USER MOD reduce.3.24.130724 H: found=0, std=0, add=973, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 973 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 92 SER OG : rot 160:sc= 0 USER MOD Set 1.2: A 106 TYR OH : rot -30:sc= -0.594 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 20 CYS SG : rot -63:sc= -0.223 USER MOD Single : A 22 THR OG1 : rot 75:sc= 0.914 USER MOD Single : A 25 ASN : amide:sc= -0.0452 X(o=-0.045,f=-0.27) USER MOD Single : A 29 HIS : no HD1:sc= -0.0935 X(o=-0.093,f=-0.22) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ -139:sc= -0.254 (180deg=-1.11) USER MOD Single : A 32 SER OG : rot 180:sc= -0.264 USER MOD Single : A 34 TYR OH : rot 158:sc= -0.93 USER MOD Single : A 37 MET CE :methyl -121:sc= -3.19! (180deg=-5.98!) USER MOD Single : A 38 HIS : no HD1:sc= -1.68 K(o=-1.7,f=-4.2) USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=-0.056) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot -13:sc= 0.934 USER MOD Single : A 56 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 LYS NZ :NH3+ -152:sc= -0.152 (180deg=-0.657) USER MOD Single : A 67 ASN : amide:sc= -0.596 X(o=-0.6,f=-0.75) USER MOD Single : A 70 CYS SG : rot 180:sc= -1.61 USER MOD Single : A 71 TYR OH : rot 165:sc= -0.297 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 ASN : amide:sc= -2.87 K(o=-2.9,f=-5.2!) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot -48:sc= 0.857 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot -3:sc= 0.91 USER MOD Single : A 118 GLN : amide:sc=-0.00838 K(o=-0.0084,f=-1.4) USER MOD Single : A 121 GLN : amide:sc= -0.179 K(o=-0.18,f=-3.3!) USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=0.22) USER MOD Single : A 126 ASN : amide:sc= -2.25 K(o=-2.2,f=-3) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.033) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -0.172 K(o=-0.17,f=-2.2!) USER MOD ----------------------------------------------------------------- ATOM 63 N VAL A 14 -6.431 7.714 -4.696 1.00 71.15 N ATOM 64 CA VAL A 14 -6.624 8.272 -3.363 1.00 50.14 C ATOM 65 C VAL A 14 -5.426 9.115 -2.942 1.00 42.41 C ATOM 66 O VAL A 14 -4.295 8.630 -2.903 1.00 33.04 O ATOM 67 CB VAL A 14 -6.851 7.164 -2.318 1.00 61.23 C ATOM 68 CG1 VAL A 14 -5.721 6.146 -2.365 1.00 54.03 C ATOM 69 CG2 VAL A 14 -6.982 7.763 -0.926 1.00 43.43 C ATOM 0 HA VAL A 14 -7.511 8.904 -3.410 1.00 50.14 H new ATOM 0 HB VAL A 14 -7.782 6.649 -2.556 1.00 61.23 H new ATOM 0 HG11 VAL A 14 -5.899 5.371 -1.620 1.00 54.03 H new ATOM 0 HG12 VAL A 14 -5.679 5.694 -3.356 1.00 54.03 H new ATOM 0 HG13 VAL A 14 -4.774 6.643 -2.153 1.00 54.03 H new ATOM 0 HG21 VAL A 14 -7.142 6.966 -0.200 1.00 43.43 H new ATOM 0 HG22 VAL A 14 -6.070 8.304 -0.675 1.00 43.43 H new ATOM 0 HG23 VAL A 14 -7.829 8.449 -0.903 1.00 43.43 H new ATOM 79 N SER A 15 -5.681 10.381 -2.627 1.00 54.24 N ATOM 80 CA SER A 15 -4.623 11.294 -2.212 1.00 10.14 C ATOM 81 C SER A 15 -5.116 12.234 -1.115 1.00 62.14 C ATOM 82 O SER A 15 -6.280 12.635 -1.102 1.00 44.35 O ATOM 83 CB SER A 15 -4.122 12.106 -3.408 1.00 24.24 C ATOM 84 OG SER A 15 -2.709 12.049 -3.507 1.00 31.44 O ATOM 0 H SER A 15 -6.612 10.798 -2.651 1.00 54.24 H new ATOM 0 HA SER A 15 -3.800 10.700 -1.815 1.00 10.14 H new ATOM 0 HB2 SER A 15 -4.570 11.723 -4.325 1.00 24.24 H new ATOM 0 HB3 SER A 15 -4.441 13.143 -3.307 1.00 24.24 H new ATOM 0 HG SER A 15 -2.414 12.574 -4.280 1.00 31.44 H new ATOM 90 N VAL A 16 -4.221 12.581 -0.196 1.00 2.30 N ATOM 91 CA VAL A 16 -4.563 13.475 0.904 1.00 24.45 C ATOM 92 C VAL A 16 -4.709 14.913 0.420 1.00 73.52 C ATOM 93 O VAL A 16 -3.781 15.484 -0.151 1.00 62.31 O ATOM 94 CB VAL A 16 -3.499 13.426 2.018 1.00 75.31 C ATOM 95 CG1 VAL A 16 -2.121 13.736 1.454 1.00 12.24 C ATOM 96 CG2 VAL A 16 -3.857 14.391 3.138 1.00 44.53 C ATOM 0 H VAL A 16 -3.254 12.257 -0.191 1.00 2.30 H new ATOM 0 HA VAL A 16 -5.516 13.132 1.305 1.00 24.45 H new ATOM 0 HB VAL A 16 -3.476 12.418 2.432 1.00 75.31 H new ATOM 0 HG11 VAL A 16 -1.383 13.697 2.255 1.00 12.24 H new ATOM 0 HG12 VAL A 16 -1.867 13.001 0.690 1.00 12.24 H new ATOM 0 HG13 VAL A 16 -2.124 14.732 1.012 1.00 12.24 H new ATOM 0 HG21 VAL A 16 -3.095 14.344 3.916 1.00 44.53 H new ATOM 0 HG22 VAL A 16 -3.909 15.405 2.742 1.00 44.53 H new ATOM 0 HG23 VAL A 16 -4.824 14.117 3.560 1.00 44.53 H new ATOM 106 N ALA A 17 -5.882 15.493 0.652 1.00 74.52 N ATOM 107 CA ALA A 17 -6.150 16.865 0.241 1.00 13.22 C ATOM 108 C ALA A 17 -5.530 17.861 1.216 1.00 74.32 C ATOM 109 O ALA A 17 -5.292 17.538 2.380 1.00 52.22 O ATOM 110 CB ALA A 17 -7.649 17.099 0.127 1.00 35.12 C ATOM 0 H ALA A 17 -6.662 15.034 1.123 1.00 74.52 H new ATOM 0 HA ALA A 17 -5.694 17.021 -0.737 1.00 13.22 H new ATOM 0 HB1 ALA A 17 -7.834 18.128 -0.181 1.00 35.12 H new ATOM 0 HB2 ALA A 17 -8.068 16.418 -0.613 1.00 35.12 H new ATOM 0 HB3 ALA A 17 -8.120 16.919 1.093 1.00 35.12 H new ATOM 116 N ASP A 18 -5.271 19.071 0.733 1.00 60.20 N ATOM 117 CA ASP A 18 -4.679 20.114 1.562 1.00 3.01 C ATOM 118 C ASP A 18 -5.487 20.317 2.840 1.00 23.42 C ATOM 119 O ASP A 18 -4.942 20.695 3.876 1.00 4.52 O ATOM 120 CB ASP A 18 -4.595 21.428 0.784 1.00 63.25 C ATOM 121 CG ASP A 18 -3.439 21.447 -0.197 1.00 60.44 C ATOM 122 OD1 ASP A 18 -2.974 20.355 -0.588 1.00 4.15 O ATOM 123 OD2 ASP A 18 -3.000 22.553 -0.576 1.00 34.32 O ATOM 0 H ASP A 18 -5.462 19.354 -0.228 1.00 60.20 H new ATOM 0 HA ASP A 18 -3.673 19.798 1.836 1.00 3.01 H new ATOM 0 HB2 ASP A 18 -5.528 21.588 0.244 1.00 63.25 H new ATOM 0 HB3 ASP A 18 -4.487 22.256 1.485 1.00 63.25 H new ATOM 128 N GLU A 19 -6.789 20.062 2.758 1.00 41.33 N ATOM 129 CA GLU A 19 -7.671 20.219 3.908 1.00 75.02 C ATOM 130 C GLU A 19 -7.241 19.306 5.053 1.00 44.55 C ATOM 131 O GLU A 19 -7.240 19.711 6.216 1.00 65.31 O ATOM 132 CB GLU A 19 -9.118 19.913 3.514 1.00 11.10 C ATOM 133 CG GLU A 19 -9.310 18.522 2.935 1.00 30.50 C ATOM 134 CD GLU A 19 -10.338 18.490 1.821 1.00 42.05 C ATOM 135 OE1 GLU A 19 -9.995 18.881 0.685 1.00 11.44 O ATOM 136 OE2 GLU A 19 -11.485 18.073 2.084 1.00 13.32 O ATOM 0 H GLU A 19 -7.256 19.746 1.908 1.00 41.33 H new ATOM 0 HA GLU A 19 -7.604 21.253 4.246 1.00 75.02 H new ATOM 0 HB2 GLU A 19 -9.756 20.023 4.391 1.00 11.10 H new ATOM 0 HB3 GLU A 19 -9.450 20.650 2.783 1.00 11.10 H new ATOM 0 HG2 GLU A 19 -8.356 18.156 2.555 1.00 30.50 H new ATOM 0 HG3 GLU A 19 -9.619 17.842 3.729 1.00 30.50 H new ATOM 143 N CYS A 20 -6.876 18.075 4.714 1.00 32.20 N ATOM 144 CA CYS A 20 -6.444 17.103 5.713 1.00 54.51 C ATOM 145 C CYS A 20 -5.129 17.532 6.355 1.00 61.01 C ATOM 146 O CYS A 20 -4.971 17.469 7.574 1.00 15.42 O ATOM 147 CB CYS A 20 -6.289 15.721 5.077 1.00 51.42 C ATOM 148 SG CYS A 20 -7.675 14.604 5.393 1.00 64.53 S ATOM 0 H CYS A 20 -6.870 17.726 3.756 1.00 32.20 H new ATOM 0 HA CYS A 20 -7.207 17.053 6.490 1.00 54.51 H new ATOM 0 HB2 CYS A 20 -6.170 15.840 4.000 1.00 51.42 H new ATOM 0 HB3 CYS A 20 -5.374 15.262 5.450 1.00 51.42 H new ATOM 0 HG CYS A 20 -7.764 14.373 6.669 1.00 64.53 H new ATOM 154 N VAL A 21 -4.185 17.966 5.525 1.00 13.23 N ATOM 155 CA VAL A 21 -2.883 18.405 6.011 1.00 25.45 C ATOM 156 C VAL A 21 -3.024 19.558 6.999 1.00 60.42 C ATOM 157 O VAL A 21 -2.396 19.564 8.058 1.00 32.23 O ATOM 158 CB VAL A 21 -1.970 18.845 4.852 1.00 41.33 C ATOM 159 CG1 VAL A 21 -0.560 19.114 5.354 1.00 4.02 C ATOM 160 CG2 VAL A 21 -1.962 17.794 3.752 1.00 44.41 C ATOM 0 H VAL A 21 -4.298 18.023 4.513 1.00 13.23 H new ATOM 0 HA VAL A 21 -2.430 17.552 6.516 1.00 25.45 H new ATOM 0 HB VAL A 21 -2.363 19.772 4.435 1.00 41.33 H new ATOM 0 HG11 VAL A 21 0.070 19.424 4.520 1.00 4.02 H new ATOM 0 HG12 VAL A 21 -0.585 19.905 6.103 1.00 4.02 H new ATOM 0 HG13 VAL A 21 -0.153 18.206 5.799 1.00 4.02 H new ATOM 0 HG21 VAL A 21 -1.312 18.121 2.941 1.00 44.41 H new ATOM 0 HG22 VAL A 21 -1.594 16.850 4.154 1.00 44.41 H new ATOM 0 HG23 VAL A 21 -2.975 17.657 3.372 1.00 44.41 H new ATOM 170 N THR A 22 -3.854 20.534 6.645 1.00 41.10 N ATOM 171 CA THR A 22 -4.078 21.694 7.499 1.00 31.50 C ATOM 172 C THR A 22 -4.770 21.294 8.798 1.00 43.44 C ATOM 173 O THR A 22 -4.403 21.761 9.876 1.00 54.03 O ATOM 174 CB THR A 22 -4.928 22.761 6.785 1.00 14.20 C ATOM 175 OG1 THR A 22 -4.424 22.986 5.464 1.00 74.44 O ATOM 176 CG2 THR A 22 -4.922 24.068 7.564 1.00 33.22 C ATOM 0 H THR A 22 -4.382 20.544 5.773 1.00 41.10 H new ATOM 0 HA THR A 22 -3.098 22.114 7.727 1.00 31.50 H new ATOM 0 HB THR A 22 -5.953 22.396 6.725 1.00 14.20 H new ATOM 0 HG1 THR A 22 -4.668 22.232 4.888 1.00 74.44 H new ATOM 0 HG21 THR A 22 -5.529 24.807 7.040 1.00 33.22 H new ATOM 0 HG22 THR A 22 -5.333 23.900 8.559 1.00 33.22 H new ATOM 0 HG23 THR A 22 -3.899 24.435 7.651 1.00 33.22 H new ATOM 184 N ALA A 23 -5.771 20.428 8.687 1.00 32.10 N ATOM 185 CA ALA A 23 -6.512 19.964 9.853 1.00 32.14 C ATOM 186 C ALA A 23 -5.584 19.303 10.866 1.00 23.43 C ATOM 187 O ALA A 23 -5.682 19.550 12.069 1.00 55.52 O ATOM 188 CB ALA A 23 -7.610 18.998 9.432 1.00 42.34 C ATOM 0 H ALA A 23 -6.088 20.033 7.801 1.00 32.10 H new ATOM 0 HA ALA A 23 -6.969 20.831 10.330 1.00 32.14 H new ATOM 0 HB1 ALA A 23 -8.155 18.660 10.313 1.00 42.34 H new ATOM 0 HB2 ALA A 23 -8.297 19.502 8.752 1.00 42.34 H new ATOM 0 HB3 ALA A 23 -7.166 18.139 8.929 1.00 42.34 H new ATOM 194 N LEU A 24 -4.683 18.460 10.374 1.00 64.14 N ATOM 195 CA LEU A 24 -3.736 17.762 11.236 1.00 21.34 C ATOM 196 C LEU A 24 -2.721 18.734 11.830 1.00 35.45 C ATOM 197 O LEU A 24 -2.373 18.640 13.007 1.00 41.15 O ATOM 198 CB LEU A 24 -3.011 16.667 10.451 1.00 53.20 C ATOM 199 CG LEU A 24 -3.899 15.590 9.826 1.00 42.22 C ATOM 200 CD1 LEU A 24 -3.224 14.985 8.604 1.00 11.54 C ATOM 201 CD2 LEU A 24 -4.226 14.510 10.846 1.00 23.14 C ATOM 0 H LEU A 24 -4.588 18.243 9.382 1.00 64.14 H new ATOM 0 HA LEU A 24 -4.295 17.305 12.052 1.00 21.34 H new ATOM 0 HB2 LEU A 24 -2.433 17.139 9.657 1.00 53.20 H new ATOM 0 HB3 LEU A 24 -2.299 16.181 11.118 1.00 53.20 H new ATOM 0 HG LEU A 24 -4.832 16.055 9.508 1.00 42.22 H new ATOM 0 HD11 LEU A 24 -3.870 14.221 8.172 1.00 11.54 H new ATOM 0 HD12 LEU A 24 -3.042 15.765 7.865 1.00 11.54 H new ATOM 0 HD13 LEU A 24 -2.276 14.535 8.898 1.00 11.54 H new ATOM 0 HD21 LEU A 24 -4.859 13.752 10.384 1.00 23.14 H new ATOM 0 HD22 LEU A 24 -3.303 14.048 11.195 1.00 23.14 H new ATOM 0 HD23 LEU A 24 -4.751 14.955 11.691 1.00 23.14 H new ATOM 213 N ASN A 25 -2.253 19.668 11.009 1.00 31.50 N ATOM 214 CA ASN A 25 -1.280 20.658 11.454 1.00 43.32 C ATOM 215 C ASN A 25 -1.816 21.453 12.641 1.00 62.12 C ATOM 216 O ASN A 25 -1.114 21.659 13.631 1.00 21.20 O ATOM 217 CB ASN A 25 -0.927 21.608 10.307 1.00 14.13 C ATOM 218 CG ASN A 25 0.556 21.607 9.990 1.00 34.42 C ATOM 219 OD1 ASN A 25 1.186 20.551 9.923 1.00 3.53 O ATOM 220 ND2 ASN A 25 1.120 22.793 9.793 1.00 34.35 N ATOM 0 H ASN A 25 -2.532 19.760 10.032 1.00 31.50 H new ATOM 0 HA ASN A 25 -0.380 20.130 11.770 1.00 43.32 H new ATOM 0 HB2 ASN A 25 -1.486 21.321 9.416 1.00 14.13 H new ATOM 0 HB3 ASN A 25 -1.239 22.619 10.567 1.00 14.13 H new ATOM 0 HD21 ASN A 25 2.115 22.855 9.576 1.00 34.35 H new ATOM 0 HD22 ASN A 25 0.558 23.642 9.859 1.00 34.35 H new ATOM 227 N ASP A 26 -3.064 21.896 12.534 1.00 64.12 N ATOM 228 CA ASP A 26 -3.695 22.666 13.599 1.00 53.53 C ATOM 229 C ASP A 26 -4.009 21.779 14.799 1.00 22.12 C ATOM 230 O ASP A 26 -3.874 22.201 15.949 1.00 73.23 O ATOM 231 CB ASP A 26 -4.977 23.327 13.088 1.00 31.52 C ATOM 232 CG ASP A 26 -4.700 24.437 12.094 1.00 11.55 C ATOM 233 OD1 ASP A 26 -4.317 24.126 10.947 1.00 25.13 O ATOM 234 OD2 ASP A 26 -4.868 25.618 12.464 1.00 44.44 O ATOM 0 H ASP A 26 -3.658 21.735 11.721 1.00 64.12 H new ATOM 0 HA ASP A 26 -2.997 23.441 13.916 1.00 53.53 H new ATOM 0 HB2 ASP A 26 -5.609 22.573 12.619 1.00 31.52 H new ATOM 0 HB3 ASP A 26 -5.536 23.731 13.932 1.00 31.52 H new ATOM 239 N LEU A 27 -4.428 20.549 14.525 1.00 31.42 N ATOM 240 CA LEU A 27 -4.762 19.601 15.583 1.00 71.12 C ATOM 241 C LEU A 27 -3.563 19.356 16.493 1.00 61.41 C ATOM 242 O LEU A 27 -3.713 19.200 17.705 1.00 65.11 O ATOM 243 CB LEU A 27 -5.237 18.278 14.978 1.00 1.43 C ATOM 244 CG LEU A 27 -5.849 17.275 15.956 1.00 33.11 C ATOM 245 CD1 LEU A 27 -7.355 17.468 16.046 1.00 71.12 C ATOM 246 CD2 LEU A 27 -5.516 15.850 15.537 1.00 53.51 C ATOM 0 H LEU A 27 -4.545 20.184 13.580 1.00 31.42 H new ATOM 0 HA LEU A 27 -5.566 20.030 16.181 1.00 71.12 H new ATOM 0 HB2 LEU A 27 -5.974 18.498 14.206 1.00 1.43 H new ATOM 0 HB3 LEU A 27 -4.390 17.803 14.484 1.00 1.43 H new ATOM 0 HG LEU A 27 -5.421 17.452 16.943 1.00 33.11 H new ATOM 0 HD11 LEU A 27 -7.773 16.745 16.747 1.00 71.12 H new ATOM 0 HD12 LEU A 27 -7.572 18.478 16.393 1.00 71.12 H new ATOM 0 HD13 LEU A 27 -7.800 17.319 15.062 1.00 71.12 H new ATOM 0 HD21 LEU A 27 -5.960 15.150 16.245 1.00 53.51 H new ATOM 0 HD22 LEU A 27 -5.915 15.661 14.541 1.00 53.51 H new ATOM 0 HD23 LEU A 27 -4.434 15.718 15.525 1.00 53.51 H new ATOM 258 N ARG A 28 -2.374 19.325 15.901 1.00 64.34 N ATOM 259 CA ARG A 28 -1.148 19.100 16.658 1.00 34.41 C ATOM 260 C ARG A 28 -0.917 20.223 17.664 1.00 11.32 C ATOM 261 O ARG A 28 -0.239 20.036 18.675 1.00 34.02 O ATOM 262 CB ARG A 28 0.049 18.993 15.712 1.00 1.11 C ATOM 263 CG ARG A 28 0.752 20.318 15.468 1.00 51.53 C ATOM 264 CD ARG A 28 1.427 20.348 14.105 1.00 11.23 C ATOM 265 NE ARG A 28 2.878 20.219 14.210 1.00 32.24 N ATOM 266 CZ ARG A 28 3.686 21.229 14.510 1.00 11.45 C ATOM 267 NH1 ARG A 28 3.187 22.437 14.734 1.00 2.35 N ATOM 268 NH2 ARG A 28 4.996 21.033 14.588 1.00 71.44 N ATOM 0 H ARG A 28 -2.233 19.453 14.899 1.00 64.34 H new ATOM 0 HA ARG A 28 -1.255 18.163 17.204 1.00 34.41 H new ATOM 0 HB2 ARG A 28 0.765 18.282 16.124 1.00 1.11 H new ATOM 0 HB3 ARG A 28 -0.288 18.589 14.757 1.00 1.11 H new ATOM 0 HG2 ARG A 28 0.030 21.132 15.536 1.00 51.53 H new ATOM 0 HG3 ARG A 28 1.496 20.486 16.247 1.00 51.53 H new ATOM 0 HD2 ARG A 28 1.035 19.539 13.488 1.00 11.23 H new ATOM 0 HD3 ARG A 28 1.182 21.282 13.599 1.00 11.23 H new ATOM 0 HE ARG A 28 3.294 19.302 14.044 1.00 32.24 H new ATOM 0 HH11 ARG A 28 2.180 22.592 14.676 1.00 2.35 H new ATOM 0 HH12 ARG A 28 3.810 23.211 14.964 1.00 2.35 H new ATOM 0 HH21 ARG A 28 5.384 20.105 14.417 1.00 71.44 H new ATOM 0 HH22 ARG A 28 5.615 21.810 14.819 1.00 71.44 H new ATOM 282 N HIS A 29 -1.484 21.391 17.380 1.00 52.53 N ATOM 283 CA HIS A 29 -1.340 22.546 18.260 1.00 61.24 C ATOM 284 C HIS A 29 -2.544 22.676 19.187 1.00 33.11 C ATOM 285 O HIS A 29 -2.781 23.734 19.771 1.00 63.14 O ATOM 286 CB HIS A 29 -1.175 23.824 17.436 1.00 20.45 C ATOM 287 CG HIS A 29 -0.551 24.951 18.199 1.00 4.24 C ATOM 288 ND1 HIS A 29 0.654 24.836 18.861 1.00 13.31 N ATOM 289 CD2 HIS A 29 -0.970 26.222 18.402 1.00 1.12 C ATOM 290 CE1 HIS A 29 0.947 25.987 19.439 1.00 3.14 C ATOM 291 NE2 HIS A 29 -0.022 26.845 19.176 1.00 43.12 N ATOM 0 H HIS A 29 -2.048 21.563 16.547 1.00 52.53 H new ATOM 0 HA HIS A 29 -0.449 22.398 18.870 1.00 61.24 H new ATOM 0 HB2 HIS A 29 -0.563 23.606 16.561 1.00 20.45 H new ATOM 0 HB3 HIS A 29 -2.152 24.140 17.071 1.00 20.45 H new ATOM 0 HD2 HIS A 29 -1.881 26.664 18.025 1.00 1.12 H new ATOM 0 HE1 HIS A 29 1.829 26.192 20.027 1.00 3.14 H new ATOM 0 HE2 HIS A 29 -0.060 27.813 19.496 1.00 43.12 H new ATOM 299 N LYS A 30 -3.304 21.593 19.318 1.00 42.50 N ATOM 300 CA LYS A 30 -4.484 21.585 20.174 1.00 2.23 C ATOM 301 C LYS A 30 -5.517 22.596 19.687 1.00 72.44 C ATOM 302 O LYS A 30 -6.066 23.367 20.473 1.00 1.44 O ATOM 303 CB LYS A 30 -4.092 21.898 21.620 1.00 31.13 C ATOM 304 CG LYS A 30 -2.858 21.149 22.092 1.00 44.14 C ATOM 305 CD LYS A 30 -2.442 21.582 23.488 1.00 72.43 C ATOM 306 CE LYS A 30 -1.626 22.865 23.454 1.00 33.20 C ATOM 307 NZ LYS A 30 -0.167 22.591 23.335 1.00 53.52 N ATOM 0 H LYS A 30 -3.123 20.709 18.842 1.00 42.50 H new ATOM 0 HA LYS A 30 -4.927 20.590 20.130 1.00 2.23 H new ATOM 0 HB2 LYS A 30 -3.915 22.969 21.716 1.00 31.13 H new ATOM 0 HB3 LYS A 30 -4.928 21.653 22.275 1.00 31.13 H new ATOM 0 HG2 LYS A 30 -3.058 20.077 22.087 1.00 44.14 H new ATOM 0 HG3 LYS A 30 -2.037 21.324 21.396 1.00 44.14 H new ATOM 0 HD2 LYS A 30 -3.329 21.730 24.104 1.00 72.43 H new ATOM 0 HD3 LYS A 30 -1.858 20.790 23.957 1.00 72.43 H new ATOM 0 HE2 LYS A 30 -1.950 23.479 22.614 1.00 33.20 H new ATOM 0 HE3 LYS A 30 -1.815 23.440 24.361 1.00 33.20 H new ATOM 0 HZ1 LYS A 30 0.355 23.490 23.315 1.00 53.52 H new ATOM 0 HZ2 LYS A 30 0.148 22.026 24.150 1.00 53.52 H new ATOM 0 HZ3 LYS A 30 0.017 22.065 22.457 1.00 53.52 H new ATOM 321 N LYS A 31 -5.780 22.585 18.384 1.00 25.21 N ATOM 322 CA LYS A 31 -6.749 23.498 17.791 1.00 72.12 C ATOM 323 C LYS A 31 -8.142 23.262 18.367 1.00 3.31 C ATOM 324 O LYS A 31 -8.934 24.195 18.503 1.00 64.02 O ATOM 325 CB LYS A 31 -6.779 23.326 16.270 1.00 30.55 C ATOM 326 CG LYS A 31 -7.262 21.957 15.823 1.00 75.02 C ATOM 327 CD LYS A 31 -8.647 22.031 15.201 1.00 30.52 C ATOM 328 CE LYS A 31 -9.217 20.644 14.944 1.00 31.04 C ATOM 329 NZ LYS A 31 -10.698 20.673 14.793 1.00 72.43 N ATOM 0 H LYS A 31 -5.335 21.953 17.719 1.00 25.21 H new ATOM 0 HA LYS A 31 -6.444 24.517 18.029 1.00 72.12 H new ATOM 0 HB2 LYS A 31 -7.427 24.089 15.839 1.00 30.55 H new ATOM 0 HB3 LYS A 31 -5.778 23.496 15.873 1.00 30.55 H new ATOM 0 HG2 LYS A 31 -6.560 21.540 15.101 1.00 75.02 H new ATOM 0 HG3 LYS A 31 -7.281 21.280 16.677 1.00 75.02 H new ATOM 0 HD2 LYS A 31 -9.315 22.583 15.862 1.00 30.52 H new ATOM 0 HD3 LYS A 31 -8.597 22.585 14.263 1.00 30.52 H new ATOM 0 HE2 LYS A 31 -8.768 20.228 14.042 1.00 31.04 H new ATOM 0 HE3 LYS A 31 -8.949 19.983 15.768 1.00 31.04 H new ATOM 0 HZ1 LYS A 31 -11.113 19.857 15.287 1.00 72.43 H new ATOM 0 HZ2 LYS A 31 -11.072 21.553 15.203 1.00 72.43 H new ATOM 0 HZ3 LYS A 31 -10.945 20.629 13.784 1.00 72.43 H new ATOM 343 N SER A 32 -8.433 22.010 18.706 1.00 51.52 N ATOM 344 CA SER A 32 -9.731 21.652 19.266 1.00 52.55 C ATOM 345 C SER A 32 -9.631 20.377 20.097 1.00 52.12 C ATOM 346 O SER A 32 -9.469 20.429 21.316 1.00 30.01 O ATOM 347 CB SER A 32 -10.759 21.467 18.147 1.00 23.34 C ATOM 348 OG SER A 32 -11.673 22.549 18.110 1.00 31.42 O ATOM 0 H SER A 32 -7.788 21.227 18.603 1.00 51.52 H new ATOM 0 HA SER A 32 -10.055 22.464 19.917 1.00 52.55 H new ATOM 0 HB2 SER A 32 -10.247 21.387 17.188 1.00 23.34 H new ATOM 0 HB3 SER A 32 -11.301 20.534 18.298 1.00 23.34 H new ATOM 0 HG SER A 32 -12.318 22.408 17.386 1.00 31.42 H new ATOM 354 N ARG A 33 -9.729 19.233 19.428 1.00 72.03 N ATOM 355 CA ARG A 33 -9.651 17.944 20.104 1.00 73.44 C ATOM 356 C ARG A 33 -9.135 16.864 19.157 1.00 21.10 C ATOM 357 O ARG A 33 -7.997 16.410 19.279 1.00 61.23 O ATOM 358 CB ARG A 33 -11.024 17.545 20.648 1.00 13.30 C ATOM 359 CG ARG A 33 -11.009 16.260 21.459 1.00 64.22 C ATOM 360 CD ARG A 33 -10.750 16.534 22.932 1.00 34.52 C ATOM 361 NE ARG A 33 -9.363 16.916 23.183 1.00 55.41 N ATOM 362 CZ ARG A 33 -8.961 17.541 24.284 1.00 52.32 C ATOM 363 NH1 ARG A 33 -9.835 17.852 25.231 1.00 75.20 N ATOM 364 NH2 ARG A 33 -7.682 17.857 24.439 1.00 24.53 N ATOM 0 H ARG A 33 -9.863 19.173 18.419 1.00 72.03 H new ATOM 0 HA ARG A 33 -8.952 18.040 20.935 1.00 73.44 H new ATOM 0 HB2 ARG A 33 -11.407 18.353 21.271 1.00 13.30 H new ATOM 0 HB3 ARG A 33 -11.716 17.430 19.814 1.00 13.30 H new ATOM 0 HG2 ARG A 33 -11.963 15.746 21.346 1.00 64.22 H new ATOM 0 HG3 ARG A 33 -10.239 15.593 21.071 1.00 64.22 H new ATOM 0 HD2 ARG A 33 -11.412 17.329 23.275 1.00 34.52 H new ATOM 0 HD3 ARG A 33 -10.992 15.645 23.514 1.00 34.52 H new ATOM 0 HE ARG A 33 -8.665 16.691 22.474 1.00 55.41 H new ATOM 0 HH11 ARG A 33 -10.819 17.611 25.115 1.00 75.20 H new ATOM 0 HH12 ARG A 33 -9.523 18.332 26.075 1.00 75.20 H new ATOM 0 HH21 ARG A 33 -7.006 17.620 23.712 1.00 24.53 H new ATOM 0 HH22 ARG A 33 -7.374 18.337 25.285 1.00 24.53 H new ATOM 378 N TYR A 34 -9.979 16.457 18.215 1.00 2.33 N ATOM 379 CA TYR A 34 -9.609 15.429 17.250 1.00 51.11 C ATOM 380 C TYR A 34 -10.230 15.714 15.886 1.00 72.02 C ATOM 381 O TYR A 34 -11.251 16.395 15.785 1.00 4.31 O ATOM 382 CB TYR A 34 -10.051 14.051 17.746 1.00 11.42 C ATOM 383 CG TYR A 34 -11.552 13.889 17.824 1.00 33.14 C ATOM 384 CD1 TYR A 34 -12.298 13.585 16.692 1.00 63.12 C ATOM 385 CD2 TYR A 34 -12.225 14.040 19.030 1.00 15.23 C ATOM 386 CE1 TYR A 34 -13.670 13.436 16.758 1.00 5.22 C ATOM 387 CE2 TYR A 34 -13.597 13.892 19.106 1.00 22.24 C ATOM 388 CZ TYR A 34 -14.314 13.590 17.968 1.00 54.13 C ATOM 389 OH TYR A 34 -15.681 13.443 18.039 1.00 23.11 O ATOM 0 H TYR A 34 -10.924 16.823 18.099 1.00 2.33 H new ATOM 0 HA TYR A 34 -8.524 15.439 17.145 1.00 51.11 H new ATOM 0 HB2 TYR A 34 -9.646 13.288 17.082 1.00 11.42 H new ATOM 0 HB3 TYR A 34 -9.623 13.875 18.733 1.00 11.42 H new ATOM 0 HD1 TYR A 34 -11.796 13.463 15.743 1.00 63.12 H new ATOM 0 HD2 TYR A 34 -11.666 14.277 19.923 1.00 15.23 H new ATOM 0 HE1 TYR A 34 -14.235 13.200 15.868 1.00 5.22 H new ATOM 0 HE2 TYR A 34 -14.105 14.012 20.052 1.00 22.24 H new ATOM 0 HH TYR A 34 -15.940 13.233 18.961 1.00 23.11 H new ATOM 399 N VAL A 35 -9.607 15.186 14.837 1.00 4.31 N ATOM 400 CA VAL A 35 -10.097 15.381 13.478 1.00 15.11 C ATOM 401 C VAL A 35 -10.271 14.048 12.760 1.00 61.41 C ATOM 402 O VAL A 35 -9.332 13.257 12.663 1.00 61.14 O ATOM 403 CB VAL A 35 -9.145 16.272 12.660 1.00 45.44 C ATOM 404 CG1 VAL A 35 -9.109 17.682 13.231 1.00 60.25 C ATOM 405 CG2 VAL A 35 -7.749 15.668 12.624 1.00 72.54 C ATOM 0 H VAL A 35 -8.761 14.620 14.903 1.00 4.31 H new ATOM 0 HA VAL A 35 -11.065 15.876 13.559 1.00 15.11 H new ATOM 0 HB VAL A 35 -9.519 16.329 11.638 1.00 45.44 H new ATOM 0 HG11 VAL A 35 -8.431 18.297 12.639 1.00 60.25 H new ATOM 0 HG12 VAL A 35 -10.110 18.113 13.200 1.00 60.25 H new ATOM 0 HG13 VAL A 35 -8.761 17.648 14.263 1.00 60.25 H new ATOM 0 HG21 VAL A 35 -7.089 16.311 12.042 1.00 72.54 H new ATOM 0 HG22 VAL A 35 -7.365 15.579 13.640 1.00 72.54 H new ATOM 0 HG23 VAL A 35 -7.792 14.680 12.165 1.00 72.54 H new ATOM 415 N ILE A 36 -11.477 13.805 12.258 1.00 30.42 N ATOM 416 CA ILE A 36 -11.773 12.567 11.547 1.00 1.12 C ATOM 417 C ILE A 36 -11.987 12.825 10.060 1.00 44.44 C ATOM 418 O ILE A 36 -12.831 13.633 9.675 1.00 53.42 O ATOM 419 CB ILE A 36 -13.022 11.873 12.121 1.00 54.21 C ATOM 420 CG1 ILE A 36 -12.947 11.820 13.648 1.00 22.51 C ATOM 421 CG2 ILE A 36 -13.163 10.473 11.543 1.00 52.14 C ATOM 422 CD1 ILE A 36 -14.138 11.142 14.289 1.00 61.13 C ATOM 0 H ILE A 36 -12.265 14.449 12.330 1.00 30.42 H new ATOM 0 HA ILE A 36 -10.911 11.913 11.680 1.00 1.12 H new ATOM 0 HB ILE A 36 -13.902 12.451 11.840 1.00 54.21 H new ATOM 0 HG12 ILE A 36 -12.039 11.294 13.941 1.00 22.51 H new ATOM 0 HG13 ILE A 36 -12.866 12.836 14.035 1.00 22.51 H new ATOM 0 HG21 ILE A 36 -14.050 9.996 11.958 1.00 52.14 H new ATOM 0 HG22 ILE A 36 -13.258 10.535 10.459 1.00 52.14 H new ATOM 0 HG23 ILE A 36 -12.282 9.884 11.797 1.00 52.14 H new ATOM 0 HD11 ILE A 36 -14.017 11.141 15.372 1.00 61.13 H new ATOM 0 HD12 ILE A 36 -15.048 11.681 14.026 1.00 61.13 H new ATOM 0 HD13 ILE A 36 -14.208 10.115 13.931 1.00 61.13 H new ATOM 434 N MET A 37 -11.216 12.132 9.228 1.00 53.24 N ATOM 435 CA MET A 37 -11.324 12.284 7.781 1.00 4.42 C ATOM 436 C MET A 37 -11.514 10.931 7.105 1.00 62.43 C ATOM 437 O MET A 37 -11.129 9.894 7.648 1.00 54.50 O ATOM 438 CB MET A 37 -10.076 12.975 7.226 1.00 74.43 C ATOM 439 CG MET A 37 -8.776 12.311 7.648 1.00 64.33 C ATOM 440 SD MET A 37 -7.860 13.284 8.859 1.00 73.32 S ATOM 441 CE MET A 37 -6.233 12.546 8.726 1.00 54.45 C ATOM 0 H MET A 37 -10.510 11.460 9.530 1.00 53.24 H new ATOM 0 HA MET A 37 -12.197 12.901 7.569 1.00 4.42 H new ATOM 0 HB2 MET A 37 -10.131 12.988 6.137 1.00 74.43 H new ATOM 0 HB3 MET A 37 -10.068 14.014 7.557 1.00 74.43 H new ATOM 0 HG2 MET A 37 -8.994 11.328 8.067 1.00 64.33 H new ATOM 0 HG3 MET A 37 -8.152 12.152 6.769 1.00 64.33 H new ATOM 0 HE1 MET A 37 -5.934 12.148 9.696 1.00 54.45 H new ATOM 0 HE2 MET A 37 -6.258 11.738 7.994 1.00 54.45 H new ATOM 0 HE3 MET A 37 -5.516 13.302 8.407 1.00 54.45 H new ATOM 451 N HIS A 38 -12.110 10.946 5.916 1.00 5.24 N ATOM 452 CA HIS A 38 -12.350 9.719 5.166 1.00 53.03 C ATOM 453 C HIS A 38 -12.022 9.912 3.688 1.00 5.45 C ATOM 454 O HIS A 38 -11.820 11.037 3.230 1.00 42.31 O ATOM 455 CB HIS A 38 -13.806 9.277 5.323 1.00 44.43 C ATOM 456 CG HIS A 38 -14.776 10.131 4.565 1.00 64.42 C ATOM 457 ND1 HIS A 38 -14.831 11.502 4.693 1.00 11.51 N ATOM 458 CD2 HIS A 38 -15.730 9.799 3.664 1.00 14.54 C ATOM 459 CE1 HIS A 38 -15.779 11.978 3.906 1.00 53.03 C ATOM 460 NE2 HIS A 38 -16.340 10.965 3.270 1.00 10.00 N ATOM 0 H HIS A 38 -12.435 11.794 5.452 1.00 5.24 H new ATOM 0 HA HIS A 38 -11.697 8.944 5.567 1.00 53.03 H new ATOM 0 HB2 HIS A 38 -13.902 8.245 4.986 1.00 44.43 H new ATOM 0 HB3 HIS A 38 -14.070 9.293 6.380 1.00 44.43 H new ATOM 0 HD2 HIS A 38 -15.967 8.803 3.319 1.00 14.54 H new ATOM 0 HE1 HIS A 38 -16.049 13.018 3.800 1.00 53.03 H new ATOM 0 HE2 HIS A 38 -17.102 11.037 2.596 1.00 10.00 H new ATOM 468 N ILE A 39 -11.969 8.809 2.950 1.00 44.32 N ATOM 469 CA ILE A 39 -11.665 8.858 1.525 1.00 4.41 C ATOM 470 C ILE A 39 -12.924 9.110 0.703 1.00 61.54 C ATOM 471 O ILE A 39 -13.916 8.391 0.831 1.00 45.34 O ATOM 472 CB ILE A 39 -11.003 7.553 1.045 1.00 34.22 C ATOM 473 CG1 ILE A 39 -9.856 7.164 1.979 1.00 23.51 C ATOM 474 CG2 ILE A 39 -10.502 7.707 -0.383 1.00 74.31 C ATOM 475 CD1 ILE A 39 -9.141 5.897 1.562 1.00 4.34 C ATOM 0 H ILE A 39 -12.132 7.871 3.315 1.00 44.32 H new ATOM 0 HA ILE A 39 -10.968 9.683 1.379 1.00 4.41 H new ATOM 0 HB ILE A 39 -11.747 6.757 1.064 1.00 34.22 H new ATOM 0 HG12 ILE A 39 -9.136 7.982 2.018 1.00 23.51 H new ATOM 0 HG13 ILE A 39 -10.247 7.036 2.988 1.00 23.51 H new ATOM 0 HG21 ILE A 39 -10.037 6.776 -0.708 1.00 74.31 H new ATOM 0 HG22 ILE A 39 -11.340 7.942 -1.039 1.00 74.31 H new ATOM 0 HG23 ILE A 39 -9.770 8.513 -0.427 1.00 74.31 H new ATOM 0 HD11 ILE A 39 -8.340 5.682 2.269 1.00 4.34 H new ATOM 0 HD12 ILE A 39 -9.848 5.067 1.551 1.00 4.34 H new ATOM 0 HD13 ILE A 39 -8.720 6.028 0.565 1.00 4.34 H new ATOM 487 N VAL A 40 -12.877 10.133 -0.144 1.00 2.30 N ATOM 488 CA VAL A 40 -14.013 10.478 -0.991 1.00 3.15 C ATOM 489 C VAL A 40 -13.727 10.153 -2.452 1.00 74.34 C ATOM 490 O VAL A 40 -12.697 10.549 -2.997 1.00 61.54 O ATOM 491 CB VAL A 40 -14.371 11.971 -0.869 1.00 3.23 C ATOM 492 CG1 VAL A 40 -15.579 12.303 -1.732 1.00 23.15 C ATOM 493 CG2 VAL A 40 -14.626 12.341 0.585 1.00 63.43 C ATOM 0 H VAL A 40 -12.064 10.738 -0.262 1.00 2.30 H new ATOM 0 HA VAL A 40 -14.857 9.880 -0.647 1.00 3.15 H new ATOM 0 HB VAL A 40 -13.526 12.560 -1.227 1.00 3.23 H new ATOM 0 HG11 VAL A 40 -15.817 13.362 -1.633 1.00 23.15 H new ATOM 0 HG12 VAL A 40 -15.354 12.078 -2.775 1.00 23.15 H new ATOM 0 HG13 VAL A 40 -16.432 11.707 -1.408 1.00 23.15 H new ATOM 0 HG21 VAL A 40 -14.878 13.399 0.652 1.00 63.43 H new ATOM 0 HG22 VAL A 40 -15.453 11.746 0.972 1.00 63.43 H new ATOM 0 HG23 VAL A 40 -13.730 12.143 1.173 1.00 63.43 H new ATOM 503 N ASP A 41 -14.647 9.430 -3.082 1.00 61.20 N ATOM 504 CA ASP A 41 -14.496 9.052 -4.482 1.00 65.14 C ATOM 505 C ASP A 41 -13.267 8.169 -4.677 1.00 42.12 C ATOM 506 O ASP A 41 -12.794 7.987 -5.799 1.00 31.23 O ATOM 507 CB ASP A 41 -14.387 10.299 -5.361 1.00 1.55 C ATOM 508 CG ASP A 41 -14.989 10.093 -6.737 1.00 1.15 C ATOM 509 OD1 ASP A 41 -16.162 9.673 -6.813 1.00 71.34 O ATOM 510 OD2 ASP A 41 -14.287 10.351 -7.737 1.00 5.24 O ATOM 0 H ASP A 41 -15.505 9.094 -2.645 1.00 61.20 H new ATOM 0 HA ASP A 41 -15.379 8.485 -4.777 1.00 65.14 H new ATOM 0 HB2 ASP A 41 -14.890 11.132 -4.869 1.00 1.55 H new ATOM 0 HB3 ASP A 41 -13.338 10.576 -5.465 1.00 1.55 H new ATOM 515 N GLN A 42 -12.755 7.625 -3.578 1.00 0.12 N ATOM 516 CA GLN A 42 -11.580 6.763 -3.629 1.00 11.05 C ATOM 517 C GLN A 42 -10.468 7.406 -4.450 1.00 50.25 C ATOM 518 O GLN A 42 -9.678 6.715 -5.094 1.00 41.32 O ATOM 519 CB GLN A 42 -11.946 5.401 -4.221 1.00 1.10 C ATOM 520 CG GLN A 42 -13.022 4.666 -3.438 1.00 1.11 C ATOM 521 CD GLN A 42 -14.383 4.744 -4.102 1.00 25.41 C ATOM 522 OE1 GLN A 42 -14.567 4.268 -5.222 1.00 73.44 O ATOM 523 NE2 GLN A 42 -15.345 5.345 -3.412 1.00 44.43 N ATOM 0 H GLN A 42 -13.135 7.766 -2.642 1.00 0.12 H new ATOM 0 HA GLN A 42 -11.219 6.623 -2.610 1.00 11.05 H new ATOM 0 HB2 GLN A 42 -12.286 5.540 -5.247 1.00 1.10 H new ATOM 0 HB3 GLN A 42 -11.051 4.780 -4.263 1.00 1.10 H new ATOM 0 HG2 GLN A 42 -12.735 3.620 -3.328 1.00 1.11 H new ATOM 0 HG3 GLN A 42 -13.087 5.086 -2.434 1.00 1.11 H new ATOM 0 HE21 GLN A 42 -15.147 5.725 -2.486 1.00 44.43 H new ATOM 0 HE22 GLN A 42 -16.282 5.426 -3.807 1.00 44.43 H new ATOM 532 N LYS A 43 -10.412 8.733 -4.425 1.00 12.51 N ATOM 533 CA LYS A 43 -9.397 9.471 -5.167 1.00 4.54 C ATOM 534 C LYS A 43 -8.929 10.693 -4.381 1.00 72.41 C ATOM 535 O LYS A 43 -7.738 10.999 -4.343 1.00 43.33 O ATOM 536 CB LYS A 43 -9.945 9.906 -6.527 1.00 40.45 C ATOM 537 CG LYS A 43 -9.441 9.061 -7.685 1.00 11.34 C ATOM 538 CD LYS A 43 -10.421 9.064 -8.846 1.00 13.53 C ATOM 539 CE LYS A 43 -9.837 9.759 -10.066 1.00 53.12 C ATOM 540 NZ LYS A 43 -10.900 10.233 -10.996 1.00 65.32 N ATOM 0 H LYS A 43 -11.059 9.320 -3.898 1.00 12.51 H new ATOM 0 HA LYS A 43 -8.544 8.811 -5.321 1.00 4.54 H new ATOM 0 HB2 LYS A 43 -11.034 9.860 -6.502 1.00 40.45 H new ATOM 0 HB3 LYS A 43 -9.673 10.947 -6.703 1.00 40.45 H new ATOM 0 HG2 LYS A 43 -8.476 9.441 -8.021 1.00 11.34 H new ATOM 0 HG3 LYS A 43 -9.280 8.038 -7.347 1.00 11.34 H new ATOM 0 HD2 LYS A 43 -10.686 8.038 -9.102 1.00 13.53 H new ATOM 0 HD3 LYS A 43 -11.341 9.566 -8.546 1.00 13.53 H new ATOM 0 HE2 LYS A 43 -9.230 10.606 -9.746 1.00 53.12 H new ATOM 0 HE3 LYS A 43 -9.174 9.073 -10.592 1.00 53.12 H new ATOM 0 HZ1 LYS A 43 -10.462 10.701 -11.815 1.00 65.32 H new ATOM 0 HZ2 LYS A 43 -11.463 9.422 -11.322 1.00 65.32 H new ATOM 0 HZ3 LYS A 43 -11.518 10.908 -10.502 1.00 65.32 H new ATOM 554 N SER A 44 -9.875 11.385 -3.754 1.00 40.13 N ATOM 555 CA SER A 44 -9.560 12.574 -2.971 1.00 42.24 C ATOM 556 C SER A 44 -10.089 12.442 -1.546 1.00 44.23 C ATOM 557 O SER A 44 -11.269 12.163 -1.334 1.00 51.52 O ATOM 558 CB SER A 44 -10.153 13.819 -3.634 1.00 43.02 C ATOM 559 OG SER A 44 -9.180 14.841 -3.762 1.00 44.13 O ATOM 0 H SER A 44 -10.866 11.143 -3.773 1.00 40.13 H new ATOM 0 HA SER A 44 -8.475 12.675 -2.930 1.00 42.24 H new ATOM 0 HB2 SER A 44 -10.544 13.560 -4.618 1.00 43.02 H new ATOM 0 HB3 SER A 44 -10.993 14.184 -3.043 1.00 43.02 H new ATOM 0 HG SER A 44 -9.583 15.625 -4.190 1.00 44.13 H new ATOM 565 N ILE A 45 -9.206 12.644 -0.574 1.00 13.43 N ATOM 566 CA ILE A 45 -9.583 12.549 0.831 1.00 15.31 C ATOM 567 C ILE A 45 -10.262 13.830 1.306 1.00 21.20 C ATOM 568 O ILE A 45 -9.763 14.931 1.076 1.00 63.20 O ATOM 569 CB ILE A 45 -8.361 12.268 1.724 1.00 30.44 C ATOM 570 CG1 ILE A 45 -7.666 10.978 1.283 1.00 20.13 C ATOM 571 CG2 ILE A 45 -8.781 12.177 3.184 1.00 72.22 C ATOM 572 CD1 ILE A 45 -6.364 10.715 2.007 1.00 41.21 C ATOM 0 H ILE A 45 -8.225 12.874 -0.733 1.00 13.43 H new ATOM 0 HA ILE A 45 -10.282 11.717 0.914 1.00 15.31 H new ATOM 0 HB ILE A 45 -7.656 13.093 1.620 1.00 30.44 H new ATOM 0 HG12 ILE A 45 -8.340 10.137 1.447 1.00 20.13 H new ATOM 0 HG13 ILE A 45 -7.473 11.027 0.211 1.00 20.13 H new ATOM 0 HG21 ILE A 45 -7.906 11.978 3.803 1.00 72.22 H new ATOM 0 HG22 ILE A 45 -9.236 13.119 3.491 1.00 72.22 H new ATOM 0 HG23 ILE A 45 -9.502 11.369 3.305 1.00 72.22 H new ATOM 0 HD11 ILE A 45 -5.927 9.785 1.644 1.00 41.21 H new ATOM 0 HD12 ILE A 45 -5.672 11.537 1.822 1.00 41.21 H new ATOM 0 HD13 ILE A 45 -6.553 10.634 3.077 1.00 41.21 H new ATOM 584 N ALA A 46 -11.402 13.677 1.972 1.00 50.04 N ATOM 585 CA ALA A 46 -12.147 14.821 2.483 1.00 72.31 C ATOM 586 C ALA A 46 -12.578 14.594 3.928 1.00 24.21 C ATOM 587 O ALA A 46 -12.641 13.457 4.397 1.00 43.14 O ATOM 588 CB ALA A 46 -13.360 15.095 1.606 1.00 41.11 C ATOM 0 H ALA A 46 -11.829 12.772 2.170 1.00 50.04 H new ATOM 0 HA ALA A 46 -11.491 15.691 2.459 1.00 72.31 H new ATOM 0 HB1 ALA A 46 -13.907 15.952 1.999 1.00 41.11 H new ATOM 0 HB2 ALA A 46 -13.033 15.309 0.589 1.00 41.11 H new ATOM 0 HB3 ALA A 46 -14.010 14.220 1.601 1.00 41.11 H new ATOM 594 N VAL A 47 -12.872 15.683 4.631 1.00 52.01 N ATOM 595 CA VAL A 47 -13.297 15.603 6.023 1.00 31.43 C ATOM 596 C VAL A 47 -14.753 15.164 6.129 1.00 15.41 C ATOM 597 O VAL A 47 -15.606 15.613 5.363 1.00 50.53 O ATOM 598 CB VAL A 47 -13.126 16.954 6.741 1.00 2.53 C ATOM 599 CG1 VAL A 47 -11.652 17.309 6.868 1.00 30.23 C ATOM 600 CG2 VAL A 47 -13.884 18.048 6.005 1.00 50.43 C ATOM 0 H VAL A 47 -12.824 16.631 4.259 1.00 52.01 H new ATOM 0 HA VAL A 47 -12.661 14.861 6.505 1.00 31.43 H new ATOM 0 HB VAL A 47 -13.542 16.867 7.745 1.00 2.53 H new ATOM 0 HG11 VAL A 47 -11.551 18.267 7.378 1.00 30.23 H new ATOM 0 HG12 VAL A 47 -11.140 16.537 7.442 1.00 30.23 H new ATOM 0 HG13 VAL A 47 -11.208 17.378 5.875 1.00 30.23 H new ATOM 0 HG21 VAL A 47 -13.752 18.996 6.526 1.00 50.43 H new ATOM 0 HG22 VAL A 47 -13.500 18.136 4.989 1.00 50.43 H new ATOM 0 HG23 VAL A 47 -14.944 17.797 5.972 1.00 50.43 H new ATOM 610 N LYS A 48 -15.033 14.284 7.085 1.00 42.44 N ATOM 611 CA LYS A 48 -16.387 13.785 7.294 1.00 43.33 C ATOM 612 C LYS A 48 -17.011 14.410 8.537 1.00 11.31 C ATOM 613 O LYS A 48 -18.169 14.828 8.520 1.00 14.52 O ATOM 614 CB LYS A 48 -16.375 12.261 7.427 1.00 34.21 C ATOM 615 CG LYS A 48 -17.458 11.571 6.615 1.00 11.12 C ATOM 616 CD LYS A 48 -18.488 10.905 7.512 1.00 70.54 C ATOM 617 CE LYS A 48 -19.860 10.872 6.856 1.00 70.22 C ATOM 618 NZ LYS A 48 -20.196 9.516 6.340 1.00 32.23 N ATOM 0 H LYS A 48 -14.339 13.902 7.728 1.00 42.44 H new ATOM 0 HA LYS A 48 -16.988 14.063 6.429 1.00 43.33 H new ATOM 0 HB2 LYS A 48 -15.402 11.885 7.112 1.00 34.21 H new ATOM 0 HB3 LYS A 48 -16.495 11.995 8.477 1.00 34.21 H new ATOM 0 HG2 LYS A 48 -17.951 12.299 5.971 1.00 11.12 H new ATOM 0 HG3 LYS A 48 -17.005 10.824 5.963 1.00 11.12 H new ATOM 0 HD2 LYS A 48 -18.169 9.888 7.742 1.00 70.54 H new ATOM 0 HD3 LYS A 48 -18.549 11.442 8.459 1.00 70.54 H new ATOM 0 HE2 LYS A 48 -20.615 11.183 7.578 1.00 70.22 H new ATOM 0 HE3 LYS A 48 -19.888 11.590 6.036 1.00 70.22 H new ATOM 0 HZ1 LYS A 48 -21.138 9.535 5.901 1.00 32.23 H new ATOM 0 HZ2 LYS A 48 -19.490 9.229 5.632 1.00 32.23 H new ATOM 0 HZ3 LYS A 48 -20.195 8.835 7.126 1.00 32.23 H new ATOM 632 N THR A 49 -16.236 14.473 9.616 1.00 71.44 N ATOM 633 CA THR A 49 -16.713 15.047 10.867 1.00 21.13 C ATOM 634 C THR A 49 -15.550 15.418 11.780 1.00 1.31 C ATOM 635 O THR A 49 -14.758 14.560 12.173 1.00 55.44 O ATOM 636 CB THR A 49 -17.645 14.074 11.613 1.00 73.52 C ATOM 637 OG1 THR A 49 -18.807 13.804 10.820 1.00 10.02 O ATOM 638 CG2 THR A 49 -18.065 14.649 12.957 1.00 24.43 C ATOM 0 H THR A 49 -15.275 14.133 9.648 1.00 71.44 H new ATOM 0 HA THR A 49 -17.271 15.947 10.609 1.00 21.13 H new ATOM 0 HB THR A 49 -17.100 13.146 11.787 1.00 73.52 H new ATOM 0 HG1 THR A 49 -18.857 14.448 10.083 1.00 10.02 H new ATOM 0 HG21 THR A 49 -18.723 13.944 13.465 1.00 24.43 H new ATOM 0 HG22 THR A 49 -17.181 14.826 13.569 1.00 24.43 H new ATOM 0 HG23 THR A 49 -18.593 15.590 12.801 1.00 24.43 H new ATOM 646 N ILE A 50 -15.453 16.700 12.115 1.00 43.41 N ATOM 647 CA ILE A 50 -14.387 17.184 12.983 1.00 23.15 C ATOM 648 C ILE A 50 -14.891 17.395 14.407 1.00 2.11 C ATOM 649 O ILE A 50 -16.051 17.745 14.621 1.00 43.14 O ATOM 650 CB ILE A 50 -13.790 18.504 12.461 1.00 10.11 C ATOM 651 CG1 ILE A 50 -14.904 19.511 12.165 1.00 23.33 C ATOM 652 CG2 ILE A 50 -12.953 18.251 11.216 1.00 0.01 C ATOM 653 CD1 ILE A 50 -14.393 20.880 11.775 1.00 63.24 C ATOM 0 H ILE A 50 -16.100 17.422 11.798 1.00 43.41 H new ATOM 0 HA ILE A 50 -13.610 16.419 12.984 1.00 23.15 H new ATOM 0 HB ILE A 50 -13.143 18.923 13.231 1.00 10.11 H new ATOM 0 HG12 ILE A 50 -15.529 19.123 11.361 1.00 23.33 H new ATOM 0 HG13 ILE A 50 -15.540 19.607 13.045 1.00 23.33 H new ATOM 0 HG21 ILE A 50 -12.538 19.193 10.859 1.00 0.01 H new ATOM 0 HG22 ILE A 50 -12.141 17.565 11.457 1.00 0.01 H new ATOM 0 HG23 ILE A 50 -13.580 17.813 10.439 1.00 0.01 H new ATOM 0 HD11 ILE A 50 -15.237 21.541 11.580 1.00 63.24 H new ATOM 0 HD12 ILE A 50 -13.792 21.289 12.587 1.00 63.24 H new ATOM 0 HD13 ILE A 50 -13.781 20.798 10.877 1.00 63.24 H new ATOM 665 N GLY A 51 -14.009 17.181 15.379 1.00 12.23 N ATOM 666 CA GLY A 51 -14.383 17.355 16.771 1.00 62.42 C ATOM 667 C GLY A 51 -13.830 18.635 17.364 1.00 24.04 C ATOM 668 O GLY A 51 -12.654 18.952 17.184 1.00 15.43 O ATOM 0 H GLY A 51 -13.043 16.891 15.228 1.00 12.23 H new ATOM 0 HA2 GLY A 51 -15.470 17.360 16.854 1.00 62.42 H new ATOM 0 HA3 GLY A 51 -14.023 16.505 17.350 1.00 62.42 H new ATOM 672 N GLU A 52 -14.679 19.373 18.073 1.00 71.44 N ATOM 673 CA GLU A 52 -14.268 20.627 18.692 1.00 21.00 C ATOM 674 C GLU A 52 -14.488 20.586 20.202 1.00 43.15 C ATOM 675 O GLU A 52 -15.013 21.532 20.789 1.00 74.13 O ATOM 676 CB GLU A 52 -15.041 21.799 18.085 1.00 54.15 C ATOM 677 CG GLU A 52 -15.124 21.753 16.568 1.00 35.10 C ATOM 678 CD GLU A 52 -15.723 23.015 15.978 1.00 73.22 C ATOM 679 OE1 GLU A 52 -16.556 23.651 16.657 1.00 73.43 O ATOM 680 OE2 GLU A 52 -15.358 23.366 14.836 1.00 11.33 O ATOM 0 H GLU A 52 -15.655 19.124 18.233 1.00 71.44 H new ATOM 0 HA GLU A 52 -13.204 20.765 18.500 1.00 21.00 H new ATOM 0 HB2 GLU A 52 -16.051 21.809 18.496 1.00 54.15 H new ATOM 0 HB3 GLU A 52 -14.565 22.732 18.386 1.00 54.15 H new ATOM 0 HG2 GLU A 52 -14.125 21.603 16.158 1.00 35.10 H new ATOM 0 HG3 GLU A 52 -15.725 20.895 16.267 1.00 35.10 H new ATOM 687 N ARG A 53 -14.082 19.484 20.823 1.00 62.30 N ATOM 688 CA ARG A 53 -14.236 19.318 22.263 1.00 24.03 C ATOM 689 C ARG A 53 -15.710 19.316 22.656 1.00 72.11 C ATOM 690 O ARG A 53 -16.052 19.487 23.825 1.00 0.12 O ATOM 691 CB ARG A 53 -13.500 20.434 23.008 1.00 71.41 C ATOM 692 CG ARG A 53 -12.106 20.709 22.469 1.00 3.03 C ATOM 693 CD ARG A 53 -11.454 21.882 23.185 1.00 41.15 C ATOM 694 NE ARG A 53 -11.629 23.134 22.454 1.00 13.51 N ATOM 695 CZ ARG A 53 -11.100 24.290 22.839 1.00 13.45 C ATOM 696 NH1 ARG A 53 -10.366 24.352 23.942 1.00 50.43 N ATOM 697 NH2 ARG A 53 -11.305 25.387 22.121 1.00 1.35 N ATOM 0 H ARG A 53 -13.644 18.693 20.352 1.00 62.30 H new ATOM 0 HA ARG A 53 -13.803 18.357 22.541 1.00 24.03 H new ATOM 0 HB2 ARG A 53 -14.090 21.349 22.950 1.00 71.41 H new ATOM 0 HB3 ARG A 53 -13.427 20.169 24.063 1.00 71.41 H new ATOM 0 HG2 ARG A 53 -11.487 19.820 22.587 1.00 3.03 H new ATOM 0 HG3 ARG A 53 -12.162 20.919 21.401 1.00 3.03 H new ATOM 0 HD2 ARG A 53 -11.882 21.981 24.182 1.00 41.15 H new ATOM 0 HD3 ARG A 53 -10.390 21.683 23.313 1.00 41.15 H new ATOM 0 HE ARG A 53 -12.188 23.120 21.601 1.00 13.51 H new ATOM 0 HH11 ARG A 53 -10.207 23.511 24.497 1.00 50.43 H new ATOM 0 HH12 ARG A 53 -9.961 25.241 24.236 1.00 50.43 H new ATOM 0 HH21 ARG A 53 -11.869 25.343 21.272 1.00 1.35 H new ATOM 0 HH22 ARG A 53 -10.898 26.274 22.418 1.00 1.35 H new ATOM 711 N GLY A 54 -16.580 19.121 21.669 1.00 1.31 N ATOM 712 CA GLY A 54 -18.007 19.101 21.931 1.00 11.44 C ATOM 713 C GLY A 54 -18.720 17.997 21.176 1.00 10.15 C ATOM 714 O GLY A 54 -19.948 17.915 21.197 1.00 63.23 O ATOM 0 H GLY A 54 -16.322 18.977 20.693 1.00 1.31 H new ATOM 0 HA2 GLY A 54 -18.175 18.973 23.000 1.00 11.44 H new ATOM 0 HA3 GLY A 54 -18.438 20.063 21.654 1.00 11.44 H new ATOM 718 N ALA A 55 -17.949 17.147 20.507 1.00 23.31 N ATOM 719 CA ALA A 55 -18.514 16.042 19.743 1.00 70.05 C ATOM 720 C ALA A 55 -18.914 14.889 20.657 1.00 13.42 C ATOM 721 O ALA A 55 -18.062 14.239 21.260 1.00 31.42 O ATOM 722 CB ALA A 55 -17.522 15.565 18.692 1.00 21.23 C ATOM 0 H ALA A 55 -16.931 17.202 20.479 1.00 23.31 H new ATOM 0 HA ALA A 55 -19.413 16.402 19.242 1.00 70.05 H new ATOM 0 HB1 ALA A 55 -17.957 14.739 18.129 1.00 21.23 H new ATOM 0 HB2 ALA A 55 -17.289 16.385 18.012 1.00 21.23 H new ATOM 0 HB3 ALA A 55 -16.608 15.229 19.181 1.00 21.23 H new ATOM 728 N ASN A 56 -20.217 14.643 20.756 1.00 44.21 N ATOM 729 CA ASN A 56 -20.730 13.569 21.599 1.00 43.23 C ATOM 730 C ASN A 56 -20.416 12.205 20.993 1.00 65.23 C ATOM 731 O ASN A 56 -20.073 12.101 19.815 1.00 63.32 O ATOM 732 CB ASN A 56 -22.240 13.720 21.789 1.00 74.51 C ATOM 733 CG ASN A 56 -22.607 14.135 23.201 1.00 41.14 C ATOM 734 OD1 ASN A 56 -22.372 15.274 23.605 1.00 21.21 O ATOM 735 ND2 ASN A 56 -23.186 13.210 23.958 1.00 43.41 N ATOM 0 H ASN A 56 -20.936 15.173 20.263 1.00 44.21 H new ATOM 0 HA ASN A 56 -20.240 13.637 22.570 1.00 43.23 H new ATOM 0 HB2 ASN A 56 -22.620 14.461 21.085 1.00 74.51 H new ATOM 0 HB3 ASN A 56 -22.729 12.775 21.552 1.00 74.51 H new ATOM 0 HD21 ASN A 56 -23.455 13.431 24.917 1.00 43.41 H new ATOM 0 HD22 ASN A 56 -23.361 12.279 23.581 1.00 43.41 H new ATOM 742 N PHE A 57 -20.535 11.161 21.806 1.00 74.52 N ATOM 743 CA PHE A 57 -20.264 9.802 21.351 1.00 70.04 C ATOM 744 C PHE A 57 -21.330 9.336 20.364 1.00 74.22 C ATOM 745 O PHE A 57 -21.024 8.691 19.361 1.00 41.24 O ATOM 746 CB PHE A 57 -20.203 8.845 22.543 1.00 62.34 C ATOM 747 CG PHE A 57 -18.916 8.928 23.313 1.00 13.53 C ATOM 748 CD1 PHE A 57 -17.746 8.399 22.793 1.00 32.13 C ATOM 749 CD2 PHE A 57 -18.877 9.537 24.557 1.00 1.23 C ATOM 750 CE1 PHE A 57 -16.561 8.474 23.501 1.00 53.02 C ATOM 751 CE2 PHE A 57 -17.695 9.616 25.269 1.00 23.33 C ATOM 752 CZ PHE A 57 -16.535 9.084 24.740 1.00 52.23 C ATOM 0 H PHE A 57 -20.817 11.230 22.784 1.00 74.52 H new ATOM 0 HA PHE A 57 -19.299 9.801 20.844 1.00 70.04 H new ATOM 0 HB2 PHE A 57 -21.034 9.061 23.215 1.00 62.34 H new ATOM 0 HB3 PHE A 57 -20.339 7.824 22.186 1.00 62.34 H new ATOM 0 HD1 PHE A 57 -17.760 7.923 21.824 1.00 32.13 H new ATOM 0 HD2 PHE A 57 -19.781 9.955 24.975 1.00 1.23 H new ATOM 0 HE1 PHE A 57 -15.656 8.056 23.086 1.00 53.02 H new ATOM 0 HE2 PHE A 57 -17.678 10.093 26.238 1.00 23.33 H new ATOM 0 HZ PHE A 57 -15.610 9.145 25.294 1.00 52.23 H new ATOM 762 N ASP A 58 -22.583 9.666 20.657 1.00 54.15 N ATOM 763 CA ASP A 58 -23.696 9.282 19.796 1.00 53.33 C ATOM 764 C ASP A 58 -23.473 9.771 18.368 1.00 3.21 C ATOM 765 O ASP A 58 -23.651 9.019 17.410 1.00 4.32 O ATOM 766 CB ASP A 58 -25.009 9.846 20.341 1.00 10.45 C ATOM 767 CG ASP A 58 -25.781 8.829 21.159 1.00 40.24 C ATOM 768 OD1 ASP A 58 -25.168 8.183 22.034 1.00 31.41 O ATOM 769 OD2 ASP A 58 -26.998 8.680 20.923 1.00 11.33 O ATOM 0 H ASP A 58 -22.854 10.198 21.484 1.00 54.15 H new ATOM 0 HA ASP A 58 -23.754 8.194 19.784 1.00 53.33 H new ATOM 0 HB2 ASP A 58 -24.798 10.719 20.958 1.00 10.45 H new ATOM 0 HB3 ASP A 58 -25.628 10.185 19.510 1.00 10.45 H new ATOM 774 N GLN A 59 -23.083 11.035 18.235 1.00 60.21 N ATOM 775 CA GLN A 59 -22.837 11.624 16.924 1.00 72.21 C ATOM 776 C GLN A 59 -21.581 11.036 16.290 1.00 4.20 C ATOM 777 O GLN A 59 -21.485 10.920 15.068 1.00 34.21 O ATOM 778 CB GLN A 59 -22.701 13.143 17.041 1.00 21.22 C ATOM 779 CG GLN A 59 -23.864 13.804 17.762 1.00 14.13 C ATOM 780 CD GLN A 59 -23.894 15.307 17.566 1.00 12.12 C ATOM 781 OE1 GLN A 59 -24.872 15.860 17.062 1.00 74.40 O ATOM 782 NE2 GLN A 59 -22.820 15.978 17.965 1.00 62.21 N ATOM 0 H GLN A 59 -22.931 11.670 19.018 1.00 60.21 H new ATOM 0 HA GLN A 59 -23.688 11.391 16.284 1.00 72.21 H new ATOM 0 HB2 GLN A 59 -21.777 13.377 17.569 1.00 21.22 H new ATOM 0 HB3 GLN A 59 -22.614 13.570 16.042 1.00 21.22 H new ATOM 0 HG2 GLN A 59 -24.800 13.376 17.403 1.00 14.13 H new ATOM 0 HG3 GLN A 59 -23.800 13.582 18.827 1.00 14.13 H new ATOM 0 HE21 GLN A 59 -22.031 15.480 18.378 1.00 62.21 H new ATOM 0 HE22 GLN A 59 -22.783 16.992 17.859 1.00 62.21 H new ATOM 791 N PHE A 60 -20.618 10.667 17.129 1.00 41.44 N ATOM 792 CA PHE A 60 -19.366 10.093 16.650 1.00 21.12 C ATOM 793 C PHE A 60 -19.614 8.769 15.932 1.00 11.53 C ATOM 794 O PHE A 60 -19.100 8.539 14.838 1.00 45.24 O ATOM 795 CB PHE A 60 -18.399 9.880 17.817 1.00 72.21 C ATOM 796 CG PHE A 60 -17.174 9.094 17.445 1.00 52.44 C ATOM 797 CD1 PHE A 60 -17.173 7.711 17.518 1.00 74.21 C ATOM 798 CD2 PHE A 60 -16.023 9.740 17.022 1.00 73.21 C ATOM 799 CE1 PHE A 60 -16.048 6.985 17.176 1.00 60.13 C ATOM 800 CE2 PHE A 60 -14.895 9.019 16.678 1.00 12.31 C ATOM 801 CZ PHE A 60 -14.907 7.640 16.756 1.00 10.42 C ATOM 0 H PHE A 60 -20.681 10.755 18.143 1.00 41.44 H new ATOM 0 HA PHE A 60 -18.922 10.792 15.942 1.00 21.12 H new ATOM 0 HB2 PHE A 60 -18.093 10.851 18.207 1.00 72.21 H new ATOM 0 HB3 PHE A 60 -18.922 9.363 18.622 1.00 72.21 H new ATOM 0 HD1 PHE A 60 -18.062 7.194 17.846 1.00 74.21 H new ATOM 0 HD2 PHE A 60 -16.007 10.818 16.961 1.00 73.21 H new ATOM 0 HE1 PHE A 60 -16.061 5.907 17.237 1.00 60.13 H new ATOM 0 HE2 PHE A 60 -14.005 9.534 16.348 1.00 12.31 H new ATOM 0 HZ PHE A 60 -14.026 7.075 16.489 1.00 10.42 H new ATOM 811 N ILE A 61 -20.405 7.904 16.557 1.00 20.31 N ATOM 812 CA ILE A 61 -20.722 6.604 15.978 1.00 21.05 C ATOM 813 C ILE A 61 -21.724 6.740 14.837 1.00 34.15 C ATOM 814 O ILE A 61 -21.657 6.010 13.849 1.00 4.21 O ATOM 815 CB ILE A 61 -21.292 5.641 17.036 1.00 35.22 C ATOM 816 CG1 ILE A 61 -21.556 4.267 16.417 1.00 25.41 C ATOM 817 CG2 ILE A 61 -22.569 6.210 17.637 1.00 2.22 C ATOM 818 CD1 ILE A 61 -20.722 3.160 17.025 1.00 11.42 C ATOM 0 H ILE A 61 -20.838 8.079 17.464 1.00 20.31 H new ATOM 0 HA ILE A 61 -19.789 6.194 15.591 1.00 21.05 H new ATOM 0 HB ILE A 61 -20.558 5.525 17.833 1.00 35.22 H new ATOM 0 HG12 ILE A 61 -22.612 4.022 16.534 1.00 25.41 H new ATOM 0 HG13 ILE A 61 -21.356 4.315 15.347 1.00 25.41 H new ATOM 0 HG21 ILE A 61 -22.960 5.518 18.383 1.00 2.22 H new ATOM 0 HG22 ILE A 61 -22.353 7.169 18.109 1.00 2.22 H new ATOM 0 HG23 ILE A 61 -23.310 6.352 16.850 1.00 2.22 H new ATOM 0 HD11 ILE A 61 -20.961 2.215 16.538 1.00 11.42 H new ATOM 0 HD12 ILE A 61 -19.664 3.383 16.885 1.00 11.42 H new ATOM 0 HD13 ILE A 61 -20.939 3.084 18.091 1.00 11.42 H new ATOM 830 N GLU A 62 -22.653 7.680 14.982 1.00 42.44 N ATOM 831 CA GLU A 62 -23.669 7.912 13.962 1.00 41.43 C ATOM 832 C GLU A 62 -23.029 8.338 12.643 1.00 12.34 C ATOM 833 O GLU A 62 -23.447 7.905 11.570 1.00 11.10 O ATOM 834 CB GLU A 62 -24.658 8.981 14.430 1.00 54.51 C ATOM 835 CG GLU A 62 -25.833 8.422 15.215 1.00 24.13 C ATOM 836 CD GLU A 62 -26.928 7.878 14.319 1.00 61.01 C ATOM 837 OE1 GLU A 62 -26.598 7.185 13.333 1.00 2.34 O ATOM 838 OE2 GLU A 62 -28.114 8.145 14.602 1.00 34.21 O ATOM 0 H GLU A 62 -22.723 8.292 15.795 1.00 42.44 H new ATOM 0 HA GLU A 62 -24.205 6.977 13.800 1.00 41.43 H new ATOM 0 HB2 GLU A 62 -24.130 9.706 15.050 1.00 54.51 H new ATOM 0 HB3 GLU A 62 -25.036 9.520 13.561 1.00 54.51 H new ATOM 0 HG2 GLU A 62 -25.480 7.628 15.874 1.00 24.13 H new ATOM 0 HG3 GLU A 62 -26.245 9.205 15.851 1.00 24.13 H new ATOM 845 N ALA A 63 -22.013 9.190 12.733 1.00 12.35 N ATOM 846 CA ALA A 63 -21.315 9.674 11.549 1.00 4.02 C ATOM 847 C ALA A 63 -20.325 8.635 11.033 1.00 73.14 C ATOM 848 O ALA A 63 -20.334 8.290 9.851 1.00 41.15 O ATOM 849 CB ALA A 63 -20.598 10.981 11.856 1.00 32.21 C ATOM 0 H ALA A 63 -21.655 9.559 13.614 1.00 12.35 H new ATOM 0 HA ALA A 63 -22.055 9.853 10.769 1.00 4.02 H new ATOM 0 HB1 ALA A 63 -20.081 11.331 10.963 1.00 32.21 H new ATOM 0 HB2 ALA A 63 -21.325 11.730 12.171 1.00 32.21 H new ATOM 0 HB3 ALA A 63 -19.874 10.820 12.655 1.00 32.21 H new ATOM 855 N ILE A 64 -19.474 8.140 11.925 1.00 51.31 N ATOM 856 CA ILE A 64 -18.479 7.140 11.558 1.00 11.32 C ATOM 857 C ILE A 64 -19.140 5.814 11.199 1.00 64.32 C ATOM 858 O ILE A 64 -20.009 5.326 11.921 1.00 73.32 O ATOM 859 CB ILE A 64 -17.470 6.906 12.698 1.00 43.24 C ATOM 860 CG1 ILE A 64 -16.746 8.209 13.043 1.00 51.30 C ATOM 861 CG2 ILE A 64 -16.471 5.827 12.307 1.00 30.11 C ATOM 862 CD1 ILE A 64 -15.870 8.728 11.925 1.00 45.42 C ATOM 0 H ILE A 64 -19.453 8.415 12.907 1.00 51.31 H new ATOM 0 HA ILE A 64 -17.948 7.526 10.688 1.00 11.32 H new ATOM 0 HB ILE A 64 -18.013 6.569 13.581 1.00 43.24 H new ATOM 0 HG12 ILE A 64 -17.485 8.969 13.298 1.00 51.30 H new ATOM 0 HG13 ILE A 64 -16.133 8.051 13.930 1.00 51.30 H new ATOM 0 HG21 ILE A 64 -15.764 5.673 13.122 1.00 30.11 H new ATOM 0 HG22 ILE A 64 -17.001 4.896 12.105 1.00 30.11 H new ATOM 0 HG23 ILE A 64 -15.931 6.138 11.413 1.00 30.11 H new ATOM 0 HD11 ILE A 64 -15.388 9.654 12.240 1.00 45.42 H new ATOM 0 HD12 ILE A 64 -15.108 7.986 11.685 1.00 45.42 H new ATOM 0 HD13 ILE A 64 -16.481 8.919 11.043 1.00 45.42 H new ATOM 874 N ASP A 65 -18.720 5.234 10.080 1.00 44.24 N ATOM 875 CA ASP A 65 -19.268 3.962 9.625 1.00 31.31 C ATOM 876 C ASP A 65 -18.176 2.900 9.537 1.00 53.04 C ATOM 877 O ASP A 65 -17.228 3.032 8.762 1.00 33.41 O ATOM 878 CB ASP A 65 -19.944 4.131 8.264 1.00 71.45 C ATOM 879 CG ASP A 65 -21.373 4.622 8.384 1.00 51.43 C ATOM 880 OD1 ASP A 65 -21.855 4.771 9.526 1.00 43.40 O ATOM 881 OD2 ASP A 65 -22.010 4.858 7.335 1.00 32.54 O ATOM 0 H ASP A 65 -18.001 5.625 9.471 1.00 44.24 H new ATOM 0 HA ASP A 65 -20.011 3.634 10.352 1.00 31.31 H new ATOM 0 HB2 ASP A 65 -19.370 4.835 7.662 1.00 71.45 H new ATOM 0 HB3 ASP A 65 -19.934 3.178 7.736 1.00 71.45 H new ATOM 886 N LYS A 66 -18.315 1.848 10.336 1.00 73.32 N ATOM 887 CA LYS A 66 -17.342 0.762 10.349 1.00 42.22 C ATOM 888 C LYS A 66 -17.345 0.013 9.020 1.00 32.54 C ATOM 889 O LYS A 66 -18.086 -0.954 8.845 1.00 65.14 O ATOM 890 CB LYS A 66 -17.643 -0.207 11.494 1.00 11.23 C ATOM 891 CG LYS A 66 -16.762 -1.444 11.491 1.00 35.45 C ATOM 892 CD LYS A 66 -17.186 -2.433 12.565 1.00 54.12 C ATOM 893 CE LYS A 66 -16.877 -3.865 12.157 1.00 75.23 C ATOM 894 NZ LYS A 66 -17.636 -4.272 10.942 1.00 55.23 N ATOM 0 H LYS A 66 -19.093 1.724 10.984 1.00 73.32 H new ATOM 0 HA LYS A 66 -16.353 1.195 10.499 1.00 42.22 H new ATOM 0 HB2 LYS A 66 -17.519 0.315 12.443 1.00 11.23 H new ATOM 0 HB3 LYS A 66 -18.687 -0.515 11.434 1.00 11.23 H new ATOM 0 HG2 LYS A 66 -16.810 -1.924 10.514 1.00 35.45 H new ATOM 0 HG3 LYS A 66 -15.724 -1.153 11.652 1.00 35.45 H new ATOM 0 HD2 LYS A 66 -16.673 -2.201 13.498 1.00 54.12 H new ATOM 0 HD3 LYS A 66 -18.254 -2.330 12.755 1.00 54.12 H new ATOM 0 HE2 LYS A 66 -15.808 -3.966 11.968 1.00 75.23 H new ATOM 0 HE3 LYS A 66 -17.121 -4.538 12.980 1.00 75.23 H new ATOM 0 HZ1 LYS A 66 -17.791 -5.300 10.958 1.00 55.23 H new ATOM 0 HZ2 LYS A 66 -18.554 -3.784 10.926 1.00 55.23 H new ATOM 0 HZ3 LYS A 66 -17.094 -4.017 10.092 1.00 55.23 H new ATOM 908 N ASN A 67 -16.512 0.464 8.089 1.00 44.30 N ATOM 909 CA ASN A 67 -16.418 -0.165 6.777 1.00 53.14 C ATOM 910 C ASN A 67 -15.378 0.537 5.910 1.00 64.05 C ATOM 911 O ASN A 67 -14.281 0.020 5.696 1.00 70.13 O ATOM 912 CB ASN A 67 -17.780 -0.141 6.079 1.00 63.43 C ATOM 913 CG ASN A 67 -17.675 -0.446 4.597 1.00 71.02 C ATOM 914 OD1 ASN A 67 -18.071 0.362 3.756 1.00 21.33 O ATOM 915 ND2 ASN A 67 -17.140 -1.617 4.270 1.00 50.40 N ATOM 0 H ASN A 67 -15.892 1.263 8.219 1.00 44.30 H new ATOM 0 HA ASN A 67 -16.107 -1.200 6.919 1.00 53.14 H new ATOM 0 HB2 ASN A 67 -18.440 -0.869 6.551 1.00 63.43 H new ATOM 0 HB3 ASN A 67 -18.237 0.839 6.214 1.00 63.43 H new ATOM 0 HD21 ASN A 67 -17.044 -1.877 3.289 1.00 50.40 H new ATOM 0 HD22 ASN A 67 -16.825 -2.256 5.000 1.00 50.40 H new ATOM 922 N VAL A 68 -15.729 1.719 5.413 1.00 60.12 N ATOM 923 CA VAL A 68 -14.825 2.493 4.570 1.00 14.34 C ATOM 924 C VAL A 68 -13.586 2.925 5.346 1.00 50.41 C ATOM 925 O VAL A 68 -13.602 3.051 6.571 1.00 61.35 O ATOM 926 CB VAL A 68 -15.522 3.743 4.000 1.00 34.12 C ATOM 927 CG1 VAL A 68 -16.529 3.351 2.930 1.00 53.15 C ATOM 928 CG2 VAL A 68 -16.195 4.532 5.113 1.00 32.24 C ATOM 0 H VAL A 68 -16.633 2.161 5.580 1.00 60.12 H new ATOM 0 HA VAL A 68 -14.527 1.845 3.746 1.00 14.34 H new ATOM 0 HB VAL A 68 -14.767 4.380 3.539 1.00 34.12 H new ATOM 0 HG11 VAL A 68 -17.012 4.247 2.539 1.00 53.15 H new ATOM 0 HG12 VAL A 68 -16.016 2.832 2.120 1.00 53.15 H new ATOM 0 HG13 VAL A 68 -17.282 2.693 3.363 1.00 53.15 H new ATOM 0 HG21 VAL A 68 -16.682 5.412 4.692 1.00 32.24 H new ATOM 0 HG22 VAL A 68 -16.939 3.905 5.605 1.00 32.24 H new ATOM 0 HG23 VAL A 68 -15.447 4.845 5.841 1.00 32.24 H new ATOM 938 N PRO A 69 -12.484 3.160 4.618 1.00 74.14 N ATOM 939 CA PRO A 69 -11.215 3.583 5.216 1.00 1.02 C ATOM 940 C PRO A 69 -11.277 5.006 5.761 1.00 64.02 C ATOM 941 O PRO A 69 -11.511 5.957 5.014 1.00 71.11 O ATOM 942 CB PRO A 69 -10.227 3.499 4.050 1.00 53.33 C ATOM 943 CG PRO A 69 -11.067 3.661 2.830 1.00 51.21 C ATOM 944 CD PRO A 69 -12.393 3.031 3.154 1.00 73.45 C ATOM 0 HA PRO A 69 -10.940 2.964 6.070 1.00 1.02 H new ATOM 0 HB2 PRO A 69 -9.470 4.280 4.116 1.00 53.33 H new ATOM 0 HB3 PRO A 69 -9.701 2.544 4.045 1.00 53.33 H new ATOM 0 HG2 PRO A 69 -11.187 4.714 2.576 1.00 51.21 H new ATOM 0 HG3 PRO A 69 -10.604 3.176 1.970 1.00 51.21 H new ATOM 0 HD2 PRO A 69 -13.214 3.544 2.654 1.00 73.45 H new ATOM 0 HD3 PRO A 69 -12.430 1.988 2.840 1.00 73.45 H new ATOM 952 N CYS A 70 -11.065 5.145 7.065 1.00 44.03 N ATOM 953 CA CYS A 70 -11.096 6.453 7.709 1.00 15.13 C ATOM 954 C CYS A 70 -10.002 6.565 8.766 1.00 54.40 C ATOM 955 O CYS A 70 -9.614 5.571 9.380 1.00 12.53 O ATOM 956 CB CYS A 70 -12.465 6.697 8.347 1.00 50.42 C ATOM 957 SG CYS A 70 -13.858 6.457 7.219 1.00 10.13 S ATOM 0 H CYS A 70 -10.870 4.368 7.697 1.00 44.03 H new ATOM 0 HA CYS A 70 -10.918 7.211 6.946 1.00 15.13 H new ATOM 0 HB2 CYS A 70 -12.582 6.027 9.199 1.00 50.42 H new ATOM 0 HB3 CYS A 70 -12.497 7.715 8.735 1.00 50.42 H new ATOM 0 HG CYS A 70 -14.972 6.684 7.850 1.00 10.13 H new ATOM 963 N TYR A 71 -9.508 7.781 8.971 1.00 11.11 N ATOM 964 CA TYR A 71 -8.455 8.023 9.951 1.00 73.24 C ATOM 965 C TYR A 71 -8.833 9.168 10.885 1.00 51.10 C ATOM 966 O TYR A 71 -9.255 10.235 10.439 1.00 64.32 O ATOM 967 CB TYR A 71 -7.136 8.340 9.245 1.00 60.14 C ATOM 968 CG TYR A 71 -6.821 7.403 8.100 1.00 30.14 C ATOM 969 CD1 TYR A 71 -7.343 7.624 6.832 1.00 64.32 C ATOM 970 CD2 TYR A 71 -6.001 6.297 8.288 1.00 2.11 C ATOM 971 CE1 TYR A 71 -7.058 6.770 5.784 1.00 70.31 C ATOM 972 CE2 TYR A 71 -5.710 5.439 7.246 1.00 64.53 C ATOM 973 CZ TYR A 71 -6.241 5.679 5.996 1.00 70.23 C ATOM 974 OH TYR A 71 -5.954 4.827 4.954 1.00 30.41 O ATOM 0 H TYR A 71 -9.819 8.614 8.472 1.00 11.11 H new ATOM 0 HA TYR A 71 -8.333 7.118 10.546 1.00 73.24 H new ATOM 0 HB2 TYR A 71 -7.172 9.362 8.868 1.00 60.14 H new ATOM 0 HB3 TYR A 71 -6.325 8.297 9.972 1.00 60.14 H new ATOM 0 HD1 TYR A 71 -7.982 8.478 6.662 1.00 64.32 H new ATOM 0 HD2 TYR A 71 -5.584 6.105 9.266 1.00 2.11 H new ATOM 0 HE1 TYR A 71 -7.473 6.956 4.804 1.00 70.31 H new ATOM 0 HE2 TYR A 71 -5.070 4.584 7.409 1.00 64.53 H new ATOM 0 HH TYR A 71 -5.191 4.261 5.195 1.00 30.41 H new ATOM 984 N ALA A 72 -8.678 8.938 12.185 1.00 50.33 N ATOM 985 CA ALA A 72 -9.000 9.950 13.183 1.00 3.42 C ATOM 986 C ALA A 72 -7.796 10.249 14.070 1.00 23.42 C ATOM 987 O ALA A 72 -7.200 9.341 14.650 1.00 15.24 O ATOM 988 CB ALA A 72 -10.182 9.501 14.029 1.00 71.35 C ATOM 0 H ALA A 72 -8.331 8.060 12.571 1.00 50.33 H new ATOM 0 HA ALA A 72 -9.270 10.867 12.660 1.00 3.42 H new ATOM 0 HB1 ALA A 72 -10.411 10.267 14.770 1.00 71.35 H new ATOM 0 HB2 ALA A 72 -11.050 9.345 13.388 1.00 71.35 H new ATOM 0 HB3 ALA A 72 -9.933 8.569 14.536 1.00 71.35 H new ATOM 994 N ALA A 73 -7.442 11.526 14.170 1.00 31.22 N ATOM 995 CA ALA A 73 -6.310 11.943 14.988 1.00 43.23 C ATOM 996 C ALA A 73 -6.779 12.637 16.262 1.00 22.10 C ATOM 997 O ALA A 73 -7.572 13.578 16.213 1.00 63.41 O ATOM 998 CB ALA A 73 -5.394 12.861 14.191 1.00 23.34 C ATOM 0 H ALA A 73 -7.923 12.290 13.695 1.00 31.22 H new ATOM 0 HA ALA A 73 -5.753 11.051 15.276 1.00 43.23 H new ATOM 0 HB1 ALA A 73 -4.553 13.165 14.814 1.00 23.34 H new ATOM 0 HB2 ALA A 73 -5.023 12.332 13.313 1.00 23.34 H new ATOM 0 HB3 ALA A 73 -5.949 13.744 13.875 1.00 23.34 H new ATOM 1004 N PHE A 74 -6.285 12.167 17.402 1.00 22.55 N ATOM 1005 CA PHE A 74 -6.655 12.741 18.691 1.00 70.03 C ATOM 1006 C PHE A 74 -5.447 13.381 19.368 1.00 23.54 C ATOM 1007 O PHE A 74 -4.402 12.748 19.525 1.00 33.21 O ATOM 1008 CB PHE A 74 -7.254 11.665 19.599 1.00 3.45 C ATOM 1009 CG PHE A 74 -8.700 11.378 19.315 1.00 32.32 C ATOM 1010 CD1 PHE A 74 -9.103 10.958 18.057 1.00 4.34 C ATOM 1011 CD2 PHE A 74 -9.657 11.526 20.306 1.00 75.02 C ATOM 1012 CE1 PHE A 74 -10.433 10.694 17.793 1.00 31.31 C ATOM 1013 CE2 PHE A 74 -10.990 11.262 20.047 1.00 5.45 C ATOM 1014 CZ PHE A 74 -11.378 10.845 18.790 1.00 65.34 C ATOM 0 H PHE A 74 -5.627 11.390 17.460 1.00 22.55 H new ATOM 0 HA PHE A 74 -7.402 13.515 18.516 1.00 70.03 H new ATOM 0 HB2 PHE A 74 -6.680 10.745 19.486 1.00 3.45 H new ATOM 0 HB3 PHE A 74 -7.151 11.979 20.638 1.00 3.45 H new ATOM 0 HD1 PHE A 74 -8.369 10.836 17.274 1.00 4.34 H new ATOM 0 HD2 PHE A 74 -9.359 11.851 21.292 1.00 75.02 H new ATOM 0 HE1 PHE A 74 -10.734 10.370 16.808 1.00 31.31 H new ATOM 0 HE2 PHE A 74 -11.726 11.382 20.828 1.00 5.45 H new ATOM 0 HZ PHE A 74 -12.418 10.637 18.586 1.00 65.34 H new ATOM 1024 N ASP A 75 -5.597 14.639 19.768 1.00 72.44 N ATOM 1025 CA ASP A 75 -4.519 15.365 20.429 1.00 34.10 C ATOM 1026 C ASP A 75 -4.712 15.364 21.942 1.00 14.23 C ATOM 1027 O ASP A 75 -5.725 15.847 22.450 1.00 60.03 O ATOM 1028 CB ASP A 75 -4.452 16.803 19.912 1.00 70.33 C ATOM 1029 CG ASP A 75 -3.673 17.715 20.838 1.00 2.40 C ATOM 1030 OD1 ASP A 75 -4.230 18.120 21.880 1.00 73.10 O ATOM 1031 OD2 ASP A 75 -2.505 18.025 20.522 1.00 72.54 O ATOM 0 H ASP A 75 -6.455 15.177 19.646 1.00 72.44 H new ATOM 0 HA ASP A 75 -3.580 14.861 20.200 1.00 34.10 H new ATOM 0 HB2 ASP A 75 -3.989 16.810 18.925 1.00 70.33 H new ATOM 0 HB3 ASP A 75 -5.464 17.190 19.792 1.00 70.33 H new ATOM 1036 N PHE A 76 -3.735 14.818 22.658 1.00 1.10 N ATOM 1037 CA PHE A 76 -3.798 14.752 24.113 1.00 1.54 C ATOM 1038 C PHE A 76 -2.659 15.548 24.744 1.00 43.34 C ATOM 1039 O PHE A 76 -1.485 15.251 24.524 1.00 51.25 O ATOM 1040 CB PHE A 76 -3.739 13.297 24.583 1.00 50.35 C ATOM 1041 CG PHE A 76 -4.231 13.100 25.988 1.00 5.10 C ATOM 1042 CD1 PHE A 76 -5.581 13.198 26.284 1.00 25.21 C ATOM 1043 CD2 PHE A 76 -3.342 12.818 27.013 1.00 34.34 C ATOM 1044 CE1 PHE A 76 -6.036 13.017 27.576 1.00 33.44 C ATOM 1045 CE2 PHE A 76 -3.792 12.635 28.307 1.00 12.13 C ATOM 1046 CZ PHE A 76 -5.141 12.736 28.589 1.00 24.15 C ATOM 0 H PHE A 76 -2.890 14.415 22.254 1.00 1.10 H new ATOM 0 HA PHE A 76 -4.744 15.191 24.430 1.00 1.54 H new ATOM 0 HB2 PHE A 76 -4.334 12.681 23.909 1.00 50.35 H new ATOM 0 HB3 PHE A 76 -2.711 12.943 24.514 1.00 50.35 H new ATOM 0 HD1 PHE A 76 -6.286 13.418 25.496 1.00 25.21 H new ATOM 0 HD2 PHE A 76 -2.286 12.740 26.798 1.00 34.34 H new ATOM 0 HE1 PHE A 76 -7.091 13.095 27.793 1.00 33.44 H new ATOM 0 HE2 PHE A 76 -3.090 12.413 29.097 1.00 12.13 H new ATOM 0 HZ PHE A 76 -5.494 12.595 29.600 1.00 24.15 H new ATOM 1056 N GLU A 77 -3.015 16.561 25.528 1.00 50.04 N ATOM 1057 CA GLU A 77 -2.023 17.401 26.188 1.00 24.54 C ATOM 1058 C GLU A 77 -2.269 17.451 27.694 1.00 45.44 C ATOM 1059 O GLU A 77 -3.343 17.848 28.145 1.00 73.20 O ATOM 1060 CB GLU A 77 -2.051 18.816 25.608 1.00 74.12 C ATOM 1061 CG GLU A 77 -1.199 19.808 26.381 1.00 52.33 C ATOM 1062 CD GLU A 77 -2.025 20.890 27.049 1.00 51.31 C ATOM 1063 OE1 GLU A 77 -2.910 21.461 26.377 1.00 61.43 O ATOM 1064 OE2 GLU A 77 -1.787 21.167 28.243 1.00 41.00 O ATOM 0 H GLU A 77 -3.983 16.819 25.721 1.00 50.04 H new ATOM 0 HA GLU A 77 -1.040 16.965 26.011 1.00 24.54 H new ATOM 0 HB2 GLU A 77 -1.707 18.783 24.574 1.00 74.12 H new ATOM 0 HB3 GLU A 77 -3.081 19.172 25.590 1.00 74.12 H new ATOM 0 HG2 GLU A 77 -0.624 19.275 27.139 1.00 52.33 H new ATOM 0 HG3 GLU A 77 -0.481 20.270 25.703 1.00 52.33 H new ATOM 1167 N ARG A 85 3.130 18.567 28.477 1.00 72.54 N ATOM 1168 CA ARG A 85 3.556 18.020 27.194 1.00 55.33 C ATOM 1169 C ARG A 85 2.361 17.814 26.267 1.00 12.11 C ATOM 1170 O ARG A 85 1.213 18.016 26.664 1.00 51.44 O ATOM 1171 CB ARG A 85 4.290 16.694 27.399 1.00 45.35 C ATOM 1172 CG ARG A 85 5.798 16.802 27.237 1.00 51.21 C ATOM 1173 CD ARG A 85 6.392 17.809 28.209 1.00 12.33 C ATOM 1174 NE ARG A 85 7.371 17.196 29.102 1.00 5.00 N ATOM 1175 CZ ARG A 85 8.080 17.878 29.995 1.00 64.12 C ATOM 1176 NH1 ARG A 85 7.919 19.189 30.113 1.00 33.53 N ATOM 1177 NH2 ARG A 85 8.953 17.249 30.772 1.00 72.33 N ATOM 0 HA ARG A 85 4.235 18.735 26.730 1.00 55.33 H new ATOM 0 HB2 ARG A 85 4.066 16.315 28.396 1.00 45.35 H new ATOM 0 HB3 ARG A 85 3.908 15.963 26.687 1.00 45.35 H new ATOM 0 HG2 ARG A 85 6.253 15.825 27.400 1.00 51.21 H new ATOM 0 HG3 ARG A 85 6.035 17.098 26.215 1.00 51.21 H new ATOM 0 HD2 ARG A 85 6.866 18.616 27.650 1.00 12.33 H new ATOM 0 HD3 ARG A 85 5.593 18.257 28.800 1.00 12.33 H new ATOM 0 HE ARG A 85 7.519 16.189 29.037 1.00 5.00 H new ATOM 0 HH11 ARG A 85 7.250 19.676 29.517 1.00 33.53 H new ATOM 0 HH12 ARG A 85 8.465 19.710 30.799 1.00 33.53 H new ATOM 0 HH21 ARG A 85 9.080 16.241 30.684 1.00 72.33 H new ATOM 0 HH22 ARG A 85 9.497 17.774 31.457 1.00 72.33 H new ATOM 1191 N ASP A 86 2.639 17.411 25.032 1.00 2.33 N ATOM 1192 CA ASP A 86 1.588 17.177 24.049 1.00 11.11 C ATOM 1193 C ASP A 86 1.951 16.013 23.132 1.00 13.22 C ATOM 1194 O ASP A 86 3.077 15.921 22.644 1.00 23.33 O ATOM 1195 CB ASP A 86 1.345 18.439 23.220 1.00 2.20 C ATOM 1196 CG ASP A 86 2.381 18.623 22.129 1.00 43.13 C ATOM 1197 OD1 ASP A 86 3.576 18.761 22.463 1.00 4.10 O ATOM 1198 OD2 ASP A 86 1.997 18.630 20.940 1.00 1.03 O ATOM 0 H ASP A 86 3.584 17.240 24.688 1.00 2.33 H new ATOM 0 HA ASP A 86 0.674 16.922 24.585 1.00 11.11 H new ATOM 0 HB2 ASP A 86 0.353 18.390 22.771 1.00 2.20 H new ATOM 0 HB3 ASP A 86 1.355 19.309 23.877 1.00 2.20 H new ATOM 1203 N LYS A 87 0.989 15.126 22.903 1.00 61.54 N ATOM 1204 CA LYS A 87 1.206 13.967 22.044 1.00 33.25 C ATOM 1205 C LYS A 87 0.038 13.777 21.082 1.00 33.40 C ATOM 1206 O LYS A 87 -1.122 13.961 21.453 1.00 33.02 O ATOM 1207 CB LYS A 87 1.392 12.706 22.892 1.00 4.41 C ATOM 1208 CG LYS A 87 2.085 11.574 22.154 1.00 74.13 C ATOM 1209 CD LYS A 87 3.535 11.432 22.584 1.00 40.12 C ATOM 1210 CE LYS A 87 4.479 11.512 21.394 1.00 5.22 C ATOM 1211 NZ LYS A 87 5.725 12.259 21.724 1.00 52.10 N ATOM 0 H LYS A 87 0.051 15.187 23.300 1.00 61.54 H new ATOM 0 HA LYS A 87 2.110 14.142 21.461 1.00 33.25 H new ATOM 0 HB2 LYS A 87 1.971 12.958 23.780 1.00 4.41 H new ATOM 0 HB3 LYS A 87 0.416 12.362 23.235 1.00 4.41 H new ATOM 0 HG2 LYS A 87 1.556 10.639 22.341 1.00 74.13 H new ATOM 0 HG3 LYS A 87 2.039 11.757 21.080 1.00 74.13 H new ATOM 0 HD2 LYS A 87 3.782 12.216 23.299 1.00 40.12 H new ATOM 0 HD3 LYS A 87 3.672 10.479 23.096 1.00 40.12 H new ATOM 0 HE2 LYS A 87 4.736 10.505 21.065 1.00 5.22 H new ATOM 0 HE3 LYS A 87 3.973 12.000 20.561 1.00 5.22 H new ATOM 0 HZ1 LYS A 87 6.342 12.292 20.888 1.00 52.10 H new ATOM 0 HZ2 LYS A 87 5.482 13.228 22.013 1.00 52.10 H new ATOM 0 HZ3 LYS A 87 6.221 11.780 22.502 1.00 52.10 H new ATOM 1225 N LEU A 88 0.351 13.406 19.845 1.00 35.34 N ATOM 1226 CA LEU A 88 -0.674 13.189 18.830 1.00 63.44 C ATOM 1227 C LEU A 88 -0.835 11.702 18.527 1.00 3.15 C ATOM 1228 O LEU A 88 0.149 10.992 18.314 1.00 14.21 O ATOM 1229 CB LEU A 88 -0.318 13.945 17.549 1.00 40.33 C ATOM 1230 CG LEU A 88 -0.779 15.402 17.480 1.00 62.34 C ATOM 1231 CD1 LEU A 88 0.110 16.284 18.342 1.00 13.24 C ATOM 1232 CD2 LEU A 88 -0.783 15.892 16.039 1.00 41.00 C ATOM 0 H LEU A 88 1.305 13.249 19.521 1.00 35.34 H new ATOM 0 HA LEU A 88 -1.620 13.567 19.218 1.00 63.44 H new ATOM 0 HB2 LEU A 88 0.765 13.921 17.426 1.00 40.33 H new ATOM 0 HB3 LEU A 88 -0.747 13.408 16.703 1.00 40.33 H new ATOM 0 HG LEU A 88 -1.797 15.460 17.866 1.00 62.34 H new ATOM 0 HD11 LEU A 88 -0.233 17.317 18.281 1.00 13.24 H new ATOM 0 HD12 LEU A 88 0.063 15.947 19.377 1.00 13.24 H new ATOM 0 HD13 LEU A 88 1.139 16.222 17.987 1.00 13.24 H new ATOM 0 HD21 LEU A 88 -1.114 16.930 16.009 1.00 41.00 H new ATOM 0 HD22 LEU A 88 0.224 15.819 15.627 1.00 41.00 H new ATOM 0 HD23 LEU A 88 -1.462 15.278 15.448 1.00 41.00 H new ATOM 1244 N ILE A 89 -2.080 11.239 18.509 1.00 21.12 N ATOM 1245 CA ILE A 89 -2.369 9.838 18.230 1.00 71.13 C ATOM 1246 C ILE A 89 -3.146 9.686 16.926 1.00 1.43 C ATOM 1247 O ILE A 89 -3.933 10.558 16.555 1.00 71.12 O ATOM 1248 CB ILE A 89 -3.174 9.191 19.372 1.00 20.51 C ATOM 1249 CG1 ILE A 89 -2.738 9.765 20.722 1.00 61.24 C ATOM 1250 CG2 ILE A 89 -3.000 7.679 19.352 1.00 0.23 C ATOM 1251 CD1 ILE A 89 -1.250 9.658 20.971 1.00 21.45 C ATOM 0 H ILE A 89 -2.905 11.813 18.684 1.00 21.12 H new ATOM 0 HA ILE A 89 -1.409 9.330 18.140 1.00 71.13 H new ATOM 0 HB ILE A 89 -4.230 9.418 19.226 1.00 20.51 H new ATOM 0 HG12 ILE A 89 -3.033 10.813 20.774 1.00 61.24 H new ATOM 0 HG13 ILE A 89 -3.270 9.244 21.518 1.00 61.24 H new ATOM 0 HG21 ILE A 89 -3.575 7.236 20.165 1.00 0.23 H new ATOM 0 HG22 ILE A 89 -3.355 7.285 18.400 1.00 0.23 H new ATOM 0 HG23 ILE A 89 -1.946 7.432 19.477 1.00 0.23 H new ATOM 0 HD11 ILE A 89 -1.013 10.084 21.946 1.00 21.45 H new ATOM 0 HD12 ILE A 89 -0.952 8.610 20.951 1.00 21.45 H new ATOM 0 HD13 ILE A 89 -0.711 10.203 20.196 1.00 21.45 H new ATOM 1263 N LEU A 90 -2.921 8.574 16.236 1.00 31.21 N ATOM 1264 CA LEU A 90 -3.601 8.306 14.974 1.00 74.13 C ATOM 1265 C LEU A 90 -4.246 6.924 14.985 1.00 32.43 C ATOM 1266 O LEU A 90 -3.564 5.911 15.144 1.00 3.02 O ATOM 1267 CB LEU A 90 -2.616 8.412 13.808 1.00 34.02 C ATOM 1268 CG LEU A 90 -3.198 8.175 12.414 1.00 20.31 C ATOM 1269 CD1 LEU A 90 -2.494 9.048 11.387 1.00 75.44 C ATOM 1270 CD2 LEU A 90 -3.088 6.705 12.033 1.00 10.44 C ATOM 0 H LEU A 90 -2.273 7.843 16.529 1.00 31.21 H new ATOM 0 HA LEU A 90 -4.386 9.052 14.848 1.00 74.13 H new ATOM 0 HB2 LEU A 90 -2.166 9.404 13.828 1.00 34.02 H new ATOM 0 HB3 LEU A 90 -1.812 7.694 13.971 1.00 34.02 H new ATOM 0 HG LEU A 90 -4.253 8.447 12.430 1.00 20.31 H new ATOM 0 HD11 LEU A 90 -2.921 8.866 10.401 1.00 75.44 H new ATOM 0 HD12 LEU A 90 -2.624 10.097 11.651 1.00 75.44 H new ATOM 0 HD13 LEU A 90 -1.431 8.807 11.372 1.00 75.44 H new ATOM 0 HD21 LEU A 90 -3.507 6.555 11.038 1.00 10.44 H new ATOM 0 HD22 LEU A 90 -2.040 6.406 12.034 1.00 10.44 H new ATOM 0 HD23 LEU A 90 -3.638 6.100 12.754 1.00 10.44 H new ATOM 1282 N ILE A 91 -5.563 6.889 14.814 1.00 53.40 N ATOM 1283 CA ILE A 91 -6.299 5.631 14.801 1.00 11.25 C ATOM 1284 C ILE A 91 -6.952 5.390 13.445 1.00 72.32 C ATOM 1285 O ILE A 91 -7.747 6.203 12.973 1.00 5.21 O ATOM 1286 CB ILE A 91 -7.385 5.603 15.893 1.00 22.05 C ATOM 1287 CG1 ILE A 91 -6.755 5.800 17.274 1.00 15.21 C ATOM 1288 CG2 ILE A 91 -8.157 4.293 15.839 1.00 25.03 C ATOM 1289 CD1 ILE A 91 -6.825 7.227 17.772 1.00 73.12 C ATOM 0 H ILE A 91 -6.143 7.718 14.682 1.00 53.40 H new ATOM 0 HA ILE A 91 -5.575 4.840 14.999 1.00 11.25 H new ATOM 0 HB ILE A 91 -8.083 6.421 15.712 1.00 22.05 H new ATOM 0 HG12 ILE A 91 -7.257 5.149 17.990 1.00 15.21 H new ATOM 0 HG13 ILE A 91 -5.711 5.488 17.236 1.00 15.21 H new ATOM 0 HG21 ILE A 91 -8.921 4.288 16.617 1.00 25.03 H new ATOM 0 HG22 ILE A 91 -8.632 4.191 14.863 1.00 25.03 H new ATOM 0 HG23 ILE A 91 -7.472 3.460 15.998 1.00 25.03 H new ATOM 0 HD11 ILE A 91 -6.360 7.292 18.756 1.00 73.12 H new ATOM 0 HD12 ILE A 91 -6.298 7.881 17.077 1.00 73.12 H new ATOM 0 HD13 ILE A 91 -7.868 7.537 17.842 1.00 73.12 H new ATOM 1301 N SER A 92 -6.613 4.265 12.823 1.00 40.14 N ATOM 1302 CA SER A 92 -7.165 3.917 11.519 1.00 62.34 C ATOM 1303 C SER A 92 -8.279 2.884 11.659 1.00 63.35 C ATOM 1304 O SER A 92 -8.135 1.893 12.375 1.00 63.13 O ATOM 1305 CB SER A 92 -6.064 3.376 10.604 1.00 73.14 C ATOM 1306 OG SER A 92 -4.818 3.986 10.890 1.00 64.30 O ATOM 0 H SER A 92 -5.959 3.579 13.201 1.00 40.14 H new ATOM 0 HA SER A 92 -7.585 4.820 11.076 1.00 62.34 H new ATOM 0 HB2 SER A 92 -5.981 2.296 10.729 1.00 73.14 H new ATOM 0 HB3 SER A 92 -6.331 3.557 9.563 1.00 73.14 H new ATOM 0 HG SER A 92 -4.092 3.426 10.544 1.00 64.30 H new ATOM 1312 N TRP A 93 -9.389 3.123 10.970 1.00 45.24 N ATOM 1313 CA TRP A 93 -10.528 2.214 11.016 1.00 11.14 C ATOM 1314 C TRP A 93 -10.543 1.297 9.799 1.00 72.14 C ATOM 1315 O TRP A 93 -10.699 1.755 8.668 1.00 70.25 O ATOM 1316 CB TRP A 93 -11.835 3.005 11.091 1.00 51.23 C ATOM 1317 CG TRP A 93 -11.844 4.037 12.178 1.00 60.21 C ATOM 1318 CD1 TRP A 93 -11.902 5.392 12.021 1.00 2.31 C ATOM 1319 CD2 TRP A 93 -11.791 3.796 13.588 1.00 34.13 C ATOM 1320 NE1 TRP A 93 -11.888 6.009 13.249 1.00 34.52 N ATOM 1321 CE2 TRP A 93 -11.822 5.051 14.227 1.00 41.33 C ATOM 1322 CE3 TRP A 93 -11.724 2.642 14.374 1.00 42.30 C ATOM 1323 CZ2 TRP A 93 -11.786 5.182 15.612 1.00 3.43 C ATOM 1324 CZ3 TRP A 93 -11.688 2.774 15.749 1.00 5.21 C ATOM 1325 CH2 TRP A 93 -11.719 4.036 16.357 1.00 13.20 C ATOM 0 H TRP A 93 -9.524 3.939 10.373 1.00 45.24 H new ATOM 0 HA TRP A 93 -10.433 1.597 11.910 1.00 11.14 H new ATOM 0 HB2 TRP A 93 -12.010 3.495 10.133 1.00 51.23 H new ATOM 0 HB3 TRP A 93 -12.662 2.313 11.251 1.00 51.23 H new ATOM 0 HD1 TRP A 93 -11.952 5.904 11.071 1.00 2.31 H new ATOM 0 HE1 TRP A 93 -11.921 7.016 13.407 1.00 34.52 H new ATOM 0 HE3 TRP A 93 -11.701 1.665 13.915 1.00 42.30 H new ATOM 0 HZ2 TRP A 93 -11.810 6.154 16.082 1.00 3.43 H new ATOM 0 HZ3 TRP A 93 -11.635 1.889 16.366 1.00 5.21 H new ATOM 0 HH2 TRP A 93 -11.689 4.106 17.434 1.00 13.20 H new ATOM 1336 N ASN A 94 -10.381 0.000 10.038 1.00 65.30 N ATOM 1337 CA ASN A 94 -10.375 -0.982 8.959 1.00 13.23 C ATOM 1338 C ASN A 94 -10.550 -2.395 9.508 1.00 11.53 C ATOM 1339 O ASN A 94 -9.583 -3.109 9.771 1.00 24.31 O ATOM 1340 CB ASN A 94 -9.071 -0.889 8.164 1.00 75.40 C ATOM 1341 CG ASN A 94 -7.860 -0.714 9.059 1.00 43.03 C ATOM 1342 OD1 ASN A 94 -7.177 -1.682 9.395 1.00 50.22 O ATOM 1343 ND2 ASN A 94 -7.587 0.526 9.449 1.00 32.31 N ATOM 0 H ASN A 94 -10.252 -0.396 10.969 1.00 65.30 H new ATOM 0 HA ASN A 94 -11.213 -0.763 8.297 1.00 13.23 H new ATOM 0 HB2 ASN A 94 -8.949 -1.791 7.564 1.00 75.40 H new ATOM 0 HB3 ASN A 94 -9.131 -0.051 7.470 1.00 75.40 H new ATOM 0 HD21 ASN A 94 -6.784 0.706 10.051 1.00 32.31 H new ATOM 0 HD22 ASN A 94 -8.181 1.298 9.146 1.00 32.31 H new ATOM 1350 N PRO A 95 -11.814 -2.808 9.686 1.00 64.23 N ATOM 1351 CA PRO A 95 -12.145 -4.139 10.204 1.00 55.21 C ATOM 1352 C PRO A 95 -11.819 -5.247 9.208 1.00 1.43 C ATOM 1353 O PRO A 95 -12.165 -5.157 8.030 1.00 24.11 O ATOM 1354 CB PRO A 95 -13.656 -4.061 10.441 1.00 42.45 C ATOM 1355 CG PRO A 95 -14.133 -3.010 9.498 1.00 0.14 C ATOM 1356 CD PRO A 95 -13.015 -2.009 9.394 1.00 75.24 C ATOM 0 HA PRO A 95 -11.571 -4.383 11.098 1.00 55.21 H new ATOM 0 HB2 PRO A 95 -14.138 -5.019 10.243 1.00 42.45 H new ATOM 0 HB3 PRO A 95 -13.882 -3.798 11.474 1.00 42.45 H new ATOM 0 HG2 PRO A 95 -14.366 -3.437 8.523 1.00 0.14 H new ATOM 0 HG3 PRO A 95 -15.045 -2.540 9.866 1.00 0.14 H new ATOM 0 HD2 PRO A 95 -12.968 -1.561 8.402 1.00 75.24 H new ATOM 0 HD3 PRO A 95 -13.138 -1.193 10.107 1.00 75.24 H new ATOM 1364 N ASP A 96 -11.152 -6.290 9.689 1.00 0.02 N ATOM 1365 CA ASP A 96 -10.780 -7.417 8.841 1.00 11.42 C ATOM 1366 C ASP A 96 -12.014 -8.047 8.202 1.00 1.55 C ATOM 1367 O ASP A 96 -11.927 -8.673 7.146 1.00 12.42 O ATOM 1368 CB ASP A 96 -10.020 -8.465 9.654 1.00 23.34 C ATOM 1369 CG ASP A 96 -8.685 -7.952 10.158 1.00 50.24 C ATOM 1370 OD1 ASP A 96 -7.869 -7.504 9.325 1.00 61.23 O ATOM 1371 OD2 ASP A 96 -8.457 -7.997 11.384 1.00 1.33 O ATOM 0 H ASP A 96 -10.858 -6.379 10.662 1.00 0.02 H new ATOM 0 HA ASP A 96 -10.132 -7.045 8.047 1.00 11.42 H new ATOM 0 HB2 ASP A 96 -10.630 -8.775 10.502 1.00 23.34 H new ATOM 0 HB3 ASP A 96 -9.857 -9.350 9.038 1.00 23.34 H new ATOM 1376 N SER A 97 -13.162 -7.877 8.851 1.00 24.22 N ATOM 1377 CA SER A 97 -14.413 -8.433 8.349 1.00 23.32 C ATOM 1378 C SER A 97 -15.219 -7.373 7.606 1.00 14.55 C ATOM 1379 O SER A 97 -16.400 -7.563 7.319 1.00 72.14 O ATOM 1380 CB SER A 97 -15.240 -9.005 9.502 1.00 31.11 C ATOM 1381 OG SER A 97 -14.793 -10.302 9.856 1.00 32.41 O ATOM 0 H SER A 97 -13.251 -7.359 9.725 1.00 24.22 H new ATOM 0 HA SER A 97 -14.172 -9.235 7.652 1.00 23.32 H new ATOM 0 HB2 SER A 97 -15.170 -8.344 10.366 1.00 31.11 H new ATOM 0 HB3 SER A 97 -16.291 -9.045 9.215 1.00 31.11 H new ATOM 0 HG SER A 97 -15.336 -10.645 10.596 1.00 32.41 H new ATOM 1387 N GLY A 98 -14.572 -6.253 7.299 1.00 4.20 N ATOM 1388 CA GLY A 98 -15.243 -5.177 6.593 1.00 70.42 C ATOM 1389 C GLY A 98 -15.346 -5.438 5.103 1.00 15.22 C ATOM 1390 O GLY A 98 -16.084 -6.323 4.671 1.00 50.12 O ATOM 0 H GLY A 98 -13.594 -6.071 7.527 1.00 4.20 H new ATOM 0 HA2 GLY A 98 -16.243 -5.044 7.006 1.00 70.42 H new ATOM 0 HA3 GLY A 98 -14.703 -4.245 6.759 1.00 70.42 H new ATOM 1394 N ALA A 99 -14.607 -4.664 4.316 1.00 45.20 N ATOM 1395 CA ALA A 99 -14.618 -4.816 2.866 1.00 10.53 C ATOM 1396 C ALA A 99 -13.202 -4.950 2.317 1.00 22.22 C ATOM 1397 O ALA A 99 -12.222 -4.576 2.962 1.00 60.21 O ATOM 1398 CB ALA A 99 -15.328 -3.636 2.218 1.00 63.11 C ATOM 0 H ALA A 99 -13.993 -3.925 4.658 1.00 45.20 H new ATOM 0 HA ALA A 99 -15.161 -5.730 2.625 1.00 10.53 H new ATOM 0 HB1 ALA A 99 -15.329 -3.762 1.135 1.00 63.11 H new ATOM 0 HB2 ALA A 99 -16.355 -3.587 2.579 1.00 63.11 H new ATOM 0 HB3 ALA A 99 -14.809 -2.713 2.475 1.00 63.11 H new ATOM 1404 N PRO A 100 -13.089 -5.498 1.098 1.00 43.21 N ATOM 1405 CA PRO A 100 -11.796 -5.695 0.435 1.00 1.45 C ATOM 1406 C PRO A 100 -11.156 -4.377 0.011 1.00 63.43 C ATOM 1407 O PRO A 100 -9.975 -4.140 0.265 1.00 64.25 O ATOM 1408 CB PRO A 100 -12.151 -6.537 -0.792 1.00 51.13 C ATOM 1409 CG PRO A 100 -13.581 -6.221 -1.068 1.00 3.12 C ATOM 1410 CD PRO A 100 -14.214 -5.966 0.272 1.00 31.40 C ATOM 0 HA PRO A 100 -11.067 -6.166 1.094 1.00 1.45 H new ATOM 0 HB2 PRO A 100 -11.518 -6.283 -1.643 1.00 51.13 H new ATOM 0 HB3 PRO A 100 -12.011 -7.600 -0.596 1.00 51.13 H new ATOM 0 HG2 PRO A 100 -13.670 -5.348 -1.714 1.00 3.12 H new ATOM 0 HG3 PRO A 100 -14.072 -7.048 -1.580 1.00 3.12 H new ATOM 0 HD2 PRO A 100 -15.004 -5.217 0.207 1.00 31.40 H new ATOM 0 HD3 PRO A 100 -14.665 -6.870 0.682 1.00 31.40 H new ATOM 1418 N ARG A 101 -11.943 -3.524 -0.636 1.00 45.04 N ATOM 1419 CA ARG A 101 -11.452 -2.231 -1.097 1.00 5.31 C ATOM 1420 C ARG A 101 -11.045 -1.352 0.083 1.00 73.13 C ATOM 1421 O ARG A 101 -10.082 -0.589 0.001 1.00 62.52 O ATOM 1422 CB ARG A 101 -12.521 -1.522 -1.930 1.00 34.22 C ATOM 1423 CG ARG A 101 -12.636 -2.051 -3.350 1.00 54.32 C ATOM 1424 CD ARG A 101 -13.130 -0.976 -4.306 1.00 71.11 C ATOM 1425 NE ARG A 101 -14.194 -1.466 -5.178 1.00 73.11 N ATOM 1426 CZ ARG A 101 -14.001 -2.356 -6.145 1.00 44.45 C ATOM 1427 NH1 ARG A 101 -12.790 -2.850 -6.363 1.00 61.02 N ATOM 1428 NH2 ARG A 101 -15.020 -2.753 -6.897 1.00 45.41 N ATOM 0 H ARG A 101 -12.923 -3.705 -0.853 1.00 45.04 H new ATOM 0 HA ARG A 101 -10.574 -2.405 -1.719 1.00 5.31 H new ATOM 0 HB2 ARG A 101 -13.485 -1.627 -1.433 1.00 34.22 H new ATOM 0 HB3 ARG A 101 -12.295 -0.456 -1.965 1.00 34.22 H new ATOM 0 HG2 ARG A 101 -11.665 -2.417 -3.683 1.00 54.32 H new ATOM 0 HG3 ARG A 101 -13.320 -2.899 -3.369 1.00 54.32 H new ATOM 0 HD2 ARG A 101 -13.494 -0.122 -3.735 1.00 71.11 H new ATOM 0 HD3 ARG A 101 -12.298 -0.621 -4.914 1.00 71.11 H new ATOM 0 HE ARG A 101 -15.137 -1.105 -5.037 1.00 73.11 H new ATOM 0 HH11 ARG A 101 -12.004 -2.547 -5.788 1.00 61.02 H new ATOM 0 HH12 ARG A 101 -12.644 -3.533 -7.106 1.00 61.02 H new ATOM 0 HH21 ARG A 101 -15.953 -2.375 -6.733 1.00 45.41 H new ATOM 0 HH22 ARG A 101 -14.870 -3.436 -7.639 1.00 45.41 H new ATOM 1442 N THR A 102 -11.787 -1.464 1.180 1.00 12.43 N ATOM 1443 CA THR A 102 -11.506 -0.679 2.376 1.00 51.12 C ATOM 1444 C THR A 102 -10.154 -1.051 2.972 1.00 24.34 C ATOM 1445 O THR A 102 -9.362 -0.181 3.334 1.00 44.44 O ATOM 1446 CB THR A 102 -12.597 -0.874 3.445 1.00 14.13 C ATOM 1447 OG1 THR A 102 -12.515 -2.194 3.995 1.00 44.33 O ATOM 1448 CG2 THR A 102 -13.981 -0.651 2.853 1.00 20.44 C ATOM 0 H THR A 102 -12.587 -2.091 1.265 1.00 12.43 H new ATOM 0 HA THR A 102 -11.490 0.367 2.071 1.00 51.12 H new ATOM 0 HB THR A 102 -12.435 -0.141 4.235 1.00 14.13 H new ATOM 0 HG1 THR A 102 -12.453 -2.848 3.268 1.00 44.33 H new ATOM 0 HG21 THR A 102 -14.735 -0.794 3.627 1.00 20.44 H new ATOM 0 HG22 THR A 102 -14.050 0.364 2.462 1.00 20.44 H new ATOM 0 HG23 THR A 102 -14.150 -1.363 2.045 1.00 20.44 H new ATOM 1456 N LYS A 103 -9.894 -2.350 3.073 1.00 70.51 N ATOM 1457 CA LYS A 103 -8.636 -2.839 3.624 1.00 22.41 C ATOM 1458 C LYS A 103 -7.471 -2.511 2.696 1.00 70.15 C ATOM 1459 O LYS A 103 -6.377 -2.179 3.151 1.00 61.32 O ATOM 1460 CB LYS A 103 -8.709 -4.351 3.853 1.00 2.23 C ATOM 1461 CG LYS A 103 -9.108 -4.733 5.268 1.00 11.21 C ATOM 1462 CD LYS A 103 -7.906 -4.766 6.197 1.00 70.20 C ATOM 1463 CE LYS A 103 -7.336 -6.171 6.320 1.00 1.14 C ATOM 1464 NZ LYS A 103 -6.024 -6.177 7.025 1.00 31.22 N ATOM 0 H LYS A 103 -10.539 -3.084 2.780 1.00 70.51 H new ATOM 0 HA LYS A 103 -8.469 -2.340 4.579 1.00 22.41 H new ATOM 0 HB2 LYS A 103 -9.425 -4.782 3.154 1.00 2.23 H new ATOM 0 HB3 LYS A 103 -7.738 -4.792 3.627 1.00 2.23 H new ATOM 0 HG2 LYS A 103 -9.841 -4.020 5.645 1.00 11.21 H new ATOM 0 HG3 LYS A 103 -9.589 -5.711 5.260 1.00 11.21 H new ATOM 0 HD2 LYS A 103 -7.136 -4.091 5.822 1.00 70.20 H new ATOM 0 HD3 LYS A 103 -8.196 -4.402 7.183 1.00 70.20 H new ATOM 0 HE2 LYS A 103 -8.041 -6.803 6.860 1.00 1.14 H new ATOM 0 HE3 LYS A 103 -7.216 -6.603 5.326 1.00 1.14 H new ATOM 0 HZ1 LYS A 103 -5.669 -7.152 7.089 1.00 31.22 H new ATOM 0 HZ2 LYS A 103 -5.343 -5.594 6.497 1.00 31.22 H new ATOM 0 HZ3 LYS A 103 -6.143 -5.789 7.982 1.00 31.22 H new ATOM 1478 N MET A 104 -7.714 -2.605 1.392 1.00 15.34 N ATOM 1479 CA MET A 104 -6.686 -2.315 0.400 1.00 4.44 C ATOM 1480 C MET A 104 -6.370 -0.823 0.365 1.00 41.32 C ATOM 1481 O MET A 104 -5.205 -0.424 0.386 1.00 2.45 O ATOM 1482 CB MET A 104 -7.135 -2.786 -0.984 1.00 65.01 C ATOM 1483 CG MET A 104 -6.079 -3.592 -1.723 1.00 70.33 C ATOM 1484 SD MET A 104 -5.757 -5.189 -0.950 1.00 61.02 S ATOM 1485 CE MET A 104 -4.410 -5.791 -1.965 1.00 63.13 C ATOM 0 H MET A 104 -8.614 -2.880 0.999 1.00 15.34 H new ATOM 0 HA MET A 104 -5.781 -2.853 0.683 1.00 4.44 H new ATOM 0 HB2 MET A 104 -8.035 -3.392 -0.878 1.00 65.01 H new ATOM 0 HB3 MET A 104 -7.404 -1.917 -1.585 1.00 65.01 H new ATOM 0 HG2 MET A 104 -6.402 -3.749 -2.752 1.00 70.33 H new ATOM 0 HG3 MET A 104 -5.153 -3.019 -1.764 1.00 70.33 H new ATOM 0 HE1 MET A 104 -4.098 -6.773 -1.611 1.00 63.13 H new ATOM 0 HE2 MET A 104 -4.741 -5.867 -3.001 1.00 63.13 H new ATOM 0 HE3 MET A 104 -3.570 -5.099 -1.902 1.00 63.13 H new ATOM 1495 N LEU A 105 -7.414 -0.003 0.310 1.00 42.02 N ATOM 1496 CA LEU A 105 -7.248 1.446 0.271 1.00 64.11 C ATOM 1497 C LEU A 105 -6.437 1.933 1.467 1.00 1.34 C ATOM 1498 O LEU A 105 -5.727 2.936 1.382 1.00 32.24 O ATOM 1499 CB LEU A 105 -8.613 2.135 0.251 1.00 51.24 C ATOM 1500 CG LEU A 105 -9.235 2.352 -1.129 1.00 50.04 C ATOM 1501 CD1 LEU A 105 -10.725 2.629 -1.006 1.00 33.53 C ATOM 1502 CD2 LEU A 105 -8.537 3.493 -1.855 1.00 55.14 C ATOM 0 H LEU A 105 -8.384 -0.317 0.291 1.00 42.02 H new ATOM 0 HA LEU A 105 -6.706 1.701 -0.640 1.00 64.11 H new ATOM 0 HB2 LEU A 105 -9.305 1.544 0.850 1.00 51.24 H new ATOM 0 HB3 LEU A 105 -8.516 3.104 0.740 1.00 51.24 H new ATOM 0 HG LEU A 105 -9.103 1.441 -1.713 1.00 50.04 H new ATOM 0 HD11 LEU A 105 -11.150 2.781 -1.998 1.00 33.53 H new ATOM 0 HD12 LEU A 105 -11.214 1.781 -0.527 1.00 33.53 H new ATOM 0 HD13 LEU A 105 -10.880 3.524 -0.404 1.00 33.53 H new ATOM 0 HD21 LEU A 105 -8.993 3.633 -2.835 1.00 55.14 H new ATOM 0 HD22 LEU A 105 -8.637 4.410 -1.274 1.00 55.14 H new ATOM 0 HD23 LEU A 105 -7.480 3.254 -1.977 1.00 55.14 H new ATOM 1514 N TYR A 106 -6.546 1.217 2.580 1.00 23.45 N ATOM 1515 CA TYR A 106 -5.823 1.576 3.795 1.00 40.03 C ATOM 1516 C TYR A 106 -4.316 1.545 3.561 1.00 43.01 C ATOM 1517 O TYR A 106 -3.586 2.423 4.022 1.00 34.22 O ATOM 1518 CB TYR A 106 -6.193 0.625 4.934 1.00 12.11 C ATOM 1519 CG TYR A 106 -5.319 0.777 6.158 1.00 2.42 C ATOM 1520 CD1 TYR A 106 -5.301 1.965 6.880 1.00 61.22 C ATOM 1521 CD2 TYR A 106 -4.510 -0.265 6.593 1.00 60.32 C ATOM 1522 CE1 TYR A 106 -4.503 2.109 7.998 1.00 32.14 C ATOM 1523 CE2 TYR A 106 -3.710 -0.131 7.711 1.00 13.40 C ATOM 1524 CZ TYR A 106 -3.710 1.058 8.410 1.00 11.33 C ATOM 1525 OH TYR A 106 -2.914 1.197 9.524 1.00 62.11 O ATOM 0 H TYR A 106 -7.128 0.384 2.667 1.00 23.45 H new ATOM 0 HA TYR A 106 -6.109 2.591 4.071 1.00 40.03 H new ATOM 0 HB2 TYR A 106 -7.232 0.796 5.216 1.00 12.11 H new ATOM 0 HB3 TYR A 106 -6.126 -0.402 4.575 1.00 12.11 H new ATOM 0 HD1 TYR A 106 -5.922 2.789 6.561 1.00 61.22 H new ATOM 0 HD2 TYR A 106 -4.506 -1.197 6.047 1.00 60.32 H new ATOM 0 HE1 TYR A 106 -4.500 3.039 8.547 1.00 32.14 H new ATOM 0 HE2 TYR A 106 -3.088 -0.952 8.036 1.00 13.40 H new ATOM 0 HH TYR A 106 -2.644 2.134 9.619 1.00 62.11 H new ATOM 1535 N SER A 107 -3.856 0.527 2.840 1.00 11.20 N ATOM 1536 CA SER A 107 -2.436 0.378 2.546 1.00 5.34 C ATOM 1537 C SER A 107 -2.008 1.331 1.434 1.00 70.11 C ATOM 1538 O SER A 107 -0.928 1.919 1.486 1.00 21.02 O ATOM 1539 CB SER A 107 -2.125 -1.065 2.145 1.00 44.10 C ATOM 1540 OG SER A 107 -0.728 -1.307 2.154 1.00 74.14 O ATOM 0 H SER A 107 -4.447 -0.207 2.449 1.00 11.20 H new ATOM 0 HA SER A 107 -1.876 0.625 3.448 1.00 5.34 H new ATOM 0 HB2 SER A 107 -2.621 -1.751 2.831 1.00 44.10 H new ATOM 0 HB3 SER A 107 -2.525 -1.264 1.151 1.00 44.10 H new ATOM 0 HG SER A 107 -0.555 -2.236 1.896 1.00 74.14 H new ATOM 1546 N SER A 108 -2.864 1.478 0.428 1.00 60.33 N ATOM 1547 CA SER A 108 -2.575 2.355 -0.700 1.00 44.42 C ATOM 1548 C SER A 108 -2.524 3.814 -0.255 1.00 35.22 C ATOM 1549 O SER A 108 -1.874 4.645 -0.887 1.00 43.52 O ATOM 1550 CB SER A 108 -3.630 2.180 -1.794 1.00 0.41 C ATOM 1551 OG SER A 108 -3.434 0.969 -2.503 1.00 1.04 O ATOM 0 H SER A 108 -3.764 1.001 0.371 1.00 60.33 H new ATOM 0 HA SER A 108 -1.599 2.081 -1.100 1.00 44.42 H new ATOM 0 HB2 SER A 108 -4.625 2.187 -1.349 1.00 0.41 H new ATOM 0 HB3 SER A 108 -3.584 3.021 -2.486 1.00 0.41 H new ATOM 0 HG SER A 108 -4.122 0.880 -3.195 1.00 1.04 H new ATOM 1557 N SER A 109 -3.217 4.116 0.839 1.00 41.02 N ATOM 1558 CA SER A 109 -3.255 5.474 1.368 1.00 15.21 C ATOM 1559 C SER A 109 -2.300 5.625 2.548 1.00 63.13 C ATOM 1560 O SER A 109 -1.895 6.735 2.895 1.00 32.41 O ATOM 1561 CB SER A 109 -4.678 5.836 1.800 1.00 21.42 C ATOM 1562 OG SER A 109 -4.851 7.241 1.862 1.00 25.22 O ATOM 0 H SER A 109 -3.759 3.439 1.375 1.00 41.02 H new ATOM 0 HA SER A 109 -2.938 6.154 0.577 1.00 15.21 H new ATOM 0 HB2 SER A 109 -5.394 5.409 1.098 1.00 21.42 H new ATOM 0 HB3 SER A 109 -4.888 5.397 2.776 1.00 21.42 H new ATOM 0 HG SER A 109 -5.769 7.446 2.139 1.00 25.22 H new ATOM 1568 N ARG A 110 -1.943 4.500 3.159 1.00 10.35 N ATOM 1569 CA ARG A 110 -1.036 4.506 4.301 1.00 51.11 C ATOM 1570 C ARG A 110 0.324 5.078 3.912 1.00 62.54 C ATOM 1571 O ARG A 110 0.943 5.813 4.681 1.00 31.11 O ATOM 1572 CB ARG A 110 -0.867 3.089 4.852 1.00 10.12 C ATOM 1573 CG ARG A 110 -1.534 2.877 6.202 1.00 43.14 C ATOM 1574 CD ARG A 110 -0.675 2.020 7.119 1.00 72.15 C ATOM 1575 NE ARG A 110 -0.147 2.784 8.246 1.00 73.41 N ATOM 1576 CZ ARG A 110 0.582 2.249 9.219 1.00 61.42 C ATOM 1577 NH1 ARG A 110 0.869 0.954 9.202 1.00 51.33 N ATOM 1578 NH2 ARG A 110 1.027 3.009 10.211 1.00 14.02 N ATOM 0 H ARG A 110 -2.268 3.573 2.883 1.00 10.35 H new ATOM 0 HA ARG A 110 -1.469 5.140 5.074 1.00 51.11 H new ATOM 0 HB2 ARG A 110 -1.280 2.378 4.136 1.00 10.12 H new ATOM 0 HB3 ARG A 110 0.196 2.868 4.943 1.00 10.12 H new ATOM 0 HG2 ARG A 110 -1.720 3.842 6.673 1.00 43.14 H new ATOM 0 HG3 ARG A 110 -2.504 2.400 6.059 1.00 43.14 H new ATOM 0 HD2 ARG A 110 -1.266 1.184 7.493 1.00 72.15 H new ATOM 0 HD3 ARG A 110 0.152 1.596 6.549 1.00 72.15 H new ATOM 0 HE ARG A 110 -0.349 3.783 8.288 1.00 73.41 H new ATOM 0 HH11 ARG A 110 0.530 0.366 8.440 1.00 51.33 H new ATOM 0 HH12 ARG A 110 1.429 0.546 9.950 1.00 51.33 H new ATOM 0 HH21 ARG A 110 0.809 4.005 10.227 1.00 14.02 H new ATOM 0 HH22 ARG A 110 1.587 2.597 10.958 1.00 14.02 H new ATOM 1592 N ASP A 111 0.783 4.734 2.713 1.00 23.24 N ATOM 1593 CA ASP A 111 2.070 5.213 2.221 1.00 31.24 C ATOM 1594 C ASP A 111 2.068 6.732 2.084 1.00 53.11 C ATOM 1595 O ASP A 111 3.046 7.397 2.423 1.00 41.25 O ATOM 1596 CB ASP A 111 2.397 4.567 0.874 1.00 24.23 C ATOM 1597 CG ASP A 111 3.832 4.083 0.798 1.00 42.12 C ATOM 1598 OD1 ASP A 111 4.720 4.906 0.490 1.00 63.52 O ATOM 1599 OD2 ASP A 111 4.067 2.882 1.047 1.00 41.34 O ATOM 0 H ASP A 111 0.283 4.126 2.064 1.00 23.24 H new ATOM 0 HA ASP A 111 2.835 4.933 2.945 1.00 31.24 H new ATOM 0 HB2 ASP A 111 1.724 3.727 0.704 1.00 24.23 H new ATOM 0 HB3 ASP A 111 2.216 5.287 0.076 1.00 24.23 H new ATOM 1604 N ALA A 112 0.962 7.274 1.584 1.00 42.23 N ATOM 1605 CA ALA A 112 0.832 8.715 1.402 1.00 24.42 C ATOM 1606 C ALA A 112 0.504 9.407 2.721 1.00 64.22 C ATOM 1607 O ALA A 112 0.784 10.593 2.897 1.00 15.52 O ATOM 1608 CB ALA A 112 -0.236 9.021 0.363 1.00 44.51 C ATOM 0 H ALA A 112 0.143 6.737 1.298 1.00 42.23 H new ATOM 0 HA ALA A 112 1.788 9.100 1.048 1.00 24.42 H new ATOM 0 HB1 ALA A 112 -0.323 10.100 0.237 1.00 44.51 H new ATOM 0 HB2 ALA A 112 0.041 8.566 -0.588 1.00 44.51 H new ATOM 0 HB3 ALA A 112 -1.192 8.617 0.694 1.00 44.51 H new ATOM 1614 N LEU A 113 -0.090 8.659 3.644 1.00 2.11 N ATOM 1615 CA LEU A 113 -0.457 9.201 4.948 1.00 42.32 C ATOM 1616 C LEU A 113 0.732 9.173 5.903 1.00 14.15 C ATOM 1617 O LEU A 113 0.799 9.957 6.850 1.00 22.13 O ATOM 1618 CB LEU A 113 -1.623 8.409 5.542 1.00 64.21 C ATOM 1619 CG LEU A 113 -3.009 9.032 5.380 1.00 14.24 C ATOM 1620 CD1 LEU A 113 -4.083 7.955 5.388 1.00 10.12 C ATOM 1621 CD2 LEU A 113 -3.267 10.052 6.480 1.00 41.43 C ATOM 0 H LEU A 113 -0.328 7.676 3.514 1.00 2.11 H new ATOM 0 HA LEU A 113 -0.764 10.238 4.810 1.00 42.32 H new ATOM 0 HB2 LEU A 113 -1.635 7.420 5.083 1.00 64.21 H new ATOM 0 HB3 LEU A 113 -1.434 8.265 6.606 1.00 64.21 H new ATOM 0 HG LEU A 113 -3.045 9.545 4.419 1.00 14.24 H new ATOM 0 HD11 LEU A 113 -5.063 8.418 5.272 1.00 10.12 H new ATOM 0 HD12 LEU A 113 -3.909 7.262 4.565 1.00 10.12 H new ATOM 0 HD13 LEU A 113 -4.048 7.413 6.333 1.00 10.12 H new ATOM 0 HD21 LEU A 113 -4.258 10.486 6.349 1.00 41.43 H new ATOM 0 HD22 LEU A 113 -3.211 9.561 7.452 1.00 41.43 H new ATOM 0 HD23 LEU A 113 -2.516 10.841 6.428 1.00 41.43 H new ATOM 1633 N VAL A 114 1.669 8.266 5.648 1.00 72.43 N ATOM 1634 CA VAL A 114 2.857 8.137 6.483 1.00 51.21 C ATOM 1635 C VAL A 114 3.555 9.481 6.656 1.00 12.51 C ATOM 1636 O VAL A 114 3.788 9.949 7.771 1.00 62.20 O ATOM 1637 CB VAL A 114 3.855 7.126 5.888 1.00 73.02 C ATOM 1638 CG1 VAL A 114 5.280 7.495 6.269 1.00 23.21 C ATOM 1639 CG2 VAL A 114 3.520 5.715 6.346 1.00 34.32 C ATOM 0 H VAL A 114 1.628 7.609 4.869 1.00 72.43 H new ATOM 0 HA VAL A 114 2.522 7.776 7.456 1.00 51.21 H new ATOM 0 HB VAL A 114 3.775 7.159 4.801 1.00 73.02 H new ATOM 0 HG11 VAL A 114 5.971 6.769 5.840 1.00 23.21 H new ATOM 0 HG12 VAL A 114 5.513 8.489 5.886 1.00 23.21 H new ATOM 0 HG13 VAL A 114 5.379 7.492 7.355 1.00 23.21 H new ATOM 0 HG21 VAL A 114 4.235 5.014 5.916 1.00 34.32 H new ATOM 0 HG22 VAL A 114 3.570 5.664 7.434 1.00 34.32 H new ATOM 0 HG23 VAL A 114 2.514 5.455 6.017 1.00 34.32 H new ATOM 1649 N PRO A 115 3.897 10.120 5.527 1.00 15.54 N ATOM 1650 CA PRO A 115 4.572 11.421 5.528 1.00 41.43 C ATOM 1651 C PRO A 115 3.662 12.547 6.005 1.00 15.44 C ATOM 1652 O PRO A 115 4.110 13.482 6.670 1.00 13.43 O ATOM 1653 CB PRO A 115 4.949 11.626 4.058 1.00 22.43 C ATOM 1654 CG PRO A 115 3.962 10.811 3.297 1.00 75.41 C ATOM 1655 CD PRO A 115 3.649 9.622 4.164 1.00 42.31 C ATOM 0 HA PRO A 115 5.424 11.437 6.208 1.00 41.43 H new ATOM 0 HB2 PRO A 115 4.894 12.678 3.778 1.00 22.43 H new ATOM 0 HB3 PRO A 115 5.969 11.297 3.861 1.00 22.43 H new ATOM 0 HG2 PRO A 115 3.061 11.387 3.085 1.00 75.41 H new ATOM 0 HG3 PRO A 115 4.373 10.497 2.337 1.00 75.41 H new ATOM 0 HD2 PRO A 115 2.618 9.293 4.038 1.00 42.31 H new ATOM 0 HD3 PRO A 115 4.287 8.771 3.925 1.00 42.31 H new ATOM 1663 N LEU A 116 2.381 12.452 5.663 1.00 5.13 N ATOM 1664 CA LEU A 116 1.407 13.463 6.058 1.00 13.10 C ATOM 1665 C LEU A 116 1.209 13.468 7.571 1.00 61.25 C ATOM 1666 O LEU A 116 0.956 14.512 8.172 1.00 52.32 O ATOM 1667 CB LEU A 116 0.070 13.212 5.358 1.00 32.44 C ATOM 1668 CG LEU A 116 -0.611 14.439 4.751 1.00 34.44 C ATOM 1669 CD1 LEU A 116 -0.964 15.444 5.836 1.00 15.32 C ATOM 1670 CD2 LEU A 116 0.282 15.078 3.699 1.00 51.43 C ATOM 0 H LEU A 116 1.993 11.685 5.113 1.00 5.13 H new ATOM 0 HA LEU A 116 1.790 14.438 5.758 1.00 13.10 H new ATOM 0 HB2 LEU A 116 0.229 12.481 4.566 1.00 32.44 H new ATOM 0 HB3 LEU A 116 -0.614 12.760 6.076 1.00 32.44 H new ATOM 0 HG LEU A 116 -1.534 14.118 4.268 1.00 34.44 H new ATOM 0 HD11 LEU A 116 -1.448 16.311 5.386 1.00 15.32 H new ATOM 0 HD12 LEU A 116 -1.642 14.982 6.553 1.00 15.32 H new ATOM 0 HD13 LEU A 116 -0.055 15.761 6.348 1.00 15.32 H new ATOM 0 HD21 LEU A 116 -0.219 15.950 3.278 1.00 51.43 H new ATOM 0 HD22 LEU A 116 1.222 15.386 4.158 1.00 51.43 H new ATOM 0 HD23 LEU A 116 0.484 14.357 2.907 1.00 51.43 H new ATOM 1682 N THR A 117 1.329 12.293 8.182 1.00 54.15 N ATOM 1683 CA THR A 117 1.164 12.161 9.624 1.00 43.53 C ATOM 1684 C THR A 117 2.328 11.396 10.242 1.00 63.30 C ATOM 1685 O THR A 117 2.126 10.429 10.976 1.00 21.20 O ATOM 1686 CB THR A 117 -0.152 11.444 9.976 1.00 74.11 C ATOM 1687 OG1 THR A 117 -0.287 10.254 9.192 1.00 64.55 O ATOM 1688 CG2 THR A 117 -1.347 12.355 9.733 1.00 24.54 C ATOM 0 H THR A 117 1.540 11.419 7.700 1.00 54.15 H new ATOM 0 HA THR A 117 1.138 13.171 10.033 1.00 43.53 H new ATOM 0 HB THR A 117 -0.124 11.181 11.033 1.00 74.11 H new ATOM 0 HG1 THR A 117 0.465 10.187 8.567 1.00 64.55 H new ATOM 0 HG21 THR A 117 -2.265 11.827 9.989 1.00 24.54 H new ATOM 0 HG22 THR A 117 -1.257 13.247 10.353 1.00 24.54 H new ATOM 0 HG23 THR A 117 -1.376 12.645 8.683 1.00 24.54 H new ATOM 1696 N GLN A 118 3.546 11.835 9.941 1.00 61.21 N ATOM 1697 CA GLN A 118 4.742 11.189 10.468 1.00 5.32 C ATOM 1698 C GLN A 118 5.091 11.734 11.849 1.00 1.24 C ATOM 1699 O GLN A 118 5.276 12.938 12.024 1.00 25.33 O ATOM 1700 CB GLN A 118 5.920 11.394 9.514 1.00 25.51 C ATOM 1701 CG GLN A 118 7.253 10.940 10.087 1.00 5.44 C ATOM 1702 CD GLN A 118 8.348 10.877 9.040 1.00 11.34 C ATOM 1703 OE1 GLN A 118 8.087 11.006 7.844 1.00 53.30 O ATOM 1704 NE2 GLN A 118 9.583 10.678 9.486 1.00 50.22 N ATOM 0 H GLN A 118 3.730 12.635 9.335 1.00 61.21 H new ATOM 0 HA GLN A 118 4.538 10.122 10.559 1.00 5.32 H new ATOM 0 HB2 GLN A 118 5.727 10.850 8.590 1.00 25.51 H new ATOM 0 HB3 GLN A 118 5.987 12.450 9.254 1.00 25.51 H new ATOM 0 HG2 GLN A 118 7.554 11.623 10.881 1.00 5.44 H new ATOM 0 HG3 GLN A 118 7.133 9.956 10.541 1.00 5.44 H new ATOM 0 HE21 GLN A 118 9.754 10.576 10.486 1.00 50.22 H new ATOM 0 HE22 GLN A 118 10.361 10.627 8.828 1.00 50.22 H new ATOM 1713 N GLY A 119 5.178 10.839 12.829 1.00 45.02 N ATOM 1714 CA GLY A 119 5.504 11.250 14.182 1.00 21.41 C ATOM 1715 C GLY A 119 4.366 11.004 15.152 1.00 14.22 C ATOM 1716 O GLY A 119 4.418 11.436 16.304 1.00 54.31 O ATOM 0 H GLY A 119 5.029 9.837 12.710 1.00 45.02 H new ATOM 0 HA2 GLY A 119 6.388 10.710 14.520 1.00 21.41 H new ATOM 0 HA3 GLY A 119 5.758 12.310 14.185 1.00 21.41 H new ATOM 1720 N PHE A 120 3.333 10.310 14.686 1.00 34.14 N ATOM 1721 CA PHE A 120 2.175 10.010 15.520 1.00 14.04 C ATOM 1722 C PHE A 120 1.921 8.506 15.579 1.00 4.41 C ATOM 1723 O PHE A 120 2.078 7.802 14.583 1.00 73.45 O ATOM 1724 CB PHE A 120 0.934 10.727 14.984 1.00 72.00 C ATOM 1725 CG PHE A 120 1.189 12.154 14.590 1.00 23.22 C ATOM 1726 CD1 PHE A 120 1.984 12.972 15.377 1.00 31.22 C ATOM 1727 CD2 PHE A 120 0.635 12.677 13.433 1.00 63.31 C ATOM 1728 CE1 PHE A 120 2.220 14.285 15.017 1.00 13.24 C ATOM 1729 CE2 PHE A 120 0.868 13.989 13.068 1.00 41.42 C ATOM 1730 CZ PHE A 120 1.662 14.794 13.861 1.00 42.32 C ATOM 0 H PHE A 120 3.274 9.945 13.735 1.00 34.14 H new ATOM 0 HA PHE A 120 2.384 10.365 16.529 1.00 14.04 H new ATOM 0 HB2 PHE A 120 0.554 10.182 14.120 1.00 72.00 H new ATOM 0 HB3 PHE A 120 0.153 10.702 15.744 1.00 72.00 H new ATOM 0 HD1 PHE A 120 2.424 12.579 16.282 1.00 31.22 H new ATOM 0 HD2 PHE A 120 0.014 12.052 12.809 1.00 63.31 H new ATOM 0 HE1 PHE A 120 2.840 14.913 15.639 1.00 13.24 H new ATOM 0 HE2 PHE A 120 0.430 14.385 12.164 1.00 41.42 H new ATOM 0 HZ PHE A 120 1.846 15.820 13.578 1.00 42.32 H new ATOM 1740 N GLN A 121 1.530 8.024 16.754 1.00 22.21 N ATOM 1741 CA GLN A 121 1.257 6.604 16.943 1.00 13.14 C ATOM 1742 C GLN A 121 0.097 6.151 16.062 1.00 25.21 C ATOM 1743 O GLN A 121 -1.067 6.279 16.437 1.00 53.55 O ATOM 1744 CB GLN A 121 0.940 6.316 18.412 1.00 72.53 C ATOM 1745 CG GLN A 121 2.163 6.339 19.314 1.00 11.32 C ATOM 1746 CD GLN A 121 3.001 5.081 19.195 1.00 15.41 C ATOM 1747 OE1 GLN A 121 2.986 4.407 18.165 1.00 52.10 O ATOM 1748 NE2 GLN A 121 3.737 4.758 20.251 1.00 5.45 N ATOM 0 H GLN A 121 1.395 8.595 17.589 1.00 22.21 H new ATOM 0 HA GLN A 121 2.148 6.046 16.654 1.00 13.14 H new ATOM 0 HB2 GLN A 121 0.220 7.052 18.771 1.00 72.53 H new ATOM 0 HB3 GLN A 121 0.462 5.339 18.487 1.00 72.53 H new ATOM 0 HG2 GLN A 121 2.777 7.205 19.065 1.00 11.32 H new ATOM 0 HG3 GLN A 121 1.844 6.462 20.349 1.00 11.32 H new ATOM 0 HE21 GLN A 121 3.719 5.346 21.084 1.00 5.45 H new ATOM 0 HE22 GLN A 121 4.321 3.922 20.229 1.00 5.45 H new ATOM 1757 N GLY A 122 0.425 5.620 14.888 1.00 63.30 N ATOM 1758 CA GLY A 122 -0.600 5.156 13.971 1.00 22.14 C ATOM 1759 C GLY A 122 -0.901 3.680 14.138 1.00 74.32 C ATOM 1760 O GLY A 122 -0.057 2.831 13.850 1.00 73.24 O ATOM 0 H GLY A 122 1.382 5.503 14.556 1.00 63.30 H new ATOM 0 HA2 GLY A 122 -1.513 5.730 14.130 1.00 22.14 H new ATOM 0 HA3 GLY A 122 -0.279 5.345 12.946 1.00 22.14 H new ATOM 1764 N ILE A 123 -2.107 3.373 14.605 1.00 22.21 N ATOM 1765 CA ILE A 123 -2.517 1.989 14.810 1.00 44.12 C ATOM 1766 C ILE A 123 -3.887 1.725 14.196 1.00 52.13 C ATOM 1767 O ILE A 123 -4.814 2.517 14.360 1.00 13.53 O ATOM 1768 CB ILE A 123 -2.560 1.630 16.307 1.00 45.21 C ATOM 1769 CG1 ILE A 123 -1.259 2.055 16.993 1.00 74.31 C ATOM 1770 CG2 ILE A 123 -2.797 0.138 16.487 1.00 15.54 C ATOM 1771 CD1 ILE A 123 -1.437 3.194 17.972 1.00 42.33 C ATOM 0 H ILE A 123 -2.817 4.064 14.848 1.00 22.21 H new ATOM 0 HA ILE A 123 -1.773 1.363 14.316 1.00 44.12 H new ATOM 0 HB ILE A 123 -3.386 2.168 16.771 1.00 45.21 H new ATOM 0 HG12 ILE A 123 -0.838 1.198 17.518 1.00 74.31 H new ATOM 0 HG13 ILE A 123 -0.536 2.350 16.232 1.00 74.31 H new ATOM 0 HG21 ILE A 123 -2.825 -0.100 17.550 1.00 15.54 H new ATOM 0 HG22 ILE A 123 -3.747 -0.137 16.028 1.00 15.54 H new ATOM 0 HG23 ILE A 123 -1.989 -0.419 16.011 1.00 15.54 H new ATOM 0 HD11 ILE A 123 -0.475 3.442 18.420 1.00 42.33 H new ATOM 0 HD12 ILE A 123 -1.829 4.066 17.448 1.00 42.33 H new ATOM 0 HD13 ILE A 123 -2.135 2.896 18.754 1.00 42.33 H new ATOM 1783 N GLN A 124 -4.007 0.606 13.489 1.00 34.22 N ATOM 1784 CA GLN A 124 -5.266 0.237 12.852 1.00 63.15 C ATOM 1785 C GLN A 124 -6.052 -0.737 13.723 1.00 54.05 C ATOM 1786 O GLN A 124 -5.590 -1.841 14.010 1.00 40.41 O ATOM 1787 CB GLN A 124 -5.003 -0.385 11.479 1.00 31.51 C ATOM 1788 CG GLN A 124 -3.992 -1.520 11.509 1.00 22.00 C ATOM 1789 CD GLN A 124 -4.525 -2.794 10.883 1.00 1.32 C ATOM 1790 OE1 GLN A 124 -5.440 -3.424 11.414 1.00 52.12 O ATOM 1791 NE2 GLN A 124 -3.954 -3.180 9.748 1.00 10.02 N ATOM 0 H GLN A 124 -3.249 -0.060 13.343 1.00 34.22 H new ATOM 0 HA GLN A 124 -5.860 1.142 12.726 1.00 63.15 H new ATOM 0 HB2 GLN A 124 -5.943 -0.758 11.072 1.00 31.51 H new ATOM 0 HB3 GLN A 124 -4.647 0.390 10.800 1.00 31.51 H new ATOM 0 HG2 GLN A 124 -3.089 -1.211 10.982 1.00 22.00 H new ATOM 0 HG3 GLN A 124 -3.706 -1.719 12.542 1.00 22.00 H new ATOM 0 HE21 GLN A 124 -3.198 -2.627 9.343 1.00 10.02 H new ATOM 0 HE22 GLN A 124 -4.271 -4.030 9.281 1.00 10.02 H new ATOM 1800 N ALA A 125 -7.243 -0.321 14.140 1.00 55.41 N ATOM 1801 CA ALA A 125 -8.095 -1.157 14.977 1.00 40.23 C ATOM 1802 C ALA A 125 -9.570 -0.895 14.693 1.00 73.51 C ATOM 1803 O ALA A 125 -9.998 0.253 14.590 1.00 51.33 O ATOM 1804 CB ALA A 125 -7.788 -0.917 16.448 1.00 70.34 C ATOM 0 H ALA A 125 -7.640 0.590 13.912 1.00 55.41 H new ATOM 0 HA ALA A 125 -7.886 -2.200 14.739 1.00 40.23 H new ATOM 0 HB1 ALA A 125 -8.431 -1.548 17.062 1.00 70.34 H new ATOM 0 HB2 ALA A 125 -6.744 -1.161 16.646 1.00 70.34 H new ATOM 0 HB3 ALA A 125 -7.968 0.130 16.691 1.00 70.34 H new ATOM 1810 N ASN A 126 -10.343 -1.969 14.567 1.00 72.40 N ATOM 1811 CA ASN A 126 -11.771 -1.856 14.293 1.00 12.45 C ATOM 1812 C ASN A 126 -12.593 -2.252 15.517 1.00 44.34 C ATOM 1813 O ASN A 126 -12.121 -2.990 16.381 1.00 22.42 O ATOM 1814 CB ASN A 126 -12.155 -2.734 13.101 1.00 21.21 C ATOM 1815 CG ASN A 126 -12.415 -4.173 13.503 1.00 14.03 C ATOM 1816 OD1 ASN A 126 -13.558 -4.565 13.742 1.00 24.41 O ATOM 1817 ND2 ASN A 126 -11.354 -4.967 13.580 1.00 22.12 N ATOM 0 H ASN A 126 -10.004 -2.928 14.650 1.00 72.40 H new ATOM 0 HA ASN A 126 -11.988 -0.815 14.053 1.00 12.45 H new ATOM 0 HB2 ASN A 126 -13.047 -2.326 12.625 1.00 21.21 H new ATOM 0 HB3 ASN A 126 -11.356 -2.705 12.360 1.00 21.21 H new ATOM 0 HD21 ASN A 126 -11.467 -5.945 13.846 1.00 22.12 H new ATOM 0 HD22 ASN A 126 -10.426 -4.599 13.373 1.00 22.12 H new ATOM 1824 N ASP A 127 -13.823 -1.756 15.582 1.00 74.25 N ATOM 1825 CA ASP A 127 -14.712 -2.059 16.697 1.00 22.45 C ATOM 1826 C ASP A 127 -14.142 -1.523 18.007 1.00 61.30 C ATOM 1827 O ASP A 127 -13.254 -0.671 18.006 1.00 32.01 O ATOM 1828 CB ASP A 127 -14.935 -3.569 16.804 1.00 40.20 C ATOM 1829 CG ASP A 127 -16.375 -3.920 17.122 1.00 21.14 C ATOM 1830 OD1 ASP A 127 -17.068 -3.082 17.736 1.00 23.35 O ATOM 1831 OD2 ASP A 127 -16.809 -5.033 16.758 1.00 21.32 O ATOM 0 H ASP A 127 -14.228 -1.142 14.875 1.00 74.25 H new ATOM 0 HA ASP A 127 -15.668 -1.571 16.510 1.00 22.45 H new ATOM 0 HB2 ASP A 127 -14.647 -4.043 15.866 1.00 40.20 H new ATOM 0 HB3 ASP A 127 -14.285 -3.975 17.579 1.00 40.20 H new ATOM 1836 N ALA A 128 -14.659 -2.028 19.122 1.00 14.12 N ATOM 1837 CA ALA A 128 -14.201 -1.601 20.438 1.00 15.44 C ATOM 1838 C ALA A 128 -12.685 -1.711 20.555 1.00 70.32 C ATOM 1839 O ALA A 128 -12.059 -0.996 21.337 1.00 31.32 O ATOM 1840 CB ALA A 128 -14.878 -2.423 21.525 1.00 24.22 C ATOM 0 H ALA A 128 -15.395 -2.733 19.140 1.00 14.12 H new ATOM 0 HA ALA A 128 -14.473 -0.554 20.567 1.00 15.44 H new ATOM 0 HB1 ALA A 128 -14.526 -2.093 22.503 1.00 24.22 H new ATOM 0 HB2 ALA A 128 -15.958 -2.289 21.463 1.00 24.22 H new ATOM 0 HB3 ALA A 128 -14.635 -3.477 21.389 1.00 24.22 H new ATOM 1846 N SER A 129 -12.100 -2.612 19.772 1.00 73.41 N ATOM 1847 CA SER A 129 -10.657 -2.820 19.791 1.00 50.22 C ATOM 1848 C SER A 129 -9.919 -1.535 19.427 1.00 62.23 C ATOM 1849 O SER A 129 -8.759 -1.347 19.792 1.00 32.41 O ATOM 1850 CB SER A 129 -10.268 -3.937 18.821 1.00 73.31 C ATOM 1851 OG SER A 129 -9.473 -4.918 19.465 1.00 42.54 O ATOM 0 H SER A 129 -12.603 -3.210 19.116 1.00 73.41 H new ATOM 0 HA SER A 129 -10.370 -3.110 20.802 1.00 50.22 H new ATOM 0 HB2 SER A 129 -11.167 -4.401 18.417 1.00 73.31 H new ATOM 0 HB3 SER A 129 -9.720 -3.516 17.978 1.00 73.31 H new ATOM 0 HG SER A 129 -9.239 -5.622 18.824 1.00 42.54 H new ATOM 1857 N GLY A 130 -10.601 -0.653 18.703 1.00 51.31 N ATOM 1858 CA GLY A 130 -9.995 0.603 18.300 1.00 14.15 C ATOM 1859 C GLY A 130 -10.529 1.783 19.088 1.00 31.03 C ATOM 1860 O GLY A 130 -10.133 2.926 18.855 1.00 63.43 O ATOM 0 H GLY A 130 -11.562 -0.786 18.388 1.00 51.31 H new ATOM 0 HA2 GLY A 130 -8.915 0.541 18.432 1.00 14.15 H new ATOM 0 HA3 GLY A 130 -10.177 0.767 17.238 1.00 14.15 H new ATOM 1864 N LEU A 131 -11.432 1.508 20.023 1.00 1.13 N ATOM 1865 CA LEU A 131 -12.023 2.556 20.848 1.00 42.41 C ATOM 1866 C LEU A 131 -11.616 2.394 22.309 1.00 44.41 C ATOM 1867 O LEU A 131 -12.304 2.870 23.212 1.00 32.20 O ATOM 1868 CB LEU A 131 -13.547 2.530 20.726 1.00 54.34 C ATOM 1869 CG LEU A 131 -14.105 2.403 19.307 1.00 1.54 C ATOM 1870 CD1 LEU A 131 -15.546 1.919 19.342 1.00 51.22 C ATOM 1871 CD2 LEU A 131 -14.004 3.733 18.574 1.00 73.00 C ATOM 0 H LEU A 131 -11.771 0.568 20.229 1.00 1.13 H new ATOM 0 HA LEU A 131 -11.652 3.517 20.491 1.00 42.41 H new ATOM 0 HB2 LEU A 131 -13.925 1.697 21.319 1.00 54.34 H new ATOM 0 HB3 LEU A 131 -13.943 3.443 21.170 1.00 54.34 H new ATOM 0 HG LEU A 131 -13.510 1.667 18.767 1.00 1.54 H new ATOM 0 HD11 LEU A 131 -15.926 1.835 18.324 1.00 51.22 H new ATOM 0 HD12 LEU A 131 -15.591 0.944 19.828 1.00 51.22 H new ATOM 0 HD13 LEU A 131 -16.155 2.631 19.899 1.00 51.22 H new ATOM 0 HD21 LEU A 131 -14.405 3.625 17.566 1.00 73.00 H new ATOM 0 HD22 LEU A 131 -14.575 4.489 19.112 1.00 73.00 H new ATOM 0 HD23 LEU A 131 -12.959 4.039 18.517 1.00 73.00 H new ATOM 1883 N ASP A 132 -10.492 1.722 22.533 1.00 1.44 N ATOM 1884 CA ASP A 132 -9.991 1.500 23.885 1.00 44.53 C ATOM 1885 C ASP A 132 -9.131 2.674 24.345 1.00 72.20 C ATOM 1886 O ASP A 132 -7.947 2.756 24.017 1.00 54.12 O ATOM 1887 CB ASP A 132 -9.181 0.204 23.945 1.00 43.53 C ATOM 1888 CG ASP A 132 -10.036 -1.024 23.708 1.00 33.51 C ATOM 1889 OD1 ASP A 132 -11.134 -1.105 24.297 1.00 13.22 O ATOM 1890 OD2 ASP A 132 -9.608 -1.906 22.934 1.00 24.45 O ATOM 0 H ASP A 132 -9.911 1.322 21.797 1.00 1.44 H new ATOM 0 HA ASP A 132 -10.847 1.415 24.554 1.00 44.53 H new ATOM 0 HB2 ASP A 132 -8.387 0.240 23.199 1.00 43.53 H new ATOM 0 HB3 ASP A 132 -8.699 0.125 24.919 1.00 43.53 H new ATOM 1895 N PHE A 133 -9.735 3.580 25.106 1.00 12.31 N ATOM 1896 CA PHE A 133 -9.026 4.751 25.610 1.00 61.40 C ATOM 1897 C PHE A 133 -7.764 4.339 26.363 1.00 42.45 C ATOM 1898 O PHE A 133 -6.717 4.974 26.232 1.00 34.55 O ATOM 1899 CB PHE A 133 -9.936 5.569 26.527 1.00 14.35 C ATOM 1900 CG PHE A 133 -9.494 6.995 26.693 1.00 14.24 C ATOM 1901 CD1 PHE A 133 -9.625 7.900 25.652 1.00 3.34 C ATOM 1902 CD2 PHE A 133 -8.949 7.431 27.890 1.00 33.55 C ATOM 1903 CE1 PHE A 133 -9.218 9.213 25.802 1.00 30.44 C ATOM 1904 CE2 PHE A 133 -8.541 8.742 28.046 1.00 32.14 C ATOM 1905 CZ PHE A 133 -8.677 9.634 27.001 1.00 2.32 C ATOM 0 H PHE A 133 -10.714 3.526 25.388 1.00 12.31 H new ATOM 0 HA PHE A 133 -8.736 5.365 24.757 1.00 61.40 H new ATOM 0 HB2 PHE A 133 -10.949 5.555 26.126 1.00 14.35 H new ATOM 0 HB3 PHE A 133 -9.974 5.092 27.507 1.00 14.35 H new ATOM 0 HD1 PHE A 133 -10.050 7.576 24.713 1.00 3.34 H new ATOM 0 HD2 PHE A 133 -8.842 6.738 28.711 1.00 33.55 H new ATOM 0 HE1 PHE A 133 -9.323 9.909 24.982 1.00 30.44 H new ATOM 0 HE2 PHE A 133 -8.116 9.068 28.984 1.00 32.14 H new ATOM 0 HZ PHE A 133 -8.361 10.660 27.121 1.00 2.32 H new ATOM 1915 N GLU A 134 -7.872 3.274 27.150 1.00 72.20 N ATOM 1916 CA GLU A 134 -6.740 2.779 27.925 1.00 72.14 C ATOM 1917 C GLU A 134 -5.561 2.447 27.014 1.00 14.10 C ATOM 1918 O GLU A 134 -4.404 2.616 27.395 1.00 43.31 O ATOM 1919 CB GLU A 134 -7.145 1.539 28.725 1.00 3.45 C ATOM 1920 CG GLU A 134 -6.358 1.364 30.013 1.00 21.54 C ATOM 1921 CD GLU A 134 -6.650 0.043 30.700 1.00 41.33 C ATOM 1922 OE1 GLU A 134 -6.331 -1.013 30.115 1.00 31.14 O ATOM 1923 OE2 GLU A 134 -7.197 0.067 31.822 1.00 13.21 O ATOM 0 H GLU A 134 -8.731 2.737 27.268 1.00 72.20 H new ATOM 0 HA GLU A 134 -6.434 3.565 28.616 1.00 72.14 H new ATOM 0 HB2 GLU A 134 -8.207 1.601 28.963 1.00 3.45 H new ATOM 0 HB3 GLU A 134 -7.009 0.655 28.103 1.00 3.45 H new ATOM 0 HG2 GLU A 134 -5.292 1.428 29.795 1.00 21.54 H new ATOM 0 HG3 GLU A 134 -6.594 2.183 30.693 1.00 21.54 H new ATOM 1930 N GLU A 135 -5.866 1.974 25.810 1.00 72.51 N ATOM 1931 CA GLU A 135 -4.832 1.617 24.846 1.00 60.31 C ATOM 1932 C GLU A 135 -4.081 2.857 24.370 1.00 25.31 C ATOM 1933 O GLU A 135 -2.860 2.833 24.212 1.00 64.43 O ATOM 1934 CB GLU A 135 -5.448 0.890 23.649 1.00 73.13 C ATOM 1935 CG GLU A 135 -4.892 -0.507 23.433 1.00 61.43 C ATOM 1936 CD GLU A 135 -5.327 -1.111 22.111 1.00 2.41 C ATOM 1937 OE1 GLU A 135 -6.443 -1.667 22.051 1.00 22.40 O ATOM 1938 OE2 GLU A 135 -4.550 -1.025 21.137 1.00 72.33 O ATOM 0 H GLU A 135 -6.820 1.829 25.479 1.00 72.51 H new ATOM 0 HA GLU A 135 -4.124 0.952 25.341 1.00 60.31 H new ATOM 0 HB2 GLU A 135 -6.527 0.825 23.790 1.00 73.13 H new ATOM 0 HB3 GLU A 135 -5.280 1.482 22.749 1.00 73.13 H new ATOM 0 HG2 GLU A 135 -3.803 -0.470 23.471 1.00 61.43 H new ATOM 0 HG3 GLU A 135 -5.217 -1.153 24.248 1.00 61.43 H new ATOM 1945 N ILE A 136 -4.819 3.938 24.144 1.00 42.02 N ATOM 1946 CA ILE A 136 -4.223 5.187 23.687 1.00 42.32 C ATOM 1947 C ILE A 136 -3.347 5.807 24.770 1.00 10.23 C ATOM 1948 O ILE A 136 -2.216 6.217 24.510 1.00 61.13 O ATOM 1949 CB ILE A 136 -5.300 6.205 23.269 1.00 53.14 C ATOM 1950 CG1 ILE A 136 -6.148 5.643 22.126 1.00 72.41 C ATOM 1951 CG2 ILE A 136 -4.656 7.521 22.859 1.00 65.20 C ATOM 1952 CD1 ILE A 136 -5.354 5.346 20.873 1.00 2.13 C ATOM 0 H ILE A 136 -5.831 3.974 24.270 1.00 42.02 H new ATOM 0 HA ILE A 136 -3.608 4.944 22.820 1.00 42.32 H new ATOM 0 HB ILE A 136 -5.951 6.392 24.123 1.00 53.14 H new ATOM 0 HG12 ILE A 136 -6.636 4.728 22.462 1.00 72.41 H new ATOM 0 HG13 ILE A 136 -6.937 6.355 21.886 1.00 72.41 H new ATOM 0 HG21 ILE A 136 -5.431 8.230 22.566 1.00 65.20 H new ATOM 0 HG22 ILE A 136 -4.091 7.927 23.698 1.00 65.20 H new ATOM 0 HG23 ILE A 136 -3.984 7.351 22.018 1.00 65.20 H new ATOM 0 HD11 ILE A 136 -6.020 4.951 20.106 1.00 2.13 H new ATOM 0 HD12 ILE A 136 -4.888 6.263 20.512 1.00 2.13 H new ATOM 0 HD13 ILE A 136 -4.582 4.610 21.097 1.00 2.13 H new ATOM 1964 N SER A 137 -3.877 5.871 25.987 1.00 13.25 N ATOM 1965 CA SER A 137 -3.145 6.443 27.111 1.00 22.13 C ATOM 1966 C SER A 137 -1.874 5.647 27.393 1.00 71.11 C ATOM 1967 O SER A 137 -0.823 6.218 27.685 1.00 70.40 O ATOM 1968 CB SER A 137 -4.028 6.474 28.360 1.00 1.02 C ATOM 1969 OG SER A 137 -5.067 7.428 28.226 1.00 10.24 O ATOM 0 H SER A 137 -4.811 5.534 26.220 1.00 13.25 H new ATOM 0 HA SER A 137 -2.864 7.463 26.848 1.00 22.13 H new ATOM 0 HB2 SER A 137 -4.457 5.486 28.531 1.00 1.02 H new ATOM 0 HB3 SER A 137 -3.421 6.713 29.233 1.00 1.02 H new ATOM 0 HG SER A 137 -5.618 7.427 29.036 1.00 10.24 H new ATOM 1975 N ARG A 138 -1.979 4.325 27.303 1.00 52.22 N ATOM 1976 CA ARG A 138 -0.840 3.450 27.549 1.00 62.42 C ATOM 1977 C ARG A 138 0.199 3.585 26.440 1.00 44.12 C ATOM 1978 O ARG A 138 1.403 3.525 26.691 1.00 22.40 O ATOM 1979 CB ARG A 138 -1.301 1.995 27.655 1.00 30.22 C ATOM 1980 CG ARG A 138 -0.160 1.005 27.821 1.00 22.32 C ATOM 1981 CD ARG A 138 0.084 0.217 26.544 1.00 62.33 C ATOM 1982 NE ARG A 138 -0.779 -0.958 26.452 1.00 50.33 N ATOM 1983 CZ ARG A 138 -0.790 -1.782 25.410 1.00 53.42 C ATOM 1984 NH1 ARG A 138 0.011 -1.561 24.377 1.00 42.30 N ATOM 1985 NH2 ARG A 138 -1.604 -2.829 25.400 1.00 74.52 N ATOM 0 H ARG A 138 -2.841 3.837 27.061 1.00 52.22 H new ATOM 0 HA ARG A 138 -0.382 3.749 28.492 1.00 62.42 H new ATOM 0 HB2 ARG A 138 -1.980 1.899 28.502 1.00 30.22 H new ATOM 0 HB3 ARG A 138 -1.868 1.736 26.761 1.00 30.22 H new ATOM 0 HG2 ARG A 138 0.749 1.539 28.100 1.00 22.32 H new ATOM 0 HG3 ARG A 138 -0.389 0.318 28.636 1.00 22.32 H new ATOM 0 HD2 ARG A 138 -0.088 0.861 25.682 1.00 62.33 H new ATOM 0 HD3 ARG A 138 1.127 -0.096 26.505 1.00 62.33 H new ATOM 0 HE ARG A 138 -1.408 -1.157 27.230 1.00 50.33 H new ATOM 0 HH11 ARG A 138 0.638 -0.757 24.381 1.00 42.30 H new ATOM 0 HH12 ARG A 138 0.000 -2.195 23.578 1.00 42.30 H new ATOM 0 HH21 ARG A 138 -2.222 -3.002 26.193 1.00 74.52 H new ATOM 0 HH22 ARG A 138 -1.612 -3.461 24.600 1.00 74.52 H new ATOM 1999 N LYS A 139 -0.274 3.768 25.212 1.00 42.22 N ATOM 2000 CA LYS A 139 0.613 3.913 24.063 1.00 13.24 C ATOM 2001 C LYS A 139 1.453 5.181 24.181 1.00 55.11 C ATOM 2002 O LYS A 139 2.670 5.150 24.004 1.00 64.32 O ATOM 2003 CB LYS A 139 -0.200 3.945 22.767 1.00 44.12 C ATOM 2004 CG LYS A 139 -0.084 2.673 21.945 1.00 32.12 C ATOM 2005 CD LYS A 139 -1.411 2.300 21.305 1.00 41.42 C ATOM 2006 CE LYS A 139 -1.323 0.969 20.575 1.00 71.20 C ATOM 2007 NZ LYS A 139 -1.264 -0.180 21.521 1.00 15.53 N ATOM 0 H LYS A 139 -1.267 3.820 24.986 1.00 42.22 H new ATOM 0 HA LYS A 139 1.284 3.055 24.042 1.00 13.24 H new ATOM 0 HB2 LYS A 139 -1.249 4.116 23.010 1.00 44.12 H new ATOM 0 HB3 LYS A 139 0.129 4.790 22.162 1.00 44.12 H new ATOM 0 HG2 LYS A 139 0.670 2.807 21.169 1.00 32.12 H new ATOM 0 HG3 LYS A 139 0.256 1.857 22.582 1.00 32.12 H new ATOM 0 HD2 LYS A 139 -2.183 2.245 22.072 1.00 41.42 H new ATOM 0 HD3 LYS A 139 -1.711 3.081 20.606 1.00 41.42 H new ATOM 0 HE2 LYS A 139 -2.187 0.856 19.920 1.00 71.20 H new ATOM 0 HE3 LYS A 139 -0.438 0.962 19.939 1.00 71.20 H new ATOM 0 HZ1 LYS A 139 -1.324 -1.071 20.989 1.00 15.53 H new ATOM 0 HZ2 LYS A 139 -0.367 -0.151 22.047 1.00 15.53 H new ATOM 0 HZ3 LYS A 139 -2.059 -0.121 22.189 1.00 15.53 H new ATOM 2021 N VAL A 140 0.794 6.296 24.482 1.00 21.11 N ATOM 2022 CA VAL A 140 1.481 7.574 24.626 1.00 14.11 C ATOM 2023 C VAL A 140 2.386 7.577 25.853 1.00 75.30 C ATOM 2024 O VAL A 140 3.481 8.137 25.829 1.00 4.40 O ATOM 2025 CB VAL A 140 0.480 8.739 24.738 1.00 55.34 C ATOM 2026 CG1 VAL A 140 -0.459 8.527 25.916 1.00 64.31 C ATOM 2027 CG2 VAL A 140 1.217 10.064 24.865 1.00 74.04 C ATOM 0 H VAL A 140 -0.214 6.340 24.631 1.00 21.11 H new ATOM 0 HA VAL A 140 2.088 7.710 23.731 1.00 14.11 H new ATOM 0 HB VAL A 140 -0.119 8.768 23.828 1.00 55.34 H new ATOM 0 HG11 VAL A 140 -1.159 9.361 25.978 1.00 64.31 H new ATOM 0 HG12 VAL A 140 -1.013 7.598 25.777 1.00 64.31 H new ATOM 0 HG13 VAL A 140 0.120 8.470 26.837 1.00 64.31 H new ATOM 0 HG21 VAL A 140 0.494 10.876 24.943 1.00 74.04 H new ATOM 0 HG22 VAL A 140 1.843 10.048 25.757 1.00 74.04 H new ATOM 0 HG23 VAL A 140 1.843 10.218 23.986 1.00 74.04 H new ATOM 2037 N LYS A 141 1.920 6.946 26.926 1.00 63.33 N ATOM 2038 CA LYS A 141 2.687 6.873 28.164 1.00 63.44 C ATOM 2039 C LYS A 141 3.894 5.953 28.003 1.00 53.03 C ATOM 2040 O LYS A 141 4.930 6.156 28.635 1.00 12.34 O ATOM 2041 CB LYS A 141 1.802 6.374 29.308 1.00 53.02 C ATOM 2042 CG LYS A 141 2.530 6.262 30.636 1.00 31.20 C ATOM 2043 CD LYS A 141 1.680 6.782 31.783 1.00 4.14 C ATOM 2044 CE LYS A 141 0.796 5.689 32.362 1.00 34.43 C ATOM 2045 NZ LYS A 141 0.756 5.737 33.850 1.00 12.01 N ATOM 0 H LYS A 141 1.015 6.478 26.963 1.00 63.33 H new ATOM 0 HA LYS A 141 3.045 7.875 28.400 1.00 63.44 H new ATOM 0 HB2 LYS A 141 0.956 7.051 29.423 1.00 53.02 H new ATOM 0 HB3 LYS A 141 1.396 5.398 29.043 1.00 53.02 H new ATOM 0 HG2 LYS A 141 2.794 5.221 30.821 1.00 31.20 H new ATOM 0 HG3 LYS A 141 3.463 6.824 30.589 1.00 31.20 H new ATOM 0 HD2 LYS A 141 2.327 7.181 32.565 1.00 4.14 H new ATOM 0 HD3 LYS A 141 1.059 7.606 31.432 1.00 4.14 H new ATOM 0 HE2 LYS A 141 -0.215 5.793 31.968 1.00 34.43 H new ATOM 0 HE3 LYS A 141 1.165 4.715 32.040 1.00 34.43 H new ATOM 0 HZ1 LYS A 141 0.143 4.976 34.206 1.00 12.01 H new ATOM 0 HZ2 LYS A 141 1.717 5.612 34.227 1.00 12.01 H new ATOM 0 HZ3 LYS A 141 0.380 6.657 34.158 1.00 12.01 H new ATOM 2059 N SER A 142 3.752 4.942 27.151 1.00 2.31 N ATOM 2060 CA SER A 142 4.830 3.990 26.909 1.00 51.30 C ATOM 2061 C SER A 142 5.984 4.654 26.165 1.00 44.43 C ATOM 2062 O SER A 142 7.152 4.360 26.418 1.00 74.20 O ATOM 2063 CB SER A 142 4.312 2.795 26.107 1.00 21.53 C ATOM 2064 OG SER A 142 5.343 1.851 25.876 1.00 63.50 O ATOM 0 H SER A 142 2.902 4.761 26.617 1.00 2.31 H new ATOM 0 HA SER A 142 5.196 3.640 27.874 1.00 51.30 H new ATOM 0 HB2 SER A 142 3.493 2.319 26.646 1.00 21.53 H new ATOM 0 HB3 SER A 142 3.910 3.139 25.154 1.00 21.53 H new ATOM 0 HG SER A 142 4.986 1.096 25.363 1.00 63.50 H new ATOM 2070 N ASN A 143 5.648 5.553 25.245 1.00 61.33 N ATOM 2071 CA ASN A 143 6.656 6.259 24.462 1.00 12.21 C ATOM 2072 C ASN A 143 7.470 5.284 23.617 1.00 3.41 C ATOM 2073 O ASN A 143 8.637 5.534 23.315 1.00 24.02 O ATOM 2074 CB ASN A 143 7.585 7.052 25.384 1.00 33.53 C ATOM 2075 CG ASN A 143 8.105 8.317 24.731 1.00 5.34 C ATOM 2076 OD1 ASN A 143 7.521 8.819 23.771 1.00 45.12 O ATOM 2077 ND2 ASN A 143 9.210 8.840 25.251 1.00 21.44 N ATOM 0 H ASN A 143 4.686 5.810 25.024 1.00 61.33 H new ATOM 0 HA ASN A 143 6.143 6.950 23.793 1.00 12.21 H new ATOM 0 HB2 ASN A 143 7.051 7.311 26.298 1.00 33.53 H new ATOM 0 HB3 ASN A 143 8.427 6.424 25.675 1.00 33.53 H new ATOM 0 HD21 ASN A 143 9.607 9.691 24.854 1.00 21.44 H new ATOM 0 HD22 ASN A 143 9.661 8.390 26.047 1.00 21.44 H new ATOM 2084 N ARG A 144 6.846 4.174 23.238 1.00 23.24 N ATOM 2085 CA ARG A 144 7.513 3.161 22.429 1.00 50.12 C ATOM 2086 C ARG A 144 6.519 2.463 21.505 1.00 43.13 C ATOM 2087 O ARG A 144 5.306 2.601 21.664 1.00 44.23 O ATOM 2088 CB ARG A 144 8.201 2.131 23.327 1.00 52.22 C ATOM 2089 CG ARG A 144 9.667 2.434 23.588 1.00 1.05 C ATOM 2090 CD ARG A 144 10.078 2.026 24.995 1.00 51.23 C ATOM 2091 NE ARG A 144 11.516 1.792 25.099 1.00 74.14 N ATOM 2092 CZ ARG A 144 12.424 2.759 25.036 1.00 63.24 C ATOM 2093 NH1 ARG A 144 12.046 4.019 24.870 1.00 20.24 N ATOM 2094 NH2 ARG A 144 13.714 2.466 25.138 1.00 4.25 N ATOM 0 H ARG A 144 5.880 3.953 23.478 1.00 23.24 H new ATOM 0 HA ARG A 144 8.265 3.658 21.817 1.00 50.12 H new ATOM 0 HB2 ARG A 144 7.674 2.082 24.280 1.00 52.22 H new ATOM 0 HB3 ARG A 144 8.119 1.147 22.866 1.00 52.22 H new ATOM 0 HG2 ARG A 144 10.284 1.907 22.860 1.00 1.05 H new ATOM 0 HG3 ARG A 144 9.850 3.499 23.449 1.00 1.05 H new ATOM 0 HD2 ARG A 144 9.786 2.806 25.698 1.00 51.23 H new ATOM 0 HD3 ARG A 144 9.542 1.121 25.281 1.00 51.23 H new ATOM 0 HE ARG A 144 11.841 0.834 25.227 1.00 74.14 H new ATOM 0 HH11 ARG A 144 11.055 4.248 24.790 1.00 20.24 H new ATOM 0 HH12 ARG A 144 12.746 4.759 24.822 1.00 20.24 H new ATOM 0 HH21 ARG A 144 14.009 1.498 25.265 1.00 4.25 H new ATOM 0 HH22 ARG A 144 14.411 3.209 25.090 1.00 4.25 H new