 -3.034 12.497 1.00 73.54 C ATOM 596 CD2 LEU A 40 27.399 -3.049 13.809 1.00 62.24 C ATOM 0 H LEU A 40 26.249 -6.281 10.398 1.00 35.33 H new ATOM 0 HA LEU A 40 28.595 -5.336 11.898 1.00 10.22 H new ATOM 0 HB2 LEU A 40 25.622 -5.470 12.346 1.00 73.24 H new ATOM 0 HB3 LEU A 40 26.686 -5.435 13.738 1.00 73.24 H new ATOM 0 HG LEU A 40 27.222 -3.352 11.704 1.00 44.11 H new ATOM 0 HD11 LEU A 40 25.336 -1.948 12.436 1.00 73.54 H new ATOM 0 HD12 LEU A 40 24.780 -3.419 11.602 1.00 73.54 H new ATOM 0 HD13 LEU A 40 24.690 -3.314 13.377 1.00 73.54 H new ATOM 0 HD21 LEU A 40 27.434 -1.962 13.730 1.00 62.24 H new ATOM 0 HD22 LEU A 40 26.872 -3.330 14.721 1.00 62.24 H new ATOM 0 HD23 LEU A 40 28.414 -3.444 13.840 1.00 62.24 H new ATOM 608 N GLY A 41 27.676 -8.334 11.812 1.00 24.22 N ATOM 609 CA GLY A 41 27.897 -9.669 12.337 1.00 3.24 C ATOM 610 C GLY A 41 29.297 -9.850 12.890 1.00 11.14 C ATOM 611 O GLY A 41 29.512 -10.640 13.809 1.00 32.44 O ATOM 0 H GLY A 41 27.316 -8.303 10.858 1.00 24.22 H new ATOM 0 HA2 GLY A 41 27.170 -9.872 13.123 1.00 3.24 H new ATOM 0 HA3 GLY A 41 27.724 -10.400 11.547 1.00 3.24 H new ATOM 615 N VAL A 42 30.253 -9.117 12.329 1.00 40.13 N ATOM 616 CA VAL A 42 31.640 -9.201 12.771 1.00 51.42 C ATOM 617 C VAL A 42 31.779 -8.771 14.227 1.00 44.12 C ATOM 618 O VAL A 42 32.315 -9.509 15.054 1.00 52.53 O ATOM 619 CB VAL A 42 32.561 -8.327 11.899 1.00 53.34 C ATOM 620 CG1 VAL A 42 34.004 -8.443 12.363 1.00 65.21 C ATOM 621 CG2 VAL A 42 32.430 -8.714 10.433 1.00 4.42 C ATOM 0 H VAL A 42 30.092 -8.458 11.567 1.00 40.13 H new ATOM 0 HA VAL A 42 31.941 -10.244 12.672 1.00 51.42 H new ATOM 0 HB VAL A 42 32.254 -7.287 12.006 1.00 53.34 H new ATOM 0 HG11 VAL A 42 34.639 -7.819 11.735 1.00 65.21 H new ATOM 0 HG12 VAL A 42 34.081 -8.113 13.399 1.00 65.21 H new ATOM 0 HG13 VAL A 42 34.328 -9.481 12.288 1.00 65.21 H new ATOM 0 HG21 VAL A 42 33.087 -8.087 9.831 1.00 4.42 H new ATOM 0 HG22 VAL A 42 32.710 -9.760 10.306 1.00 4.42 H new ATOM 0 HG23 VAL A 42 31.398 -8.573 10.110 1.00 4.42 H new ATOM 631 N ALA A 43 31.293 -7.573 14.534 1.00 45.44 N ATOM 632 CA ALA A 43 31.362 -7.045 15.891 1.00 75.23 C ATOM 633 C ALA A 43 30.518 -7.881 16.847 1.00 20.04 C ATOM 634 O ALA A 43 30.960 -8.222 17.945 1.00 53.51 O ATOM 635 CB ALA A 43 30.909 -5.593 15.916 1.00 54.11 C ATOM 0 H ALA A 43 30.847 -6.950 13.861 1.00 45.44 H new ATOM 0 HA ALA A 43 32.399 -7.096 16.223 1.00 75.23 H new ATOM 0 HB1 ALA A 43 30.966 -5.212 16.936 1.00 54.11 H new ATOM 0 HB2 ALA A 43 31.555 -4.999 15.270 1.00 54.11 H new ATOM 0 HB3 ALA A 43 29.881 -5.526 15.560 1.00 54.11 H new ATOM 641 N VAL A 44 29.301 -8.208 16.425 1.00 70.24 N ATOM 642 CA VAL A 44 28.395 -9.005 17.244 1.00 44.31 C ATOM 643 C VAL A 44 28.996 -10.370 17.558 1.00 21.23 C ATOM 644 O VAL A 44 29.064 -10.780 18.718 1.00 54.23 O ATOM 645 CB VAL A 44 27.036 -9.202 16.548 1.00 73.11 C ATOM 646 CG1 VAL A 44 26.113 -10.051 17.409 1.00 12.55 C ATOM 647 CG2 VAL A 44 26.398 -7.857 16.234 1.00 62.13 C ATOM 0 H VAL A 44 28.919 -7.933 15.520 1.00 70.24 H new ATOM 0 HA VAL A 44 28.242 -8.456 18.173 1.00 44.31 H new ATOM 0 HB VAL A 44 27.202 -9.728 15.608 1.00 73.11 H new ATOM 0 HG11 VAL A 44 25.157 -10.179 16.901 1.00 12.55 H new ATOM 0 HG12 VAL A 44 26.568 -11.027 17.578 1.00 12.55 H new ATOM 0 HG13 VAL A 44 25.951 -9.556 18.366 1.00 12.55 H new ATOM 0 HG21 VAL A 44 25.438 -8.016 15.742 1.00 62.13 H new ATOM 0 HG22 VAL A 44 26.244 -7.302 17.160 1.00 62.13 H new ATOM 0 HG23 VAL A 44 27.054 -7.288 15.575 1.00 62.13 H new ATOM 657 N THR A 45 29.433 -11.072 16.517 1.00 33.53 N ATOM 658 CA THR A 45 30.028 -12.393 16.681 1.00 13.24 C ATOM 659 C THR A 45 31.256 -12.334 17.582 1.00 21.20 C ATOM 660 O THR A 45 31.417 -13.155 18.485 1.00 35.15 O ATOM 661 CB THR A 45 30.429 -13.001 15.324 1.00 13.12 C ATOM 662 OG1 THR A 45 29.274 -13.136 14.488 1.00 44.14 O ATOM 663 CG2 THR A 45 31.086 -14.360 15.513 1.00 1.32 C ATOM 0 H THR A 45 29.386 -10.748 15.551 1.00 33.53 H new ATOM 0 HA THR A 45 29.271 -13.026 17.144 1.00 13.24 H new ATOM 0 HB THR A 45 31.146 -12.332 14.848 1.00 13.12 H new ATOM 0 HG1 THR A 45 29.240 -12.389 13.854 1.00 44.14 H new ATOM 0 HG21 THR A 45 31.360 -14.770 14.541 1.00 1.32 H new ATOM 0 HG22 THR A 45 31.981 -14.250 16.126 1.00 1.32 H new ATOM 0 HG23 THR A 45 30.388 -15.036 16.008 1.00 1.32 H new ATOM 671 N LYS A 46 32.122 -11.358 17.331 1.00 11.01 N ATOM 672 CA LYS A 46 33.336 -11.190 18.120 1.00 23.04 C ATOM 673 C LYS A 46 33.007 -11.053 19.603 1.00 13.24 C ATOM 674 O LYS A 46 33.576 -11.751 20.443 1.00 41.32 O ATOM 675 CB LYS A 46 34.113 -9.960 17.644 1.00 71.51 C ATOM 676 CG LYS A 46 35.185 -10.279 16.616 1.00 55.14 C ATOM 677 CD LYS A 46 36.359 -9.321 16.720 1.00 43.24 C ATOM 678 CE LYS A 46 37.615 -9.908 16.094 1.00 71.52 C ATOM 679 NZ LYS A 46 38.334 -8.912 15.253 1.00 3.22 N ATOM 0 H LYS A 46 32.005 -10.671 16.586 1.00 11.01 H new ATOM 0 HA LYS A 46 33.953 -12.078 17.983 1.00 23.04 H new ATOM 0 HB2 LYS A 46 33.414 -9.242 17.216 1.00 71.51 H new ATOM 0 HB3 LYS A 46 34.578 -9.479 18.504 1.00 71.51 H new ATOM 0 HG2 LYS A 46 35.535 -11.301 16.759 1.00 55.14 H new ATOM 0 HG3 LYS A 46 34.758 -10.225 15.615 1.00 55.14 H new ATOM 0 HD2 LYS A 46 36.109 -8.383 16.225 1.00 43.24 H new ATOM 0 HD3 LYS A 46 36.548 -9.088 17.768 1.00 43.24 H new ATOM 0 HE2 LYS A 46 38.279 -10.266 16.881 1.00 71.52 H new ATOM 0 HE3 LYS A 46 37.348 -10.772 15.485 1.00 71.52 H new ATOM 0 HZ1 LYS A 46 39.184 -9.351 14.845 1.00 3.22 H new ATOM 0 HZ2 LYS A 46 37.709 -8.589 14.487 1.00 3.22 H new ATOM 0 HZ3 LYS A 46 38.612 -8.099 15.839 1.00 3.22 H new ATOM 693 N TYR A 47 32.084 -10.151 19.919 1.00 52.05 N ATOM 694 CA TYR A 47 31.679 -9.922 21.301 1.00 63.14 C ATOM 695 C TYR A 47 31.161 -11.208 21.937 1.00 61.44 C ATOM 696 O TYR A 47 31.681 -11.663 22.956 1.00 21.23 O ATOM 697 CB TYR A 47 30.602 -8.838 21.366 1.00 44.11 C ATOM 698 CG TYR A 47 30.930 -7.716 22.325 1.00 42.21 C ATOM 699 CD1 TYR A 47 31.468 -7.982 23.578 1.00 11.13 C ATOM 700 CD2 TYR A 47 30.702 -6.390 21.978 1.00 34.04 C ATOM 701 CE1 TYR A 47 31.768 -6.960 24.458 1.00 24.22 C ATOM 702 CE2 TYR A 47 31.000 -5.362 22.851 1.00 4.22 C ATOM 703 CZ TYR A 47 31.533 -5.652 24.090 1.00 44.11 C ATOM 704 OH TYR A 47 31.831 -4.631 24.963 1.00 40.42 O ATOM 0 H TYR A 47 31.602 -9.566 19.236 1.00 52.05 H new ATOM 0 HA TYR A 47 32.554 -9.589 21.859 1.00 63.14 H new ATOM 0 HB2 TYR A 47 30.456 -8.422 20.369 1.00 44.11 H new ATOM 0 HB3 TYR A 47 29.657 -9.294 21.662 1.00 44.11 H new ATOM 0 HD1 TYR A 47 31.655 -9.005 23.869 1.00 11.13 H new ATOM 0 HD2 TYR A 47 30.285 -6.159 21.009 1.00 34.04 H new ATOM 0 HE1 TYR A 47 32.184 -7.184 25.429 1.00 24.22 H new ATOM 0 HE2 TYR A 47 30.817 -4.337 22.565 1.00 4.22 H new ATOM 0 HH TYR A 47 31.607 -3.771 24.550 1.00 40.42 H new ATOM 714 N CYS A 48 30.134 -11.790 21.327 1.00 41.20 N ATOM 715 CA CYS A 48 29.544 -13.024 21.832 1.00 31.25 C ATOM 716 C CYS A 48 30.604 -14.110 21.988 1.00 11.31 C ATOM 717 O CYS A 48 30.581 -14.882 22.946 1.00 23.44 O ATOM 718 CB CYS A 48 28.437 -13.506 20.894 1.00 72.31 C ATOM 719 SG CYS A 48 27.131 -12.289 20.606 1.00 42.01 S ATOM 0 H CYS A 48 29.693 -11.427 20.482 1.00 41.20 H new ATOM 0 HA CYS A 48 29.115 -12.817 22.812 1.00 31.25 H new ATOM 0 HB2 CYS A 48 28.881 -13.780 19.937 1.00 72.31 H new ATOM 0 HB3 CYS A 48 27.991 -14.410 21.310 1.00 72.31 H new ATOM 0 HG CYS A 48 27.561 -11.377 19.786 1.00 42.01 H new ATOM 725 N LYS A 49 31.532 -14.164 21.038 1.00 14.24 N ATOM 726 CA LYS A 49 32.601 -15.155 21.068 1.00 11.43 C ATOM 727 C LYS A 49 33.537 -14.910 22.248 1.00 50.45 C ATOM 728 O LYS A 49 34.046 -15.852 22.853 1.00 31.11 O ATOM 729 CB LYS A 49 33.393 -15.120 19.759 1.00 32.22 C ATOM 730 CG LYS A 49 34.638 -15.990 19.779 1.00 41.44 C ATOM 731 CD LYS A 49 35.177 -16.222 18.377 1.00 25.52 C ATOM 732 CE LYS A 49 36.358 -15.312 18.076 1.00 21.11 C ATOM 733 NZ LYS A 49 37.653 -15.935 18.469 1.00 52.44 N ATOM 0 H LYS A 49 31.565 -13.533 20.238 1.00 14.24 H new ATOM 0 HA LYS A 49 32.147 -16.139 21.185 1.00 11.43 H new ATOM 0 HB2 LYS A 49 32.746 -15.444 18.944 1.00 32.22 H new ATOM 0 HB3 LYS A 49 33.682 -14.091 19.546 1.00 32.22 H new ATOM 0 HG2 LYS A 49 35.405 -15.516 20.391 1.00 41.44 H new ATOM 0 HG3 LYS A 49 34.406 -16.948 20.244 1.00 41.44 H new ATOM 0 HD2 LYS A 49 35.482 -17.263 18.271 1.00 25.52 H new ATOM 0 HD3 LYS A 49 34.386 -16.046 17.648 1.00 25.52 H new ATOM 0 HE2 LYS A 49 36.375 -15.080 17.011 1.00 21.11 H new ATOM 0 HE3 LYS A 49 36.233 -14.368 18.606 1.00 21.11 H new ATOM 0 HZ1 LYS A 49 38.428 -15.264 18.295 1.00 52.44 H new ATOM 0 HZ2 LYS A 49 37.628 -16.180 19.479 1.00 52.44 H new ATOM 0 HZ3 LYS A 49 37.808 -16.796 17.907 1.00 52.44 H new ATOM 747 N GLU A 50 33.758 -13.638 22.568 1.00 73.41 N ATOM 748 CA GLU A 50 34.632 -13.271 23.676 1.00 62.35 C ATOM 749 C GLU A 50 33.947 -13.523 25.016 1.00 44.32 C ATOM 750 O GLU A 50 34.604 -13.813 26.015 1.00 65.33 O ATOM 751 CB GLU A 50 35.040 -11.801 23.567 1.00 41.44 C ATOM 752 CG GLU A 50 35.803 -11.473 22.294 1.00 74.02 C ATOM 753 CD GLU A 50 37.242 -11.077 22.561 1.00 32.44 C ATOM 754 OE1 GLU A 50 38.104 -11.979 22.623 1.00 52.33 O ATOM 755 OE2 GLU A 50 37.506 -9.866 22.709 1.00 14.41 O ATOM 0 H GLU A 50 33.344 -12.846 22.076 1.00 73.41 H new ATOM 0 HA GLU A 50 35.525 -13.893 23.622 1.00 62.35 H new ATOM 0 HB2 GLU A 50 34.145 -11.180 23.614 1.00 41.44 H new ATOM 0 HB3 GLU A 50 35.656 -11.539 24.427 1.00 41.44 H new ATOM 0 HG2 GLU A 50 35.785 -12.338 21.631 1.00 74.02 H new ATOM 0 HG3 GLU A 50 35.298 -10.661 21.771 1.00 74.02 H new ATOM 762 N GLU A 51 32.623 -13.408 25.028 1.00 40.41 N ATOM 763 CA GLU A 51 31.849 -13.621 26.245 1.00 4.14 C ATOM 764 C GLU A 51 31.667 -15.111 26.520 1.00 53.11 C ATOM 765 O GLU A 51 31.618 -15.540 27.673 1.00 4.05 O ATOM 766 CB GLU A 51 30.484 -12.940 26.134 1.00 35.41 C ATOM 767 CG GLU A 51 30.062 -12.211 27.399 1.00 41.14 C ATOM 768 CD GLU A 51 30.495 -10.758 27.405 1.00 11.35 C ATOM 769 OE1 GLU A 51 31.717 -10.504 27.434 1.00 44.41 O ATOM 770 OE2 GLU A 51 29.612 -9.875 27.383 1.00 41.12 O ATOM 0 H GLU A 51 32.064 -13.169 24.209 1.00 40.41 H new ATOM 0 HA GLU A 51 32.399 -13.181 27.077 1.00 4.14 H new ATOM 0 HB2 GLU A 51 30.508 -12.231 25.307 1.00 35.41 H new ATOM 0 HB3 GLU A 51 29.732 -13.690 25.889 1.00 35.41 H new ATOM 0 HG2 GLU A 51 28.978 -12.264 27.500 1.00 41.14 H new ATOM 0 HG3 GLU A 51 30.488 -12.717 28.265 1.00 41.14 H new ATOM 777 N LEU A 52 31.565 -15.895 25.452 1.00 1.23 N ATOM 778 CA LEU A 52 31.387 -17.337 25.576 1.00 20.45 C ATOM 779 C LEU A 52 32.731 -18.040 25.734 1.00 65.51 C ATOM 780 O LEU A 52 32.822 -19.096 26.360 1.00 42.31 O ATOM 781 CB LEU A 52 30.651 -17.887 24.353 1.00 21.45 C ATOM 782 CG LEU A 52 29.430 -18.762 24.642 1.00 41.41 C ATOM 783 CD1 LEU A 52 28.607 -18.962 23.379 1.00 12.00 C ATOM 784 CD2 LEU A 52 29.859 -20.103 25.220 1.00 52.44 C ATOM 0 H LEU A 52 31.603 -15.556 24.491 1.00 1.23 H new ATOM 0 HA LEU A 52 30.791 -17.529 26.468 1.00 20.45 H new ATOM 0 HB2 LEU A 52 30.333 -17.046 23.737 1.00 21.45 H new ATOM 0 HB3 LEU A 52 31.357 -18.468 23.760 1.00 21.45 H new ATOM 0 HG LEU A 52 28.809 -18.254 25.380 1.00 41.41 H new ATOM 0 HD11 LEU A 52 27.742 -19.587 23.603 1.00 12.00 H new ATOM 0 HD12 LEU A 52 28.269 -17.994 23.008 1.00 12.00 H new ATOM 0 HD13 LEU A 52 29.219 -19.448 22.619 1.00 12.00 H new ATOM 0 HD21 LEU A 52 28.977 -20.712 25.419 1.00 52.44 H new ATOM 0 HD22 LEU A 52 30.502 -20.618 24.506 1.00 52.44 H new ATOM 0 HD23 LEU A 52 30.405 -19.941 26.149 1.00 52.44 H new ATOM 796 N GLY A 53 33.775 -17.446 25.163 1.00 71.44 N ATOM 797 CA GLY A 53 35.101 -18.029 25.253 1.00 41.43 C ATOM 798 C GLY A 53 35.276 -19.217 24.329 1.00 64.34 C ATOM 799 O GLY A 53 36.163 -20.048 24.533 1.00 52.41 O ATOM 0 H GLY A 53 33.726 -16.572 24.640 1.00 71.44 H new ATOM 0 HA2 GLY A 53 35.845 -17.271 25.010 1.00 41.43 H new ATOM 0 HA3 GLY A 53 35.288 -18.341 26.280 1.00 41.43 H new ATOM 803 N THR A 54 34.428 -19.302 23.308 1.00 23.02 N ATOM 804 CA THR A 54 34.491 -20.399 22.351 1.00 24.10 C ATOM 805 C THR A 54 34.242 -19.905 20.931 1.00 42.33 C ATOM 806 O THR A 54 33.364 -19.075 20.698 1.00 33.04 O ATOM 807 CB THR A 54 33.466 -21.498 22.687 1.00 15.23 C ATOM 808 OG1 THR A 54 33.259 -22.340 21.548 1.00 33.30 O ATOM 809 CG2 THR A 54 32.141 -20.887 23.120 1.00 21.41 C ATOM 0 H THR A 54 33.689 -18.623 23.123 1.00 23.02 H new ATOM 0 HA THR A 54 35.495 -20.817 22.416 1.00 24.10 H new ATOM 0 HB THR A 54 33.861 -22.093 23.511 1.00 15.23 H new ATOM 0 HG1 THR A 54 32.339 -22.234 21.226 1.00 33.30 H new ATOM 0 HG21 THR A 54 31.432 -21.682 23.352 1.00 21.41 H new ATOM 0 HG22 THR A 54 32.297 -20.270 24.005 1.00 21.41 H new ATOM 0 HG23 THR A 54 31.744 -20.271 22.313 1.00 21.41 H new ATOM 817 N GLU A 55 35.021 -20.420 19.984 1.00 34.23 N ATOM 818 CA GLU A 55 34.883 -20.030 18.586 1.00 11.52 C ATOM 819 C GLU A 55 33.997 -21.016 17.831 1.00 53.44 C ATOM 820 O GLU A 55 33.978 -21.035 16.599 1.00 10.33 O ATOM 821 CB GLU A 55 36.257 -19.947 17.919 1.00 63.21 C ATOM 822 CG GLU A 55 36.247 -19.205 16.593 1.00 12.33 C ATOM 823 CD GLU A 55 36.998 -19.945 15.504 1.00 43.11 C ATOM 824 OE1 GLU A 55 38.027 -20.579 15.820 1.00 42.35 O ATOM 825 OE2 GLU A 55 36.558 -19.890 14.337 1.00 63.53 O ATOM 0 H GLU A 55 35.753 -21.108 20.160 1.00 34.23 H new ATOM 0 HA GLU A 55 34.412 -19.048 18.554 1.00 11.52 H new ATOM 0 HB2 GLU A 55 36.951 -19.452 18.598 1.00 63.21 H new ATOM 0 HB3 GLU A 55 36.635 -20.957 17.758 1.00 63.21 H new ATOM 0 HG2 GLU A 55 35.216 -19.049 16.276 1.00 12.33 H new ATOM 0 HG3 GLU A 55 36.691 -18.219 16.730 1.00 12.33 H new ATOM 832 N THR A 56 33.263 -21.835 18.577 1.00 13.02 N ATOM 833 CA THR A 56 32.376 -22.825 17.980 1.00 54.14 C ATOM 834 C THR A 56 30.924 -22.361 18.025 1.00 62.21 C ATOM 835 O THR A 56 30.289 -22.376 19.080 1.00 25.45 O ATOM 836 CB THR A 56 32.491 -24.185 18.693 1.00 75.42 C ATOM 837 OG1 THR A 56 33.519 -24.132 19.688 1.00 41.35 O ATOM 838 CG2 THR A 56 32.798 -25.294 17.697 1.00 0.14 C ATOM 0 H THR A 56 33.265 -21.832 19.597 1.00 13.02 H new ATOM 0 HA THR A 56 32.685 -22.941 16.941 1.00 54.14 H new ATOM 0 HB THR A 56 31.535 -24.402 19.171 1.00 75.42 H new ATOM 0 HG1 THR A 56 33.171 -23.698 20.495 1.00 41.35 H new ATOM 0 HG21 THR A 56 32.875 -26.245 18.224 1.00 0.14 H new ATOM 0 HG22 THR A 56 31.998 -25.352 16.959 1.00 0.14 H new ATOM 0 HG23 THR A 56 33.741 -25.081 17.194 1.00 0.14 H new ATOM 846 N LEU A 57 30.403 -21.950 16.874 1.00 3.12 N ATOM 847 CA LEU A 57 29.025 -21.482 16.782 1.00 14.03 C ATOM 848 C LEU A 57 28.480 -21.667 15.370 1.00 51.14 C ATOM 849 O LEU A 57 29.230 -21.637 14.395 1.00 2.01 O ATOM 850 CB LEU A 57 28.937 -20.009 17.186 1.00 21.21 C ATOM 851 CG LEU A 57 29.261 -19.693 18.647 1.00 72.41 C ATOM 852 CD1 LEU A 57 29.280 -18.190 18.876 1.00 23.13 C ATOM 853 CD2 LEU A 57 28.256 -20.363 19.573 1.00 73.14 C ATOM 0 H LEU A 57 30.914 -21.931 15.992 1.00 3.12 H new ATOM 0 HA LEU A 57 28.420 -22.077 17.466 1.00 14.03 H new ATOM 0 HB2 LEU A 57 29.616 -19.438 16.553 1.00 21.21 H new ATOM 0 HB3 LEU A 57 27.928 -19.654 16.973 1.00 21.21 H new ATOM 0 HG LEU A 57 30.252 -20.087 18.873 1.00 72.41 H new ATOM 0 HD11 LEU A 57 29.512 -17.984 19.921 1.00 23.13 H new ATOM 0 HD12 LEU A 57 30.038 -17.734 18.239 1.00 23.13 H new ATOM 0 HD13 LEU A 57 28.303 -17.772 18.632 1.00 23.13 H new ATOM 0 HD21 LEU A 57 28.502 -20.127 20.608 1.00 73.14 H new ATOM 0 HD22 LEU A 57 27.254 -19.999 19.346 1.00 73.14 H new ATOM 0 HD23 LEU A 57 28.292 -21.443 19.428 1.00 73.14 H new ATOM 865 N GLY A 58 27.168 -21.856 15.267 1.00 72.23 N ATOM 866 CA GLY A 58 26.544 -22.041 13.969 1.00 5.12 C ATOM 867 C GLY A 58 26.149 -23.482 13.716 1.00 61.22 C ATOM 868 O GLY A 58 26.258 -23.975 12.593 1.00 54.34 O ATOM 0 H GLY A 58 26.526 -21.884 16.059 1.00 72.23 H new ATOM 0 HA2 GLY A 58 25.659 -21.408 13.901 1.00 5.12 H new ATOM 0 HA3 GLY A 58 27.231 -21.714 13.189 1.00 5.12 H new ATOM 872 N TYR A 59 25.691 -24.161 14.762 1.00 51.32 N ATOM 873 CA TYR A 59 25.282 -25.556 14.648 1.00 10.33 C ATOM 874 C TYR A 59 23.761 -25.680 14.650 1.00 4.52 C ATOM 875 O TYR A 59 23.048 -24.705 14.894 1.00 63.32 O ATOM 876 CB TYR A 59 25.873 -26.377 15.795 1.00 22.22 C ATOM 877 CG TYR A 59 26.754 -27.516 15.333 1.00 74.30 C ATOM 878 CD1 TYR A 59 26.206 -28.740 14.968 1.00 1.03 C ATOM 879 CD2 TYR A 59 28.133 -27.368 15.260 1.00 23.11 C ATOM 880 CE1 TYR A 59 27.007 -29.783 14.546 1.00 31.43 C ATOM 881 CE2 TYR A 59 28.942 -28.406 14.838 1.00 52.32 C ATOM 882 CZ TYR A 59 28.374 -29.611 14.482 1.00 31.55 C ATOM 883 OH TYR A 59 29.175 -30.648 14.061 1.00 31.02 O ATOM 0 H TYR A 59 25.594 -23.768 15.698 1.00 51.32 H new ATOM 0 HA TYR A 59 25.659 -25.943 13.701 1.00 10.33 H new ATOM 0 HB2 TYR A 59 26.454 -25.718 16.441 1.00 22.22 H new ATOM 0 HB3 TYR A 59 25.060 -26.780 16.399 1.00 22.22 H new ATOM 0 HD1 TYR A 59 25.136 -28.878 15.015 1.00 1.03 H new ATOM 0 HD2 TYR A 59 28.581 -26.425 15.538 1.00 23.11 H new ATOM 0 HE1 TYR A 59 26.565 -30.728 14.268 1.00 31.43 H new ATOM 0 HE2 TYR A 59 30.013 -28.274 14.787 1.00 52.32 H new ATOM 0 HH TYR A 59 30.112 -30.363 14.072 1.00 31.02 H new ATOM 893 N CYS A 60 23.272 -26.884 14.378 1.00 64.12 N ATOM 894 CA CYS A 60 21.836 -27.137 14.348 1.00 62.45 C ATOM 895 C CYS A 60 21.127 -26.140 13.437 1.00 63.21 C ATOM 896 O CYS A 60 19.978 -25.770 13.678 1.00 11.34 O ATOM 897 CB CYS A 60 21.254 -27.060 15.760 1.00 71.54 C ATOM 898 SG CYS A 60 21.432 -28.585 16.716 1.00 51.24 S ATOM 0 H CYS A 60 23.848 -27.701 14.175 1.00 64.12 H new ATOM 0 HA CYS A 60 21.677 -28.140 13.952 1.00 62.45 H new ATOM 0 HB2 CYS A 60 21.741 -26.247 16.299 1.00 71.54 H new ATOM 0 HB3 CYS A 60 20.196 -26.808 15.692 1.00 71.54 H new ATOM 0 HG CYS A 60 20.912 -28.421 17.896 1.00 51.24 H new ATOM 904 N THR A 61 21.821 -25.707 12.389 1.00 50.13 N ATOM 905 CA THR A 61 21.260 -24.750 11.443 1.00 34.33 C ATOM 906 C THR A 61 20.103 -25.363 10.662 1.00 62.51 C ATOM 907 O THR A 61 20.295 -25.903 9.572 1.00 51.31 O ATOM 908 CB THR A 61 22.326 -24.249 10.451 1.00 21.21 C ATOM 909 OG1 THR A 61 21.706 -23.487 9.410 1.00 43.35 O ATOM 910 CG2 THR A 61 23.092 -25.416 9.846 1.00 43.55 C ATOM 0 H THR A 61 22.773 -26.004 12.174 1.00 50.13 H new ATOM 0 HA THR A 61 20.894 -23.906 12.027 1.00 34.33 H new ATOM 0 HB THR A 61 23.028 -23.617 10.994 1.00 21.21 H new ATOM 0 HG1 THR A 61 22.391 -23.171 8.784 1.00 43.35 H new ATOM 0 HG21 THR A 61 23.839 -25.038 9.148 1.00 43.55 H new ATOM 0 HG22 THR A 61 23.586 -25.977 10.639 1.00 43.55 H new ATOM 0 HG23 THR A 61 22.400 -26.070 9.316 1.00 43.55 H new ATOM 918 N ASP A 62 18.903 -25.277 11.225 1.00 23.12 N ATOM 919 CA ASP A 62 17.715 -25.822 10.580 1.00 74.22 C ATOM 920 C ASP A 62 16.930 -24.724 9.869 1.00 43.14 C ATOM 921 O ASP A 62 16.865 -23.589 10.340 1.00 11.52 O ATOM 922 CB ASP A 62 16.823 -26.518 11.609 1.00 12.14 C ATOM 923 CG ASP A 62 16.114 -27.730 11.037 1.00 51.51 C ATOM 924 OD1 ASP A 62 16.769 -28.781 10.881 1.00 42.23 O ATOM 925 OD2 ASP A 62 14.904 -27.626 10.744 1.00 21.21 O ATOM 0 H ASP A 62 18.727 -24.835 12.127 1.00 23.12 H new ATOM 0 HA ASP A 62 18.038 -26.552 9.838 1.00 74.22 H new ATOM 0 HB2 ASP A 62 17.428 -26.824 12.462 1.00 12.14 H new ATOM 0 HB3 ASP A 62 16.083 -25.810 11.981 1.00 12.14 H new ATOM 930 N PHE A 63 16.337 -25.069 8.731 1.00 64.54 N ATOM 931 CA PHE A 63 15.559 -24.112 7.953 1.00 62.52 C ATOM 932 C PHE A 63 14.085 -24.507 7.923 1.00 44.24 C ATOM 933 O PHE A 63 13.749 -25.671 7.710 1.00 73.21 O ATOM 934 CB PHE A 63 16.103 -24.020 6.526 1.00 64.43 C ATOM 935 CG PHE A 63 15.329 -23.078 5.649 1.00 64.44 C ATOM 936 CD1 PHE A 63 15.600 -21.720 5.660 1.00 2.42 C ATOM 937 CD2 PHE A 63 14.331 -23.552 4.812 1.00 4.41 C ATOM 938 CE1 PHE A 63 14.889 -20.851 4.855 1.00 52.44 C ATOM 939 CE2 PHE A 63 13.617 -22.687 4.004 1.00 71.41 C ATOM 940 CZ PHE A 63 13.897 -21.335 4.025 1.00 72.25 C ATOM 0 H PHE A 63 16.380 -26.005 8.327 1.00 64.54 H new ATOM 0 HA PHE A 63 15.646 -23.136 8.431 1.00 62.52 H new ATOM 0 HB2 PHE A 63 17.144 -23.698 6.562 1.00 64.43 H new ATOM 0 HB3 PHE A 63 16.093 -25.013 6.077 1.00 64.43 H new ATOM 0 HD1 PHE A 63 16.376 -21.336 6.305 1.00 2.42 H new ATOM 0 HD2 PHE A 63 14.109 -24.609 4.791 1.00 4.41 H new ATOM 0 HE1 PHE A 63 15.109 -19.794 4.875 1.00 52.44 H new ATOM 0 HE2 PHE A 63 12.841 -23.068 3.357 1.00 71.41 H new ATOM 0 HZ PHE A 63 13.341 -20.657 3.394 1.00 72.25 H new ATOM 950 N GLN A 64 13.213 -23.528 8.138 1.00 54.33 N ATOM 951 CA GLN A 64 11.775 -23.773 8.137 1.00 42.45 C ATOM 952 C GLN A 64 11.039 -22.689 7.356 1.00 41.14 C ATOM 953 O GLN A 64 11.028 -21.524 7.752 1.00 40.13 O ATOM 954 CB GLN A 64 11.246 -23.833 9.570 1.00 33.43 C ATOM 955 CG GLN A 64 12.128 -24.638 10.511 1.00 30.11 C ATOM 956 CD GLN A 64 11.514 -24.805 11.887 1.00 21.01 C ATOM 957 OE1 GLN A 64 11.060 -25.891 12.250 1.00 42.24 O ATOM 958 NE2 GLN A 64 11.497 -23.727 12.663 1.00 71.34 N ATOM 0 H GLN A 64 13.476 -22.559 8.315 1.00 54.33 H new ATOM 0 HA GLN A 64 11.595 -24.732 7.650 1.00 42.45 H new ATOM 0 HB2 GLN A 64 11.149 -22.818 9.955 1.00 33.43 H new ATOM 0 HB3 GLN A 64 10.246 -24.268 9.562 1.00 33.43 H new ATOM 0 HG2 GLN A 64 12.312 -25.621 10.078 1.00 30.11 H new ATOM 0 HG3 GLN A 64 13.096 -24.145 10.606 1.00 30.11 H new ATOM 0 HE21 GLN A 64 11.884 -22.847 12.322 1.00 71.34 H new ATOM 0 HE22 GLN A 64 11.097 -23.779 13.600 1.00 71.34 H new ATOM 967 N ALA A 65 10.425 -23.081 6.244 1.00 64.00 N ATOM 968 CA ALA A 65 9.686 -22.143 5.408 1.00 35.44 C ATOM 969 C ALA A 65 8.184 -22.268 5.641 1.00 54.01 C ATOM 970 O ALA A 65 7.695 -23.317 6.060 1.00 30.25 O ATOM 971 CB ALA A 65 10.015 -22.371 3.941 1.00 40.05 C ATOM 0 H ALA A 65 10.425 -24.042 5.901 1.00 64.00 H new ATOM 0 HA ALA A 65 9.988 -21.132 5.683 1.00 35.44 H new ATOM 0 HB1 ALA A 65 9.456 -21.664 3.329 1.00 40.05 H new ATOM 0 HB2 ALA A 65 11.083 -22.225 3.781 1.00 40.05 H new ATOM 0 HB3 ALA A 65 9.742 -23.388 3.661 1.00 40.05 H new ATOM 977 N VAL A 66 7.455 -21.190 5.366 1.00 25.32 N ATOM 978 CA VAL A 66 6.009 -21.179 5.545 1.00 35.31 C ATOM 979 C VAL A 66 5.395 -19.902 4.984 1.00 41.43 C ATOM 980 O VAL A 66 5.206 -18.911 5.691 1.00 62.45 O ATOM 981 CB VAL A 66 5.626 -21.309 7.031 1.00 32.44 C ATOM 982 CG1 VAL A 66 6.361 -20.271 7.865 1.00 13.01 C ATOM 983 CG2 VAL A 66 4.120 -21.178 7.207 1.00 44.11 C ATOM 0 H VAL A 66 7.843 -20.313 5.018 1.00 25.32 H new ATOM 0 HA VAL A 66 5.617 -22.037 5.000 1.00 35.31 H new ATOM 0 HB VAL A 66 5.925 -22.298 7.380 1.00 32.44 H new ATOM 0 HG11 VAL A 66 6.078 -20.378 8.912 1.00 13.01 H new ATOM 0 HG12 VAL A 66 7.436 -20.418 7.763 1.00 13.01 H new ATOM 0 HG13 VAL A 66 6.097 -19.272 7.518 1.00 13.01 H new ATOM 0 HG21 VAL A 66 3.868 -21.272 8.263 1.00 44.11 H new ATOM 0 HG22 VAL A 66 3.794 -20.204 6.842 1.00 44.11 H new ATOM 0 HG23 VAL A 66 3.618 -21.964 6.642 1.00 44.11 H new ATOM 993 N PRO A 67 5.075 -19.922 3.681 1.00 1.42 N ATOM 994 CA PRO A 67 4.477 -18.772 2.995 1.00 33.54 C ATOM 995 C PRO A 67 3.043 -18.512 3.444 1.00 11.21 C ATOM 996 O PRO A 67 2.232 -19.433 3.529 1.00 14.33 O ATOM 997 CB PRO A 67 4.509 -19.183 1.521 1.00 3.01 C ATOM 998 CG PRO A 67 4.512 -20.673 1.543 1.00 54.44 C ATOM 999 CD PRO A 67 5.272 -21.068 2.778 1.00 3.30 C ATOM 0 HA PRO A 67 5.014 -17.847 3.206 1.00 33.54 H new ATOM 0 HB2 PRO A 67 3.643 -18.797 0.983 1.00 3.01 H new ATOM 0 HB3 PRO A 67 5.395 -18.793 1.020 1.00 3.01 H new ATOM 0 HG2 PRO A 67 3.495 -21.065 1.569 1.00 54.44 H new ATOM 0 HG3 PRO A 67 4.986 -21.075 0.648 1.00 54.44 H new ATOM 0 HD2 PRO A 67 4.885 -21.991 3.210 1.00 3.30 H new ATOM 0 HD3 PRO A 67 6.328 -21.234 2.564 1.00 3.30 H new ATOM 1007 N GLY A 68 2.737 -17.250 3.730 1.00 41.31 N ATOM 1008 CA GLY A 68 1.400 -16.891 4.166 1.00 3.21 C ATOM 1009 C GLY A 68 1.306 -16.724 5.670 1.00 44.02 C ATOM 1010 O GLY A 68 0.268 -16.318 6.192 1.00 13.13 O ATOM 0 H GLY A 68 3.391 -16.470 3.668 1.00 41.31 H new ATOM 0 HA2 GLY A 68 1.100 -15.962 3.681 1.00 3.21 H new ATOM 0 HA3 GLY A 68 0.698 -17.660 3.844 1.00 3.21 H new ATOM 1014 N CYS A 69 2.392 -17.039 6.367 1.00 21.12 N ATOM 1015 CA CYS A 69 2.427 -16.924 7.821 1.00 61.31 C ATOM 1016 C CYS A 69 3.721 -16.263 8.283 1.00 3.30 C ATOM 1017 O CYS A 69 3.702 -15.330 9.085 1.00 31.33 O ATOM 1018 CB CYS A 69 2.287 -18.304 8.466 1.00 53.12 C ATOM 1019 SG CYS A 69 0.950 -19.308 7.777 1.00 11.04 S ATOM 0 H CYS A 69 3.260 -17.376 5.949 1.00 21.12 H new ATOM 0 HA CYS A 69 1.590 -16.299 8.132 1.00 61.31 H new ATOM 0 HB2 CYS A 69 3.227 -18.843 8.353 1.00 53.12 H new ATOM 0 HB3 CYS A 69 2.118 -18.178 9.536 1.00 53.12 H new ATOM 0 HG CYS A 69 -0.196 -18.782 8.094 1.00 11.04 H new ATOM 1025 N GLY A 70 4.846 -16.754 7.772 1.00 43.54 N ATOM 1026 CA GLY A 70 6.135 -16.199 8.145 1.00 74.32 C ATOM 1027 C GLY A 70 7.284 -17.130 7.814 1.00 21.43 C ATOM 1028 O GLY A 70 7.274 -17.796 6.778 1.00 3.51 O ATOM 0 H GLY A 70 4.888 -17.526 7.107 1.00 43.54 H new ATOM 0 HA2 GLY A 70 6.281 -15.249 7.630 1.00 74.32 H new ATOM 0 HA3 GLY A 70 6.140 -15.986 9.214 1.00 74.32 H new ATOM 1032 N ILE A 71 8.278 -17.177 8.695 1.00 35.24 N ATOM 1033 CA ILE A 71 9.439 -18.033 8.491 1.00 24.31 C ATOM 1034 C ILE A 71 10.030 -18.486 9.822 1.00 35.13 C ATOM 1035 O ILE A 71 9.932 -17.784 10.827 1.00 3.44 O ATOM 1036 CB ILE A 71 10.531 -17.315 7.676 1.00 23.41 C ATOM 1037 CG1 ILE A 71 9.931 -16.697 6.412 1.00 61.45 C ATOM 1038 CG2 ILE A 71 11.649 -18.284 7.320 1.00 42.14 C ATOM 1039 CD1 ILE A 71 10.945 -15.976 5.551 1.00 23.34 C ATOM 0 H ILE A 71 8.302 -16.632 9.557 1.00 35.24 H new ATOM 0 HA ILE A 71 9.094 -18.904 7.934 1.00 24.31 H new ATOM 0 HB ILE A 71 10.951 -16.514 8.285 1.00 23.41 H new ATOM 0 HG12 ILE A 71 9.459 -17.483 5.822 1.00 61.45 H new ATOM 0 HG13 ILE A 71 9.146 -15.997 6.697 1.00 61.45 H new ATOM 0 HG21 ILE A 71 12.413 -17.762 6.744 1.00 42.14 H new ATOM 0 HG22 ILE A 71 12.091 -18.681 8.234 1.00 42.14 H new ATOM 0 HG23 ILE A 71 11.245 -19.104 6.727 1.00 42.14 H new ATOM 0 HD11 ILE A 71 10.449 -15.563 4.673 1.00 23.34 H new ATOM 0 HD12 ILE A 71 11.400 -15.168 6.124 1.00 23.34 H new ATOM 0 HD13 ILE A 71 11.718 -16.677 5.235 1.00 23.34 H new ATOM 1051 N GLY A 72 10.644 -19.665 9.821 1.00 71.43 N ATOM 1052 CA GLY A 72 11.243 -20.192 11.033 1.00 13.54 C ATOM 1053 C GLY A 72 12.547 -20.917 10.768 1.00 31.14 C ATOM 1054 O GLY A 72 12.838 -21.290 9.631 1.00 14.01 O ATOM 0 H GLY A 72 10.737 -20.265 9.002 1.00 71.43 H new ATOM 0 HA2 GLY A 72 11.421 -19.374 11.732 1.00 13.54 H new ATOM 0 HA3 GLY A 72 10.542 -20.875 11.513 1.00 13.54 H new ATOM 1058 N CYS A 73 13.335 -21.117 11.819 1.00 51.41 N ATOM 1059 CA CYS A 73 14.617 -21.800 11.694 1.00 63.51 C ATOM 1060 C CYS A 73 15.188 -22.142 13.067 1.00 55.23 C ATOM 1061 O CYS A 73 14.686 -21.680 14.092 1.00 74.50 O ATOM 1062 CB CYS A 73 15.608 -20.932 10.918 1.00 5.11 C ATOM 1063 SG CYS A 73 15.705 -19.223 11.500 1.00 2.31 S ATOM 0 H CYS A 73 13.108 -20.816 12.767 1.00 51.41 H new ATOM 0 HA CYS A 73 14.453 -22.729 11.147 1.00 63.51 H new ATOM 0 HB2 CYS A 73 16.598 -21.383 10.983 1.00 5.11 H new ATOM 0 HB3 CYS A 73 15.326 -20.931 9.865 1.00 5.11 H new ATOM 0 HG CYS A 73 16.571 -18.569 10.784 1.00 2.31 H new ATOM 1069 N LYS A 74 16.239 -22.954 13.080 1.00 73.35 N ATOM 1070 CA LYS A 74 16.878 -23.359 14.326 1.00 63.13 C ATOM 1071 C LYS A 74 18.389 -23.165 14.250 1.00 64.34 C ATOM 1072 O LYS A 74 19.010 -23.442 13.223 1.00 20.52 O ATOM 1073 CB LYS A 74 16.556 -24.823 14.637 1.00 41.55 C ATOM 1074 CG LYS A 74 15.080 -25.159 14.515 1.00 20.35 C ATOM 1075 CD LYS A 74 14.701 -26.332 15.405 1.00 52.52 C ATOM 1076 CE LYS A 74 13.257 -26.756 15.182 1.00 2.22 C ATOM 1077 NZ LYS A 74 13.158 -27.922 14.261 1.00 15.14 N ATOM 0 H LYS A 74 16.667 -23.345 12.241 1.00 73.35 H new ATOM 0 HA LYS A 74 16.488 -22.730 15.126 1.00 63.13 H new ATOM 0 HB2 LYS A 74 17.123 -25.463 13.961 1.00 41.55 H new ATOM 0 HB3 LYS A 74 16.890 -25.053 15.649 1.00 41.55 H new ATOM 0 HG2 LYS A 74 14.484 -24.288 14.786 1.00 20.35 H new ATOM 0 HG3 LYS A 74 14.844 -25.397 13.478 1.00 20.35 H new ATOM 0 HD2 LYS A 74 15.364 -27.173 15.202 1.00 52.52 H new ATOM 0 HD3 LYS A 74 14.844 -26.058 16.450 1.00 52.52 H new ATOM 0 HE2 LYS A 74 12.801 -27.009 16.139 1.00 2.22 H new ATOM 0 HE3 LYS A 74 12.692 -25.919 14.771 1.00 2.22 H new ATOM 0 HZ1 LYS A 74 12.159 -28.181 14.134 1.00 15.14 H new ATOM 0 HZ2 LYS A 74 13.570 -27.672 13.339 1.00 15.14 H new ATOM 0 HZ3 LYS A 74 13.676 -28.728 14.665 1.00 15.14 H new ATOM 1091 N VAL A 75 18.976 -22.689 15.343 1.00 23.12 N ATOM 1092 CA VAL A 75 20.415 -22.461 15.401 1.00 42.11 C ATOM 1093 C VAL A 75 20.916 -22.473 16.841 1.00 62.13 C ATOM 1094 O VAL A 75 20.559 -21.608 17.640 1.00 32.35 O ATOM 1095 CB VAL A 75 20.797 -21.120 14.747 1.00 5.32 C ATOM 1096 CG1 VAL A 75 20.870 -21.264 13.235 1.00 62.33 C ATOM 1097 CG2 VAL A 75 19.807 -20.034 15.140 1.00 32.43 C ATOM 0 H VAL A 75 18.477 -22.454 16.201 1.00 23.12 H new ATOM 0 HA VAL A 75 20.887 -23.274 14.849 1.00 42.11 H new ATOM 0 HB VAL A 75 21.783 -20.828 15.108 1.00 5.32 H new ATOM 0 HG11 VAL A 75 21.141 -20.306 12.791 1.00 62.33 H new ATOM 0 HG12 VAL A 75 21.622 -22.010 12.976 1.00 62.33 H new ATOM 0 HG13 VAL A 75 19.899 -21.580 12.852 1.00 62.33 H new ATOM 0 HG21 VAL A 75 20.093 -19.094 14.669 1.00 32.43 H new ATOM 0 HG22 VAL A 75 18.807 -20.316 14.810 1.00 32.43 H new ATOM 0 HG23 VAL A 75 19.811 -19.913 16.223 1.00 32.43 H new ATOM 1107 N SER A 76 21.747 -23.459 17.164 1.00 33.22 N ATOM 1108 CA SER A 76 22.295 -23.586 18.509 1.00 21.34 C ATOM 1109 C SER A 76 23.535 -24.475 18.509 1.00 70.32 C ATOM 1110 O SER A 76 23.503 -25.603 18.018 1.00 43.23 O ATOM 1111 CB SER A 76 21.243 -24.160 19.460 1.00 74.31 C ATOM 1112 OG SER A 76 21.035 -25.541 19.217 1.00 54.21 O ATOM 0 H SER A 76 22.055 -24.181 16.513 1.00 33.22 H new ATOM 0 HA SER A 76 22.581 -22.592 18.853 1.00 21.34 H new ATOM 0 HB2 SER A 76 21.562 -24.013 20.492 1.00 74.31 H new ATOM 0 HB3 SER A 76 20.304 -23.620 19.337 1.00 74.31 H new ATOM 0 HG SER A 76 20.765 -25.983 20.049 1.00 54.21 H new ATOM 1118 N ASN A 77 24.627 -23.958 19.063 1.00 15.01 N ATOM 1119 CA ASN A 77 25.878 -24.704 19.127 1.00 43.44 C ATOM 1120 C ASN A 77 26.033 -25.393 20.479 1.00 71.02 C ATOM 1121 O ASN A 77 27.039 -26.053 20.740 1.00 33.10 O ATOM 1122 CB ASN A 77 27.065 -23.770 18.879 1.00 61.43 C ATOM 1123 CG ASN A 77 28.323 -24.525 18.492 1.00 11.45 C ATOM 1124 OD1 ASN A 77 29.004 -25.096 19.344 1.00 13.14 O ATOM 1125 ND2 ASN A 77 28.637 -24.529 17.202 1.00 21.23 N ATOM 0 H ASN A 77 24.671 -23.025 19.474 1.00 15.01 H new ATOM 0 HA ASN A 77 25.856 -25.469 18.351 1.00 43.44 H new ATOM 0 HB2 ASN A 77 26.810 -23.065 18.088 1.00 61.43 H new ATOM 0 HB3 ASN A 77 27.258 -23.185 19.778 1.00 61.43 H new ATOM 0 HD21 ASN A 77 29.472 -25.019 16.882 1.00 21.23 H new ATOM 0 HD22 ASN A 77 28.043 -24.042 16.531 1.00 21.23 H new ATOM 1132 N VAL A 78 25.029 -25.235 21.336 1.00 72.55 N ATOM 1133 CA VAL A 78 25.052 -25.844 22.660 1.00 14.34 C ATOM 1134 C VAL A 78 25.487 -27.303 22.588 1.00 73.03 C ATOM 1135 O VAL A 78 26.415 -27.719 23.280 1.00 41.21 O ATOM 1136 CB VAL A 78 23.671 -25.764 23.338 1.00 32.33 C ATOM 1137 CG1 VAL A 78 23.698 -26.462 24.689 1.00 22.54 C ATOM 1138 CG2 VAL A 78 23.233 -24.315 23.487 1.00 42.03 C ATOM 0 H VAL A 78 24.190 -24.690 21.137 1.00 72.55 H new ATOM 0 HA VAL A 78 25.774 -25.283 23.254 1.00 14.34 H new ATOM 0 HB VAL A 78 22.946 -26.276 22.705 1.00 32.33 H new ATOM 0 HG11 VAL A 78 22.714 -26.395 25.153 1.00 22.54 H new ATOM 0 HG12 VAL A 78 23.964 -27.510 24.552 1.00 22.54 H new ATOM 0 HG13 VAL A 78 24.436 -25.982 25.332 1.00 22.54 H new ATOM 0 HG21 VAL A 78 22.255 -24.278 23.968 1.00 42.03 H new ATOM 0 HG22 VAL A 78 23.958 -23.777 24.097 1.00 42.03 H new ATOM 0 HG23 VAL A 78 23.171 -23.851 22.503 1.00 42.03 H new ATOM 1148 N GLU A 79 24.809 -28.076 21.744 1.00 4.41 N ATOM 1149 CA GLU A 79 25.127 -29.489 21.581 1.00 34.55 C ATOM 1150 C GLU A 79 26.610 -29.683 21.279 1.00 32.13 C ATOM 1151 O GLU A 79 27.263 -30.553 21.854 1.00 61.03 O ATOM 1152 CB GLU A 79 24.283 -30.099 20.460 1.00 53.41 C ATOM 1153 CG GLU A 79 24.440 -29.389 19.126 1.00 40.14 C ATOM 1154 CD GLU A 79 25.470 -30.050 18.231 1.00 61.52 C ATOM 1155 OE1 GLU A 79 25.344 -31.268 17.982 1.00 42.12 O ATOM 1156 OE2 GLU A 79 26.401 -29.352 17.780 1.00 45.30 O ATOM 0 H GLU A 79 24.037 -27.747 21.164 1.00 4.41 H new ATOM 0 HA GLU A 79 24.896 -29.996 22.518 1.00 34.55 H new ATOM 0 HB2 GLU A 79 24.557 -31.147 20.339 1.00 53.41 H new ATOM 0 HB3 GLU A 79 23.233 -30.076 20.753 1.00 53.41 H new ATOM 0 HG2 GLU A 79 23.478 -29.369 18.614 1.00 40.14 H new ATOM 0 HG3 GLU A 79 24.729 -28.353 19.302 1.00 40.14 H new ATOM 1163 N GLY A 80 27.135 -28.865 20.372 1.00 12.11 N ATOM 1164 CA GLY A 80 28.536 -28.962 20.008 1.00 23.12 C ATOM 1165 C GLY A 80 29.460 -28.665 21.173 1.00 53.20 C ATOM 1166 O GLY A 80 30.533 -29.257 21.289 1.00 20.04 O ATOM 0 H GLY A 80 26.615 -28.137 19.883 1.00 12.11 H new ATOM 0 HA2 GLY A 80 28.742 -29.964 19.631 1.00 23.12 H new ATOM 0 HA3 GLY A 80 28.746 -28.267 19.195 1.00 23.12 H new ATOM 1170 N ILE A 81 29.043 -27.744 22.036 1.00 23.40 N ATOM 1171 CA ILE A 81 29.841 -27.370 23.197 1.00 44.43 C ATOM 1172 C ILE A 81 29.735 -28.418 24.299 1.00 54.10 C ATOM 1173 O ILE A 81 30.677 -29.172 24.547 1.00 15.13 O ATOM 1174 CB ILE A 81 29.409 -26.003 23.760 1.00 51.02 C ATOM 1175 CG1 ILE A 81 29.468 -24.934 22.666 1.00 25.34 C ATOM 1176 CG2 ILE A 81 30.289 -25.613 24.938 1.00 41.12 C ATOM 1177 CD1 ILE A 81 30.874 -24.622 22.203 1.00 1.31 C ATOM 0 H ILE A 81 28.158 -27.244 21.953 1.00 23.40 H new ATOM 0 HA ILE A 81 30.876 -27.305 22.860 1.00 44.43 H new ATOM 0 HB ILE A 81 28.380 -26.080 24.111 1.00 51.02 H new ATOM 0 HG12 ILE A 81 28.878 -25.266 21.812 1.00 25.34 H new ATOM 0 HG13 ILE A 81 29.005 -24.020 23.037 1.00 25.34 H new ATOM 0 HG21 ILE A 81 29.971 -24.645 25.325 1.00 41.12 H new ATOM 0 HG22 ILE A 81 30.200 -26.364 25.723 1.00 41.12 H new ATOM 0 HG23 ILE A 81 31.327 -25.550 24.612 1.00 41.12 H new ATOM 0 HD11 ILE A 81 30.840 -23.857 21.428 1.00 1.31 H new ATOM 0 HD12 ILE A 81 31.462 -24.259 23.046 1.00 1.31 H new ATOM 0 HD13 ILE A 81 31.334 -25.525 21.802 1.00 1.31 H new ATOM 1189 N LEU A 82 28.581 -28.462 24.956 1.00 2.54 N ATOM 1190 CA LEU A 82 28.349 -29.419 26.032 1.00 63.40 C ATOM 1191 C LEU A 82 28.654 -30.841 25.570 1.00 1.14 C ATOM 1192 O LEU A 82 29.290 -31.614 26.286 1.00 1.44 O ATOM 1193 CB LEU A 82 26.902 -29.329 26.519 1.00 2.53 C ATOM 1194 CG LEU A 82 26.704 -28.788 27.936 1.00 33.40 C ATOM 1195 CD1 LEU A 82 27.283 -29.752 28.961 1.00 51.45 C ATOM 1196 CD2 LEU A 82 27.339 -27.413 28.076 1.00 13.41 C ATOM 0 H LEU A 82 27.791 -27.846 24.762 1.00 2.54 H new ATOM 0 HA LEU A 82 29.019 -29.172 26.856 1.00 63.40 H new ATOM 0 HB2 LEU A 82 26.346 -28.695 25.828 1.00 2.53 H new ATOM 0 HB3 LEU A 82 26.459 -30.324 26.466 1.00 2.53 H new ATOM 0 HG LEU A 82 25.634 -28.692 28.121 1.00 33.40 H new ATOM 0 HD11 LEU A 82 27.133 -29.351 29.963 1.00 51.45 H new ATOM 0 HD12 LEU A 82 26.782 -30.716 28.877 1.00 51.45 H new ATOM 0 HD13 LEU A 82 28.350 -29.881 28.778 1.00 51.45 H new ATOM 0 HD21 LEU A 82 27.188 -27.044 29.091 1.00 13.41 H new ATOM 0 HD22 LEU A 82 28.407 -27.483 27.870 1.00 13.41 H new ATOM 0 HD23 LEU A 82 26.877 -26.725 27.367 1.00 13.41 H new ATOM 1208 N ALA A 83 28.197 -31.178 24.369 1.00 45.04 N ATOM 1209 CA ALA A 83 28.425 -32.505 23.810 1.00 50.35 C ATOM 1210 C ALA A 83 27.785 -33.583 24.677 1.00 31.20 C ATOM 1211 O ALA A 83 28.131 -34.760 24.577 1.00 54.13 O ATOM 1212 CB ALA A 83 29.916 -32.764 23.656 1.00 23.22 C ATOM 0 H ALA A 83 27.667 -30.551 23.764 1.00 45.04 H new ATOM 0 HA ALA A 83 27.958 -32.543 22.826 1.00 50.35 H new ATOM 0 HB1 ALA A 83 30.071 -33.758 23.238 1.00 23.22 H new ATOM 0 HB2 ALA A 83 30.348 -32.018 22.989 1.00 23.22 H new ATOM 0 HB3 ALA A 83 30.399 -32.701 24.631 1.00 23.22 H new ATOM 1218 N ALA A 84 26.851 -33.174 25.529 1.00 53.40 N ATOM 1219 CA ALA A 84 26.162 -34.105 26.413 1.00 33.31 C ATOM 1220 C ALA A 84 24.664 -33.823 26.448 1.00 14.13 C ATOM 1221 O ALA A 84 23.850 -34.743 26.525 1.00 74.32 O ATOM 1222 CB ALA A 84 26.747 -34.033 27.815 1.00 24.45 C ATOM 0 H ALA A 84 26.554 -32.203 25.626 1.00 53.40 H new ATOM 0 HA ALA A 84 26.306 -35.112 26.022 1.00 33.31 H new ATOM 0 HB1 ALA A 84 26.223 -34.734 28.465 1.00 24.45 H new ATOM 0 HB2 ALA A 84 27.805 -34.292 27.781 1.00 24.45 H new ATOM 0 HB3 ALA A 84 26.633 -33.022 28.205 1.00 24.45 H new ATOM 1228 N VAL A 85 24.306 -32.544 26.393 1.00 53.12 N ATOM 1229 CA VAL A 85 22.905 -32.140 26.418 1.00 71.20 C ATOM 1230 C VAL A 85 22.587 -31.188 25.271 1.00 53.03 C ATOM 1231 O VAL A 85 22.609 -29.966 25.421 1.00 63.24 O ATOM 1232 CB VAL A 85 22.541 -31.460 27.751 1.00 33.11 C ATOM 1233 CG1 VAL A 85 23.554 -30.379 28.094 1.00 64.03 C ATOM 1234 CG2 VAL A 85 21.135 -30.883 27.688 1.00 75.23 C ATOM 0 H VAL A 85 24.967 -31.770 26.331 1.00 53.12 H new ATOM 0 HA VAL A 85 22.312 -33.048 26.308 1.00 71.20 H new ATOM 0 HB VAL A 85 22.566 -32.211 28.540 1.00 33.11 H new ATOM 0 HG11 VAL A 85 23.280 -29.910 29.039 1.00 64.03 H new ATOM 0 HG12 VAL A 85 24.545 -30.824 28.184 1.00 64.03 H new ATOM 0 HG13 VAL A 85 23.564 -29.627 27.305 1.00 64.03 H new ATOM 0 HG21 VAL A 85 20.894 -30.406 28.638 1.00 75.23 H new ATOM 0 HG22 VAL A 85 21.080 -30.145 26.888 1.00 75.23 H new ATOM 0 HG23 VAL A 85 20.422 -31.684 27.493 1.00 75.23 H new ATOM 1244 N PRO A 86 22.282 -31.758 24.096 1.00 70.44 N ATOM 1245 CA PRO A 86 21.952 -30.978 22.899 1.00 31.51 C ATOM 1246 C PRO A 86 20.604 -30.276 23.019 1.00 51.42 C ATOM 1247 O PRO A 86 19.619 -30.874 23.450 1.00 12.34 O ATOM 1248 CB PRO A 86 21.909 -32.032 21.790 1.00 72.24 C ATOM 1249 CG PRO A 86 21.589 -33.307 22.490 1.00 25.45 C ATOM 1250 CD PRO A 86 22.236 -33.209 23.845 1.00 54.43 C ATOM 0 HA PRO A 86 22.673 -30.180 22.720 1.00 31.51 H new ATOM 0 HB2 PRO A 86 21.153 -31.790 21.043 1.00 72.24 H new ATOM 0 HB3 PRO A 86 22.864 -32.096 21.268 1.00 72.24 H new ATOM 0 HG2 PRO A 86 20.511 -33.442 22.581 1.00 25.45 H new ATOM 0 HG3 PRO A 86 21.972 -34.164 21.935 1.00 25.45 H new ATOM 0 HD2 PRO A 86 21.656 -33.730 24.606 1.00 54.43 H new ATOM 0 HD3 PRO A 86 23.233 -33.649 23.847 1.00 54.43 H new ATOM 1258 N GLN A 87 20.568 -29.004 22.634 1.00 65.13 N ATOM 1259 CA GLN A 87 19.340 -28.221 22.699 1.00 44.33 C ATOM 1260 C GLN A 87 19.190 -27.340 21.463 1.00 45.13 C ATOM 1261 O GLN A 87 19.822 -26.288 21.356 1.00 64.24 O ATOM 1262 CB GLN A 87 19.328 -27.356 23.960 1.00 5.24 C ATOM 1263 CG GLN A 87 18.030 -27.445 24.747 1.00 44.55 C ATOM 1264 CD GLN A 87 17.412 -26.085 25.008 1.00 63.21 C ATOM 1265 OE1 GLN A 87 17.525 -25.540 26.106 1.00 0.12 O ATOM 1266 NE2 GLN A 87 16.754 -25.530 23.997 1.00 2.42 N ATOM 0 H GLN A 87 21.375 -28.494 22.274 1.00 65.13 H new ATOM 0 HA GLN A 87 18.499 -28.914 22.734 1.00 44.33 H new ATOM 0 HB2 GLN A 87 20.155 -27.656 24.604 1.00 5.24 H new ATOM 0 HB3 GLN A 87 19.503 -26.317 23.680 1.00 5.24 H new ATOM 0 HG2 GLN A 87 17.319 -28.064 24.200 1.00 44.55 H new ATOM 0 HG3 GLN A 87 18.219 -27.943 25.698 1.00 44.55 H new ATOM 0 HE21 GLN A 87 16.686 -26.018 23.104 1.00 2.42 H new ATOM 0 HE22 GLN A 87 16.317 -24.616 24.113 1.00 2.42 H new ATOM 1275 N THR A 88 18.350 -27.776 20.530 1.00 52.04 N ATOM 1276 CA THR A 88 18.118 -27.028 19.300 1.00 31.52 C ATOM 1277 C THR A 88 17.135 -25.886 19.529 1.00 73.15 C ATOM 1278 O THR A 88 15.951 -26.113 19.779 1.00 30.33 O ATOM 1279 CB THR A 88 17.578 -27.940 18.182 1.00 13.20 C ATOM 1280 OG1 THR A 88 18.123 -29.257 18.318 1.00 75.14 O ATOM 1281 CG2 THR A 88 17.927 -27.380 16.811 1.00 11.34 C ATOM 0 H THR A 88 17.819 -28.644 20.602 1.00 52.04 H new ATOM 0 HA THR A 88 19.080 -26.619 18.992 1.00 31.52 H new ATOM 0 HB THR A 88 16.493 -27.985 18.273 1.00 13.20 H new ATOM 0 HG1 THR A 88 19.019 -29.283 17.922 1.00 75.14 H new ATOM 0 HG21 THR A 88 17.535 -28.041 16.038 1.00 11.34 H new ATOM 0 HG22 THR A 88 17.486 -26.390 16.699 1.00 11.34 H new ATOM 0 HG23 THR A 88 19.010 -27.308 16.712 1.00 11.34 H new ATOM 1289 N PHE A 89 17.632 -24.657 19.439 1.00 0.05 N ATOM 1290 CA PHE A 89 16.797 -23.478 19.637 1.00 74.12 C ATOM 1291 C PHE A 89 16.074 -23.101 18.347 1.00 65.25 C ATOM 1292 O PHE A 89 16.704 -22.735 17.354 1.00 2.13 O ATOM 1293 CB PHE A 89 17.645 -22.301 20.122 1.00 21.02 C ATOM 1294 CG PHE A 89 17.299 -21.845 21.511 1.00 51.13 C ATOM 1295 CD1 PHE A 89 17.556 -22.655 22.605 1.00 74.53 C ATOM 1296 CD2 PHE A 89 16.716 -20.606 21.722 1.00 43.41 C ATOM 1297 CE1 PHE A 89 17.239 -22.239 23.884 1.00 54.41 C ATOM 1298 CE2 PHE A 89 16.398 -20.183 22.999 1.00 75.33 C ATOM 1299 CZ PHE A 89 16.658 -21.001 24.081 1.00 72.21 C ATOM 0 H PHE A 89 18.609 -24.451 19.230 1.00 0.05 H new ATOM 0 HA PHE A 89 16.051 -23.716 20.395 1.00 74.12 H new ATOM 0 HB2 PHE A 89 18.697 -22.585 20.093 1.00 21.02 H new ATOM 0 HB3 PHE A 89 17.521 -21.466 19.433 1.00 21.02 H new ATOM 0 HD1 PHE A 89 18.010 -23.624 22.456 1.00 74.53 H new ATOM 0 HD2 PHE A 89 16.508 -19.963 20.879 1.00 43.41 H new ATOM 0 HE1 PHE A 89 17.445 -22.880 24.728 1.00 54.41 H new ATOM 0 HE2 PHE A 89 15.947 -19.214 23.150 1.00 75.33 H new ATOM 0 HZ PHE A 89 16.408 -20.674 25.079 1.00 72.21 H new ATOM 1309 N SER A 90 14.749 -23.195 18.368 1.00 13.45 N ATOM 1310 CA SER A 90 13.940 -22.868 17.200 1.00 50.01 C ATOM 1311 C SER A 90 13.308 -21.487 17.345 1.00 1.13 C ATOM 1312 O SER A 90 12.830 -21.120 18.419 1.00 42.12 O ATOM 1313 CB SER A 90 12.849 -23.922 16.998 1.00 43.45 C ATOM 1314 OG SER A 90 11.657 -23.558 17.672 1.00 4.31 O ATOM 0 H SER A 90 14.212 -23.495 19.182 1.00 13.45 H new ATOM 0 HA SER A 90 14.593 -22.859 16.328 1.00 50.01 H new ATOM 0 HB2 SER A 90 12.647 -24.041 15.934 1.00 43.45 H new ATOM 0 HB3 SER A 90 13.198 -24.887 17.366 1.00 43.45 H new ATOM 0 HG SER A 90 10.975 -24.247 17.526 1.00 4.31 H new ATOM 1320 N VAL A 91 13.310 -20.725 16.256 1.00 13.32 N ATOM 1321 CA VAL A 91 12.736 -19.384 16.260 1.00 22.24 C ATOM 1322 C VAL A 91 11.759 -19.201 15.104 1.00 4.33 C ATOM 1323 O VAL A 91 12.116 -19.389 13.940 1.00 14.23 O ATOM 1324 CB VAL A 91 13.831 -18.305 16.169 1.00 3.11 C ATOM 1325 CG1 VAL A 91 14.685 -18.514 14.928 1.00 51.15 C ATOM 1326 CG2 VAL A 91 13.211 -16.916 16.172 1.00 2.22 C ATOM 0 H VAL A 91 13.703 -21.013 15.360 1.00 13.32 H new ATOM 0 HA VAL A 91 12.202 -19.271 17.204 1.00 22.24 H new ATOM 0 HB VAL A 91 14.476 -18.392 17.043 1.00 3.11 H new ATOM 0 HG11 VAL A 91 15.453 -17.742 14.881 1.00 51.15 H new ATOM 0 HG12 VAL A 91 15.158 -19.495 14.973 1.00 51.15 H new ATOM 0 HG13 VAL A 91 14.056 -18.455 14.040 1.00 51.15 H new ATOM 0 HG21 VAL A 91 13.999 -16.166 16.107 1.00 2.22 H new ATOM 0 HG22 VAL A 91 12.542 -16.814 15.318 1.00 2.22 H new ATOM 0 HG23 VAL A 91 12.647 -16.771 17.094 1.00 2.22 H new ATOM 1336 N LEU A 92 10.526 -18.832 15.432 1.00 1.02 N ATOM 1337 CA LEU A 92 9.496 -18.622 14.421 1.00 40.22 C ATOM 1338 C LEU A 92 8.977 -17.188 14.462 1.00 62.04 C ATOM 1339 O LEU A 92 8.516 -16.714 15.500 1.00 1.13 O ATOM 1340 CB LEU A 92 8.340 -19.601 14.631 1.00 13.12 C ATOM 1341 CG LEU A 92 8.579 -21.034 14.155 1.00 74.11 C ATOM 1342 CD1 LEU A 92 9.520 -21.762 15.103 1.00 53.45 C ATOM 1343 CD2 LEU A 92 7.259 -21.782 14.032 1.00 21.21 C ATOM 0 H LEU A 92 10.215 -18.672 16.390 1.00 1.02 H new ATOM 0 HA LEU A 92 9.941 -18.800 13.442 1.00 40.22 H new ATOM 0 HB2 LEU A 92 8.102 -19.628 15.694 1.00 13.12 H new ATOM 0 HB3 LEU A 92 7.462 -19.210 14.117 1.00 13.12 H new ATOM 0 HG LEU A 92 9.046 -20.996 13.171 1.00 74.11 H new ATOM 0 HD11 LEU A 92 9.678 -22.780 14.748 1.00 53.45 H new ATOM 0 HD12 LEU A 92 10.475 -21.238 15.141 1.00 53.45 H new ATOM 0 HD13 LEU A 92 9.082 -21.790 16.101 1.00 53.45 H new ATOM 0 HD21 LEU A 92 7.448 -22.800 13.692 1.00 21.21 H new ATOM 0 HD22 LEU A 92 6.765 -21.810 15.003 1.00 21.21 H new ATOM 0 HD23 LEU A 92 6.618 -21.273 13.313 1.00 21.21 H new ATOM 1355 N ILE A 93 9.054 -16.504 13.325 1.00 31.01 N ATOM 1356 CA ILE A 93 8.589 -15.126 13.231 1.00 51.23 C ATOM 1357 C ILE A 93 7.531 -14.976 12.143 1.00 41.24 C ATOM 1358 O ILE A 93 7.753 -15.349 10.991 1.00 15.44 O ATOM 1359 CB ILE A 93 9.751 -14.158 12.938 1.00 20.41 C ATOM 1360 CG1 ILE A 93 9.241 -12.717 12.877 1.00 33.23 C ATOM 1361 CG2 ILE A 93 10.441 -14.537 11.636 1.00 75.31 C ATOM 1362 CD1 ILE A 93 10.329 -11.702 12.608 1.00 1.35 C ATOM 0 H ILE A 93 9.434 -16.882 12.457 1.00 31.01 H new ATOM 0 HA ILE A 93 8.152 -14.874 14.197 1.00 51.23 H new ATOM 0 HB ILE A 93 10.478 -14.232 13.747 1.00 20.41 H new ATOM 0 HG12 ILE A 93 8.484 -12.641 12.097 1.00 33.23 H new ATOM 0 HG13 ILE A 93 8.753 -12.473 13.820 1.00 33.23 H new ATOM 0 HG21 ILE A 93 11.260 -13.844 11.443 1.00 75.31 H new ATOM 0 HG22 ILE A 93 10.835 -15.550 11.714 1.00 75.31 H new ATOM 0 HG23 ILE A 93 9.724 -14.489 10.817 1.00 75.31 H new ATOM 0 HD11 ILE A 93 9.895 -10.703 12.578 1.00 1.35 H new ATOM 0 HD12 ILE A 93 11.075 -11.750 13.401 1.00 1.35 H new ATOM 0 HD13 ILE A 93 10.802 -11.921 11.651 1.00 1.35 H new ATOM 1374 N GLY A 94 6.380 -14.425 12.516 1.00 51.12 N ATOM 1375 CA GLY A 94 5.305 -14.233 11.560 1.00 70.22 C ATOM 1376 C GLY A 94 4.289 -13.210 12.027 1.00 31.13 C ATOM 1377 O GLY A 94 4.432 -12.631 13.103 1.00 14.30 O ATOM 0 H GLY A 94 6.173 -14.108 13.463 1.00 51.12 H new ATOM 0 HA2 GLY A 94 5.724 -13.914 10.606 1.00 70.22 H new ATOM 0 HA3 GLY A 94 4.804 -15.185 11.386 1.00 70.22 H new ATOM 1381 N ASN A 95 3.261 -12.986 11.216 1.00 75.23 N ATOM 1382 CA ASN A 95 2.217 -12.024 11.551 1.00 4.33 C ATOM 1383 C ASN A 95 1.022 -12.720 12.195 1.00 0.51 C ATOM 1384 O ASN A 95 1.108 -13.881 12.595 1.00 2.42 O ATOM 1385 CB ASN A 95 1.769 -11.269 10.298 1.00 35.13 C ATOM 1386 CG ASN A 95 0.949 -12.137 9.363 1.00 20.21 C ATOM 1387 OD1 ASN A 95 1.105 -13.358 9.335 1.00 32.03 O ATOM 1388 ND2 ASN A 95 0.070 -11.509 8.591 1.00 41.21 N ATOM 0 H ASN A 95 3.128 -13.458 10.321 1.00 75.23 H new ATOM 0 HA ASN A 95 2.629 -11.313 12.267 1.00 4.33 H new ATOM 0 HB2 ASN A 95 1.181 -10.400 10.592 1.00 35.13 H new ATOM 0 HB3 ASN A 95 2.646 -10.897 9.768 1.00 35.13 H new ATOM 0 HD21 ASN A 95 -0.510 -12.041 7.941 1.00 41.21 H new ATOM 0 HD22 ASN A 95 -0.026 -10.495 8.648 1.00 41.21 H new ATOM 1395 N ARG A 96 -0.092 -12.002 12.291 1.00 13.30 N ATOM 1396 CA ARG A 96 -1.305 -12.550 12.886 1.00 11.55 C ATOM 1397 C ARG A 96 -1.605 -13.938 12.329 1.00 53.20 C ATOM 1398 O ARG A 96 -2.000 -14.840 13.066 1.00 33.50 O ATOM 1399 CB ARG A 96 -2.491 -11.618 12.629 1.00 2.35 C ATOM 1400 CG ARG A 96 -3.317 -11.326 13.872 1.00 45.23 C ATOM 1401 CD ARG A 96 -2.754 -10.147 14.650 1.00 12.31 C ATOM 1402 NE ARG A 96 -3.667 -9.696 15.697 1.00 34.41 N ATOM 1403 CZ ARG A 96 -3.769 -10.281 16.886 1.00 65.35 C ATOM 1404 NH1 ARG A 96 -3.016 -11.334 17.176 1.00 14.33 N ATOM 1405 NH2 ARG A 96 -4.623 -9.813 17.786 1.00 31.02 N ATOM 0 H ARG A 96 -0.180 -11.040 11.964 1.00 13.30 H new ATOM 0 HA ARG A 96 -1.145 -12.636 13.961 1.00 11.55 H new ATOM 0 HB2 ARG A 96 -2.121 -10.678 12.220 1.00 2.35 H new ATOM 0 HB3 ARG A 96 -3.135 -12.064 11.871 1.00 2.35 H new ATOM 0 HG2 ARG A 96 -4.347 -11.115 13.585 1.00 45.23 H new ATOM 0 HG3 ARG A 96 -3.339 -12.208 14.511 1.00 45.23 H new ATOM 0 HD2 ARG A 96 -1.801 -10.430 15.097 1.00 12.31 H new ATOM 0 HD3 ARG A 96 -2.553 -9.323 13.965 1.00 12.31 H new ATOM 0 HE ARG A 96 -4.259 -8.888 15.505 1.00 34.41 H new ATOM 0 HH11 ARG A 96 -2.358 -11.696 16.486 1.00 14.33 H new ATOM 0 HH12 ARG A 96 -3.095 -11.782 18.089 1.00 14.33 H new ATOM 0 HH21 ARG A 96 -5.203 -9.003 17.566 1.00 31.02 H new ATOM 0 HH22 ARG A 96 -4.700 -10.263 18.698 1.00 31.02 H new ATOM 1419 N GLU A 97 -1.415 -14.099 11.023 1.00 34.42 N ATOM 1420 CA GLU A 97 -1.667 -15.377 10.368 1.00 74.34 C ATOM 1421 C GLU A 97 -0.850 -16.491 11.015 1.00 64.43 C ATOM 1422 O GLU A 97 -1.359 -17.584 11.266 1.00 2.50 O ATOM 1423 CB GLU A 97 -1.335 -15.285 8.877 1.00 62.41 C ATOM 1424 CG GLU A 97 -2.322 -16.021 7.987 1.00 60.34 C ATOM 1425 CD GLU A 97 -2.713 -17.376 8.544 1.00 23.31 C ATOM 1426 OE1 GLU A 97 -1.954 -18.346 8.332 1.00 52.51 O ATOM 1427 OE2 GLU A 97 -3.776 -17.468 9.192 1.00 52.40 O ATOM 0 H GLU A 97 -1.088 -13.362 10.399 1.00 34.42 H new ATOM 0 HA GLU A 97 -2.725 -15.613 10.483 1.00 74.34 H new ATOM 0 HB2 GLU A 97 -1.307 -14.236 8.584 1.00 62.41 H new ATOM 0 HB3 GLU A 97 -0.337 -15.689 8.710 1.00 62.41 H new ATOM 0 HG2 GLU A 97 -3.217 -15.412 7.862 1.00 60.34 H new ATOM 0 HG3 GLU A 97 -1.885 -16.152 6.997 1.00 60.34 H new ATOM 1434 N TRP A 98 0.420 -16.207 11.281 1.00 50.33 N ATOM 1435 CA TRP A 98 1.309 -17.184 11.898 1.00 62.42 C ATOM 1436 C TRP A 98 0.886 -17.475 13.334 1.00 44.43 C ATOM 1437 O TRP A 98 0.828 -18.632 13.752 1.00 14.43 O ATOM 1438 CB TRP A 98 2.753 -16.680 11.870 1.00 31.12 C ATOM 1439 CG TRP A 98 3.688 -17.509 12.698 1.00 34.11 C ATOM 1440 CD1 TRP A 98 4.447 -18.561 12.271 1.00 4.52 C ATOM 1441 CD2 TRP A 98 3.959 -17.356 14.095 1.00 24.35 C ATOM 1442 NE1 TRP A 98 5.175 -19.071 13.319 1.00 2.31 N ATOM 1443 CE2 TRP A 98 4.894 -18.349 14.449 1.00 44.11 C ATOM 1444 CE3 TRP A 98 3.506 -16.477 15.082 1.00 52.41 C ATOM 1445 CZ2 TRP A 98 5.381 -18.485 15.746 1.00 12.44 C ATOM 1446 CZ3 TRP A 98 3.989 -16.613 16.369 1.00 3.23 C ATOM 1447 CH2 TRP A 98 4.919 -17.610 16.692 1.00 4.22 C ATOM 0 H TRP A 98 0.857 -15.308 11.079 1.00 50.33 H new ATOM 0 HA TRP A 98 1.244 -18.109 11.326 1.00 62.42 H new ATOM 0 HB2 TRP A 98 3.106 -16.668 10.839 1.00 31.12 H new ATOM 0 HB3 TRP A 98 2.778 -15.651 12.228 1.00 31.12 H new ATOM 0 HD1 TRP A 98 4.471 -18.937 11.259 1.00 4.52 H new ATOM 0 HE1 TRP A 98 5.820 -19.859 13.264 1.00 2.31 H new ATOM 0 HE3 TRP A 98 2.790 -15.704 14.843 1.00 52.41 H new ATOM 0 HZ2 TRP A 98 6.098 -19.253 15.997 1.00 12.44 H new ATOM 0 HZ3 TRP A 98 3.644 -15.939 17.139 1.00 3.23 H new ATOM 0 HH2 TRP A 98 5.278 -17.690 17.707 1.00 4.22 H new ATOM 1458 N LEU A 99 0.593 -16.419 14.084 1.00 13.42 N ATOM 1459 CA LEU A 99 0.175 -16.561 15.475 1.00 54.44 C ATOM 1460 C LEU A 99 -1.002 -17.524 15.594 1.00 54.44 C ATOM 1461 O LEU A 99 -1.017 -18.398 16.460 1.00 2.45 O ATOM 1462 CB LEU A 99 -0.206 -15.198 16.055 1.00 52.50 C ATOM 1463 CG LEU A 99 -0.112 -15.065 17.575 1.00 23.34 C ATOM 1464 CD1 LEU A 99 1.296 -15.386 18.053 1.00 61.34 C ATOM 1465 CD2 LEU A 99 -0.520 -13.667 18.016 1.00 72.05 C ATOM 0 H LEU A 99 0.637 -15.455 13.753 1.00 13.42 H new ATOM 0 HA LEU A 99 1.013 -16.968 16.041 1.00 54.44 H new ATOM 0 HB2 LEU A 99 0.436 -14.441 15.604 1.00 52.50 H new ATOM 0 HB3 LEU A 99 -1.228 -14.970 15.753 1.00 52.50 H new ATOM 0 HG LEU A 99 -0.800 -15.781 18.025 1.00 23.34 H new ATOM 0 HD11 LEU A 99 1.344 -15.286 19.137 1.00 61.34 H new ATOM 0 HD12 LEU A 99 1.552 -16.407 17.771 1.00 61.34 H new ATOM 0 HD13 LEU A 99 2.003 -14.695 17.593 1.00 61.34 H new ATOM 0 HD21 LEU A 99 -0.447 -13.592 19.101 1.00 72.05 H new ATOM 0 HD22 LEU A 99 0.141 -12.933 17.556 1.00 72.05 H new ATOM 0 HD23 LEU A 99 -1.547 -13.474 17.708 1.00 72.05 H new ATOM 1477 N ARG A 100 -1.987 -17.358 14.716 1.00 65.31 N ATOM 1478 CA ARG A 100 -3.167 -18.213 14.722 1.00 33.50 C ATOM 1479 C ARG A 100 -2.881 -19.541 14.026 1.00 41.32 C ATOM 1480 O ARG A 100 -3.513 -20.556 14.319 1.00 52.34 O ATOM 1481 CB ARG A 100 -4.338 -17.507 14.036 1.00 71.54 C ATOM 1482 CG ARG A 100 -5.397 -17.004 15.003 1.00 40.34 C ATOM 1483 CD ARG A 100 -4.801 -16.071 16.045 1.00 23.13 C ATOM 1484 NE ARG A 100 -5.782 -15.678 17.053 1.00 22.02 N ATOM 1485 CZ ARG A 100 -5.640 -14.620 17.843 1.00 11.34 C ATOM 1486 NH1 ARG A 100 -4.564 -13.852 17.743 1.00 65.54 N ATOM 1487 NH2 ARG A 100 -6.577 -14.327 18.736 1.00 2.24 N ATOM 0 H ARG A 100 -1.990 -16.639 13.992 1.00 65.31 H new ATOM 0 HA ARG A 100 -3.432 -18.417 15.760 1.00 33.50 H new ATOM 0 HB2 ARG A 100 -3.956 -16.665 13.459 1.00 71.54 H new ATOM 0 HB3 ARG A 100 -4.801 -18.194 13.328 1.00 71.54 H new ATOM 0 HG2 ARG A 100 -6.178 -16.482 14.450 1.00 40.34 H new ATOM 0 HG3 ARG A 100 -5.870 -17.851 15.500 1.00 40.34 H new ATOM 0 HD2 ARG A 100 -3.958 -16.562 16.532 1.00 23.13 H new ATOM 0 HD3 ARG A 100 -4.410 -15.180 15.553 1.00 23.13 H new ATOM 0 HE ARG A 100 -6.622 -16.247 17.156 1.00 22.02 H new ATOM 0 HH11 ARG A 100 -3.842 -14.073 17.058 1.00 65.54 H new ATOM 0 HH12 ARG A 100 -4.458 -13.040 18.352 1.00 65.54 H new ATOM 0 HH21 ARG A 100 -7.407 -14.915 18.816 1.00 2.24 H new ATOM 0 HH22 ARG A 100 -6.467 -13.514 19.342 1.00 2.24 H new ATOM 1501 N ARG A 101 -1.925 -19.525 13.103 1.00 4.30 N ATOM 1502 CA ARG A 101 -1.556 -20.726 12.364 1.00 61.10 C ATOM 1503 C ARG A 101 -0.875 -21.740 13.279 1.00 11.20 C ATOM 1504 O ARG A 101 -0.938 -22.945 13.041 1.00 23.25 O ATOM 1505 CB ARG A 101 -0.629 -20.370 11.200 1.00 21.32 C ATOM 1506 CG ARG A 101 -0.096 -21.582 10.453 1.00 34.32 C ATOM 1507 CD ARG A 101 1.292 -21.970 10.938 1.00 51.42 C ATOM 1508 NE ARG A 101 2.107 -22.538 9.867 1.00 13.41 N ATOM 1509 CZ ARG A 101 3.170 -23.305 10.081 1.00 51.33 C ATOM 1510 NH1 ARG A 101 3.545 -23.594 11.319 1.00 34.21 N ATOM 1511 NH2 ARG A 101 3.860 -23.784 9.054 1.00 25.42 N ATOM 0 H ARG A 101 -1.392 -18.693 12.849 1.00 4.30 H new ATOM 0 HA ARG A 101 -2.468 -21.174 11.969 1.00 61.10 H new ATOM 0 HB2 ARG A 101 -1.167 -19.730 10.500 1.00 21.32 H new ATOM 0 HB3 ARG A 101 0.212 -19.790 11.580 1.00 21.32 H new ATOM 0 HG2 ARG A 101 -0.777 -22.422 10.587 1.00 34.32 H new ATOM 0 HG3 ARG A 101 -0.062 -21.367 9.385 1.00 34.32 H new ATOM 0 HD2 ARG A 101 1.792 -21.092 11.347 1.00 51.42 H new ATOM 0 HD3 ARG A 101 1.204 -22.693 11.749 1.00 51.42 H new ATOM 0 HE ARG A 101 1.845 -22.335 8.902 1.00 13.41 H new ATOM 0 HH11 ARG A 101 3.017 -23.227 12.111 1.00 34.21 H new ATOM 0 HH12 ARG A 101 4.362 -24.183 11.480 1.00 34.21 H new ATOM 0 HH21 ARG A 101 3.574 -23.563 8.100 1.00 25.42 H new ATOM 0 HH22 ARG A 101 4.676 -24.373 9.218 1.00 25.42 H new ATOM 1525 N ASN A 102 -0.225 -21.241 14.325 1.00 23.45 N ATOM 1526 CA ASN A 102 0.469 -22.103 15.276 1.00 71.43 C ATOM 1527 C ASN A 102 -0.232 -22.094 16.631 1.00 71.23 C ATOM 1528 O ASN A 102 -0.015 -22.977 17.460 1.00 74.15 O ATOM 1529 CB ASN A 102 1.922 -21.653 15.438 1.00 62.22 C ATOM 1530 CG ASN A 102 2.803 -22.121 14.295 1.00 2.24 C ATOM 1531 OD1 ASN A 102 3.143 -23.300 14.201 1.00 34.42 O ATOM 1532 ND2 ASN A 102 3.178 -21.195 13.420 1.00 1.13 N ATOM 0 H ASN A 102 -0.164 -20.245 14.536 1.00 23.45 H new ATOM 0 HA ASN A 102 0.452 -23.120 14.885 1.00 71.43 H new ATOM 0 HB2 ASN A 102 1.958 -20.565 15.499 1.00 62.22 H new ATOM 0 HB3 ASN A 102 2.316 -22.038 16.378 1.00 62.22 H new ATOM 0 HD21 ASN A 102 3.772 -21.450 12.631 1.00 1.13 H new ATOM 0 HD22 ASN A 102 2.872 -20.229 13.537 1.00 1.13 H new ATOM 1539 N GLY A 103 -1.075 -21.089 16.848 1.00 1.13 N ATOM 1540 CA GLY A 103 -1.795 -20.984 18.104 1.00 55.55 C ATOM 1541 C GLY A 103 -3.089 -21.774 18.098 1.00 62.13 C ATOM 1542 O GLY A 103 -3.502 -22.310 19.127 1.00 71.33 O ATOM 0 H GLY A 103 -1.272 -20.346 16.177 1.00 1.13 H new ATOM 0 HA2 GLY A 103 -1.159 -21.340 18.915 1.00 55.55 H new ATOM 0 HA3 GLY A 103 -2.014 -19.936 18.307 1.00 55.55 H new ATOM 1546 N LEU A 104 -3.731 -21.846 16.937 1.00 20.11 N ATOM 1547 CA LEU A 104 -4.987 -22.576 16.802 1.00 41.25 C ATOM 1548 C LEU A 104 -5.179 -23.069 15.371 1.00 43.53 C ATOM 1549 O LEU A 104 -4.278 -22.959 14.538 1.00 22.12 O ATOM 1550 CB LEU A 104 -6.163 -21.686 17.209 1.00 62.43 C ATOM 1551 CG LEU A 104 -6.262 -20.337 16.496 1.00 0.03 C ATOM 1552 CD1 LEU A 104 -7.159 -20.444 15.273 1.00 51.10 C ATOM 1553 CD2 LEU A 104 -6.780 -19.268 17.448 1.00 63.31 C ATOM 0 H LEU A 104 -3.403 -21.408 16.076 1.00 20.11 H new ATOM 0 HA LEU A 104 -4.949 -23.442 17.463 1.00 41.25 H new ATOM 0 HB2 LEU A 104 -7.087 -22.236 17.033 1.00 62.43 H new ATOM 0 HB3 LEU A 104 -6.100 -21.504 18.282 1.00 62.43 H new ATOM 0 HG LEU A 104 -5.264 -20.048 16.165 1.00 0.03 H new ATOM 0 HD11 LEU A 104 -7.217 -19.474 14.779 1.00 51.10 H new ATOM 0 HD12 LEU A 104 -6.746 -21.179 14.582 1.00 51.10 H new ATOM 0 HD13 LEU A 104 -8.157 -20.755 15.580 1.00 51.10 H new ATOM 0 HD21 LEU A 104 -6.844 -18.314 16.924 1.00 63.31 H new ATOM 0 HD22 LEU A 104 -7.769 -19.551 17.809 1.00 63.31 H new ATOM 0 HD23 LEU A 104 -6.098 -19.172 18.293 1.00 63.31 H new ATOM 1565 N THR A 105 -6.360 -23.610 15.090 1.00 21.21 N ATOM 1566 CA THR A 105 -6.671 -24.119 13.760 1.00 0.41 C ATOM 1567 C THR A 105 -6.938 -22.978 12.784 1.00 22.51 C ATOM 1568 O THR A 105 -6.088 -22.645 11.958 1.00 41.31 O ATOM 1569 CB THR A 105 -7.896 -25.053 13.788 1.00 44.40 C ATOM 1570 OG1 THR A 105 -7.620 -26.197 14.603 1.00 33.21 O ATOM 1571 CG2 THR A 105 -8.266 -25.502 12.382 1.00 4.25 C ATOM 0 H THR A 105 -7.117 -23.707 15.766 1.00 21.21 H new ATOM 0 HA THR A 105 -5.801 -24.684 13.426 1.00 0.41 H new ATOM 0 HB THR A 105 -8.737 -24.502 14.209 1.00 44.40 H new ATOM 0 HG1 THR A 105 -8.404 -26.785 14.617 1.00 33.21 H new ATOM 0 HG21 THR A 105 -9.133 -26.160 12.427 1.00 4.25 H new ATOM 0 HG22 THR A 105 -8.503 -24.630 11.772 1.00 4.25 H new ATOM 0 HG23 THR A 105 -7.427 -26.037 11.938 1.00 4.25 H new ATOM 1579 N ILE A 106 -8.122 -22.384 12.885 1.00 21.23 N ATOM 1580 CA ILE A 106 -8.499 -21.280 12.012 1.00 41.21 C ATOM 1581 C ILE A 106 -9.566 -20.405 12.661 1.00 2.13 C ATOM 1582 O ILE A 106 -10.454 -20.902 13.353 1.00 32.12 O ATOM 1583 CB ILE A 106 -9.023 -21.788 10.656 1.00 73.11 C ATOM 1584 CG1 ILE A 106 -9.186 -20.623 9.678 1.00 11.51 C ATOM 1585 CG2 ILE A 106 -10.344 -22.521 10.840 1.00 42.23 C ATOM 1586 CD1 ILE A 106 -9.998 -20.972 8.451 1.00 72.42 C ATOM 0 H ILE A 106 -8.837 -22.649 13.563 1.00 21.23 H new ATOM 0 HA ILE A 106 -7.599 -20.688 11.846 1.00 41.21 H new ATOM 0 HB ILE A 106 -8.296 -22.487 10.241 1.00 73.11 H new ATOM 0 HG12 ILE A 106 -9.663 -19.790 10.194 1.00 11.51 H new ATOM 0 HG13 ILE A 106 -8.199 -20.281 9.365 1.00 11.51 H new ATOM 0 HG21 ILE A 106 -10.702 -22.874 9.873 1.00 42.23 H new ATOM 0 HG22 ILE A 106 -10.198 -23.372 11.506 1.00 42.23 H new ATOM 0 HG23 ILE A 106 -11.079 -21.843 11.273 1.00 42.23 H new ATOM 0 HD11 ILE A 106 -10.072 -20.099 7.803 1.00 72.42 H new ATOM 0 HD12 ILE A 106 -9.511 -21.784 7.911 1.00 72.42 H new ATOM 0 HD13 ILE A 106 -10.997 -21.285 8.753 1.00 72.42 H new ATOM 1598 N SER A 107 -9.473 -19.099 12.432 1.00 45.01 N ATOM 1599 CA SER A 107 -10.429 -18.154 12.996 1.00 4.41 C ATOM 1600 C SER A 107 -10.766 -17.057 11.991 1.00 53.04 C ATOM 1601 O SER A 107 -9.921 -16.229 11.652 1.00 52.43 O ATOM 1602 CB SER A 107 -9.868 -17.532 14.277 1.00 52.02 C ATOM 1603 OG SER A 107 -10.496 -18.076 15.425 1.00 62.21 O ATOM 0 H SER A 107 -8.745 -18.671 11.860 1.00 45.01 H new ATOM 0 HA SER A 107 -11.343 -18.698 13.234 1.00 4.41 H new ATOM 0 HB2 SER A 107 -8.793 -17.706 14.329 1.00 52.02 H new ATOM 0 HB3 SER A 107 -10.015 -16.452 14.255 1.00 52.02 H new ATOM 0 HG SER A 107 -10.119 -17.664 16.230 1.00 62.21 H new ATOM 1609 N SER A 108 -12.008 -17.059 11.517 1.00 33.01 N ATOM 1610 CA SER A 108 -12.458 -16.067 10.547 1.00 32.42 C ATOM 1611 C SER A 108 -12.370 -14.660 11.129 1.00 45.34 C ATOM 1612 O SER A 108 -12.223 -13.681 10.396 1.00 60.54 O ATOM 1613 CB SER A 108 -13.895 -16.363 10.114 1.00 53.35 C ATOM 1614 OG SER A 108 -14.064 -17.736 9.808 1.00 22.22 O ATOM 0 H SER A 108 -12.720 -17.736 11.789 1.00 33.01 H new ATOM 0 HA SER A 108 -11.805 -16.123 9.676 1.00 32.42 H new ATOM 0 HB2 SER A 108 -14.584 -16.077 10.909 1.00 53.35 H new ATOM 0 HB3 SER A 108 -14.147 -15.759 9.242 1.00 53.35 H new ATOM 0 HG SER A 108 -14.991 -17.899 9.536 1.00 22.22 H new ATOM 1620 N ASP A 109 -12.460 -14.566 12.451 1.00 44.24 N ATOM 1621 CA ASP A 109 -12.389 -13.279 13.132 1.00 3.34 C ATOM 1622 C ASP A 109 -10.962 -12.739 13.128 1.00 23.43 C ATOM 1623 O ASP A 109 -10.731 -11.565 12.839 1.00 34.05 O ATOM 1624 CB ASP A 109 -12.893 -13.411 14.570 1.00 11.43 C ATOM 1625 CG ASP A 109 -13.605 -12.162 15.051 1.00 53.51 C ATOM 1626 OD1 ASP A 109 -13.065 -11.055 14.845 1.00 11.22 O ATOM 1627 OD2 ASP A 109 -14.703 -12.291 15.633 1.00 4.25 O ATOM 0 H ASP A 109 -12.582 -15.366 13.072 1.00 44.24 H new ATOM 0 HA ASP A 109 -13.025 -12.576 12.595 1.00 3.34 H new ATOM 0 HB2 ASP A 109 -13.572 -14.261 14.637 1.00 11.43 H new ATOM 0 HB3 ASP A 109 -12.051 -13.622 15.229 1.00 11.43 H new ATOM 1632 N VAL A 110 -10.006 -13.605 13.452 1.00 73.23 N ATOM 1633 CA VAL A 110 -8.602 -13.216 13.485 1.00 25.33 C ATOM 1634 C VAL A 110 -8.099 -12.852 12.093 1.00 2.41 C ATOM 1635 O VAL A 110 -7.408 -11.848 11.914 1.00 34.32 O ATOM 1636 CB VAL A 110 -7.721 -14.342 14.058 1.00 21.55 C ATOM 1637 CG1 VAL A 110 -6.265 -13.906 14.114 1.00 62.20 C ATOM 1638 CG2 VAL A 110 -8.215 -14.756 15.437 1.00 51.35 C ATOM 0 H VAL A 110 -10.179 -14.580 13.695 1.00 73.23 H new ATOM 0 HA VAL A 110 -8.531 -12.343 14.134 1.00 25.33 H new ATOM 0 HB VAL A 110 -7.791 -15.206 13.397 1.00 21.55 H new ATOM 0 HG11 VAL A 110 -5.658 -14.715 14.522 1.00 62.20 H new ATOM 0 HG12 VAL A 110 -5.919 -13.664 13.109 1.00 62.20 H new ATOM 0 HG13 VAL A 110 -6.173 -13.027 14.751 1.00 62.20 H new ATOM 0 HG21 VAL A 110 -7.581 -15.552 15.827 1.00 51.35 H new ATOM 0 HG22 VAL A 110 -8.176 -13.899 16.110 1.00 51.35 H new ATOM 0 HG23 VAL A 110 -9.242 -15.113 15.363 1.00 51.35 H new ATOM 1648 N SER A 111 -8.450 -13.673 11.109 1.00 72.10 N ATOM 1649 CA SER A 111 -8.032 -13.439 9.732 1.00 61.12 C ATOM 1650 C SER A 111 -8.680 -12.175 9.174 1.00 30.35 C ATOM 1651 O SER A 111 -8.019 -11.355 8.538 1.00 53.35 O ATOM 1652 CB SER A 111 -8.393 -14.640 8.856 1.00 72.13 C ATOM 1653 OG SER A 111 -7.418 -14.849 7.849 1.00 24.14 O ATOM 0 H SER A 111 -9.023 -14.507 11.240 1.00 72.10 H new ATOM 0 HA SER A 111 -6.950 -13.305 9.725 1.00 61.12 H new ATOM 0 HB2 SER A 111 -8.478 -15.533 9.475 1.00 72.13 H new ATOM 0 HB3 SER A 111 -9.367 -14.478 8.395 1.00 72.13 H new ATOM 0 HG SER A 111 -7.671 -15.623 7.304 1.00 24.14 H new ATOM 1659 N ASP A 112 -9.977 -12.026 9.419 1.00 32.31 N ATOM 1660 CA ASP A 112 -10.716 -10.863 8.943 1.00 12.33 C ATOM 1661 C ASP A 112 -10.124 -9.575 9.507 1.00 44.12 C ATOM 1662 O ASP A 112 -9.923 -8.602 8.780 1.00 60.41 O ATOM 1663 CB ASP A 112 -12.191 -10.974 9.334 1.00 42.22 C ATOM 1664 CG ASP A 112 -13.006 -9.785 8.863 1.00 25.01 C ATOM 1665 OD1 ASP A 112 -13.039 -9.536 7.640 1.00 61.10 O ATOM 1666 OD2 ASP A 112 -13.609 -9.103 9.718 1.00 71.01 O ATOM 0 H ASP A 112 -10.538 -12.696 9.945 1.00 32.31 H new ATOM 0 HA ASP A 112 -10.637 -10.833 7.856 1.00 12.33 H new ATOM 0 HB2 ASP A 112 -12.608 -11.888 8.911 1.00 42.22 H new ATOM 0 HB3 ASP A 112 -12.271 -11.059 10.418 1.00 42.22 H new ATOM 1671 N ALA A 113 -9.847 -9.576 10.807 1.00 63.14 N ATOM 1672 CA ALA A 113 -9.276 -8.409 11.467 1.00 15.33 C ATOM 1673 C ALA A 113 -7.853 -8.147 10.988 1.00 64.50 C ATOM 1674 O ALA A 113 -7.477 -7.006 10.723 1.00 25.05 O ATOM 1675 CB ALA A 113 -9.302 -8.592 12.978 1.00 62.15 C ATOM 0 H ALA A 113 -10.009 -10.372 11.424 1.00 63.14 H new ATOM 0 HA ALA A 113 -9.883 -7.542 11.206 1.00 15.33 H new ATOM 0 HB1 ALA A 113 -8.872 -7.713 13.458 1.00 62.15 H new ATOM 0 HB2 ALA A 113 -10.332 -8.721 13.311 1.00 62.15 H new ATOM 0 HB3 ALA A 113 -8.720 -9.473 13.248 1.00 62.15 H new ATOM 1681 N MET A 114 -7.065 -9.212 10.879 1.00 31.52 N ATOM 1682 CA MET A 114 -5.682 -9.097 10.431 1.00 32.20 C ATOM 1683 C MET A 114 -5.602 -8.355 9.101 1.00 62.02 C ATOM 1684 O MET A 114 -4.895 -7.354 8.978 1.00 52.12 O ATOM 1685 CB MET A 114 -5.051 -10.484 10.294 1.00 41.04 C ATOM 1686 CG MET A 114 -3.631 -10.454 9.752 1.00 61.30 C ATOM 1687 SD MET A 114 -3.096 -12.055 9.118 1.00 63.10 S ATOM 1688 CE MET A 114 -3.981 -12.116 7.562 1.00 20.31 C ATOM 0 H MET A 114 -7.361 -10.164 11.095 1.00 31.52 H new ATOM 0 HA MET A 114 -5.130 -8.527 11.178 1.00 32.20 H new ATOM 0 HB2 MET A 114 -5.049 -10.971 11.269 1.00 41.04 H new ATOM 0 HB3 MET A 114 -5.670 -11.093 9.635 1.00 41.04 H new ATOM 0 HG2 MET A 114 -3.566 -9.712 8.956 1.00 61.30 H new ATOM 0 HG3 MET A 114 -2.951 -10.135 10.542 1.00 61.30 H new ATOM 0 HE1 MET A 114 -3.561 -12.902 6.935 1.00 20.31 H new ATOM 0 HE2 MET A 114 -5.034 -12.326 7.750 1.00 20.31 H new ATOM 0 HE3 MET A 114 -3.888 -11.157 7.052 1.00 20.31 H new ATOM 1698 N THR A 115 -6.330 -8.852 8.106 1.00 72.02 N ATOM 1699 CA THR A 115 -6.340 -8.237 6.785 1.00 70.05 C ATOM 1700 C THR A 115 -7.063 -6.895 6.808 1.00 75.51 C ATOM 1701 O THR A 115 -6.742 -5.993 6.035 1.00 53.31 O ATOM 1702 CB THR A 115 -7.013 -9.152 5.744 1.00 64.11 C ATOM 1703 OG1 THR A 115 -7.156 -10.474 6.274 1.00 31.43 O ATOM 1704 CG2 THR A 115 -6.199 -9.201 4.460 1.00 44.13 C ATOM 0 H THR A 115 -6.921 -9.679 8.190 1.00 72.02 H new ATOM 0 HA THR A 115 -5.299 -8.081 6.502 1.00 70.05 H new ATOM 0 HB THR A 115 -7.998 -8.743 5.516 1.00 64.11 H new ATOM 0 HG1 THR A 115 -7.852 -10.476 6.963 1.00 31.43 H new ATOM 0 HG21 THR A 115 -6.694 -9.853 3.740 1.00 44.13 H new ATOM 0 HG22 THR A 115 -6.116 -8.197 4.043 1.00 44.13 H new ATOM 0 HG23 THR A 115 -5.203 -9.588 4.675 1.00 44.13 H new ATOM 1712 N ASP A 116 -8.041 -6.771 7.699 1.00 25.12 N ATOM 1713 CA ASP A 116 -8.809 -5.538 7.824 1.00 1.14 C ATOM 1714 C ASP A 116 -7.892 -4.353 8.109 1.00 44.44 C ATOM 1715 O ASP A 116 -7.998 -3.305 7.470 1.00 1.24 O ATOM 1716 CB ASP A 116 -9.850 -5.671 8.937 1.00 70.31 C ATOM 1717 CG ASP A 116 -11.254 -5.858 8.396 1.00 11.24 C ATOM 1718 OD1 ASP A 116 -11.428 -6.670 7.463 1.00 11.42 O ATOM 1719 OD2 ASP A 116 -12.179 -5.193 8.907 1.00 12.32 O ATOM 0 H ASP A 116 -8.320 -7.509 8.345 1.00 25.12 H new ATOM 0 HA ASP A 116 -9.320 -5.360 6.878 1.00 1.14 H new ATOM 0 HB2 ASP A 116 -9.592 -6.519 9.572 1.00 70.31 H new ATOM 0 HB3 ASP A 116 -9.821 -4.781 9.566 1.00 70.31 H new ATOM 1724 N HIS A 117 -6.991 -4.525 9.071 1.00 14.04 N ATOM 1725 CA HIS A 117 -6.055 -3.469 9.441 1.00 74.02 C ATOM 1726 C HIS A 117 -4.868 -3.436 8.483 1.00 54.41 C ATOM 1727 O HIS A 117 -4.332 -2.370 8.182 1.00 11.21 O ATOM 1728 CB HIS A 117 -5.563 -3.673 10.874 1.00 14.10 C ATOM 1729 CG HIS A 117 -6.485 -3.106 11.910 1.00 61.31 C ATOM 1730 ND1 HIS A 117 -7.793 -3.516 12.059 1.00 71.24 N ATOM 1731 CD2 HIS A 117 -6.280 -2.157 12.853 1.00 71.21 C ATOM 1732 CE1 HIS A 117 -8.354 -2.842 13.047 1.00 24.40 C ATOM 1733 NE2 HIS A 117 -7.456 -2.011 13.546 1.00 35.42 N ATOM 0 H HIS A 117 -6.889 -5.386 9.609 1.00 14.04 H new ATOM 0 HA HIS A 117 -6.578 -2.515 9.377 1.00 74.02 H new ATOM 0 HB2 HIS A 117 -5.436 -4.740 11.057 1.00 14.10 H new ATOM 0 HB3 HIS A 117 -4.581 -3.212 10.982 1.00 14.10 H new ATOM 0 HD2 HIS A 117 -5.362 -1.615 13.028 1.00 71.21 H new ATOM 0 HE1 HIS A 117 -9.373 -2.951 13.389 1.00 24.40 H new ATOM 0 HE2 HIS A 117 -7.611 -1.366 14.320 1.00 35.42 H new ATOM 1741 N GLU A 118 -4.464 -4.610 8.008 1.00 3.33 N ATOM 1742 CA GLU A 118 -3.339 -4.713 7.086 1.00 71.40 C ATOM 1743 C GLU A 118 -3.640 -3.989 5.777 1.00 12.22 C ATOM 1744 O GLU A 118 -2.731 -3.652 5.019 1.00 74.33 O ATOM 1745 CB GLU A 118 -3.015 -6.182 6.806 1.00 65.24 C ATOM 1746 CG GLU A 118 -1.887 -6.731 7.663 1.00 3.24 C ATOM 1747 CD GLU A 118 -0.816 -7.426 6.845 1.00 74.33 C ATOM 1748 OE1 GLU A 118 0.033 -6.724 6.259 1.00 44.31 O ATOM 1749 OE2 GLU A 118 -0.829 -8.674 6.790 1.00 11.05 O ATOM 0 H GLU A 118 -4.898 -5.502 8.246 1.00 3.33 H new ATOM 0 HA GLU A 118 -2.475 -4.239 7.552 1.00 71.40 H new ATOM 0 HB2 GLU A 118 -3.911 -6.781 6.972 1.00 65.24 H new ATOM 0 HB3 GLU A 118 -2.748 -6.292 5.755 1.00 65.24 H new ATOM 0 HG2 GLU A 118 -1.435 -5.915 8.228 1.00 3.24 H new ATOM 0 HG3 GLU A 118 -2.297 -7.433 8.389 1.00 3.24 H new ATOM 1756 N MET A 119 -4.923 -3.753 5.520 1.00 45.12 N ATOM 1757 CA MET A 119 -5.344 -3.068 4.303 1.00 1.13 C ATOM 1758 C MET A 119 -4.870 -1.618 4.304 1.00 63.14 C ATOM 1759 O MET A 119 -4.900 -0.944 3.274 1.00 52.20 O ATOM 1760 CB MET A 119 -6.867 -3.119 4.165 1.00 3.44 C ATOM 1761 CG MET A 119 -7.371 -2.639 2.814 1.00 1.30 C ATOM 1762 SD MET A 119 -8.300 -3.906 1.929 1.00 0.34 S ATOM 1763 CE MET A 119 -7.085 -4.438 0.726 1.00 21.30 C ATOM 0 H MET A 119 -5.688 -4.026 6.137 1.00 45.12 H new ATOM 0 HA MET A 119 -4.892 -3.579 3.453 1.00 1.13 H new ATOM 0 HB2 MET A 119 -7.204 -4.143 4.327 1.00 3.44 H new ATOM 0 HB3 MET A 119 -7.315 -2.508 4.949 1.00 3.44 H new ATOM 0 HG2 MET A 119 -8.004 -1.763 2.957 1.00 1.30 H new ATOM 0 HG3 MET A 119 -6.523 -2.324 2.205 1.00 1.30 H new ATOM 0 HE1 MET A 119 -7.511 -5.223 0.101 1.00 21.30 H new ATOM 0 HE2 MET A 119 -6.797 -3.592 0.101 1.00 21.30 H new ATOM 0 HE3 MET A 119 -6.206 -4.823 1.243 1.00 21.30 H new ATOM 1773 N LYS A 120 -4.432 -1.144 5.465 1.00 42.20 N ATOM 1774 CA LYS A 120 -3.950 0.226 5.600 1.00 60.31 C ATOM 1775 C LYS A 120 -2.440 0.294 5.393 1.00 13.20 C ATOM 1776 O LYS A 120 -1.856 1.377 5.364 1.00 34.31 O ATOM 1777 CB LYS A 120 -4.312 0.782 6.979 1.00 52.13 C ATOM 1778 CG LYS A 120 -5.483 1.750 6.956 1.00 64.03 C ATOM 1779 CD LYS A 120 -6.453 1.479 8.094 1.00 45.34 C ATOM 1780 CE LYS A 120 -7.806 1.019 7.575 1.00 52.34 C ATOM 1781 NZ LYS A 120 -8.461 2.060 6.735 1.00 60.05 N ATOM 0 H LYS A 120 -4.401 -1.688 6.327 1.00 42.20 H new ATOM 0 HA LYS A 120 -4.432 0.832 4.833 1.00 60.31 H new ATOM 0 HB2 LYS A 120 -4.550 -0.047 7.645 1.00 52.13 H new ATOM 0 HB3 LYS A 120 -3.442 1.287 7.398 1.00 52.13 H new ATOM 0 HG2 LYS A 120 -5.112 2.773 7.028 1.00 64.03 H new ATOM 0 HG3 LYS A 120 -6.006 1.667 6.003 1.00 64.03 H new ATOM 0 HD2 LYS A 120 -6.037 0.718 8.754 1.00 45.34 H new ATOM 0 HD3 LYS A 120 -6.579 2.383 8.689 1.00 45.34 H new ATOM 0 HE2 LYS A 120 -7.680 0.107 6.991 1.00 52.34 H new ATOM 0 HE3 LYS A 120 -8.453 0.772 8.417 1.00 52.34 H new ATOM 0 HZ1 LYS A 120 -9.492 1.921 6.751 1.00 60.05 H new ATOM 0 HZ2 LYS A 120 -8.233 3.003 7.110 1.00 60.05 H new ATOM 0 HZ3 LYS A 120 -8.116 1.984 5.757 1.00 60.05 H new ATOM 1795 N GLY A 121 -1.814 -0.870 5.248 1.00 3.41 N ATOM 1796 CA GLY A 121 -0.378 -0.919 5.044 1.00 3.32 C ATOM 1797 C GLY A 121 0.366 -1.406 6.272 1.00 72.21 C ATOM 1798 O GLY A 121 1.512 -1.843 6.177 1.00 22.52 O ATOM 0 H GLY A 121 -2.275 -1.779 5.268 1.00 3.41 H new ATOM 0 HA2 GLY A 121 -0.156 -1.577 4.204 1.00 3.32 H new ATOM 0 HA3 GLY A 121 -0.018 0.074 4.775 1.00 3.32 H new ATOM 1802 N GLN A 122 -0.287 -1.329 7.427 1.00 75.42 N ATOM 1803 CA GLN A 122 0.321 -1.764 8.678 1.00 30.54 C ATOM 1804 C GLN A 122 0.668 -3.249 8.628 1.00 42.31 C ATOM 1805 O GLN A 122 -0.027 -4.039 7.989 1.00 34.11 O ATOM 1806 CB GLN A 122 -0.622 -1.489 9.851 1.00 3.21 C ATOM 1807 CG GLN A 122 -0.933 -0.014 10.048 1.00 51.14 C ATOM 1808 CD GLN A 122 -2.416 0.252 10.214 1.00 52.44 C ATOM 1809 OE1 GLN A 122 -2.961 1.185 9.623 1.00 52.15 O ATOM 1810 NE2 GLN A 122 -3.078 -0.568 11.021 1.00 55.10 N ATOM 0 H GLN A 122 -1.237 -0.969 7.522 1.00 75.42 H new ATOM 0 HA GLN A 122 1.242 -1.198 8.820 1.00 30.54 H new ATOM 0 HB2 GLN A 122 -1.555 -2.030 9.691 1.00 3.21 H new ATOM 0 HB3 GLN A 122 -0.177 -1.883 10.765 1.00 3.21 H new ATOM 0 HG2 GLN A 122 -0.402 0.351 10.927 1.00 51.14 H new ATOM 0 HG3 GLN A 122 -0.560 0.550 9.193 1.00 51.14 H new ATOM 0 HE21 GLN A 122 -2.586 -1.328 11.491 1.00 55.10 H new ATOM 0 HE22 GLN A 122 -4.078 -0.438 11.171 1.00 55.10 H new ATOM 1819 N THR A 123 1.749 -3.622 9.305 1.00 25.04 N ATOM 1820 CA THR A 123 2.190 -5.011 9.337 1.00 42.25 C ATOM 1821 C THR A 123 2.631 -5.417 10.738 1.00 12.43 C ATOM 1822 O THR A 123 3.683 -4.993 11.215 1.00 0.23 O ATOM 1823 CB THR A 123 3.352 -5.254 8.355 1.00 3.40 C ATOM 1824 OG1 THR A 123 3.539 -4.103 7.523 1.00 70.53 O ATOM 1825 CG2 THR A 123 3.083 -6.475 7.489 1.00 54.55 C ATOM 0 H THR A 123 2.336 -2.981 9.839 1.00 25.04 H new ATOM 0 HA THR A 123 1.337 -5.620 9.038 1.00 42.25 H new ATOM 0 HB THR A 123 4.257 -5.433 8.935 1.00 3.40 H new ATOM 0 HG1 THR A 123 3.891 -4.383 6.652 1.00 70.53 H new ATOM 0 HG21 THR A 123 3.917 -6.626 6.804 1.00 54.55 H new ATOM 0 HG22 THR A 123 2.971 -7.354 8.124 1.00 54.55 H new ATOM 0 HG23 THR A 123 2.168 -6.321 6.918 1.00 54.55 H new ATOM 1833 N ALA A 124 1.819 -6.240 11.393 1.00 24.43 N ATOM 1834 CA ALA A 124 2.128 -6.706 12.740 1.00 55.51 C ATOM 1835 C ALA A 124 2.791 -8.078 12.708 1.00 4.02 C ATOM 1836 O ALA A 124 2.137 -9.088 12.448 1.00 21.34 O ATOM 1837 CB ALA A 124 0.864 -6.748 13.586 1.00 55.02 C ATOM 0 H ALA A 124 0.943 -6.598 11.013 1.00 24.43 H new ATOM 0 HA ALA A 124 2.830 -6.003 13.189 1.00 55.51 H new ATOM 0 HB1 ALA A 124 1.109 -7.098 14.589 1.00 55.02 H new ATOM 0 HB2 ALA A 124 0.432 -5.749 13.645 1.00 55.02 H new ATOM 0 HB3 ALA A 124 0.144 -7.428 13.131 1.00 55.02 H new ATOM 1843 N ILE A 125 4.093 -8.107 12.973 1.00 1.42 N ATOM 1844 CA ILE A 125 4.844 -9.356 12.975 1.00 5.41 C ATOM 1845 C ILE A 125 5.549 -9.571 14.310 1.00 20.32 C ATOM 1846 O ILE A 125 6.241 -8.683 14.810 1.00 30.42 O ATOM 1847 CB ILE A 125 5.890 -9.385 11.845 1.00 63.21 C ATOM 1848 CG1 ILE A 125 6.679 -10.696 11.884 1.00 35.00 C ATOM 1849 CG2 ILE A 125 6.828 -8.193 11.960 1.00 63.01 C ATOM 1850 CD1 ILE A 125 6.649 -11.458 10.578 1.00 73.32 C ATOM 0 H ILE A 125 4.649 -7.280 13.189 1.00 1.42 H new ATOM 0 HA ILE A 125 4.124 -10.158 12.814 1.00 5.41 H new ATOM 0 HB ILE A 125 5.371 -9.323 10.888 1.00 63.21 H new ATOM 0 HG12 ILE A 125 7.715 -10.480 12.145 1.00 35.00 H new ATOM 0 HG13 ILE A 125 6.276 -11.330 12.674 1.00 35.00 H new ATOM 0 HG21 ILE A 125 7.561 -8.228 11.154 1.00 63.01 H new ATOM 0 HG22 ILE A 125 6.253 -7.270 11.888 1.00 63.01 H new ATOM 0 HG23 ILE A 125 7.342 -8.226 12.920 1.00 63.01 H new ATOM 0 HD11 ILE A 125 7.228 -12.376 10.679 1.00 73.32 H new ATOM 0 HD12 ILE A 125 5.618 -11.706 10.325 1.00 73.32 H new ATOM 0 HD13 ILE A 125 7.079 -10.843 9.788 1.00 73.32 H new ATOM 1862 N LEU A 126 5.370 -10.757 14.882 1.00 2.23 N ATOM 1863 CA LEU A 126 5.990 -11.091 16.160 1.00 65.23 C ATOM 1864 C LEU A 126 6.961 -12.258 16.005 1.00 40.41 C ATOM 1865 O LEU A 126 6.899 -13.006 15.029 1.00 52.50 O ATOM 1866 CB LEU A 126 4.918 -11.439 17.194 1.00 5.41 C ATOM 1867 CG LEU A 126 3.572 -11.900 16.636 1.00 31.51 C ATOM 1868 CD1 LEU A 126 3.730 -13.205 15.871 1.00 63.12 C ATOM 1869 CD2 LEU A 126 2.556 -12.058 17.758 1.00 55.14 C ATOM 0 H LEU A 126 4.801 -11.503 14.481 1.00 2.23 H new ATOM 0 HA LEU A 126 6.548 -10.220 16.504 1.00 65.23 H new ATOM 0 HB2 LEU A 126 5.308 -12.224 17.842 1.00 5.41 H new ATOM 0 HB3 LEU A 126 4.748 -10.563 17.821 1.00 5.41 H new ATOM 0 HG LEU A 126 3.207 -11.140 15.946 1.00 31.51 H new ATOM 0 HD11 LEU A 126 2.761 -13.518 15.481 1.00 63.12 H new ATOM 0 HD12 LEU A 126 4.425 -13.060 15.044 1.00 63.12 H new ATOM 0 HD13 LEU A 126 4.117 -13.974 16.539 1.00 63.12 H new ATOM 0 HD21 LEU A 126 1.603 -12.387 17.343 1.00 55.14 H new ATOM 0 HD22 LEU A 126 2.915 -12.799 18.473 1.00 55.14 H new ATOM 0 HD23 LEU A 126 2.421 -11.102 18.264 1.00 55.14 H new ATOM 1881 N VAL A 127 7.857 -12.408 16.976 1.00 73.45 N ATOM 1882 CA VAL A 127 8.839 -13.486 16.949 1.00 15.11 C ATOM 1883 C VAL A 127 8.731 -14.358 18.195 1.00 5.43 C ATOM 1884 O VAL A 127 8.557 -13.854 19.304 1.00 4.24 O ATOM 1885 CB VAL A 127 10.273 -12.936 16.843 1.00 41.53 C ATOM 1886 CG1 VAL A 127 10.634 -12.141 18.089 1.00 63.24 C ATOM 1887 CG2 VAL A 127 11.263 -14.069 16.617 1.00 13.34 C ATOM 0 H VAL A 127 7.923 -11.797 17.790 1.00 73.45 H new ATOM 0 HA VAL A 127 8.624 -14.089 16.067 1.00 15.11 H new ATOM 0 HB VAL A 127 10.323 -12.264 15.986 1.00 41.53 H new ATOM 0 HG11 VAL A 127 11.651 -11.760 17.996 1.00 63.24 H new ATOM 0 HG12 VAL A 127 9.943 -11.306 18.201 1.00 63.24 H new ATOM 0 HG13 VAL A 127 10.567 -12.787 18.965 1.00 63.24 H new ATOM 0 HG21 VAL A 127 12.272 -13.662 16.544 1.00 13.34 H new ATOM 0 HG22 VAL A 127 11.213 -14.768 17.452 1.00 13.34 H new ATOM 0 HG23 VAL A 127 11.015 -14.590 15.692 1.00 13.34 H new ATOM 1897 N ALA A 128 8.837 -15.669 18.005 1.00 43.45 N ATOM 1898 CA ALA A 128 8.755 -16.611 19.113 1.00 0.15 C ATOM 1899 C ALA A 128 10.005 -17.482 19.188 1.00 52.50 C ATOM 1900 O ALA A 128 10.610 -17.804 18.165 1.00 12.10 O ATOM 1901 CB ALA A 128 7.512 -17.478 18.978 1.00 65.52 C ATOM 0 H ALA A 128 8.980 -16.103 17.093 1.00 43.45 H new ATOM 0 HA ALA A 128 8.687 -16.039 20.039 1.00 0.15 H new ATOM 0 HB1 ALA A 128 7.464 -18.177 19.813 1.00 65.52 H new ATOM 0 HB2 ALA A 128 6.625 -16.845 18.983 1.00 65.52 H new ATOM 0 HB3 ALA A 128 7.556 -18.034 18.041 1.00 65.52 H new ATOM 1907 N ILE A 129 10.386 -17.858 20.404 1.00 43.02 N ATOM 1908 CA ILE A 129 11.564 -18.692 20.610 1.00 0.54 C ATOM 1909 C ILE A 129 11.223 -19.931 21.430 1.00 21.40 C ATOM 1910 O ILE A 129 10.662 -19.832 22.521 1.00 14.21 O ATOM 1911 CB ILE A 129 12.687 -17.913 21.321 1.00 60.11 C ATOM 1912 CG1 ILE A 129 13.067 -16.671 20.512 1.00 11.03 C ATOM 1913 CG2 ILE A 129 13.900 -18.807 21.531 1.00 43.25 C ATOM 1914 CD1 ILE A 129 13.947 -15.702 21.271 1.00 54.13 C ATOM 0 H ILE A 129 9.897 -17.599 21.261 1.00 43.02 H new ATOM 0 HA ILE A 129 11.912 -18.997 19.623 1.00 0.54 H new ATOM 0 HB ILE A 129 12.324 -17.591 22.297 1.00 60.11 H new ATOM 0 HG12 ILE A 129 13.583 -16.983 19.604 1.00 11.03 H new ATOM 0 HG13 ILE A 129 12.157 -16.157 20.202 1.00 11.03 H new ATOM 0 HG21 ILE A 129 14.685 -18.243 22.034 1.00 43.25 H new ATOM 0 HG22 ILE A 129 13.619 -19.664 22.144 1.00 43.25 H new ATOM 0 HG23 ILE A 129 14.266 -19.156 20.566 1.00 43.25 H new ATOM 0 HD11 ILE A 129 14.177 -14.846 20.637 1.00 54.13 H new ATOM 0 HD12 ILE A 129 13.426 -15.361 22.166 1.00 54.13 H new ATOM 0 HD13 ILE A 129 14.873 -16.200 21.558 1.00 54.13 H new ATOM 1926 N ASP A 130 11.568 -21.099 20.898 1.00 54.33 N ATOM 1927 CA ASP A 130 11.301 -22.359 21.581 1.00 71.20 C ATOM 1928 C ASP A 130 9.802 -22.569 21.769 1.00 14.42 C ATOM 1929 O ASP A 130 9.364 -23.133 22.771 1.00 3.32 O ATOM 1930 CB ASP A 130 12.007 -22.388 22.938 1.00 52.24 C ATOM 1931 CG ASP A 130 12.593 -23.749 23.256 1.00 21.05 C ATOM 1932 OD1 ASP A 130 13.747 -24.007 22.855 1.00 61.45 O ATOM 1933 OD2 ASP A 130 11.898 -24.556 23.909 1.00 43.32 O ATOM 0 H ASP A 130 12.033 -21.199 19.996 1.00 54.33 H new ATOM 0 HA ASP A 130 11.688 -23.168 20.962 1.00 71.20 H new ATOM 0 HB2 ASP A 130 12.802 -21.642 22.947 1.00 52.24 H new ATOM 0 HB3 ASP A 130 11.299 -22.109 23.719 1.00 52.24 H new ATOM 1938 N GLY A 131 9.018 -22.109 20.798 1.00 3.32 N ATOM 1939 CA GLY A 131 7.576 -22.254 20.877 1.00 65.13 C ATOM 1940 C GLY A 131 6.950 -21.290 21.865 1.00 74.43 C ATOM 1941 O GLY A 131 5.868 -21.548 22.393 1.00 12.20 O ATOM 0 H GLY A 131 9.356 -21.639 19.958 1.00 3.32 H new ATOM 0 HA2 GLY A 131 7.143 -22.090 19.890 1.00 65.13 H new ATOM 0 HA3 GLY A 131 7.332 -23.276 21.167 1.00 65.13 H new ATOM 1945 N VAL A 132 7.631 -20.177 22.117 1.00 71.21 N ATOM 1946 CA VAL A 132 7.135 -19.172 23.049 1.00 54.32 C ATOM 1947 C VAL A 132 7.414 -17.763 22.537 1.00 15.02 C ATOM 1948 O VAL A 132 8.569 -17.357 22.402 1.00 14.12 O ATOM 1949 CB VAL A 132 7.770 -19.335 24.442 1.00 25.31 C ATOM 1950 CG1 VAL A 132 7.187 -18.325 25.418 1.00 40.54 C ATOM 1951 CG2 VAL A 132 7.576 -20.755 24.953 1.00 70.03 C ATOM 0 H VAL A 132 8.528 -19.949 21.689 1.00 71.21 H new ATOM 0 HA VAL A 132 6.058 -19.320 23.130 1.00 54.32 H new ATOM 0 HB VAL A 132 8.840 -19.146 24.358 1.00 25.31 H new ATOM 0 HG11 VAL A 132 7.649 -18.456 26.397 1.00 40.54 H new ATOM 0 HG12 VAL A 132 7.383 -17.315 25.057 1.00 40.54 H new ATOM 0 HG13 VAL A 132 6.111 -18.478 25.501 1.00 40.54 H new ATOM 0 HG21 VAL A 132 8.031 -20.852 25.939 1.00 70.03 H new ATOM 0 HG22 VAL A 132 6.511 -20.975 25.022 1.00 70.03 H new ATOM 0 HG23 VAL A 132 8.047 -21.457 24.265 1.00 70.03 H new ATOM 1961 N LEU A 133 6.349 -17.021 22.254 1.00 13.11 N ATOM 1962 CA LEU A 133 6.478 -15.655 21.757 1.00 30.42 C ATOM 1963 C LEU A 133 7.451 -14.854 22.615 1.00 4.43 C ATOM 1964 O LEU A 133 7.278 -14.743 23.830 1.00 61.04 O ATOM 1965 CB LEU A 133 5.112 -14.967 21.737 1.00 31.44 C ATOM 1966 CG LEU A 133 4.586 -14.480 23.088 1.00 30.41 C ATOM 1967 CD1 LEU A 133 3.253 -13.769 22.917 1.00 73.22 C ATOM 1968 CD2 LEU A 133 4.451 -15.644 24.059 1.00 73.41 C ATOM 0 H LEU A 133 5.387 -17.342 22.360 1.00 13.11 H new ATOM 0 HA LEU A 133 6.870 -15.700 20.741 1.00 30.42 H new ATOM 0 HB2 LEU A 133 5.167 -14.113 21.062 1.00 31.44 H new ATOM 0 HB3 LEU A 133 4.384 -15.660 21.315 1.00 31.44 H new ATOM 0 HG LEU A 133 5.303 -13.770 23.501 1.00 30.41 H new ATOM 0 HD11 LEU A 133 2.894 -13.430 23.889 1.00 73.22 H new ATOM 0 HD12 LEU A 133 3.380 -12.911 22.257 1.00 73.22 H new ATOM 0 HD13 LEU A 133 2.527 -14.456 22.482 1.00 73.22 H new ATOM 0 HD21 LEU A 133 4.076 -15.279 25.015 1.00 73.41 H new ATOM 0 HD22 LEU A 133 3.755 -16.378 23.652 1.00 73.41 H new ATOM 0 HD23 LEU A 133 5.425 -16.110 24.206 1.00 73.41 H new ATOM 1980 N CYS A 134 8.473 -14.295 21.976 1.00 1.23 N ATOM 1981 CA CYS A 134 9.474 -13.501 22.681 1.00 71.31 C ATOM 1982 C CYS A 134 9.139 -12.015 22.608 1.00 30.14 C ATOM 1983 O CYS A 134 9.359 -11.271 23.563 1.00 34.55 O ATOM 1984 CB CYS A 134 10.862 -13.753 22.091 1.00 62.00 C ATOM 1985 SG CYS A 134 12.169 -12.740 22.821 1.00 4.44 S ATOM 0 H CYS A 134 8.630 -14.377 20.972 1.00 1.23 H new ATOM 0 HA CYS A 134 9.472 -13.804 23.728 1.00 71.31 H new ATOM 0 HB2 CYS A 134 11.116 -14.805 22.223 1.00 62.00 H new ATOM 0 HB3 CYS A 134 10.828 -13.566 21.018 1.00 62.00 H new ATOM 0 HG CYS A 134 11.638 -11.819 23.569 1.00 4.44 H new ATOM 1991 N GLY A 135 8.607 -11.588 21.467 1.00 71.51 N ATOM 1992 CA GLY A 135 8.252 -10.192 21.290 1.00 60.50 C ATOM 1993 C GLY A 135 7.403 -9.962 20.056 1.00 61.05 C ATOM 1994 O GLY A 135 7.299 -10.834 19.194 1.00 65.52 O ATOM 0 H GLY A 135 8.415 -12.184 20.662 1.00 71.51 H new ATOM 0 HA2 GLY A 135 7.711 -9.844 22.170 1.00 60.50 H new ATOM 0 HA3 GLY A 135 9.161 -9.595 21.218 1.00 60.50 H new ATOM 1998 N MET A 136 6.793 -8.785 19.970 1.00 14.45 N ATOM 1999 CA MET A 136 5.948 -8.443 18.832 1.00 14.21 C ATOM 2000 C MET A 136 6.295 -7.059 18.293 1.00 2.33 C ATOM 2001 O MET A 136 6.474 -6.111 19.059 1.00 32.34 O ATOM 2002 CB MET A 136 4.472 -8.491 19.232 1.00 32.34 C ATOM 2003 CG MET A 136 4.142 -7.632 20.442 1.00 54.22 C ATOM 2004 SD MET A 136 3.528 -5.998 19.987 1.00 64.44 S ATOM 2005 CE MET A 136 1.770 -6.211 20.251 1.00 73.55 C ATOM 0 H MET A 136 6.868 -8.052 20.675 1.00 14.45 H new ATOM 0 HA MET A 136 6.128 -9.176 18.045 1.00 14.21 H new ATOM 0 HB2 MET A 136 3.865 -8.164 18.388 1.00 32.34 H new ATOM 0 HB3 MET A 136 4.195 -9.524 19.443 1.00 32.34 H new ATOM 0 HG2 MET A 136 3.394 -8.140 21.051 1.00 54.22 H new ATOM 0 HG3 MET A 136 5.034 -7.522 21.059 1.00 54.22 H new ATOM 0 HE1 MET A 136 1.251 -5.283 20.012 1.00 73.55 H new ATOM 0 HE2 MET A 136 1.400 -7.010 19.609 1.00 73.55 H new ATOM 0 HE3 MET A 136 1.587 -6.470 21.294 1.00 73.55 H new ATOM 2015 N ILE A 137 6.390 -6.949 16.972 1.00 33.55 N ATOM 2016 CA ILE A 137 6.715 -5.681 16.333 1.00 41.23 C ATOM 2017 C ILE A 137 5.602 -5.240 15.389 1.00 53.33 C ATOM 2018 O ILE A 137 4.964 -6.065 14.736 1.00 34.45 O ATOM 2019 CB ILE A 137 8.035 -5.770 15.545 1.00 44.11 C ATOM 2020 CG1 ILE A 137 9.162 -6.274 16.450 1.00 54.41 C ATOM 2021 CG2 ILE A 137 8.391 -4.415 14.952 1.00 11.30 C ATOM 2022 CD1 ILE A 137 9.402 -7.763 16.344 1.00 71.25 C ATOM 0 H ILE A 137 6.246 -7.723 16.324 1.00 33.55 H new ATOM 0 HA ILE A 137 6.825 -4.945 17.130 1.00 41.23 H new ATOM 0 HB ILE A 137 7.905 -6.480 14.728 1.00 44.11 H new ATOM 0 HG12 ILE A 137 10.082 -5.747 16.198 1.00 54.41 H new ATOM 0 HG13 ILE A 137 8.925 -6.025 17.484 1.00 54.41 H new ATOM 0 HG21 ILE A 137 9.326 -4.495 14.398 1.00 11.30 H new ATOM 0 HG22 ILE A 137 7.597 -4.093 14.279 1.00 11.30 H new ATOM 0 HG23 ILE A 137 8.505 -3.686 15.754 1.00 11.30 H new ATOM 0 HD11 ILE A 137 10.214 -8.049 17.013 1.00 71.25 H new ATOM 0 HD12 ILE A 137 8.495 -8.299 16.625 1.00 71.25 H new ATOM 0 HD13 ILE A 137 9.670 -8.016 15.318 1.00 71.25 H new ATOM 2034 N ALA A 138 5.375 -3.932 15.320 1.00 41.01 N ATOM 2035 CA ALA A 138 4.342 -3.380 14.453 1.00 74.33 C ATOM 2036 C ALA A 138 4.898 -2.261 13.579 1.00 70.21 C ATOM 2037 O ALA A 138 5.292 -1.208 14.080 1.00 44.21 O ATOM 2038 CB ALA A 138 3.172 -2.872 15.283 1.00 71.53 C ATOM 0 H ALA A 138 5.893 -3.235 15.855 1.00 41.01 H new ATOM 0 HA ALA A 138 3.990 -4.176 13.797 1.00 74.33 H new ATOM 0 HB1 ALA A 138 2.408 -2.462 14.622 1.00 71.53 H new ATOM 0 HB2 ALA A 138 2.750 -3.695 15.859 1.00 71.53 H new ATOM 0 HB3 ALA A 138 3.519 -2.094 15.963 1.00 71.53 H new ATOM 2044 N ILE A 139 4.927 -2.497 12.272 1.00 43.24 N ATOM 2045 CA ILE A 139 5.435 -1.508 11.329 1.00 42.11 C ATOM 2046 C ILE A 139 4.294 -0.784 10.623 1.00 34.10 C ATOM 2047 O ILE A 139 3.207 -1.336 10.451 1.00 23.13 O ATOM 2048 CB ILE A 139 6.349 -2.155 10.272 1.00 62.32 C ATOM 2049 CG1 ILE A 139 5.643 -3.343 9.614 1.00 42.42 C ATOM 2050 CG2 ILE A 139 7.661 -2.596 10.904 1.00 11.01 C ATOM 2051 CD1 ILE A 139 6.308 -3.810 8.338 1.00 4.12 C ATOM 0 H ILE A 139 4.605 -3.364 11.842 1.00 43.24 H new ATOM 0 HA ILE A 139 6.015 -0.789 11.908 1.00 42.11 H new ATOM 0 HB ILE A 139 6.570 -1.415 9.502 1.00 62.32 H new ATOM 0 HG12 ILE A 139 5.609 -4.172 10.321 1.00 42.42 H new ATOM 0 HG13 ILE A 139 4.611 -3.067 9.396 1.00 42.42 H new ATOM 0 HG21 ILE A 139 8.296 -3.051 10.144 1.00 11.01 H new ATOM 0 HG22 ILE A 139 8.169 -1.731 11.330 1.00 11.01 H new ATOM 0 HG23 ILE A 139 7.460 -3.322 11.691 1.00 11.01 H new ATOM 0 HD11 ILE A 139 5.754 -4.654 7.927 1.00 4.12 H new ATOM 0 HD12 ILE A 139 6.318 -2.995 7.614 1.00 4.12 H new ATOM 0 HD13 ILE A 139 7.331 -4.118 8.553 1.00 4.12 H new ATOM 2063 N ALA A 140 4.549 0.455 10.214 1.00 34.53 N ATOM 2064 CA ALA A 140 3.544 1.253 9.523 1.00 32.12 C ATOM 2065 C ALA A 140 4.046 1.704 8.156 1.00 3.10 C ATOM 2066 O ALA A 140 4.913 2.573 8.058 1.00 10.14 O ATOM 2067 CB ALA A 140 3.154 2.457 10.368 1.00 73.20 C ATOM 0 H ALA A 140 5.443 0.927 10.349 1.00 34.53 H new ATOM 0 HA ALA A 140 2.663 0.630 9.370 1.00 32.12 H new ATOM 0 HB1 ALA A 140 2.403 3.044 9.840 1.00 73.20 H new ATOM 0 HB2 ALA A 140 2.746 2.117 11.320 1.00 73.20 H new ATOM 0 HB3 ALA A 140 4.034 3.074 10.551 1.00 73.20 H new ATOM 2073 N ASP A 141 3.498 1.108 7.103 1.00 14.22 N ATOM 2074 CA ASP A 141 3.890 1.449 5.741 1.00 42.42 C ATOM 2075 C ASP A 141 3.024 2.579 5.192 1.00 30.03 C ATOM 2076 O ASP A 141 1.801 2.455 5.116 1.00 52.32 O ATOM 2077 CB ASP A 141 3.784 0.222 4.834 1.00 11.12 C ATOM 2078 CG ASP A 141 5.026 0.016 3.990 1.00 3.51 C ATOM 2079 OD1 ASP A 141 6.135 0.308 4.486 1.00 73.42 O ATOM 2080 OD2 ASP A 141 4.890 -0.435 2.833 1.00 2.24 O ATOM 0 H ASP A 141 2.780 0.386 7.167 1.00 14.22 H new ATOM 0 HA ASP A 141 4.926 1.787 5.762 1.00 42.42 H new ATOM 0 HB2 ASP A 141 3.613 -0.664 5.445 1.00 11.12 H new ATOM 0 HB3 ASP A 141 2.918 0.331 4.181 1.00 11.12 H new TER 2085 ASP A 141