USER MOD reduce.3.24.130724 H: found=0, std=0, add=1094, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1089 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 113 SER OG : rot 180:sc=0.000647 USER MOD Set 1.2: A 114 LYS NZ :NH3+ -160:sc=-0.000333 (180deg=0) USER MOD Set 2.1: A 103 HIS : no HD1:sc= 0.612 K(o=1.6,f=-2.8) USER MOD Set 2.2: A 110 SER OG : rot 150:sc= 0.969 USER MOD Set 3.1: A 54 THR OG1 : rot 180:sc= -0.875 USER MOD Set 3.2: A 56 SER OG : rot -78:sc= 0.444 USER MOD Set 3.3: A 57 MET CE :methyl -154:sc= -3.74! (180deg=-4.57!) USER MOD Single : A 1 GLY N :NH3+ -113:sc= 0.0317 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.0017) USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -0.348 K(o=-0.35,f=-2.4!) USER MOD Single : A 29 GLN : amide:sc= -0.0375 X(o=-0.038,f=-0.3) USER MOD Single : A 30 GLN : amide:sc= -0.262 K(o=-0.26,f=-2!) USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=-0.0024) USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 35 GLN : amide:sc= -0.015 X(o=-0.015,f=-0.045) USER MOD Single : A 37 GLN : amide:sc= -0.25 K(o=-0.25,f=-2.6!) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.00605 USER MOD Single : A 40 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.218 X(o=-0.22,f=-0.67) USER MOD Single : A 42 GLN : amide:sc= -0.069 K(o=-0.069,f=-1.3!) USER MOD Single : A 46 HIS : no HD1:sc= -0.0395 X(o=-0.039,f=-0.013) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 50 GLN :FLIP amide:sc= -0.0824 F(o=-0.61,f=-0.082) USER MOD Single : A 60 SER OG : rot 60:sc= 0.808 USER MOD Single : A 64 GLN : amide:sc= -0.205 K(o=-0.2,f=-0.92) USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=-0.089) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 MET CE :methyl 151:sc= -2.83! (180deg=-3.81!) USER MOD Single : A 79 GLN : amide:sc= -0.0246 K(o=-0.025,f=-0.92) USER MOD Single : A 81 MET CE :methyl 167:sc= -0.949 (180deg=-1.13) USER MOD Single : A 82 HIS : no HD1:sc= -4.39! C(o=-4.4!,f=-7.8!) USER MOD Single : A 84 THR OG1 : rot 9:sc= 0.786 USER MOD Single : A 88 LYS NZ :NH3+ 145:sc= -2.39 (180deg=-5.21!) USER MOD Single : A 90 THR OG1 : rot -99:sc= -2.19! USER MOD Single : A 92 MET CE :methyl 132:sc= -2.28 (180deg=-5.32!) USER MOD Single : A 98 ASN : amide:sc= -0.288 K(o=-0.29,f=-2.8!) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 104 MET CE :methyl 165:sc= -6.41! (180deg=-7.63!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 126 GLN : amide:sc= -0.11 X(o=-0.11,f=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=-0.0058) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 ASN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 137 SER OG : rot 180:sc= 0.00795 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -29.570 -8.778 -77.732 1.00 0.00 N ATOM 2 CA GLY A 1 -30.622 -7.978 -77.046 1.00 0.00 C ATOM 3 C GLY A 1 -30.323 -7.767 -75.572 1.00 0.00 C ATOM 4 O GLY A 1 -29.580 -8.544 -74.971 1.00 0.00 O ATOM 0 H1 GLY A 1 -29.072 -8.179 -78.420 1.00 0.00 H new ATOM 0 H2 GLY A 1 -28.892 -9.135 -77.029 1.00 0.00 H new ATOM 0 H3 GLY A 1 -30.011 -9.580 -78.226 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -30.715 -7.009 -77.537 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -31.583 -8.482 -77.150 1.00 0.00 H new ATOM 10 N PRO A 2 -30.893 -6.715 -74.954 1.00 0.00 N ATOM 11 CA PRO A 2 -30.673 -6.419 -73.536 1.00 0.00 C ATOM 12 C PRO A 2 -31.422 -7.381 -72.620 1.00 0.00 C ATOM 13 O PRO A 2 -32.472 -7.043 -72.070 1.00 0.00 O ATOM 14 CB PRO A 2 -31.216 -4.998 -73.386 1.00 0.00 C ATOM 15 CG PRO A 2 -32.262 -4.883 -74.441 1.00 0.00 C ATOM 16 CD PRO A 2 -31.794 -5.733 -75.591 1.00 0.00 C ATOM 0 HA PRO A 2 -29.625 -6.521 -73.253 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -31.635 -4.836 -72.393 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -30.430 -4.256 -73.525 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -33.228 -5.227 -74.071 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -32.390 -3.846 -74.751 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -32.629 -6.222 -76.094 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -31.273 -5.139 -76.342 1.00 0.00 H new ATOM 24 N LEU A 3 -30.877 -8.583 -72.461 1.00 0.00 N ATOM 25 CA LEU A 3 -31.491 -9.597 -71.613 1.00 0.00 C ATOM 26 C LEU A 3 -31.122 -9.379 -70.150 1.00 0.00 C ATOM 27 O LEU A 3 -29.946 -9.405 -69.786 1.00 0.00 O ATOM 28 CB LEU A 3 -31.054 -10.994 -72.059 1.00 0.00 C ATOM 29 CG LEU A 3 -32.051 -12.114 -71.753 1.00 0.00 C ATOM 30 CD1 LEU A 3 -33.228 -12.056 -72.715 1.00 0.00 C ATOM 31 CD2 LEU A 3 -31.367 -13.470 -71.825 1.00 0.00 C ATOM 0 H LEU A 3 -30.010 -8.878 -72.909 1.00 0.00 H new ATOM 0 HA LEU A 3 -32.573 -9.512 -71.712 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -30.871 -10.975 -73.133 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -30.105 -11.232 -71.578 1.00 0.00 H new ATOM 0 HG LEU A 3 -32.428 -11.974 -70.740 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -33.927 -12.859 -72.483 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -33.733 -11.095 -72.615 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -32.868 -12.172 -73.737 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -32.091 -14.255 -71.605 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -30.962 -13.620 -72.826 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -30.557 -13.508 -71.096 1.00 0.00 H new ATOM 43 N GLY A 4 -32.133 -9.161 -69.315 1.00 0.00 N ATOM 44 CA GLY A 4 -31.893 -8.939 -67.901 1.00 0.00 C ATOM 45 C GLY A 4 -31.979 -10.216 -67.089 1.00 0.00 C ATOM 46 O GLY A 4 -32.531 -10.225 -65.990 1.00 0.00 O ATOM 0 H GLY A 4 -33.114 -9.134 -69.592 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -30.907 -8.494 -67.769 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -32.620 -8.221 -67.521 1.00 0.00 H new ATOM 50 N SER A 5 -31.427 -11.298 -67.631 1.00 0.00 N ATOM 51 CA SER A 5 -31.442 -12.587 -66.950 1.00 0.00 C ATOM 52 C SER A 5 -30.214 -12.748 -66.059 1.00 0.00 C ATOM 53 O SER A 5 -29.159 -13.189 -66.514 1.00 0.00 O ATOM 54 CB SER A 5 -31.499 -13.725 -67.970 1.00 0.00 C ATOM 55 OG SER A 5 -32.739 -13.736 -68.655 1.00 0.00 O ATOM 0 H SER A 5 -30.964 -11.307 -68.540 1.00 0.00 H new ATOM 0 HA SER A 5 -32.331 -12.626 -66.321 1.00 0.00 H new ATOM 0 HB2 SER A 5 -30.685 -13.616 -68.687 1.00 0.00 H new ATOM 0 HB3 SER A 5 -31.352 -14.679 -67.464 1.00 0.00 H new ATOM 0 HG SER A 5 -32.749 -14.472 -69.302 1.00 0.00 H new ATOM 61 N ALA A 6 -30.363 -12.389 -64.787 1.00 0.00 N ATOM 62 CA ALA A 6 -29.268 -12.495 -63.830 1.00 0.00 C ATOM 63 C ALA A 6 -29.737 -13.148 -62.534 1.00 0.00 C ATOM 64 O ALA A 6 -30.348 -12.499 -61.685 1.00 0.00 O ATOM 65 CB ALA A 6 -28.679 -11.120 -63.548 1.00 0.00 C ATOM 0 H ALA A 6 -31.231 -12.023 -64.396 1.00 0.00 H new ATOM 0 HA ALA A 6 -28.494 -13.126 -64.266 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -27.863 -11.214 -62.832 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -28.301 -10.689 -64.475 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -29.451 -10.471 -63.135 1.00 0.00 H new ATOM 71 N ALA A 7 -29.450 -14.439 -62.390 1.00 0.00 N ATOM 72 CA ALA A 7 -29.848 -15.183 -61.200 1.00 0.00 C ATOM 73 C ALA A 7 -28.629 -15.658 -60.415 1.00 0.00 C ATOM 74 O ALA A 7 -27.494 -15.531 -60.875 1.00 0.00 O ATOM 75 CB ALA A 7 -30.722 -16.365 -61.586 1.00 0.00 C ATOM 0 H ALA A 7 -28.944 -14.991 -63.082 1.00 0.00 H new ATOM 0 HA ALA A 7 -30.422 -14.514 -60.559 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -31.012 -16.912 -60.689 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -31.615 -16.005 -62.096 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -30.166 -17.027 -62.250 1.00 0.00 H new ATOM 81 N ALA A 8 -28.873 -16.207 -59.228 1.00 0.00 N ATOM 82 CA ALA A 8 -27.796 -16.702 -58.378 1.00 0.00 C ATOM 83 C ALA A 8 -28.003 -18.175 -58.035 1.00 0.00 C ATOM 84 O ALA A 8 -29.136 -18.648 -57.944 1.00 0.00 O ATOM 85 CB ALA A 8 -27.700 -15.870 -57.109 1.00 0.00 C ATOM 0 H ALA A 8 -29.807 -16.320 -58.834 1.00 0.00 H new ATOM 0 HA ALA A 8 -26.860 -16.611 -58.928 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -26.892 -16.251 -56.484 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -27.498 -14.831 -57.370 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -28.641 -15.931 -56.562 1.00 0.00 H new ATOM 91 N ALA A 9 -26.900 -18.892 -57.844 1.00 0.00 N ATOM 92 CA ALA A 9 -26.957 -20.311 -57.509 1.00 0.00 C ATOM 93 C ALA A 9 -25.945 -20.658 -56.421 1.00 0.00 C ATOM 94 O ALA A 9 -25.494 -19.785 -55.680 1.00 0.00 O ATOM 95 CB ALA A 9 -26.718 -21.156 -58.752 1.00 0.00 C ATOM 0 H ALA A 9 -25.955 -18.514 -57.915 1.00 0.00 H new ATOM 0 HA ALA A 9 -27.952 -20.531 -57.123 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -26.763 -22.213 -58.488 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -27.484 -20.935 -59.495 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -25.735 -20.927 -59.164 1.00 0.00 H new ATOM 101 N THR A 10 -25.596 -21.939 -56.328 1.00 0.00 N ATOM 102 CA THR A 10 -24.637 -22.403 -55.330 1.00 0.00 C ATOM 103 C THR A 10 -23.304 -21.665 -55.467 1.00 0.00 C ATOM 104 O THR A 10 -22.941 -21.229 -56.559 1.00 0.00 O ATOM 105 CB THR A 10 -24.413 -23.910 -55.475 1.00 0.00 C ATOM 106 OG1 THR A 10 -23.771 -24.204 -56.704 1.00 0.00 O ATOM 107 CG2 THR A 10 -25.692 -24.715 -55.418 1.00 0.00 C ATOM 0 H THR A 10 -25.963 -22.674 -56.932 1.00 0.00 H new ATOM 0 HA THR A 10 -25.048 -22.193 -54.342 1.00 0.00 H new ATOM 0 HB THR A 10 -23.790 -24.193 -54.626 1.00 0.00 H new ATOM 0 HG1 THR A 10 -23.634 -25.172 -56.778 1.00 0.00 H new ATOM 0 HG21 THR A 10 -25.460 -25.774 -55.527 1.00 0.00 H new ATOM 0 HG22 THR A 10 -26.185 -24.548 -54.460 1.00 0.00 H new ATOM 0 HG23 THR A 10 -26.354 -24.403 -56.226 1.00 0.00 H new ATOM 115 N PRO A 11 -22.553 -21.512 -54.358 1.00 0.00 N ATOM 116 CA PRO A 11 -22.945 -22.020 -53.039 1.00 0.00 C ATOM 117 C PRO A 11 -23.926 -21.095 -52.326 1.00 0.00 C ATOM 118 O PRO A 11 -24.368 -21.383 -51.214 1.00 0.00 O ATOM 119 CB PRO A 11 -21.617 -22.070 -52.289 1.00 0.00 C ATOM 120 CG PRO A 11 -20.816 -20.957 -52.874 1.00 0.00 C ATOM 121 CD PRO A 11 -21.244 -20.833 -54.315 1.00 0.00 C ATOM 0 HA PRO A 11 -23.460 -22.979 -53.101 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -21.761 -21.935 -51.217 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -21.120 -23.031 -52.425 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -20.994 -20.026 -52.335 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -19.749 -21.168 -52.803 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -21.326 -19.789 -54.619 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -20.527 -21.305 -54.986 1.00 0.00 H new ATOM 129 N ALA A 12 -24.259 -19.983 -52.974 1.00 0.00 N ATOM 130 CA ALA A 12 -25.189 -19.015 -52.403 1.00 0.00 C ATOM 131 C ALA A 12 -26.610 -19.568 -52.374 1.00 0.00 C ATOM 132 O ALA A 12 -27.378 -19.385 -53.319 1.00 0.00 O ATOM 133 CB ALA A 12 -25.141 -17.713 -53.187 1.00 0.00 C ATOM 0 H ALA A 12 -23.899 -19.730 -53.894 1.00 0.00 H new ATOM 0 HA ALA A 12 -24.885 -18.818 -51.375 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -25.840 -16.999 -52.750 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -24.132 -17.302 -53.149 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -25.417 -17.903 -54.224 1.00 0.00 H new ATOM 139 N VAL A 13 -26.952 -20.247 -51.282 1.00 0.00 N ATOM 140 CA VAL A 13 -28.282 -20.829 -51.129 1.00 0.00 C ATOM 141 C VAL A 13 -29.262 -19.811 -50.553 1.00 0.00 C ATOM 142 O VAL A 13 -28.907 -19.020 -49.679 1.00 0.00 O ATOM 143 CB VAL A 13 -28.252 -22.069 -50.215 1.00 0.00 C ATOM 144 CG1 VAL A 13 -29.563 -22.835 -50.309 1.00 0.00 C ATOM 145 CG2 VAL A 13 -27.077 -22.968 -50.571 1.00 0.00 C ATOM 0 H VAL A 13 -26.328 -20.407 -50.492 1.00 0.00 H new ATOM 0 HA VAL A 13 -28.613 -21.129 -52.123 1.00 0.00 H new ATOM 0 HB VAL A 13 -28.126 -21.734 -49.186 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -29.522 -23.707 -49.656 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -30.385 -22.189 -50.000 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -29.722 -23.159 -51.338 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -27.073 -23.838 -49.915 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -27.170 -23.295 -51.607 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -26.146 -22.416 -50.447 1.00 0.00 H new ATOM 155 N ARG A 14 -30.495 -19.837 -51.049 1.00 0.00 N ATOM 156 CA ARG A 14 -31.526 -18.915 -50.587 1.00 0.00 C ATOM 157 C ARG A 14 -31.949 -19.244 -49.159 1.00 0.00 C ATOM 158 O ARG A 14 -32.229 -20.398 -48.834 1.00 0.00 O ATOM 159 CB ARG A 14 -32.742 -18.971 -51.514 1.00 0.00 C ATOM 160 CG ARG A 14 -33.778 -17.897 -51.224 1.00 0.00 C ATOM 161 CD ARG A 14 -33.804 -16.839 -52.315 1.00 0.00 C ATOM 162 NE ARG A 14 -35.167 -16.494 -52.709 1.00 0.00 N ATOM 163 CZ ARG A 14 -35.611 -15.245 -52.816 1.00 0.00 C ATOM 164 NH1 ARG A 14 -34.801 -14.226 -52.559 1.00 0.00 N ATOM 165 NH2 ARG A 14 -36.865 -15.014 -53.180 1.00 0.00 N ATOM 0 H ARG A 14 -30.804 -20.487 -51.771 1.00 0.00 H new ATOM 0 HA ARG A 14 -31.110 -17.908 -50.602 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -32.406 -18.871 -52.546 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -33.212 -19.951 -51.425 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -34.763 -18.355 -51.136 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -33.558 -17.427 -50.265 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -33.290 -15.944 -51.964 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -33.256 -17.201 -53.185 1.00 0.00 H new ATOM 0 HE ARG A 14 -35.815 -17.254 -52.914 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -33.836 -14.400 -52.279 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -35.144 -13.269 -52.642 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -37.491 -15.795 -53.378 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -37.204 -14.055 -53.262 1.00 0.00 H new ATOM 179 N THR A 15 -31.990 -18.222 -48.309 1.00 0.00 N ATOM 180 CA THR A 15 -32.376 -18.400 -46.914 1.00 0.00 C ATOM 181 C THR A 15 -33.831 -17.997 -46.693 1.00 0.00 C ATOM 182 O THR A 15 -34.123 -16.861 -46.321 1.00 0.00 O ATOM 183 CB THR A 15 -31.462 -17.580 -46.002 1.00 0.00 C ATOM 184 OG1 THR A 15 -30.181 -17.422 -46.588 1.00 0.00 O ATOM 185 CG2 THR A 15 -31.269 -18.196 -44.635 1.00 0.00 C ATOM 0 H THR A 15 -31.760 -17.261 -48.563 1.00 0.00 H new ATOM 0 HA THR A 15 -32.271 -19.457 -46.667 1.00 0.00 H new ATOM 0 HB THR A 15 -31.963 -16.620 -45.880 1.00 0.00 H new ATOM 0 HG1 THR A 15 -29.611 -16.894 -45.991 1.00 0.00 H new ATOM 0 HG21 THR A 15 -30.610 -17.563 -44.040 1.00 0.00 H new ATOM 0 HG22 THR A 15 -32.234 -18.285 -44.136 1.00 0.00 H new ATOM 0 HG23 THR A 15 -30.823 -19.185 -44.741 1.00 0.00 H new ATOM 193 N VAL A 16 -34.741 -18.940 -46.925 1.00 0.00 N ATOM 194 CA VAL A 16 -36.167 -18.688 -46.750 1.00 0.00 C ATOM 195 C VAL A 16 -36.675 -19.309 -45.445 1.00 0.00 C ATOM 196 O VAL A 16 -36.369 -20.462 -45.143 1.00 0.00 O ATOM 197 CB VAL A 16 -36.985 -19.244 -47.936 1.00 0.00 C ATOM 198 CG1 VAL A 16 -36.722 -20.731 -48.120 1.00 0.00 C ATOM 199 CG2 VAL A 16 -38.471 -18.978 -47.742 1.00 0.00 C ATOM 0 H VAL A 16 -34.515 -19.885 -47.235 1.00 0.00 H new ATOM 0 HA VAL A 16 -36.301 -17.607 -46.708 1.00 0.00 H new ATOM 0 HB VAL A 16 -36.665 -18.727 -48.841 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -37.308 -21.103 -48.961 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -35.662 -20.891 -48.317 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -37.007 -21.266 -47.214 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -39.026 -19.379 -48.590 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -38.810 -19.461 -46.825 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -38.642 -17.904 -47.671 1.00 0.00 H new ATOM 209 N PRO A 17 -37.445 -18.548 -44.640 1.00 0.00 N ATOM 210 CA PRO A 17 -37.837 -17.168 -44.958 1.00 0.00 C ATOM 211 C PRO A 17 -36.691 -16.178 -44.774 1.00 0.00 C ATOM 212 O PRO A 17 -35.850 -16.342 -43.891 1.00 0.00 O ATOM 213 CB PRO A 17 -38.954 -16.881 -43.955 1.00 0.00 C ATOM 214 CG PRO A 17 -38.641 -17.752 -42.789 1.00 0.00 C ATOM 215 CD PRO A 17 -38.012 -18.997 -43.354 1.00 0.00 C ATOM 0 HA PRO A 17 -38.138 -17.061 -46.000 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -38.972 -15.829 -43.671 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -39.933 -17.115 -44.374 1.00 0.00 H new ATOM 0 HG2 PRO A 17 -37.962 -17.251 -42.100 1.00 0.00 H new ATOM 0 HG3 PRO A 17 -39.544 -17.992 -42.228 1.00 0.00 H new ATOM 0 HD2 PRO A 17 -37.241 -19.392 -42.692 1.00 0.00 H new ATOM 0 HD3 PRO A 17 -38.748 -19.789 -43.495 1.00 0.00 H new ATOM 223 N GLN A 18 -36.666 -15.150 -45.618 1.00 0.00 N ATOM 224 CA GLN A 18 -35.627 -14.129 -45.553 1.00 0.00 C ATOM 225 C GLN A 18 -35.803 -13.252 -44.318 1.00 0.00 C ATOM 226 O GLN A 18 -36.872 -12.684 -44.096 1.00 0.00 O ATOM 227 CB GLN A 18 -35.656 -13.264 -46.814 1.00 0.00 C ATOM 228 CG GLN A 18 -34.399 -13.374 -47.661 1.00 0.00 C ATOM 229 CD GLN A 18 -33.865 -12.022 -48.091 1.00 0.00 C ATOM 230 OE1 GLN A 18 -34.582 -11.222 -48.691 1.00 0.00 O ATOM 231 NE2 GLN A 18 -32.600 -11.760 -47.785 1.00 0.00 N ATOM 0 H GLN A 18 -37.355 -15.003 -46.356 1.00 0.00 H new ATOM 0 HA GLN A 18 -34.662 -14.631 -45.486 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -36.517 -13.549 -47.419 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -35.799 -12.223 -46.526 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -33.630 -13.901 -47.096 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -34.613 -13.974 -48.546 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -32.042 -12.453 -47.286 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -32.186 -10.866 -48.049 1.00 0.00 H new ATOM 240 N TYR A 19 -34.746 -13.144 -43.520 1.00 0.00 N ATOM 241 CA TYR A 19 -34.782 -12.332 -42.309 1.00 0.00 C ATOM 242 C TYR A 19 -34.640 -10.851 -42.646 1.00 0.00 C ATOM 243 O TYR A 19 -34.539 -10.479 -43.815 1.00 0.00 O ATOM 244 CB TYR A 19 -33.671 -12.761 -41.350 1.00 0.00 C ATOM 245 CG TYR A 19 -34.178 -13.399 -40.077 1.00 0.00 C ATOM 246 CD1 TYR A 19 -34.702 -14.686 -40.082 1.00 0.00 C ATOM 247 CD2 TYR A 19 -34.134 -12.714 -38.869 1.00 0.00 C ATOM 248 CE1 TYR A 19 -35.167 -15.272 -38.921 1.00 0.00 C ATOM 249 CE2 TYR A 19 -34.597 -13.293 -37.703 1.00 0.00 C ATOM 250 CZ TYR A 19 -35.112 -14.572 -37.734 1.00 0.00 C ATOM 251 OH TYR A 19 -35.574 -15.152 -36.576 1.00 0.00 O ATOM 0 H TYR A 19 -33.854 -13.608 -43.690 1.00 0.00 H new ATOM 0 HA TYR A 19 -35.746 -12.485 -41.825 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -33.014 -13.464 -41.861 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -33.068 -11.890 -41.094 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -34.746 -15.237 -41.010 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -33.731 -11.712 -38.841 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -35.572 -16.273 -38.943 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -34.556 -12.747 -36.772 1.00 0.00 H new ATOM 0 HH TYR A 19 -35.463 -14.527 -35.830 1.00 0.00 H new ATOM 261 N LYS A 20 -34.635 -10.012 -41.616 1.00 0.00 N ATOM 262 CA LYS A 20 -34.506 -8.571 -41.805 1.00 0.00 C ATOM 263 C LYS A 20 -33.057 -8.186 -42.079 1.00 0.00 C ATOM 264 O LYS A 20 -32.135 -8.712 -41.454 1.00 0.00 O ATOM 265 CB LYS A 20 -35.019 -7.824 -40.572 1.00 0.00 C ATOM 266 CG LYS A 20 -36.456 -8.162 -40.208 1.00 0.00 C ATOM 267 CD LYS A 20 -36.720 -7.948 -38.727 1.00 0.00 C ATOM 268 CE LYS A 20 -36.358 -9.179 -37.912 1.00 0.00 C ATOM 269 NZ LYS A 20 -37.529 -10.076 -37.709 1.00 0.00 N ATOM 0 H LYS A 20 -34.719 -10.304 -40.642 1.00 0.00 H new ATOM 0 HA LYS A 20 -35.108 -8.289 -42.669 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -34.375 -8.055 -39.724 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -34.941 -6.751 -40.749 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -37.136 -7.543 -40.793 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -36.664 -9.199 -40.470 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -36.143 -7.094 -38.373 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -37.772 -7.707 -38.575 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -35.564 -9.728 -38.418 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -35.965 -8.870 -36.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -37.240 -10.903 -37.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -38.278 -9.560 -37.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -37.889 -10.392 -38.632 1.00 0.00 H new ATOM 283 N TYR A 21 -32.862 -7.262 -43.016 1.00 0.00 N ATOM 284 CA TYR A 21 -31.524 -6.802 -43.372 1.00 0.00 C ATOM 285 C TYR A 21 -30.874 -6.065 -42.205 1.00 0.00 C ATOM 286 O TYR A 21 -31.111 -4.874 -42.002 1.00 0.00 O ATOM 287 CB TYR A 21 -31.587 -5.887 -44.596 1.00 0.00 C ATOM 288 CG TYR A 21 -31.047 -6.519 -45.859 1.00 0.00 C ATOM 289 CD1 TYR A 21 -29.685 -6.739 -46.023 1.00 0.00 C ATOM 290 CD2 TYR A 21 -31.900 -6.894 -46.890 1.00 0.00 C ATOM 291 CE1 TYR A 21 -29.188 -7.316 -47.177 1.00 0.00 C ATOM 292 CE2 TYR A 21 -31.411 -7.472 -48.047 1.00 0.00 C ATOM 293 CZ TYR A 21 -30.055 -7.681 -48.185 1.00 0.00 C ATOM 294 OH TYR A 21 -29.565 -8.255 -49.336 1.00 0.00 O ATOM 0 H TYR A 21 -33.614 -6.817 -43.542 1.00 0.00 H new ATOM 0 HA TYR A 21 -30.917 -7.676 -43.610 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -32.622 -5.590 -44.763 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -31.025 -4.977 -44.387 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -29.003 -6.454 -45.236 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -32.963 -6.731 -46.786 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -28.126 -7.480 -47.288 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -32.088 -7.758 -48.839 1.00 0.00 H new ATOM 0 HH TYR A 21 -30.307 -8.453 -49.944 1.00 0.00 H new ATOM 304 N ALA A 22 -30.055 -6.781 -41.442 1.00 0.00 N ATOM 305 CA ALA A 22 -29.373 -6.197 -40.293 1.00 0.00 C ATOM 306 C ALA A 22 -28.021 -5.615 -40.695 1.00 0.00 C ATOM 307 O ALA A 22 -27.752 -4.435 -40.472 1.00 0.00 O ATOM 308 CB ALA A 22 -29.198 -7.237 -39.197 1.00 0.00 C ATOM 0 H ALA A 22 -29.847 -7.767 -41.599 1.00 0.00 H new ATOM 0 HA ALA A 22 -29.990 -5.384 -39.910 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -28.687 -6.786 -38.346 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -30.176 -7.602 -38.882 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -28.605 -8.069 -39.576 1.00 0.00 H new ATOM 314 N ALA A 23 -27.175 -6.453 -41.286 1.00 0.00 N ATOM 315 CA ALA A 23 -25.850 -6.024 -41.718 1.00 0.00 C ATOM 316 C ALA A 23 -25.939 -5.050 -42.887 1.00 0.00 C ATOM 317 O ALA A 23 -26.245 -5.442 -44.013 1.00 0.00 O ATOM 318 CB ALA A 23 -25.004 -7.231 -42.098 1.00 0.00 C ATOM 0 H ALA A 23 -27.384 -7.433 -41.477 1.00 0.00 H new ATOM 0 HA ALA A 23 -25.375 -5.506 -40.885 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -24.017 -6.897 -42.419 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -24.902 -7.890 -41.236 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -25.486 -7.772 -42.912 1.00 0.00 H new ATOM 324 N GLY A 24 -25.667 -3.778 -42.612 1.00 0.00 N ATOM 325 CA GLY A 24 -25.716 -2.766 -43.651 1.00 0.00 C ATOM 326 C GLY A 24 -24.335 -2.304 -44.073 1.00 0.00 C ATOM 327 O GLY A 24 -23.838 -2.696 -45.129 1.00 0.00 O ATOM 0 H GLY A 24 -25.413 -3.430 -41.687 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -26.244 -3.164 -44.518 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -26.289 -1.910 -43.294 1.00 0.00 H new ATOM 331 N VAL A 25 -23.714 -1.474 -43.243 1.00 0.00 N ATOM 332 CA VAL A 25 -22.378 -0.962 -43.529 1.00 0.00 C ATOM 333 C VAL A 25 -21.324 -1.704 -42.715 1.00 0.00 C ATOM 334 O VAL A 25 -21.336 -1.667 -41.485 1.00 0.00 O ATOM 335 CB VAL A 25 -22.274 0.546 -43.230 1.00 0.00 C ATOM 336 CG1 VAL A 25 -20.999 1.122 -43.827 1.00 0.00 C ATOM 337 CG2 VAL A 25 -23.498 1.284 -43.751 1.00 0.00 C ATOM 0 H VAL A 25 -24.114 -1.141 -42.366 1.00 0.00 H new ATOM 0 HA VAL A 25 -22.198 -1.124 -44.592 1.00 0.00 H new ATOM 0 HB VAL A 25 -22.235 0.680 -42.149 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -20.943 2.188 -43.606 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -20.135 0.616 -43.397 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -21.004 0.975 -44.907 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -23.404 2.347 -43.529 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -23.576 1.144 -44.829 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -24.393 0.891 -43.268 1.00 0.00 H new ATOM 347 N ARG A 26 -20.414 -2.382 -43.410 1.00 0.00 N ATOM 348 CA ARG A 26 -19.355 -3.137 -42.751 1.00 0.00 C ATOM 349 C ARG A 26 -18.286 -2.204 -42.188 1.00 0.00 C ATOM 350 O ARG A 26 -17.255 -1.974 -42.820 1.00 0.00 O ATOM 351 CB ARG A 26 -18.720 -4.127 -43.730 1.00 0.00 C ATOM 352 CG ARG A 26 -19.725 -5.050 -44.400 1.00 0.00 C ATOM 353 CD ARG A 26 -19.100 -5.807 -45.561 1.00 0.00 C ATOM 354 NE ARG A 26 -18.487 -4.906 -46.533 1.00 0.00 N ATOM 355 CZ ARG A 26 -18.891 -4.799 -47.796 1.00 0.00 C ATOM 356 NH1 ARG A 26 -19.903 -5.535 -48.239 1.00 0.00 N ATOM 357 NH2 ARG A 26 -18.281 -3.957 -48.618 1.00 0.00 N ATOM 0 H ARG A 26 -20.390 -2.423 -44.429 1.00 0.00 H new ATOM 0 HA ARG A 26 -19.800 -3.689 -41.923 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -18.182 -3.571 -44.498 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -17.984 -4.730 -43.198 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -20.113 -5.759 -43.669 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -20.573 -4.467 -44.759 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -18.347 -6.497 -45.181 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -19.863 -6.409 -46.055 1.00 0.00 H new ATOM 0 HE ARG A 26 -17.706 -4.326 -46.227 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -20.374 -6.186 -47.610 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -20.210 -5.450 -49.208 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -17.502 -3.391 -48.282 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -18.591 -3.875 -49.586 1.00 0.00 H new ATOM 371 N ASN A 27 -18.539 -1.674 -40.995 1.00 0.00 N ATOM 372 CA ASN A 27 -17.594 -0.772 -40.344 1.00 0.00 C ATOM 373 C ASN A 27 -16.632 -1.540 -39.433 1.00 0.00 C ATOM 374 O ASN A 27 -15.416 -1.376 -39.538 1.00 0.00 O ATOM 375 CB ASN A 27 -18.338 0.300 -39.542 1.00 0.00 C ATOM 376 CG ASN A 27 -18.266 1.667 -40.193 1.00 0.00 C ATOM 377 OD1 ASN A 27 -17.401 1.926 -41.029 1.00 0.00 O ATOM 378 ND2 ASN A 27 -19.179 2.553 -39.810 1.00 0.00 N ATOM 0 H ASN A 27 -19.389 -1.853 -40.460 1.00 0.00 H new ATOM 0 HA ASN A 27 -17.008 -0.285 -41.124 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -19.382 0.008 -39.433 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -17.916 0.356 -38.539 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -19.180 3.490 -40.212 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -19.878 2.296 -39.114 1.00 0.00 H new ATOM 385 N PRO A 28 -17.150 -2.395 -38.523 1.00 0.00 N ATOM 386 CA PRO A 28 -16.303 -3.175 -37.614 1.00 0.00 C ATOM 387 C PRO A 28 -15.585 -4.312 -38.331 1.00 0.00 C ATOM 388 O PRO A 28 -16.164 -5.374 -38.568 1.00 0.00 O ATOM 389 CB PRO A 28 -17.296 -3.727 -36.591 1.00 0.00 C ATOM 390 CG PRO A 28 -18.583 -3.821 -37.332 1.00 0.00 C ATOM 391 CD PRO A 28 -18.587 -2.675 -38.307 1.00 0.00 C ATOM 0 HA PRO A 28 -15.510 -2.571 -37.172 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -16.981 -4.702 -36.218 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -17.383 -3.068 -35.727 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -18.665 -4.775 -37.852 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -19.431 -3.756 -36.650 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -19.087 -2.943 -39.238 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -19.108 -1.807 -37.903 1.00 0.00 H new ATOM 399 N GLN A 29 -14.323 -4.083 -38.682 1.00 0.00 N ATOM 400 CA GLN A 29 -13.530 -5.089 -39.379 1.00 0.00 C ATOM 401 C GLN A 29 -12.768 -5.965 -38.387 1.00 0.00 C ATOM 402 O GLN A 29 -13.226 -7.049 -38.026 1.00 0.00 O ATOM 403 CB GLN A 29 -12.549 -4.423 -40.351 1.00 0.00 C ATOM 404 CG GLN A 29 -12.970 -3.031 -40.795 1.00 0.00 C ATOM 405 CD GLN A 29 -11.868 -2.005 -40.618 1.00 0.00 C ATOM 406 OE1 GLN A 29 -10.693 -2.292 -40.853 1.00 0.00 O ATOM 407 NE2 GLN A 29 -12.241 -0.800 -40.204 1.00 0.00 N ATOM 0 H GLN A 29 -13.829 -3.211 -38.495 1.00 0.00 H new ATOM 0 HA GLN A 29 -14.213 -5.721 -39.946 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -11.569 -4.362 -39.878 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -12.439 -5.056 -41.231 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -13.267 -3.062 -41.843 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -13.845 -2.721 -40.224 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -13.225 -0.606 -40.021 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -11.543 -0.069 -40.069 1.00 0.00 H new ATOM 416 N GLN A 30 -11.603 -5.490 -37.954 1.00 0.00 N ATOM 417 CA GLN A 30 -10.779 -6.233 -37.006 1.00 0.00 C ATOM 418 C GLN A 30 -10.953 -5.691 -35.590 1.00 0.00 C ATOM 419 O GLN A 30 -11.886 -4.937 -35.313 1.00 0.00 O ATOM 420 CB GLN A 30 -9.306 -6.161 -37.416 1.00 0.00 C ATOM 421 CG GLN A 30 -8.765 -7.469 -37.971 1.00 0.00 C ATOM 422 CD GLN A 30 -8.084 -7.295 -39.315 1.00 0.00 C ATOM 423 OE1 GLN A 30 -7.735 -6.183 -39.709 1.00 0.00 O ATOM 424 NE2 GLN A 30 -7.891 -8.401 -40.026 1.00 0.00 N ATOM 0 H GLN A 30 -11.209 -4.595 -38.244 1.00 0.00 H new ATOM 0 HA GLN A 30 -11.103 -7.274 -37.018 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -9.184 -5.379 -38.166 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -8.710 -5.869 -36.551 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -8.056 -7.895 -37.261 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -9.583 -8.183 -38.072 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -8.197 -9.303 -39.660 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -7.437 -8.348 -40.938 1.00 0.00 H new ATOM 433 N HIS A 31 -10.047 -6.081 -34.698 1.00 0.00 N ATOM 434 CA HIS A 31 -10.097 -5.635 -33.310 1.00 0.00 C ATOM 435 C HIS A 31 -8.697 -5.563 -32.710 1.00 0.00 C ATOM 436 O HIS A 31 -8.537 -5.479 -31.491 1.00 0.00 O ATOM 437 CB HIS A 31 -10.973 -6.577 -32.482 1.00 0.00 C ATOM 438 CG HIS A 31 -12.244 -5.946 -32.004 1.00 0.00 C ATOM 439 ND1 HIS A 31 -13.445 -6.196 -32.624 1.00 0.00 N ATOM 440 CD2 HIS A 31 -12.447 -5.092 -30.972 1.00 0.00 C ATOM 441 CE1 HIS A 31 -14.347 -5.494 -31.962 1.00 0.00 C ATOM 442 NE2 HIS A 31 -13.789 -4.809 -30.954 1.00 0.00 N ATOM 0 H HIS A 31 -9.269 -6.705 -34.912 1.00 0.00 H new ATOM 0 HA HIS A 31 -10.531 -4.635 -33.291 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -11.215 -7.455 -33.081 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -10.404 -6.926 -31.621 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -11.698 -4.709 -30.295 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -15.400 -5.474 -32.202 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -14.271 -4.194 -30.298 1.00 0.00 H new ATOM 450 N LEU A 32 -7.684 -5.594 -33.572 1.00 0.00 N ATOM 451 CA LEU A 32 -6.297 -5.532 -33.126 1.00 0.00 C ATOM 452 C LEU A 32 -5.793 -4.091 -33.112 1.00 0.00 C ATOM 453 O LEU A 32 -5.692 -3.469 -32.055 1.00 0.00 O ATOM 454 CB LEU A 32 -5.407 -6.384 -34.033 1.00 0.00 C ATOM 455 CG LEU A 32 -5.774 -7.868 -34.093 1.00 0.00 C ATOM 456 CD1 LEU A 32 -6.118 -8.274 -35.518 1.00 0.00 C ATOM 457 CD2 LEU A 32 -4.635 -8.721 -33.554 1.00 0.00 C ATOM 0 H LEU A 32 -7.799 -5.662 -34.583 1.00 0.00 H new ATOM 0 HA LEU A 32 -6.252 -5.925 -32.110 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -5.446 -5.975 -35.043 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -4.376 -6.294 -33.692 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.651 -8.032 -33.468 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -6.377 -9.333 -35.542 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -6.965 -7.685 -35.870 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -5.259 -8.095 -36.165 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -4.913 -9.774 -33.604 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -3.740 -8.553 -34.153 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -4.435 -8.448 -32.518 1.00 0.00 H new ATOM 469 N ASN A 33 -5.478 -3.569 -34.294 1.00 0.00 N ATOM 470 CA ASN A 33 -4.984 -2.202 -34.419 1.00 0.00 C ATOM 471 C ASN A 33 -6.072 -1.279 -34.961 1.00 0.00 C ATOM 472 O ASN A 33 -6.037 -0.876 -36.124 1.00 0.00 O ATOM 473 CB ASN A 33 -3.762 -2.162 -35.339 1.00 0.00 C ATOM 474 CG ASN A 33 -2.728 -3.209 -34.973 1.00 0.00 C ATOM 475 OD1 ASN A 33 -2.837 -4.370 -35.368 1.00 0.00 O ATOM 476 ND2 ASN A 33 -1.715 -2.802 -34.216 1.00 0.00 N ATOM 0 H ASN A 33 -5.556 -4.072 -35.178 1.00 0.00 H new ATOM 0 HA ASN A 33 -4.696 -1.853 -33.427 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -4.082 -2.316 -36.370 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -3.306 -1.173 -35.291 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -0.988 -3.462 -33.940 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -1.665 -1.830 -33.911 1.00 0.00 H new ATOM 483 N ALA A 34 -7.038 -0.948 -34.109 1.00 0.00 N ATOM 484 CA ALA A 34 -8.137 -0.075 -34.501 1.00 0.00 C ATOM 485 C ALA A 34 -7.651 1.353 -34.728 1.00 0.00 C ATOM 486 O ALA A 34 -7.013 1.948 -33.860 1.00 0.00 O ATOM 487 CB ALA A 34 -9.233 -0.099 -33.447 1.00 0.00 C ATOM 0 H ALA A 34 -7.081 -1.272 -33.143 1.00 0.00 H new ATOM 0 HA ALA A 34 -8.544 -0.447 -35.441 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -10.047 0.558 -33.754 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -9.609 -1.116 -33.336 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -8.829 0.244 -32.494 1.00 0.00 H new ATOM 493 N GLN A 35 -7.960 1.896 -35.901 1.00 0.00 N ATOM 494 CA GLN A 35 -7.564 3.256 -36.245 1.00 0.00 C ATOM 495 C GLN A 35 -8.658 4.252 -35.859 1.00 0.00 C ATOM 496 O GLN A 35 -9.826 3.882 -35.749 1.00 0.00 O ATOM 497 CB GLN A 35 -7.267 3.358 -37.743 1.00 0.00 C ATOM 498 CG GLN A 35 -6.247 2.342 -38.233 1.00 0.00 C ATOM 499 CD GLN A 35 -4.882 2.536 -37.602 1.00 0.00 C ATOM 500 OE1 GLN A 35 -4.607 2.017 -36.520 1.00 0.00 O ATOM 501 NE2 GLN A 35 -4.019 3.286 -38.275 1.00 0.00 N ATOM 0 H GLN A 35 -8.485 1.413 -36.631 1.00 0.00 H new ATOM 0 HA GLN A 35 -6.661 3.501 -35.687 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -8.195 3.225 -38.299 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -6.903 4.361 -37.965 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -6.606 1.337 -38.012 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -6.156 2.417 -39.317 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -4.289 3.697 -39.169 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -3.086 3.452 -37.899 1.00 0.00 H new ATOM 510 N PRO A 36 -8.298 5.531 -35.633 1.00 0.00 N ATOM 511 CA PRO A 36 -6.922 6.029 -35.754 1.00 0.00 C ATOM 512 C PRO A 36 -6.053 5.625 -34.567 1.00 0.00 C ATOM 513 O PRO A 36 -4.977 5.051 -34.739 1.00 0.00 O ATOM 514 CB PRO A 36 -7.083 7.558 -35.799 1.00 0.00 C ATOM 515 CG PRO A 36 -8.555 7.814 -35.863 1.00 0.00 C ATOM 516 CD PRO A 36 -9.218 6.608 -35.265 1.00 0.00 C ATOM 0 HA PRO A 36 -6.424 5.617 -36.632 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -6.644 8.023 -34.916 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -6.575 7.979 -36.667 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -8.817 8.716 -35.310 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -8.879 7.966 -36.893 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -9.327 6.698 -34.184 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -10.216 6.448 -35.674 1.00 0.00 H new ATOM 524 N GLN A 37 -6.525 5.934 -33.363 1.00 0.00 N ATOM 525 CA GLN A 37 -5.788 5.612 -32.146 1.00 0.00 C ATOM 526 C GLN A 37 -5.976 4.148 -31.763 1.00 0.00 C ATOM 527 O GLN A 37 -7.099 3.646 -31.719 1.00 0.00 O ATOM 528 CB GLN A 37 -6.247 6.513 -30.998 1.00 0.00 C ATOM 529 CG GLN A 37 -5.221 7.562 -30.603 1.00 0.00 C ATOM 530 CD GLN A 37 -4.382 7.140 -29.413 1.00 0.00 C ATOM 531 OE1 GLN A 37 -4.672 6.140 -28.755 1.00 0.00 O ATOM 532 NE2 GLN A 37 -3.333 7.904 -29.129 1.00 0.00 N ATOM 0 H GLN A 37 -7.415 6.407 -33.204 1.00 0.00 H new ATOM 0 HA GLN A 37 -4.729 5.784 -32.337 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -7.172 7.012 -31.286 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -6.475 5.894 -30.130 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -4.566 7.762 -31.451 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -5.733 8.495 -30.369 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -3.129 8.724 -29.701 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -2.731 7.671 -28.339 1.00 0.00 H new ATOM 541 N VAL A 38 -4.867 3.471 -31.479 1.00 0.00 N ATOM 542 CA VAL A 38 -4.906 2.065 -31.092 1.00 0.00 C ATOM 543 C VAL A 38 -5.265 1.913 -29.618 1.00 0.00 C ATOM 544 O VAL A 38 -5.135 2.856 -28.837 1.00 0.00 O ATOM 545 CB VAL A 38 -3.558 1.366 -31.355 1.00 0.00 C ATOM 546 CG1 VAL A 38 -3.759 -0.131 -31.541 1.00 0.00 C ATOM 547 CG2 VAL A 38 -2.865 1.970 -32.567 1.00 0.00 C ATOM 0 H VAL A 38 -3.930 3.874 -31.510 1.00 0.00 H new ATOM 0 HA VAL A 38 -5.674 1.592 -31.704 1.00 0.00 H new ATOM 0 HB VAL A 38 -2.918 1.520 -30.486 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -2.796 -0.607 -31.726 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -4.206 -0.553 -30.641 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -4.419 -0.307 -32.390 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -1.915 1.461 -32.734 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -3.500 1.852 -33.445 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -2.683 3.030 -32.391 1.00 0.00 H new ATOM 557 N THR A 39 -5.716 0.720 -29.246 1.00 0.00 N ATOM 558 CA THR A 39 -6.097 0.442 -27.866 1.00 0.00 C ATOM 559 C THR A 39 -4.977 -0.283 -27.126 1.00 0.00 C ATOM 560 O THR A 39 -5.233 -1.125 -26.264 1.00 0.00 O ATOM 561 CB THR A 39 -7.375 -0.399 -27.831 1.00 0.00 C ATOM 562 OG1 THR A 39 -7.895 -0.574 -29.138 1.00 0.00 O ATOM 563 CG2 THR A 39 -8.468 0.208 -26.979 1.00 0.00 C ATOM 0 H THR A 39 -5.827 -0.070 -29.881 1.00 0.00 H new ATOM 0 HA THR A 39 -6.280 1.393 -27.366 1.00 0.00 H new ATOM 0 HB THR A 39 -7.082 -1.352 -27.391 1.00 0.00 H new ATOM 0 HG1 THR A 39 -8.711 -1.115 -29.096 1.00 0.00 H new ATOM 0 HG21 THR A 39 -9.345 -0.438 -26.998 1.00 0.00 H new ATOM 0 HG22 THR A 39 -8.115 0.311 -25.953 1.00 0.00 H new ATOM 0 HG23 THR A 39 -8.732 1.190 -27.372 1.00 0.00 H new ATOM 571 N MET A 40 -3.737 0.051 -27.466 1.00 0.00 N ATOM 572 CA MET A 40 -2.578 -0.569 -26.834 1.00 0.00 C ATOM 573 C MET A 40 -2.072 0.278 -25.670 1.00 0.00 C ATOM 574 O MET A 40 -2.380 1.466 -25.576 1.00 0.00 O ATOM 575 CB MET A 40 -1.459 -0.771 -27.857 1.00 0.00 C ATOM 576 CG MET A 40 -1.026 0.512 -28.549 1.00 0.00 C ATOM 577 SD MET A 40 0.689 0.945 -28.201 1.00 0.00 S ATOM 578 CE MET A 40 1.551 -0.176 -29.301 1.00 0.00 C ATOM 0 H MET A 40 -3.508 0.747 -28.175 1.00 0.00 H new ATOM 0 HA MET A 40 -2.885 -1.540 -26.446 1.00 0.00 H new ATOM 0 HB2 MET A 40 -0.597 -1.213 -27.357 1.00 0.00 H new ATOM 0 HB3 MET A 40 -1.792 -1.485 -28.610 1.00 0.00 H new ATOM 0 HG2 MET A 40 -1.157 0.402 -29.625 1.00 0.00 H new ATOM 0 HG3 MET A 40 -1.674 1.328 -28.231 1.00 0.00 H new ATOM 0 HE1 MET A 40 2.626 -0.029 -29.201 1.00 0.00 H new ATOM 0 HE2 MET A 40 1.300 -1.205 -29.042 1.00 0.00 H new ATOM 0 HE3 MET A 40 1.252 0.022 -30.330 1.00 0.00 H new ATOM 588 N GLN A 41 -1.294 -0.342 -24.788 1.00 0.00 N ATOM 589 CA GLN A 41 -0.745 0.352 -23.629 1.00 0.00 C ATOM 590 C GLN A 41 0.763 0.143 -23.533 1.00 0.00 C ATOM 591 O GLN A 41 1.356 -0.553 -24.357 1.00 0.00 O ATOM 592 CB GLN A 41 -1.421 -0.139 -22.348 1.00 0.00 C ATOM 593 CG GLN A 41 -2.704 0.605 -22.014 1.00 0.00 C ATOM 594 CD GLN A 41 -2.466 2.070 -21.709 1.00 0.00 C ATOM 595 OE1 GLN A 41 -1.461 2.435 -21.098 1.00 0.00 O ATOM 596 NE2 GLN A 41 -3.392 2.921 -22.137 1.00 0.00 N ATOM 0 H GLN A 41 -1.030 -1.325 -24.854 1.00 0.00 H new ATOM 0 HA GLN A 41 -0.939 1.418 -23.750 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -1.642 -1.202 -22.448 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -0.724 -0.036 -21.517 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -3.397 0.520 -22.851 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -3.181 0.132 -21.156 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -4.209 2.575 -22.640 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -3.286 3.920 -21.963 1.00 0.00 H new ATOM 605 N GLN A 42 1.377 0.748 -22.520 1.00 0.00 N ATOM 606 CA GLN A 42 2.816 0.626 -22.315 1.00 0.00 C ATOM 607 C GLN A 42 3.209 1.057 -20.902 1.00 0.00 C ATOM 608 O GLN A 42 2.611 1.975 -20.340 1.00 0.00 O ATOM 609 CB GLN A 42 3.573 1.466 -23.345 1.00 0.00 C ATOM 610 CG GLN A 42 3.106 2.912 -23.416 1.00 0.00 C ATOM 611 CD GLN A 42 3.472 3.578 -24.729 1.00 0.00 C ATOM 612 OE1 GLN A 42 3.497 2.935 -25.779 1.00 0.00 O ATOM 613 NE2 GLN A 42 3.759 4.873 -24.676 1.00 0.00 N ATOM 0 H GLN A 42 0.900 1.327 -21.829 1.00 0.00 H new ATOM 0 HA GLN A 42 3.085 -0.423 -22.442 1.00 0.00 H new ATOM 0 HB2 GLN A 42 4.636 1.448 -23.105 1.00 0.00 H new ATOM 0 HB3 GLN A 42 3.460 1.008 -24.328 1.00 0.00 H new ATOM 0 HG2 GLN A 42 2.025 2.948 -23.283 1.00 0.00 H new ATOM 0 HG3 GLN A 42 3.547 3.474 -22.592 1.00 0.00 H new ATOM 0 HE21 GLN A 42 3.726 5.367 -23.784 1.00 0.00 H new ATOM 0 HE22 GLN A 42 4.013 5.374 -25.527 1.00 0.00 H new ATOM 622 N PRO A 43 4.224 0.401 -20.311 1.00 0.00 N ATOM 623 CA PRO A 43 4.693 0.724 -18.959 1.00 0.00 C ATOM 624 C PRO A 43 5.491 2.024 -18.919 1.00 0.00 C ATOM 625 O PRO A 43 6.721 2.011 -18.977 1.00 0.00 O ATOM 626 CB PRO A 43 5.585 -0.466 -18.606 1.00 0.00 C ATOM 627 CG PRO A 43 6.097 -0.951 -19.917 1.00 0.00 C ATOM 628 CD PRO A 43 4.993 -0.709 -20.911 1.00 0.00 C ATOM 0 HA PRO A 43 3.869 0.878 -18.263 1.00 0.00 H new ATOM 0 HB2 PRO A 43 6.401 -0.169 -17.947 1.00 0.00 H new ATOM 0 HB3 PRO A 43 5.023 -1.243 -18.087 1.00 0.00 H new ATOM 0 HG2 PRO A 43 7.003 -0.417 -20.203 1.00 0.00 H new ATOM 0 HG3 PRO A 43 6.353 -2.009 -19.868 1.00 0.00 H new ATOM 0 HD2 PRO A 43 5.387 -0.440 -21.891 1.00 0.00 H new ATOM 0 HD3 PRO A 43 4.375 -1.597 -21.049 1.00 0.00 H new ATOM 636 N ALA A 44 4.783 3.144 -18.819 1.00 0.00 N ATOM 637 CA ALA A 44 5.425 4.454 -18.777 1.00 0.00 C ATOM 638 C ALA A 44 6.062 4.711 -17.414 1.00 0.00 C ATOM 639 O ALA A 44 5.946 3.896 -16.499 1.00 0.00 O ATOM 640 CB ALA A 44 4.419 5.546 -19.107 1.00 0.00 C ATOM 0 H ALA A 44 3.765 3.172 -18.766 1.00 0.00 H new ATOM 0 HA ALA A 44 6.217 4.467 -19.526 1.00 0.00 H new ATOM 0 HB1 ALA A 44 4.912 6.518 -19.072 1.00 0.00 H new ATOM 0 HB2 ALA A 44 4.016 5.380 -20.106 1.00 0.00 H new ATOM 0 HB3 ALA A 44 3.607 5.525 -18.380 1.00 0.00 H new ATOM 646 N VAL A 45 6.740 5.849 -17.290 1.00 0.00 N ATOM 647 CA VAL A 45 7.403 6.213 -16.043 1.00 0.00 C ATOM 648 C VAL A 45 6.489 7.060 -15.162 1.00 0.00 C ATOM 649 O VAL A 45 6.950 7.739 -14.244 1.00 0.00 O ATOM 650 CB VAL A 45 8.711 6.990 -16.300 1.00 0.00 C ATOM 651 CG1 VAL A 45 9.747 6.656 -15.238 1.00 0.00 C ATOM 652 CG2 VAL A 45 9.250 6.695 -17.693 1.00 0.00 C ATOM 0 H VAL A 45 6.844 6.534 -18.038 1.00 0.00 H new ATOM 0 HA VAL A 45 7.640 5.280 -15.531 1.00 0.00 H new ATOM 0 HB VAL A 45 8.493 8.056 -16.242 1.00 0.00 H new ATOM 0 HG11 VAL A 45 10.663 7.213 -15.435 1.00 0.00 H new ATOM 0 HG12 VAL A 45 9.361 6.928 -14.255 1.00 0.00 H new ATOM 0 HG13 VAL A 45 9.960 5.587 -15.261 1.00 0.00 H new ATOM 0 HG21 VAL A 45 10.172 7.254 -17.852 1.00 0.00 H new ATOM 0 HG22 VAL A 45 9.451 5.628 -17.787 1.00 0.00 H new ATOM 0 HG23 VAL A 45 8.513 6.992 -18.439 1.00 0.00 H new ATOM 662 N HIS A 46 5.191 7.011 -15.446 1.00 0.00 N ATOM 663 CA HIS A 46 4.212 7.772 -14.678 1.00 0.00 C ATOM 664 C HIS A 46 3.873 7.061 -13.372 1.00 0.00 C ATOM 665 O HIS A 46 3.351 5.946 -13.378 1.00 0.00 O ATOM 666 CB HIS A 46 2.940 7.984 -15.501 1.00 0.00 C ATOM 667 CG HIS A 46 2.260 9.290 -15.228 1.00 0.00 C ATOM 668 ND1 HIS A 46 0.954 9.343 -14.802 1.00 0.00 N ATOM 669 CD2 HIS A 46 2.742 10.552 -15.336 1.00 0.00 C ATOM 670 CE1 HIS A 46 0.671 10.625 -14.660 1.00 0.00 C ATOM 671 NE2 HIS A 46 1.724 11.395 -14.971 1.00 0.00 N ATOM 0 H HIS A 46 4.793 6.453 -16.201 1.00 0.00 H new ATOM 0 HA HIS A 46 4.649 8.742 -14.440 1.00 0.00 H new ATOM 0 HB2 HIS A 46 3.189 7.928 -16.561 1.00 0.00 H new ATOM 0 HB3 HIS A 46 2.244 7.171 -15.294 1.00 0.00 H new ATOM 0 HD2 HIS A 46 3.735 10.838 -15.649 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -0.286 11.005 -14.335 1.00 0.00 H new ATOM 0 HE2 HIS A 46 1.761 12.414 -14.942 1.00 0.00 H new ATOM 679 N VAL A 47 4.174 7.714 -12.255 1.00 0.00 N ATOM 680 CA VAL A 47 3.904 7.146 -10.940 1.00 0.00 C ATOM 681 C VAL A 47 2.646 7.754 -10.326 1.00 0.00 C ATOM 682 O VAL A 47 1.984 8.587 -10.943 1.00 0.00 O ATOM 683 CB VAL A 47 5.088 7.364 -9.978 1.00 0.00 C ATOM 684 CG1 VAL A 47 6.279 6.517 -10.399 1.00 0.00 C ATOM 685 CG2 VAL A 47 5.465 8.837 -9.919 1.00 0.00 C ATOM 0 H VAL A 47 4.605 8.638 -12.234 1.00 0.00 H new ATOM 0 HA VAL A 47 3.755 6.076 -11.083 1.00 0.00 H new ATOM 0 HB VAL A 47 4.784 7.052 -8.979 1.00 0.00 H new ATOM 0 HG11 VAL A 47 7.106 6.683 -9.709 1.00 0.00 H new ATOM 0 HG12 VAL A 47 6.000 5.463 -10.384 1.00 0.00 H new ATOM 0 HG13 VAL A 47 6.586 6.796 -11.407 1.00 0.00 H new ATOM 0 HG21 VAL A 47 6.303 8.971 -9.235 1.00 0.00 H new ATOM 0 HG22 VAL A 47 5.750 9.180 -10.914 1.00 0.00 H new ATOM 0 HG23 VAL A 47 4.612 9.417 -9.566 1.00 0.00 H new ATOM 695 N GLN A 48 2.325 7.332 -9.106 1.00 0.00 N ATOM 696 CA GLN A 48 1.148 7.835 -8.407 1.00 0.00 C ATOM 697 C GLN A 48 1.495 9.058 -7.566 1.00 0.00 C ATOM 698 O GLN A 48 2.642 9.507 -7.549 1.00 0.00 O ATOM 699 CB GLN A 48 0.552 6.742 -7.517 1.00 0.00 C ATOM 700 CG GLN A 48 -0.693 6.095 -8.101 1.00 0.00 C ATOM 701 CD GLN A 48 -1.351 5.124 -7.140 1.00 0.00 C ATOM 702 OE1 GLN A 48 -1.741 5.496 -6.034 1.00 0.00 O ATOM 703 NE2 GLN A 48 -1.477 3.870 -7.559 1.00 0.00 N ATOM 0 H GLN A 48 2.864 6.643 -8.582 1.00 0.00 H new ATOM 0 HA GLN A 48 0.411 8.128 -9.154 1.00 0.00 H new ATOM 0 HB2 GLN A 48 1.305 5.973 -7.346 1.00 0.00 H new ATOM 0 HB3 GLN A 48 0.307 7.170 -6.545 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -1.408 6.872 -8.373 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -0.428 5.569 -9.019 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -1.139 3.605 -8.484 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -1.911 3.172 -6.955 1.00 0.00 H new ATOM 712 N GLY A 49 0.497 9.595 -6.869 1.00 0.00 N ATOM 713 CA GLY A 49 0.718 10.761 -6.033 1.00 0.00 C ATOM 714 C GLY A 49 1.228 10.400 -4.653 1.00 0.00 C ATOM 715 O GLY A 49 0.553 9.699 -3.899 1.00 0.00 O ATOM 0 H GLY A 49 -0.460 9.243 -6.869 1.00 0.00 H new ATOM 0 HA2 GLY A 49 1.435 11.422 -6.520 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -0.215 11.317 -5.938 1.00 0.00 H new ATOM 719 N GLN A 50 2.421 10.882 -4.320 1.00 0.00 N ATOM 720 CA GLN A 50 3.027 10.604 -3.024 1.00 0.00 C ATOM 721 C GLN A 50 2.563 11.610 -1.975 1.00 0.00 C ATOM 722 O GLN A 50 3.346 12.052 -1.134 1.00 0.00 O ATOM 723 CB GLN A 50 4.552 10.634 -3.139 1.00 0.00 C ATOM 724 CG GLN A 50 5.083 9.922 -4.373 1.00 0.00 C ATOM 725 CD GLN A 50 4.771 8.438 -4.371 1.00 0.00 C ATOM 726 OE1 GLN A 50 5.660 7.646 -3.785 1.00 0.00 O flip ATOM 727 NE2 GLN A 50 3.742 8.009 -4.893 1.00 0.00 N flip ATOM 0 H GLN A 50 2.988 11.469 -4.932 1.00 0.00 H new ATOM 0 HA GLN A 50 2.710 9.610 -2.708 1.00 0.00 H new ATOM 0 HB2 GLN A 50 4.886 11.671 -3.156 1.00 0.00 H new ATOM 0 HB3 GLN A 50 4.984 10.174 -2.250 1.00 0.00 H new ATOM 0 HG2 GLN A 50 4.653 10.379 -5.264 1.00 0.00 H new ATOM 0 HG3 GLN A 50 6.162 10.062 -4.432 1.00 0.00 H new ATOM 0 HE21 GLN A 50 3.086 8.654 -5.333 1.00 0.00 H new ATOM 0 HE22 GLN A 50 3.546 7.008 -4.886 1.00 0.00 H new ATOM 736 N GLU A 51 1.283 11.965 -2.029 1.00 0.00 N ATOM 737 CA GLU A 51 0.712 12.918 -1.084 1.00 0.00 C ATOM 738 C GLU A 51 0.535 12.291 0.304 1.00 0.00 C ATOM 739 O GLU A 51 0.971 12.865 1.302 1.00 0.00 O ATOM 740 CB GLU A 51 -0.630 13.445 -1.601 1.00 0.00 C ATOM 741 CG GLU A 51 -0.588 14.906 -2.023 1.00 0.00 C ATOM 742 CD GLU A 51 -0.832 15.854 -0.866 1.00 0.00 C ATOM 743 OE1 GLU A 51 -1.841 15.672 -0.152 1.00 0.00 O ATOM 744 OE2 GLU A 51 -0.015 16.780 -0.675 1.00 0.00 O ATOM 0 H GLU A 51 0.621 11.607 -2.718 1.00 0.00 H new ATOM 0 HA GLU A 51 1.408 13.751 -0.991 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.946 12.839 -2.450 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.384 13.322 -0.823 1.00 0.00 H new ATOM 0 HG2 GLU A 51 0.383 15.124 -2.468 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -1.338 15.079 -2.794 1.00 0.00 H new ATOM 751 N PRO A 52 -0.104 11.103 0.397 1.00 0.00 N ATOM 752 CA PRO A 52 -0.329 10.432 1.685 1.00 0.00 C ATOM 753 C PRO A 52 0.974 10.105 2.410 1.00 0.00 C ATOM 754 O PRO A 52 2.065 10.326 1.884 1.00 0.00 O ATOM 755 CB PRO A 52 -1.063 9.140 1.305 1.00 0.00 C ATOM 756 CG PRO A 52 -1.635 9.401 -0.045 1.00 0.00 C ATOM 757 CD PRO A 52 -0.672 10.330 -0.725 1.00 0.00 C ATOM 0 HA PRO A 52 -0.888 11.067 2.372 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -0.381 8.290 1.286 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -1.846 8.905 2.026 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -1.748 8.474 -0.608 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -2.625 9.851 0.030 1.00 0.00 H new ATOM 0 HD2 PRO A 52 0.099 9.784 -1.269 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -1.175 10.975 -1.445 1.00 0.00 H new ATOM 765 N LEU A 53 0.845 9.569 3.619 1.00 0.00 N ATOM 766 CA LEU A 53 2.000 9.196 4.429 1.00 0.00 C ATOM 767 C LEU A 53 2.723 7.993 3.830 1.00 0.00 C ATOM 768 O LEU A 53 2.090 7.024 3.408 1.00 0.00 O ATOM 769 CB LEU A 53 1.548 8.853 5.851 1.00 0.00 C ATOM 770 CG LEU A 53 2.143 9.693 6.993 1.00 0.00 C ATOM 771 CD1 LEU A 53 3.430 9.067 7.505 1.00 0.00 C ATOM 772 CD2 LEU A 53 2.381 11.133 6.567 1.00 0.00 C ATOM 0 H LEU A 53 -0.054 9.382 4.062 1.00 0.00 H new ATOM 0 HA LEU A 53 2.686 10.043 4.450 1.00 0.00 H new ATOM 0 HB2 LEU A 53 0.463 8.944 5.893 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.787 7.806 6.040 1.00 0.00 H new ATOM 0 HG LEU A 53 1.415 9.706 7.804 1.00 0.00 H new ATOM 0 HD11 LEU A 53 3.835 9.677 8.313 1.00 0.00 H new ATOM 0 HD12 LEU A 53 3.224 8.063 7.876 1.00 0.00 H new ATOM 0 HD13 LEU A 53 4.156 9.012 6.693 1.00 0.00 H new ATOM 0 HD21 LEU A 53 2.802 11.694 7.401 1.00 0.00 H new ATOM 0 HD22 LEU A 53 3.076 11.154 5.728 1.00 0.00 H new ATOM 0 HD23 LEU A 53 1.436 11.584 6.266 1.00 0.00 H new ATOM 784 N THR A 54 4.048 8.062 3.803 1.00 0.00 N ATOM 785 CA THR A 54 4.874 6.971 3.292 1.00 0.00 C ATOM 786 C THR A 54 6.339 7.224 3.621 1.00 0.00 C ATOM 787 O THR A 54 6.674 8.223 4.256 1.00 0.00 O ATOM 788 CB THR A 54 4.698 6.796 1.781 1.00 0.00 C ATOM 789 OG1 THR A 54 3.673 7.638 1.285 1.00 0.00 O ATOM 790 CG2 THR A 54 4.358 5.374 1.383 1.00 0.00 C ATOM 0 H THR A 54 4.579 8.869 4.132 1.00 0.00 H new ATOM 0 HA THR A 54 4.549 6.050 3.777 1.00 0.00 H new ATOM 0 HB THR A 54 5.662 7.062 1.348 1.00 0.00 H new ATOM 0 HG1 THR A 54 3.582 7.508 0.318 1.00 0.00 H new ATOM 0 HG21 THR A 54 4.246 5.316 0.300 1.00 0.00 H new ATOM 0 HG22 THR A 54 5.158 4.706 1.702 1.00 0.00 H new ATOM 0 HG23 THR A 54 3.425 5.076 1.861 1.00 0.00 H new ATOM 798 N ALA A 55 7.208 6.316 3.188 1.00 0.00 N ATOM 799 CA ALA A 55 8.638 6.433 3.462 1.00 0.00 C ATOM 800 C ALA A 55 9.178 7.806 3.073 1.00 0.00 C ATOM 801 O ALA A 55 10.089 8.327 3.715 1.00 0.00 O ATOM 802 CB ALA A 55 9.405 5.340 2.739 1.00 0.00 C ATOM 0 H ALA A 55 6.948 5.492 2.646 1.00 0.00 H new ATOM 0 HA ALA A 55 8.778 6.316 4.537 1.00 0.00 H new ATOM 0 HB1 ALA A 55 10.469 5.440 2.953 1.00 0.00 H new ATOM 0 HB2 ALA A 55 9.057 4.365 3.079 1.00 0.00 H new ATOM 0 HB3 ALA A 55 9.241 5.429 1.665 1.00 0.00 H new ATOM 808 N SER A 56 8.618 8.385 2.015 1.00 0.00 N ATOM 809 CA SER A 56 9.052 9.697 1.546 1.00 0.00 C ATOM 810 C SER A 56 8.667 10.783 2.544 1.00 0.00 C ATOM 811 O SER A 56 9.490 11.623 2.910 1.00 0.00 O ATOM 812 CB SER A 56 8.444 10.003 0.177 1.00 0.00 C ATOM 813 OG SER A 56 8.128 11.378 0.051 1.00 0.00 O ATOM 0 H SER A 56 7.865 7.968 1.468 1.00 0.00 H new ATOM 0 HA SER A 56 10.138 9.681 1.454 1.00 0.00 H new ATOM 0 HB2 SER A 56 9.144 9.715 -0.607 1.00 0.00 H new ATOM 0 HB3 SER A 56 7.543 9.406 0.035 1.00 0.00 H new ATOM 0 HG SER A 56 7.291 11.566 0.524 1.00 0.00 H new ATOM 819 N MET A 57 7.413 10.755 2.984 1.00 0.00 N ATOM 820 CA MET A 57 6.924 11.715 3.966 1.00 0.00 C ATOM 821 C MET A 57 7.764 11.631 5.228 1.00 0.00 C ATOM 822 O MET A 57 8.060 12.637 5.871 1.00 0.00 O ATOM 823 CB MET A 57 5.464 11.424 4.310 1.00 0.00 C ATOM 824 CG MET A 57 4.463 11.886 3.260 1.00 0.00 C ATOM 825 SD MET A 57 5.168 12.008 1.603 1.00 0.00 S ATOM 826 CE MET A 57 5.038 10.307 1.057 1.00 0.00 C ATOM 0 H MET A 57 6.717 10.077 2.675 1.00 0.00 H new ATOM 0 HA MET A 57 6.998 12.717 3.542 1.00 0.00 H new ATOM 0 HB2 MET A 57 5.346 10.351 4.458 1.00 0.00 H new ATOM 0 HB3 MET A 57 5.225 11.905 5.258 1.00 0.00 H new ATOM 0 HG2 MET A 57 3.623 11.192 3.239 1.00 0.00 H new ATOM 0 HG3 MET A 57 4.066 12.859 3.550 1.00 0.00 H new ATOM 0 HE1 MET A 57 5.801 10.107 0.305 1.00 0.00 H new ATOM 0 HE2 MET A 57 5.183 9.640 1.907 1.00 0.00 H new ATOM 0 HE3 MET A 57 4.051 10.137 0.627 1.00 0.00 H new ATOM 836 N LEU A 58 8.142 10.409 5.567 1.00 0.00 N ATOM 837 CA LEU A 58 8.963 10.148 6.736 1.00 0.00 C ATOM 838 C LEU A 58 10.347 10.746 6.562 1.00 0.00 C ATOM 839 O LEU A 58 10.884 11.382 7.469 1.00 0.00 O ATOM 840 CB LEU A 58 9.064 8.643 6.947 1.00 0.00 C ATOM 841 CG LEU A 58 7.717 7.930 7.009 1.00 0.00 C ATOM 842 CD1 LEU A 58 7.887 6.442 6.753 1.00 0.00 C ATOM 843 CD2 LEU A 58 7.049 8.187 8.349 1.00 0.00 C ATOM 0 H LEU A 58 7.889 9.573 5.041 1.00 0.00 H new ATOM 0 HA LEU A 58 8.502 10.611 7.608 1.00 0.00 H new ATOM 0 HB2 LEU A 58 9.654 8.212 6.138 1.00 0.00 H new ATOM 0 HB3 LEU A 58 9.607 8.453 7.873 1.00 0.00 H new ATOM 0 HG LEU A 58 7.071 8.329 6.226 1.00 0.00 H new ATOM 0 HD11 LEU A 58 6.915 5.951 6.801 1.00 0.00 H new ATOM 0 HD12 LEU A 58 8.321 6.290 5.765 1.00 0.00 H new ATOM 0 HD13 LEU A 58 8.547 6.016 7.509 1.00 0.00 H new ATOM 0 HD21 LEU A 58 6.088 7.673 8.381 1.00 0.00 H new ATOM 0 HD22 LEU A 58 7.687 7.815 9.151 1.00 0.00 H new ATOM 0 HD23 LEU A 58 6.892 9.258 8.478 1.00 0.00 H new ATOM 855 N ALA A 59 10.910 10.553 5.377 1.00 0.00 N ATOM 856 CA ALA A 59 12.226 11.092 5.058 1.00 0.00 C ATOM 857 C ALA A 59 12.186 12.616 5.021 1.00 0.00 C ATOM 858 O ALA A 59 13.224 13.274 4.948 1.00 0.00 O ATOM 859 CB ALA A 59 12.719 10.540 3.729 1.00 0.00 C ATOM 0 H ALA A 59 10.475 10.026 4.619 1.00 0.00 H new ATOM 0 HA ALA A 59 12.922 10.785 5.839 1.00 0.00 H new ATOM 0 HB1 ALA A 59 13.703 10.953 3.506 1.00 0.00 H new ATOM 0 HB2 ALA A 59 12.786 9.454 3.789 1.00 0.00 H new ATOM 0 HB3 ALA A 59 12.022 10.817 2.939 1.00 0.00 H new ATOM 865 N SER A 60 10.978 13.170 5.076 1.00 0.00 N ATOM 866 CA SER A 60 10.793 14.615 5.056 1.00 0.00 C ATOM 867 C SER A 60 11.071 15.219 6.427 1.00 0.00 C ATOM 868 O SER A 60 11.094 16.441 6.583 1.00 0.00 O ATOM 869 CB SER A 60 9.369 14.960 4.619 1.00 0.00 C ATOM 870 OG SER A 60 9.071 14.402 3.351 1.00 0.00 O ATOM 0 H SER A 60 10.111 12.636 5.135 1.00 0.00 H new ATOM 0 HA SER A 60 11.501 15.036 4.342 1.00 0.00 H new ATOM 0 HB2 SER A 60 8.659 14.589 5.358 1.00 0.00 H new ATOM 0 HB3 SER A 60 9.251 16.043 4.579 1.00 0.00 H new ATOM 0 HG SER A 60 9.163 13.427 3.393 1.00 0.00 H new ATOM 876 N ALA A 61 11.307 14.359 7.414 1.00 0.00 N ATOM 877 CA ALA A 61 11.570 14.808 8.768 1.00 0.00 C ATOM 878 C ALA A 61 12.788 14.100 9.349 1.00 0.00 C ATOM 879 O ALA A 61 12.675 12.988 9.865 1.00 0.00 O ATOM 880 CB ALA A 61 10.348 14.562 9.642 1.00 0.00 C ATOM 0 H ALA A 61 11.320 13.346 7.296 1.00 0.00 H new ATOM 0 HA ALA A 61 11.781 15.877 8.743 1.00 0.00 H new ATOM 0 HB1 ALA A 61 10.553 14.902 10.657 1.00 0.00 H new ATOM 0 HB2 ALA A 61 9.497 15.112 9.240 1.00 0.00 H new ATOM 0 HB3 ALA A 61 10.119 13.497 9.655 1.00 0.00 H new ATOM 886 N PRO A 62 13.978 14.737 9.272 1.00 0.00 N ATOM 887 CA PRO A 62 15.209 14.183 9.854 1.00 0.00 C ATOM 888 C PRO A 62 14.973 13.784 11.310 1.00 0.00 C ATOM 889 O PRO A 62 13.869 13.977 11.802 1.00 0.00 O ATOM 890 CB PRO A 62 16.203 15.346 9.753 1.00 0.00 C ATOM 891 CG PRO A 62 15.693 16.183 8.632 1.00 0.00 C ATOM 892 CD PRO A 62 14.196 16.076 8.693 1.00 0.00 C ATOM 0 HA PRO A 62 15.562 13.284 9.349 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.245 15.913 10.683 1.00 0.00 H new ATOM 0 HB3 PRO A 62 17.213 14.988 9.552 1.00 0.00 H new ATOM 0 HG2 PRO A 62 16.016 17.219 8.738 1.00 0.00 H new ATOM 0 HG3 PRO A 62 16.072 15.827 7.674 1.00 0.00 H new ATOM 0 HD2 PRO A 62 13.761 16.859 9.314 1.00 0.00 H new ATOM 0 HD3 PRO A 62 13.745 16.166 7.705 1.00 0.00 H new ATOM 900 N PRO A 63 15.977 13.208 12.013 1.00 0.00 N ATOM 901 CA PRO A 63 15.841 12.797 13.408 1.00 0.00 C ATOM 902 C PRO A 63 14.751 13.570 14.149 1.00 0.00 C ATOM 903 O PRO A 63 15.023 14.550 14.845 1.00 0.00 O ATOM 904 CB PRO A 63 17.226 13.113 13.960 1.00 0.00 C ATOM 905 CG PRO A 63 18.160 12.867 12.810 1.00 0.00 C ATOM 906 CD PRO A 63 17.343 12.941 11.533 1.00 0.00 C ATOM 0 HA PRO A 63 15.539 11.756 13.521 1.00 0.00 H new ATOM 0 HB2 PRO A 63 17.288 14.144 14.307 1.00 0.00 H new ATOM 0 HB3 PRO A 63 17.468 12.476 14.810 1.00 0.00 H new ATOM 0 HG2 PRO A 63 18.957 13.610 12.798 1.00 0.00 H new ATOM 0 HG3 PRO A 63 18.635 11.891 12.905 1.00 0.00 H new ATOM 0 HD2 PRO A 63 17.699 13.733 10.874 1.00 0.00 H new ATOM 0 HD3 PRO A 63 17.395 12.010 10.969 1.00 0.00 H new ATOM 914 N GLN A 64 13.509 13.130 13.956 1.00 0.00 N ATOM 915 CA GLN A 64 12.345 13.791 14.532 1.00 0.00 C ATOM 916 C GLN A 64 11.158 12.835 14.564 1.00 0.00 C ATOM 917 O GLN A 64 10.892 12.190 15.578 1.00 0.00 O ATOM 918 CB GLN A 64 11.984 15.033 13.706 1.00 0.00 C ATOM 919 CG GLN A 64 10.836 15.839 14.291 1.00 0.00 C ATOM 920 CD GLN A 64 11.128 17.327 14.337 1.00 0.00 C ATOM 921 OE1 GLN A 64 12.267 17.742 14.551 1.00 0.00 O ATOM 922 NE2 GLN A 64 10.096 18.138 14.139 1.00 0.00 N ATOM 0 H GLN A 64 13.284 12.307 13.397 1.00 0.00 H new ATOM 0 HA GLN A 64 12.585 14.094 15.551 1.00 0.00 H new ATOM 0 HB2 GLN A 64 12.862 15.673 13.625 1.00 0.00 H new ATOM 0 HB3 GLN A 64 11.721 14.723 12.695 1.00 0.00 H new ATOM 0 HG2 GLN A 64 9.938 15.667 13.698 1.00 0.00 H new ATOM 0 HG3 GLN A 64 10.625 15.483 15.299 1.00 0.00 H new ATOM 0 HE21 GLN A 64 9.169 17.750 13.965 1.00 0.00 H new ATOM 0 HE22 GLN A 64 10.230 19.149 14.161 1.00 0.00 H new ATOM 931 N GLU A 65 10.455 12.746 13.438 1.00 0.00 N ATOM 932 CA GLU A 65 9.315 11.849 13.315 1.00 0.00 C ATOM 933 C GLU A 65 9.675 10.656 12.438 1.00 0.00 C ATOM 934 O GLU A 65 8.825 9.824 12.125 1.00 0.00 O ATOM 935 CB GLU A 65 8.111 12.587 12.727 1.00 0.00 C ATOM 936 CG GLU A 65 8.114 14.083 12.997 1.00 0.00 C ATOM 937 CD GLU A 65 7.400 14.448 14.285 1.00 0.00 C ATOM 938 OE1 GLU A 65 6.848 13.537 14.938 1.00 0.00 O ATOM 939 OE2 GLU A 65 7.390 15.646 14.639 1.00 0.00 O ATOM 0 H GLU A 65 10.657 13.287 12.597 1.00 0.00 H new ATOM 0 HA GLU A 65 9.051 11.490 14.310 1.00 0.00 H new ATOM 0 HB2 GLU A 65 8.087 12.422 11.650 1.00 0.00 H new ATOM 0 HB3 GLU A 65 7.197 12.156 13.136 1.00 0.00 H new ATOM 0 HG2 GLU A 65 9.144 14.437 13.045 1.00 0.00 H new ATOM 0 HG3 GLU A 65 7.637 14.599 12.164 1.00 0.00 H new ATOM 946 N GLN A 66 10.944 10.587 12.040 1.00 0.00 N ATOM 947 CA GLN A 66 11.430 9.497 11.200 1.00 0.00 C ATOM 948 C GLN A 66 11.186 8.149 11.865 1.00 0.00 C ATOM 949 O GLN A 66 11.166 7.111 11.204 1.00 0.00 O ATOM 950 CB GLN A 66 12.921 9.670 10.920 1.00 0.00 C ATOM 951 CG GLN A 66 13.232 9.944 9.461 1.00 0.00 C ATOM 952 CD GLN A 66 14.622 9.491 9.062 1.00 0.00 C ATOM 953 OE1 GLN A 66 15.578 9.637 9.825 1.00 0.00 O ATOM 954 NE2 GLN A 66 14.743 8.938 7.860 1.00 0.00 N ATOM 0 H GLN A 66 11.655 11.275 12.287 1.00 0.00 H new ATOM 0 HA GLN A 66 10.881 9.525 10.259 1.00 0.00 H new ATOM 0 HB2 GLN A 66 13.304 10.491 11.526 1.00 0.00 H new ATOM 0 HB3 GLN A 66 13.449 8.769 11.233 1.00 0.00 H new ATOM 0 HG2 GLN A 66 12.496 9.438 8.836 1.00 0.00 H new ATOM 0 HG3 GLN A 66 13.133 11.012 9.268 1.00 0.00 H new ATOM 0 HE21 GLN A 66 13.924 8.837 7.260 1.00 0.00 H new ATOM 0 HE22 GLN A 66 15.655 8.615 7.537 1.00 0.00 H new ATOM 963 N LYS A 67 10.994 8.180 13.178 1.00 0.00 N ATOM 964 CA LYS A 67 10.735 6.972 13.944 1.00 0.00 C ATOM 965 C LYS A 67 9.582 7.188 14.920 1.00 0.00 C ATOM 966 O LYS A 67 9.501 6.526 15.955 1.00 0.00 O ATOM 967 CB LYS A 67 11.992 6.550 14.699 1.00 0.00 C ATOM 968 CG LYS A 67 12.447 7.559 15.741 1.00 0.00 C ATOM 969 CD LYS A 67 13.789 7.170 16.341 1.00 0.00 C ATOM 970 CE LYS A 67 13.664 6.847 17.820 1.00 0.00 C ATOM 971 NZ LYS A 67 14.852 6.109 18.331 1.00 0.00 N ATOM 0 H LYS A 67 11.013 9.034 13.735 1.00 0.00 H new ATOM 0 HA LYS A 67 10.454 6.179 13.251 1.00 0.00 H new ATOM 0 HB2 LYS A 67 11.807 5.594 15.189 1.00 0.00 H new ATOM 0 HB3 LYS A 67 12.799 6.391 13.983 1.00 0.00 H new ATOM 0 HG2 LYS A 67 12.523 8.546 15.285 1.00 0.00 H new ATOM 0 HG3 LYS A 67 11.700 7.630 16.532 1.00 0.00 H new ATOM 0 HD2 LYS A 67 14.189 6.305 15.811 1.00 0.00 H new ATOM 0 HD3 LYS A 67 14.500 7.985 16.204 1.00 0.00 H new ATOM 0 HE2 LYS A 67 13.541 7.772 18.384 1.00 0.00 H new ATOM 0 HE3 LYS A 67 12.767 6.250 17.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 14.727 5.908 19.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 14.955 5.214 17.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 15.705 6.688 18.196 1.00 0.00 H new ATOM 985 N GLN A 68 8.676 8.096 14.566 1.00 0.00 N ATOM 986 CA GLN A 68 7.528 8.396 15.415 1.00 0.00 C ATOM 987 C GLN A 68 6.230 8.480 14.611 1.00 0.00 C ATOM 988 O GLN A 68 5.220 7.886 14.988 1.00 0.00 O ATOM 989 CB GLN A 68 7.756 9.709 16.162 1.00 0.00 C ATOM 990 CG GLN A 68 8.921 9.660 17.137 1.00 0.00 C ATOM 991 CD GLN A 68 8.470 9.679 18.584 1.00 0.00 C ATOM 992 OE1 GLN A 68 8.043 8.661 19.128 1.00 0.00 O ATOM 993 NE2 GLN A 68 8.560 10.844 19.216 1.00 0.00 N ATOM 0 H GLN A 68 8.715 8.634 13.701 1.00 0.00 H new ATOM 0 HA GLN A 68 7.427 7.578 16.129 1.00 0.00 H new ATOM 0 HB2 GLN A 68 7.933 10.504 15.437 1.00 0.00 H new ATOM 0 HB3 GLN A 68 6.848 9.970 16.706 1.00 0.00 H new ATOM 0 HG2 GLN A 68 9.506 8.758 16.954 1.00 0.00 H new ATOM 0 HG3 GLN A 68 9.579 10.509 16.954 1.00 0.00 H new ATOM 0 HE21 GLN A 68 8.920 11.663 18.727 1.00 0.00 H new ATOM 0 HE22 GLN A 68 8.269 10.919 20.191 1.00 0.00 H new ATOM 1002 N MET A 69 6.251 9.243 13.519 1.00 0.00 N ATOM 1003 CA MET A 69 5.051 9.452 12.711 1.00 0.00 C ATOM 1004 C MET A 69 4.771 8.293 11.753 1.00 0.00 C ATOM 1005 O MET A 69 3.827 8.355 10.965 1.00 0.00 O ATOM 1006 CB MET A 69 5.162 10.757 11.919 1.00 0.00 C ATOM 1007 CG MET A 69 6.134 10.689 10.749 1.00 0.00 C ATOM 1008 SD MET A 69 5.463 11.432 9.247 1.00 0.00 S ATOM 1009 CE MET A 69 6.864 12.398 8.687 1.00 0.00 C ATOM 0 H MET A 69 7.082 9.725 13.175 1.00 0.00 H new ATOM 0 HA MET A 69 4.214 9.509 13.407 1.00 0.00 H new ATOM 0 HB2 MET A 69 4.175 11.027 11.543 1.00 0.00 H new ATOM 0 HB3 MET A 69 5.476 11.554 12.593 1.00 0.00 H new ATOM 0 HG2 MET A 69 7.059 11.198 11.020 1.00 0.00 H new ATOM 0 HG3 MET A 69 6.389 9.647 10.553 1.00 0.00 H new ATOM 0 HE1 MET A 69 6.834 12.487 7.601 1.00 0.00 H new ATOM 0 HE2 MET A 69 6.823 13.391 9.134 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.789 11.904 8.985 1.00 0.00 H new ATOM 1019 N LEU A 70 5.581 7.243 11.813 1.00 0.00 N ATOM 1020 CA LEU A 70 5.378 6.087 10.944 1.00 0.00 C ATOM 1021 C LEU A 70 4.208 5.268 11.443 1.00 0.00 C ATOM 1022 O LEU A 70 3.461 4.685 10.660 1.00 0.00 O ATOM 1023 CB LEU A 70 6.621 5.188 10.863 1.00 0.00 C ATOM 1024 CG LEU A 70 7.854 5.654 11.640 1.00 0.00 C ATOM 1025 CD1 LEU A 70 8.254 7.050 11.208 1.00 0.00 C ATOM 1026 CD2 LEU A 70 7.610 5.591 13.139 1.00 0.00 C ATOM 0 H LEU A 70 6.377 7.166 12.446 1.00 0.00 H new ATOM 0 HA LEU A 70 5.178 6.471 9.944 1.00 0.00 H new ATOM 0 HB2 LEU A 70 6.348 4.195 11.221 1.00 0.00 H new ATOM 0 HB3 LEU A 70 6.898 5.084 9.814 1.00 0.00 H new ATOM 0 HG LEU A 70 8.679 4.978 11.413 1.00 0.00 H new ATOM 0 HD11 LEU A 70 9.133 7.367 11.770 1.00 0.00 H new ATOM 0 HD12 LEU A 70 8.485 7.049 10.143 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.432 7.740 11.400 1.00 0.00 H new ATOM 0 HD21 LEU A 70 8.502 5.928 13.667 1.00 0.00 H new ATOM 0 HD22 LEU A 70 6.770 6.235 13.398 1.00 0.00 H new ATOM 0 HD23 LEU A 70 7.383 4.565 13.428 1.00 0.00 H new ATOM 1038 N GLY A 71 4.062 5.214 12.758 1.00 0.00 N ATOM 1039 CA GLY A 71 2.974 4.466 13.327 1.00 0.00 C ATOM 1040 C GLY A 71 2.175 5.270 14.336 1.00 0.00 C ATOM 1041 O GLY A 71 1.556 4.705 15.238 1.00 0.00 O ATOM 0 H GLY A 71 4.675 5.673 13.432 1.00 0.00 H new ATOM 0 HA2 GLY A 71 2.312 4.132 12.529 1.00 0.00 H new ATOM 0 HA3 GLY A 71 3.367 3.572 13.811 1.00 0.00 H new ATOM 1045 N GLU A 72 2.175 6.594 14.173 1.00 0.00 N ATOM 1046 CA GLU A 72 1.435 7.475 15.073 1.00 0.00 C ATOM 1047 C GLU A 72 0.845 8.670 14.323 1.00 0.00 C ATOM 1048 O GLU A 72 0.164 9.509 14.912 1.00 0.00 O ATOM 1049 CB GLU A 72 2.343 7.972 16.202 1.00 0.00 C ATOM 1050 CG GLU A 72 2.894 6.859 17.081 1.00 0.00 C ATOM 1051 CD GLU A 72 2.764 7.165 18.559 1.00 0.00 C ATOM 1052 OE1 GLU A 72 1.634 7.092 19.084 1.00 0.00 O ATOM 1053 OE2 GLU A 72 3.794 7.477 19.194 1.00 0.00 O ATOM 0 H GLU A 72 2.678 7.077 13.428 1.00 0.00 H new ATOM 0 HA GLU A 72 0.614 6.897 15.498 1.00 0.00 H new ATOM 0 HB2 GLU A 72 3.176 8.526 15.769 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.784 8.671 16.824 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.368 5.931 16.858 1.00 0.00 H new ATOM 0 HG3 GLU A 72 3.944 6.696 16.839 1.00 0.00 H new ATOM 1060 N ARG A 73 1.108 8.736 13.022 1.00 0.00 N ATOM 1061 CA ARG A 73 0.593 9.811 12.182 1.00 0.00 C ATOM 1062 C ARG A 73 -0.133 9.228 10.979 1.00 0.00 C ATOM 1063 O ARG A 73 -0.982 9.876 10.369 1.00 0.00 O ATOM 1064 CB ARG A 73 1.732 10.718 11.715 1.00 0.00 C ATOM 1065 CG ARG A 73 1.315 12.165 11.511 1.00 0.00 C ATOM 1066 CD ARG A 73 0.818 12.407 10.096 1.00 0.00 C ATOM 1067 NE ARG A 73 0.558 13.821 9.839 1.00 0.00 N ATOM 1068 CZ ARG A 73 -0.598 14.421 10.112 1.00 0.00 C ATOM 1069 NH1 ARG A 73 -1.597 13.733 10.648 1.00 0.00 N ATOM 1070 NH2 ARG A 73 -0.755 15.711 9.846 1.00 0.00 N ATOM 0 H ARG A 73 1.679 8.053 12.524 1.00 0.00 H new ATOM 0 HA ARG A 73 -0.107 10.406 12.769 1.00 0.00 H new ATOM 0 HB2 ARG A 73 2.538 10.681 12.448 1.00 0.00 H new ATOM 0 HB3 ARG A 73 2.134 10.329 10.779 1.00 0.00 H new ATOM 0 HG2 ARG A 73 0.530 12.422 12.222 1.00 0.00 H new ATOM 0 HG3 ARG A 73 2.160 12.821 11.718 1.00 0.00 H new ATOM 0 HD2 ARG A 73 1.558 12.040 9.385 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -0.095 11.835 9.930 1.00 0.00 H new ATOM 0 HE ARG A 73 1.305 14.380 9.427 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -1.481 12.740 10.852 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -2.482 14.196 10.856 1.00 0.00 H new ATOM 0 HH21 ARG A 73 0.010 16.243 9.432 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -1.641 16.171 10.055 1.00 0.00 H new ATOM 1084 N LEU A 74 0.207 7.985 10.658 1.00 0.00 N ATOM 1085 CA LEU A 74 -0.417 7.276 9.551 1.00 0.00 C ATOM 1086 C LEU A 74 -1.784 6.763 9.953 1.00 0.00 C ATOM 1087 O LEU A 74 -2.634 6.504 9.107 1.00 0.00 O ATOM 1088 CB LEU A 74 0.454 6.097 9.135 1.00 0.00 C ATOM 1089 CG LEU A 74 1.294 6.334 7.893 1.00 0.00 C ATOM 1090 CD1 LEU A 74 2.665 5.703 8.053 1.00 0.00 C ATOM 1091 CD2 LEU A 74 0.578 5.796 6.663 1.00 0.00 C ATOM 0 H LEU A 74 0.917 7.446 11.154 1.00 0.00 H new ATOM 0 HA LEU A 74 -0.525 7.969 8.716 1.00 0.00 H new ATOM 0 HB2 LEU A 74 1.117 5.843 9.962 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -0.187 5.232 8.964 1.00 0.00 H new ATOM 0 HG LEU A 74 1.434 7.407 7.759 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.255 5.882 7.154 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.170 6.144 8.912 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.556 4.630 8.208 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.191 5.972 5.779 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.409 4.726 6.780 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -0.379 6.304 6.548 1.00 0.00 H new ATOM 1103 N PHE A 75 -1.961 6.590 11.253 1.00 0.00 N ATOM 1104 CA PHE A 75 -3.201 6.066 11.818 1.00 0.00 C ATOM 1105 C PHE A 75 -4.444 6.560 11.063 1.00 0.00 C ATOM 1106 O PHE A 75 -5.251 5.749 10.596 1.00 0.00 O ATOM 1107 CB PHE A 75 -3.286 6.439 13.303 1.00 0.00 C ATOM 1108 CG PHE A 75 -3.970 5.412 14.162 1.00 0.00 C ATOM 1109 CD1 PHE A 75 -3.895 4.061 13.854 1.00 0.00 C ATOM 1110 CD2 PHE A 75 -4.663 5.797 15.299 1.00 0.00 C ATOM 1111 CE1 PHE A 75 -4.512 3.119 14.655 1.00 0.00 C ATOM 1112 CE2 PHE A 75 -5.282 4.859 16.102 1.00 0.00 C ATOM 1113 CZ PHE A 75 -5.209 3.519 15.778 1.00 0.00 C ATOM 0 H PHE A 75 -1.249 6.808 11.950 1.00 0.00 H new ATOM 0 HA PHE A 75 -3.183 4.981 11.713 1.00 0.00 H new ATOM 0 HB2 PHE A 75 -2.277 6.600 13.683 1.00 0.00 H new ATOM 0 HB3 PHE A 75 -3.817 7.386 13.398 1.00 0.00 H new ATOM 0 HD1 PHE A 75 -3.348 3.742 12.979 1.00 0.00 H new ATOM 0 HD2 PHE A 75 -4.720 6.843 15.560 1.00 0.00 H new ATOM 0 HE1 PHE A 75 -4.449 2.071 14.403 1.00 0.00 H new ATOM 0 HE2 PHE A 75 -5.823 5.174 16.982 1.00 0.00 H new ATOM 0 HZ PHE A 75 -5.696 2.785 16.402 1.00 0.00 H new ATOM 1123 N PRO A 76 -4.622 7.891 10.907 1.00 0.00 N ATOM 1124 CA PRO A 76 -5.790 8.444 10.211 1.00 0.00 C ATOM 1125 C PRO A 76 -5.740 8.220 8.702 1.00 0.00 C ATOM 1126 O PRO A 76 -6.771 8.243 8.029 1.00 0.00 O ATOM 1127 CB PRO A 76 -5.715 9.939 10.528 1.00 0.00 C ATOM 1128 CG PRO A 76 -4.271 10.201 10.769 1.00 0.00 C ATOM 1129 CD PRO A 76 -3.731 8.955 11.414 1.00 0.00 C ATOM 0 HA PRO A 76 -6.715 7.966 10.535 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -6.094 10.539 9.700 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -6.314 10.189 11.403 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -3.751 10.415 9.835 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -4.133 11.067 11.416 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -2.693 8.776 11.135 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -3.762 9.020 12.502 1.00 0.00 H new ATOM 1137 N LEU A 77 -4.539 8.003 8.175 1.00 0.00 N ATOM 1138 CA LEU A 77 -4.360 7.803 6.743 1.00 0.00 C ATOM 1139 C LEU A 77 -4.482 6.331 6.354 1.00 0.00 C ATOM 1140 O LEU A 77 -4.711 6.012 5.188 1.00 0.00 O ATOM 1141 CB LEU A 77 -3.006 8.360 6.301 1.00 0.00 C ATOM 1142 CG LEU A 77 -2.878 9.883 6.401 1.00 0.00 C ATOM 1143 CD1 LEU A 77 -1.469 10.326 6.044 1.00 0.00 C ATOM 1144 CD2 LEU A 77 -3.897 10.564 5.501 1.00 0.00 C ATOM 0 H LEU A 77 -3.677 7.961 8.718 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.157 8.342 6.230 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.225 7.903 6.908 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -2.824 8.061 5.269 1.00 0.00 H new ATOM 0 HG LEU A 77 -3.078 10.177 7.431 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.398 11.411 6.121 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -0.758 9.866 6.731 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.239 10.019 5.024 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.791 11.646 5.585 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.729 10.262 4.467 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.903 10.273 5.805 1.00 0.00 H new ATOM 1156 N ILE A 78 -4.334 5.433 7.327 1.00 0.00 N ATOM 1157 CA ILE A 78 -4.475 4.005 7.058 1.00 0.00 C ATOM 1158 C ILE A 78 -5.939 3.658 6.857 1.00 0.00 C ATOM 1159 O ILE A 78 -6.287 2.872 5.976 1.00 0.00 O ATOM 1160 CB ILE A 78 -3.916 3.135 8.189 1.00 0.00 C ATOM 1161 CG1 ILE A 78 -2.509 3.592 8.575 1.00 0.00 C ATOM 1162 CG2 ILE A 78 -3.916 1.672 7.770 1.00 0.00 C ATOM 1163 CD1 ILE A 78 -1.441 3.197 7.577 1.00 0.00 C ATOM 0 H ILE A 78 -4.119 5.666 8.297 1.00 0.00 H new ATOM 0 HA ILE A 78 -3.900 3.797 6.156 1.00 0.00 H new ATOM 0 HB ILE A 78 -4.556 3.244 9.065 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -2.507 4.676 8.685 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.256 3.173 9.549 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -3.517 1.062 8.580 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -4.935 1.357 7.547 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -3.295 1.548 6.883 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -0.471 3.557 7.921 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -1.413 2.111 7.484 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -1.669 3.638 6.607 1.00 0.00 H new ATOM 1175 N GLN A 79 -6.797 4.268 7.673 1.00 0.00 N ATOM 1176 CA GLN A 79 -8.237 4.070 7.552 1.00 0.00 C ATOM 1177 C GLN A 79 -8.683 4.370 6.125 1.00 0.00 C ATOM 1178 O GLN A 79 -9.773 3.989 5.701 1.00 0.00 O ATOM 1179 CB GLN A 79 -8.973 4.988 8.528 1.00 0.00 C ATOM 1180 CG GLN A 79 -9.414 4.298 9.808 1.00 0.00 C ATOM 1181 CD GLN A 79 -9.014 5.068 11.051 1.00 0.00 C ATOM 1182 OE1 GLN A 79 -7.835 5.135 11.400 1.00 0.00 O ATOM 1183 NE2 GLN A 79 -9.996 5.653 11.726 1.00 0.00 N ATOM 0 H GLN A 79 -6.519 4.902 8.423 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.474 3.033 7.790 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -8.324 5.826 8.783 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -9.849 5.404 8.030 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -10.497 4.173 9.795 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -8.978 3.300 9.847 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -10.959 5.571 11.399 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -9.788 6.185 12.571 1.00 0.00 H new ATOM 1192 N ALA A 80 -7.817 5.066 5.399 1.00 0.00 N ATOM 1193 CA ALA A 80 -8.067 5.418 4.009 1.00 0.00 C ATOM 1194 C ALA A 80 -7.778 4.238 3.090 1.00 0.00 C ATOM 1195 O ALA A 80 -8.472 4.028 2.095 1.00 0.00 O ATOM 1196 CB ALA A 80 -7.206 6.606 3.611 1.00 0.00 C ATOM 0 H ALA A 80 -6.923 5.401 5.758 1.00 0.00 H new ATOM 0 HA ALA A 80 -9.119 5.684 3.907 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.399 6.863 2.569 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -7.447 7.459 4.246 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -6.154 6.349 3.732 1.00 0.00 H new ATOM 1202 N MET A 81 -6.730 3.486 3.416 1.00 0.00 N ATOM 1203 CA MET A 81 -6.347 2.326 2.618 1.00 0.00 C ATOM 1204 C MET A 81 -7.341 1.191 2.817 1.00 0.00 C ATOM 1205 O MET A 81 -7.799 0.571 1.857 1.00 0.00 O ATOM 1206 CB MET A 81 -4.944 1.848 3.002 1.00 0.00 C ATOM 1207 CG MET A 81 -3.977 2.970 3.337 1.00 0.00 C ATOM 1208 SD MET A 81 -2.817 2.515 4.634 1.00 0.00 S ATOM 1209 CE MET A 81 -1.344 2.196 3.671 1.00 0.00 C ATOM 0 H MET A 81 -6.133 3.659 4.225 1.00 0.00 H new ATOM 0 HA MET A 81 -6.348 2.623 1.569 1.00 0.00 H new ATOM 0 HB2 MET A 81 -5.021 1.181 3.861 1.00 0.00 H new ATOM 0 HB3 MET A 81 -4.533 1.262 2.179 1.00 0.00 H new ATOM 0 HG2 MET A 81 -3.423 3.248 2.440 1.00 0.00 H new ATOM 0 HG3 MET A 81 -4.540 3.849 3.650 1.00 0.00 H new ATOM 0 HE1 MET A 81 -0.482 2.129 4.335 1.00 0.00 H new ATOM 0 HE2 MET A 81 -1.459 1.257 3.130 1.00 0.00 H new ATOM 0 HE3 MET A 81 -1.191 3.008 2.960 1.00 0.00 H new ATOM 1219 N HIS A 82 -7.662 0.926 4.075 1.00 0.00 N ATOM 1220 CA HIS A 82 -8.589 -0.138 4.430 1.00 0.00 C ATOM 1221 C HIS A 82 -9.865 0.440 5.031 1.00 0.00 C ATOM 1222 O HIS A 82 -9.823 1.483 5.677 1.00 0.00 O ATOM 1223 CB HIS A 82 -7.924 -1.077 5.434 1.00 0.00 C ATOM 1224 CG HIS A 82 -7.146 -2.185 4.795 1.00 0.00 C ATOM 1225 ND1 HIS A 82 -7.331 -3.495 5.161 1.00 0.00 N ATOM 1226 CD2 HIS A 82 -6.191 -2.124 3.836 1.00 0.00 C ATOM 1227 CE1 HIS A 82 -6.502 -4.200 4.413 1.00 0.00 C ATOM 1228 NE2 HIS A 82 -5.782 -3.411 3.604 1.00 0.00 N ATOM 0 H HIS A 82 -7.290 1.439 4.874 1.00 0.00 H new ATOM 0 HA HIS A 82 -8.852 -0.691 3.528 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -7.257 -0.498 6.073 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -8.690 -1.507 6.079 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -5.823 -1.233 3.349 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -6.415 -5.276 4.449 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -5.066 -3.711 2.942 1.00 0.00 H new ATOM 1236 N PRO A 83 -11.017 -0.232 4.835 1.00 0.00 N ATOM 1237 CA PRO A 83 -12.301 0.228 5.383 1.00 0.00 C ATOM 1238 C PRO A 83 -12.245 0.405 6.897 1.00 0.00 C ATOM 1239 O PRO A 83 -12.688 -0.463 7.651 1.00 0.00 O ATOM 1240 CB PRO A 83 -13.277 -0.893 5.008 1.00 0.00 C ATOM 1241 CG PRO A 83 -12.642 -1.580 3.849 1.00 0.00 C ATOM 1242 CD PRO A 83 -11.161 -1.489 4.079 1.00 0.00 C ATOM 0 HA PRO A 83 -12.588 1.203 4.989 1.00 0.00 H new ATOM 0 HB2 PRO A 83 -13.428 -1.580 5.840 1.00 0.00 H new ATOM 0 HB3 PRO A 83 -14.256 -0.493 4.743 1.00 0.00 H new ATOM 0 HG2 PRO A 83 -12.965 -2.619 3.786 1.00 0.00 H new ATOM 0 HG3 PRO A 83 -12.922 -1.102 2.910 1.00 0.00 H new ATOM 0 HD2 PRO A 83 -10.787 -2.344 4.643 1.00 0.00 H new ATOM 0 HD3 PRO A 83 -10.608 -1.460 3.140 1.00 0.00 H new ATOM 1250 N THR A 84 -11.680 1.532 7.331 1.00 0.00 N ATOM 1251 CA THR A 84 -11.523 1.831 8.751 1.00 0.00 C ATOM 1252 C THR A 84 -10.986 0.621 9.513 1.00 0.00 C ATOM 1253 O THR A 84 -11.342 0.394 10.670 1.00 0.00 O ATOM 1254 CB THR A 84 -12.855 2.286 9.355 1.00 0.00 C ATOM 1255 OG1 THR A 84 -13.805 1.235 9.327 1.00 0.00 O ATOM 1256 CG2 THR A 84 -13.462 3.474 8.642 1.00 0.00 C ATOM 0 H THR A 84 -11.321 2.258 6.711 1.00 0.00 H new ATOM 0 HA THR A 84 -10.799 2.641 8.843 1.00 0.00 H new ATOM 0 HB THR A 84 -12.621 2.579 10.379 1.00 0.00 H new ATOM 0 HG1 THR A 84 -13.363 0.402 9.061 1.00 0.00 H new ATOM 0 HG21 THR A 84 -14.403 3.744 9.121 1.00 0.00 H new ATOM 0 HG22 THR A 84 -12.774 4.318 8.692 1.00 0.00 H new ATOM 0 HG23 THR A 84 -13.646 3.217 7.599 1.00 0.00 H new ATOM 1264 N LEU A 85 -10.128 -0.152 8.853 1.00 0.00 N ATOM 1265 CA LEU A 85 -9.542 -1.343 9.458 1.00 0.00 C ATOM 1266 C LEU A 85 -8.244 -1.006 10.182 1.00 0.00 C ATOM 1267 O LEU A 85 -7.529 -1.896 10.641 1.00 0.00 O ATOM 1268 CB LEU A 85 -9.275 -2.401 8.387 1.00 0.00 C ATOM 1269 CG LEU A 85 -10.287 -3.547 8.338 1.00 0.00 C ATOM 1270 CD1 LEU A 85 -10.924 -3.635 6.961 1.00 0.00 C ATOM 1271 CD2 LEU A 85 -9.618 -4.862 8.705 1.00 0.00 C ATOM 0 H LEU A 85 -9.823 0.026 7.896 1.00 0.00 H new ATOM 0 HA LEU A 85 -10.252 -1.736 10.186 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -9.256 -1.912 7.413 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.283 -2.820 8.553 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.073 -3.347 9.066 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -11.641 -4.456 6.944 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -11.437 -2.700 6.737 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -10.151 -3.813 6.213 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.352 -5.667 8.665 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -8.813 -5.070 8.000 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -9.209 -4.793 9.713 1.00 0.00 H new ATOM 1283 N ALA A 86 -7.944 0.285 10.270 1.00 0.00 N ATOM 1284 CA ALA A 86 -6.730 0.747 10.932 1.00 0.00 C ATOM 1285 C ALA A 86 -6.900 0.769 12.445 1.00 0.00 C ATOM 1286 O ALA A 86 -6.548 1.746 13.104 1.00 0.00 O ATOM 1287 CB ALA A 86 -6.347 2.128 10.421 1.00 0.00 C ATOM 0 H ALA A 86 -8.526 1.031 9.890 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.929 0.047 10.696 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.439 2.463 10.923 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -6.172 2.083 9.346 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -7.155 2.830 10.628 1.00 0.00 H new ATOM 1293 N GLY A 87 -7.440 -0.314 12.992 1.00 0.00 N ATOM 1294 CA GLY A 87 -7.611 -0.407 14.428 1.00 0.00 C ATOM 1295 C GLY A 87 -6.339 -0.860 15.112 1.00 0.00 C ATOM 1296 O GLY A 87 -6.241 -0.843 16.340 1.00 0.00 O ATOM 0 H GLY A 87 -7.762 -1.127 12.467 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -7.911 0.564 14.823 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -8.416 -1.106 14.655 1.00 0.00 H new ATOM 1300 N LYS A 88 -5.359 -1.261 14.305 1.00 0.00 N ATOM 1301 CA LYS A 88 -4.074 -1.721 14.815 1.00 0.00 C ATOM 1302 C LYS A 88 -3.101 -1.982 13.669 1.00 0.00 C ATOM 1303 O LYS A 88 -2.235 -2.849 13.761 1.00 0.00 O ATOM 1304 CB LYS A 88 -4.254 -2.997 15.650 1.00 0.00 C ATOM 1305 CG LYS A 88 -2.984 -3.469 16.346 1.00 0.00 C ATOM 1306 CD LYS A 88 -2.440 -2.417 17.297 1.00 0.00 C ATOM 1307 CE LYS A 88 -1.278 -1.660 16.675 1.00 0.00 C ATOM 1308 NZ LYS A 88 -1.182 -0.266 17.191 1.00 0.00 N ATOM 0 H LYS A 88 -5.434 -1.276 13.288 1.00 0.00 H new ATOM 0 HA LYS A 88 -3.661 -0.938 15.451 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -5.023 -2.821 16.402 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -4.618 -3.794 15.002 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -3.191 -4.386 16.898 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -2.228 -3.710 15.599 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -3.233 -1.717 17.561 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -2.114 -2.893 18.222 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -0.348 -2.189 16.883 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -1.397 -1.639 15.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -0.182 0.011 17.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -1.676 0.379 16.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -1.621 -0.213 18.132 1.00 0.00 H new ATOM 1322 N ILE A 89 -3.262 -1.257 12.567 1.00 0.00 N ATOM 1323 CA ILE A 89 -2.380 -1.444 11.428 1.00 0.00 C ATOM 1324 C ILE A 89 -1.053 -0.709 11.623 1.00 0.00 C ATOM 1325 O ILE A 89 -0.124 -1.250 12.217 1.00 0.00 O ATOM 1326 CB ILE A 89 -3.032 -1.003 10.110 1.00 0.00 C ATOM 1327 CG1 ILE A 89 -4.364 -1.736 9.916 1.00 0.00 C ATOM 1328 CG2 ILE A 89 -2.081 -1.287 8.958 1.00 0.00 C ATOM 1329 CD1 ILE A 89 -5.162 -1.256 8.725 1.00 0.00 C ATOM 0 H ILE A 89 -3.983 -0.547 12.442 1.00 0.00 H new ATOM 0 HA ILE A 89 -2.184 -2.514 11.365 1.00 0.00 H new ATOM 0 HB ILE A 89 -3.236 0.067 10.139 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -4.167 -2.802 9.803 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -4.967 -1.617 10.816 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -2.541 -0.975 8.021 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -1.153 -0.735 9.108 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.866 -2.355 8.919 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -6.090 -1.824 8.656 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -5.392 -0.197 8.844 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -4.580 -1.401 7.815 1.00 0.00 H new ATOM 1341 N THR A 90 -0.975 0.521 11.114 1.00 0.00 N ATOM 1342 CA THR A 90 0.240 1.330 11.206 1.00 0.00 C ATOM 1343 C THR A 90 0.763 1.388 12.634 1.00 0.00 C ATOM 1344 O THR A 90 1.972 1.341 12.860 1.00 0.00 O ATOM 1345 CB THR A 90 -0.045 2.738 10.680 1.00 0.00 C ATOM 1346 OG1 THR A 90 0.722 2.995 9.517 1.00 0.00 O ATOM 1347 CG2 THR A 90 0.232 3.857 11.663 1.00 0.00 C ATOM 0 H THR A 90 -1.746 0.981 10.630 1.00 0.00 H new ATOM 0 HA THR A 90 1.014 0.864 10.595 1.00 0.00 H new ATOM 0 HB THR A 90 -1.116 2.738 10.478 1.00 0.00 H new ATOM 0 HG1 THR A 90 1.515 3.518 9.757 1.00 0.00 H new ATOM 0 HG21 THR A 90 -0.000 4.815 11.198 1.00 0.00 H new ATOM 0 HG22 THR A 90 -0.388 3.724 12.550 1.00 0.00 H new ATOM 0 HG23 THR A 90 1.284 3.838 11.949 1.00 0.00 H new ATOM 1355 N GLY A 91 -0.146 1.521 13.591 1.00 0.00 N ATOM 1356 CA GLY A 91 0.261 1.556 14.977 1.00 0.00 C ATOM 1357 C GLY A 91 1.079 0.338 15.333 1.00 0.00 C ATOM 1358 O GLY A 91 1.997 0.403 16.153 1.00 0.00 O ATOM 0 H GLY A 91 -1.150 1.605 13.432 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.844 2.457 15.166 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -0.620 1.606 15.617 1.00 0.00 H new ATOM 1362 N MET A 92 0.772 -0.772 14.673 1.00 0.00 N ATOM 1363 CA MET A 92 1.479 -2.012 14.900 1.00 0.00 C ATOM 1364 C MET A 92 2.736 -2.059 14.054 1.00 0.00 C ATOM 1365 O MET A 92 3.696 -2.748 14.390 1.00 0.00 O ATOM 1366 CB MET A 92 0.548 -3.178 14.581 1.00 0.00 C ATOM 1367 CG MET A 92 1.180 -4.296 13.798 1.00 0.00 C ATOM 1368 SD MET A 92 0.565 -4.392 12.110 1.00 0.00 S ATOM 1369 CE MET A 92 -0.517 -5.809 12.248 1.00 0.00 C ATOM 0 H MET A 92 0.032 -0.832 13.973 1.00 0.00 H new ATOM 0 HA MET A 92 1.784 -2.083 15.944 1.00 0.00 H new ATOM 0 HB2 MET A 92 0.162 -3.582 15.517 1.00 0.00 H new ATOM 0 HB3 MET A 92 -0.307 -2.799 14.021 1.00 0.00 H new ATOM 0 HG2 MET A 92 2.261 -4.156 13.780 1.00 0.00 H new ATOM 0 HG3 MET A 92 0.990 -5.242 14.305 1.00 0.00 H new ATOM 0 HE1 MET A 92 -1.481 -5.576 11.796 1.00 0.00 H new ATOM 0 HE2 MET A 92 -0.071 -6.659 11.732 1.00 0.00 H new ATOM 0 HE3 MET A 92 -0.660 -6.057 13.300 1.00 0.00 H new ATOM 1379 N LEU A 93 2.740 -1.282 12.979 1.00 0.00 N ATOM 1380 CA LEU A 93 3.894 -1.200 12.100 1.00 0.00 C ATOM 1381 C LEU A 93 5.097 -0.661 12.855 1.00 0.00 C ATOM 1382 O LEU A 93 6.206 -0.609 12.326 1.00 0.00 O ATOM 1383 CB LEU A 93 3.582 -0.314 10.903 1.00 0.00 C ATOM 1384 CG LEU A 93 2.978 -1.039 9.697 1.00 0.00 C ATOM 1385 CD1 LEU A 93 3.990 -2.001 9.094 1.00 0.00 C ATOM 1386 CD2 LEU A 93 1.711 -1.778 10.097 1.00 0.00 C ATOM 0 H LEU A 93 1.953 -0.698 12.696 1.00 0.00 H new ATOM 0 HA LEU A 93 4.130 -2.202 11.741 1.00 0.00 H new ATOM 0 HB2 LEU A 93 2.892 0.468 11.220 1.00 0.00 H new ATOM 0 HB3 LEU A 93 4.501 0.180 10.587 1.00 0.00 H new ATOM 0 HG LEU A 93 2.717 -0.296 8.943 1.00 0.00 H new ATOM 0 HD11 LEU A 93 3.545 -2.508 8.238 1.00 0.00 H new ATOM 0 HD12 LEU A 93 4.871 -1.447 8.770 1.00 0.00 H new ATOM 0 HD13 LEU A 93 4.281 -2.739 9.842 1.00 0.00 H new ATOM 0 HD21 LEU A 93 1.296 -2.287 9.227 1.00 0.00 H new ATOM 0 HD22 LEU A 93 1.946 -2.511 10.869 1.00 0.00 H new ATOM 0 HD23 LEU A 93 0.981 -1.066 10.483 1.00 0.00 H new ATOM 1398 N LEU A 94 4.870 -0.258 14.098 1.00 0.00 N ATOM 1399 CA LEU A 94 5.945 0.200 14.954 1.00 0.00 C ATOM 1400 C LEU A 94 6.199 -0.843 16.029 1.00 0.00 C ATOM 1401 O LEU A 94 6.654 -0.533 17.130 1.00 0.00 O ATOM 1402 CB LEU A 94 5.594 1.550 15.576 1.00 0.00 C ATOM 1403 CG LEU A 94 6.252 2.753 14.897 1.00 0.00 C ATOM 1404 CD1 LEU A 94 5.927 2.765 13.409 1.00 0.00 C ATOM 1405 CD2 LEU A 94 5.809 4.051 15.556 1.00 0.00 C ATOM 0 H LEU A 94 3.947 -0.241 14.533 1.00 0.00 H new ATOM 0 HA LEU A 94 6.852 0.334 14.364 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.512 1.679 15.546 1.00 0.00 H new ATOM 0 HB3 LEU A 94 5.885 1.538 16.626 1.00 0.00 H new ATOM 0 HG LEU A 94 7.332 2.667 15.013 1.00 0.00 H new ATOM 0 HD11 LEU A 94 6.402 3.627 12.940 1.00 0.00 H new ATOM 0 HD12 LEU A 94 6.299 1.850 12.948 1.00 0.00 H new ATOM 0 HD13 LEU A 94 4.847 2.827 13.273 1.00 0.00 H new ATOM 0 HD21 LEU A 94 6.288 4.894 15.058 1.00 0.00 H new ATOM 0 HD22 LEU A 94 4.726 4.149 15.475 1.00 0.00 H new ATOM 0 HD23 LEU A 94 6.094 4.041 16.608 1.00 0.00 H new ATOM 1417 N GLU A 95 5.869 -2.088 15.691 1.00 0.00 N ATOM 1418 CA GLU A 95 6.033 -3.206 16.610 1.00 0.00 C ATOM 1419 C GLU A 95 5.915 -4.546 15.882 1.00 0.00 C ATOM 1420 O GLU A 95 6.068 -5.602 16.496 1.00 0.00 O ATOM 1421 CB GLU A 95 4.994 -3.128 17.732 1.00 0.00 C ATOM 1422 CG GLU A 95 3.589 -3.519 17.298 1.00 0.00 C ATOM 1423 CD GLU A 95 2.617 -3.578 18.459 1.00 0.00 C ATOM 1424 OE1 GLU A 95 2.009 -2.534 18.779 1.00 0.00 O ATOM 1425 OE2 GLU A 95 2.465 -4.667 19.052 1.00 0.00 O ATOM 0 H GLU A 95 5.485 -2.346 14.782 1.00 0.00 H new ATOM 0 HA GLU A 95 7.032 -3.140 17.041 1.00 0.00 H new ATOM 0 HB2 GLU A 95 5.306 -3.779 18.549 1.00 0.00 H new ATOM 0 HB3 GLU A 95 4.973 -2.111 18.125 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.227 -2.801 16.562 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.622 -4.491 16.806 1.00 0.00 H new ATOM 1432 N ILE A 96 5.684 -4.503 14.566 1.00 0.00 N ATOM 1433 CA ILE A 96 5.554 -5.731 13.775 1.00 0.00 C ATOM 1434 C ILE A 96 6.850 -6.545 13.785 1.00 0.00 C ATOM 1435 O ILE A 96 7.659 -6.451 14.709 1.00 0.00 O ATOM 1436 CB ILE A 96 5.199 -5.453 12.294 1.00 0.00 C ATOM 1437 CG1 ILE A 96 6.350 -4.740 11.577 1.00 0.00 C ATOM 1438 CG2 ILE A 96 3.911 -4.662 12.163 1.00 0.00 C ATOM 1439 CD1 ILE A 96 6.693 -3.388 12.147 1.00 0.00 C ATOM 0 H ILE A 96 5.584 -3.641 14.030 1.00 0.00 H new ATOM 0 HA ILE A 96 4.744 -6.288 14.246 1.00 0.00 H new ATOM 0 HB ILE A 96 5.042 -6.418 11.813 1.00 0.00 H new ATOM 0 HG12 ILE A 96 7.236 -5.374 11.618 1.00 0.00 H new ATOM 0 HG13 ILE A 96 6.090 -4.622 10.525 1.00 0.00 H new ATOM 0 HG21 ILE A 96 3.697 -4.488 11.109 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.092 -5.224 12.612 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.018 -3.705 12.675 1.00 0.00 H new ATOM 0 HD11 ILE A 96 7.517 -2.953 11.582 1.00 0.00 H new ATOM 0 HD12 ILE A 96 5.823 -2.734 12.082 1.00 0.00 H new ATOM 0 HD13 ILE A 96 6.987 -3.497 13.191 1.00 0.00 H new ATOM 1451 N ASP A 97 7.048 -7.315 12.716 1.00 0.00 N ATOM 1452 CA ASP A 97 8.245 -8.122 12.537 1.00 0.00 C ATOM 1453 C ASP A 97 9.503 -7.255 12.529 1.00 0.00 C ATOM 1454 O ASP A 97 10.619 -7.768 12.429 1.00 0.00 O ATOM 1455 CB ASP A 97 8.136 -8.886 11.217 1.00 0.00 C ATOM 1456 CG ASP A 97 8.841 -10.228 11.258 1.00 0.00 C ATOM 1457 OD1 ASP A 97 8.628 -10.980 12.232 1.00 0.00 O ATOM 1458 OD2 ASP A 97 9.607 -10.525 10.318 1.00 0.00 O ATOM 0 H ASP A 97 6.379 -7.394 11.950 1.00 0.00 H new ATOM 0 HA ASP A 97 8.324 -8.819 13.371 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.084 -9.040 10.977 1.00 0.00 H new ATOM 0 HB3 ASP A 97 8.561 -8.281 10.416 1.00 0.00 H new ATOM 1463 N ASN A 98 9.302 -5.938 12.602 1.00 0.00 N ATOM 1464 CA ASN A 98 10.392 -4.963 12.597 1.00 0.00 C ATOM 1465 C ASN A 98 10.942 -4.753 11.192 1.00 0.00 C ATOM 1466 O ASN A 98 11.427 -3.670 10.865 1.00 0.00 O ATOM 1467 CB ASN A 98 11.516 -5.377 13.554 1.00 0.00 C ATOM 1468 CG ASN A 98 11.512 -4.567 14.837 1.00 0.00 C ATOM 1469 OD1 ASN A 98 10.642 -3.723 15.051 1.00 0.00 O ATOM 1470 ND2 ASN A 98 12.492 -4.819 15.698 1.00 0.00 N ATOM 0 H ASN A 98 8.375 -5.517 12.666 1.00 0.00 H new ATOM 0 HA ASN A 98 9.979 -4.017 12.946 1.00 0.00 H new ATOM 0 HB2 ASN A 98 11.413 -6.435 13.795 1.00 0.00 H new ATOM 0 HB3 ASN A 98 12.477 -5.256 13.055 1.00 0.00 H new ATOM 0 HD21 ASN A 98 12.544 -4.304 16.577 1.00 0.00 H new ATOM 0 HD22 ASN A 98 13.193 -5.528 15.480 1.00 0.00 H new ATOM 1477 N SER A 99 10.847 -5.779 10.358 1.00 0.00 N ATOM 1478 CA SER A 99 11.295 -5.671 8.977 1.00 0.00 C ATOM 1479 C SER A 99 10.303 -4.838 8.179 1.00 0.00 C ATOM 1480 O SER A 99 10.663 -4.196 7.193 1.00 0.00 O ATOM 1481 CB SER A 99 11.459 -7.051 8.343 1.00 0.00 C ATOM 1482 OG SER A 99 11.954 -7.991 9.281 1.00 0.00 O ATOM 0 H SER A 99 10.466 -6.691 10.612 1.00 0.00 H new ATOM 0 HA SER A 99 12.268 -5.180 8.967 1.00 0.00 H new ATOM 0 HB2 SER A 99 10.499 -7.392 7.955 1.00 0.00 H new ATOM 0 HB3 SER A 99 12.141 -6.986 7.495 1.00 0.00 H new ATOM 0 HG SER A 99 12.048 -8.866 8.849 1.00 0.00 H new ATOM 1488 N GLU A 100 9.052 -4.840 8.632 1.00 0.00 N ATOM 1489 CA GLU A 100 8.009 -4.038 8.009 1.00 0.00 C ATOM 1490 C GLU A 100 8.101 -2.607 8.514 1.00 0.00 C ATOM 1491 O GLU A 100 7.726 -1.666 7.816 1.00 0.00 O ATOM 1492 CB GLU A 100 6.630 -4.628 8.296 1.00 0.00 C ATOM 1493 CG GLU A 100 6.638 -6.142 8.432 1.00 0.00 C ATOM 1494 CD GLU A 100 5.777 -6.827 7.389 1.00 0.00 C ATOM 1495 OE1 GLU A 100 4.688 -6.300 7.080 1.00 0.00 O ATOM 1496 OE2 GLU A 100 6.193 -7.891 6.883 1.00 0.00 O ATOM 0 H GLU A 100 8.738 -5.391 9.431 1.00 0.00 H new ATOM 0 HA GLU A 100 8.153 -4.043 6.929 1.00 0.00 H new ATOM 0 HB2 GLU A 100 6.240 -4.190 9.215 1.00 0.00 H new ATOM 0 HB3 GLU A 100 5.948 -4.346 7.494 1.00 0.00 H new ATOM 0 HG2 GLU A 100 7.662 -6.505 8.347 1.00 0.00 H new ATOM 0 HG3 GLU A 100 6.284 -6.415 9.426 1.00 0.00 H new ATOM 1503 N LEU A 101 8.642 -2.454 9.720 1.00 0.00 N ATOM 1504 CA LEU A 101 8.869 -1.137 10.299 1.00 0.00 C ATOM 1505 C LEU A 101 10.070 -0.487 9.623 1.00 0.00 C ATOM 1506 O LEU A 101 10.199 0.734 9.585 1.00 0.00 O ATOM 1507 CB LEU A 101 9.115 -1.252 11.809 1.00 0.00 C ATOM 1508 CG LEU A 101 9.908 -0.104 12.439 1.00 0.00 C ATOM 1509 CD1 LEU A 101 8.973 0.883 13.119 1.00 0.00 C ATOM 1510 CD2 LEU A 101 10.930 -0.645 13.429 1.00 0.00 C ATOM 0 H LEU A 101 8.931 -3.230 10.315 1.00 0.00 H new ATOM 0 HA LEU A 101 7.984 -0.520 10.139 1.00 0.00 H new ATOM 0 HB2 LEU A 101 8.150 -1.322 12.312 1.00 0.00 H new ATOM 0 HB3 LEU A 101 9.644 -2.185 12.003 1.00 0.00 H new ATOM 0 HG LEU A 101 10.441 0.422 11.647 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.556 1.691 13.561 1.00 0.00 H new ATOM 0 HD12 LEU A 101 8.281 1.294 12.384 1.00 0.00 H new ATOM 0 HD13 LEU A 101 8.411 0.372 13.901 1.00 0.00 H new ATOM 0 HD21 LEU A 101 11.485 0.184 13.868 1.00 0.00 H new ATOM 0 HD22 LEU A 101 10.417 -1.196 14.217 1.00 0.00 H new ATOM 0 HD23 LEU A 101 11.621 -1.311 12.912 1.00 0.00 H new ATOM 1522 N LEU A 102 10.949 -1.333 9.095 1.00 0.00 N ATOM 1523 CA LEU A 102 12.158 -0.878 8.425 1.00 0.00 C ATOM 1524 C LEU A 102 11.896 -0.586 6.954 1.00 0.00 C ATOM 1525 O LEU A 102 12.306 0.450 6.431 1.00 0.00 O ATOM 1526 CB LEU A 102 13.246 -1.950 8.541 1.00 0.00 C ATOM 1527 CG LEU A 102 13.941 -2.073 9.908 1.00 0.00 C ATOM 1528 CD1 LEU A 102 15.414 -2.400 9.721 1.00 0.00 C ATOM 1529 CD2 LEU A 102 13.778 -0.805 10.739 1.00 0.00 C ATOM 0 H LEU A 102 10.843 -2.347 9.120 1.00 0.00 H new ATOM 0 HA LEU A 102 12.486 0.043 8.907 1.00 0.00 H new ATOM 0 HB2 LEU A 102 12.803 -2.915 8.295 1.00 0.00 H new ATOM 0 HB3 LEU A 102 14.007 -1.747 7.788 1.00 0.00 H new ATOM 0 HG LEU A 102 13.462 -2.886 10.453 1.00 0.00 H new ATOM 0 HD11 LEU A 102 15.895 -2.484 10.696 1.00 0.00 H new ATOM 0 HD12 LEU A 102 15.512 -3.344 9.185 1.00 0.00 H new ATOM 0 HD13 LEU A 102 15.893 -1.606 9.148 1.00 0.00 H new ATOM 0 HD21 LEU A 102 14.282 -0.931 11.697 1.00 0.00 H new ATOM 0 HD22 LEU A 102 14.217 0.038 10.206 1.00 0.00 H new ATOM 0 HD23 LEU A 102 12.718 -0.615 10.909 1.00 0.00 H new ATOM 1541 N HIS A 103 11.242 -1.527 6.284 1.00 0.00 N ATOM 1542 CA HIS A 103 10.944 -1.395 4.869 1.00 0.00 C ATOM 1543 C HIS A 103 10.029 -0.204 4.610 1.00 0.00 C ATOM 1544 O HIS A 103 10.229 0.549 3.657 1.00 0.00 O ATOM 1545 CB HIS A 103 10.292 -2.682 4.364 1.00 0.00 C ATOM 1546 CG HIS A 103 10.876 -3.190 3.083 1.00 0.00 C ATOM 1547 ND1 HIS A 103 11.343 -2.331 2.116 1.00 0.00 N ATOM 1548 CD2 HIS A 103 11.050 -4.467 2.663 1.00 0.00 C ATOM 1549 CE1 HIS A 103 11.785 -3.097 1.134 1.00 0.00 C ATOM 1550 NE2 HIS A 103 11.627 -4.397 1.422 1.00 0.00 N ATOM 0 H HIS A 103 10.907 -2.394 6.704 1.00 0.00 H new ATOM 0 HA HIS A 103 11.876 -1.223 4.331 1.00 0.00 H new ATOM 0 HB2 HIS A 103 10.390 -3.453 5.129 1.00 0.00 H new ATOM 0 HB3 HIS A 103 9.225 -2.507 4.223 1.00 0.00 H new ATOM 0 HD2 HIS A 103 10.785 -5.365 3.202 1.00 0.00 H new ATOM 0 HE1 HIS A 103 12.218 -2.724 0.218 1.00 0.00 H new ATOM 0 HE2 HIS A 103 11.887 -5.185 0.829 1.00 0.00 H new ATOM 1558 N MET A 104 9.025 -0.041 5.466 1.00 0.00 N ATOM 1559 CA MET A 104 8.070 1.051 5.336 1.00 0.00 C ATOM 1560 C MET A 104 8.774 2.405 5.326 1.00 0.00 C ATOM 1561 O MET A 104 8.318 3.343 4.674 1.00 0.00 O ATOM 1562 CB MET A 104 7.069 1.000 6.488 1.00 0.00 C ATOM 1563 CG MET A 104 7.712 1.263 7.836 1.00 0.00 C ATOM 1564 SD MET A 104 6.690 2.280 8.914 1.00 0.00 S ATOM 1565 CE MET A 104 5.090 1.526 8.655 1.00 0.00 C ATOM 0 H MET A 104 8.852 -0.656 6.261 1.00 0.00 H new ATOM 0 HA MET A 104 7.547 0.933 4.387 1.00 0.00 H new ATOM 0 HB2 MET A 104 6.284 1.737 6.315 1.00 0.00 H new ATOM 0 HB3 MET A 104 6.589 0.021 6.504 1.00 0.00 H new ATOM 0 HG2 MET A 104 7.915 0.312 8.328 1.00 0.00 H new ATOM 0 HG3 MET A 104 8.673 1.755 7.685 1.00 0.00 H new ATOM 0 HE1 MET A 104 4.403 1.854 9.435 1.00 0.00 H new ATOM 0 HE2 MET A 104 4.701 1.823 7.681 1.00 0.00 H new ATOM 0 HE3 MET A 104 5.189 0.441 8.691 1.00 0.00 H new ATOM 1575 N LEU A 105 9.872 2.508 6.072 1.00 0.00 N ATOM 1576 CA LEU A 105 10.628 3.752 6.150 1.00 0.00 C ATOM 1577 C LEU A 105 11.646 3.843 5.027 1.00 0.00 C ATOM 1578 O LEU A 105 12.268 4.886 4.825 1.00 0.00 O ATOM 1579 CB LEU A 105 11.358 3.854 7.492 1.00 0.00 C ATOM 1580 CG LEU A 105 10.510 3.545 8.722 1.00 0.00 C ATOM 1581 CD1 LEU A 105 11.372 3.539 9.975 1.00 0.00 C ATOM 1582 CD2 LEU A 105 9.383 4.551 8.852 1.00 0.00 C ATOM 0 H LEU A 105 10.256 1.745 6.630 1.00 0.00 H new ATOM 0 HA LEU A 105 9.918 4.573 6.056 1.00 0.00 H new ATOM 0 HB2 LEU A 105 12.208 3.172 7.477 1.00 0.00 H new ATOM 0 HB3 LEU A 105 11.760 4.862 7.592 1.00 0.00 H new ATOM 0 HG LEU A 105 10.074 2.553 8.603 1.00 0.00 H new ATOM 0 HD11 LEU A 105 10.751 3.317 10.843 1.00 0.00 H new ATOM 0 HD12 LEU A 105 12.147 2.779 9.880 1.00 0.00 H new ATOM 0 HD13 LEU A 105 11.836 4.517 10.102 1.00 0.00 H new ATOM 0 HD21 LEU A 105 8.787 4.317 9.734 1.00 0.00 H new ATOM 0 HD22 LEU A 105 9.800 5.553 8.951 1.00 0.00 H new ATOM 0 HD23 LEU A 105 8.751 4.506 7.965 1.00 0.00 H new ATOM 1594 N GLU A 106 11.836 2.740 4.316 1.00 0.00 N ATOM 1595 CA GLU A 106 12.838 2.695 3.263 1.00 0.00 C ATOM 1596 C GLU A 106 12.220 2.660 1.867 1.00 0.00 C ATOM 1597 O GLU A 106 12.934 2.779 0.870 1.00 0.00 O ATOM 1598 CB GLU A 106 13.755 1.481 3.468 1.00 0.00 C ATOM 1599 CG GLU A 106 13.329 0.242 2.693 1.00 0.00 C ATOM 1600 CD GLU A 106 14.318 -0.137 1.608 1.00 0.00 C ATOM 1601 OE1 GLU A 106 14.828 0.776 0.925 1.00 0.00 O ATOM 1602 OE2 GLU A 106 14.583 -1.346 1.441 1.00 0.00 O ATOM 0 H GLU A 106 11.315 1.873 4.448 1.00 0.00 H new ATOM 0 HA GLU A 106 13.421 3.614 3.329 1.00 0.00 H new ATOM 0 HB2 GLU A 106 14.769 1.751 3.172 1.00 0.00 H new ATOM 0 HB3 GLU A 106 13.787 1.239 4.530 1.00 0.00 H new ATOM 0 HG2 GLU A 106 13.216 -0.593 3.384 1.00 0.00 H new ATOM 0 HG3 GLU A 106 12.352 0.418 2.243 1.00 0.00 H new ATOM 1609 N SER A 107 10.903 2.491 1.784 1.00 0.00 N ATOM 1610 CA SER A 107 10.242 2.419 0.485 1.00 0.00 C ATOM 1611 C SER A 107 8.902 3.151 0.488 1.00 0.00 C ATOM 1612 O SER A 107 8.088 2.967 1.393 1.00 0.00 O ATOM 1613 CB SER A 107 10.031 0.959 0.086 1.00 0.00 C ATOM 1614 OG SER A 107 10.168 0.785 -1.314 1.00 0.00 O ATOM 0 H SER A 107 10.281 2.403 2.587 1.00 0.00 H new ATOM 0 HA SER A 107 10.890 2.910 -0.241 1.00 0.00 H new ATOM 0 HB2 SER A 107 10.753 0.329 0.606 1.00 0.00 H new ATOM 0 HB3 SER A 107 9.039 0.633 0.400 1.00 0.00 H new ATOM 0 HG SER A 107 10.030 -0.158 -1.541 1.00 0.00 H new ATOM 1620 N PRO A 108 8.645 3.980 -0.544 1.00 0.00 N ATOM 1621 CA PRO A 108 7.385 4.720 -0.668 1.00 0.00 C ATOM 1622 C PRO A 108 6.221 3.801 -1.018 1.00 0.00 C ATOM 1623 O PRO A 108 5.097 4.254 -1.235 1.00 0.00 O ATOM 1624 CB PRO A 108 7.660 5.700 -1.809 1.00 0.00 C ATOM 1625 CG PRO A 108 8.697 5.027 -2.638 1.00 0.00 C ATOM 1626 CD PRO A 108 9.553 4.246 -1.678 1.00 0.00 C ATOM 0 HA PRO A 108 7.097 5.208 0.263 1.00 0.00 H new ATOM 0 HB2 PRO A 108 6.758 5.899 -2.387 1.00 0.00 H new ATOM 0 HB3 PRO A 108 8.015 6.659 -1.431 1.00 0.00 H new ATOM 0 HG2 PRO A 108 8.239 4.369 -3.377 1.00 0.00 H new ATOM 0 HG3 PRO A 108 9.292 5.757 -3.187 1.00 0.00 H new ATOM 0 HD2 PRO A 108 9.917 3.321 -2.126 1.00 0.00 H new ATOM 0 HD3 PRO A 108 10.428 4.816 -1.366 1.00 0.00 H new ATOM 1634 N GLU A 109 6.507 2.506 -1.076 1.00 0.00 N ATOM 1635 CA GLU A 109 5.496 1.504 -1.382 1.00 0.00 C ATOM 1636 C GLU A 109 5.475 0.427 -0.309 1.00 0.00 C ATOM 1637 O GLU A 109 4.567 -0.399 -0.266 1.00 0.00 O ATOM 1638 CB GLU A 109 5.771 0.875 -2.748 1.00 0.00 C ATOM 1639 CG GLU A 109 5.904 1.890 -3.872 1.00 0.00 C ATOM 1640 CD GLU A 109 5.660 1.282 -5.239 1.00 0.00 C ATOM 1641 OE1 GLU A 109 4.626 0.604 -5.411 1.00 0.00 O ATOM 1642 OE2 GLU A 109 6.505 1.483 -6.136 1.00 0.00 O ATOM 0 H GLU A 109 7.439 2.124 -0.914 1.00 0.00 H new ATOM 0 HA GLU A 109 4.522 1.993 -1.407 1.00 0.00 H new ATOM 0 HB2 GLU A 109 6.688 0.288 -2.690 1.00 0.00 H new ATOM 0 HB3 GLU A 109 4.964 0.183 -2.989 1.00 0.00 H new ATOM 0 HG2 GLU A 109 5.196 2.703 -3.708 1.00 0.00 H new ATOM 0 HG3 GLU A 109 6.902 2.327 -3.846 1.00 0.00 H new ATOM 1649 N SER A 110 6.484 0.440 0.559 1.00 0.00 N ATOM 1650 CA SER A 110 6.551 -0.513 1.656 1.00 0.00 C ATOM 1651 C SER A 110 5.630 -0.071 2.773 1.00 0.00 C ATOM 1652 O SER A 110 4.846 -0.854 3.294 1.00 0.00 O ATOM 1653 CB SER A 110 7.977 -0.649 2.176 1.00 0.00 C ATOM 1654 OG SER A 110 8.575 -1.846 1.714 1.00 0.00 O ATOM 0 H SER A 110 7.262 1.099 0.522 1.00 0.00 H new ATOM 0 HA SER A 110 6.232 -1.488 1.287 1.00 0.00 H new ATOM 0 HB2 SER A 110 8.569 0.206 1.851 1.00 0.00 H new ATOM 0 HB3 SER A 110 7.973 -0.638 3.266 1.00 0.00 H new ATOM 0 HG SER A 110 9.542 -1.715 1.625 1.00 0.00 H new ATOM 1660 N LEU A 111 5.703 1.206 3.102 1.00 0.00 N ATOM 1661 CA LEU A 111 4.823 1.785 4.094 1.00 0.00 C ATOM 1662 C LEU A 111 3.386 1.357 3.802 1.00 0.00 C ATOM 1663 O LEU A 111 2.641 0.973 4.703 1.00 0.00 O ATOM 1664 CB LEU A 111 4.972 3.312 4.038 1.00 0.00 C ATOM 1665 CG LEU A 111 4.407 4.119 5.215 1.00 0.00 C ATOM 1666 CD1 LEU A 111 3.021 3.641 5.620 1.00 0.00 C ATOM 1667 CD2 LEU A 111 5.362 4.074 6.395 1.00 0.00 C ATOM 0 H LEU A 111 6.367 1.863 2.693 1.00 0.00 H new ATOM 0 HA LEU A 111 5.081 1.440 5.095 1.00 0.00 H new ATOM 0 HB2 LEU A 111 6.033 3.544 3.949 1.00 0.00 H new ATOM 0 HB3 LEU A 111 4.491 3.664 3.126 1.00 0.00 H new ATOM 0 HG LEU A 111 4.305 5.153 4.886 1.00 0.00 H new ATOM 0 HD11 LEU A 111 2.660 4.240 6.456 1.00 0.00 H new ATOM 0 HD12 LEU A 111 2.339 3.747 4.776 1.00 0.00 H new ATOM 0 HD13 LEU A 111 3.070 2.594 5.918 1.00 0.00 H new ATOM 0 HD21 LEU A 111 4.947 4.651 7.221 1.00 0.00 H new ATOM 0 HD22 LEU A 111 5.503 3.040 6.709 1.00 0.00 H new ATOM 0 HD23 LEU A 111 6.322 4.499 6.102 1.00 0.00 H new ATOM 1679 N ARG A 112 3.037 1.347 2.521 1.00 0.00 N ATOM 1680 CA ARG A 112 1.701 0.955 2.096 1.00 0.00 C ATOM 1681 C ARG A 112 1.553 -0.565 2.056 1.00 0.00 C ATOM 1682 O ARG A 112 0.663 -1.123 2.695 1.00 0.00 O ATOM 1683 CB ARG A 112 1.391 1.561 0.724 1.00 0.00 C ATOM 1684 CG ARG A 112 0.634 0.628 -0.205 1.00 0.00 C ATOM 1685 CD ARG A 112 0.220 1.334 -1.485 1.00 0.00 C ATOM 1686 NE ARG A 112 -0.581 0.473 -2.350 1.00 0.00 N ATOM 1687 CZ ARG A 112 -0.245 0.164 -3.599 1.00 0.00 C ATOM 1688 NH1 ARG A 112 0.873 0.642 -4.126 1.00 0.00 N ATOM 1689 NH2 ARG A 112 -1.028 -0.628 -4.320 1.00 0.00 N ATOM 0 H ARG A 112 3.663 1.607 1.758 1.00 0.00 H new ATOM 0 HA ARG A 112 0.986 1.337 2.825 1.00 0.00 H new ATOM 0 HB2 ARG A 112 0.807 2.471 0.863 1.00 0.00 H new ATOM 0 HB3 ARG A 112 2.327 1.852 0.247 1.00 0.00 H new ATOM 0 HG2 ARG A 112 1.259 -0.231 -0.448 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -0.251 0.245 0.304 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -0.350 2.230 -1.237 1.00 0.00 H new ATOM 0 HD3 ARG A 112 1.110 1.661 -2.023 1.00 0.00 H new ATOM 0 HE ARG A 112 -1.447 0.087 -1.975 1.00 0.00 H new ATOM 0 HH11 ARG A 112 1.479 1.249 -3.573 1.00 0.00 H new ATOM 0 HH12 ARG A 112 1.128 0.403 -5.084 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -1.888 -1.000 -3.916 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -0.770 -0.865 -5.278 1.00 0.00 H new ATOM 1703 N SER A 113 2.409 -1.225 1.281 1.00 0.00 N ATOM 1704 CA SER A 113 2.359 -2.677 1.143 1.00 0.00 C ATOM 1705 C SER A 113 2.404 -3.352 2.508 1.00 0.00 C ATOM 1706 O SER A 113 1.504 -4.109 2.865 1.00 0.00 O ATOM 1707 CB SER A 113 3.521 -3.171 0.279 1.00 0.00 C ATOM 1708 OG SER A 113 3.518 -4.585 0.179 1.00 0.00 O ATOM 0 H SER A 113 3.147 -0.776 0.738 1.00 0.00 H new ATOM 0 HA SER A 113 1.419 -2.938 0.657 1.00 0.00 H new ATOM 0 HB2 SER A 113 3.450 -2.733 -0.717 1.00 0.00 H new ATOM 0 HB3 SER A 113 4.465 -2.836 0.708 1.00 0.00 H new ATOM 0 HG SER A 113 4.269 -4.875 -0.379 1.00 0.00 H new ATOM 1714 N LYS A 114 3.449 -3.055 3.270 1.00 0.00 N ATOM 1715 CA LYS A 114 3.621 -3.624 4.599 1.00 0.00 C ATOM 1716 C LYS A 114 2.399 -3.370 5.476 1.00 0.00 C ATOM 1717 O LYS A 114 2.068 -4.189 6.328 1.00 0.00 O ATOM 1718 CB LYS A 114 4.869 -3.049 5.273 1.00 0.00 C ATOM 1719 CG LYS A 114 6.146 -3.269 4.479 1.00 0.00 C ATOM 1720 CD LYS A 114 6.520 -4.741 4.414 1.00 0.00 C ATOM 1721 CE LYS A 114 6.816 -5.177 2.989 1.00 0.00 C ATOM 1722 NZ LYS A 114 5.628 -5.797 2.340 1.00 0.00 N ATOM 0 H LYS A 114 4.194 -2.419 2.987 1.00 0.00 H new ATOM 0 HA LYS A 114 3.741 -4.701 4.481 1.00 0.00 H new ATOM 0 HB2 LYS A 114 4.728 -1.979 5.428 1.00 0.00 H new ATOM 0 HB3 LYS A 114 4.981 -3.502 6.258 1.00 0.00 H new ATOM 0 HG2 LYS A 114 6.018 -2.881 3.469 1.00 0.00 H new ATOM 0 HG3 LYS A 114 6.960 -2.706 4.936 1.00 0.00 H new ATOM 0 HD2 LYS A 114 7.393 -4.924 5.040 1.00 0.00 H new ATOM 0 HD3 LYS A 114 5.706 -5.343 4.818 1.00 0.00 H new ATOM 0 HE2 LYS A 114 7.140 -4.315 2.406 1.00 0.00 H new ATOM 0 HE3 LYS A 114 7.641 -5.889 2.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 5.936 -6.374 1.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 5.133 -6.401 3.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 4.985 -5.050 2.008 1.00 0.00 H new ATOM 1736 N VAL A 115 1.733 -2.231 5.273 1.00 0.00 N ATOM 1737 CA VAL A 115 0.545 -1.908 6.056 1.00 0.00 C ATOM 1738 C VAL A 115 -0.625 -2.791 5.632 1.00 0.00 C ATOM 1739 O VAL A 115 -1.170 -3.537 6.443 1.00 0.00 O ATOM 1740 CB VAL A 115 0.169 -0.411 5.940 1.00 0.00 C ATOM 1741 CG1 VAL A 115 -1.336 -0.191 6.033 1.00 0.00 C ATOM 1742 CG2 VAL A 115 0.877 0.382 7.024 1.00 0.00 C ATOM 0 H VAL A 115 1.994 -1.527 4.582 1.00 0.00 H new ATOM 0 HA VAL A 115 0.775 -2.105 7.103 1.00 0.00 H new ATOM 0 HB VAL A 115 0.491 -0.064 4.958 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -1.554 0.873 5.947 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -1.833 -0.730 5.226 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -1.699 -0.559 6.993 1.00 0.00 H new ATOM 0 HG21 VAL A 115 0.609 1.435 6.938 1.00 0.00 H new ATOM 0 HG22 VAL A 115 0.575 0.010 8.003 1.00 0.00 H new ATOM 0 HG23 VAL A 115 1.955 0.271 6.910 1.00 0.00 H new ATOM 1752 N ASP A 116 -0.985 -2.728 4.352 1.00 0.00 N ATOM 1753 CA ASP A 116 -2.068 -3.548 3.823 1.00 0.00 C ATOM 1754 C ASP A 116 -1.810 -5.023 4.122 1.00 0.00 C ATOM 1755 O ASP A 116 -2.742 -5.807 4.311 1.00 0.00 O ATOM 1756 CB ASP A 116 -2.208 -3.331 2.314 1.00 0.00 C ATOM 1757 CG ASP A 116 -2.758 -4.549 1.596 1.00 0.00 C ATOM 1758 OD1 ASP A 116 -3.920 -4.922 1.864 1.00 0.00 O ATOM 1759 OD2 ASP A 116 -2.026 -5.132 0.770 1.00 0.00 O ATOM 0 H ASP A 116 -0.542 -2.118 3.664 1.00 0.00 H new ATOM 0 HA ASP A 116 -2.998 -3.251 4.307 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -2.865 -2.480 2.133 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -1.234 -3.077 1.896 1.00 0.00 H new ATOM 1764 N GLU A 117 -0.534 -5.391 4.163 1.00 0.00 N ATOM 1765 CA GLU A 117 -0.142 -6.758 4.471 1.00 0.00 C ATOM 1766 C GLU A 117 -0.194 -6.983 5.971 1.00 0.00 C ATOM 1767 O GLU A 117 -0.505 -8.079 6.437 1.00 0.00 O ATOM 1768 CB GLU A 117 1.265 -7.045 3.943 1.00 0.00 C ATOM 1769 CG GLU A 117 1.329 -7.193 2.431 1.00 0.00 C ATOM 1770 CD GLU A 117 1.332 -8.642 1.985 1.00 0.00 C ATOM 1771 OE1 GLU A 117 2.010 -9.463 2.638 1.00 0.00 O ATOM 1772 OE2 GLU A 117 0.655 -8.956 0.983 1.00 0.00 O ATOM 0 H GLU A 117 0.247 -4.759 3.986 1.00 0.00 H new ATOM 0 HA GLU A 117 -0.838 -7.440 3.983 1.00 0.00 H new ATOM 0 HB2 GLU A 117 1.931 -6.238 4.249 1.00 0.00 H new ATOM 0 HB3 GLU A 117 1.638 -7.959 4.405 1.00 0.00 H new ATOM 0 HG2 GLU A 117 0.477 -6.681 1.983 1.00 0.00 H new ATOM 0 HG3 GLU A 117 2.228 -6.701 2.059 1.00 0.00 H new ATOM 1779 N ALA A 118 0.097 -5.927 6.723 1.00 0.00 N ATOM 1780 CA ALA A 118 0.031 -5.993 8.172 1.00 0.00 C ATOM 1781 C ALA A 118 -1.414 -6.108 8.614 1.00 0.00 C ATOM 1782 O ALA A 118 -1.697 -6.562 9.714 1.00 0.00 O ATOM 1783 CB ALA A 118 0.692 -4.783 8.807 1.00 0.00 C ATOM 0 H ALA A 118 0.379 -5.020 6.352 1.00 0.00 H new ATOM 0 HA ALA A 118 0.576 -6.877 8.504 1.00 0.00 H new ATOM 0 HB1 ALA A 118 0.627 -4.861 9.892 1.00 0.00 H new ATOM 0 HB2 ALA A 118 1.739 -4.742 8.508 1.00 0.00 H new ATOM 0 HB3 ALA A 118 0.185 -3.876 8.477 1.00 0.00 H new ATOM 1789 N VAL A 119 -2.330 -5.706 7.736 1.00 0.00 N ATOM 1790 CA VAL A 119 -3.748 -5.839 8.014 1.00 0.00 C ATOM 1791 C VAL A 119 -4.136 -7.300 7.996 1.00 0.00 C ATOM 1792 O VAL A 119 -4.801 -7.789 8.904 1.00 0.00 O ATOM 1793 CB VAL A 119 -4.611 -5.091 7.001 1.00 0.00 C ATOM 1794 CG1 VAL A 119 -6.058 -5.101 7.459 1.00 0.00 C ATOM 1795 CG2 VAL A 119 -4.099 -3.674 6.815 1.00 0.00 C ATOM 0 H VAL A 119 -2.112 -5.288 6.832 1.00 0.00 H new ATOM 0 HA VAL A 119 -3.924 -5.403 8.997 1.00 0.00 H new ATOM 0 HB VAL A 119 -4.553 -5.592 6.035 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -6.673 -4.567 6.735 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.407 -6.131 7.541 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -6.135 -4.613 8.431 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.724 -3.153 6.090 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -4.133 -3.147 7.768 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.071 -3.703 6.453 1.00 0.00 H new ATOM 1805 N ALA A 120 -3.697 -7.995 6.954 1.00 0.00 N ATOM 1806 CA ALA A 120 -3.942 -9.420 6.843 1.00 0.00 C ATOM 1807 C ALA A 120 -3.332 -10.133 8.037 1.00 0.00 C ATOM 1808 O ALA A 120 -3.779 -11.206 8.439 1.00 0.00 O ATOM 1809 CB ALA A 120 -3.353 -9.955 5.547 1.00 0.00 C ATOM 0 H ALA A 120 -3.171 -7.593 6.178 1.00 0.00 H new ATOM 0 HA ALA A 120 -5.017 -9.601 6.831 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.544 -11.026 5.476 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -3.815 -9.447 4.700 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.278 -9.776 5.535 1.00 0.00 H new ATOM 1815 N VAL A 121 -2.313 -9.500 8.605 1.00 0.00 N ATOM 1816 CA VAL A 121 -1.624 -10.017 9.774 1.00 0.00 C ATOM 1817 C VAL A 121 -2.345 -9.578 11.044 1.00 0.00 C ATOM 1818 O VAL A 121 -2.410 -10.316 12.031 1.00 0.00 O ATOM 1819 CB VAL A 121 -0.165 -9.514 9.793 1.00 0.00 C ATOM 1820 CG1 VAL A 121 0.429 -9.582 11.188 1.00 0.00 C ATOM 1821 CG2 VAL A 121 0.677 -10.306 8.804 1.00 0.00 C ATOM 0 H VAL A 121 -1.943 -8.612 8.265 1.00 0.00 H new ATOM 0 HA VAL A 121 -1.622 -11.106 9.729 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.164 -8.467 9.491 1.00 0.00 H new ATOM 0 HG11 VAL A 121 1.457 -9.220 11.164 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -0.158 -8.961 11.864 1.00 0.00 H new ATOM 0 HG13 VAL A 121 0.416 -10.614 11.539 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.704 -9.942 8.827 1.00 0.00 H new ATOM 0 HG22 VAL A 121 0.660 -11.362 9.075 1.00 0.00 H new ATOM 0 HG23 VAL A 121 0.271 -10.183 7.800 1.00 0.00 H new ATOM 1831 N LEU A 122 -2.895 -8.371 11.001 1.00 0.00 N ATOM 1832 CA LEU A 122 -3.647 -7.830 12.120 1.00 0.00 C ATOM 1833 C LEU A 122 -4.923 -8.633 12.299 1.00 0.00 C ATOM 1834 O LEU A 122 -5.388 -8.856 13.415 1.00 0.00 O ATOM 1835 CB LEU A 122 -3.950 -6.345 11.883 1.00 0.00 C ATOM 1836 CG LEU A 122 -5.412 -5.923 12.060 1.00 0.00 C ATOM 1837 CD1 LEU A 122 -5.623 -5.331 13.443 1.00 0.00 C ATOM 1838 CD2 LEU A 122 -5.812 -4.926 10.983 1.00 0.00 C ATOM 0 H LEU A 122 -2.832 -7.747 10.197 1.00 0.00 H new ATOM 0 HA LEU A 122 -3.058 -7.906 13.034 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -3.337 -5.756 12.565 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -3.638 -6.088 10.871 1.00 0.00 H new ATOM 0 HG LEU A 122 -6.045 -6.805 11.960 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -6.666 -5.035 13.557 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -5.372 -6.075 14.199 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -4.982 -4.458 13.567 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -6.853 -4.637 11.124 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -5.178 -4.042 11.052 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -5.692 -5.384 10.001 1.00 0.00 H new ATOM 1850 N GLN A 123 -5.453 -9.101 11.177 1.00 0.00 N ATOM 1851 CA GLN A 123 -6.636 -9.942 11.176 1.00 0.00 C ATOM 1852 C GLN A 123 -6.243 -11.379 11.504 1.00 0.00 C ATOM 1853 O GLN A 123 -7.035 -12.148 12.048 1.00 0.00 O ATOM 1854 CB GLN A 123 -7.325 -9.878 9.810 1.00 0.00 C ATOM 1855 CG GLN A 123 -7.938 -8.522 9.497 1.00 0.00 C ATOM 1856 CD GLN A 123 -9.442 -8.589 9.316 1.00 0.00 C ATOM 1857 OE1 GLN A 123 -9.940 -8.676 8.193 1.00 0.00 O ATOM 1858 NE2 GLN A 123 -10.174 -8.549 10.424 1.00 0.00 N ATOM 0 H GLN A 123 -5.076 -8.908 10.249 1.00 0.00 H new ATOM 0 HA GLN A 123 -7.333 -9.583 11.933 1.00 0.00 H new ATOM 0 HB2 GLN A 123 -6.600 -10.126 9.035 1.00 0.00 H new ATOM 0 HB3 GLN A 123 -8.106 -10.638 9.771 1.00 0.00 H new ATOM 0 HG2 GLN A 123 -7.704 -7.827 10.303 1.00 0.00 H new ATOM 0 HG3 GLN A 123 -7.484 -8.123 8.590 1.00 0.00 H new ATOM 0 HE21 GLN A 123 -9.719 -8.477 11.334 1.00 0.00 H new ATOM 0 HE22 GLN A 123 -11.191 -8.591 10.365 1.00 0.00 H new ATOM 1867 N ALA A 124 -4.999 -11.723 11.172 1.00 0.00 N ATOM 1868 CA ALA A 124 -4.466 -13.056 11.433 1.00 0.00 C ATOM 1869 C ALA A 124 -3.829 -13.137 12.806 1.00 0.00 C ATOM 1870 O ALA A 124 -3.182 -14.128 13.141 1.00 0.00 O ATOM 1871 CB ALA A 124 -3.452 -13.435 10.372 1.00 0.00 C ATOM 0 H ALA A 124 -4.339 -11.091 10.719 1.00 0.00 H new ATOM 0 HA ALA A 124 -5.299 -13.758 11.402 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -3.063 -14.432 10.580 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -3.931 -13.429 9.393 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -2.632 -12.717 10.379 1.00 0.00 H new ATOM 1877 N HIS A 125 -4.008 -12.093 13.592 1.00 0.00 N ATOM 1878 CA HIS A 125 -3.501 -12.073 14.951 1.00 0.00 C ATOM 1879 C HIS A 125 -4.636 -11.752 15.911 1.00 0.00 C ATOM 1880 O HIS A 125 -4.652 -12.205 17.055 1.00 0.00 O ATOM 1881 CB HIS A 125 -2.377 -11.045 15.095 1.00 0.00 C ATOM 1882 CG HIS A 125 -1.204 -11.542 15.883 1.00 0.00 C ATOM 1883 ND1 HIS A 125 -0.343 -12.484 15.372 1.00 0.00 N ATOM 1884 CD2 HIS A 125 -0.796 -11.199 17.129 1.00 0.00 C ATOM 1885 CE1 HIS A 125 0.563 -12.694 16.310 1.00 0.00 C ATOM 1886 NE2 HIS A 125 0.328 -11.938 17.392 1.00 0.00 N ATOM 0 H HIS A 125 -4.502 -11.246 13.312 1.00 0.00 H new ATOM 0 HA HIS A 125 -3.093 -13.055 15.190 1.00 0.00 H new ATOM 0 HB2 HIS A 125 -2.038 -10.749 14.102 1.00 0.00 H new ATOM 0 HB3 HIS A 125 -2.774 -10.151 15.576 1.00 0.00 H new ATOM 0 HD2 HIS A 125 -1.265 -10.483 17.787 1.00 0.00 H new ATOM 0 HE1 HIS A 125 1.387 -13.386 16.217 1.00 0.00 H new ATOM 0 HE2 HIS A 125 0.881 -11.917 18.249 1.00 0.00 H new ATOM 1894 N GLN A 126 -5.580 -10.952 15.426 1.00 0.00 N ATOM 1895 CA GLN A 126 -6.747 -10.570 16.213 1.00 0.00 C ATOM 1896 C GLN A 126 -7.890 -11.567 16.028 1.00 0.00 C ATOM 1897 O GLN A 126 -8.317 -12.220 16.981 1.00 0.00 O ATOM 1898 CB GLN A 126 -7.213 -9.166 15.821 1.00 0.00 C ATOM 1899 CG GLN A 126 -6.281 -8.063 16.295 1.00 0.00 C ATOM 1900 CD GLN A 126 -6.559 -7.640 17.724 1.00 0.00 C ATOM 1901 OE1 GLN A 126 -7.262 -6.659 17.968 1.00 0.00 O ATOM 1902 NE2 GLN A 126 -6.007 -8.381 18.678 1.00 0.00 N ATOM 0 H GLN A 126 -5.559 -10.554 14.487 1.00 0.00 H new ATOM 0 HA GLN A 126 -6.458 -10.573 17.264 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -7.305 -9.112 14.736 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -8.207 -8.993 16.234 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -5.249 -8.405 16.215 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -6.382 -7.199 15.638 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -5.431 -9.186 18.430 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -6.159 -8.145 19.659 1.00 0.00 H new ATOM 1911 N ALA A 127 -8.395 -11.661 14.800 1.00 0.00 N ATOM 1912 CA ALA A 127 -9.519 -12.543 14.494 1.00 0.00 C ATOM 1913 C ALA A 127 -9.057 -13.896 13.961 1.00 0.00 C ATOM 1914 O ALA A 127 -9.844 -14.640 13.374 1.00 0.00 O ATOM 1915 CB ALA A 127 -10.450 -11.875 13.495 1.00 0.00 C ATOM 0 H ALA A 127 -8.043 -11.136 13.999 1.00 0.00 H new ATOM 0 HA ALA A 127 -10.056 -12.726 15.425 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -11.284 -12.541 13.274 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -10.830 -10.945 13.917 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -9.904 -11.660 12.576 1.00 0.00 H new ATOM 1921 N LYS A 128 -7.785 -14.218 14.173 1.00 0.00 N ATOM 1922 CA LYS A 128 -7.238 -15.497 13.730 1.00 0.00 C ATOM 1923 C LYS A 128 -7.784 -16.635 14.580 1.00 0.00 C ATOM 1924 O LYS A 128 -8.911 -16.573 15.072 1.00 0.00 O ATOM 1925 CB LYS A 128 -5.712 -15.483 13.835 1.00 0.00 C ATOM 1926 CG LYS A 128 -5.203 -15.010 15.187 1.00 0.00 C ATOM 1927 CD LYS A 128 -3.868 -15.650 15.544 1.00 0.00 C ATOM 1928 CE LYS A 128 -4.003 -17.146 15.779 1.00 0.00 C ATOM 1929 NZ LYS A 128 -2.917 -17.671 16.652 1.00 0.00 N ATOM 0 H LYS A 128 -7.115 -13.613 14.647 1.00 0.00 H new ATOM 0 HA LYS A 128 -7.533 -15.650 12.692 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -5.333 -16.487 13.644 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -5.308 -14.836 13.057 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -5.095 -13.925 15.175 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -5.938 -15.249 15.956 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -3.153 -15.471 14.741 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -3.466 -15.176 16.440 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -4.970 -17.356 16.236 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -3.983 -17.667 14.822 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -3.045 -18.694 16.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -1.995 -17.494 16.204 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -2.951 -17.192 17.575 1.00 0.00 H new ATOM 1943 N GLU A 129 -6.962 -17.662 14.777 1.00 0.00 N ATOM 1944 CA GLU A 129 -7.324 -18.765 15.649 1.00 0.00 C ATOM 1945 C GLU A 129 -7.055 -18.354 17.088 1.00 0.00 C ATOM 1946 O GLU A 129 -7.090 -19.170 18.008 1.00 0.00 O ATOM 1947 CB GLU A 129 -6.521 -20.018 15.295 1.00 0.00 C ATOM 1948 CG GLU A 129 -6.804 -20.549 13.899 1.00 0.00 C ATOM 1949 CD GLU A 129 -5.927 -21.731 13.533 1.00 0.00 C ATOM 1950 OE1 GLU A 129 -5.519 -22.475 14.449 1.00 0.00 O ATOM 1951 OE2 GLU A 129 -5.650 -21.913 12.329 1.00 0.00 O ATOM 0 H GLU A 129 -6.043 -17.749 14.343 1.00 0.00 H new ATOM 0 HA GLU A 129 -8.381 -18.999 15.522 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -5.458 -19.794 15.381 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -6.742 -20.799 16.023 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -7.851 -20.844 13.833 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -6.652 -19.750 13.173 1.00 0.00 H new ATOM 1958 N ALA A 130 -6.774 -17.063 17.254 1.00 0.00 N ATOM 1959 CA ALA A 130 -6.466 -16.488 18.551 1.00 0.00 C ATOM 1960 C ALA A 130 -7.606 -16.705 19.540 1.00 0.00 C ATOM 1961 O ALA A 130 -7.405 -16.667 20.753 1.00 0.00 O ATOM 1962 CB ALA A 130 -6.170 -15.003 18.393 1.00 0.00 C ATOM 0 H ALA A 130 -6.755 -16.390 16.488 1.00 0.00 H new ATOM 0 HA ALA A 130 -5.586 -16.991 18.952 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -5.939 -14.572 19.367 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -5.318 -14.871 17.726 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -7.041 -14.501 17.972 1.00 0.00 H new ATOM 1968 N ALA A 131 -8.806 -16.934 19.012 1.00 0.00 N ATOM 1969 CA ALA A 131 -9.981 -17.157 19.847 1.00 0.00 C ATOM 1970 C ALA A 131 -10.071 -18.615 20.289 1.00 0.00 C ATOM 1971 O ALA A 131 -9.137 -19.392 20.093 1.00 0.00 O ATOM 1972 CB ALA A 131 -11.243 -16.747 19.104 1.00 0.00 C ATOM 0 H ALA A 131 -8.989 -16.970 18.009 1.00 0.00 H new ATOM 0 HA ALA A 131 -9.885 -16.540 20.740 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -12.112 -16.919 19.740 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -11.186 -15.690 18.846 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -11.337 -17.338 18.193 1.00 0.00 H new ATOM 1978 N GLN A 132 -11.202 -18.978 20.887 1.00 0.00 N ATOM 1979 CA GLN A 132 -11.416 -20.341 21.359 1.00 0.00 C ATOM 1980 C GLN A 132 -11.602 -21.303 20.190 1.00 0.00 C ATOM 1981 O GLN A 132 -10.691 -22.054 19.841 1.00 0.00 O ATOM 1982 CB GLN A 132 -12.636 -20.398 22.281 1.00 0.00 C ATOM 1983 CG GLN A 132 -12.319 -20.066 23.729 1.00 0.00 C ATOM 1984 CD GLN A 132 -13.541 -20.135 24.625 1.00 0.00 C ATOM 1985 OE1 GLN A 132 -14.128 -21.201 24.812 1.00 0.00 O ATOM 1986 NE2 GLN A 132 -13.931 -18.995 25.184 1.00 0.00 N ATOM 0 H GLN A 132 -11.985 -18.346 21.056 1.00 0.00 H new ATOM 0 HA GLN A 132 -10.531 -20.647 21.917 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -13.391 -19.703 21.914 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -13.071 -21.396 22.233 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -11.562 -20.758 24.099 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -11.890 -19.066 23.783 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -13.415 -18.135 25.001 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -14.747 -18.980 25.796 1.00 0.00 H new ATOM 1995 N LYS A 133 -12.789 -21.277 19.590 1.00 0.00 N ATOM 1996 CA LYS A 133 -13.096 -22.149 18.463 1.00 0.00 C ATOM 1997 C LYS A 133 -12.234 -21.801 17.254 1.00 0.00 C ATOM 1998 O LYS A 133 -12.287 -20.682 16.742 1.00 0.00 O ATOM 1999 CB LYS A 133 -14.576 -22.040 18.095 1.00 0.00 C ATOM 2000 CG LYS A 133 -15.500 -22.748 19.074 1.00 0.00 C ATOM 2001 CD LYS A 133 -15.908 -21.832 20.216 1.00 0.00 C ATOM 2002 CE LYS A 133 -16.716 -22.577 21.267 1.00 0.00 C ATOM 2003 NZ LYS A 133 -15.891 -22.934 22.455 1.00 0.00 N ATOM 0 H LYS A 133 -13.553 -20.661 19.866 1.00 0.00 H new ATOM 0 HA LYS A 133 -12.877 -23.174 18.760 1.00 0.00 H new ATOM 0 HB2 LYS A 133 -14.853 -20.987 18.044 1.00 0.00 H new ATOM 0 HB3 LYS A 133 -14.726 -22.458 17.099 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -16.390 -23.096 18.549 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -15.001 -23.630 19.474 1.00 0.00 H new ATOM 0 HD2 LYS A 133 -15.017 -21.404 20.676 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -16.496 -21.001 19.825 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -17.558 -21.960 21.582 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -17.132 -23.484 20.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 -16.480 -23.440 23.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 -15.102 -23.544 22.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 -15.514 -22.067 22.889 1.00 0.00 H new ATOM 2017 N ALA A 134 -11.442 -22.767 16.802 1.00 0.00 N ATOM 2018 CA ALA A 134 -10.565 -22.563 15.655 1.00 0.00 C ATOM 2019 C ALA A 134 -11.293 -22.853 14.346 1.00 0.00 C ATOM 2020 O ALA A 134 -10.734 -23.463 13.434 1.00 0.00 O ATOM 2021 CB ALA A 134 -9.324 -23.435 15.779 1.00 0.00 C ATOM 0 H ALA A 134 -11.389 -23.699 17.212 1.00 0.00 H new ATOM 0 HA ALA A 134 -10.260 -21.517 15.643 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -8.678 -23.273 14.916 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -8.785 -23.174 16.690 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -9.619 -24.484 15.820 1.00 0.00 H new ATOM 2027 N VAL A 135 -12.542 -22.408 14.259 1.00 0.00 N ATOM 2028 CA VAL A 135 -13.346 -22.614 13.060 1.00 0.00 C ATOM 2029 C VAL A 135 -13.350 -21.365 12.184 1.00 0.00 C ATOM 2030 O VAL A 135 -12.949 -20.287 12.622 1.00 0.00 O ATOM 2031 CB VAL A 135 -14.802 -22.990 13.404 1.00 0.00 C ATOM 2032 CG1 VAL A 135 -15.335 -24.014 12.413 1.00 0.00 C ATOM 2033 CG2 VAL A 135 -14.905 -23.515 14.829 1.00 0.00 C ATOM 0 H VAL A 135 -13.020 -21.902 15.005 1.00 0.00 H new ATOM 0 HA VAL A 135 -12.890 -23.441 12.516 1.00 0.00 H new ATOM 0 HB VAL A 135 -15.413 -22.090 13.332 1.00 0.00 H new ATOM 0 HG11 VAL A 135 -16.363 -24.268 12.670 1.00 0.00 H new ATOM 0 HG12 VAL A 135 -15.305 -23.596 11.407 1.00 0.00 H new ATOM 0 HG13 VAL A 135 -14.719 -24.912 12.451 1.00 0.00 H new ATOM 0 HG21 VAL A 135 -15.941 -23.773 15.048 1.00 0.00 H new ATOM 0 HG22 VAL A 135 -14.280 -24.401 14.936 1.00 0.00 H new ATOM 0 HG23 VAL A 135 -14.568 -22.747 15.525 1.00 0.00 H new ATOM 2043 N ASN A 136 -13.804 -21.519 10.944 1.00 0.00 N ATOM 2044 CA ASN A 136 -13.858 -20.404 10.006 1.00 0.00 C ATOM 2045 C ASN A 136 -15.218 -19.714 10.058 1.00 0.00 C ATOM 2046 O ASN A 136 -15.955 -19.694 9.071 1.00 0.00 O ATOM 2047 CB ASN A 136 -13.571 -20.894 8.585 1.00 0.00 C ATOM 2048 CG ASN A 136 -12.229 -21.590 8.475 1.00 0.00 C ATOM 2049 OD1 ASN A 136 -11.297 -21.289 9.220 1.00 0.00 O ATOM 2050 ND2 ASN A 136 -12.123 -22.528 7.540 1.00 0.00 N ATOM 0 H ASN A 136 -14.140 -22.405 10.566 1.00 0.00 H new ATOM 0 HA ASN A 136 -13.095 -19.680 10.293 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -14.359 -21.579 8.273 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -13.595 -20.047 7.899 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -11.243 -23.030 7.419 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -12.921 -22.746 6.944 1.00 0.00 H new ATOM 2057 N SER A 137 -15.545 -19.147 11.215 1.00 0.00 N ATOM 2058 CA SER A 137 -16.817 -18.460 11.400 1.00 0.00 C ATOM 2059 C SER A 137 -16.636 -16.946 11.328 1.00 0.00 C ATOM 2060 O SER A 137 -15.513 -16.447 11.259 1.00 0.00 O ATOM 2061 CB SER A 137 -17.437 -18.846 12.744 1.00 0.00 C ATOM 2062 OG SER A 137 -16.658 -19.828 13.402 1.00 0.00 O ATOM 0 H SER A 137 -14.945 -19.150 12.040 1.00 0.00 H new ATOM 0 HA SER A 137 -17.486 -18.766 10.596 1.00 0.00 H new ATOM 0 HB2 SER A 137 -17.522 -17.962 13.376 1.00 0.00 H new ATOM 0 HB3 SER A 137 -18.447 -19.224 12.587 1.00 0.00 H new ATOM 0 HG SER A 137 -17.075 -20.056 14.259 1.00 0.00 H new ATOM 2068 N ALA A 138 -17.751 -16.223 11.345 1.00 0.00 N ATOM 2069 CA ALA A 138 -17.722 -14.766 11.281 1.00 0.00 C ATOM 2070 C ALA A 138 -17.075 -14.176 12.529 1.00 0.00 C ATOM 2071 O ALA A 138 -17.284 -14.666 13.639 1.00 0.00 O ATOM 2072 CB ALA A 138 -19.130 -14.220 11.105 1.00 0.00 C ATOM 0 H ALA A 138 -18.688 -16.623 11.403 1.00 0.00 H new ATOM 0 HA ALA A 138 -17.121 -14.475 10.420 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -19.095 -13.132 11.059 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -19.558 -14.609 10.181 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -19.748 -14.528 11.949 1.00 0.00 H new ATOM 2078 N THR A 139 -16.289 -13.120 12.340 1.00 0.00 N ATOM 2079 CA THR A 139 -15.608 -12.463 13.450 1.00 0.00 C ATOM 2080 C THR A 139 -16.342 -11.193 13.868 1.00 0.00 C ATOM 2081 O THR A 139 -17.126 -10.636 13.099 1.00 0.00 O ATOM 2082 CB THR A 139 -14.165 -12.129 13.066 1.00 0.00 C ATOM 2083 OG1 THR A 139 -14.123 -11.000 12.209 1.00 0.00 O ATOM 2084 CG2 THR A 139 -13.452 -13.265 12.366 1.00 0.00 C ATOM 0 H THR A 139 -16.108 -12.701 11.428 1.00 0.00 H new ATOM 0 HA THR A 139 -15.602 -13.151 14.295 1.00 0.00 H new ATOM 0 HB THR A 139 -13.655 -11.929 14.008 1.00 0.00 H new ATOM 0 HG1 THR A 139 -13.192 -10.801 11.976 1.00 0.00 H new ATOM 0 HG21 THR A 139 -12.434 -12.960 12.122 1.00 0.00 H new ATOM 0 HG22 THR A 139 -13.423 -14.135 13.022 1.00 0.00 H new ATOM 0 HG23 THR A 139 -13.984 -13.519 11.449 1.00 0.00 H new ATOM 2092 N GLY A 140 -16.079 -10.741 15.090 1.00 0.00 N ATOM 2093 CA GLY A 140 -16.722 -9.542 15.593 1.00 0.00 C ATOM 2094 C GLY A 140 -15.989 -8.277 15.191 1.00 0.00 C ATOM 2095 O GLY A 140 -14.996 -7.902 15.815 1.00 0.00 O ATOM 0 H GLY A 140 -15.431 -11.185 15.741 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -17.745 -9.499 15.220 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -16.781 -9.594 16.680 1.00 0.00 H new ATOM 2099 N VAL A 141 -16.480 -7.617 14.147 1.00 0.00 N ATOM 2100 CA VAL A 141 -15.864 -6.387 13.658 1.00 0.00 C ATOM 2101 C VAL A 141 -16.573 -5.144 14.207 1.00 0.00 C ATOM 2102 O VAL A 141 -15.924 -4.254 14.756 1.00 0.00 O ATOM 2103 CB VAL A 141 -15.854 -6.327 12.117 1.00 0.00 C ATOM 2104 CG1 VAL A 141 -14.842 -5.301 11.629 1.00 0.00 C ATOM 2105 CG2 VAL A 141 -15.562 -7.699 11.528 1.00 0.00 C ATOM 0 H VAL A 141 -17.303 -7.913 13.622 1.00 0.00 H new ATOM 0 HA VAL A 141 -14.835 -6.396 14.017 1.00 0.00 H new ATOM 0 HB VAL A 141 -16.843 -6.017 11.778 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -14.849 -5.273 10.539 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -15.104 -4.318 12.019 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -13.847 -5.577 11.978 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -15.559 -7.635 10.440 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -14.587 -8.043 11.873 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -16.330 -8.403 11.848 1.00 0.00 H new ATOM 2115 N PRO A 142 -17.915 -5.054 14.072 1.00 0.00 N ATOM 2116 CA PRO A 142 -18.674 -3.899 14.566 1.00 0.00 C ATOM 2117 C PRO A 142 -18.696 -3.828 16.089 1.00 0.00 C ATOM 2118 O PRO A 142 -18.349 -4.794 16.771 1.00 0.00 O ATOM 2119 CB PRO A 142 -20.084 -4.133 14.021 1.00 0.00 C ATOM 2120 CG PRO A 142 -20.174 -5.605 13.825 1.00 0.00 C ATOM 2121 CD PRO A 142 -18.795 -6.054 13.433 1.00 0.00 C ATOM 0 HA PRO A 142 -18.232 -2.956 14.243 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -20.842 -3.780 14.720 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -20.240 -3.599 13.084 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -20.501 -6.101 14.739 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -20.900 -5.852 13.050 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -18.584 -7.062 13.790 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -18.669 -6.067 12.350 1.00 0.00 H new ATOM 2129 N THR A 143 -19.104 -2.678 16.617 1.00 0.00 N ATOM 2130 CA THR A 143 -19.171 -2.476 18.059 1.00 0.00 C ATOM 2131 C THR A 143 -20.613 -2.533 18.551 1.00 0.00 C ATOM 2132 O THR A 143 -21.532 -2.090 17.861 1.00 0.00 O ATOM 2133 CB THR A 143 -18.545 -1.132 18.436 1.00 0.00 C ATOM 2134 OG1 THR A 143 -18.813 -0.817 19.791 1.00 0.00 O ATOM 2135 CG2 THR A 143 -19.042 0.019 17.587 1.00 0.00 C ATOM 0 H THR A 143 -19.394 -1.870 16.065 1.00 0.00 H new ATOM 0 HA THR A 143 -18.611 -3.278 18.539 1.00 0.00 H new ATOM 0 HB THR A 143 -17.475 -1.252 18.264 1.00 0.00 H new ATOM 0 HG1 THR A 143 -18.403 0.045 20.014 1.00 0.00 H new ATOM 0 HG21 THR A 143 -18.559 0.942 17.907 1.00 0.00 H new ATOM 0 HG22 THR A 143 -18.804 -0.172 16.540 1.00 0.00 H new ATOM 0 HG23 THR A 143 -20.122 0.116 17.702 1.00 0.00 H new ATOM 2143 N VAL A 144 -20.803 -3.080 19.747 1.00 0.00 N ATOM 2144 CA VAL A 144 -22.134 -3.194 20.333 1.00 0.00 C ATOM 2145 C VAL A 144 -22.088 -2.988 21.844 1.00 0.00 C ATOM 2146 O VAL A 144 -20.975 -3.016 22.411 1.00 0.00 O ATOM 2147 CB VAL A 144 -22.769 -4.565 20.032 1.00 0.00 C ATOM 2148 CG1 VAL A 144 -23.373 -4.579 18.637 1.00 0.00 C ATOM 2149 CG2 VAL A 144 -21.743 -5.677 20.189 1.00 0.00 C ATOM 2150 OXT VAL A 144 -23.165 -2.803 22.448 1.00 0.00 O ATOM 0 H VAL A 144 -20.053 -3.451 20.330 1.00 0.00 H new ATOM 0 HA VAL A 144 -22.745 -2.414 19.880 1.00 0.00 H new ATOM 0 HB VAL A 144 -23.570 -4.739 20.751 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -23.817 -5.555 18.442 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -24.142 -3.810 18.566 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -22.594 -4.382 17.901 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -22.211 -6.637 19.972 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -20.918 -5.511 19.497 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -21.364 -5.681 21.211 1.00 0.00 H new TER 2160 VAL A 144