USER MOD reduce.3.24.130724 H: found=0, std=0, add=1172, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1171 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 124 LYS NZ :NH3+ -162:sc= 0.921 (180deg=0.106) USER MOD Set 1.2: A 127 THR OG1 : rot -150:sc= 0.666 USER MOD Set 2.1: A 101 GLN : amide:sc= -0.259 X(o=-0.18,f=-0.42) USER MOD Set 2.2: A 106 THR OG1 : rot 180:sc= 0.0816 USER MOD Set 3.1: A 23 LYS NZ :NH3+ -167:sc= -0.529 (180deg=-0.591) USER MOD Set 3.2: A 35 THR OG1 : rot 71:sc= 0.93 USER MOD Single : A 1 MET CE :methyl 177:sc= -1.2 (180deg=-1.21) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.228 USER MOD Single : A 12 ASN :FLIP amide:sc= -0.235 F(o=-0.97,f=-0.23) USER MOD Single : A 17 SER OG : rot 152:sc= 0.673 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 MET CE :methyl -140:sc= -0.367 (180deg=-4.25!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl -179:sc= -0.852 (180deg=-0.923) USER MOD Single : A 41 ASN : amide:sc= 0.108 K(o=0.11,f=-3.9!) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= -1.69 K(o=-1.7,f=-9.7!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN :FLIP amide:sc= -0.251 F(o=-1.1,f=-0.25) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= 0.053 K(o=0.053,f=-1.9!) USER MOD Single : A 85 CYS SG : rot -110:sc= 0.18 USER MOD Single : A 87 SER OG : rot 180:sc= -0.461 USER MOD Single : A 88 MET CE :methyl 162:sc= -0.0935 (180deg=-0.519) USER MOD Single : A 90 ASN : amide:sc= -1.2 K(o=-1.2,f=-8.8!) USER MOD Single : A 97 MET CE :methyl -164:sc= 0 (180deg=-0.119) USER MOD Single : A 98 GLN : amide:sc= -0.0147 X(o=-0.015,f=-0.012) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 TYR OH : rot -106:sc= 0.286 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HD1:sc= -0.645 K(o=-0.65,f=-1.5) USER MOD Single : A 120 LYS NZ :NH3+ 170:sc=-0.00732 (180deg=-0.113) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ -163:sc= 0.513 (180deg=-0.775) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot -67:sc= 0.147 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 142 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 144 CYS SG : rot -40:sc= 0.19 USER MOD Single : A 148 HIS : no HD1:sc= -0.286 X(o=-0.29,f=-0.021) USER MOD Single : A 149 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 150 HIS : no HD1:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 151 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 152 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 153 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -14.286 -0.534 -2.295 1.00 43.32 N ATOM 2 CA MET A 1 -12.813 -0.694 -2.154 1.00 74.31 C ATOM 3 C MET A 1 -12.282 -1.680 -3.226 1.00 35.45 C ATOM 4 O MET A 1 -12.391 -2.899 -3.062 1.00 33.24 O ATOM 5 CB MET A 1 -12.467 -1.167 -0.713 1.00 12.04 C ATOM 6 CG MET A 1 -10.966 -1.276 -0.399 1.00 15.13 C ATOM 7 SD MET A 1 -10.668 -1.669 1.337 1.00 54.32 S ATOM 8 CE MET A 1 -8.877 -1.737 1.416 1.00 62.31 C ATOM 0 H1 MET A 1 -14.634 0.128 -1.573 1.00 43.32 H new ATOM 0 H2 MET A 1 -14.506 -0.162 -3.241 1.00 43.32 H new ATOM 0 H3 MET A 1 -14.749 -1.457 -2.170 1.00 43.32 H new ATOM 0 HA MET A 1 -12.323 0.266 -2.316 1.00 74.31 H new ATOM 0 HB2 MET A 1 -12.920 -0.476 -0.003 1.00 12.04 H new ATOM 0 HB3 MET A 1 -12.927 -2.141 -0.548 1.00 12.04 H new ATOM 0 HG2 MET A 1 -10.519 -2.046 -1.027 1.00 15.13 H new ATOM 0 HG3 MET A 1 -10.474 -0.336 -0.648 1.00 15.13 H new ATOM 0 HE1 MET A 1 -8.565 -1.919 2.444 1.00 62.31 H new ATOM 0 HE2 MET A 1 -8.515 -2.544 0.779 1.00 62.31 H new ATOM 0 HE3 MET A 1 -8.461 -0.790 1.073 1.00 62.31 H new ATOM 20 N ARG A 2 -11.812 -1.119 -4.363 1.00 54.54 N ATOM 21 CA ARG A 2 -11.189 -1.874 -5.495 1.00 71.25 C ATOM 22 C ARG A 2 -10.243 -3.034 -5.051 1.00 1.43 C ATOM 23 O ARG A 2 -9.403 -2.868 -4.154 1.00 11.54 O ATOM 24 CB ARG A 2 -10.420 -0.879 -6.404 1.00 65.21 C ATOM 25 CG ARG A 2 -11.298 0.234 -7.032 1.00 50.15 C ATOM 26 CD ARG A 2 -10.463 1.312 -7.750 1.00 11.04 C ATOM 27 NE ARG A 2 -9.611 0.746 -8.806 1.00 73.13 N ATOM 28 CZ ARG A 2 -8.746 1.416 -9.533 1.00 51.03 C ATOM 29 NH1 ARG A 2 -8.581 2.691 -9.384 1.00 0.22 N ATOM 30 NH2 ARG A 2 -8.050 0.793 -10.424 1.00 63.11 N ATOM 0 H ARG A 2 -11.851 -0.114 -4.531 1.00 54.54 H new ATOM 0 HA ARG A 2 -12.005 -2.353 -6.037 1.00 71.25 H new ATOM 0 HB2 ARG A 2 -9.627 -0.412 -5.820 1.00 65.21 H new ATOM 0 HB3 ARG A 2 -9.937 -1.438 -7.206 1.00 65.21 H new ATOM 0 HG2 ARG A 2 -11.994 -0.214 -7.741 1.00 50.15 H new ATOM 0 HG3 ARG A 2 -11.897 0.703 -6.251 1.00 50.15 H new ATOM 0 HD2 ARG A 2 -11.131 2.056 -8.185 1.00 11.04 H new ATOM 0 HD3 ARG A 2 -9.839 1.830 -7.022 1.00 11.04 H new ATOM 0 HE ARG A 2 -9.699 -0.253 -8.990 1.00 73.13 H new ATOM 0 HH11 ARG A 2 -9.129 3.198 -8.689 1.00 0.22 H new ATOM 0 HH12 ARG A 2 -7.903 3.188 -9.961 1.00 0.22 H new ATOM 0 HH21 ARG A 2 -8.174 -0.210 -10.558 1.00 63.11 H new ATOM 0 HH22 ARG A 2 -7.376 1.304 -10.994 1.00 63.11 H new ATOM 44 N SER A 3 -10.407 -4.202 -5.713 1.00 0.21 N ATOM 45 CA SER A 3 -9.651 -5.443 -5.409 1.00 41.30 C ATOM 46 C SER A 3 -8.161 -5.323 -5.798 1.00 32.52 C ATOM 47 O SER A 3 -7.802 -4.491 -6.637 1.00 61.10 O ATOM 48 CB SER A 3 -10.274 -6.646 -6.158 1.00 54.00 C ATOM 49 OG SER A 3 -10.150 -6.509 -7.570 1.00 23.53 O ATOM 0 H SER A 3 -11.072 -4.313 -6.479 1.00 0.21 H new ATOM 0 HA SER A 3 -9.712 -5.599 -4.332 1.00 41.30 H new ATOM 0 HB2 SER A 3 -9.786 -7.566 -5.837 1.00 54.00 H new ATOM 0 HB3 SER A 3 -11.327 -6.734 -5.892 1.00 54.00 H new ATOM 0 HG SER A 3 -10.552 -7.286 -8.011 1.00 23.53 H new ATOM 55 N ALA A 4 -7.314 -6.188 -5.204 1.00 14.12 N ATOM 56 CA ALA A 4 -5.854 -6.229 -5.492 1.00 75.53 C ATOM 57 C ALA A 4 -5.551 -6.475 -6.984 1.00 60.34 C ATOM 58 O ALA A 4 -4.580 -5.945 -7.515 1.00 44.41 O ATOM 59 CB ALA A 4 -5.171 -7.312 -4.654 1.00 32.35 C ATOM 0 H ALA A 4 -7.614 -6.877 -4.514 1.00 14.12 H new ATOM 0 HA ALA A 4 -5.459 -5.248 -5.228 1.00 75.53 H new ATOM 0 HB1 ALA A 4 -4.104 -7.327 -4.878 1.00 32.35 H new ATOM 0 HB2 ALA A 4 -5.316 -7.098 -3.595 1.00 32.35 H new ATOM 0 HB3 ALA A 4 -5.605 -8.283 -4.891 1.00 32.35 H new ATOM 65 N THR A 5 -6.397 -7.287 -7.632 1.00 22.04 N ATOM 66 CA THR A 5 -6.269 -7.629 -9.065 1.00 55.35 C ATOM 67 C THR A 5 -6.494 -6.374 -9.949 1.00 75.13 C ATOM 68 O THR A 5 -5.747 -6.114 -10.897 1.00 25.23 O ATOM 69 CB THR A 5 -7.301 -8.750 -9.468 1.00 54.32 C ATOM 70 OG1 THR A 5 -7.494 -9.656 -8.367 1.00 62.24 O ATOM 71 CG2 THR A 5 -6.818 -9.560 -10.686 1.00 23.13 C ATOM 0 H THR A 5 -7.196 -7.730 -7.179 1.00 22.04 H new ATOM 0 HA THR A 5 -5.259 -8.004 -9.229 1.00 55.35 H new ATOM 0 HB THR A 5 -8.236 -8.252 -9.726 1.00 54.32 H new ATOM 0 HG1 THR A 5 -8.138 -10.349 -8.623 1.00 62.24 H new ATOM 0 HG21 THR A 5 -7.557 -10.322 -10.932 1.00 23.13 H new ATOM 0 HG22 THR A 5 -6.687 -8.893 -11.538 1.00 23.13 H new ATOM 0 HG23 THR A 5 -5.867 -10.039 -10.451 1.00 23.13 H new ATOM 79 N ASP A 6 -7.530 -5.597 -9.587 1.00 33.52 N ATOM 80 CA ASP A 6 -7.931 -4.366 -10.306 1.00 12.20 C ATOM 81 C ASP A 6 -6.871 -3.235 -10.141 1.00 62.51 C ATOM 82 O ASP A 6 -6.538 -2.529 -11.102 1.00 14.54 O ATOM 83 CB ASP A 6 -9.315 -3.907 -9.773 1.00 40.10 C ATOM 84 CG ASP A 6 -9.970 -2.823 -10.639 1.00 0.44 C ATOM 85 OD1 ASP A 6 -9.618 -1.637 -10.493 1.00 73.21 O ATOM 86 OD2 ASP A 6 -10.841 -3.157 -11.475 1.00 41.02 O ATOM 0 H ASP A 6 -8.120 -5.804 -8.781 1.00 33.52 H new ATOM 0 HA ASP A 6 -7.999 -4.583 -11.372 1.00 12.20 H new ATOM 0 HB2 ASP A 6 -9.980 -4.769 -9.718 1.00 40.10 H new ATOM 0 HB3 ASP A 6 -9.198 -3.529 -8.757 1.00 40.10 H new ATOM 91 N LEU A 7 -6.369 -3.072 -8.903 1.00 1.45 N ATOM 92 CA LEU A 7 -5.317 -2.080 -8.569 1.00 11.42 C ATOM 93 C LEU A 7 -3.981 -2.423 -9.258 1.00 54.50 C ATOM 94 O LEU A 7 -3.296 -1.533 -9.766 1.00 55.21 O ATOM 95 CB LEU A 7 -5.108 -2.027 -7.039 1.00 15.51 C ATOM 96 CG LEU A 7 -6.354 -1.618 -6.198 1.00 40.55 C ATOM 97 CD1 LEU A 7 -6.059 -1.751 -4.698 1.00 42.53 C ATOM 98 CD2 LEU A 7 -6.829 -0.195 -6.558 1.00 54.22 C ATOM 0 H LEU A 7 -6.678 -3.622 -8.102 1.00 1.45 H new ATOM 0 HA LEU A 7 -5.650 -1.107 -8.931 1.00 11.42 H new ATOM 0 HB2 LEU A 7 -4.773 -3.008 -6.703 1.00 15.51 H new ATOM 0 HB3 LEU A 7 -4.303 -1.324 -6.825 1.00 15.51 H new ATOM 0 HG LEU A 7 -7.168 -2.300 -6.441 1.00 40.55 H new ATOM 0 HD11 LEU A 7 -6.941 -1.461 -4.127 1.00 42.53 H new ATOM 0 HD12 LEU A 7 -5.801 -2.785 -4.468 1.00 42.53 H new ATOM 0 HD13 LEU A 7 -5.225 -1.102 -4.432 1.00 42.53 H new ATOM 0 HD21 LEU A 7 -7.700 0.061 -5.955 1.00 54.22 H new ATOM 0 HD22 LEU A 7 -6.028 0.517 -6.360 1.00 54.22 H new ATOM 0 HD23 LEU A 7 -7.096 -0.157 -7.614 1.00 54.22 H new ATOM 110 N LEU A 8 -3.643 -3.727 -9.246 1.00 15.33 N ATOM 111 CA LEU A 8 -2.443 -4.292 -9.907 1.00 4.52 C ATOM 112 C LEU A 8 -2.369 -3.860 -11.384 1.00 22.43 C ATOM 113 O LEU A 8 -1.332 -3.386 -11.852 1.00 63.30 O ATOM 114 CB LEU A 8 -2.496 -5.838 -9.829 1.00 11.55 C ATOM 115 CG LEU A 8 -1.249 -6.611 -10.358 1.00 72.53 C ATOM 116 CD1 LEU A 8 -0.052 -6.464 -9.393 1.00 12.33 C ATOM 117 CD2 LEU A 8 -1.593 -8.092 -10.627 1.00 33.34 C ATOM 0 H LEU A 8 -4.204 -4.433 -8.769 1.00 15.33 H new ATOM 0 HA LEU A 8 -1.558 -3.918 -9.393 1.00 4.52 H new ATOM 0 HB2 LEU A 8 -2.655 -6.121 -8.788 1.00 11.55 H new ATOM 0 HB3 LEU A 8 -3.368 -6.177 -10.388 1.00 11.55 H new ATOM 0 HG LEU A 8 -0.951 -6.168 -11.308 1.00 72.53 H new ATOM 0 HD11 LEU A 8 0.803 -7.013 -9.787 1.00 12.33 H new ATOM 0 HD12 LEU A 8 0.208 -5.410 -9.294 1.00 12.33 H new ATOM 0 HD13 LEU A 8 -0.321 -6.865 -8.416 1.00 12.33 H new ATOM 0 HD21 LEU A 8 -0.708 -8.610 -10.995 1.00 33.34 H new ATOM 0 HD22 LEU A 8 -1.930 -8.561 -9.703 1.00 33.34 H new ATOM 0 HD23 LEU A 8 -2.385 -8.152 -11.374 1.00 33.34 H new ATOM 129 N ASP A 9 -3.509 -4.027 -12.079 1.00 64.11 N ATOM 130 CA ASP A 9 -3.694 -3.623 -13.489 1.00 34.32 C ATOM 131 C ASP A 9 -3.310 -2.137 -13.720 1.00 35.32 C ATOM 132 O ASP A 9 -2.582 -1.820 -14.668 1.00 24.23 O ATOM 133 CB ASP A 9 -5.174 -3.872 -13.887 1.00 74.32 C ATOM 134 CG ASP A 9 -5.491 -3.553 -15.360 1.00 3.23 C ATOM 135 OD1 ASP A 9 -5.315 -4.440 -16.221 1.00 5.34 O ATOM 136 OD2 ASP A 9 -5.917 -2.416 -15.665 1.00 73.11 O ATOM 0 H ASP A 9 -4.342 -4.453 -11.672 1.00 64.11 H new ATOM 0 HA ASP A 9 -3.031 -4.221 -14.115 1.00 34.32 H new ATOM 0 HB2 ASP A 9 -5.421 -4.915 -13.691 1.00 74.32 H new ATOM 0 HB3 ASP A 9 -5.818 -3.267 -13.249 1.00 74.32 H new ATOM 141 N GLU A 10 -3.787 -1.246 -12.822 1.00 12.35 N ATOM 142 CA GLU A 10 -3.541 0.209 -12.936 1.00 51.33 C ATOM 143 C GLU A 10 -2.081 0.577 -12.554 1.00 74.20 C ATOM 144 O GLU A 10 -1.534 1.546 -13.083 1.00 12.05 O ATOM 145 CB GLU A 10 -4.548 1.032 -12.087 1.00 33.11 C ATOM 146 CG GLU A 10 -4.535 2.544 -12.431 1.00 53.54 C ATOM 147 CD GLU A 10 -5.549 3.386 -11.644 1.00 12.04 C ATOM 148 OE1 GLU A 10 -6.757 3.073 -11.694 1.00 1.11 O ATOM 149 OE2 GLU A 10 -5.153 4.371 -10.991 1.00 31.13 O ATOM 0 H GLU A 10 -4.345 -1.510 -12.010 1.00 12.35 H new ATOM 0 HA GLU A 10 -3.692 0.470 -13.984 1.00 51.33 H new ATOM 0 HB2 GLU A 10 -5.553 0.638 -12.242 1.00 33.11 H new ATOM 0 HB3 GLU A 10 -4.314 0.903 -11.030 1.00 33.11 H new ATOM 0 HG2 GLU A 10 -3.535 2.937 -12.247 1.00 53.54 H new ATOM 0 HG3 GLU A 10 -4.733 2.663 -13.496 1.00 53.54 H new ATOM 156 N LEU A 11 -1.464 -0.204 -11.638 1.00 1.41 N ATOM 157 CA LEU A 11 -0.043 -0.031 -11.235 1.00 63.04 C ATOM 158 C LEU A 11 0.913 -0.140 -12.452 1.00 21.50 C ATOM 159 O LEU A 11 1.740 0.746 -12.687 1.00 11.41 O ATOM 160 CB LEU A 11 0.353 -1.093 -10.162 1.00 31.41 C ATOM 161 CG LEU A 11 -0.260 -0.908 -8.735 1.00 1.21 C ATOM 162 CD1 LEU A 11 -0.006 -2.152 -7.854 1.00 12.11 C ATOM 163 CD2 LEU A 11 0.294 0.368 -8.063 1.00 15.33 C ATOM 0 H LEU A 11 -1.933 -0.971 -11.156 1.00 1.41 H new ATOM 0 HA LEU A 11 0.056 0.968 -10.811 1.00 63.04 H new ATOM 0 HB2 LEU A 11 0.063 -2.076 -10.533 1.00 31.41 H new ATOM 0 HB3 LEU A 11 1.439 -1.095 -10.069 1.00 31.41 H new ATOM 0 HG LEU A 11 -1.338 -0.793 -8.844 1.00 1.21 H new ATOM 0 HD11 LEU A 11 -0.443 -1.995 -6.868 1.00 12.11 H new ATOM 0 HD12 LEU A 11 -0.463 -3.026 -8.318 1.00 12.11 H new ATOM 0 HD13 LEU A 11 1.067 -2.314 -7.753 1.00 12.11 H new ATOM 0 HD21 LEU A 11 -0.146 0.477 -7.072 1.00 15.33 H new ATOM 0 HD22 LEU A 11 1.378 0.291 -7.973 1.00 15.33 H new ATOM 0 HD23 LEU A 11 0.041 1.238 -8.670 1.00 15.33 H new ATOM 175 N ASN A 12 0.784 -1.248 -13.219 1.00 70.34 N ATOM 176 CA ASN A 12 1.599 -1.479 -14.444 1.00 21.03 C ATOM 177 C ASN A 12 1.021 -0.752 -15.691 1.00 31.22 C ATOM 178 O ASN A 12 1.597 -0.836 -16.781 1.00 51.12 O ATOM 179 CB ASN A 12 1.789 -3.001 -14.714 1.00 42.33 C ATOM 180 CG ASN A 12 0.490 -3.769 -14.941 1.00 24.14 C ATOM 181 OD1 ASN A 12 -0.013 -4.414 -13.912 1.00 63.23 O flip ATOM 182 ND2 ASN A 12 -0.039 -3.814 -16.044 1.00 50.43 N flip ATOM 0 H ASN A 12 0.124 -1.998 -13.014 1.00 70.34 H new ATOM 0 HA ASN A 12 2.580 -1.043 -14.256 1.00 21.03 H new ATOM 0 HB2 ASN A 12 2.428 -3.125 -15.589 1.00 42.33 H new ATOM 0 HB3 ASN A 12 2.316 -3.444 -13.869 1.00 42.33 H new ATOM 0 HD21 ASN A 12 0.370 -3.305 -16.827 1.00 50.43 H new ATOM 0 HD22 ASN A 12 -0.889 -4.361 -16.180 1.00 50.43 H new ATOM 189 N ALA A 13 -0.115 -0.048 -15.526 1.00 11.24 N ATOM 190 CA ALA A 13 -0.669 0.848 -16.568 1.00 31.12 C ATOM 191 C ALA A 13 -0.009 2.245 -16.492 1.00 55.20 C ATOM 192 O ALA A 13 0.446 2.785 -17.506 1.00 41.25 O ATOM 193 CB ALA A 13 -2.193 0.971 -16.414 1.00 33.42 C ATOM 0 H ALA A 13 -0.674 -0.081 -14.674 1.00 11.24 H new ATOM 0 HA ALA A 13 -0.450 0.415 -17.544 1.00 31.12 H new ATOM 0 HB1 ALA A 13 -2.585 1.632 -17.187 1.00 33.42 H new ATOM 0 HB2 ALA A 13 -2.649 -0.014 -16.514 1.00 33.42 H new ATOM 0 HB3 ALA A 13 -2.427 1.382 -15.432 1.00 33.42 H new ATOM 199 N VAL A 14 0.022 2.826 -15.274 1.00 22.44 N ATOM 200 CA VAL A 14 0.594 4.167 -15.034 1.00 2.24 C ATOM 201 C VAL A 14 2.140 4.107 -14.933 1.00 22.14 C ATOM 202 O VAL A 14 2.712 3.100 -14.510 1.00 25.24 O ATOM 203 CB VAL A 14 -0.016 4.854 -13.744 1.00 21.51 C ATOM 204 CG1 VAL A 14 -1.560 4.986 -13.855 1.00 30.10 C ATOM 205 CG2 VAL A 14 0.386 4.127 -12.427 1.00 5.20 C ATOM 0 H VAL A 14 -0.347 2.381 -14.434 1.00 22.44 H new ATOM 0 HA VAL A 14 0.325 4.781 -15.893 1.00 2.24 H new ATOM 0 HB VAL A 14 0.414 5.854 -13.695 1.00 21.51 H new ATOM 0 HG11 VAL A 14 -1.950 5.461 -12.955 1.00 30.10 H new ATOM 0 HG12 VAL A 14 -1.812 5.594 -14.724 1.00 30.10 H new ATOM 0 HG13 VAL A 14 -2.003 3.996 -13.964 1.00 30.10 H new ATOM 0 HG21 VAL A 14 -0.061 4.642 -11.576 1.00 5.20 H new ATOM 0 HG22 VAL A 14 0.029 3.097 -12.456 1.00 5.20 H new ATOM 0 HG23 VAL A 14 1.471 4.132 -12.325 1.00 5.20 H new ATOM 215 N ASP A 15 2.796 5.206 -15.323 1.00 52.33 N ATOM 216 CA ASP A 15 4.277 5.317 -15.330 1.00 30.44 C ATOM 217 C ASP A 15 4.868 5.437 -13.905 1.00 30.45 C ATOM 218 O ASP A 15 6.014 5.038 -13.666 1.00 32.43 O ATOM 219 CB ASP A 15 4.702 6.543 -16.166 1.00 31.32 C ATOM 220 CG ASP A 15 4.290 6.421 -17.639 1.00 34.14 C ATOM 221 OD1 ASP A 15 5.022 5.769 -18.415 1.00 63.43 O ATOM 222 OD2 ASP A 15 3.234 6.967 -18.030 1.00 22.11 O ATOM 0 H ASP A 15 2.323 6.050 -15.645 1.00 52.33 H new ATOM 0 HA ASP A 15 4.668 4.400 -15.772 1.00 30.44 H new ATOM 0 HB2 ASP A 15 4.255 7.442 -15.740 1.00 31.32 H new ATOM 0 HB3 ASP A 15 5.783 6.664 -16.103 1.00 31.32 H new ATOM 227 N GLU A 16 4.077 5.990 -12.965 1.00 3.22 N ATOM 228 CA GLU A 16 4.518 6.274 -11.579 1.00 72.31 C ATOM 229 C GLU A 16 3.348 6.013 -10.605 1.00 3.03 C ATOM 230 O GLU A 16 2.215 6.447 -10.856 1.00 63.04 O ATOM 231 CB GLU A 16 5.002 7.752 -11.417 1.00 42.42 C ATOM 232 CG GLU A 16 6.269 8.127 -12.216 1.00 31.11 C ATOM 233 CD GLU A 16 6.719 9.579 -11.980 1.00 34.34 C ATOM 234 OE1 GLU A 16 6.160 10.495 -12.618 1.00 63.01 O ATOM 235 OE2 GLU A 16 7.619 9.818 -11.142 1.00 64.22 O ATOM 0 H GLU A 16 3.108 6.255 -13.144 1.00 3.22 H new ATOM 0 HA GLU A 16 5.357 5.616 -11.353 1.00 72.31 H new ATOM 0 HB2 GLU A 16 4.193 8.416 -11.720 1.00 42.42 H new ATOM 0 HB3 GLU A 16 5.191 7.941 -10.360 1.00 42.42 H new ATOM 0 HG2 GLU A 16 7.079 7.452 -11.940 1.00 31.11 H new ATOM 0 HG3 GLU A 16 6.079 7.979 -13.279 1.00 31.11 H new ATOM 242 N SER A 17 3.637 5.312 -9.498 1.00 73.14 N ATOM 243 CA SER A 17 2.649 5.016 -8.439 1.00 34.33 C ATOM 244 C SER A 17 2.321 6.288 -7.602 1.00 4.24 C ATOM 245 O SER A 17 2.874 6.507 -6.518 1.00 41.52 O ATOM 246 CB SER A 17 3.185 3.869 -7.553 1.00 5.02 C ATOM 247 OG SER A 17 4.475 4.169 -7.039 1.00 64.01 O ATOM 0 H SER A 17 4.564 4.932 -9.308 1.00 73.14 H new ATOM 0 HA SER A 17 1.713 4.697 -8.898 1.00 34.33 H new ATOM 0 HB2 SER A 17 2.495 3.692 -6.728 1.00 5.02 H new ATOM 0 HB3 SER A 17 3.229 2.948 -8.135 1.00 5.02 H new ATOM 0 HG SER A 17 4.604 3.702 -6.187 1.00 64.01 H new ATOM 253 N ALA A 18 1.433 7.142 -8.148 1.00 42.32 N ATOM 254 CA ALA A 18 1.111 8.469 -7.573 1.00 43.21 C ATOM 255 C ALA A 18 0.008 8.387 -6.489 1.00 71.43 C ATOM 256 O ALA A 18 0.253 8.691 -5.312 1.00 12.23 O ATOM 257 CB ALA A 18 0.689 9.425 -8.706 1.00 5.35 C ATOM 0 H ALA A 18 0.916 6.933 -9.002 1.00 42.32 H new ATOM 0 HA ALA A 18 2.005 8.851 -7.081 1.00 43.21 H new ATOM 0 HB1 ALA A 18 0.451 10.403 -8.287 1.00 5.35 H new ATOM 0 HB2 ALA A 18 1.506 9.525 -9.421 1.00 5.35 H new ATOM 0 HB3 ALA A 18 -0.189 9.024 -9.212 1.00 5.35 H new ATOM 263 N ARG A 19 -1.210 7.984 -6.896 1.00 12.31 N ATOM 264 CA ARG A 19 -2.372 7.871 -5.980 1.00 30.14 C ATOM 265 C ARG A 19 -2.570 6.405 -5.524 1.00 12.52 C ATOM 266 O ARG A 19 -3.102 6.148 -4.442 1.00 72.11 O ATOM 267 CB ARG A 19 -3.660 8.420 -6.665 1.00 74.50 C ATOM 268 CG ARG A 19 -4.873 8.666 -5.714 1.00 42.43 C ATOM 269 CD ARG A 19 -4.789 10.005 -4.929 1.00 45.14 C ATOM 270 NE ARG A 19 -3.623 10.089 -4.013 1.00 3.35 N ATOM 271 CZ ARG A 19 -2.646 10.981 -4.081 1.00 53.24 C ATOM 272 NH1 ARG A 19 -2.593 11.857 -5.034 1.00 73.41 N ATOM 273 NH2 ARG A 19 -1.714 10.982 -3.193 1.00 21.11 N ATOM 0 H ARG A 19 -1.421 7.728 -7.861 1.00 12.31 H new ATOM 0 HA ARG A 19 -2.173 8.474 -5.094 1.00 30.14 H new ATOM 0 HB2 ARG A 19 -3.414 9.358 -7.162 1.00 74.50 H new ATOM 0 HB3 ARG A 19 -3.965 7.718 -7.441 1.00 74.50 H new ATOM 0 HG2 ARG A 19 -5.791 8.656 -6.301 1.00 42.43 H new ATOM 0 HG3 ARG A 19 -4.940 7.842 -5.004 1.00 42.43 H new ATOM 0 HD2 ARG A 19 -4.741 10.830 -5.640 1.00 45.14 H new ATOM 0 HD3 ARG A 19 -5.704 10.135 -4.351 1.00 45.14 H new ATOM 0 HE ARG A 19 -3.570 9.398 -3.265 1.00 3.35 H new ATOM 0 HH11 ARG A 19 -3.314 11.871 -5.755 1.00 73.41 H new ATOM 0 HH12 ARG A 19 -1.830 12.533 -5.063 1.00 73.41 H new ATOM 0 HH21 ARG A 19 -1.728 10.296 -2.438 1.00 21.11 H new ATOM 0 HH22 ARG A 19 -0.961 11.668 -3.244 1.00 21.11 H new ATOM 287 N ILE A 20 -2.129 5.448 -6.362 1.00 0.21 N ATOM 288 CA ILE A 20 -2.131 4.012 -6.022 1.00 52.22 C ATOM 289 C ILE A 20 -0.669 3.515 -5.985 1.00 31.41 C ATOM 290 O ILE A 20 -0.003 3.435 -7.016 1.00 63.54 O ATOM 291 CB ILE A 20 -2.988 3.144 -7.029 1.00 33.21 C ATOM 292 CG1 ILE A 20 -4.448 3.700 -7.108 1.00 43.42 C ATOM 293 CG2 ILE A 20 -2.987 1.645 -6.614 1.00 64.24 C ATOM 294 CD1 ILE A 20 -5.409 2.897 -7.970 1.00 41.32 C ATOM 0 H ILE A 20 -1.762 5.648 -7.292 1.00 0.21 H new ATOM 0 HA ILE A 20 -2.601 3.893 -5.046 1.00 52.22 H new ATOM 0 HB ILE A 20 -2.535 3.213 -8.018 1.00 33.21 H new ATOM 0 HG12 ILE A 20 -4.853 3.754 -6.097 1.00 43.42 H new ATOM 0 HG13 ILE A 20 -4.409 4.720 -7.491 1.00 43.42 H new ATOM 0 HG21 ILE A 20 -3.583 1.071 -7.323 1.00 64.24 H new ATOM 0 HG22 ILE A 20 -1.964 1.269 -6.612 1.00 64.24 H new ATOM 0 HG23 ILE A 20 -3.413 1.544 -5.616 1.00 64.24 H new ATOM 0 HD11 ILE A 20 -6.392 3.369 -7.956 1.00 41.32 H new ATOM 0 HD12 ILE A 20 -5.038 2.863 -8.994 1.00 41.32 H new ATOM 0 HD13 ILE A 20 -5.488 1.883 -7.579 1.00 41.32 H new ATOM 306 N GLU A 21 -0.190 3.232 -4.769 1.00 32.31 N ATOM 307 CA GLU A 21 1.195 2.805 -4.480 1.00 73.03 C ATOM 308 C GLU A 21 1.280 1.268 -4.272 1.00 65.01 C ATOM 309 O GLU A 21 0.305 0.644 -3.872 1.00 51.24 O ATOM 310 CB GLU A 21 1.677 3.565 -3.212 1.00 44.42 C ATOM 311 CG GLU A 21 3.074 3.184 -2.672 1.00 64.35 C ATOM 312 CD GLU A 21 4.236 3.568 -3.603 1.00 31.42 C ATOM 313 OE1 GLU A 21 4.605 2.761 -4.480 1.00 51.11 O ATOM 314 OE2 GLU A 21 4.816 4.657 -3.424 1.00 74.32 O ATOM 0 H GLU A 21 -0.767 3.294 -3.930 1.00 32.31 H new ATOM 0 HA GLU A 21 1.838 3.043 -5.327 1.00 73.03 H new ATOM 0 HB2 GLU A 21 1.675 4.633 -3.432 1.00 44.42 H new ATOM 0 HB3 GLU A 21 0.948 3.402 -2.418 1.00 44.42 H new ATOM 0 HG2 GLU A 21 3.222 3.667 -1.706 1.00 64.35 H new ATOM 0 HG3 GLU A 21 3.103 2.108 -2.498 1.00 64.35 H new ATOM 321 N ALA A 22 2.450 0.669 -4.583 1.00 51.12 N ATOM 322 CA ALA A 22 2.738 -0.761 -4.309 1.00 32.11 C ATOM 323 C ALA A 22 4.012 -0.914 -3.440 1.00 40.20 C ATOM 324 O ALA A 22 5.031 -0.268 -3.708 1.00 41.52 O ATOM 325 CB ALA A 22 2.902 -1.531 -5.629 1.00 72.11 C ATOM 0 H ALA A 22 3.223 1.161 -5.031 1.00 51.12 H new ATOM 0 HA ALA A 22 1.896 -1.178 -3.756 1.00 32.11 H new ATOM 0 HB1 ALA A 22 3.113 -2.579 -5.415 1.00 72.11 H new ATOM 0 HB2 ALA A 22 1.983 -1.457 -6.210 1.00 72.11 H new ATOM 0 HB3 ALA A 22 3.727 -1.104 -6.199 1.00 72.11 H new ATOM 331 N LYS A 23 3.942 -1.769 -2.399 1.00 0.34 N ATOM 332 CA LYS A 23 5.104 -2.116 -1.533 1.00 64.23 C ATOM 333 C LYS A 23 5.219 -3.661 -1.375 1.00 61.32 C ATOM 334 O LYS A 23 4.225 -4.385 -1.452 1.00 30.14 O ATOM 335 CB LYS A 23 5.002 -1.428 -0.122 1.00 75.41 C ATOM 336 CG LYS A 23 5.931 -0.205 0.119 1.00 63.11 C ATOM 337 CD LYS A 23 5.471 1.096 -0.583 1.00 61.21 C ATOM 338 CE LYS A 23 6.337 2.310 -0.176 1.00 50.44 C ATOM 339 NZ LYS A 23 5.909 3.575 -0.832 1.00 32.11 N ATOM 0 H LYS A 23 3.080 -2.243 -2.129 1.00 0.34 H new ATOM 0 HA LYS A 23 6.004 -1.740 -2.020 1.00 64.23 H new ATOM 0 HB2 LYS A 23 3.971 -1.109 0.029 1.00 75.41 H new ATOM 0 HB3 LYS A 23 5.218 -2.177 0.640 1.00 75.41 H new ATOM 0 HG2 LYS A 23 5.998 -0.021 1.191 1.00 63.11 H new ATOM 0 HG3 LYS A 23 6.935 -0.453 -0.225 1.00 63.11 H new ATOM 0 HD2 LYS A 23 5.520 0.962 -1.664 1.00 61.21 H new ATOM 0 HD3 LYS A 23 4.429 1.294 -0.333 1.00 61.21 H new ATOM 0 HE2 LYS A 23 6.292 2.435 0.906 1.00 50.44 H new ATOM 0 HE3 LYS A 23 7.378 2.109 -0.431 1.00 50.44 H new ATOM 0 HZ1 LYS A 23 6.644 4.300 -0.702 1.00 32.11 H new ATOM 0 HZ2 LYS A 23 5.765 3.407 -1.848 1.00 32.11 H new ATOM 0 HZ3 LYS A 23 5.019 3.903 -0.405 1.00 32.11 H new ATOM 353 N ARG A 24 6.459 -4.142 -1.198 1.00 52.11 N ATOM 354 CA ARG A 24 6.755 -5.554 -0.831 1.00 52.43 C ATOM 355 C ARG A 24 6.718 -5.766 0.706 1.00 72.32 C ATOM 356 O ARG A 24 6.664 -4.799 1.478 1.00 41.21 O ATOM 357 CB ARG A 24 8.149 -5.943 -1.405 1.00 55.22 C ATOM 358 CG ARG A 24 8.204 -5.962 -2.947 1.00 12.10 C ATOM 359 CD ARG A 24 9.618 -6.163 -3.521 1.00 21.14 C ATOM 360 NE ARG A 24 10.518 -5.051 -3.154 1.00 44.55 N ATOM 361 CZ ARG A 24 11.392 -4.462 -3.939 1.00 14.21 C ATOM 362 NH1 ARG A 24 11.525 -4.807 -5.174 1.00 1.05 N ATOM 363 NH2 ARG A 24 12.103 -3.490 -3.472 1.00 22.13 N ATOM 0 H ARG A 24 7.295 -3.568 -1.304 1.00 52.11 H new ATOM 0 HA ARG A 24 5.986 -6.197 -1.260 1.00 52.43 H new ATOM 0 HB2 ARG A 24 8.894 -5.240 -1.033 1.00 55.22 H new ATOM 0 HB3 ARG A 24 8.425 -6.928 -1.029 1.00 55.22 H new ATOM 0 HG2 ARG A 24 7.558 -6.759 -3.313 1.00 12.10 H new ATOM 0 HG3 ARG A 24 7.799 -5.024 -3.326 1.00 12.10 H new ATOM 0 HD2 ARG A 24 10.031 -7.102 -3.153 1.00 21.14 H new ATOM 0 HD3 ARG A 24 9.562 -6.243 -4.607 1.00 21.14 H new ATOM 0 HE ARG A 24 10.455 -4.706 -2.196 1.00 44.55 H new ATOM 0 HH11 ARG A 24 10.945 -5.552 -5.561 1.00 1.05 H new ATOM 0 HH12 ARG A 24 12.210 -4.335 -5.764 1.00 1.05 H new ATOM 0 HH21 ARG A 24 11.982 -3.189 -2.505 1.00 22.13 H new ATOM 0 HH22 ARG A 24 12.785 -3.024 -4.070 1.00 22.13 H new ATOM 377 N ALA A 25 6.749 -7.046 1.144 1.00 12.00 N ATOM 378 CA ALA A 25 6.857 -7.407 2.586 1.00 73.20 C ATOM 379 C ALA A 25 8.210 -6.930 3.180 1.00 55.11 C ATOM 380 O ALA A 25 8.284 -6.498 4.336 1.00 72.01 O ATOM 381 CB ALA A 25 6.675 -8.922 2.772 1.00 44.43 C ATOM 0 H ALA A 25 6.701 -7.852 0.521 1.00 12.00 H new ATOM 0 HA ALA A 25 6.061 -6.897 3.129 1.00 73.20 H new ATOM 0 HB1 ALA A 25 6.756 -9.171 3.830 1.00 44.43 H new ATOM 0 HB2 ALA A 25 5.693 -9.218 2.404 1.00 44.43 H new ATOM 0 HB3 ALA A 25 7.447 -9.452 2.214 1.00 44.43 H new ATOM 387 N SER A 26 9.270 -7.036 2.362 1.00 2.20 N ATOM 388 CA SER A 26 10.604 -6.441 2.637 1.00 1.31 C ATOM 389 C SER A 26 10.539 -4.899 2.776 1.00 13.35 C ATOM 390 O SER A 26 11.261 -4.309 3.584 1.00 60.44 O ATOM 391 CB SER A 26 11.574 -6.816 1.485 1.00 32.45 C ATOM 392 OG SER A 26 12.852 -6.214 1.635 1.00 44.43 O ATOM 0 H SER A 26 9.232 -7.542 1.477 1.00 2.20 H new ATOM 0 HA SER A 26 10.960 -6.841 3.586 1.00 1.31 H new ATOM 0 HB2 SER A 26 11.688 -7.899 1.448 1.00 32.45 H new ATOM 0 HB3 SER A 26 11.140 -6.508 0.534 1.00 32.45 H new ATOM 0 HG SER A 26 13.428 -6.480 0.888 1.00 44.43 H new ATOM 398 N ASP A 27 9.660 -4.263 1.979 1.00 52.11 N ATOM 399 CA ASP A 27 9.517 -2.786 1.916 1.00 5.32 C ATOM 400 C ASP A 27 8.500 -2.245 2.956 1.00 33.42 C ATOM 401 O ASP A 27 8.221 -1.037 2.993 1.00 32.22 O ATOM 402 CB ASP A 27 9.126 -2.378 0.467 1.00 2.02 C ATOM 403 CG ASP A 27 10.253 -2.634 -0.561 1.00 33.34 C ATOM 404 OD1 ASP A 27 10.871 -3.721 -0.537 1.00 50.03 O ATOM 405 OD2 ASP A 27 10.522 -1.754 -1.406 1.00 34.43 O ATOM 0 H ASP A 27 9.023 -4.757 1.355 1.00 52.11 H new ATOM 0 HA ASP A 27 10.474 -2.333 2.175 1.00 5.32 H new ATOM 0 HB2 ASP A 27 8.237 -2.932 0.167 1.00 2.02 H new ATOM 0 HB3 ASP A 27 8.863 -1.320 0.452 1.00 2.02 H new ATOM 410 N MET A 28 7.961 -3.151 3.800 1.00 41.45 N ATOM 411 CA MET A 28 7.137 -2.780 4.975 1.00 51.04 C ATOM 412 C MET A 28 7.967 -2.019 6.041 1.00 51.03 C ATOM 413 O MET A 28 9.032 -2.485 6.463 1.00 3.52 O ATOM 414 CB MET A 28 6.474 -4.039 5.605 1.00 2.21 C ATOM 415 CG MET A 28 5.271 -4.574 4.821 1.00 5.52 C ATOM 416 SD MET A 28 3.943 -3.349 4.704 1.00 11.33 S ATOM 417 CE MET A 28 3.549 -3.024 6.433 1.00 24.23 C ATOM 0 H MET A 28 8.083 -4.157 3.688 1.00 41.45 H new ATOM 0 HA MET A 28 6.353 -2.110 4.622 1.00 51.04 H new ATOM 0 HB2 MET A 28 7.222 -4.828 5.685 1.00 2.21 H new ATOM 0 HB3 MET A 28 6.155 -3.799 6.619 1.00 2.21 H new ATOM 0 HG2 MET A 28 5.589 -4.861 3.819 1.00 5.52 H new ATOM 0 HG3 MET A 28 4.893 -5.474 5.306 1.00 5.52 H new ATOM 0 HE1 MET A 28 2.469 -2.930 6.549 1.00 24.23 H new ATOM 0 HE2 MET A 28 3.910 -3.847 7.049 1.00 24.23 H new ATOM 0 HE3 MET A 28 4.029 -2.097 6.748 1.00 24.23 H new ATOM 427 N GLY A 29 7.455 -0.851 6.466 1.00 25.21 N ATOM 428 CA GLY A 29 8.124 -0.005 7.463 1.00 50.33 C ATOM 429 C GLY A 29 7.774 1.477 7.306 1.00 43.04 C ATOM 430 O GLY A 29 6.660 1.814 6.881 1.00 23.21 O ATOM 0 H GLY A 29 6.571 -0.471 6.129 1.00 25.21 H new ATOM 0 HA2 GLY A 29 7.844 -0.337 8.463 1.00 50.33 H new ATOM 0 HA3 GLY A 29 9.203 -0.131 7.376 1.00 50.33 H new ATOM 434 N LYS A 30 8.750 2.364 7.623 1.00 24.11 N ATOM 435 CA LYS A 30 8.549 3.837 7.612 1.00 31.51 C ATOM 436 C LYS A 30 8.295 4.393 6.185 1.00 22.15 C ATOM 437 O LYS A 30 7.797 5.505 6.044 1.00 25.42 O ATOM 438 CB LYS A 30 9.755 4.574 8.271 1.00 53.21 C ATOM 439 CG LYS A 30 11.095 4.494 7.495 1.00 31.10 C ATOM 440 CD LYS A 30 12.189 5.392 8.130 1.00 1.42 C ATOM 441 CE LYS A 30 13.496 5.435 7.315 1.00 14.34 C ATOM 442 NZ LYS A 30 14.183 4.115 7.252 1.00 21.32 N ATOM 0 H LYS A 30 9.693 2.082 7.892 1.00 24.11 H new ATOM 0 HA LYS A 30 7.652 4.030 8.201 1.00 31.51 H new ATOM 0 HB2 LYS A 30 9.491 5.624 8.397 1.00 53.21 H new ATOM 0 HB3 LYS A 30 9.908 4.162 9.268 1.00 53.21 H new ATOM 0 HG2 LYS A 30 11.441 3.461 7.475 1.00 31.10 H new ATOM 0 HG3 LYS A 30 10.933 4.796 6.460 1.00 31.10 H new ATOM 0 HD2 LYS A 30 11.801 6.405 8.234 1.00 1.42 H new ATOM 0 HD3 LYS A 30 12.408 5.030 9.134 1.00 1.42 H new ATOM 0 HE2 LYS A 30 13.276 5.773 6.302 1.00 14.34 H new ATOM 0 HE3 LYS A 30 14.170 6.169 7.757 1.00 14.34 H new ATOM 0 HZ1 LYS A 30 15.055 4.204 6.692 1.00 21.32 H new ATOM 0 HZ2 LYS A 30 14.420 3.801 8.215 1.00 21.32 H new ATOM 0 HZ3 LYS A 30 13.554 3.417 6.805 1.00 21.32 H new ATOM 456 N SER A 31 8.654 3.613 5.141 1.00 1.22 N ATOM 457 CA SER A 31 8.397 3.981 3.723 1.00 11.41 C ATOM 458 C SER A 31 6.902 3.826 3.361 1.00 33.33 C ATOM 459 O SER A 31 6.358 4.621 2.589 1.00 3.11 O ATOM 460 CB SER A 31 9.267 3.125 2.777 1.00 14.42 C ATOM 461 OG SER A 31 10.648 3.352 3.016 1.00 53.30 O ATOM 0 H SER A 31 9.127 2.716 5.252 1.00 1.22 H new ATOM 0 HA SER A 31 8.665 5.030 3.599 1.00 11.41 H new ATOM 0 HB2 SER A 31 9.038 2.069 2.921 1.00 14.42 H new ATOM 0 HB3 SER A 31 9.029 3.365 1.741 1.00 14.42 H new ATOM 0 HG SER A 31 11.181 2.799 2.407 1.00 53.30 H new ATOM 467 N VAL A 32 6.247 2.783 3.915 1.00 32.23 N ATOM 468 CA VAL A 32 4.777 2.600 3.787 1.00 42.31 C ATOM 469 C VAL A 32 4.040 3.743 4.527 1.00 45.00 C ATOM 470 O VAL A 32 3.139 4.382 3.977 1.00 53.35 O ATOM 471 CB VAL A 32 4.304 1.207 4.364 1.00 32.54 C ATOM 472 CG1 VAL A 32 2.774 0.998 4.190 1.00 11.35 C ATOM 473 CG2 VAL A 32 5.091 0.040 3.726 1.00 14.31 C ATOM 0 H VAL A 32 6.709 2.052 4.456 1.00 32.23 H new ATOM 0 HA VAL A 32 4.533 2.623 2.725 1.00 42.31 H new ATOM 0 HB VAL A 32 4.515 1.217 5.433 1.00 32.54 H new ATOM 0 HG11 VAL A 32 2.490 0.029 4.600 1.00 11.35 H new ATOM 0 HG12 VAL A 32 2.237 1.786 4.718 1.00 11.35 H new ATOM 0 HG13 VAL A 32 2.520 1.032 3.131 1.00 11.35 H new ATOM 0 HG21 VAL A 32 4.743 -0.905 4.143 1.00 14.31 H new ATOM 0 HG22 VAL A 32 4.932 0.041 2.648 1.00 14.31 H new ATOM 0 HG23 VAL A 32 6.154 0.160 3.936 1.00 14.31 H new ATOM 483 N MET A 33 4.489 3.997 5.771 1.00 61.02 N ATOM 484 CA MET A 33 3.932 5.044 6.658 1.00 21.33 C ATOM 485 C MET A 33 4.105 6.467 6.081 1.00 35.34 C ATOM 486 O MET A 33 3.241 7.327 6.262 1.00 0.12 O ATOM 487 CB MET A 33 4.585 4.951 8.057 1.00 3.11 C ATOM 488 CG MET A 33 4.395 3.588 8.734 1.00 0.22 C ATOM 489 SD MET A 33 2.666 3.067 8.772 1.00 44.44 S ATOM 490 CE MET A 33 1.906 4.406 9.687 1.00 32.34 C ATOM 0 H MET A 33 5.257 3.477 6.196 1.00 61.02 H new ATOM 0 HA MET A 33 2.860 4.863 6.738 1.00 21.33 H new ATOM 0 HB2 MET A 33 5.652 5.156 7.965 1.00 3.11 H new ATOM 0 HB3 MET A 33 4.165 5.727 8.697 1.00 3.11 H new ATOM 0 HG2 MET A 33 4.985 2.839 8.206 1.00 0.22 H new ATOM 0 HG3 MET A 33 4.779 3.636 9.753 1.00 0.22 H new ATOM 0 HE1 MET A 33 0.840 4.209 9.803 1.00 32.34 H new ATOM 0 HE2 MET A 33 2.369 4.484 10.671 1.00 32.34 H new ATOM 0 HE3 MET A 33 2.045 5.342 9.146 1.00 32.34 H new ATOM 500 N GLU A 34 5.231 6.686 5.390 1.00 31.03 N ATOM 501 CA GLU A 34 5.528 7.949 4.678 1.00 61.35 C ATOM 502 C GLU A 34 4.470 8.230 3.579 1.00 53.40 C ATOM 503 O GLU A 34 4.028 9.373 3.396 1.00 75.34 O ATOM 504 CB GLU A 34 6.948 7.851 4.058 1.00 3.53 C ATOM 505 CG GLU A 34 7.405 9.066 3.224 1.00 1.12 C ATOM 506 CD GLU A 34 8.849 8.918 2.704 1.00 5.14 C ATOM 507 OE1 GLU A 34 9.067 8.154 1.733 1.00 63.44 O ATOM 508 OE2 GLU A 34 9.773 9.543 3.278 1.00 61.21 O ATOM 0 H GLU A 34 5.972 5.990 5.305 1.00 31.03 H new ATOM 0 HA GLU A 34 5.492 8.778 5.385 1.00 61.35 H new ATOM 0 HB2 GLU A 34 7.665 7.698 4.864 1.00 3.53 H new ATOM 0 HB3 GLU A 34 6.986 6.965 3.424 1.00 3.53 H new ATOM 0 HG2 GLU A 34 6.730 9.196 2.378 1.00 1.12 H new ATOM 0 HG3 GLU A 34 7.332 9.968 3.832 1.00 1.12 H new ATOM 515 N THR A 35 4.061 7.156 2.872 1.00 42.44 N ATOM 516 CA THR A 35 3.037 7.233 1.809 1.00 21.41 C ATOM 517 C THR A 35 1.620 7.490 2.411 1.00 75.22 C ATOM 518 O THR A 35 0.819 8.222 1.823 1.00 14.14 O ATOM 519 CB THR A 35 3.022 5.935 0.921 1.00 4.22 C ATOM 520 OG1 THR A 35 4.366 5.503 0.608 1.00 13.31 O ATOM 521 CG2 THR A 35 2.265 6.162 -0.401 1.00 5.41 C ATOM 0 H THR A 35 4.429 6.216 3.021 1.00 42.44 H new ATOM 0 HA THR A 35 3.302 8.075 1.170 1.00 21.41 H new ATOM 0 HB THR A 35 2.512 5.167 1.502 1.00 4.22 H new ATOM 0 HG1 THR A 35 4.790 5.143 1.415 1.00 13.31 H new ATOM 0 HG21 THR A 35 2.275 5.244 -0.988 1.00 5.41 H new ATOM 0 HG22 THR A 35 1.234 6.444 -0.186 1.00 5.41 H new ATOM 0 HG23 THR A 35 2.749 6.959 -0.965 1.00 5.41 H new ATOM 529 N VAL A 36 1.342 6.903 3.606 1.00 15.13 N ATOM 530 CA VAL A 36 0.077 7.136 4.369 1.00 52.11 C ATOM 531 C VAL A 36 -0.092 8.646 4.711 1.00 11.01 C ATOM 532 O VAL A 36 -1.168 9.226 4.513 1.00 54.22 O ATOM 533 CB VAL A 36 0.032 6.280 5.703 1.00 1.42 C ATOM 534 CG1 VAL A 36 -1.283 6.505 6.494 1.00 74.11 C ATOM 535 CG2 VAL A 36 0.234 4.773 5.416 1.00 52.24 C ATOM 0 H VAL A 36 1.982 6.258 4.069 1.00 15.13 H new ATOM 0 HA VAL A 36 -0.746 6.818 3.729 1.00 52.11 H new ATOM 0 HB VAL A 36 0.859 6.627 6.323 1.00 1.42 H new ATOM 0 HG11 VAL A 36 -1.271 5.899 7.400 1.00 74.11 H new ATOM 0 HG12 VAL A 36 -1.370 7.558 6.763 1.00 74.11 H new ATOM 0 HG13 VAL A 36 -2.133 6.216 5.876 1.00 74.11 H new ATOM 0 HG21 VAL A 36 0.197 4.216 6.352 1.00 52.24 H new ATOM 0 HG22 VAL A 36 -0.556 4.420 4.753 1.00 52.24 H new ATOM 0 HG23 VAL A 36 1.203 4.620 4.940 1.00 52.24 H new ATOM 545 N ILE A 37 1.004 9.260 5.205 1.00 21.05 N ATOM 546 CA ILE A 37 1.083 10.722 5.485 1.00 74.04 C ATOM 547 C ILE A 37 0.877 11.550 4.182 1.00 54.25 C ATOM 548 O ILE A 37 0.226 12.605 4.191 1.00 62.41 O ATOM 549 CB ILE A 37 2.482 11.092 6.139 1.00 1.11 C ATOM 550 CG1 ILE A 37 2.714 10.288 7.466 1.00 62.42 C ATOM 551 CG2 ILE A 37 2.625 12.621 6.391 1.00 31.32 C ATOM 552 CD1 ILE A 37 4.116 10.416 8.069 1.00 54.44 C ATOM 0 H ILE A 37 1.866 8.760 5.424 1.00 21.05 H new ATOM 0 HA ILE A 37 0.286 10.970 6.187 1.00 74.04 H new ATOM 0 HB ILE A 37 3.253 10.807 5.423 1.00 1.11 H new ATOM 0 HG12 ILE A 37 1.986 10.621 8.206 1.00 62.42 H new ATOM 0 HG13 ILE A 37 2.514 9.234 7.273 1.00 62.42 H new ATOM 0 HG21 ILE A 37 3.597 12.827 6.839 1.00 31.32 H new ATOM 0 HG22 ILE A 37 2.541 13.155 5.445 1.00 31.32 H new ATOM 0 HG23 ILE A 37 1.837 12.954 7.066 1.00 31.32 H new ATOM 0 HD11 ILE A 37 4.175 9.824 8.982 1.00 54.44 H new ATOM 0 HD12 ILE A 37 4.854 10.053 7.354 1.00 54.44 H new ATOM 0 HD13 ILE A 37 4.318 11.462 8.301 1.00 54.44 H new ATOM 564 N ALA A 38 1.413 11.023 3.058 1.00 21.14 N ATOM 565 CA ALA A 38 1.355 11.677 1.728 1.00 14.00 C ATOM 566 C ALA A 38 -0.074 11.674 1.109 1.00 61.13 C ATOM 567 O ALA A 38 -0.319 12.370 0.123 1.00 63.35 O ATOM 568 CB ALA A 38 2.363 11.008 0.777 1.00 4.45 C ATOM 0 H ALA A 38 1.901 10.127 3.047 1.00 21.14 H new ATOM 0 HA ALA A 38 1.622 12.724 1.870 1.00 14.00 H new ATOM 0 HB1 ALA A 38 2.318 11.491 -0.199 1.00 4.45 H new ATOM 0 HB2 ALA A 38 3.369 11.107 1.185 1.00 4.45 H new ATOM 0 HB3 ALA A 38 2.117 9.951 0.671 1.00 4.45 H new ATOM 574 N PHE A 39 -0.991 10.844 1.646 1.00 13.22 N ATOM 575 CA PHE A 39 -2.438 10.922 1.309 1.00 34.25 C ATOM 576 C PHE A 39 -3.191 11.855 2.298 1.00 3.42 C ATOM 577 O PHE A 39 -4.034 12.662 1.889 1.00 63.01 O ATOM 578 CB PHE A 39 -3.094 9.509 1.343 1.00 42.14 C ATOM 579 CG PHE A 39 -2.490 8.476 0.380 1.00 3.11 C ATOM 580 CD1 PHE A 39 -2.470 8.706 -0.991 1.00 34.02 C ATOM 581 CD2 PHE A 39 -1.957 7.272 0.845 1.00 43.41 C ATOM 582 CE1 PHE A 39 -1.935 7.774 -1.864 1.00 1.04 C ATOM 583 CE2 PHE A 39 -1.425 6.338 -0.028 1.00 11.31 C ATOM 584 CZ PHE A 39 -1.414 6.591 -1.382 1.00 51.13 C ATOM 0 H PHE A 39 -0.761 10.110 2.316 1.00 13.22 H new ATOM 0 HA PHE A 39 -2.514 11.331 0.301 1.00 34.25 H new ATOM 0 HB2 PHE A 39 -3.022 9.119 2.358 1.00 42.14 H new ATOM 0 HB3 PHE A 39 -4.155 9.615 1.116 1.00 42.14 H new ATOM 0 HD1 PHE A 39 -2.878 9.626 -1.381 1.00 34.02 H new ATOM 0 HD2 PHE A 39 -1.960 7.065 1.905 1.00 43.41 H new ATOM 0 HE1 PHE A 39 -1.926 7.974 -2.925 1.00 1.04 H new ATOM 0 HE2 PHE A 39 -1.019 5.412 0.352 1.00 11.31 H new ATOM 0 HZ PHE A 39 -0.998 5.865 -2.065 1.00 51.13 H new ATOM 594 N ALA A 40 -2.854 11.727 3.601 1.00 73.12 N ATOM 595 CA ALA A 40 -3.605 12.356 4.719 1.00 23.10 C ATOM 596 C ALA A 40 -3.466 13.903 4.777 1.00 1.24 C ATOM 597 O ALA A 40 -4.470 14.629 4.778 1.00 54.31 O ATOM 598 CB ALA A 40 -3.144 11.735 6.049 1.00 51.23 C ATOM 0 H ALA A 40 -2.050 11.182 3.912 1.00 73.12 H new ATOM 0 HA ALA A 40 -4.662 12.157 4.542 1.00 23.10 H new ATOM 0 HB1 ALA A 40 -3.691 12.192 6.873 1.00 51.23 H new ATOM 0 HB2 ALA A 40 -3.337 10.662 6.036 1.00 51.23 H new ATOM 0 HB3 ALA A 40 -2.076 11.910 6.181 1.00 51.23 H new ATOM 604 N ASN A 41 -2.213 14.393 4.832 1.00 21.11 N ATOM 605 CA ASN A 41 -1.904 15.841 5.007 1.00 65.13 C ATOM 606 C ASN A 41 -2.187 16.668 3.734 1.00 5.23 C ATOM 607 O ASN A 41 -2.258 17.900 3.796 1.00 21.23 O ATOM 608 CB ASN A 41 -0.422 16.031 5.426 1.00 63.22 C ATOM 609 CG ASN A 41 -0.087 15.412 6.782 1.00 11.44 C ATOM 610 OD1 ASN A 41 -0.678 14.423 7.202 1.00 73.25 O ATOM 611 ND2 ASN A 41 0.863 15.993 7.484 1.00 54.34 N ATOM 0 H ASN A 41 -1.383 13.805 4.757 1.00 21.11 H new ATOM 0 HA ASN A 41 -2.564 16.207 5.793 1.00 65.13 H new ATOM 0 HB2 ASN A 41 0.222 15.589 4.665 1.00 63.22 H new ATOM 0 HB3 ASN A 41 -0.195 17.097 5.456 1.00 63.22 H new ATOM 0 HD21 ASN A 41 1.121 15.621 8.398 1.00 54.34 H new ATOM 0 HD22 ASN A 41 1.341 16.815 7.114 1.00 54.34 H new ATOM 618 N GLU A 42 -2.328 15.987 2.595 1.00 3.51 N ATOM 619 CA GLU A 42 -2.556 16.634 1.294 1.00 71.42 C ATOM 620 C GLU A 42 -4.044 17.056 1.101 1.00 34.23 C ATOM 621 O GLU A 42 -4.951 16.245 1.351 1.00 62.11 O ATOM 622 CB GLU A 42 -2.092 15.680 0.168 1.00 43.41 C ATOM 623 CG GLU A 42 -0.563 15.533 0.046 1.00 74.40 C ATOM 624 CD GLU A 42 0.143 16.850 -0.331 1.00 2.12 C ATOM 625 OE1 GLU A 42 -0.042 17.325 -1.473 1.00 21.12 O ATOM 626 OE2 GLU A 42 0.875 17.419 0.509 1.00 22.31 O ATOM 0 H GLU A 42 -2.288 14.969 2.545 1.00 3.51 H new ATOM 0 HA GLU A 42 -1.971 17.553 1.256 1.00 71.42 H new ATOM 0 HB2 GLU A 42 -2.526 14.695 0.341 1.00 43.41 H new ATOM 0 HB3 GLU A 42 -2.487 16.040 -0.782 1.00 43.41 H new ATOM 0 HG2 GLU A 42 -0.162 15.171 0.993 1.00 74.40 H new ATOM 0 HG3 GLU A 42 -0.336 14.778 -0.706 1.00 74.40 H new ATOM 633 N PRO A 43 -4.311 18.336 0.639 1.00 35.42 N ATOM 634 CA PRO A 43 -5.688 18.885 0.512 1.00 2.30 C ATOM 635 C PRO A 43 -6.547 18.145 -0.551 1.00 63.53 C ATOM 636 O PRO A 43 -6.390 18.376 -1.754 1.00 61.03 O ATOM 637 CB PRO A 43 -5.456 20.381 0.117 1.00 11.54 C ATOM 638 CG PRO A 43 -4.013 20.648 0.434 1.00 43.34 C ATOM 639 CD PRO A 43 -3.301 19.338 0.203 1.00 72.45 C ATOM 0 HA PRO A 43 -6.254 18.764 1.436 1.00 2.30 H new ATOM 0 HB2 PRO A 43 -5.665 20.547 -0.940 1.00 11.54 H new ATOM 0 HB3 PRO A 43 -6.113 21.044 0.680 1.00 11.54 H new ATOM 0 HG2 PRO A 43 -3.609 21.432 -0.206 1.00 43.34 H new ATOM 0 HG3 PRO A 43 -3.893 20.984 1.464 1.00 43.34 H new ATOM 0 HD2 PRO A 43 -3.025 19.206 -0.843 1.00 72.45 H new ATOM 0 HD3 PRO A 43 -2.383 19.268 0.786 1.00 72.45 H new ATOM 647 N GLY A 44 -7.446 17.256 -0.081 1.00 41.03 N ATOM 648 CA GLY A 44 -8.345 16.488 -0.958 1.00 41.10 C ATOM 649 C GLY A 44 -7.674 15.442 -1.865 1.00 11.24 C ATOM 650 O GLY A 44 -8.198 15.144 -2.947 1.00 45.12 O ATOM 0 H GLY A 44 -7.567 17.053 0.911 1.00 41.03 H new ATOM 0 HA2 GLY A 44 -9.081 15.980 -0.335 1.00 41.10 H new ATOM 0 HA3 GLY A 44 -8.891 17.190 -1.589 1.00 41.10 H new ATOM 654 N LEU A 45 -6.531 14.850 -1.436 1.00 70.14 N ATOM 655 CA LEU A 45 -5.886 13.719 -2.170 1.00 23.32 C ATOM 656 C LEU A 45 -6.308 12.347 -1.560 1.00 65.23 C ATOM 657 O LEU A 45 -5.615 11.330 -1.723 1.00 24.22 O ATOM 658 CB LEU A 45 -4.330 13.897 -2.229 1.00 22.13 C ATOM 659 CG LEU A 45 -3.785 14.917 -3.305 1.00 64.13 C ATOM 660 CD1 LEU A 45 -4.186 16.376 -2.998 1.00 13.31 C ATOM 661 CD2 LEU A 45 -2.250 14.793 -3.473 1.00 14.21 C ATOM 0 H LEU A 45 -6.035 15.132 -0.590 1.00 70.14 H new ATOM 0 HA LEU A 45 -6.241 13.730 -3.201 1.00 23.32 H new ATOM 0 HB2 LEU A 45 -3.984 14.218 -1.246 1.00 22.13 H new ATOM 0 HB3 LEU A 45 -3.881 12.923 -2.422 1.00 22.13 H new ATOM 0 HG LEU A 45 -4.258 14.649 -4.250 1.00 64.13 H new ATOM 0 HD11 LEU A 45 -3.785 17.034 -3.769 1.00 13.31 H new ATOM 0 HD12 LEU A 45 -5.273 16.459 -2.980 1.00 13.31 H new ATOM 0 HD13 LEU A 45 -3.784 16.667 -2.028 1.00 13.31 H new ATOM 0 HD21 LEU A 45 -1.907 15.508 -4.220 1.00 14.21 H new ATOM 0 HD22 LEU A 45 -1.762 15.001 -2.521 1.00 14.21 H new ATOM 0 HD23 LEU A 45 -2.000 13.783 -3.796 1.00 14.21 H new ATOM 673 N ASP A 46 -7.462 12.358 -0.858 1.00 73.51 N ATOM 674 CA ASP A 46 -8.230 11.152 -0.453 1.00 72.43 C ATOM 675 C ASP A 46 -8.491 10.181 -1.639 1.00 54.31 C ATOM 676 O ASP A 46 -8.562 10.596 -2.804 1.00 34.41 O ATOM 677 CB ASP A 46 -9.582 11.619 0.175 1.00 64.41 C ATOM 678 CG ASP A 46 -10.589 10.481 0.458 1.00 63.42 C ATOM 679 OD1 ASP A 46 -10.267 9.573 1.245 1.00 72.31 O ATOM 680 OD2 ASP A 46 -11.690 10.477 -0.127 1.00 12.05 O ATOM 0 H ASP A 46 -7.899 13.226 -0.548 1.00 73.51 H new ATOM 0 HA ASP A 46 -7.638 10.595 0.273 1.00 72.43 H new ATOM 0 HB2 ASP A 46 -9.372 12.141 1.109 1.00 64.41 H new ATOM 0 HB3 ASP A 46 -10.049 12.340 -0.496 1.00 64.41 H new ATOM 685 N GLY A 47 -8.663 8.892 -1.309 1.00 75.44 N ATOM 686 CA GLY A 47 -8.911 7.857 -2.312 1.00 72.14 C ATOM 687 C GLY A 47 -7.632 7.177 -2.794 1.00 34.04 C ATOM 688 O GLY A 47 -7.525 6.823 -3.972 1.00 51.42 O ATOM 0 H GLY A 47 -8.634 8.545 -0.350 1.00 75.44 H new ATOM 0 HA2 GLY A 47 -9.580 7.105 -1.893 1.00 72.14 H new ATOM 0 HA3 GLY A 47 -9.424 8.301 -3.165 1.00 72.14 H new ATOM 692 N GLY A 48 -6.654 6.970 -1.884 1.00 73.42 N ATOM 693 CA GLY A 48 -5.377 6.338 -2.240 1.00 62.00 C ATOM 694 C GLY A 48 -5.275 4.893 -1.743 1.00 21.31 C ATOM 695 O GLY A 48 -5.727 4.582 -0.633 1.00 51.14 O ATOM 0 H GLY A 48 -6.730 7.233 -0.901 1.00 73.42 H new ATOM 0 HA2 GLY A 48 -5.257 6.355 -3.323 1.00 62.00 H new ATOM 0 HA3 GLY A 48 -4.558 6.921 -1.820 1.00 62.00 H new ATOM 699 N TYR A 49 -4.681 4.008 -2.564 1.00 65.21 N ATOM 700 CA TYR A 49 -4.564 2.561 -2.254 1.00 1.15 C ATOM 701 C TYR A 49 -3.084 2.105 -2.155 1.00 55.40 C ATOM 702 O TYR A 49 -2.299 2.329 -3.068 1.00 44.50 O ATOM 703 CB TYR A 49 -5.303 1.734 -3.342 1.00 74.35 C ATOM 704 CG TYR A 49 -6.841 1.894 -3.334 1.00 0.43 C ATOM 705 CD1 TYR A 49 -7.646 1.048 -2.564 1.00 63.21 C ATOM 706 CD2 TYR A 49 -7.484 2.878 -4.098 1.00 41.54 C ATOM 707 CE1 TYR A 49 -9.019 1.173 -2.555 1.00 71.51 C ATOM 708 CE2 TYR A 49 -8.866 3.004 -4.086 1.00 74.14 C ATOM 709 CZ TYR A 49 -9.626 2.145 -3.316 1.00 64.32 C ATOM 710 OH TYR A 49 -11.002 2.266 -3.287 1.00 0.15 O ATOM 0 H TYR A 49 -4.268 4.269 -3.459 1.00 65.21 H new ATOM 0 HA TYR A 49 -5.024 2.390 -1.281 1.00 1.15 H new ATOM 0 HB2 TYR A 49 -4.925 2.026 -4.322 1.00 74.35 H new ATOM 0 HB3 TYR A 49 -5.059 0.680 -3.208 1.00 74.35 H new ATOM 0 HD1 TYR A 49 -7.182 0.280 -1.963 1.00 63.21 H new ATOM 0 HD2 TYR A 49 -6.894 3.549 -4.706 1.00 41.54 H new ATOM 0 HE1 TYR A 49 -9.618 0.508 -1.951 1.00 71.51 H new ATOM 0 HE2 TYR A 49 -9.346 3.771 -4.676 1.00 74.14 H new ATOM 0 HH TYR A 49 -11.278 2.999 -3.876 1.00 0.15 H new ATOM 720 N LEU A 50 -2.739 1.451 -1.036 1.00 2.33 N ATOM 721 CA LEU A 50 -1.431 0.791 -0.805 1.00 70.25 C ATOM 722 C LEU A 50 -1.573 -0.723 -1.028 1.00 0.13 C ATOM 723 O LEU A 50 -2.187 -1.412 -0.218 1.00 72.24 O ATOM 724 CB LEU A 50 -0.952 1.049 0.653 1.00 50.24 C ATOM 725 CG LEU A 50 -0.489 2.495 0.979 1.00 1.43 C ATOM 726 CD1 LEU A 50 -0.389 2.715 2.500 1.00 62.23 C ATOM 727 CD2 LEU A 50 0.858 2.797 0.294 1.00 64.24 C ATOM 0 H LEU A 50 -3.373 1.360 -0.242 1.00 2.33 H new ATOM 0 HA LEU A 50 -0.700 1.201 -1.502 1.00 70.25 H new ATOM 0 HB2 LEU A 50 -1.765 0.789 1.331 1.00 50.24 H new ATOM 0 HB3 LEU A 50 -0.128 0.369 0.868 1.00 50.24 H new ATOM 0 HG LEU A 50 -1.237 3.186 0.590 1.00 1.43 H new ATOM 0 HD11 LEU A 50 -0.063 3.736 2.699 1.00 62.23 H new ATOM 0 HD12 LEU A 50 -1.365 2.550 2.956 1.00 62.23 H new ATOM 0 HD13 LEU A 50 0.332 2.015 2.922 1.00 62.23 H new ATOM 0 HD21 LEU A 50 1.168 3.814 0.533 1.00 64.24 H new ATOM 0 HD22 LEU A 50 1.612 2.095 0.649 1.00 64.24 H new ATOM 0 HD23 LEU A 50 0.748 2.695 -0.786 1.00 64.24 H new ATOM 739 N LEU A 51 -0.995 -1.252 -2.102 1.00 11.15 N ATOM 740 CA LEU A 51 -1.100 -2.683 -2.416 1.00 72.25 C ATOM 741 C LEU A 51 0.201 -3.402 -2.011 1.00 12.44 C ATOM 742 O LEU A 51 1.258 -3.214 -2.623 1.00 4.13 O ATOM 743 CB LEU A 51 -1.442 -2.891 -3.915 1.00 24.30 C ATOM 744 CG LEU A 51 -1.700 -4.369 -4.347 1.00 53.33 C ATOM 745 CD1 LEU A 51 -2.712 -5.061 -3.412 1.00 1.55 C ATOM 746 CD2 LEU A 51 -2.157 -4.451 -5.823 1.00 71.50 C ATOM 0 H LEU A 51 -0.447 -0.715 -2.774 1.00 11.15 H new ATOM 0 HA LEU A 51 -1.916 -3.121 -1.842 1.00 72.25 H new ATOM 0 HB2 LEU A 51 -2.327 -2.302 -4.153 1.00 24.30 H new ATOM 0 HB3 LEU A 51 -0.624 -2.493 -4.515 1.00 24.30 H new ATOM 0 HG LEU A 51 -0.754 -4.904 -4.262 1.00 53.33 H new ATOM 0 HD11 LEU A 51 -2.868 -6.088 -3.742 1.00 1.55 H new ATOM 0 HD12 LEU A 51 -2.325 -5.062 -2.393 1.00 1.55 H new ATOM 0 HD13 LEU A 51 -3.660 -4.523 -3.439 1.00 1.55 H new ATOM 0 HD21 LEU A 51 -2.328 -5.493 -6.093 1.00 71.50 H new ATOM 0 HD22 LEU A 51 -3.081 -3.886 -5.950 1.00 71.50 H new ATOM 0 HD23 LEU A 51 -1.384 -4.031 -6.467 1.00 71.50 H new ATOM 758 N LEU A 52 0.094 -4.223 -0.957 1.00 33.44 N ATOM 759 CA LEU A 52 1.233 -4.915 -0.332 1.00 3.23 C ATOM 760 C LEU A 52 1.315 -6.371 -0.828 1.00 72.43 C ATOM 761 O LEU A 52 0.295 -7.056 -0.918 1.00 65.31 O ATOM 762 CB LEU A 52 1.096 -4.878 1.218 1.00 44.11 C ATOM 763 CG LEU A 52 0.846 -3.467 1.856 1.00 33.31 C ATOM 764 CD1 LEU A 52 0.768 -3.554 3.391 1.00 64.45 C ATOM 765 CD2 LEU A 52 1.907 -2.433 1.415 1.00 33.31 C ATOM 0 H LEU A 52 -0.798 -4.429 -0.507 1.00 33.44 H new ATOM 0 HA LEU A 52 2.152 -4.402 -0.615 1.00 3.23 H new ATOM 0 HB2 LEU A 52 0.275 -5.535 1.505 1.00 44.11 H new ATOM 0 HB3 LEU A 52 2.005 -5.295 1.653 1.00 44.11 H new ATOM 0 HG LEU A 52 -0.118 -3.119 1.486 1.00 33.31 H new ATOM 0 HD11 LEU A 52 0.594 -2.560 3.803 1.00 64.45 H new ATOM 0 HD12 LEU A 52 -0.051 -4.214 3.677 1.00 64.45 H new ATOM 0 HD13 LEU A 52 1.706 -3.950 3.781 1.00 64.45 H new ATOM 0 HD21 LEU A 52 1.694 -1.471 1.881 1.00 33.31 H new ATOM 0 HD22 LEU A 52 2.896 -2.773 1.721 1.00 33.31 H new ATOM 0 HD23 LEU A 52 1.881 -2.324 0.331 1.00 33.31 H new ATOM 777 N GLY A 53 2.533 -6.827 -1.148 1.00 30.13 N ATOM 778 CA GLY A 53 2.765 -8.204 -1.621 1.00 5.41 C ATOM 779 C GLY A 53 2.820 -8.303 -3.141 1.00 71.24 C ATOM 780 O GLY A 53 2.395 -9.301 -3.734 1.00 62.22 O ATOM 0 H GLY A 53 3.379 -6.261 -1.088 1.00 30.13 H new ATOM 0 HA2 GLY A 53 3.701 -8.574 -1.203 1.00 5.41 H new ATOM 0 HA3 GLY A 53 1.971 -8.851 -1.247 1.00 5.41 H new ATOM 784 N VAL A 54 3.355 -7.253 -3.775 1.00 22.23 N ATOM 785 CA VAL A 54 3.565 -7.204 -5.233 1.00 34.11 C ATOM 786 C VAL A 54 5.071 -7.228 -5.539 1.00 62.02 C ATOM 787 O VAL A 54 5.853 -6.569 -4.863 1.00 4.02 O ATOM 788 CB VAL A 54 2.926 -5.902 -5.857 1.00 3.42 C ATOM 789 CG1 VAL A 54 3.141 -5.831 -7.391 1.00 10.43 C ATOM 790 CG2 VAL A 54 1.425 -5.804 -5.510 1.00 52.55 C ATOM 0 H VAL A 54 3.657 -6.407 -3.291 1.00 22.23 H new ATOM 0 HA VAL A 54 3.080 -8.074 -5.676 1.00 34.11 H new ATOM 0 HB VAL A 54 3.439 -5.047 -5.416 1.00 3.42 H new ATOM 0 HG11 VAL A 54 2.686 -4.920 -7.780 1.00 10.43 H new ATOM 0 HG12 VAL A 54 4.209 -5.825 -7.609 1.00 10.43 H new ATOM 0 HG13 VAL A 54 2.679 -6.698 -7.864 1.00 10.43 H new ATOM 0 HG21 VAL A 54 1.008 -4.899 -5.951 1.00 52.55 H new ATOM 0 HG22 VAL A 54 0.902 -6.675 -5.906 1.00 52.55 H new ATOM 0 HG23 VAL A 54 1.303 -5.769 -4.427 1.00 52.55 H new ATOM 800 N ASP A 55 5.458 -7.995 -6.556 1.00 44.05 N ATOM 801 CA ASP A 55 6.837 -8.051 -7.057 1.00 73.44 C ATOM 802 C ASP A 55 6.905 -7.243 -8.364 1.00 72.03 C ATOM 803 O ASP A 55 5.919 -7.172 -9.104 1.00 11.41 O ATOM 804 CB ASP A 55 7.247 -9.529 -7.285 1.00 51.15 C ATOM 805 CG ASP A 55 8.743 -9.708 -7.578 1.00 75.22 C ATOM 806 OD1 ASP A 55 9.535 -9.832 -6.614 1.00 41.04 O ATOM 807 OD2 ASP A 55 9.141 -9.707 -8.762 1.00 41.15 O ATOM 0 H ASP A 55 4.817 -8.604 -7.064 1.00 44.05 H new ATOM 0 HA ASP A 55 7.532 -7.622 -6.335 1.00 73.44 H new ATOM 0 HB2 ASP A 55 6.985 -10.111 -6.402 1.00 51.15 H new ATOM 0 HB3 ASP A 55 6.670 -9.934 -8.117 1.00 51.15 H new ATOM 812 N TRP A 56 8.051 -6.625 -8.643 1.00 41.33 N ATOM 813 CA TRP A 56 8.229 -5.788 -9.848 1.00 65.30 C ATOM 814 C TRP A 56 9.663 -5.898 -10.410 1.00 5.10 C ATOM 815 O TRP A 56 10.640 -5.992 -9.657 1.00 74.54 O ATOM 816 CB TRP A 56 7.831 -4.306 -9.563 1.00 35.24 C ATOM 817 CG TRP A 56 8.461 -3.694 -8.323 1.00 11.01 C ATOM 818 CD1 TRP A 56 9.744 -3.232 -8.178 1.00 11.24 C ATOM 819 CD2 TRP A 56 7.815 -3.461 -7.061 1.00 65.10 C ATOM 820 NE1 TRP A 56 9.932 -2.755 -6.908 1.00 63.43 N ATOM 821 CE2 TRP A 56 8.764 -2.875 -6.208 1.00 2.30 C ATOM 822 CE3 TRP A 56 6.526 -3.694 -6.576 1.00 42.32 C ATOM 823 CZ2 TRP A 56 8.468 -2.519 -4.896 1.00 51.13 C ATOM 824 CZ3 TRP A 56 6.234 -3.340 -5.273 1.00 62.01 C ATOM 825 CH2 TRP A 56 7.202 -2.755 -4.451 1.00 2.31 C ATOM 0 H TRP A 56 8.880 -6.683 -8.052 1.00 41.33 H new ATOM 0 HA TRP A 56 7.557 -6.167 -10.618 1.00 65.30 H new ATOM 0 HB2 TRP A 56 8.105 -3.700 -10.427 1.00 35.24 H new ATOM 0 HB3 TRP A 56 6.747 -4.250 -9.466 1.00 35.24 H new ATOM 0 HD1 TRP A 56 10.497 -3.243 -8.953 1.00 11.24 H new ATOM 0 HE1 TRP A 56 10.804 -2.372 -6.543 1.00 63.43 H new ATOM 0 HE3 TRP A 56 5.773 -4.142 -7.207 1.00 42.32 H new ATOM 0 HZ2 TRP A 56 9.213 -2.073 -4.255 1.00 51.13 H new ATOM 0 HZ3 TRP A 56 5.243 -3.518 -4.883 1.00 62.01 H new ATOM 0 HH2 TRP A 56 6.940 -2.484 -3.439 1.00 2.31 H new ATOM 836 N ALA A 57 9.765 -5.882 -11.747 1.00 73.14 N ATOM 837 CA ALA A 57 11.049 -5.977 -12.474 1.00 55.11 C ATOM 838 C ALA A 57 10.976 -5.190 -13.804 1.00 13.51 C ATOM 839 O ALA A 57 9.892 -5.019 -14.376 1.00 74.44 O ATOM 840 CB ALA A 57 11.414 -7.456 -12.726 1.00 41.23 C ATOM 0 H ALA A 57 8.956 -5.802 -12.363 1.00 73.14 H new ATOM 0 HA ALA A 57 11.833 -5.533 -11.861 1.00 55.11 H new ATOM 0 HB1 ALA A 57 12.362 -7.511 -13.262 1.00 41.23 H new ATOM 0 HB2 ALA A 57 11.506 -7.976 -11.772 1.00 41.23 H new ATOM 0 HB3 ALA A 57 10.632 -7.927 -13.322 1.00 41.23 H new ATOM 846 N ILE A 58 12.141 -4.707 -14.281 1.00 72.04 N ATOM 847 CA ILE A 58 12.237 -3.939 -15.541 1.00 53.33 C ATOM 848 C ILE A 58 12.384 -4.896 -16.752 1.00 20.01 C ATOM 849 O ILE A 58 13.260 -5.771 -16.768 1.00 30.45 O ATOM 850 CB ILE A 58 13.444 -2.921 -15.508 1.00 32.44 C ATOM 851 CG1 ILE A 58 13.335 -1.963 -14.273 1.00 34.01 C ATOM 852 CG2 ILE A 58 13.547 -2.108 -16.830 1.00 53.44 C ATOM 853 CD1 ILE A 58 12.086 -1.088 -14.235 1.00 75.04 C ATOM 0 H ILE A 58 13.036 -4.836 -13.809 1.00 72.04 H new ATOM 0 HA ILE A 58 11.315 -3.368 -15.648 1.00 53.33 H new ATOM 0 HB ILE A 58 14.359 -3.505 -15.410 1.00 32.44 H new ATOM 0 HG12 ILE A 58 13.365 -2.564 -13.364 1.00 34.01 H new ATOM 0 HG13 ILE A 58 14.212 -1.316 -14.257 1.00 34.01 H new ATOM 0 HG21 ILE A 58 14.389 -1.419 -16.769 1.00 53.44 H new ATOM 0 HG22 ILE A 58 13.697 -2.791 -17.666 1.00 53.44 H new ATOM 0 HG23 ILE A 58 12.627 -1.544 -16.983 1.00 53.44 H new ATOM 0 HD11 ILE A 58 12.107 -0.463 -13.342 1.00 75.04 H new ATOM 0 HD12 ILE A 58 12.059 -0.454 -15.121 1.00 75.04 H new ATOM 0 HD13 ILE A 58 11.199 -1.721 -14.214 1.00 75.04 H new ATOM 865 N ASN A 59 11.506 -4.722 -17.749 1.00 74.31 N ATOM 866 CA ASN A 59 11.538 -5.502 -19.008 1.00 41.04 C ATOM 867 C ASN A 59 12.464 -4.839 -20.066 1.00 50.34 C ATOM 868 O ASN A 59 13.062 -3.786 -19.821 1.00 72.02 O ATOM 869 CB ASN A 59 10.088 -5.677 -19.549 1.00 74.24 C ATOM 870 CG ASN A 59 9.330 -4.358 -19.758 1.00 44.21 C ATOM 871 OD1 ASN A 59 9.907 -3.327 -20.070 1.00 70.30 O ATOM 872 ND2 ASN A 59 8.027 -4.381 -19.581 1.00 75.32 N ATOM 0 H ASN A 59 10.750 -4.038 -17.712 1.00 74.31 H new ATOM 0 HA ASN A 59 11.956 -6.487 -18.799 1.00 41.04 H new ATOM 0 HB2 ASN A 59 10.128 -6.214 -20.497 1.00 74.24 H new ATOM 0 HB3 ASN A 59 9.526 -6.300 -18.853 1.00 74.24 H new ATOM 0 HD21 ASN A 59 7.480 -3.529 -19.704 1.00 75.32 H new ATOM 0 HD22 ASN A 59 7.563 -5.251 -19.321 1.00 75.32 H new ATOM 879 N ASP A 60 12.547 -5.466 -21.249 1.00 24.40 N ATOM 880 CA ASP A 60 13.348 -4.974 -22.407 1.00 20.43 C ATOM 881 C ASP A 60 12.899 -3.574 -22.941 1.00 71.33 C ATOM 882 O ASP A 60 13.666 -2.899 -23.640 1.00 74.45 O ATOM 883 CB ASP A 60 13.291 -6.032 -23.540 1.00 61.11 C ATOM 884 CG ASP A 60 11.853 -6.502 -23.835 1.00 54.21 C ATOM 885 OD1 ASP A 60 11.123 -5.822 -24.584 1.00 63.32 O ATOM 886 OD2 ASP A 60 11.434 -7.536 -23.272 1.00 11.13 O ATOM 0 H ASP A 60 12.058 -6.340 -21.442 1.00 24.40 H new ATOM 0 HA ASP A 60 14.371 -4.835 -22.056 1.00 20.43 H new ATOM 0 HB2 ASP A 60 13.726 -5.612 -24.447 1.00 61.11 H new ATOM 0 HB3 ASP A 60 13.901 -6.891 -23.262 1.00 61.11 H new ATOM 891 N LYS A 61 11.664 -3.154 -22.611 1.00 72.04 N ATOM 892 CA LYS A 61 11.113 -1.835 -23.026 1.00 72.42 C ATOM 893 C LYS A 61 11.602 -0.673 -22.116 1.00 52.13 C ATOM 894 O LYS A 61 11.466 0.502 -22.482 1.00 64.34 O ATOM 895 CB LYS A 61 9.560 -1.868 -22.999 1.00 60.42 C ATOM 896 CG LYS A 61 8.909 -3.009 -23.816 1.00 54.21 C ATOM 897 CD LYS A 61 7.360 -2.965 -23.756 1.00 23.44 C ATOM 898 CE LYS A 61 6.810 -3.055 -22.319 1.00 42.10 C ATOM 899 NZ LYS A 61 5.330 -2.967 -22.270 1.00 42.45 N ATOM 0 H LYS A 61 11.017 -3.710 -22.052 1.00 72.04 H new ATOM 0 HA LYS A 61 11.475 -1.651 -24.038 1.00 72.42 H new ATOM 0 HB2 LYS A 61 9.233 -1.953 -21.963 1.00 60.42 H new ATOM 0 HB3 LYS A 61 9.186 -0.915 -23.374 1.00 60.42 H new ATOM 0 HG2 LYS A 61 9.232 -2.940 -24.855 1.00 54.21 H new ATOM 0 HG3 LYS A 61 9.258 -3.969 -23.437 1.00 54.21 H new ATOM 0 HD2 LYS A 61 7.010 -2.041 -24.216 1.00 23.44 H new ATOM 0 HD3 LYS A 61 6.956 -3.787 -24.346 1.00 23.44 H new ATOM 0 HE2 LYS A 61 7.130 -3.995 -21.869 1.00 42.10 H new ATOM 0 HE3 LYS A 61 7.238 -2.252 -21.719 1.00 42.10 H new ATOM 0 HZ1 LYS A 61 5.011 -3.033 -21.282 1.00 42.45 H new ATOM 0 HZ2 LYS A 61 5.023 -2.059 -22.674 1.00 42.45 H new ATOM 0 HZ3 LYS A 61 4.917 -3.748 -22.820 1.00 42.45 H new ATOM 913 N GLY A 62 12.167 -1.017 -20.943 1.00 51.45 N ATOM 914 CA GLY A 62 12.468 -0.028 -19.894 1.00 53.14 C ATOM 915 C GLY A 62 11.213 0.368 -19.111 1.00 14.44 C ATOM 916 O GLY A 62 10.996 1.542 -18.797 1.00 64.34 O ATOM 0 H GLY A 62 12.424 -1.974 -20.699 1.00 51.45 H new ATOM 0 HA2 GLY A 62 13.210 -0.439 -19.209 1.00 53.14 H new ATOM 0 HA3 GLY A 62 12.909 0.860 -20.347 1.00 53.14 H new ATOM 920 N ASP A 63 10.392 -0.644 -18.811 1.00 43.43 N ATOM 921 CA ASP A 63 9.062 -0.493 -18.189 1.00 2.50 C ATOM 922 C ASP A 63 8.932 -1.432 -16.960 1.00 31.34 C ATOM 923 O ASP A 63 9.379 -2.587 -17.003 1.00 44.34 O ATOM 924 CB ASP A 63 7.996 -0.803 -19.282 1.00 4.34 C ATOM 925 CG ASP A 63 6.555 -0.939 -18.774 1.00 71.05 C ATOM 926 OD1 ASP A 63 6.044 0.007 -18.140 1.00 53.21 O ATOM 927 OD2 ASP A 63 5.920 -1.989 -19.035 1.00 53.23 O ATOM 0 H ASP A 63 10.635 -1.617 -18.997 1.00 43.43 H new ATOM 0 HA ASP A 63 8.913 0.521 -17.818 1.00 2.50 H new ATOM 0 HB2 ASP A 63 8.026 -0.011 -20.030 1.00 4.34 H new ATOM 0 HB3 ASP A 63 8.275 -1.729 -19.786 1.00 4.34 H new ATOM 932 N THR A 64 8.319 -0.927 -15.871 1.00 44.51 N ATOM 933 CA THR A 64 8.134 -1.693 -14.615 1.00 13.11 C ATOM 934 C THR A 64 6.858 -2.567 -14.693 1.00 50.32 C ATOM 935 O THR A 64 5.749 -2.040 -14.852 1.00 15.50 O ATOM 936 CB THR A 64 8.031 -0.741 -13.366 1.00 71.13 C ATOM 937 OG1 THR A 64 9.126 0.193 -13.353 1.00 53.22 O ATOM 938 CG2 THR A 64 8.033 -1.526 -12.033 1.00 63.53 C ATOM 0 H THR A 64 7.939 0.019 -15.834 1.00 44.51 H new ATOM 0 HA THR A 64 9.010 -2.331 -14.496 1.00 13.11 H new ATOM 0 HB THR A 64 7.083 -0.210 -13.454 1.00 71.13 H new ATOM 0 HG1 THR A 64 9.047 0.779 -12.571 1.00 53.22 H new ATOM 0 HG21 THR A 64 7.960 -0.828 -11.199 1.00 63.53 H new ATOM 0 HG22 THR A 64 7.182 -2.207 -12.011 1.00 63.53 H new ATOM 0 HG23 THR A 64 8.958 -2.097 -11.948 1.00 63.53 H new ATOM 946 N VAL A 65 7.021 -3.898 -14.566 1.00 31.43 N ATOM 947 CA VAL A 65 5.894 -4.861 -14.612 1.00 41.35 C ATOM 948 C VAL A 65 5.528 -5.315 -13.185 1.00 3.34 C ATOM 949 O VAL A 65 6.380 -5.838 -12.466 1.00 11.44 O ATOM 950 CB VAL A 65 6.230 -6.126 -15.486 1.00 2.22 C ATOM 951 CG1 VAL A 65 5.002 -7.072 -15.606 1.00 30.41 C ATOM 952 CG2 VAL A 65 6.756 -5.712 -16.879 1.00 0.44 C ATOM 0 H VAL A 65 7.931 -4.338 -14.429 1.00 31.43 H new ATOM 0 HA VAL A 65 5.050 -4.346 -15.072 1.00 41.35 H new ATOM 0 HB VAL A 65 7.022 -6.679 -14.981 1.00 2.22 H new ATOM 0 HG11 VAL A 65 5.267 -7.936 -16.216 1.00 30.41 H new ATOM 0 HG12 VAL A 65 4.702 -7.407 -14.613 1.00 30.41 H new ATOM 0 HG13 VAL A 65 4.175 -6.537 -16.074 1.00 30.41 H new ATOM 0 HG21 VAL A 65 6.981 -6.604 -17.463 1.00 0.44 H new ATOM 0 HG22 VAL A 65 5.997 -5.123 -17.394 1.00 0.44 H new ATOM 0 HG23 VAL A 65 7.662 -5.116 -16.764 1.00 0.44 H new ATOM 962 N TYR A 66 4.255 -5.136 -12.801 1.00 52.35 N ATOM 963 CA TYR A 66 3.748 -5.503 -11.460 1.00 33.02 C ATOM 964 C TYR A 66 3.022 -6.876 -11.507 1.00 75.51 C ATOM 965 O TYR A 66 2.046 -7.051 -12.244 1.00 61.23 O ATOM 966 CB TYR A 66 2.811 -4.386 -10.923 1.00 63.44 C ATOM 967 CG TYR A 66 3.537 -3.061 -10.611 1.00 5.51 C ATOM 968 CD1 TYR A 66 3.848 -2.153 -11.624 1.00 53.25 C ATOM 969 CD2 TYR A 66 3.914 -2.722 -9.306 1.00 12.32 C ATOM 970 CE1 TYR A 66 4.500 -0.964 -11.353 1.00 54.54 C ATOM 971 CE2 TYR A 66 4.568 -1.535 -9.032 1.00 22.41 C ATOM 972 CZ TYR A 66 4.855 -0.658 -10.056 1.00 13.13 C ATOM 973 OH TYR A 66 5.514 0.521 -9.783 1.00 53.31 O ATOM 0 H TYR A 66 3.543 -4.732 -13.409 1.00 52.35 H new ATOM 0 HA TYR A 66 4.591 -5.599 -10.776 1.00 33.02 H new ATOM 0 HB2 TYR A 66 2.029 -4.196 -11.658 1.00 63.44 H new ATOM 0 HB3 TYR A 66 2.319 -4.742 -10.018 1.00 63.44 H new ATOM 0 HD1 TYR A 66 3.573 -2.384 -12.643 1.00 53.25 H new ATOM 0 HD2 TYR A 66 3.689 -3.401 -8.497 1.00 12.32 H new ATOM 0 HE1 TYR A 66 4.730 -0.277 -12.154 1.00 54.54 H new ATOM 0 HE2 TYR A 66 4.853 -1.296 -8.018 1.00 22.41 H new ATOM 0 HH TYR A 66 5.689 0.583 -8.821 1.00 53.31 H new ATOM 983 N ARG A 67 3.511 -7.827 -10.691 1.00 41.05 N ATOM 984 CA ARG A 67 3.013 -9.227 -10.632 1.00 20.41 C ATOM 985 C ARG A 67 2.651 -9.624 -9.167 1.00 50.41 C ATOM 986 O ARG A 67 3.378 -9.273 -8.232 1.00 4.54 O ATOM 987 CB ARG A 67 4.081 -10.196 -11.233 1.00 25.51 C ATOM 988 CG ARG A 67 5.491 -10.060 -10.614 1.00 23.43 C ATOM 989 CD ARG A 67 6.509 -11.079 -11.161 1.00 12.52 C ATOM 990 NE ARG A 67 6.136 -12.472 -10.839 1.00 13.43 N ATOM 991 CZ ARG A 67 6.974 -13.476 -10.665 1.00 50.22 C ATOM 992 NH1 ARG A 67 8.262 -13.315 -10.741 1.00 52.33 N ATOM 993 NH2 ARG A 67 6.507 -14.652 -10.405 1.00 3.20 N ATOM 0 H ARG A 67 4.276 -7.649 -10.040 1.00 41.05 H new ATOM 0 HA ARG A 67 2.103 -9.304 -11.227 1.00 20.41 H new ATOM 0 HB2 ARG A 67 3.737 -11.222 -11.101 1.00 25.51 H new ATOM 0 HB3 ARG A 67 4.151 -10.019 -12.306 1.00 25.51 H new ATOM 0 HG2 ARG A 67 5.864 -9.053 -10.799 1.00 23.43 H new ATOM 0 HG3 ARG A 67 5.417 -10.179 -9.533 1.00 23.43 H new ATOM 0 HD2 ARG A 67 6.587 -10.967 -12.242 1.00 12.52 H new ATOM 0 HD3 ARG A 67 7.494 -10.864 -10.746 1.00 12.52 H new ATOM 0 HE ARG A 67 5.141 -12.676 -10.743 1.00 13.43 H new ATOM 0 HH11 ARG A 67 8.650 -12.393 -10.940 1.00 52.33 H new ATOM 0 HH12 ARG A 67 8.885 -14.111 -10.602 1.00 52.33 H new ATOM 0 HH21 ARG A 67 5.500 -14.797 -10.336 1.00 3.20 H new ATOM 0 HH22 ARG A 67 7.146 -15.436 -10.269 1.00 3.20 H new ATOM 1007 N PRO A 68 1.514 -10.365 -8.935 1.00 41.33 N ATOM 1008 CA PRO A 68 1.053 -10.718 -7.573 1.00 2.14 C ATOM 1009 C PRO A 68 1.710 -12.018 -7.032 1.00 54.25 C ATOM 1010 O PRO A 68 1.324 -13.131 -7.403 1.00 22.12 O ATOM 1011 CB PRO A 68 -0.473 -10.873 -7.778 1.00 61.02 C ATOM 1012 CG PRO A 68 -0.617 -11.416 -9.179 1.00 60.41 C ATOM 1013 CD PRO A 68 0.601 -10.929 -9.971 1.00 50.01 C ATOM 0 HA PRO A 68 1.321 -9.974 -6.823 1.00 2.14 H new ATOM 0 HB2 PRO A 68 -0.904 -11.553 -7.043 1.00 61.02 H new ATOM 0 HB3 PRO A 68 -0.987 -9.918 -7.669 1.00 61.02 H new ATOM 0 HG2 PRO A 68 -0.661 -12.505 -9.169 1.00 60.41 H new ATOM 0 HG3 PRO A 68 -1.541 -11.064 -9.637 1.00 60.41 H new ATOM 0 HD2 PRO A 68 1.074 -11.746 -10.515 1.00 50.01 H new ATOM 0 HD3 PRO A 68 0.321 -10.175 -10.707 1.00 50.01 H new ATOM 1021 N VAL A 69 2.758 -11.874 -6.206 1.00 50.05 N ATOM 1022 CA VAL A 69 3.414 -13.025 -5.529 1.00 44.45 C ATOM 1023 C VAL A 69 2.896 -13.208 -4.079 1.00 1.55 C ATOM 1024 O VAL A 69 3.078 -14.273 -3.476 1.00 22.33 O ATOM 1025 CB VAL A 69 4.983 -12.861 -5.521 1.00 41.11 C ATOM 1026 CG1 VAL A 69 5.544 -12.847 -6.968 1.00 70.14 C ATOM 1027 CG2 VAL A 69 5.422 -11.592 -4.733 1.00 12.35 C ATOM 0 H VAL A 69 3.177 -10.971 -5.984 1.00 50.05 H new ATOM 0 HA VAL A 69 3.156 -13.918 -6.099 1.00 44.45 H new ATOM 0 HB VAL A 69 5.404 -13.724 -5.004 1.00 41.11 H new ATOM 0 HG11 VAL A 69 6.628 -12.733 -6.937 1.00 70.14 H new ATOM 0 HG12 VAL A 69 5.292 -13.784 -7.465 1.00 70.14 H new ATOM 0 HG13 VAL A 69 5.107 -12.014 -7.520 1.00 70.14 H new ATOM 0 HG21 VAL A 69 6.509 -11.512 -4.749 1.00 12.35 H new ATOM 0 HG22 VAL A 69 4.986 -10.707 -5.196 1.00 12.35 H new ATOM 0 HG23 VAL A 69 5.079 -11.668 -3.701 1.00 12.35 H new ATOM 1037 N GLY A 70 2.268 -12.152 -3.533 1.00 5.34 N ATOM 1038 CA GLY A 70 1.723 -12.170 -2.169 1.00 54.11 C ATOM 1039 C GLY A 70 2.783 -11.948 -1.082 1.00 63.41 C ATOM 1040 O GLY A 70 3.984 -11.846 -1.373 1.00 51.45 O ATOM 0 H GLY A 70 2.126 -11.269 -4.023 1.00 5.34 H new ATOM 0 HA2 GLY A 70 0.958 -11.398 -2.082 1.00 54.11 H new ATOM 0 HA3 GLY A 70 1.231 -13.127 -1.996 1.00 54.11 H new ATOM 1044 N LEU A 71 2.335 -11.837 0.180 1.00 34.00 N ATOM 1045 CA LEU A 71 3.243 -11.764 1.347 1.00 14.21 C ATOM 1046 C LEU A 71 3.414 -13.171 1.977 1.00 40.11 C ATOM 1047 O LEU A 71 2.418 -13.893 2.105 1.00 42.30 O ATOM 1048 CB LEU A 71 2.719 -10.757 2.415 1.00 14.51 C ATOM 1049 CG LEU A 71 2.312 -9.330 1.876 1.00 55.21 C ATOM 1050 CD1 LEU A 71 0.787 -9.221 1.632 1.00 51.11 C ATOM 1051 CD2 LEU A 71 2.816 -8.196 2.790 1.00 52.42 C ATOM 0 H LEU A 71 1.345 -11.795 0.423 1.00 34.00 H new ATOM 0 HA LEU A 71 4.211 -11.406 0.997 1.00 14.21 H new ATOM 0 HB2 LEU A 71 1.853 -11.198 2.908 1.00 14.51 H new ATOM 0 HB3 LEU A 71 3.489 -10.631 3.176 1.00 14.51 H new ATOM 0 HG LEU A 71 2.808 -9.209 0.913 1.00 55.21 H new ATOM 0 HD11 LEU A 71 0.548 -8.224 1.262 1.00 51.11 H new ATOM 0 HD12 LEU A 71 0.482 -9.964 0.895 1.00 51.11 H new ATOM 0 HD13 LEU A 71 0.255 -9.398 2.567 1.00 51.11 H new ATOM 0 HD21 LEU A 71 2.512 -7.234 2.378 1.00 52.42 H new ATOM 0 HD22 LEU A 71 2.390 -8.315 3.786 1.00 52.42 H new ATOM 0 HD23 LEU A 71 3.903 -8.236 2.853 1.00 52.42 H new ATOM 1063 N PRO A 72 4.674 -13.592 2.365 1.00 52.21 N ATOM 1064 CA PRO A 72 4.915 -14.912 3.022 1.00 63.55 C ATOM 1065 C PRO A 72 4.132 -15.063 4.359 1.00 55.04 C ATOM 1066 O PRO A 72 3.660 -16.158 4.690 1.00 52.13 O ATOM 1067 CB PRO A 72 6.459 -14.949 3.229 1.00 34.02 C ATOM 1068 CG PRO A 72 6.914 -13.519 3.102 1.00 2.50 C ATOM 1069 CD PRO A 72 5.945 -12.843 2.161 1.00 21.10 C ATOM 0 HA PRO A 72 4.558 -15.746 2.418 1.00 63.55 H new ATOM 0 HB2 PRO A 72 6.715 -15.357 4.207 1.00 34.02 H new ATOM 0 HB3 PRO A 72 6.940 -15.582 2.484 1.00 34.02 H new ATOM 0 HG2 PRO A 72 6.919 -13.026 4.074 1.00 2.50 H new ATOM 0 HG3 PRO A 72 7.931 -13.469 2.714 1.00 2.50 H new ATOM 0 HD2 PRO A 72 5.829 -11.785 2.398 1.00 21.10 H new ATOM 0 HD3 PRO A 72 6.284 -12.903 1.127 1.00 21.10 H new ATOM 1077 N ASP A 73 4.008 -13.952 5.119 1.00 65.41 N ATOM 1078 CA ASP A 73 3.103 -13.860 6.287 1.00 32.03 C ATOM 1079 C ASP A 73 2.243 -12.565 6.173 1.00 42.41 C ATOM 1080 O ASP A 73 2.640 -11.510 6.683 1.00 22.21 O ATOM 1081 CB ASP A 73 3.901 -13.863 7.613 1.00 10.10 C ATOM 1082 CG ASP A 73 4.784 -15.101 7.806 1.00 43.02 C ATOM 1083 OD1 ASP A 73 4.232 -16.194 8.062 1.00 70.42 O ATOM 1084 OD2 ASP A 73 6.027 -14.985 7.704 1.00 24.33 O ATOM 0 H ASP A 73 4.532 -13.095 4.940 1.00 65.41 H new ATOM 0 HA ASP A 73 2.449 -14.732 6.293 1.00 32.03 H new ATOM 0 HB2 ASP A 73 4.528 -12.972 7.650 1.00 10.10 H new ATOM 0 HB3 ASP A 73 3.202 -13.795 8.446 1.00 10.10 H new ATOM 1089 N PRO A 74 1.064 -12.619 5.477 1.00 60.35 N ATOM 1090 CA PRO A 74 0.225 -11.415 5.213 1.00 63.35 C ATOM 1091 C PRO A 74 -0.582 -10.923 6.446 1.00 50.23 C ATOM 1092 O PRO A 74 -0.898 -9.728 6.556 1.00 75.24 O ATOM 1093 CB PRO A 74 -0.706 -11.908 4.075 1.00 34.52 C ATOM 1094 CG PRO A 74 -0.867 -13.377 4.331 1.00 42.22 C ATOM 1095 CD PRO A 74 0.466 -13.849 4.880 1.00 13.45 C ATOM 0 HA PRO A 74 0.826 -10.542 4.957 1.00 63.35 H new ATOM 0 HB2 PRO A 74 -1.667 -11.394 4.097 1.00 34.52 H new ATOM 0 HB3 PRO A 74 -0.267 -11.722 3.095 1.00 34.52 H new ATOM 0 HG2 PRO A 74 -1.671 -13.564 5.042 1.00 42.22 H new ATOM 0 HG3 PRO A 74 -1.122 -13.908 3.414 1.00 42.22 H new ATOM 0 HD2 PRO A 74 0.336 -14.633 5.626 1.00 13.45 H new ATOM 0 HD3 PRO A 74 1.099 -14.260 4.094 1.00 13.45 H new ATOM 1103 N ASP A 75 -0.894 -11.849 7.369 1.00 42.12 N ATOM 1104 CA ASP A 75 -1.719 -11.565 8.560 1.00 44.21 C ATOM 1105 C ASP A 75 -0.941 -10.717 9.587 1.00 31.32 C ATOM 1106 O ASP A 75 -1.465 -9.716 10.083 1.00 74.14 O ATOM 1107 CB ASP A 75 -2.195 -12.885 9.206 1.00 24.35 C ATOM 1108 CG ASP A 75 -2.925 -13.796 8.211 1.00 25.41 C ATOM 1109 OD1 ASP A 75 -2.249 -14.575 7.500 1.00 60.20 O ATOM 1110 OD2 ASP A 75 -4.170 -13.719 8.117 1.00 41.02 O ATOM 0 H ASP A 75 -0.581 -12.818 7.312 1.00 42.12 H new ATOM 0 HA ASP A 75 -2.589 -10.992 8.240 1.00 44.21 H new ATOM 0 HB2 ASP A 75 -1.336 -13.415 9.616 1.00 24.35 H new ATOM 0 HB3 ASP A 75 -2.858 -12.659 10.041 1.00 24.35 H new ATOM 1115 N LYS A 76 0.324 -11.119 9.880 1.00 40.51 N ATOM 1116 CA LYS A 76 1.192 -10.373 10.831 1.00 41.14 C ATOM 1117 C LYS A 76 1.455 -8.928 10.320 1.00 24.51 C ATOM 1118 O LYS A 76 1.491 -7.991 11.104 1.00 4.43 O ATOM 1119 CB LYS A 76 2.547 -11.110 11.094 1.00 20.33 C ATOM 1120 CG LYS A 76 3.621 -10.934 9.989 1.00 1.52 C ATOM 1121 CD LYS A 76 4.980 -11.594 10.320 1.00 33.42 C ATOM 1122 CE LYS A 76 6.046 -11.289 9.244 1.00 60.31 C ATOM 1123 NZ LYS A 76 7.281 -12.090 9.419 1.00 40.54 N ATOM 0 H LYS A 76 0.762 -11.947 9.476 1.00 40.51 H new ATOM 0 HA LYS A 76 0.656 -10.322 11.779 1.00 41.14 H new ATOM 0 HB2 LYS A 76 2.959 -10.753 12.038 1.00 20.33 H new ATOM 0 HB3 LYS A 76 2.345 -12.174 11.216 1.00 20.33 H new ATOM 0 HG2 LYS A 76 3.242 -11.355 9.058 1.00 1.52 H new ATOM 0 HG3 LYS A 76 3.779 -9.869 9.816 1.00 1.52 H new ATOM 0 HD2 LYS A 76 5.330 -11.238 11.289 1.00 33.42 H new ATOM 0 HD3 LYS A 76 4.849 -12.673 10.405 1.00 33.42 H new ATOM 0 HE2 LYS A 76 5.627 -11.486 8.257 1.00 60.31 H new ATOM 0 HE3 LYS A 76 6.298 -10.229 9.278 1.00 60.31 H new ATOM 0 HZ1 LYS A 76 7.962 -11.846 8.671 1.00 40.54 H new ATOM 0 HZ2 LYS A 76 7.699 -11.884 10.349 1.00 40.54 H new ATOM 0 HZ3 LYS A 76 7.050 -13.102 9.360 1.00 40.54 H new ATOM 1137 N VAL A 77 1.596 -8.780 8.981 1.00 4.44 N ATOM 1138 CA VAL A 77 1.819 -7.478 8.310 1.00 52.52 C ATOM 1139 C VAL A 77 0.638 -6.507 8.563 1.00 61.24 C ATOM 1140 O VAL A 77 0.854 -5.335 8.865 1.00 50.21 O ATOM 1141 CB VAL A 77 2.061 -7.686 6.763 1.00 33.31 C ATOM 1142 CG1 VAL A 77 2.008 -6.355 5.971 1.00 12.00 C ATOM 1143 CG2 VAL A 77 3.409 -8.418 6.521 1.00 43.42 C ATOM 0 H VAL A 77 1.558 -9.566 8.332 1.00 4.44 H new ATOM 0 HA VAL A 77 2.714 -7.026 8.738 1.00 52.52 H new ATOM 0 HB VAL A 77 1.247 -8.307 6.389 1.00 33.31 H new ATOM 0 HG11 VAL A 77 2.180 -6.554 4.913 1.00 12.00 H new ATOM 0 HG12 VAL A 77 1.028 -5.894 6.099 1.00 12.00 H new ATOM 0 HG13 VAL A 77 2.778 -5.679 6.343 1.00 12.00 H new ATOM 0 HG21 VAL A 77 3.562 -8.554 5.450 1.00 43.42 H new ATOM 0 HG22 VAL A 77 4.225 -7.823 6.931 1.00 43.42 H new ATOM 0 HG23 VAL A 77 3.388 -9.391 7.011 1.00 43.42 H new ATOM 1153 N GLN A 78 -0.594 -7.028 8.457 1.00 61.30 N ATOM 1154 CA GLN A 78 -1.836 -6.266 8.741 1.00 13.44 C ATOM 1155 C GLN A 78 -1.878 -5.747 10.208 1.00 4.22 C ATOM 1156 O GLN A 78 -2.183 -4.573 10.462 1.00 13.33 O ATOM 1157 CB GLN A 78 -3.073 -7.167 8.440 1.00 20.25 C ATOM 1158 CG GLN A 78 -4.442 -6.527 8.772 1.00 14.25 C ATOM 1159 CD GLN A 78 -5.649 -7.389 8.381 1.00 3.11 C ATOM 1160 OE1 GLN A 78 -6.773 -6.750 8.099 1.00 63.51 O flip ATOM 1161 NE2 GLN A 78 -5.583 -8.615 8.354 1.00 40.32 N flip ATOM 0 H GLN A 78 -0.765 -7.992 8.172 1.00 61.30 H new ATOM 0 HA GLN A 78 -1.855 -5.389 8.095 1.00 13.44 H new ATOM 0 HB2 GLN A 78 -3.060 -7.435 7.384 1.00 20.25 H new ATOM 0 HB3 GLN A 78 -2.975 -8.094 9.005 1.00 20.25 H new ATOM 0 HG2 GLN A 78 -4.486 -6.324 9.842 1.00 14.25 H new ATOM 0 HG3 GLN A 78 -4.515 -5.566 8.262 1.00 14.25 H new ATOM 0 HE21 GLN A 78 -4.704 -9.083 8.576 1.00 40.32 H new ATOM 0 HE22 GLN A 78 -6.407 -9.165 8.110 1.00 40.32 H new ATOM 1170 N ARG A 79 -1.539 -6.638 11.150 1.00 74.01 N ATOM 1171 CA ARG A 79 -1.600 -6.342 12.609 1.00 72.14 C ATOM 1172 C ARG A 79 -0.498 -5.339 13.042 1.00 54.32 C ATOM 1173 O ARG A 79 -0.764 -4.389 13.786 1.00 70.00 O ATOM 1174 CB ARG A 79 -1.474 -7.648 13.441 1.00 73.51 C ATOM 1175 CG ARG A 79 -2.411 -8.803 13.009 1.00 71.24 C ATOM 1176 CD ARG A 79 -3.904 -8.415 12.985 1.00 51.42 C ATOM 1177 NE ARG A 79 -4.398 -8.013 14.313 1.00 70.23 N ATOM 1178 CZ ARG A 79 -5.543 -7.410 14.553 1.00 11.04 C ATOM 1179 NH1 ARG A 79 -6.358 -7.087 13.593 1.00 73.13 N ATOM 1180 NH2 ARG A 79 -5.864 -7.127 15.769 1.00 61.12 N ATOM 0 H ARG A 79 -1.215 -7.581 10.936 1.00 74.01 H new ATOM 0 HA ARG A 79 -2.570 -5.884 12.801 1.00 72.14 H new ATOM 0 HB2 ARG A 79 -0.443 -7.998 13.383 1.00 73.51 H new ATOM 0 HB3 ARG A 79 -1.673 -7.413 14.487 1.00 73.51 H new ATOM 0 HG2 ARG A 79 -2.118 -9.145 12.016 1.00 71.24 H new ATOM 0 HG3 ARG A 79 -2.274 -9.644 13.689 1.00 71.24 H new ATOM 0 HD2 ARG A 79 -4.053 -7.596 12.281 1.00 51.42 H new ATOM 0 HD3 ARG A 79 -4.491 -9.259 12.622 1.00 51.42 H new ATOM 0 HE ARG A 79 -3.802 -8.219 15.115 1.00 70.23 H new ATOM 0 HH11 ARG A 79 -6.116 -7.300 12.625 1.00 73.13 H new ATOM 0 HH12 ARG A 79 -7.239 -6.620 13.807 1.00 73.13 H new ATOM 0 HH21 ARG A 79 -5.233 -7.370 16.533 1.00 61.12 H new ATOM 0 HH22 ARG A 79 -6.749 -6.660 15.967 1.00 61.12 H new ATOM 1194 N ASP A 80 0.737 -5.574 12.560 1.00 43.13 N ATOM 1195 CA ASP A 80 1.907 -4.710 12.838 1.00 41.41 C ATOM 1196 C ASP A 80 1.799 -3.348 12.122 1.00 34.31 C ATOM 1197 O ASP A 80 2.365 -2.369 12.596 1.00 55.00 O ATOM 1198 CB ASP A 80 3.234 -5.431 12.467 1.00 43.40 C ATOM 1199 CG ASP A 80 3.590 -6.558 13.457 1.00 1.25 C ATOM 1200 OD1 ASP A 80 3.864 -6.246 14.640 1.00 2.24 O ATOM 1201 OD2 ASP A 80 3.582 -7.747 13.076 1.00 74.52 O ATOM 0 H ASP A 80 0.955 -6.372 11.963 1.00 43.13 H new ATOM 0 HA ASP A 80 1.915 -4.512 13.910 1.00 41.41 H new ATOM 0 HB2 ASP A 80 3.149 -5.847 11.463 1.00 43.40 H new ATOM 0 HB3 ASP A 80 4.045 -4.703 12.443 1.00 43.40 H new ATOM 1206 N LEU A 81 1.092 -3.300 10.974 1.00 74.40 N ATOM 1207 CA LEU A 81 0.819 -2.029 10.255 1.00 24.22 C ATOM 1208 C LEU A 81 -0.174 -1.151 11.052 1.00 30.43 C ATOM 1209 O LEU A 81 -0.010 0.064 11.131 1.00 24.44 O ATOM 1210 CB LEU A 81 0.294 -2.292 8.818 1.00 72.31 C ATOM 1211 CG LEU A 81 0.101 -1.031 7.903 1.00 62.44 C ATOM 1212 CD1 LEU A 81 1.394 -0.189 7.787 1.00 62.00 C ATOM 1213 CD2 LEU A 81 -0.414 -1.439 6.507 1.00 65.31 C ATOM 0 H LEU A 81 0.698 -4.125 10.521 1.00 74.40 H new ATOM 0 HA LEU A 81 1.761 -1.488 10.168 1.00 24.22 H new ATOM 0 HB2 LEU A 81 0.986 -2.972 8.321 1.00 72.31 H new ATOM 0 HB3 LEU A 81 -0.663 -2.809 8.893 1.00 72.31 H new ATOM 0 HG LEU A 81 -0.650 -0.402 8.380 1.00 62.44 H new ATOM 0 HD11 LEU A 81 1.211 0.672 7.144 1.00 62.00 H new ATOM 0 HD12 LEU A 81 1.695 0.154 8.777 1.00 62.00 H new ATOM 0 HD13 LEU A 81 2.189 -0.800 7.358 1.00 62.00 H new ATOM 0 HD21 LEU A 81 -0.540 -0.549 5.891 1.00 65.31 H new ATOM 0 HD22 LEU A 81 0.306 -2.108 6.035 1.00 65.31 H new ATOM 0 HD23 LEU A 81 -1.372 -1.949 6.607 1.00 65.31 H new ATOM 1225 N ALA A 82 -1.193 -1.792 11.649 1.00 63.31 N ATOM 1226 CA ALA A 82 -2.149 -1.118 12.565 1.00 53.10 C ATOM 1227 C ALA A 82 -1.437 -0.619 13.856 1.00 32.20 C ATOM 1228 O ALA A 82 -1.726 0.474 14.361 1.00 31.55 O ATOM 1229 CB ALA A 82 -3.308 -2.075 12.905 1.00 23.21 C ATOM 0 H ALA A 82 -1.383 -2.785 11.516 1.00 63.31 H new ATOM 0 HA ALA A 82 -2.555 -0.241 12.061 1.00 53.10 H new ATOM 0 HB1 ALA A 82 -4.006 -1.576 13.577 1.00 23.21 H new ATOM 0 HB2 ALA A 82 -3.826 -2.359 11.989 1.00 23.21 H new ATOM 0 HB3 ALA A 82 -2.913 -2.968 13.390 1.00 23.21 H new ATOM 1235 N SER A 83 -0.487 -1.440 14.356 1.00 63.41 N ATOM 1236 CA SER A 83 0.328 -1.128 15.560 1.00 3.53 C ATOM 1237 C SER A 83 1.246 0.102 15.329 1.00 64.01 C ATOM 1238 O SER A 83 1.229 1.054 16.122 1.00 2.25 O ATOM 1239 CB SER A 83 1.183 -2.357 15.959 1.00 11.02 C ATOM 1240 OG SER A 83 1.989 -2.091 17.098 1.00 15.24 O ATOM 0 H SER A 83 -0.260 -2.342 13.937 1.00 63.41 H new ATOM 0 HA SER A 83 -0.360 -0.885 16.370 1.00 3.53 H new ATOM 0 HB2 SER A 83 0.528 -3.203 16.167 1.00 11.02 H new ATOM 0 HB3 SER A 83 1.820 -2.644 15.122 1.00 11.02 H new ATOM 0 HG SER A 83 2.513 -2.888 17.321 1.00 15.24 H new ATOM 1246 N GLN A 84 2.044 0.074 14.235 1.00 34.04 N ATOM 1247 CA GLN A 84 2.926 1.206 13.851 1.00 13.42 C ATOM 1248 C GLN A 84 2.113 2.470 13.474 1.00 73.11 C ATOM 1249 O GLN A 84 2.556 3.576 13.719 1.00 34.13 O ATOM 1250 CB GLN A 84 3.917 0.803 12.717 1.00 55.04 C ATOM 1251 CG GLN A 84 3.277 0.475 11.356 1.00 73.42 C ATOM 1252 CD GLN A 84 4.251 -0.168 10.355 1.00 51.00 C ATOM 1253 OE1 GLN A 84 4.907 0.502 9.569 1.00 41.11 O ATOM 1254 NE2 GLN A 84 4.365 -1.483 10.387 1.00 2.32 N ATOM 0 H GLN A 84 2.096 -0.722 13.600 1.00 34.04 H new ATOM 0 HA GLN A 84 3.521 1.458 14.729 1.00 13.42 H new ATOM 0 HB2 GLN A 84 4.629 1.616 12.576 1.00 55.04 H new ATOM 0 HB3 GLN A 84 4.486 -0.065 13.049 1.00 55.04 H new ATOM 0 HG2 GLN A 84 2.434 -0.198 11.513 1.00 73.42 H new ATOM 0 HG3 GLN A 84 2.876 1.391 10.922 1.00 73.42 H new ATOM 0 HE21 GLN A 84 3.811 -2.027 11.048 1.00 2.32 H new ATOM 0 HE22 GLN A 84 5.007 -1.955 9.750 1.00 2.32 H new ATOM 1263 N CYS A 85 0.910 2.306 12.911 1.00 64.42 N ATOM 1264 CA CYS A 85 0.053 3.467 12.544 1.00 14.44 C ATOM 1265 C CYS A 85 -0.500 4.199 13.792 1.00 31.34 C ATOM 1266 O CYS A 85 -0.803 5.397 13.741 1.00 45.40 O ATOM 1267 CB CYS A 85 -1.103 3.026 11.619 1.00 12.31 C ATOM 1268 SG CYS A 85 -2.061 4.386 10.915 1.00 62.20 S ATOM 0 H CYS A 85 0.501 1.396 12.697 1.00 64.42 H new ATOM 0 HA CYS A 85 0.684 4.173 12.004 1.00 14.44 H new ATOM 0 HB2 CYS A 85 -0.692 2.428 10.805 1.00 12.31 H new ATOM 0 HB3 CYS A 85 -1.775 2.378 12.182 1.00 12.31 H new ATOM 0 HG CYS A 85 -3.248 4.401 11.446 1.00 62.20 H new ATOM 1274 N ALA A 86 -0.609 3.462 14.913 1.00 70.43 N ATOM 1275 CA ALA A 86 -1.044 4.017 16.215 1.00 54.12 C ATOM 1276 C ALA A 86 0.139 4.626 17.021 1.00 43.03 C ATOM 1277 O ALA A 86 -0.039 5.603 17.756 1.00 10.44 O ATOM 1278 CB ALA A 86 -1.737 2.915 17.035 1.00 31.34 C ATOM 0 H ALA A 86 -0.399 2.464 14.945 1.00 70.43 H new ATOM 0 HA ALA A 86 -1.744 4.828 16.016 1.00 54.12 H new ATOM 0 HB1 ALA A 86 -2.058 3.322 17.994 1.00 31.34 H new ATOM 0 HB2 ALA A 86 -2.605 2.546 16.489 1.00 31.34 H new ATOM 0 HB3 ALA A 86 -1.040 2.095 17.204 1.00 31.34 H new ATOM 1284 N SER A 87 1.343 4.031 16.887 1.00 71.33 N ATOM 1285 CA SER A 87 2.541 4.411 17.693 1.00 31.32 C ATOM 1286 C SER A 87 3.433 5.487 17.015 1.00 24.10 C ATOM 1287 O SER A 87 3.988 6.340 17.702 1.00 13.32 O ATOM 1288 CB SER A 87 3.386 3.152 18.001 1.00 21.41 C ATOM 1289 OG SER A 87 3.796 2.492 16.812 1.00 43.21 O ATOM 0 H SER A 87 1.520 3.277 16.223 1.00 71.33 H new ATOM 0 HA SER A 87 2.164 4.856 18.614 1.00 31.32 H new ATOM 0 HB2 SER A 87 4.264 3.436 18.581 1.00 21.41 H new ATOM 0 HB3 SER A 87 2.805 2.465 18.617 1.00 21.41 H new ATOM 0 HG SER A 87 4.329 1.703 17.043 1.00 43.21 H new ATOM 1295 N MET A 88 3.586 5.429 15.678 1.00 61.23 N ATOM 1296 CA MET A 88 4.492 6.344 14.922 1.00 65.21 C ATOM 1297 C MET A 88 3.888 7.753 14.760 1.00 52.40 C ATOM 1298 O MET A 88 4.570 8.757 14.988 1.00 61.24 O ATOM 1299 CB MET A 88 4.830 5.776 13.515 1.00 5.52 C ATOM 1300 CG MET A 88 5.512 4.405 13.525 1.00 4.23 C ATOM 1301 SD MET A 88 5.963 3.830 11.874 1.00 64.32 S ATOM 1302 CE MET A 88 7.163 5.058 11.356 1.00 42.45 C ATOM 0 H MET A 88 3.095 4.757 15.088 1.00 61.23 H new ATOM 0 HA MET A 88 5.406 6.419 15.511 1.00 65.21 H new ATOM 0 HB2 MET A 88 3.909 5.704 12.936 1.00 5.52 H new ATOM 0 HB3 MET A 88 5.477 6.485 12.998 1.00 5.52 H new ATOM 0 HG2 MET A 88 6.408 4.455 14.144 1.00 4.23 H new ATOM 0 HG3 MET A 88 4.846 3.677 13.988 1.00 4.23 H new ATOM 0 HE1 MET A 88 7.747 4.667 10.523 1.00 42.45 H new ATOM 0 HE2 MET A 88 6.644 5.964 11.042 1.00 42.45 H new ATOM 0 HE3 MET A 88 7.828 5.290 12.188 1.00 42.45 H new ATOM 1312 N LEU A 89 2.613 7.808 14.347 1.00 74.11 N ATOM 1313 CA LEU A 89 1.911 9.074 14.046 1.00 50.05 C ATOM 1314 C LEU A 89 1.479 9.821 15.332 1.00 24.51 C ATOM 1315 O LEU A 89 1.202 9.200 16.364 1.00 4.43 O ATOM 1316 CB LEU A 89 0.682 8.781 13.137 1.00 55.12 C ATOM 1317 CG LEU A 89 1.004 8.070 11.778 1.00 2.33 C ATOM 1318 CD1 LEU A 89 -0.282 7.759 10.973 1.00 13.33 C ATOM 1319 CD2 LEU A 89 1.996 8.914 10.941 1.00 33.43 C ATOM 0 H LEU A 89 2.036 6.978 14.211 1.00 74.11 H new ATOM 0 HA LEU A 89 2.604 9.731 13.521 1.00 50.05 H new ATOM 0 HB2 LEU A 89 -0.021 8.161 13.694 1.00 55.12 H new ATOM 0 HB3 LEU A 89 0.177 9.723 12.924 1.00 55.12 H new ATOM 0 HG LEU A 89 1.477 7.115 12.009 1.00 2.33 H new ATOM 0 HD11 LEU A 89 -0.016 7.266 10.038 1.00 13.33 H new ATOM 0 HD12 LEU A 89 -0.927 7.103 11.557 1.00 13.33 H new ATOM 0 HD13 LEU A 89 -0.809 8.688 10.756 1.00 13.33 H new ATOM 0 HD21 LEU A 89 2.206 8.403 10.002 1.00 33.43 H new ATOM 0 HD22 LEU A 89 1.558 9.890 10.733 1.00 33.43 H new ATOM 0 HD23 LEU A 89 2.923 9.044 11.499 1.00 33.43 H new ATOM 1331 N ASN A 90 1.463 11.167 15.242 1.00 1.24 N ATOM 1332 CA ASN A 90 0.995 12.086 16.317 1.00 63.14 C ATOM 1333 C ASN A 90 -0.437 11.752 16.815 1.00 63.22 C ATOM 1334 O ASN A 90 -0.767 11.957 17.988 1.00 33.31 O ATOM 1335 CB ASN A 90 1.057 13.558 15.802 1.00 72.34 C ATOM 1336 CG ASN A 90 0.205 13.806 14.542 1.00 72.33 C ATOM 1337 OD1 ASN A 90 0.012 12.924 13.715 1.00 31.42 O ATOM 1338 ND2 ASN A 90 -0.304 15.007 14.373 1.00 71.25 N ATOM 0 H ASN A 90 1.779 11.661 14.408 1.00 1.24 H new ATOM 0 HA ASN A 90 1.660 11.956 17.171 1.00 63.14 H new ATOM 0 HB2 ASN A 90 0.721 14.226 16.595 1.00 72.34 H new ATOM 0 HB3 ASN A 90 2.094 13.815 15.586 1.00 72.34 H new ATOM 0 HD21 ASN A 90 -0.866 15.211 13.547 1.00 71.25 H new ATOM 0 HD22 ASN A 90 -0.137 15.734 15.068 1.00 71.25 H new ATOM 1345 N VAL A 91 -1.275 11.244 15.894 1.00 64.01 N ATOM 1346 CA VAL A 91 -2.688 10.885 16.159 1.00 1.21 C ATOM 1347 C VAL A 91 -3.006 9.449 15.671 1.00 51.11 C ATOM 1348 O VAL A 91 -2.184 8.802 15.009 1.00 44.30 O ATOM 1349 CB VAL A 91 -3.665 11.896 15.448 1.00 32.43 C ATOM 1350 CG1 VAL A 91 -3.492 13.338 15.994 1.00 53.05 C ATOM 1351 CG2 VAL A 91 -3.468 11.848 13.912 1.00 51.12 C ATOM 0 H VAL A 91 -0.990 11.067 14.931 1.00 64.01 H new ATOM 0 HA VAL A 91 -2.834 10.934 17.238 1.00 1.21 H new ATOM 0 HB VAL A 91 -4.687 11.591 15.672 1.00 32.43 H new ATOM 0 HG11 VAL A 91 -4.182 14.007 15.480 1.00 53.05 H new ATOM 0 HG12 VAL A 91 -3.704 13.350 17.063 1.00 53.05 H new ATOM 0 HG13 VAL A 91 -2.468 13.671 15.823 1.00 53.05 H new ATOM 0 HG21 VAL A 91 -4.150 12.552 13.436 1.00 51.12 H new ATOM 0 HG22 VAL A 91 -2.440 12.117 13.668 1.00 51.12 H new ATOM 0 HG23 VAL A 91 -3.675 10.841 13.550 1.00 51.12 H new ATOM 1361 N ALA A 92 -4.215 8.969 16.007 1.00 0.43 N ATOM 1362 CA ALA A 92 -4.740 7.687 15.506 1.00 40.42 C ATOM 1363 C ALA A 92 -5.390 7.861 14.108 1.00 53.41 C ATOM 1364 O ALA A 92 -6.487 8.425 13.984 1.00 41.14 O ATOM 1365 CB ALA A 92 -5.748 7.101 16.509 1.00 22.41 C ATOM 0 H ALA A 92 -4.855 9.458 16.633 1.00 0.43 H new ATOM 0 HA ALA A 92 -3.908 6.990 15.400 1.00 40.42 H new ATOM 0 HB1 ALA A 92 -6.130 6.153 16.129 1.00 22.41 H new ATOM 0 HB2 ALA A 92 -5.254 6.936 17.467 1.00 22.41 H new ATOM 0 HB3 ALA A 92 -6.575 7.798 16.643 1.00 22.41 H new ATOM 1371 N LEU A 93 -4.678 7.413 13.066 1.00 74.22 N ATOM 1372 CA LEU A 93 -5.213 7.323 11.690 1.00 41.53 C ATOM 1373 C LEU A 93 -5.782 5.896 11.496 1.00 11.14 C ATOM 1374 O LEU A 93 -5.135 4.918 11.881 1.00 74.00 O ATOM 1375 CB LEU A 93 -4.078 7.663 10.662 1.00 2.41 C ATOM 1376 CG LEU A 93 -4.511 8.095 9.211 1.00 71.44 C ATOM 1377 CD1 LEU A 93 -3.354 8.821 8.484 1.00 51.32 C ATOM 1378 CD2 LEU A 93 -5.014 6.901 8.351 1.00 62.33 C ATOM 0 H LEU A 93 -3.711 7.100 13.148 1.00 74.22 H new ATOM 0 HA LEU A 93 -6.015 8.042 11.523 1.00 41.53 H new ATOM 0 HB2 LEU A 93 -3.472 8.465 11.084 1.00 2.41 H new ATOM 0 HB3 LEU A 93 -3.433 6.789 10.573 1.00 2.41 H new ATOM 0 HG LEU A 93 -5.349 8.782 9.332 1.00 71.44 H new ATOM 0 HD11 LEU A 93 -3.677 9.110 7.484 1.00 51.32 H new ATOM 0 HD12 LEU A 93 -3.073 9.712 9.046 1.00 51.32 H new ATOM 0 HD13 LEU A 93 -2.495 8.154 8.409 1.00 51.32 H new ATOM 0 HD21 LEU A 93 -5.298 7.259 7.362 1.00 62.33 H new ATOM 0 HD22 LEU A 93 -4.219 6.162 8.254 1.00 62.33 H new ATOM 0 HD23 LEU A 93 -5.878 6.444 8.833 1.00 62.33 H new ATOM 1390 N ARG A 94 -7.004 5.776 10.935 1.00 64.34 N ATOM 1391 CA ARG A 94 -7.648 4.458 10.678 1.00 45.12 C ATOM 1392 C ARG A 94 -7.712 4.139 9.162 1.00 1.54 C ATOM 1393 O ARG A 94 -8.624 4.605 8.464 1.00 12.24 O ATOM 1394 CB ARG A 94 -9.072 4.401 11.303 1.00 52.24 C ATOM 1395 CG ARG A 94 -9.093 4.442 12.849 1.00 24.14 C ATOM 1396 CD ARG A 94 -10.524 4.361 13.418 1.00 14.05 C ATOM 1397 NE ARG A 94 -11.357 5.519 13.003 1.00 52.30 N ATOM 1398 CZ ARG A 94 -12.414 5.478 12.209 1.00 24.05 C ATOM 1399 NH1 ARG A 94 -12.832 4.365 11.695 1.00 2.22 N ATOM 1400 NH2 ARG A 94 -13.048 6.570 11.934 1.00 42.11 N ATOM 0 H ARG A 94 -7.570 6.575 10.649 1.00 64.34 H new ATOM 0 HA ARG A 94 -7.029 3.698 11.155 1.00 45.12 H new ATOM 0 HB2 ARG A 94 -9.657 5.238 10.921 1.00 52.24 H new ATOM 0 HB3 ARG A 94 -9.566 3.489 10.969 1.00 52.24 H new ATOM 0 HG2 ARG A 94 -8.502 3.614 13.240 1.00 24.14 H new ATOM 0 HG3 ARG A 94 -8.620 5.362 13.192 1.00 24.14 H new ATOM 0 HD2 ARG A 94 -10.995 3.437 13.082 1.00 14.05 H new ATOM 0 HD3 ARG A 94 -10.479 4.319 14.506 1.00 14.05 H new ATOM 0 HE ARG A 94 -11.088 6.434 13.365 1.00 52.30 H new ATOM 0 HH11 ARG A 94 -12.343 3.493 11.900 1.00 2.22 H new ATOM 0 HH12 ARG A 94 -13.650 4.360 11.086 1.00 2.22 H new ATOM 0 HH21 ARG A 94 -12.732 7.456 12.329 1.00 42.11 H new ATOM 0 HH22 ARG A 94 -13.864 6.546 11.322 1.00 42.11 H new ATOM 1414 N PRO A 95 -6.717 3.369 8.607 1.00 34.31 N ATOM 1415 CA PRO A 95 -6.802 2.829 7.238 1.00 52.04 C ATOM 1416 C PRO A 95 -7.567 1.472 7.181 1.00 41.30 C ATOM 1417 O PRO A 95 -7.687 0.758 8.185 1.00 1.44 O ATOM 1418 CB PRO A 95 -5.312 2.695 6.845 1.00 73.21 C ATOM 1419 CG PRO A 95 -4.594 2.388 8.133 1.00 2.43 C ATOM 1420 CD PRO A 95 -5.424 2.998 9.256 1.00 73.23 C ATOM 0 HA PRO A 95 -7.369 3.461 6.555 1.00 52.04 H new ATOM 0 HB2 PRO A 95 -5.167 1.900 6.113 1.00 73.21 H new ATOM 0 HB3 PRO A 95 -4.939 3.615 6.395 1.00 73.21 H new ATOM 0 HG2 PRO A 95 -4.490 1.312 8.270 1.00 2.43 H new ATOM 0 HG3 PRO A 95 -3.588 2.807 8.124 1.00 2.43 H new ATOM 0 HD2 PRO A 95 -5.577 2.287 10.068 1.00 73.23 H new ATOM 0 HD3 PRO A 95 -4.931 3.870 9.685 1.00 73.23 H new ATOM 1428 N GLU A 96 -8.071 1.130 5.987 1.00 74.21 N ATOM 1429 CA GLU A 96 -8.858 -0.102 5.754 1.00 63.21 C ATOM 1430 C GLU A 96 -7.958 -1.172 5.108 1.00 23.15 C ATOM 1431 O GLU A 96 -7.257 -0.879 4.155 1.00 3.15 O ATOM 1432 CB GLU A 96 -10.095 0.210 4.870 1.00 3.35 C ATOM 1433 CG GLU A 96 -10.985 -1.009 4.541 1.00 72.45 C ATOM 1434 CD GLU A 96 -11.539 -1.730 5.784 1.00 54.30 C ATOM 1435 OE1 GLU A 96 -12.506 -1.223 6.391 1.00 31.11 O ATOM 1436 OE2 GLU A 96 -11.015 -2.804 6.158 1.00 44.41 O ATOM 0 H GLU A 96 -7.947 1.698 5.149 1.00 74.21 H new ATOM 0 HA GLU A 96 -9.223 -0.489 6.705 1.00 63.21 H new ATOM 0 HB2 GLU A 96 -10.704 0.960 5.375 1.00 3.35 H new ATOM 0 HB3 GLU A 96 -9.752 0.654 3.935 1.00 3.35 H new ATOM 0 HG2 GLU A 96 -11.819 -0.681 3.921 1.00 72.45 H new ATOM 0 HG3 GLU A 96 -10.408 -1.719 3.948 1.00 72.45 H new ATOM 1443 N MET A 97 -7.979 -2.408 5.637 1.00 60.40 N ATOM 1444 CA MET A 97 -7.040 -3.483 5.224 1.00 73.14 C ATOM 1445 C MET A 97 -7.804 -4.763 4.786 1.00 42.23 C ATOM 1446 O MET A 97 -8.500 -5.381 5.597 1.00 75.35 O ATOM 1447 CB MET A 97 -6.065 -3.797 6.391 1.00 65.10 C ATOM 1448 CG MET A 97 -5.245 -2.595 6.884 1.00 43.12 C ATOM 1449 SD MET A 97 -4.163 -3.020 8.267 1.00 61.45 S ATOM 1450 CE MET A 97 -3.562 -1.406 8.764 1.00 45.14 C ATOM 0 H MET A 97 -8.640 -2.696 6.359 1.00 60.40 H new ATOM 0 HA MET A 97 -6.469 -3.135 4.363 1.00 73.14 H new ATOM 0 HB2 MET A 97 -6.638 -4.196 7.228 1.00 65.10 H new ATOM 0 HB3 MET A 97 -5.379 -4.581 6.072 1.00 65.10 H new ATOM 0 HG2 MET A 97 -4.644 -2.207 6.062 1.00 43.12 H new ATOM 0 HG3 MET A 97 -5.922 -1.797 7.188 1.00 43.12 H new ATOM 0 HE1 MET A 97 -2.686 -1.524 9.402 1.00 45.14 H new ATOM 0 HE2 MET A 97 -3.291 -0.830 7.879 1.00 45.14 H new ATOM 0 HE3 MET A 97 -4.343 -0.881 9.314 1.00 45.14 H new ATOM 1460 N GLN A 98 -7.664 -5.150 3.499 1.00 75.42 N ATOM 1461 CA GLN A 98 -8.315 -6.353 2.917 1.00 12.24 C ATOM 1462 C GLN A 98 -7.264 -7.401 2.491 1.00 43.42 C ATOM 1463 O GLN A 98 -6.285 -7.067 1.823 1.00 65.35 O ATOM 1464 CB GLN A 98 -9.171 -5.974 1.675 1.00 34.54 C ATOM 1465 CG GLN A 98 -10.345 -5.016 1.942 1.00 72.30 C ATOM 1466 CD GLN A 98 -11.380 -5.551 2.931 1.00 71.11 C ATOM 1467 OE1 GLN A 98 -12.317 -6.250 2.554 1.00 41.44 O ATOM 1468 NE2 GLN A 98 -11.245 -5.204 4.199 1.00 32.24 N ATOM 0 H GLN A 98 -7.094 -4.636 2.828 1.00 75.42 H new ATOM 0 HA GLN A 98 -8.957 -6.776 3.689 1.00 12.24 H new ATOM 0 HB2 GLN A 98 -8.517 -5.520 0.931 1.00 34.54 H new ATOM 0 HB3 GLN A 98 -9.566 -6.890 1.235 1.00 34.54 H new ATOM 0 HG2 GLN A 98 -9.951 -4.073 2.321 1.00 72.30 H new ATOM 0 HG3 GLN A 98 -10.842 -4.797 0.997 1.00 72.30 H new ATOM 0 HE21 GLN A 98 -10.458 -4.623 4.488 1.00 32.24 H new ATOM 0 HE22 GLN A 98 -11.928 -5.518 4.889 1.00 32.24 H new ATOM 1477 N LEU A 99 -7.494 -8.670 2.860 1.00 61.10 N ATOM 1478 CA LEU A 99 -6.640 -9.807 2.432 1.00 1.21 C ATOM 1479 C LEU A 99 -7.224 -10.437 1.140 1.00 34.12 C ATOM 1480 O LEU A 99 -8.287 -11.062 1.161 1.00 71.11 O ATOM 1481 CB LEU A 99 -6.513 -10.842 3.588 1.00 61.34 C ATOM 1482 CG LEU A 99 -5.660 -10.361 4.813 1.00 14.42 C ATOM 1483 CD1 LEU A 99 -5.809 -11.306 6.021 1.00 12.34 C ATOM 1484 CD2 LEU A 99 -4.169 -10.198 4.420 1.00 3.20 C ATOM 0 H LEU A 99 -8.271 -8.945 3.461 1.00 61.10 H new ATOM 0 HA LEU A 99 -5.634 -9.454 2.203 1.00 1.21 H new ATOM 0 HB2 LEU A 99 -7.513 -11.099 3.938 1.00 61.34 H new ATOM 0 HB3 LEU A 99 -6.070 -11.756 3.191 1.00 61.34 H new ATOM 0 HG LEU A 99 -6.044 -9.386 5.113 1.00 14.42 H new ATOM 0 HD11 LEU A 99 -5.202 -10.937 6.848 1.00 12.34 H new ATOM 0 HD12 LEU A 99 -6.855 -11.344 6.326 1.00 12.34 H new ATOM 0 HD13 LEU A 99 -5.475 -12.306 5.744 1.00 12.34 H new ATOM 0 HD21 LEU A 99 -3.599 -9.864 5.287 1.00 3.20 H new ATOM 0 HD22 LEU A 99 -3.777 -11.155 4.075 1.00 3.20 H new ATOM 0 HD23 LEU A 99 -4.082 -9.461 3.622 1.00 3.20 H new ATOM 1496 N GLU A 100 -6.509 -10.235 0.024 1.00 13.44 N ATOM 1497 CA GLU A 100 -6.975 -10.553 -1.346 1.00 21.54 C ATOM 1498 C GLU A 100 -6.226 -11.759 -1.955 1.00 24.52 C ATOM 1499 O GLU A 100 -5.003 -11.765 -1.997 1.00 12.31 O ATOM 1500 CB GLU A 100 -6.716 -9.309 -2.232 1.00 51.04 C ATOM 1501 CG GLU A 100 -7.442 -8.017 -1.796 1.00 43.33 C ATOM 1502 CD GLU A 100 -8.944 -8.029 -2.106 1.00 35.33 C ATOM 1503 OE1 GLU A 100 -9.298 -8.130 -3.299 1.00 1.32 O ATOM 1504 OE2 GLU A 100 -9.770 -7.940 -1.175 1.00 61.42 O ATOM 0 H GLU A 100 -5.570 -9.838 0.042 1.00 13.44 H new ATOM 0 HA GLU A 100 -8.033 -10.812 -1.301 1.00 21.54 H new ATOM 0 HB2 GLU A 100 -5.644 -9.114 -2.249 1.00 51.04 H new ATOM 0 HB3 GLU A 100 -7.013 -9.545 -3.254 1.00 51.04 H new ATOM 0 HG2 GLU A 100 -7.301 -7.873 -0.725 1.00 43.33 H new ATOM 0 HG3 GLU A 100 -6.982 -7.164 -2.295 1.00 43.33 H new ATOM 1511 N GLN A 101 -6.961 -12.760 -2.462 1.00 21.32 N ATOM 1512 CA GLN A 101 -6.358 -13.909 -3.173 1.00 4.24 C ATOM 1513 C GLN A 101 -6.428 -13.703 -4.703 1.00 53.11 C ATOM 1514 O GLN A 101 -7.505 -13.745 -5.309 1.00 55.40 O ATOM 1515 CB GLN A 101 -7.016 -15.252 -2.750 1.00 1.31 C ATOM 1516 CG GLN A 101 -6.632 -15.729 -1.328 1.00 31.31 C ATOM 1517 CD GLN A 101 -7.207 -14.871 -0.186 1.00 41.22 C ATOM 1518 OE1 GLN A 101 -8.294 -14.310 -0.288 1.00 43.24 O ATOM 1519 NE2 GLN A 101 -6.479 -14.757 0.908 1.00 64.12 N ATOM 0 H GLN A 101 -7.978 -12.801 -2.395 1.00 21.32 H new ATOM 0 HA GLN A 101 -5.307 -13.964 -2.888 1.00 4.24 H new ATOM 0 HB2 GLN A 101 -8.099 -15.145 -2.805 1.00 1.31 H new ATOM 0 HB3 GLN A 101 -6.735 -16.023 -3.468 1.00 1.31 H new ATOM 0 HG2 GLN A 101 -6.973 -16.756 -1.200 1.00 31.31 H new ATOM 0 HG3 GLN A 101 -5.545 -15.741 -1.244 1.00 31.31 H new ATOM 0 HE21 GLN A 101 -5.578 -15.231 0.973 1.00 64.12 H new ATOM 0 HE22 GLN A 101 -6.817 -14.195 1.689 1.00 64.12 H new ATOM 1528 N VAL A 102 -5.251 -13.460 -5.300 1.00 32.54 N ATOM 1529 CA VAL A 102 -5.078 -13.216 -6.748 1.00 32.44 C ATOM 1530 C VAL A 102 -4.115 -14.283 -7.317 1.00 24.23 C ATOM 1531 O VAL A 102 -2.929 -14.286 -6.979 1.00 33.33 O ATOM 1532 CB VAL A 102 -4.505 -11.771 -7.036 1.00 25.22 C ATOM 1533 CG1 VAL A 102 -4.476 -11.469 -8.553 1.00 34.13 C ATOM 1534 CG2 VAL A 102 -5.284 -10.687 -6.247 1.00 61.41 C ATOM 0 H VAL A 102 -4.373 -13.426 -4.783 1.00 32.54 H new ATOM 0 HA VAL A 102 -6.053 -13.282 -7.230 1.00 32.44 H new ATOM 0 HB VAL A 102 -3.474 -11.747 -6.683 1.00 25.22 H new ATOM 0 HG11 VAL A 102 -4.077 -10.468 -8.717 1.00 34.13 H new ATOM 0 HG12 VAL A 102 -3.843 -12.199 -9.057 1.00 34.13 H new ATOM 0 HG13 VAL A 102 -5.488 -11.527 -8.955 1.00 34.13 H new ATOM 0 HG21 VAL A 102 -4.865 -9.705 -6.467 1.00 61.41 H new ATOM 0 HG22 VAL A 102 -6.334 -10.708 -6.540 1.00 61.41 H new ATOM 0 HG23 VAL A 102 -5.202 -10.885 -5.178 1.00 61.41 H new ATOM 1544 N GLY A 103 -4.636 -15.182 -8.181 1.00 12.03 N ATOM 1545 CA GLY A 103 -3.891 -16.373 -8.633 1.00 71.10 C ATOM 1546 C GLY A 103 -3.465 -17.314 -7.489 1.00 12.03 C ATOM 1547 O GLY A 103 -2.430 -17.988 -7.580 1.00 63.11 O ATOM 0 H GLY A 103 -5.572 -15.103 -8.579 1.00 12.03 H new ATOM 0 HA2 GLY A 103 -4.508 -16.930 -9.338 1.00 71.10 H new ATOM 0 HA3 GLY A 103 -3.002 -16.050 -9.175 1.00 71.10 H new ATOM 1551 N GLY A 104 -4.268 -17.336 -6.402 1.00 21.30 N ATOM 1552 CA GLY A 104 -3.982 -18.148 -5.204 1.00 11.43 C ATOM 1553 C GLY A 104 -3.003 -17.491 -4.216 1.00 62.04 C ATOM 1554 O GLY A 104 -2.685 -18.078 -3.180 1.00 14.21 O ATOM 0 H GLY A 104 -5.129 -16.793 -6.333 1.00 21.30 H new ATOM 0 HA2 GLY A 104 -4.919 -18.354 -4.687 1.00 11.43 H new ATOM 0 HA3 GLY A 104 -3.573 -19.108 -5.519 1.00 11.43 H new ATOM 1558 N LYS A 105 -2.530 -16.273 -4.535 1.00 34.43 N ATOM 1559 CA LYS A 105 -1.504 -15.553 -3.731 1.00 11.35 C ATOM 1560 C LYS A 105 -2.197 -14.492 -2.853 1.00 74.24 C ATOM 1561 O LYS A 105 -3.074 -13.789 -3.346 1.00 5.34 O ATOM 1562 CB LYS A 105 -0.465 -14.870 -4.674 1.00 44.22 C ATOM 1563 CG LYS A 105 -0.054 -15.705 -5.916 1.00 43.44 C ATOM 1564 CD LYS A 105 0.612 -17.064 -5.585 1.00 12.13 C ATOM 1565 CE LYS A 105 1.997 -16.914 -4.946 1.00 71.12 C ATOM 1566 NZ LYS A 105 2.628 -18.228 -4.672 1.00 61.32 N ATOM 0 H LYS A 105 -2.843 -15.753 -5.355 1.00 34.43 H new ATOM 0 HA LYS A 105 -0.980 -16.265 -3.094 1.00 11.35 H new ATOM 0 HB2 LYS A 105 -0.876 -13.920 -5.014 1.00 44.22 H new ATOM 0 HB3 LYS A 105 0.431 -14.641 -4.097 1.00 44.22 H new ATOM 0 HG2 LYS A 105 -0.940 -15.888 -6.525 1.00 43.44 H new ATOM 0 HG3 LYS A 105 0.634 -15.116 -6.523 1.00 43.44 H new ATOM 0 HD2 LYS A 105 -0.035 -17.624 -4.909 1.00 12.13 H new ATOM 0 HD3 LYS A 105 0.702 -17.650 -6.499 1.00 12.13 H new ATOM 0 HE2 LYS A 105 2.640 -16.334 -5.607 1.00 71.12 H new ATOM 0 HE3 LYS A 105 1.908 -16.353 -4.015 1.00 71.12 H new ATOM 0 HZ1 LYS A 105 3.563 -18.081 -4.240 1.00 61.32 H new ATOM 0 HZ2 LYS A 105 2.027 -18.772 -4.020 1.00 61.32 H new ATOM 0 HZ3 LYS A 105 2.737 -18.753 -5.563 1.00 61.32 H new ATOM 1580 N THR A 106 -1.806 -14.346 -1.573 1.00 3.21 N ATOM 1581 CA THR A 106 -2.518 -13.429 -0.634 1.00 31.11 C ATOM 1582 C THR A 106 -1.795 -12.060 -0.497 1.00 23.35 C ATOM 1583 O THR A 106 -0.650 -11.991 -0.056 1.00 72.25 O ATOM 1584 CB THR A 106 -2.720 -14.065 0.786 1.00 24.44 C ATOM 1585 OG1 THR A 106 -3.360 -15.349 0.660 1.00 60.31 O ATOM 1586 CG2 THR A 106 -3.583 -13.173 1.707 1.00 62.25 C ATOM 0 H THR A 106 -1.014 -14.839 -1.160 1.00 3.21 H new ATOM 0 HA THR A 106 -3.501 -13.261 -1.074 1.00 31.11 H new ATOM 0 HB THR A 106 -1.732 -14.168 1.234 1.00 24.44 H new ATOM 0 HG1 THR A 106 -3.482 -15.742 1.549 1.00 60.31 H new ATOM 0 HG21 THR A 106 -3.695 -13.654 2.679 1.00 62.25 H new ATOM 0 HG22 THR A 106 -3.098 -12.205 1.835 1.00 62.25 H new ATOM 0 HG23 THR A 106 -4.566 -13.029 1.258 1.00 62.25 H new ATOM 1594 N LEU A 107 -2.523 -10.980 -0.827 1.00 41.54 N ATOM 1595 CA LEU A 107 -2.028 -9.584 -0.820 1.00 4.43 C ATOM 1596 C LEU A 107 -2.795 -8.786 0.264 1.00 33.03 C ATOM 1597 O LEU A 107 -3.804 -9.263 0.788 1.00 3.11 O ATOM 1598 CB LEU A 107 -2.207 -8.899 -2.219 1.00 4.12 C ATOM 1599 CG LEU A 107 -1.333 -9.444 -3.413 1.00 43.14 C ATOM 1600 CD1 LEU A 107 -1.826 -10.814 -3.934 1.00 42.53 C ATOM 1601 CD2 LEU A 107 -1.262 -8.416 -4.568 1.00 65.24 C ATOM 0 H LEU A 107 -3.499 -11.051 -1.114 1.00 41.54 H new ATOM 0 HA LEU A 107 -0.961 -9.595 -0.597 1.00 4.43 H new ATOM 0 HB2 LEU A 107 -3.256 -8.984 -2.504 1.00 4.12 H new ATOM 0 HB3 LEU A 107 -1.993 -7.836 -2.103 1.00 4.12 H new ATOM 0 HG LEU A 107 -0.329 -9.594 -3.017 1.00 43.14 H new ATOM 0 HD11 LEU A 107 -1.189 -11.142 -4.755 1.00 42.53 H new ATOM 0 HD12 LEU A 107 -1.784 -11.546 -3.128 1.00 42.53 H new ATOM 0 HD13 LEU A 107 -2.853 -10.721 -4.287 1.00 42.53 H new ATOM 0 HD21 LEU A 107 -0.653 -8.819 -5.377 1.00 65.24 H new ATOM 0 HD22 LEU A 107 -2.267 -8.213 -4.937 1.00 65.24 H new ATOM 0 HD23 LEU A 107 -0.816 -7.490 -4.204 1.00 65.24 H new ATOM 1613 N LEU A 108 -2.312 -7.579 0.611 1.00 55.23 N ATOM 1614 CA LEU A 108 -3.030 -6.675 1.546 1.00 73.04 C ATOM 1615 C LEU A 108 -3.286 -5.300 0.882 1.00 70.14 C ATOM 1616 O LEU A 108 -2.350 -4.533 0.655 1.00 61.32 O ATOM 1617 CB LEU A 108 -2.232 -6.490 2.874 1.00 32.51 C ATOM 1618 CG LEU A 108 -2.984 -5.726 4.028 1.00 60.33 C ATOM 1619 CD1 LEU A 108 -4.142 -6.568 4.608 1.00 13.03 C ATOM 1620 CD2 LEU A 108 -2.008 -5.295 5.150 1.00 11.15 C ATOM 0 H LEU A 108 -1.431 -7.202 0.262 1.00 55.23 H new ATOM 0 HA LEU A 108 -3.989 -7.135 1.785 1.00 73.04 H new ATOM 0 HB2 LEU A 108 -1.945 -7.475 3.243 1.00 32.51 H new ATOM 0 HB3 LEU A 108 -1.310 -5.953 2.650 1.00 32.51 H new ATOM 0 HG LEU A 108 -3.413 -4.826 3.588 1.00 60.33 H new ATOM 0 HD11 LEU A 108 -4.637 -6.008 5.401 1.00 13.03 H new ATOM 0 HD12 LEU A 108 -4.860 -6.791 3.819 1.00 13.03 H new ATOM 0 HD13 LEU A 108 -3.747 -7.500 5.013 1.00 13.03 H new ATOM 0 HD21 LEU A 108 -2.559 -4.771 5.930 1.00 11.15 H new ATOM 0 HD22 LEU A 108 -1.529 -6.177 5.575 1.00 11.15 H new ATOM 0 HD23 LEU A 108 -1.247 -4.633 4.736 1.00 11.15 H new ATOM 1632 N VAL A 109 -4.559 -5.005 0.564 1.00 21.35 N ATOM 1633 CA VAL A 109 -4.966 -3.665 0.090 1.00 33.04 C ATOM 1634 C VAL A 109 -5.214 -2.757 1.310 1.00 44.13 C ATOM 1635 O VAL A 109 -6.022 -3.087 2.176 1.00 40.53 O ATOM 1636 CB VAL A 109 -6.262 -3.699 -0.801 1.00 53.13 C ATOM 1637 CG1 VAL A 109 -6.650 -2.277 -1.284 1.00 63.23 C ATOM 1638 CG2 VAL A 109 -6.091 -4.647 -2.002 1.00 15.22 C ATOM 0 H VAL A 109 -5.326 -5.675 0.626 1.00 21.35 H new ATOM 0 HA VAL A 109 -4.158 -3.279 -0.532 1.00 33.04 H new ATOM 0 HB VAL A 109 -7.072 -4.081 -0.180 1.00 53.13 H new ATOM 0 HG11 VAL A 109 -7.549 -2.334 -1.897 1.00 63.23 H new ATOM 0 HG12 VAL A 109 -6.839 -1.639 -0.421 1.00 63.23 H new ATOM 0 HG13 VAL A 109 -5.835 -1.858 -1.874 1.00 63.23 H new ATOM 0 HG21 VAL A 109 -7.004 -4.648 -2.598 1.00 15.22 H new ATOM 0 HG22 VAL A 109 -5.257 -4.309 -2.617 1.00 15.22 H new ATOM 0 HG23 VAL A 109 -5.891 -5.657 -1.643 1.00 15.22 H new ATOM 1648 N VAL A 110 -4.509 -1.622 1.372 1.00 1.00 N ATOM 1649 CA VAL A 110 -4.618 -0.660 2.481 1.00 12.43 C ATOM 1650 C VAL A 110 -5.118 0.695 1.943 1.00 10.21 C ATOM 1651 O VAL A 110 -4.355 1.481 1.379 1.00 62.01 O ATOM 1652 CB VAL A 110 -3.243 -0.485 3.231 1.00 40.14 C ATOM 1653 CG1 VAL A 110 -3.370 0.437 4.474 1.00 20.45 C ATOM 1654 CG2 VAL A 110 -2.642 -1.858 3.608 1.00 72.03 C ATOM 0 H VAL A 110 -3.843 -1.341 0.652 1.00 1.00 H new ATOM 0 HA VAL A 110 -5.336 -1.048 3.204 1.00 12.43 H new ATOM 0 HB VAL A 110 -2.557 0.007 2.541 1.00 40.14 H new ATOM 0 HG11 VAL A 110 -2.398 0.529 4.960 1.00 20.45 H new ATOM 0 HG12 VAL A 110 -3.714 1.423 4.162 1.00 20.45 H new ATOM 0 HG13 VAL A 110 -4.086 0.007 5.174 1.00 20.45 H new ATOM 0 HG21 VAL A 110 -1.693 -1.711 4.124 1.00 72.03 H new ATOM 0 HG22 VAL A 110 -3.333 -2.390 4.262 1.00 72.03 H new ATOM 0 HG23 VAL A 110 -2.476 -2.443 2.703 1.00 72.03 H new ATOM 1664 N TYR A 111 -6.419 0.944 2.115 1.00 13.32 N ATOM 1665 CA TYR A 111 -7.054 2.210 1.734 1.00 33.21 C ATOM 1666 C TYR A 111 -6.786 3.280 2.811 1.00 45.13 C ATOM 1667 O TYR A 111 -7.140 3.091 3.974 1.00 20.24 O ATOM 1668 CB TYR A 111 -8.584 2.009 1.540 1.00 11.20 C ATOM 1669 CG TYR A 111 -9.335 3.300 1.188 1.00 12.14 C ATOM 1670 CD1 TYR A 111 -9.208 3.869 -0.075 1.00 54.21 C ATOM 1671 CD2 TYR A 111 -10.131 3.973 2.129 1.00 31.23 C ATOM 1672 CE1 TYR A 111 -9.846 5.042 -0.395 1.00 13.42 C ATOM 1673 CE2 TYR A 111 -10.766 5.156 1.810 1.00 63.54 C ATOM 1674 CZ TYR A 111 -10.619 5.687 0.546 1.00 51.42 C ATOM 1675 OH TYR A 111 -11.244 6.868 0.216 1.00 30.14 O ATOM 0 H TYR A 111 -7.065 0.270 2.525 1.00 13.32 H new ATOM 0 HA TYR A 111 -6.627 2.548 0.790 1.00 33.21 H new ATOM 0 HB2 TYR A 111 -8.748 1.276 0.750 1.00 11.20 H new ATOM 0 HB3 TYR A 111 -9.006 1.591 2.454 1.00 11.20 H new ATOM 0 HD1 TYR A 111 -8.596 3.379 -0.818 1.00 54.21 H new ATOM 0 HD2 TYR A 111 -10.248 3.558 3.119 1.00 31.23 H new ATOM 0 HE1 TYR A 111 -9.742 5.460 -1.386 1.00 13.42 H new ATOM 0 HE2 TYR A 111 -11.374 5.662 2.545 1.00 63.54 H new ATOM 0 HH TYR A 111 -10.779 7.616 0.646 1.00 30.14 H new ATOM 1685 N VAL A 112 -6.178 4.404 2.415 1.00 32.31 N ATOM 1686 CA VAL A 112 -5.936 5.536 3.324 1.00 43.22 C ATOM 1687 C VAL A 112 -6.987 6.645 3.045 1.00 60.45 C ATOM 1688 O VAL A 112 -6.985 7.230 1.948 1.00 4.43 O ATOM 1689 CB VAL A 112 -4.474 6.099 3.175 1.00 11.34 C ATOM 1690 CG1 VAL A 112 -4.207 7.268 4.163 1.00 51.43 C ATOM 1691 CG2 VAL A 112 -3.425 4.966 3.349 1.00 4.53 C ATOM 0 H VAL A 112 -5.841 4.557 1.464 1.00 32.31 H new ATOM 0 HA VAL A 112 -6.037 5.187 4.352 1.00 43.22 H new ATOM 0 HB VAL A 112 -4.376 6.500 2.166 1.00 11.34 H new ATOM 0 HG11 VAL A 112 -3.188 7.631 4.031 1.00 51.43 H new ATOM 0 HG12 VAL A 112 -4.909 8.078 3.966 1.00 51.43 H new ATOM 0 HG13 VAL A 112 -4.337 6.916 5.186 1.00 51.43 H new ATOM 0 HG21 VAL A 112 -2.422 5.379 3.242 1.00 4.53 H new ATOM 0 HG22 VAL A 112 -3.530 4.521 4.339 1.00 4.53 H new ATOM 0 HG23 VAL A 112 -3.586 4.202 2.589 1.00 4.53 H new ATOM 1701 N PRO A 113 -7.932 6.911 4.008 1.00 61.51 N ATOM 1702 CA PRO A 113 -8.944 7.990 3.861 1.00 13.40 C ATOM 1703 C PRO A 113 -8.363 9.403 4.107 1.00 21.22 C ATOM 1704 O PRO A 113 -7.194 9.552 4.496 1.00 74.33 O ATOM 1705 CB PRO A 113 -9.993 7.614 4.936 1.00 50.43 C ATOM 1706 CG PRO A 113 -9.188 6.959 6.017 1.00 11.50 C ATOM 1707 CD PRO A 113 -8.103 6.177 5.300 1.00 74.33 C ATOM 0 HA PRO A 113 -9.346 8.049 2.850 1.00 13.40 H new ATOM 0 HB2 PRO A 113 -10.517 8.495 5.307 1.00 50.43 H new ATOM 0 HB3 PRO A 113 -10.749 6.938 4.536 1.00 50.43 H new ATOM 0 HG2 PRO A 113 -8.757 7.701 6.689 1.00 11.50 H new ATOM 0 HG3 PRO A 113 -9.809 6.301 6.624 1.00 11.50 H new ATOM 0 HD2 PRO A 113 -7.177 6.157 5.875 1.00 74.33 H new ATOM 0 HD3 PRO A 113 -8.398 5.141 5.136 1.00 74.33 H new ATOM 1715 N GLU A 114 -9.187 10.436 3.843 1.00 32.12 N ATOM 1716 CA GLU A 114 -8.866 11.838 4.172 1.00 13.10 C ATOM 1717 C GLU A 114 -8.598 12.042 5.683 1.00 34.41 C ATOM 1718 O GLU A 114 -8.987 11.222 6.524 1.00 41.30 O ATOM 1719 CB GLU A 114 -10.016 12.790 3.698 1.00 2.01 C ATOM 1720 CG GLU A 114 -11.320 12.758 4.545 1.00 41.14 C ATOM 1721 CD GLU A 114 -12.044 11.394 4.568 1.00 0.12 C ATOM 1722 OE1 GLU A 114 -12.525 10.960 3.507 1.00 42.10 O ATOM 1723 OE2 GLU A 114 -12.133 10.754 5.642 1.00 32.03 O ATOM 0 H GLU A 114 -10.096 10.321 3.395 1.00 32.12 H new ATOM 0 HA GLU A 114 -7.947 12.087 3.641 1.00 13.10 H new ATOM 0 HB2 GLU A 114 -9.636 13.811 3.691 1.00 2.01 H new ATOM 0 HB3 GLU A 114 -10.269 12.537 2.668 1.00 2.01 H new ATOM 0 HG2 GLU A 114 -11.078 13.043 5.569 1.00 41.14 H new ATOM 0 HG3 GLU A 114 -12.006 13.511 4.158 1.00 41.14 H new ATOM 1730 N ALA A 115 -7.927 13.141 6.009 1.00 54.03 N ATOM 1731 CA ALA A 115 -7.678 13.540 7.402 1.00 10.35 C ATOM 1732 C ALA A 115 -8.505 14.810 7.749 1.00 22.22 C ATOM 1733 O ALA A 115 -8.550 15.766 6.966 1.00 32.02 O ATOM 1734 CB ALA A 115 -6.172 13.747 7.615 1.00 72.51 C ATOM 0 H ALA A 115 -7.538 13.785 5.320 1.00 54.03 H new ATOM 0 HA ALA A 115 -8.002 12.751 8.081 1.00 10.35 H new ATOM 0 HB1 ALA A 115 -5.988 14.043 8.648 1.00 72.51 H new ATOM 0 HB2 ALA A 115 -5.644 12.817 7.404 1.00 72.51 H new ATOM 0 HB3 ALA A 115 -5.814 14.528 6.945 1.00 72.51 H new ATOM 1740 N ASP A 116 -9.150 14.796 8.937 1.00 73.52 N ATOM 1741 CA ASP A 116 -10.080 15.865 9.412 1.00 2.11 C ATOM 1742 C ASP A 116 -9.342 17.220 9.647 1.00 34.31 C ATOM 1743 O ASP A 116 -8.145 17.241 9.735 1.00 50.31 O ATOM 1744 CB ASP A 116 -10.748 15.372 10.727 1.00 63.43 C ATOM 1745 CG ASP A 116 -11.899 16.270 11.203 1.00 34.30 C ATOM 1746 OD1 ASP A 116 -13.053 16.072 10.761 1.00 61.10 O ATOM 1747 OD2 ASP A 116 -11.653 17.203 11.994 1.00 63.03 O ATOM 0 H ASP A 116 -9.043 14.035 9.608 1.00 73.52 H new ATOM 0 HA ASP A 116 -10.832 16.051 8.645 1.00 2.11 H new ATOM 0 HB2 ASP A 116 -11.125 14.360 10.577 1.00 63.43 H new ATOM 0 HB3 ASP A 116 -9.992 15.317 11.511 1.00 63.43 H new ATOM 1752 N VAL A 117 -10.058 18.352 9.689 1.00 55.24 N ATOM 1753 CA VAL A 117 -9.456 19.677 10.052 1.00 74.31 C ATOM 1754 C VAL A 117 -8.549 19.643 11.341 1.00 4.23 C ATOM 1755 O VAL A 117 -7.501 20.292 11.372 1.00 22.50 O ATOM 1756 CB VAL A 117 -10.585 20.762 10.200 1.00 32.24 C ATOM 1757 CG1 VAL A 117 -10.019 22.156 10.577 1.00 35.21 C ATOM 1758 CG2 VAL A 117 -11.432 20.845 8.901 1.00 50.43 C ATOM 0 H VAL A 117 -11.055 18.394 9.479 1.00 55.24 H new ATOM 0 HA VAL A 117 -8.789 19.941 9.231 1.00 74.31 H new ATOM 0 HB VAL A 117 -11.228 20.448 11.022 1.00 32.24 H new ATOM 0 HG11 VAL A 117 -10.838 22.869 10.667 1.00 35.21 H new ATOM 0 HG12 VAL A 117 -9.490 22.089 11.528 1.00 35.21 H new ATOM 0 HG13 VAL A 117 -9.330 22.491 9.801 1.00 35.21 H new ATOM 0 HG21 VAL A 117 -12.209 21.600 9.021 1.00 50.43 H new ATOM 0 HG22 VAL A 117 -10.789 21.115 8.064 1.00 50.43 H new ATOM 0 HG23 VAL A 117 -11.894 19.877 8.706 1.00 50.43 H new ATOM 1768 N THR A 118 -8.946 18.869 12.379 1.00 5.41 N ATOM 1769 CA THR A 118 -8.140 18.749 13.636 1.00 61.11 C ATOM 1770 C THR A 118 -6.879 17.846 13.448 1.00 63.53 C ATOM 1771 O THR A 118 -5.804 18.150 13.978 1.00 10.03 O ATOM 1772 CB THR A 118 -8.993 18.251 14.859 1.00 14.32 C ATOM 1773 OG1 THR A 118 -8.179 18.224 16.054 1.00 21.01 O ATOM 1774 CG2 THR A 118 -9.626 16.868 14.634 1.00 43.22 C ATOM 0 H THR A 118 -9.807 18.322 12.380 1.00 5.41 H new ATOM 0 HA THR A 118 -7.801 19.760 13.861 1.00 61.11 H new ATOM 0 HB THR A 118 -9.812 18.961 14.975 1.00 14.32 H new ATOM 0 HG1 THR A 118 -8.719 17.914 16.811 1.00 21.01 H new ATOM 0 HG21 THR A 118 -10.201 16.583 15.515 1.00 43.22 H new ATOM 0 HG22 THR A 118 -10.286 16.906 13.767 1.00 43.22 H new ATOM 0 HG23 THR A 118 -8.841 16.132 14.460 1.00 43.22 H new ATOM 1782 N HIS A 119 -7.024 16.740 12.691 1.00 74.31 N ATOM 1783 CA HIS A 119 -5.907 15.867 12.248 1.00 35.53 C ATOM 1784 C HIS A 119 -6.239 15.410 10.835 1.00 41.42 C ATOM 1785 O HIS A 119 -6.983 14.453 10.688 1.00 63.51 O ATOM 1786 CB HIS A 119 -5.652 14.675 13.219 1.00 55.15 C ATOM 1787 CG HIS A 119 -6.877 13.996 13.798 1.00 65.00 C ATOM 1788 ND1 HIS A 119 -7.313 14.285 15.066 1.00 52.34 N ATOM 1789 CD2 HIS A 119 -7.676 13.029 13.269 1.00 3.33 C ATOM 1790 CE1 HIS A 119 -8.353 13.507 15.282 1.00 50.44 C ATOM 1791 NE2 HIS A 119 -8.609 12.731 14.222 1.00 32.33 N ATOM 0 H HIS A 119 -7.935 16.419 12.362 1.00 74.31 H new ATOM 0 HA HIS A 119 -4.969 16.422 12.256 1.00 35.53 H new ATOM 0 HB2 HIS A 119 -5.065 13.924 12.690 1.00 55.15 H new ATOM 0 HB3 HIS A 119 -5.039 15.034 14.046 1.00 55.15 H new ATOM 0 HD2 HIS A 119 -7.589 12.585 12.289 1.00 3.33 H new ATOM 0 HE1 HIS A 119 -8.926 13.496 16.197 1.00 50.44 H new ATOM 0 HE2 HIS A 119 -9.360 12.046 14.141 1.00 32.33 H new ATOM 1799 N LYS A 120 -5.774 16.043 9.716 1.00 12.13 N ATOM 1800 CA LYS A 120 -4.442 16.596 9.312 1.00 54.34 C ATOM 1801 C LYS A 120 -3.559 17.518 10.255 1.00 42.34 C ATOM 1802 O LYS A 120 -3.769 17.667 11.448 1.00 14.32 O ATOM 1803 CB LYS A 120 -4.722 17.259 7.927 1.00 61.32 C ATOM 1804 CG LYS A 120 -5.736 18.428 7.985 1.00 21.43 C ATOM 1805 CD LYS A 120 -6.128 18.970 6.599 1.00 3.11 C ATOM 1806 CE LYS A 120 -7.083 20.173 6.699 1.00 4.52 C ATOM 1807 NZ LYS A 120 -6.458 21.346 7.379 1.00 32.13 N ATOM 0 H LYS A 120 -6.434 16.201 8.955 1.00 12.13 H new ATOM 0 HA LYS A 120 -3.759 15.747 9.343 1.00 54.34 H new ATOM 0 HB2 LYS A 120 -3.782 17.626 7.514 1.00 61.32 H new ATOM 0 HB3 LYS A 120 -5.097 16.500 7.241 1.00 61.32 H new ATOM 0 HG2 LYS A 120 -6.635 18.093 8.503 1.00 21.43 H new ATOM 0 HG3 LYS A 120 -5.310 19.239 8.576 1.00 21.43 H new ATOM 0 HD2 LYS A 120 -5.229 19.265 6.058 1.00 3.11 H new ATOM 0 HD3 LYS A 120 -6.603 18.177 6.021 1.00 3.11 H new ATOM 0 HE2 LYS A 120 -7.400 20.465 5.698 1.00 4.52 H new ATOM 0 HE3 LYS A 120 -7.979 19.877 7.244 1.00 4.52 H new ATOM 0 HZ1 LYS A 120 -7.073 22.178 7.272 1.00 32.13 H new ATOM 0 HZ2 LYS A 120 -6.333 21.135 8.390 1.00 32.13 H new ATOM 0 HZ3 LYS A 120 -5.532 21.543 6.950 1.00 32.13 H new ATOM 1821 N PRO A 121 -2.547 18.230 9.675 1.00 40.15 N ATOM 1822 CA PRO A 121 -1.133 17.971 9.963 1.00 24.21 C ATOM 1823 C PRO A 121 -0.817 16.715 10.829 1.00 52.03 C ATOM 1824 O PRO A 121 -0.559 16.803 12.032 1.00 65.24 O ATOM 1825 CB PRO A 121 -0.685 19.319 10.563 1.00 43.03 C ATOM 1826 CG PRO A 121 -1.553 20.353 9.845 1.00 0.05 C ATOM 1827 CD PRO A 121 -2.613 19.577 9.048 1.00 24.21 C ATOM 0 HA PRO A 121 -0.573 17.680 9.074 1.00 24.21 H new ATOM 0 HB2 PRO A 121 -0.841 19.347 11.641 1.00 43.03 H new ATOM 0 HB3 PRO A 121 0.376 19.500 10.390 1.00 43.03 H new ATOM 0 HG2 PRO A 121 -2.025 21.024 10.562 1.00 0.05 H new ATOM 0 HG3 PRO A 121 -0.947 20.970 9.181 1.00 0.05 H new ATOM 0 HD2 PRO A 121 -3.603 20.023 9.143 1.00 24.21 H new ATOM 0 HD3 PRO A 121 -2.380 19.544 7.984 1.00 24.21 H new ATOM 1835 N ILE A 122 -0.890 15.538 10.168 1.00 73.24 N ATOM 1836 CA ILE A 122 -0.525 14.235 10.760 1.00 33.32 C ATOM 1837 C ILE A 122 0.929 13.908 10.405 1.00 11.42 C ATOM 1838 O ILE A 122 1.262 13.686 9.239 1.00 64.43 O ATOM 1839 CB ILE A 122 -1.468 13.086 10.255 1.00 2.10 C ATOM 1840 CG1 ILE A 122 -2.941 13.409 10.637 1.00 60.44 C ATOM 1841 CG2 ILE A 122 -1.028 11.696 10.808 1.00 23.20 C ATOM 1842 CD1 ILE A 122 -3.949 12.370 10.215 1.00 63.42 C ATOM 0 H ILE A 122 -1.207 15.467 9.201 1.00 73.24 H new ATOM 0 HA ILE A 122 -0.640 14.307 11.842 1.00 33.32 H new ATOM 0 HB ILE A 122 -1.393 13.029 9.169 1.00 2.10 H new ATOM 0 HG12 ILE A 122 -3.001 13.535 11.718 1.00 60.44 H new ATOM 0 HG13 ILE A 122 -3.216 14.364 10.189 1.00 60.44 H new ATOM 0 HG21 ILE A 122 -1.704 10.926 10.437 1.00 23.20 H new ATOM 0 HG22 ILE A 122 -0.013 11.477 10.477 1.00 23.20 H new ATOM 0 HG23 ILE A 122 -1.059 11.712 11.897 1.00 23.20 H new ATOM 0 HD11 ILE A 122 -4.946 12.683 10.525 1.00 63.42 H new ATOM 0 HD12 ILE A 122 -3.924 12.258 9.131 1.00 63.42 H new ATOM 0 HD13 ILE A 122 -3.706 11.416 10.684 1.00 63.42 H new ATOM 1854 N TYR A 123 1.782 13.880 11.417 1.00 0.24 N ATOM 1855 CA TYR A 123 3.228 13.678 11.233 1.00 53.43 C ATOM 1856 C TYR A 123 3.773 12.595 12.185 1.00 75.30 C ATOM 1857 O TYR A 123 3.347 12.474 13.339 1.00 53.43 O ATOM 1858 CB TYR A 123 3.996 15.024 11.403 1.00 44.35 C ATOM 1859 CG TYR A 123 3.798 15.737 12.756 1.00 20.12 C ATOM 1860 CD1 TYR A 123 2.714 16.600 12.965 1.00 5.13 C ATOM 1861 CD2 TYR A 123 4.689 15.551 13.819 1.00 61.45 C ATOM 1862 CE1 TYR A 123 2.532 17.249 14.172 1.00 52.51 C ATOM 1863 CE2 TYR A 123 4.506 16.199 15.028 1.00 71.51 C ATOM 1864 CZ TYR A 123 3.429 17.043 15.203 1.00 13.21 C ATOM 1865 OH TYR A 123 3.249 17.687 16.413 1.00 71.23 O ATOM 0 H TYR A 123 1.502 13.995 12.391 1.00 0.24 H new ATOM 0 HA TYR A 123 3.391 13.322 10.216 1.00 53.43 H new ATOM 0 HB2 TYR A 123 5.060 14.834 11.265 1.00 44.35 H new ATOM 0 HB3 TYR A 123 3.687 15.701 10.607 1.00 44.35 H new ATOM 0 HD1 TYR A 123 2.006 16.762 12.166 1.00 5.13 H new ATOM 0 HD2 TYR A 123 5.534 14.890 13.694 1.00 61.45 H new ATOM 0 HE1 TYR A 123 1.692 17.914 14.309 1.00 52.51 H new ATOM 0 HE2 TYR A 123 5.207 16.044 15.835 1.00 71.51 H new ATOM 0 HH TYR A 123 3.967 17.432 17.029 1.00 71.23 H new ATOM 1875 N LYS A 124 4.695 11.798 11.646 1.00 54.23 N ATOM 1876 CA LYS A 124 5.515 10.845 12.404 1.00 44.22 C ATOM 1877 C LYS A 124 6.398 11.593 13.447 1.00 30.42 C ATOM 1878 O LYS A 124 6.993 12.628 13.122 1.00 51.35 O ATOM 1879 CB LYS A 124 6.396 10.077 11.383 1.00 62.35 C ATOM 1880 CG LYS A 124 7.507 9.187 11.976 1.00 54.51 C ATOM 1881 CD LYS A 124 8.468 8.648 10.888 1.00 60.23 C ATOM 1882 CE LYS A 124 9.698 7.956 11.488 1.00 55.51 C ATOM 1883 NZ LYS A 124 10.514 8.877 12.337 1.00 15.14 N ATOM 0 H LYS A 124 4.900 11.795 10.647 1.00 54.23 H new ATOM 0 HA LYS A 124 4.884 10.150 12.957 1.00 44.22 H new ATOM 0 HB2 LYS A 124 5.746 9.451 10.772 1.00 62.35 H new ATOM 0 HB3 LYS A 124 6.859 10.804 10.715 1.00 62.35 H new ATOM 0 HG2 LYS A 124 8.075 9.759 12.709 1.00 54.51 H new ATOM 0 HG3 LYS A 124 7.055 8.349 12.506 1.00 54.51 H new ATOM 0 HD2 LYS A 124 7.933 7.944 10.250 1.00 60.23 H new ATOM 0 HD3 LYS A 124 8.792 9.472 10.252 1.00 60.23 H new ATOM 0 HE2 LYS A 124 9.376 7.104 12.087 1.00 55.51 H new ATOM 0 HE3 LYS A 124 10.319 7.563 10.683 1.00 55.51 H new ATOM 0 HZ1 LYS A 124 11.465 8.478 12.467 1.00 15.14 H new ATOM 0 HZ2 LYS A 124 10.588 9.804 11.871 1.00 15.14 H new ATOM 0 HZ3 LYS A 124 10.057 8.991 13.264 1.00 15.14 H new ATOM 1897 N LYS A 125 6.460 11.080 14.700 1.00 35.23 N ATOM 1898 CA LYS A 125 7.391 11.624 15.722 1.00 2.14 C ATOM 1899 C LYS A 125 8.861 11.329 15.343 1.00 24.34 C ATOM 1900 O LYS A 125 9.144 10.359 14.624 1.00 53.40 O ATOM 1901 CB LYS A 125 7.071 11.111 17.158 1.00 64.10 C ATOM 1902 CG LYS A 125 5.834 11.773 17.830 1.00 22.13 C ATOM 1903 CD LYS A 125 4.466 11.193 17.378 1.00 20.15 C ATOM 1904 CE LYS A 125 4.051 9.922 18.159 1.00 51.32 C ATOM 1905 NZ LYS A 125 5.021 8.807 18.029 1.00 52.24 N ATOM 0 H LYS A 125 5.886 10.302 15.025 1.00 35.23 H new ATOM 0 HA LYS A 125 7.247 12.704 15.736 1.00 2.14 H new ATOM 0 HB2 LYS A 125 6.910 10.034 17.116 1.00 64.10 H new ATOM 0 HB3 LYS A 125 7.943 11.278 17.790 1.00 64.10 H new ATOM 0 HG2 LYS A 125 5.921 11.663 18.911 1.00 22.13 H new ATOM 0 HG3 LYS A 125 5.849 12.842 17.616 1.00 22.13 H new ATOM 0 HD2 LYS A 125 3.697 11.955 17.503 1.00 20.15 H new ATOM 0 HD3 LYS A 125 4.512 10.959 16.315 1.00 20.15 H new ATOM 0 HE2 LYS A 125 3.937 10.174 19.213 1.00 51.32 H new ATOM 0 HE3 LYS A 125 3.076 9.589 17.804 1.00 51.32 H new ATOM 0 HZ1 LYS A 125 4.568 7.917 18.319 1.00 52.24 H new ATOM 0 HZ2 LYS A 125 5.332 8.731 17.039 1.00 52.24 H new ATOM 0 HZ3 LYS A 125 5.844 8.990 18.637 1.00 52.24 H new ATOM 1919 N ALA A 126 9.769 12.204 15.828 1.00 33.14 N ATOM 1920 CA ALA A 126 11.203 12.227 15.443 1.00 11.11 C ATOM 1921 C ALA A 126 11.394 12.641 13.954 1.00 41.23 C ATOM 1922 O ALA A 126 12.459 12.420 13.364 1.00 44.34 O ATOM 1923 CB ALA A 126 11.900 10.888 15.772 1.00 53.42 C ATOM 0 H ALA A 126 9.526 12.925 16.507 1.00 33.14 H new ATOM 0 HA ALA A 126 11.691 12.994 16.045 1.00 11.11 H new ATOM 0 HB1 ALA A 126 12.948 10.941 15.477 1.00 53.42 H new ATOM 0 HB2 ALA A 126 11.834 10.697 16.843 1.00 53.42 H new ATOM 0 HB3 ALA A 126 11.410 10.080 15.229 1.00 53.42 H new ATOM 1929 N THR A 127 10.351 13.278 13.376 1.00 34.25 N ATOM 1930 CA THR A 127 10.353 13.795 11.987 1.00 60.34 C ATOM 1931 C THR A 127 9.627 15.161 11.947 1.00 42.13 C ATOM 1932 O THR A 127 8.395 15.222 12.064 1.00 14.31 O ATOM 1933 CB THR A 127 9.672 12.784 10.989 1.00 35.32 C ATOM 1934 OG1 THR A 127 10.356 11.518 11.029 1.00 34.11 O ATOM 1935 CG2 THR A 127 9.667 13.302 9.532 1.00 74.11 C ATOM 0 H THR A 127 9.473 13.450 13.866 1.00 34.25 H new ATOM 0 HA THR A 127 11.388 13.919 11.668 1.00 60.34 H new ATOM 0 HB THR A 127 8.637 12.673 11.311 1.00 35.32 H new ATOM 0 HG1 THR A 127 10.287 11.081 10.155 1.00 34.11 H new ATOM 0 HG21 THR A 127 9.186 12.567 8.886 1.00 74.11 H new ATOM 0 HG22 THR A 127 9.119 14.243 9.482 1.00 74.11 H new ATOM 0 HG23 THR A 127 10.693 13.462 9.199 1.00 74.11 H new ATOM 1943 N GLY A 128 10.412 16.249 11.820 1.00 21.24 N ATOM 1944 CA GLY A 128 9.875 17.616 11.805 1.00 42.31 C ATOM 1945 C GLY A 128 9.223 17.994 10.471 1.00 51.44 C ATOM 1946 O GLY A 128 7.991 18.016 10.349 1.00 31.21 O ATOM 0 H GLY A 128 11.427 16.202 11.726 1.00 21.24 H new ATOM 0 HA2 GLY A 128 9.140 17.719 12.603 1.00 42.31 H new ATOM 0 HA3 GLY A 128 10.680 18.318 12.020 1.00 42.31 H new ATOM 1950 N LEU A 129 10.062 18.294 9.469 1.00 74.01 N ATOM 1951 CA LEU A 129 9.613 18.673 8.110 1.00 13.42 C ATOM 1952 C LEU A 129 10.473 17.970 7.016 1.00 75.42 C ATOM 1953 O LEU A 129 11.688 17.804 7.198 1.00 35.42 O ATOM 1954 CB LEU A 129 9.586 20.241 7.973 1.00 63.13 C ATOM 1955 CG LEU A 129 10.792 21.052 8.586 1.00 61.34 C ATOM 1956 CD1 LEU A 129 12.079 20.953 7.736 1.00 13.32 C ATOM 1957 CD2 LEU A 129 10.405 22.531 8.836 1.00 64.50 C ATOM 0 H LEU A 129 11.077 18.282 9.573 1.00 74.01 H new ATOM 0 HA LEU A 129 8.593 18.321 7.953 1.00 13.42 H new ATOM 0 HB2 LEU A 129 9.523 20.484 6.912 1.00 63.13 H new ATOM 0 HB3 LEU A 129 8.668 20.602 8.437 1.00 63.13 H new ATOM 0 HG LEU A 129 11.016 20.587 9.546 1.00 61.34 H new ATOM 0 HD11 LEU A 129 12.873 21.531 8.209 1.00 13.32 H new ATOM 0 HD12 LEU A 129 12.386 19.910 7.660 1.00 13.32 H new ATOM 0 HD13 LEU A 129 11.887 21.348 6.738 1.00 13.32 H new ATOM 0 HD21 LEU A 129 11.257 23.064 9.259 1.00 64.50 H new ATOM 0 HD22 LEU A 129 10.118 22.996 7.893 1.00 64.50 H new ATOM 0 HD23 LEU A 129 9.568 22.575 9.532 1.00 64.50 H new ATOM 1969 N PRO A 130 9.846 17.492 5.881 1.00 34.23 N ATOM 1970 CA PRO A 130 10.585 16.820 4.769 1.00 0.41 C ATOM 1971 C PRO A 130 11.540 17.785 4.006 1.00 42.14 C ATOM 1972 O PRO A 130 12.759 17.547 3.930 1.00 1.33 O ATOM 1973 CB PRO A 130 9.444 16.275 3.845 1.00 40.33 C ATOM 1974 CG PRO A 130 8.201 16.328 4.691 1.00 1.51 C ATOM 1975 CD PRO A 130 8.383 17.521 5.602 1.00 4.14 C ATOM 0 HA PRO A 130 11.248 16.036 5.134 1.00 0.41 H new ATOM 0 HB2 PRO A 130 9.337 16.885 2.948 1.00 40.33 H new ATOM 0 HB3 PRO A 130 9.655 15.257 3.516 1.00 40.33 H new ATOM 0 HG2 PRO A 130 7.310 16.439 4.073 1.00 1.51 H new ATOM 0 HG3 PRO A 130 8.078 15.410 5.266 1.00 1.51 H new ATOM 0 HD2 PRO A 130 8.080 18.450 5.119 1.00 4.14 H new ATOM 0 HD3 PRO A 130 7.794 17.429 6.514 1.00 4.14 H new ATOM 1983 N GLY A 131 10.962 18.872 3.455 1.00 2.45 N ATOM 1984 CA GLY A 131 11.726 19.884 2.710 1.00 41.15 C ATOM 1985 C GLY A 131 12.265 19.366 1.370 1.00 71.42 C ATOM 1986 O GLY A 131 13.477 19.147 1.222 1.00 22.45 O ATOM 0 H GLY A 131 9.963 19.069 3.515 1.00 2.45 H new ATOM 0 HA2 GLY A 131 11.089 20.750 2.528 1.00 41.15 H new ATOM 0 HA3 GLY A 131 12.560 20.225 3.323 1.00 41.15 H new ATOM 1990 N GLY A 132 11.344 19.167 0.401 1.00 12.21 N ATOM 1991 CA GLY A 132 11.681 18.616 -0.923 1.00 41.14 C ATOM 1992 C GLY A 132 12.603 19.507 -1.787 1.00 53.31 C ATOM 1993 O GLY A 132 13.379 18.983 -2.601 1.00 42.45 O ATOM 0 H GLY A 132 10.354 19.383 0.517 1.00 12.21 H new ATOM 0 HA2 GLY A 132 12.162 17.648 -0.785 1.00 41.14 H new ATOM 0 HA3 GLY A 132 10.756 18.437 -1.471 1.00 41.14 H new ATOM 1997 N ALA A 133 12.490 20.847 -1.604 1.00 45.23 N ATOM 1998 CA ALA A 133 13.309 21.898 -2.291 1.00 21.22 C ATOM 1999 C ALA A 133 12.951 22.096 -3.798 1.00 24.51 C ATOM 2000 O ALA A 133 12.555 23.195 -4.209 1.00 62.33 O ATOM 2001 CB ALA A 133 14.824 21.656 -2.104 1.00 44.21 C ATOM 0 H ALA A 133 11.809 21.245 -0.957 1.00 45.23 H new ATOM 0 HA ALA A 133 13.047 22.834 -1.797 1.00 21.22 H new ATOM 0 HB1 ALA A 133 15.383 22.439 -2.616 1.00 44.21 H new ATOM 0 HB2 ALA A 133 15.067 21.673 -1.042 1.00 44.21 H new ATOM 0 HB3 ALA A 133 15.092 20.686 -2.522 1.00 44.21 H new ATOM 2007 N TYR A 134 13.087 21.019 -4.596 1.00 3.13 N ATOM 2008 CA TYR A 134 12.884 21.025 -6.070 1.00 42.02 C ATOM 2009 C TYR A 134 11.454 21.486 -6.495 1.00 42.14 C ATOM 2010 O TYR A 134 10.478 21.292 -5.764 1.00 2.34 O ATOM 2011 CB TYR A 134 13.190 19.601 -6.622 1.00 20.23 C ATOM 2012 CG TYR A 134 13.069 19.448 -8.149 1.00 31.15 C ATOM 2013 CD1 TYR A 134 13.930 20.133 -9.015 1.00 30.34 C ATOM 2014 CD2 TYR A 134 12.081 18.640 -8.723 1.00 52.44 C ATOM 2015 CE1 TYR A 134 13.812 20.008 -10.388 1.00 61.32 C ATOM 2016 CE2 TYR A 134 11.961 18.517 -10.092 1.00 54.24 C ATOM 2017 CZ TYR A 134 12.825 19.201 -10.923 1.00 4.44 C ATOM 2018 OH TYR A 134 12.701 19.080 -12.294 1.00 43.35 O ATOM 0 H TYR A 134 13.345 20.101 -4.234 1.00 3.13 H new ATOM 0 HA TYR A 134 13.569 21.757 -6.498 1.00 42.02 H new ATOM 0 HB2 TYR A 134 14.201 19.323 -6.324 1.00 20.23 H new ATOM 0 HB3 TYR A 134 12.512 18.892 -6.147 1.00 20.23 H new ATOM 0 HD1 TYR A 134 14.699 20.770 -8.604 1.00 30.34 H new ATOM 0 HD2 TYR A 134 11.399 18.102 -8.082 1.00 52.44 H new ATOM 0 HE1 TYR A 134 14.489 20.540 -11.040 1.00 61.32 H new ATOM 0 HE2 TYR A 134 11.192 17.886 -10.513 1.00 54.24 H new ATOM 0 HH TYR A 134 11.959 18.475 -12.503 1.00 43.35 H new ATOM 2028 N ARG A 135 11.355 22.050 -7.721 1.00 13.32 N ATOM 2029 CA ARG A 135 10.107 22.640 -8.291 1.00 43.14 C ATOM 2030 C ARG A 135 9.117 21.548 -8.852 1.00 23.53 C ATOM 2031 O ARG A 135 8.397 21.772 -9.833 1.00 1.04 O ATOM 2032 CB ARG A 135 10.543 23.667 -9.391 1.00 51.13 C ATOM 2033 CG ARG A 135 9.449 24.617 -9.968 1.00 3.22 C ATOM 2034 CD ARG A 135 8.876 25.627 -8.944 1.00 21.30 C ATOM 2035 NE ARG A 135 7.894 25.027 -8.016 1.00 44.13 N ATOM 2036 CZ ARG A 135 7.174 25.693 -7.141 1.00 60.50 C ATOM 2037 NH1 ARG A 135 7.305 26.973 -6.990 1.00 10.53 N ATOM 2038 NH2 ARG A 135 6.329 25.057 -6.405 1.00 1.03 N ATOM 0 H ARG A 135 12.149 22.112 -8.358 1.00 13.32 H new ATOM 0 HA ARG A 135 9.542 23.142 -7.505 1.00 43.14 H new ATOM 0 HB2 ARG A 135 11.340 24.285 -8.976 1.00 51.13 H new ATOM 0 HB3 ARG A 135 10.973 23.107 -10.221 1.00 51.13 H new ATOM 0 HG2 ARG A 135 9.870 25.169 -10.808 1.00 3.22 H new ATOM 0 HG3 ARG A 135 8.631 24.013 -10.361 1.00 3.22 H new ATOM 0 HD2 ARG A 135 9.697 26.054 -8.367 1.00 21.30 H new ATOM 0 HD3 ARG A 135 8.403 26.449 -9.481 1.00 21.30 H new ATOM 0 HE ARG A 135 7.765 24.016 -8.058 1.00 44.13 H new ATOM 0 HH11 ARG A 135 7.979 27.487 -7.557 1.00 10.53 H new ATOM 0 HH12 ARG A 135 6.734 27.467 -6.304 1.00 10.53 H new ATOM 0 HH21 ARG A 135 6.224 24.047 -6.505 1.00 1.03 H new ATOM 0 HH22 ARG A 135 5.765 25.563 -5.723 1.00 1.03 H new ATOM 2052 N ARG A 136 9.061 20.373 -8.195 1.00 71.05 N ATOM 2053 CA ARG A 136 8.080 19.309 -8.514 1.00 60.55 C ATOM 2054 C ARG A 136 6.671 19.703 -7.991 1.00 45.04 C ATOM 2055 O ARG A 136 6.379 19.607 -6.790 1.00 61.40 O ATOM 2056 CB ARG A 136 8.546 17.934 -7.943 1.00 71.42 C ATOM 2057 CG ARG A 136 8.997 17.946 -6.460 1.00 24.52 C ATOM 2058 CD ARG A 136 9.392 16.550 -5.938 1.00 71.41 C ATOM 2059 NE ARG A 136 10.482 15.926 -6.719 1.00 22.42 N ATOM 2060 CZ ARG A 136 10.951 14.707 -6.530 1.00 72.13 C ATOM 2061 NH1 ARG A 136 10.448 13.926 -5.623 1.00 42.33 N ATOM 2062 NH2 ARG A 136 11.916 14.272 -7.263 1.00 5.43 N ATOM 0 H ARG A 136 9.691 20.132 -7.430 1.00 71.05 H new ATOM 0 HA ARG A 136 8.017 19.203 -9.597 1.00 60.55 H new ATOM 0 HB2 ARG A 136 7.729 17.220 -8.051 1.00 71.42 H new ATOM 0 HB3 ARG A 136 9.372 17.568 -8.553 1.00 71.42 H new ATOM 0 HG2 ARG A 136 9.845 18.622 -6.349 1.00 24.52 H new ATOM 0 HG3 ARG A 136 8.190 18.343 -5.844 1.00 24.52 H new ATOM 0 HD2 ARG A 136 9.701 16.632 -4.896 1.00 71.41 H new ATOM 0 HD3 ARG A 136 8.518 15.899 -5.961 1.00 71.41 H new ATOM 0 HE ARG A 136 10.905 16.482 -7.463 1.00 22.42 H new ATOM 0 HH11 ARG A 136 9.676 14.251 -5.041 1.00 42.33 H new ATOM 0 HH12 ARG A 136 10.825 12.987 -5.493 1.00 42.33 H new ATOM 0 HH21 ARG A 136 12.316 14.869 -7.987 1.00 5.43 H new ATOM 0 HH22 ARG A 136 12.281 13.330 -7.120 1.00 5.43 H new ATOM 2076 N ILE A 137 5.822 20.206 -8.902 1.00 40.41 N ATOM 2077 CA ILE A 137 4.458 20.678 -8.569 1.00 0.00 C ATOM 2078 C ILE A 137 3.466 19.478 -8.526 1.00 25.12 C ATOM 2079 O ILE A 137 2.726 19.214 -9.482 1.00 12.34 O ATOM 2080 CB ILE A 137 3.982 21.788 -9.594 1.00 25.33 C ATOM 2081 CG1 ILE A 137 5.080 22.903 -9.743 1.00 64.53 C ATOM 2082 CG2 ILE A 137 2.617 22.409 -9.171 1.00 14.11 C ATOM 2083 CD1 ILE A 137 4.819 23.912 -10.854 1.00 52.51 C ATOM 0 H ILE A 137 6.057 20.299 -9.890 1.00 40.41 H new ATOM 0 HA ILE A 137 4.477 21.133 -7.579 1.00 0.00 H new ATOM 0 HB ILE A 137 3.837 21.309 -10.563 1.00 25.33 H new ATOM 0 HG12 ILE A 137 5.165 23.439 -8.797 1.00 64.53 H new ATOM 0 HG13 ILE A 137 6.042 22.424 -9.925 1.00 64.53 H new ATOM 0 HG21 ILE A 137 2.321 23.166 -9.897 1.00 14.11 H new ATOM 0 HG22 ILE A 137 1.858 21.628 -9.132 1.00 14.11 H new ATOM 0 HG23 ILE A 137 2.715 22.868 -8.187 1.00 14.11 H new ATOM 0 HD11 ILE A 137 5.628 24.641 -10.881 1.00 52.51 H new ATOM 0 HD12 ILE A 137 4.766 23.394 -11.811 1.00 52.51 H new ATOM 0 HD13 ILE A 137 3.875 24.424 -10.666 1.00 52.51 H new ATOM 2095 N GLY A 138 3.529 18.711 -7.419 1.00 42.32 N ATOM 2096 CA GLY A 138 2.628 17.562 -7.190 1.00 14.12 C ATOM 2097 C GLY A 138 1.449 17.902 -6.269 1.00 52.32 C ATOM 2098 O GLY A 138 0.337 17.382 -6.443 1.00 11.23 O ATOM 0 H GLY A 138 4.198 18.867 -6.665 1.00 42.32 H new ATOM 0 HA2 GLY A 138 2.245 17.211 -8.148 1.00 14.12 H new ATOM 0 HA3 GLY A 138 3.198 16.741 -6.754 1.00 14.12 H new ATOM 2102 N SER A 139 1.710 18.788 -5.289 1.00 31.43 N ATOM 2103 CA SER A 139 0.705 19.241 -4.302 1.00 72.31 C ATOM 2104 C SER A 139 -0.334 20.195 -4.941 1.00 72.23 C ATOM 2105 O SER A 139 0.031 21.250 -5.486 1.00 0.41 O ATOM 2106 CB SER A 139 1.417 19.950 -3.125 1.00 12.23 C ATOM 2107 OG SER A 139 2.318 19.070 -2.462 1.00 13.23 O ATOM 0 H SER A 139 2.628 19.213 -5.157 1.00 31.43 H new ATOM 0 HA SER A 139 0.170 18.364 -3.938 1.00 72.31 H new ATOM 0 HB2 SER A 139 1.960 20.819 -3.496 1.00 12.23 H new ATOM 0 HB3 SER A 139 0.675 20.317 -2.416 1.00 12.23 H new ATOM 0 HG SER A 139 1.812 18.356 -2.020 1.00 13.23 H new ATOM 2113 N SER A 140 -1.625 19.812 -4.871 1.00 25.45 N ATOM 2114 CA SER A 140 -2.748 20.656 -5.354 1.00 24.22 C ATOM 2115 C SER A 140 -3.010 21.821 -4.369 1.00 20.43 C ATOM 2116 O SER A 140 -3.193 21.586 -3.161 1.00 23.12 O ATOM 2117 CB SER A 140 -4.038 19.813 -5.519 1.00 12.00 C ATOM 2118 OG SER A 140 -5.125 20.606 -5.985 1.00 22.34 O ATOM 0 H SER A 140 -1.922 18.917 -4.482 1.00 25.45 H new ATOM 0 HA SER A 140 -2.469 21.064 -6.325 1.00 24.22 H new ATOM 0 HB2 SER A 140 -3.854 18.998 -6.220 1.00 12.00 H new ATOM 0 HB3 SER A 140 -4.301 19.359 -4.564 1.00 12.00 H new ATOM 0 HG SER A 140 -5.922 20.044 -6.080 1.00 22.34 H new ATOM 2124 N ASP A 141 -3.023 23.067 -4.886 1.00 53.23 N ATOM 2125 CA ASP A 141 -3.193 24.281 -4.055 1.00 4.50 C ATOM 2126 C ASP A 141 -4.669 24.490 -3.627 1.00 63.31 C ATOM 2127 O ASP A 141 -5.594 24.459 -4.451 1.00 32.31 O ATOM 2128 CB ASP A 141 -2.617 25.534 -4.777 1.00 32.13 C ATOM 2129 CG ASP A 141 -3.180 25.774 -6.185 1.00 14.33 C ATOM 2130 OD1 ASP A 141 -2.779 25.045 -7.121 1.00 60.22 O ATOM 2131 OD2 ASP A 141 -4.015 26.684 -6.369 1.00 64.11 O ATOM 0 H ASP A 141 -2.917 23.261 -5.882 1.00 53.23 H new ATOM 0 HA ASP A 141 -2.622 24.134 -3.138 1.00 4.50 H new ATOM 0 HB2 ASP A 141 -2.817 26.414 -4.165 1.00 32.13 H new ATOM 0 HB3 ASP A 141 -1.534 25.432 -4.845 1.00 32.13 H new ATOM 2136 N GLN A 142 -4.864 24.670 -2.308 1.00 21.32 N ATOM 2137 CA GLN A 142 -6.189 24.899 -1.686 1.00 41.11 C ATOM 2138 C GLN A 142 -6.615 26.390 -1.789 1.00 13.22 C ATOM 2139 O GLN A 142 -5.899 27.215 -2.376 1.00 2.42 O ATOM 2140 CB GLN A 142 -6.135 24.431 -0.201 1.00 50.04 C ATOM 2141 CG GLN A 142 -5.074 25.151 0.668 1.00 44.32 C ATOM 2142 CD GLN A 142 -4.891 24.542 2.061 1.00 11.30 C ATOM 2143 OE1 GLN A 142 -5.050 23.345 2.264 1.00 13.51 O ATOM 2144 NE2 GLN A 142 -4.554 25.361 3.034 1.00 5.31 N ATOM 0 H GLN A 142 -4.100 24.661 -1.633 1.00 21.32 H new ATOM 0 HA GLN A 142 -6.941 24.320 -2.222 1.00 41.11 H new ATOM 0 HB2 GLN A 142 -7.116 24.582 0.249 1.00 50.04 H new ATOM 0 HB3 GLN A 142 -5.936 23.360 -0.179 1.00 50.04 H new ATOM 0 HG2 GLN A 142 -4.117 25.131 0.146 1.00 44.32 H new ATOM 0 HG3 GLN A 142 -5.357 26.198 0.775 1.00 44.32 H new ATOM 0 HE21 GLN A 142 -4.427 26.355 2.843 1.00 5.31 H new ATOM 0 HE22 GLN A 142 -4.420 25.002 3.979 1.00 5.31 H new ATOM 2153 N ARG A 143 -7.797 26.722 -1.223 1.00 22.43 N ATOM 2154 CA ARG A 143 -8.343 28.105 -1.221 1.00 40.30 C ATOM 2155 C ARG A 143 -7.477 29.041 -0.329 1.00 60.21 C ATOM 2156 O ARG A 143 -7.754 29.224 0.866 1.00 62.31 O ATOM 2157 CB ARG A 143 -9.833 28.082 -0.760 1.00 4.40 C ATOM 2158 CG ARG A 143 -10.587 29.431 -0.894 1.00 11.11 C ATOM 2159 CD ARG A 143 -12.073 29.324 -0.483 1.00 22.21 C ATOM 2160 NE ARG A 143 -12.792 30.603 -0.628 1.00 70.14 N ATOM 2161 CZ ARG A 143 -14.052 30.811 -0.314 1.00 2.51 C ATOM 2162 NH1 ARG A 143 -14.803 29.866 0.163 1.00 45.12 N ATOM 2163 NH2 ARG A 143 -14.553 31.982 -0.481 1.00 23.01 N ATOM 0 H ARG A 143 -8.400 26.045 -0.756 1.00 22.43 H new ATOM 0 HA ARG A 143 -8.306 28.506 -2.234 1.00 40.30 H new ATOM 0 HB2 ARG A 143 -10.365 27.328 -1.340 1.00 4.40 H new ATOM 0 HB3 ARG A 143 -9.869 27.766 0.283 1.00 4.40 H new ATOM 0 HG2 ARG A 143 -10.095 30.181 -0.274 1.00 11.11 H new ATOM 0 HG3 ARG A 143 -10.523 29.778 -1.925 1.00 11.11 H new ATOM 0 HD2 ARG A 143 -12.562 28.565 -1.094 1.00 22.21 H new ATOM 0 HD3 ARG A 143 -12.137 28.990 0.553 1.00 22.21 H new ATOM 0 HE ARG A 143 -12.268 31.393 -1.004 1.00 70.14 H new ATOM 0 HH11 ARG A 143 -14.419 28.931 0.304 1.00 45.12 H new ATOM 0 HH12 ARG A 143 -15.777 30.058 0.397 1.00 45.12 H new ATOM 0 HH21 ARG A 143 -13.975 32.736 -0.853 1.00 23.01 H new ATOM 0 HH22 ARG A 143 -15.529 32.158 -0.242 1.00 23.01 H new ATOM 2177 N CYS A 144 -6.397 29.587 -0.929 1.00 21.13 N ATOM 2178 CA CYS A 144 -5.379 30.405 -0.219 1.00 22.12 C ATOM 2179 C CYS A 144 -4.451 31.141 -1.210 1.00 72.15 C ATOM 2180 O CYS A 144 -4.368 30.774 -2.384 1.00 3.23 O ATOM 2181 CB CYS A 144 -4.515 29.505 0.699 1.00 20.45 C ATOM 2182 SG CYS A 144 -3.590 28.217 -0.172 1.00 32.35 S ATOM 0 H CYS A 144 -6.202 29.475 -1.924 1.00 21.13 H new ATOM 0 HA CYS A 144 -5.914 31.145 0.376 1.00 22.12 H new ATOM 0 HB2 CYS A 144 -3.812 30.133 1.246 1.00 20.45 H new ATOM 0 HB3 CYS A 144 -5.162 29.033 1.438 1.00 20.45 H new ATOM 0 HG CYS A 144 -4.334 27.706 -1.107 1.00 32.35 H new ATOM 2188 N VAL A 145 -3.751 32.176 -0.716 1.00 5.24 N ATOM 2189 CA VAL A 145 -2.714 32.896 -1.498 1.00 62.31 C ATOM 2190 C VAL A 145 -1.359 32.130 -1.465 1.00 54.41 C ATOM 2191 O VAL A 145 -0.899 31.712 -0.401 1.00 11.33 O ATOM 2192 CB VAL A 145 -2.532 34.379 -0.972 1.00 61.13 C ATOM 2193 CG1 VAL A 145 -2.231 34.428 0.550 1.00 44.23 C ATOM 2194 CG2 VAL A 145 -1.454 35.151 -1.783 1.00 15.53 C ATOM 0 H VAL A 145 -3.881 32.540 0.228 1.00 5.24 H new ATOM 0 HA VAL A 145 -3.052 32.944 -2.533 1.00 62.31 H new ATOM 0 HB VAL A 145 -3.486 34.883 -1.128 1.00 61.13 H new ATOM 0 HG11 VAL A 145 -2.114 35.465 0.865 1.00 44.23 H new ATOM 0 HG12 VAL A 145 -3.056 33.973 1.099 1.00 44.23 H new ATOM 0 HG13 VAL A 145 -1.312 33.880 0.757 1.00 44.23 H new ATOM 0 HG21 VAL A 145 -1.360 36.164 -1.391 1.00 15.53 H new ATOM 0 HG22 VAL A 145 -0.496 34.638 -1.696 1.00 15.53 H new ATOM 0 HG23 VAL A 145 -1.749 35.194 -2.831 1.00 15.53 H new ATOM 2204 N LEU A 146 -0.753 31.908 -2.648 1.00 61.41 N ATOM 2205 CA LEU A 146 0.610 31.316 -2.775 1.00 3.51 C ATOM 2206 C LEU A 146 1.594 32.350 -3.380 1.00 4.23 C ATOM 2207 O LEU A 146 1.244 33.517 -3.583 1.00 65.15 O ATOM 2208 CB LEU A 146 0.598 30.022 -3.661 1.00 73.04 C ATOM 2209 CG LEU A 146 -0.133 28.759 -3.088 1.00 32.25 C ATOM 2210 CD1 LEU A 146 -1.672 28.885 -3.153 1.00 43.20 C ATOM 2211 CD2 LEU A 146 0.349 27.472 -3.797 1.00 35.51 C ATOM 0 H LEU A 146 -1.186 32.130 -3.544 1.00 61.41 H new ATOM 0 HA LEU A 146 0.940 31.041 -1.773 1.00 3.51 H new ATOM 0 HB2 LEU A 146 0.137 30.273 -4.616 1.00 73.04 H new ATOM 0 HB3 LEU A 146 1.632 29.747 -3.868 1.00 73.04 H new ATOM 0 HG LEU A 146 0.132 28.692 -2.033 1.00 32.25 H new ATOM 0 HD11 LEU A 146 -2.128 27.984 -2.744 1.00 43.20 H new ATOM 0 HD12 LEU A 146 -1.991 29.750 -2.571 1.00 43.20 H new ATOM 0 HD13 LEU A 146 -1.983 29.011 -4.190 1.00 43.20 H new ATOM 0 HD21 LEU A 146 -0.173 26.610 -3.381 1.00 35.51 H new ATOM 0 HD22 LEU A 146 0.138 27.544 -4.864 1.00 35.51 H new ATOM 0 HD23 LEU A 146 1.422 27.354 -3.646 1.00 35.51 H new ATOM 2223 N GLU A 147 2.838 31.908 -3.642 1.00 51.51 N ATOM 2224 CA GLU A 147 3.825 32.684 -4.422 1.00 31.21 C ATOM 2225 C GLU A 147 3.670 32.373 -5.932 1.00 1.51 C ATOM 2226 O GLU A 147 4.179 31.365 -6.418 1.00 33.52 O ATOM 2227 CB GLU A 147 5.269 32.368 -3.922 1.00 11.51 C ATOM 2228 CG GLU A 147 6.413 33.044 -4.718 1.00 71.53 C ATOM 2229 CD GLU A 147 6.289 34.577 -4.814 1.00 61.41 C ATOM 2230 OE1 GLU A 147 6.632 35.272 -3.832 1.00 11.32 O ATOM 2231 OE2 GLU A 147 5.831 35.090 -5.866 1.00 33.42 O ATOM 0 H GLU A 147 3.188 31.006 -3.321 1.00 51.51 H new ATOM 0 HA GLU A 147 3.644 33.749 -4.277 1.00 31.21 H new ATOM 0 HB2 GLU A 147 5.348 32.671 -2.878 1.00 11.51 H new ATOM 0 HB3 GLU A 147 5.417 31.289 -3.952 1.00 11.51 H new ATOM 0 HG2 GLU A 147 7.365 32.795 -4.248 1.00 71.53 H new ATOM 0 HG3 GLU A 147 6.436 32.628 -5.725 1.00 71.53 H new ATOM 2238 N HIS A 148 2.901 33.216 -6.647 1.00 72.15 N ATOM 2239 CA HIS A 148 2.747 33.146 -8.125 1.00 22.42 C ATOM 2240 C HIS A 148 2.558 34.568 -8.705 1.00 64.21 C ATOM 2241 O HIS A 148 1.592 35.258 -8.359 1.00 4.30 O ATOM 2242 CB HIS A 148 1.532 32.255 -8.546 1.00 21.02 C ATOM 2243 CG HIS A 148 1.667 30.780 -8.231 1.00 33.22 C ATOM 2244 ND1 HIS A 148 0.849 30.115 -7.343 1.00 14.51 N ATOM 2245 CD2 HIS A 148 2.526 29.844 -8.705 1.00 12.01 C ATOM 2246 CE1 HIS A 148 1.197 28.849 -7.284 1.00 44.12 C ATOM 2247 NE2 HIS A 148 2.205 28.653 -8.101 1.00 22.24 N ATOM 0 H HIS A 148 2.364 33.971 -6.220 1.00 72.15 H new ATOM 0 HA HIS A 148 3.655 32.693 -8.524 1.00 22.42 H new ATOM 0 HB2 HIS A 148 0.637 32.634 -8.052 1.00 21.02 H new ATOM 0 HB3 HIS A 148 1.376 32.367 -9.619 1.00 21.02 H new ATOM 0 HD2 HIS A 148 3.316 30.005 -9.424 1.00 12.01 H new ATOM 0 HE1 HIS A 148 0.731 28.096 -6.666 1.00 44.12 H new ATOM 0 HE2 HIS A 148 2.674 27.761 -8.261 1.00 22.24 H new ATOM 2256 N HIS A 149 3.499 35.017 -9.559 1.00 51.30 N ATOM 2257 CA HIS A 149 3.352 36.283 -10.312 1.00 62.32 C ATOM 2258 C HIS A 149 2.262 36.091 -11.399 1.00 45.53 C ATOM 2259 O HIS A 149 2.518 35.443 -12.420 1.00 60.31 O ATOM 2260 CB HIS A 149 4.718 36.701 -10.939 1.00 42.40 C ATOM 2261 CG HIS A 149 4.723 38.072 -11.588 1.00 43.33 C ATOM 2262 ND1 HIS A 149 5.234 39.195 -10.972 1.00 14.01 N ATOM 2263 CD2 HIS A 149 4.309 38.486 -12.814 1.00 71.34 C ATOM 2264 CE1 HIS A 149 5.123 40.232 -11.775 1.00 41.51 C ATOM 2265 NE2 HIS A 149 4.570 39.831 -12.902 1.00 45.42 N ATOM 0 H HIS A 149 4.371 34.522 -9.746 1.00 51.30 H new ATOM 0 HA HIS A 149 3.045 37.086 -9.642 1.00 62.32 H new ATOM 0 HB2 HIS A 149 5.481 36.679 -10.161 1.00 42.40 H new ATOM 0 HB3 HIS A 149 5.002 35.959 -11.686 1.00 42.40 H new ATOM 0 HD2 HIS A 149 3.858 37.871 -13.578 1.00 71.34 H new ATOM 0 HE1 HIS A 149 5.433 41.241 -11.548 1.00 41.51 H new ATOM 0 HE2 HIS A 149 4.369 40.423 -13.708 1.00 45.42 H new ATOM 2274 N HIS A 150 1.048 36.634 -11.151 1.00 24.33 N ATOM 2275 CA HIS A 150 -0.136 36.408 -12.016 1.00 53.52 C ATOM 2276 C HIS A 150 0.124 36.836 -13.486 1.00 10.35 C ATOM 2277 O HIS A 150 0.286 38.026 -13.780 1.00 51.42 O ATOM 2278 CB HIS A 150 -1.371 37.157 -11.455 1.00 10.44 C ATOM 2279 CG HIS A 150 -2.660 36.882 -12.197 1.00 34.44 C ATOM 2280 ND1 HIS A 150 -3.052 37.588 -13.320 1.00 45.52 N ATOM 2281 CD2 HIS A 150 -3.629 35.956 -11.989 1.00 24.02 C ATOM 2282 CE1 HIS A 150 -4.197 37.113 -13.763 1.00 61.41 C ATOM 2283 NE2 HIS A 150 -4.567 36.125 -12.976 1.00 73.41 N ATOM 0 H HIS A 150 0.861 37.238 -10.351 1.00 24.33 H new ATOM 0 HA HIS A 150 -0.334 35.336 -12.014 1.00 53.52 H new ATOM 0 HB2 HIS A 150 -1.503 36.882 -10.409 1.00 10.44 H new ATOM 0 HB3 HIS A 150 -1.173 38.229 -11.480 1.00 10.44 H new ATOM 0 HD2 HIS A 150 -3.657 35.224 -11.196 1.00 24.02 H new ATOM 0 HE1 HIS A 150 -4.740 37.472 -14.625 1.00 61.41 H new ATOM 0 HE2 HIS A 150 -5.417 35.572 -13.083 1.00 73.41 H new ATOM 2292 N HIS A 151 0.156 35.843 -14.390 1.00 30.31 N ATOM 2293 CA HIS A 151 0.365 36.063 -15.833 1.00 13.30 C ATOM 2294 C HIS A 151 -0.921 36.656 -16.470 1.00 71.04 C ATOM 2295 O HIS A 151 -1.889 35.933 -16.730 1.00 34.24 O ATOM 2296 CB HIS A 151 0.766 34.727 -16.522 1.00 61.14 C ATOM 2297 CG HIS A 151 1.877 33.969 -15.826 1.00 60.21 C ATOM 2298 ND1 HIS A 151 2.972 34.587 -15.265 1.00 33.23 N ATOM 2299 CD2 HIS A 151 2.027 32.647 -15.554 1.00 51.23 C ATOM 2300 CE1 HIS A 151 3.747 33.689 -14.697 1.00 70.21 C ATOM 2301 NE2 HIS A 151 3.198 32.508 -14.856 1.00 12.41 N ATOM 0 H HIS A 151 0.037 34.861 -14.141 1.00 30.31 H new ATOM 0 HA HIS A 151 1.177 36.776 -15.976 1.00 13.30 H new ATOM 0 HB2 HIS A 151 -0.113 34.085 -16.580 1.00 61.14 H new ATOM 0 HB3 HIS A 151 1.074 34.939 -17.546 1.00 61.14 H new ATOM 0 HD2 HIS A 151 1.350 31.854 -15.835 1.00 51.23 H new ATOM 0 HE1 HIS A 151 4.677 33.890 -14.186 1.00 70.21 H new ATOM 0 HE2 HIS A 151 3.582 31.627 -14.514 1.00 12.41 H new ATOM 2310 N HIS A 152 -0.941 37.985 -16.656 1.00 53.51 N ATOM 2311 CA HIS A 152 -2.094 38.711 -17.246 1.00 42.51 C ATOM 2312 C HIS A 152 -1.757 39.251 -18.658 1.00 52.42 C ATOM 2313 O HIS A 152 -2.433 38.898 -19.634 1.00 42.34 O ATOM 2314 CB HIS A 152 -2.524 39.864 -16.296 1.00 53.43 C ATOM 2315 CG HIS A 152 -3.620 40.753 -16.842 1.00 12.34 C ATOM 2316 ND1 HIS A 152 -4.889 40.293 -17.124 1.00 54.30 N ATOM 2317 CD2 HIS A 152 -3.629 42.072 -17.163 1.00 60.50 C ATOM 2318 CE1 HIS A 152 -5.620 41.276 -17.608 1.00 20.33 C ATOM 2319 NE2 HIS A 152 -4.883 42.363 -17.636 1.00 13.41 N ATOM 0 H HIS A 152 -0.162 38.593 -16.404 1.00 53.51 H new ATOM 0 HA HIS A 152 -2.925 38.015 -17.358 1.00 42.51 H new ATOM 0 HB2 HIS A 152 -2.859 39.434 -15.352 1.00 53.43 H new ATOM 0 HB3 HIS A 152 -1.652 40.479 -16.074 1.00 53.43 H new ATOM 0 HD2 HIS A 152 -2.804 42.762 -17.064 1.00 60.50 H new ATOM 0 HE1 HIS A 152 -6.649 41.201 -17.927 1.00 20.33 H new ATOM 0 HE2 HIS A 152 -5.194 43.279 -17.959 1.00 13.41 H new ATOM 2328 N HIS A 153 -0.714 40.116 -18.743 1.00 63.12 N ATOM 2329 CA HIS A 153 -0.319 40.820 -19.996 1.00 74.30 C ATOM 2330 C HIS A 153 -1.466 41.701 -20.542 1.00 11.21 C ATOM 2331 O HIS A 153 -1.326 42.367 -21.574 1.00 1.32 O ATOM 2332 CB HIS A 153 0.185 39.826 -21.086 1.00 45.24 C ATOM 2333 CG HIS A 153 1.492 39.149 -20.756 1.00 62.52 C ATOM 2334 ND1 HIS A 153 2.665 39.416 -21.430 1.00 12.03 N ATOM 2335 CD2 HIS A 153 1.805 38.208 -19.828 1.00 53.35 C ATOM 2336 CE1 HIS A 153 3.635 38.677 -20.938 1.00 41.41 C ATOM 2337 NE2 HIS A 153 3.142 37.937 -19.964 1.00 52.45 N ATOM 0 H HIS A 153 -0.121 40.347 -17.946 1.00 63.12 H new ATOM 0 HA HIS A 153 0.512 41.477 -19.739 1.00 74.30 H new ATOM 0 HB2 HIS A 153 -0.576 39.062 -21.243 1.00 45.24 H new ATOM 0 HB3 HIS A 153 0.296 40.364 -22.027 1.00 45.24 H new ATOM 0 HD2 HIS A 153 1.128 37.758 -19.117 1.00 53.35 H new ATOM 0 HE1 HIS A 153 4.661 38.676 -21.274 1.00 41.41 H new ATOM 0 HE2 HIS A 153 3.671 37.270 -19.402 1.00 52.45 H new TER 2346 HIS A 153