USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1150 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 148 HIS : no HD1:sc= -0.0125 X(o=-0.022,f=0.066) USER MOD Set 1.2: A 150 HIS : no HE2:sc=-0.00915 X(o=-0.022,f=-0.46) USER MOD Set 2.1: A 113 CYS SG : rot -62:sc= -0.888 USER MOD Set 2.2: A 114 SER OG : rot 180:sc= 0 USER MOD Set 2.3: A 117 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 79 MET CE :methyl -133:sc= -0.164 (180deg=-0.488) USER MOD Set 3.2: A 89 HIS : no HD1:sc= -2.24! C(o=-2.4!,f=-6.9!) USER MOD Set 4.1: A 43 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 46 THR OG1 : rot 180:sc= -0.0672 USER MOD Set 5.1: A 31 HIS : no HD1:sc= -2.71 K(o=-5.8,f=-4!) USER MOD Set 5.2: A 33 GLN : amide:sc= -3.07 K(o=-5.8,f=-2) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HE2:sc= 0.112 K(o=0.11,f=-2.3) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -160:sc= 0 USER MOD Single : A 45 HIS : no HD1:sc= 0.168 K(o=0.17,f=-2.1!) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0.0794 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot 128:sc= 0.553 USER MOD Single : A 78 THR OG1 : rot 90:sc= 0.483 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc= -0.533 X(o=-0.53,f=-0.13) USER MOD Single : A 102 HIS : no HE2:sc= 0.101 K(o=0.1,f=-0.85) USER MOD Single : A 103 CYS SG : rot -87:sc= -2.72! USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.0105 USER MOD Single : A 110 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 135 ASN : amide:sc= -0.026 K(o=-0.026,f=-2.2) USER MOD Single : A 141 TYR OH : rot 80:sc=-0.00747 USER MOD Single : A 146 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 147 HIS : no HE2:sc= -0.153 K(o=-0.15,f=-0.87) USER MOD Single : A 149 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 151 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.248 16.243 10.881 1.00 3.50 N ATOM 2 CA MET A 1 -2.762 14.847 10.872 1.00 64.44 C ATOM 3 C MET A 1 -2.209 14.072 9.655 1.00 22.11 C ATOM 4 O MET A 1 -1.250 13.308 9.806 1.00 40.43 O ATOM 5 CB MET A 1 -4.319 14.835 10.896 1.00 32.25 C ATOM 6 CG MET A 1 -4.961 13.436 10.926 1.00 34.41 C ATOM 7 SD MET A 1 -6.766 13.500 10.981 1.00 12.41 S ATOM 8 CE MET A 1 -7.185 11.754 10.982 1.00 11.33 C ATOM 0 H1 MET A 1 -2.630 16.748 11.706 1.00 3.50 H new ATOM 0 H2 MET A 1 -1.209 16.230 10.933 1.00 3.50 H new ATOM 0 H3 MET A 1 -2.545 16.728 10.010 1.00 3.50 H new ATOM 0 HA MET A 1 -2.413 14.342 11.773 1.00 64.44 H new ATOM 0 HB2 MET A 1 -4.658 15.392 11.770 1.00 32.25 H new ATOM 0 HB3 MET A 1 -4.685 15.367 10.018 1.00 32.25 H new ATOM 0 HG2 MET A 1 -4.648 12.878 10.044 1.00 34.41 H new ATOM 0 HG3 MET A 1 -4.594 12.891 11.795 1.00 34.41 H new ATOM 0 HE1 MET A 1 -8.269 11.640 11.014 1.00 11.33 H new ATOM 0 HE2 MET A 1 -6.797 11.286 10.077 1.00 11.33 H new ATOM 0 HE3 MET A 1 -6.744 11.274 11.856 1.00 11.33 H new ATOM 20 N ALA A 2 -2.811 14.302 8.456 1.00 0.23 N ATOM 21 CA ALA A 2 -2.426 13.646 7.179 1.00 11.40 C ATOM 22 C ALA A 2 -2.261 12.109 7.317 1.00 42.13 C ATOM 23 O ALA A 2 -1.246 11.539 6.914 1.00 22.41 O ATOM 24 CB ALA A 2 -1.161 14.306 6.607 1.00 64.43 C ATOM 0 H ALA A 2 -3.586 14.956 8.350 1.00 0.23 H new ATOM 0 HA ALA A 2 -3.245 13.792 6.475 1.00 11.40 H new ATOM 0 HB1 ALA A 2 -0.887 13.818 5.672 1.00 64.43 H new ATOM 0 HB2 ALA A 2 -1.354 15.363 6.422 1.00 64.43 H new ATOM 0 HB3 ALA A 2 -0.344 14.206 7.321 1.00 64.43 H new ATOM 30 N THR A 3 -3.283 11.447 7.891 1.00 34.45 N ATOM 31 CA THR A 3 -3.255 9.990 8.168 1.00 22.44 C ATOM 32 C THR A 3 -4.240 9.247 7.233 1.00 25.42 C ATOM 33 O THR A 3 -5.456 9.227 7.448 1.00 24.34 O ATOM 34 CB THR A 3 -3.570 9.677 9.671 1.00 72.33 C ATOM 35 OG1 THR A 3 -2.698 10.453 10.518 1.00 55.14 O ATOM 36 CG2 THR A 3 -3.382 8.180 10.004 1.00 54.54 C ATOM 0 H THR A 3 -4.151 11.901 8.177 1.00 34.45 H new ATOM 0 HA THR A 3 -2.244 9.633 7.969 1.00 22.44 H new ATOM 0 HB THR A 3 -4.614 9.937 9.847 1.00 72.33 H new ATOM 0 HG1 THR A 3 -2.896 10.258 11.458 1.00 55.14 H new ATOM 0 HG21 THR A 3 -3.611 8.010 11.056 1.00 54.54 H new ATOM 0 HG22 THR A 3 -4.052 7.583 9.385 1.00 54.54 H new ATOM 0 HG23 THR A 3 -2.350 7.890 9.806 1.00 54.54 H new ATOM 44 N LEU A 4 -3.665 8.645 6.198 1.00 2.14 N ATOM 45 CA LEU A 4 -4.384 7.956 5.118 1.00 0.44 C ATOM 46 C LEU A 4 -4.506 6.465 5.472 1.00 10.41 C ATOM 47 O LEU A 4 -3.501 5.798 5.665 1.00 33.03 O ATOM 48 CB LEU A 4 -3.601 8.087 3.764 1.00 73.35 C ATOM 49 CG LEU A 4 -3.367 9.520 3.192 1.00 45.34 C ATOM 50 CD1 LEU A 4 -2.418 10.364 4.065 1.00 3.14 C ATOM 51 CD2 LEU A 4 -2.837 9.445 1.750 1.00 11.00 C ATOM 0 H LEU A 4 -2.652 8.619 6.078 1.00 2.14 H new ATOM 0 HA LEU A 4 -5.369 8.409 5.007 1.00 0.44 H new ATOM 0 HB2 LEU A 4 -2.627 7.616 3.894 1.00 73.35 H new ATOM 0 HB3 LEU A 4 -4.137 7.509 3.011 1.00 73.35 H new ATOM 0 HG LEU A 4 -4.335 10.021 3.197 1.00 45.34 H new ATOM 0 HD11 LEU A 4 -2.293 11.350 3.618 1.00 3.14 H new ATOM 0 HD12 LEU A 4 -2.840 10.470 5.064 1.00 3.14 H new ATOM 0 HD13 LEU A 4 -1.449 9.870 4.131 1.00 3.14 H new ATOM 0 HD21 LEU A 4 -2.680 10.453 1.367 1.00 11.00 H new ATOM 0 HD22 LEU A 4 -1.893 8.901 1.737 1.00 11.00 H new ATOM 0 HD23 LEU A 4 -3.563 8.928 1.122 1.00 11.00 H new ATOM 63 N ARG A 5 -5.731 5.956 5.599 1.00 63.14 N ATOM 64 CA ARG A 5 -5.971 4.512 5.801 1.00 24.43 C ATOM 65 C ARG A 5 -7.206 4.058 4.997 1.00 75.43 C ATOM 66 O ARG A 5 -8.236 4.739 4.978 1.00 41.25 O ATOM 67 CB ARG A 5 -6.140 4.195 7.311 1.00 42.21 C ATOM 68 CG ARG A 5 -6.314 2.689 7.637 1.00 13.30 C ATOM 69 CD ARG A 5 -6.459 2.409 9.144 1.00 43.13 C ATOM 70 NE ARG A 5 -7.575 3.172 9.748 1.00 54.32 N ATOM 71 CZ ARG A 5 -8.550 2.682 10.478 1.00 73.43 C ATOM 72 NH1 ARG A 5 -8.678 1.410 10.664 1.00 74.13 N ATOM 73 NH2 ARG A 5 -9.419 3.482 10.994 1.00 41.12 N ATOM 0 H ARG A 5 -6.581 6.518 5.567 1.00 63.14 H new ATOM 0 HA ARG A 5 -5.106 3.958 5.437 1.00 24.43 H new ATOM 0 HB2 ARG A 5 -5.269 4.572 7.848 1.00 42.21 H new ATOM 0 HB3 ARG A 5 -7.007 4.738 7.688 1.00 42.21 H new ATOM 0 HG2 ARG A 5 -7.194 2.310 7.117 1.00 13.30 H new ATOM 0 HG3 ARG A 5 -5.455 2.139 7.252 1.00 13.30 H new ATOM 0 HD2 ARG A 5 -6.623 1.343 9.300 1.00 43.13 H new ATOM 0 HD3 ARG A 5 -5.529 2.666 9.651 1.00 43.13 H new ATOM 0 HE ARG A 5 -7.588 4.178 9.580 1.00 54.32 H new ATOM 0 HH11 ARG A 5 -8.013 0.763 10.240 1.00 74.13 H new ATOM 0 HH12 ARG A 5 -9.444 1.053 11.235 1.00 74.13 H new ATOM 0 HH21 ARG A 5 -9.346 4.487 10.834 1.00 41.12 H new ATOM 0 HH22 ARG A 5 -10.180 3.110 11.563 1.00 41.12 H new ATOM 87 N ARG A 6 -7.083 2.904 4.336 1.00 74.41 N ATOM 88 CA ARG A 6 -8.157 2.316 3.520 1.00 24.33 C ATOM 89 C ARG A 6 -8.123 0.783 3.714 1.00 34.13 C ATOM 90 O ARG A 6 -7.050 0.181 3.750 1.00 71.53 O ATOM 91 CB ARG A 6 -7.975 2.738 2.017 1.00 54.31 C ATOM 92 CG ARG A 6 -9.291 2.934 1.211 1.00 53.10 C ATOM 93 CD ARG A 6 -10.082 1.635 0.955 1.00 14.14 C ATOM 94 NE ARG A 6 -11.374 1.895 0.290 1.00 23.02 N ATOM 95 CZ ARG A 6 -12.217 0.977 -0.134 1.00 22.34 C ATOM 96 NH1 ARG A 6 -11.986 -0.292 0.038 1.00 1.13 N ATOM 97 NH2 ARG A 6 -13.310 1.340 -0.717 1.00 14.12 N ATOM 0 H ARG A 6 -6.230 2.345 4.350 1.00 74.41 H new ATOM 0 HA ARG A 6 -9.136 2.681 3.832 1.00 24.33 H new ATOM 0 HB2 ARG A 6 -7.408 3.669 1.985 1.00 54.31 H new ATOM 0 HB3 ARG A 6 -7.372 1.981 1.516 1.00 54.31 H new ATOM 0 HG2 ARG A 6 -9.931 3.634 1.748 1.00 53.10 H new ATOM 0 HG3 ARG A 6 -9.050 3.393 0.252 1.00 53.10 H new ATOM 0 HD2 ARG A 6 -9.485 0.963 0.338 1.00 14.14 H new ATOM 0 HD3 ARG A 6 -10.258 1.125 1.902 1.00 14.14 H new ATOM 0 HE ARG A 6 -11.636 2.870 0.147 1.00 23.02 H new ATOM 0 HH11 ARG A 6 -11.135 -0.596 0.511 1.00 1.13 H new ATOM 0 HH12 ARG A 6 -12.656 -0.983 -0.300 1.00 1.13 H new ATOM 0 HH21 ARG A 6 -13.514 2.331 -0.846 1.00 14.12 H new ATOM 0 HH22 ARG A 6 -13.969 0.636 -1.049 1.00 14.12 H new ATOM 111 N SER A 7 -9.302 0.170 3.834 1.00 74.03 N ATOM 112 CA SER A 7 -9.457 -1.291 4.057 1.00 11.35 C ATOM 113 C SER A 7 -10.440 -1.881 3.033 1.00 64.32 C ATOM 114 O SER A 7 -11.391 -1.210 2.622 1.00 33.51 O ATOM 115 CB SER A 7 -9.961 -1.565 5.495 1.00 61.00 C ATOM 116 OG SER A 7 -11.232 -0.966 5.731 1.00 73.20 O ATOM 0 H SER A 7 -10.191 0.667 3.780 1.00 74.03 H new ATOM 0 HA SER A 7 -8.485 -1.768 3.930 1.00 11.35 H new ATOM 0 HB2 SER A 7 -10.030 -2.641 5.658 1.00 61.00 H new ATOM 0 HB3 SER A 7 -9.238 -1.179 6.214 1.00 61.00 H new ATOM 0 HG SER A 7 -11.520 -1.161 6.647 1.00 73.20 H new ATOM 122 N VAL A 8 -10.211 -3.138 2.628 1.00 21.44 N ATOM 123 CA VAL A 8 -11.048 -3.823 1.617 1.00 4.44 C ATOM 124 C VAL A 8 -11.229 -5.313 1.985 1.00 24.02 C ATOM 125 O VAL A 8 -10.315 -5.926 2.534 1.00 1.44 O ATOM 126 CB VAL A 8 -10.394 -3.687 0.187 1.00 11.41 C ATOM 127 CG1 VAL A 8 -9.070 -4.502 0.075 1.00 4.02 C ATOM 128 CG2 VAL A 8 -11.397 -4.059 -0.930 1.00 51.15 C ATOM 0 H VAL A 8 -9.447 -3.711 2.986 1.00 21.44 H new ATOM 0 HA VAL A 8 -12.030 -3.350 1.600 1.00 4.44 H new ATOM 0 HB VAL A 8 -10.131 -2.638 0.049 1.00 11.41 H new ATOM 0 HG11 VAL A 8 -8.652 -4.382 -0.924 1.00 4.02 H new ATOM 0 HG12 VAL A 8 -8.355 -4.138 0.813 1.00 4.02 H new ATOM 0 HG13 VAL A 8 -9.275 -5.557 0.258 1.00 4.02 H new ATOM 0 HG21 VAL A 8 -10.915 -3.955 -1.902 1.00 51.15 H new ATOM 0 HG22 VAL A 8 -11.724 -5.090 -0.796 1.00 51.15 H new ATOM 0 HG23 VAL A 8 -12.260 -3.395 -0.880 1.00 51.15 H new ATOM 138 N GLU A 9 -12.410 -5.895 1.695 1.00 53.25 N ATOM 139 CA GLU A 9 -12.664 -7.333 1.930 1.00 3.53 C ATOM 140 C GLU A 9 -12.498 -8.140 0.622 1.00 62.30 C ATOM 141 O GLU A 9 -13.274 -7.992 -0.327 1.00 55.50 O ATOM 142 CB GLU A 9 -14.061 -7.559 2.558 1.00 4.12 C ATOM 143 CG GLU A 9 -14.198 -6.982 3.984 1.00 25.13 C ATOM 144 CD GLU A 9 -15.469 -7.454 4.702 1.00 40.00 C ATOM 145 OE1 GLU A 9 -16.524 -6.794 4.583 1.00 72.23 O ATOM 146 OE2 GLU A 9 -15.423 -8.502 5.387 1.00 11.33 O ATOM 0 H GLU A 9 -13.204 -5.392 1.298 1.00 53.25 H new ATOM 0 HA GLU A 9 -11.923 -7.695 2.643 1.00 3.53 H new ATOM 0 HB2 GLU A 9 -14.816 -7.104 1.917 1.00 4.12 H new ATOM 0 HB3 GLU A 9 -14.269 -8.629 2.586 1.00 4.12 H new ATOM 0 HG2 GLU A 9 -13.327 -7.271 4.572 1.00 25.13 H new ATOM 0 HG3 GLU A 9 -14.200 -5.893 3.931 1.00 25.13 H new ATOM 153 N VAL A 10 -11.462 -8.978 0.610 1.00 44.30 N ATOM 154 CA VAL A 10 -11.083 -9.846 -0.519 1.00 62.22 C ATOM 155 C VAL A 10 -11.761 -11.235 -0.392 1.00 22.23 C ATOM 156 O VAL A 10 -11.737 -11.837 0.684 1.00 4.14 O ATOM 157 CB VAL A 10 -9.522 -10.002 -0.524 1.00 73.32 C ATOM 158 CG1 VAL A 10 -9.044 -10.952 -1.635 1.00 50.32 C ATOM 159 CG2 VAL A 10 -8.836 -8.617 -0.631 1.00 2.42 C ATOM 0 H VAL A 10 -10.838 -9.079 1.411 1.00 44.30 H new ATOM 0 HA VAL A 10 -11.416 -9.396 -1.454 1.00 62.22 H new ATOM 0 HB VAL A 10 -9.232 -10.454 0.424 1.00 73.32 H new ATOM 0 HG11 VAL A 10 -7.957 -11.032 -1.603 1.00 50.32 H new ATOM 0 HG12 VAL A 10 -9.485 -11.938 -1.485 1.00 50.32 H new ATOM 0 HG13 VAL A 10 -9.351 -10.561 -2.605 1.00 50.32 H new ATOM 0 HG21 VAL A 10 -7.754 -8.746 -0.633 1.00 2.42 H new ATOM 0 HG22 VAL A 10 -9.145 -8.128 -1.555 1.00 2.42 H new ATOM 0 HG23 VAL A 10 -9.126 -8.001 0.220 1.00 2.42 H new ATOM 169 N ALA A 11 -12.366 -11.740 -1.491 1.00 15.44 N ATOM 170 CA ALA A 11 -12.972 -13.101 -1.542 1.00 34.50 C ATOM 171 C ALA A 11 -11.909 -14.210 -1.814 1.00 70.15 C ATOM 172 O ALA A 11 -12.090 -15.067 -2.688 1.00 13.34 O ATOM 173 CB ALA A 11 -14.104 -13.118 -2.597 1.00 12.40 C ATOM 0 H ALA A 11 -12.451 -11.223 -2.366 1.00 15.44 H new ATOM 0 HA ALA A 11 -13.396 -13.328 -0.564 1.00 34.50 H new ATOM 0 HB1 ALA A 11 -14.549 -14.112 -2.637 1.00 12.40 H new ATOM 0 HB2 ALA A 11 -14.867 -12.389 -2.324 1.00 12.40 H new ATOM 0 HB3 ALA A 11 -13.694 -12.865 -3.575 1.00 12.40 H new ATOM 179 N ALA A 12 -10.823 -14.206 -1.015 1.00 55.10 N ATOM 180 CA ALA A 12 -9.712 -15.188 -1.112 1.00 42.20 C ATOM 181 C ALA A 12 -8.921 -15.256 0.230 1.00 55.01 C ATOM 182 O ALA A 12 -8.937 -14.283 0.999 1.00 61.15 O ATOM 183 CB ALA A 12 -8.775 -14.819 -2.279 1.00 12.14 C ATOM 0 H ALA A 12 -10.686 -13.517 -0.276 1.00 55.10 H new ATOM 0 HA ALA A 12 -10.135 -16.174 -1.306 1.00 42.20 H new ATOM 0 HB1 ALA A 12 -7.965 -15.546 -2.339 1.00 12.14 H new ATOM 0 HB2 ALA A 12 -9.337 -14.824 -3.213 1.00 12.14 H new ATOM 0 HB3 ALA A 12 -8.359 -13.826 -2.111 1.00 12.14 H new ATOM 189 N PRO A 13 -8.226 -16.408 0.540 1.00 54.13 N ATOM 190 CA PRO A 13 -7.401 -16.549 1.778 1.00 3.21 C ATOM 191 C PRO A 13 -6.169 -15.592 1.814 1.00 61.30 C ATOM 192 O PRO A 13 -5.517 -15.349 0.787 1.00 12.34 O ATOM 193 CB PRO A 13 -6.968 -18.044 1.754 1.00 72.40 C ATOM 194 CG PRO A 13 -7.034 -18.429 0.308 1.00 44.10 C ATOM 195 CD PRO A 13 -8.205 -17.666 -0.266 1.00 11.42 C ATOM 0 HA PRO A 13 -7.962 -16.274 2.671 1.00 3.21 H new ATOM 0 HB2 PRO A 13 -5.962 -18.173 2.154 1.00 72.40 H new ATOM 0 HB3 PRO A 13 -7.633 -18.660 2.360 1.00 72.40 H new ATOM 0 HG2 PRO A 13 -6.109 -18.172 -0.208 1.00 44.10 H new ATOM 0 HG3 PRO A 13 -7.174 -19.504 0.195 1.00 44.10 H new ATOM 0 HD2 PRO A 13 -8.069 -17.461 -1.328 1.00 11.42 H new ATOM 0 HD3 PRO A 13 -9.136 -18.223 -0.165 1.00 11.42 H new ATOM 203 N ALA A 14 -5.882 -15.072 3.030 1.00 13.44 N ATOM 204 CA ALA A 14 -4.828 -14.060 3.321 1.00 74.34 C ATOM 205 C ALA A 14 -3.437 -14.367 2.724 1.00 13.05 C ATOM 206 O ALA A 14 -2.743 -13.455 2.285 1.00 1.21 O ATOM 207 CB ALA A 14 -4.708 -13.883 4.849 1.00 11.50 C ATOM 0 H ALA A 14 -6.393 -15.352 3.867 1.00 13.44 H new ATOM 0 HA ALA A 14 -5.154 -13.143 2.830 1.00 74.34 H new ATOM 0 HB1 ALA A 14 -3.938 -13.144 5.070 1.00 11.50 H new ATOM 0 HB2 ALA A 14 -5.663 -13.545 5.252 1.00 11.50 H new ATOM 0 HB3 ALA A 14 -4.438 -14.835 5.306 1.00 11.50 H new ATOM 213 N ALA A 15 -3.042 -15.648 2.746 1.00 31.22 N ATOM 214 CA ALA A 15 -1.712 -16.103 2.278 1.00 23.33 C ATOM 215 C ALA A 15 -1.481 -15.830 0.768 1.00 73.12 C ATOM 216 O ALA A 15 -0.441 -15.283 0.382 1.00 35.01 O ATOM 217 CB ALA A 15 -1.543 -17.596 2.601 1.00 62.53 C ATOM 0 H ALA A 15 -3.633 -16.405 3.089 1.00 31.22 H new ATOM 0 HA ALA A 15 -0.955 -15.524 2.808 1.00 23.33 H new ATOM 0 HB1 ALA A 15 -0.565 -17.934 2.258 1.00 62.53 H new ATOM 0 HB2 ALA A 15 -1.622 -17.747 3.678 1.00 62.53 H new ATOM 0 HB3 ALA A 15 -2.322 -18.168 2.097 1.00 62.53 H new ATOM 223 N ASP A 16 -2.453 -16.235 -0.067 1.00 33.23 N ATOM 224 CA ASP A 16 -2.440 -15.985 -1.535 1.00 4.22 C ATOM 225 C ASP A 16 -2.353 -14.479 -1.873 1.00 32.01 C ATOM 226 O ASP A 16 -1.606 -14.068 -2.772 1.00 53.25 O ATOM 227 CB ASP A 16 -3.715 -16.587 -2.171 1.00 22.45 C ATOM 228 CG ASP A 16 -3.768 -18.116 -2.061 1.00 71.31 C ATOM 229 OD1 ASP A 16 -3.908 -18.637 -0.932 1.00 43.14 O ATOM 230 OD2 ASP A 16 -3.685 -18.805 -3.099 1.00 72.55 O ATOM 0 H ASP A 16 -3.276 -16.747 0.249 1.00 33.23 H new ATOM 0 HA ASP A 16 -1.550 -16.463 -1.943 1.00 4.22 H new ATOM 0 HB2 ASP A 16 -4.593 -16.162 -1.686 1.00 22.45 H new ATOM 0 HB3 ASP A 16 -3.761 -16.301 -3.222 1.00 22.45 H new ATOM 235 N VAL A 17 -3.120 -13.679 -1.126 1.00 42.51 N ATOM 236 CA VAL A 17 -3.171 -12.211 -1.277 1.00 32.23 C ATOM 237 C VAL A 17 -1.853 -11.560 -0.779 1.00 3.04 C ATOM 238 O VAL A 17 -1.405 -10.542 -1.312 1.00 1.43 O ATOM 239 CB VAL A 17 -4.408 -11.615 -0.512 1.00 4.04 C ATOM 240 CG1 VAL A 17 -4.564 -10.099 -0.789 1.00 74.45 C ATOM 241 CG2 VAL A 17 -5.703 -12.398 -0.865 1.00 62.12 C ATOM 0 H VAL A 17 -3.732 -14.031 -0.390 1.00 42.51 H new ATOM 0 HA VAL A 17 -3.284 -11.983 -2.337 1.00 32.23 H new ATOM 0 HB VAL A 17 -4.232 -11.730 0.558 1.00 4.04 H new ATOM 0 HG11 VAL A 17 -5.428 -9.717 -0.246 1.00 74.45 H new ATOM 0 HG12 VAL A 17 -3.667 -9.575 -0.459 1.00 74.45 H new ATOM 0 HG13 VAL A 17 -4.707 -9.937 -1.857 1.00 74.45 H new ATOM 0 HG21 VAL A 17 -6.547 -11.969 -0.324 1.00 62.12 H new ATOM 0 HG22 VAL A 17 -5.887 -12.332 -1.937 1.00 62.12 H new ATOM 0 HG23 VAL A 17 -5.585 -13.444 -0.581 1.00 62.12 H new ATOM 251 N TRP A 18 -1.252 -12.166 0.260 1.00 72.43 N ATOM 252 CA TRP A 18 0.035 -11.716 0.832 1.00 64.43 C ATOM 253 C TRP A 18 1.210 -11.923 -0.156 1.00 42.23 C ATOM 254 O TRP A 18 2.200 -11.197 -0.104 1.00 72.25 O ATOM 255 CB TRP A 18 0.319 -12.425 2.185 1.00 4.24 C ATOM 256 CG TRP A 18 1.602 -11.975 2.864 1.00 4.14 C ATOM 257 CD1 TRP A 18 2.658 -12.753 3.254 1.00 41.33 C ATOM 258 CD2 TRP A 18 1.973 -10.622 3.183 1.00 71.25 C ATOM 259 NE1 TRP A 18 3.634 -11.973 3.817 1.00 1.33 N ATOM 260 CE2 TRP A 18 3.241 -10.667 3.779 1.00 5.10 C ATOM 261 CE3 TRP A 18 1.348 -9.380 3.029 1.00 72.43 C ATOM 262 CZ2 TRP A 18 3.896 -9.525 4.212 1.00 3.02 C ATOM 263 CZ3 TRP A 18 2.000 -8.244 3.459 1.00 32.44 C ATOM 264 CH2 TRP A 18 3.265 -8.326 4.042 1.00 41.21 C ATOM 0 H TRP A 18 -1.643 -12.983 0.729 1.00 72.43 H new ATOM 0 HA TRP A 18 -0.050 -10.645 1.016 1.00 64.43 H new ATOM 0 HB2 TRP A 18 -0.518 -12.246 2.859 1.00 4.24 H new ATOM 0 HB3 TRP A 18 0.368 -13.501 2.016 1.00 4.24 H new ATOM 0 HD1 TRP A 18 2.714 -13.825 3.135 1.00 41.33 H new ATOM 0 HE1 TRP A 18 4.514 -12.314 4.203 1.00 1.33 H new ATOM 0 HE3 TRP A 18 0.368 -9.312 2.580 1.00 72.43 H new ATOM 0 HZ2 TRP A 18 4.873 -9.581 4.669 1.00 3.02 H new ATOM 0 HZ3 TRP A 18 1.527 -7.280 3.343 1.00 32.44 H new ATOM 0 HH2 TRP A 18 3.756 -7.421 4.366 1.00 41.21 H new ATOM 275 N THR A 19 1.107 -12.932 -1.036 1.00 4.33 N ATOM 276 CA THR A 19 2.071 -13.114 -2.153 1.00 23.11 C ATOM 277 C THR A 19 1.973 -11.930 -3.152 1.00 4.22 C ATOM 278 O THR A 19 2.974 -11.447 -3.661 1.00 41.14 O ATOM 279 CB THR A 19 1.813 -14.464 -2.912 1.00 43.13 C ATOM 280 OG1 THR A 19 1.735 -15.544 -1.967 1.00 64.51 O ATOM 281 CG2 THR A 19 2.915 -14.782 -3.948 1.00 4.40 C ATOM 0 H THR A 19 0.371 -13.637 -1.003 1.00 4.33 H new ATOM 0 HA THR A 19 3.072 -13.143 -1.724 1.00 23.11 H new ATOM 0 HB THR A 19 0.872 -14.353 -3.450 1.00 43.13 H new ATOM 0 HG1 THR A 19 1.572 -16.385 -2.444 1.00 64.51 H new ATOM 0 HG21 THR A 19 2.687 -15.726 -4.444 1.00 4.40 H new ATOM 0 HG22 THR A 19 2.959 -13.984 -4.689 1.00 4.40 H new ATOM 0 HG23 THR A 19 3.878 -14.861 -3.443 1.00 4.40 H new ATOM 289 N LEU A 20 0.744 -11.433 -3.350 1.00 54.43 N ATOM 290 CA LEU A 20 0.422 -10.379 -4.339 1.00 64.02 C ATOM 291 C LEU A 20 0.934 -8.975 -3.885 1.00 22.20 C ATOM 292 O LEU A 20 1.615 -8.268 -4.646 1.00 3.51 O ATOM 293 CB LEU A 20 -1.119 -10.374 -4.536 1.00 14.40 C ATOM 294 CG LEU A 20 -1.711 -9.320 -5.517 1.00 23.04 C ATOM 295 CD1 LEU A 20 -1.216 -9.534 -6.955 1.00 13.44 C ATOM 296 CD2 LEU A 20 -3.249 -9.316 -5.463 1.00 15.32 C ATOM 0 H LEU A 20 -0.069 -11.752 -2.824 1.00 54.43 H new ATOM 0 HA LEU A 20 0.928 -10.594 -5.280 1.00 64.02 H new ATOM 0 HB2 LEU A 20 -1.418 -11.363 -4.883 1.00 14.40 H new ATOM 0 HB3 LEU A 20 -1.583 -10.225 -3.561 1.00 14.40 H new ATOM 0 HG LEU A 20 -1.355 -8.343 -5.191 1.00 23.04 H new ATOM 0 HD11 LEU A 20 -1.653 -8.777 -7.607 1.00 13.44 H new ATOM 0 HD12 LEU A 20 -0.129 -9.452 -6.982 1.00 13.44 H new ATOM 0 HD13 LEU A 20 -1.514 -10.525 -7.299 1.00 13.44 H new ATOM 0 HD21 LEU A 20 -3.636 -8.571 -6.158 1.00 15.32 H new ATOM 0 HD22 LEU A 20 -3.625 -10.301 -5.741 1.00 15.32 H new ATOM 0 HD23 LEU A 20 -3.577 -9.074 -4.452 1.00 15.32 H new ATOM 308 N VAL A 21 0.580 -8.589 -2.641 1.00 42.45 N ATOM 309 CA VAL A 21 0.954 -7.272 -2.047 1.00 62.22 C ATOM 310 C VAL A 21 2.345 -7.297 -1.365 1.00 25.54 C ATOM 311 O VAL A 21 3.057 -6.286 -1.357 1.00 1.15 O ATOM 312 CB VAL A 21 -0.124 -6.775 -1.011 1.00 2.13 C ATOM 313 CG1 VAL A 21 -1.489 -6.563 -1.690 1.00 42.01 C ATOM 314 CG2 VAL A 21 -0.247 -7.730 0.203 1.00 15.13 C ATOM 0 H VAL A 21 0.028 -9.175 -2.015 1.00 42.45 H new ATOM 0 HA VAL A 21 0.998 -6.575 -2.884 1.00 62.22 H new ATOM 0 HB VAL A 21 0.218 -5.813 -0.629 1.00 2.13 H new ATOM 0 HG11 VAL A 21 -2.213 -6.220 -0.951 1.00 42.01 H new ATOM 0 HG12 VAL A 21 -1.392 -5.815 -2.477 1.00 42.01 H new ATOM 0 HG13 VAL A 21 -1.830 -7.503 -2.123 1.00 42.01 H new ATOM 0 HG21 VAL A 21 -1.001 -7.348 0.891 1.00 15.13 H new ATOM 0 HG22 VAL A 21 -0.539 -8.722 -0.142 1.00 15.13 H new ATOM 0 HG23 VAL A 21 0.713 -7.793 0.715 1.00 15.13 H new ATOM 324 N GLY A 22 2.701 -8.462 -0.779 1.00 74.42 N ATOM 325 CA GLY A 22 3.982 -8.647 -0.069 1.00 21.53 C ATOM 326 C GLY A 22 5.197 -8.574 -0.990 1.00 40.13 C ATOM 327 O GLY A 22 6.310 -8.260 -0.538 1.00 2.13 O ATOM 0 H GLY A 22 2.111 -9.294 -0.786 1.00 74.42 H new ATOM 0 HA2 GLY A 22 4.074 -7.885 0.705 1.00 21.53 H new ATOM 0 HA3 GLY A 22 3.974 -9.613 0.435 1.00 21.53 H new ATOM 331 N ASP A 23 4.988 -8.901 -2.287 1.00 71.21 N ATOM 332 CA ASP A 23 5.988 -8.649 -3.335 1.00 64.40 C ATOM 333 C ASP A 23 6.221 -7.127 -3.507 1.00 52.52 C ATOM 334 O ASP A 23 5.501 -6.430 -4.245 1.00 4.13 O ATOM 335 CB ASP A 23 5.599 -9.312 -4.693 1.00 62.41 C ATOM 336 CG ASP A 23 5.981 -10.800 -4.800 1.00 23.22 C ATOM 337 OD1 ASP A 23 7.108 -11.160 -4.391 1.00 73.31 O ATOM 338 OD2 ASP A 23 5.193 -11.606 -5.351 1.00 31.35 O ATOM 0 H ASP A 23 4.132 -9.340 -2.626 1.00 71.21 H new ATOM 0 HA ASP A 23 6.921 -9.111 -3.013 1.00 64.40 H new ATOM 0 HB2 ASP A 23 4.523 -9.213 -4.838 1.00 62.41 H new ATOM 0 HB3 ASP A 23 6.081 -8.765 -5.503 1.00 62.41 H new ATOM 343 N PHE A 24 7.257 -6.637 -2.809 1.00 3.42 N ATOM 344 CA PHE A 24 7.778 -5.258 -2.925 1.00 2.02 C ATOM 345 C PHE A 24 8.597 -5.088 -4.261 1.00 4.05 C ATOM 346 O PHE A 24 9.307 -4.105 -4.462 1.00 41.43 O ATOM 347 CB PHE A 24 8.627 -4.987 -1.647 1.00 3.33 C ATOM 348 CG PHE A 24 9.112 -3.550 -1.408 1.00 21.53 C ATOM 349 CD1 PHE A 24 8.260 -2.586 -0.862 1.00 54.25 C ATOM 350 CD2 PHE A 24 10.429 -3.170 -1.707 1.00 33.14 C ATOM 351 CE1 PHE A 24 8.706 -1.297 -0.622 1.00 23.40 C ATOM 352 CE2 PHE A 24 10.868 -1.881 -1.473 1.00 43.12 C ATOM 353 CZ PHE A 24 10.006 -0.945 -0.931 1.00 53.11 C ATOM 0 H PHE A 24 7.771 -7.199 -2.131 1.00 3.42 H new ATOM 0 HA PHE A 24 6.974 -4.524 -2.983 1.00 2.02 H new ATOM 0 HB2 PHE A 24 8.038 -5.291 -0.782 1.00 3.33 H new ATOM 0 HB3 PHE A 24 9.502 -5.636 -1.681 1.00 3.33 H new ATOM 0 HD1 PHE A 24 7.240 -2.850 -0.624 1.00 54.25 H new ATOM 0 HD2 PHE A 24 11.110 -3.896 -2.126 1.00 33.14 H new ATOM 0 HE1 PHE A 24 8.037 -0.566 -0.193 1.00 23.40 H new ATOM 0 HE2 PHE A 24 11.884 -1.604 -1.713 1.00 43.12 H new ATOM 0 HZ PHE A 24 10.350 0.063 -0.749 1.00 53.11 H new ATOM 363 N SER A 25 8.474 -6.075 -5.176 1.00 4.55 N ATOM 364 CA SER A 25 9.030 -6.023 -6.547 1.00 34.14 C ATOM 365 C SER A 25 7.932 -6.039 -7.630 1.00 13.30 C ATOM 366 O SER A 25 8.241 -5.912 -8.820 1.00 61.42 O ATOM 367 CB SER A 25 9.987 -7.216 -6.761 1.00 12.55 C ATOM 368 OG SER A 25 9.327 -8.459 -6.557 1.00 5.30 O ATOM 0 H SER A 25 7.978 -6.944 -4.980 1.00 4.55 H new ATOM 0 HA SER A 25 9.569 -5.081 -6.645 1.00 34.14 H new ATOM 0 HB2 SER A 25 10.393 -7.181 -7.772 1.00 12.55 H new ATOM 0 HB3 SER A 25 10.830 -7.134 -6.075 1.00 12.55 H new ATOM 0 HG SER A 25 9.960 -9.193 -6.702 1.00 5.30 H new ATOM 374 N ALA A 26 6.646 -6.132 -7.228 1.00 70.14 N ATOM 375 CA ALA A 26 5.536 -6.378 -8.177 1.00 63.32 C ATOM 376 C ALA A 26 4.595 -5.165 -8.245 1.00 24.04 C ATOM 377 O ALA A 26 4.780 -4.318 -9.105 1.00 22.33 O ATOM 378 CB ALA A 26 4.785 -7.664 -7.799 1.00 35.00 C ATOM 0 H ALA A 26 6.350 -6.041 -6.256 1.00 70.14 H new ATOM 0 HA ALA A 26 5.952 -6.518 -9.175 1.00 63.32 H new ATOM 0 HB1 ALA A 26 3.972 -7.832 -8.505 1.00 35.00 H new ATOM 0 HB2 ALA A 26 5.473 -8.509 -7.830 1.00 35.00 H new ATOM 0 HB3 ALA A 26 4.377 -7.565 -6.793 1.00 35.00 H new ATOM 384 N ILE A 27 3.644 -5.085 -7.284 1.00 11.30 N ATOM 385 CA ILE A 27 2.542 -4.071 -7.167 1.00 54.31 C ATOM 386 C ILE A 27 1.627 -3.878 -8.437 1.00 51.23 C ATOM 387 O ILE A 27 0.409 -3.899 -8.296 1.00 1.22 O ATOM 388 CB ILE A 27 2.990 -2.677 -6.536 1.00 51.30 C ATOM 389 CG1 ILE A 27 1.737 -1.807 -6.202 1.00 12.31 C ATOM 390 CG2 ILE A 27 3.961 -1.886 -7.434 1.00 25.51 C ATOM 391 CD1 ILE A 27 1.985 -0.613 -5.301 1.00 53.54 C ATOM 0 H ILE A 27 3.614 -5.761 -6.520 1.00 11.30 H new ATOM 0 HA ILE A 27 1.891 -4.553 -6.437 1.00 54.31 H new ATOM 0 HB ILE A 27 3.533 -2.912 -5.620 1.00 51.30 H new ATOM 0 HG12 ILE A 27 1.306 -1.449 -7.137 1.00 12.31 H new ATOM 0 HG13 ILE A 27 0.990 -2.445 -5.730 1.00 12.31 H new ATOM 0 HG21 ILE A 27 4.226 -0.948 -6.946 1.00 25.51 H new ATOM 0 HG22 ILE A 27 4.863 -2.475 -7.602 1.00 25.51 H new ATOM 0 HG23 ILE A 27 3.482 -1.675 -8.390 1.00 25.51 H new ATOM 0 HD11 ILE A 27 1.048 -0.081 -5.135 1.00 53.54 H new ATOM 0 HD12 ILE A 27 2.382 -0.955 -4.345 1.00 53.54 H new ATOM 0 HD13 ILE A 27 2.703 0.057 -5.774 1.00 53.54 H new ATOM 403 N HIS A 28 2.185 -3.702 -9.663 1.00 45.40 N ATOM 404 CA HIS A 28 1.382 -3.607 -10.931 1.00 41.13 C ATOM 405 C HIS A 28 0.529 -4.883 -11.253 1.00 42.10 C ATOM 406 O HIS A 28 -0.212 -4.901 -12.240 1.00 21.42 O ATOM 407 CB HIS A 28 2.307 -3.251 -12.130 1.00 75.52 C ATOM 408 CG HIS A 28 3.338 -4.291 -12.497 1.00 74.41 C ATOM 409 ND1 HIS A 28 4.563 -4.391 -11.874 1.00 52.54 N ATOM 410 CD2 HIS A 28 3.331 -5.260 -13.444 1.00 2.41 C ATOM 411 CE1 HIS A 28 5.263 -5.360 -12.425 1.00 4.22 C ATOM 412 NE2 HIS A 28 4.541 -5.905 -13.377 1.00 62.33 N ATOM 0 H HIS A 28 3.191 -3.622 -9.810 1.00 45.40 H new ATOM 0 HA HIS A 28 0.660 -2.807 -10.767 1.00 41.13 H new ATOM 0 HB2 HIS A 28 1.682 -3.063 -13.003 1.00 75.52 H new ATOM 0 HB3 HIS A 28 2.824 -2.319 -11.901 1.00 75.52 H new ATOM 0 HD1 HIS A 28 4.879 -3.803 -11.103 1.00 52.54 H new ATOM 0 HD2 HIS A 28 2.523 -5.484 -14.125 1.00 2.41 H new ATOM 0 HE1 HIS A 28 6.262 -5.657 -12.142 1.00 4.22 H new ATOM 421 N ARG A 29 0.663 -5.944 -10.429 1.00 60.25 N ATOM 422 CA ARG A 29 -0.159 -7.179 -10.528 1.00 41.40 C ATOM 423 C ARG A 29 -1.590 -7.002 -9.939 1.00 5.03 C ATOM 424 O ARG A 29 -2.458 -7.850 -10.163 1.00 70.00 O ATOM 425 CB ARG A 29 0.555 -8.341 -9.793 1.00 11.03 C ATOM 426 CG ARG A 29 1.907 -8.776 -10.394 1.00 23.33 C ATOM 427 CD ARG A 29 2.518 -9.974 -9.633 1.00 3.51 C ATOM 428 NE ARG A 29 1.585 -11.111 -9.572 1.00 22.43 N ATOM 429 CZ ARG A 29 1.561 -12.054 -8.658 1.00 71.31 C ATOM 430 NH1 ARG A 29 2.419 -12.091 -7.681 1.00 32.33 N ATOM 431 NH2 ARG A 29 0.656 -12.969 -8.737 1.00 11.24 N ATOM 0 H ARG A 29 1.346 -5.973 -9.672 1.00 60.25 H new ATOM 0 HA ARG A 29 -0.269 -7.403 -11.589 1.00 41.40 H new ATOM 0 HB2 ARG A 29 0.716 -8.047 -8.756 1.00 11.03 H new ATOM 0 HB3 ARG A 29 -0.111 -9.204 -9.780 1.00 11.03 H new ATOM 0 HG2 ARG A 29 1.769 -9.044 -11.442 1.00 23.33 H new ATOM 0 HG3 ARG A 29 2.602 -7.937 -10.368 1.00 23.33 H new ATOM 0 HD2 ARG A 29 3.440 -10.285 -10.124 1.00 3.51 H new ATOM 0 HD3 ARG A 29 2.784 -9.666 -8.622 1.00 3.51 H new ATOM 0 HE ARG A 29 0.887 -11.173 -10.314 1.00 22.43 H new ATOM 0 HH11 ARG A 29 3.140 -11.373 -7.608 1.00 32.33 H new ATOM 0 HH12 ARG A 29 2.371 -12.838 -6.988 1.00 32.33 H new ATOM 0 HH21 ARG A 29 -0.022 -12.951 -9.498 1.00 11.24 H new ATOM 0 HH22 ARG A 29 0.619 -13.711 -8.038 1.00 11.24 H new ATOM 445 N TRP A 30 -1.799 -5.940 -9.131 1.00 21.20 N ATOM 446 CA TRP A 30 -3.130 -5.595 -8.551 1.00 64.52 C ATOM 447 C TRP A 30 -3.465 -4.101 -8.734 1.00 33.42 C ATOM 448 O TRP A 30 -4.633 -3.732 -8.911 1.00 50.23 O ATOM 449 CB TRP A 30 -3.183 -5.973 -7.047 1.00 50.23 C ATOM 450 CG TRP A 30 -2.101 -5.352 -6.178 1.00 2.34 C ATOM 451 CD1 TRP A 30 -0.807 -5.771 -6.052 1.00 40.22 C ATOM 452 CD2 TRP A 30 -2.234 -4.223 -5.295 1.00 23.32 C ATOM 453 NE1 TRP A 30 -0.136 -4.968 -5.175 1.00 1.45 N ATOM 454 CE2 TRP A 30 -0.987 -4.019 -4.692 1.00 53.53 C ATOM 455 CE3 TRP A 30 -3.284 -3.364 -4.963 1.00 50.54 C ATOM 456 CZ2 TRP A 30 -0.755 -3.000 -3.777 1.00 23.01 C ATOM 457 CZ3 TRP A 30 -3.058 -2.352 -4.049 1.00 54.45 C ATOM 458 CH2 TRP A 30 -1.799 -2.179 -3.467 1.00 71.11 C ATOM 0 H TRP A 30 -1.057 -5.295 -8.859 1.00 21.20 H new ATOM 0 HA TRP A 30 -3.879 -6.173 -9.092 1.00 64.52 H new ATOM 0 HB2 TRP A 30 -4.155 -5.680 -6.651 1.00 50.23 H new ATOM 0 HB3 TRP A 30 -3.117 -7.058 -6.960 1.00 50.23 H new ATOM 0 HD1 TRP A 30 -0.377 -6.615 -6.571 1.00 40.22 H new ATOM 0 HE1 TRP A 30 0.847 -5.063 -4.921 1.00 1.45 H new ATOM 0 HE3 TRP A 30 -4.258 -3.489 -5.414 1.00 50.54 H new ATOM 0 HZ2 TRP A 30 0.217 -2.863 -3.327 1.00 23.01 H new ATOM 0 HZ3 TRP A 30 -3.865 -1.686 -3.781 1.00 54.45 H new ATOM 0 HH2 TRP A 30 -1.650 -1.379 -2.757 1.00 71.11 H new ATOM 469 N HIS A 31 -2.427 -3.258 -8.673 1.00 33.30 N ATOM 470 CA HIS A 31 -2.553 -1.800 -8.748 1.00 62.01 C ATOM 471 C HIS A 31 -2.523 -1.357 -10.239 1.00 11.01 C ATOM 472 O HIS A 31 -1.467 -1.446 -10.884 1.00 40.45 O ATOM 473 CB HIS A 31 -1.410 -1.136 -7.947 1.00 2.40 C ATOM 474 CG HIS A 31 -1.697 0.285 -7.559 1.00 44.44 C ATOM 475 ND1 HIS A 31 -1.428 1.344 -8.394 1.00 11.34 N ATOM 476 CD2 HIS A 31 -2.248 0.752 -6.421 1.00 3.34 C ATOM 477 CE1 HIS A 31 -1.817 2.416 -7.738 1.00 24.42 C ATOM 478 NE2 HIS A 31 -2.320 2.107 -6.543 1.00 43.22 N ATOM 0 H HIS A 31 -1.463 -3.575 -8.569 1.00 33.30 H new ATOM 0 HA HIS A 31 -3.501 -1.485 -8.312 1.00 62.01 H new ATOM 0 HB2 HIS A 31 -1.222 -1.719 -7.046 1.00 2.40 H new ATOM 0 HB3 HIS A 31 -0.497 -1.165 -8.541 1.00 2.40 H new ATOM 0 HD2 HIS A 31 -2.571 0.164 -5.574 1.00 3.34 H new ATOM 0 HE1 HIS A 31 -1.738 3.423 -8.121 1.00 24.42 H new ATOM 0 HE2 HIS A 31 -2.689 2.760 -5.852 1.00 43.22 H new ATOM 486 N PRO A 32 -3.671 -0.861 -10.807 1.00 5.03 N ATOM 487 CA PRO A 32 -3.810 -0.585 -12.275 1.00 43.44 C ATOM 488 C PRO A 32 -2.961 0.611 -12.801 1.00 24.01 C ATOM 489 O PRO A 32 -2.882 0.830 -14.015 1.00 70.50 O ATOM 490 CB PRO A 32 -5.334 -0.292 -12.423 1.00 70.53 C ATOM 491 CG PRO A 32 -5.747 0.236 -11.082 1.00 35.25 C ATOM 492 CD PRO A 32 -4.932 -0.536 -10.070 1.00 34.34 C ATOM 0 HA PRO A 32 -3.441 -1.422 -12.868 1.00 43.44 H new ATOM 0 HB2 PRO A 32 -5.523 0.436 -13.212 1.00 70.53 H new ATOM 0 HB3 PRO A 32 -5.888 -1.194 -12.682 1.00 70.53 H new ATOM 0 HG2 PRO A 32 -5.554 1.306 -11.006 1.00 35.25 H new ATOM 0 HG3 PRO A 32 -6.815 0.092 -10.917 1.00 35.25 H new ATOM 0 HD2 PRO A 32 -4.733 0.058 -9.178 1.00 34.34 H new ATOM 0 HD3 PRO A 32 -5.449 -1.438 -9.743 1.00 34.34 H new ATOM 500 N GLN A 33 -2.341 1.378 -11.887 1.00 50.33 N ATOM 501 CA GLN A 33 -1.662 2.659 -12.221 1.00 31.10 C ATOM 502 C GLN A 33 -0.114 2.597 -12.139 1.00 11.14 C ATOM 503 O GLN A 33 0.556 3.568 -12.508 1.00 20.01 O ATOM 504 CB GLN A 33 -2.234 3.750 -11.279 1.00 13.32 C ATOM 505 CG GLN A 33 -3.737 4.068 -11.525 1.00 73.01 C ATOM 506 CD GLN A 33 -4.481 4.622 -10.305 1.00 33.21 C ATOM 507 OE1 GLN A 33 -5.374 5.450 -10.429 1.00 20.43 O ATOM 508 NE2 GLN A 33 -4.184 4.099 -9.127 1.00 42.52 N ATOM 0 H GLN A 33 -2.292 1.135 -10.897 1.00 50.33 H new ATOM 0 HA GLN A 33 -1.866 2.892 -13.266 1.00 31.10 H new ATOM 0 HB2 GLN A 33 -2.105 3.428 -10.246 1.00 13.32 H new ATOM 0 HB3 GLN A 33 -1.654 4.664 -11.403 1.00 13.32 H new ATOM 0 HG2 GLN A 33 -3.814 4.789 -12.339 1.00 73.01 H new ATOM 0 HG3 GLN A 33 -4.237 3.158 -11.857 1.00 73.01 H new ATOM 0 HE21 GLN A 33 -3.435 3.411 -9.049 1.00 42.52 H new ATOM 0 HE22 GLN A 33 -4.704 4.384 -8.297 1.00 42.52 H new ATOM 517 N VAL A 34 0.459 1.479 -11.653 1.00 50.34 N ATOM 518 CA VAL A 34 1.936 1.309 -11.596 1.00 54.15 C ATOM 519 C VAL A 34 2.542 0.905 -12.970 1.00 34.34 C ATOM 520 O VAL A 34 2.081 -0.041 -13.609 1.00 45.32 O ATOM 521 CB VAL A 34 2.335 0.244 -10.514 1.00 35.02 C ATOM 522 CG1 VAL A 34 3.873 0.045 -10.445 1.00 71.42 C ATOM 523 CG2 VAL A 34 1.743 0.626 -9.140 1.00 11.11 C ATOM 0 H VAL A 34 -0.068 0.682 -11.295 1.00 50.34 H new ATOM 0 HA VAL A 34 2.347 2.280 -11.322 1.00 54.15 H new ATOM 0 HB VAL A 34 1.910 -0.716 -10.809 1.00 35.02 H new ATOM 0 HG11 VAL A 34 4.110 -0.699 -9.685 1.00 71.42 H new ATOM 0 HG12 VAL A 34 4.240 -0.296 -11.413 1.00 71.42 H new ATOM 0 HG13 VAL A 34 4.351 0.990 -10.188 1.00 71.42 H new ATOM 0 HG21 VAL A 34 2.028 -0.122 -8.400 1.00 11.11 H new ATOM 0 HG22 VAL A 34 2.126 1.601 -8.837 1.00 11.11 H new ATOM 0 HG23 VAL A 34 0.656 0.669 -9.211 1.00 11.11 H new ATOM 533 N SER A 35 3.619 1.617 -13.383 1.00 21.22 N ATOM 534 CA SER A 35 4.395 1.323 -14.624 1.00 61.43 C ATOM 535 C SER A 35 5.611 0.390 -14.341 1.00 52.00 C ATOM 536 O SER A 35 6.653 0.499 -14.996 1.00 3.44 O ATOM 537 CB SER A 35 4.873 2.655 -15.251 1.00 32.02 C ATOM 538 OG SER A 35 3.779 3.475 -15.620 1.00 53.33 O ATOM 0 H SER A 35 3.980 2.418 -12.864 1.00 21.22 H new ATOM 0 HA SER A 35 3.742 0.797 -15.321 1.00 61.43 H new ATOM 0 HB2 SER A 35 5.505 3.187 -14.540 1.00 32.02 H new ATOM 0 HB3 SER A 35 5.486 2.447 -16.128 1.00 32.02 H new ATOM 0 HG SER A 35 4.113 4.309 -16.011 1.00 53.33 H new ATOM 544 N ALA A 36 5.422 -0.537 -13.376 1.00 65.33 N ATOM 545 CA ALA A 36 6.427 -1.543 -12.923 1.00 60.42 C ATOM 546 C ALA A 36 7.656 -0.908 -12.188 1.00 70.21 C ATOM 547 O ALA A 36 8.321 -0.019 -12.729 1.00 2.21 O ATOM 548 CB ALA A 36 6.874 -2.463 -14.078 1.00 70.11 C ATOM 0 H ALA A 36 4.540 -0.614 -12.870 1.00 65.33 H new ATOM 0 HA ALA A 36 5.917 -2.158 -12.181 1.00 60.42 H new ATOM 0 HB1 ALA A 36 7.606 -3.182 -13.709 1.00 70.11 H new ATOM 0 HB2 ALA A 36 6.010 -2.996 -14.474 1.00 70.11 H new ATOM 0 HB3 ALA A 36 7.323 -1.862 -14.869 1.00 70.11 H new ATOM 554 N PRO A 37 7.983 -1.368 -10.929 1.00 53.43 N ATOM 555 CA PRO A 37 9.127 -0.831 -10.150 1.00 61.35 C ATOM 556 C PRO A 37 10.497 -1.499 -10.494 1.00 73.23 C ATOM 557 O PRO A 37 10.557 -2.676 -10.866 1.00 74.24 O ATOM 558 CB PRO A 37 8.689 -1.129 -8.699 1.00 63.32 C ATOM 559 CG PRO A 37 7.913 -2.412 -8.786 1.00 32.31 C ATOM 560 CD PRO A 37 7.265 -2.432 -10.165 1.00 72.11 C ATOM 0 HA PRO A 37 9.317 0.222 -10.358 1.00 61.35 H new ATOM 0 HB2 PRO A 37 9.551 -1.232 -8.039 1.00 63.32 H new ATOM 0 HB3 PRO A 37 8.075 -0.322 -8.298 1.00 63.32 H new ATOM 0 HG2 PRO A 37 8.569 -3.272 -8.653 1.00 32.31 H new ATOM 0 HG3 PRO A 37 7.158 -2.463 -8.002 1.00 32.31 H new ATOM 0 HD2 PRO A 37 7.375 -3.406 -10.642 1.00 72.11 H new ATOM 0 HD3 PRO A 37 6.196 -2.225 -10.105 1.00 72.11 H new ATOM 568 N THR A 38 11.587 -0.719 -10.354 1.00 54.23 N ATOM 569 CA THR A 38 12.980 -1.197 -10.556 1.00 63.42 C ATOM 570 C THR A 38 13.689 -1.321 -9.191 1.00 55.11 C ATOM 571 O THR A 38 13.841 -0.323 -8.478 1.00 73.33 O ATOM 572 CB THR A 38 13.785 -0.241 -11.498 1.00 42.42 C ATOM 573 OG1 THR A 38 13.158 -0.213 -12.793 1.00 41.42 O ATOM 574 CG2 THR A 38 15.265 -0.664 -11.656 1.00 51.24 C ATOM 0 H THR A 38 11.531 0.266 -10.096 1.00 54.23 H new ATOM 0 HA THR A 38 12.938 -2.175 -11.036 1.00 63.42 H new ATOM 0 HB THR A 38 13.778 0.748 -11.040 1.00 42.42 H new ATOM 0 HG1 THR A 38 13.800 0.108 -13.460 1.00 41.42 H new ATOM 0 HG21 THR A 38 15.774 0.035 -12.320 1.00 51.24 H new ATOM 0 HG22 THR A 38 15.751 -0.658 -10.681 1.00 51.24 H new ATOM 0 HG23 THR A 38 15.313 -1.667 -12.079 1.00 51.24 H new ATOM 582 N LEU A 39 14.143 -2.541 -8.854 1.00 21.35 N ATOM 583 CA LEU A 39 14.605 -2.884 -7.486 1.00 65.12 C ATOM 584 C LEU A 39 16.116 -2.661 -7.296 1.00 73.30 C ATOM 585 O LEU A 39 16.930 -2.985 -8.166 1.00 73.13 O ATOM 586 CB LEU A 39 14.175 -4.341 -7.110 1.00 54.14 C ATOM 587 CG LEU A 39 12.802 -4.459 -6.375 1.00 3.44 C ATOM 588 CD1 LEU A 39 12.891 -3.880 -4.947 1.00 23.33 C ATOM 589 CD2 LEU A 39 11.674 -3.778 -7.182 1.00 44.34 C ATOM 0 H LEU A 39 14.202 -3.317 -9.514 1.00 21.35 H new ATOM 0 HA LEU A 39 14.115 -2.197 -6.795 1.00 65.12 H new ATOM 0 HB2 LEU A 39 14.134 -4.937 -8.021 1.00 54.14 H new ATOM 0 HB3 LEU A 39 14.947 -4.779 -6.477 1.00 54.14 H new ATOM 0 HG LEU A 39 12.556 -5.518 -6.295 1.00 3.44 H new ATOM 0 HD11 LEU A 39 11.923 -3.974 -4.455 1.00 23.33 H new ATOM 0 HD12 LEU A 39 13.641 -4.429 -4.378 1.00 23.33 H new ATOM 0 HD13 LEU A 39 13.172 -2.828 -4.998 1.00 23.33 H new ATOM 0 HD21 LEU A 39 10.731 -3.877 -6.644 1.00 44.34 H new ATOM 0 HD22 LEU A 39 11.907 -2.721 -7.313 1.00 44.34 H new ATOM 0 HD23 LEU A 39 11.587 -4.254 -8.159 1.00 44.34 H new ATOM 601 N ARG A 40 16.452 -2.089 -6.128 1.00 72.35 N ATOM 602 CA ARG A 40 17.818 -1.715 -5.730 1.00 70.21 C ATOM 603 C ARG A 40 18.122 -2.267 -4.320 1.00 24.42 C ATOM 604 O ARG A 40 17.195 -2.613 -3.577 1.00 0.13 O ATOM 605 CB ARG A 40 17.981 -0.163 -5.734 1.00 10.53 C ATOM 606 CG ARG A 40 17.457 0.549 -7.008 1.00 22.32 C ATOM 607 CD ARG A 40 17.926 2.014 -7.126 1.00 13.13 C ATOM 608 NE ARG A 40 17.399 2.881 -6.049 1.00 72.44 N ATOM 609 CZ ARG A 40 18.122 3.646 -5.254 1.00 74.04 C ATOM 610 NH1 ARG A 40 19.415 3.569 -5.226 1.00 62.23 N ATOM 611 NH2 ARG A 40 17.532 4.449 -4.442 1.00 50.01 N ATOM 0 H ARG A 40 15.759 -1.868 -5.413 1.00 72.35 H new ATOM 0 HA ARG A 40 18.520 -2.143 -6.446 1.00 70.21 H new ATOM 0 HB2 ARG A 40 17.459 0.244 -4.868 1.00 10.53 H new ATOM 0 HB3 ARG A 40 19.037 0.076 -5.611 1.00 10.53 H new ATOM 0 HG2 ARG A 40 17.789 -0.003 -7.887 1.00 22.32 H new ATOM 0 HG3 ARG A 40 16.367 0.523 -7.008 1.00 22.32 H new ATOM 0 HD2 ARG A 40 19.015 2.043 -7.107 1.00 13.13 H new ATOM 0 HD3 ARG A 40 17.613 2.413 -8.091 1.00 13.13 H new ATOM 0 HE ARG A 40 16.389 2.888 -5.909 1.00 72.44 H new ATOM 0 HH11 ARG A 40 19.899 2.904 -5.829 1.00 62.23 H new ATOM 0 HH12 ARG A 40 19.948 4.173 -4.601 1.00 62.23 H new ATOM 0 HH21 ARG A 40 16.513 4.491 -4.416 1.00 50.01 H new ATOM 0 HH22 ARG A 40 18.083 5.044 -3.823 1.00 50.01 H new ATOM 625 N GLY A 41 19.418 -2.276 -3.953 1.00 11.02 N ATOM 626 CA GLY A 41 19.890 -2.779 -2.646 1.00 41.13 C ATOM 627 C GLY A 41 19.388 -4.188 -2.253 1.00 13.24 C ATOM 628 O GLY A 41 19.155 -5.038 -3.125 1.00 43.32 O ATOM 0 H GLY A 41 20.168 -1.935 -4.554 1.00 11.02 H new ATOM 0 HA2 GLY A 41 20.980 -2.790 -2.653 1.00 41.13 H new ATOM 0 HA3 GLY A 41 19.583 -2.074 -1.873 1.00 41.13 H new ATOM 632 N ALA A 42 19.258 -4.446 -0.940 1.00 42.33 N ATOM 633 CA ALA A 42 19.086 -5.816 -0.399 1.00 4.43 C ATOM 634 C ALA A 42 17.616 -6.307 -0.452 1.00 72.34 C ATOM 635 O ALA A 42 16.864 -6.064 0.486 1.00 13.22 O ATOM 636 CB ALA A 42 19.630 -5.884 1.046 1.00 32.40 C ATOM 0 H ALA A 42 19.268 -3.720 -0.224 1.00 42.33 H new ATOM 0 HA ALA A 42 19.659 -6.488 -1.038 1.00 4.43 H new ATOM 0 HB1 ALA A 42 19.500 -6.893 1.437 1.00 32.40 H new ATOM 0 HB2 ALA A 42 20.689 -5.627 1.048 1.00 32.40 H new ATOM 0 HB3 ALA A 42 19.085 -5.179 1.674 1.00 32.40 H new ATOM 642 N SER A 43 17.231 -6.914 -1.605 1.00 73.50 N ATOM 643 CA SER A 43 16.031 -7.811 -1.766 1.00 2.43 C ATOM 644 C SER A 43 14.640 -7.171 -1.412 1.00 72.25 C ATOM 645 O SER A 43 14.468 -6.597 -0.342 1.00 74.42 O ATOM 646 CB SER A 43 16.229 -9.121 -0.956 1.00 45.55 C ATOM 647 OG SER A 43 15.101 -9.989 -1.040 1.00 1.02 O ATOM 0 H SER A 43 17.751 -6.798 -2.475 1.00 73.50 H new ATOM 0 HA SER A 43 15.982 -8.010 -2.837 1.00 2.43 H new ATOM 0 HB2 SER A 43 17.113 -9.642 -1.324 1.00 45.55 H new ATOM 0 HB3 SER A 43 16.417 -8.874 0.089 1.00 45.55 H new ATOM 0 HG SER A 43 15.272 -10.800 -0.517 1.00 1.02 H new ATOM 653 N PRO A 44 13.586 -7.339 -2.288 1.00 5.03 N ATOM 654 CA PRO A 44 12.201 -6.837 -2.008 1.00 12.23 C ATOM 655 C PRO A 44 11.546 -7.446 -0.724 1.00 43.24 C ATOM 656 O PRO A 44 10.547 -6.929 -0.229 1.00 0.21 O ATOM 657 CB PRO A 44 11.410 -7.247 -3.282 1.00 41.02 C ATOM 658 CG PRO A 44 12.210 -8.359 -3.881 1.00 74.43 C ATOM 659 CD PRO A 44 13.652 -8.001 -3.620 1.00 31.22 C ATOM 0 HA PRO A 44 12.205 -5.766 -1.807 1.00 12.23 H new ATOM 0 HB2 PRO A 44 10.400 -7.574 -3.034 1.00 41.02 H new ATOM 0 HB3 PRO A 44 11.313 -6.411 -3.974 1.00 41.02 H new ATOM 0 HG2 PRO A 44 11.954 -9.316 -3.426 1.00 74.43 H new ATOM 0 HG3 PRO A 44 12.015 -8.452 -4.949 1.00 74.43 H new ATOM 0 HD2 PRO A 44 14.292 -8.883 -3.603 1.00 31.22 H new ATOM 0 HD3 PRO A 44 14.049 -7.334 -4.385 1.00 31.22 H new ATOM 667 N HIS A 45 12.094 -8.559 -0.205 1.00 54.22 N ATOM 668 CA HIS A 45 11.602 -9.188 1.056 1.00 5.23 C ATOM 669 C HIS A 45 12.665 -9.114 2.190 1.00 35.45 C ATOM 670 O HIS A 45 12.591 -9.866 3.170 1.00 20.13 O ATOM 671 CB HIS A 45 11.155 -10.647 0.780 1.00 20.10 C ATOM 672 CG HIS A 45 9.913 -10.755 -0.073 1.00 42.45 C ATOM 673 ND1 HIS A 45 8.664 -11.013 0.454 1.00 33.30 N ATOM 674 CD2 HIS A 45 9.723 -10.634 -1.410 1.00 11.43 C ATOM 675 CE1 HIS A 45 7.776 -11.054 -0.515 1.00 11.21 C ATOM 676 NE2 HIS A 45 8.388 -10.822 -1.653 1.00 11.13 N ATOM 0 H HIS A 45 12.879 -9.050 -0.632 1.00 54.22 H new ATOM 0 HA HIS A 45 10.737 -8.625 1.407 1.00 5.23 H new ATOM 0 HB2 HIS A 45 11.969 -11.179 0.288 1.00 20.10 H new ATOM 0 HB3 HIS A 45 10.975 -11.148 1.731 1.00 20.10 H new ATOM 0 HD2 HIS A 45 10.484 -10.427 -2.148 1.00 11.43 H new ATOM 0 HE1 HIS A 45 6.720 -11.246 -0.395 1.00 11.21 H new ATOM 0 HE2 HIS A 45 7.942 -10.787 -2.570 1.00 11.13 H new ATOM 685 N THR A 46 13.626 -8.185 2.056 1.00 2.15 N ATOM 686 CA THR A 46 14.622 -7.867 3.116 1.00 63.13 C ATOM 687 C THR A 46 14.552 -6.351 3.450 1.00 54.31 C ATOM 688 O THR A 46 14.689 -5.529 2.538 1.00 61.13 O ATOM 689 CB THR A 46 16.079 -8.246 2.677 1.00 13.13 C ATOM 690 OG1 THR A 46 16.168 -9.656 2.430 1.00 15.10 O ATOM 691 CG2 THR A 46 17.147 -7.855 3.718 1.00 4.03 C ATOM 0 H THR A 46 13.742 -7.627 1.210 1.00 2.15 H new ATOM 0 HA THR A 46 14.378 -8.458 3.999 1.00 63.13 H new ATOM 0 HB THR A 46 16.281 -7.680 1.768 1.00 13.13 H new ATOM 0 HG1 THR A 46 17.081 -9.883 2.155 1.00 15.10 H new ATOM 0 HG21 THR A 46 18.133 -8.144 3.354 1.00 4.03 H new ATOM 0 HG22 THR A 46 17.121 -6.777 3.878 1.00 4.03 H new ATOM 0 HG23 THR A 46 16.943 -8.367 4.659 1.00 4.03 H new ATOM 699 N PRO A 47 14.303 -5.957 4.751 1.00 55.23 N ATOM 700 CA PRO A 47 14.250 -4.523 5.190 1.00 41.55 C ATOM 701 C PRO A 47 15.517 -3.694 4.817 1.00 31.35 C ATOM 702 O PRO A 47 16.491 -3.637 5.582 1.00 34.34 O ATOM 703 CB PRO A 47 14.069 -4.631 6.731 1.00 52.13 C ATOM 704 CG PRO A 47 13.415 -5.958 6.938 1.00 24.32 C ATOM 705 CD PRO A 47 14.012 -6.870 5.892 1.00 32.10 C ATOM 0 HA PRO A 47 13.448 -3.982 4.687 1.00 41.55 H new ATOM 0 HB2 PRO A 47 15.027 -4.576 7.248 1.00 52.13 H new ATOM 0 HB3 PRO A 47 13.451 -3.820 7.116 1.00 52.13 H new ATOM 0 HG2 PRO A 47 13.604 -6.336 7.943 1.00 24.32 H new ATOM 0 HG3 PRO A 47 12.334 -5.885 6.824 1.00 24.32 H new ATOM 0 HD2 PRO A 47 14.917 -7.358 6.255 1.00 32.10 H new ATOM 0 HD3 PRO A 47 13.317 -7.660 5.606 1.00 32.10 H new ATOM 713 N GLY A 48 15.497 -3.091 3.610 1.00 15.31 N ATOM 714 CA GLY A 48 16.625 -2.298 3.090 1.00 23.11 C ATOM 715 C GLY A 48 16.766 -2.400 1.567 1.00 5.32 C ATOM 716 O GLY A 48 17.857 -2.679 1.051 1.00 4.33 O ATOM 0 H GLY A 48 14.702 -3.141 2.973 1.00 15.31 H new ATOM 0 HA2 GLY A 48 16.489 -1.253 3.369 1.00 23.11 H new ATOM 0 HA3 GLY A 48 17.549 -2.636 3.560 1.00 23.11 H new ATOM 720 N ALA A 49 15.652 -2.160 0.846 1.00 3.15 N ATOM 721 CA ALA A 49 15.604 -2.209 -0.640 1.00 51.05 C ATOM 722 C ALA A 49 14.759 -1.050 -1.204 1.00 42.42 C ATOM 723 O ALA A 49 13.771 -0.654 -0.597 1.00 64.35 O ATOM 724 CB ALA A 49 15.034 -3.558 -1.109 1.00 34.15 C ATOM 0 H ALA A 49 14.756 -1.926 1.273 1.00 3.15 H new ATOM 0 HA ALA A 49 16.621 -2.103 -1.016 1.00 51.05 H new ATOM 0 HB1 ALA A 49 15.004 -3.581 -2.198 1.00 34.15 H new ATOM 0 HB2 ALA A 49 15.668 -4.367 -0.746 1.00 34.15 H new ATOM 0 HB3 ALA A 49 14.025 -3.683 -0.716 1.00 34.15 H new ATOM 730 N GLU A 50 15.149 -0.510 -2.372 1.00 1.22 N ATOM 731 CA GLU A 50 14.428 0.612 -3.034 1.00 24.31 C ATOM 732 C GLU A 50 13.728 0.105 -4.307 1.00 52.15 C ATOM 733 O GLU A 50 14.181 -0.855 -4.916 1.00 43.32 O ATOM 734 CB GLU A 50 15.396 1.779 -3.407 1.00 2.33 C ATOM 735 CG GLU A 50 16.224 2.382 -2.242 1.00 60.45 C ATOM 736 CD GLU A 50 17.365 1.471 -1.741 1.00 2.21 C ATOM 737 OE1 GLU A 50 18.298 1.195 -2.527 1.00 73.14 O ATOM 738 OE2 GLU A 50 17.343 1.040 -0.568 1.00 21.33 O ATOM 0 H GLU A 50 15.968 -0.831 -2.888 1.00 1.22 H new ATOM 0 HA GLU A 50 13.690 0.993 -2.328 1.00 24.31 H new ATOM 0 HB2 GLU A 50 16.088 1.420 -4.169 1.00 2.33 H new ATOM 0 HB3 GLU A 50 14.810 2.578 -3.860 1.00 2.33 H new ATOM 0 HG2 GLU A 50 16.648 3.332 -2.566 1.00 60.45 H new ATOM 0 HG3 GLU A 50 15.555 2.599 -1.409 1.00 60.45 H new ATOM 745 N ARG A 51 12.638 0.760 -4.715 1.00 41.32 N ATOM 746 CA ARG A 51 11.912 0.409 -5.955 1.00 74.12 C ATOM 747 C ARG A 51 11.456 1.700 -6.681 1.00 41.34 C ATOM 748 O ARG A 51 10.825 2.588 -6.086 1.00 64.21 O ATOM 749 CB ARG A 51 10.727 -0.547 -5.626 1.00 62.31 C ATOM 750 CG ARG A 51 9.632 0.080 -4.760 1.00 54.50 C ATOM 751 CD ARG A 51 8.627 -0.920 -4.182 1.00 20.25 C ATOM 752 NE ARG A 51 7.846 -1.661 -5.167 1.00 24.20 N ATOM 753 CZ ARG A 51 6.709 -2.262 -4.900 1.00 63.34 C ATOM 754 NH1 ARG A 51 6.010 -1.946 -3.846 1.00 65.23 N ATOM 755 NH2 ARG A 51 6.261 -3.159 -5.710 1.00 21.51 N ATOM 0 H ARG A 51 12.230 1.544 -4.205 1.00 41.32 H new ATOM 0 HA ARG A 51 12.573 -0.126 -6.636 1.00 74.12 H new ATOM 0 HB2 ARG A 51 10.283 -0.890 -6.560 1.00 62.31 H new ATOM 0 HB3 ARG A 51 11.117 -1.428 -5.116 1.00 62.31 H new ATOM 0 HG2 ARG A 51 10.102 0.620 -3.938 1.00 54.50 H new ATOM 0 HG3 ARG A 51 9.091 0.815 -5.356 1.00 54.50 H new ATOM 0 HD2 ARG A 51 9.167 -1.634 -3.560 1.00 20.25 H new ATOM 0 HD3 ARG A 51 7.940 -0.383 -3.528 1.00 20.25 H new ATOM 0 HE ARG A 51 8.205 -1.716 -6.120 1.00 24.20 H new ATOM 0 HH11 ARG A 51 6.344 -1.220 -3.211 1.00 65.23 H new ATOM 0 HH12 ARG A 51 5.129 -2.424 -3.656 1.00 65.23 H new ATOM 0 HH21 ARG A 51 6.789 -3.397 -6.550 1.00 21.51 H new ATOM 0 HH22 ARG A 51 5.379 -3.631 -5.511 1.00 21.51 H new ATOM 769 N VAL A 52 11.836 1.821 -7.965 1.00 1.24 N ATOM 770 CA VAL A 52 11.603 3.031 -8.780 1.00 31.11 C ATOM 771 C VAL A 52 10.523 2.742 -9.855 1.00 64.30 C ATOM 772 O VAL A 52 10.802 2.089 -10.867 1.00 43.31 O ATOM 773 CB VAL A 52 12.953 3.511 -9.448 1.00 2.02 C ATOM 774 CG1 VAL A 52 12.780 4.878 -10.152 1.00 73.10 C ATOM 775 CG2 VAL A 52 14.112 3.553 -8.412 1.00 4.32 C ATOM 0 H VAL A 52 12.317 1.078 -8.472 1.00 1.24 H new ATOM 0 HA VAL A 52 11.243 3.833 -8.136 1.00 31.11 H new ATOM 0 HB VAL A 52 13.219 2.780 -10.212 1.00 2.02 H new ATOM 0 HG11 VAL A 52 13.727 5.179 -10.601 1.00 73.10 H new ATOM 0 HG12 VAL A 52 12.021 4.793 -10.930 1.00 73.10 H new ATOM 0 HG13 VAL A 52 12.470 5.626 -9.422 1.00 73.10 H new ATOM 0 HG21 VAL A 52 15.026 3.887 -8.902 1.00 4.32 H new ATOM 0 HG22 VAL A 52 13.857 4.245 -7.609 1.00 4.32 H new ATOM 0 HG23 VAL A 52 14.266 2.557 -7.997 1.00 4.32 H new ATOM 785 N PHE A 53 9.285 3.199 -9.584 1.00 13.10 N ATOM 786 CA PHE A 53 8.089 2.962 -10.436 1.00 75.45 C ATOM 787 C PHE A 53 8.238 3.606 -11.833 1.00 62.43 C ATOM 788 O PHE A 53 7.798 4.733 -12.042 1.00 55.35 O ATOM 789 CB PHE A 53 6.804 3.512 -9.730 1.00 70.42 C ATOM 790 CG PHE A 53 6.304 2.742 -8.501 1.00 55.11 C ATOM 791 CD1 PHE A 53 7.177 2.112 -7.617 1.00 35.20 C ATOM 792 CD2 PHE A 53 4.936 2.653 -8.234 1.00 20.50 C ATOM 793 CE1 PHE A 53 6.700 1.419 -6.524 1.00 40.42 C ATOM 794 CE2 PHE A 53 4.467 1.961 -7.138 1.00 4.52 C ATOM 795 CZ PHE A 53 5.345 1.343 -6.286 1.00 42.51 C ATOM 0 H PHE A 53 9.078 3.754 -8.754 1.00 13.10 H new ATOM 0 HA PHE A 53 7.996 1.885 -10.575 1.00 75.45 H new ATOM 0 HB2 PHE A 53 6.996 4.542 -9.430 1.00 70.42 H new ATOM 0 HB3 PHE A 53 5.999 3.539 -10.464 1.00 70.42 H new ATOM 0 HD1 PHE A 53 8.242 2.167 -7.790 1.00 35.20 H new ATOM 0 HD2 PHE A 53 4.233 3.135 -8.898 1.00 20.50 H new ATOM 0 HE1 PHE A 53 7.392 0.934 -5.852 1.00 40.42 H new ATOM 0 HE2 PHE A 53 3.405 1.906 -6.950 1.00 4.52 H new ATOM 0 HZ PHE A 53 4.976 0.798 -5.430 1.00 42.51 H new ATOM 805 N GLY A 54 8.876 2.883 -12.769 1.00 20.44 N ATOM 806 CA GLY A 54 9.149 3.383 -14.119 1.00 51.12 C ATOM 807 C GLY A 54 10.635 3.289 -14.476 1.00 33.01 C ATOM 808 O GLY A 54 11.015 2.601 -15.432 1.00 61.13 O ATOM 0 H GLY A 54 9.216 1.935 -12.607 1.00 20.44 H new ATOM 0 HA2 GLY A 54 8.566 2.812 -14.842 1.00 51.12 H new ATOM 0 HA3 GLY A 54 8.823 4.420 -14.194 1.00 51.12 H new ATOM 812 N ALA A 55 11.466 3.985 -13.666 1.00 35.32 N ATOM 813 CA ALA A 55 12.924 4.171 -13.880 1.00 53.24 C ATOM 814 C ALA A 55 13.276 4.738 -15.286 1.00 23.44 C ATOM 815 O ALA A 55 13.465 3.978 -16.247 1.00 1.33 O ATOM 816 CB ALA A 55 13.698 2.878 -13.569 1.00 62.31 C ATOM 0 H ALA A 55 11.133 4.447 -12.820 1.00 35.32 H new ATOM 0 HA ALA A 55 13.245 4.935 -13.172 1.00 53.24 H new ATOM 0 HB1 ALA A 55 14.763 3.043 -13.734 1.00 62.31 H new ATOM 0 HB2 ALA A 55 13.531 2.595 -12.530 1.00 62.31 H new ATOM 0 HB3 ALA A 55 13.349 2.079 -14.223 1.00 62.31 H new ATOM 822 N GLY A 56 13.320 6.085 -15.410 1.00 20.44 N ATOM 823 CA GLY A 56 13.721 6.739 -16.673 1.00 71.21 C ATOM 824 C GLY A 56 13.205 8.176 -16.853 1.00 3.34 C ATOM 825 O GLY A 56 13.751 8.930 -17.667 1.00 21.45 O ATOM 0 H GLY A 56 13.085 6.733 -14.658 1.00 20.44 H new ATOM 0 HA2 GLY A 56 14.809 6.750 -16.729 1.00 71.21 H new ATOM 0 HA3 GLY A 56 13.365 6.134 -17.507 1.00 71.21 H new ATOM 829 N THR A 57 12.150 8.558 -16.109 1.00 3.44 N ATOM 830 CA THR A 57 11.489 9.891 -16.249 1.00 60.12 C ATOM 831 C THR A 57 11.851 10.829 -15.076 1.00 44.24 C ATOM 832 O THR A 57 12.448 10.409 -14.075 1.00 43.14 O ATOM 833 CB THR A 57 9.915 9.783 -16.341 1.00 52.22 C ATOM 834 OG1 THR A 57 9.327 9.658 -15.029 1.00 15.02 O ATOM 835 CG2 THR A 57 9.464 8.592 -17.209 1.00 70.12 C ATOM 0 H THR A 57 11.726 7.964 -15.396 1.00 3.44 H new ATOM 0 HA THR A 57 11.865 10.307 -17.184 1.00 60.12 H new ATOM 0 HB THR A 57 9.571 10.704 -16.811 1.00 52.22 H new ATOM 0 HG1 THR A 57 8.353 9.594 -15.112 1.00 15.02 H new ATOM 0 HG21 THR A 57 8.375 8.558 -17.243 1.00 70.12 H new ATOM 0 HG22 THR A 57 9.855 8.710 -18.220 1.00 70.12 H new ATOM 0 HG23 THR A 57 9.843 7.665 -16.779 1.00 70.12 H new ATOM 843 N GLU A 58 11.439 12.107 -15.205 1.00 40.10 N ATOM 844 CA GLU A 58 11.676 13.161 -14.188 1.00 12.32 C ATOM 845 C GLU A 58 10.504 13.281 -13.164 1.00 4.31 C ATOM 846 O GLU A 58 10.504 14.190 -12.323 1.00 31.20 O ATOM 847 CB GLU A 58 11.916 14.522 -14.910 1.00 11.41 C ATOM 848 CG GLU A 58 10.716 15.028 -15.748 1.00 31.13 C ATOM 849 CD GLU A 58 11.026 16.315 -16.536 1.00 1.53 C ATOM 850 OE1 GLU A 58 11.034 17.407 -15.927 1.00 23.55 O ATOM 851 OE2 GLU A 58 11.274 16.238 -17.761 1.00 71.52 O ATOM 0 H GLU A 58 10.929 12.442 -16.022 1.00 40.10 H new ATOM 0 HA GLU A 58 12.559 12.882 -13.613 1.00 12.32 H new ATOM 0 HB2 GLU A 58 12.164 15.276 -14.163 1.00 11.41 H new ATOM 0 HB3 GLU A 58 12.783 14.424 -15.563 1.00 11.41 H new ATOM 0 HG2 GLU A 58 10.413 14.247 -16.445 1.00 31.13 H new ATOM 0 HG3 GLU A 58 9.870 15.210 -15.086 1.00 31.13 H new ATOM 858 N GLU A 59 9.521 12.354 -13.224 1.00 25.22 N ATOM 859 CA GLU A 59 8.341 12.351 -12.309 1.00 73.43 C ATOM 860 C GLU A 59 8.075 10.910 -11.762 1.00 52.34 C ATOM 861 O GLU A 59 6.938 10.525 -11.464 1.00 70.52 O ATOM 862 CB GLU A 59 7.096 12.934 -13.064 1.00 60.50 C ATOM 863 CG GLU A 59 5.919 13.359 -12.150 1.00 44.00 C ATOM 864 CD GLU A 59 4.705 13.897 -12.928 1.00 73.44 C ATOM 865 OE1 GLU A 59 3.843 13.087 -13.344 1.00 62.40 O ATOM 866 OE2 GLU A 59 4.602 15.127 -13.134 1.00 55.14 O ATOM 0 H GLU A 59 9.516 11.590 -13.900 1.00 25.22 H new ATOM 0 HA GLU A 59 8.542 12.986 -11.446 1.00 73.43 H new ATOM 0 HB2 GLU A 59 7.415 13.798 -13.647 1.00 60.50 H new ATOM 0 HB3 GLU A 59 6.736 12.187 -13.772 1.00 60.50 H new ATOM 0 HG2 GLU A 59 5.607 12.504 -11.550 1.00 44.00 H new ATOM 0 HG3 GLU A 59 6.265 14.125 -11.456 1.00 44.00 H new ATOM 873 N GLU A 60 9.161 10.135 -11.607 1.00 40.30 N ATOM 874 CA GLU A 60 9.115 8.750 -11.092 1.00 53.12 C ATOM 875 C GLU A 60 8.765 8.685 -9.580 1.00 33.32 C ATOM 876 O GLU A 60 9.082 9.602 -8.817 1.00 75.15 O ATOM 877 CB GLU A 60 10.477 8.025 -11.383 1.00 54.23 C ATOM 878 CG GLU A 60 10.335 6.685 -12.115 1.00 22.00 C ATOM 879 CD GLU A 60 9.767 6.816 -13.542 1.00 1.44 C ATOM 880 OE1 GLU A 60 8.546 7.020 -13.710 1.00 12.11 O ATOM 881 OE2 GLU A 60 10.533 6.696 -14.508 1.00 11.13 O ATOM 0 H GLU A 60 10.103 10.451 -11.836 1.00 40.30 H new ATOM 0 HA GLU A 60 8.312 8.233 -11.617 1.00 53.12 H new ATOM 0 HB2 GLU A 60 11.107 8.686 -11.978 1.00 54.23 H new ATOM 0 HB3 GLU A 60 10.995 7.857 -10.439 1.00 54.23 H new ATOM 0 HG2 GLU A 60 11.311 6.203 -12.165 1.00 22.00 H new ATOM 0 HG3 GLU A 60 9.686 6.030 -11.534 1.00 22.00 H new ATOM 888 N LEU A 61 8.124 7.569 -9.167 1.00 41.11 N ATOM 889 CA LEU A 61 7.740 7.318 -7.756 1.00 13.41 C ATOM 890 C LEU A 61 8.719 6.313 -7.105 1.00 0.32 C ATOM 891 O LEU A 61 8.783 5.153 -7.504 1.00 61.44 O ATOM 892 CB LEU A 61 6.281 6.793 -7.667 1.00 22.03 C ATOM 893 CG LEU A 61 5.735 6.549 -6.217 1.00 44.42 C ATOM 894 CD1 LEU A 61 5.742 7.854 -5.378 1.00 62.31 C ATOM 895 CD2 LEU A 61 4.331 5.895 -6.248 1.00 20.11 C ATOM 0 H LEU A 61 7.857 6.816 -9.801 1.00 41.11 H new ATOM 0 HA LEU A 61 7.795 8.261 -7.212 1.00 13.41 H new ATOM 0 HB2 LEU A 61 5.626 7.507 -8.167 1.00 22.03 H new ATOM 0 HB3 LEU A 61 6.216 5.857 -8.222 1.00 22.03 H new ATOM 0 HG LEU A 61 6.410 5.849 -5.725 1.00 44.42 H new ATOM 0 HD11 LEU A 61 5.357 7.647 -4.379 1.00 62.31 H new ATOM 0 HD12 LEU A 61 6.761 8.233 -5.303 1.00 62.31 H new ATOM 0 HD13 LEU A 61 5.112 8.601 -5.862 1.00 62.31 H new ATOM 0 HD21 LEU A 61 3.980 5.739 -5.228 1.00 20.11 H new ATOM 0 HD22 LEU A 61 3.636 6.549 -6.775 1.00 20.11 H new ATOM 0 HD23 LEU A 61 4.388 4.936 -6.763 1.00 20.11 H new ATOM 907 N VAL A 62 9.491 6.772 -6.099 1.00 12.03 N ATOM 908 CA VAL A 62 10.506 5.936 -5.407 1.00 33.15 C ATOM 909 C VAL A 62 10.111 5.708 -3.926 1.00 3.10 C ATOM 910 O VAL A 62 10.047 6.662 -3.140 1.00 24.33 O ATOM 911 CB VAL A 62 11.946 6.580 -5.476 1.00 52.14 C ATOM 912 CG1 VAL A 62 13.024 5.626 -4.880 1.00 53.34 C ATOM 913 CG2 VAL A 62 12.306 6.999 -6.928 1.00 10.14 C ATOM 0 H VAL A 62 9.433 7.726 -5.742 1.00 12.03 H new ATOM 0 HA VAL A 62 10.536 4.978 -5.926 1.00 33.15 H new ATOM 0 HB VAL A 62 11.932 7.482 -4.865 1.00 52.14 H new ATOM 0 HG11 VAL A 62 14.004 6.100 -4.943 1.00 53.34 H new ATOM 0 HG12 VAL A 62 12.788 5.417 -3.836 1.00 53.34 H new ATOM 0 HG13 VAL A 62 13.035 4.693 -5.443 1.00 53.34 H new ATOM 0 HG21 VAL A 62 13.303 7.439 -6.943 1.00 10.14 H new ATOM 0 HG22 VAL A 62 12.287 6.122 -7.575 1.00 10.14 H new ATOM 0 HG23 VAL A 62 11.581 7.730 -7.286 1.00 10.14 H new ATOM 923 N GLU A 63 9.843 4.440 -3.564 1.00 71.31 N ATOM 924 CA GLU A 63 9.620 4.005 -2.159 1.00 63.15 C ATOM 925 C GLU A 63 10.719 2.995 -1.717 1.00 74.32 C ATOM 926 O GLU A 63 11.389 2.384 -2.557 1.00 33.34 O ATOM 927 CB GLU A 63 8.177 3.429 -1.961 1.00 55.04 C ATOM 928 CG GLU A 63 7.722 2.417 -3.018 1.00 74.43 C ATOM 929 CD GLU A 63 6.344 1.772 -2.741 1.00 64.33 C ATOM 930 OE1 GLU A 63 5.307 2.422 -2.999 1.00 4.30 O ATOM 931 OE2 GLU A 63 6.298 0.606 -2.265 1.00 13.31 O ATOM 0 H GLU A 63 9.773 3.677 -4.238 1.00 71.31 H new ATOM 0 HA GLU A 63 9.699 4.880 -1.514 1.00 63.15 H new ATOM 0 HB2 GLU A 63 8.125 2.954 -0.981 1.00 55.04 H new ATOM 0 HB3 GLU A 63 7.471 4.259 -1.950 1.00 55.04 H new ATOM 0 HG2 GLU A 63 7.687 2.915 -3.987 1.00 74.43 H new ATOM 0 HG3 GLU A 63 8.470 1.627 -3.092 1.00 74.43 H new ATOM 938 N ARG A 64 10.889 2.829 -0.389 1.00 55.35 N ATOM 939 CA ARG A 64 12.007 2.066 0.220 1.00 3.41 C ATOM 940 C ARG A 64 11.542 1.291 1.476 1.00 32.34 C ATOM 941 O ARG A 64 10.914 1.857 2.372 1.00 51.14 O ATOM 942 CB ARG A 64 13.178 3.008 0.600 1.00 73.33 C ATOM 943 CG ARG A 64 14.432 2.274 1.144 1.00 11.13 C ATOM 944 CD ARG A 64 15.547 3.232 1.590 1.00 31.33 C ATOM 945 NE ARG A 64 16.785 2.508 1.938 1.00 22.14 N ATOM 946 CZ ARG A 64 17.754 2.963 2.697 1.00 15.21 C ATOM 947 NH1 ARG A 64 17.652 4.098 3.313 1.00 33.00 N ATOM 948 NH2 ARG A 64 18.828 2.263 2.842 1.00 30.34 N ATOM 0 H ARG A 64 10.249 3.223 0.301 1.00 55.35 H new ATOM 0 HA ARG A 64 12.351 1.350 -0.526 1.00 3.41 H new ATOM 0 HB2 ARG A 64 13.462 3.588 -0.278 1.00 73.33 H new ATOM 0 HB3 ARG A 64 12.831 3.717 1.352 1.00 73.33 H new ATOM 0 HG2 ARG A 64 14.141 1.647 1.987 1.00 11.13 H new ATOM 0 HG3 ARG A 64 14.820 1.610 0.372 1.00 11.13 H new ATOM 0 HD2 ARG A 64 15.755 3.945 0.792 1.00 31.33 H new ATOM 0 HD3 ARG A 64 15.208 3.808 2.451 1.00 31.33 H new ATOM 0 HE ARG A 64 16.898 1.570 1.554 1.00 22.14 H new ATOM 0 HH11 ARG A 64 16.805 4.658 3.213 1.00 33.00 H new ATOM 0 HH12 ARG A 64 18.418 4.432 3.898 1.00 33.00 H new ATOM 0 HH21 ARG A 64 18.919 1.364 2.369 1.00 30.34 H new ATOM 0 HH22 ARG A 64 19.586 2.609 3.430 1.00 30.34 H new ATOM 962 N LEU A 65 11.917 0.006 1.535 1.00 33.52 N ATOM 963 CA LEU A 65 11.510 -0.950 2.579 1.00 74.34 C ATOM 964 C LEU A 65 12.248 -0.708 3.921 1.00 2.51 C ATOM 965 O LEU A 65 13.483 -0.743 3.982 1.00 34.54 O ATOM 966 CB LEU A 65 11.772 -2.382 2.038 1.00 60.10 C ATOM 967 CG LEU A 65 11.336 -3.581 2.929 1.00 2.15 C ATOM 968 CD1 LEU A 65 9.894 -3.411 3.435 1.00 33.11 C ATOM 969 CD2 LEU A 65 11.498 -4.912 2.158 1.00 14.33 C ATOM 0 H LEU A 65 12.531 -0.412 0.836 1.00 33.52 H new ATOM 0 HA LEU A 65 10.451 -0.816 2.799 1.00 74.34 H new ATOM 0 HB2 LEU A 65 11.265 -2.476 1.077 1.00 60.10 H new ATOM 0 HB3 LEU A 65 12.841 -2.478 1.846 1.00 60.10 H new ATOM 0 HG LEU A 65 11.987 -3.605 3.803 1.00 2.15 H new ATOM 0 HD11 LEU A 65 9.622 -4.266 4.054 1.00 33.11 H new ATOM 0 HD12 LEU A 65 9.821 -2.498 4.026 1.00 33.11 H new ATOM 0 HD13 LEU A 65 9.215 -3.348 2.585 1.00 33.11 H new ATOM 0 HD21 LEU A 65 11.189 -5.741 2.795 1.00 14.33 H new ATOM 0 HD22 LEU A 65 10.877 -4.891 1.262 1.00 14.33 H new ATOM 0 HD23 LEU A 65 12.542 -5.043 1.873 1.00 14.33 H new ATOM 981 N VAL A 66 11.458 -0.458 4.987 1.00 32.20 N ATOM 982 CA VAL A 66 11.970 -0.211 6.359 1.00 34.12 C ATOM 983 C VAL A 66 11.894 -1.499 7.217 1.00 74.23 C ATOM 984 O VAL A 66 12.854 -1.871 7.898 1.00 61.52 O ATOM 985 CB VAL A 66 11.146 0.929 7.074 1.00 4.02 C ATOM 986 CG1 VAL A 66 11.702 1.234 8.492 1.00 11.22 C ATOM 987 CG2 VAL A 66 11.095 2.209 6.204 1.00 34.23 C ATOM 0 H VAL A 66 10.441 -0.421 4.923 1.00 32.20 H new ATOM 0 HA VAL A 66 13.010 0.101 6.265 1.00 34.12 H new ATOM 0 HB VAL A 66 10.125 0.567 7.197 1.00 4.02 H new ATOM 0 HG11 VAL A 66 11.109 2.024 8.953 1.00 11.22 H new ATOM 0 HG12 VAL A 66 11.648 0.335 9.105 1.00 11.22 H new ATOM 0 HG13 VAL A 66 12.740 1.558 8.414 1.00 11.22 H new ATOM 0 HG21 VAL A 66 10.521 2.978 6.721 1.00 34.23 H new ATOM 0 HG22 VAL A 66 12.108 2.570 6.028 1.00 34.23 H new ATOM 0 HG23 VAL A 66 10.620 1.982 5.250 1.00 34.23 H new ATOM 997 N GLU A 67 10.725 -2.157 7.179 1.00 31.45 N ATOM 998 CA GLU A 67 10.426 -3.377 7.960 1.00 4.24 C ATOM 999 C GLU A 67 9.531 -4.321 7.127 1.00 74.34 C ATOM 1000 O GLU A 67 8.558 -3.876 6.518 1.00 44.20 O ATOM 1001 CB GLU A 67 9.722 -2.982 9.292 1.00 54.43 C ATOM 1002 CG GLU A 67 9.272 -4.163 10.176 1.00 30.54 C ATOM 1003 CD GLU A 67 8.633 -3.708 11.500 1.00 2.13 C ATOM 1004 OE1 GLU A 67 9.370 -3.514 12.494 1.00 51.33 O ATOM 1005 OE2 GLU A 67 7.397 -3.525 11.554 1.00 55.32 O ATOM 0 H GLU A 67 9.945 -1.854 6.596 1.00 31.45 H new ATOM 0 HA GLU A 67 11.353 -3.899 8.197 1.00 4.24 H new ATOM 0 HB2 GLU A 67 10.401 -2.355 9.870 1.00 54.43 H new ATOM 0 HB3 GLU A 67 8.849 -2.373 9.056 1.00 54.43 H new ATOM 0 HG2 GLU A 67 8.557 -4.773 9.623 1.00 30.54 H new ATOM 0 HG3 GLU A 67 10.132 -4.797 10.392 1.00 30.54 H new ATOM 1012 N ARG A 68 9.856 -5.621 7.105 1.00 35.13 N ATOM 1013 CA ARG A 68 9.121 -6.615 6.295 1.00 72.42 C ATOM 1014 C ARG A 68 8.809 -7.856 7.166 1.00 23.41 C ATOM 1015 O ARG A 68 9.707 -8.618 7.530 1.00 3.11 O ATOM 1016 CB ARG A 68 9.959 -6.966 5.018 1.00 75.45 C ATOM 1017 CG ARG A 68 9.168 -7.550 3.808 1.00 54.11 C ATOM 1018 CD ARG A 68 8.727 -9.011 4.002 1.00 55.05 C ATOM 1019 NE ARG A 68 9.881 -9.890 4.279 1.00 2.10 N ATOM 1020 CZ ARG A 68 9.839 -11.051 4.880 1.00 33.54 C ATOM 1021 NH1 ARG A 68 8.734 -11.540 5.314 1.00 30.43 N ATOM 1022 NH2 ARG A 68 10.926 -11.716 5.058 1.00 21.34 N ATOM 0 H ARG A 68 10.628 -6.015 7.642 1.00 35.13 H new ATOM 0 HA ARG A 68 8.168 -6.210 5.955 1.00 72.42 H new ATOM 0 HB2 ARG A 68 10.472 -6.063 4.687 1.00 75.45 H new ATOM 0 HB3 ARG A 68 10.729 -7.684 5.301 1.00 75.45 H new ATOM 0 HG2 ARG A 68 8.286 -6.934 3.631 1.00 54.11 H new ATOM 0 HG3 ARG A 68 9.788 -7.483 2.914 1.00 54.11 H new ATOM 0 HD2 ARG A 68 8.016 -9.072 4.826 1.00 55.05 H new ATOM 0 HD3 ARG A 68 8.210 -9.358 3.108 1.00 55.05 H new ATOM 0 HE ARG A 68 10.797 -9.561 3.973 1.00 2.10 H new ATOM 0 HH11 ARG A 68 7.864 -11.021 5.193 1.00 30.43 H new ATOM 0 HH12 ARG A 68 8.726 -12.447 5.780 1.00 30.43 H new ATOM 0 HH21 ARG A 68 11.815 -11.337 4.731 1.00 21.34 H new ATOM 0 HH22 ARG A 68 10.899 -12.622 5.526 1.00 21.34 H new ATOM 1036 N ASP A 69 7.519 -8.025 7.495 1.00 52.20 N ATOM 1037 CA ASP A 69 7.002 -9.147 8.310 1.00 71.21 C ATOM 1038 C ASP A 69 6.359 -10.218 7.369 1.00 73.01 C ATOM 1039 O ASP A 69 6.304 -10.014 6.154 1.00 4.13 O ATOM 1040 CB ASP A 69 5.974 -8.569 9.331 1.00 31.45 C ATOM 1041 CG ASP A 69 5.662 -9.525 10.486 1.00 5.21 C ATOM 1042 OD1 ASP A 69 4.779 -10.386 10.335 1.00 1.53 O ATOM 1043 OD2 ASP A 69 6.328 -9.435 11.538 1.00 4.22 O ATOM 0 H ASP A 69 6.789 -7.377 7.199 1.00 52.20 H new ATOM 0 HA ASP A 69 7.802 -9.640 8.863 1.00 71.21 H new ATOM 0 HB2 ASP A 69 6.362 -7.635 9.737 1.00 31.45 H new ATOM 0 HB3 ASP A 69 5.049 -8.329 8.807 1.00 31.45 H new ATOM 1048 N GLU A 70 5.900 -11.366 7.923 1.00 23.41 N ATOM 1049 CA GLU A 70 5.222 -12.435 7.129 1.00 31.04 C ATOM 1050 C GLU A 70 4.348 -13.356 8.010 1.00 43.14 C ATOM 1051 O GLU A 70 3.291 -13.830 7.571 1.00 13.13 O ATOM 1052 CB GLU A 70 6.269 -13.268 6.350 1.00 74.42 C ATOM 1053 CG GLU A 70 5.691 -14.263 5.324 1.00 14.51 C ATOM 1054 CD GLU A 70 6.753 -14.762 4.329 1.00 22.11 C ATOM 1055 OE1 GLU A 70 7.143 -13.978 3.436 1.00 22.15 O ATOM 1056 OE2 GLU A 70 7.206 -15.919 4.444 1.00 5.43 O ATOM 0 H GLU A 70 5.984 -11.581 8.916 1.00 23.41 H new ATOM 0 HA GLU A 70 4.555 -11.941 6.422 1.00 31.04 H new ATOM 0 HB2 GLU A 70 6.939 -12.583 5.830 1.00 74.42 H new ATOM 0 HB3 GLU A 70 6.874 -13.822 7.067 1.00 74.42 H new ATOM 0 HG2 GLU A 70 5.261 -15.115 5.851 1.00 14.51 H new ATOM 0 HG3 GLU A 70 4.879 -13.785 4.776 1.00 14.51 H new ATOM 1063 N SER A 71 4.798 -13.607 9.256 1.00 61.23 N ATOM 1064 CA SER A 71 4.052 -14.439 10.244 1.00 53.22 C ATOM 1065 C SER A 71 2.697 -13.785 10.625 1.00 5.32 C ATOM 1066 O SER A 71 1.693 -14.470 10.845 1.00 64.15 O ATOM 1067 CB SER A 71 4.912 -14.658 11.515 1.00 64.44 C ATOM 1068 OG SER A 71 6.161 -15.264 11.199 1.00 5.13 O ATOM 0 H SER A 71 5.683 -13.245 9.612 1.00 61.23 H new ATOM 0 HA SER A 71 3.843 -15.403 9.780 1.00 53.22 H new ATOM 0 HB2 SER A 71 5.084 -13.702 12.009 1.00 64.44 H new ATOM 0 HB3 SER A 71 4.369 -15.287 12.220 1.00 64.44 H new ATOM 0 HG SER A 71 6.682 -15.388 12.020 1.00 5.13 H new ATOM 1074 N ALA A 72 2.695 -12.443 10.674 1.00 42.31 N ATOM 1075 CA ALA A 72 1.488 -11.616 10.924 1.00 4.24 C ATOM 1076 C ALA A 72 0.978 -10.976 9.608 1.00 74.03 C ATOM 1077 O ALA A 72 -0.153 -10.482 9.555 1.00 75.43 O ATOM 1078 CB ALA A 72 1.800 -10.529 11.969 1.00 10.12 C ATOM 0 H ALA A 72 3.540 -11.888 10.540 1.00 42.31 H new ATOM 0 HA ALA A 72 0.700 -12.261 11.313 1.00 4.24 H new ATOM 0 HB1 ALA A 72 0.908 -9.927 12.146 1.00 10.12 H new ATOM 0 HB2 ALA A 72 2.111 -11.000 12.902 1.00 10.12 H new ATOM 0 HB3 ALA A 72 2.602 -9.889 11.600 1.00 10.12 H new ATOM 1084 N ARG A 73 1.844 -11.002 8.566 1.00 54.14 N ATOM 1085 CA ARG A 73 1.557 -10.474 7.209 1.00 30.53 C ATOM 1086 C ARG A 73 1.431 -8.928 7.199 1.00 45.02 C ATOM 1087 O ARG A 73 0.349 -8.377 6.988 1.00 72.00 O ATOM 1088 CB ARG A 73 0.314 -11.174 6.560 1.00 65.21 C ATOM 1089 CG ARG A 73 0.496 -12.690 6.338 1.00 41.40 C ATOM 1090 CD ARG A 73 -0.751 -13.381 5.753 1.00 11.13 C ATOM 1091 NE ARG A 73 -0.460 -14.780 5.388 1.00 2.13 N ATOM 1092 CZ ARG A 73 -0.646 -15.835 6.155 1.00 24.34 C ATOM 1093 NH1 ARG A 73 -1.152 -15.737 7.345 1.00 44.21 N ATOM 1094 NH2 ARG A 73 -0.293 -16.999 5.725 1.00 1.52 N ATOM 0 H ARG A 73 2.780 -11.398 8.647 1.00 54.14 H new ATOM 0 HA ARG A 73 2.417 -10.719 6.586 1.00 30.53 H new ATOM 0 HB2 ARG A 73 -0.556 -11.012 7.197 1.00 65.21 H new ATOM 0 HB3 ARG A 73 0.101 -10.699 5.602 1.00 65.21 H new ATOM 0 HG2 ARG A 73 1.339 -12.852 5.667 1.00 41.40 H new ATOM 0 HG3 ARG A 73 0.750 -13.160 7.288 1.00 41.40 H new ATOM 0 HD2 ARG A 73 -1.562 -13.353 6.481 1.00 11.13 H new ATOM 0 HD3 ARG A 73 -1.094 -12.836 4.873 1.00 11.13 H new ATOM 0 HE ARG A 73 -0.080 -14.946 4.456 1.00 2.13 H new ATOM 0 HH11 ARG A 73 -1.419 -14.824 7.712 1.00 44.21 H new ATOM 0 HH12 ARG A 73 -1.283 -16.573 7.914 1.00 44.21 H new ATOM 0 HH21 ARG A 73 0.125 -17.096 4.800 1.00 1.52 H new ATOM 0 HH22 ARG A 73 -0.432 -17.823 6.310 1.00 1.52 H new ATOM 1108 N ARG A 74 2.573 -8.245 7.417 1.00 54.22 N ATOM 1109 CA ARG A 74 2.653 -6.762 7.453 1.00 32.10 C ATOM 1110 C ARG A 74 3.877 -6.237 6.648 1.00 12.40 C ATOM 1111 O ARG A 74 4.976 -6.769 6.756 1.00 0.04 O ATOM 1112 CB ARG A 74 2.731 -6.276 8.923 1.00 65.43 C ATOM 1113 CG ARG A 74 2.901 -4.748 9.084 1.00 54.41 C ATOM 1114 CD ARG A 74 2.947 -4.306 10.551 1.00 42.21 C ATOM 1115 NE ARG A 74 1.703 -4.639 11.260 1.00 51.12 N ATOM 1116 CZ ARG A 74 1.469 -4.443 12.535 1.00 30.21 C ATOM 1117 NH1 ARG A 74 2.348 -3.890 13.314 1.00 4.22 N ATOM 1118 NH2 ARG A 74 0.331 -4.802 13.025 1.00 52.21 N ATOM 0 H ARG A 74 3.471 -8.703 7.574 1.00 54.22 H new ATOM 0 HA ARG A 74 1.753 -6.363 6.985 1.00 32.10 H new ATOM 0 HB2 ARG A 74 1.824 -6.585 9.443 1.00 65.43 H new ATOM 0 HB3 ARG A 74 3.566 -6.776 9.414 1.00 65.43 H new ATOM 0 HG2 ARG A 74 3.819 -4.435 8.586 1.00 54.41 H new ATOM 0 HG3 ARG A 74 2.077 -4.241 8.582 1.00 54.41 H new ATOM 0 HD2 ARG A 74 3.789 -4.786 11.049 1.00 42.21 H new ATOM 0 HD3 ARG A 74 3.118 -3.231 10.602 1.00 42.21 H new ATOM 0 HE ARG A 74 0.954 -5.061 10.710 1.00 51.12 H new ATOM 0 HH11 ARG A 74 3.249 -3.595 12.938 1.00 4.22 H new ATOM 0 HH12 ARG A 74 2.138 -3.750 14.302 1.00 4.22 H new ATOM 0 HH21 ARG A 74 -0.371 -5.231 12.422 1.00 52.21 H new ATOM 0 HH22 ARG A 74 0.133 -4.656 14.015 1.00 52.21 H new ATOM 1132 N LEU A 75 3.650 -5.195 5.837 1.00 13.51 N ATOM 1133 CA LEU A 75 4.686 -4.523 5.011 1.00 52.15 C ATOM 1134 C LEU A 75 4.811 -3.044 5.445 1.00 45.24 C ATOM 1135 O LEU A 75 3.849 -2.299 5.369 1.00 30.43 O ATOM 1136 CB LEU A 75 4.290 -4.645 3.501 1.00 70.42 C ATOM 1137 CG LEU A 75 5.116 -3.816 2.465 1.00 41.54 C ATOM 1138 CD1 LEU A 75 6.617 -4.114 2.569 1.00 2.41 C ATOM 1139 CD2 LEU A 75 4.598 -4.048 1.024 1.00 63.40 C ATOM 0 H LEU A 75 2.725 -4.780 5.728 1.00 13.51 H new ATOM 0 HA LEU A 75 5.656 -4.999 5.154 1.00 52.15 H new ATOM 0 HB2 LEU A 75 4.358 -5.696 3.220 1.00 70.42 H new ATOM 0 HB3 LEU A 75 3.243 -4.356 3.404 1.00 70.42 H new ATOM 0 HG LEU A 75 4.977 -2.762 2.706 1.00 41.54 H new ATOM 0 HD11 LEU A 75 7.158 -3.519 1.833 1.00 2.41 H new ATOM 0 HD12 LEU A 75 6.969 -3.862 3.569 1.00 2.41 H new ATOM 0 HD13 LEU A 75 6.792 -5.173 2.379 1.00 2.41 H new ATOM 0 HD21 LEU A 75 5.191 -3.459 0.325 1.00 63.40 H new ATOM 0 HD22 LEU A 75 4.684 -5.105 0.772 1.00 63.40 H new ATOM 0 HD23 LEU A 75 3.553 -3.744 0.960 1.00 63.40 H new ATOM 1151 N VAL A 76 5.997 -2.640 5.934 1.00 51.12 N ATOM 1152 CA VAL A 76 6.274 -1.243 6.363 1.00 21.24 C ATOM 1153 C VAL A 76 7.383 -0.628 5.477 1.00 52.12 C ATOM 1154 O VAL A 76 8.484 -1.177 5.371 1.00 63.11 O ATOM 1155 CB VAL A 76 6.715 -1.173 7.876 1.00 64.41 C ATOM 1156 CG1 VAL A 76 6.977 0.291 8.334 1.00 51.41 C ATOM 1157 CG2 VAL A 76 5.684 -1.876 8.795 1.00 40.11 C ATOM 0 H VAL A 76 6.794 -3.266 6.046 1.00 51.12 H new ATOM 0 HA VAL A 76 5.350 -0.676 6.251 1.00 21.24 H new ATOM 0 HB VAL A 76 7.659 -1.711 7.963 1.00 64.41 H new ATOM 0 HG11 VAL A 76 7.278 0.296 9.381 1.00 51.41 H new ATOM 0 HG12 VAL A 76 7.770 0.726 7.726 1.00 51.41 H new ATOM 0 HG13 VAL A 76 6.066 0.878 8.216 1.00 51.41 H new ATOM 0 HG21 VAL A 76 6.016 -1.811 9.831 1.00 40.11 H new ATOM 0 HG22 VAL A 76 4.714 -1.389 8.693 1.00 40.11 H new ATOM 0 HG23 VAL A 76 5.595 -2.924 8.508 1.00 40.11 H new ATOM 1167 N TYR A 77 7.093 0.528 4.875 1.00 31.14 N ATOM 1168 CA TYR A 77 8.018 1.233 3.968 1.00 45.22 C ATOM 1169 C TYR A 77 7.828 2.770 4.052 1.00 11.22 C ATOM 1170 O TYR A 77 7.023 3.267 4.842 1.00 1.24 O ATOM 1171 CB TYR A 77 7.865 0.701 2.508 1.00 1.33 C ATOM 1172 CG TYR A 77 6.512 0.979 1.820 1.00 64.02 C ATOM 1173 CD1 TYR A 77 6.302 2.150 1.082 1.00 51.41 C ATOM 1174 CD2 TYR A 77 5.458 0.056 1.884 1.00 64.24 C ATOM 1175 CE1 TYR A 77 5.107 2.390 0.443 1.00 31.12 C ATOM 1176 CE2 TYR A 77 4.255 0.298 1.243 1.00 30.14 C ATOM 1177 CZ TYR A 77 4.089 1.466 0.521 1.00 74.53 C ATOM 1178 OH TYR A 77 2.905 1.712 -0.135 1.00 41.52 O ATOM 0 H TYR A 77 6.203 1.010 5.001 1.00 31.14 H new ATOM 0 HA TYR A 77 9.039 1.025 4.288 1.00 45.22 H new ATOM 0 HB2 TYR A 77 8.656 1.139 1.899 1.00 1.33 H new ATOM 0 HB3 TYR A 77 8.030 -0.376 2.517 1.00 1.33 H new ATOM 0 HD1 TYR A 77 7.095 2.880 1.013 1.00 51.41 H new ATOM 0 HD2 TYR A 77 5.587 -0.859 2.443 1.00 64.24 H new ATOM 0 HE1 TYR A 77 4.968 3.302 -0.119 1.00 31.12 H new ATOM 0 HE2 TYR A 77 3.451 -0.421 1.306 1.00 30.14 H new ATOM 0 HH TYR A 77 2.674 0.940 -0.693 1.00 41.52 H new ATOM 1188 N THR A 78 8.612 3.507 3.248 1.00 75.11 N ATOM 1189 CA THR A 78 8.618 4.997 3.212 1.00 70.54 C ATOM 1190 C THR A 78 8.891 5.502 1.778 1.00 0.11 C ATOM 1191 O THR A 78 9.349 4.741 0.947 1.00 34.24 O ATOM 1192 CB THR A 78 9.723 5.576 4.166 1.00 2.22 C ATOM 1193 OG1 THR A 78 9.757 7.018 4.089 1.00 41.33 O ATOM 1194 CG2 THR A 78 11.125 5.018 3.836 1.00 22.01 C ATOM 0 H THR A 78 9.272 3.089 2.592 1.00 75.11 H new ATOM 0 HA THR A 78 7.637 5.337 3.544 1.00 70.54 H new ATOM 0 HB THR A 78 9.460 5.266 5.177 1.00 2.22 H new ATOM 0 HG1 THR A 78 9.151 7.396 4.760 1.00 41.33 H new ATOM 0 HG21 THR A 78 11.857 5.446 4.521 1.00 22.01 H new ATOM 0 HG22 THR A 78 11.119 3.933 3.942 1.00 22.01 H new ATOM 0 HG23 THR A 78 11.389 5.281 2.812 1.00 22.01 H new ATOM 1202 N MET A 79 8.593 6.779 1.488 1.00 44.04 N ATOM 1203 CA MET A 79 9.046 7.448 0.243 1.00 2.12 C ATOM 1204 C MET A 79 10.271 8.349 0.561 1.00 52.03 C ATOM 1205 O MET A 79 10.099 9.447 1.105 1.00 13.45 O ATOM 1206 CB MET A 79 7.896 8.271 -0.407 1.00 25.21 C ATOM 1207 CG MET A 79 6.738 7.425 -0.970 1.00 32.32 C ATOM 1208 SD MET A 79 5.506 8.418 -1.852 1.00 35.53 S ATOM 1209 CE MET A 79 4.919 9.535 -0.576 1.00 61.23 C ATOM 0 H MET A 79 8.037 7.378 2.099 1.00 44.04 H new ATOM 0 HA MET A 79 9.341 6.688 -0.480 1.00 2.12 H new ATOM 0 HB2 MET A 79 7.496 8.961 0.336 1.00 25.21 H new ATOM 0 HB3 MET A 79 8.311 8.876 -1.213 1.00 25.21 H new ATOM 0 HG2 MET A 79 7.141 6.670 -1.646 1.00 32.32 H new ATOM 0 HG3 MET A 79 6.251 6.894 -0.152 1.00 32.32 H new ATOM 0 HE1 MET A 79 3.829 9.563 -0.590 1.00 61.23 H new ATOM 0 HE2 MET A 79 5.261 9.186 0.398 1.00 61.23 H new ATOM 0 HE3 MET A 79 5.310 10.536 -0.760 1.00 61.23 H new ATOM 1219 N PRO A 80 11.536 7.886 0.263 1.00 2.20 N ATOM 1220 CA PRO A 80 12.775 8.666 0.549 1.00 51.23 C ATOM 1221 C PRO A 80 12.946 9.907 -0.367 1.00 71.33 C ATOM 1222 O PRO A 80 13.658 10.855 -0.014 1.00 11.54 O ATOM 1223 CB PRO A 80 13.901 7.622 0.325 1.00 71.41 C ATOM 1224 CG PRO A 80 13.334 6.673 -0.686 1.00 12.24 C ATOM 1225 CD PRO A 80 11.861 6.565 -0.349 1.00 53.21 C ATOM 0 HA PRO A 80 12.769 9.094 1.551 1.00 51.23 H new ATOM 0 HB2 PRO A 80 14.813 8.094 -0.041 1.00 71.41 H new ATOM 0 HB3 PRO A 80 14.157 7.109 1.252 1.00 71.41 H new ATOM 0 HG2 PRO A 80 13.479 7.045 -1.700 1.00 12.24 H new ATOM 0 HG3 PRO A 80 13.823 5.700 -0.630 1.00 12.24 H new ATOM 0 HD2 PRO A 80 11.260 6.378 -1.239 1.00 53.21 H new ATOM 0 HD3 PRO A 80 11.668 5.746 0.343 1.00 53.21 H new ATOM 1233 N ASP A 81 12.268 9.895 -1.526 1.00 41.10 N ATOM 1234 CA ASP A 81 12.302 11.007 -2.494 1.00 45.11 C ATOM 1235 C ASP A 81 10.874 11.238 -3.077 1.00 15.32 C ATOM 1236 O ASP A 81 10.590 10.826 -4.200 1.00 65.13 O ATOM 1237 CB ASP A 81 13.353 10.697 -3.607 1.00 50.24 C ATOM 1238 CG ASP A 81 13.643 11.899 -4.526 1.00 3.24 C ATOM 1239 OD1 ASP A 81 14.488 12.746 -4.156 1.00 40.32 O ATOM 1240 OD2 ASP A 81 13.026 12.011 -5.607 1.00 13.44 O ATOM 0 H ASP A 81 11.680 9.115 -1.820 1.00 41.10 H new ATOM 0 HA ASP A 81 12.607 11.930 -2.001 1.00 45.11 H new ATOM 0 HB2 ASP A 81 14.283 10.374 -3.139 1.00 50.24 H new ATOM 0 HB3 ASP A 81 12.995 9.864 -4.212 1.00 50.24 H new ATOM 1245 N PRO A 82 9.927 11.856 -2.288 1.00 23.44 N ATOM 1246 CA PRO A 82 8.533 12.104 -2.751 1.00 70.32 C ATOM 1247 C PRO A 82 8.367 13.447 -3.537 1.00 42.44 C ATOM 1248 O PRO A 82 9.055 14.433 -3.239 1.00 3.01 O ATOM 1249 CB PRO A 82 7.753 12.120 -1.415 1.00 3.42 C ATOM 1250 CG PRO A 82 8.712 12.725 -0.425 1.00 50.32 C ATOM 1251 CD PRO A 82 10.118 12.343 -0.888 1.00 35.44 C ATOM 0 HA PRO A 82 8.187 11.357 -3.466 1.00 70.32 H new ATOM 0 HB2 PRO A 82 6.841 12.711 -1.495 1.00 3.42 H new ATOM 0 HB3 PRO A 82 7.456 11.114 -1.117 1.00 3.42 H new ATOM 0 HG2 PRO A 82 8.598 13.808 -0.387 1.00 50.32 H new ATOM 0 HG3 PRO A 82 8.520 12.349 0.580 1.00 50.32 H new ATOM 0 HD2 PRO A 82 10.794 13.197 -0.853 1.00 35.44 H new ATOM 0 HD3 PRO A 82 10.549 11.569 -0.253 1.00 35.44 H new ATOM 1259 N PRO A 83 7.441 13.515 -4.560 1.00 31.34 N ATOM 1260 CA PRO A 83 7.151 14.762 -5.325 1.00 12.42 C ATOM 1261 C PRO A 83 6.070 15.665 -4.650 1.00 34.43 C ATOM 1262 O PRO A 83 5.401 16.456 -5.323 1.00 72.11 O ATOM 1263 CB PRO A 83 6.667 14.214 -6.715 1.00 64.45 C ATOM 1264 CG PRO A 83 6.651 12.703 -6.582 1.00 21.52 C ATOM 1265 CD PRO A 83 6.631 12.401 -5.100 1.00 73.12 C ATOM 0 HA PRO A 83 8.020 15.417 -5.390 1.00 12.42 H new ATOM 0 HB2 PRO A 83 5.676 14.595 -6.962 1.00 64.45 H new ATOM 0 HB3 PRO A 83 7.338 14.529 -7.514 1.00 64.45 H new ATOM 0 HG2 PRO A 83 5.776 12.280 -7.076 1.00 21.52 H new ATOM 0 HG3 PRO A 83 7.529 12.263 -7.056 1.00 21.52 H new ATOM 0 HD2 PRO A 83 5.619 12.397 -4.696 1.00 73.12 H new ATOM 0 HD3 PRO A 83 7.069 11.429 -4.874 1.00 73.12 H new ATOM 1273 N PHE A 84 5.914 15.539 -3.312 1.00 22.43 N ATOM 1274 CA PHE A 84 4.923 16.316 -2.513 1.00 43.25 C ATOM 1275 C PHE A 84 5.638 17.100 -1.380 1.00 2.21 C ATOM 1276 O PHE A 84 6.665 16.629 -0.880 1.00 1.24 O ATOM 1277 CB PHE A 84 3.863 15.350 -1.902 1.00 41.32 C ATOM 1278 CG PHE A 84 3.096 14.533 -2.944 1.00 52.14 C ATOM 1279 CD1 PHE A 84 2.087 15.121 -3.708 1.00 64.11 C ATOM 1280 CD2 PHE A 84 3.399 13.188 -3.175 1.00 22.42 C ATOM 1281 CE1 PHE A 84 1.403 14.391 -4.663 1.00 12.42 C ATOM 1282 CE2 PHE A 84 2.710 12.460 -4.132 1.00 63.14 C ATOM 1283 CZ PHE A 84 1.715 13.064 -4.877 1.00 15.04 C ATOM 0 H PHE A 84 6.471 14.895 -2.749 1.00 22.43 H new ATOM 0 HA PHE A 84 4.424 17.028 -3.170 1.00 43.25 H new ATOM 0 HB2 PHE A 84 4.362 14.667 -1.214 1.00 41.32 H new ATOM 0 HB3 PHE A 84 3.152 15.931 -1.315 1.00 41.32 H new ATOM 0 HD1 PHE A 84 1.837 16.160 -3.551 1.00 64.11 H new ATOM 0 HD2 PHE A 84 4.179 12.711 -2.601 1.00 22.42 H new ATOM 0 HE1 PHE A 84 0.622 14.861 -5.243 1.00 12.42 H new ATOM 0 HE2 PHE A 84 2.951 11.420 -4.296 1.00 63.14 H new ATOM 0 HZ PHE A 84 1.182 12.498 -5.626 1.00 15.04 H new ATOM 1293 N PRO A 85 5.110 18.304 -0.949 1.00 32.12 N ATOM 1294 CA PRO A 85 5.693 19.077 0.185 1.00 52.34 C ATOM 1295 C PRO A 85 5.348 18.441 1.564 1.00 70.55 C ATOM 1296 O PRO A 85 4.477 18.922 2.311 1.00 14.12 O ATOM 1297 CB PRO A 85 5.069 20.485 -0.001 1.00 73.24 C ATOM 1298 CG PRO A 85 3.726 20.212 -0.619 1.00 41.22 C ATOM 1299 CD PRO A 85 3.923 19.009 -1.531 1.00 72.01 C ATOM 0 HA PRO A 85 6.783 19.098 0.180 1.00 52.34 H new ATOM 0 HB2 PRO A 85 4.971 21.007 0.951 1.00 73.24 H new ATOM 0 HB3 PRO A 85 5.685 21.112 -0.646 1.00 73.24 H new ATOM 0 HG2 PRO A 85 2.979 20.003 0.147 1.00 41.22 H new ATOM 0 HG3 PRO A 85 3.373 21.076 -1.182 1.00 41.22 H new ATOM 0 HD2 PRO A 85 3.042 18.367 -1.540 1.00 72.01 H new ATOM 0 HD3 PRO A 85 4.106 19.315 -2.561 1.00 72.01 H new ATOM 1307 N ILE A 86 6.035 17.322 1.871 1.00 44.41 N ATOM 1308 CA ILE A 86 5.788 16.492 3.077 1.00 74.30 C ATOM 1309 C ILE A 86 7.120 16.129 3.784 1.00 24.41 C ATOM 1310 O ILE A 86 8.202 16.281 3.210 1.00 44.11 O ATOM 1311 CB ILE A 86 4.992 15.169 2.715 1.00 45.03 C ATOM 1312 CG1 ILE A 86 5.814 14.248 1.754 1.00 43.31 C ATOM 1313 CG2 ILE A 86 3.607 15.502 2.103 1.00 3.35 C ATOM 1314 CD1 ILE A 86 5.126 12.944 1.371 1.00 40.23 C ATOM 0 H ILE A 86 6.787 16.961 1.284 1.00 44.41 H new ATOM 0 HA ILE A 86 5.178 17.085 3.758 1.00 74.30 H new ATOM 0 HB ILE A 86 4.833 14.621 3.644 1.00 45.03 H new ATOM 0 HG12 ILE A 86 6.038 14.805 0.844 1.00 43.31 H new ATOM 0 HG13 ILE A 86 6.768 14.013 2.227 1.00 43.31 H new ATOM 0 HG21 ILE A 86 3.083 14.577 1.864 1.00 3.35 H new ATOM 0 HG22 ILE A 86 3.021 16.076 2.820 1.00 3.35 H new ATOM 0 HG23 ILE A 86 3.742 16.087 1.194 1.00 3.35 H new ATOM 0 HD11 ILE A 86 5.772 12.374 0.704 1.00 40.23 H new ATOM 0 HD12 ILE A 86 4.927 12.360 2.270 1.00 40.23 H new ATOM 0 HD13 ILE A 86 4.186 13.164 0.865 1.00 40.23 H new ATOM 1326 N THR A 87 7.025 15.653 5.037 1.00 2.20 N ATOM 1327 CA THR A 87 8.200 15.221 5.849 1.00 62.11 C ATOM 1328 C THR A 87 7.875 13.879 6.567 1.00 41.51 C ATOM 1329 O THR A 87 6.703 13.547 6.715 1.00 51.12 O ATOM 1330 CB THR A 87 8.587 16.325 6.911 1.00 14.33 C ATOM 1331 OG1 THR A 87 8.555 17.631 6.307 1.00 43.05 O ATOM 1332 CG2 THR A 87 9.987 16.100 7.522 1.00 60.53 C ATOM 0 H THR A 87 6.135 15.553 5.526 1.00 2.20 H new ATOM 0 HA THR A 87 9.050 15.078 5.182 1.00 62.11 H new ATOM 0 HB THR A 87 7.851 16.253 7.712 1.00 14.33 H new ATOM 0 HG1 THR A 87 8.795 18.306 6.975 1.00 43.05 H new ATOM 0 HG21 THR A 87 10.200 16.888 8.244 1.00 60.53 H new ATOM 0 HG22 THR A 87 10.014 15.132 8.022 1.00 60.53 H new ATOM 0 HG23 THR A 87 10.737 16.121 6.731 1.00 60.53 H new ATOM 1340 N ASN A 88 8.921 13.126 7.000 1.00 0.00 N ATOM 1341 CA ASN A 88 8.821 11.828 7.758 1.00 54.05 C ATOM 1342 C ASN A 88 7.652 10.898 7.301 1.00 33.44 C ATOM 1343 O ASN A 88 6.634 10.748 7.988 1.00 2.21 O ATOM 1344 CB ASN A 88 8.837 12.054 9.309 1.00 1.44 C ATOM 1345 CG ASN A 88 7.722 12.961 9.851 1.00 62.14 C ATOM 1346 OD1 ASN A 88 6.640 12.509 10.198 1.00 5.24 O ATOM 1347 ND2 ASN A 88 7.966 14.254 9.897 1.00 42.13 N ATOM 0 H ASN A 88 9.888 13.404 6.832 1.00 0.00 H new ATOM 0 HA ASN A 88 9.724 11.276 7.497 1.00 54.05 H new ATOM 0 HB2 ASN A 88 8.766 11.084 9.802 1.00 1.44 H new ATOM 0 HB3 ASN A 88 9.800 12.483 9.587 1.00 1.44 H new ATOM 0 HD21 ASN A 88 7.246 14.897 10.226 1.00 42.13 H new ATOM 0 HD22 ASN A 88 8.875 14.612 9.603 1.00 42.13 H new ATOM 1354 N HIS A 89 7.803 10.303 6.103 1.00 4.21 N ATOM 1355 CA HIS A 89 6.763 9.436 5.507 1.00 62.03 C ATOM 1356 C HIS A 89 6.779 8.006 6.120 1.00 4.31 C ATOM 1357 O HIS A 89 7.835 7.381 6.248 1.00 34.11 O ATOM 1358 CB HIS A 89 6.928 9.370 3.966 1.00 12.22 C ATOM 1359 CG HIS A 89 5.824 8.593 3.287 1.00 13.24 C ATOM 1360 ND1 HIS A 89 6.053 7.384 2.687 1.00 22.33 N ATOM 1361 CD2 HIS A 89 4.508 8.885 3.188 1.00 73.25 C ATOM 1362 CE1 HIS A 89 4.887 6.971 2.241 1.00 4.35 C ATOM 1363 NE2 HIS A 89 3.917 7.849 2.523 1.00 43.43 N ATOM 0 H HIS A 89 8.637 10.406 5.525 1.00 4.21 H new ATOM 0 HA HIS A 89 5.795 9.880 5.739 1.00 62.03 H new ATOM 0 HB2 HIS A 89 6.951 10.383 3.565 1.00 12.22 H new ATOM 0 HB3 HIS A 89 7.887 8.911 3.728 1.00 12.22 H new ATOM 0 HD2 HIS A 89 4.017 9.770 3.564 1.00 73.25 H new ATOM 0 HE1 HIS A 89 4.732 6.041 1.714 1.00 4.35 H new ATOM 0 HE2 HIS A 89 2.929 7.761 2.287 1.00 43.43 H new ATOM 1371 N ARG A 90 5.595 7.526 6.522 1.00 34.21 N ATOM 1372 CA ARG A 90 5.375 6.143 6.990 1.00 41.23 C ATOM 1373 C ARG A 90 4.170 5.525 6.247 1.00 62.53 C ATOM 1374 O ARG A 90 3.055 6.026 6.360 1.00 42.41 O ATOM 1375 CB ARG A 90 5.101 6.144 8.518 1.00 11.31 C ATOM 1376 CG ARG A 90 4.880 4.739 9.137 1.00 1.22 C ATOM 1377 CD ARG A 90 6.175 3.908 9.198 1.00 62.51 C ATOM 1378 NE ARG A 90 7.172 4.540 10.077 1.00 13.32 N ATOM 1379 CZ ARG A 90 8.468 4.346 10.046 1.00 61.41 C ATOM 1380 NH1 ARG A 90 9.017 3.516 9.211 1.00 12.43 N ATOM 1381 NH2 ARG A 90 9.213 4.995 10.871 1.00 52.24 N ATOM 0 H ARG A 90 4.747 8.093 6.533 1.00 34.21 H new ATOM 0 HA ARG A 90 6.266 5.550 6.784 1.00 41.23 H new ATOM 0 HB2 ARG A 90 5.940 6.621 9.024 1.00 11.31 H new ATOM 0 HB3 ARG A 90 4.221 6.756 8.715 1.00 11.31 H new ATOM 0 HG2 ARG A 90 4.476 4.849 10.143 1.00 1.22 H new ATOM 0 HG3 ARG A 90 4.135 4.201 8.551 1.00 1.22 H new ATOM 0 HD2 ARG A 90 5.950 2.905 9.561 1.00 62.51 H new ATOM 0 HD3 ARG A 90 6.588 3.799 8.195 1.00 62.51 H new ATOM 0 HE ARG A 90 6.820 5.192 10.778 1.00 13.32 H new ATOM 0 HH11 ARG A 90 8.436 2.994 8.555 1.00 12.43 H new ATOM 0 HH12 ARG A 90 10.029 3.387 9.211 1.00 12.43 H new ATOM 0 HH21 ARG A 90 8.793 5.647 11.534 1.00 52.24 H new ATOM 0 HH22 ARG A 90 10.224 4.858 10.862 1.00 52.24 H new ATOM 1395 N ALA A 91 4.401 4.436 5.500 1.00 24.42 N ATOM 1396 CA ALA A 91 3.334 3.704 4.771 1.00 35.32 C ATOM 1397 C ALA A 91 3.352 2.199 5.113 1.00 34.30 C ATOM 1398 O ALA A 91 4.378 1.541 4.964 1.00 32.53 O ATOM 1399 CB ALA A 91 3.477 3.919 3.259 1.00 61.43 C ATOM 0 H ALA A 91 5.329 4.031 5.379 1.00 24.42 H new ATOM 0 HA ALA A 91 2.372 4.104 5.090 1.00 35.32 H new ATOM 0 HB1 ALA A 91 2.688 3.376 2.738 1.00 61.43 H new ATOM 0 HB2 ALA A 91 3.396 4.982 3.033 1.00 61.43 H new ATOM 0 HB3 ALA A 91 4.449 3.551 2.929 1.00 61.43 H new ATOM 1405 N VAL A 92 2.202 1.661 5.563 1.00 54.11 N ATOM 1406 CA VAL A 92 2.070 0.245 5.981 1.00 22.11 C ATOM 1407 C VAL A 92 0.936 -0.458 5.183 1.00 33.34 C ATOM 1408 O VAL A 92 -0.233 -0.086 5.283 1.00 13.00 O ATOM 1409 CB VAL A 92 1.787 0.119 7.532 1.00 33.12 C ATOM 1410 CG1 VAL A 92 1.718 -1.368 7.974 1.00 72.03 C ATOM 1411 CG2 VAL A 92 2.833 0.906 8.371 1.00 41.44 C ATOM 0 H VAL A 92 1.336 2.193 5.648 1.00 54.11 H new ATOM 0 HA VAL A 92 3.019 -0.246 5.766 1.00 22.11 H new ATOM 0 HB VAL A 92 0.812 0.568 7.721 1.00 33.12 H new ATOM 0 HG11 VAL A 92 1.522 -1.421 9.045 1.00 72.03 H new ATOM 0 HG12 VAL A 92 0.916 -1.871 7.434 1.00 72.03 H new ATOM 0 HG13 VAL A 92 2.667 -1.857 7.754 1.00 72.03 H new ATOM 0 HG21 VAL A 92 2.606 0.796 9.431 1.00 41.44 H new ATOM 0 HG22 VAL A 92 3.830 0.513 8.171 1.00 41.44 H new ATOM 0 HG23 VAL A 92 2.797 1.961 8.100 1.00 41.44 H new ATOM 1421 N LEU A 93 1.308 -1.488 4.406 1.00 1.31 N ATOM 1422 CA LEU A 93 0.377 -2.342 3.642 1.00 72.32 C ATOM 1423 C LEU A 93 0.308 -3.738 4.307 1.00 22.00 C ATOM 1424 O LEU A 93 1.297 -4.451 4.367 1.00 50.31 O ATOM 1425 CB LEU A 93 0.853 -2.431 2.168 1.00 25.10 C ATOM 1426 CG LEU A 93 0.032 -3.354 1.206 1.00 35.15 C ATOM 1427 CD1 LEU A 93 -1.487 -3.072 1.270 1.00 52.45 C ATOM 1428 CD2 LEU A 93 0.560 -3.227 -0.241 1.00 62.14 C ATOM 0 H LEU A 93 2.284 -1.758 4.287 1.00 1.31 H new ATOM 0 HA LEU A 93 -0.626 -1.914 3.645 1.00 72.32 H new ATOM 0 HB2 LEU A 93 0.853 -1.424 1.752 1.00 25.10 H new ATOM 0 HB3 LEU A 93 1.887 -2.776 2.167 1.00 25.10 H new ATOM 0 HG LEU A 93 0.172 -4.381 1.543 1.00 35.15 H new ATOM 0 HD11 LEU A 93 -2.010 -3.739 0.584 1.00 52.45 H new ATOM 0 HD12 LEU A 93 -1.846 -3.241 2.285 1.00 52.45 H new ATOM 0 HD13 LEU A 93 -1.677 -2.037 0.986 1.00 52.45 H new ATOM 0 HD21 LEU A 93 -0.020 -3.874 -0.898 1.00 62.14 H new ATOM 0 HD22 LEU A 93 0.465 -2.193 -0.574 1.00 62.14 H new ATOM 0 HD23 LEU A 93 1.608 -3.524 -0.273 1.00 62.14 H new ATOM 1440 N GLU A 94 -0.871 -4.123 4.795 1.00 10.33 N ATOM 1441 CA GLU A 94 -1.048 -5.324 5.643 1.00 22.22 C ATOM 1442 C GLU A 94 -2.244 -6.169 5.159 1.00 2.51 C ATOM 1443 O GLU A 94 -3.191 -5.633 4.590 1.00 5.12 O ATOM 1444 CB GLU A 94 -1.249 -4.857 7.116 1.00 64.52 C ATOM 1445 CG GLU A 94 -1.526 -5.981 8.138 1.00 74.44 C ATOM 1446 CD GLU A 94 -1.646 -5.475 9.586 1.00 64.13 C ATOM 1447 OE1 GLU A 94 -2.523 -4.624 9.854 1.00 53.40 O ATOM 1448 OE2 GLU A 94 -0.876 -5.927 10.462 1.00 20.44 O ATOM 0 H GLU A 94 -1.739 -3.616 4.619 1.00 10.33 H new ATOM 0 HA GLU A 94 -0.164 -5.958 5.577 1.00 22.22 H new ATOM 0 HB2 GLU A 94 -0.358 -4.314 7.432 1.00 64.52 H new ATOM 0 HB3 GLU A 94 -2.079 -4.151 7.145 1.00 64.52 H new ATOM 0 HG2 GLU A 94 -2.448 -6.493 7.862 1.00 74.44 H new ATOM 0 HG3 GLU A 94 -0.724 -6.717 8.084 1.00 74.44 H new ATOM 1455 N VAL A 95 -2.184 -7.502 5.367 1.00 25.35 N ATOM 1456 CA VAL A 95 -3.324 -8.415 5.113 1.00 22.54 C ATOM 1457 C VAL A 95 -3.765 -9.072 6.441 1.00 53.22 C ATOM 1458 O VAL A 95 -3.014 -9.851 7.043 1.00 34.51 O ATOM 1459 CB VAL A 95 -2.981 -9.533 4.057 1.00 45.14 C ATOM 1460 CG1 VAL A 95 -4.228 -10.388 3.721 1.00 74.21 C ATOM 1461 CG2 VAL A 95 -2.376 -8.928 2.772 1.00 11.42 C ATOM 0 H VAL A 95 -1.350 -7.975 5.714 1.00 25.35 H new ATOM 0 HA VAL A 95 -4.134 -7.816 4.697 1.00 22.54 H new ATOM 0 HB VAL A 95 -2.232 -10.185 4.507 1.00 45.14 H new ATOM 0 HG11 VAL A 95 -3.960 -11.151 2.990 1.00 74.21 H new ATOM 0 HG12 VAL A 95 -4.595 -10.868 4.628 1.00 74.21 H new ATOM 0 HG13 VAL A 95 -5.008 -9.748 3.308 1.00 74.21 H new ATOM 0 HG21 VAL A 95 -2.151 -9.726 2.065 1.00 11.42 H new ATOM 0 HG22 VAL A 95 -3.090 -8.237 2.324 1.00 11.42 H new ATOM 0 HG23 VAL A 95 -1.459 -8.393 3.019 1.00 11.42 H new ATOM 1471 N VAL A 96 -4.984 -8.737 6.884 1.00 54.14 N ATOM 1472 CA VAL A 96 -5.590 -9.265 8.122 1.00 51.40 C ATOM 1473 C VAL A 96 -6.440 -10.527 7.799 1.00 41.30 C ATOM 1474 O VAL A 96 -7.424 -10.419 7.052 1.00 42.33 O ATOM 1475 CB VAL A 96 -6.499 -8.166 8.803 1.00 11.24 C ATOM 1476 CG1 VAL A 96 -7.184 -8.691 10.092 1.00 41.44 C ATOM 1477 CG2 VAL A 96 -5.688 -6.871 9.079 1.00 63.24 C ATOM 0 H VAL A 96 -5.589 -8.082 6.388 1.00 54.14 H new ATOM 0 HA VAL A 96 -4.792 -9.536 8.813 1.00 51.40 H new ATOM 0 HB VAL A 96 -7.296 -7.923 8.101 1.00 11.24 H new ATOM 0 HG11 VAL A 96 -7.798 -7.901 10.525 1.00 41.44 H new ATOM 0 HG12 VAL A 96 -7.813 -9.547 9.847 1.00 41.44 H new ATOM 0 HG13 VAL A 96 -6.423 -8.994 10.811 1.00 41.44 H new ATOM 0 HG21 VAL A 96 -6.335 -6.130 9.548 1.00 63.24 H new ATOM 0 HG22 VAL A 96 -4.855 -7.098 9.744 1.00 63.24 H new ATOM 0 HG23 VAL A 96 -5.304 -6.475 8.139 1.00 63.24 H new ATOM 1487 N PRO A 97 -6.063 -11.749 8.318 1.00 73.01 N ATOM 1488 CA PRO A 97 -6.902 -12.976 8.186 1.00 41.34 C ATOM 1489 C PRO A 97 -8.247 -12.883 8.979 1.00 14.20 C ATOM 1490 O PRO A 97 -8.395 -13.458 10.062 1.00 2.14 O ATOM 1491 CB PRO A 97 -5.971 -14.116 8.723 1.00 53.24 C ATOM 1492 CG PRO A 97 -4.591 -13.518 8.738 1.00 32.13 C ATOM 1493 CD PRO A 97 -4.787 -12.046 9.018 1.00 72.22 C ATOM 0 HA PRO A 97 -7.227 -13.145 7.159 1.00 41.34 H new ATOM 0 HB2 PRO A 97 -6.273 -14.435 9.720 1.00 53.24 H new ATOM 0 HB3 PRO A 97 -6.013 -14.995 8.080 1.00 53.24 H new ATOM 0 HG2 PRO A 97 -3.971 -13.983 9.504 1.00 32.13 H new ATOM 0 HG3 PRO A 97 -4.087 -13.671 7.784 1.00 32.13 H new ATOM 0 HD2 PRO A 97 -4.854 -11.842 10.087 1.00 72.22 H new ATOM 0 HD3 PRO A 97 -3.963 -11.447 8.630 1.00 72.22 H new ATOM 1501 N ARG A 98 -9.215 -12.135 8.409 1.00 43.41 N ATOM 1502 CA ARG A 98 -10.548 -11.881 9.023 1.00 12.33 C ATOM 1503 C ARG A 98 -11.429 -13.163 9.051 1.00 45.13 C ATOM 1504 O ARG A 98 -12.208 -13.390 9.987 1.00 53.21 O ATOM 1505 CB ARG A 98 -11.243 -10.712 8.235 1.00 12.40 C ATOM 1506 CG ARG A 98 -12.724 -10.393 8.631 1.00 54.13 C ATOM 1507 CD ARG A 98 -13.778 -10.997 7.663 1.00 3.24 C ATOM 1508 NE ARG A 98 -15.139 -10.953 8.231 1.00 15.35 N ATOM 1509 CZ ARG A 98 -16.261 -11.097 7.560 1.00 0.24 C ATOM 1510 NH1 ARG A 98 -16.270 -11.207 6.268 1.00 11.13 N ATOM 1511 NH2 ARG A 98 -17.379 -11.121 8.201 1.00 42.43 N ATOM 0 H ARG A 98 -9.098 -11.684 7.502 1.00 43.41 H new ATOM 0 HA ARG A 98 -10.416 -11.589 10.065 1.00 12.33 H new ATOM 0 HB2 ARG A 98 -10.650 -9.808 8.371 1.00 12.40 H new ATOM 0 HB3 ARG A 98 -11.217 -10.953 7.172 1.00 12.40 H new ATOM 0 HG2 ARG A 98 -12.910 -10.770 9.637 1.00 54.13 H new ATOM 0 HG3 ARG A 98 -12.855 -9.312 8.667 1.00 54.13 H new ATOM 0 HD2 ARG A 98 -13.761 -10.450 6.721 1.00 3.24 H new ATOM 0 HD3 ARG A 98 -13.513 -12.030 7.437 1.00 3.24 H new ATOM 0 HE ARG A 98 -15.217 -10.797 9.236 1.00 15.35 H new ATOM 0 HH11 ARG A 98 -15.393 -11.183 5.748 1.00 11.13 H new ATOM 0 HH12 ARG A 98 -17.154 -11.318 5.772 1.00 11.13 H new ATOM 0 HH21 ARG A 98 -17.387 -11.029 9.217 1.00 42.43 H new ATOM 0 HH22 ARG A 98 -18.256 -11.232 7.692 1.00 42.43 H new ATOM 1525 N ASP A 99 -11.259 -13.992 8.019 1.00 53.21 N ATOM 1526 CA ASP A 99 -12.044 -15.217 7.777 1.00 11.42 C ATOM 1527 C ASP A 99 -11.195 -16.200 6.921 1.00 71.33 C ATOM 1528 O ASP A 99 -10.173 -15.801 6.342 1.00 10.53 O ATOM 1529 CB ASP A 99 -13.377 -14.821 7.072 1.00 74.22 C ATOM 1530 CG ASP A 99 -14.256 -16.006 6.651 1.00 15.41 C ATOM 1531 OD1 ASP A 99 -14.931 -16.595 7.512 1.00 35.21 O ATOM 1532 OD2 ASP A 99 -14.262 -16.357 5.450 1.00 24.52 O ATOM 0 H ASP A 99 -10.551 -13.829 7.303 1.00 53.21 H new ATOM 0 HA ASP A 99 -12.292 -15.721 8.711 1.00 11.42 H new ATOM 0 HB2 ASP A 99 -13.951 -14.181 7.742 1.00 74.22 H new ATOM 0 HB3 ASP A 99 -13.142 -14.228 6.188 1.00 74.22 H new ATOM 1537 N ASP A 100 -11.616 -17.475 6.859 1.00 61.45 N ATOM 1538 CA ASP A 100 -10.938 -18.532 6.068 1.00 52.03 C ATOM 1539 C ASP A 100 -10.876 -18.177 4.556 1.00 61.01 C ATOM 1540 O ASP A 100 -9.810 -18.255 3.933 1.00 62.32 O ATOM 1541 CB ASP A 100 -11.679 -19.876 6.265 1.00 61.43 C ATOM 1542 CG ASP A 100 -11.702 -20.333 7.732 1.00 11.22 C ATOM 1543 OD1 ASP A 100 -12.451 -19.738 8.534 1.00 62.14 O ATOM 1544 OD2 ASP A 100 -10.975 -21.285 8.095 1.00 21.23 O ATOM 0 H ASP A 100 -12.441 -17.809 7.357 1.00 61.45 H new ATOM 0 HA ASP A 100 -9.912 -18.614 6.426 1.00 52.03 H new ATOM 0 HB2 ASP A 100 -12.703 -19.778 5.904 1.00 61.43 H new ATOM 0 HB3 ASP A 100 -11.199 -20.643 5.658 1.00 61.43 H new ATOM 1549 N ARG A 101 -12.030 -17.774 3.996 1.00 44.34 N ATOM 1550 CA ARG A 101 -12.177 -17.433 2.559 1.00 13.13 C ATOM 1551 C ARG A 101 -12.127 -15.887 2.343 1.00 12.34 C ATOM 1552 O ARG A 101 -12.127 -15.418 1.212 1.00 20.02 O ATOM 1553 CB ARG A 101 -13.526 -18.045 2.006 1.00 40.14 C ATOM 1554 CG ARG A 101 -13.470 -18.677 0.583 1.00 32.52 C ATOM 1555 CD ARG A 101 -13.127 -17.683 -0.545 1.00 11.52 C ATOM 1556 NE ARG A 101 -13.029 -18.323 -1.866 1.00 12.24 N ATOM 1557 CZ ARG A 101 -11.960 -18.932 -2.346 1.00 61.24 C ATOM 1558 NH1 ARG A 101 -10.906 -19.128 -1.618 1.00 72.51 N ATOM 1559 NH2 ARG A 101 -11.967 -19.378 -3.556 1.00 64.14 N ATOM 0 H ARG A 101 -12.896 -17.673 4.526 1.00 44.34 H new ATOM 0 HA ARG A 101 -11.343 -17.864 2.005 1.00 13.13 H new ATOM 0 HB2 ARG A 101 -13.866 -18.809 2.705 1.00 40.14 H new ATOM 0 HB3 ARG A 101 -14.281 -17.259 2.001 1.00 40.14 H new ATOM 0 HG2 ARG A 101 -12.729 -19.477 0.583 1.00 32.52 H new ATOM 0 HG3 ARG A 101 -14.434 -19.136 0.365 1.00 32.52 H new ATOM 0 HD2 ARG A 101 -13.890 -16.905 -0.580 1.00 11.52 H new ATOM 0 HD3 ARG A 101 -12.181 -17.192 -0.314 1.00 11.52 H new ATOM 0 HE ARG A 101 -13.857 -18.294 -2.461 1.00 12.24 H new ATOM 0 HH11 ARG A 101 -10.889 -18.809 -0.649 1.00 72.51 H new ATOM 0 HH12 ARG A 101 -10.094 -19.601 -2.014 1.00 72.51 H new ATOM 0 HH21 ARG A 101 -12.796 -19.260 -4.138 1.00 64.14 H new ATOM 0 HH22 ARG A 101 -11.143 -19.849 -3.931 1.00 64.14 H new ATOM 1573 N HIS A 102 -12.098 -15.083 3.429 1.00 54.43 N ATOM 1574 CA HIS A 102 -12.146 -13.598 3.324 1.00 15.52 C ATOM 1575 C HIS A 102 -11.047 -12.934 4.174 1.00 15.11 C ATOM 1576 O HIS A 102 -10.929 -13.202 5.362 1.00 22.14 O ATOM 1577 CB HIS A 102 -13.546 -13.072 3.736 1.00 61.54 C ATOM 1578 CG HIS A 102 -14.669 -13.643 2.908 1.00 64.21 C ATOM 1579 ND1 HIS A 102 -15.516 -14.627 3.366 1.00 2.04 N ATOM 1580 CD2 HIS A 102 -15.068 -13.375 1.642 1.00 11.44 C ATOM 1581 CE1 HIS A 102 -16.383 -14.936 2.428 1.00 75.14 C ATOM 1582 NE2 HIS A 102 -16.132 -14.192 1.373 1.00 71.51 N ATOM 0 H HIS A 102 -12.042 -15.430 4.386 1.00 54.43 H new ATOM 0 HA HIS A 102 -11.962 -13.332 2.283 1.00 15.52 H new ATOM 0 HB2 HIS A 102 -13.721 -13.310 4.785 1.00 61.54 H new ATOM 0 HB3 HIS A 102 -13.557 -11.985 3.650 1.00 61.54 H new ATOM 0 HD1 HIS A 102 -15.477 -15.052 4.293 1.00 2.04 H new ATOM 0 HD2 HIS A 102 -14.629 -12.652 0.971 1.00 11.44 H new ATOM 0 HE1 HIS A 102 -17.167 -15.674 2.510 1.00 75.14 H new ATOM 1591 N CYS A 103 -10.267 -12.035 3.562 1.00 71.25 N ATOM 1592 CA CYS A 103 -9.160 -11.323 4.248 1.00 71.24 C ATOM 1593 C CYS A 103 -9.267 -9.809 3.995 1.00 3.11 C ATOM 1594 O CYS A 103 -9.491 -9.378 2.859 1.00 52.55 O ATOM 1595 CB CYS A 103 -7.796 -11.841 3.750 1.00 43.44 C ATOM 1596 SG CYS A 103 -7.452 -11.502 2.010 1.00 73.23 S ATOM 0 H CYS A 103 -10.377 -11.775 2.582 1.00 71.25 H new ATOM 0 HA CYS A 103 -9.238 -11.513 5.319 1.00 71.24 H new ATOM 0 HB2 CYS A 103 -7.009 -11.393 4.356 1.00 43.44 H new ATOM 0 HB3 CYS A 103 -7.750 -12.918 3.913 1.00 43.44 H new ATOM 0 HG CYS A 103 -7.948 -12.453 1.276 1.00 73.23 H new ATOM 1602 N THR A 104 -9.122 -9.003 5.058 1.00 21.35 N ATOM 1603 CA THR A 104 -9.207 -7.533 4.952 1.00 21.44 C ATOM 1604 C THR A 104 -7.804 -6.928 4.723 1.00 12.43 C ATOM 1605 O THR A 104 -6.968 -6.936 5.629 1.00 72.42 O ATOM 1606 CB THR A 104 -9.858 -6.892 6.225 1.00 42.43 C ATOM 1607 OG1 THR A 104 -11.113 -7.539 6.502 1.00 33.20 O ATOM 1608 CG2 THR A 104 -10.092 -5.373 6.047 1.00 42.51 C ATOM 0 H THR A 104 -8.945 -9.342 6.003 1.00 21.35 H new ATOM 0 HA THR A 104 -9.845 -7.307 4.098 1.00 21.44 H new ATOM 0 HB THR A 104 -9.169 -7.031 7.058 1.00 42.43 H new ATOM 0 HG1 THR A 104 -11.519 -7.139 7.299 1.00 33.20 H new ATOM 0 HG21 THR A 104 -10.545 -4.966 6.951 1.00 42.51 H new ATOM 0 HG22 THR A 104 -9.139 -4.877 5.864 1.00 42.51 H new ATOM 0 HG23 THR A 104 -10.758 -5.204 5.201 1.00 42.51 H new ATOM 1616 N VAL A 105 -7.556 -6.393 3.511 1.00 1.10 N ATOM 1617 CA VAL A 105 -6.257 -5.785 3.156 1.00 60.45 C ATOM 1618 C VAL A 105 -6.292 -4.270 3.454 1.00 62.13 C ATOM 1619 O VAL A 105 -7.085 -3.520 2.867 1.00 70.35 O ATOM 1620 CB VAL A 105 -5.883 -6.051 1.651 1.00 13.42 C ATOM 1621 CG1 VAL A 105 -4.486 -5.475 1.295 1.00 43.41 C ATOM 1622 CG2 VAL A 105 -5.958 -7.563 1.342 1.00 61.34 C ATOM 0 H VAL A 105 -8.243 -6.370 2.757 1.00 1.10 H new ATOM 0 HA VAL A 105 -5.483 -6.251 3.766 1.00 60.45 H new ATOM 0 HB VAL A 105 -6.610 -5.532 1.027 1.00 13.42 H new ATOM 0 HG11 VAL A 105 -4.264 -5.679 0.247 1.00 43.41 H new ATOM 0 HG12 VAL A 105 -4.483 -4.398 1.463 1.00 43.41 H new ATOM 0 HG13 VAL A 105 -3.729 -5.943 1.924 1.00 43.41 H new ATOM 0 HG21 VAL A 105 -5.697 -7.734 0.298 1.00 61.34 H new ATOM 0 HG22 VAL A 105 -5.260 -8.101 1.983 1.00 61.34 H new ATOM 0 HG23 VAL A 105 -6.970 -7.922 1.527 1.00 61.34 H new ATOM 1632 N VAL A 106 -5.433 -3.850 4.388 1.00 2.22 N ATOM 1633 CA VAL A 106 -5.388 -2.481 4.921 1.00 15.23 C ATOM 1634 C VAL A 106 -4.135 -1.748 4.390 1.00 20.32 C ATOM 1635 O VAL A 106 -3.008 -2.080 4.775 1.00 5.13 O ATOM 1636 CB VAL A 106 -5.361 -2.503 6.499 1.00 4.45 C ATOM 1637 CG1 VAL A 106 -5.371 -1.069 7.098 1.00 2.42 C ATOM 1638 CG2 VAL A 106 -6.523 -3.364 7.060 1.00 63.42 C ATOM 0 H VAL A 106 -4.734 -4.464 4.805 1.00 2.22 H new ATOM 0 HA VAL A 106 -6.282 -1.952 4.592 1.00 15.23 H new ATOM 0 HB VAL A 106 -4.423 -2.966 6.806 1.00 4.45 H new ATOM 0 HG11 VAL A 106 -5.352 -1.129 8.186 1.00 2.42 H new ATOM 0 HG12 VAL A 106 -4.495 -0.523 6.749 1.00 2.42 H new ATOM 0 HG13 VAL A 106 -6.274 -0.548 6.779 1.00 2.42 H new ATOM 0 HG21 VAL A 106 -6.483 -3.364 8.149 1.00 63.42 H new ATOM 0 HG22 VAL A 106 -7.475 -2.948 6.732 1.00 63.42 H new ATOM 0 HG23 VAL A 106 -6.428 -4.386 6.694 1.00 63.42 H new ATOM 1648 N TRP A 107 -4.333 -0.762 3.502 1.00 75.53 N ATOM 1649 CA TRP A 107 -3.229 0.062 2.962 1.00 24.31 C ATOM 1650 C TRP A 107 -3.242 1.442 3.656 1.00 61.13 C ATOM 1651 O TRP A 107 -4.262 2.139 3.658 1.00 0.24 O ATOM 1652 CB TRP A 107 -3.345 0.208 1.417 1.00 14.12 C ATOM 1653 CG TRP A 107 -2.071 0.658 0.720 1.00 65.25 C ATOM 1654 CD1 TRP A 107 -0.824 0.829 1.272 1.00 34.12 C ATOM 1655 CD2 TRP A 107 -1.925 0.964 -0.672 1.00 13.51 C ATOM 1656 NE1 TRP A 107 0.063 1.227 0.315 1.00 41.34 N ATOM 1657 CE2 TRP A 107 -0.582 1.319 -0.886 1.00 31.13 C ATOM 1658 CE3 TRP A 107 -2.807 0.977 -1.755 1.00 40.43 C ATOM 1659 CZ2 TRP A 107 -0.096 1.685 -2.138 1.00 34.54 C ATOM 1660 CZ3 TRP A 107 -2.325 1.340 -2.998 1.00 4.14 C ATOM 1661 CH2 TRP A 107 -0.980 1.688 -3.181 1.00 34.32 C ATOM 0 H TRP A 107 -5.252 -0.511 3.138 1.00 75.53 H new ATOM 0 HA TRP A 107 -2.279 -0.431 3.167 1.00 24.31 H new ATOM 0 HB2 TRP A 107 -3.652 -0.750 0.998 1.00 14.12 H new ATOM 0 HB3 TRP A 107 -4.137 0.923 1.192 1.00 14.12 H new ATOM 0 HD1 TRP A 107 -0.581 0.671 2.313 1.00 34.12 H new ATOM 0 HE1 TRP A 107 1.051 1.425 0.471 1.00 41.34 H new ATOM 0 HE3 TRP A 107 -3.845 0.709 -1.623 1.00 40.43 H new ATOM 0 HZ2 TRP A 107 0.940 1.956 -2.280 1.00 34.54 H new ATOM 0 HZ3 TRP A 107 -2.997 1.356 -3.844 1.00 4.14 H new ATOM 0 HH2 TRP A 107 -0.635 1.964 -4.166 1.00 34.32 H new ATOM 1672 N THR A 108 -2.101 1.820 4.241 1.00 4.23 N ATOM 1673 CA THR A 108 -1.965 3.022 5.090 1.00 70.35 C ATOM 1674 C THR A 108 -0.730 3.849 4.658 1.00 63.43 C ATOM 1675 O THR A 108 0.251 3.296 4.169 1.00 34.30 O ATOM 1676 CB THR A 108 -1.838 2.604 6.604 1.00 74.44 C ATOM 1677 OG1 THR A 108 -2.961 1.779 6.979 1.00 32.30 O ATOM 1678 CG2 THR A 108 -1.760 3.812 7.564 1.00 45.21 C ATOM 0 H THR A 108 -1.231 1.297 4.141 1.00 4.23 H new ATOM 0 HA THR A 108 -2.856 3.638 4.969 1.00 70.35 H new ATOM 0 HB THR A 108 -0.902 2.053 6.696 1.00 74.44 H new ATOM 0 HG1 THR A 108 -2.877 1.520 7.920 1.00 32.30 H new ATOM 0 HG21 THR A 108 -1.674 3.456 8.591 1.00 45.21 H new ATOM 0 HG22 THR A 108 -0.889 4.418 7.316 1.00 45.21 H new ATOM 0 HG23 THR A 108 -2.662 4.415 7.464 1.00 45.21 H new ATOM 1686 N ALA A 109 -0.832 5.175 4.807 1.00 32.15 N ATOM 1687 CA ALA A 109 0.282 6.134 4.675 1.00 33.44 C ATOM 1688 C ALA A 109 0.037 7.317 5.632 1.00 20.11 C ATOM 1689 O ALA A 109 -1.095 7.572 6.012 1.00 54.12 O ATOM 1690 CB ALA A 109 0.419 6.635 3.227 1.00 70.14 C ATOM 0 H ALA A 109 -1.718 5.629 5.030 1.00 32.15 H new ATOM 0 HA ALA A 109 1.214 5.633 4.936 1.00 33.44 H new ATOM 0 HB1 ALA A 109 1.248 7.340 3.163 1.00 70.14 H new ATOM 0 HB2 ALA A 109 0.609 5.790 2.566 1.00 70.14 H new ATOM 0 HB3 ALA A 109 -0.503 7.131 2.925 1.00 70.14 H new ATOM 1696 N MET A 110 1.104 8.023 6.027 1.00 3.05 N ATOM 1697 CA MET A 110 1.009 9.237 6.874 1.00 13.32 C ATOM 1698 C MET A 110 2.311 10.052 6.806 1.00 53.14 C ATOM 1699 O MET A 110 3.403 9.492 6.686 1.00 13.21 O ATOM 1700 CB MET A 110 0.611 8.896 8.345 1.00 10.22 C ATOM 1701 CG MET A 110 1.449 7.806 9.019 1.00 14.41 C ATOM 1702 SD MET A 110 0.809 7.372 10.654 1.00 44.14 S ATOM 1703 CE MET A 110 1.837 5.970 11.089 1.00 14.12 C ATOM 0 H MET A 110 2.060 7.776 5.773 1.00 3.05 H new ATOM 0 HA MET A 110 0.207 9.857 6.474 1.00 13.32 H new ATOM 0 HB2 MET A 110 0.681 9.805 8.942 1.00 10.22 H new ATOM 0 HB3 MET A 110 -0.434 8.586 8.358 1.00 10.22 H new ATOM 0 HG2 MET A 110 1.463 6.917 8.388 1.00 14.41 H new ATOM 0 HG3 MET A 110 2.480 8.147 9.112 1.00 14.41 H new ATOM 0 HE1 MET A 110 1.551 5.601 12.074 1.00 14.12 H new ATOM 0 HE2 MET A 110 1.703 5.178 10.352 1.00 14.12 H new ATOM 0 HE3 MET A 110 2.883 6.277 11.106 1.00 14.12 H new ATOM 1713 N PHE A 111 2.171 11.386 6.884 1.00 14.31 N ATOM 1714 CA PHE A 111 3.265 12.346 6.603 1.00 31.23 C ATOM 1715 C PHE A 111 3.000 13.718 7.255 1.00 4.45 C ATOM 1716 O PHE A 111 1.857 14.088 7.532 1.00 11.35 O ATOM 1717 CB PHE A 111 3.509 12.476 5.052 1.00 41.22 C ATOM 1718 CG PHE A 111 2.253 12.412 4.159 1.00 42.42 C ATOM 1719 CD1 PHE A 111 1.370 13.483 4.055 1.00 1.30 C ATOM 1720 CD2 PHE A 111 1.966 11.263 3.415 1.00 63.03 C ATOM 1721 CE1 PHE A 111 0.250 13.403 3.241 1.00 23.23 C ATOM 1722 CE2 PHE A 111 0.853 11.185 2.609 1.00 73.20 C ATOM 1723 CZ PHE A 111 -0.006 12.252 2.519 1.00 35.21 C ATOM 0 H PHE A 111 1.294 11.836 7.145 1.00 14.31 H new ATOM 0 HA PHE A 111 4.177 11.954 7.053 1.00 31.23 H new ATOM 0 HB2 PHE A 111 4.016 13.422 4.863 1.00 41.22 H new ATOM 0 HB3 PHE A 111 4.189 11.682 4.744 1.00 41.22 H new ATOM 0 HD1 PHE A 111 1.559 14.387 4.615 1.00 1.30 H new ATOM 0 HD2 PHE A 111 2.634 10.416 3.474 1.00 63.03 H new ATOM 0 HE1 PHE A 111 -0.425 14.243 3.171 1.00 23.23 H new ATOM 0 HE2 PHE A 111 0.655 10.284 2.047 1.00 73.20 H new ATOM 0 HZ PHE A 111 -0.879 12.193 1.886 1.00 35.21 H new ATOM 1733 N ASP A 112 4.088 14.454 7.502 1.00 55.23 N ATOM 1734 CA ASP A 112 4.051 15.820 8.030 1.00 12.41 C ATOM 1735 C ASP A 112 3.815 16.807 6.868 1.00 44.40 C ATOM 1736 O ASP A 112 4.755 17.287 6.224 1.00 61.21 O ATOM 1737 CB ASP A 112 5.369 16.112 8.784 1.00 15.23 C ATOM 1738 CG ASP A 112 5.458 17.543 9.326 1.00 54.31 C ATOM 1739 OD1 ASP A 112 4.784 17.849 10.333 1.00 21.21 O ATOM 1740 OD2 ASP A 112 6.200 18.373 8.749 1.00 60.32 O ATOM 0 H ASP A 112 5.034 14.111 7.338 1.00 55.23 H new ATOM 0 HA ASP A 112 3.231 15.938 8.738 1.00 12.41 H new ATOM 0 HB2 ASP A 112 5.467 15.411 9.613 1.00 15.23 H new ATOM 0 HB3 ASP A 112 6.210 15.933 8.114 1.00 15.23 H new ATOM 1745 N CYS A 113 2.535 16.996 6.547 1.00 62.13 N ATOM 1746 CA CYS A 113 2.078 17.959 5.520 1.00 33.03 C ATOM 1747 C CYS A 113 1.269 19.114 6.155 1.00 14.24 C ATOM 1748 O CYS A 113 0.651 18.934 7.213 1.00 50.30 O ATOM 1749 CB CYS A 113 1.224 17.224 4.469 1.00 30.24 C ATOM 1750 SG CYS A 113 0.520 18.295 3.193 1.00 75.22 S ATOM 0 H CYS A 113 1.772 16.485 6.991 1.00 62.13 H new ATOM 0 HA CYS A 113 2.954 18.393 5.039 1.00 33.03 H new ATOM 0 HB2 CYS A 113 1.838 16.463 3.988 1.00 30.24 H new ATOM 0 HB3 CYS A 113 0.412 16.704 4.978 1.00 30.24 H new ATOM 0 HG CYS A 113 -0.275 19.163 3.745 1.00 75.22 H new ATOM 1756 N SER A 114 1.282 20.297 5.499 1.00 63.03 N ATOM 1757 CA SER A 114 0.498 21.488 5.935 1.00 73.55 C ATOM 1758 C SER A 114 -1.027 21.177 5.918 1.00 2.22 C ATOM 1759 O SER A 114 -1.511 20.658 4.917 1.00 40.05 O ATOM 1760 CB SER A 114 0.816 22.689 5.007 1.00 24.11 C ATOM 1761 OG SER A 114 0.484 22.407 3.655 1.00 2.22 O ATOM 0 H SER A 114 1.832 20.458 4.655 1.00 63.03 H new ATOM 0 HA SER A 114 0.780 21.742 6.957 1.00 73.55 H new ATOM 0 HB2 SER A 114 0.262 23.566 5.343 1.00 24.11 H new ATOM 0 HB3 SER A 114 1.876 22.934 5.079 1.00 24.11 H new ATOM 0 HG SER A 114 0.695 23.185 3.097 1.00 2.22 H new ATOM 1767 N PRO A 115 -1.801 21.518 7.015 1.00 73.33 N ATOM 1768 CA PRO A 115 -3.187 20.984 7.276 1.00 2.41 C ATOM 1769 C PRO A 115 -4.170 21.008 6.063 1.00 1.42 C ATOM 1770 O PRO A 115 -4.872 20.018 5.812 1.00 20.31 O ATOM 1771 CB PRO A 115 -3.706 21.871 8.455 1.00 30.33 C ATOM 1772 CG PRO A 115 -2.735 23.017 8.543 1.00 20.25 C ATOM 1773 CD PRO A 115 -1.405 22.459 8.093 1.00 5.43 C ATOM 0 HA PRO A 115 -3.139 19.918 7.499 1.00 2.41 H new ATOM 0 HB2 PRO A 115 -4.719 22.227 8.264 1.00 30.33 H new ATOM 0 HB3 PRO A 115 -3.736 21.308 9.388 1.00 30.33 H new ATOM 0 HG2 PRO A 115 -3.048 23.845 7.907 1.00 20.25 H new ATOM 0 HG3 PRO A 115 -2.674 23.402 9.561 1.00 20.25 H new ATOM 0 HD2 PRO A 115 -0.740 23.241 7.726 1.00 5.43 H new ATOM 0 HD3 PRO A 115 -0.883 21.951 8.904 1.00 5.43 H new ATOM 1781 N GLU A 116 -4.200 22.127 5.310 1.00 11.51 N ATOM 1782 CA GLU A 116 -5.116 22.292 4.143 1.00 23.54 C ATOM 1783 C GLU A 116 -4.696 21.403 2.945 1.00 13.42 C ATOM 1784 O GLU A 116 -5.549 20.830 2.251 1.00 23.42 O ATOM 1785 CB GLU A 116 -5.190 23.781 3.722 1.00 74.30 C ATOM 1786 CG GLU A 116 -5.631 24.720 4.858 1.00 43.31 C ATOM 1787 CD GLU A 116 -5.875 26.166 4.397 1.00 50.13 C ATOM 1788 OE1 GLU A 116 -4.906 26.955 4.333 1.00 35.13 O ATOM 1789 OE2 GLU A 116 -7.042 26.521 4.101 1.00 40.01 O ATOM 0 H GLU A 116 -3.603 22.935 5.483 1.00 11.51 H new ATOM 0 HA GLU A 116 -6.108 21.964 4.455 1.00 23.54 H new ATOM 0 HB2 GLU A 116 -4.212 24.097 3.360 1.00 74.30 H new ATOM 0 HB3 GLU A 116 -5.886 23.880 2.889 1.00 74.30 H new ATOM 0 HG2 GLU A 116 -6.545 24.331 5.307 1.00 43.31 H new ATOM 0 HG3 GLU A 116 -4.868 24.719 5.637 1.00 43.31 H new ATOM 1796 N THR A 117 -3.377 21.285 2.720 1.00 60.32 N ATOM 1797 CA THR A 117 -2.805 20.371 1.696 1.00 22.02 C ATOM 1798 C THR A 117 -2.857 18.899 2.177 1.00 35.12 C ATOM 1799 O THR A 117 -2.967 17.979 1.375 1.00 62.31 O ATOM 1800 CB THR A 117 -1.327 20.775 1.349 1.00 22.13 C ATOM 1801 OG1 THR A 117 -1.282 22.159 0.951 1.00 4.32 O ATOM 1802 CG2 THR A 117 -0.705 19.915 0.226 1.00 30.03 C ATOM 0 H THR A 117 -2.674 21.814 3.236 1.00 60.32 H new ATOM 0 HA THR A 117 -3.411 20.462 0.794 1.00 22.02 H new ATOM 0 HB THR A 117 -0.741 20.605 2.252 1.00 22.13 H new ATOM 0 HG1 THR A 117 -0.359 22.408 0.737 1.00 4.32 H new ATOM 0 HG21 THR A 117 0.316 20.247 0.037 1.00 30.03 H new ATOM 0 HG22 THR A 117 -0.695 18.869 0.532 1.00 30.03 H new ATOM 0 HG23 THR A 117 -1.296 20.022 -0.684 1.00 30.03 H new ATOM 1810 N ALA A 118 -2.842 18.711 3.512 1.00 24.23 N ATOM 1811 CA ALA A 118 -2.791 17.385 4.165 1.00 13.41 C ATOM 1812 C ALA A 118 -4.108 16.607 3.949 1.00 14.10 C ATOM 1813 O ALA A 118 -4.097 15.471 3.466 1.00 3.01 O ATOM 1814 CB ALA A 118 -2.495 17.562 5.663 1.00 1.45 C ATOM 0 H ALA A 118 -2.865 19.485 4.176 1.00 24.23 H new ATOM 0 HA ALA A 118 -1.991 16.800 3.712 1.00 13.41 H new ATOM 0 HB1 ALA A 118 -2.457 16.585 6.144 1.00 1.45 H new ATOM 0 HB2 ALA A 118 -1.536 18.065 5.787 1.00 1.45 H new ATOM 0 HB3 ALA A 118 -3.281 18.162 6.121 1.00 1.45 H new ATOM 1820 N ARG A 119 -5.245 17.277 4.263 1.00 71.14 N ATOM 1821 CA ARG A 119 -6.607 16.720 4.051 1.00 0.31 C ATOM 1822 C ARG A 119 -6.898 16.493 2.547 1.00 53.40 C ATOM 1823 O ARG A 119 -7.642 15.573 2.178 1.00 0.21 O ATOM 1824 CB ARG A 119 -7.697 17.631 4.693 1.00 52.34 C ATOM 1825 CG ARG A 119 -7.668 19.106 4.225 1.00 64.42 C ATOM 1826 CD ARG A 119 -8.825 19.947 4.800 1.00 24.04 C ATOM 1827 NE ARG A 119 -10.120 19.618 4.165 1.00 21.23 N ATOM 1828 CZ ARG A 119 -11.303 19.688 4.738 1.00 61.31 C ATOM 1829 NH1 ARG A 119 -11.436 19.946 6.007 1.00 73.00 N ATOM 1830 NH2 ARG A 119 -12.356 19.483 4.025 1.00 2.15 N ATOM 0 H ARG A 119 -5.245 18.213 4.668 1.00 71.14 H new ATOM 0 HA ARG A 119 -6.642 15.751 4.548 1.00 0.31 H new ATOM 0 HB2 ARG A 119 -8.678 17.213 4.469 1.00 52.34 H new ATOM 0 HB3 ARG A 119 -7.580 17.606 5.776 1.00 52.34 H new ATOM 0 HG2 ARG A 119 -6.719 19.555 4.519 1.00 64.42 H new ATOM 0 HG3 ARG A 119 -7.711 19.136 3.136 1.00 64.42 H new ATOM 0 HD2 ARG A 119 -8.896 19.779 5.875 1.00 24.04 H new ATOM 0 HD3 ARG A 119 -8.610 21.006 4.656 1.00 24.04 H new ATOM 0 HE ARG A 119 -10.094 19.308 3.193 1.00 21.23 H new ATOM 0 HH11 ARG A 119 -10.610 20.100 6.585 1.00 73.00 H new ATOM 0 HH12 ARG A 119 -12.366 19.994 6.423 1.00 73.00 H new ATOM 0 HH21 ARG A 119 -12.266 19.270 3.032 1.00 2.15 H new ATOM 0 HH22 ARG A 119 -13.280 19.534 4.454 1.00 2.15 H new ATOM 1844 N GLU A 120 -6.285 17.339 1.696 1.00 22.33 N ATOM 1845 CA GLU A 120 -6.362 17.201 0.227 1.00 61.44 C ATOM 1846 C GLU A 120 -5.629 15.917 -0.242 1.00 60.31 C ATOM 1847 O GLU A 120 -6.171 15.151 -1.034 1.00 73.03 O ATOM 1848 CB GLU A 120 -5.774 18.454 -0.473 1.00 65.44 C ATOM 1849 CG GLU A 120 -5.812 18.396 -2.017 1.00 1.41 C ATOM 1850 CD GLU A 120 -5.256 19.655 -2.699 1.00 35.31 C ATOM 1851 OE1 GLU A 120 -4.035 19.896 -2.601 1.00 25.35 O ATOM 1852 OE2 GLU A 120 -6.034 20.404 -3.343 1.00 44.24 O ATOM 0 H GLU A 120 -5.725 18.134 2.005 1.00 22.33 H new ATOM 0 HA GLU A 120 -7.412 17.116 -0.053 1.00 61.44 H new ATOM 0 HB2 GLU A 120 -6.325 19.334 -0.140 1.00 65.44 H new ATOM 0 HB3 GLU A 120 -4.741 18.584 -0.151 1.00 65.44 H new ATOM 0 HG2 GLU A 120 -5.241 17.530 -2.353 1.00 1.41 H new ATOM 0 HG3 GLU A 120 -6.842 18.244 -2.340 1.00 1.41 H new ATOM 1859 N LEU A 121 -4.425 15.666 0.311 1.00 4.14 N ATOM 1860 CA LEU A 121 -3.593 14.488 -0.053 1.00 51.22 C ATOM 1861 C LEU A 121 -4.203 13.180 0.499 1.00 73.43 C ATOM 1862 O LEU A 121 -3.971 12.104 -0.059 1.00 24.12 O ATOM 1863 CB LEU A 121 -2.128 14.663 0.440 1.00 52.32 C ATOM 1864 CG LEU A 121 -1.291 15.778 -0.274 1.00 45.43 C ATOM 1865 CD1 LEU A 121 0.109 15.934 0.366 1.00 52.01 C ATOM 1866 CD2 LEU A 121 -1.192 15.515 -1.798 1.00 70.24 C ATOM 0 H LEU A 121 -3.999 16.266 1.018 1.00 4.14 H new ATOM 0 HA LEU A 121 -3.578 14.419 -1.141 1.00 51.22 H new ATOM 0 HB2 LEU A 121 -2.149 14.880 1.508 1.00 52.32 H new ATOM 0 HB3 LEU A 121 -1.609 13.712 0.318 1.00 52.32 H new ATOM 0 HG LEU A 121 -1.817 16.723 -0.136 1.00 45.43 H new ATOM 0 HD11 LEU A 121 0.662 16.716 -0.154 1.00 52.01 H new ATOM 0 HD12 LEU A 121 0.001 16.204 1.417 1.00 52.01 H new ATOM 0 HD13 LEU A 121 0.652 14.992 0.287 1.00 52.01 H new ATOM 0 HD21 LEU A 121 -0.605 16.305 -2.266 1.00 70.24 H new ATOM 0 HD22 LEU A 121 -0.709 14.553 -1.971 1.00 70.24 H new ATOM 0 HD23 LEU A 121 -2.192 15.501 -2.231 1.00 70.24 H new ATOM 1878 N GLU A 122 -4.992 13.282 1.592 1.00 44.04 N ATOM 1879 CA GLU A 122 -5.759 12.138 2.141 1.00 74.20 C ATOM 1880 C GLU A 122 -6.865 11.673 1.161 1.00 51.04 C ATOM 1881 O GLU A 122 -7.189 10.489 1.106 1.00 41.33 O ATOM 1882 CB GLU A 122 -6.363 12.489 3.534 1.00 74.43 C ATOM 1883 CG GLU A 122 -5.313 12.742 4.634 1.00 71.44 C ATOM 1884 CD GLU A 122 -5.925 13.083 6.007 1.00 52.24 C ATOM 1885 OE1 GLU A 122 -6.404 14.215 6.189 1.00 62.52 O ATOM 1886 OE2 GLU A 122 -5.934 12.221 6.909 1.00 21.22 O ATOM 0 H GLU A 122 -5.115 14.149 2.115 1.00 44.04 H new ATOM 0 HA GLU A 122 -5.064 11.309 2.271 1.00 74.20 H new ATOM 0 HB2 GLU A 122 -6.988 13.376 3.433 1.00 74.43 H new ATOM 0 HB3 GLU A 122 -7.015 11.675 3.850 1.00 74.43 H new ATOM 0 HG2 GLU A 122 -4.685 11.857 4.736 1.00 71.44 H new ATOM 0 HG3 GLU A 122 -4.663 13.560 4.323 1.00 71.44 H new ATOM 1893 N SER A 123 -7.466 12.625 0.425 1.00 21.03 N ATOM 1894 CA SER A 123 -8.408 12.304 -0.683 1.00 3.14 C ATOM 1895 C SER A 123 -7.678 11.827 -1.972 1.00 42.33 C ATOM 1896 O SER A 123 -7.997 10.767 -2.515 1.00 51.53 O ATOM 1897 CB SER A 123 -9.290 13.529 -1.002 1.00 21.42 C ATOM 1898 OG SER A 123 -10.222 13.246 -2.039 1.00 30.03 O ATOM 0 H SER A 123 -7.322 13.624 0.571 1.00 21.03 H new ATOM 0 HA SER A 123 -9.031 11.478 -0.341 1.00 3.14 H new ATOM 0 HB2 SER A 123 -9.826 13.836 -0.104 1.00 21.42 H new ATOM 0 HB3 SER A 123 -8.658 14.366 -1.298 1.00 21.42 H new ATOM 0 HG SER A 123 -10.766 14.042 -2.216 1.00 30.03 H new ATOM 1904 N VAL A 124 -6.704 12.629 -2.456 1.00 74.14 N ATOM 1905 CA VAL A 124 -5.976 12.368 -3.733 1.00 23.30 C ATOM 1906 C VAL A 124 -5.231 11.007 -3.714 1.00 70.30 C ATOM 1907 O VAL A 124 -5.441 10.152 -4.584 1.00 54.43 O ATOM 1908 CB VAL A 124 -4.951 13.534 -4.046 1.00 61.15 C ATOM 1909 CG1 VAL A 124 -4.086 13.228 -5.302 1.00 62.14 C ATOM 1910 CG2 VAL A 124 -5.686 14.894 -4.202 1.00 31.41 C ATOM 0 H VAL A 124 -6.395 13.476 -1.979 1.00 74.14 H new ATOM 0 HA VAL A 124 -6.728 12.328 -4.521 1.00 23.30 H new ATOM 0 HB VAL A 124 -4.274 13.603 -3.194 1.00 61.15 H new ATOM 0 HG11 VAL A 124 -3.397 14.054 -5.480 1.00 62.14 H new ATOM 0 HG12 VAL A 124 -3.519 12.312 -5.139 1.00 62.14 H new ATOM 0 HG13 VAL A 124 -4.735 13.104 -6.169 1.00 62.14 H new ATOM 0 HG21 VAL A 124 -4.959 15.678 -4.416 1.00 31.41 H new ATOM 0 HG22 VAL A 124 -6.402 14.829 -5.021 1.00 31.41 H new ATOM 0 HG23 VAL A 124 -6.213 15.131 -3.278 1.00 31.41 H new ATOM 1920 N ILE A 125 -4.378 10.816 -2.705 1.00 54.54 N ATOM 1921 CA ILE A 125 -3.576 9.588 -2.551 1.00 11.54 C ATOM 1922 C ILE A 125 -4.409 8.472 -1.858 1.00 54.14 C ATOM 1923 O ILE A 125 -4.457 7.337 -2.334 1.00 62.30 O ATOM 1924 CB ILE A 125 -2.249 9.886 -1.750 1.00 45.32 C ATOM 1925 CG1 ILE A 125 -1.450 11.060 -2.418 1.00 63.32 C ATOM 1926 CG2 ILE A 125 -1.365 8.617 -1.606 1.00 41.15 C ATOM 1927 CD1 ILE A 125 -0.234 11.539 -1.628 1.00 73.31 C ATOM 0 H ILE A 125 -4.220 11.504 -1.969 1.00 54.54 H new ATOM 0 HA ILE A 125 -3.297 9.233 -3.543 1.00 11.54 H new ATOM 0 HB ILE A 125 -2.533 10.195 -0.744 1.00 45.32 H new ATOM 0 HG12 ILE A 125 -1.120 10.740 -3.406 1.00 63.32 H new ATOM 0 HG13 ILE A 125 -2.125 11.903 -2.565 1.00 63.32 H new ATOM 0 HG21 ILE A 125 -0.461 8.864 -1.049 1.00 41.15 H new ATOM 0 HG22 ILE A 125 -1.920 7.845 -1.073 1.00 41.15 H new ATOM 0 HG23 ILE A 125 -1.092 8.250 -2.595 1.00 41.15 H new ATOM 0 HD11 ILE A 125 0.254 12.351 -2.168 1.00 73.31 H new ATOM 0 HD12 ILE A 125 -0.554 11.895 -0.648 1.00 73.31 H new ATOM 0 HD13 ILE A 125 0.467 10.714 -1.503 1.00 73.31 H new ATOM 1939 N GLY A 126 -5.104 8.825 -0.756 1.00 10.45 N ATOM 1940 CA GLY A 126 -5.865 7.842 0.055 1.00 53.31 C ATOM 1941 C GLY A 126 -7.102 7.230 -0.633 1.00 63.14 C ATOM 1942 O GLY A 126 -7.623 6.207 -0.167 1.00 64.14 O ATOM 0 H GLY A 126 -5.156 9.781 -0.405 1.00 10.45 H new ATOM 0 HA2 GLY A 126 -5.192 7.033 0.340 1.00 53.31 H new ATOM 0 HA3 GLY A 126 -6.186 8.328 0.976 1.00 53.31 H new ATOM 1946 N ASP A 127 -7.585 7.846 -1.729 1.00 53.51 N ATOM 1947 CA ASP A 127 -8.707 7.294 -2.529 1.00 22.00 C ATOM 1948 C ASP A 127 -8.250 7.015 -3.982 1.00 74.11 C ATOM 1949 O ASP A 127 -8.315 5.871 -4.451 1.00 62.23 O ATOM 1950 CB ASP A 127 -9.922 8.259 -2.498 1.00 71.43 C ATOM 1951 CG ASP A 127 -11.204 7.631 -3.080 1.00 25.34 C ATOM 1952 OD1 ASP A 127 -11.932 6.956 -2.323 1.00 34.04 O ATOM 1953 OD2 ASP A 127 -11.483 7.804 -4.290 1.00 74.44 O ATOM 0 H ASP A 127 -7.218 8.728 -2.085 1.00 53.51 H new ATOM 0 HA ASP A 127 -9.019 6.347 -2.088 1.00 22.00 H new ATOM 0 HB2 ASP A 127 -10.109 8.566 -1.469 1.00 71.43 H new ATOM 0 HB3 ASP A 127 -9.678 9.160 -3.060 1.00 71.43 H new ATOM 1958 N GLY A 128 -7.751 8.068 -4.664 1.00 41.41 N ATOM 1959 CA GLY A 128 -7.341 7.986 -6.084 1.00 14.14 C ATOM 1960 C GLY A 128 -6.183 7.012 -6.376 1.00 64.14 C ATOM 1961 O GLY A 128 -5.963 6.624 -7.527 1.00 74.03 O ATOM 0 H GLY A 128 -7.621 8.992 -4.251 1.00 41.41 H new ATOM 0 HA2 GLY A 128 -8.205 7.688 -6.678 1.00 14.14 H new ATOM 0 HA3 GLY A 128 -7.051 8.982 -6.420 1.00 14.14 H new ATOM 1965 N VAL A 129 -5.427 6.638 -5.332 1.00 13.32 N ATOM 1966 CA VAL A 129 -4.369 5.603 -5.422 1.00 34.54 C ATOM 1967 C VAL A 129 -4.778 4.341 -4.617 1.00 35.12 C ATOM 1968 O VAL A 129 -4.764 3.222 -5.149 1.00 14.24 O ATOM 1969 CB VAL A 129 -2.992 6.157 -4.891 1.00 3.41 C ATOM 1970 CG1 VAL A 129 -1.863 5.093 -4.958 1.00 31.22 C ATOM 1971 CG2 VAL A 129 -2.587 7.457 -5.638 1.00 60.43 C ATOM 0 H VAL A 129 -5.527 7.040 -4.400 1.00 13.32 H new ATOM 0 HA VAL A 129 -4.250 5.333 -6.471 1.00 34.54 H new ATOM 0 HB VAL A 129 -3.132 6.401 -3.838 1.00 3.41 H new ATOM 0 HG11 VAL A 129 -0.935 5.523 -4.581 1.00 31.22 H new ATOM 0 HG12 VAL A 129 -2.138 4.232 -4.348 1.00 31.22 H new ATOM 0 HG13 VAL A 129 -1.723 4.776 -5.991 1.00 31.22 H new ATOM 0 HG21 VAL A 129 -1.634 7.817 -5.251 1.00 60.43 H new ATOM 0 HG22 VAL A 129 -2.491 7.249 -6.704 1.00 60.43 H new ATOM 0 HG23 VAL A 129 -3.352 8.218 -5.484 1.00 60.43 H new ATOM 1981 N PHE A 130 -5.156 4.546 -3.334 1.00 10.42 N ATOM 1982 CA PHE A 130 -5.395 3.437 -2.371 1.00 62.34 C ATOM 1983 C PHE A 130 -6.722 2.703 -2.625 1.00 44.13 C ATOM 1984 O PHE A 130 -6.711 1.500 -2.896 1.00 0.23 O ATOM 1985 CB PHE A 130 -5.334 3.945 -0.894 1.00 71.42 C ATOM 1986 CG PHE A 130 -3.944 4.308 -0.356 1.00 24.33 C ATOM 1987 CD1 PHE A 130 -2.906 4.704 -1.202 1.00 32.23 C ATOM 1988 CD2 PHE A 130 -3.679 4.241 1.012 1.00 74.24 C ATOM 1989 CE1 PHE A 130 -1.659 5.017 -0.701 1.00 61.13 C ATOM 1990 CE2 PHE A 130 -2.431 4.555 1.508 1.00 35.22 C ATOM 1991 CZ PHE A 130 -1.422 4.938 0.652 1.00 61.32 C ATOM 0 H PHE A 130 -5.304 5.474 -2.937 1.00 10.42 H new ATOM 0 HA PHE A 130 -4.591 2.719 -2.532 1.00 62.34 H new ATOM 0 HB2 PHE A 130 -5.974 4.823 -0.808 1.00 71.42 H new ATOM 0 HB3 PHE A 130 -5.760 3.176 -0.250 1.00 71.42 H new ATOM 0 HD1 PHE A 130 -3.082 4.766 -2.266 1.00 32.23 H new ATOM 0 HD2 PHE A 130 -4.462 3.939 1.692 1.00 74.24 H new ATOM 0 HE1 PHE A 130 -0.869 5.324 -1.371 1.00 61.13 H new ATOM 0 HE2 PHE A 130 -2.244 4.500 2.570 1.00 35.22 H new ATOM 0 HZ PHE A 130 -0.444 5.176 1.043 1.00 61.32 H new ATOM 2001 N ALA A 131 -7.858 3.426 -2.523 1.00 41.12 N ATOM 2002 CA ALA A 131 -9.206 2.831 -2.749 1.00 44.04 C ATOM 2003 C ALA A 131 -9.316 2.194 -4.153 1.00 73.25 C ATOM 2004 O ALA A 131 -9.924 1.146 -4.321 1.00 74.33 O ATOM 2005 CB ALA A 131 -10.311 3.877 -2.535 1.00 13.11 C ATOM 0 H ALA A 131 -7.876 4.418 -2.287 1.00 41.12 H new ATOM 0 HA ALA A 131 -9.342 2.037 -2.015 1.00 44.04 H new ATOM 0 HB1 ALA A 131 -11.285 3.418 -2.706 1.00 13.11 H new ATOM 0 HB2 ALA A 131 -10.262 4.254 -1.514 1.00 13.11 H new ATOM 0 HB3 ALA A 131 -10.171 4.702 -3.234 1.00 13.11 H new ATOM 2011 N VAL A 132 -8.676 2.837 -5.138 1.00 60.22 N ATOM 2012 CA VAL A 132 -8.526 2.310 -6.513 1.00 23.51 C ATOM 2013 C VAL A 132 -7.829 0.915 -6.547 1.00 43.34 C ATOM 2014 O VAL A 132 -8.395 -0.057 -7.064 1.00 60.13 O ATOM 2015 CB VAL A 132 -7.718 3.350 -7.382 1.00 73.43 C ATOM 2016 CG1 VAL A 132 -7.173 2.730 -8.686 1.00 23.03 C ATOM 2017 CG2 VAL A 132 -8.581 4.597 -7.683 1.00 42.14 C ATOM 0 H VAL A 132 -8.240 3.750 -5.007 1.00 60.22 H new ATOM 0 HA VAL A 132 -9.524 2.169 -6.928 1.00 23.51 H new ATOM 0 HB VAL A 132 -6.854 3.656 -6.793 1.00 73.43 H new ATOM 0 HG11 VAL A 132 -6.625 3.487 -9.247 1.00 23.03 H new ATOM 0 HG12 VAL A 132 -6.505 1.903 -8.444 1.00 23.03 H new ATOM 0 HG13 VAL A 132 -8.003 2.362 -9.289 1.00 23.03 H new ATOM 0 HG21 VAL A 132 -8.005 5.302 -8.283 1.00 42.14 H new ATOM 0 HG22 VAL A 132 -9.474 4.298 -8.232 1.00 42.14 H new ATOM 0 HG23 VAL A 132 -8.873 5.072 -6.746 1.00 42.14 H new ATOM 2027 N GLY A 133 -6.613 0.838 -5.965 1.00 54.34 N ATOM 2028 CA GLY A 133 -5.800 -0.389 -6.003 1.00 32.23 C ATOM 2029 C GLY A 133 -6.426 -1.557 -5.231 1.00 0.50 C ATOM 2030 O GLY A 133 -6.457 -2.690 -5.714 1.00 1.44 O ATOM 0 H GLY A 133 -6.176 1.612 -5.465 1.00 54.34 H new ATOM 0 HA2 GLY A 133 -5.653 -0.687 -7.041 1.00 32.23 H new ATOM 0 HA3 GLY A 133 -4.814 -0.176 -5.589 1.00 32.23 H new ATOM 2034 N LEU A 134 -6.955 -1.244 -4.036 1.00 5.31 N ATOM 2035 CA LEU A 134 -7.583 -2.229 -3.126 1.00 51.30 C ATOM 2036 C LEU A 134 -8.911 -2.801 -3.690 1.00 35.14 C ATOM 2037 O LEU A 134 -9.181 -4.000 -3.548 1.00 43.43 O ATOM 2038 CB LEU A 134 -7.824 -1.579 -1.739 1.00 3.24 C ATOM 2039 CG LEU A 134 -6.546 -1.192 -0.926 1.00 50.41 C ATOM 2040 CD1 LEU A 134 -6.931 -0.604 0.444 1.00 20.11 C ATOM 2041 CD2 LEU A 134 -5.575 -2.392 -0.774 1.00 53.21 C ATOM 0 H LEU A 134 -6.961 -0.293 -3.667 1.00 5.31 H new ATOM 0 HA LEU A 134 -6.895 -3.068 -3.028 1.00 51.30 H new ATOM 0 HB2 LEU A 134 -8.424 -0.680 -1.882 1.00 3.24 H new ATOM 0 HB3 LEU A 134 -8.418 -2.267 -1.137 1.00 3.24 H new ATOM 0 HG LEU A 134 -6.015 -0.424 -1.488 1.00 50.41 H new ATOM 0 HD11 LEU A 134 -6.027 -0.341 0.994 1.00 20.11 H new ATOM 0 HD12 LEU A 134 -7.540 0.288 0.299 1.00 20.11 H new ATOM 0 HD13 LEU A 134 -7.499 -1.342 1.010 1.00 20.11 H new ATOM 0 HD21 LEU A 134 -4.700 -2.082 -0.203 1.00 53.21 H new ATOM 0 HD22 LEU A 134 -6.080 -3.205 -0.251 1.00 53.21 H new ATOM 0 HD23 LEU A 134 -5.262 -2.734 -1.761 1.00 53.21 H new ATOM 2053 N ASN A 135 -9.729 -1.938 -4.332 1.00 72.35 N ATOM 2054 CA ASN A 135 -10.999 -2.371 -4.972 1.00 15.31 C ATOM 2055 C ASN A 135 -10.718 -3.281 -6.185 1.00 42.25 C ATOM 2056 O ASN A 135 -11.339 -4.335 -6.322 1.00 35.15 O ATOM 2057 CB ASN A 135 -11.859 -1.150 -5.401 1.00 1.32 C ATOM 2058 CG ASN A 135 -12.536 -0.431 -4.232 1.00 44.42 C ATOM 2059 OD1 ASN A 135 -12.095 -0.501 -3.086 1.00 64.12 O ATOM 2060 ND2 ASN A 135 -13.601 0.294 -4.518 1.00 62.41 N ATOM 0 H ASN A 135 -9.537 -0.940 -4.423 1.00 72.35 H new ATOM 0 HA ASN A 135 -11.563 -2.940 -4.233 1.00 15.31 H new ATOM 0 HB2 ASN A 135 -11.226 -0.441 -5.934 1.00 1.32 H new ATOM 0 HB3 ASN A 135 -12.624 -1.484 -6.102 1.00 1.32 H new ATOM 0 HD21 ASN A 135 -14.078 0.813 -3.780 1.00 62.41 H new ATOM 0 HD22 ASN A 135 -13.947 0.336 -5.477 1.00 62.41 H new ATOM 2067 N ALA A 136 -9.752 -2.875 -7.039 1.00 50.43 N ATOM 2068 CA ALA A 136 -9.290 -3.682 -8.198 1.00 12.04 C ATOM 2069 C ALA A 136 -8.734 -5.058 -7.749 1.00 64.15 C ATOM 2070 O ALA A 136 -8.916 -6.075 -8.430 1.00 4.23 O ATOM 2071 CB ALA A 136 -8.227 -2.901 -8.994 1.00 14.25 C ATOM 0 H ALA A 136 -9.270 -1.981 -6.947 1.00 50.43 H new ATOM 0 HA ALA A 136 -10.149 -3.871 -8.842 1.00 12.04 H new ATOM 0 HB1 ALA A 136 -7.894 -3.500 -9.842 1.00 14.25 H new ATOM 0 HB2 ALA A 136 -8.657 -1.967 -9.356 1.00 14.25 H new ATOM 0 HB3 ALA A 136 -7.377 -2.682 -8.348 1.00 14.25 H new ATOM 2077 N LEU A 137 -8.079 -5.069 -6.576 1.00 32.12 N ATOM 2078 CA LEU A 137 -7.559 -6.295 -5.937 1.00 51.35 C ATOM 2079 C LEU A 137 -8.735 -7.220 -5.506 1.00 11.10 C ATOM 2080 O LEU A 137 -8.699 -8.438 -5.717 1.00 32.44 O ATOM 2081 CB LEU A 137 -6.644 -5.893 -4.735 1.00 20.34 C ATOM 2082 CG LEU A 137 -5.712 -7.002 -4.132 1.00 53.22 C ATOM 2083 CD1 LEU A 137 -4.575 -6.383 -3.304 1.00 4.11 C ATOM 2084 CD2 LEU A 137 -6.474 -8.031 -3.279 1.00 72.04 C ATOM 0 H LEU A 137 -7.893 -4.222 -6.039 1.00 32.12 H new ATOM 0 HA LEU A 137 -6.956 -6.864 -6.645 1.00 51.35 H new ATOM 0 HB2 LEU A 137 -6.015 -5.062 -5.054 1.00 20.34 H new ATOM 0 HB3 LEU A 137 -7.284 -5.520 -3.935 1.00 20.34 H new ATOM 0 HG LEU A 137 -5.291 -7.533 -4.986 1.00 53.22 H new ATOM 0 HD11 LEU A 137 -3.946 -7.176 -2.899 1.00 4.11 H new ATOM 0 HD12 LEU A 137 -3.974 -5.733 -3.940 1.00 4.11 H new ATOM 0 HD13 LEU A 137 -4.997 -5.801 -2.485 1.00 4.11 H new ATOM 0 HD21 LEU A 137 -5.774 -8.771 -2.891 1.00 72.04 H new ATOM 0 HD22 LEU A 137 -6.964 -7.523 -2.448 1.00 72.04 H new ATOM 0 HD23 LEU A 137 -7.224 -8.528 -3.893 1.00 72.04 H new ATOM 2096 N ALA A 138 -9.776 -6.621 -4.915 1.00 23.41 N ATOM 2097 CA ALA A 138 -10.984 -7.357 -4.475 1.00 45.51 C ATOM 2098 C ALA A 138 -11.839 -7.850 -5.673 1.00 71.23 C ATOM 2099 O ALA A 138 -12.610 -8.790 -5.526 1.00 3.11 O ATOM 2100 CB ALA A 138 -11.818 -6.483 -3.533 1.00 33.43 C ATOM 0 H ALA A 138 -9.812 -5.619 -4.726 1.00 23.41 H new ATOM 0 HA ALA A 138 -10.652 -8.245 -3.937 1.00 45.51 H new ATOM 0 HB1 ALA A 138 -12.704 -7.033 -3.215 1.00 33.43 H new ATOM 0 HB2 ALA A 138 -11.222 -6.218 -2.659 1.00 33.43 H new ATOM 0 HB3 ALA A 138 -12.122 -5.575 -4.053 1.00 33.43 H new ATOM 2106 N GLU A 139 -11.708 -7.184 -6.841 1.00 33.51 N ATOM 2107 CA GLU A 139 -12.383 -7.597 -8.106 1.00 32.04 C ATOM 2108 C GLU A 139 -11.744 -8.876 -8.708 1.00 64.03 C ATOM 2109 O GLU A 139 -12.455 -9.799 -9.127 1.00 5.21 O ATOM 2110 CB GLU A 139 -12.324 -6.442 -9.153 1.00 63.11 C ATOM 2111 CG GLU A 139 -13.148 -5.185 -8.779 1.00 21.13 C ATOM 2112 CD GLU A 139 -12.916 -3.950 -9.674 1.00 14.52 C ATOM 2113 OE1 GLU A 139 -12.183 -4.045 -10.689 1.00 44.13 O ATOM 2114 OE2 GLU A 139 -13.479 -2.873 -9.364 1.00 34.21 O ATOM 0 H GLU A 139 -11.135 -6.346 -6.941 1.00 33.51 H new ATOM 0 HA GLU A 139 -13.422 -7.819 -7.863 1.00 32.04 H new ATOM 0 HB2 GLU A 139 -11.283 -6.149 -9.292 1.00 63.11 H new ATOM 0 HB3 GLU A 139 -12.679 -6.821 -10.111 1.00 63.11 H new ATOM 0 HG2 GLU A 139 -14.207 -5.443 -8.812 1.00 21.13 H new ATOM 0 HG3 GLU A 139 -12.918 -4.914 -7.749 1.00 21.13 H new ATOM 2121 N ARG A 140 -10.394 -8.925 -8.732 1.00 51.34 N ATOM 2122 CA ARG A 140 -9.636 -10.046 -9.362 1.00 11.30 C ATOM 2123 C ARG A 140 -9.678 -11.345 -8.511 1.00 34.32 C ATOM 2124 O ARG A 140 -9.449 -12.441 -9.034 1.00 2.44 O ATOM 2125 CB ARG A 140 -8.174 -9.608 -9.675 1.00 14.51 C ATOM 2126 CG ARG A 140 -7.351 -9.143 -8.449 1.00 13.32 C ATOM 2127 CD ARG A 140 -6.055 -8.403 -8.841 1.00 12.15 C ATOM 2128 NE ARG A 140 -6.339 -7.224 -9.700 1.00 45.43 N ATOM 2129 CZ ARG A 140 -5.771 -6.949 -10.861 1.00 73.31 C ATOM 2130 NH1 ARG A 140 -4.880 -7.730 -11.380 1.00 21.32 N ATOM 2131 NH2 ARG A 140 -6.120 -5.890 -11.514 1.00 61.15 N ATOM 0 H ARG A 140 -9.800 -8.204 -8.324 1.00 51.34 H new ATOM 0 HA ARG A 140 -10.130 -10.286 -10.303 1.00 11.30 H new ATOM 0 HB2 ARG A 140 -7.654 -10.442 -10.147 1.00 14.51 H new ATOM 0 HB3 ARG A 140 -8.202 -8.797 -10.403 1.00 14.51 H new ATOM 0 HG2 ARG A 140 -7.966 -8.487 -7.833 1.00 13.32 H new ATOM 0 HG3 ARG A 140 -7.098 -10.009 -7.838 1.00 13.32 H new ATOM 0 HD2 ARG A 140 -5.532 -8.081 -7.940 1.00 12.15 H new ATOM 0 HD3 ARG A 140 -5.390 -9.087 -9.368 1.00 12.15 H new ATOM 0 HE ARG A 140 -7.039 -6.564 -9.361 1.00 45.43 H new ATOM 0 HH11 ARG A 140 -4.601 -8.581 -10.892 1.00 21.32 H new ATOM 0 HH12 ARG A 140 -4.457 -7.495 -12.278 1.00 21.32 H new ATOM 0 HH21 ARG A 140 -6.833 -5.268 -11.133 1.00 61.15 H new ATOM 0 HH22 ARG A 140 -5.683 -5.676 -12.410 1.00 61.15 H new ATOM 2145 N TYR A 141 -9.968 -11.215 -7.200 1.00 23.32 N ATOM 2146 CA TYR A 141 -10.292 -12.373 -6.321 1.00 71.15 C ATOM 2147 C TYR A 141 -11.816 -12.501 -6.104 1.00 23.34 C ATOM 2148 O TYR A 141 -12.296 -13.537 -5.630 1.00 72.52 O ATOM 2149 CB TYR A 141 -9.616 -12.237 -4.949 1.00 10.21 C ATOM 2150 CG TYR A 141 -8.088 -12.336 -4.952 1.00 62.23 C ATOM 2151 CD1 TYR A 141 -7.436 -13.545 -5.216 1.00 34.32 C ATOM 2152 CD2 TYR A 141 -7.301 -11.241 -4.627 1.00 13.03 C ATOM 2153 CE1 TYR A 141 -6.058 -13.644 -5.148 1.00 70.14 C ATOM 2154 CE2 TYR A 141 -5.935 -11.332 -4.567 1.00 1.04 C ATOM 2155 CZ TYR A 141 -5.312 -12.533 -4.824 1.00 64.51 C ATOM 2156 OH TYR A 141 -3.936 -12.622 -4.744 1.00 42.24 O ATOM 0 H TYR A 141 -9.986 -10.316 -6.718 1.00 23.32 H new ATOM 0 HA TYR A 141 -9.918 -13.264 -6.826 1.00 71.15 H new ATOM 0 HB2 TYR A 141 -9.899 -11.277 -4.518 1.00 10.21 H new ATOM 0 HB3 TYR A 141 -10.011 -13.011 -4.291 1.00 10.21 H new ATOM 0 HD1 TYR A 141 -8.018 -14.416 -5.477 1.00 34.32 H new ATOM 0 HD2 TYR A 141 -7.776 -10.294 -4.416 1.00 13.03 H new ATOM 0 HE1 TYR A 141 -5.570 -14.587 -5.348 1.00 70.14 H new ATOM 0 HE2 TYR A 141 -5.347 -10.461 -4.318 1.00 1.04 H new ATOM 0 HH TYR A 141 -3.553 -12.586 -5.645 1.00 42.24 H new ATOM 2166 N GLY A 142 -12.567 -11.438 -6.443 1.00 10.13 N ATOM 2167 CA GLY A 142 -14.037 -11.431 -6.334 1.00 30.12 C ATOM 2168 C GLY A 142 -14.714 -12.100 -7.526 1.00 53.11 C ATOM 2169 O GLY A 142 -15.604 -11.532 -8.151 1.00 41.33 O ATOM 0 H GLY A 142 -12.176 -10.565 -6.798 1.00 10.13 H new ATOM 0 HA2 GLY A 142 -14.333 -11.943 -5.418 1.00 30.12 H new ATOM 0 HA3 GLY A 142 -14.387 -10.402 -6.252 1.00 30.12 H new ATOM 2173 N ARG A 143 -14.268 -13.329 -7.824 1.00 62.43 N ATOM 2174 CA ARG A 143 -14.840 -14.196 -8.868 1.00 42.22 C ATOM 2175 C ARG A 143 -16.208 -14.747 -8.404 1.00 14.21 C ATOM 2176 O ARG A 143 -17.101 -15.008 -9.212 1.00 34.33 O ATOM 2177 CB ARG A 143 -13.849 -15.355 -9.143 1.00 15.12 C ATOM 2178 CG ARG A 143 -12.408 -14.911 -9.505 1.00 22.03 C ATOM 2179 CD ARG A 143 -11.435 -16.103 -9.591 1.00 21.41 C ATOM 2180 NE ARG A 143 -11.328 -16.835 -8.306 1.00 15.31 N ATOM 2181 CZ ARG A 143 -10.979 -18.099 -8.166 1.00 74.34 C ATOM 2182 NH1 ARG A 143 -10.742 -18.855 -9.189 1.00 64.22 N ATOM 2183 NH2 ARG A 143 -10.888 -18.608 -6.985 1.00 14.32 N ATOM 0 H ARG A 143 -13.482 -13.759 -7.336 1.00 62.43 H new ATOM 0 HA ARG A 143 -14.998 -13.628 -9.785 1.00 42.22 H new ATOM 0 HB2 ARG A 143 -13.806 -15.994 -8.261 1.00 15.12 H new ATOM 0 HB3 ARG A 143 -14.241 -15.963 -9.958 1.00 15.12 H new ATOM 0 HG2 ARG A 143 -12.421 -14.385 -10.460 1.00 22.03 H new ATOM 0 HG3 ARG A 143 -12.049 -14.204 -8.757 1.00 22.03 H new ATOM 0 HD2 ARG A 143 -11.771 -16.788 -10.370 1.00 21.41 H new ATOM 0 HD3 ARG A 143 -10.449 -15.744 -9.885 1.00 21.41 H new ATOM 0 HE ARG A 143 -11.543 -16.315 -7.455 1.00 15.31 H new ATOM 0 HH11 ARG A 143 -10.823 -18.476 -10.133 1.00 64.22 H new ATOM 0 HH12 ARG A 143 -10.474 -19.829 -9.052 1.00 64.22 H new ATOM 0 HH21 ARG A 143 -11.085 -18.034 -6.166 1.00 14.32 H new ATOM 0 HH22 ARG A 143 -10.619 -19.585 -6.870 1.00 14.32 H new ATOM 2197 N LEU A 144 -16.330 -14.904 -7.068 1.00 33.54 N ATOM 2198 CA LEU A 144 -17.578 -15.299 -6.379 1.00 34.51 C ATOM 2199 C LEU A 144 -18.711 -14.275 -6.660 1.00 11.12 C ATOM 2200 O LEU A 144 -19.875 -14.645 -6.843 1.00 0.52 O ATOM 2201 CB LEU A 144 -17.329 -15.416 -4.835 1.00 74.15 C ATOM 2202 CG LEU A 144 -16.425 -16.595 -4.327 1.00 73.24 C ATOM 2203 CD1 LEU A 144 -16.949 -17.957 -4.816 1.00 51.41 C ATOM 2204 CD2 LEU A 144 -14.929 -16.393 -4.670 1.00 21.35 C ATOM 0 H LEU A 144 -15.550 -14.757 -6.427 1.00 33.54 H new ATOM 0 HA LEU A 144 -17.889 -16.270 -6.764 1.00 34.51 H new ATOM 0 HB2 LEU A 144 -16.882 -14.481 -4.496 1.00 74.15 H new ATOM 0 HB3 LEU A 144 -18.299 -15.502 -4.345 1.00 74.15 H new ATOM 0 HG LEU A 144 -16.488 -16.590 -3.239 1.00 73.24 H new ATOM 0 HD11 LEU A 144 -16.300 -18.751 -4.446 1.00 51.41 H new ATOM 0 HD12 LEU A 144 -17.961 -18.113 -4.443 1.00 51.41 H new ATOM 0 HD13 LEU A 144 -16.958 -17.974 -5.906 1.00 51.41 H new ATOM 0 HD21 LEU A 144 -14.352 -17.238 -4.295 1.00 21.35 H new ATOM 0 HD22 LEU A 144 -14.810 -16.324 -5.751 1.00 21.35 H new ATOM 0 HD23 LEU A 144 -14.570 -15.474 -4.206 1.00 21.35 H new ATOM 2216 N GLU A 145 -18.337 -12.981 -6.683 1.00 65.32 N ATOM 2217 CA GLU A 145 -19.250 -11.876 -7.037 1.00 61.45 C ATOM 2218 C GLU A 145 -19.337 -11.744 -8.582 1.00 12.43 C ATOM 2219 O GLU A 145 -20.393 -11.971 -9.175 1.00 41.34 O ATOM 2220 CB GLU A 145 -18.744 -10.560 -6.388 1.00 42.24 C ATOM 2221 CG GLU A 145 -18.565 -10.632 -4.858 1.00 3.13 C ATOM 2222 CD GLU A 145 -17.940 -9.355 -4.267 1.00 11.35 C ATOM 2223 OE1 GLU A 145 -16.743 -9.108 -4.515 1.00 22.13 O ATOM 2224 OE2 GLU A 145 -18.645 -8.578 -3.586 1.00 54.51 O ATOM 0 H GLU A 145 -17.392 -12.672 -6.456 1.00 65.32 H new ATOM 0 HA GLU A 145 -20.250 -12.084 -6.658 1.00 61.45 H new ATOM 0 HB2 GLU A 145 -17.790 -10.289 -6.841 1.00 42.24 H new ATOM 0 HB3 GLU A 145 -19.447 -9.760 -6.622 1.00 42.24 H new ATOM 0 HG2 GLU A 145 -19.535 -10.805 -4.392 1.00 3.13 H new ATOM 0 HG3 GLU A 145 -17.935 -11.487 -4.611 1.00 3.13 H new ATOM 2231 N HIS A 146 -18.201 -11.339 -9.208 1.00 45.33 N ATOM 2232 CA HIS A 146 -17.997 -11.275 -10.690 1.00 52.50 C ATOM 2233 C HIS A 146 -18.810 -10.134 -11.380 1.00 64.40 C ATOM 2234 O HIS A 146 -18.542 -9.795 -12.537 1.00 25.15 O ATOM 2235 CB HIS A 146 -18.275 -12.668 -11.357 1.00 21.21 C ATOM 2236 CG HIS A 146 -17.835 -12.784 -12.806 1.00 4.52 C ATOM 2237 ND1 HIS A 146 -16.554 -13.137 -13.173 1.00 31.24 N ATOM 2238 CD2 HIS A 146 -18.506 -12.589 -13.976 1.00 12.11 C ATOM 2239 CE1 HIS A 146 -16.451 -13.141 -14.488 1.00 43.44 C ATOM 2240 NE2 HIS A 146 -17.617 -12.817 -15.000 1.00 34.31 N ATOM 0 H HIS A 146 -17.377 -11.039 -8.687 1.00 45.33 H new ATOM 0 HA HIS A 146 -16.948 -11.024 -10.845 1.00 52.50 H new ATOM 0 HB2 HIS A 146 -17.769 -13.440 -10.776 1.00 21.21 H new ATOM 0 HB3 HIS A 146 -19.344 -12.875 -11.300 1.00 21.21 H new ATOM 0 HD2 HIS A 146 -19.544 -12.308 -14.080 1.00 12.11 H new ATOM 0 HE1 HIS A 146 -15.558 -13.372 -15.050 1.00 43.44 H new ATOM 0 HE2 HIS A 146 -17.828 -12.746 -15.995 1.00 34.31 H new ATOM 2249 N HIS A 147 -19.750 -9.503 -10.653 1.00 30.34 N ATOM 2250 CA HIS A 147 -20.730 -8.550 -11.232 1.00 64.23 C ATOM 2251 C HIS A 147 -20.167 -7.089 -11.268 1.00 51.44 C ATOM 2252 O HIS A 147 -20.829 -6.136 -10.840 1.00 30.54 O ATOM 2253 CB HIS A 147 -22.063 -8.655 -10.429 1.00 25.23 C ATOM 2254 CG HIS A 147 -23.258 -8.019 -11.108 1.00 63.12 C ATOM 2255 ND1 HIS A 147 -23.593 -6.692 -10.953 1.00 14.32 N ATOM 2256 CD2 HIS A 147 -24.178 -8.533 -11.961 1.00 33.43 C ATOM 2257 CE1 HIS A 147 -24.659 -6.416 -11.670 1.00 1.33 C ATOM 2258 NE2 HIS A 147 -25.036 -7.513 -12.294 1.00 30.13 N ATOM 0 H HIS A 147 -19.856 -9.636 -9.647 1.00 30.34 H new ATOM 0 HA HIS A 147 -20.924 -8.814 -12.272 1.00 64.23 H new ATOM 0 HB2 HIS A 147 -22.281 -9.708 -10.248 1.00 25.23 H new ATOM 0 HB3 HIS A 147 -21.923 -8.187 -9.455 1.00 25.23 H new ATOM 0 HD1 HIS A 147 -23.089 -6.024 -10.369 1.00 14.32 H new ATOM 0 HD2 HIS A 147 -24.227 -9.553 -12.313 1.00 33.43 H new ATOM 0 HE1 HIS A 147 -25.144 -5.453 -11.736 1.00 1.33 H new ATOM 2267 N HIS A 148 -18.938 -6.937 -11.806 1.00 21.42 N ATOM 2268 CA HIS A 148 -18.276 -5.628 -12.008 1.00 4.25 C ATOM 2269 C HIS A 148 -17.021 -5.814 -12.895 1.00 5.30 C ATOM 2270 O HIS A 148 -16.060 -6.475 -12.483 1.00 73.20 O ATOM 2271 CB HIS A 148 -17.893 -4.966 -10.650 1.00 20.13 C ATOM 2272 CG HIS A 148 -17.492 -3.517 -10.759 1.00 51.30 C ATOM 2273 ND1 HIS A 148 -16.466 -2.951 -10.030 1.00 62.24 N ATOM 2274 CD2 HIS A 148 -18.028 -2.502 -11.479 1.00 53.00 C ATOM 2275 CE1 HIS A 148 -16.395 -1.665 -10.295 1.00 23.02 C ATOM 2276 NE2 HIS A 148 -17.328 -1.369 -11.166 1.00 12.33 N ATOM 0 H HIS A 148 -18.371 -7.726 -12.116 1.00 21.42 H new ATOM 0 HA HIS A 148 -18.978 -4.961 -12.509 1.00 4.25 H new ATOM 0 HB2 HIS A 148 -18.740 -5.047 -9.968 1.00 20.13 H new ATOM 0 HB3 HIS A 148 -17.071 -5.526 -10.205 1.00 20.13 H new ATOM 0 HD2 HIS A 148 -18.854 -2.574 -12.171 1.00 53.00 H new ATOM 0 HE1 HIS A 148 -15.687 -0.970 -9.867 1.00 23.02 H new ATOM 0 HE2 HIS A 148 -17.505 -0.441 -11.550 1.00 12.33 H new ATOM 2285 N HIS A 149 -17.036 -5.229 -14.109 1.00 70.53 N ATOM 2286 CA HIS A 149 -15.935 -5.374 -15.090 1.00 10.44 C ATOM 2287 C HIS A 149 -15.503 -4.002 -15.665 1.00 55.23 C ATOM 2288 O HIS A 149 -16.336 -3.218 -16.123 1.00 14.22 O ATOM 2289 CB HIS A 149 -16.363 -6.333 -16.228 1.00 3.43 C ATOM 2290 CG HIS A 149 -15.283 -6.617 -17.246 1.00 40.12 C ATOM 2291 ND1 HIS A 149 -15.419 -6.353 -18.591 1.00 63.41 N ATOM 2292 CD2 HIS A 149 -14.048 -7.160 -17.103 1.00 25.40 C ATOM 2293 CE1 HIS A 149 -14.327 -6.719 -19.227 1.00 22.41 C ATOM 2294 NE2 HIS A 149 -13.481 -7.210 -18.350 1.00 20.01 N ATOM 0 H HIS A 149 -17.805 -4.646 -14.439 1.00 70.53 H new ATOM 0 HA HIS A 149 -15.074 -5.798 -14.574 1.00 10.44 H new ATOM 0 HB2 HIS A 149 -16.688 -7.276 -15.789 1.00 3.43 H new ATOM 0 HB3 HIS A 149 -17.225 -5.907 -16.741 1.00 3.43 H new ATOM 0 HD2 HIS A 149 -13.596 -7.491 -16.180 1.00 25.40 H new ATOM 0 HE1 HIS A 149 -14.155 -6.631 -20.290 1.00 22.41 H new ATOM 0 HE2 HIS A 149 -12.551 -7.571 -18.563 1.00 20.01 H new ATOM 2303 N HIS A 150 -14.184 -3.736 -15.622 1.00 4.42 N ATOM 2304 CA HIS A 150 -13.564 -2.531 -16.235 1.00 21.42 C ATOM 2305 C HIS A 150 -12.961 -2.864 -17.626 1.00 41.31 C ATOM 2306 O HIS A 150 -12.825 -4.039 -17.992 1.00 51.31 O ATOM 2307 CB HIS A 150 -12.450 -1.968 -15.315 1.00 71.33 C ATOM 2308 CG HIS A 150 -12.906 -1.466 -13.968 1.00 51.12 C ATOM 2309 ND1 HIS A 150 -12.695 -0.176 -13.537 1.00 22.42 N ATOM 2310 CD2 HIS A 150 -13.499 -2.102 -12.934 1.00 65.34 C ATOM 2311 CE1 HIS A 150 -13.126 -0.048 -12.301 1.00 40.24 C ATOM 2312 NE2 HIS A 150 -13.617 -1.200 -11.905 1.00 75.45 N ATOM 0 H HIS A 150 -13.511 -4.348 -15.161 1.00 4.42 H new ATOM 0 HA HIS A 150 -14.346 -1.782 -16.359 1.00 21.42 H new ATOM 0 HB2 HIS A 150 -11.705 -2.748 -15.158 1.00 71.33 H new ATOM 0 HB3 HIS A 150 -11.951 -1.151 -15.837 1.00 71.33 H new ATOM 0 HD1 HIS A 150 -12.269 0.567 -14.091 1.00 22.42 H new ATOM 0 HD2 HIS A 150 -13.822 -3.133 -12.919 1.00 65.34 H new ATOM 0 HE1 HIS A 150 -13.083 0.855 -11.710 1.00 40.24 H new ATOM 2321 N HIS A 151 -12.593 -1.813 -18.385 1.00 52.23 N ATOM 2322 CA HIS A 151 -11.921 -1.950 -19.701 1.00 24.34 C ATOM 2323 C HIS A 151 -10.418 -2.242 -19.525 1.00 14.34 C ATOM 2324 O HIS A 151 -9.749 -1.653 -18.668 1.00 41.14 O ATOM 2325 CB HIS A 151 -12.122 -0.669 -20.547 1.00 54.13 C ATOM 2326 CG HIS A 151 -13.570 -0.309 -20.778 1.00 32.44 C ATOM 2327 ND1 HIS A 151 -14.234 0.650 -20.044 1.00 41.52 N ATOM 2328 CD2 HIS A 151 -14.475 -0.780 -21.668 1.00 21.14 C ATOM 2329 CE1 HIS A 151 -15.474 0.747 -20.462 1.00 11.40 C ATOM 2330 NE2 HIS A 151 -15.649 -0.105 -21.446 1.00 10.15 N ATOM 0 H HIS A 151 -12.751 -0.844 -18.107 1.00 52.23 H new ATOM 0 HA HIS A 151 -12.374 -2.792 -20.225 1.00 24.34 H new ATOM 0 HB2 HIS A 151 -11.625 0.164 -20.050 1.00 54.13 H new ATOM 0 HB3 HIS A 151 -11.633 -0.802 -21.512 1.00 54.13 H new ATOM 0 HD2 HIS A 151 -14.305 -1.543 -22.413 1.00 21.14 H new ATOM 0 HE1 HIS A 151 -16.224 1.415 -20.064 1.00 11.40 H new ATOM 0 HE2 HIS A 151 -16.518 -0.243 -21.962 1.00 10.15 H new TER 2339 HIS A 151