USER MOD reduce.3.24.130724 H: found=0, std=0, add=1348, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1350 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 188 ASN : amide:sc= -1.15 K(o=-1.1,f=0.14) USER MOD Set 1.2: A 193 THR OG1 : rot 160:sc= 0 USER MOD Set 2.1: A 176 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 180 HIS : no HE2:sc= 0.414 K(o=0.41,f=-1.4!) USER MOD Set 3.1: A 116 HIS : no HD1:sc= 0.348 K(o=0.78,f=0.21) USER MOD Set 3.2: A 118 THR OG1 : rot 135:sc= 0.437 USER MOD Set 4.1: A 29 GLN : amide:sc= -0.0362 K(o=0.055,f=-0.88) USER MOD Set 4.2: A 163 GLN : amide:sc= 0.0911 K(o=0.055,f=-4.7!) USER MOD Set 5.1: A 26 SER OG : rot -122:sc= 0.223 USER MOD Set 5.2: A 28 SER OG : rot 180:sc= 0.221 USER MOD Single : A 3 SER OG : rot 36:sc= 0.0121 USER MOD Single : A 4 MET CE :methyl -161:sc= -0.0263 (180deg=-0.327) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 GLN : amide:sc= -0.931 K(o=-0.93,f=0) USER MOD Single : A 7 SER OG : rot -170:sc= -0.384 USER MOD Single : A 8 ASN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 156:sc= -0.111 (180deg=-0.507) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc=-0.00744 K(o=-0.0074,f=-0.83) USER MOD Single : A 23 LYS NZ :NH3+ 164:sc= 0.401 (180deg=0.297) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 170:sc= -0.214 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 ASN : amide:sc= -0.083 K(o=-0.083,f=-1!) USER MOD Single : A 57 ASN : amide:sc= -1.38 K(o=-1.4,f=-2.1) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HD1:sc= -0.793 X(o=-0.79,f=-0.47) USER MOD Single : A 69 ASN : amide:sc= -0.729 K(o=-0.73,f=-3.1!) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 HIS : no HE2:sc= -0.177 K(o=-0.18,f=-2.2) USER MOD Single : A 75 SER OG : rot -130:sc= -0.663 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot -122:sc= 0.321 USER MOD Single : A 86 MET CE :methyl 162:sc= -0.0591 (180deg=-0.479) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -3.21! K(o=-3.2!,f=-0.29) USER MOD Single : A 104 TYR OH : rot -170:sc= 0.458 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 96:sc= -0.326 USER MOD Single : A 113 SER OG : rot -27:sc= 0.2 USER MOD Single : A 114 GLN : amide:sc= -0.0611 X(o=-0.061,f=-0.11) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 TYR OH : rot 143:sc= 0.209 USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 125 SER OG : rot -21:sc= 0.0899 USER MOD Single : A 128 GLN : amide:sc= -1.63! K(o=-1.6!,f=-0.37) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 ASN : amide:sc= 0.095 K(o=0.095,f=-3.2!) USER MOD Single : A 148 SER OG : rot 180:sc= -0.0489 USER MOD Single : A 154 CYS SG : rot 50:sc= -1.52 USER MOD Single : A 157 SER OG : rot 65:sc= -0.0617 USER MOD Single : A 160 LYS NZ :NH3+ 148:sc= -0.0287 (180deg=-0.506) USER MOD Single : A 162 MET CE :methyl -159:sc= -0.428 (180deg=-0.55) USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 173 MET CE :methyl -155:sc= 0 (180deg=-0.82) USER MOD Single : A 175 THR OG1 : rot 87:sc= 0.351 USER MOD Single : A 178 ASN : amide:sc= -3.09! C(o=-3.1!,f=-4.3!) USER MOD Single : A 186 GLN : amide:sc= 0.01 K(o=0.01,f=-0.87) USER MOD Single : A 198 TYR OH : rot 180:sc= 0 USER MOD Single : A 200 ASN : amide:sc= -0.474 X(o=-0.47,f=-0.1) USER MOD Single : A 201 ASN : amide:sc= -0.0449 K(o=-0.045,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 28 N SER A 3 6.363 -0.655 -0.607 1.00 23.33 N ATOM 29 CA SER A 3 7.181 -0.938 -1.797 1.00 0.01 C ATOM 30 C SER A 3 7.821 0.335 -2.351 1.00 40.33 C ATOM 31 O SER A 3 9.032 0.528 -2.237 1.00 33.42 O ATOM 32 CB SER A 3 6.363 -1.644 -2.887 1.00 73.53 C ATOM 33 OG SER A 3 5.923 -2.918 -2.451 1.00 1.42 O ATOM 0 HA SER A 3 7.979 -1.611 -1.483 1.00 0.01 H new ATOM 0 HB2 SER A 3 5.502 -1.031 -3.155 1.00 73.53 H new ATOM 0 HB3 SER A 3 6.969 -1.753 -3.787 1.00 73.53 H new ATOM 0 HG SER A 3 5.710 -2.881 -1.495 1.00 1.42 H new ATOM 39 N MET A 4 7.004 1.197 -2.953 1.00 62.21 N ATOM 40 CA MET A 4 7.485 2.452 -3.516 1.00 74.22 C ATOM 41 C MET A 4 7.573 3.527 -2.436 1.00 11.02 C ATOM 42 O MET A 4 6.654 4.328 -2.265 1.00 31.10 O ATOM 43 CB MET A 4 6.559 2.916 -4.644 1.00 31.25 C ATOM 44 CG MET A 4 6.418 1.908 -5.773 1.00 12.35 C ATOM 45 SD MET A 4 5.307 2.475 -7.075 1.00 64.11 S ATOM 46 CE MET A 4 5.245 1.021 -8.118 1.00 33.43 C ATOM 0 H MET A 4 6.001 1.046 -3.063 1.00 62.21 H new ATOM 0 HA MET A 4 8.483 2.286 -3.922 1.00 74.22 H new ATOM 0 HB2 MET A 4 5.573 3.124 -4.230 1.00 31.25 H new ATOM 0 HB3 MET A 4 6.938 3.853 -5.051 1.00 31.25 H new ATOM 0 HG2 MET A 4 7.400 1.707 -6.201 1.00 12.35 H new ATOM 0 HG3 MET A 4 6.048 0.966 -5.369 1.00 12.35 H new ATOM 0 HE1 MET A 4 4.892 1.300 -9.111 1.00 33.43 H new ATOM 0 HE2 MET A 4 6.242 0.587 -8.196 1.00 33.43 H new ATOM 0 HE3 MET A 4 4.564 0.290 -7.683 1.00 33.43 H new ATOM 56 N SER A 5 8.684 3.533 -1.703 1.00 24.54 N ATOM 57 CA SER A 5 8.890 4.502 -0.633 1.00 61.33 C ATOM 58 C SER A 5 10.043 5.446 -0.957 1.00 22.21 C ATOM 59 O SER A 5 9.994 6.631 -0.631 1.00 11.34 O ATOM 60 CB SER A 5 9.158 3.781 0.691 1.00 54.04 C ATOM 61 OG SER A 5 10.238 2.871 0.570 1.00 75.21 O ATOM 0 H SER A 5 9.455 2.877 -1.832 1.00 24.54 H new ATOM 0 HA SER A 5 7.981 5.096 -0.539 1.00 61.33 H new ATOM 0 HB2 SER A 5 9.381 4.513 1.468 1.00 54.04 H new ATOM 0 HB3 SER A 5 8.262 3.246 1.005 1.00 54.04 H new ATOM 0 HG SER A 5 10.389 2.426 1.430 1.00 75.21 H new ATOM 67 N GLN A 6 11.076 4.911 -1.599 1.00 62.15 N ATOM 68 CA GLN A 6 12.242 5.704 -1.972 1.00 41.41 C ATOM 69 C GLN A 6 12.103 6.236 -3.396 1.00 15.43 C ATOM 70 O GLN A 6 12.801 7.171 -3.790 1.00 11.22 O ATOM 71 CB GLN A 6 13.518 4.866 -1.847 1.00 32.02 C ATOM 72 CG GLN A 6 13.482 3.575 -2.652 1.00 51.12 C ATOM 73 CD GLN A 6 14.750 2.753 -2.510 1.00 63.24 C ATOM 74 OE1 GLN A 6 14.713 1.525 -2.564 1.00 44.15 O ATOM 75 NE2 GLN A 6 15.883 3.426 -2.332 1.00 70.24 N ATOM 0 H GLN A 6 11.130 3.930 -1.872 1.00 62.15 H new ATOM 0 HA GLN A 6 12.308 6.553 -1.291 1.00 41.41 H new ATOM 0 HB2 GLN A 6 14.369 5.464 -2.174 1.00 32.02 H new ATOM 0 HB3 GLN A 6 13.683 4.625 -0.797 1.00 32.02 H new ATOM 0 HG2 GLN A 6 12.630 2.976 -2.331 1.00 51.12 H new ATOM 0 HG3 GLN A 6 13.326 3.813 -3.704 1.00 51.12 H new ATOM 0 HE21 GLN A 6 15.870 4.445 -2.293 1.00 70.24 H new ATOM 0 HE22 GLN A 6 16.765 2.923 -2.234 1.00 70.24 H new ATOM 84 N SER A 7 11.193 5.635 -4.160 1.00 42.13 N ATOM 85 CA SER A 7 10.960 6.044 -5.539 1.00 21.20 C ATOM 86 C SER A 7 10.069 7.282 -5.600 1.00 25.20 C ATOM 87 O SER A 7 10.268 8.158 -6.441 1.00 30.31 O ATOM 88 CB SER A 7 10.329 4.899 -6.336 1.00 51.11 C ATOM 89 OG SER A 7 9.077 4.524 -5.792 1.00 53.41 O ATOM 0 H SER A 7 10.606 4.863 -3.845 1.00 42.13 H new ATOM 0 HA SER A 7 11.923 6.295 -5.984 1.00 21.20 H new ATOM 0 HB2 SER A 7 10.200 5.203 -7.375 1.00 51.11 H new ATOM 0 HB3 SER A 7 11.000 4.040 -6.336 1.00 51.11 H new ATOM 0 HG SER A 7 8.771 3.696 -6.217 1.00 53.41 H new ATOM 95 N ASN A 8 9.092 7.350 -4.698 1.00 45.45 N ATOM 96 CA ASN A 8 8.175 8.484 -4.646 1.00 60.14 C ATOM 97 C ASN A 8 8.738 9.597 -3.767 1.00 0.43 C ATOM 98 O ASN A 8 8.183 10.694 -3.704 1.00 73.23 O ATOM 99 CB ASN A 8 6.806 8.042 -4.120 1.00 21.31 C ATOM 100 CG ASN A 8 6.159 6.987 -4.998 1.00 74.31 C ATOM 101 OD1 ASN A 8 6.440 6.897 -6.194 1.00 22.44 O ATOM 102 ND2 ASN A 8 5.281 6.185 -4.408 1.00 14.14 N ATOM 0 H ASN A 8 8.916 6.633 -3.994 1.00 45.45 H new ATOM 0 HA ASN A 8 8.056 8.869 -5.659 1.00 60.14 H new ATOM 0 HB2 ASN A 8 6.918 7.650 -3.109 1.00 21.31 H new ATOM 0 HB3 ASN A 8 6.148 8.909 -4.055 1.00 21.31 H new ATOM 0 HD21 ASN A 8 4.810 5.459 -4.948 1.00 14.14 H new ATOM 0 HD22 ASN A 8 5.078 6.294 -3.414 1.00 14.14 H new ATOM 109 N ARG A 9 9.848 9.303 -3.094 1.00 12.02 N ATOM 110 CA ARG A 9 10.504 10.268 -2.218 1.00 51.05 C ATOM 111 C ARG A 9 11.352 11.244 -3.029 1.00 14.21 C ATOM 112 O ARG A 9 11.462 12.423 -2.687 1.00 25.40 O ATOM 113 CB ARG A 9 11.373 9.530 -1.198 1.00 42.50 C ATOM 114 CG ARG A 9 12.000 10.433 -0.146 1.00 31.12 C ATOM 115 CD ARG A 9 12.842 9.635 0.837 1.00 42.03 C ATOM 116 NE ARG A 9 13.873 8.848 0.162 1.00 5.14 N ATOM 117 CZ ARG A 9 14.615 7.924 0.766 1.00 73.34 C ATOM 118 NH1 ARG A 9 14.446 7.669 2.057 1.00 13.23 N1+ ATOM 119 NH2 ARG A 9 15.525 7.251 0.078 1.00 21.22 N ATOM 0 H ARG A 9 10.314 8.397 -3.140 1.00 12.02 H new ATOM 0 HA ARG A 9 9.740 10.840 -1.691 1.00 51.05 H new ATOM 0 HB2 ARG A 9 10.766 8.775 -0.698 1.00 42.50 H new ATOM 0 HB3 ARG A 9 12.166 9.002 -1.727 1.00 42.50 H new ATOM 0 HG2 ARG A 9 12.621 11.185 -0.633 1.00 31.12 H new ATOM 0 HG3 ARG A 9 11.216 10.966 0.392 1.00 31.12 H new ATOM 0 HD2 ARG A 9 13.312 10.315 1.547 1.00 42.03 H new ATOM 0 HD3 ARG A 9 12.197 8.970 1.411 1.00 42.03 H new ATOM 0 HE ARG A 9 14.033 9.018 -0.831 1.00 5.14 H new ATOM 0 HH11 ARG A 9 13.745 8.182 2.591 1.00 13.23 H new ATOM 0 HH12 ARG A 9 15.017 6.959 2.516 1.00 13.23 H new ATOM 0 HH21 ARG A 9 15.657 7.441 -0.915 1.00 21.22 H new ATOM 0 HH22 ARG A 9 16.094 6.543 0.542 1.00 21.22 H new ATOM 133 N GLU A 10 11.944 10.743 -4.110 1.00 63.25 N ATOM 134 CA GLU A 10 12.780 11.562 -4.979 1.00 11.22 C ATOM 135 C GLU A 10 11.922 12.423 -5.906 1.00 31.42 C ATOM 136 O GLU A 10 12.377 13.447 -6.410 1.00 63.04 O ATOM 137 CB GLU A 10 13.712 10.670 -5.803 1.00 15.12 C ATOM 138 CG GLU A 10 14.802 11.434 -6.538 1.00 44.41 C ATOM 139 CD GLU A 10 15.609 10.550 -7.470 1.00 40.11 C ATOM 140 OE1 GLU A 10 16.585 9.929 -7.001 1.00 32.10 O ATOM 141 OE2 GLU A 10 15.263 10.480 -8.668 1.00 2.34 O1- ATOM 0 H GLU A 10 11.859 9.770 -4.405 1.00 63.25 H new ATOM 0 HA GLU A 10 13.379 12.224 -4.354 1.00 11.22 H new ATOM 0 HB2 GLU A 10 14.177 9.938 -5.142 1.00 15.12 H new ATOM 0 HB3 GLU A 10 13.119 10.113 -6.529 1.00 15.12 H new ATOM 0 HG2 GLU A 10 14.349 12.243 -7.112 1.00 44.41 H new ATOM 0 HG3 GLU A 10 15.471 11.895 -5.811 1.00 44.41 H new ATOM 148 N LEU A 11 10.672 12.007 -6.111 1.00 22.23 N ATOM 149 CA LEU A 11 9.748 12.738 -6.977 1.00 41.33 C ATOM 150 C LEU A 11 9.329 14.067 -6.352 1.00 3.53 C ATOM 151 O LEU A 11 8.880 14.976 -7.052 1.00 35.05 O ATOM 152 CB LEU A 11 8.506 11.892 -7.268 1.00 5.34 C ATOM 153 CG LEU A 11 8.772 10.565 -7.982 1.00 65.44 C ATOM 154 CD1 LEU A 11 7.465 9.835 -8.249 1.00 15.33 C ATOM 155 CD2 LEU A 11 9.530 10.797 -9.281 1.00 11.20 C ATOM 0 H LEU A 11 10.276 11.167 -5.689 1.00 22.23 H new ATOM 0 HA LEU A 11 10.270 12.948 -7.910 1.00 41.33 H new ATOM 0 HB2 LEU A 11 8.000 11.684 -6.326 1.00 5.34 H new ATOM 0 HB3 LEU A 11 7.819 12.481 -7.875 1.00 5.34 H new ATOM 0 HG LEU A 11 9.389 9.943 -7.334 1.00 65.44 H new ATOM 0 HD11 LEU A 11 7.672 8.893 -8.757 1.00 15.33 H new ATOM 0 HD12 LEU A 11 6.961 9.634 -7.304 1.00 15.33 H new ATOM 0 HD13 LEU A 11 6.825 10.454 -8.878 1.00 15.33 H new ATOM 0 HD21 LEU A 11 9.709 9.841 -9.773 1.00 11.20 H new ATOM 0 HD22 LEU A 11 8.941 11.438 -9.937 1.00 11.20 H new ATOM 0 HD23 LEU A 11 10.484 11.278 -9.065 1.00 11.20 H new ATOM 167 N VAL A 12 9.480 14.175 -5.034 1.00 22.34 N ATOM 168 CA VAL A 12 9.117 15.393 -4.319 1.00 40.42 C ATOM 169 C VAL A 12 10.222 16.444 -4.423 1.00 65.31 C ATOM 170 O VAL A 12 9.946 17.639 -4.520 1.00 60.14 O ATOM 171 CB VAL A 12 8.824 15.110 -2.830 1.00 23.32 C ATOM 172 CG1 VAL A 12 8.217 16.333 -2.159 1.00 25.03 C ATOM 173 CG2 VAL A 12 7.906 13.906 -2.680 1.00 53.22 C ATOM 0 H VAL A 12 9.851 13.433 -4.441 1.00 22.34 H new ATOM 0 HA VAL A 12 8.211 15.776 -4.789 1.00 40.42 H new ATOM 0 HB VAL A 12 9.769 14.882 -2.336 1.00 23.32 H new ATOM 0 HG11 VAL A 12 8.018 16.112 -1.110 1.00 25.03 H new ATOM 0 HG12 VAL A 12 8.913 17.169 -2.228 1.00 25.03 H new ATOM 0 HG13 VAL A 12 7.284 16.596 -2.657 1.00 25.03 H new ATOM 0 HG21 VAL A 12 7.713 13.725 -1.623 1.00 53.22 H new ATOM 0 HG22 VAL A 12 6.964 14.101 -3.193 1.00 53.22 H new ATOM 0 HG23 VAL A 12 8.382 13.029 -3.117 1.00 53.22 H new ATOM 183 N VAL A 13 11.473 15.989 -4.417 1.00 44.24 N ATOM 184 CA VAL A 13 12.619 16.891 -4.505 1.00 64.33 C ATOM 185 C VAL A 13 12.933 17.260 -5.963 1.00 42.14 C ATOM 186 O VAL A 13 13.734 18.159 -6.228 1.00 23.25 O ATOM 187 CB VAL A 13 13.868 16.270 -3.830 1.00 50.40 C ATOM 188 CG1 VAL A 13 14.502 15.199 -4.707 1.00 71.34 C ATOM 189 CG2 VAL A 13 14.882 17.346 -3.469 1.00 33.23 C ATOM 0 H VAL A 13 11.719 15.001 -4.352 1.00 44.24 H new ATOM 0 HA VAL A 13 12.354 17.805 -3.973 1.00 64.33 H new ATOM 0 HB VAL A 13 13.539 15.789 -2.909 1.00 50.40 H new ATOM 0 HG11 VAL A 13 15.375 14.785 -4.202 1.00 71.34 H new ATOM 0 HG12 VAL A 13 13.779 14.404 -4.891 1.00 71.34 H new ATOM 0 HG13 VAL A 13 14.807 15.639 -5.656 1.00 71.34 H new ATOM 0 HG21 VAL A 13 15.749 16.885 -2.997 1.00 33.23 H new ATOM 0 HG22 VAL A 13 15.196 17.868 -4.373 1.00 33.23 H new ATOM 0 HG23 VAL A 13 14.428 18.057 -2.779 1.00 33.23 H new ATOM 199 N ASP A 14 12.283 16.571 -6.903 1.00 1.42 N ATOM 200 CA ASP A 14 12.492 16.827 -8.327 1.00 43.32 C ATOM 201 C ASP A 14 11.909 18.175 -8.742 1.00 21.21 C ATOM 202 O ASP A 14 12.602 18.998 -9.342 1.00 63.44 O ATOM 203 CB ASP A 14 11.870 15.713 -9.173 1.00 21.13 C ATOM 204 CG ASP A 14 12.788 14.515 -9.328 1.00 4.43 C ATOM 205 OD1 ASP A 14 12.279 13.375 -9.340 1.00 34.52 O ATOM 206 OD2 ASP A 14 14.016 14.717 -9.438 1.00 73.41 O1- ATOM 0 H ASP A 14 11.608 15.833 -6.703 1.00 1.42 H new ATOM 0 HA ASP A 14 13.568 16.850 -8.500 1.00 43.32 H new ATOM 0 HB2 ASP A 14 10.935 15.392 -8.714 1.00 21.13 H new ATOM 0 HB3 ASP A 14 11.622 16.106 -10.159 1.00 21.13 H new ATOM 211 N PHE A 15 10.637 18.400 -8.417 1.00 30.02 N ATOM 212 CA PHE A 15 9.969 19.651 -8.767 1.00 40.51 C ATOM 213 C PHE A 15 10.243 20.738 -7.726 1.00 55.12 C ATOM 214 O PHE A 15 9.923 21.909 -7.940 1.00 23.20 O ATOM 215 CB PHE A 15 8.457 19.426 -8.927 1.00 2.42 C ATOM 216 CG PHE A 15 7.701 19.295 -7.631 1.00 22.33 C ATOM 217 CD1 PHE A 15 7.115 20.406 -7.041 1.00 44.13 C ATOM 218 CD2 PHE A 15 7.572 18.065 -7.006 1.00 51.43 C ATOM 219 CE1 PHE A 15 6.418 20.291 -5.855 1.00 3.55 C ATOM 220 CE2 PHE A 15 6.875 17.946 -5.819 1.00 74.33 C ATOM 221 CZ PHE A 15 6.299 19.060 -5.243 1.00 54.30 C ATOM 0 H PHE A 15 10.051 17.734 -7.914 1.00 30.02 H new ATOM 0 HA PHE A 15 10.374 19.992 -9.720 1.00 40.51 H new ATOM 0 HB2 PHE A 15 8.038 20.257 -9.494 1.00 2.42 H new ATOM 0 HB3 PHE A 15 8.298 18.524 -9.518 1.00 2.42 H new ATOM 0 HD1 PHE A 15 7.205 21.372 -7.515 1.00 44.13 H new ATOM 0 HD2 PHE A 15 8.021 17.190 -7.452 1.00 51.43 H new ATOM 0 HE1 PHE A 15 5.966 21.164 -5.407 1.00 3.55 H new ATOM 0 HE2 PHE A 15 6.781 16.982 -5.342 1.00 74.33 H new ATOM 0 HZ PHE A 15 5.756 18.968 -4.314 1.00 54.30 H new ATOM 231 N LEU A 16 10.842 20.343 -6.605 1.00 64.22 N ATOM 232 CA LEU A 16 11.157 21.276 -5.528 1.00 72.32 C ATOM 233 C LEU A 16 12.373 22.133 -5.873 1.00 33.21 C ATOM 234 O LEU A 16 12.509 23.254 -5.385 1.00 40.03 O ATOM 235 CB LEU A 16 11.420 20.509 -4.230 1.00 4.43 C ATOM 236 CG LEU A 16 10.620 20.985 -3.016 1.00 71.13 C ATOM 237 CD1 LEU A 16 9.141 20.675 -3.191 1.00 3.51 C ATOM 238 CD2 LEU A 16 11.151 20.341 -1.746 1.00 52.20 C ATOM 0 H LEU A 16 11.120 19.379 -6.419 1.00 64.22 H new ATOM 0 HA LEU A 16 10.300 21.936 -5.396 1.00 72.32 H new ATOM 0 HB2 LEU A 16 11.200 19.455 -4.399 1.00 4.43 H new ATOM 0 HB3 LEU A 16 12.482 20.579 -3.995 1.00 4.43 H new ATOM 0 HG LEU A 16 10.735 22.066 -2.932 1.00 71.13 H new ATOM 0 HD11 LEU A 16 8.591 21.022 -2.316 1.00 3.51 H new ATOM 0 HD12 LEU A 16 8.766 21.182 -4.080 1.00 3.51 H new ATOM 0 HD13 LEU A 16 9.005 19.599 -3.302 1.00 3.51 H new ATOM 0 HD21 LEU A 16 10.571 20.690 -0.891 1.00 52.20 H new ATOM 0 HD22 LEU A 16 11.065 19.257 -1.824 1.00 52.20 H new ATOM 0 HD23 LEU A 16 12.198 20.613 -1.610 1.00 52.20 H new ATOM 250 N SER A 17 13.248 21.601 -6.724 1.00 61.33 N ATOM 251 CA SER A 17 14.458 22.312 -7.131 1.00 54.41 C ATOM 252 C SER A 17 14.184 23.275 -8.287 1.00 31.12 C ATOM 253 O SER A 17 15.054 24.060 -8.665 1.00 53.12 O ATOM 254 CB SER A 17 15.546 21.314 -7.531 1.00 53.13 C ATOM 255 OG SER A 17 15.127 20.509 -8.620 1.00 2.41 O ATOM 0 H SER A 17 13.141 20.678 -7.146 1.00 61.33 H new ATOM 0 HA SER A 17 14.799 22.900 -6.279 1.00 54.41 H new ATOM 0 HB2 SER A 17 16.455 21.852 -7.801 1.00 53.13 H new ATOM 0 HB3 SER A 17 15.792 20.679 -6.680 1.00 53.13 H new ATOM 0 HG SER A 17 15.841 19.881 -8.857 1.00 2.41 H new ATOM 261 N TYR A 18 12.976 23.213 -8.844 1.00 32.53 N ATOM 262 CA TYR A 18 12.603 24.085 -9.956 1.00 34.51 C ATOM 263 C TYR A 18 12.017 25.401 -9.452 1.00 33.20 C ATOM 264 O TYR A 18 11.936 26.377 -10.196 1.00 73.25 O ATOM 265 CB TYR A 18 11.593 23.389 -10.874 1.00 41.32 C ATOM 266 CG TYR A 18 12.110 22.119 -11.518 1.00 34.43 C ATOM 267 CD1 TYR A 18 13.442 21.996 -11.900 1.00 24.32 C ATOM 268 CD2 TYR A 18 11.262 21.044 -11.746 1.00 12.13 C ATOM 269 CE1 TYR A 18 13.911 20.836 -12.488 1.00 62.14 C ATOM 270 CE2 TYR A 18 11.723 19.882 -12.333 1.00 51.11 C ATOM 271 CZ TYR A 18 13.048 19.783 -12.702 1.00 0.54 C ATOM 272 OH TYR A 18 13.511 18.626 -13.286 1.00 61.02 O ATOM 0 H TYR A 18 12.242 22.571 -8.545 1.00 32.53 H new ATOM 0 HA TYR A 18 13.509 24.302 -10.522 1.00 34.51 H new ATOM 0 HB2 TYR A 18 10.698 23.152 -10.298 1.00 41.32 H new ATOM 0 HB3 TYR A 18 11.293 24.084 -11.658 1.00 41.32 H new ATOM 0 HD1 TYR A 18 14.121 22.820 -11.735 1.00 24.32 H new ATOM 0 HD2 TYR A 18 10.223 21.118 -11.459 1.00 12.13 H new ATOM 0 HE1 TYR A 18 14.948 20.755 -12.778 1.00 62.14 H new ATOM 0 HE2 TYR A 18 11.049 19.055 -12.502 1.00 51.11 H new ATOM 0 HH TYR A 18 12.776 17.982 -13.364 1.00 61.02 H new ATOM 282 N LYS A 19 11.604 25.421 -8.186 1.00 33.40 N ATOM 283 CA LYS A 19 11.025 26.621 -7.588 1.00 71.20 C ATOM 284 C LYS A 19 11.987 27.264 -6.594 1.00 74.34 C ATOM 285 O LYS A 19 11.907 28.465 -6.328 1.00 53.33 O ATOM 286 CB LYS A 19 9.702 26.288 -6.891 1.00 24.30 C ATOM 287 CG LYS A 19 8.487 26.391 -7.802 1.00 64.24 C ATOM 288 CD LYS A 19 8.475 25.294 -8.854 1.00 35.31 C ATOM 289 CE LYS A 19 7.694 25.715 -10.089 1.00 14.51 C ATOM 290 NZ LYS A 19 8.355 26.838 -10.809 1.00 1.03 N1+ ATOM 0 H LYS A 19 11.660 24.621 -7.556 1.00 33.40 H new ATOM 0 HA LYS A 19 10.836 27.333 -8.392 1.00 71.20 H new ATOM 0 HB2 LYS A 19 9.758 25.277 -6.488 1.00 24.30 H new ATOM 0 HB3 LYS A 19 9.568 26.961 -6.044 1.00 24.30 H new ATOM 0 HG2 LYS A 19 7.578 26.331 -7.204 1.00 64.24 H new ATOM 0 HG3 LYS A 19 8.482 27.365 -8.292 1.00 64.24 H new ATOM 0 HD2 LYS A 19 9.499 25.048 -9.136 1.00 35.31 H new ATOM 0 HD3 LYS A 19 8.034 24.390 -8.434 1.00 35.31 H new ATOM 0 HE2 LYS A 19 7.592 24.863 -10.761 1.00 14.51 H new ATOM 0 HE3 LYS A 19 6.687 26.014 -9.797 1.00 14.51 H new ATOM 0 HZ1 LYS A 19 8.059 26.833 -11.806 1.00 1.03 H new ATOM 0 HZ2 LYS A 19 8.081 27.740 -10.371 1.00 1.03 H new ATOM 0 HZ3 LYS A 19 9.387 26.726 -10.754 1.00 1.03 H new ATOM 304 N LEU A 20 12.894 26.459 -6.050 1.00 51.53 N ATOM 305 CA LEU A 20 13.871 26.947 -5.084 1.00 12.22 C ATOM 306 C LEU A 20 15.057 27.604 -5.777 1.00 64.24 C ATOM 307 O LEU A 20 15.383 28.757 -5.499 1.00 44.31 O ATOM 308 CB LEU A 20 14.360 25.801 -4.198 1.00 74.32 C ATOM 309 CG LEU A 20 13.487 25.500 -2.981 1.00 34.14 C ATOM 310 CD1 LEU A 20 13.862 24.156 -2.379 1.00 64.12 C ATOM 311 CD2 LEU A 20 13.626 26.604 -1.944 1.00 33.14 C ATOM 0 H LEU A 20 12.972 25.464 -6.262 1.00 51.53 H new ATOM 0 HA LEU A 20 13.378 27.697 -4.466 1.00 12.22 H new ATOM 0 HB2 LEU A 20 14.432 24.899 -4.805 1.00 74.32 H new ATOM 0 HB3 LEU A 20 15.367 26.034 -3.853 1.00 74.32 H new ATOM 0 HG LEU A 20 12.447 25.456 -3.303 1.00 34.14 H new ATOM 0 HD11 LEU A 20 13.231 23.956 -1.513 1.00 64.12 H new ATOM 0 HD12 LEU A 20 13.717 23.372 -3.122 1.00 64.12 H new ATOM 0 HD13 LEU A 20 14.907 24.175 -2.070 1.00 64.12 H new ATOM 0 HD21 LEU A 20 12.998 26.375 -1.083 1.00 33.14 H new ATOM 0 HD22 LEU A 20 14.666 26.676 -1.626 1.00 33.14 H new ATOM 0 HD23 LEU A 20 13.314 27.553 -2.379 1.00 33.14 H new ATOM 323 N SER A 21 15.692 26.865 -6.688 1.00 21.30 N ATOM 324 CA SER A 21 16.856 27.366 -7.419 1.00 40.15 C ATOM 325 C SER A 21 16.480 28.480 -8.397 1.00 30.21 C ATOM 326 O SER A 21 17.353 29.170 -8.924 1.00 52.24 O ATOM 327 CB SER A 21 17.539 26.223 -8.172 1.00 61.20 C ATOM 328 OG SER A 21 17.976 25.213 -7.279 1.00 34.20 O ATOM 0 H SER A 21 15.418 25.915 -6.937 1.00 21.30 H new ATOM 0 HA SER A 21 17.546 27.785 -6.686 1.00 40.15 H new ATOM 0 HB2 SER A 21 16.846 25.796 -8.898 1.00 61.20 H new ATOM 0 HB3 SER A 21 18.390 26.610 -8.733 1.00 61.20 H new ATOM 0 HG SER A 21 18.408 24.493 -7.785 1.00 34.20 H new ATOM 334 N GLN A 22 15.181 28.651 -8.636 1.00 15.21 N ATOM 335 CA GLN A 22 14.696 29.687 -9.540 1.00 24.03 C ATOM 336 C GLN A 22 14.800 31.064 -8.887 1.00 23.23 C ATOM 337 O GLN A 22 15.067 32.063 -9.556 1.00 32.33 O ATOM 338 CB GLN A 22 13.245 29.409 -9.937 1.00 43.51 C ATOM 339 CG GLN A 22 12.737 30.303 -11.057 1.00 31.51 C ATOM 340 CD GLN A 22 11.256 30.126 -11.325 1.00 2.13 C ATOM 341 OE1 GLN A 22 10.699 29.047 -11.122 1.00 10.23 O ATOM 342 NE2 GLN A 22 10.609 31.189 -11.787 1.00 21.52 N ATOM 0 H GLN A 22 14.446 28.083 -8.214 1.00 15.21 H new ATOM 0 HA GLN A 22 15.318 29.677 -10.435 1.00 24.03 H new ATOM 0 HB2 GLN A 22 13.155 28.368 -10.246 1.00 43.51 H new ATOM 0 HB3 GLN A 22 12.607 29.538 -9.063 1.00 43.51 H new ATOM 0 HG2 GLN A 22 12.933 31.344 -10.802 1.00 31.51 H new ATOM 0 HG3 GLN A 22 13.295 30.088 -11.969 1.00 31.51 H new ATOM 0 HE21 GLN A 22 11.110 32.064 -11.941 1.00 21.52 H new ATOM 0 HE22 GLN A 22 9.611 31.131 -11.988 1.00 21.52 H new ATOM 351 N LYS A 23 14.593 31.105 -7.572 1.00 42.13 N ATOM 352 CA LYS A 23 14.662 32.355 -6.822 1.00 21.42 C ATOM 353 C LYS A 23 16.088 32.634 -6.351 1.00 52.15 C ATOM 354 O LYS A 23 16.454 33.783 -6.098 1.00 43.43 O ATOM 355 CB LYS A 23 13.713 32.310 -5.620 1.00 14.44 C ATOM 356 CG LYS A 23 12.251 32.090 -5.990 1.00 43.44 C ATOM 357 CD LYS A 23 11.679 33.263 -6.776 1.00 23.41 C ATOM 358 CE LYS A 23 11.659 32.983 -8.271 1.00 34.14 C ATOM 359 NZ LYS A 23 11.197 34.163 -9.052 1.00 24.44 N1+ ATOM 0 H LYS A 23 14.376 30.286 -7.005 1.00 42.13 H new ATOM 0 HA LYS A 23 14.356 33.163 -7.487 1.00 21.42 H new ATOM 0 HB2 LYS A 23 14.031 31.512 -4.949 1.00 14.44 H new ATOM 0 HB3 LYS A 23 13.800 33.245 -5.067 1.00 14.44 H new ATOM 0 HG2 LYS A 23 12.160 31.179 -6.581 1.00 43.44 H new ATOM 0 HG3 LYS A 23 11.666 31.942 -5.083 1.00 43.44 H new ATOM 0 HD2 LYS A 23 10.666 33.472 -6.432 1.00 23.41 H new ATOM 0 HD3 LYS A 23 12.273 34.156 -6.581 1.00 23.41 H new ATOM 0 HE2 LYS A 23 12.658 32.699 -8.600 1.00 34.14 H new ATOM 0 HE3 LYS A 23 11.004 32.135 -8.473 1.00 34.14 H new ATOM 0 HZ1 LYS A 23 11.449 34.037 -10.053 1.00 24.44 H new ATOM 0 HZ2 LYS A 23 10.165 34.255 -8.964 1.00 24.44 H new ATOM 0 HZ3 LYS A 23 11.654 35.022 -8.686 1.00 24.44 H new ATOM 373 N GLY A 24 16.889 31.576 -6.235 1.00 74.33 N ATOM 374 CA GLY A 24 18.267 31.730 -5.800 1.00 61.44 C ATOM 375 C GLY A 24 18.602 30.872 -4.595 1.00 53.43 C ATOM 376 O GLY A 24 19.597 31.116 -3.911 1.00 72.31 O ATOM 0 H GLY A 24 16.608 30.616 -6.434 1.00 74.33 H new ATOM 0 HA2 GLY A 24 18.934 31.470 -6.622 1.00 61.44 H new ATOM 0 HA3 GLY A 24 18.452 32.777 -5.558 1.00 61.44 H new ATOM 380 N TYR A 25 17.773 29.866 -4.335 1.00 2.32 N ATOM 381 CA TYR A 25 17.986 28.969 -3.204 1.00 35.14 C ATOM 382 C TYR A 25 18.368 27.573 -3.689 1.00 43.25 C ATOM 383 O TYR A 25 17.505 26.771 -4.042 1.00 11.33 O ATOM 384 CB TYR A 25 16.726 28.888 -2.335 1.00 14.21 C ATOM 385 CG TYR A 25 16.120 30.232 -1.992 1.00 22.42 C ATOM 386 CD1 TYR A 25 16.877 31.224 -1.381 1.00 51.14 C ATOM 387 CD2 TYR A 25 14.787 30.505 -2.274 1.00 42.50 C ATOM 388 CE1 TYR A 25 16.324 32.449 -1.062 1.00 21.22 C ATOM 389 CE2 TYR A 25 14.227 31.729 -1.959 1.00 54.30 C ATOM 390 CZ TYR A 25 15.000 32.696 -1.354 1.00 2.54 C ATOM 391 OH TYR A 25 14.446 33.915 -1.038 1.00 33.01 O ATOM 0 H TYR A 25 16.946 29.651 -4.893 1.00 2.32 H new ATOM 0 HA TYR A 25 18.803 29.371 -2.605 1.00 35.14 H new ATOM 0 HB2 TYR A 25 15.979 28.287 -2.854 1.00 14.21 H new ATOM 0 HB3 TYR A 25 16.969 28.365 -1.410 1.00 14.21 H new ATOM 0 HD1 TYR A 25 17.915 31.034 -1.152 1.00 51.14 H new ATOM 0 HD2 TYR A 25 14.178 29.748 -2.747 1.00 42.50 H new ATOM 0 HE1 TYR A 25 16.926 33.209 -0.586 1.00 21.22 H new ATOM 0 HE2 TYR A 25 13.190 31.926 -2.186 1.00 54.30 H new ATOM 0 HH TYR A 25 13.505 33.927 -1.311 1.00 33.01 H new ATOM 401 N SER A 26 19.666 27.290 -3.705 1.00 41.43 N ATOM 402 CA SER A 26 20.161 25.990 -4.151 1.00 44.31 C ATOM 403 C SER A 26 19.935 24.921 -3.084 1.00 31.30 C ATOM 404 O SER A 26 19.880 25.221 -1.890 1.00 53.54 O ATOM 405 CB SER A 26 21.649 26.082 -4.495 1.00 52.25 C ATOM 406 OG SER A 26 22.115 24.879 -5.083 1.00 64.20 O ATOM 0 H SER A 26 20.395 27.942 -3.415 1.00 41.43 H new ATOM 0 HA SER A 26 19.605 25.704 -5.043 1.00 44.31 H new ATOM 0 HB2 SER A 26 21.816 26.913 -5.180 1.00 52.25 H new ATOM 0 HB3 SER A 26 22.221 26.294 -3.592 1.00 52.25 H new ATOM 0 HG SER A 26 22.851 24.517 -4.547 1.00 64.20 H new ATOM 412 N TRP A 27 19.809 23.670 -3.525 1.00 61.20 N ATOM 413 CA TRP A 27 19.591 22.550 -2.612 1.00 53.30 C ATOM 414 C TRP A 27 20.909 22.053 -2.017 1.00 22.33 C ATOM 415 O TRP A 27 20.925 21.104 -1.233 1.00 44.40 O ATOM 416 CB TRP A 27 18.879 21.403 -3.332 1.00 4.15 C ATOM 417 CG TRP A 27 17.478 21.177 -2.850 1.00 14.02 C ATOM 418 CD1 TRP A 27 16.330 21.299 -3.579 1.00 22.51 C ATOM 419 CD2 TRP A 27 17.076 20.793 -1.528 1.00 54.12 C ATOM 420 NE1 TRP A 27 15.240 21.011 -2.793 1.00 34.12 N ATOM 421 CE2 TRP A 27 15.672 20.699 -1.530 1.00 11.52 C ATOM 422 CE3 TRP A 27 17.768 20.517 -0.344 1.00 53.32 C ATOM 423 CZ2 TRP A 27 14.948 20.342 -0.395 1.00 20.51 C ATOM 424 CZ3 TRP A 27 17.048 20.164 0.782 1.00 40.24 C ATOM 425 CH2 TRP A 27 15.651 20.079 0.749 1.00 31.43 C ATOM 0 H TRP A 27 19.854 23.407 -4.509 1.00 61.20 H new ATOM 0 HA TRP A 27 18.961 22.906 -1.797 1.00 53.30 H new ATOM 0 HB2 TRP A 27 18.858 21.612 -4.402 1.00 4.15 H new ATOM 0 HB3 TRP A 27 19.454 20.487 -3.198 1.00 4.15 H new ATOM 0 HD1 TRP A 27 16.285 21.581 -4.621 1.00 22.51 H new ATOM 0 HE1 TRP A 27 14.267 21.027 -3.100 1.00 34.12 H new ATOM 0 HE3 TRP A 27 18.846 20.579 -0.310 1.00 53.32 H new ATOM 0 HZ2 TRP A 27 13.870 20.275 -0.417 1.00 20.51 H new ATOM 0 HZ3 TRP A 27 17.572 19.950 1.702 1.00 40.24 H new ATOM 0 HH2 TRP A 27 15.117 19.800 1.645 1.00 31.43 H new ATOM 436 N SER A 28 22.010 22.701 -2.392 1.00 32.31 N ATOM 437 CA SER A 28 23.329 22.332 -1.890 1.00 50.44 C ATOM 438 C SER A 28 23.613 23.014 -0.553 1.00 42.24 C ATOM 439 O SER A 28 24.687 22.847 0.026 1.00 22.54 O ATOM 440 CB SER A 28 24.409 22.705 -2.909 1.00 22.54 C ATOM 441 OG SER A 28 24.421 24.101 -3.153 1.00 51.11 O ATOM 0 H SER A 28 22.013 23.486 -3.043 1.00 32.31 H new ATOM 0 HA SER A 28 23.344 21.253 -1.736 1.00 50.44 H new ATOM 0 HB2 SER A 28 25.385 22.389 -2.541 1.00 22.54 H new ATOM 0 HB3 SER A 28 24.232 22.171 -3.843 1.00 22.54 H new ATOM 0 HG SER A 28 25.120 24.313 -3.806 1.00 51.11 H new ATOM 447 N GLN A 29 22.638 23.781 -0.071 1.00 65.33 N ATOM 448 CA GLN A 29 22.767 24.491 1.195 1.00 12.55 C ATOM 449 C GLN A 29 22.471 23.563 2.371 1.00 40.41 C ATOM 450 O GLN A 29 23.139 23.621 3.404 1.00 71.43 O ATOM 451 CB GLN A 29 21.815 25.690 1.220 1.00 13.34 C ATOM 452 CG GLN A 29 21.969 26.571 2.450 1.00 42.43 C ATOM 453 CD GLN A 29 20.944 27.688 2.500 1.00 1.54 C ATOM 454 OE1 GLN A 29 19.821 27.541 2.015 1.00 23.32 O ATOM 455 NE2 GLN A 29 21.327 28.814 3.088 1.00 40.23 N ATOM 0 H GLN A 29 21.745 23.926 -0.543 1.00 65.33 H new ATOM 0 HA GLN A 29 23.794 24.845 1.288 1.00 12.55 H new ATOM 0 HB2 GLN A 29 21.983 26.294 0.329 1.00 13.34 H new ATOM 0 HB3 GLN A 29 20.788 25.328 1.170 1.00 13.34 H new ATOM 0 HG2 GLN A 29 21.876 25.957 3.346 1.00 42.43 H new ATOM 0 HG3 GLN A 29 22.970 27.001 2.461 1.00 42.43 H new ATOM 0 HE21 GLN A 29 22.267 28.892 3.476 1.00 40.23 H new ATOM 0 HE22 GLN A 29 20.682 29.601 3.152 1.00 40.23 H new ATOM 464 N PHE A 30 21.470 22.701 2.204 1.00 24.33 N ATOM 465 CA PHE A 30 21.086 21.767 3.255 1.00 64.10 C ATOM 466 C PHE A 30 21.408 20.325 2.861 1.00 62.41 C ATOM 467 O PHE A 30 20.974 19.381 3.523 1.00 72.45 O ATOM 468 CB PHE A 30 19.596 21.910 3.572 1.00 0.40 C ATOM 469 CG PHE A 30 19.266 21.656 5.017 1.00 73.03 C ATOM 470 CD1 PHE A 30 18.644 20.480 5.405 1.00 30.11 C ATOM 471 CD2 PHE A 30 19.582 22.593 5.986 1.00 11.20 C ATOM 472 CE1 PHE A 30 18.344 20.244 6.732 1.00 23.22 C ATOM 473 CE2 PHE A 30 19.284 22.363 7.316 1.00 74.13 C ATOM 474 CZ PHE A 30 18.664 21.187 7.689 1.00 21.13 C ATOM 0 H PHE A 30 20.913 22.632 1.353 1.00 24.33 H new ATOM 0 HA PHE A 30 21.664 22.008 4.147 1.00 64.10 H new ATOM 0 HB2 PHE A 30 19.270 22.915 3.304 1.00 0.40 H new ATOM 0 HB3 PHE A 30 19.031 21.215 2.950 1.00 0.40 H new ATOM 0 HD1 PHE A 30 18.391 19.739 4.661 1.00 30.11 H new ATOM 0 HD2 PHE A 30 20.067 23.514 5.699 1.00 11.20 H new ATOM 0 HE1 PHE A 30 17.860 19.323 7.021 1.00 23.22 H new ATOM 0 HE2 PHE A 30 19.536 23.102 8.062 1.00 74.13 H new ATOM 0 HZ PHE A 30 18.430 21.005 8.727 1.00 21.13 H new ATOM 484 N SER A 31 22.174 20.158 1.782 1.00 32.32 N ATOM 485 CA SER A 31 22.562 18.827 1.317 1.00 50.21 C ATOM 486 C SER A 31 23.604 18.223 2.254 1.00 64.30 C ATOM 487 O SER A 31 23.669 17.006 2.431 1.00 12.40 O ATOM 488 CB SER A 31 23.114 18.891 -0.110 1.00 63.34 C ATOM 489 OG SER A 31 24.293 19.675 -0.171 1.00 12.04 O ATOM 0 H SER A 31 22.537 20.925 1.216 1.00 32.32 H new ATOM 0 HA SER A 31 21.675 18.193 1.317 1.00 50.21 H new ATOM 0 HB2 SER A 31 23.326 17.883 -0.466 1.00 63.34 H new ATOM 0 HB3 SER A 31 22.360 19.312 -0.775 1.00 63.34 H new ATOM 0 HG SER A 31 24.711 19.569 -1.051 1.00 12.04 H new ATOM 781 N SER A 52 2.775 34.308 13.897 1.00 74.33 N ATOM 782 CA SER A 52 2.429 35.714 13.714 1.00 61.41 C ATOM 783 C SER A 52 3.386 36.397 12.737 1.00 74.22 C ATOM 784 O SER A 52 3.024 37.379 12.088 1.00 10.31 O ATOM 785 CB SER A 52 2.449 36.441 15.061 1.00 11.53 C ATOM 786 OG SER A 52 1.968 37.769 14.933 1.00 64.53 O ATOM 0 HA SER A 52 1.424 35.762 13.294 1.00 61.41 H new ATOM 0 HB2 SER A 52 1.837 35.897 15.780 1.00 11.53 H new ATOM 0 HB3 SER A 52 3.465 36.456 15.455 1.00 11.53 H new ATOM 0 HG SER A 52 1.990 38.211 15.808 1.00 64.53 H new ATOM 792 N ALA A 53 4.605 35.871 12.633 1.00 12.45 N ATOM 793 CA ALA A 53 5.609 36.438 11.738 1.00 52.14 C ATOM 794 C ALA A 53 5.548 35.802 10.352 1.00 64.14 C ATOM 795 O ALA A 53 5.886 36.441 9.354 1.00 13.30 O ATOM 796 CB ALA A 53 6.999 36.278 12.332 1.00 34.31 C ATOM 0 H ALA A 53 4.920 35.054 13.157 1.00 12.45 H new ATOM 0 HA ALA A 53 5.391 37.500 11.626 1.00 52.14 H new ATOM 0 HB1 ALA A 53 7.736 36.706 11.653 1.00 34.31 H new ATOM 0 HB2 ALA A 53 7.047 36.794 13.291 1.00 34.31 H new ATOM 0 HB3 ALA A 53 7.212 35.219 12.479 1.00 34.31 H new ATOM 802 N ILE A 54 5.118 34.543 10.293 1.00 15.24 N ATOM 803 CA ILE A 54 5.018 33.832 9.022 1.00 4.43 C ATOM 804 C ILE A 54 3.649 34.040 8.375 1.00 50.54 C ATOM 805 O ILE A 54 2.692 33.319 8.662 1.00 64.03 O ATOM 806 CB ILE A 54 5.291 32.318 9.182 1.00 44.13 C ATOM 807 CG1 ILE A 54 4.561 31.759 10.407 1.00 34.42 C ATOM 808 CG2 ILE A 54 6.788 32.059 9.288 1.00 34.42 C ATOM 809 CD1 ILE A 54 4.635 30.253 10.527 1.00 1.41 C ATOM 0 H ILE A 54 4.835 33.997 11.107 1.00 15.24 H new ATOM 0 HA ILE A 54 5.786 34.252 8.372 1.00 4.43 H new ATOM 0 HB ILE A 54 4.910 31.806 8.298 1.00 44.13 H new ATOM 0 HG12 ILE A 54 4.984 32.207 11.306 1.00 34.42 H new ATOM 0 HG13 ILE A 54 3.514 32.060 10.363 1.00 34.42 H new ATOM 0 HG21 ILE A 54 6.965 30.989 9.400 1.00 34.42 H new ATOM 0 HG22 ILE A 54 7.284 32.416 8.385 1.00 34.42 H new ATOM 0 HG23 ILE A 54 7.188 32.586 10.154 1.00 34.42 H new ATOM 0 HD11 ILE A 54 4.095 29.932 11.418 1.00 1.41 H new ATOM 0 HD12 ILE A 54 4.185 29.795 9.646 1.00 1.41 H new ATOM 0 HD13 ILE A 54 5.678 29.945 10.604 1.00 1.41 H new ATOM 821 N ASN A 55 3.566 35.045 7.506 1.00 54.25 N ATOM 822 CA ASN A 55 2.323 35.361 6.808 1.00 44.55 C ATOM 823 C ASN A 55 2.594 36.273 5.615 1.00 53.32 C ATOM 824 O ASN A 55 2.741 37.487 5.769 1.00 32.33 O ATOM 825 CB ASN A 55 1.324 36.026 7.760 1.00 64.24 C ATOM 826 CG ASN A 55 -0.102 35.931 7.257 1.00 15.45 C ATOM 827 OD1 ASN A 55 -0.472 34.969 6.583 1.00 13.12 O ATOM 828 ND2 ASN A 55 -0.913 36.931 7.582 1.00 60.33 N ATOM 0 H ASN A 55 4.348 35.656 7.268 1.00 54.25 H new ATOM 0 HA ASN A 55 1.892 34.428 6.445 1.00 44.55 H new ATOM 0 HB2 ASN A 55 1.393 35.556 8.741 1.00 64.24 H new ATOM 0 HB3 ASN A 55 1.592 37.075 7.889 1.00 64.24 H new ATOM 0 HD21 ASN A 55 -1.884 36.921 7.271 1.00 60.33 H new ATOM 0 HD22 ASN A 55 -0.564 37.709 8.142 1.00 60.33 H new ATOM 835 N GLY A 56 2.664 35.679 4.426 1.00 51.01 N ATOM 836 CA GLY A 56 2.922 36.450 3.222 1.00 12.02 C ATOM 837 C GLY A 56 4.405 36.654 2.972 1.00 41.15 C ATOM 838 O GLY A 56 4.987 37.642 3.423 1.00 42.41 O ATOM 0 H GLY A 56 2.547 34.677 4.275 1.00 51.01 H new ATOM 0 HA2 GLY A 56 2.479 35.941 2.366 1.00 12.02 H new ATOM 0 HA3 GLY A 56 2.433 37.421 3.304 1.00 12.02 H new ATOM 842 N ASN A 57 5.015 35.717 2.253 1.00 70.35 N ATOM 843 CA ASN A 57 6.439 35.790 1.941 1.00 14.12 C ATOM 844 C ASN A 57 6.683 36.712 0.745 1.00 12.55 C ATOM 845 O ASN A 57 5.968 36.640 -0.255 1.00 14.35 O ATOM 846 CB ASN A 57 6.980 34.388 1.647 1.00 40.43 C ATOM 847 CG ASN A 57 8.464 34.256 1.932 1.00 71.24 C ATOM 848 OD1 ASN A 57 8.868 33.992 3.064 1.00 25.14 O ATOM 849 ND2 ASN A 57 9.284 34.429 0.902 1.00 1.21 N ATOM 0 H ASN A 57 4.544 34.895 1.874 1.00 70.35 H new ATOM 0 HA ASN A 57 6.964 36.202 2.803 1.00 14.12 H new ATOM 0 HB2 ASN A 57 6.434 33.660 2.247 1.00 40.43 H new ATOM 0 HB3 ASN A 57 6.793 34.144 0.601 1.00 40.43 H new ATOM 0 HD21 ASN A 57 10.292 34.344 1.033 1.00 1.21 H new ATOM 0 HD22 ASN A 57 8.906 34.647 -0.020 1.00 1.21 H new ATOM 856 N PRO A 58 7.692 37.602 0.840 1.00 4.21 N ATOM 857 CA PRO A 58 8.032 38.541 -0.241 1.00 14.42 C ATOM 858 C PRO A 58 8.546 37.840 -1.500 1.00 2.13 C ATOM 859 O PRO A 58 8.308 38.304 -2.615 1.00 0.21 O ATOM 860 CB PRO A 58 9.134 39.412 0.372 1.00 72.54 C ATOM 861 CG PRO A 58 9.698 38.609 1.491 1.00 33.21 C ATOM 862 CD PRO A 58 8.567 37.774 2.017 1.00 42.52 C ATOM 0 HA PRO A 58 7.157 39.101 -0.572 1.00 14.42 H new ATOM 0 HB2 PRO A 58 9.901 39.651 -0.365 1.00 72.54 H new ATOM 0 HB3 PRO A 58 8.731 40.359 0.732 1.00 72.54 H new ATOM 0 HG2 PRO A 58 10.518 37.980 1.144 1.00 33.21 H new ATOM 0 HG3 PRO A 58 10.100 39.256 2.271 1.00 33.21 H new ATOM 0 HD2 PRO A 58 8.919 36.816 2.399 1.00 42.52 H new ATOM 0 HD3 PRO A 58 8.047 38.272 2.835 1.00 42.52 H new ATOM 870 N SER A 59 9.245 36.723 -1.315 1.00 22.34 N ATOM 871 CA SER A 59 9.791 35.960 -2.435 1.00 32.21 C ATOM 872 C SER A 59 8.900 34.765 -2.772 1.00 3.10 C ATOM 873 O SER A 59 9.387 33.659 -3.009 1.00 60.44 O ATOM 874 CB SER A 59 11.207 35.481 -2.106 1.00 2.30 C ATOM 875 OG SER A 59 12.075 36.575 -1.866 1.00 74.44 O ATOM 0 H SER A 59 9.447 36.325 -0.398 1.00 22.34 H new ATOM 0 HA SER A 59 9.827 36.615 -3.305 1.00 32.21 H new ATOM 0 HB2 SER A 59 11.181 34.835 -1.228 1.00 2.30 H new ATOM 0 HB3 SER A 59 11.592 34.882 -2.931 1.00 2.30 H new ATOM 0 HG SER A 59 12.972 36.241 -1.657 1.00 74.44 H new ATOM 881 N TRP A 60 7.591 35.002 -2.807 1.00 54.22 N ATOM 882 CA TRP A 60 6.623 33.952 -3.111 1.00 73.23 C ATOM 883 C TRP A 60 6.132 34.064 -4.556 1.00 21.41 C ATOM 884 O TRP A 60 5.024 33.638 -4.884 1.00 4.11 O ATOM 885 CB TRP A 60 5.439 34.044 -2.143 1.00 72.33 C ATOM 886 CG TRP A 60 4.845 32.715 -1.778 1.00 64.10 C ATOM 887 CD1 TRP A 60 5.027 31.526 -2.424 1.00 5.03 C ATOM 888 CD2 TRP A 60 3.967 32.441 -0.679 1.00 71.35 C ATOM 889 NE1 TRP A 60 4.318 30.533 -1.796 1.00 45.43 N ATOM 890 CE2 TRP A 60 3.660 31.068 -0.722 1.00 14.41 C ATOM 891 CE3 TRP A 60 3.412 33.224 0.337 1.00 2.32 C ATOM 892 CZ2 TRP A 60 2.823 30.463 0.211 1.00 3.23 C ATOM 893 CZ3 TRP A 60 2.581 32.621 1.262 1.00 0.13 C ATOM 894 CH2 TRP A 60 2.294 31.252 1.194 1.00 54.24 C ATOM 0 H TRP A 60 7.175 35.916 -2.628 1.00 54.22 H new ATOM 0 HA TRP A 60 7.112 32.985 -2.993 1.00 73.23 H new ATOM 0 HB2 TRP A 60 5.765 34.547 -1.233 1.00 72.33 H new ATOM 0 HB3 TRP A 60 4.664 34.666 -2.591 1.00 72.33 H new ATOM 0 HD1 TRP A 60 5.640 31.387 -3.302 1.00 5.03 H new ATOM 0 HE1 TRP A 60 4.287 29.555 -2.083 1.00 45.43 H new ATOM 0 HE3 TRP A 60 3.628 34.280 0.398 1.00 2.32 H new ATOM 0 HZ2 TRP A 60 2.599 29.408 0.160 1.00 3.23 H new ATOM 0 HZ3 TRP A 60 2.145 33.216 2.051 1.00 0.13 H new ATOM 0 HH2 TRP A 60 1.642 30.811 1.933 1.00 54.24 H new ATOM 905 N HIS A 61 6.970 34.630 -5.420 1.00 25.52 N ATOM 906 CA HIS A 61 6.617 34.801 -6.826 1.00 54.03 C ATOM 907 C HIS A 61 7.421 33.856 -7.723 1.00 24.45 C ATOM 908 O HIS A 61 8.139 34.293 -8.624 1.00 34.41 O ATOM 909 CB HIS A 61 6.819 36.264 -7.260 1.00 24.23 C ATOM 910 CG HIS A 61 8.139 36.859 -6.856 1.00 61.24 C ATOM 911 ND1 HIS A 61 8.361 37.434 -5.623 1.00 12.42 N ATOM 912 CD2 HIS A 61 9.306 36.975 -7.536 1.00 32.11 C ATOM 913 CE1 HIS A 61 9.604 37.877 -5.562 1.00 74.03 C ATOM 914 NE2 HIS A 61 10.198 37.610 -6.709 1.00 73.22 N ATOM 0 H HIS A 61 7.896 34.977 -5.172 1.00 25.52 H new ATOM 0 HA HIS A 61 5.563 34.547 -6.938 1.00 54.03 H new ATOM 0 HB2 HIS A 61 6.725 36.324 -8.344 1.00 24.23 H new ATOM 0 HB3 HIS A 61 6.017 36.869 -6.836 1.00 24.23 H new ATOM 0 HD2 HIS A 61 9.498 36.631 -8.542 1.00 32.11 H new ATOM 0 HE1 HIS A 61 10.057 38.373 -4.717 1.00 74.03 H new ATOM 0 HE2 HIS A 61 11.164 37.839 -6.943 1.00 73.22 H new ATOM 923 N LEU A 62 7.282 32.554 -7.483 1.00 60.23 N ATOM 924 CA LEU A 62 7.995 31.553 -8.274 1.00 53.32 C ATOM 925 C LEU A 62 7.255 31.249 -9.577 1.00 64.45 C ATOM 926 O LEU A 62 6.204 31.831 -9.848 1.00 4.12 O ATOM 927 CB LEU A 62 8.247 30.250 -7.475 1.00 60.31 C ATOM 928 CG LEU A 62 7.132 29.733 -6.534 1.00 5.22 C ATOM 929 CD1 LEU A 62 7.184 30.435 -5.185 1.00 43.25 C ATOM 930 CD2 LEU A 62 5.745 29.868 -7.154 1.00 53.32 C ATOM 0 H LEU A 62 6.685 32.169 -6.751 1.00 60.23 H new ATOM 0 HA LEU A 62 8.967 31.980 -8.520 1.00 53.32 H new ATOM 0 HB2 LEU A 62 8.469 29.459 -8.192 1.00 60.31 H new ATOM 0 HB3 LEU A 62 9.145 30.397 -6.875 1.00 60.31 H new ATOM 0 HG LEU A 62 7.318 28.670 -6.380 1.00 5.22 H new ATOM 0 HD11 LEU A 62 6.389 30.052 -4.545 1.00 43.25 H new ATOM 0 HD12 LEU A 62 8.150 30.249 -4.715 1.00 43.25 H new ATOM 0 HD13 LEU A 62 7.050 31.507 -5.327 1.00 43.25 H new ATOM 0 HD21 LEU A 62 4.996 29.492 -6.456 1.00 53.32 H new ATOM 0 HD22 LEU A 62 5.544 30.917 -7.371 1.00 53.32 H new ATOM 0 HD23 LEU A 62 5.702 29.291 -8.078 1.00 53.32 H new ATOM 942 N ALA A 63 7.826 30.347 -10.383 1.00 74.21 N ATOM 943 CA ALA A 63 7.238 29.948 -11.666 1.00 61.02 C ATOM 944 C ALA A 63 7.091 31.137 -12.621 1.00 53.04 C ATOM 945 O ALA A 63 7.690 32.195 -12.414 1.00 15.12 O ATOM 946 CB ALA A 63 5.893 29.264 -11.446 1.00 32.44 C ATOM 0 H ALA A 63 8.704 29.875 -10.166 1.00 74.21 H new ATOM 0 HA ALA A 63 7.921 29.239 -12.134 1.00 61.02 H new ATOM 0 HB1 ALA A 63 5.470 28.974 -12.408 1.00 32.44 H new ATOM 0 HB2 ALA A 63 6.033 28.376 -10.829 1.00 32.44 H new ATOM 0 HB3 ALA A 63 5.213 29.952 -10.943 1.00 32.44 H new ATOM 952 N ASP A 64 6.303 30.951 -13.676 1.00 13.50 N ATOM 953 CA ASP A 64 6.077 32.005 -14.659 1.00 61.22 C ATOM 954 C ASP A 64 4.593 32.345 -14.759 1.00 52.13 C ATOM 955 O ASP A 64 3.837 31.669 -15.457 1.00 50.40 O ATOM 956 CB ASP A 64 6.611 31.581 -16.030 1.00 24.33 C ATOM 957 CG ASP A 64 8.110 31.355 -16.025 1.00 12.13 C ATOM 958 OD1 ASP A 64 8.534 30.190 -15.867 1.00 72.03 O ATOM 959 OD2 ASP A 64 8.859 32.342 -16.176 1.00 51.52 O1- ATOM 0 H ASP A 64 5.810 30.080 -13.872 1.00 13.50 H new ATOM 0 HA ASP A 64 6.614 32.895 -14.330 1.00 61.22 H new ATOM 0 HB2 ASP A 64 6.110 30.665 -16.344 1.00 24.33 H new ATOM 0 HB3 ASP A 64 6.365 32.347 -16.765 1.00 24.33 H new ATOM 964 N GLU A 65 4.185 33.397 -14.052 1.00 54.02 N ATOM 965 CA GLU A 65 2.790 33.832 -14.054 1.00 23.21 C ATOM 966 C GLU A 65 2.421 34.562 -15.357 1.00 24.42 C ATOM 967 O GLU A 65 1.451 34.178 -16.013 1.00 2.34 O ATOM 968 CB GLU A 65 2.500 34.718 -12.836 1.00 35.22 C ATOM 969 CG GLU A 65 1.034 35.095 -12.687 1.00 42.51 C ATOM 970 CD GLU A 65 0.785 36.021 -11.513 1.00 74.11 C ATOM 971 OE1 GLU A 65 1.073 37.230 -11.639 1.00 14.14 O ATOM 972 OE2 GLU A 65 0.300 35.538 -10.468 1.00 65.12 O1- ATOM 0 H GLU A 65 4.801 33.964 -13.470 1.00 54.02 H new ATOM 0 HA GLU A 65 2.168 32.939 -13.993 1.00 23.21 H new ATOM 0 HB2 GLU A 65 2.825 34.199 -11.935 1.00 35.22 H new ATOM 0 HB3 GLU A 65 3.094 35.629 -12.911 1.00 35.22 H new ATOM 0 HG2 GLU A 65 0.692 35.576 -13.603 1.00 42.51 H new ATOM 0 HG3 GLU A 65 0.441 34.189 -12.562 1.00 42.51 H new ATOM 979 N PRO A 66 3.172 35.624 -15.761 1.00 43.01 N ATOM 980 CA PRO A 66 2.878 36.361 -17.001 1.00 13.12 C ATOM 981 C PRO A 66 3.005 35.484 -18.245 1.00 4.25 C ATOM 982 O PRO A 66 2.188 35.572 -19.163 1.00 42.32 O ATOM 983 CB PRO A 66 3.929 37.477 -17.025 1.00 70.11 C ATOM 984 CG PRO A 66 5.013 37.021 -16.113 1.00 54.50 C ATOM 985 CD PRO A 66 4.340 36.197 -15.056 1.00 23.15 C ATOM 0 HA PRO A 66 1.852 36.729 -17.014 1.00 13.12 H new ATOM 0 HB2 PRO A 66 4.307 37.638 -18.034 1.00 70.11 H new ATOM 0 HB3 PRO A 66 3.505 38.423 -16.688 1.00 70.11 H new ATOM 0 HG2 PRO A 66 5.756 36.434 -16.652 1.00 54.50 H new ATOM 0 HG3 PRO A 66 5.536 37.870 -15.673 1.00 54.50 H new ATOM 0 HD2 PRO A 66 5.000 35.419 -14.673 1.00 23.15 H new ATOM 0 HD3 PRO A 66 4.037 36.806 -14.204 1.00 23.15 H new ATOM 993 N ALA A 67 4.032 34.638 -18.268 1.00 24.23 N ATOM 994 CA ALA A 67 4.260 33.741 -19.393 1.00 34.21 C ATOM 995 C ALA A 67 3.829 32.318 -19.046 1.00 64.33 C ATOM 996 O ALA A 67 4.657 31.464 -18.727 1.00 15.33 O ATOM 997 CB ALA A 67 5.724 33.774 -19.811 1.00 61.20 C ATOM 0 H ALA A 67 4.719 34.556 -17.519 1.00 24.23 H new ATOM 0 HA ALA A 67 3.655 34.082 -20.233 1.00 34.21 H new ATOM 0 HB1 ALA A 67 5.877 33.098 -20.653 1.00 61.20 H new ATOM 0 HB2 ALA A 67 5.996 34.788 -20.105 1.00 61.20 H new ATOM 0 HB3 ALA A 67 6.348 33.459 -18.975 1.00 61.20 H new ATOM 1003 N VAL A 68 2.522 32.076 -19.099 1.00 24.33 N ATOM 1004 CA VAL A 68 1.973 30.762 -18.790 1.00 52.42 C ATOM 1005 C VAL A 68 2.061 29.833 -20.004 1.00 54.54 C ATOM 1006 O VAL A 68 1.752 30.228 -21.130 1.00 22.13 O ATOM 1007 CB VAL A 68 0.507 30.865 -18.297 1.00 52.45 C ATOM 1008 CG1 VAL A 68 -0.371 31.576 -19.318 1.00 33.15 C ATOM 1009 CG2 VAL A 68 -0.056 29.489 -17.969 1.00 71.52 C ATOM 0 H VAL A 68 1.824 32.775 -19.354 1.00 24.33 H new ATOM 0 HA VAL A 68 2.573 30.338 -17.985 1.00 52.42 H new ATOM 0 HB VAL A 68 0.508 31.460 -17.384 1.00 52.45 H new ATOM 0 HG11 VAL A 68 -1.393 31.632 -18.943 1.00 33.15 H new ATOM 0 HG12 VAL A 68 0.010 32.583 -19.486 1.00 33.15 H new ATOM 0 HG13 VAL A 68 -0.359 31.022 -20.257 1.00 33.15 H new ATOM 0 HG21 VAL A 68 -1.086 29.590 -17.626 1.00 71.52 H new ATOM 0 HG22 VAL A 68 -0.031 28.863 -18.861 1.00 71.52 H new ATOM 0 HG23 VAL A 68 0.545 29.028 -17.185 1.00 71.52 H new ATOM 1019 N ASN A 69 2.506 28.602 -19.766 1.00 12.52 N ATOM 1020 CA ASN A 69 2.642 27.618 -20.833 1.00 62.31 C ATOM 1021 C ASN A 69 2.050 26.276 -20.409 1.00 52.35 C ATOM 1022 O ASN A 69 2.465 25.691 -19.407 1.00 12.14 O ATOM 1023 CB ASN A 69 4.119 27.448 -21.206 1.00 64.52 C ATOM 1024 CG ASN A 69 4.315 26.893 -22.607 1.00 44.03 C ATOM 1025 OD1 ASN A 69 3.499 26.120 -23.108 1.00 1.12 O ATOM 1026 ND2 ASN A 69 5.408 27.290 -23.248 1.00 14.02 N ATOM 0 H ASN A 69 2.778 28.263 -18.843 1.00 12.52 H new ATOM 0 HA ASN A 69 2.093 27.976 -21.704 1.00 62.31 H new ATOM 0 HB2 ASN A 69 4.621 28.412 -21.129 1.00 64.52 H new ATOM 0 HB3 ASN A 69 4.596 26.782 -20.487 1.00 64.52 H new ATOM 0 HD21 ASN A 69 5.596 26.953 -24.192 1.00 14.02 H new ATOM 0 HD22 ASN A 69 6.059 27.932 -22.796 1.00 14.02 H new ATOM 1033 N GLY A 70 1.076 25.798 -21.178 1.00 41.10 N ATOM 1034 CA GLY A 70 0.443 24.528 -20.876 1.00 22.11 C ATOM 1035 C GLY A 70 1.096 23.374 -21.610 1.00 22.11 C ATOM 1036 O GLY A 70 0.795 23.132 -22.780 1.00 72.54 O ATOM 0 H GLY A 70 0.714 26.269 -22.007 1.00 41.10 H new ATOM 0 HA2 GLY A 70 0.490 24.347 -19.802 1.00 22.11 H new ATOM 0 HA3 GLY A 70 -0.612 24.577 -21.145 1.00 22.11 H new ATOM 1040 N ALA A 71 1.991 22.669 -20.910 1.00 32.52 N ATOM 1041 CA ALA A 71 2.719 21.525 -21.469 1.00 73.22 C ATOM 1042 C ALA A 71 3.581 21.933 -22.663 1.00 30.32 C ATOM 1043 O ALA A 71 3.155 21.842 -23.816 1.00 20.43 O ATOM 1044 CB ALA A 71 1.762 20.401 -21.851 1.00 43.24 C ATOM 0 H ALA A 71 2.231 22.875 -19.940 1.00 32.52 H new ATOM 0 HA ALA A 71 3.388 21.155 -20.692 1.00 73.22 H new ATOM 0 HB1 ALA A 71 2.328 19.565 -22.263 1.00 43.24 H new ATOM 0 HB2 ALA A 71 1.218 20.070 -20.966 1.00 43.24 H new ATOM 0 HB3 ALA A 71 1.055 20.763 -22.597 1.00 43.24 H new ATOM 1050 N THR A 72 4.798 22.384 -22.374 1.00 74.51 N ATOM 1051 CA THR A 72 5.728 22.809 -23.416 1.00 32.31 C ATOM 1052 C THR A 72 6.627 21.653 -23.858 1.00 34.30 C ATOM 1053 O THR A 72 7.195 21.678 -24.951 1.00 52.30 O ATOM 1054 CB THR A 72 6.599 23.994 -22.942 1.00 41.01 C ATOM 1055 OG1 THR A 72 7.514 24.383 -23.974 1.00 34.24 O ATOM 1056 CG2 THR A 72 7.374 23.639 -21.679 1.00 71.34 C ATOM 0 H THR A 72 5.164 22.465 -21.425 1.00 74.51 H new ATOM 0 HA THR A 72 5.130 23.135 -24.267 1.00 32.31 H new ATOM 0 HB THR A 72 5.932 24.826 -22.716 1.00 41.01 H new ATOM 0 HG1 THR A 72 8.059 25.135 -23.662 1.00 34.24 H new ATOM 0 HG21 THR A 72 7.977 24.493 -21.370 1.00 71.34 H new ATOM 0 HG22 THR A 72 6.675 23.382 -20.883 1.00 71.34 H new ATOM 0 HG23 THR A 72 8.025 22.788 -21.879 1.00 71.34 H new ATOM 1064 N GLY A 73 6.744 20.638 -23.005 1.00 71.44 N ATOM 1065 CA GLY A 73 7.571 19.489 -23.324 1.00 14.10 C ATOM 1066 C GLY A 73 8.065 18.767 -22.086 1.00 53.25 C ATOM 1067 O GLY A 73 9.225 18.910 -21.699 1.00 51.51 O ATOM 0 H GLY A 73 6.280 20.592 -22.098 1.00 71.44 H new ATOM 0 HA2 GLY A 73 7.001 18.795 -23.942 1.00 14.10 H new ATOM 0 HA3 GLY A 73 8.426 19.814 -23.916 1.00 14.10 H new ATOM 1071 N HIS A 74 7.183 17.989 -21.466 1.00 3.13 N ATOM 1072 CA HIS A 74 7.535 17.238 -20.264 1.00 25.33 C ATOM 1073 C HIS A 74 8.186 15.903 -20.627 1.00 21.44 C ATOM 1074 O HIS A 74 9.033 15.396 -19.894 1.00 51.01 O ATOM 1075 CB HIS A 74 6.294 17.013 -19.382 1.00 20.21 C ATOM 1076 CG HIS A 74 5.192 16.238 -20.044 1.00 74.00 C ATOM 1077 ND1 HIS A 74 4.295 16.804 -20.925 1.00 3.44 N ATOM 1078 CD2 HIS A 74 4.847 14.931 -19.948 1.00 2.52 C ATOM 1079 CE1 HIS A 74 3.447 15.881 -21.342 1.00 10.44 C ATOM 1080 NE2 HIS A 74 3.761 14.736 -20.764 1.00 13.23 N ATOM 0 H HIS A 74 6.219 17.862 -21.775 1.00 3.13 H new ATOM 0 HA HIS A 74 8.258 17.825 -19.697 1.00 25.33 H new ATOM 0 HB2 HIS A 74 6.598 16.487 -18.477 1.00 20.21 H new ATOM 0 HB3 HIS A 74 5.904 17.982 -19.072 1.00 20.21 H new ATOM 0 HD1 HIS A 74 4.287 17.783 -21.210 1.00 3.44 H new ATOM 0 HD2 HIS A 74 5.336 14.182 -19.342 1.00 2.52 H new ATOM 0 HE1 HIS A 74 2.635 16.036 -22.037 1.00 10.44 H new ATOM 1089 N SER A 75 7.792 15.347 -21.771 1.00 22.24 N ATOM 1090 CA SER A 75 8.331 14.073 -22.233 1.00 71.32 C ATOM 1091 C SER A 75 9.483 14.284 -23.218 1.00 3.04 C ATOM 1092 O SER A 75 9.926 13.345 -23.879 1.00 40.42 O ATOM 1093 CB SER A 75 7.224 13.243 -22.887 1.00 64.34 C ATOM 1094 OG SER A 75 6.583 13.970 -23.920 1.00 61.11 O ATOM 0 H SER A 75 7.100 15.761 -22.395 1.00 22.24 H new ATOM 0 HA SER A 75 8.721 13.535 -21.369 1.00 71.32 H new ATOM 0 HB2 SER A 75 7.646 12.324 -23.293 1.00 64.34 H new ATOM 0 HB3 SER A 75 6.491 12.952 -22.135 1.00 64.34 H new ATOM 0 HG SER A 75 5.612 13.927 -23.796 1.00 61.11 H new ATOM 1100 N SER A 76 9.965 15.524 -23.302 1.00 54.44 N ATOM 1101 CA SER A 76 11.065 15.865 -24.200 1.00 15.10 C ATOM 1102 C SER A 76 12.416 15.558 -23.555 1.00 53.35 C ATOM 1103 O SER A 76 13.413 15.358 -24.251 1.00 23.24 O ATOM 1104 CB SER A 76 10.992 17.345 -24.586 1.00 73.21 C ATOM 1105 OG SER A 76 11.970 17.672 -25.558 1.00 73.30 O ATOM 0 H SER A 76 9.609 16.310 -22.757 1.00 54.44 H new ATOM 0 HA SER A 76 10.970 15.256 -25.099 1.00 15.10 H new ATOM 0 HB2 SER A 76 9.999 17.573 -24.974 1.00 73.21 H new ATOM 0 HB3 SER A 76 11.137 17.962 -23.699 1.00 73.21 H new ATOM 0 HG SER A 76 11.899 18.622 -25.787 1.00 73.30 H new ATOM 1111 N SER A 77 12.439 15.521 -22.223 1.00 50.20 N ATOM 1112 CA SER A 77 13.666 15.235 -21.483 1.00 40.52 C ATOM 1113 C SER A 77 14.045 13.759 -21.609 1.00 25.42 C ATOM 1114 O SER A 77 15.228 13.419 -21.661 1.00 12.15 O ATOM 1115 CB SER A 77 13.498 15.610 -20.009 1.00 12.03 C ATOM 1116 OG SER A 77 14.721 15.474 -19.305 1.00 2.11 O ATOM 0 H SER A 77 11.622 15.686 -21.635 1.00 50.20 H new ATOM 0 HA SER A 77 14.469 15.835 -21.911 1.00 40.52 H new ATOM 0 HB2 SER A 77 13.142 16.637 -19.930 1.00 12.03 H new ATOM 0 HB3 SER A 77 12.740 14.974 -19.553 1.00 12.03 H new ATOM 0 HG SER A 77 14.602 14.847 -18.561 1.00 2.11 H new ATOM 1122 N LEU A 78 13.022 12.898 -21.658 1.00 45.32 N ATOM 1123 CA LEU A 78 13.207 11.450 -21.787 1.00 1.43 C ATOM 1124 C LEU A 78 14.037 10.876 -20.638 1.00 1.33 C ATOM 1125 O LEU A 78 15.221 10.576 -20.797 1.00 32.03 O ATOM 1126 CB LEU A 78 13.851 11.102 -23.134 1.00 62.23 C ATOM 1127 CG LEU A 78 12.971 10.290 -24.087 1.00 4.35 C ATOM 1128 CD1 LEU A 78 13.590 10.242 -25.475 1.00 12.55 C ATOM 1129 CD2 LEU A 78 12.763 8.880 -23.551 1.00 53.04 C ATOM 0 H LEU A 78 12.045 13.186 -21.609 1.00 45.32 H new ATOM 0 HA LEU A 78 12.218 10.994 -21.741 1.00 1.43 H new ATOM 0 HB2 LEU A 78 14.139 12.028 -23.631 1.00 62.23 H new ATOM 0 HB3 LEU A 78 14.768 10.543 -22.947 1.00 62.23 H new ATOM 0 HG LEU A 78 12.000 10.780 -24.158 1.00 4.35 H new ATOM 0 HD11 LEU A 78 12.950 9.660 -26.139 1.00 12.55 H new ATOM 0 HD12 LEU A 78 13.690 11.255 -25.864 1.00 12.55 H new ATOM 0 HD13 LEU A 78 14.574 9.776 -25.419 1.00 12.55 H new ATOM 0 HD21 LEU A 78 12.135 8.317 -24.242 1.00 53.04 H new ATOM 0 HD22 LEU A 78 13.728 8.383 -23.451 1.00 53.04 H new ATOM 0 HD23 LEU A 78 12.277 8.929 -22.577 1.00 53.04 H new ATOM 1141 N ASP A 79 13.402 10.731 -19.479 1.00 4.20 N ATOM 1142 CA ASP A 79 14.068 10.185 -18.301 1.00 44.32 C ATOM 1143 C ASP A 79 13.523 8.798 -17.972 1.00 33.32 C ATOM 1144 O ASP A 79 13.849 8.218 -16.935 1.00 63.14 O ATOM 1145 CB ASP A 79 13.881 11.118 -17.101 1.00 21.32 C ATOM 1146 CG ASP A 79 14.496 12.486 -17.321 1.00 24.35 C ATOM 1147 OD1 ASP A 79 13.762 13.490 -17.212 1.00 44.45 O ATOM 1148 OD2 ASP A 79 15.711 12.553 -17.600 1.00 14.03 O1- ATOM 0 H ASP A 79 12.425 10.984 -19.330 1.00 4.20 H new ATOM 0 HA ASP A 79 15.133 10.100 -18.519 1.00 44.32 H new ATOM 0 HB2 ASP A 79 12.816 11.232 -16.897 1.00 21.32 H new ATOM 0 HB3 ASP A 79 14.328 10.661 -16.218 1.00 21.32 H new ATOM 1153 N ALA A 80 12.698 8.267 -18.873 1.00 3.21 N ATOM 1154 CA ALA A 80 12.095 6.951 -18.688 1.00 40.04 C ATOM 1155 C ALA A 80 12.920 5.856 -19.362 1.00 24.34 C ATOM 1156 O ALA A 80 12.463 4.722 -19.497 1.00 30.50 O ATOM 1157 CB ALA A 80 10.674 6.951 -19.231 1.00 74.44 C ATOM 0 H ALA A 80 12.432 8.731 -19.741 1.00 3.21 H new ATOM 0 HA ALA A 80 12.073 6.737 -17.619 1.00 40.04 H new ATOM 0 HB1 ALA A 80 10.230 5.965 -19.089 1.00 74.44 H new ATOM 0 HB2 ALA A 80 10.081 7.695 -18.699 1.00 74.44 H new ATOM 0 HB3 ALA A 80 10.691 7.192 -20.294 1.00 74.44 H new ATOM 1163 N ARG A 81 14.140 6.201 -19.773 1.00 45.31 N ATOM 1164 CA ARG A 81 15.033 5.249 -20.434 1.00 23.14 C ATOM 1165 C ARG A 81 15.538 4.192 -19.453 1.00 60.05 C ATOM 1166 O ARG A 81 15.839 3.063 -19.843 1.00 31.14 O ATOM 1167 CB ARG A 81 16.223 5.984 -21.054 1.00 43.53 C ATOM 1168 CG ARG A 81 15.831 7.024 -22.091 1.00 62.34 C ATOM 1169 CD ARG A 81 17.044 7.795 -22.586 1.00 33.32 C ATOM 1170 NE ARG A 81 16.680 8.848 -23.532 1.00 51.30 N ATOM 1171 CZ ARG A 81 17.467 9.880 -23.829 1.00 65.54 C ATOM 1172 NH1 ARG A 81 18.658 10.000 -23.258 1.00 5.44 N1+ ATOM 1173 NH2 ARG A 81 17.062 10.795 -24.699 1.00 2.11 N ATOM 0 H ARG A 81 14.534 7.135 -19.660 1.00 45.31 H new ATOM 0 HA ARG A 81 14.466 4.748 -21.219 1.00 23.14 H new ATOM 0 HB2 ARG A 81 16.790 6.471 -20.261 1.00 43.53 H new ATOM 0 HB3 ARG A 81 16.887 5.254 -21.518 1.00 43.53 H new ATOM 0 HG2 ARG A 81 15.340 6.535 -22.932 1.00 62.34 H new ATOM 0 HG3 ARG A 81 15.108 7.717 -21.659 1.00 62.34 H new ATOM 0 HD2 ARG A 81 17.564 8.237 -21.736 1.00 33.32 H new ATOM 0 HD3 ARG A 81 17.741 7.106 -23.063 1.00 33.32 H new ATOM 0 HE ARG A 81 15.771 8.789 -23.991 1.00 51.30 H new ATOM 0 HH11 ARG A 81 18.975 9.300 -22.588 1.00 5.44 H new ATOM 0 HH12 ARG A 81 19.257 10.793 -23.489 1.00 5.44 H new ATOM 0 HH21 ARG A 81 16.147 10.709 -25.141 1.00 2.11 H new ATOM 0 HH22 ARG A 81 17.666 11.585 -24.926 1.00 2.11 H new ATOM 1187 N GLU A 82 15.628 4.570 -18.181 1.00 70.12 N ATOM 1188 CA GLU A 82 16.098 3.665 -17.137 1.00 23.31 C ATOM 1189 C GLU A 82 14.927 3.109 -16.323 1.00 4.31 C ATOM 1190 O GLU A 82 15.132 2.407 -15.331 1.00 72.35 O ATOM 1191 CB GLU A 82 17.075 4.399 -16.215 1.00 20.40 C ATOM 1192 CG GLU A 82 18.209 5.089 -16.959 1.00 15.22 C ATOM 1193 CD GLU A 82 18.928 6.118 -16.108 1.00 12.33 C ATOM 1194 OE1 GLU A 82 18.292 7.125 -15.731 1.00 34.55 O ATOM 1195 OE2 GLU A 82 20.128 5.922 -15.826 1.00 22.15 O1- ATOM 0 H GLU A 82 15.380 5.502 -17.847 1.00 70.12 H new ATOM 0 HA GLU A 82 16.608 2.828 -17.613 1.00 23.31 H new ATOM 0 HB2 GLU A 82 16.527 5.141 -15.635 1.00 20.40 H new ATOM 0 HB3 GLU A 82 17.497 3.687 -15.505 1.00 20.40 H new ATOM 0 HG2 GLU A 82 18.925 4.340 -17.297 1.00 15.22 H new ATOM 0 HG3 GLU A 82 17.811 5.575 -17.850 1.00 15.22 H new ATOM 1202 N VAL A 83 13.700 3.422 -16.770 1.00 0.31 N ATOM 1203 CA VAL A 83 12.464 2.977 -16.107 1.00 11.23 C ATOM 1204 C VAL A 83 12.468 3.366 -14.620 1.00 23.34 C ATOM 1205 O VAL A 83 13.063 4.381 -14.251 1.00 54.21 O ATOM 1206 CB VAL A 83 12.232 1.446 -16.257 1.00 21.33 C ATOM 1207 CG1 VAL A 83 10.742 1.129 -16.294 1.00 15.22 C ATOM 1208 CG2 VAL A 83 12.908 0.902 -17.511 1.00 54.14 C ATOM 0 H VAL A 83 13.537 3.991 -17.601 1.00 0.31 H new ATOM 0 HA VAL A 83 11.640 3.486 -16.607 1.00 11.23 H new ATOM 0 HB VAL A 83 12.678 0.961 -15.389 1.00 21.33 H new ATOM 0 HG11 VAL A 83 10.601 0.053 -16.399 1.00 15.22 H new ATOM 0 HG12 VAL A 83 10.275 1.467 -15.369 1.00 15.22 H new ATOM 0 HG13 VAL A 83 10.282 1.640 -17.140 1.00 15.22 H new ATOM 0 HG21 VAL A 83 12.727 -0.170 -17.586 1.00 54.14 H new ATOM 0 HG22 VAL A 83 12.500 1.401 -18.390 1.00 54.14 H new ATOM 0 HG23 VAL A 83 13.981 1.085 -17.455 1.00 54.14 H new ATOM 1218 N ILE A 84 11.794 2.564 -13.780 1.00 35.11 N ATOM 1219 CA ILE A 84 11.714 2.811 -12.333 1.00 61.14 C ATOM 1220 C ILE A 84 10.853 4.042 -12.017 1.00 21.13 C ATOM 1221 O ILE A 84 11.036 5.104 -12.608 1.00 13.15 O ATOM 1222 CB ILE A 84 13.124 2.978 -11.708 1.00 74.23 C ATOM 1223 CG1 ILE A 84 13.956 1.713 -11.938 1.00 62.43 C ATOM 1224 CG2 ILE A 84 13.031 3.286 -10.218 1.00 74.14 C ATOM 1225 CD1 ILE A 84 15.421 1.877 -11.593 1.00 70.13 C ATOM 0 H ILE A 84 11.292 1.730 -14.084 1.00 35.11 H new ATOM 0 HA ILE A 84 11.239 1.936 -11.890 1.00 61.14 H new ATOM 0 HB ILE A 84 13.615 3.820 -12.196 1.00 74.23 H new ATOM 0 HG12 ILE A 84 13.540 0.902 -11.341 1.00 62.43 H new ATOM 0 HG13 ILE A 84 13.869 1.417 -12.983 1.00 62.43 H new ATOM 0 HG21 ILE A 84 14.034 3.398 -9.806 1.00 74.14 H new ATOM 0 HG22 ILE A 84 12.473 4.211 -10.072 1.00 74.14 H new ATOM 0 HG23 ILE A 84 12.519 2.469 -9.709 1.00 74.14 H new ATOM 0 HD11 ILE A 84 15.946 0.941 -11.781 1.00 70.13 H new ATOM 0 HD12 ILE A 84 15.854 2.666 -12.208 1.00 70.13 H new ATOM 0 HD13 ILE A 84 15.519 2.143 -10.540 1.00 70.13 H new ATOM 1237 N PRO A 85 9.889 3.911 -11.078 1.00 21.13 N ATOM 1238 CA PRO A 85 9.006 5.023 -10.680 1.00 73.14 C ATOM 1239 C PRO A 85 9.713 6.082 -9.823 1.00 50.23 C ATOM 1240 O PRO A 85 9.099 6.697 -8.950 1.00 4.23 O ATOM 1241 CB PRO A 85 7.914 4.326 -9.866 1.00 31.44 C ATOM 1242 CG PRO A 85 8.554 3.095 -9.328 1.00 53.42 C ATOM 1243 CD PRO A 85 9.566 2.663 -10.353 1.00 70.04 C ATOM 0 HA PRO A 85 8.641 5.572 -11.548 1.00 73.14 H new ATOM 0 HB2 PRO A 85 7.554 4.966 -9.061 1.00 31.44 H new ATOM 0 HB3 PRO A 85 7.053 4.082 -10.489 1.00 31.44 H new ATOM 0 HG2 PRO A 85 9.032 3.293 -8.369 1.00 53.42 H new ATOM 0 HG3 PRO A 85 7.813 2.313 -9.160 1.00 53.42 H new ATOM 0 HD2 PRO A 85 10.451 2.232 -9.885 1.00 70.04 H new ATOM 0 HD3 PRO A 85 9.159 1.905 -11.023 1.00 70.04 H new ATOM 1251 N MET A 86 10.998 6.298 -10.090 1.00 73.33 N ATOM 1252 CA MET A 86 11.791 7.276 -9.357 1.00 75.42 C ATOM 1253 C MET A 86 12.458 8.256 -10.320 1.00 34.14 C ATOM 1254 O MET A 86 12.530 9.456 -10.051 1.00 74.12 O ATOM 1255 CB MET A 86 12.855 6.564 -8.519 1.00 64.02 C ATOM 1256 CG MET A 86 13.609 7.482 -7.571 1.00 53.43 C ATOM 1257 SD MET A 86 14.792 6.597 -6.535 1.00 12.41 S ATOM 1258 CE MET A 86 15.922 5.959 -7.770 1.00 21.53 C ATOM 0 H MET A 86 11.515 5.803 -10.816 1.00 73.33 H new ATOM 0 HA MET A 86 11.128 7.834 -8.696 1.00 75.42 H new ATOM 0 HB2 MET A 86 12.378 5.773 -7.940 1.00 64.02 H new ATOM 0 HB3 MET A 86 13.569 6.083 -9.188 1.00 64.02 H new ATOM 0 HG2 MET A 86 14.136 8.241 -8.150 1.00 53.43 H new ATOM 0 HG3 MET A 86 12.895 8.005 -6.934 1.00 53.43 H new ATOM 0 HE1 MET A 86 16.859 5.673 -7.292 1.00 21.53 H new ATOM 0 HE2 MET A 86 15.479 5.088 -8.252 1.00 21.53 H new ATOM 0 HE3 MET A 86 16.116 6.728 -8.518 1.00 21.53 H new ATOM 1268 N ALA A 87 12.938 7.734 -11.445 1.00 54.22 N ATOM 1269 CA ALA A 87 13.605 8.555 -12.448 1.00 53.42 C ATOM 1270 C ALA A 87 12.738 8.741 -13.690 1.00 13.41 C ATOM 1271 O ALA A 87 12.904 9.710 -14.429 1.00 23.33 O ATOM 1272 CB ALA A 87 14.943 7.936 -12.824 1.00 24.21 C ATOM 0 H ALA A 87 12.877 6.744 -11.684 1.00 54.22 H new ATOM 0 HA ALA A 87 13.775 9.541 -12.015 1.00 53.42 H new ATOM 0 HB1 ALA A 87 15.433 8.557 -13.574 1.00 24.21 H new ATOM 0 HB2 ALA A 87 15.575 7.870 -11.938 1.00 24.21 H new ATOM 0 HB3 ALA A 87 14.781 6.937 -13.230 1.00 24.21 H new ATOM 1278 N ALA A 88 11.811 7.811 -13.915 1.00 61.15 N ATOM 1279 CA ALA A 88 10.922 7.879 -15.073 1.00 45.52 C ATOM 1280 C ALA A 88 9.810 8.904 -14.867 1.00 75.23 C ATOM 1281 O ALA A 88 9.340 9.520 -15.823 1.00 22.52 O ATOM 1282 CB ALA A 88 10.329 6.509 -15.365 1.00 71.22 C ATOM 0 H ALA A 88 11.656 7.003 -13.312 1.00 61.15 H new ATOM 0 HA ALA A 88 11.516 8.200 -15.929 1.00 45.52 H new ATOM 0 HB1 ALA A 88 9.669 6.575 -16.230 1.00 71.22 H new ATOM 0 HB2 ALA A 88 11.132 5.802 -15.574 1.00 71.22 H new ATOM 0 HB3 ALA A 88 9.761 6.167 -14.500 1.00 71.22 H new ATOM 1288 N VAL A 89 9.396 9.088 -13.614 1.00 43.51 N ATOM 1289 CA VAL A 89 8.336 10.041 -13.289 1.00 55.25 C ATOM 1290 C VAL A 89 8.907 11.444 -13.077 1.00 52.21 C ATOM 1291 O VAL A 89 8.176 12.385 -12.767 1.00 54.11 O ATOM 1292 CB VAL A 89 7.545 9.615 -12.031 1.00 14.41 C ATOM 1293 CG1 VAL A 89 6.111 10.119 -12.100 1.00 23.12 C ATOM 1294 CG2 VAL A 89 7.571 8.105 -11.859 1.00 12.30 C ATOM 0 H VAL A 89 9.777 8.591 -12.809 1.00 43.51 H new ATOM 0 HA VAL A 89 7.653 10.053 -14.139 1.00 55.25 H new ATOM 0 HB VAL A 89 8.026 10.065 -11.163 1.00 14.41 H new ATOM 0 HG11 VAL A 89 5.573 9.808 -11.205 1.00 23.12 H new ATOM 0 HG12 VAL A 89 6.110 11.207 -12.164 1.00 23.12 H new ATOM 0 HG13 VAL A 89 5.621 9.704 -12.981 1.00 23.12 H new ATOM 0 HG21 VAL A 89 7.008 7.831 -10.967 1.00 12.30 H new ATOM 0 HG22 VAL A 89 7.122 7.632 -12.732 1.00 12.30 H new ATOM 0 HG23 VAL A 89 8.602 7.768 -11.754 1.00 12.30 H new ATOM 1304 N LYS A 90 10.223 11.571 -13.248 1.00 23.33 N ATOM 1305 CA LYS A 90 10.903 12.854 -13.096 1.00 35.54 C ATOM 1306 C LYS A 90 10.500 13.804 -14.222 1.00 30.13 C ATOM 1307 O LYS A 90 10.315 15.002 -14.003 1.00 54.30 O ATOM 1308 CB LYS A 90 12.421 12.644 -13.098 1.00 23.43 C ATOM 1309 CG LYS A 90 13.225 13.934 -13.098 1.00 23.05 C ATOM 1310 CD LYS A 90 14.706 13.663 -13.303 1.00 34.41 C ATOM 1311 CE LYS A 90 15.493 14.955 -13.445 1.00 51.13 C ATOM 1312 NZ LYS A 90 16.941 14.699 -13.677 1.00 65.32 N1+ ATOM 0 H LYS A 90 10.840 10.797 -13.493 1.00 23.33 H new ATOM 0 HA LYS A 90 10.609 13.298 -12.145 1.00 35.54 H new ATOM 0 HB2 LYS A 90 12.697 12.056 -12.223 1.00 23.43 H new ATOM 0 HB3 LYS A 90 12.695 12.058 -13.975 1.00 23.43 H new ATOM 0 HG2 LYS A 90 12.861 14.592 -13.887 1.00 23.05 H new ATOM 0 HG3 LYS A 90 13.076 14.457 -12.153 1.00 23.05 H new ATOM 0 HD2 LYS A 90 15.093 13.091 -12.460 1.00 34.41 H new ATOM 0 HD3 LYS A 90 14.845 13.051 -14.194 1.00 34.41 H new ATOM 0 HE2 LYS A 90 15.090 15.537 -14.274 1.00 51.13 H new ATOM 0 HE3 LYS A 90 15.370 15.556 -12.544 1.00 51.13 H new ATOM 0 HZ1 LYS A 90 17.443 15.605 -13.769 1.00 65.32 H new ATOM 0 HZ2 LYS A 90 17.332 14.166 -12.874 1.00 65.32 H new ATOM 0 HZ3 LYS A 90 17.060 14.147 -14.550 1.00 65.32 H new ATOM 1326 N GLN A 91 10.356 13.253 -15.426 1.00 32.23 N ATOM 1327 CA GLN A 91 9.967 14.038 -16.593 1.00 13.32 C ATOM 1328 C GLN A 91 8.453 14.253 -16.627 1.00 4.30 C ATOM 1329 O GLN A 91 7.971 15.235 -17.191 1.00 74.41 O ATOM 1330 CB GLN A 91 10.428 13.345 -17.879 1.00 31.23 C ATOM 1331 CG GLN A 91 9.943 11.909 -18.009 1.00 63.44 C ATOM 1332 CD GLN A 91 9.356 11.612 -19.373 1.00 72.42 C ATOM 1333 OE1 GLN A 91 8.156 11.776 -19.594 1.00 73.13 O ATOM 1334 NE2 GLN A 91 10.199 11.170 -20.296 1.00 22.03 N ATOM 0 H GLN A 91 10.504 12.262 -15.618 1.00 32.23 H new ATOM 0 HA GLN A 91 10.451 15.012 -16.522 1.00 13.32 H new ATOM 0 HB2 GLN A 91 10.074 13.917 -18.736 1.00 31.23 H new ATOM 0 HB3 GLN A 91 11.517 13.356 -17.916 1.00 31.23 H new ATOM 0 HG2 GLN A 91 10.775 11.230 -17.820 1.00 63.44 H new ATOM 0 HG3 GLN A 91 9.192 11.713 -17.244 1.00 63.44 H new ATOM 0 HE21 GLN A 91 11.186 11.049 -20.069 1.00 22.03 H new ATOM 0 HE22 GLN A 91 9.860 10.951 -21.233 1.00 22.03 H new ATOM 1343 N ALA A 92 7.711 13.331 -16.013 1.00 50.43 N ATOM 1344 CA ALA A 92 6.254 13.417 -15.968 1.00 24.00 C ATOM 1345 C ALA A 92 5.791 14.477 -14.971 1.00 22.41 C ATOM 1346 O ALA A 92 4.640 14.911 -15.002 1.00 10.13 O ATOM 1347 CB ALA A 92 5.658 12.062 -15.616 1.00 21.40 C ATOM 0 H ALA A 92 8.098 12.515 -15.539 1.00 50.43 H new ATOM 0 HA ALA A 92 5.903 13.713 -16.957 1.00 24.00 H new ATOM 0 HB1 ALA A 92 4.571 12.139 -15.586 1.00 21.40 H new ATOM 0 HB2 ALA A 92 5.949 11.330 -16.369 1.00 21.40 H new ATOM 0 HB3 ALA A 92 6.027 11.745 -14.641 1.00 21.40 H new ATOM 1353 N LEU A 93 6.696 14.888 -14.086 1.00 71.20 N ATOM 1354 CA LEU A 93 6.389 15.901 -13.083 1.00 55.44 C ATOM 1355 C LEU A 93 7.319 17.105 -13.228 1.00 13.40 C ATOM 1356 O LEU A 93 7.461 17.908 -12.306 1.00 52.35 O ATOM 1357 CB LEU A 93 6.509 15.311 -11.674 1.00 70.05 C ATOM 1358 CG LEU A 93 5.516 14.191 -11.346 1.00 1.23 C ATOM 1359 CD1 LEU A 93 5.841 13.566 -9.998 1.00 33.44 C ATOM 1360 CD2 LEU A 93 4.089 14.721 -11.352 1.00 51.40 C ATOM 0 H LEU A 93 7.651 14.533 -14.044 1.00 71.20 H new ATOM 0 HA LEU A 93 5.363 16.235 -13.239 1.00 55.44 H new ATOM 0 HB2 LEU A 93 7.521 14.927 -11.544 1.00 70.05 H new ATOM 0 HB3 LEU A 93 6.378 16.114 -10.949 1.00 70.05 H new ATOM 0 HG LEU A 93 5.603 13.423 -12.114 1.00 1.23 H new ATOM 0 HD11 LEU A 93 5.125 12.773 -9.783 1.00 33.44 H new ATOM 0 HD12 LEU A 93 6.848 13.149 -10.024 1.00 33.44 H new ATOM 0 HD13 LEU A 93 5.783 14.328 -9.220 1.00 33.44 H new ATOM 0 HD21 LEU A 93 3.399 13.911 -11.117 1.00 51.40 H new ATOM 0 HD22 LEU A 93 3.991 15.509 -10.606 1.00 51.40 H new ATOM 0 HD23 LEU A 93 3.854 15.123 -12.338 1.00 51.40 H new ATOM 1372 N ARG A 94 7.945 17.225 -14.398 1.00 75.25 N ATOM 1373 CA ARG A 94 8.863 18.325 -14.671 1.00 35.44 C ATOM 1374 C ARG A 94 8.115 19.536 -15.222 1.00 1.44 C ATOM 1375 O ARG A 94 8.023 20.572 -14.564 1.00 14.23 O ATOM 1376 CB ARG A 94 9.945 17.877 -15.657 1.00 13.12 C ATOM 1377 CG ARG A 94 11.047 18.901 -15.865 1.00 23.13 C ATOM 1378 CD ARG A 94 12.175 18.338 -16.713 1.00 73.14 C ATOM 1379 NE ARG A 94 13.282 19.281 -16.842 1.00 61.42 N ATOM 1380 CZ ARG A 94 14.562 18.919 -16.910 1.00 60.12 C ATOM 1381 NH1 ARG A 94 14.900 17.637 -16.862 1.00 11.13 N1+ ATOM 1382 NH2 ARG A 94 15.506 19.843 -17.024 1.00 5.33 N ATOM 0 H ARG A 94 7.831 16.571 -15.173 1.00 75.25 H new ATOM 0 HA ARG A 94 9.336 18.616 -13.733 1.00 35.44 H new ATOM 0 HB2 ARG A 94 10.388 16.948 -15.298 1.00 13.12 H new ATOM 0 HB3 ARG A 94 9.479 17.658 -16.618 1.00 13.12 H new ATOM 0 HG2 ARG A 94 10.635 19.788 -16.347 1.00 23.13 H new ATOM 0 HG3 ARG A 94 11.439 19.217 -14.898 1.00 23.13 H new ATOM 0 HD2 ARG A 94 12.537 17.412 -16.267 1.00 73.14 H new ATOM 0 HD3 ARG A 94 11.794 18.087 -17.703 1.00 73.14 H new ATOM 0 HE ARG A 94 13.062 20.276 -16.882 1.00 61.42 H new ATOM 0 HH11 ARG A 94 14.178 16.922 -16.773 1.00 11.13 H new ATOM 0 HH12 ARG A 94 15.882 17.366 -16.915 1.00 11.13 H new ATOM 0 HH21 ARG A 94 15.252 20.830 -17.060 1.00 5.33 H new ATOM 0 HH22 ARG A 94 16.486 19.567 -17.076 1.00 5.33 H new ATOM 1396 N GLU A 95 7.583 19.400 -16.434 1.00 71.54 N ATOM 1397 CA GLU A 95 6.837 20.484 -17.066 1.00 74.44 C ATOM 1398 C GLU A 95 5.335 20.247 -16.944 1.00 64.42 C ATOM 1399 O GLU A 95 4.527 21.068 -17.381 1.00 2.11 O ATOM 1400 CB GLU A 95 7.233 20.622 -18.540 1.00 55.34 C ATOM 1401 CG GLU A 95 8.716 20.887 -18.754 1.00 74.24 C ATOM 1402 CD GLU A 95 9.189 22.158 -18.076 1.00 22.21 C ATOM 1403 OE1 GLU A 95 8.922 23.253 -18.614 1.00 32.21 O ATOM 1404 OE2 GLU A 95 9.828 22.059 -17.007 1.00 30.22 O1- ATOM 0 H GLU A 95 7.654 18.552 -16.997 1.00 71.54 H new ATOM 0 HA GLU A 95 7.084 21.412 -16.550 1.00 74.44 H new ATOM 0 HB2 GLU A 95 6.956 19.709 -19.068 1.00 55.34 H new ATOM 0 HB3 GLU A 95 6.660 21.435 -18.986 1.00 55.34 H new ATOM 0 HG2 GLU A 95 9.290 20.042 -18.373 1.00 74.24 H new ATOM 0 HG3 GLU A 95 8.918 20.954 -19.823 1.00 74.24 H new ATOM 1411 N ALA A 96 4.970 19.115 -16.346 1.00 33.44 N ATOM 1412 CA ALA A 96 3.569 18.762 -16.154 1.00 21.51 C ATOM 1413 C ALA A 96 3.194 18.818 -14.677 1.00 5.24 C ATOM 1414 O ALA A 96 2.037 19.058 -14.328 1.00 14.11 O ATOM 1415 CB ALA A 96 3.293 17.380 -16.723 1.00 50.44 C ATOM 0 H ALA A 96 5.629 18.425 -15.985 1.00 33.44 H new ATOM 0 HA ALA A 96 2.954 19.488 -16.687 1.00 21.51 H new ATOM 0 HB1 ALA A 96 2.243 17.128 -16.573 1.00 50.44 H new ATOM 0 HB2 ALA A 96 3.519 17.374 -17.789 1.00 50.44 H new ATOM 0 HB3 ALA A 96 3.918 16.646 -16.215 1.00 50.44 H new ATOM 1421 N GLY A 97 4.184 18.593 -13.813 1.00 51.23 N ATOM 1422 CA GLY A 97 3.951 18.631 -12.379 1.00 64.12 C ATOM 1423 C GLY A 97 4.026 20.040 -11.823 1.00 64.21 C ATOM 1424 O GLY A 97 3.467 20.329 -10.765 1.00 64.15 O ATOM 0 H GLY A 97 5.145 18.385 -14.083 1.00 51.23 H new ATOM 0 HA2 GLY A 97 2.970 18.208 -12.161 1.00 64.12 H new ATOM 0 HA3 GLY A 97 4.688 18.004 -11.876 1.00 64.12 H new ATOM 1428 N ASP A 98 4.725 20.915 -12.540 1.00 64.45 N ATOM 1429 CA ASP A 98 4.870 22.307 -12.132 1.00 40.24 C ATOM 1430 C ASP A 98 4.019 23.214 -13.015 1.00 72.42 C ATOM 1431 O ASP A 98 4.137 24.437 -12.962 1.00 34.33 O ATOM 1432 CB ASP A 98 6.336 22.734 -12.211 1.00 73.55 C ATOM 1433 CG ASP A 98 7.213 21.977 -11.235 1.00 23.02 C ATOM 1434 OD1 ASP A 98 7.194 22.316 -10.033 1.00 60.34 O ATOM 1435 OD2 ASP A 98 7.920 21.045 -11.674 1.00 62.31 O1- ATOM 0 H ASP A 98 5.202 20.682 -13.411 1.00 64.45 H new ATOM 0 HA ASP A 98 4.529 22.399 -11.101 1.00 40.24 H new ATOM 0 HB2 ASP A 98 6.704 22.574 -13.225 1.00 73.55 H new ATOM 0 HB3 ASP A 98 6.411 23.803 -12.009 1.00 73.55 H new ATOM 1440 N GLU A 99 3.159 22.596 -13.821 1.00 50.25 N ATOM 1441 CA GLU A 99 2.282 23.324 -14.733 1.00 71.44 C ATOM 1442 C GLU A 99 1.094 23.938 -13.992 1.00 10.12 C ATOM 1443 O GLU A 99 0.557 24.967 -14.404 1.00 3.14 O ATOM 1444 CB GLU A 99 1.778 22.375 -15.823 1.00 22.22 C ATOM 1445 CG GLU A 99 1.109 23.075 -16.994 1.00 23.45 C ATOM 1446 CD GLU A 99 0.344 22.114 -17.882 1.00 43.13 C ATOM 1447 OE1 GLU A 99 0.966 21.164 -18.403 1.00 65.24 O ATOM 1448 OE2 GLU A 99 -0.876 22.312 -18.057 1.00 35.21 O1- ATOM 0 H GLU A 99 3.051 21.582 -13.860 1.00 50.25 H new ATOM 0 HA GLU A 99 2.854 24.136 -15.183 1.00 71.44 H new ATOM 0 HB2 GLU A 99 2.618 21.788 -16.196 1.00 22.22 H new ATOM 0 HB3 GLU A 99 1.071 21.674 -15.381 1.00 22.22 H new ATOM 0 HG2 GLU A 99 0.427 23.837 -16.617 1.00 23.45 H new ATOM 0 HG3 GLU A 99 1.866 23.589 -17.587 1.00 23.45 H new ATOM 1455 N PHE A 100 0.693 23.299 -12.895 1.00 20.03 N ATOM 1456 CA PHE A 100 -0.434 23.770 -12.097 1.00 64.44 C ATOM 1457 C PHE A 100 -0.081 25.048 -11.339 1.00 22.54 C ATOM 1458 O PHE A 100 -0.864 25.997 -11.311 1.00 41.45 O ATOM 1459 CB PHE A 100 -0.867 22.682 -11.113 1.00 12.52 C ATOM 1460 CG PHE A 100 -2.342 22.673 -10.828 1.00 21.12 C ATOM 1461 CD1 PHE A 100 -3.241 22.221 -11.781 1.00 14.31 C ATOM 1462 CD2 PHE A 100 -2.829 23.113 -9.608 1.00 41.04 C ATOM 1463 CE1 PHE A 100 -4.598 22.208 -11.522 1.00 1.24 C ATOM 1464 CE2 PHE A 100 -4.185 23.103 -9.344 1.00 62.11 C ATOM 1465 CZ PHE A 100 -5.071 22.650 -10.301 1.00 65.43 C ATOM 0 H PHE A 100 1.134 22.451 -12.539 1.00 20.03 H new ATOM 0 HA PHE A 100 -1.258 23.996 -12.775 1.00 64.44 H new ATOM 0 HB2 PHE A 100 -0.578 21.709 -11.511 1.00 12.52 H new ATOM 0 HB3 PHE A 100 -0.326 22.817 -10.176 1.00 12.52 H new ATOM 0 HD1 PHE A 100 -2.877 21.875 -12.737 1.00 14.31 H new ATOM 0 HD2 PHE A 100 -2.141 23.468 -8.855 1.00 41.04 H new ATOM 0 HE1 PHE A 100 -5.288 21.853 -12.273 1.00 1.24 H new ATOM 0 HE2 PHE A 100 -4.552 23.449 -8.389 1.00 62.11 H new ATOM 0 HZ PHE A 100 -6.131 22.641 -10.096 1.00 65.43 H new ATOM 1475 N GLU A 101 1.107 25.070 -10.738 1.00 63.54 N ATOM 1476 CA GLU A 101 1.563 26.232 -9.978 1.00 30.42 C ATOM 1477 C GLU A 101 2.196 27.288 -10.888 1.00 53.33 C ATOM 1478 O GLU A 101 2.697 28.308 -10.413 1.00 41.41 O ATOM 1479 CB GLU A 101 2.554 25.798 -8.895 1.00 4.52 C ATOM 1480 CG GLU A 101 3.745 25.015 -9.426 1.00 13.13 C ATOM 1481 CD GLU A 101 4.573 24.395 -8.318 1.00 41.05 C ATOM 1482 OE1 GLU A 101 5.221 25.152 -7.565 1.00 32.01 O ATOM 1483 OE2 GLU A 101 4.573 23.151 -8.203 1.00 62.54 O1- ATOM 0 H GLU A 101 1.771 24.296 -10.763 1.00 63.54 H new ATOM 0 HA GLU A 101 0.692 26.684 -9.504 1.00 30.42 H new ATOM 0 HB2 GLU A 101 2.917 26.683 -8.373 1.00 4.52 H new ATOM 0 HB3 GLU A 101 2.029 25.188 -8.160 1.00 4.52 H new ATOM 0 HG2 GLU A 101 3.391 24.229 -10.093 1.00 13.13 H new ATOM 0 HG3 GLU A 101 4.376 25.677 -10.019 1.00 13.13 H new ATOM 1490 N LEU A 102 2.167 27.037 -12.194 1.00 23.43 N ATOM 1491 CA LEU A 102 2.721 27.968 -13.171 1.00 61.22 C ATOM 1492 C LEU A 102 1.598 28.748 -13.849 1.00 34.41 C ATOM 1493 O LEU A 102 1.824 29.807 -14.434 1.00 44.11 O ATOM 1494 CB LEU A 102 3.542 27.208 -14.218 1.00 62.35 C ATOM 1495 CG LEU A 102 4.456 28.069 -15.092 1.00 14.24 C ATOM 1496 CD1 LEU A 102 5.882 27.543 -15.049 1.00 55.42 C ATOM 1497 CD2 LEU A 102 3.948 28.105 -16.526 1.00 62.43 C ATOM 0 H LEU A 102 1.764 26.193 -12.601 1.00 23.43 H new ATOM 0 HA LEU A 102 3.375 28.671 -12.655 1.00 61.22 H new ATOM 0 HB2 LEU A 102 4.153 26.465 -13.705 1.00 62.35 H new ATOM 0 HB3 LEU A 102 2.856 26.664 -14.867 1.00 62.35 H new ATOM 0 HG LEU A 102 4.448 29.085 -14.698 1.00 14.24 H new ATOM 0 HD11 LEU A 102 6.519 28.167 -15.676 1.00 55.42 H new ATOM 0 HD12 LEU A 102 6.248 27.567 -14.023 1.00 55.42 H new ATOM 0 HD13 LEU A 102 5.903 26.517 -15.418 1.00 55.42 H new ATOM 0 HD21 LEU A 102 4.611 28.722 -17.132 1.00 62.43 H new ATOM 0 HD22 LEU A 102 3.925 27.093 -16.930 1.00 62.43 H new ATOM 0 HD23 LEU A 102 2.943 28.526 -16.545 1.00 62.43 H new ATOM 1509 N ARG A 103 0.384 28.211 -13.754 1.00 62.12 N ATOM 1510 CA ARG A 103 -0.789 28.835 -14.354 1.00 60.12 C ATOM 1511 C ARG A 103 -1.203 30.089 -13.586 1.00 41.31 C ATOM 1512 O ARG A 103 -1.216 31.189 -14.140 1.00 34.42 O ATOM 1513 CB ARG A 103 -1.950 27.837 -14.394 1.00 62.14 C ATOM 1514 CG ARG A 103 -3.205 28.381 -15.055 1.00 32.00 C ATOM 1515 CD ARG A 103 -4.375 27.426 -14.895 1.00 31.41 C ATOM 1516 NE ARG A 103 -5.608 27.973 -15.456 1.00 2.15 N ATOM 1517 CZ ARG A 103 -6.824 27.536 -15.138 1.00 70.25 C ATOM 1518 NH1 ARG A 103 -6.974 26.548 -14.266 1.00 55.11 N1+ ATOM 1519 NH2 ARG A 103 -7.893 28.089 -15.694 1.00 32.41 N ATOM 0 H ARG A 103 0.188 27.339 -13.263 1.00 62.12 H new ATOM 0 HA ARG A 103 -0.532 29.131 -15.371 1.00 60.12 H new ATOM 0 HB2 ARG A 103 -1.629 26.942 -14.927 1.00 62.14 H new ATOM 0 HB3 ARG A 103 -2.190 27.533 -13.375 1.00 62.14 H new ATOM 0 HG2 ARG A 103 -3.459 29.346 -14.617 1.00 32.00 H new ATOM 0 HG3 ARG A 103 -3.015 28.552 -16.115 1.00 32.00 H new ATOM 0 HD2 ARG A 103 -4.141 26.481 -15.385 1.00 31.41 H new ATOM 0 HD3 ARG A 103 -4.523 27.208 -13.837 1.00 31.41 H new ATOM 0 HE ARG A 103 -5.532 28.734 -16.131 1.00 2.15 H new ATOM 0 HH11 ARG A 103 -6.155 26.119 -13.835 1.00 55.11 H new ATOM 0 HH12 ARG A 103 -7.909 26.217 -14.026 1.00 55.11 H new ATOM 0 HH21 ARG A 103 -7.783 28.849 -16.365 1.00 32.41 H new ATOM 0 HH22 ARG A 103 -8.825 27.754 -15.451 1.00 32.41 H new ATOM 1533 N TYR A 104 -1.534 29.919 -12.308 1.00 52.42 N ATOM 1534 CA TYR A 104 -1.956 31.040 -11.474 1.00 13.30 C ATOM 1535 C TYR A 104 -0.804 31.574 -10.623 1.00 63.24 C ATOM 1536 O TYR A 104 -0.833 32.732 -10.204 1.00 72.05 O ATOM 1537 CB TYR A 104 -3.132 30.629 -10.576 1.00 1.53 C ATOM 1538 CG TYR A 104 -2.921 29.329 -9.825 1.00 74.53 C ATOM 1539 CD1 TYR A 104 -2.141 29.287 -8.676 1.00 43.20 C ATOM 1540 CD2 TYR A 104 -3.506 28.147 -10.263 1.00 44.51 C ATOM 1541 CE1 TYR A 104 -1.949 28.107 -7.987 1.00 12.51 C ATOM 1542 CE2 TYR A 104 -3.318 26.962 -9.577 1.00 64.31 C ATOM 1543 CZ TYR A 104 -2.538 26.948 -8.440 1.00 25.55 C ATOM 1544 OH TYR A 104 -2.348 25.772 -7.752 1.00 54.23 O ATOM 0 H TYR A 104 -1.518 29.018 -11.829 1.00 52.42 H new ATOM 0 HA TYR A 104 -2.279 31.841 -12.139 1.00 13.30 H new ATOM 0 HB2 TYR A 104 -3.318 31.425 -9.855 1.00 1.53 H new ATOM 0 HB3 TYR A 104 -4.028 30.539 -11.190 1.00 1.53 H new ATOM 0 HD1 TYR A 104 -1.677 30.193 -8.316 1.00 43.20 H new ATOM 0 HD2 TYR A 104 -4.117 28.155 -11.153 1.00 44.51 H new ATOM 0 HE1 TYR A 104 -1.339 28.093 -7.096 1.00 12.51 H new ATOM 0 HE2 TYR A 104 -3.780 26.052 -9.930 1.00 64.31 H new ATOM 0 HH TYR A 104 -2.694 25.024 -8.282 1.00 54.23 H new ATOM 1554 N ARG A 105 0.199 30.717 -10.378 1.00 42.41 N ATOM 1555 CA ARG A 105 1.376 31.068 -9.569 1.00 15.40 C ATOM 1556 C ARG A 105 1.009 31.246 -8.095 1.00 65.40 C ATOM 1557 O ARG A 105 0.147 32.059 -7.755 1.00 0.05 O ATOM 1558 CB ARG A 105 2.055 32.337 -10.099 1.00 1.02 C ATOM 1559 CG ARG A 105 3.312 32.720 -9.335 1.00 42.53 C ATOM 1560 CD ARG A 105 3.333 34.202 -8.998 1.00 64.23 C ATOM 1561 NE ARG A 105 2.291 34.558 -8.038 1.00 15.05 N ATOM 1562 CZ ARG A 105 2.128 35.780 -7.539 1.00 3.35 C ATOM 1563 NH1 ARG A 105 2.938 36.765 -7.906 1.00 74.31 N1+ ATOM 1564 NH2 ARG A 105 1.154 36.018 -6.673 1.00 64.40 N ATOM 0 H ARG A 105 0.217 29.762 -10.735 1.00 42.41 H new ATOM 0 HA ARG A 105 2.079 30.239 -9.649 1.00 15.40 H new ATOM 0 HB2 ARG A 105 2.308 32.192 -11.149 1.00 1.02 H new ATOM 0 HB3 ARG A 105 1.346 33.164 -10.054 1.00 1.02 H new ATOM 0 HG2 ARG A 105 3.372 32.137 -8.416 1.00 42.53 H new ATOM 0 HG3 ARG A 105 4.190 32.469 -9.930 1.00 42.53 H new ATOM 0 HD2 ARG A 105 4.308 34.468 -8.590 1.00 64.23 H new ATOM 0 HD3 ARG A 105 3.200 34.784 -9.910 1.00 64.23 H new ATOM 0 HE ARG A 105 1.650 33.826 -7.732 1.00 15.05 H new ATOM 0 HH11 ARG A 105 3.689 36.586 -8.573 1.00 74.31 H new ATOM 0 HH12 ARG A 105 2.810 37.701 -7.521 1.00 74.31 H new ATOM 0 HH21 ARG A 105 0.529 35.264 -6.389 1.00 64.40 H new ATOM 0 HH22 ARG A 105 1.029 36.955 -6.291 1.00 64.40 H new ATOM 1578 N ARG A 106 1.684 30.476 -7.229 1.00 33.45 N ATOM 1579 CA ARG A 106 1.455 30.516 -5.778 1.00 65.14 C ATOM 1580 C ARG A 106 0.087 29.935 -5.417 1.00 44.23 C ATOM 1581 O ARG A 106 -0.951 30.464 -5.818 1.00 1.42 O ATOM 1582 CB ARG A 106 1.583 31.948 -5.240 1.00 72.31 C ATOM 1583 CG ARG A 106 1.410 32.055 -3.733 1.00 51.11 C ATOM 1584 CD ARG A 106 1.158 33.491 -3.300 1.00 13.11 C ATOM 1585 NE ARG A 106 2.254 34.380 -3.678 1.00 34.31 N ATOM 1586 CZ ARG A 106 2.307 35.670 -3.356 1.00 13.22 C ATOM 1587 NH1 ARG A 106 1.330 36.225 -2.651 1.00 71.44 N1+ ATOM 1588 NH2 ARG A 106 3.340 36.406 -3.741 1.00 33.14 N ATOM 0 H ARG A 106 2.402 29.810 -7.514 1.00 33.45 H new ATOM 0 HA ARG A 106 2.222 29.900 -5.309 1.00 65.14 H new ATOM 0 HB2 ARG A 106 2.562 32.343 -5.513 1.00 72.31 H new ATOM 0 HB3 ARG A 106 0.838 32.577 -5.727 1.00 72.31 H new ATOM 0 HG2 ARG A 106 0.577 31.427 -3.416 1.00 51.11 H new ATOM 0 HG3 ARG A 106 2.303 31.675 -3.236 1.00 51.11 H new ATOM 0 HD2 ARG A 106 0.231 33.847 -3.750 1.00 13.11 H new ATOM 0 HD3 ARG A 106 1.021 33.524 -2.219 1.00 13.11 H new ATOM 0 HE ARG A 106 3.024 33.989 -4.221 1.00 34.31 H new ATOM 0 HH11 ARG A 106 0.533 35.662 -2.353 1.00 71.44 H new ATOM 0 HH12 ARG A 106 1.376 37.214 -2.407 1.00 71.44 H new ATOM 0 HH21 ARG A 106 4.093 35.983 -4.284 1.00 33.14 H new ATOM 0 HH22 ARG A 106 3.382 37.395 -3.495 1.00 33.14 H new ATOM 1602 N ALA A 107 0.099 28.842 -4.654 1.00 61.14 N ATOM 1603 CA ALA A 107 -1.134 28.178 -4.233 1.00 3.22 C ATOM 1604 C ALA A 107 -2.033 29.122 -3.439 1.00 74.33 C ATOM 1605 O ALA A 107 -3.143 29.441 -3.866 1.00 23.20 O ATOM 1606 CB ALA A 107 -0.807 26.938 -3.412 1.00 13.05 C ATOM 0 H ALA A 107 0.952 28.397 -4.314 1.00 61.14 H new ATOM 0 HA ALA A 107 -1.678 27.878 -5.129 1.00 3.22 H new ATOM 0 HB1 ALA A 107 -1.732 26.451 -3.104 1.00 13.05 H new ATOM 0 HB2 ALA A 107 -0.217 26.248 -4.015 1.00 13.05 H new ATOM 0 HB3 ALA A 107 -0.237 27.226 -2.529 1.00 13.05 H new ATOM 1612 N PHE A 108 -1.546 29.570 -2.285 1.00 42.23 N ATOM 1613 CA PHE A 108 -2.303 30.482 -1.433 1.00 73.30 C ATOM 1614 C PHE A 108 -1.397 31.567 -0.863 1.00 1.24 C ATOM 1615 O PHE A 108 -0.192 31.366 -0.720 1.00 50.31 O ATOM 1616 CB PHE A 108 -2.976 29.717 -0.290 1.00 12.43 C ATOM 1617 CG PHE A 108 -4.161 28.899 -0.721 1.00 2.32 C ATOM 1618 CD1 PHE A 108 -5.409 29.485 -0.860 1.00 33.21 C ATOM 1619 CD2 PHE A 108 -4.027 27.546 -0.989 1.00 53.41 C ATOM 1620 CE1 PHE A 108 -6.500 28.737 -1.258 1.00 23.13 C ATOM 1621 CE2 PHE A 108 -5.114 26.793 -1.387 1.00 60.34 C ATOM 1622 CZ PHE A 108 -6.353 27.389 -1.522 1.00 45.21 C ATOM 0 H PHE A 108 -0.629 29.316 -1.918 1.00 42.23 H new ATOM 0 HA PHE A 108 -3.072 30.953 -2.046 1.00 73.30 H new ATOM 0 HB2 PHE A 108 -2.242 29.059 0.176 1.00 12.43 H new ATOM 0 HB3 PHE A 108 -3.295 30.428 0.472 1.00 12.43 H new ATOM 0 HD1 PHE A 108 -5.530 30.538 -0.655 1.00 33.21 H new ATOM 0 HD2 PHE A 108 -3.061 27.075 -0.885 1.00 53.41 H new ATOM 0 HE1 PHE A 108 -7.467 29.206 -1.363 1.00 23.13 H new ATOM 0 HE2 PHE A 108 -4.996 25.739 -1.592 1.00 60.34 H new ATOM 0 HZ PHE A 108 -7.205 26.802 -1.833 1.00 45.21 H new ATOM 1632 N SER A 109 -1.983 32.716 -0.544 1.00 33.32 N ATOM 1633 CA SER A 109 -1.228 33.832 0.017 1.00 73.01 C ATOM 1634 C SER A 109 -1.308 33.823 1.542 1.00 62.34 C ATOM 1635 O SER A 109 -0.387 34.270 2.226 1.00 14.24 O ATOM 1636 CB SER A 109 -1.752 35.162 -0.531 1.00 45.41 C ATOM 1637 OG SER A 109 -3.135 35.317 -0.266 1.00 51.10 O ATOM 0 H SER A 109 -2.979 32.900 -0.664 1.00 33.32 H new ATOM 0 HA SER A 109 -0.184 33.720 -0.276 1.00 73.01 H new ATOM 0 HB2 SER A 109 -1.199 35.987 -0.082 1.00 45.41 H new ATOM 0 HB3 SER A 109 -1.578 35.209 -1.606 1.00 45.41 H new ATOM 0 HG SER A 109 -3.443 36.175 -0.625 1.00 51.10 H new ATOM 1643 N ASP A 110 -2.418 33.306 2.063 1.00 62.34 N ATOM 1644 CA ASP A 110 -2.629 33.226 3.502 1.00 11.32 C ATOM 1645 C ASP A 110 -2.906 31.783 3.915 1.00 55.22 C ATOM 1646 O ASP A 110 -4.061 31.364 4.019 1.00 21.41 O ATOM 1647 CB ASP A 110 -3.793 34.131 3.920 1.00 3.34 C ATOM 1648 CG ASP A 110 -3.787 34.447 5.404 1.00 41.24 C ATOM 1649 OD1 ASP A 110 -3.300 35.535 5.775 1.00 44.25 O ATOM 1650 OD2 ASP A 110 -4.271 33.609 6.194 1.00 1.11 O1- ATOM 0 H ASP A 110 -3.187 32.935 1.505 1.00 62.34 H new ATOM 0 HA ASP A 110 -1.725 33.567 4.007 1.00 11.32 H new ATOM 0 HB2 ASP A 110 -3.745 35.062 3.355 1.00 3.34 H new ATOM 0 HB3 ASP A 110 -4.735 33.648 3.660 1.00 3.34 H new ATOM 1655 N LEU A 111 -1.837 31.023 4.137 1.00 60.21 N ATOM 1656 CA LEU A 111 -1.961 29.623 4.531 1.00 54.45 C ATOM 1657 C LEU A 111 -0.740 29.173 5.332 1.00 1.24 C ATOM 1658 O LEU A 111 -0.671 28.030 5.785 1.00 0.51 O ATOM 1659 CB LEU A 111 -2.127 28.742 3.288 1.00 14.15 C ATOM 1660 CG LEU A 111 -2.866 27.420 3.513 1.00 11.22 C ATOM 1661 CD1 LEU A 111 -4.316 27.674 3.899 1.00 12.31 C ATOM 1662 CD2 LEU A 111 -2.794 26.553 2.267 1.00 51.45 C ATOM 0 H LEU A 111 -0.876 31.353 4.051 1.00 60.21 H new ATOM 0 HA LEU A 111 -2.843 29.521 5.164 1.00 54.45 H new ATOM 0 HB2 LEU A 111 -2.661 29.312 2.528 1.00 14.15 H new ATOM 0 HB3 LEU A 111 -1.138 28.522 2.885 1.00 14.15 H new ATOM 0 HG LEU A 111 -2.380 26.891 4.333 1.00 11.22 H new ATOM 0 HD11 LEU A 111 -4.823 26.722 4.054 1.00 12.31 H new ATOM 0 HD12 LEU A 111 -4.351 28.258 4.819 1.00 12.31 H new ATOM 0 HD13 LEU A 111 -4.814 28.224 3.101 1.00 12.31 H new ATOM 0 HD21 LEU A 111 -3.324 25.617 2.444 1.00 51.45 H new ATOM 0 HD22 LEU A 111 -3.255 27.079 1.431 1.00 51.45 H new ATOM 0 HD23 LEU A 111 -1.751 26.340 2.031 1.00 51.45 H new ATOM 1674 N THR A 112 0.217 30.085 5.505 1.00 23.41 N ATOM 1675 CA THR A 112 1.443 29.797 6.248 1.00 54.11 C ATOM 1676 C THR A 112 1.177 29.668 7.746 1.00 2.10 C ATOM 1677 O THR A 112 1.807 28.862 8.431 1.00 21.10 O ATOM 1678 CB THR A 112 2.501 30.893 6.020 1.00 13.41 C ATOM 1679 OG1 THR A 112 1.888 32.186 6.090 1.00 11.44 O ATOM 1680 CG2 THR A 112 3.178 30.722 4.671 1.00 73.11 C ATOM 0 H THR A 112 0.165 31.035 5.138 1.00 23.41 H new ATOM 0 HA THR A 112 1.819 28.845 5.873 1.00 54.11 H new ATOM 0 HB THR A 112 3.257 30.804 6.801 1.00 13.41 H new ATOM 0 HG1 THR A 112 2.003 32.554 6.991 1.00 11.44 H new ATOM 0 HG21 THR A 112 3.921 31.508 4.534 1.00 73.11 H new ATOM 0 HG22 THR A 112 3.668 29.749 4.630 1.00 73.11 H new ATOM 0 HG23 THR A 112 2.432 30.786 3.879 1.00 73.11 H new ATOM 1688 N SER A 113 0.239 30.469 8.245 1.00 45.01 N ATOM 1689 CA SER A 113 -0.120 30.445 9.659 1.00 35.51 C ATOM 1690 C SER A 113 -1.204 29.401 9.926 1.00 63.44 C ATOM 1691 O SER A 113 -1.481 29.058 11.076 1.00 21.00 O ATOM 1692 CB SER A 113 -0.604 31.830 10.099 1.00 4.34 C ATOM 1693 OG SER A 113 -0.899 31.856 11.485 1.00 61.04 O ATOM 0 H SER A 113 -0.287 31.144 7.689 1.00 45.01 H new ATOM 0 HA SER A 113 0.765 30.175 10.235 1.00 35.51 H new ATOM 0 HB2 SER A 113 0.161 32.573 9.874 1.00 4.34 H new ATOM 0 HB3 SER A 113 -1.493 32.105 9.531 1.00 4.34 H new ATOM 0 HG SER A 113 -1.147 30.956 11.784 1.00 61.04 H new ATOM 1699 N GLN A 114 -1.805 28.893 8.851 1.00 74.03 N ATOM 1700 CA GLN A 114 -2.862 27.893 8.959 1.00 14.21 C ATOM 1701 C GLN A 114 -2.289 26.504 9.244 1.00 4.52 C ATOM 1702 O GLN A 114 -2.853 25.746 10.034 1.00 44.42 O ATOM 1703 CB GLN A 114 -3.692 27.866 7.671 1.00 22.13 C ATOM 1704 CG GLN A 114 -4.930 26.982 7.751 1.00 52.25 C ATOM 1705 CD GLN A 114 -5.944 27.481 8.763 1.00 3.41 C ATOM 1706 OE1 GLN A 114 -5.914 27.096 9.931 1.00 60.14 O ATOM 1707 NE2 GLN A 114 -6.850 28.343 8.317 1.00 70.03 N ATOM 0 H GLN A 114 -1.576 29.160 7.893 1.00 74.03 H new ATOM 0 HA GLN A 114 -3.503 28.169 9.796 1.00 14.21 H new ATOM 0 HB2 GLN A 114 -3.999 28.883 7.427 1.00 22.13 H new ATOM 0 HB3 GLN A 114 -3.062 27.519 6.852 1.00 22.13 H new ATOM 0 HG2 GLN A 114 -5.399 26.931 6.768 1.00 52.25 H new ATOM 0 HG3 GLN A 114 -4.630 25.968 8.014 1.00 52.25 H new ATOM 0 HE21 GLN A 114 -6.838 28.636 7.340 1.00 70.03 H new ATOM 0 HE22 GLN A 114 -7.558 28.713 8.951 1.00 70.03 H new ATOM 1716 N LEU A 115 -1.165 26.176 8.607 1.00 52.42 N ATOM 1717 CA LEU A 115 -0.538 24.872 8.803 1.00 65.13 C ATOM 1718 C LEU A 115 0.389 24.882 10.019 1.00 44.13 C ATOM 1719 O LEU A 115 0.722 23.823 10.552 1.00 23.02 O ATOM 1720 CB LEU A 115 0.225 24.442 7.544 1.00 55.43 C ATOM 1721 CG LEU A 115 1.643 25.000 7.404 1.00 20.32 C ATOM 1722 CD1 LEU A 115 2.644 23.865 7.265 1.00 34.33 C ATOM 1723 CD2 LEU A 115 1.733 25.937 6.211 1.00 72.14 C ATOM 0 H LEU A 115 -0.675 26.790 7.957 1.00 52.42 H new ATOM 0 HA LEU A 115 -1.329 24.146 8.991 1.00 65.13 H new ATOM 0 HB2 LEU A 115 0.280 23.353 7.529 1.00 55.43 H new ATOM 0 HB3 LEU A 115 -0.353 24.745 6.670 1.00 55.43 H new ATOM 0 HG LEU A 115 1.882 25.567 8.304 1.00 20.32 H new ATOM 0 HD11 LEU A 115 3.649 24.276 7.166 1.00 34.33 H new ATOM 0 HD12 LEU A 115 2.598 23.229 8.149 1.00 34.33 H new ATOM 0 HD13 LEU A 115 2.405 23.275 6.380 1.00 34.33 H new ATOM 0 HD21 LEU A 115 2.749 26.324 6.128 1.00 72.14 H new ATOM 0 HD22 LEU A 115 1.476 25.394 5.302 1.00 72.14 H new ATOM 0 HD23 LEU A 115 1.039 26.766 6.347 1.00 72.14 H new ATOM 1735 N HIS A 116 0.800 26.088 10.439 1.00 52.33 N ATOM 1736 CA HIS A 116 1.675 26.276 11.605 1.00 31.20 C ATOM 1737 C HIS A 116 3.066 25.670 11.392 1.00 12.10 C ATOM 1738 O HIS A 116 3.234 24.449 11.375 1.00 23.32 O ATOM 1739 CB HIS A 116 1.020 25.680 12.860 1.00 62.35 C ATOM 1740 CG HIS A 116 1.679 26.080 14.145 1.00 60.42 C ATOM 1741 ND1 HIS A 116 1.681 27.375 14.619 1.00 74.44 N ATOM 1742 CD2 HIS A 116 2.347 25.344 15.064 1.00 14.43 C ATOM 1743 CE1 HIS A 116 2.322 27.417 15.774 1.00 12.45 C ATOM 1744 NE2 HIS A 116 2.735 26.198 16.065 1.00 21.21 N ATOM 0 H HIS A 116 0.535 26.959 9.980 1.00 52.33 H new ATOM 0 HA HIS A 116 1.809 27.349 11.741 1.00 31.20 H new ATOM 0 HB2 HIS A 116 -0.026 25.986 12.890 1.00 62.35 H new ATOM 0 HB3 HIS A 116 1.032 24.593 12.781 1.00 62.35 H new ATOM 0 HD2 HIS A 116 2.539 24.282 15.018 1.00 14.43 H new ATOM 0 HE1 HIS A 116 2.481 28.299 16.377 1.00 12.45 H new ATOM 0 HE2 HIS A 116 3.258 25.933 16.900 1.00 21.21 H new ATOM 1753 N ILE A 117 4.065 26.538 11.244 1.00 32.33 N ATOM 1754 CA ILE A 117 5.441 26.093 11.042 1.00 41.30 C ATOM 1755 C ILE A 117 6.187 26.008 12.373 1.00 61.03 C ATOM 1756 O ILE A 117 6.727 27.003 12.862 1.00 53.41 O ATOM 1757 CB ILE A 117 6.212 27.031 10.087 1.00 75.52 C ATOM 1758 CG1 ILE A 117 5.480 27.158 8.746 1.00 63.13 C ATOM 1759 CG2 ILE A 117 7.630 26.522 9.871 1.00 14.04 C ATOM 1760 CD1 ILE A 117 5.475 25.883 7.930 1.00 43.34 C ATOM 0 H ILE A 117 3.947 27.551 11.260 1.00 32.33 H new ATOM 0 HA ILE A 117 5.389 25.103 10.590 1.00 41.30 H new ATOM 0 HB ILE A 117 6.264 28.019 10.545 1.00 75.52 H new ATOM 0 HG12 ILE A 117 4.450 27.463 8.932 1.00 63.13 H new ATOM 0 HG13 ILE A 117 5.947 27.951 8.161 1.00 63.13 H new ATOM 0 HG21 ILE A 117 8.159 27.194 9.196 1.00 14.04 H new ATOM 0 HG22 ILE A 117 8.152 26.483 10.827 1.00 14.04 H new ATOM 0 HG23 ILE A 117 7.596 25.523 9.435 1.00 14.04 H new ATOM 0 HD11 ILE A 117 4.939 26.051 6.996 1.00 43.34 H new ATOM 0 HD12 ILE A 117 6.501 25.587 7.712 1.00 43.34 H new ATOM 0 HD13 ILE A 117 4.981 25.092 8.494 1.00 43.34 H new ATOM 1772 N THR A 118 6.197 24.813 12.956 1.00 10.23 N ATOM 1773 CA THR A 118 6.871 24.572 14.228 1.00 54.04 C ATOM 1774 C THR A 118 7.269 23.101 14.345 1.00 61.11 C ATOM 1775 O THR A 118 6.415 22.223 14.239 1.00 11.44 O ATOM 1776 CB THR A 118 5.968 24.955 15.427 1.00 40.13 C ATOM 1777 OG1 THR A 118 5.800 26.377 15.484 1.00 12.31 O ATOM 1778 CG2 THR A 118 6.550 24.466 16.747 1.00 72.24 C ATOM 0 H THR A 118 5.741 23.989 12.563 1.00 10.23 H new ATOM 0 HA THR A 118 7.763 25.198 14.252 1.00 54.04 H new ATOM 0 HB THR A 118 5.003 24.472 15.276 1.00 40.13 H new ATOM 0 HG1 THR A 118 4.857 26.589 15.649 1.00 12.31 H new ATOM 0 HG21 THR A 118 5.889 24.753 17.565 1.00 72.24 H new ATOM 0 HG22 THR A 118 6.646 23.381 16.722 1.00 72.24 H new ATOM 0 HG23 THR A 118 7.532 24.914 16.900 1.00 72.24 H new ATOM 1786 N PRO A 119 8.575 22.814 14.547 1.00 60.12 N ATOM 1787 CA PRO A 119 9.079 21.439 14.682 1.00 64.33 C ATOM 1788 C PRO A 119 8.327 20.641 15.744 1.00 0.31 C ATOM 1789 O PRO A 119 8.397 20.946 16.936 1.00 72.22 O ATOM 1790 CB PRO A 119 10.551 21.620 15.084 1.00 11.42 C ATOM 1791 CG PRO A 119 10.714 23.064 15.420 1.00 63.35 C ATOM 1792 CD PRO A 119 9.661 23.799 14.644 1.00 63.31 C ATOM 0 HA PRO A 119 8.948 20.874 13.759 1.00 64.33 H new ATOM 0 HB2 PRO A 119 10.802 20.991 15.938 1.00 11.42 H new ATOM 0 HB3 PRO A 119 11.216 21.332 14.269 1.00 11.42 H new ATOM 0 HG2 PRO A 119 10.595 23.230 16.491 1.00 63.35 H new ATOM 0 HG3 PRO A 119 11.710 23.415 15.152 1.00 63.35 H new ATOM 0 HD2 PRO A 119 9.340 24.705 15.158 1.00 63.31 H new ATOM 0 HD3 PRO A 119 10.021 24.101 13.661 1.00 63.31 H new ATOM 1800 N GLY A 120 7.605 19.619 15.295 1.00 43.34 N ATOM 1801 CA GLY A 120 6.832 18.792 16.202 1.00 51.53 C ATOM 1802 C GLY A 120 5.352 18.826 15.875 1.00 21.50 C ATOM 1803 O GLY A 120 4.687 17.791 15.861 1.00 64.55 O ATOM 0 H GLY A 120 7.542 19.348 14.314 1.00 43.34 H new ATOM 0 HA2 GLY A 120 7.191 17.764 16.152 1.00 51.53 H new ATOM 0 HA3 GLY A 120 6.986 19.134 17.226 1.00 51.53 H new ATOM 1807 N THR A 121 4.839 20.025 15.610 1.00 61.11 N ATOM 1808 CA THR A 121 3.431 20.205 15.273 1.00 3.40 C ATOM 1809 C THR A 121 3.275 20.613 13.806 1.00 13.54 C ATOM 1810 O THR A 121 2.200 21.033 13.373 1.00 20.43 O ATOM 1811 CB THR A 121 2.771 21.270 16.174 1.00 51.22 C ATOM 1812 OG1 THR A 121 3.389 21.270 17.467 1.00 40.33 O ATOM 1813 CG2 THR A 121 1.279 21.007 16.330 1.00 3.54 C ATOM 0 H THR A 121 5.381 20.889 15.623 1.00 61.11 H new ATOM 0 HA THR A 121 2.932 19.250 15.438 1.00 3.40 H new ATOM 0 HB THR A 121 2.907 22.242 15.700 1.00 51.22 H new ATOM 0 HG1 THR A 121 2.966 21.950 18.032 1.00 40.33 H new ATOM 0 HG21 THR A 121 0.840 21.772 16.970 1.00 3.54 H new ATOM 0 HG22 THR A 121 0.801 21.034 15.351 1.00 3.54 H new ATOM 0 HG23 THR A 121 1.128 20.026 16.781 1.00 3.54 H new ATOM 1821 N ALA A 122 4.358 20.476 13.043 1.00 51.13 N ATOM 1822 CA ALA A 122 4.354 20.825 11.625 1.00 12.43 C ATOM 1823 C ALA A 122 3.824 19.673 10.776 1.00 31.34 C ATOM 1824 O ALA A 122 3.693 19.797 9.559 1.00 73.24 O ATOM 1825 CB ALA A 122 5.754 21.216 11.175 1.00 23.51 C ATOM 0 H ALA A 122 5.252 20.124 13.385 1.00 51.13 H new ATOM 0 HA ALA A 122 3.688 21.677 11.487 1.00 12.43 H new ATOM 0 HB1 ALA A 122 5.737 21.474 10.116 1.00 23.51 H new ATOM 0 HB2 ALA A 122 6.095 22.075 11.752 1.00 23.51 H new ATOM 0 HB3 ALA A 122 6.434 20.379 11.334 1.00 23.51 H new ATOM 1831 N TYR A 123 3.527 18.552 11.429 1.00 30.15 N ATOM 1832 CA TYR A 123 3.004 17.375 10.747 1.00 4.23 C ATOM 1833 C TYR A 123 1.565 17.103 11.179 1.00 30.11 C ATOM 1834 O TYR A 123 0.758 16.594 10.401 1.00 10.21 O ATOM 1835 CB TYR A 123 3.888 16.158 11.044 1.00 14.22 C ATOM 1836 CG TYR A 123 3.391 14.866 10.430 1.00 12.33 C ATOM 1837 CD1 TYR A 123 3.063 13.778 11.231 1.00 34.24 C ATOM 1838 CD2 TYR A 123 3.248 14.733 9.054 1.00 64.42 C ATOM 1839 CE1 TYR A 123 2.608 12.597 10.678 1.00 14.42 C ATOM 1840 CE2 TYR A 123 2.792 13.555 8.494 1.00 32.40 C ATOM 1841 CZ TYR A 123 2.474 12.490 9.310 1.00 61.00 C ATOM 1842 OH TYR A 123 2.020 11.316 8.756 1.00 63.11 O ATOM 0 H TYR A 123 3.641 18.436 12.436 1.00 30.15 H new ATOM 0 HA TYR A 123 3.012 17.562 9.673 1.00 4.23 H new ATOM 0 HB2 TYR A 123 4.896 16.357 10.679 1.00 14.22 H new ATOM 0 HB3 TYR A 123 3.960 16.030 12.124 1.00 14.22 H new ATOM 0 HD1 TYR A 123 3.166 13.858 12.303 1.00 34.24 H new ATOM 0 HD2 TYR A 123 3.498 15.564 8.412 1.00 64.42 H new ATOM 0 HE1 TYR A 123 2.358 11.761 11.314 1.00 14.42 H new ATOM 0 HE2 TYR A 123 2.685 13.469 7.423 1.00 32.40 H new ATOM 0 HH TYR A 123 1.448 11.517 7.986 1.00 63.11 H new ATOM 1852 N GLN A 124 1.252 17.458 12.424 1.00 40.14 N ATOM 1853 CA GLN A 124 -0.087 17.255 12.973 1.00 1.34 C ATOM 1854 C GLN A 124 -1.099 18.179 12.302 1.00 23.13 C ATOM 1855 O GLN A 124 -2.189 17.750 11.922 1.00 72.24 O ATOM 1856 CB GLN A 124 -0.084 17.505 14.481 1.00 71.22 C ATOM 1857 CG GLN A 124 0.911 16.642 15.240 1.00 34.40 C ATOM 1858 CD GLN A 124 0.966 16.977 16.719 1.00 44.04 C ATOM 1859 OE1 GLN A 124 -0.027 17.404 17.309 1.00 1.04 O ATOM 1860 NE2 GLN A 124 2.131 16.786 17.325 1.00 21.23 N ATOM 0 H GLN A 124 1.910 17.889 13.073 1.00 40.14 H new ATOM 0 HA GLN A 124 -0.377 16.222 12.778 1.00 1.34 H new ATOM 0 HB2 GLN A 124 0.143 18.555 14.666 1.00 71.22 H new ATOM 0 HB3 GLN A 124 -1.084 17.321 14.873 1.00 71.22 H new ATOM 0 HG2 GLN A 124 0.642 15.593 15.119 1.00 34.40 H new ATOM 0 HG3 GLN A 124 1.902 16.770 14.805 1.00 34.40 H new ATOM 0 HE21 GLN A 124 2.928 16.430 16.797 1.00 21.23 H new ATOM 0 HE22 GLN A 124 2.229 16.995 18.319 1.00 21.23 H new ATOM 1869 N SER A 125 -0.726 19.448 12.157 1.00 13.11 N ATOM 1870 CA SER A 125 -1.596 20.438 11.533 1.00 63.44 C ATOM 1871 C SER A 125 -1.459 20.403 10.011 1.00 62.04 C ATOM 1872 O SER A 125 -2.268 20.991 9.293 1.00 11.24 O ATOM 1873 CB SER A 125 -1.269 21.836 12.060 1.00 62.23 C ATOM 1874 OG SER A 125 -2.185 22.800 11.565 1.00 20.23 O ATOM 0 H SER A 125 0.175 19.814 12.464 1.00 13.11 H new ATOM 0 HA SER A 125 -2.627 20.195 11.789 1.00 63.44 H new ATOM 0 HB2 SER A 125 -1.295 21.832 13.150 1.00 62.23 H new ATOM 0 HB3 SER A 125 -0.256 22.110 11.767 1.00 62.23 H new ATOM 0 HG SER A 125 -2.609 22.460 10.750 1.00 20.23 H new ATOM 1880 N PHE A 126 -0.432 19.706 9.527 1.00 55.24 N ATOM 1881 CA PHE A 126 -0.193 19.587 8.092 1.00 31.44 C ATOM 1882 C PHE A 126 -1.212 18.649 7.455 1.00 23.35 C ATOM 1883 O PHE A 126 -1.652 18.874 6.330 1.00 64.40 O ATOM 1884 CB PHE A 126 1.223 19.069 7.829 1.00 5.42 C ATOM 1885 CG PHE A 126 1.727 19.354 6.441 1.00 43.23 C ATOM 1886 CD1 PHE A 126 1.455 18.486 5.395 1.00 34.13 C ATOM 1887 CD2 PHE A 126 2.475 20.491 6.184 1.00 21.24 C ATOM 1888 CE1 PHE A 126 1.918 18.748 4.120 1.00 3.43 C ATOM 1889 CE2 PHE A 126 2.942 20.758 4.912 1.00 23.41 C ATOM 1890 CZ PHE A 126 2.663 19.886 3.878 1.00 41.24 C ATOM 0 H PHE A 126 0.247 19.216 10.109 1.00 55.24 H new ATOM 0 HA PHE A 126 -0.298 20.576 7.646 1.00 31.44 H new ATOM 0 HB2 PHE A 126 1.904 19.518 8.552 1.00 5.42 H new ATOM 0 HB3 PHE A 126 1.243 17.992 7.999 1.00 5.42 H new ATOM 0 HD1 PHE A 126 0.874 17.594 5.579 1.00 34.13 H new ATOM 0 HD2 PHE A 126 2.696 21.177 6.988 1.00 21.24 H new ATOM 0 HE1 PHE A 126 1.698 18.064 3.314 1.00 3.43 H new ATOM 0 HE2 PHE A 126 3.525 21.648 4.726 1.00 23.41 H new ATOM 0 HZ PHE A 126 3.026 20.093 2.882 1.00 41.24 H new ATOM 1900 N GLU A 127 -1.588 17.604 8.191 1.00 2.20 N ATOM 1901 CA GLU A 127 -2.553 16.621 7.706 1.00 74.21 C ATOM 1902 C GLU A 127 -3.971 17.193 7.691 1.00 13.00 C ATOM 1903 O GLU A 127 -4.869 16.631 7.063 1.00 70.13 O ATOM 1904 CB GLU A 127 -2.509 15.365 8.578 1.00 62.44 C ATOM 1905 CG GLU A 127 -1.175 14.636 8.531 1.00 21.40 C ATOM 1906 CD GLU A 127 -1.066 13.552 9.585 1.00 32.20 C ATOM 1907 OE1 GLU A 127 -1.354 12.379 9.263 1.00 43.30 O ATOM 1908 OE2 GLU A 127 -0.691 13.875 10.733 1.00 50.51 O1- ATOM 0 H GLU A 127 -1.236 17.417 9.130 1.00 2.20 H new ATOM 0 HA GLU A 127 -2.280 16.362 6.683 1.00 74.21 H new ATOM 0 HB2 GLU A 127 -2.726 15.642 9.610 1.00 62.44 H new ATOM 0 HB3 GLU A 127 -3.297 14.683 8.258 1.00 62.44 H new ATOM 0 HG2 GLU A 127 -1.042 14.193 7.544 1.00 21.40 H new ATOM 0 HG3 GLU A 127 -0.367 15.355 8.669 1.00 21.40 H new ATOM 1915 N GLN A 128 -4.163 18.311 8.385 1.00 53.35 N ATOM 1916 CA GLN A 128 -5.466 18.961 8.454 1.00 70.25 C ATOM 1917 C GLN A 128 -5.660 19.919 7.279 1.00 60.34 C ATOM 1918 O GLN A 128 -6.736 19.974 6.684 1.00 75.44 O ATOM 1919 CB GLN A 128 -5.602 19.714 9.783 1.00 10.01 C ATOM 1920 CG GLN A 128 -7.000 20.259 10.050 1.00 62.21 C ATOM 1921 CD GLN A 128 -7.165 21.713 9.635 1.00 34.24 C ATOM 1922 OE1 GLN A 128 -8.234 22.120 9.183 1.00 71.43 O ATOM 1923 NE2 GLN A 128 -6.111 22.506 9.800 1.00 3.22 N ATOM 0 H GLN A 128 -3.429 18.787 8.909 1.00 53.35 H new ATOM 0 HA GLN A 128 -6.239 18.195 8.396 1.00 70.25 H new ATOM 0 HB2 GLN A 128 -5.323 19.045 10.597 1.00 10.01 H new ATOM 0 HB3 GLN A 128 -4.893 20.542 9.793 1.00 10.01 H new ATOM 0 HG2 GLN A 128 -7.729 19.650 9.515 1.00 62.21 H new ATOM 0 HG3 GLN A 128 -7.224 20.163 11.113 1.00 62.21 H new ATOM 0 HE21 GLN A 128 -5.243 22.128 10.178 1.00 3.22 H new ATOM 0 HE22 GLN A 128 -6.171 23.493 9.548 1.00 3.22 H new ATOM 1932 N VAL A 129 -4.607 20.664 6.946 1.00 52.22 N ATOM 1933 CA VAL A 129 -4.660 21.628 5.850 1.00 22.34 C ATOM 1934 C VAL A 129 -4.530 20.938 4.491 1.00 31.31 C ATOM 1935 O VAL A 129 -5.122 21.379 3.504 1.00 12.30 O ATOM 1936 CB VAL A 129 -3.554 22.698 5.991 1.00 11.54 C ATOM 1937 CG1 VAL A 129 -3.694 23.771 4.921 1.00 31.31 C ATOM 1938 CG2 VAL A 129 -3.591 23.323 7.377 1.00 52.41 C ATOM 0 H VAL A 129 -3.706 20.618 7.421 1.00 52.22 H new ATOM 0 HA VAL A 129 -5.634 22.115 5.904 1.00 22.34 H new ATOM 0 HB VAL A 129 -2.590 22.207 5.856 1.00 11.54 H new ATOM 0 HG11 VAL A 129 -2.904 24.512 5.043 1.00 31.31 H new ATOM 0 HG12 VAL A 129 -3.614 23.314 3.935 1.00 31.31 H new ATOM 0 HG13 VAL A 129 -4.665 24.257 5.018 1.00 31.31 H new ATOM 0 HG21 VAL A 129 -2.805 24.074 7.458 1.00 52.41 H new ATOM 0 HG22 VAL A 129 -4.561 23.793 7.538 1.00 52.41 H new ATOM 0 HG23 VAL A 129 -3.433 22.550 8.129 1.00 52.41 H new ATOM 1948 N VAL A 130 -3.767 19.846 4.447 1.00 21.12 N ATOM 1949 CA VAL A 130 -3.566 19.103 3.206 1.00 62.21 C ATOM 1950 C VAL A 130 -4.815 18.294 2.838 1.00 32.14 C ATOM 1951 O VAL A 130 -4.962 17.839 1.704 1.00 22.20 O ATOM 1952 CB VAL A 130 -2.334 18.168 3.300 1.00 32.44 C ATOM 1953 CG1 VAL A 130 -2.689 16.836 3.949 1.00 23.44 C ATOM 1954 CG2 VAL A 130 -1.718 17.953 1.926 1.00 2.30 C ATOM 0 H VAL A 130 -3.280 19.458 5.255 1.00 21.12 H new ATOM 0 HA VAL A 130 -3.381 19.834 2.419 1.00 62.21 H new ATOM 0 HB VAL A 130 -1.596 18.656 3.937 1.00 32.44 H new ATOM 0 HG11 VAL A 130 -1.800 16.207 3.998 1.00 23.44 H new ATOM 0 HG12 VAL A 130 -3.065 17.011 4.957 1.00 23.44 H new ATOM 0 HG13 VAL A 130 -3.456 16.336 3.357 1.00 23.44 H new ATOM 0 HG21 VAL A 130 -0.854 17.294 2.014 1.00 2.30 H new ATOM 0 HG22 VAL A 130 -2.455 17.499 1.264 1.00 2.30 H new ATOM 0 HG23 VAL A 130 -1.402 18.912 1.515 1.00 2.30 H new ATOM 1964 N ASN A 131 -5.715 18.131 3.807 1.00 62.35 N ATOM 1965 CA ASN A 131 -6.955 17.394 3.593 1.00 15.13 C ATOM 1966 C ASN A 131 -8.019 18.309 2.988 1.00 62.24 C ATOM 1967 O ASN A 131 -8.997 17.843 2.400 1.00 44.43 O ATOM 1968 CB ASN A 131 -7.447 16.803 4.918 1.00 1.33 C ATOM 1969 CG ASN A 131 -8.560 15.788 4.735 1.00 43.42 C ATOM 1970 OD1 ASN A 131 -8.306 14.615 4.462 1.00 41.44 O ATOM 1971 ND2 ASN A 131 -9.802 16.233 4.894 1.00 72.21 N ATOM 0 H ASN A 131 -5.606 18.502 4.751 1.00 62.35 H new ATOM 0 HA ASN A 131 -6.765 16.579 2.894 1.00 15.13 H new ATOM 0 HB2 ASN A 131 -6.610 16.329 5.431 1.00 1.33 H new ATOM 0 HB3 ASN A 131 -7.800 17.609 5.561 1.00 1.33 H new ATOM 0 HD21 ASN A 131 -10.590 15.594 4.790 1.00 72.21 H new ATOM 0 HD22 ASN A 131 -9.967 17.214 5.120 1.00 72.21 H new ATOM 1978 N GLU A 132 -7.809 19.618 3.125 1.00 40.21 N ATOM 1979 CA GLU A 132 -8.740 20.612 2.597 1.00 4.42 C ATOM 1980 C GLU A 132 -8.506 20.850 1.105 1.00 0.33 C ATOM 1981 O GLU A 132 -9.227 21.620 0.471 1.00 34.43 O ATOM 1982 CB GLU A 132 -8.603 21.932 3.363 1.00 63.23 C ATOM 1983 CG GLU A 132 -8.771 21.791 4.869 1.00 31.12 C ATOM 1984 CD GLU A 132 -10.106 21.184 5.259 1.00 11.25 C ATOM 1985 OE1 GLU A 132 -10.145 19.969 5.546 1.00 5.51 O ATOM 1986 OE2 GLU A 132 -11.112 21.925 5.276 1.00 42.21 O1- ATOM 0 H GLU A 132 -6.998 20.015 3.600 1.00 40.21 H new ATOM 0 HA GLU A 132 -9.751 20.225 2.729 1.00 4.42 H new ATOM 0 HB2 GLU A 132 -7.623 22.361 3.155 1.00 63.23 H new ATOM 0 HB3 GLU A 132 -9.346 22.637 2.989 1.00 63.23 H new ATOM 0 HG2 GLU A 132 -7.966 21.170 5.263 1.00 31.12 H new ATOM 0 HG3 GLU A 132 -8.674 22.772 5.334 1.00 31.12 H new ATOM 1993 N LEU A 133 -7.493 20.186 0.552 1.00 43.41 N ATOM 1994 CA LEU A 133 -7.169 20.317 -0.864 1.00 30.13 C ATOM 1995 C LEU A 133 -7.078 18.944 -1.531 1.00 24.24 C ATOM 1996 O LEU A 133 -6.840 18.843 -2.736 1.00 34.34 O ATOM 1997 CB LEU A 133 -5.859 21.096 -1.047 1.00 74.13 C ATOM 1998 CG LEU A 133 -4.683 20.626 -0.184 1.00 42.24 C ATOM 1999 CD1 LEU A 133 -3.777 19.688 -0.968 1.00 34.23 C ATOM 2000 CD2 LEU A 133 -3.894 21.819 0.334 1.00 20.31 C ATOM 0 H LEU A 133 -6.882 19.551 1.066 1.00 43.41 H new ATOM 0 HA LEU A 133 -7.971 20.875 -1.347 1.00 30.13 H new ATOM 0 HB2 LEU A 133 -5.565 21.035 -2.095 1.00 74.13 H new ATOM 0 HB3 LEU A 133 -6.049 22.147 -0.829 1.00 74.13 H new ATOM 0 HG LEU A 133 -5.084 20.078 0.669 1.00 42.24 H new ATOM 0 HD11 LEU A 133 -2.950 19.368 -0.335 1.00 34.23 H new ATOM 0 HD12 LEU A 133 -4.347 18.816 -1.289 1.00 34.23 H new ATOM 0 HD13 LEU A 133 -3.385 20.207 -1.842 1.00 34.23 H new ATOM 0 HD21 LEU A 133 -3.062 21.468 0.945 1.00 20.31 H new ATOM 0 HD22 LEU A 133 -3.508 22.393 -0.508 1.00 20.31 H new ATOM 0 HD23 LEU A 133 -4.545 22.452 0.937 1.00 20.31 H new ATOM 2012 N PHE A 134 -7.276 17.890 -0.740 1.00 54.13 N ATOM 2013 CA PHE A 134 -7.223 16.524 -1.255 1.00 63.14 C ATOM 2014 C PHE A 134 -8.611 15.883 -1.229 1.00 43.10 C ATOM 2015 O PHE A 134 -8.750 14.665 -1.358 1.00 40.33 O ATOM 2016 CB PHE A 134 -6.234 15.684 -0.441 1.00 74.12 C ATOM 2017 CG PHE A 134 -5.670 14.515 -1.201 1.00 31.43 C ATOM 2018 CD1 PHE A 134 -5.928 13.214 -0.797 1.00 50.23 C ATOM 2019 CD2 PHE A 134 -4.886 14.720 -2.324 1.00 34.14 C ATOM 2020 CE1 PHE A 134 -5.413 12.141 -1.500 1.00 42.50 C ATOM 2021 CE2 PHE A 134 -4.368 13.651 -3.030 1.00 64.34 C ATOM 2022 CZ PHE A 134 -4.632 12.360 -2.617 1.00 41.30 C ATOM 0 H PHE A 134 -7.474 17.957 0.258 1.00 54.13 H new ATOM 0 HA PHE A 134 -6.881 16.561 -2.289 1.00 63.14 H new ATOM 0 HB2 PHE A 134 -5.414 16.322 -0.111 1.00 74.12 H new ATOM 0 HB3 PHE A 134 -6.734 15.317 0.456 1.00 74.12 H new ATOM 0 HD1 PHE A 134 -6.538 13.037 0.076 1.00 50.23 H new ATOM 0 HD2 PHE A 134 -4.677 15.728 -2.652 1.00 34.14 H new ATOM 0 HE1 PHE A 134 -5.621 11.132 -1.176 1.00 42.50 H new ATOM 0 HE2 PHE A 134 -3.757 13.825 -3.904 1.00 64.34 H new ATOM 0 HZ PHE A 134 -4.228 11.523 -3.167 1.00 41.30 H new ATOM 2032 N ARG A 135 -9.637 16.717 -1.067 1.00 72.13 N ATOM 2033 CA ARG A 135 -11.022 16.246 -1.031 1.00 14.02 C ATOM 2034 C ARG A 135 -11.444 15.709 -2.396 1.00 12.25 C ATOM 2035 O ARG A 135 -12.107 14.676 -2.491 1.00 25.54 O ATOM 2036 CB ARG A 135 -11.982 17.369 -0.600 1.00 51.01 C ATOM 2037 CG ARG A 135 -11.305 18.687 -0.239 1.00 3.33 C ATOM 2038 CD ARG A 135 -10.923 19.490 -1.477 1.00 41.35 C ATOM 2039 NE ARG A 135 -12.088 19.894 -2.258 1.00 15.33 N ATOM 2040 CZ ARG A 135 -12.008 20.505 -3.437 1.00 70.32 C ATOM 2041 NH1 ARG A 135 -10.823 20.780 -3.967 1.00 54.21 N1+ ATOM 2042 NH2 ARG A 135 -13.113 20.839 -4.088 1.00 54.11 N ATOM 0 H ARG A 135 -9.535 17.726 -0.958 1.00 72.13 H new ATOM 0 HA ARG A 135 -11.075 15.442 -0.297 1.00 14.02 H new ATOM 0 HB2 ARG A 135 -12.692 17.551 -1.407 1.00 51.01 H new ATOM 0 HB3 ARG A 135 -12.558 17.025 0.259 1.00 51.01 H new ATOM 0 HG2 ARG A 135 -11.974 19.279 0.385 1.00 3.33 H new ATOM 0 HG3 ARG A 135 -10.412 18.486 0.353 1.00 3.33 H new ATOM 0 HD2 ARG A 135 -10.366 20.377 -1.174 1.00 41.35 H new ATOM 0 HD3 ARG A 135 -10.258 18.894 -2.102 1.00 41.35 H new ATOM 0 HE ARG A 135 -13.014 19.697 -1.879 1.00 15.33 H new ATOM 0 HH11 ARG A 135 -9.970 20.523 -3.470 1.00 54.21 H new ATOM 0 HH12 ARG A 135 -10.765 21.249 -4.871 1.00 54.21 H new ATOM 0 HH21 ARG A 135 -14.026 20.628 -3.685 1.00 54.11 H new ATOM 0 HH22 ARG A 135 -13.051 21.307 -4.992 1.00 54.11 H new ATOM 2056 N ASP A 136 -11.052 16.419 -3.450 1.00 34.00 N ATOM 2057 CA ASP A 136 -11.378 16.017 -4.813 1.00 23.21 C ATOM 2058 C ASP A 136 -10.124 15.582 -5.568 1.00 12.24 C ATOM 2059 O ASP A 136 -10.083 15.622 -6.799 1.00 13.01 O ATOM 2060 CB ASP A 136 -12.071 17.164 -5.554 1.00 12.15 C ATOM 2061 CG ASP A 136 -13.536 17.290 -5.182 1.00 41.24 C ATOM 2062 OD1 ASP A 136 -14.392 16.918 -6.012 1.00 31.33 O ATOM 2063 OD2 ASP A 136 -13.828 17.755 -4.061 1.00 31.34 O1- ATOM 0 H ASP A 136 -10.506 17.278 -3.385 1.00 34.00 H new ATOM 0 HA ASP A 136 -12.058 15.167 -4.763 1.00 23.21 H new ATOM 0 HB2 ASP A 136 -11.560 18.100 -5.329 1.00 12.15 H new ATOM 0 HB3 ASP A 136 -11.984 17.004 -6.629 1.00 12.15 H new ATOM 2068 N GLY A 137 -9.107 15.155 -4.820 1.00 44.32 N ATOM 2069 CA GLY A 137 -7.865 14.711 -5.428 1.00 35.12 C ATOM 2070 C GLY A 137 -7.850 13.216 -5.684 1.00 75.04 C ATOM 2071 O GLY A 137 -6.923 12.518 -5.273 1.00 42.11 O ATOM 0 H GLY A 137 -9.123 15.109 -3.801 1.00 44.32 H new ATOM 0 HA2 GLY A 137 -7.715 15.240 -6.369 1.00 35.12 H new ATOM 0 HA3 GLY A 137 -7.031 14.974 -4.778 1.00 35.12 H new ATOM 2075 N VAL A 138 -8.883 12.727 -6.366 1.00 35.22 N ATOM 2076 CA VAL A 138 -9.002 11.306 -6.679 1.00 35.12 C ATOM 2077 C VAL A 138 -8.626 11.039 -8.139 1.00 75.24 C ATOM 2078 O VAL A 138 -8.661 9.900 -8.607 1.00 74.33 O ATOM 2079 CB VAL A 138 -10.438 10.791 -6.417 1.00 14.54 C ATOM 2080 CG1 VAL A 138 -10.442 9.289 -6.167 1.00 12.53 C ATOM 2081 CG2 VAL A 138 -11.073 11.526 -5.244 1.00 54.32 C ATOM 0 H VAL A 138 -9.653 13.298 -6.714 1.00 35.22 H new ATOM 0 HA VAL A 138 -8.313 10.771 -6.025 1.00 35.12 H new ATOM 0 HB VAL A 138 -11.031 10.991 -7.310 1.00 14.54 H new ATOM 0 HG11 VAL A 138 -11.463 8.953 -5.986 1.00 12.53 H new ATOM 0 HG12 VAL A 138 -10.040 8.774 -7.039 1.00 12.53 H new ATOM 0 HG13 VAL A 138 -9.826 9.063 -5.297 1.00 12.53 H new ATOM 0 HG21 VAL A 138 -12.081 11.146 -5.080 1.00 54.32 H new ATOM 0 HG22 VAL A 138 -10.474 11.366 -4.347 1.00 54.32 H new ATOM 0 HG23 VAL A 138 -11.118 12.593 -5.464 1.00 54.32 H new ATOM 2091 N ASN A 139 -8.257 12.100 -8.852 1.00 21.43 N ATOM 2092 CA ASN A 139 -7.876 11.984 -10.255 1.00 1.11 C ATOM 2093 C ASN A 139 -6.380 12.235 -10.434 1.00 63.12 C ATOM 2094 O ASN A 139 -5.736 12.840 -9.577 1.00 35.44 O ATOM 2095 CB ASN A 139 -8.683 12.975 -11.099 1.00 32.13 C ATOM 2096 CG ASN A 139 -8.767 12.574 -12.560 1.00 40.14 C ATOM 2097 OD1 ASN A 139 -7.969 13.018 -13.385 1.00 63.25 O ATOM 2098 ND2 ASN A 139 -9.736 11.727 -12.886 1.00 74.42 N ATOM 0 H ASN A 139 -8.214 13.049 -8.481 1.00 21.43 H new ATOM 0 HA ASN A 139 -8.094 10.970 -10.589 1.00 1.11 H new ATOM 0 HB2 ASN A 139 -9.691 13.056 -10.691 1.00 32.13 H new ATOM 0 HB3 ASN A 139 -8.229 13.963 -11.024 1.00 32.13 H new ATOM 0 HD21 ASN A 139 -9.841 11.419 -13.853 1.00 74.42 H new ATOM 0 HD22 ASN A 139 -10.376 11.384 -12.170 1.00 74.42 H new ATOM 2105 N TRP A 140 -5.840 11.766 -11.559 1.00 54.33 N ATOM 2106 CA TRP A 140 -4.420 11.925 -11.870 1.00 61.13 C ATOM 2107 C TRP A 140 -4.073 13.383 -12.168 1.00 40.24 C ATOM 2108 O TRP A 140 -2.925 13.800 -12.009 1.00 42.12 O ATOM 2109 CB TRP A 140 -4.041 11.048 -13.068 1.00 54.30 C ATOM 2110 CG TRP A 140 -4.138 9.577 -12.792 1.00 12.32 C ATOM 2111 CD1 TRP A 140 -3.121 8.745 -12.418 1.00 2.44 C ATOM 2112 CD2 TRP A 140 -5.315 8.761 -12.872 1.00 0.43 C ATOM 2113 NE1 TRP A 140 -3.593 7.465 -12.258 1.00 60.20 N ATOM 2114 CE2 TRP A 140 -4.936 7.449 -12.530 1.00 11.14 C ATOM 2115 CE3 TRP A 140 -6.652 9.013 -13.197 1.00 43.34 C ATOM 2116 CZ2 TRP A 140 -5.845 6.395 -12.504 1.00 33.21 C ATOM 2117 CZ3 TRP A 140 -7.553 7.965 -13.170 1.00 62.13 C ATOM 2118 CH2 TRP A 140 -7.146 6.670 -12.826 1.00 55.42 C ATOM 0 H TRP A 140 -6.370 11.269 -12.275 1.00 54.33 H new ATOM 0 HA TRP A 140 -3.851 11.612 -10.995 1.00 61.13 H new ATOM 0 HB2 TRP A 140 -4.691 11.295 -13.908 1.00 54.30 H new ATOM 0 HB3 TRP A 140 -3.022 11.285 -13.373 1.00 54.30 H new ATOM 0 HD1 TRP A 140 -2.095 9.049 -12.270 1.00 2.44 H new ATOM 0 HE1 TRP A 140 -3.035 6.657 -11.982 1.00 60.20 H new ATOM 0 HE3 TRP A 140 -6.975 10.008 -13.464 1.00 43.34 H new ATOM 0 HZ2 TRP A 140 -5.534 5.395 -12.239 1.00 33.21 H new ATOM 0 HZ3 TRP A 140 -8.588 8.148 -13.418 1.00 62.13 H new ATOM 0 HH2 TRP A 140 -7.874 5.872 -12.815 1.00 55.42 H new ATOM 2129 N GLY A 141 -5.070 14.152 -12.602 1.00 64.25 N ATOM 2130 CA GLY A 141 -4.849 15.554 -12.910 1.00 31.02 C ATOM 2131 C GLY A 141 -5.248 16.475 -11.771 1.00 22.22 C ATOM 2132 O GLY A 141 -5.070 17.690 -11.858 1.00 14.23 O ATOM 0 H GLY A 141 -6.027 13.828 -12.745 1.00 64.25 H new ATOM 0 HA2 GLY A 141 -3.796 15.708 -13.144 1.00 31.02 H new ATOM 0 HA3 GLY A 141 -5.416 15.819 -13.802 1.00 31.02 H new ATOM 2136 N ARG A 142 -5.790 15.896 -10.700 1.00 73.43 N ATOM 2137 CA ARG A 142 -6.215 16.675 -9.539 1.00 35.51 C ATOM 2138 C ARG A 142 -5.256 16.485 -8.365 1.00 65.42 C ATOM 2139 O ARG A 142 -5.447 17.068 -7.297 1.00 75.45 O ATOM 2140 CB ARG A 142 -7.637 16.287 -9.120 1.00 24.11 C ATOM 2141 CG ARG A 142 -8.728 17.105 -9.800 1.00 21.43 C ATOM 2142 CD ARG A 142 -8.869 16.749 -11.272 1.00 70.43 C ATOM 2143 NE ARG A 142 -9.899 17.547 -11.933 1.00 22.41 N ATOM 2144 CZ ARG A 142 -10.457 17.218 -13.095 1.00 12.10 C ATOM 2145 NH1 ARG A 142 -10.088 16.110 -13.727 1.00 44.31 N1+ ATOM 2146 NH2 ARG A 142 -11.388 17.998 -13.626 1.00 70.32 N ATOM 0 H ARG A 142 -5.945 14.892 -10.613 1.00 73.43 H new ATOM 0 HA ARG A 142 -6.204 17.727 -9.825 1.00 35.51 H new ATOM 0 HB2 ARG A 142 -7.796 15.232 -9.343 1.00 24.11 H new ATOM 0 HB3 ARG A 142 -7.731 16.402 -8.040 1.00 24.11 H new ATOM 0 HG2 ARG A 142 -9.678 16.936 -9.293 1.00 21.43 H new ATOM 0 HG3 ARG A 142 -8.500 18.166 -9.703 1.00 21.43 H new ATOM 0 HD2 ARG A 142 -7.914 16.902 -11.775 1.00 70.43 H new ATOM 0 HD3 ARG A 142 -9.114 15.691 -11.367 1.00 70.43 H new ATOM 0 HE ARG A 142 -10.208 18.406 -11.477 1.00 22.41 H new ATOM 0 HH11 ARG A 142 -9.373 15.506 -13.322 1.00 44.31 H new ATOM 0 HH12 ARG A 142 -10.520 15.863 -14.618 1.00 44.31 H new ATOM 0 HH21 ARG A 142 -11.676 18.849 -13.144 1.00 70.32 H new ATOM 0 HH22 ARG A 142 -11.817 17.747 -14.517 1.00 70.32 H new ATOM 2160 N ILE A 143 -4.223 15.668 -8.568 1.00 31.43 N ATOM 2161 CA ILE A 143 -3.233 15.409 -7.526 1.00 43.20 C ATOM 2162 C ILE A 143 -2.055 16.383 -7.642 1.00 53.11 C ATOM 2163 O ILE A 143 -1.135 16.373 -6.822 1.00 4.22 O ATOM 2164 CB ILE A 143 -2.725 13.948 -7.583 1.00 72.55 C ATOM 2165 CG1 ILE A 143 -1.957 13.594 -6.303 1.00 22.11 C ATOM 2166 CG2 ILE A 143 -1.853 13.726 -8.814 1.00 61.31 C ATOM 2167 CD1 ILE A 143 -1.591 12.132 -6.191 1.00 62.43 C ATOM 0 H ILE A 143 -4.051 15.175 -9.444 1.00 31.43 H new ATOM 0 HA ILE A 143 -3.721 15.562 -6.563 1.00 43.20 H new ATOM 0 HB ILE A 143 -3.590 13.289 -7.657 1.00 72.55 H new ATOM 0 HG12 ILE A 143 -1.046 14.190 -6.262 1.00 22.11 H new ATOM 0 HG13 ILE A 143 -2.561 13.874 -5.440 1.00 22.11 H new ATOM 0 HG21 ILE A 143 -1.507 12.692 -8.833 1.00 61.31 H new ATOM 0 HG22 ILE A 143 -2.434 13.931 -9.713 1.00 61.31 H new ATOM 0 HG23 ILE A 143 -0.994 14.395 -8.777 1.00 61.31 H new ATOM 0 HD11 ILE A 143 -1.051 11.963 -5.260 1.00 62.43 H new ATOM 0 HD12 ILE A 143 -2.498 11.528 -6.199 1.00 62.43 H new ATOM 0 HD13 ILE A 143 -0.960 11.849 -7.033 1.00 62.43 H new ATOM 2179 N VAL A 144 -2.099 17.236 -8.663 1.00 42.22 N ATOM 2180 CA VAL A 144 -1.046 18.221 -8.886 1.00 70.12 C ATOM 2181 C VAL A 144 -1.153 19.360 -7.870 1.00 13.34 C ATOM 2182 O VAL A 144 -0.180 20.069 -7.608 1.00 50.21 O ATOM 2183 CB VAL A 144 -1.100 18.797 -10.318 1.00 63.44 C ATOM 2184 CG1 VAL A 144 0.254 19.360 -10.720 1.00 60.24 C ATOM 2185 CG2 VAL A 144 -1.555 17.738 -11.314 1.00 34.33 C ATOM 0 H VAL A 144 -2.854 17.264 -9.349 1.00 42.22 H new ATOM 0 HA VAL A 144 -0.092 17.710 -8.759 1.00 70.12 H new ATOM 0 HB VAL A 144 -1.828 19.608 -10.328 1.00 63.44 H new ATOM 0 HG11 VAL A 144 0.195 19.761 -11.732 1.00 60.24 H new ATOM 0 HG12 VAL A 144 0.537 20.155 -10.030 1.00 60.24 H new ATOM 0 HG13 VAL A 144 1.002 18.568 -10.686 1.00 60.24 H new ATOM 0 HG21 VAL A 144 -1.585 18.169 -12.315 1.00 34.33 H new ATOM 0 HG22 VAL A 144 -0.857 16.901 -11.300 1.00 34.33 H new ATOM 0 HG23 VAL A 144 -2.550 17.385 -11.041 1.00 34.33 H new ATOM 2195 N ALA A 145 -2.345 19.519 -7.293 1.00 72.13 N ATOM 2196 CA ALA A 145 -2.588 20.551 -6.289 1.00 54.42 C ATOM 2197 C ALA A 145 -2.167 20.062 -4.904 1.00 14.40 C ATOM 2198 O ALA A 145 -2.100 20.838 -3.950 1.00 71.23 O ATOM 2199 CB ALA A 145 -4.057 20.950 -6.287 1.00 2.45 C ATOM 0 H ALA A 145 -3.159 18.943 -7.506 1.00 72.13 H new ATOM 0 HA ALA A 145 -1.989 21.426 -6.541 1.00 54.42 H new ATOM 0 HB1 ALA A 145 -4.224 21.720 -5.534 1.00 2.45 H new ATOM 0 HB2 ALA A 145 -4.330 21.337 -7.269 1.00 2.45 H new ATOM 0 HB3 ALA A 145 -4.670 20.079 -6.057 1.00 2.45 H new ATOM 2205 N PHE A 146 -1.887 18.764 -4.810 1.00 2.20 N ATOM 2206 CA PHE A 146 -1.461 18.148 -3.560 1.00 62.11 C ATOM 2207 C PHE A 146 0.026 18.397 -3.319 1.00 64.51 C ATOM 2208 O PHE A 146 0.458 18.599 -2.184 1.00 35.24 O ATOM 2209 CB PHE A 146 -1.755 16.641 -3.601 1.00 1.14 C ATOM 2210 CG PHE A 146 -1.100 15.845 -2.504 1.00 4.25 C ATOM 2211 CD1 PHE A 146 -1.557 15.926 -1.198 1.00 50.41 C ATOM 2212 CD2 PHE A 146 -0.030 15.009 -2.785 1.00 20.52 C ATOM 2213 CE1 PHE A 146 -0.958 15.188 -0.194 1.00 22.33 C ATOM 2214 CE2 PHE A 146 0.573 14.271 -1.785 1.00 10.24 C ATOM 2215 CZ PHE A 146 0.108 14.361 -0.488 1.00 73.52 C ATOM 0 H PHE A 146 -1.949 18.115 -5.594 1.00 2.20 H new ATOM 0 HA PHE A 146 -2.017 18.596 -2.736 1.00 62.11 H new ATOM 0 HB2 PHE A 146 -2.833 16.493 -3.545 1.00 1.14 H new ATOM 0 HB3 PHE A 146 -1.428 16.246 -4.563 1.00 1.14 H new ATOM 0 HD1 PHE A 146 -2.390 16.572 -0.962 1.00 50.41 H new ATOM 0 HD2 PHE A 146 0.336 14.934 -3.798 1.00 20.52 H new ATOM 0 HE1 PHE A 146 -1.324 15.258 0.820 1.00 22.33 H new ATOM 0 HE2 PHE A 146 1.407 13.625 -2.017 1.00 10.24 H new ATOM 0 HZ PHE A 146 0.578 13.785 0.296 1.00 73.52 H new ATOM 2225 N PHE A 147 0.801 18.395 -4.402 1.00 11.32 N ATOM 2226 CA PHE A 147 2.241 18.613 -4.318 1.00 1.21 C ATOM 2227 C PHE A 147 2.592 20.099 -4.381 1.00 32.03 C ATOM 2228 O PHE A 147 3.698 20.495 -4.012 1.00 20.42 O ATOM 2229 CB PHE A 147 2.954 17.858 -5.441 1.00 1.02 C ATOM 2230 CG PHE A 147 2.963 16.367 -5.251 1.00 34.05 C ATOM 2231 CD1 PHE A 147 3.822 15.777 -4.336 1.00 44.02 C ATOM 2232 CD2 PHE A 147 2.114 15.555 -5.987 1.00 43.44 C ATOM 2233 CE1 PHE A 147 3.833 14.406 -4.159 1.00 2.22 C ATOM 2234 CE2 PHE A 147 2.121 14.184 -5.813 1.00 75.23 C ATOM 2235 CZ PHE A 147 2.982 13.609 -4.899 1.00 20.24 C ATOM 0 H PHE A 147 0.453 18.244 -5.349 1.00 11.32 H new ATOM 0 HA PHE A 147 2.578 18.232 -3.354 1.00 1.21 H new ATOM 0 HB2 PHE A 147 2.470 18.092 -6.389 1.00 1.02 H new ATOM 0 HB3 PHE A 147 3.982 18.213 -5.511 1.00 1.02 H new ATOM 0 HD1 PHE A 147 4.490 16.396 -3.755 1.00 44.02 H new ATOM 0 HD2 PHE A 147 1.440 15.999 -6.704 1.00 43.44 H new ATOM 0 HE1 PHE A 147 4.506 13.959 -3.443 1.00 2.22 H new ATOM 0 HE2 PHE A 147 1.453 13.563 -6.391 1.00 75.23 H new ATOM 0 HZ PHE A 147 2.990 12.538 -4.763 1.00 20.24 H new ATOM 2245 N SER A 148 1.647 20.921 -4.841 1.00 44.32 N ATOM 2246 CA SER A 148 1.872 22.362 -4.943 1.00 41.34 C ATOM 2247 C SER A 148 1.854 23.019 -3.563 1.00 63.02 C ATOM 2248 O SER A 148 2.348 24.134 -3.391 1.00 11.15 O ATOM 2249 CB SER A 148 0.819 23.010 -5.847 1.00 15.04 C ATOM 2250 OG SER A 148 -0.470 22.942 -5.265 1.00 33.54 O ATOM 0 H SER A 148 0.724 20.615 -5.147 1.00 44.32 H new ATOM 0 HA SER A 148 2.857 22.515 -5.384 1.00 41.34 H new ATOM 0 HB2 SER A 148 1.084 24.052 -6.029 1.00 15.04 H new ATOM 0 HB3 SER A 148 0.810 22.510 -6.815 1.00 15.04 H new ATOM 0 HG SER A 148 -1.122 23.364 -5.863 1.00 33.54 H new ATOM 2256 N PHE A 149 1.281 22.318 -2.585 1.00 60.53 N ATOM 2257 CA PHE A 149 1.208 22.817 -1.216 1.00 53.25 C ATOM 2258 C PHE A 149 2.556 22.643 -0.516 1.00 43.24 C ATOM 2259 O PHE A 149 2.957 23.474 0.301 1.00 32.13 O ATOM 2260 CB PHE A 149 0.101 22.081 -0.449 1.00 71.21 C ATOM 2261 CG PHE A 149 -0.016 22.474 1.000 1.00 41.30 C ATOM 2262 CD1 PHE A 149 -0.094 23.808 1.372 1.00 34.43 C ATOM 2263 CD2 PHE A 149 -0.050 21.505 1.990 1.00 11.54 C ATOM 2264 CE1 PHE A 149 -0.203 24.165 2.703 1.00 1.15 C ATOM 2265 CE2 PHE A 149 -0.159 21.857 3.321 1.00 32.33 C ATOM 2266 CZ PHE A 149 -0.235 23.188 3.678 1.00 71.42 C ATOM 0 H PHE A 149 0.859 21.399 -2.719 1.00 60.53 H new ATOM 0 HA PHE A 149 0.969 23.880 -1.238 1.00 53.25 H new ATOM 0 HB2 PHE A 149 -0.853 22.268 -0.942 1.00 71.21 H new ATOM 0 HB3 PHE A 149 0.285 21.008 -0.509 1.00 71.21 H new ATOM 0 HD1 PHE A 149 -0.069 24.576 0.613 1.00 34.43 H new ATOM 0 HD2 PHE A 149 0.009 20.462 1.717 1.00 11.54 H new ATOM 0 HE1 PHE A 149 -0.263 25.207 2.980 1.00 1.15 H new ATOM 0 HE2 PHE A 149 -0.185 21.091 4.082 1.00 32.33 H new ATOM 0 HZ PHE A 149 -0.319 23.465 4.718 1.00 71.42 H new ATOM 2276 N GLY A 150 3.255 21.561 -0.855 1.00 53.35 N ATOM 2277 CA GLY A 150 4.555 21.294 -0.265 1.00 14.43 C ATOM 2278 C GLY A 150 5.677 22.021 -0.983 1.00 20.20 C ATOM 2279 O GLY A 150 6.815 22.035 -0.513 1.00 21.02 O ATOM 0 H GLY A 150 2.942 20.863 -1.530 1.00 53.35 H new ATOM 0 HA2 GLY A 150 4.544 21.594 0.783 1.00 14.43 H new ATOM 0 HA3 GLY A 150 4.748 20.221 -0.288 1.00 14.43 H new ATOM 2283 N GLY A 151 5.354 22.624 -2.126 1.00 22.22 N ATOM 2284 CA GLY A 151 6.346 23.355 -2.894 1.00 54.03 C ATOM 2285 C GLY A 151 6.184 24.859 -2.769 1.00 31.24 C ATOM 2286 O GLY A 151 6.923 25.623 -3.391 1.00 21.32 O ATOM 0 H GLY A 151 4.419 22.618 -2.534 1.00 22.22 H new ATOM 0 HA2 GLY A 151 7.343 23.071 -2.558 1.00 54.03 H new ATOM 0 HA3 GLY A 151 6.270 23.070 -3.943 1.00 54.03 H new ATOM 2290 N ALA A 152 5.216 25.283 -1.959 1.00 51.32 N ATOM 2291 CA ALA A 152 4.954 26.703 -1.749 1.00 32.42 C ATOM 2292 C ALA A 152 5.637 27.207 -0.481 1.00 3.21 C ATOM 2293 O ALA A 152 6.004 28.377 -0.386 1.00 11.44 O ATOM 2294 CB ALA A 152 3.456 26.956 -1.679 1.00 63.13 C ATOM 0 H ALA A 152 4.599 24.661 -1.437 1.00 51.32 H new ATOM 0 HA ALA A 152 5.367 27.253 -2.595 1.00 32.42 H new ATOM 0 HB1 ALA A 152 3.273 28.019 -1.522 1.00 63.13 H new ATOM 0 HB2 ALA A 152 2.990 26.642 -2.613 1.00 63.13 H new ATOM 0 HB3 ALA A 152 3.029 26.389 -0.852 1.00 63.13 H new ATOM 2300 N LEU A 153 5.810 26.310 0.488 1.00 32.11 N ATOM 2301 CA LEU A 153 6.448 26.655 1.757 1.00 31.34 C ATOM 2302 C LEU A 153 7.966 26.480 1.680 1.00 2.33 C ATOM 2303 O LEU A 153 8.658 26.526 2.698 1.00 22.33 O ATOM 2304 CB LEU A 153 5.881 25.786 2.885 1.00 45.23 C ATOM 2305 CG LEU A 153 4.808 26.443 3.762 1.00 11.41 C ATOM 2306 CD1 LEU A 153 5.407 27.571 4.587 1.00 2.13 C ATOM 2307 CD2 LEU A 153 3.652 26.955 2.913 1.00 42.32 C ATOM 0 H LEU A 153 5.516 25.336 0.418 1.00 32.11 H new ATOM 0 HA LEU A 153 6.236 27.704 1.966 1.00 31.34 H new ATOM 0 HB2 LEU A 153 5.459 24.882 2.444 1.00 45.23 H new ATOM 0 HB3 LEU A 153 6.705 25.473 3.526 1.00 45.23 H new ATOM 0 HG LEU A 153 4.419 25.687 4.444 1.00 11.41 H new ATOM 0 HD11 LEU A 153 4.630 28.024 5.202 1.00 2.13 H new ATOM 0 HD12 LEU A 153 6.193 27.174 5.229 1.00 2.13 H new ATOM 0 HD13 LEU A 153 5.828 28.324 3.921 1.00 2.13 H new ATOM 0 HD21 LEU A 153 2.904 27.417 3.557 1.00 42.32 H new ATOM 0 HD22 LEU A 153 4.022 27.692 2.201 1.00 42.32 H new ATOM 0 HD23 LEU A 153 3.201 26.123 2.372 1.00 42.32 H new ATOM 2319 N CYS A 154 8.475 26.286 0.466 1.00 22.54 N ATOM 2320 CA CYS A 154 9.906 26.101 0.248 1.00 61.42 C ATOM 2321 C CYS A 154 10.647 27.434 0.271 1.00 64.22 C ATOM 2322 O CYS A 154 11.769 27.520 0.772 1.00 65.43 O ATOM 2323 CB CYS A 154 10.146 25.394 -1.085 1.00 71.15 C ATOM 2324 SG CYS A 154 9.489 23.714 -1.151 1.00 10.33 S ATOM 0 H CYS A 154 7.914 26.253 -0.385 1.00 22.54 H new ATOM 0 HA CYS A 154 10.293 25.485 1.059 1.00 61.42 H new ATOM 0 HB2 CYS A 154 9.694 25.982 -1.884 1.00 71.15 H new ATOM 0 HB3 CYS A 154 11.218 25.362 -1.280 1.00 71.15 H new ATOM 0 HG CYS A 154 8.255 23.714 -0.741 1.00 10.33 H new ATOM 2330 N VAL A 155 10.015 28.473 -0.273 1.00 23.04 N ATOM 2331 CA VAL A 155 10.619 29.802 -0.309 1.00 44.04 C ATOM 2332 C VAL A 155 10.502 30.502 1.046 1.00 23.14 C ATOM 2333 O VAL A 155 11.145 31.526 1.282 1.00 14.41 O ATOM 2334 CB VAL A 155 9.999 30.688 -1.411 1.00 33.00 C ATOM 2335 CG1 VAL A 155 10.537 30.291 -2.778 1.00 31.42 C ATOM 2336 CG2 VAL A 155 8.481 30.602 -1.393 1.00 51.41 C ATOM 0 H VAL A 155 9.087 28.420 -0.694 1.00 23.04 H new ATOM 0 HA VAL A 155 11.674 29.658 -0.542 1.00 44.04 H new ATOM 0 HB VAL A 155 10.281 31.722 -1.211 1.00 33.00 H new ATOM 0 HG11 VAL A 155 10.090 30.925 -3.543 1.00 31.42 H new ATOM 0 HG12 VAL A 155 11.620 30.414 -2.792 1.00 31.42 H new ATOM 0 HG13 VAL A 155 10.287 29.249 -2.979 1.00 31.42 H new ATOM 0 HG21 VAL A 155 8.071 31.236 -2.179 1.00 51.41 H new ATOM 0 HG22 VAL A 155 8.173 29.570 -1.561 1.00 51.41 H new ATOM 0 HG23 VAL A 155 8.109 30.938 -0.425 1.00 51.41 H new ATOM 2346 N GLU A 156 9.677 29.942 1.932 1.00 62.51 N ATOM 2347 CA GLU A 156 9.497 30.493 3.272 1.00 15.51 C ATOM 2348 C GLU A 156 10.591 29.979 4.202 1.00 32.42 C ATOM 2349 O GLU A 156 10.915 30.611 5.209 1.00 14.41 O ATOM 2350 CB GLU A 156 8.125 30.112 3.840 1.00 12.22 C ATOM 2351 CG GLU A 156 7.004 31.062 3.448 1.00 20.13 C ATOM 2352 CD GLU A 156 6.351 30.690 2.133 1.00 71.11 C ATOM 2353 OE1 GLU A 156 5.451 29.827 2.141 1.00 11.52 O ATOM 2354 OE2 GLU A 156 6.734 31.266 1.096 1.00 0.55 O1- ATOM 0 H GLU A 156 9.123 29.106 1.744 1.00 62.51 H new ATOM 0 HA GLU A 156 9.558 31.579 3.202 1.00 15.51 H new ATOM 0 HB2 GLU A 156 7.870 29.108 3.502 1.00 12.22 H new ATOM 0 HB3 GLU A 156 8.192 30.075 4.927 1.00 12.22 H new ATOM 0 HG2 GLU A 156 6.249 31.069 4.234 1.00 20.13 H new ATOM 0 HG3 GLU A 156 7.401 32.075 3.378 1.00 20.13 H new ATOM 2361 N SER A 157 11.154 28.824 3.847 1.00 45.42 N ATOM 2362 CA SER A 157 12.213 28.200 4.633 1.00 1.41 C ATOM 2363 C SER A 157 13.482 29.046 4.612 1.00 64.54 C ATOM 2364 O SER A 157 14.052 29.350 5.660 1.00 24.21 O ATOM 2365 CB SER A 157 12.511 26.801 4.095 1.00 1.31 C ATOM 2366 OG SER A 157 11.346 25.994 4.100 1.00 12.43 O ATOM 0 H SER A 157 10.890 28.300 3.013 1.00 45.42 H new ATOM 0 HA SER A 157 11.870 28.124 5.665 1.00 1.41 H new ATOM 0 HB2 SER A 157 12.902 26.874 3.080 1.00 1.31 H new ATOM 0 HB3 SER A 157 13.285 26.332 4.702 1.00 1.31 H new ATOM 0 HG SER A 157 10.687 26.366 3.477 1.00 12.43 H new ATOM 2372 N VAL A 158 13.917 29.428 3.414 1.00 63.31 N ATOM 2373 CA VAL A 158 15.116 30.245 3.264 1.00 40.11 C ATOM 2374 C VAL A 158 14.754 31.729 3.284 1.00 3.02 C ATOM 2375 O VAL A 158 15.052 32.474 2.349 1.00 52.11 O ATOM 2376 CB VAL A 158 15.877 29.915 1.960 1.00 34.21 C ATOM 2377 CG1 VAL A 158 17.349 30.283 2.092 1.00 14.34 C ATOM 2378 CG2 VAL A 158 15.722 28.445 1.596 1.00 34.44 C ATOM 0 H VAL A 158 13.458 29.185 2.536 1.00 63.31 H new ATOM 0 HA VAL A 158 15.771 30.016 4.105 1.00 40.11 H new ATOM 0 HB VAL A 158 15.444 30.509 1.155 1.00 34.21 H new ATOM 0 HG11 VAL A 158 17.869 30.043 1.164 1.00 14.34 H new ATOM 0 HG12 VAL A 158 17.441 31.350 2.294 1.00 14.34 H new ATOM 0 HG13 VAL A 158 17.793 29.719 2.912 1.00 14.34 H new ATOM 0 HG21 VAL A 158 16.267 28.239 0.675 1.00 34.44 H new ATOM 0 HG22 VAL A 158 16.122 27.827 2.400 1.00 34.44 H new ATOM 0 HG23 VAL A 158 14.666 28.215 1.452 1.00 34.44 H new ATOM 2388 N ASP A 159 14.095 32.143 4.364 1.00 12.13 N ATOM 2389 CA ASP A 159 13.675 33.527 4.539 1.00 21.34 C ATOM 2390 C ASP A 159 13.534 33.850 6.024 1.00 45.21 C ATOM 2391 O ASP A 159 13.790 34.975 6.455 1.00 12.42 O ATOM 2392 CB ASP A 159 12.344 33.772 3.817 1.00 61.11 C ATOM 2393 CG ASP A 159 11.954 35.238 3.787 1.00 53.33 C ATOM 2394 OD1 ASP A 159 12.487 35.976 2.933 1.00 4.41 O ATOM 2395 OD2 ASP A 159 11.113 35.646 4.616 1.00 41.43 O1- ATOM 0 H ASP A 159 13.839 31.530 5.138 1.00 12.13 H new ATOM 0 HA ASP A 159 14.433 34.180 4.108 1.00 21.34 H new ATOM 0 HB2 ASP A 159 12.416 33.399 2.795 1.00 61.11 H new ATOM 0 HB3 ASP A 159 11.557 33.201 4.311 1.00 61.11 H new ATOM 2400 N LYS A 160 13.128 32.849 6.802 1.00 11.13 N ATOM 2401 CA LYS A 160 12.951 33.015 8.241 1.00 64.02 C ATOM 2402 C LYS A 160 14.033 32.265 9.019 1.00 30.45 C ATOM 2403 O LYS A 160 13.855 31.953 10.198 1.00 60.11 O ATOM 2404 CB LYS A 160 11.563 32.523 8.664 1.00 1.33 C ATOM 2405 CG LYS A 160 10.413 33.278 8.008 1.00 4.22 C ATOM 2406 CD LYS A 160 9.819 34.330 8.937 1.00 42.21 C ATOM 2407 CE LYS A 160 10.735 35.535 9.097 1.00 13.43 C ATOM 2408 NZ LYS A 160 10.999 36.212 7.797 1.00 74.41 N1+ ATOM 0 H LYS A 160 12.915 31.913 6.458 1.00 11.13 H new ATOM 0 HA LYS A 160 13.039 34.077 8.472 1.00 64.02 H new ATOM 0 HB2 LYS A 160 11.474 31.464 8.422 1.00 1.33 H new ATOM 0 HB3 LYS A 160 11.472 32.611 9.747 1.00 1.33 H new ATOM 0 HG2 LYS A 160 10.768 33.758 7.096 1.00 4.22 H new ATOM 0 HG3 LYS A 160 9.636 32.572 7.715 1.00 4.22 H new ATOM 0 HD2 LYS A 160 8.856 34.657 8.545 1.00 42.21 H new ATOM 0 HD3 LYS A 160 9.631 33.886 9.914 1.00 42.21 H new ATOM 0 HE2 LYS A 160 10.283 36.245 9.790 1.00 13.43 H new ATOM 0 HE3 LYS A 160 11.679 35.216 9.538 1.00 13.43 H new ATOM 0 HZ1 LYS A 160 11.127 37.232 7.956 1.00 74.41 H new ATOM 0 HZ2 LYS A 160 11.861 35.818 7.369 1.00 74.41 H new ATOM 0 HZ3 LYS A 160 10.194 36.060 7.157 1.00 74.41 H new ATOM 2422 N GLU A 161 15.150 31.978 8.338 1.00 71.31 N ATOM 2423 CA GLU A 161 16.292 31.272 8.937 1.00 20.23 C ATOM 2424 C GLU A 161 15.928 29.842 9.355 1.00 72.33 C ATOM 2425 O GLU A 161 16.528 29.280 10.271 1.00 44.00 O ATOM 2426 CB GLU A 161 16.835 32.056 10.140 1.00 1.23 C ATOM 2427 CG GLU A 161 18.321 31.848 10.384 1.00 54.31 C ATOM 2428 CD GLU A 161 18.810 32.547 11.636 1.00 52.11 C ATOM 2429 OE1 GLU A 161 19.029 31.857 12.654 1.00 22.53 O ATOM 2430 OE2 GLU A 161 18.973 33.785 11.599 1.00 51.41 O1- ATOM 0 H GLU A 161 15.288 32.228 7.359 1.00 71.31 H new ATOM 0 HA GLU A 161 17.068 31.203 8.175 1.00 20.23 H new ATOM 0 HB2 GLU A 161 16.646 33.118 9.985 1.00 1.23 H new ATOM 0 HB3 GLU A 161 16.284 31.761 11.033 1.00 1.23 H new ATOM 0 HG2 GLU A 161 18.526 30.781 10.465 1.00 54.31 H new ATOM 0 HG3 GLU A 161 18.881 32.216 9.525 1.00 54.31 H new ATOM 2437 N MET A 162 14.953 29.251 8.670 1.00 44.15 N ATOM 2438 CA MET A 162 14.525 27.889 8.973 1.00 73.01 C ATOM 2439 C MET A 162 14.632 26.998 7.735 1.00 60.45 C ATOM 2440 O MET A 162 13.627 26.610 7.138 1.00 1.01 O ATOM 2441 CB MET A 162 13.094 27.886 9.527 1.00 1.23 C ATOM 2442 CG MET A 162 12.104 28.687 8.694 1.00 15.50 C ATOM 2443 SD MET A 162 10.469 28.769 9.449 1.00 71.12 S ATOM 2444 CE MET A 162 9.481 29.325 8.062 1.00 73.54 C ATOM 0 H MET A 162 14.446 29.693 7.903 1.00 44.15 H new ATOM 0 HA MET A 162 15.188 27.483 9.737 1.00 73.01 H new ATOM 0 HB2 MET A 162 12.745 26.856 9.596 1.00 1.23 H new ATOM 0 HB3 MET A 162 13.107 28.287 10.541 1.00 1.23 H new ATOM 0 HG2 MET A 162 12.487 29.698 8.554 1.00 15.50 H new ATOM 0 HG3 MET A 162 12.021 28.238 7.704 1.00 15.50 H new ATOM 0 HE1 MET A 162 8.559 29.775 8.429 1.00 73.54 H new ATOM 0 HE2 MET A 162 10.042 30.063 7.489 1.00 73.54 H new ATOM 0 HE3 MET A 162 9.241 28.476 7.423 1.00 73.54 H new ATOM 2454 N GLN A 163 15.867 26.671 7.359 1.00 24.22 N ATOM 2455 CA GLN A 163 16.123 25.836 6.186 1.00 61.45 C ATOM 2456 C GLN A 163 15.901 24.354 6.488 1.00 64.20 C ATOM 2457 O GLN A 163 16.139 23.496 5.637 1.00 74.23 O ATOM 2458 CB GLN A 163 17.549 26.062 5.675 1.00 74.13 C ATOM 2459 CG GLN A 163 17.758 27.427 5.031 1.00 15.51 C ATOM 2460 CD GLN A 163 18.380 28.442 5.974 1.00 30.44 C ATOM 2461 OE1 GLN A 163 18.212 28.369 7.191 1.00 62.41 O ATOM 2462 NE2 GLN A 163 19.102 29.403 5.411 1.00 71.13 N ATOM 0 H GLN A 163 16.708 26.972 7.851 1.00 24.22 H new ATOM 0 HA GLN A 163 15.413 26.128 5.412 1.00 61.45 H new ATOM 0 HB2 GLN A 163 18.245 25.951 6.506 1.00 74.13 H new ATOM 0 HB3 GLN A 163 17.793 25.286 4.949 1.00 74.13 H new ATOM 0 HG2 GLN A 163 18.397 27.315 4.155 1.00 15.51 H new ATOM 0 HG3 GLN A 163 16.799 27.807 4.679 1.00 15.51 H new ATOM 0 HE21 GLN A 163 19.217 29.428 4.398 1.00 71.13 H new ATOM 0 HE22 GLN A 163 19.542 30.117 5.992 1.00 71.13 H new ATOM 2471 N VAL A 164 15.446 24.060 7.701 1.00 72.04 N ATOM 2472 CA VAL A 164 15.172 22.688 8.108 1.00 23.43 C ATOM 2473 C VAL A 164 13.721 22.319 7.777 1.00 40.03 C ATOM 2474 O VAL A 164 13.350 21.144 7.764 1.00 42.33 O ATOM 2475 CB VAL A 164 15.444 22.490 9.619 1.00 13.21 C ATOM 2476 CG1 VAL A 164 14.434 23.255 10.465 1.00 10.33 C ATOM 2477 CG2 VAL A 164 15.450 21.012 9.983 1.00 5.43 C ATOM 0 H VAL A 164 15.259 24.757 8.422 1.00 72.04 H new ATOM 0 HA VAL A 164 15.842 22.029 7.555 1.00 23.43 H new ATOM 0 HB VAL A 164 16.433 22.894 9.834 1.00 13.21 H new ATOM 0 HG11 VAL A 164 14.650 23.097 11.522 1.00 10.33 H new ATOM 0 HG12 VAL A 164 14.499 24.319 10.236 1.00 10.33 H new ATOM 0 HG13 VAL A 164 13.428 22.897 10.243 1.00 10.33 H new ATOM 0 HG21 VAL A 164 15.643 20.901 11.050 1.00 5.43 H new ATOM 0 HG22 VAL A 164 14.481 20.574 9.742 1.00 5.43 H new ATOM 0 HG23 VAL A 164 16.230 20.501 9.418 1.00 5.43 H new ATOM 2487 N LEU A 165 12.915 23.342 7.488 1.00 11.00 N ATOM 2488 CA LEU A 165 11.505 23.157 7.152 1.00 54.21 C ATOM 2489 C LEU A 165 11.351 22.595 5.739 1.00 41.30 C ATOM 2490 O LEU A 165 10.448 21.802 5.474 1.00 30.23 O ATOM 2491 CB LEU A 165 10.766 24.500 7.280 1.00 22.24 C ATOM 2492 CG LEU A 165 9.230 24.436 7.341 1.00 24.21 C ATOM 2493 CD1 LEU A 165 8.625 24.427 5.944 1.00 43.24 C ATOM 2494 CD2 LEU A 165 8.764 23.222 8.135 1.00 5.12 C ATOM 0 H LEU A 165 13.220 24.315 7.480 1.00 11.00 H new ATOM 0 HA LEU A 165 11.069 22.439 7.847 1.00 54.21 H new ATOM 0 HB2 LEU A 165 11.122 25.001 8.180 1.00 22.24 H new ATOM 0 HB3 LEU A 165 11.048 25.126 6.434 1.00 22.24 H new ATOM 0 HG LEU A 165 8.882 25.332 7.855 1.00 24.21 H new ATOM 0 HD11 LEU A 165 7.538 24.381 6.018 1.00 43.24 H new ATOM 0 HD12 LEU A 165 8.915 25.336 5.416 1.00 43.24 H new ATOM 0 HD13 LEU A 165 8.988 23.558 5.396 1.00 43.24 H new ATOM 0 HD21 LEU A 165 7.675 23.201 8.162 1.00 5.12 H new ATOM 0 HD22 LEU A 165 9.132 22.313 7.660 1.00 5.12 H new ATOM 0 HD23 LEU A 165 9.151 23.282 9.152 1.00 5.12 H new ATOM 2506 N VAL A 166 12.244 23.002 4.840 1.00 1.44 N ATOM 2507 CA VAL A 166 12.204 22.543 3.454 1.00 34.13 C ATOM 2508 C VAL A 166 12.734 21.110 3.325 1.00 22.41 C ATOM 2509 O VAL A 166 12.526 20.447 2.307 1.00 71.24 O ATOM 2510 CB VAL A 166 13.006 23.492 2.531 1.00 61.42 C ATOM 2511 CG1 VAL A 166 14.507 23.334 2.740 1.00 52.35 C ATOM 2512 CG2 VAL A 166 12.636 23.270 1.072 1.00 62.24 C ATOM 0 H VAL A 166 13.005 23.649 5.047 1.00 1.44 H new ATOM 0 HA VAL A 166 11.160 22.551 3.140 1.00 34.13 H new ATOM 0 HB VAL A 166 12.741 24.515 2.798 1.00 61.42 H new ATOM 0 HG11 VAL A 166 15.040 24.015 2.076 1.00 52.35 H new ATOM 0 HG12 VAL A 166 14.757 23.566 3.775 1.00 52.35 H new ATOM 0 HG13 VAL A 166 14.799 22.308 2.518 1.00 52.35 H new ATOM 0 HG21 VAL A 166 13.213 23.948 0.443 1.00 62.24 H new ATOM 0 HG22 VAL A 166 12.858 22.240 0.793 1.00 62.24 H new ATOM 0 HG23 VAL A 166 11.572 23.463 0.933 1.00 62.24 H new ATOM 2522 N SER A 167 13.405 20.633 4.370 1.00 65.41 N ATOM 2523 CA SER A 167 13.960 19.285 4.372 1.00 54.41 C ATOM 2524 C SER A 167 12.952 18.276 4.918 1.00 30.23 C ATOM 2525 O SER A 167 12.944 17.112 4.514 1.00 51.44 O ATOM 2526 CB SER A 167 15.242 19.245 5.204 1.00 60.24 C ATOM 2527 OG SER A 167 15.856 17.970 5.139 1.00 60.50 O ATOM 0 H SER A 167 13.577 21.161 5.226 1.00 65.41 H new ATOM 0 HA SER A 167 14.191 19.013 3.342 1.00 54.41 H new ATOM 0 HB2 SER A 167 15.936 20.004 4.844 1.00 60.24 H new ATOM 0 HB3 SER A 167 15.013 19.489 6.241 1.00 60.24 H new ATOM 0 HG SER A 167 16.674 17.973 5.679 1.00 60.50 H new ATOM 2533 N ARG A 168 12.099 18.728 5.834 1.00 53.43 N ATOM 2534 CA ARG A 168 11.092 17.859 6.435 1.00 2.12 C ATOM 2535 C ARG A 168 9.762 17.939 5.686 1.00 54.24 C ATOM 2536 O ARG A 168 8.868 17.125 5.916 1.00 40.52 O ATOM 2537 CB ARG A 168 10.889 18.216 7.910 1.00 74.33 C ATOM 2538 CG ARG A 168 10.473 19.659 8.141 1.00 13.34 C ATOM 2539 CD ARG A 168 10.392 19.988 9.623 1.00 12.20 C ATOM 2540 NE ARG A 168 9.255 19.336 10.269 1.00 40.14 N ATOM 2541 CZ ARG A 168 9.218 19.024 11.562 1.00 63.01 C ATOM 2542 NH1 ARG A 168 10.251 19.299 12.346 1.00 32.13 N1+ ATOM 2543 NH2 ARG A 168 8.143 18.438 12.072 1.00 4.11 N ATOM 0 H ARG A 168 12.085 19.689 6.175 1.00 53.43 H new ATOM 0 HA ARG A 168 11.456 16.834 6.363 1.00 2.12 H new ATOM 0 HB2 ARG A 168 10.130 17.557 8.332 1.00 74.33 H new ATOM 0 HB3 ARG A 168 11.815 18.024 8.451 1.00 74.33 H new ATOM 0 HG2 ARG A 168 11.187 20.326 7.658 1.00 13.34 H new ATOM 0 HG3 ARG A 168 9.504 19.838 7.675 1.00 13.34 H new ATOM 0 HD2 ARG A 168 11.314 19.678 10.114 1.00 12.20 H new ATOM 0 HD3 ARG A 168 10.311 21.067 9.750 1.00 12.20 H new ATOM 0 HE ARG A 168 8.443 19.107 9.696 1.00 40.14 H new ATOM 0 HH11 ARG A 168 11.079 19.752 11.959 1.00 32.13 H new ATOM 0 HH12 ARG A 168 10.218 19.058 13.337 1.00 32.13 H new ATOM 0 HH21 ARG A 168 7.345 18.227 11.473 1.00 4.11 H new ATOM 0 HH22 ARG A 168 8.114 18.199 13.063 1.00 4.11 H new ATOM 2557 N ILE A 169 9.639 18.915 4.784 1.00 23.34 N ATOM 2558 CA ILE A 169 8.412 19.087 4.009 1.00 34.51 C ATOM 2559 C ILE A 169 8.352 18.088 2.850 1.00 22.24 C ATOM 2560 O ILE A 169 7.287 17.839 2.284 1.00 44.21 O ATOM 2561 CB ILE A 169 8.271 20.535 3.477 1.00 35.12 C ATOM 2562 CG1 ILE A 169 6.810 20.835 3.130 1.00 13.21 C ATOM 2563 CG2 ILE A 169 9.167 20.765 2.264 1.00 24.50 C ATOM 2564 CD1 ILE A 169 6.522 22.308 2.944 1.00 21.34 C ATOM 0 H ILE A 169 10.371 19.594 4.574 1.00 23.34 H new ATOM 0 HA ILE A 169 7.576 18.893 4.681 1.00 34.51 H new ATOM 0 HB ILE A 169 8.591 21.218 4.264 1.00 35.12 H new ATOM 0 HG12 ILE A 169 6.546 20.303 2.216 1.00 13.21 H new ATOM 0 HG13 ILE A 169 6.170 20.445 3.922 1.00 13.21 H new ATOM 0 HG21 ILE A 169 9.047 21.790 1.912 1.00 24.50 H new ATOM 0 HG22 ILE A 169 10.207 20.596 2.543 1.00 24.50 H new ATOM 0 HG23 ILE A 169 8.888 20.073 1.469 1.00 24.50 H new ATOM 0 HD11 ILE A 169 5.468 22.445 2.700 1.00 21.34 H new ATOM 0 HD12 ILE A 169 6.754 22.843 3.865 1.00 21.34 H new ATOM 0 HD13 ILE A 169 7.136 22.699 2.133 1.00 21.34 H new ATOM 2576 N ALA A 170 9.502 17.512 2.511 1.00 32.15 N ATOM 2577 CA ALA A 170 9.583 16.532 1.435 1.00 73.20 C ATOM 2578 C ALA A 170 9.564 15.113 1.997 1.00 4.01 C ATOM 2579 O ALA A 170 9.664 14.136 1.252 1.00 62.31 O ATOM 2580 CB ALA A 170 10.840 16.762 0.608 1.00 14.01 C ATOM 0 H ALA A 170 10.392 17.709 2.968 1.00 32.15 H new ATOM 0 HA ALA A 170 8.714 16.654 0.789 1.00 73.20 H new ATOM 0 HB1 ALA A 170 10.889 16.024 -0.192 1.00 14.01 H new ATOM 0 HB2 ALA A 170 10.814 17.763 0.177 1.00 14.01 H new ATOM 0 HB3 ALA A 170 11.718 16.664 1.246 1.00 14.01 H new ATOM 2586 N ALA A 171 9.427 15.011 3.318 1.00 0.42 N ATOM 2587 CA ALA A 171 9.400 13.719 3.993 1.00 51.34 C ATOM 2588 C ALA A 171 7.975 13.192 4.140 1.00 22.10 C ATOM 2589 O ALA A 171 7.720 12.011 3.906 1.00 62.35 O ATOM 2590 CB ALA A 171 10.070 13.825 5.355 1.00 4.32 C ATOM 0 H ALA A 171 9.333 15.812 3.942 1.00 0.42 H new ATOM 0 HA ALA A 171 9.952 13.008 3.378 1.00 51.34 H new ATOM 0 HB1 ALA A 171 10.044 12.854 5.850 1.00 4.32 H new ATOM 0 HB2 ALA A 171 11.106 14.140 5.227 1.00 4.32 H new ATOM 0 HB3 ALA A 171 9.541 14.557 5.965 1.00 4.32 H new ATOM 2596 N TRP A 172 7.046 14.069 4.522 1.00 33.33 N ATOM 2597 CA TRP A 172 5.650 13.670 4.697 1.00 74.00 C ATOM 2598 C TRP A 172 4.873 13.739 3.382 1.00 12.01 C ATOM 2599 O TRP A 172 3.661 13.523 3.355 1.00 42.00 O ATOM 2600 CB TRP A 172 4.963 14.524 5.771 1.00 34.11 C ATOM 2601 CG TRP A 172 5.183 16.002 5.634 1.00 62.31 C ATOM 2602 CD1 TRP A 172 4.921 16.777 4.542 1.00 71.03 C ATOM 2603 CD2 TRP A 172 5.693 16.886 6.639 1.00 55.35 C ATOM 2604 NE1 TRP A 172 5.246 18.085 4.802 1.00 0.01 N ATOM 2605 CE2 TRP A 172 5.720 18.178 6.083 1.00 53.41 C ATOM 2606 CE3 TRP A 172 6.132 16.711 7.954 1.00 72.15 C ATOM 2607 CZ2 TRP A 172 6.168 19.287 6.795 1.00 74.34 C ATOM 2608 CZ3 TRP A 172 6.576 17.812 8.660 1.00 52.31 C ATOM 2609 CH2 TRP A 172 6.591 19.086 8.080 1.00 5.14 C ATOM 0 H TRP A 172 7.233 15.053 4.715 1.00 33.33 H new ATOM 0 HA TRP A 172 5.652 12.632 5.029 1.00 74.00 H new ATOM 0 HB2 TRP A 172 3.892 14.326 5.742 1.00 34.11 H new ATOM 0 HB3 TRP A 172 5.320 14.207 6.751 1.00 34.11 H new ATOM 0 HD1 TRP A 172 4.517 16.414 3.609 1.00 71.03 H new ATOM 0 HE1 TRP A 172 5.150 18.861 4.147 1.00 0.01 H new ATOM 0 HE3 TRP A 172 6.124 15.732 8.410 1.00 72.15 H new ATOM 0 HZ2 TRP A 172 6.181 20.270 6.349 1.00 74.34 H new ATOM 0 HZ3 TRP A 172 6.917 17.688 9.677 1.00 52.31 H new ATOM 0 HH2 TRP A 172 6.944 19.927 8.659 1.00 5.14 H new ATOM 2620 N MET A 173 5.573 14.047 2.296 1.00 11.14 N ATOM 2621 CA MET A 173 4.950 14.119 0.980 1.00 24.41 C ATOM 2622 C MET A 173 5.184 12.822 0.214 1.00 12.32 C ATOM 2623 O MET A 173 4.733 12.666 -0.922 1.00 15.53 O ATOM 2624 CB MET A 173 5.502 15.304 0.187 1.00 55.20 C ATOM 2625 CG MET A 173 4.773 16.610 0.458 1.00 44.41 C ATOM 2626 SD MET A 173 3.026 16.530 0.020 1.00 75.35 S ATOM 2627 CE MET A 173 2.489 18.180 0.460 1.00 63.34 C ATOM 0 H MET A 173 6.572 14.251 2.301 1.00 11.14 H new ATOM 0 HA MET A 173 3.878 14.262 1.115 1.00 24.41 H new ATOM 0 HB2 MET A 173 6.558 15.430 0.426 1.00 55.20 H new ATOM 0 HB3 MET A 173 5.441 15.078 -0.878 1.00 55.20 H new ATOM 0 HG2 MET A 173 4.868 16.863 1.514 1.00 44.41 H new ATOM 0 HG3 MET A 173 5.249 17.412 -0.106 1.00 44.41 H new ATOM 0 HE1 MET A 173 1.421 18.170 0.676 1.00 63.34 H new ATOM 0 HE2 MET A 173 3.034 18.517 1.342 1.00 63.34 H new ATOM 0 HE3 MET A 173 2.685 18.860 -0.369 1.00 63.34 H new ATOM 2637 N ALA A 174 5.893 11.893 0.852 1.00 44.34 N ATOM 2638 CA ALA A 174 6.197 10.603 0.250 1.00 53.00 C ATOM 2639 C ALA A 174 5.866 9.460 1.205 1.00 24.42 C ATOM 2640 O ALA A 174 5.252 8.473 0.808 1.00 44.33 O ATOM 2641 CB ALA A 174 7.660 10.545 -0.157 1.00 53.31 C ATOM 0 H ALA A 174 6.269 12.014 1.793 1.00 44.34 H new ATOM 0 HA ALA A 174 5.578 10.489 -0.640 1.00 53.00 H new ATOM 0 HB1 ALA A 174 7.875 9.575 -0.606 1.00 53.31 H new ATOM 0 HB2 ALA A 174 7.868 11.334 -0.880 1.00 53.31 H new ATOM 0 HB3 ALA A 174 8.288 10.685 0.723 1.00 53.31 H new ATOM 2647 N THR A 175 6.276 9.607 2.466 1.00 55.35 N ATOM 2648 CA THR A 175 6.028 8.589 3.487 1.00 0.41 C ATOM 2649 C THR A 175 4.541 8.505 3.829 1.00 52.20 C ATOM 2650 O THR A 175 4.000 7.417 4.031 1.00 40.55 O ATOM 2651 CB THR A 175 6.831 8.881 4.772 1.00 63.53 C ATOM 2652 OG1 THR A 175 8.207 9.108 4.446 1.00 0.43 O ATOM 2653 CG2 THR A 175 6.731 7.726 5.758 1.00 41.12 C ATOM 0 H THR A 175 6.783 10.425 2.805 1.00 55.35 H new ATOM 0 HA THR A 175 6.354 7.634 3.074 1.00 0.41 H new ATOM 0 HB THR A 175 6.408 9.772 5.237 1.00 63.53 H new ATOM 0 HG1 THR A 175 8.339 10.054 4.227 1.00 0.43 H new ATOM 0 HG21 THR A 175 7.307 7.961 6.653 1.00 41.12 H new ATOM 0 HG22 THR A 175 5.687 7.568 6.029 1.00 41.12 H new ATOM 0 HG23 THR A 175 7.127 6.820 5.299 1.00 41.12 H new ATOM 2661 N TYR A 176 3.887 9.662 3.887 1.00 35.14 N ATOM 2662 CA TYR A 176 2.461 9.729 4.190 1.00 72.13 C ATOM 2663 C TYR A 176 1.638 9.370 2.951 1.00 73.55 C ATOM 2664 O TYR A 176 0.469 8.993 3.052 1.00 41.31 O ATOM 2665 CB TYR A 176 2.100 11.135 4.686 1.00 14.44 C ATOM 2666 CG TYR A 176 0.636 11.326 5.017 1.00 65.24 C ATOM 2667 CD1 TYR A 176 0.052 10.658 6.085 1.00 23.40 C ATOM 2668 CD2 TYR A 176 -0.159 12.182 4.264 1.00 52.23 C ATOM 2669 CE1 TYR A 176 -1.283 10.835 6.392 1.00 75.44 C ATOM 2670 CE2 TYR A 176 -1.495 12.364 4.565 1.00 31.02 C ATOM 2671 CZ TYR A 176 -2.052 11.688 5.630 1.00 13.10 C ATOM 2672 OH TYR A 176 -3.381 11.868 5.935 1.00 40.41 O ATOM 0 H TYR A 176 4.325 10.569 3.727 1.00 35.14 H new ATOM 0 HA TYR A 176 2.230 9.009 4.975 1.00 72.13 H new ATOM 0 HB2 TYR A 176 2.692 11.357 5.574 1.00 14.44 H new ATOM 0 HB3 TYR A 176 2.385 11.860 3.924 1.00 14.44 H new ATOM 0 HD1 TYR A 176 0.651 9.989 6.685 1.00 23.40 H new ATOM 0 HD2 TYR A 176 0.275 12.714 3.430 1.00 52.23 H new ATOM 0 HE1 TYR A 176 -1.722 10.307 7.226 1.00 75.44 H new ATOM 0 HE2 TYR A 176 -2.100 13.032 3.970 1.00 31.02 H new ATOM 0 HH TYR A 176 -3.779 12.501 5.302 1.00 40.41 H new ATOM 2682 N LEU A 177 2.271 9.476 1.785 1.00 5.13 N ATOM 2683 CA LEU A 177 1.617 9.169 0.519 1.00 35.34 C ATOM 2684 C LEU A 177 1.453 7.660 0.332 1.00 63.42 C ATOM 2685 O LEU A 177 0.363 7.184 0.017 1.00 33.43 O ATOM 2686 CB LEU A 177 2.422 9.762 -0.642 1.00 70.13 C ATOM 2687 CG LEU A 177 1.823 9.550 -2.035 1.00 13.23 C ATOM 2688 CD1 LEU A 177 0.531 10.338 -2.192 1.00 2.41 C ATOM 2689 CD2 LEU A 177 2.825 9.947 -3.109 1.00 41.03 C ATOM 0 H LEU A 177 3.242 9.774 1.693 1.00 5.13 H new ATOM 0 HA LEU A 177 0.623 9.615 0.532 1.00 35.34 H new ATOM 0 HB2 LEU A 177 2.535 10.833 -0.473 1.00 70.13 H new ATOM 0 HB3 LEU A 177 3.422 9.329 -0.626 1.00 70.13 H new ATOM 0 HG LEU A 177 1.591 8.491 -2.151 1.00 13.23 H new ATOM 0 HD11 LEU A 177 0.123 10.173 -3.189 1.00 2.41 H new ATOM 0 HD12 LEU A 177 -0.190 10.007 -1.445 1.00 2.41 H new ATOM 0 HD13 LEU A 177 0.734 11.400 -2.054 1.00 2.41 H new ATOM 0 HD21 LEU A 177 2.384 9.790 -4.094 1.00 41.03 H new ATOM 0 HD22 LEU A 177 3.087 10.999 -2.992 1.00 41.03 H new ATOM 0 HD23 LEU A 177 3.723 9.337 -3.012 1.00 41.03 H new ATOM 2701 N ASN A 178 2.534 6.908 0.544 1.00 13.43 N ATOM 2702 CA ASN A 178 2.502 5.453 0.382 1.00 60.41 C ATOM 2703 C ASN A 178 2.009 4.744 1.645 1.00 24.14 C ATOM 2704 O ASN A 178 2.052 3.516 1.729 1.00 73.02 O ATOM 2705 CB ASN A 178 3.887 4.925 -0.016 1.00 2.51 C ATOM 2706 CG ASN A 178 4.993 5.351 0.936 1.00 24.32 C ATOM 2707 OD1 ASN A 178 4.824 5.359 2.155 1.00 42.42 O ATOM 2708 ND2 ASN A 178 6.138 5.717 0.377 1.00 0.14 N ATOM 0 H ASN A 178 3.440 7.281 0.827 1.00 13.43 H new ATOM 0 HA ASN A 178 1.792 5.234 -0.416 1.00 60.41 H new ATOM 0 HB2 ASN A 178 3.854 3.836 -0.059 1.00 2.51 H new ATOM 0 HB3 ASN A 178 4.127 5.276 -1.020 1.00 2.51 H new ATOM 0 HD21 ASN A 178 6.917 6.019 0.962 1.00 0.14 H new ATOM 0 HD22 ASN A 178 6.240 5.697 -0.638 1.00 0.14 H new ATOM 2715 N ASP A 179 1.544 5.517 2.621 1.00 25.03 N ATOM 2716 CA ASP A 179 1.044 4.949 3.867 1.00 73.14 C ATOM 2717 C ASP A 179 -0.393 4.466 3.692 1.00 61.13 C ATOM 2718 O ASP A 179 -0.701 3.299 3.941 1.00 73.23 O ATOM 2719 CB ASP A 179 1.120 5.984 4.992 1.00 71.40 C ATOM 2720 CG ASP A 179 1.233 5.342 6.361 1.00 53.21 C ATOM 2721 OD1 ASP A 179 2.374 5.147 6.831 1.00 52.15 O ATOM 2722 OD2 ASP A 179 0.183 5.034 6.963 1.00 32.10 O1- ATOM 0 H ASP A 179 1.503 6.535 2.573 1.00 25.03 H new ATOM 0 HA ASP A 179 1.669 4.096 4.134 1.00 73.14 H new ATOM 0 HB2 ASP A 179 1.979 6.634 4.827 1.00 71.40 H new ATOM 0 HB3 ASP A 179 0.232 6.615 4.962 1.00 71.40 H new ATOM 2727 N HIS A 180 -1.265 5.373 3.255 1.00 63.24 N ATOM 2728 CA HIS A 180 -2.674 5.056 3.031 1.00 62.21 C ATOM 2729 C HIS A 180 -3.321 6.097 2.120 1.00 61.34 C ATOM 2730 O HIS A 180 -4.543 6.131 1.967 1.00 34.15 O ATOM 2731 CB HIS A 180 -3.434 4.973 4.365 1.00 1.12 C ATOM 2732 CG HIS A 180 -3.343 6.212 5.210 1.00 33.40 C ATOM 2733 ND1 HIS A 180 -2.406 6.372 6.208 1.00 4.30 N ATOM 2734 CD2 HIS A 180 -4.082 7.348 5.206 1.00 52.43 C ATOM 2735 CE1 HIS A 180 -2.571 7.550 6.781 1.00 11.21 C ATOM 2736 NE2 HIS A 180 -3.581 8.162 6.192 1.00 50.12 N ATOM 0 H HIS A 180 -1.017 6.341 3.048 1.00 63.24 H new ATOM 0 HA HIS A 180 -2.727 4.083 2.542 1.00 62.21 H new ATOM 0 HB2 HIS A 180 -4.484 4.765 4.159 1.00 1.12 H new ATOM 0 HB3 HIS A 180 -3.048 4.129 4.937 1.00 1.12 H new ATOM 0 HD1 HIS A 180 -1.695 5.687 6.464 1.00 4.30 H new ATOM 0 HD2 HIS A 180 -4.910 7.571 4.550 1.00 52.43 H new ATOM 0 HE1 HIS A 180 -1.980 7.946 7.594 1.00 11.21 H new ATOM 2745 N LEU A 181 -2.490 6.939 1.510 1.00 53.34 N ATOM 2746 CA LEU A 181 -2.979 7.991 0.626 1.00 23.13 C ATOM 2747 C LEU A 181 -2.820 7.609 -0.848 1.00 50.43 C ATOM 2748 O LEU A 181 -2.870 8.469 -1.729 1.00 72.33 O ATOM 2749 CB LEU A 181 -2.238 9.299 0.916 1.00 73.23 C ATOM 2750 CG LEU A 181 -3.079 10.570 0.777 1.00 43.11 C ATOM 2751 CD1 LEU A 181 -4.120 10.650 1.885 1.00 20.25 C ATOM 2752 CD2 LEU A 181 -2.186 11.800 0.793 1.00 55.23 C ATOM 0 H LEU A 181 -1.476 6.912 1.612 1.00 53.34 H new ATOM 0 HA LEU A 181 -4.043 8.125 0.819 1.00 23.13 H new ATOM 0 HB2 LEU A 181 -1.840 9.255 1.930 1.00 73.23 H new ATOM 0 HB3 LEU A 181 -1.385 9.372 0.241 1.00 73.23 H new ATOM 0 HG LEU A 181 -3.602 10.534 -0.179 1.00 43.11 H new ATOM 0 HD11 LEU A 181 -4.707 11.561 1.768 1.00 20.25 H new ATOM 0 HD12 LEU A 181 -4.779 9.784 1.828 1.00 20.25 H new ATOM 0 HD13 LEU A 181 -3.620 10.663 2.854 1.00 20.25 H new ATOM 0 HD21 LEU A 181 -2.799 12.696 0.693 1.00 55.23 H new ATOM 0 HD22 LEU A 181 -1.637 11.839 1.734 1.00 55.23 H new ATOM 0 HD23 LEU A 181 -1.481 11.749 -0.037 1.00 55.23 H new ATOM 2764 N GLU A 182 -2.633 6.316 -1.114 1.00 1.44 N ATOM 2765 CA GLU A 182 -2.485 5.830 -2.486 1.00 24.31 C ATOM 2766 C GLU A 182 -3.503 4.729 -2.793 1.00 4.44 C ATOM 2767 O GLU A 182 -3.150 3.551 -2.871 1.00 11.01 O ATOM 2768 CB GLU A 182 -1.064 5.309 -2.729 1.00 71.32 C ATOM 2769 CG GLU A 182 -0.048 6.404 -3.011 1.00 74.35 C ATOM 2770 CD GLU A 182 1.293 5.862 -3.464 1.00 10.35 C ATOM 2771 OE1 GLU A 182 2.287 6.047 -2.732 1.00 32.40 O ATOM 2772 OE2 GLU A 182 1.351 5.253 -4.552 1.00 75.54 O1- ATOM 0 H GLU A 182 -2.581 5.589 -0.401 1.00 1.44 H new ATOM 0 HA GLU A 182 -2.671 6.670 -3.155 1.00 24.31 H new ATOM 0 HB2 GLU A 182 -0.741 4.743 -1.856 1.00 71.32 H new ATOM 0 HB3 GLU A 182 -1.080 4.616 -3.570 1.00 71.32 H new ATOM 0 HG2 GLU A 182 -0.443 7.070 -3.778 1.00 74.35 H new ATOM 0 HG3 GLU A 182 0.093 7.002 -2.111 1.00 74.35 H new ATOM 2779 N PRO A 183 -4.789 5.099 -2.961 1.00 53.10 N ATOM 2780 CA PRO A 183 -5.859 4.150 -3.264 1.00 20.14 C ATOM 2781 C PRO A 183 -5.977 3.864 -4.760 1.00 34.23 C ATOM 2782 O PRO A 183 -5.970 2.709 -5.184 1.00 5.13 O ATOM 2783 CB PRO A 183 -7.124 4.864 -2.757 1.00 72.12 C ATOM 2784 CG PRO A 183 -6.701 6.233 -2.312 1.00 61.43 C ATOM 2785 CD PRO A 183 -5.316 6.461 -2.850 1.00 53.45 C ATOM 0 HA PRO A 183 -5.683 3.179 -2.800 1.00 20.14 H new ATOM 0 HB2 PRO A 183 -7.874 4.928 -3.546 1.00 72.12 H new ATOM 0 HB3 PRO A 183 -7.575 4.312 -1.933 1.00 72.12 H new ATOM 0 HG2 PRO A 183 -7.390 6.990 -2.686 1.00 61.43 H new ATOM 0 HG3 PRO A 183 -6.709 6.305 -1.224 1.00 61.43 H new ATOM 0 HD2 PRO A 183 -5.334 6.969 -3.814 1.00 53.45 H new ATOM 0 HD3 PRO A 183 -4.716 7.075 -2.178 1.00 53.45 H new ATOM 2793 N TRP A 184 -6.086 4.929 -5.550 1.00 1.53 N ATOM 2794 CA TRP A 184 -6.211 4.818 -6.999 1.00 33.41 C ATOM 2795 C TRP A 184 -4.841 4.839 -7.676 1.00 11.53 C ATOM 2796 O TRP A 184 -4.714 4.487 -8.849 1.00 40.15 O ATOM 2797 CB TRP A 184 -7.078 5.962 -7.540 1.00 72.21 C ATOM 2798 CG TRP A 184 -6.672 7.316 -7.028 1.00 2.40 C ATOM 2799 CD1 TRP A 184 -7.098 7.919 -5.879 1.00 43.23 C ATOM 2800 CD2 TRP A 184 -5.761 8.233 -7.647 1.00 32.22 C ATOM 2801 NE1 TRP A 184 -6.503 9.149 -5.742 1.00 51.34 N ATOM 2802 CE2 TRP A 184 -5.679 9.365 -6.815 1.00 11.02 C ATOM 2803 CE3 TRP A 184 -5.003 8.205 -8.821 1.00 24.34 C ATOM 2804 CZ2 TRP A 184 -4.872 10.457 -7.121 1.00 5.52 C ATOM 2805 CZ3 TRP A 184 -4.204 9.290 -9.123 1.00 1.45 C ATOM 2806 CH2 TRP A 184 -4.142 10.401 -8.276 1.00 64.43 C ATOM 0 H TRP A 184 -6.090 5.889 -5.205 1.00 1.53 H new ATOM 0 HA TRP A 184 -6.687 3.864 -7.225 1.00 33.41 H new ATOM 0 HB2 TRP A 184 -7.026 5.963 -8.629 1.00 72.21 H new ATOM 0 HB3 TRP A 184 -8.118 5.778 -7.271 1.00 72.21 H new ATOM 0 HD1 TRP A 184 -7.801 7.491 -5.180 1.00 43.23 H new ATOM 0 HE1 TRP A 184 -6.650 9.796 -4.968 1.00 51.34 H new ATOM 0 HE3 TRP A 184 -5.042 7.350 -9.480 1.00 24.34 H new ATOM 0 HZ2 TRP A 184 -4.824 11.317 -6.470 1.00 5.52 H new ATOM 0 HZ3 TRP A 184 -3.617 9.280 -10.029 1.00 1.45 H new ATOM 0 HH2 TRP A 184 -3.504 11.232 -8.539 1.00 64.43 H new ATOM 2817 N ILE A 185 -3.821 5.257 -6.928 1.00 2.34 N ATOM 2818 CA ILE A 185 -2.463 5.333 -7.455 1.00 1.34 C ATOM 2819 C ILE A 185 -1.819 3.950 -7.526 1.00 24.15 C ATOM 2820 O ILE A 185 -1.349 3.535 -8.584 1.00 41.21 O ATOM 2821 CB ILE A 185 -1.580 6.269 -6.603 1.00 10.52 C ATOM 2822 CG1 ILE A 185 -2.252 7.637 -6.454 1.00 70.51 C ATOM 2823 CG2 ILE A 185 -0.202 6.419 -7.235 1.00 44.33 C ATOM 2824 CD1 ILE A 185 -1.563 8.556 -5.470 1.00 3.13 C ATOM 0 H ILE A 185 -3.911 5.548 -5.955 1.00 2.34 H new ATOM 0 HA ILE A 185 -2.536 5.741 -8.463 1.00 1.34 H new ATOM 0 HB ILE A 185 -1.459 5.830 -5.613 1.00 10.52 H new ATOM 0 HG12 ILE A 185 -2.283 8.123 -7.429 1.00 70.51 H new ATOM 0 HG13 ILE A 185 -3.285 7.491 -6.137 1.00 70.51 H new ATOM 0 HG21 ILE A 185 0.409 7.082 -6.622 1.00 44.33 H new ATOM 0 HG22 ILE A 185 0.277 5.442 -7.300 1.00 44.33 H new ATOM 0 HG23 ILE A 185 -0.304 6.841 -8.235 1.00 44.33 H new ATOM 0 HD11 ILE A 185 -2.099 9.504 -5.421 1.00 3.13 H new ATOM 0 HD12 ILE A 185 -1.555 8.092 -4.484 1.00 3.13 H new ATOM 0 HD13 ILE A 185 -0.538 8.735 -5.795 1.00 3.13 H new ATOM 2836 N GLN A 186 -1.812 3.239 -6.398 1.00 53.43 N ATOM 2837 CA GLN A 186 -1.226 1.899 -6.335 1.00 34.11 C ATOM 2838 C GLN A 186 -2.090 0.876 -7.071 1.00 73.11 C ATOM 2839 O GLN A 186 -1.607 -0.189 -7.457 1.00 14.34 O ATOM 2840 CB GLN A 186 -1.037 1.465 -4.879 1.00 1.23 C ATOM 2841 CG GLN A 186 0.186 2.074 -4.212 1.00 30.32 C ATOM 2842 CD GLN A 186 1.491 1.533 -4.767 1.00 25.25 C ATOM 2843 OE1 GLN A 186 1.566 0.386 -5.208 1.00 13.33 O ATOM 2844 NE2 GLN A 186 2.531 2.359 -4.746 1.00 63.31 N ATOM 0 H GLN A 186 -2.205 3.568 -5.516 1.00 53.43 H new ATOM 0 HA GLN A 186 -0.254 1.942 -6.827 1.00 34.11 H new ATOM 0 HB2 GLN A 186 -1.925 1.740 -4.309 1.00 1.23 H new ATOM 0 HB3 GLN A 186 -0.957 0.379 -4.841 1.00 1.23 H new ATOM 0 HG2 GLN A 186 0.163 3.156 -4.341 1.00 30.32 H new ATOM 0 HG3 GLN A 186 0.144 1.879 -3.140 1.00 30.32 H new ATOM 0 HE21 GLN A 186 2.426 3.302 -4.372 1.00 63.31 H new ATOM 0 HE22 GLN A 186 3.435 2.050 -5.104 1.00 63.31 H new ATOM 2853 N GLU A 187 -3.365 1.207 -7.263 1.00 43.33 N ATOM 2854 CA GLU A 187 -4.296 0.320 -7.957 1.00 30.12 C ATOM 2855 C GLU A 187 -4.034 0.327 -9.462 1.00 61.14 C ATOM 2856 O GLU A 187 -4.242 -0.678 -10.143 1.00 33.41 O ATOM 2857 CB GLU A 187 -5.738 0.749 -7.677 1.00 71.25 C ATOM 2858 CG GLU A 187 -6.780 -0.258 -8.139 1.00 62.51 C ATOM 2859 CD GLU A 187 -8.199 0.223 -7.906 1.00 70.11 C ATOM 2860 OE1 GLU A 187 -8.768 0.859 -8.819 1.00 35.40 O ATOM 2861 OE2 GLU A 187 -8.742 -0.036 -6.810 1.00 42.34 O1- ATOM 0 H GLU A 187 -3.778 2.085 -6.947 1.00 43.33 H new ATOM 0 HA GLU A 187 -4.144 -0.693 -7.585 1.00 30.12 H new ATOM 0 HB2 GLU A 187 -5.856 0.914 -6.606 1.00 71.25 H new ATOM 0 HB3 GLU A 187 -5.925 1.703 -8.170 1.00 71.25 H new ATOM 0 HG2 GLU A 187 -6.639 -0.460 -9.201 1.00 62.51 H new ATOM 0 HG3 GLU A 187 -6.628 -1.200 -7.612 1.00 62.51 H new ATOM 2868 N ASN A 188 -3.571 1.466 -9.971 1.00 64.33 N ATOM 2869 CA ASN A 188 -3.280 1.610 -11.393 1.00 0.22 C ATOM 2870 C ASN A 188 -1.891 1.062 -11.725 1.00 20.40 C ATOM 2871 O ASN A 188 -1.645 0.612 -12.845 1.00 51.34 O ATOM 2872 CB ASN A 188 -3.382 3.081 -11.802 1.00 45.15 C ATOM 2873 CG ASN A 188 -3.924 3.257 -13.207 1.00 2.31 C ATOM 2874 OD1 ASN A 188 -5.137 3.304 -13.415 1.00 43.24 O ATOM 2875 ND2 ASN A 188 -3.028 3.362 -14.181 1.00 12.32 N ATOM 0 H ASN A 188 -3.389 2.304 -9.418 1.00 64.33 H new ATOM 0 HA ASN A 188 -4.015 1.033 -11.954 1.00 0.22 H new ATOM 0 HB2 ASN A 188 -4.028 3.606 -11.098 1.00 45.15 H new ATOM 0 HB3 ASN A 188 -2.397 3.542 -11.736 1.00 45.15 H new ATOM 0 HD21 ASN A 188 -3.335 3.487 -15.146 1.00 12.32 H new ATOM 0 HD22 ASN A 188 -2.032 3.318 -13.965 1.00 12.32 H new ATOM 2882 N GLY A 189 -0.988 1.101 -10.746 1.00 64.31 N ATOM 2883 CA GLY A 189 0.360 0.601 -10.956 1.00 21.13 C ATOM 2884 C GLY A 189 1.426 1.546 -10.434 1.00 55.40 C ATOM 2885 O GLY A 189 2.504 1.656 -11.019 1.00 3.12 O ATOM 0 H GLY A 189 -1.167 1.470 -9.812 1.00 64.31 H new ATOM 0 HA2 GLY A 189 0.465 -0.366 -10.463 1.00 21.13 H new ATOM 0 HA3 GLY A 189 0.519 0.434 -12.021 1.00 21.13 H new ATOM 2889 N GLY A 190 1.124 2.225 -9.329 1.00 71.53 N ATOM 2890 CA GLY A 190 2.069 3.159 -8.742 1.00 43.35 C ATOM 2891 C GLY A 190 2.189 4.445 -9.537 1.00 55.20 C ATOM 2892 O GLY A 190 1.190 4.983 -10.015 1.00 70.51 O ATOM 0 H GLY A 190 0.239 2.144 -8.829 1.00 71.53 H new ATOM 0 HA2 GLY A 190 1.758 3.393 -7.724 1.00 43.35 H new ATOM 0 HA3 GLY A 190 3.048 2.685 -8.675 1.00 43.35 H new ATOM 2896 N TRP A 191 3.416 4.935 -9.679 1.00 31.40 N ATOM 2897 CA TRP A 191 3.668 6.164 -10.423 1.00 3.01 C ATOM 2898 C TRP A 191 4.366 5.874 -11.748 1.00 65.13 C ATOM 2899 O TRP A 191 4.561 6.774 -12.566 1.00 43.01 O ATOM 2900 CB TRP A 191 4.508 7.131 -9.586 1.00 35.44 C ATOM 2901 CG TRP A 191 3.704 7.891 -8.575 1.00 11.12 C ATOM 2902 CD1 TRP A 191 3.436 7.517 -7.290 1.00 63.50 C ATOM 2903 CD2 TRP A 191 3.060 9.155 -8.769 1.00 32.32 C ATOM 2904 NE1 TRP A 191 2.667 8.472 -6.672 1.00 10.42 N ATOM 2905 CE2 TRP A 191 2.422 9.488 -7.559 1.00 53.30 C ATOM 2906 CE3 TRP A 191 2.961 10.039 -9.848 1.00 23.32 C ATOM 2907 CZ2 TRP A 191 1.697 10.666 -7.400 1.00 22.20 C ATOM 2908 CZ3 TRP A 191 2.241 11.208 -9.688 1.00 32.41 C ATOM 2909 CH2 TRP A 191 1.618 11.512 -8.472 1.00 4.25 C ATOM 0 H TRP A 191 4.252 4.500 -9.289 1.00 31.40 H new ATOM 0 HA TRP A 191 2.705 6.627 -10.641 1.00 3.01 H new ATOM 0 HB2 TRP A 191 5.290 6.571 -9.072 1.00 35.44 H new ATOM 0 HB3 TRP A 191 5.006 7.838 -10.250 1.00 35.44 H new ATOM 0 HD1 TRP A 191 3.779 6.603 -6.827 1.00 63.50 H new ATOM 0 HE1 TRP A 191 2.332 8.432 -5.709 1.00 10.42 H new ATOM 0 HE3 TRP A 191 3.439 9.812 -10.790 1.00 23.32 H new ATOM 0 HZ2 TRP A 191 1.214 10.903 -6.464 1.00 22.20 H new ATOM 0 HZ3 TRP A 191 2.158 11.898 -10.515 1.00 32.41 H new ATOM 0 HH2 TRP A 191 1.063 12.434 -8.378 1.00 4.25 H new ATOM 2920 N ASP A 192 4.736 4.610 -11.957 1.00 41.32 N ATOM 2921 CA ASP A 192 5.405 4.197 -13.187 1.00 2.15 C ATOM 2922 C ASP A 192 4.412 4.148 -14.348 1.00 61.14 C ATOM 2923 O ASP A 192 4.786 4.324 -15.508 1.00 53.44 O ATOM 2924 CB ASP A 192 6.065 2.828 -12.999 1.00 51.33 C ATOM 2925 CG ASP A 192 7.072 2.514 -14.088 1.00 31.41 C ATOM 2926 OD1 ASP A 192 8.209 3.025 -14.011 1.00 40.54 O ATOM 2927 OD2 ASP A 192 6.725 1.755 -15.018 1.00 63.14 O1- ATOM 0 H ASP A 192 4.583 3.855 -11.288 1.00 41.32 H new ATOM 0 HA ASP A 192 6.177 4.930 -13.422 1.00 2.15 H new ATOM 0 HB2 ASP A 192 6.562 2.798 -12.029 1.00 51.33 H new ATOM 0 HB3 ASP A 192 5.296 2.056 -12.987 1.00 51.33 H new ATOM 2932 N THR A 193 3.143 3.913 -14.020 1.00 42.11 N ATOM 2933 CA THR A 193 2.084 3.850 -15.023 1.00 71.11 C ATOM 2934 C THR A 193 1.657 5.254 -15.455 1.00 34.14 C ATOM 2935 O THR A 193 1.065 5.434 -16.520 1.00 21.35 O ATOM 2936 CB THR A 193 0.857 3.076 -14.493 1.00 72.23 C ATOM 2937 OG1 THR A 193 -0.156 3.005 -15.503 1.00 64.13 O ATOM 2938 CG2 THR A 193 0.289 3.735 -13.243 1.00 41.42 C ATOM 0 H THR A 193 2.823 3.763 -13.063 1.00 42.11 H new ATOM 0 HA THR A 193 2.486 3.319 -15.886 1.00 71.11 H new ATOM 0 HB THR A 193 1.183 2.069 -14.234 1.00 72.23 H new ATOM 0 HG1 THR A 193 -0.771 2.270 -15.298 1.00 64.13 H new ATOM 0 HG21 THR A 193 -0.574 3.168 -12.893 1.00 41.42 H new ATOM 0 HG22 THR A 193 1.051 3.755 -12.464 1.00 41.42 H new ATOM 0 HG23 THR A 193 -0.017 4.755 -13.476 1.00 41.42 H new ATOM 2946 N PHE A 194 1.973 6.245 -14.620 1.00 63.35 N ATOM 2947 CA PHE A 194 1.638 7.638 -14.904 1.00 21.42 C ATOM 2948 C PHE A 194 2.571 8.208 -15.972 1.00 74.44 C ATOM 2949 O PHE A 194 2.245 9.192 -16.638 1.00 44.25 O ATOM 2950 CB PHE A 194 1.726 8.467 -13.617 1.00 54.02 C ATOM 2951 CG PHE A 194 1.349 9.914 -13.788 1.00 70.10 C ATOM 2952 CD1 PHE A 194 2.304 10.911 -13.661 1.00 43.25 C ATOM 2953 CD2 PHE A 194 0.042 10.275 -14.074 1.00 14.52 C ATOM 2954 CE1 PHE A 194 1.963 12.240 -13.817 1.00 65.11 C ATOM 2955 CE2 PHE A 194 -0.305 11.604 -14.231 1.00 41.11 C ATOM 2956 CZ PHE A 194 0.657 12.588 -14.102 1.00 53.34 C ATOM 0 H PHE A 194 2.464 6.105 -13.737 1.00 63.35 H new ATOM 0 HA PHE A 194 0.618 7.684 -15.285 1.00 21.42 H new ATOM 0 HB2 PHE A 194 1.076 8.020 -12.865 1.00 54.02 H new ATOM 0 HB3 PHE A 194 2.744 8.412 -13.231 1.00 54.02 H new ATOM 0 HD1 PHE A 194 3.327 10.645 -13.437 1.00 43.25 H new ATOM 0 HD2 PHE A 194 -0.714 9.510 -14.175 1.00 14.52 H new ATOM 0 HE1 PHE A 194 2.717 13.007 -13.716 1.00 65.11 H new ATOM 0 HE2 PHE A 194 -1.327 11.873 -14.454 1.00 41.11 H new ATOM 0 HZ PHE A 194 0.388 13.627 -14.224 1.00 53.34 H new ATOM 2966 N VAL A 195 3.731 7.574 -16.133 1.00 52.33 N ATOM 2967 CA VAL A 195 4.715 8.002 -17.121 1.00 53.41 C ATOM 2968 C VAL A 195 4.245 7.668 -18.534 1.00 43.43 C ATOM 2969 O VAL A 195 4.432 8.452 -19.461 1.00 30.33 O ATOM 2970 CB VAL A 195 6.084 7.334 -16.877 1.00 21.41 C ATOM 2971 CG1 VAL A 195 7.151 7.945 -17.773 1.00 2.30 C ATOM 2972 CG2 VAL A 195 6.480 7.443 -15.412 1.00 34.35 C ATOM 0 H VAL A 195 4.012 6.759 -15.588 1.00 52.33 H new ATOM 0 HA VAL A 195 4.824 9.082 -17.018 1.00 53.41 H new ATOM 0 HB VAL A 195 5.997 6.277 -17.129 1.00 21.41 H new ATOM 0 HG11 VAL A 195 8.108 7.458 -17.583 1.00 2.30 H new ATOM 0 HG12 VAL A 195 6.873 7.804 -18.818 1.00 2.30 H new ATOM 0 HG13 VAL A 195 7.238 9.011 -17.561 1.00 2.30 H new ATOM 0 HG21 VAL A 195 7.448 6.966 -15.260 1.00 34.35 H new ATOM 0 HG22 VAL A 195 6.545 8.494 -15.130 1.00 34.35 H new ATOM 0 HG23 VAL A 195 5.731 6.947 -14.795 1.00 34.35 H new ATOM 2982 N GLU A 196 3.629 6.498 -18.686 1.00 14.11 N ATOM 2983 CA GLU A 196 3.127 6.055 -19.984 1.00 4.20 C ATOM 2984 C GLU A 196 1.739 6.629 -20.262 1.00 15.34 C ATOM 2985 O GLU A 196 1.246 6.568 -21.389 1.00 61.15 O ATOM 2986 CB GLU A 196 3.077 4.524 -20.044 1.00 31.43 C ATOM 2987 CG GLU A 196 4.406 3.869 -20.399 1.00 74.41 C ATOM 2988 CD GLU A 196 5.457 4.023 -19.315 1.00 3.32 C ATOM 2989 OE1 GLU A 196 5.371 3.304 -18.297 1.00 41.21 O ATOM 2990 OE2 GLU A 196 6.369 4.859 -19.486 1.00 23.14 O1- ATOM 0 H GLU A 196 3.465 5.839 -17.925 1.00 14.11 H new ATOM 0 HA GLU A 196 3.812 6.421 -20.749 1.00 4.20 H new ATOM 0 HB2 GLU A 196 2.744 4.144 -19.078 1.00 31.43 H new ATOM 0 HB3 GLU A 196 2.330 4.225 -20.779 1.00 31.43 H new ATOM 0 HG2 GLU A 196 4.242 2.808 -20.589 1.00 74.41 H new ATOM 0 HG3 GLU A 196 4.782 4.304 -21.325 1.00 74.41 H new ATOM 2997 N LEU A 197 1.116 7.189 -19.227 1.00 55.40 N ATOM 2998 CA LEU A 197 -0.216 7.769 -19.352 1.00 12.03 C ATOM 2999 C LEU A 197 -0.144 9.227 -19.801 1.00 31.24 C ATOM 3000 O LEU A 197 -0.805 9.622 -20.762 1.00 54.02 O ATOM 3001 CB LEU A 197 -0.957 7.672 -18.015 1.00 14.21 C ATOM 3002 CG LEU A 197 -2.400 8.184 -18.026 1.00 25.45 C ATOM 3003 CD1 LEU A 197 -3.285 7.284 -18.877 1.00 53.33 C ATOM 3004 CD2 LEU A 197 -2.940 8.279 -16.608 1.00 52.21 C ATOM 0 H LEU A 197 1.515 7.253 -18.291 1.00 55.40 H new ATOM 0 HA LEU A 197 -0.760 7.206 -20.110 1.00 12.03 H new ATOM 0 HB2 LEU A 197 -0.962 6.630 -17.696 1.00 14.21 H new ATOM 0 HB3 LEU A 197 -0.396 8.232 -17.267 1.00 14.21 H new ATOM 0 HG LEU A 197 -2.407 9.181 -18.466 1.00 25.45 H new ATOM 0 HD11 LEU A 197 -4.306 7.666 -18.871 1.00 53.33 H new ATOM 0 HD12 LEU A 197 -2.910 7.267 -19.900 1.00 53.33 H new ATOM 0 HD13 LEU A 197 -3.274 6.273 -18.470 1.00 53.33 H new ATOM 0 HD21 LEU A 197 -3.967 8.644 -16.633 1.00 52.21 H new ATOM 0 HD22 LEU A 197 -2.917 7.293 -16.143 1.00 52.21 H new ATOM 0 HD23 LEU A 197 -2.324 8.967 -16.029 1.00 52.21 H new ATOM 3016 N TYR A 198 0.664 10.019 -19.102 1.00 22.15 N ATOM 3017 CA TYR A 198 0.816 11.435 -19.421 1.00 72.53 C ATOM 3018 C TYR A 198 1.856 11.645 -20.520 1.00 33.44 C ATOM 3019 O TYR A 198 1.585 12.304 -21.524 1.00 45.13 O ATOM 3020 CB TYR A 198 1.211 12.218 -18.168 1.00 14.44 C ATOM 3021 CG TYR A 198 0.540 13.568 -18.063 1.00 73.14 C ATOM 3022 CD1 TYR A 198 1.129 14.703 -18.605 1.00 23.14 C ATOM 3023 CD2 TYR A 198 -0.684 13.707 -17.422 1.00 61.30 C ATOM 3024 CE1 TYR A 198 0.517 15.938 -18.512 1.00 24.53 C ATOM 3025 CE2 TYR A 198 -1.303 14.939 -17.324 1.00 60.02 C ATOM 3026 CZ TYR A 198 -0.698 16.050 -17.871 1.00 12.25 C ATOM 3027 OH TYR A 198 -1.311 17.279 -17.776 1.00 15.10 O ATOM 0 H TYR A 198 1.224 9.704 -18.310 1.00 22.15 H new ATOM 0 HA TYR A 198 -0.143 11.803 -19.787 1.00 72.53 H new ATOM 0 HB2 TYR A 198 0.961 11.628 -17.287 1.00 14.44 H new ATOM 0 HB3 TYR A 198 2.292 12.357 -18.162 1.00 14.44 H new ATOM 0 HD1 TYR A 198 2.081 14.619 -19.108 1.00 23.14 H new ATOM 0 HD2 TYR A 198 -1.160 12.838 -16.993 1.00 61.30 H new ATOM 0 HE1 TYR A 198 0.988 16.811 -18.939 1.00 24.53 H new ATOM 0 HE2 TYR A 198 -2.255 15.030 -16.822 1.00 60.02 H new ATOM 0 HH TYR A 198 -2.160 17.185 -17.296 1.00 15.10 H new ATOM 3037 N GLY A 199 3.046 11.083 -20.321 1.00 13.15 N ATOM 3038 CA GLY A 199 4.108 11.218 -21.304 1.00 63.12 C ATOM 3039 C GLY A 199 4.203 10.017 -22.224 1.00 2.40 C ATOM 3040 O GLY A 199 5.168 9.253 -22.161 1.00 44.54 O ATOM 0 H GLY A 199 3.294 10.536 -19.496 1.00 13.15 H new ATOM 0 HA2 GLY A 199 3.936 12.115 -21.899 1.00 63.12 H new ATOM 0 HA3 GLY A 199 5.059 11.354 -20.790 1.00 63.12 H new ATOM 3044 N ASN A 200 3.200 9.856 -23.084 1.00 12.22 N ATOM 3045 CA ASN A 200 3.161 8.739 -24.025 1.00 31.11 C ATOM 3046 C ASN A 200 4.070 8.990 -25.229 1.00 31.33 C ATOM 3047 O ASN A 200 4.256 8.108 -26.068 1.00 41.40 O ATOM 3048 CB ASN A 200 1.723 8.484 -24.491 1.00 4.43 C ATOM 3049 CG ASN A 200 1.055 9.729 -25.048 1.00 42.43 C ATOM 3050 OD1 ASN A 200 1.151 10.018 -26.241 1.00 1.41 O ATOM 3051 ND2 ASN A 200 0.367 10.469 -24.186 1.00 21.30 N ATOM 0 H ASN A 200 2.401 10.487 -23.149 1.00 12.22 H new ATOM 0 HA ASN A 200 3.529 7.854 -23.506 1.00 31.11 H new ATOM 0 HB2 ASN A 200 1.726 7.706 -25.255 1.00 4.43 H new ATOM 0 HB3 ASN A 200 1.136 8.106 -23.654 1.00 4.43 H new ATOM 0 HD21 ASN A 200 -0.108 11.314 -24.504 1.00 21.30 H new ATOM 0 HD22 ASN A 200 0.313 10.193 -23.206 1.00 21.30 H new ATOM 3058 N ASN A 201 4.630 10.197 -25.309 1.00 60.41 N ATOM 3059 CA ASN A 201 5.527 10.557 -26.403 1.00 21.42 C ATOM 3060 C ASN A 201 6.903 9.935 -26.187 1.00 33.55 C ATOM 3061 O ASN A 201 7.585 9.562 -27.142 1.00 43.22 O ATOM 3062 CB ASN A 201 5.652 12.079 -26.520 1.00 50.22 C ATOM 3063 CG ASN A 201 4.383 12.739 -27.032 1.00 13.05 C ATOM 3064 OD1 ASN A 201 3.275 12.261 -26.792 1.00 53.41 O ATOM 3065 ND2 ASN A 201 4.542 13.850 -27.743 1.00 4.34 N ATOM 0 H ASN A 201 4.477 10.941 -24.628 1.00 60.41 H new ATOM 0 HA ASN A 201 5.106 10.170 -27.331 1.00 21.42 H new ATOM 0 HB2 ASN A 201 5.903 12.494 -25.544 1.00 50.22 H new ATOM 0 HB3 ASN A 201 6.477 12.320 -27.190 1.00 50.22 H new ATOM 0 HD21 ASN A 201 3.727 14.340 -28.113 1.00 4.34 H new ATOM 0 HD22 ASN A 201 5.479 14.213 -27.919 1.00 4.34 H new ATOM 3072 N ALA A 202 7.301 9.826 -24.920 1.00 2.13 N ATOM 3073 CA ALA A 202 8.586 9.236 -24.564 1.00 20.24 C ATOM 3074 C ALA A 202 8.485 7.714 -24.532 1.00 63.21 C ATOM 3075 O ALA A 202 9.490 7.011 -24.646 1.00 33.22 O ATOM 3076 CB ALA A 202 9.055 9.767 -23.219 1.00 72.15 C ATOM 0 H ALA A 202 6.748 10.140 -24.122 1.00 2.13 H new ATOM 0 HA ALA A 202 9.318 9.515 -25.322 1.00 20.24 H new ATOM 0 HB1 ALA A 202 10.015 9.318 -22.966 1.00 72.15 H new ATOM 0 HB2 ALA A 202 9.164 10.850 -23.273 1.00 72.15 H new ATOM 0 HB3 ALA A 202 8.323 9.514 -22.452 1.00 72.15 H new ATOM 3082 N ALA A 203 7.259 7.217 -24.375 1.00 51.11 N ATOM 3083 CA ALA A 203 7.005 5.782 -24.338 1.00 63.14 C ATOM 3084 C ALA A 203 6.923 5.211 -25.751 1.00 5.14 C ATOM 3085 O ALA A 203 7.063 4.004 -25.953 1.00 43.34 O ATOM 3086 CB ALA A 203 5.723 5.494 -23.573 1.00 2.14 C ATOM 0 H ALA A 203 6.423 7.793 -24.271 1.00 51.11 H new ATOM 0 HA ALA A 203 7.835 5.299 -23.823 1.00 63.14 H new ATOM 0 HB1 ALA A 203 5.545 4.419 -23.553 1.00 2.14 H new ATOM 0 HB2 ALA A 203 5.817 5.865 -22.553 1.00 2.14 H new ATOM 0 HB3 ALA A 203 4.887 5.991 -24.064 1.00 2.14 H new